USER MOD reduce.3.24.130724 H: found=0, std=0, add=698, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 698 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 57 GLN : amide:sc= 0.591 K(o=1.1,f=-1.5) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.5 K(o=1.1,f=-2.3) USER MOD Set 2.1: A 19 ASN : amide:sc= 2.19 K(o=3.4,f=-4.6!) USER MOD Set 2.2: A 31 GLN : amide:sc= 1.18 K(o=3.4,f=-1.6!) USER MOD Single : A 17 HIS : no HD1:sc= 0 X(o=0,f=-0.008) USER MOD Single : A 21 LYS NZ :NH3+ -164:sc= 1.3 (180deg=1.06) USER MOD Single : A 25 GLN : amide:sc= 1.12 K(o=1.1,f=-0.53) USER MOD Single : A 28 SER OG : rot -89:sc= 1.33 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HD1:sc= 0 X(o=0,f=-0.0059) USER MOD Single : A 38 THR OG1 : rot -20:sc= -1.62! USER MOD Single : A 41 SER OG : rot -141:sc= 1.38 USER MOD Single : A 42 LYS NZ :NH3+ 152:sc= 1.23 (180deg=0.962) USER MOD Single : A 44 MET CE :methyl 170:sc= -0.425 (180deg=-0.673) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot -44:sc= -0.508 USER MOD Single : A 51 GLN : amide:sc= -0.296 X(o=-0.3,f=-0.3) USER MOD Single : A 54 SER OG : rot 180:sc= 0.00869 USER MOD Single : A 55 MET CE :methyl -130:sc= 0 (180deg=-0.105) USER MOD Single : A 65 GLN : amide:sc= -0.0538 X(o=-0.054,f=-0.054) USER MOD Single : A 68 ASN : amide:sc= 1.18 K(o=1.2,f=-0.12) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.678 USER MOD Single : A 75 GLN : amide:sc= -0.0511 K(o=-0.051,f=-0.79) USER MOD Single : A 78 MET CE :methyl -134:sc= -0.734 (180deg=-2.74) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.491 K(o=-0.49,f=-1.4) USER MOD Single : A 90 GLN : amide:sc= -0.376 K(o=-0.38,f=-2.9!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.075 USER MOD Single : B 357 ASN :FLIP amide:sc= 0.731 F(o=-0.054,f=0.73) USER MOD Single : B 358 ASN : amide:sc= -2.08! C(o=-2.1!,f=-4.1!) USER MOD Single : B 365 SER OG : rot 180:sc= -0.0209 USER MOD Single : B 367 SER OG : rot 180:sc= 0.0044 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 16 -5.822 15.480 12.424 1.00 10.00 N ATOM 2 CA ASP A 16 -6.391 14.166 12.799 1.00 10.00 C ATOM 3 C ASP A 16 -5.868 13.087 11.867 1.00 10.00 C ATOM 4 O ASP A 16 -4.961 13.330 11.069 1.00 10.00 O ATOM 5 CB ASP A 16 -7.921 14.202 12.751 1.00 10.00 C ATOM 6 CG ASP A 16 -8.522 14.829 13.990 1.00 10.00 C ATOM 7 OD1 ASP A 16 -9.285 14.143 14.702 1.00 10.00 O ATOM 8 OD2 ASP A 16 -8.225 16.013 14.264 1.00 10.00 O ATOM 0 HA ASP A 16 -6.084 13.938 13.820 1.00 10.00 H new ATOM 0 HB2 ASP A 16 -8.241 14.762 11.872 1.00 10.00 H new ATOM 0 HB3 ASP A 16 -8.302 13.187 12.639 1.00 10.00 H new ATOM 13 N HIS A 17 -6.440 11.898 11.971 1.00 10.00 N ATOM 14 CA HIS A 17 -6.025 10.775 11.145 1.00 10.00 C ATOM 15 C HIS A 17 -7.006 10.558 10.000 1.00 10.00 C ATOM 16 O HIS A 17 -8.126 11.073 10.022 1.00 10.00 O ATOM 17 CB HIS A 17 -5.923 9.500 11.988 1.00 10.00 C ATOM 18 CG HIS A 17 -4.995 9.623 13.159 1.00 10.00 C ATOM 19 ND1 HIS A 17 -5.447 10.028 14.393 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.661 9.392 13.231 1.00 10.00 C ATOM 21 CE1 HIS A 17 -4.386 10.037 15.184 1.00 10.00 C ATOM 22 NE2 HIS A 17 -3.282 9.659 14.524 1.00 10.00 N ATOM 0 H HIS A 17 -7.196 11.685 12.622 1.00 10.00 H new ATOM 0 HA HIS A 17 -5.044 11.005 10.728 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.916 9.234 12.350 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.585 8.681 11.353 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -3.020 9.062 12.427 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -4.407 10.314 16.228 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -2.340 9.584 14.909 1.00 10.00 H new ATOM 30 N ILE A 18 -6.573 9.801 9.004 1.00 10.00 N ATOM 31 CA ILE A 18 -7.399 9.499 7.849 1.00 10.00 C ATOM 32 C ILE A 18 -7.613 7.988 7.761 1.00 10.00 C ATOM 33 O ILE A 18 -6.678 7.212 7.956 1.00 10.00 O ATOM 34 CB ILE A 18 -6.756 10.044 6.546 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.682 9.823 5.347 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.390 9.409 6.298 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.258 10.593 4.113 1.00 10.00 C ATOM 0 H ILE A 18 -5.644 9.381 8.975 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.365 9.991 7.965 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.610 11.117 6.671 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.712 8.759 5.111 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.695 10.117 5.620 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -4.964 9.810 5.378 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.727 9.634 7.133 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.502 8.329 6.205 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -7.956 10.392 3.301 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.255 11.661 4.333 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.257 10.281 3.816 1.00 10.00 H new ATOM 49 N ASN A 19 -8.846 7.571 7.503 1.00 10.00 N ATOM 50 CA ASN A 19 -9.160 6.148 7.423 1.00 10.00 C ATOM 51 C ASN A 19 -9.071 5.646 5.990 1.00 10.00 C ATOM 52 O ASN A 19 -9.933 5.939 5.160 1.00 10.00 O ATOM 53 CB ASN A 19 -10.558 5.866 7.984 1.00 10.00 C ATOM 54 CG ASN A 19 -10.708 6.292 9.434 1.00 10.00 C ATOM 55 OD1 ASN A 19 -10.437 5.520 10.355 1.00 10.00 O ATOM 56 ND2 ASN A 19 -11.153 7.521 9.648 1.00 10.00 N ATOM 0 H ASN A 19 -9.640 8.191 7.346 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.423 5.616 8.025 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.299 6.387 7.378 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.770 4.800 7.900 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -11.282 7.858 10.602 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.367 8.131 8.859 1.00 10.00 H new ATOM 63 N LEU A 20 -8.020 4.897 5.702 1.00 10.00 N ATOM 64 CA LEU A 20 -7.817 4.341 4.375 1.00 10.00 C ATOM 65 C LEU A 20 -8.034 2.830 4.402 1.00 10.00 C ATOM 66 O LEU A 20 -7.284 2.098 5.049 1.00 10.00 O ATOM 67 CB LEU A 20 -6.408 4.667 3.871 1.00 10.00 C ATOM 68 CG LEU A 20 -6.041 6.156 3.885 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.593 6.358 3.464 1.00 10.00 C ATOM 70 CD2 LEU A 20 -6.975 6.946 2.981 1.00 10.00 C ATOM 0 H LEU A 20 -7.290 4.659 6.374 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.540 4.788 3.693 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.686 4.125 4.482 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.308 4.293 2.852 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.155 6.525 4.904 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.354 7.421 3.481 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -3.936 5.827 4.153 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.450 5.970 2.455 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.699 8.000 3.004 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.895 6.573 1.960 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -8.001 6.832 3.330 1.00 10.00 H new ATOM 82 N LYS A 21 -9.065 2.371 3.705 1.00 10.00 N ATOM 83 CA LYS A 21 -9.388 0.952 3.662 1.00 10.00 C ATOM 84 C LYS A 21 -8.580 0.240 2.592 1.00 10.00 C ATOM 85 O LYS A 21 -8.794 0.446 1.399 1.00 10.00 O ATOM 86 CB LYS A 21 -10.878 0.743 3.378 1.00 10.00 C ATOM 87 CG LYS A 21 -11.807 1.479 4.328 1.00 10.00 C ATOM 88 CD LYS A 21 -13.255 1.343 3.888 1.00 10.00 C ATOM 89 CE LYS A 21 -14.177 2.207 4.727 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.547 2.280 4.159 1.00 10.00 N ATOM 0 H LYS A 21 -9.693 2.963 3.161 1.00 10.00 H new ATOM 0 HA LYS A 21 -9.140 0.534 4.637 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -11.090 1.066 2.359 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -11.099 -0.323 3.427 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.691 1.082 5.336 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.532 2.533 4.367 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.345 1.626 2.839 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -13.563 0.300 3.965 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -14.226 1.806 5.740 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.762 3.212 4.802 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -16.060 3.075 4.591 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.489 2.424 3.131 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -16.053 1.393 4.357 1.00 10.00 H new ATOM 104 N VAL A 22 -7.643 -0.582 3.018 1.00 10.00 N ATOM 105 CA VAL A 22 -6.829 -1.343 2.090 1.00 10.00 C ATOM 106 C VAL A 22 -7.342 -2.775 2.042 1.00 10.00 C ATOM 107 O VAL A 22 -7.428 -3.445 3.073 1.00 10.00 O ATOM 108 CB VAL A 22 -5.338 -1.339 2.485 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.487 -1.959 1.387 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.869 0.071 2.803 1.00 10.00 C ATOM 0 H VAL A 22 -7.425 -0.741 4.002 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.906 -0.874 1.109 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.223 -1.945 3.384 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.439 -1.945 1.687 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -4.803 -2.989 1.219 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.608 -1.388 0.467 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.815 0.050 3.079 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -5.002 0.705 1.926 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.453 0.471 3.632 1.00 10.00 H new ATOM 120 N ALA A 23 -7.698 -3.236 0.858 1.00 10.00 N ATOM 121 CA ALA A 23 -8.219 -4.581 0.705 1.00 10.00 C ATOM 122 C ALA A 23 -7.448 -5.344 -0.356 1.00 10.00 C ATOM 123 O ALA A 23 -7.005 -4.765 -1.350 1.00 10.00 O ATOM 124 CB ALA A 23 -9.700 -4.533 0.359 1.00 10.00 C ATOM 0 H ALA A 23 -7.636 -2.702 -0.009 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.097 -5.107 1.652 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.080 -5.548 0.246 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.244 -4.028 1.157 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -9.838 -3.988 -0.575 1.00 10.00 H new ATOM 130 N GLY A 24 -7.281 -6.641 -0.137 1.00 10.00 N ATOM 131 CA GLY A 24 -6.569 -7.468 -1.088 1.00 10.00 C ATOM 132 C GLY A 24 -7.457 -7.919 -2.230 1.00 10.00 C ATOM 133 O GLY A 24 -8.278 -7.146 -2.732 1.00 10.00 O ATOM 0 H GLY A 24 -7.627 -7.136 0.685 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -5.721 -6.912 -1.487 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.165 -8.342 -0.577 1.00 10.00 H new ATOM 137 N GLN A 25 -7.303 -9.167 -2.637 1.00 10.00 N ATOM 138 CA GLN A 25 -8.102 -9.717 -3.724 1.00 10.00 C ATOM 139 C GLN A 25 -9.241 -10.567 -3.171 1.00 10.00 C ATOM 140 O GLN A 25 -10.186 -10.904 -3.887 1.00 10.00 O ATOM 141 CB GLN A 25 -7.221 -10.549 -4.659 1.00 10.00 C ATOM 142 CG GLN A 25 -6.094 -9.753 -5.295 1.00 10.00 C ATOM 143 CD GLN A 25 -6.596 -8.674 -6.233 1.00 10.00 C ATOM 144 OE1 GLN A 25 -7.591 -8.852 -6.935 1.00 10.00 O ATOM 145 NE2 GLN A 25 -5.915 -7.543 -6.249 1.00 10.00 N ATOM 0 H GLN A 25 -6.632 -9.821 -2.233 1.00 10.00 H new ATOM 0 HA GLN A 25 -8.532 -8.892 -4.292 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -6.796 -11.382 -4.099 