USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 817 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 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -122:sc= 0.119 (180deg=-0.00932) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 37 CYS SG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -0.0172 X(o=-0.017,f=-0.13) USER MOD Single : A 50 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0742) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 76:sc= 0.252 USER MOD Single : A 65 THR OG1 : rot 94:sc= 0.0517 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 176:sc= 0 (180deg=-0.0251) USER MOD Single : A 90 MET CE :methyl -124:sc= -1.96 (180deg=-3.27!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -15.187 -26.127 -19.340 1.00 0.00 N ATOM 2 CA MET A 1 -15.544 -24.787 -18.906 1.00 0.00 C ATOM 3 C MET A 1 -16.667 -24.212 -19.773 1.00 0.00 C ATOM 4 O MET A 1 -17.051 -24.812 -20.775 1.00 0.00 O ATOM 5 CB MET A 1 -14.316 -23.879 -18.992 1.00 0.00 C ATOM 6 CG MET A 1 -13.346 -24.159 -17.843 1.00 0.00 C ATOM 7 SD MET A 1 -11.993 -22.996 -17.888 1.00 0.00 S ATOM 8 CE MET A 1 -10.763 -23.915 -16.978 1.00 0.00 C ATOM 0 H1 MET A 1 -15.307 -26.792 -18.549 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.802 -26.412 -20.129 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.195 -26.138 -19.653 1.00 0.00 H new ATOM 0 HA MET A 1 -15.896 -24.840 -17.876 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.811 -24.034 -19.945 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.628 -22.835 -18.963 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.868 -24.085 -16.889 1.00 0.00 H new ATOM 0 HG3 MET A 1 -12.964 -25.177 -17.919 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.846 -23.329 -16.911 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.134 -24.124 -15.975 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.557 -24.854 -17.492 1.00 0.00 H new ATOM 18 N ASP A 2 -17.160 -23.056 -19.354 1.00 0.00 N ATOM 19 CA ASP A 2 -18.231 -22.393 -20.079 1.00 0.00 C ATOM 20 C ASP A 2 -17.826 -20.946 -20.367 1.00 0.00 C ATOM 21 O ASP A 2 -17.162 -20.309 -19.551 1.00 0.00 O ATOM 22 CB ASP A 2 -19.520 -22.368 -19.256 1.00 0.00 C ATOM 23 CG ASP A 2 -20.024 -23.739 -18.802 1.00 0.00 C ATOM 24 OD1 ASP A 2 -20.367 -24.538 -19.756 1.00 0.00 O ATOM 25 OD2 ASP A 2 -20.087 -24.030 -17.598 1.00 0.00 O ATOM 0 H ASP A 2 -16.838 -22.561 -18.522 1.00 0.00 H new ATOM 0 HA ASP A 2 -18.404 -22.944 -21.003 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -19.359 -21.747 -18.375 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -20.301 -21.888 -19.846 1.00 0.00 H new ATOM 30 N LEU A 3 -18.242 -20.470 -21.531 1.00 0.00 N ATOM 31 CA LEU A 3 -17.931 -19.110 -21.938 1.00 0.00 C ATOM 32 C LEU A 3 -19.174 -18.471 -22.560 1.00 0.00 C ATOM 33 O LEU A 3 -19.759 -19.021 -23.491 1.00 0.00 O ATOM 34 CB LEU A 3 -16.706 -19.091 -22.854 1.00 0.00 C ATOM 35 CG LEU A 3 -15.354 -18.907 -22.163 1.00 0.00 C ATOM 36 CD1 LEU A 3 -14.455 -20.125 -22.384 1.00 0.00 C ATOM 37 CD2 LEU A 3 -14.681 -17.608 -22.612 1.00 0.00 C ATOM 0 H LEU A 3 -18.792 -21.002 -22.206 1.00 0.00 H new ATOM 0 HA LEU A 3 -17.661 -18.506 -21.072 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -16.681 -20.026 -23.414 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -16.833 -18.288 -23.580 1.00 0.00 H new ATOM 0 HG LEU A 3 -15.527 -18.825 -21.090 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -13.500 -19.968 -21.882 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -14.938 -21.013 -21.976 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -14.285 -20.263 -23.452 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -13.722 -17.501 -22.106 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -14.522 -17.635 -23.690 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -15.320 -16.761 -22.360 1.00 0.00 H new ATOM 49 N ILE A 4 -19.541 -17.318 -22.019 1.00 0.00 N ATOM 50 CA ILE A 4 -20.705 -16.598 -22.510 1.00 0.00 C ATOM 51 C ILE A 4 -20.334 -15.131 -22.734 1.00 0.00 C ATOM 52 O ILE A 4 -21.120 -14.235 -22.432 1.00 0.00 O ATOM 53 CB ILE A 4 -21.893 -16.795 -21.566 1.00 0.00 C ATOM 54 CG1 ILE A 4 -21.632 -16.135 -20.210 1.00 0.00 C ATOM 55 CG2 ILE A 4 -22.242 -18.278 -21.425 1.00 0.00 C ATOM 56 CD1 ILE A 4 -20.620 -16.942 -19.394 1.00 0.00 C ATOM 0 H ILE A 4 -19.053 -16.865 -21.246 1.00 0.00 H new ATOM 0 HA ILE A 4 -21.023 -16.997 -23.473 1.00 0.00 H new ATOM 0 HB ILE A 4 -22.761 -16.301 -22.002 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -21.259 -15.122 -20.360 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -22.567 -16.051 -19.656 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -23.090 -18.390 -20.749 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -22.501 -18.685 -22.402 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -21.384 -18.817 -21.023 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -20.452 -16.452 -18.435 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -21.007 -17.947 -19.225 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -19.679 -17.003 -19.940 1.00 0.00 H new ATOM 68 N GLY A 5 -19.135 -14.931 -23.263 1.00 0.00 N ATOM 69 CA GLY A 5 -18.651 -13.588 -23.532 1.00 0.00 C ATOM 70 C GLY A 5 -17.928 -13.011 -22.313 1.00 0.00 C ATOM 71 O GLY A 5 -18.319 -13.270 -21.176 1.00 0.00 O ATOM 0 H GLY A 5 -18.485 -15.677 -23.512 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -17.974 -13.606 -24.386 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -19.488 -12.943 -23.802 1.00 0.00 H new ATOM 75 N PHE A 6 -16.887 -12.241 -22.592 1.00 0.00 N ATOM 76 CA PHE A 6 -16.107 -11.625 -21.532 1.00 0.00 C ATOM 77 C PHE A 6 -16.671 -10.252 -21.162 1.00 0.00 C ATOM 78 O PHE A 6 -16.965 -9.990 -19.997 1.00 0.00 O ATOM 79 CB PHE A 6 -14.684 -11.452 -22.067 1.00 0.00 C ATOM 80 CG PHE A 6 -13.765 -10.651 -21.143 1.00 0.00 C ATOM 81 CD1 PHE A 6 -13.579 -11.050 -19.856 1.00 0.00 C ATOM 82 CD2 PHE A 6 -13.133 -9.540 -21.608 1.00 0.00 C ATOM 83 CE1 PHE A 6 -12.726 -10.306 -18.998 1.00 0.00 C ATOM 84 CE2 PHE A 6 -12.280 -8.797 -20.750 1.00 0.00 C ATOM 85 CZ PHE A 6 -12.095 -9.195 -19.463 1.00 0.00 C ATOM 0 H PHE A 6 -16.565 -12.029 -23.537 1.00 0.00 H new ATOM 0 HA PHE A 6 -16.133 -12.250 -20.640 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -14.247 -12.437 -22.233 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -14.729 -10.956 -23.037 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -14.080 -11.933 -19.487 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -13.280 -9.223 -22.630 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -12.579 -10.623 -17.976 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -11.778 -7.915 -21.120 1.00 0.00 H new ATOM 0 HZ PHE A 6 -11.447 -8.629 -18.810 1.00 0.00 H new ATOM 95 N GLY A 7 -16.805 -9.410 -22.177 1.00 0.00 N ATOM 96 CA GLY A 7 -17.328 -8.070 -21.973 1.00 0.00 C ATOM 97 C GLY A 7 -18.433 -8.068 -20.915 1.00 0.00 C ATOM 98 O GLY A 7 -18.333 -7.366 -19.909 1.00 0.00 O ATOM 0 H GLY A 7 -16.560 -9.630 -23.142 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.522 -7.404 -21.664 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.719 -7.681 -22.913 1.00 0.00 H new ATOM 102 N TYR A 8 -19.461 -8.861 -21.177 1.00 0.00 N ATOM 103 CA TYR A 8 -20.584 -8.959 -20.259 1.00 0.00 C ATOM 104 C TYR A 8 -20.100 -9.124 -18.817 1.00 0.00 C ATOM 105 O TYR A 8 -20.545 -8.406 -17.923 1.00 0.00 O ATOM 106 CB TYR A 8 -21.357 -10.213 -20.672 1.00 0.00 C ATOM 107 CG TYR A 8 -22.676 -9.923 -21.390 1.00 0.00 C ATOM 108 CD1 TYR A 8 -23.602 -9.075 -20.816 1.00 0.00 C ATOM 109 CD2 TYR A 8 -22.941 -10.509 -22.611 1.00 0.00 C ATOM 110 CE1 TYR A 8 -24.844 -8.801 -21.492 1.00 0.00 C ATOM 111 CE2 TYR A 8 -24.183 -10.236 -23.287 1.00 0.00 C ATOM 112 CZ TYR A 8 -25.073 -9.395 -22.694 1.00 0.00 C ATOM 113 OH TYR A 8 -26.246 -9.137 -23.332 1.00 0.00 O ATOM 0 H TYR A 8 -19.540 -9.442 -22.012 1.00 0.00 H new ATOM 0 HA TYR A 8 -21.196 -8.058 -20.302 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -20.726 -10.818 -21.323 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -21.563 -10.810 -19.783 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -23.395 -8.617 -19.860 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -22.217 -11.173 -23.060 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -25.577 -8.139 -21.054 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -24.403 -10.688 -24.243 1.00 0.00 H new ATOM 0 HH TYR A 8 -26.272 -9.628 -24.180 1.00 0.00 H new ATOM 123 N ALA A 9 -19.195 -10.075 -18.635 1.00 0.00 N ATOM 124 CA ALA A 9 -18.646 -10.343 -17.317 1.00 0.00 C ATOM 125 C ALA A 9 -18.037 -9.059 -16.752 1.00 0.00 C ATOM 126 O ALA A 9 -18.165 -8.779 -15.561 1.00 0.00 O ATOM 127 CB ALA A 9 -17.627 -11.480 -17.410 1.00 0.00 C ATOM 0 H ALA A 9 -18.828 -10.669 -19.379 1.00 0.00 H new ATOM 0 HA ALA A 9 -19.431 -10.664 -16.632 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -17.215 -11.681 -16.421 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -18.117 -12.377 -17.789 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -16.822 -11.193 -18.087 1.00 0.00 H new ATOM 133 N ALA A 10 -17.388 -8.312 -17.633 1.00 0.00 N ATOM 134 CA ALA A 10 -16.758 -7.064 -17.236 1.00 0.00 C ATOM 135 C ALA A 10 -17.838 -6.064 -16.818 1.00 0.00 C ATOM 136 O ALA A 10 -17.601 -5.210 -15.965 1.00 0.00 O ATOM 137 CB ALA A 10 -15.893 -6.541 -18.385 1.00 0.00 C ATOM 0 H ALA A 10 -17.285 -8.547 -18.620 1.00 0.00 H new ATOM 0 HA ALA A 10 -16.103 -7.220 -16.379 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -15.420 -5.605 -18.088 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -15.124 -7.275 -18.625 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -16.518 -6.370 -19.262 1.00 0.00 H new ATOM 143 N LEU A 11 -19.001 -6.203 -17.438 1.00 0.00 N ATOM 144 CA LEU A 11 -20.118 -5.322 -17.141 1.00 0.00 C ATOM 145 C LEU A 11 -20.672 -5.659 -15.755 1.00 0.00 C ATOM 146 O LEU A 11 -20.758 -4.790 -14.889 1.00 0.00 O ATOM 147 CB LEU A 11 -21.164 -5.389 -18.255 1.00 0.00 C ATOM 148 CG LEU A 11 -22.009 -4.130 -18.458 1.00 0.00 C ATOM 149 CD1 LEU A 11 -21.285 -3.123 -19.354 1.00 0.00 C ATOM 150 CD2 LEU A 11 -23.397 -4.482 -18.996 1.00 0.00 C ATOM 0 H LEU A 11 -19.194 -6.913 -18.145 1.00 0.00 H new ATOM 0 HA LEU A 11 -19.787 -4.284 -17.109 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -20.654 -5.615 -19.192 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -21.834 -6.223 -18.047 1.00 0.00 H new ATOM 0 HG LEU A 11 -22.151 -3.654 -17.488 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -21.907 -2.237 -19.482 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -20.340 -2.839 -18.892 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -21.092 -3.575 -20.327 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -23.977 -3.569 -19.131 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -23.297 -4.994 -19.953 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -23.907 -5.134 -18.287 1.00 0.00 H new ATOM 162 N VAL A 12 -21.034 -6.923 -15.588 1.00 0.00 N ATOM 163 CA VAL A 12 -21.577 -7.385 -14.323 1.00 0.00 C ATOM 164 C VAL A 12 -20.680 -6.903 -13.181 1.00 0.00 C ATOM 165 O VAL A 12 -21.151 -6.256 -12.247 1.00 0.00 O ATOM 166 CB VAL A 12 -21.747 -8.905 -14.350 1.00 0.00 C ATOM 167 CG1 VAL A 12 -22.123 -9.440 -12.966 1.00 0.00 C ATOM 168 CG2 VAL A 12 -22.779 -9.323 -15.399 1.00 0.00 C ATOM 0 H VAL A 12 -20.962 -7.641 -16.309 1.00 0.00 H new ATOM 0 HA VAL A 12 -22.569 -6.964 -14.157 1.00 0.00 H new ATOM 0 HB VAL A 12 -20.789 -9.344 -14.629 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -22.238 -10.523 -13.013 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -21.337 -9.189 -12.253 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -23.062 -8.989 -12.644 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -22.880 -10.408 -15.397 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -23.741 -8.868 -15.164 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -22.452 -8.991 -16.384 1.00 0.00 H new ATOM 178 N THR A 13 -19.403 -7.238 -13.293 1.00 0.00 N ATOM 179 CA THR A 13 -18.435 -6.848 -12.282 1.00 0.00 C ATOM 180 C THR A 13 -18.489 -5.337 -12.047 1.00 0.00 C ATOM 181 O THR A 13 -18.758 -4.888 -10.934 1.00 0.00 O ATOM 182 CB THR A 13 -17.059 -7.345 -12.728 1.00 0.00 C ATOM 183 OG1 THR A 13 -17.088 -8.743 -12.451 1.00 0.00 O ATOM 184 CG2 THR A 13 -15.929 -6.814 -11.843 1.00 0.00 C ATOM 0 H THR A 13 -19.016 -7.775 -14.069 1.00 0.00 H new ATOM 0 HA THR A 13 -18.664 -7.303 -11.319 1.00 0.00 H new ATOM 0 HB THR A 13 -16.883 -7.045 -13.761 1.00 0.00 H new ATOM 0 HG1 THR A 13 -16.234 -9.146 -12.712 1.00 0.00 H new ATOM 0 HG21 THR A 13 -14.974 -7.197 -12.203 1.00 0.00 H new ATOM 0 HG22 THR A 13 -15.920 -5.725 -11.879 1.00 0.00 H new ATOM 0 HG23 THR A 13 -16.087 -7.142 -10.815 1.00 0.00 H new ATOM 192 N PHE A 14 -18.229 -4.595 -13.113 1.00 0.00 N ATOM 193 CA PHE A 14 -18.245 -3.144 -13.037 1.00 0.00 C ATOM 194 C PHE A 14 -19.364 -2.655 -12.115 1.00 0.00 C ATOM 195 O PHE A 14 -19.116 -1.890 -11.185 1.00 0.00 O ATOM 196 CB PHE A 14 -18.503 -2.625 -14.453 1.00 0.00 C ATOM 197 CG PHE A 14 -17.382 -1.744 -15.007 1.00 0.00 C ATOM 198 CD1 PHE A 14 -17.368 -0.411 -14.737 1.00 0.00 C ATOM 199 CD2 PHE A 14 -16.399 -2.294 -15.769 1.00 0.00 C ATOM 200 CE1 PHE A 14 -16.327 0.407 -15.251 1.00 0.00 C ATOM 201 CE2 PHE A 14 -15.358 -1.476 -16.283 1.00 0.00 C ATOM 202 CZ PHE A 14 -15.344 -0.143 -16.013 1.00 0.00 C ATOM 0 H PHE A 14 -18.006 -4.971 -14.034 1.00 0.00 H new ATOM 0 HA PHE A 14 -17.298 -2.782 -12.637 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -18.646 -3.475 -15.120 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -19.433 -2.057 -14.457 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -18.149 0.025 -14.132 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -16.410 -3.352 -15.983 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -16.316 1.465 -15.037 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -14.577 -1.912 -16.888 1.00 0.00 H new ATOM 0 HZ PHE A 14 -14.552 0.479 -16.404 1.00 0.00 H new ATOM 212 N GLY A 15 -20.571 -3.118 -12.406 1.00 0.00 N