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -7.842 -10.977 -5.446 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -5.491 -9.295 -4.511 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -5.441 -10.431 -5.844 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -5.095 -7.433 -5.652 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -6.209 -6.779 -6.858 1.00 10.00 H new ATOM 154 N ASP A 26 -9.143 -10.909 -1.891 1.00 10.00 N ATOM 155 CA ASP A 26 -10.159 -11.718 -1.230 1.00 10.00 C ATOM 156 C ASP A 26 -11.118 -10.838 -0.414 1.00 10.00 C ATOM 157 O ASP A 26 -11.835 -10.008 -0.982 1.00 10.00 O ATOM 158 CB ASP A 26 -9.509 -12.799 -0.349 1.00 10.00 C ATOM 159 CG ASP A 26 -8.461 -12.250 0.601 1.00 10.00 C ATOM 160 OD1 ASP A 26 -7.321 -12.002 0.159 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.782 -12.056 1.792 1.00 10.00 O ATOM 0 H ASP A 26 -8.366 -10.637 -1.289 1.00 10.00 H new ATOM 0 HA ASP A 26 -10.745 -12.221 -1.999 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -10.285 -13.302 0.228 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -9.050 -13.552 -0.990 1.00 10.00 H new ATOM 166 N GLY A 27 -11.120 -10.997 0.907 1.00 10.00 N ATOM 167 CA GLY A 27 -12.012 -10.217 1.746 1.00 10.00 C ATOM 168 C GLY A 27 -11.333 -9.644 2.978 1.00 10.00 C ATOM 169 O GLY A 27 -12.004 -9.161 3.892 1.00 10.00 O ATOM 0 H GLY A 27 -10.521 -11.651 1.410 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.431 -9.400 1.158 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.846 -10.845 2.059 1.00 10.00 H new ATOM 173 N SER A 28 -10.009 -9.707 3.018 1.00 10.00 N ATOM 174 CA SER A 28 -9.254 -9.169 4.145 1.00 10.00 C ATOM 175 C SER A 28 -9.172 -7.644 4.047 1.00 10.00 C ATOM 176 O SER A 28 -8.751 -7.110 3.011 1.00 10.00 O ATOM 177 CB SER A 28 -7.850 -9.778 4.167 1.00 10.00 C ATOM 178 OG SER A 28 -7.400 -10.078 2.853 1.00 10.00 O ATOM 0 H SER A 28 -9.435 -10.124 2.285 1.00 10.00 H new ATOM 0 HA SER A 28 -9.765 -9.428 5.072 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.157 -9.084 4.642 1.00 10.00 H new ATOM 0 HB3 SER A 28 -7.854 -10.686 4.769 1.00 10.00 H new ATOM 0 HG SER A 28 -7.679 -10.986 2.611 1.00 10.00 H new ATOM 184 N VAL A 29 -9.581 -6.933 5.103 1.00 10.00 N ATOM 185 CA VAL A 29 -9.551 -5.472 5.068 1.00 10.00 C ATOM 186 C VAL A 29 -8.742 -4.875 6.224 1.00 10.00 C ATOM 187 O VAL A 29 -8.806 -5.336 7.360 1.00 10.00 O ATOM 188 CB VAL A 29 -10.980 -4.880 5.111 1.00 10.00 C ATOM 189 CG1 VAL A 29 -10.946 -3.374 4.901 1.00 10.00 C ATOM 190 CG2 VAL A 29 -11.877 -5.546 4.078 1.00 10.00 C ATOM 0 H VAL A 29 -9.929 -7.336 5.973 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.066 -5.207 4.128 1.00 10.00 H new ATOM 0 HB VAL A 29 -11.397 -5.079 6.098 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -11.961 -2.979 4.935 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -10.350 -2.910 5.687 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -10.503 -3.152 3.930 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -12.875 -5.112 4.129 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -11.464 -5.389 3.082 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -11.935 -6.615 4.282 1.00 10.00 H new ATOM 200 N VAL A 30 -7.956 -3.858 5.923 1.00 10.00 N ATOM 201 CA VAL A 30 -7.184 -3.179 6.947 1.00 10.00 C ATOM 202 C VAL A 30 -7.486 -1.688 6.897 1.00 10.00 C ATOM 203 O VAL A 30 -7.418 -1.059 5.838 1.00 10.00 O ATOM 204 CB VAL A 30 -5.665 -3.431 6.815 1.00 10.00 C ATOM 205 CG1 VAL A 30 -5.322 -4.866 7.197 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.191 -3.128 5.405 1.00 10.00 C ATOM 0 H VAL A 30 -7.835 -3.485 4.981 1.00 10.00 H new ATOM 0 HA VAL A 30 -7.480 -3.588 7.913 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.149 -2.760 7.502 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.248 -5.022 7.097 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -5.621 -5.049 8.229 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -5.852 -5.554 6.538 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.119 -3.312 5.334 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.717 -3.770 4.698 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.396 -2.084 5.169 1.00 10.00 H new ATOM 216 N GLN A 31 -7.863 -1.138 8.035 1.00 10.00 N ATOM 217 CA GLN A 31 -8.199 0.271 8.131 1.00 10.00 C ATOM 218 C GLN A 31 -6.986 1.064 8.585 1.00 10.00 C ATOM 219 O GLN A 31 -6.745 1.232 9.782 1.00 10.00 O ATOM 220 CB GLN A 31 -9.371 0.473 9.098 1.00 10.00 C ATOM 221 CG GLN A 31 -9.983 1.869 9.062 1.00 10.00 C ATOM 222 CD GLN A 31 -11.336 1.920 9.751 1.00 10.00 C ATOM 223 OE1 GLN A 31 -12.081 0.940 9.757 1.00 10.00 O ATOM 224 NE2 GLN A 31 -11.665 3.058 10.342 1.00 10.00 N ATOM 0 H GLN A 31 -7.945 -1.650 8.913 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.501 0.631 7.148 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.147 -0.257 8.867 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -9.030 0.265 10.112 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -9.305 2.574 9.544 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -10.092 2.189 8.026 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -11.023 3.850 10.317 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -12.561 3.143 10.822 1.00 10.00 H new ATOM 233 N PHE A 32 -6.204 1.519 7.625 1.00 10.00 N ATOM 234 CA PHE A 32 -5.018 2.296 7.925 1.00 10.00 C ATOM 235 C PHE A 32 -5.408 3.689 8.378 1.00 10.00 C ATOM 236 O PHE A 32 -5.856 4.511 7.580 1.00 10.00 O ATOM 237 CB PHE A 32 -4.091 2.367 6.716 1.00 10.00 C ATOM 238 CG PHE A 32 -3.091 1.248 6.677 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.351 0.091 5.962 1.00 10.00 C ATOM 240 CD2 PHE A 32 -1.893 1.350 7.365 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.436 -0.943 5.935 1.00 10.00 C ATOM 242 CE2 PHE A 32 -0.974 0.320 7.341 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.247 -0.828 6.626 1.00 10.00 C ATOM 0 H PHE A 32 -6.369 1.364 6.631 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.479 1.801 8.733 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.689 2.344 5.805 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.562 3.320 6.726 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.280 -0.004 5.419 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.675 2.246 7.927 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.651 -1.840 5.374 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.043 0.413 7.881 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.531 -1.636 6.607 1.00 10.00 H new ATOM 253 N LYS A 33 -5.238 3.937 9.662 1.00 10.00 N ATOM 254 CA LYS A 33 -5.575 5.214 10.255 1.00 10.00 C ATOM 255 C LYS A 33 -4.306 6.028 10.478 1.00 10.00 C ATOM 256 O LYS A 33 -3.886 6.258 11.612 1.00 10.00 O ATOM 257 CB LYS A 33 -6.311 4.984 11.576 1.00 10.00 C ATOM 258 CG LYS A 33 -7.279 6.090 11.943 1.00 10.00 C ATOM 259 CD LYS A 33 -7.942 5.803 13.275 1.00 10.00 C ATOM 260 CE LYS A 33 -9.125 6.720 13.522 1.00 10.00 C ATOM 261 NZ LYS A 33 -9.680 6.540 14.889 1.00 10.00 N ATOM 0 H LYS A 33 -4.862 3.257 10.323 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.228 5.771 9.584 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -6.857 4.042 11.517 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.577 4.877 12.375 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -6.750 7.042 11.992 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -8.038 6.188 11.167 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.275 4.765 13.300 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -7.214 5.924 14.077 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -8.817 7.757 13.387 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -9.902 6.520 12.784 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -10.487 7.182 15.023 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -9.996 5.557 15.008 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -8.945 6.755 15.593 1.00 10.00 H new ATOM 275 N ILE A 34 -3.693 6.443 9.384 1.00 10.00 N ATOM 276 CA ILE A 34 -2.464 7.220 9.442 1.00 10.00 C ATOM 277 C ILE A 34 -2.762 8.709 9.346 1.00 10.00 C ATOM 278 O ILE A 34 -3.918 9.115 9.244 1.00 10.00 O ATOM 279 CB ILE A 34 -1.490 6.827 8.308 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.146 7.033 6.935 1.00 10.00 C ATOM 281 CG2 ILE A 34 -1.041 5.384 8.475 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.188 6.874 5.773 1.00 10.00 C ATOM 0 H ILE A 34 -4.027 6.255 8.439 1.00 10.00 H new ATOM 0 HA ILE A 34 -1.994 7.002 10.401 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.613 7.472 8.366 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -2.962 6.320 6.822 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.586 8.030 6.898 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.355 5.121 7.670 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.536 5.269 9.434 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.910 4.726 8.442 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.722 7.034 4.836 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.384 7.605 5.861 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.767 5.869 5.784 1.00 10.00 H new ATOM 294 N LYS A 35 -1.718 9.520 9.383 1.00 10.00 N ATOM 295 CA LYS A 35 -1.882 10.955 9.283 1.00 10.00 C ATOM 296 C LYS A 35 -1.862 11.370 7.819 1.00 10.00 C ATOM 297 O LYS A 35 -1.300 10.673 6.973 1.00 10.00 O ATOM 298 CB LYS A 35 -0.789 11.681 10.070 1.00 10.00 C ATOM 299 CG LYS A 35 -0.890 11.471 11.571 1.00 10.00 C ATOM 300 CD LYS A 35 0.235 12.175 12.307 1.00 10.00 C ATOM 301 CE LYS A 35 -0.010 12.196 13.806 1.00 10.00 C ATOM 302 NZ LYS A 35 0.993 13.026 14.522 1.00 10.00 N ATOM 0 H LYS A 35 -0.752 9.208 9.481 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.843 11.234 9.716 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.186 11.336 9.727 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.844 12.748 9.855 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.850 11.844 11.928 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.860 10.404 11.793 1.00 10.00 H new ATOM 0 HD2 LYS A 35 1.179 11.672 12.098 1.00 10.00 H new ATOM 0 HD3 LYS A 35 0.330 13.196 11.938 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -1.009 12.583 14.005 1.00 10.00 H new ATOM 0 HE3 LYS A 35 0.020 11.177 14.193 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 0.790 13.013 15.542 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 1.945 12.642 14.354 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 0.948 14.004 14.172 1.00 10.00 H new ATOM 316 N ARG A 36 -2.464 12.511 7.529 1.00 10.00 N ATOM 317 CA ARG A 36 -2.546 13.017 6.163 1.00 10.00 C ATOM 318 C ARG A 36 -1.165 13.358 5.598 1.00 10.00 C ATOM 319 O ARG A 36 -1.002 13.513 4.386 1.00 10.00 O ATOM 320 CB ARG A 36 -3.448 14.251 6.133 1.00 10.00 C ATOM 321 CG ARG A 36 -4.234 14.409 4.843 1.00 10.00 C ATOM 322 CD ARG A 36 -5.467 15.268 5.055 1.00 10.00 C ATOM 323 NE ARG A 36 -6.169 15.539 3.800 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.449 15.236 3.579 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.165 14.609 4.502 1.00 10.00 N ATOM 326 NH2 