ATOM 213 CA GLY A 15 -21.728 -2.737 -11.614 1.00 0.00 C ATOM 214 C GLY A 15 -21.611 -3.264 -10.183 1.00 0.00 C ATOM 215 O GLY A 15 -21.609 -2.486 -9.230 1.00 0.00 O ATOM 0 H GLY A 15 -20.773 -3.753 -13.178 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -21.821 -1.651 -11.599 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -22.634 -3.128 -12.076 1.00 0.00 H new ATOM 219 N SER A 16 -21.517 -4.581 -10.076 1.00 0.00 N ATOM 220 CA SER A 16 -21.399 -5.221 -8.777 1.00 0.00 C ATOM 221 C SER A 16 -20.482 -4.398 -7.870 1.00 0.00 C ATOM 222 O SER A 16 -20.911 -3.912 -6.824 1.00 0.00 O ATOM 223 CB SER A 16 -20.869 -6.650 -8.912 1.00 0.00 C ATOM 224 OG SER A 16 -21.875 -7.552 -9.365 1.00 0.00 O ATOM 0 H SER A 16 -21.520 -5.223 -10.869 1.00 0.00 H new ATOM 0 HA SER A 16 -22.392 -5.272 -8.330 1.00 0.00 H new ATOM 0 HB2 SER A 16 -20.031 -6.662 -9.609 1.00 0.00 H new ATOM 0 HB3 SER A 16 -20.487 -6.987 -7.949 1.00 0.00 H new ATOM 0 HG SER A 16 -21.497 -8.453 -9.440 1.00 0.00 H new ATOM 230 N ILE A 17 -19.237 -4.267 -8.303 1.00 0.00 N ATOM 231 CA ILE A 17 -18.256 -3.512 -7.542 1.00 0.00 C ATOM 232 C ILE A 17 -18.806 -2.113 -7.256 1.00 0.00 C ATOM 233 O ILE A 17 -18.663 -1.601 -6.147 1.00 0.00 O ATOM 234 CB ILE A 17 -16.907 -3.506 -8.265 1.00 0.00 C ATOM 235 CG1 ILE A 17 -15.785 -3.055 -7.328 1.00 0.00 C ATOM 236 CG2 ILE A 17 -16.969 -2.656 -9.535 1.00 0.00 C ATOM 237 CD1 ILE A 17 -14.700 -4.127 -7.215 1.00 0.00 C ATOM 0 H ILE A 17 -18.885 -4.671 -9.171 1.00 0.00 H new ATOM 0 HA ILE A 17 -18.074 -3.987 -6.578 1.00 0.00 H new ATOM 0 HB ILE A 17 -16.680 -4.527 -8.572 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -15.348 -2.128 -7.699 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -16.195 -2.842 -6.341 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -15.998 -2.669 -10.029 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -17.724 -3.062 -10.208 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -17.230 -1.630 -9.274 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -13.915 -3.781 -6.543 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -15.135 -5.045 -6.821 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -14.275 -4.320 -8.200 1.00 0.00 H new ATOM 249 N PHE A 18 -19.424 -1.535 -8.275 1.00 0.00 N ATOM 250 CA PHE A 18 -19.996 -0.205 -8.147 1.00 0.00 C ATOM 251 C PHE A 18 -20.907 -0.117 -6.921 1.00 0.00 C ATOM 252 O PHE A 18 -20.950 0.912 -6.248 1.00 0.00 O ATOM 253 CB PHE A 18 -20.828 0.047 -9.406 1.00 0.00 C ATOM 254 CG PHE A 18 -20.552 1.396 -10.074 1.00 0.00 C ATOM 255 CD1 PHE A 18 -20.471 2.524 -9.320 1.00 0.00 C ATOM 256 CD2 PHE A 18 -20.389 1.466 -11.422 1.00 0.00 C ATOM 257 CE1 PHE A 18 -20.215 3.776 -9.940 1.00 0.00 C ATOM 258 CE2 PHE A 18 -20.133 2.717 -12.042 1.00 0.00 C ATOM 259 CZ PHE A 18 -20.052 3.846 -11.288 1.00 0.00 C ATOM 0 H PHE A 18 -19.541 -1.963 -9.193 1.00 0.00 H new ATOM 0 HA PHE A 18 -19.202 0.533 -8.030 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -20.632 -0.749 -10.124 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -21.885 -0.010 -9.148 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -20.601 2.468 -8.249 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -20.454 0.570 -12.021 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -20.150 4.672 -9.341 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -20.003 2.772 -13.113 1.00 0.00 H new ATOM 0 HZ PHE A 18 -19.858 4.798 -11.760 1.00 0.00 H new ATOM 269 N GLY A 19 -21.614 -1.209 -6.669 1.00 0.00 N ATOM 270 CA GLY A 19 -22.522 -1.267 -5.536 1.00 0.00 C ATOM 271 C GLY A 19 -21.807 -1.785 -4.286 1.00 0.00 C ATOM 272 O GLY A 19 -22.277 -1.579 -3.168 1.00 0.00 O ATOM 0 H GLY A 19 -21.576 -2.060 -7.230 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -22.930 -0.275 -5.341 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -23.364 -1.917 -5.773 1.00 0.00 H new ATOM 276 N TYR A 20 -20.682 -2.446 -4.518 1.00 0.00 N ATOM 277 CA TYR A 20 -19.898 -2.994 -3.425 1.00 0.00 C ATOM 278 C TYR A 20 -20.785 -3.763 -2.445 1.00 0.00 C ATOM 279 O TYR A 20 -21.433 -3.164 -1.587 1.00 0.00 O ATOM 280 CB TYR A 20 -19.283 -1.793 -2.703 1.00 0.00 C ATOM 281 CG TYR A 20 -18.738 -2.115 -1.311 1.00 0.00 C ATOM 282 CD1 TYR A 20 -17.469 -2.641 -1.171 1.00 0.00 C ATOM 283 CD2 TYR A 20 -19.514 -1.881 -0.194 1.00 0.00 C ATOM 284 CE1 TYR A 20 -16.956 -2.945 0.140 1.00 0.00 C ATOM 285 CE2 TYR A 20 -19.001 -2.185 1.116 1.00 0.00 C ATOM 286 CZ TYR A 20 -17.747 -2.702 1.219 1.00 0.00 C ATOM 287 OH TYR A 20 -17.263 -2.989 2.457 1.00 0.00 O ATOM 0 H TYR A 20 -20.295 -2.614 -5.447 1.00 0.00 H new ATOM 0 HA TYR A 20 -19.145 -3.686 -3.803 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -18.475 -1.390 -3.314 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -20.037 -1.011 -2.615 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -16.861 -2.824 -2.045 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -20.507 -1.470 -0.303 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -15.965 -3.357 0.263 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -19.599 -2.007 1.998 1.00 0.00 H new ATOM 0 HH TYR A 20 -17.937 -2.763 3.132 1.00 0.00 H new ATOM 297 N LYS A 21 -20.787 -5.078 -2.604 1.00 0.00 N ATOM 298 CA LYS A 21 -21.585 -5.936 -1.744 1.00 0.00 C ATOM 299 C LYS A 21 -20.662 -6.689 -0.784 1.00 0.00 C ATOM 300 O LYS A 21 -20.814 -6.593 0.432 1.00 0.00 O ATOM 301 CB LYS A 21 -22.480 -6.851 -2.582 1.00 0.00 C ATOM 302 CG LYS A 21 -23.932 -6.369 -2.559 1.00 0.00 C ATOM 303 CD LYS A 21 -24.813 -7.239 -3.457 1.00 0.00 C ATOM 304 CE LYS A 21 -26.296 -6.940 -3.227 1.00 0.00 C ATOM 305 NZ LYS A 21 -27.084 -8.193 -3.226 1.00 0.00 N ATOM 0 H LYS A 21 -20.248 -5.571 -3.316 1.00 0.00 H new ATOM 0 HA LYS A 21 -22.262 -5.339 -1.133 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -22.118 -6.877 -3.610 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -22.425 -7.870 -2.198 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -24.311 -6.394 -1.537 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -23.980 -5.332 -2.891 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -24.560 -7.061 -4.502 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -24.615 -8.292 -3.256 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -26.425 -6.422 -2.277 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -26.664 -6.273 -4.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -28.088 -7.972 -3.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -26.975 -8.673 -4.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -26.744 -8.816 -2.466 1.00 0.00 H new ATOM 319 N ARG A 22 -19.724 -7.421 -1.368 1.00 0.00 N ATOM 320 CA ARG A 22 -18.776 -8.190 -0.580 1.00 0.00 C ATOM 321 C ARG A 22 -17.573 -8.587 -1.437 1.00 0.00 C ATOM 322 O ARG A 22 -17.732 -9.203 -2.490 1.00 0.00 O ATOM 323 CB ARG A 22 -19.428 -9.452 -0.012 1.00 0.00 C ATOM 324 CG ARG A 22 -19.043 -9.656 1.455 1.00 0.00 C ATOM 325 CD ARG A 22 -19.087 -11.138 1.833 1.00 0.00 C ATOM 326 NE ARG A 22 -20.491 -11.581 1.982 1.00 0.00 N ATOM 327 CZ ARG A 22 -20.854 -12.782 2.452 1.00 0.00 C ATOM 328 NH1 ARG A 22 -19.919 -13.667 2.821 1.00 0.00 N ATOM 329 NH2 ARG A 22 -22.153 -13.097 2.553 1.00 0.00 N ATOM 0 H ARG A 22 -19.601 -7.498 -2.378 1.00 0.00 H new ATOM 0 HA ARG A 22 -18.446 -7.562 0.247 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -20.512 -9.377 -0.100 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -19.120 -10.319 -0.596 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -18.042 -9.262 1.630 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -19.723 -9.094 2.095 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -18.589 -11.732 1.067 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -18.545 -11.300 2.765 1.00 0.00 H new ATOM 0 HE ARG A 22 -21.229 -10.931 1.710 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -18.931 -13.427 2.744 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -20.195 -14.581 3.179 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -22.865 -12.422 2.272 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -22.430 -14.011 2.911 1.00 0.00 H new ATOM 343 N ARG A 23 -16.395 -8.220 -0.953 1.00 0.00 N ATOM 344 CA ARG A 23 -15.165 -8.530 -1.661 1.00 0.00 C ATOM 345 C ARG A 23 -13.953 -8.204 -0.788 1.00 0.00 C ATOM 346 O ARG A 23 -13.995 -7.274 0.017 1.00 0.00 O ATOM 347 CB ARG A 23 -15.069 -7.742 -2.970 1.00 0.00 C ATOM 348 CG ARG A 23 -15.049 -6.236 -2.702 1.00 0.00 C ATOM 349 CD ARG A 23 -13.660 -5.651 -2.966 1.00 0.00 C ATOM 350 NE ARG A 23 -13.750 -4.182 -3.123 1.00 0.00 N ATOM 351 CZ ARG A 23 -12.708 -3.349 -3.005 1.00 0.00 C ATOM 352 NH1 ARG A 23 -11.490 -3.834 -2.728 1.00 0.00 N ATOM 353 NH2 ARG A 23 -12.884 -2.030 -3.163 1.00 0.00 N ATOM 0 H ARG A 23 -16.267 -7.711 -0.079 1.00 0.00 H new ATOM 0 HA ARG A 23 -15.175 -9.595 -1.891 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -14.166 -8.031 -3.508 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -15.915 -7.990 -3.611 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -15.783 -5.740 -3.337 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -15.339 -6.043 -1.669 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -12.991 -5.896 -2.142 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -13.234 -6.096 -3.866 1.00 0.00 H new ATOM 0 HE ARG A 23 -14.663 -3.779 -3.334 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.356 -4.838 -2.607 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -10.697 -3.199 -2.638 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -13.811 -1.661 -3.373 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -12.091 -1.395 -3.073 1.00 0.00 H new ATOM 367 N GLY A 24 -12.900 -8.987 -0.975 1.00 0.00 N ATOM 368 CA GLY A 24 -11.678 -8.793 -0.214 1.00 0.00 C ATOM 369 C GLY A 24 -10.530 -8.350 -1.123 1.00 0.00 C ATOM 370 O GLY A 24 -10.679 -7.409 -1.901 1.00 0.00 O ATOM 0 H GLY A 24 -12.868 -9.757 -1.643 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.843 -8.044 0.561 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.409 -9.721 0.291 1.00 0.00 H new ATOM 374 N GLY A 25 -9.412 -9.048 -0.994 1.00 0.00 N ATOM 375 CA GLY A 25 -8.239 -8.738 -1.794 1.00 0.00 C ATOM 376 C GLY A 25 -6.979 -9.353 -1.182 1.00 0.00 C ATOM 377 O GLY A 25 -6.043 -8.637 -0.831 1.00 0.00 O ATOM 0 H GLY A 25 -9.293 -9.828 -0.347 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -8.376 -9.114 -2.808 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -8.121 -7.657 -1.869 1.00 0.00 H new ATOM 381 N VAL A 26 -6.997 -10.673 -1.074 1.00 0.00 N ATOM 382 CA VAL A 26 -5.867 -11.393 -0.510 1.00 0.00 C ATOM 383 C VAL A 26 -5.679 -10.975 0.949 1.00 0.00 C ATOM 384 O VAL A 26 -5.870 -9.810 1.295 1.00 0.00 O ATOM 385 CB VAL A 26 -4.620 -11.160 -1.365 1.00 0.00 C ATOM 386 CG1 VAL A 26 -3.379 -11.759 -0.699 1.00 0.00 C ATOM 387 CG2 VAL A 26 -4.809 -11.719 -2.776 1.00 0.00 C ATOM 0 H VAL A 26 -7.776 -11.263 -1.367 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.054 -12.467 -0.518 1.00 0.00 H new ATOM 0 HB VAL A 26 -4.469 -10.084 -1.450 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -2.507 -11.580 -1.327 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -3.227 -11.292 0.274 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -3.518 -12.832 -0.569 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -3.908 -11.540 -3.362 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -4.998 -12.791 -2.720 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -5.656 -11.225 -3.253 1.00 0.00 H new ATOM 397 N PRO A 27 -5.296 -11.974 1.788 1.00 0.00 N ATOM 398 CA PRO A 27 -5.080 -11.722 3.203 1.00 0.00 C ATOM 399 C PRO A 27 -3.762 -10.979 3.432 1.00 0.00 C ATOM 400 O PRO A 27 -2.846 -11.511 4.057 1.00 0.00 O ATOM 401 CB PRO A 27 -5.108 -13.095 3.856 1.00 0.00 C ATOM 402 CG PRO A 27 -4.875 -14.095 2.735 1.00 0.00 C ATOM 403 CD PRO A 27 -5.060 -13.366 1.414 1.00 0.00 C ATOM 0 HA PRO A 27 -5.842 -11.074 3.636 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -4.336 -13.179 4.621 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -6.065 -13.275 4.347 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -3.872 -14.516 2.801 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -5.575 -14.926 2.813 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -4.177 -13.462 0.782 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -5.900 -13.773 0.852 1.00 0.00 H new ATOM 411 N SER A 28 -3.709 -9.761 2.913 1.00 0.00 N ATOM 412 CA SER A 28 -2.519 -8.939 3.053 1.00 0.00 C ATOM 413 C SER A 28 -2.742 -7.578 2.391 1.00 0.00 C ATOM 414 O SER A 28 -2.751 -6.550 3.065 1.00 0.00 O ATOM 415 CB SER A 28 -1.297 -9.631 2.446 1.00 0.00 C ATOM 416 OG SER A 28 -0.078 -9.006 2.840 1.00 0.00 O ATOM 0 H SER A 28 -4.471 -9.324 2.395 1.00 0.00 H new ATOM 0 HA SER A 28 -2.328 -8.792 4.116 1.00 0.00 H new ATOM 0 HB2 SER A 28 -1.283 -10.677 2.752 1.00 0.00 H new ATOM 0 HB3 SER A 28 -1.376 -9.618 1.359 1.00 0.00 H new ATOM 0 HG SER A 28 0.678 -9.478 2.433 1.00 0.00 H new ATOM 422 N LEU A 29 -2.915 -7.617 1.078 1.00 0.00 N ATOM 423 CA LEU A 29 -3.138 -6.399 0.317 1.00 0.00 C ATOM 424 C LEU A 29 -4.104 -5.493 1.082 1.00 0.00 C ATOM 425 O LEU A 29 -3.819 -4.316 1.297 1.00 0.00 O ATOM 426 CB LEU A 29 -3.601 -6.732 -1.103 1.00 0.00 C ATOM 427 CG LEU A 29 -3.216 -5.723 -2.188 1.00 0.00 C ATOM 428 CD1 LEU A 29 -2.104 -6.276 -3.081 1.00 0.00 C ATOM 429 CD2 LEU A 29 -4.442 -5.294 -2.997 1.00 0.00 C ATOM 0 H LEU A 29 -2.905 -8.472 0.522 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.206 -5.846 0.203 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -3.193 -7.705 -1.378 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -4.686 -6.832 -1.096 1.00 0.00 H new ATOM 0 HG LEU A 29 -2.823 -4.830 -1.701 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.849 -5.540 -3.843 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.224 -6.490 -2.475 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.446 -7.193 -3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -4.141 -4.577 -3.761 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.887 -6.167 -3.474 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -5.172 -4.832 -2.333 1.00 0.00 H new ATOM 441 N ILE A 30 -5.227 -6.077 1.473 1.00 0.00 N ATOM 442 CA ILE A 30 -6.238 -5.337 2.210 1.00 0.00 C ATOM 443 C ILE A 30 -5.577 -4.608 3.382 1.00 0.00 C ATOM 444 O ILE A 30 -5.787 -3.411 3.572 1.00 0.00 O ATOM 445 CB ILE A 30 -7.381 -6.263 2.629 1.00 0.00 C ATOM 446 CG1 ILE A 30 -8.510 -5.474 3.296 1.00 0.00 C ATOM 447 CG2 ILE A 30 -6.870 -7.397 3.520 1.00 0.00 C ATOM 448 CD1 ILE A 30 -9.528 -4.991 2.260 1.00 0.00 C ATOM 0 H ILE A 30 -5.459 -7.054 1.294 1.00 0.00 H new ATOM 0 HA ILE A 30 -6.691 -4.576 1.575 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.795 -6.721 1.731 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -9.008 -6.100 4.036 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -8.095 -4.619 3.829 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.703 -8.040 3.804 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.129 -7.982 2.975 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.414 -6.978 4.417 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -10.320 -4.433 2.760 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.031 -4.346 1.535 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.959 -5.850 1.745 1.00 0.00 H new ATOM 460 N ALA A 31 -4.791 -5.361 4.138 1.00 0.00 N ATOM 461 CA ALA A 31 -4.097 -4.802 5.286 1.00 0.00 C ATOM 462 C ALA A 31 -3.268 -3.597 4.838 1.00 0.00 C ATOM 463 O ALA A 31 -3.150 -2.614 5.568 1.00 0.00 O ATOM 464 CB ALA A 31 -3.242 -5.886 5.944 1.00 0.00 C ATOM 0 H ALA A 31 -4.619 -6.354 3.978 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.810 -4.452 6.032 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.722 -5.466 6.805 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.882 -6.706 6.271 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -2.512 -6.260 5.226 1.00 0.00 H new ATOM 470 N GLY A 32 -2.713 -3.713 3.640 1.00 0.00 N ATOM 471 CA GLY A 32 -1.898 -2.646 3.086 1.00 0.00 C ATOM 472 C GLY A 32 -2.760 -1.443 2.698 1.00 0.00 C ATOM 473 O GLY A 32 -2.295 -0.304 2.732 1.00 0.00 O ATOM 0 H GLY A 32 -2.812 -4.530 3.038 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -1.148 -2.340 3.815 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.361 -3.011 2.210 1.00 0.00 H new ATOM 477 N LEU A 33 -4.000 -1.736 2.337 1.00 0.00 N ATOM 478 CA LEU A 33 -4.931 -0.692 1.942 1.00 0.00 C ATOM 479 C LEU A 33 -5.386 0.076 3.184 1.00 0.00 C ATOM 480 O LEU A 33 -5.518 1.299 3.149 1.00 0.00 O ATOM 481 CB LEU A 33 -6.084 -1.283 1.128 1.00 0.00 C ATOM 482 CG LEU A 33 -5.759 -1.662 -0.318 1.00 0.00 C ATOM 483 CD1 LEU A 33 -6.855 -2.550 -0.912 1.00 0.00 C ATOM 484 CD2 LEU A 33 -5.508 -0.415 -1.169 1.00 0.00 C ATOM 0 H LEU A 33 -4.382 -2.681 2.310 1.00 0.00 H new ATOM 0 HA LEU A 33 -4.442 0.026 1.284 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -6.447 -2.172 1.643 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.902 -0.563 1.119 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.837 -2.244 -0.319 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.599 -2.805 -1.940 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.943 -3.463 -0.323 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -7.805 -2.015 -0.896 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.279 -0.713 -2.192 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.398 0.214 -1.165 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -4.667 0.143 -0.757 1.00 0.00 H new ATOM 496 N PHE A 34 -5.613 -0.672 4.254 1.00 0.00 N ATOM 497 CA PHE A 34 -6.050 -0.077 5.505 1.00 0.00 C ATOM 498 C PHE A 34 -4.931 0.754 6.137 1.00 0.00 C ATOM 499 O PHE A 34 -5.074 1.962 6.314 1.00 0.00 O ATOM 500 CB PHE A 34 -6.409 -1.228 6.447 1.00 0.00 C ATOM 501 CG PHE A 34 -7.674 -0.985 7.272 1.00 0.00 C ATOM 502 CD1 PHE A 34 -8.882 -0.886 6.653 1.00 0.00 C ATOM 503 CD2 PHE A 34 -7.592 -0.867 8.624 1.00 0.00 C ATOM 504 CE1 PHE A 34 -10.056 -0.661 7.419 1.00 0.00 C ATOM 505 CE2 PHE A 34 -8.766 -0.641 9.391 1.00 0.00 C ATOM 506 CZ PHE A 34 -9.973 -0.543 8.772 1.00 0.00 C ATOM 0 H PHE A 34 -5.502 -1.686 4.280 1.00 0.00 H new ATOM 0 HA PHE A 34 -6.899 0.582 5.327 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -6.539 -2.137 5.860 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -5.574 -1.403 7.125 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -8.948 -0.979 5.579 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -6.633 -0.945 9.115 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -11.015 -0.584 6.928 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.700 -0.547 10.465 1.00 0.00 H new ATOM 0 HZ PHE A 34 -10.866 -0.371 9.355 1.00 0.00 H new ATOM 516 N VAL A 35 -3.842 0.072 6.461 1.00 0.00 N ATOM 517 CA VAL A 35 -2.700 0.731 7.070 1.00 0.00 C ATOM 518 C VAL A 35 -2.196 1.834 6.137 1.00 0.00 C ATOM 519 O VAL A 35 -2.011 2.974 6.560 1.00 0.00 O ATOM 520 CB VAL A 35 -1.622 -0.300 7.413 1.00 0.00 C ATOM 521 CG1 VAL A 35 -0.370 0.381 7.971 1.00 0.00 C ATOM 522 CG2 VAL A 35 -2.158 -1.348 8.390 1.00 0.00 C ATOM 0 H VAL A 35 -3.727 -0.931 6.313 1.00 0.00 H new ATOM 0 HA VAL A 35 -2.988 1.205 8.008 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.342 -0.812 6.492 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.380 -0.374 8.207 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.030 1.071 7.228 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -0.628 0.931 8.876 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -1.373 -2.069 8.617 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.478 -0.858 9.309 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.006 -1.865 7.940 1.00 0.00 H new ATOM 532 N GLY A 36 -1.988 1.457 4.884 1.00 0.00 N ATOM 533 CA GLY A 36 -1.510 2.400 3.888 1.00 0.00 C ATOM 534 C GLY A 36 -2.364 3.669 3.880 1.00 0.00 C ATOM 535 O GLY A 36 -1.836 4.777 3.974 1.00 0.00 O ATOM 0 H GLY A 36 -2.142 0.511 4.536 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -0.471 2.658 4.095 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -1.533 1.936 2.902 1.00 0.00 H new ATOM 539 N CYS A 37 -3.668 3.466 3.766 1.00 0.00 N ATOM 540 CA CYS A 37 -4.600 4.581 3.744 1.00 0.00 C ATOM 541 C CYS A 37 -4.410 5.391 5.029 1.00 0.00 C ATOM 542 O CYS A 37 -4.124 6.586 4.976 1.00 0.00 O ATOM 543 CB CYS A 37 -6.045 4.107 3.577 1.00 0.00 C ATOM 544 SG CYS A 37 -7.135 5.535 3.229 1.00 0.00 S ATOM 0 H CYS A 37 -4.102 2.546 3.688 1.00 0.00 H new ATOM 0 HA CYS A 37 -4.393 5.215 2.882 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -6.108 3.384 2.764 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -6.376 3.598 4.482 1.00 0.00 H new ATOM 0 HG CYS A 37 -8.359 5.122 3.087 1.00 0.00 H new ATOM 550 N LEU A 38 -4.577 4.707 6.151 1.00 0.00 N ATOM 551 CA LEU A 38 -4.427 5.348 7.447 1.00 0.00 C ATOM 552 C LEU A 38 -3.235 6.306 7.402 1.00 0.00 C ATOM 553 O LEU A 38 -3.339 7.453 7.835 1.00 0.00 O ATOM 554 CB LEU A 38 -4.332 4.298 8.556 1.00 0.00 C ATOM 555 CG LEU A 38 -5.069 4.628 9.856 1.00 0.00 C ATOM 556 CD1 LEU A 38 -5.340 3.360 10.668 1.00 0.00 C ATOM 557 CD2 LEU A 38 -4.307 5.676 10.668 1.00 0.00 C ATOM 0 H LEU A 38 -4.815 3.716 6.190 