ARG A 36 -8.014 15.555 2.424 1.00 10.00 N ATOM 0 H ARG A 36 -2.907 13.111 8.225 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.969 12.233 5.535 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -4.146 14.198 6.968 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -2.836 15.140 6.285 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -3.600 14.860 4.080 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -4.530 13.428 4.472 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.143 14.767 5.748 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.177 16.211 5.519 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.647 15.988 3.047 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -7.738 14.353 5.392 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.143 14.382 4.322 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -7.470 16.032 1.705 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -8.993 15.324 2.254 1.00 10.00 H new ATOM 340 N HIS A 37 -0.175 13.464 6.477 1.00 10.00 N ATOM 341 CA HIS A 37 1.189 13.795 6.069 1.00 10.00 C ATOM 342 C HIS A 37 2.094 12.565 6.124 1.00 10.00 C ATOM 343 O HIS A 37 3.295 12.659 5.871 1.00 10.00 O ATOM 344 CB HIS A 37 1.768 14.891 6.975 1.00 10.00 C ATOM 345 CG HIS A 37 0.745 15.835 7.528 1.00 10.00 C ATOM 346 ND1 HIS A 37 0.309 15.736 8.828 1.00 10.00 N ATOM 347 CD2 HIS A 37 0.095 16.857 6.919 1.00 10.00 C ATOM 348 CE1 HIS A 37 -0.586 16.696 8.982 1.00 10.00 C ATOM 349 NE2 HIS A 37 -0.749 17.399 7.853 1.00 10.00 N ATOM 0 H HIS A 37 -0.290 13.325 7.481 1.00 10.00 H new ATOM 0 HA HIS A 37 1.148 14.156 5.041 1.00 10.00 H new ATOM 0 HB2 HIS A 37 2.297 14.420 7.804 1.00 10.00 H new ATOM 0 HB3 HIS A 37 2.505 15.462 6.410 1.00 10.00 H new ATOM 0 HD2 HIS A 37 0.218 17.181 5.896 1.00 10.00 H new ATOM 0 HE1 HIS A 37 -1.119 16.889 9.901 1.00 10.00 H new ATOM 0 HE2 HIS A 37 -1.381 18.188 7.715 1.00 10.00 H new ATOM 357 N THR A 38 1.517 11.415 6.444 1.00 10.00 N ATOM 358 CA THR A 38 2.281 10.180 6.542 1.00 10.00 C ATOM 359 C THR A 38 2.483 9.543 5.166 1.00 10.00 C ATOM 360 O THR A 38 1.514 9.288 4.447 1.00 10.00 O ATOM 361 CB THR A 38 1.586 9.182 7.486 1.00 10.00 C ATOM 362 OG1 THR A 38 1.302 9.830 8.731 1.00 10.00 O ATOM 363 CG2 THR A 38 2.453 7.956 7.738 1.00 10.00 C ATOM 0 H THR A 38 0.521 11.312 6.640 1.00 10.00 H new ATOM 0 HA THR A 38 3.259 10.431 6.952 1.00 10.00 H new ATOM 0 HB THR A 38 0.662 8.850 7.012 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.875 10.619 8.827 1.00 10.00 H new ATOM 0 HG21 THR A 38 1.931 7.273 8.408 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.655 7.453 6.793 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.394 8.263 8.194 1.00 10.00 H new ATOM 371 N PRO A 39 3.749 9.307 4.775 1.00 10.00 N ATOM 372 CA PRO A 39 4.083 8.697 3.485 1.00 10.00 C ATOM 373 C PRO A 39 3.408 7.344 3.292 1.00 10.00 C ATOM 374 O PRO A 39 3.473 6.472 4.164 1.00 10.00 O ATOM 375 CB PRO A 39 5.604 8.525 3.545 1.00 10.00 C ATOM 376 CG PRO A 39 6.065 9.514 4.555 1.00 10.00 C ATOM 377 CD PRO A 39 4.955 9.632 5.558 1.00 10.00 C ATOM 0 HA PRO A 39 3.744 9.311 2.651 1.00 10.00 H new ATOM 0 HB2 PRO A 39 5.875 7.510 3.835 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.061 8.712 2.573 1.00 10.00 H new ATOM 0 HG2 PRO A 39 6.988 9.183 5.032 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.274 10.477 4.090 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.091 8.942 6.391 1.00 10.00 H new ATOM 0 HD3 PRO A 39 4.901 10.635 5.981 1.00 10.00 H new ATOM 385 N LEU A 40 2.778 7.166 2.136 1.00 10.00 N ATOM 386 CA LEU A 40 2.090 5.921 1.817 1.00 10.00 C ATOM 387 C LEU A 40 3.089 4.780 1.644 1.00 10.00 C ATOM 388 O LEU A 40 2.713 3.607 1.631 1.00 10.00 O ATOM 389 CB LEU A 40 1.245 6.090 0.553 1.00 10.00 C ATOM 390 CG LEU A 40 0.069 7.064 0.681 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.628 7.234 -0.658 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.916 6.579 1.733 1.00 10.00 C ATOM 0 H LEU A 40 2.730 7.872 1.401 1.00 10.00 H new ATOM 0 HA LEU A 40 1.429 5.671 2.647 1.00 10.00 H new ATOM 0 HB2 LEU A 40 1.892 6.431 -0.255 1.00 10.00 H new ATOM 0 HB3 LEU A 40 0.858 5.114 0.261 1.00 10.00 H new ATOM 0 HG LEU A 40 0.459 8.032 0.995 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.461 7.929 -0.549 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.079 7.626 -1.389 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -1.003 6.269 -0.998 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.744 7.284 1.809 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.299 5.599 1.448 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.412 6.506 2.697 1.00 10.00 H new ATOM 404 N SER A 41 4.360 5.137 1.519 1.00 10.00 N ATOM 405 CA SER A 41 5.427 4.165 1.369 1.00 10.00 C ATOM 406 C SER A 41 5.491 3.249 2.589 1.00 10.00 C ATOM 407 O SER A 41 5.671 2.036 2.464 1.00 10.00 O ATOM 408 CB SER A 41 6.747 4.905 1.186 1.00 10.00 C ATOM 409 OG SER A 41 6.513 6.298 1.031 1.00 10.00 O ATOM 0 H SER A 41 4.677 6.107 1.519 1.00 10.00 H new ATOM 0 HA SER A 41 5.234 3.544 0.494 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.392 4.731 2.047 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.271 4.518 0.312 1.00 10.00 H new ATOM 0 HG SER A 41 7.125 6.659 0.356 1.00 10.00 H new ATOM 415 N LYS A 42 5.312 3.837 3.768 1.00 10.00 N ATOM 416 CA LYS A 42 5.341 3.076 5.008 1.00 10.00 C ATOM 417 C LYS A 42 4.038 2.313 5.181 1.00 10.00 C ATOM 418 O LYS A 42 3.999 1.262 5.816 1.00 10.00 O ATOM 419 CB LYS A 42 5.598 3.993 6.206 1.00 10.00 C ATOM 420 CG LYS A 42 6.971 4.639 6.169 1.00 10.00 C ATOM 421 CD LYS A 42 7.430 5.083 7.547 1.00 10.00 C ATOM 422 CE LYS A 42 8.924 5.357 7.558 1.00 10.00 C ATOM 423 NZ LYS A 42 9.419 5.737 8.906 1.00 10.00 N ATOM 0 H LYS A 42 5.146 4.836 3.889 1.00 10.00 H new ATOM 0 HA LYS A 42 6.161 2.359 4.957 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.836 4.772 6.232 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.497 3.418 7.126 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.692 3.933 5.757 1.00 10.00 H new ATOM 0 HG3 LYS A 42 6.949 5.499 5.500 1.00 10.00 H new ATOM 0 HD2 LYS A 42 6.889 5.982 7.843 1.00 10.00 H new ATOM 0 HD3 LYS A 42 7.192 4.312 8.280 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.456 4.470 7.215 1.00 10.00 H new ATOM 0 HE3 LYS A 42 9.149 6.156 6.852 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 10.417 5.461 9.000 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 9.331 6.766 9.031 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 8.855 5.251 9.632 1.00 10.00 H new ATOM 437 N LEU A 43 2.975 2.848 4.589 1.00 10.00 N ATOM 438 CA LEU A 43 1.666 2.213 4.637 1.00 10.00 C ATOM 439 C LEU A 43 1.732 0.889 3.884 1.00 10.00 C ATOM 440 O LEU A 43 1.216 -0.134 4.339 1.00 10.00 O ATOM 441 CB LEU A 43 0.610 3.141 4.017 1.00 10.00 C ATOM 442 CG LEU A 43 -0.778 2.530 3.794 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.859 3.534 4.157 1.00 10.00 C ATOM 444 CD2 LEU A 43 -0.944 2.081 2.348 1.00 10.00 C ATOM 0 H LEU A 43 2.997 3.725 4.068 1.00 10.00 H new ATOM 0 HA LEU A 43 1.382 2.022 5.672 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.501 4.014 4.660 1.00 10.00 H new ATOM 0 HB3 LEU A 43 0.986 3.496 3.058 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.875 1.657 4.439 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.840 3.087 3.994 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.758 3.815 5.205 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.756 4.421 3.532 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -1.936 1.651 2.212 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -0.827 2.938 1.685 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.188 1.332 2.110 1.00 10.00 H new ATOM 456 N MET A 44 2.397 0.926 2.732 1.00 10.00 N ATOM 457 CA MET A 44 2.567 -0.256 1.899 1.00 10.00 C ATOM 458 C MET A 44 3.428 -1.285 2.617 1.00 10.00 C ATOM 459 O MET A 44 3.125 -2.479 2.612 1.00 10.00 O ATOM 460 CB MET A 44 3.220 0.116 0.563 1.00 10.00 C ATOM 461 CG MET A 44 2.373 1.038 -0.301 1.00 10.00 C ATOM 462 SD MET A 44 2.997 1.186 -1.989 1.00 10.00 S ATOM 463 CE MET A 44 4.500 2.121 -1.730 1.00 10.00 C ATOM 0 H MET A 44 2.829 1.769 2.354 1.00 10.00 H new ATOM 0 HA MET A 44 1.582 -0.682 1.705 1.00 10.00 H new ATOM 0 HB2 MET A 44 4.178 0.597 0.760 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.430 -0.797 0.006 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.350 0.664 -0.329 1.00 10.00 H new ATOM 0 HG3 MET A 44 2.339 2.027 0.157 1.00 10.00 H new ATOM 0 HE1 MET A 44 5.082 2.137 -2.652 1.00 10.00 H new ATOM 0 HE2 MET A 44 4.248 3.142 -1.442 1.00 10.00 H new ATOM 0 HE3 MET A 44 5.087 1.655 -0.938 1.00 10.00 H new ATOM 473 N LYS A 45 4.491 -0.804 3.251 1.00 10.00 N ATOM 474 CA LYS A 45 5.413 -1.667 3.978 1.00 10.00 C ATOM 475 C LYS A 45 4.730 -2.341 5.162 1.00 10.00 C ATOM 476 O LYS A 45 4.969 -3.516 5.433 1.00 10.00 O ATOM 477 CB LYS A 45 6.625 -0.867 4.461 1.00 10.00 C ATOM 478 CG LYS A 45 7.598 -0.507 3.351 1.00 10.00 C ATOM 479 CD LYS A 45 8.763 0.312 3.878 1.00 10.00 C ATOM 480 CE LYS A 45 9.805 0.554 2.798 1.00 10.00 C ATOM 481 NZ LYS A 45 10.992 1.266 3.328 1.00 10.00 N ATOM 0 H LYS A 45 4.736 0.186 3.276 1.00 10.00 H new ATOM 0 HA LYS A 45 5.747 -2.445 3.292 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.278 0.049 4.940 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.151 -1.444 5.221 1.00 10.00 H new ATOM 0 HG2 LYS A 45 7.973 -1.418 2.885 1.00 10.00 H new ATOM 0 HG3 LYS A 45 7.077 0.056 2.577 1.00 10.00 H new ATOM 0 HD2 LYS A 45 8.397 1.268 4.253 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.223 -0.206 4.720 1.00 10.00 H new ATOM 0 HE2 LYS A 45 10.114 -0.400 2.371 1.00 10.00 H new ATOM 0 HE3 LYS A 45 9.362 1.137 1.990 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.680 1.412 2.562 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.701 2.187 3.713 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 11.429 0.698 4.082 1.00 10.00 H new ATOM 495 N ALA A 46 3.872 -1.600 5.856 1.00 10.00 N ATOM 496 CA ALA A 46 3.160 -2.138 7.011 1.00 10.00 C ATOM 497 C ALA A 46 2.307 -3.339 6.613 1.00 10.00 C ATOM 498 O ALA A 46 2.338 -4.381 7.269 1.00 10.00 O ATOM 499 CB ALA A 46 2.302 -1.060 7.656 1.00 10.00 C ATOM 0 H ALA A 46 3.653 -0.628 5.640 1.00 10.00 H new ATOM 0 HA ALA A 46 3.897 -2.475 7.740 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.778 -1.478 8.516 1.00 10.00 H new ATOM 0 HB2 ALA A 46 2.937 -0.237 7.983 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.575 -0.692 6.932 1.00 10.00 H new ATOM 505 N TYR A 47 1.560 -3.196 5.522 1.00 10.00 N ATOM 506 CA TYR A 47 0.716 -4.279 5.034 1.00 10.00 C ATOM 507 C TYR A 47 1.588 -5.408 4.494 1.00 10.00 C ATOM 508 O TYR A 47 1.268 -6.588 4.648 1.00 10.00 O ATOM 509 CB TYR A 47 -0.233 -3.773 3.945 1.00 10.00 C ATOM 510 CG TYR A 47 -1.256 -4.797 3.503 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.205 -5.355 2.230 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.275 -5.204 4.355 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.140 -6.288 1.822 