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.308 5.946 7.681 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.720 3.355 8.171 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.279 4.138 8.789 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.036 5.061 9.600 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.865 3.622 11.587 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -5.954 2.677 10.082 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.395 2.877 10.915 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.853 5.892 11.587 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.316 5.295 10.916 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.208 6.589 10.081 1.00 0.00 H new ATOM 569 N ALA A 39 -2.130 5.800 6.875 1.00 0.00 N ATOM 570 CA ALA A 39 -0.919 6.597 6.769 1.00 0.00 C ATOM 571 C ALA A 39 -1.212 7.855 5.949 1.00 0.00 C ATOM 572 O ALA A 39 -1.032 8.971 6.432 1.00 0.00 O ATOM 573 CB ALA A 39 0.198 5.749 6.158 1.00 0.00 C ATOM 0 H ALA A 39 -2.047 4.849 6.517 1.00 0.00 H new ATOM 0 HA ALA A 39 -0.582 6.918 7.755 1.00 0.00 H new ATOM 0 HB1 ALA A 39 1.106 6.346 6.078 1.00 0.00 H new ATOM 0 HB2 ALA A 39 0.387 4.884 6.794 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.102 5.412 5.166 1.00 0.00 H new ATOM 579 N GLY A 40 -1.658 7.631 4.721 1.00 0.00 N ATOM 580 CA GLY A 40 -1.977 8.733 3.829 1.00 0.00 C ATOM 581 C GLY A 40 -3.015 9.665 4.458 1.00 0.00 C ATOM 582 O GLY A 40 -2.675 10.748 4.932 1.00 0.00 O ATOM 0 H GLY A 40 -1.806 6.703 4.323 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.071 9.294 3.600 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.358 8.343 2.885 1.00 0.00 H new ATOM 586 N TYR A 41 -4.259 9.210 4.441 1.00 0.00 N ATOM 587 CA TYR A 41 -5.348 9.989 5.004 1.00 0.00 C ATOM 588 C TYR A 41 -4.899 10.728 6.266 1.00 0.00 C ATOM 589 O TYR A 41 -4.956 11.956 6.324 1.00 0.00 O ATOM 590 CB TYR A 41 -6.438 8.982 5.378 1.00 0.00 C ATOM 591 CG TYR A 41 -7.778 9.228 4.682 1.00 0.00 C ATOM 592 CD1 TYR A 41 -7.839 9.293 3.305 1.00 0.00 C ATOM 593 CD2 TYR A 41 -8.926 9.386 5.431 1.00 0.00 C ATOM 594 CE1 TYR A 41 -9.100 9.525 2.649 1.00 0.00 C ATOM 595 CE2 TYR A 41 -10.188 9.617 4.776 1.00 0.00 C ATOM 596 CZ TYR A 41 -10.212 9.675 3.417 1.00 0.00 C ATOM 597 OH TYR A 41 -11.403 9.894 2.799 1.00 0.00 O ATOM 0 H TYR A 41 -4.537 8.312 4.046 1.00 0.00 H new ATOM 0 HA TYR A 41 -5.695 10.735 4.289 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -6.091 7.978 5.132 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -6.590 9.011 6.457 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -6.940 9.170 2.719 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -8.878 9.336 6.509 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -9.161 9.579 1.572 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -11.094 9.741 5.350 1.00 0.00 H new ATOM 0 HH TYR A 41 -12.110 9.981 3.472 1.00 0.00 H new ATOM 607 N GLY A 42 -4.462 9.950 7.245 1.00 0.00 N ATOM 608 CA GLY A 42 -4.003 10.516 8.502 1.00 0.00 C ATOM 609 C GLY A 42 -3.020 11.664 8.261 1.00 0.00 C ATOM 610 O GLY A 42 -3.252 12.787 8.704 1.00 0.00 O ATOM 0 H GLY A 42 -4.416 8.932 7.193 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.857 10.878 9.075 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.523 9.741 9.100 1.00 0.00 H new ATOM 614 N ALA A 43 -1.944 11.341 7.559 1.00 0.00 N ATOM 615 CA ALA A 43 -0.925 12.331 7.253 1.00 0.00 C ATOM 616 C ALA A 43 -1.583 13.547 6.597 1.00 0.00 C ATOM 617 O ALA A 43 -1.103 14.670 6.741 1.00 0.00 O ATOM 618 CB ALA A 43 0.150 11.701 6.366 1.00 0.00 C ATOM 0 H ALA A 43 -1.755 10.408 7.193 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.435 12.672 8.165 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.914 12.444 6.137 1.00 0.00 H new ATOM 0 HB2 ALA A 43 0.606 10.861 6.889 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -0.303 11.349 5.439 1.00 0.00 H new ATOM 624 N TYR A 44 -2.672 13.282 5.890 1.00 0.00 N ATOM 625 CA TYR A 44 -3.400 14.340 5.211 1.00 0.00 C ATOM 626 C TYR A 44 -4.149 15.220 6.214 1.00 0.00 C ATOM 627 O TYR A 44 -4.258 16.430 6.023 1.00 0.00 O ATOM 628 CB TYR A 44 -4.415 13.640 4.306 1.00 0.00 C ATOM 629 CG TYR A 44 -4.612 14.319 2.949 1.00 0.00 C ATOM 630 CD1 TYR A 44 -3.579 14.342 2.033 1.00 0.00 C ATOM 631 CD2 TYR A 44 -5.821 14.908 2.641 1.00 0.00 C ATOM 632 CE1 TYR A 44 -3.764 14.981 0.756 1.00 0.00 C ATOM 633 CE2 TYR A 44 -6.006 15.547 1.364 1.00 0.00 C ATOM 634 CZ TYR A 44 -4.968 15.552 0.485 1.00 0.00 C ATOM 635 OH TYR A 44 -5.143 16.156 -0.722 1.00 0.00 O ATOM 0 H TYR A 44 -3.068 12.349 5.773 1.00 0.00 H new ATOM 0 HA TYR A 44 -2.716 14.981 4.654 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -4.092 12.612 4.143 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -5.375 13.595 4.821 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -2.633 13.881 2.274 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -6.629 14.890 3.358 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -2.965 15.006 0.030 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -6.947 16.012 1.110 1.00 0.00 H new ATOM 0 HH TYR A 44 -6.052 16.519 -0.777 1.00 0.00 H new ATOM 645 N ARG A 45 -4.648 14.577 7.260 1.00 0.00 N ATOM 646 CA ARG A 45 -5.384 15.286 8.292 1.00 0.00 C ATOM 647 C ARG A 45 -4.666 16.586 8.659 1.00 0.00 C ATOM 648 O ARG A 45 -5.087 17.668 8.252 1.00 0.00 O ATOM 649 CB ARG A 45 -5.538 14.425 9.548 1.00 0.00 C ATOM 650 CG ARG A 45 -6.417 13.204 9.271 1.00 0.00 C ATOM 651 CD ARG A 45 -6.733 12.451 10.565 1.00 0.00 C ATOM 652 NE ARG A 45 -8.100 12.784 11.023 1.00 0.00 N ATOM 653 CZ ARG A 45 -9.213 12.511 10.328 1.00 0.00 C ATOM 654 NH1 ARG A 45 -9.127 11.899 9.139 1.00 0.00 N ATOM 655 NH2 ARG A 45 -10.412 12.850 10.821 1.00 0.00 N ATOM 0 H ARG A 45 -4.557 13.573 7.414 1.00 0.00 H new ATOM 0 HA ARG A 45 -6.374 15.513 7.896 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -4.556 14.100 9.893 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -5.977 15.019 10.349 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -7.345 13.520 8.794 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -5.911 12.538 8.573 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -6.647 11.377 10.401 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -6.008 12.715 11.335 1.00 0.00 H new ATOM 0 HE ARG A 45 -8.202 13.251 11.924 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -8.215 11.641 8.763 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -9.974 11.691 8.610 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -10.478 13.316 11.726 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -11.259 12.642 10.291 1.00 0.00 H new ATOM 669 N VAL A 46 -3.594 16.438 9.423 1.00 0.00 N ATOM 670 CA VAL A 46 -2.813 17.587 9.848 1.00 0.00 C ATOM 671 C VAL A 46 -1.720 17.126 10.815 1.00 0.00 C ATOM 672 O VAL A 46 -0.579 17.577 10.727 1.00 0.00 O ATOM 673 CB VAL A 46 -3.733 18.651 10.450 1.00 0.00 C ATOM 674 CG1 VAL A 46 -4.802 18.013 11.340 1.00 0.00 C ATOM 675 CG2 VAL A 46 -2.929 19.698 11.223 1.00 0.00 C ATOM 0 H VAL A 46 -3.248 15.539 9.759 1.00 0.00 H new ATOM 0 HA VAL A 46 -2.318 18.049 8.994 1.00 0.00 H new ATOM 0 HB VAL A 46 -4.240 19.158 9.629 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -5.442 18.792 11.755 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -5.405 17.325 10.748 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -4.321 17.468 12.152 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -3.607 20.442 11.640 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -2.381 19.213 12.031 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -2.225 20.186 10.549 1.00 0.00 H new ATOM 685 N SER A 47 -2.108 16.234 11.714 1.00 0.00 N ATOM 686 CA SER A 47 -1.176 15.708 12.696 1.00 0.00 C ATOM 687 C SER A 47 -0.117 14.847 12.004 1.00 0.00 C ATOM 688 O SER A 47 -0.156 13.621 12.089 1.00 0.00 O ATOM 689 CB SER A 47 -1.905 14.893 13.767 1.00 0.00 C ATOM 690 OG SER A 47 -2.264 15.691 14.892 1.00 0.00 O ATOM 0 H SER A 47 -3.055 15.862 11.783 1.00 0.00 H new ATOM 0 HA SER A 47 -0.687 16.549 13.188 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.802 14.449 13.336 1.00 0.00 H new ATOM 0 HB3 SER A 47 -1.268 14.071 14.094 1.00 0.00 H new ATOM 0 HG SER A 47 -2.728 15.135 15.552 1.00 0.00 H new ATOM 696 N ASN A 48 0.804 15.524 11.333 1.00 0.00 N ATOM 697 CA ASN A 48 1.871 14.836 10.627 1.00 0.00 C ATOM 698 C ASN A 48 2.551 15.812 9.665 1.00 0.00 C ATOM 699 O ASN A 48 1.924 16.304 8.728 1.00 0.00 O ATOM 700 CB ASN A 48 1.324 13.667 9.805 1.00 0.00 C ATOM 701 CG ASN A 48 1.963 12.346 10.239 1.00 0.00 C ATOM 702 OD1 ASN A 48 3.170 12.224 10.369 1.00 0.00 O ATOM 703 ND2 ASN A 48 1.089 11.367 10.453 1.00 0.00 N ATOM 0 H ASN A 48 0.833 16.541 11.264 1.00 0.00 H new ATOM 0 HA ASN A 48 2.576 14.458 11.367 1.00 0.00 H new ATOM 0 HB2 ASN A 48 0.242 13.608 9.924 1.00 0.00 H new ATOM 0 HB3 ASN A 48 1.519 13.839 8.747 1.00 0.00 H new ATOM 0 HD21 ASN A 48 1.416 10.446 10.745 1.00 0.00 H new ATOM 0 HD22 ASN A 48 0.091 11.537 10.326 1.00 0.00 H new ATOM 710 N ASP A 49 3.825 16.063 9.929 1.00 0.00 N ATOM 711 CA ASP A 49 4.597 16.971 9.099 1.00 0.00 C ATOM 712 C ASP A 49 4.663 16.420 7.673 1.00 0.00 C ATOM 713 O ASP A 49 4.609 17.179 6.707 1.00 0.00 O ATOM 714 CB ASP A 49 6.029 17.111 9.619 1.00 0.00 C ATOM 715 CG ASP A 49 6.146 17.471 11.101 1.00 0.00 C ATOM 716 OD1 ASP A 49 5.160 17.422 11.850 1.00 0.00 O ATOM 717 OD2 ASP A 49 7.328 17.819 11.485 1.00 0.00 O ATOM 0 H ASP A 49 4.342 15.653 10.707 1.00 0.00 H new ATOM 0 HA ASP A 49 4.109 17.945 9.121 1.00 0.00 H new ATOM 0 HB2 ASP A 49 6.556 16.173 9.446 1.00 0.00 H new ATOM 0 HB3 ASP A 49 6.539 17.876 9.033 1.00 0.00 H new ATOM 722 N LYS A 50 4.780 15.103 7.587 1.00 0.00 N ATOM 723 CA LYS A 50 4.855 14.441 6.295 1.00 0.00 C ATOM 724 C LYS A 50 3.440 14.117 5.811 1.00 0.00 C ATOM 725 O LYS A 50 2.511 14.031 6.612 1.00 0.00 O ATOM 726 CB LYS A 50 5.774 13.221 6.371 1.00 0.00 C ATOM 727 CG LYS A 50 7.236 13.644 6.530 1.00 0.00 C ATOM 728 CD LYS A 50 7.816 13.126 7.848 1.00 0.00 C ATOM 729 CE LYS A 50 9.306 13.457 7.958 1.00 0.00 C ATOM 730 NZ LYS A 50 9.503 14.915 8.118 1.00 0.00 N ATOM 0 H LYS A 50 4.825 14.476 8.391 1.00 0.00 H new ATOM 0 HA LYS A 50 5.303 15.102 5.553 1.00 0.00 H new ATOM 0 HB2 LYS A 50 5.480 12.592 7.211 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.662 12.620 5.469 1.00 0.00 H new ATOM 0 HG2 LYS A 50 7.822 13.261 5.695 1.00 0.00 H new ATOM 0 HG3 LYS A 50 7.309 14.731 6.498 1.00 0.00 H new ATOM 0 HD2 LYS A 50 7.278 13.570 8.686 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.673 12.047 7.913 1.00 0.00 H new ATOM 0 HE2 LYS A 50 9.740 12.930 8.808 1.00 0.00 H new ATOM 0 HE3 LYS A 50 9.829 13.109 7.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 10.503 15.109 8.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 9.232 15.400 7.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 8.913 15.261 8.901 1.00 0.00 H new ATOM 744 N ARG A 51 3.322 13.946 4.502 1.00 0.00 N ATOM 745 CA ARG A 51 2.036 13.632 3.902 1.00 0.00 C ATOM 746 C ARG A 51 2.128 13.718 2.377 1.00 0.00 C ATOM 747 O ARG A 51 1.442 12.982 1.668 1.00 0.00 O ATOM 748 CB ARG A 51 0.950 14.590 4.396 1.00 0.00 C ATOM 749 CG ARG A 51 1.418 16.044 4.305 1.00 0.00 C ATOM 750 CD ARG A 51 0.973 16.841 5.533 1.00 0.00 C ATOM 751 NE ARG A 51 0.209 18.036 5.111 1.00 0.00 N ATOM 752 CZ ARG A 51 -0.476 18.825 5.950 1.00 0.00 C ATOM 753 NH1 ARG A 51 -0.497 18.550 7.261 1.00 0.00 N ATOM 754 NH2 ARG A 51 -1.139 19.889 5.477 1.00 0.00 N ATOM 0 H ARG A 51 4.095 14.019 3.841 1.00 0.00 H new ATOM 0 HA ARG A 51 1.770 12.617 4.197 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.046 14.458 3.802 1.00 0.00 H new ATOM 0 HB3 ARG A 51 0.692 14.351 5.428 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.504 16.076 4.221 1.00 0.00 H new ATOM 0 HG3 ARG A 51 1.015 16.504 3.403 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.358 16.215 6.179 1.00 0.00 H new ATOM 0 HD3 ARG A 51 1.843 17.143 6.116 1.00 0.00 H new ATOM 0 HE ARG A 51 0.203 18.274 4.119 1.00 0.00 H new ATOM 0 HH11 ARG A 51 0.008 17.740 7.620 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -1.018 19.150 7.900 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.122 20.098 4.479 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -1.661 20.490 6.115 1.00 0.00 H new ATOM 768 N ASP A 52 2.980 14.622 1.917 1.00 0.00 N ATOM 769 CA ASP A 52 3.169 14.814 0.489 1.00 0.00 C ATOM 770 C ASP A 52 3.225 13.449 -0.201 1.00 0.00 C ATOM 771 O ASP A 52 2.487 13.201 -1.153 1.00 0.00 O ATOM 772 CB ASP A 52 4.483 15.543 0.201 1.00 0.00 C ATOM 773 CG ASP A 52 4.488 17.031 0.557 1.00 0.00 C ATOM 774 OD1 ASP A 52 4.066 17.310 1.744 1.00 0.00 O ATOM 775 OD2 ASP A 52 4.875 17.882 -0.259 1.00 0.00 O ATOM 0 H ASP A 52 3.547 15.230 2.508 1.00 0.00 H new ATOM 0 HA ASP A 52 2.336 15.410 0.115 1.00 0.00 H new ATOM 0 HB2 ASP A 52 5.283 15.050 0.753 1.00 0.00 H new ATOM 0 HB3 ASP A 52 4.715 15.438 -0.859 1.00 0.00 H new ATOM 780 N VAL A 53 4.107 12.601 0.307 1.00 0.00 N ATOM 781 CA VAL A 53 4.268 11.268 -0.249 1.00 0.00 C ATOM 782 C VAL A 53 5.266 10.482 0.604 1.00 0.00 C ATOM 783 O VAL A 53 5.085 9.287 0.835 1.00 0.00 O ATOM 784 CB VAL A 53 4.681 11.360 -1.719 1.00 0.00 C ATOM 785 CG1 VAL A 53 6.071 11.985 -1.860 1.00 0.00 C ATOM 786 CG2 VAL A 53 4.627 9.987 -2.391 1.00 0.00 C ATOM 0 H VAL A 53 4.717 12.811 1.097 1.00 0.00 H new ATOM 0 HA VAL A 53 3.322 10.727 -0.225 1.00 0.00 H new ATOM 0 HB VAL A 53 3.968 12.010 -2.227 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.340 12.039 -2.915 1.00 0.00 H new ATOM 0 HG12 VAL A 53 6.063 12.989 -1.436 1.00 0.00 H new ATOM 0 HG13 VAL A 53 6.801 11.373 -1.330 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.925 10.081 -3.435 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.306 9.305 -1.880 1.00 0.00 H new ATOM 0 HG23 VAL A 53 3.611 9.596 -2.338 1.00 0.00 H new ATOM 796 N LYS A 54 6.297 11.184 1.050 1.00 0.00 N ATOM 797 CA LYS A 54 7.324 10.567 1.872 1.00 0.00 C ATOM 798 C LYS A 54 6.676 9.542 2.804 1.00 0.00 C ATOM 799 O LYS A 54 7.218 8.457 3.012 1.00 0.00 O ATOM 800 CB LYS A 54 8.138 11.636 2.604 1.00 0.00 C ATOM 801 CG LYS A 54 9.454 11.917 1.876 1.00 0.00 C ATOM 802 CD LYS A 54 10.653 11.500 2.729 1.00 0.00 C ATOM 803 CE LYS A 54 11.708 10.787 1.882 1.00 0.00 C ATOM 804 NZ LYS A 54 13.005 11.496 1.962 1.00 0.00 N ATOM 0 H LYS A 54 6.443 12.175 0.858 1.00 0.00 H new ATOM 0 HA LYS A 54 8.037 10.027 1.250 1.00 0.00 H new ATOM 0 HB2 LYS A 54 7.556 12.554 2.678 1.00 0.00 H new ATOM 0 HB3 LYS A 54 8.345 11.307 3.622 1.00 0.00 H new ATOM 0 HG2 LYS A 54 9.472 11.378 0.929 1.00 0.00 H new ATOM 0 HG3 LYS A 54 9.523 12.979 1.640 1.00 0.00 H new ATOM 0 HD2 LYS A 54 11.093 12.380 3.199 1.00 0.00 H new ATOM 0 HD3 LYS A 54 10.321 10.842 3.532 1.00 0.00 H new ATOM 0 HE2 LYS A 54 11.827 9.760 2.228 1.00 0.00 H new ATOM 0 HE3 LYS A 54 11.377 10.738 0.