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.212 -6.135 3.954 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.141 -6.674 2.687 1.00 10.00 C ATOM 516 OH TYR A 47 -4.071 -7.605 2.285 1.00 10.00 O ATOM 0 H TYR A 47 1.523 -2.344 4.962 1.00 10.00 H new ATOM 0 HA TYR A 47 0.115 -4.657 5.861 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.753 -2.888 4.312 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.354 -3.462 3.080 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.422 -5.055 1.549 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.335 -4.785 5.348 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.086 -6.712 0.830 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -3.997 -6.440 4.630 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.707 -7.767 3.013 1.00 10.00 H new ATOM 526 N CYS A 48 2.699 -5.025 3.881 1.00 10.00 N ATOM 527 CA CYS A 48 3.650 -5.972 3.316 1.00 10.00 C ATOM 528 C CYS A 48 4.193 -6.903 4.396 1.00 10.00 C ATOM 529 O CYS A 48 4.190 -8.128 4.240 1.00 10.00 O ATOM 530 CB CYS A 48 4.803 -5.207 2.661 1.00 10.00 C ATOM 531 SG CYS A 48 5.918 -6.233 1.689 1.00 10.00 S ATOM 0 H CYS A 48 2.967 -4.048 3.761 1.00 10.00 H new ATOM 0 HA CYS A 48 3.139 -6.577 2.567 1.00 10.00 H new ATOM 0 HB2 CYS A 48 4.389 -4.431 2.017 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.377 -4.703 3.439 1.00 10.00 H new ATOM 0 HG CYS A 48 6.181 -7.327 2.341 1.00 10.00 H new ATOM 537 N GLU A 49 4.651 -6.307 5.492 1.00 10.00 N ATOM 538 CA GLU A 49 5.195 -7.060 6.614 1.00 10.00 C ATOM 539 C GLU A 49 4.127 -7.954 7.235 1.00 10.00 C ATOM 540 O GLU A 49 4.397 -9.097 7.606 1.00 10.00 O ATOM 541 CB GLU A 49 5.746 -6.097 7.669 1.00 10.00 C ATOM 542 CG GLU A 49 6.961 -5.302 7.210 1.00 10.00 C ATOM 543 CD GLU A 49 8.240 -6.111 7.238 1.00 10.00 C ATOM 544 OE1 GLU A 49 9.170 -5.788 6.470 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.325 -7.064 8.040 1.00 10.00 O ATOM 0 H GLU A 49 4.655 -5.296 5.626 1.00 10.00 H new ATOM 0 HA GLU A 49 6.002 -7.693 6.245 1.00 10.00 H new ATOM 0 HB2 GLU A 49 4.958 -5.402 7.958 1.00 10.00 H new ATOM 0 HB3 GLU A 49 6.012 -6.665 8.560 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.789 -4.938 6.197 1.00 10.00 H new ATOM 0 HG3 GLU A 49 7.077 -4.426 7.848 1.00 10.00 H new ATOM 552 N ARG A 50 2.909 -7.432 7.328 1.00 10.00 N ATOM 553 CA ARG A 50 1.789 -8.171 7.904 1.00 10.00 C ATOM 554 C ARG A 50 1.466 -9.421 7.096 1.00 10.00 C ATOM 555 O ARG A 50 1.184 -10.479 7.660 1.00 10.00 O ATOM 556 CB ARG A 50 0.551 -7.287 7.981 1.00 10.00 C ATOM 557 CG ARG A 50 0.523 -6.384 9.196 1.00 10.00 C ATOM 558 CD ARG A 50 -0.645 -5.427 9.128 1.00 10.00 C ATOM 559 NE ARG A 50 -1.082 -5.002 10.453 1.00 10.00 N ATOM 560 CZ ARG A 50 -2.358 -4.927 10.820 1.00 10.00 C ATOM 561 NH1 ARG A 50 -3.316 -5.323 9.991 1.00 10.00 N ATOM 562 NH2 ARG A 50 -2.678 -4.484 12.027 1.00 10.00 N ATOM 0 H ARG A 50 2.670 -6.493 7.010 1.00 10.00 H new ATOM 0 HA ARG A 50 2.085 -8.476 8.908 1.00 10.00 H new ATOM 0 HB2 ARG A 50 0.497 -6.673 7.082 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -0.337 -7.920 7.989 1.00 10.00 H new ATOM 0 HG2 ARG A 50 0.452 -6.987 10.101 1.00 10.00 H new ATOM 0 HG3 ARG A 50 1.455 -5.823 9.259 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -0.363 -4.552 8.542 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -1.475 -5.905 8.609 1.00 10.00 H new ATOM 0 HE ARG A 50 -0.369 -4.748 11.137 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -3.075 -5.686 9.069 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -4.294 -5.264 10.276 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -1.945 -4.200 12.677 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -3.657 -4.427 12.306 1.00 10.00 H new ATOM 576 N GLN A 51 1.502 -9.300 5.777 1.00 10.00 N ATOM 577 CA GLN A 51 1.205 -10.429 4.905 1.00 10.00 C ATOM 578 C GLN A 51 2.418 -11.339 4.755 1.00 10.00 C ATOM 579 O GLN A 51 2.333 -12.412 4.152 1.00 10.00 O ATOM 580 CB GLN A 51 0.742 -9.945 3.529 1.00 10.00 C ATOM 581 CG GLN A 51 -0.561 -9.154 3.557 1.00 10.00 C ATOM 582 CD GLN A 51 -1.583 -9.721 4.525 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.690 -9.277 5.670 1.00 10.00 O ATOM 584 NE2 GLN A 51 -2.336 -10.711 4.077 1.00 10.00 N ATOM 0 H GLN A 51 1.733 -8.435 5.288 1.00 10.00 H new ATOM 0 HA GLN A 51 0.399 -11.000 5.366 1.00 10.00 H new ATOM 0 HB2 GLN A 51 1.523 -9.323 3.092 1.00 10.00 H new ATOM 0 HB3 GLN A 51 0.618 -10.808 2.874 1.00 10.00 H new ATOM 0 HG2 GLN A 51 -0.346 -8.121 3.830 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -0.990 -9.136 2.555 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -2.217 -11.051 3.123 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -3.036 -11.135 4.686 1.00 10.00 H new ATOM 593 N GLY A 52 3.542 -10.902 5.310 1.00 10.00 N ATOM 594 CA GLY A 52 4.766 -11.674 5.241 1.00 10.00 C ATOM 595 C GLY A 52 5.265 -11.826 3.822 1.00 10.00 C ATOM 596 O GLY A 52 5.667 -12.916 3.410 1.00 10.00 O ATOM 0 H GLY A 52 3.626 -10.018 5.811 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.534 -11.190 5.845 1.00 10.00 H new ATOM 0 HA3 GLY A 52 4.596 -12.660 5.673 1.00 10.00 H new ATOM 600 N LEU A 53 5.231 -10.738 3.072 1.00 10.00 N ATOM 601 CA LEU A 53 5.674 -10.755 1.688 1.00 10.00 C ATOM 602 C LEU A 53 6.690 -9.652 1.441 1.00 10.00 C ATOM 603 O LEU A 53 7.073 -8.928 2.362 1.00 10.00 O ATOM 604 CB LEU A 53 4.480 -10.580 0.746 1.00 10.00 C ATOM 605 CG LEU A 53 3.439 -11.701 0.795 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.177 -11.290 0.054 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.012 -12.982 0.207 1.00 10.00 C ATOM 0 H LEU A 53 4.901 -9.830 3.399 1.00 10.00 H new ATOM 0 HA LEU A 53 6.145 -11.718 1.491 1.00 10.00 H new ATOM 0 HB2 LEU A 53 3.986 -9.637 0.983 1.00 10.00 H new ATOM 0 HB3 LEU A 53 4.853 -10.497 -0.275 1.00 10.00 H new ATOM 0 HG LEU A 53 3.178 -11.886 1.837 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.448 -12.099 0.100 1.00 10.00 H new ATOM 0 HD12 LEU A 53 1.757 -10.397 0.518 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.419 -11.078 -0.987 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.260 -13.770 0.249 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.299 -12.810 -0.830 1.00 10.00 H new ATOM 0 HD23 LEU A 53 4.888 -13.286 0.780 1.00 10.00 H new ATOM 619 N SER A 54 7.119 -9.532 0.195 1.00 10.00 N ATOM 620 CA SER A 54 8.078 -8.515 -0.196 1.00 10.00 C ATOM 621 C SER A 54 7.365 -7.394 -0.947 1.00 10.00 C ATOM 622 O SER A 54 6.411 -7.647 -1.689 1.00 10.00 O ATOM 623 CB SER A 54 9.169 -9.127 -1.079 1.00 10.00 C ATOM 624 OG SER A 54 10.130 -8.158 -1.456 1.00 10.00 O ATOM 0 H SER A 54 6.813 -10.134 -0.569 1.00 10.00 H new ATOM 0 HA SER A 54 8.544 -8.105 0.700 1.00 10.00 H new ATOM 0 HB2 SER A 54 9.660 -9.940 -0.543 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.717 -9.560 -1.971 1.00 10.00 H new ATOM 0 HG SER A 54 10.815 -8.578 -2.018 1.00 10.00 H new ATOM 630 N MET A 55 7.834 -6.161 -0.765 1.00 10.00 N ATOM 631 CA MET A 55 7.232 -5.009 -1.428 1.00 10.00 C ATOM 632 C MET A 55 7.499 -5.078 -2.925 1.00 10.00 C ATOM 633 O MET A 55 6.839 -4.419 -3.723 1.00 10.00 O ATOM 634 CB MET A 55 7.780 -3.702 -0.852 1.00 10.00 C ATOM 635 CG MET A 55 6.764 -2.570 -0.838 1.00 10.00 C ATOM 636 SD MET A 55 7.515 -0.960 -0.522 1.00 10.00 S ATOM 637 CE MET A 55 8.252 -0.615 -2.120 1.00 10.00 C ATOM 0 H MET A 55 8.627 -5.936 -0.165 1.00 10.00 H new ATOM 0 HA MET A 55 6.156 -5.031 -1.255 1.00 10.00 H new ATOM 0 HB2 MET A 55 8.127 -3.880 0.166 1.00 10.00 H new ATOM 0 HB3 MET A 55 8.648 -3.393 -1.435 1.00 10.00 H new ATOM 0 HG2 MET A 55 6.245 -2.542 -1.796 1.00 10.00 H new ATOM 0 HG3 MET A 55 6.013 -2.772 -0.074 1.00 10.00 H new ATOM 0 HE1 MET A 55 9.294 -0.324 -1.985 1.00 10.00 H new ATOM 0 HE2 MET A 55 8.202 -1.507 -2.744 1.00 10.00 H new ATOM 0 HE3 MET A 55 7.709 0.197 -2.604 1.00 10.00 H new ATOM 647 N ARG A 56 8.469 -5.902 -3.292 1.00 10.00 N ATOM 648 CA ARG A 56 8.831 -6.096 -4.684 1.00 10.00 C ATOM 649 C ARG A 56 7.819 -7.012 -5.368 1.00 10.00 C ATOM 650 O ARG A 56 7.791 -7.116 -6.594 1.00 10.00 O ATOM 651 CB ARG A 56 10.231 -6.707 -4.770 1.00 10.00 C ATOM 652 CG ARG A 56 10.860 -6.628 -6.148 1.00 10.00 C ATOM 653 CD ARG A 56 12.215 -7.310 -6.169 1.00 10.00 C ATOM 654 NE ARG A 56 13.019 -6.907 -7.321 1.00 10.00 N ATOM 655 CZ ARG A 56 14.007 -6.012 -7.261 1.00 10.00 C ATOM 656 NH1 ARG A 56 14.318 -5.424 -6.107 1.00 10.00 N ATOM 657 NH2 ARG A 56 14.693 -5.707 -8.357 1.00 10.00 N ATOM 0 H ARG A 56 9.024 -6.451 -2.636 1.00 10.00 H new ATOM 0 HA ARG A 56 8.828 -5.131 -5.191 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.881 -6.200 -4.057 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.178 -7.753 -4.466 1.00 10.00 H new ATOM 0 HG2 ARG A 56 10.202 -7.097 -6.879 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.970 -5.584 -6.442 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.753 -7.072 -5.252 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.075 -8.391 -6.186 1.00 10.00 H new ATOM 0 HE ARG A 56 12.813 -7.335 -8.224 1.00 10.00 H new ATOM 0 HH11 ARG A 56 13.799 -5.657 -5.260 1.00 10.00 H new ATOM 0 HH12 ARG A 56 15.075 -4.741 -6.070 1.00 10.00 H new ATOM 0 HH21 ARG A 56 14.464 -6.157 -9.243 1.00 10.00 H new ATOM 0 HH22 ARG A 56 15.448 -5.023 -8.312 1.00 10.00 H new ATOM 671 N GLN A 57 6.969 -7.652 -4.573 1.00 10.00 N ATOM 672 CA GLN A 57 5.970 -8.573 -5.099 1.00 10.00 C ATOM 673 C GLN A 57 4.587 -7.924 -5.202 1.00 10.00 C ATOM 674 O GLN A 57 3.904 -8.059 -6.215 1.00 10.00 O ATOM 675 CB GLN A 57 5.892 -9.820 -4.214 1.00 10.00 C ATOM 676 CG GLN A 57 4.767 -10.765 -4.594 1.00 10.00 C ATOM 677 CD GLN A 57 4.555 -11.867 -3.576 1.00 10.00 C ATOM 678 OE1 GLN A 57 5.503 -12.344 -2.946 1.00 10.00 O ATOM 679 NE2 GLN A 57 3.308 -12.269 -3.394 1.00 10.00 N ATOM 0 H GLN A 57 6.952 -7.549 -3.558 1.00 10.00 H new ATOM 0 HA GLN A 57 6.280 -8.852 -6.106 1.00 10.00 H new ATOM 0 HB2 GLN A 57 6.840 -10.355 -4.271 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.762 -9.512 -3.177 1.00 10.00 H new ATOM 0 HG2 GLN A 57 3.843 -10.197 -4.705 1.00 10.00 H new ATOM 0 HG3 GLN A 57 4.985 -11.211 -5.564 1.00 10.00 H new ATOM 0 HE21 GLN A 57 2.553 -11.849 -3.935 1.00 10.00 H new ATOM 0 HE22 GLN A 57 3.102 -12.999 -2.712 1.00 10.00 H new ATOM 688 N ILE A 58 4.173 -7.220 -4.160 1.00 10.00 N ATOM 689 CA ILE A 58 2.857 -6.588 -4.155 1.00 10.00 C ATOM 690 C ILE A 58 2.877 -5.216 -4.824 1.00 10.00 C ATOM 691 O ILE A 58 3.908 -4.545 -4.871 1.00 10.00 O ATOM 692 CB ILE A 58 2.297 -6.456 -2.724 1.00 10.00 C ATOM 693 CG1 ILE A 58 3.317 -5.785 -1.801 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.896 -7.824 -2.187 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.860 -5.690 -0.362 1.00 10.00 C ATOM 0 H ILE A 58 4.721 -7.071 -3.313 1.00 10.00 H new ATOM 0 HA ILE A 58 2.203 -7.242 -4.732 1.00 10.00 H new ATOM 0 HB ILE A 58 1.409 -5.824 -2.756 1.00 10.00 H new ATOM 0 HG12 ILE A 58 4.253 -6.343 -1.840 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.528 -4.783 -2.174 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.502 -7.717 -1.176 1.00 10.00 H new ATOM 0 HG22 ILE A 58 1.130 -8.257 -2.831 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.768 -8.478 -2.169 1.00 10.00 H new ATOM 0 HD11 ILE A 58 3.633 -5.204 0.234 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.941 -5.107 -0.310 1.00 10.00 H new ATOM 0 HD13 ILE A 58 2.677 -6.691 0.028 1.00 10.00 H new ATOM 707 N ARG A 59 1.734 -4.822 -5.371 1.00 10.00 N ATOM 708 CA ARG A 59 1.586 -3.536 -6.039 1.00 10.00 C ATOM 709 C ARG A 59 0.356 -2.814 -5.512 1.00 10.00 C ATOM 710 O ARG A 59 -0.747 -3.359 -5.545 1.00 10.00 O ATOM 711 CB ARG A 59 1.447 -3.723 -7.555 1.00 10.00 C ATOM 712 CG ARG A 59 2.649 -4.372 -8.217 1.00 10.00 C ATOM 713 CD ARG A 59 3.874 -3.476 -8.156 1.00 10.00 C ATOM 714 NE ARG A 59 5.029 -4.096 -8.796 1.00 10.00 N ATOM 715 CZ ARG A 59 5.866 -4.924 -8.176 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.707 -5.197 -6.886 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.876 -5.469 -8.842 1.00 10.00 N ATOM 0 H ARG A 59 0.884 -5.385 -5.364 1.00 10.00 H new ATOM 0 HA ARG A 59 2.478 -2.944 -5.834 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.565 -4.331 -7.755 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.275 -2.750 -8.015 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.867 -5.321 -7.726 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.414 -4.598 -9.257 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.654 -2.526 -8.643 1.00 10.00 H new ATOM 0 HD3 ARG A 59 4.111 -3.253 -7.116 1.00 10.00 H new ATOM 0 HE ARG A 59 5.206 -3.882 -9.778 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.940 -4.771 -6.365 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.352 -5.832 -6.416 1.00 10.00 H new ATOM 0 HH21 ARG A 59 7.011 -5.253 -9.830 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.517 -6.104 -8.366 1.00 10.00 H new ATOM 731 N PHE A 60 0.539 -1.596 -5.032 1.00 10.00 N ATOM 732 CA PHE A 60 -0.571 -0.815 -4.504 1.00 10.00 C ATOM 733 C PHE A 60 -1.065 0.184 -5.540 1.00 10.00 C ATOM 734 O PHE A 60 -0.268 0.823 -6.228 1.00 10.00 O ATOM 735 CB PHE A 60 -0.156 -0.075 -3.233 1.00 10.00 C ATOM 736 CG PHE A 60 0.002 -0.965 -2.031 1.00 10.00 C ATOM 737 CD1 PHE A 60 1.064 -1.851 -1.941 1.00 10.00 C ATOM 738 CD2 PHE A 60 -0.905 -0.904 -0.986 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.218 -2.659 -0.833 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.758 -1.712 0.125 1.00 10.00 C ATOM 741 CZ PHE A 60 0.306 -2.590 0.202 1.00 10.00 C ATOM 0 H PHE A 60 1.443 -1.125 -4.996 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.380 -1.505 -4.263 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.786 0.441 -3.417 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -0.900 0.690 -3.011 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.780 -1.910 -2.748 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.737 -0.217 -1.040 1.00 10.00 H new ATOM 0 HE1 PHE A 60 2.051 -3.344 -0.775 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.474 -1.657 0.932 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.424 -3.221 1.070 1.00 10.00 H new ATOM 751 N ARG A 61 -2.379 0.310 -5.651 1.00 10.00 N ATOM 752 CA ARG A 61 -2.977 1.235 -6.602 1.00 10.00 C ATOM 753 C ARG A 61 -4.085 2.045 -5.947 1.00 10.00 C ATOM 754 O ARG A 61 -4.809 1.541 -5.087 1.00 10.00 O ATOM 755 CB ARG A 61 -3.540 0.484 -7.811 1.00 10.00 C ATOM 756 CG ARG A 61 -2.482 0.008 -8.796 1.00 10.00 C ATOM 757 CD ARG A 61 -3.087 -0.277 -10.160 1.00 10.00 C ATOM 758 NE ARG A 61 -2.115 -0.859 -11.085 1.00 10.00 N ATOM 759 CZ ARG A 61 -2.007 -0.517 -12.371 1.00 10.00 C ATOM 760 NH1 ARG A 61 -2.762 0.448 -12.880 1.00 10.00 N ATOM 761 NH2 ARG A 61 -1.129 -1.133 -13.148 1.00 10.00 N ATOM 0 H ARG A 61 -3.052 -0.217 -5.094 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.193 1.914 -6.938 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.106 -0.378 -7.458 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.242 1.134 -8.334 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -1.704 0.765 -8.892 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -2.004 -0.893 -8.412 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -3.931 -0.958 -10.046 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -3.479 0.648 -10.582 1.00 10.00 H new ATOM 0 HE ARG A 61 -1.480 -1.571 -10.725 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -3.433 0.937 -12.287 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -2.671 0.701 -13.864 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -0.536 -1.868 -12.764 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -1.046 -0.872 -14.131 1.00 10.00 H new ATOM 775 N PHE A 62 -4.201 3.297 -6.358 1.00 10.00 N ATOM 776 CA PHE A 62 -5.226 4.190 -5.846 1.00 10.00 C ATOM 777 C PHE A 62 -6.092 4.658 -7.006 1.00 10.00 C ATOM 778 O PHE A 62 -5.607 5.372 -7.891 1.00 10.00 O ATOM 779 CB PHE A 62 -4.589 5.389 -5.134 1.00 10.00 C ATOM 780 CG PHE A 62 -5.579 6.452 -4.737 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.632 6.155 -3.887 1.00 10.00 C ATOM 782 CD2 PHE A 62 -5.455 7.747 -5.217 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.541 7.129 -3.522 1.00 10.00 C ATOM 784 CE2 PHE A 62 -6.362 8.723 -4.854 1.00 10.00 C ATOM 785 CZ PHE A 62 -7.406 8.414 -4.006 1.00 10.00 C ATOM 0 H PHE A 62 -3.589 3.722 -7.054 1.00 10.00 H new ATOM 0 HA PHE A 62 -5.842 3.660 -5.120 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -4.070 5.037 -4.243 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.837 5.831 -5.787 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.743 5.151 -3.506 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.641 7.995 -5.882 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -8.357 6.885 -2.858 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -6.254 9.728 -5.234 1.00 10.00 H new ATOM 0 HZ PHE A 62 -8.116 9.177 -3.722 1.00 10.00 H new ATOM 795 N ASP A 63 -7.351 4.211 -7.016 1.00 10.00 N ATOM 796 CA ASP A 63 -8.320 4.547 -8.070 1.00 10.00 C ATOM 797 C ASP A 63 -7.995 3.796 -9.360 1.00 10.00 C ATOM 798 O ASP A 63 -8.854 3.140 -9.948 1.00 10.00 O ATOM 799 CB ASP A 63 -8.369 6.056 -8.340 1.00 10.00 C ATOM 800 CG ASP A 63 -9.238 6.402 -9.536 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.478 6.327 -9.417 1.00 10.00 O ATOM 802 OD2 ASP A 63 -8.682 6.766 -10.597 1.00 10.00 O ATOM 0 H ASP A 63 -7.731 3.603 -6.291 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.303 4.238 -7.714 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -8.751 6.568 -7.457 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -7.358 6.425 -8.510 1.00 10.00 H new ATOM 807 N GLY A 64 -6.748 3.898 -9.780 1.00 10.00 N ATOM 808 CA GLY A 64 -6.297 3.238 -10.981 1.00 10.00 C ATOM 809 C GLY A 64 -4.799 3.349 -11.135 1.00 10.00 C ATOM 810 O GLY A 64 -4.138 2.410 -11.580 1.00 10.00 O ATOM 0 H GLY A 64 -6.028 4.437 -9.300 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.585 2.187 -10.952 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -6.788 3.679 -11.848 1.00 10.00 H new ATOM 814 N GLN A 65 -4.262 4.498 -10.748 1.00 10.00 N ATOM 815 CA GLN A 65 -2.831 4.747 -10.841 1.00 10.00 C ATOM 816 C GLN A 65 -2.097 4.117 -9.658 1.00 10.00 C ATOM 817 O GLN A 65 -2.642 4.030 -8.559 1.00 10.00 O ATOM 818 CB GLN A 65 -2.552 6.254 -10.887 1.00 10.00 C ATOM 819 CG GLN A 65 -3.357 7.003 -11.939 1.00 10.00 C ATOM 820 CD GLN A 65 -3.192 6.427 -13.332 1.00 10.00 C ATOM 821 OE1 GLN A 65 -3.974 5.576 -13.762 1.00 10.00 O ATOM 822 NE2 GLN A 65 -2.174 6.882 -14.043 1.00 10.00 N ATOM 0 H GLN A 65 -4.799 5.276 -10.365 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.465 4.292 -11.762 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.766 6.682 -9.908 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.490 6.410 -11.078 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -4.412 6.981 -11.665 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -3.051 8.049 -11.946 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -1.551 7.587 -13.649 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -2.012 6.528 -14.986 1.00 10.00 H new ATOM 831 N PRO A 66 -0.863 3.644 -9.879 1.00 10.00 N ATOM 832 CA PRO A 66 -0.053 3.030 -8.823 1.00 10.00 C ATOM 833 C PRO A 66 0.468 4.060 -7.827 1.00 10.00 C ATOM 834 O PRO A 66 0.733 5.210 -8.186 1.00 10.00 O ATOM 835 CB PRO A 66 1.104 2.387 -9.594 1.00 10.00 C ATOM 836 CG PRO A 66 1.231 3.198 -10.837 1.00 10.00 C ATOM 837 CD PRO A 66 -0.159 3.664 -11.176 1.00 10.00 C ATOM 0 HA PRO A 66 -0.625 2.321 -8.224 1.00 10.00 H new ATOM 0 HB2 PRO A 66 2.026 2.407 -9.013 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.894 1.342 -9.823 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.899 4.045 -10.683 1.00 10.00 H new ATOM 0 HG3 PRO A 66 1.652 2.604 -11.648 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.151 4.663 -11.611 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -0.636 3.004 -11.901 1.00 10.00 H new ATOM 845 N ILE A 67 0.608 3.644 -6.577 1.00 10.00 N ATOM 846 CA ILE A 67 1.095 4.528 -5.531 1.00 10.00 C ATOM 847 C ILE A 67 2.618 4.622 -5.578 1.00 10.00 C ATOM 848 O ILE A 67 3.310 3.604 -5.648 1.00 10.00 O ATOM 849 CB ILE A 67 0.648 4.045 -4.133 1.00 10.00 C ATOM 850 CG1 ILE A 67 -0.882 4.029 -4.044 1.00 10.00 C ATOM 851 CG2 ILE A 67 1.244 4.928 -3.041 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.414 3.622 -2.684 1.00 10.00 C ATOM 0 H ILE A 67 0.391 2.698 -6.263 1.00 10.00 H new ATOM 0 HA ILE A 67 0.666 5.514 -5.708 1.00 10.00 H new ATOM 0 HB ILE A 67 1.015 3.030 -3.982 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.261 5.021 -4.289 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.273 3.344 -4.796 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.917 4.570 -2.065 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.332 4.890 -3.095 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.910 5.956 -3.182 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.504 3.635 -2.701 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.067 2.617 -2.443 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.055 4.321 -1.929 1.00 10.00 H new ATOM 864 N ASN A 68 3.132 5.845 -5.557 1.00 10.00 N ATOM 865 CA ASN A 68 4.568 6.071 -5.601 1.00 10.00 C ATOM 866 C ASN A 68 5.161 5.969 -4.202 1.00 10.00 C ATOM 867 O ASN A 68 4.460 6.149 -3.204 1.00 10.00 O ATOM 868 CB ASN A 68 4.884 7.446 -6.199 1.00 10.00 C ATOM 869 CG ASN A 68 4.412 7.583 -7.635 1.00 10.00 C ATOM 870 OD1 ASN A 68 5.154 7.299 -8.575 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.181 8.035 -7.813 1.00 10.00 N ATOM 0 H ASN A 68 2.573 6.697 -5.510 1.00 10.00 H new ATOM 0 HA ASN A 68 5.013 5.304 -6.235 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.414 8.219 -5.591 1.00 10.00 H new ATOM 0 HB3 ASN A 68 5.960 7.618 -6.156 1.00 10.00 H new ATOM 0 HD21 ASN A 68 2.815 8.160 -8.757 1.00 10.00 H new ATOM 0 HD22 ASN A 68 2.598 8.259 -7.006 1.00 10.00 H new ATOM 878 N GLU A 69 6.459 5.709 -4.134 1.00 10.00 N ATOM 879 CA GLU A 69 7.152 5.576 -2.854 1.00 10.00 C ATOM 880 C GLU A 69 7.359 6.936 -2.182 1.00 10.00 C ATOM 881 O GLU A 69 7.973 7.027 -1.117 1.00 10.00 O ATOM 882 CB GLU A 69 8.500 4.880 -3.054 1.00 10.00 C ATOM 883 CG GLU A 69 8.376 3.464 -3.594 1.00 10.00 C ATOM 884 CD GLU A 69 9.704 2.735 -3.625 1.00 10.00 C ATOM 885 OE1 GLU A 69 10.318 2.565 -2.550 1.00 10.00 O ATOM 886 OE2 GLU A 69 10.140 2.329 -4.720 1.00 10.00 O ATOM 0 H GLU A 69 7.057 5.585 -4.951 1.00 10.00 H new ATOM 0 HA GLU A 69 6.526 4.970 -2.199 1.00 10.00 H new ATOM 0 HB2 GLU A 69 9.107 5.471 -3.740 1.00 10.00 H new ATOM 0 HB3 GLU A 69 9.031 4.853 -2.102 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.672 2.904 -2.978 1.00 10.00 H new ATOM 0 HG3 GLU A 69 7.961 3.498 -4.601 1.00 10.00 H new ATOM 893 N THR A 70 6.847 7.984 -2.806 1.00 10.00 N ATOM 894 CA THR A 70 6.965 9.330 -2.271 1.00 10.00 C ATOM 895 C THR A 70 5.591 9.997 -2.236 1.00 10.00 C ATOM 896 O THR A 70 5.474 11.222 -2.191 1.00 10.00 O ATOM 897 CB THR A 70 7.931 10.175 -3.123 1.00 10.00 C ATOM 898 OG1 THR A 70 8.837 9.311 -3.828 1.00 10.00 O ATOM 899 CG2 THR A 70 8.726 11.139 -2.255 1.00 10.00 C ATOM 0 H THR A 70 6.342 7.927 -3.690 1.00 10.00 H new ATOM 0 HA THR A 70 7.363 9.264 -1.259 1.00 10.00 H new ATOM 0 HB THR A 70 7.341 10.754 -3.833 1.00 10.00 H new ATOM 0 HG1 THR A 70 9.449 9.851 -4.370 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.400 11.723 -2.882 1.00 10.00 H new ATOM 0 HG22 THR A 70 8.042 11.810 -1.735 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.307 10.576 -1.524 1.00 10.00 H new ATOM 907 N ASP A 71 4.550 9.173 -2.251 1.00 10.00 N ATOM 908 CA ASP A 71 3.184 9.680 -2.238 1.00 10.00 C ATOM 909 C ASP A 71 2.629 9.761 -0.824 1.00 10.00 C ATOM 910 O ASP A 71 3.067 9.043 0.079 1.00 10.00 O ATOM 911 CB ASP A 71 2.272 8.804 -3.098 1.00 10.00 C ATOM 912 CG ASP A 71 2.228 9.252 -4.544 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.435 10.457 -4.801 1.00 10.00 O ATOM 914 OD2 ASP A 71 1.997 8.399 -5.426 1.00 10.00 O ATOM 0 H ASP A 71 4.625 8.156 -2.272 1.00 10.00 H new ATOM 0 HA ASP A 71 3.212 10.687 -2.654 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.618 7.771 -3.052 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.263 8.821 -2.685 1.00 10.00 H new ATOM 919 N THR A 72 1.666 10.650 -0.649 1.00 10.00 N ATOM 920 CA THR A 72 1.011 10.859 0.631 1.00 10.00 C ATOM 921 C THR A 72 -0.489 11.029 0.408 1.00 10.00 C ATOM 922 O THR A 72 -0.913 11.312 -0.717 1.00 10.00 O ATOM 923 CB THR A 72 1.567 12.111 1.343 1.00 10.00 C ATOM 924 OG1 THR A 72 1.930 13.099 0.373 1.00 10.00 O ATOM 925 CG2 THR A 72 2.776 11.767 2.200 1.00 10.00 C ATOM 0 H THR A 72 1.315 11.250 -1.395 1.00 10.00 H new ATOM 0 HA THR A 72 1.203 9.991 1.262 1.00 10.00 H new ATOM 0 HB THR A 72 0.787 12.504 1.995 1.00 10.00 H new ATOM 0 HG1 THR A 72 2.281 13.892 0.829 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.145 12.669 2.688 1.00 10.00 H new ATOM 0 HG22 THR A 72 2.490 11.036 2.956 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.561 11.349 1.570 1.00 10.00 H new ATOM 933 N PRO A 73 -1.317 10.850 1.453 1.00 10.00 N ATOM 934 CA PRO A 73 -2.772 11.000 1.337 1.00 10.00 C ATOM 935 C PRO A 73 -3.162 12.353 0.746 1.00 10.00 C ATOM 936 O PRO A 73 -4.044 12.440 -0.104 1.00 10.00 O ATOM 937 CB PRO A 73 -3.263 10.884 2.782 1.00 10.00 C ATOM 938 CG PRO A 73 -2.209 10.096 3.478 1.00 10.00 C ATOM 939 CD PRO A 73 -0.911 10.467 2.819 1.00 10.00 C ATOM 0 HA PRO A 73 -3.208 10.257 0.669 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.388 11.866 3.237 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -4.230 10.383 2.833 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -2.187 10.329 4.543 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.399 9.026 3.390 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.418 11.290 3.337 1.00 10.00 H new ATOM 0 HD3 PRO A 73 -0.211 9.631 2.811 1.00 10.00 H new ATOM 947 N ALA A 74 -2.477 13.405 1.186 1.00 10.00 N ATOM 948 CA ALA A 74 -2.749 14.749 0.701 1.00 10.00 C ATOM 949 C ALA A 74 -2.272 14.923 -0.738 1.00 10.00 C ATOM 950 O ALA A 74 -2.923 15.592 -1.538 1.00 10.00 O ATOM 951 CB ALA A 74 -2.088 15.780 1.603 1.00 10.00 C ATOM 0 H ALA A 74 -1.730 13.350 1.878 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.828 14.902 0.720 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -2.300 16.781 1.228 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.479 15.682 2.616 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -1.010 15.617 1.613 1.00 10.00 H new ATOM 957 N GLN A 75 -1.141 14.303 -1.066 1.00 10.00 N ATOM 958 CA GLN A 75 -0.568 14.403 -2.408 1.00 10.00 C ATOM 959 C GLN A 75 -1.476 13.753 -3.450 1.00 10.00 C ATOM 960 O GLN A 75 -1.665 14.284 -4.543 1.00 10.00 O ATOM 961 CB GLN A 75 0.810 13.739 -2.448 1.00 10.00 C ATOM 962 CG GLN A 75 1.572 13.981 -3.743 1.00 10.00 C ATOM 963 CD GLN A 75 1.983 15.429 -3.919 1.00 10.00 C ATOM 964 OE1 GLN A 75 2.233 16.139 -2.946 1.00 10.00 O ATOM 965 NE2 GLN A 75 2.047 15.877 -5.161 1.00 10.00 N ATOM 0 H GLN A 75 -0.602 13.725 -0.421 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.470 15.462 -2.647 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.405 14.108 -1.613 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.690 12.665 -2.303 1.00 10.00 H new ATOM 0 HG2 GLN A 75 2.461 13.351 -3.759 1.00 10.00 H new ATOM 0 HG3 GLN A 75 0.951 13.679 -4.587 1.00 10.00 H new ATOM 0 HE21 GLN A 75 1.832 15.254 -5.940 1.00 10.00 H new ATOM 0 HE22 GLN A 75 2.312 16.845 -5.341 1.00 10.00 H new ATOM 974 N LEU A 76 -2.043 12.608 -3.101 1.00 10.00 N ATOM 975 CA LEU A 76 -2.918 11.889 -4.018 1.00 10.00 C ATOM 976 C LEU A 76 -4.361 12.366 -3.906 1.00 10.00 C ATOM 977 O LEU A 76 -5.251 11.804 -4.542 1.00 10.00 O ATOM 978 CB LEU A 76 -2.843 10.383 -3.762 1.00 10.00 C ATOM 979 CG LEU A 76 -1.549 9.707 -4.220 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.645 8.202 -4.040 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.244 10.054 -5.671 1.00 10.00 C ATOM 0 H LEU A 76 -1.915 12.158 -2.195 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.572 12.096 -5.031 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -2.968 10.206 -2.694 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.682 9.903 -4.265 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.731 10.078 -3.602 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.717 7.736 -4.370 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.812 7.971 -2.988 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.475 7.817 -4.632 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.320 9.563 -5.976 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.062 9.714 -6.306 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.131 11.134 -5.771 1.00 10.00 H new ATOM 993 N GLU A 77 -4.577 13.414 -3.109 1.00 10.00 N ATOM 994 CA GLU A 77 -5.912 13.983 -2.907 1.00 10.00 C ATOM 995 C GLU A 77 -6.881 12.923 -2.391 1.00 10.00 C ATOM 996 O GLU A 77 -8.013 12.816 -2.863 1.00 10.00 O ATOM 997 CB GLU A 77 -6.443 14.590 -4.211 1.00 10.00 C ATOM 998 CG GLU A 77 -5.448 15.496 -4.919 1.00 10.00 C ATOM 999 CD GLU A 77 -5.851 16.952 -4.874 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -6.682 17.371 -5.708 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -5.334 17.689 -4.008 1.00 10.00 O ATOM 0 H GLU A 77 -3.839 13.889 -2.589 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.831 14.773 -2.160 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.729 13.783 -4.886 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.347 15.159 -3.994 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -4.467 15.380 -4.459 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -5.352 15.182 -5.958 1.00 10.00 H new ATOM 1008 N MET A 78 -6.425 12.140 -1.427 1.00 10.00 N ATOM 1009 CA MET A 78 -7.241 11.085 -0.844 1.00 10.00 C ATOM 1010 C MET A 78 -8.117 11.652 0.258 1.00 10.00 C ATOM 1011 O MET A 78 -7.799 12.688 0.844 1.00 10.00 O ATOM 1012 CB MET A 78 -6.355 9.968 -0.282 1.00 10.00 C ATOM 1013 CG MET A 78 -5.324 9.457 -1.271 1.00 10.00 C ATOM 1014 SD MET A 78 -4.233 8.210 -0.562 1.00 10.00 S ATOM 1015 CE MET A 78 -5.343 6.808 -0.463 1.00 10.00 C ATOM 0 H MET A 78 -5.489 12.215 -1.029 1.00 10.00 H new ATOM 0 HA MET A 78 -7.875 10.668 -1.626 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.843 10.334 0.608 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.987 9.138 0.033 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.835 9.036 -2.137 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.726 10.294 -1.630 1.00 10.00 H new ATOM 0 HE1 MET A 78 -5.247 6.336 0.515 1.00 10.00 H new ATOM 0 HE2 MET A 78 -6.370 7.146 -0.603 1.00 10.00 H new ATOM 0 HE3 MET A 78 -5.089 6.087 -1.240 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.214 10.976 0.544 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.126 11.426 1.578 1.00 10.00 C ATOM 1027 C GLU A 79 -10.426 10.303 2.557 1.00 10.00 C ATOM 1028 O GLU A 79 -9.953 9.179 2.393 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.424 11.957 0.965 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.629 13.447 1.188 1.00 10.00 C ATOM 1031 CD GLU A 79 -11.343 13.869 2.616 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -11.915 13.265 3.548 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -10.543 14.804 2.815 1.00 10.00 O ATOM 0 H GLU A 79 -9.495 10.115 0.075 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.644 12.239 2.121 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.422 11.754 -0.106 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.268 11.414 1.391 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.980 14.004 0.512 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.656 13.710 0.934 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.216 10.614 3.569 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.583 9.640 4.585 1.00 10.00 C ATOM 1042 C ASP A 80 -12.466 8.552 3.993 1.00 10.00 C ATOM 1043 O ASP A 80 -13.248 8.816 3.073 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.309 10.329 5.738 1.00 10.00 C ATOM 1045 CG ASP A 80 -12.398 9.456 6.968 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -13.467 9.442 7.614 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -11.396 8.797 7.305 1.00 10.00 O ATOM 0 H ASP A 80 -11.619 11.540 3.711 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.670 9.179 4.963 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.790 11.254 5.989 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.314 10.604 5.418 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.322 7.333 4.513 1.00 10.00 N ATOM 1053 CA GLU A 81 -13.099 6.183 4.053 1.00 10.00 C ATOM 1054 C GLU A 81 -12.709 5.800 2.630 1.00 10.00 C ATOM 1055 O GLU A 81 -13.528 5.278 1.870 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.600 6.482 4.121 1.00 10.00 C ATOM 1057 CG GLU A 81 -15.137 6.612 5.535 1.00 10.00 C ATOM 1058 CD GLU A 81 -15.654 5.298 6.071 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -15.424 5.000 7.261 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -16.293 4.551 5.300 1.00 10.00 O ATOM 0 H GLU A 81 -11.665 7.116 5.263 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.878 5.344 4.713 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.801 7.406 3.580 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -15.142 5.688 3.608 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.348 6.984 6.189 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -15.939 7.350 5.551 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.456 6.048 2.274 1.00 10.00 N ATOM 1068 CA ASP A 82 -10.972 5.732 0.935 1.00 10.00 C ATOM 1069 C ASP A 82 -10.651 4.252 0.811 1.00 10.00 C ATOM 1070 O ASP A 82 -10.738 3.509 1.787 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.742 6.565 0.583 1.00 10.00 C ATOM 1072 CG ASP A 82 -9.902 7.246 -0.756 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -10.292 6.559 -1.725 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -9.670 8.473 -0.840 1.00 10.00 O ATOM 0 H ASP A 82 -10.758 6.465 2.890 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.767 5.978 0.231 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.575 7.315 1.356 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.860 5.925 0.564 1.00 10.00 H new ATOM 1079 N THR A 83 -10.281 3.821 -0.387 1.00 10.00 N ATOM 1080 CA THR A 83 -9.966 2.419 -0.623 1.00 10.00 C ATOM 1081 C THR A 83 -8.701 2.251 -1.463 1.00 10.00 C ATOM 1082 O THR A 83 -8.529 2.903 -2.494 1.00 10.00 O ATOM 1083 CB THR A 83 -11.137 1.700 -1.323 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.377 2.081 -0.708 1.00 10.00 O ATOM 1085 CG2 THR A 83 -10.976 0.188 -1.244 1.00 10.00 C ATOM 0 H THR A 83 -10.192 4.420 -1.208 1.00 10.00 H new ATOM 0 HA THR A 83 -9.794 1.970 0.355 1.00 10.00 H new ATOM 0 HB THR A 83 -11.138 1.994 -2.373 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.119 1.623 -1.156 1.00 10.00 H new ATOM 0 HG21 THR A 83 -11.815 -0.294 -1.745 1.00 10.00 H new ATOM 0 HG22 THR A 83 -10.046 -0.105 -1.731 1.00 10.00 H new ATOM 0 HG23 THR A 83 -10.951 -0.121 -0.199 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.822 1.372 -1.001 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.578 1.070 -1.694 1.00 10.00 C ATOM 1095 C ILE A 84 -6.562 -0.411 -2.056 1.00 10.00 C ATOM 1096 O ILE A 84 -6.930 -1.255 -1.235 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.340 1.403 -0.830 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.419 2.837 -0.299 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.062 1.200 -1.632 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.303 3.195 0.660 1.00 10.00 C ATOM 0 H ILE A 84 -7.952 0.849 -0.135 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.529 1.687 -2.591 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.325 0.724 0.023 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.398 3.528 -1.141 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.376 2.976 0.203 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.200 1.439 -1.009 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -3.998 0.162 -1.958 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -4.072 1.854 -2.504 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.426 4.225 0.993 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.336 2.529 1.522 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.342 3.089 0.156 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.150 -0.732 -3.274 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.122 -2.121 -3.719 1.00 10.00 C ATOM 1114 C ASP A 85 -4.699 -2.654 -3.802 1.00 10.00 C ATOM 1115 O ASP A 85 -3.761 -1.916 -4.122 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.812 -2.264 -5.075 1.00 10.00 C ATOM 1117 CG ASP A 85 -8.322 -2.255 -4.959 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -8.910 -3.321 -4.673 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -8.934 -1.185 -5.164 1.00 10.00 O ATOM 0 H ASP A 85 -5.832 -0.056 -3.969 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.662 -2.712 -2.979 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -6.496 -1.451 -5.728 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.492 -3.193 -5.546 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.549 -3.940 -3.506 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.247 -4.596 -3.536 1.00 10.00 C ATOM 1126 C VAL A 86 -3.223 -5.701 -4.587 1.00 10.00 C ATOM 1127 O VAL A 86 -3.973 -6.674 -4.501 1.00 10.00 O ATOM 1128 CB VAL A 86 -2.890 -5.206 -2.167 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -1.444 -5.680 -2.149 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.141 -4.207 -1.049 1.00 10.00 C ATOM 0 H VAL A 86 -5.320 -4.553 -3.240 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.511 -3.832 -3.787 1.00 10.00 H new ATOM 0 HB VAL A 86 -3.534 -6.070 -2.002 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -1.213 -6.107 -1.173 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -1.300 -6.437 -2.920 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -0.782 -4.836 -2.341 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -2.882 -4.660 -0.092 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -2.528 -3.320 -1.209 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.194 -3.924 -1.044 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.360 -5.545 -5.579 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.228 -6.528 -6.644 1.00 10.00 C ATOM 1142 C PHE A 87 -0.951 -7.338 -6.457 1.00 10.00 C ATOM 1143 O PHE A 87 -0.011 -6.881 -5.804 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.213 -5.839 -8.011 1.00 10.00 C ATOM 1145 CG PHE A 87 -3.503 -5.151 -8.355 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -4.495 -5.820 -9.052 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -3.720 -3.833 -7.985 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -5.681 -5.189 -9.372 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -4.904 -3.197 -8.303 1.00 10.00 C ATOM 1150 CZ PHE A 87 -5.884 -3.875 -8.997 1.00 10.00 C ATOM 0 H PHE A 87 -1.737 -4.742 -5.669 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.085 -7.200 -6.601 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.405 -5.108 -8.030 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -1.991 -6.580 -8.779 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.339 -6.847 -9.349 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -2.955 -3.298 -7.442 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -6.448 -5.722 -9.914 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.062 -2.170 -8.009 1.00 10.00 H new ATOM 0 HZ PHE A 87 -6.810 -3.379 -9.247 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.924 -8.534 -7.025 1.00 10.00 N ATOM 1161 CA GLN A 88 0.238 -9.406 -6.924 1.00 10.00 C ATOM 1162 C GLN A 88 0.980 -9.458 -8.254 1.00 10.00 C ATOM 1163 O GLN A 88 0.361 -9.601 -9.312 1.00 10.00 O ATOM 1164 CB GLN A 88 -0.183 -10.823 -6.523 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.981 -10.892 -5.231 1.00 10.00 C ATOM 1166 CD GLN A 88 -0.180 -10.472 -4.013 1.00 10.00 C ATOM 1167 OE1 GLN A 88 1.043 -10.614 -3.974 1.00 10.00 O ATOM 1168 NE2 GLN A 88 -0.871 -9.965 -3.004 1.00 10.00 N ATOM 0 H GLN A 88 -1.697 -8.925 -7.563 1.00 10.00 H new ATOM 0 HA GLN A 88 0.898 -9.000 -6.158 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.777 -11.255 -7.328 1.00 10.00 H new ATOM 0 HB3 GLN A 88 0.710 -11.440 -6.419 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -1.859 -10.252 -5.319 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.342 -11.911 -5.088 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -1.883 -9.865 -3.078 1.00 10.00 H new ATOM 0 HE22 GLN A 88 -0.391 -9.674 -2.152 1.00 10.00 H new ATOM 1177 N GLN A 89 2.299 -9.329 -8.198 1.00 10.00 N ATOM 1178 CA GLN A 89 3.129 -9.374 -9.394 1.00 10.00 C ATOM 1179 C GLN A 89 3.019 -10.737 -10.070 1.00 10.00 C ATOM 1180 O GLN A 89 2.932 -11.768 -9.400 1.00 10.00 O ATOM 1181 CB GLN A 89 4.586 -9.070 -9.036 1.00 10.00 C ATOM 1182 CG GLN A 89 5.474 -8.769 -10.233 1.00 10.00 C ATOM 1183 CD GLN A 89 4.929 -7.661 -11.115 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.182 -6.790 -10.665 1.00 10.00 O ATOM 1185 NE2 GLN A 89 5.308 -7.681 -12.381 1.00 10.00 N ATOM 0 H GLN A 89 2.819 -9.192 -7.332 1.00 10.00 H new ATOM 0 HA GLN A 89 2.775 -8.616 -10.093 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.611 -8.218 -8.356 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.000 -9.921 -8.496 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.467 -8.489 -9.880 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.591 -9.675 -10.828 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.927 -8.419 -12.716 1.00 10.00 H new ATOM 0 HE22 GLN A 89 4.981 -6.959 -13.023 1.00 10.00 H new ATOM 1194 N GLN A 90 3.005 -10.732 -11.393 1.00 10.00 N ATOM 1195 CA GLN A 90 2.900 -11.959 -12.166 1.00 10.00 C ATOM 1196 C GLN A 90 4.188 -12.765 -12.082 1.00 10.00 C ATOM 1197 O GLN A 90 5.285 -12.212 -12.185 1.00 10.00 O ATOM 1198 CB GLN A 90 2.577 -11.645 -13.628 1.00 10.00 C ATOM 1199 CG GLN A 90 1.200 -11.032 -13.842 1.00 10.00 C ATOM 1200 CD GLN A 90 1.162 -9.544 -13.549 1.00 10.00 C ATOM 1201 OE1 GLN A 90 2.177 -8.852 -13.641 1.00 10.00 O ATOM 1202 NE2 GLN A 90 -0.009 -9.039 -13.203 1.00 10.00 N ATOM 0 H GLN A 90 3.066 -9.885 -11.958 1.00 10.00 H new ATOM 0 HA GLN A 90 2.090 -12.554 -11.744 1.00 10.00 H new ATOM 0 HB2 GLN A 90 3.332 -10.962 -14.017 1.00 10.00 H new ATOM 0 HB3 GLN A 90 2.649 -12.564 -14.210 1.00 10.00 H new ATOM 0 HG2 GLN A 90 0.889 -11.202 -14.873 1.00 10.00 H new ATOM 0 HG3 GLN A 90 0.478 -11.541 -13.203 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -0.827 -9.645 -13.138 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -0.095 -8.043 -13.001 1.00 10.00 H new ATOM 1211 N THR A 91 4.045 -14.069 -11.898 1.00 10.00 N ATOM 1212 CA THR A 91 5.184 -14.966 -11.796 1.00 10.00 C ATOM 1213 C THR A 91 5.839 -15.185 -13.156 1.00 10.00 C ATOM 1214 O THR A 91 7.030 -15.495 -13.247 1.00 10.00 O ATOM 1215 CB THR A 91 4.746 -16.322 -11.222 1.00 10.00 C ATOM 1216 OG1 THR A 91 3.438 -16.654 -11.710 1.00 10.00 O ATOM 1217 CG2 THR A 91 4.732 -16.290 -9.702 1.00 10.00 C ATOM 0 H THR A 91 3.140 -14.533 -11.816 1.00 10.00 H new ATOM 0 HA THR A 91 5.910 -14.502 -11.128 1.00 10.00 H new ATOM 0 HB THR A 91 5.461 -17.079 -11.544 1.00 10.00 H new ATOM 0 HG1 THR A 91 3.162 -17.520 -11.344 1.00 10.00 H new ATOM 0 HG21 THR A 91 4.419 -17.262 -9.320 1.00 10.00 H new ATOM 0 HG22 THR A 91 5.732 -16.061 -9.334 1.00 10.00 H new ATOM 0 HG23 THR A 91 4.035 -15.524 -9.361 1.00 10.00 H new ATOM 1225 N GLY A 92 5.053 -15.035 -14.209 1.00 10.00 N ATOM 1226 CA GLY A 92 5.567 -15.212 -15.548 1.00 10.00 C ATOM 1227 C GLY A 92 5.429 -13.949 -16.365 1.00 10.00 C ATOM 1228 O GLY A 92 5.348 -12.860 -15.762 1.00 10.00 O ATOM 0 H GLY A 92 4.063 -14.793 -14.159 1.00 10.00 H new ATOM 0 HA2 GLY A 92 6.616 -15.503 -15.501 1.00 10.00 H new ATOM 0 HA3 GLY A 92 5.033 -16.025 -16.040 1.00 10.00 H new TER 1232 GLY A 92 ATOM 1233 N ASN B 357 -15.543 -10.867 6.600 1.00 10.00 N ATOM 1234 CA ASN B 357 -14.373 -10.005 6.339 1.00 10.00 C ATOM 1235 C ASN B 357 -13.758 -9.553 7.655 1.00 10.00 C ATOM 1236 O ASN B 357 -14.402 -9.623 8.700 1.00 10.00 O ATOM 1237 CB ASN B 357 -14.773 -8.784 5.497 1.00 10.00 C ATOM 1238 CG ASN B 357 -15.688 -7.814 6.234 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -15.570 -6.530 5.928 1.00 10.00 O flip ATOM 1240 ND2 ASN B 357 -16.504 -8.215 7.061 1.00 10.00 N flip ATOM 0 HA ASN B 357 -13.637 -10.582 5.779 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -13.872 -8.256 5.185 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -15.272 -9.125 4.590 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -16.568 -9.211 7.273 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -17.117 -7.552 7.536 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.507 -9.122 7.616 1.00 10.00 N ATOM 1248 CA ASN B 358 -11.830 -8.662 8.825 1.00 10.00 C ATOM 1249 C ASN B 358 -11.356 -7.234 8.663 1.00 10.00 C ATOM 1250 O ASN B 358 -10.766 -6.904 7.646 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.636 -9.578 9.168 1.00 10.00 C ATOM 1252 CG ASN B 358 -9.434 -9.329 8.275 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -9.420 -9.726 7.115 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -8.411 -8.675 8.805 1.00 10.00 N ATOM 0 H ASN B 358 -11.941 -9.080 6.769 1.00 10.00 H new ATOM 0 HA ASN B 358 -12.547 -8.702 9.645 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -10.350 -9.422 10.208 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -10.943 -10.620 9.075 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -7.580 -8.488 8.244 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -8.455 -8.358 9.774 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.694 -6.371 9.606 1.00 10.00 N ATOM 1262 CA ARG B 359 -11.228 -4.991 9.552 1.00 10.00 C ATOM 1263 C ARG B 359 -10.516 -4.613 10.856 1.00 10.00 C ATOM 1264 O ARG B 359 -11.104 -4.676 11.942 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.399 -4.037 9.291 1.00 10.00 C ATOM 1266 CG ARG B 359 -13.555 -4.238 10.246 1.00 10.00 C ATOM 1267 CD ARG B 359 -14.792 -3.477 9.803 1.00 10.00 C ATOM 1268 NE ARG B 359 -14.608 -2.024 9.863 1.00 10.00 N ATOM 1269 CZ ARG B 359 -15.550 -1.143 9.520 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -16.729 -1.568 9.083 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -15.319 0.161 9.621 1.00 10.00 N ATOM 0 H ARG B 359 -12.281 -6.595 10.409 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.518 -4.902 8.730 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -12.046 -3.009 9.369 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -12.752 -4.176 8.269 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -13.788 -5.301 10.316 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -13.264 -3.909 11.243 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -15.047 -3.766 8.783 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -15.634 -3.760 10.434 1.00 10.00 H new ATOM 0 HE ARG B 359 -13.709 -1.666 10.185 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -16.915 -2.568 9.009 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -17.449 -0.894 8.821 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -14.417 0.494 9.962 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -16.043 0.829 9.357 1.00 10.00 H new ATOM 1285 N ASP B 360 -9.253 -4.237 10.745 1.00 10.00 N ATOM 1286 CA ASP B 360 -8.451 -3.805 11.891 1.00 10.00 C ATOM 1287 C ASP B 360 -7.775 -2.464 11.580 1.00 10.00 C ATOM 1288 O ASP B 360 -7.342 -2.258 10.448 1.00 10.00 O ATOM 1289 CB ASP B 360 -7.473 -4.892 12.365 1.00 10.00 C ATOM 1290 CG ASP B 360 -6.077 -4.792 11.803 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -5.797 -5.461 10.789 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -5.231 -4.100 12.408 1.00 10.00 O ATOM 0 H ASP B 360 -8.749 -4.221 9.859 1.00 10.00 H new ATOM 0 HA ASP B 360 -9.115 -3.645 12.741 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -7.413 -4.854 13.453 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -7.884 -5.867 12.102 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.676 -1.525 12.549 1.00 10.00 N ATOM 1298 CA PRO B 361 -7.094 -0.207 12.301 1.00 10.00 C ATOM 1299 C PRO B 361 -5.678 -0.028 12.864 1.00 10.00 C ATOM 1300 O PRO B 361 -5.392 -0.304 14.029 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.073 0.687 13.068 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.609 -0.164 14.193 1.00 10.00 C ATOM 1303 CD PRO B 361 -8.223 -1.601 13.904 1.00 10.00 C ATOM 0 HA PRO B 361 -6.977 -0.001 11.237 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.572 1.575 13.453 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -8.879 1.031 12.420 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -8.195 0.159 15.148 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.692 -0.065 14.265 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.487 -1.973 14.617 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -9.083 -2.269 13.956 1.00 10.00 H new ATOM 1311 N ILE B 362 -4.806 0.460 11.987 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.391 0.665 12.282 1.00 10.00 C ATOM 1313 C ILE B 362 -3.022 2.139 12.167 1.00 10.00 C ATOM 1314 O ILE B 362 -3.393 2.793 11.199 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.512 -0.130 11.291 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.111 -1.509 11.007 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.102 -0.278 11.827 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -3.863 -1.589 9.692 1.00 10.00 C ATOM 0 H ILE B 362 -5.066 0.728 11.038 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.216 0.319 13.301 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.477 0.429 10.356 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -2.311 -2.249 11.003 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -3.788 -1.776 11.819 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.499 -0.841 11.114 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.663 0.709 11.974 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.128 -0.809 12.779 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -4.259 -2.596 9.560 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -4.686 -0.874 9.699 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -3.186 -1.355 8.871 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.293 2.660 13.145 1.00 10.00 N ATOM 1331 CA VAL B 363 -1.898 4.063 13.119 1.00 10.00 C ATOM 1332 C VAL B 363 -0.384 4.193 13.031 1.00 10.00 C ATOM 1333 O VAL B 363 0.350 3.605 13.827 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.375 4.806 14.394 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -1.965 6.271 14.358 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -3.881 4.676 14.573 1.00 10.00 C ATOM 0 H VAL B 363 -1.966 2.139 13.959 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.365 4.510 12.241 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.890 4.338 15.250 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.312 6.768 15.264 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -0.879 6.344 14.298 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.410 6.752 13.487 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.187 5.206 15.475 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.388 5.105 13.709 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -4.147 3.623 14.664 1.00 10.00 H new ATOM 1346 N ILE B 364 0.072 4.948 12.037 1.00 10.00 N ATOM 1347 CA ILE B 364 1.498 5.199 11.853 1.00 10.00 C ATOM 1348 C ILE B 364 1.759 6.702 11.863 1.00 10.00 C ATOM 1349 O ILE B 364 1.106 7.455 11.142 1.00 10.00 O ATOM 1350 CB ILE B 364 2.034 4.625 10.520 1.00 10.00 C ATOM 1351 CG1 ILE B 364 1.723 3.133 10.401 1.00 10.00 C ATOM 1352 CG2 ILE B 364 3.538 4.863 10.411 1.00 10.00 C ATOM 1353 CD1 ILE B 364 1.832 2.609 8.985 1.00 10.00 C ATOM 0 H ILE B 364 -0.527 5.398 11.344 1.00 10.00 H new ATOM 0 HA ILE B 364 2.015 4.701 12.673 1.00 10.00 H new ATOM 0 HB ILE B 364 1.533 5.141 9.701 1.00 10.00 H new ATOM 0 HG12 ILE B 364 2.406 2.575 11.041 1.00 10.00 H new ATOM 0 HG13 ILE B 364 0.715 2.948 10.773 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.904 4.455 9.469 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.740 5.933 10.445 1.00 10.00 H new ATOM 0 HG23 ILE B 364 4.045 4.371 11.241 1.00 10.00 H new ATOM 0 HD11 ILE B 364 1.599 1.544 8.972 1.00 10.00 H new ATOM 0 HD12 ILE B 364 1.129 3.142 8.345 1.00 10.00 H new ATOM 0 HD13 ILE B 364 2.847 2.763 8.617 1.00 10.00 H new ATOM 1365 N SER B 365 2.687 7.141 12.696 1.00 10.00 N ATOM 1366 CA SER B 365 3.036 8.551 12.757 1.00 10.00 C ATOM 1367 C SER B 365 4.535 8.743 12.548 1.00 10.00 C ATOM 1368 O SER B 365 5.347 8.105 13.222 1.00 10.00 O ATOM 1369 CB SER B 365 2.592 9.153 14.089 1.00 10.00 C ATOM 1370 OG SER B 365 1.203 8.954 14.280 1.00 10.00 O ATOM 0 H SER B 365 3.211 6.545 13.337 1.00 10.00 H new ATOM 0 HA SER B 365 2.513 9.072 11.955 1.00 10.00 H new ATOM 0 HB2 SER B 365 3.148 8.694 14.907 1.00 10.00 H new ATOM 0 HB3 SER B 365 2.820 10.219 14.108 1.00 10.00 H new ATOM 0 HG SER B 365 0.932 9.343 15.138 1.00 10.00 H new ATOM 1376 N ASP B 366 4.903 9.611 11.617 1.00 10.00 N ATOM 1377 CA ASP B 366 6.312 9.880 11.357 1.00 10.00 C ATOM 1378 C ASP B 366 6.612 11.361 11.524 1.00 10.00 C ATOM 1379 O ASP B 366 5.870 12.215 11.029 1.00 10.00 O ATOM 1380 CB ASP B 366 6.726 9.407 9.966 1.00 10.00 C ATOM 1381 CG ASP B 366 8.110 8.785 9.971 1.00 10.00 C ATOM 1382 OD1 ASP B 366 8.566 8.325 8.906 1.00 10.00 O ATOM 1383 OD2 ASP B 366 8.740 8.725 11.051 1.00 10.00 O ATOM 0 H ASP B 366 4.253 10.137 11.033 1.00 10.00 H new ATOM 0 HA ASP B 366 6.895 9.318 12.087 1.00 10.00 H new ATOM 0 HB2 ASP B 366 6.002 8.680 9.599 1.00 10.00 H new ATOM 0 HB3 ASP B 366 6.709 10.250 9.275 1.00 10.00 H new ATOM 1388 N SER B 367 7.673 11.666 12.251 1.00 10.00 N ATOM 1389 CA SER B 367 8.072 13.046 12.491 1.00 10.00 C ATOM 1390 C SER B 367 9.401 13.355 11.791 1.00 10.00 C ATOM 1391 O SER B 367 10.465 13.017 12.307 1.00 10.00 O ATOM 1392 CB SER B 367 8.202 13.278 13.998 1.00 10.00 C ATOM 1393 OG SER B 367 8.659 12.101 14.645 1.00 10.00 O ATOM 0 H SER B 367 8.279 10.972 12.689 1.00 10.00 H new ATOM 0 HA SER B 367 7.312 13.713 12.083 1.00 10.00 H new ATOM 0 HB2 SER B 367 8.896 14.097 14.187 1.00 10.00 H new ATOM 0 HB3 SER B 367 7.238 13.576 14.410 1.00 10.00 H new ATOM 0 HG SER B 367 8.738 12.267 15.608 1.00 10.00 H new ATOM 1399 N PRO B 368 9.361 13.985 10.604 1.00 10.00 N ATOM 1400 CA PRO B 368 10.558 14.331 9.854 1.00 10.00 C ATOM 1401 C PRO B 368 11.106 15.698 10.255 1.00 10.00 C ATOM 1402 O PRO B 368 11.317 16.549 9.362 1.00 10.00 O ATOM 1403 CB PRO B 368 10.076 14.344 8.394 1.00 10.00 C ATOM 1404 CG PRO B 368 8.574 14.348 8.439 1.00 10.00 C ATOM 1405 CD PRO B 368 8.155 14.412 9.887 1.00 10.00 C ATOM 0 HA PRO B 368 11.374 13.632 10.034 1.00 10.00 H new ATOM 0 HB2 PRO B 368 10.450 15.223 7.870 1.00 10.00 H new ATOM 0 HB3 PRO B 368 10.445 13.471 7.856 1.00 10.00 H new ATOM 0 HG2 PRO B 368 8.178 15.202 7.889 1.00 10.00 H new ATOM 0 HG3 PRO B 368 8.175 13.451 7.966 1.00 10.00 H new ATOM 0 HD2 PRO B 368 7.851 15.419 10.174 1.00 10.00 H new ATOM 0 HD3 PRO B 368 7.311 13.754 10.091 1.00 10.00 H new TER 1413 PRO B 368