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.709 10.998 1.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 12.891 12.468 1.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.327 11.521 2.951 1.00 0.00 H new ATOM 818 N VAL A 55 5.526 9.921 3.341 1.00 0.00 N ATOM 819 CA VAL A 55 4.799 9.048 4.247 1.00 0.00 C ATOM 820 C VAL A 55 4.840 7.616 3.710 1.00 0.00 C ATOM 821 O VAL A 55 5.315 6.707 4.390 1.00 0.00 O ATOM 822 CB VAL A 55 3.375 9.571 4.447 1.00 0.00 C ATOM 823 CG1 VAL A 55 3.367 10.814 5.339 1.00 0.00 C ATOM 824 CG2 VAL A 55 2.701 9.856 3.103 1.00 0.00 C ATOM 0 H VAL A 55 5.079 10.821 3.166 1.00 0.00 H new ATOM 0 HA VAL A 55 5.269 9.040 5.230 1.00 0.00 H new ATOM 0 HB VAL A 55 2.801 8.794 4.951 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.343 11.165 5.465 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.788 10.565 6.313 1.00 0.00 H new ATOM 0 HG13 VAL A 55 3.965 11.598 4.875 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.690 10.226 3.274 1.00 0.00 H new ATOM 0 HG22 VAL A 55 3.275 10.606 2.560 1.00 0.00 H new ATOM 0 HG23 VAL A 55 2.657 8.938 2.516 1.00 0.00 H new ATOM 834 N SER A 56 4.336 7.458 2.495 1.00 0.00 N ATOM 835 CA SER A 56 4.309 6.152 1.859 1.00 0.00 C ATOM 836 C SER A 56 5.681 5.485 1.976 1.00 0.00 C ATOM 837 O SER A 56 5.775 4.304 2.306 1.00 0.00 O ATOM 838 CB SER A 56 3.896 6.263 0.390 1.00 0.00 C ATOM 839 OG SER A 56 3.437 5.018 -0.131 1.00 0.00 O ATOM 0 H SER A 56 3.943 8.214 1.934 1.00 0.00 H new ATOM 0 HA SER A 56 3.568 5.537 2.371 1.00 0.00 H new ATOM 0 HB2 SER A 56 3.109 7.010 0.290 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.744 6.612 -0.200 1.00 0.00 H new ATOM 0 HG SER A 56 3.181 5.131 -1.070 1.00 0.00 H new ATOM 845 N LEU A 57 6.711 6.271 1.698 1.00 0.00 N ATOM 846 CA LEU A 57 8.073 5.771 1.767 1.00 0.00 C ATOM 847 C LEU A 57 8.320 5.166 3.150 1.00 0.00 C ATOM 848 O LEU A 57 8.938 4.108 3.268 1.00 0.00 O ATOM 849 CB LEU A 57 9.068 6.872 1.392 1.00 0.00 C ATOM 850 CG LEU A 57 10.490 6.410 1.070 1.00 0.00 C ATOM 851 CD1 LEU A 57 11.003 7.067 -0.213 1.00 0.00 C ATOM 852 CD2 LEU A 57 11.428 6.655 2.253 1.00 0.00 C ATOM 0 H LEU A 57 6.629 7.250 1.425 1.00 0.00 H new ATOM 0 HA LEU A 57 8.223 4.975 1.038 1.00 0.00 H new ATOM 0 HB2 LEU A 57 8.677 7.408 0.527 1.00 0.00 H new ATOM 0 HB3 LEU A 57 9.117 7.586 2.214 1.00 0.00 H new ATOM 0 HG LEU A 57 10.467 5.334 0.895 1.00 0.00 H new ATOM 0 HD11 LEU A 57 12.016 6.721 -0.419 1.00 0.00 H new ATOM 0 HD12 LEU A 57 10.352 6.798 -1.045 1.00 0.00 H new ATOM 0 HD13 LEU A 57 11.007 8.150 -0.091 1.00 0.00 H new ATOM 0 HD21 LEU A 57 12.432 6.317 1.997 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.451 7.720 2.485 1.00 0.00 H new ATOM 0 HD23 LEU A 57 11.070 6.103 3.122 1.00 0.00 H new ATOM 864 N PHE A 58 7.824 5.862 4.163 1.00 0.00 N ATOM 865 CA PHE A 58 7.983 5.406 5.533 1.00 0.00 C ATOM 866 C PHE A 58 7.077 4.207 5.821 1.00 0.00 C ATOM 867 O PHE A 58 7.348 3.423 6.730 1.00 0.00 O ATOM 868 CB PHE A 58 7.576 6.568 6.441 1.00 0.00 C ATOM 869 CG PHE A 58 7.652 6.246 7.935 1.00 0.00 C ATOM 870 CD1 PHE A 58 8.859 6.038 8.526 1.00 0.00 C ATOM 871 CD2 PHE A 58 6.512 6.169 8.673 1.00 0.00 C ATOM 872 CE1 PHE A 58 8.930 5.740 9.912 1.00 0.00 C ATOM 873 CE2 PHE A 58 6.582 5.871 10.060 1.00 0.00 C ATOM 874 CZ PHE A 58 7.790 5.662 10.650 1.00 0.00 C ATOM 0 H PHE A 58 7.312 6.738 4.062 1.00 0.00 H new ATOM 0 HA PHE A 58 9.014 5.097 5.705 1.00 0.00 H new ATOM 0 HB2 PHE A 58 8.219 7.423 6.231 1.00 0.00 H new ATOM 0 HB3 PHE A 58 6.557 6.868 6.196 1.00 0.00 H new ATOM 0 HD1 PHE A 58 9.764 6.100 7.940 1.00 0.00 H new ATOM 0 HD2 PHE A 58 5.553 6.335 8.204 1.00 0.00 H new ATOM 0 HE1 PHE A 58 9.889 5.575 10.381 1.00 0.00 H new ATOM 0 HE2 PHE A 58 5.677 5.810 10.646 1.00 0.00 H new ATOM 0 HZ PHE A 58 7.844 5.434 11.704 1.00 0.00 H new ATOM 884 N THR A 59 6.019 4.102 5.030 1.00 0.00 N ATOM 885 CA THR A 59 5.071 3.012 5.188 1.00 0.00 C ATOM 886 C THR A 59 5.666 1.707 4.656 1.00 0.00 C ATOM 887 O THR A 59 5.588 0.671 5.315 1.00 0.00 O ATOM 888 CB THR A 59 3.769 3.414 4.493 1.00 0.00 C ATOM 889 OG1 THR A 59 3.306 4.533 5.244 1.00 0.00 O ATOM 890 CG2 THR A 59 2.666 2.368 4.666 1.00 0.00 C ATOM 0 H THR A 59 5.797 4.754 4.278 1.00 0.00 H new ATOM 0 HA THR A 59 4.851 2.828 6.240 1.00 0.00 H new ATOM 0 HB THR A 59 3.958 3.570 3.431 1.00 0.00 H new ATOM 0 HG1 THR A 59 3.835 5.325 5.011 1.00 0.00 H new ATOM 0 HG21 THR A 59 1.764 2.702 4.154 1.00 0.00 H new ATOM 0 HG22 THR A 59 2.994 1.419 4.241 1.00 0.00 H new ATOM 0 HG23 THR A 59 2.453 2.236 5.727 1.00 0.00 H new ATOM 898 N ALA A 60 6.247 1.799 3.468 1.00 0.00 N ATOM 899 CA ALA A 60 6.855 0.638 2.840 1.00 0.00 C ATOM 900 C ALA A 60 8.126 0.259 3.602 1.00 0.00 C ATOM 901 O ALA A 60 8.426 -0.923 3.767 1.00 0.00 O ATOM 902 CB ALA A 60 7.127 0.940 1.365 1.00 0.00 C ATOM 0 H ALA A 60 6.309 2.660 2.924 1.00 0.00 H new ATOM 0 HA ALA A 60 6.180 -0.217 2.879 1.00 0.00 H new ATOM 0 HB1 ALA A 60 7.583 0.070 0.893 1.00 0.00 H new ATOM 0 HB2 ALA A 60 6.189 1.175 0.863 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.803 1.791 1.287 1.00 0.00 H new ATOM 908 N PHE A 61 8.840 1.283 4.045 1.00 0.00 N ATOM 909 CA PHE A 61 10.073 1.072 4.785 1.00 0.00 C ATOM 910 C PHE A 61 9.802 0.348 6.106 1.00 0.00 C ATOM 911 O PHE A 61 10.477 -0.628 6.432 1.00 0.00 O ATOM 912 CB PHE A 61 10.656 2.454 5.086 1.00 0.00 C ATOM 913 CG PHE A 61 11.756 2.447 6.149 1.00 0.00 C ATOM 914 CD1 PHE A 61 12.935 1.813 5.904 1.00 0.00 C ATOM 915 CD2 PHE A 61 11.556 3.075 7.339 1.00 0.00 C ATOM 916 CE1 PHE A 61 13.956 1.806 6.891 1.00 0.00 C ATOM 917 CE2 PHE A 61 12.577 3.068 8.326 1.00 0.00 C ATOM 918 CZ PHE A 61 13.755 2.434 8.081 1.00 0.00 C ATOM 0 H PHE A 61 8.588 2.262 3.906 1.00 0.00 H new ATOM 0 HA PHE A 61 10.759 0.460 4.199 1.00 0.00 H new ATOM 0 HB2 PHE A 61 11.058 2.876 4.165 1.00 0.00 H new ATOM 0 HB3 PHE A 61 9.852 3.113 5.414 1.00 0.00 H new ATOM 0 HD1 PHE A 61 13.094 1.315 4.959 1.00 0.00 H new ATOM 0 HD2 PHE A 61 10.621 3.579 7.533 1.00 0.00 H new ATOM 0 HE1 PHE A 61 14.892 1.302 6.697 1.00 0.00 H new ATOM 0 HE2 PHE A 61 12.418 3.566 9.271 1.00 0.00 H new ATOM 0 HZ PHE A 61 14.531 2.429 8.832 1.00 0.00 H new ATOM 928 N PHE A 62 8.814 0.853 6.829 1.00 0.00 N ATOM 929 CA PHE A 62 8.446 0.266 8.106 1.00 0.00 C ATOM 930 C PHE A 62 7.942 -1.167 7.927 1.00 0.00 C ATOM 931 O PHE A 62 8.347 -2.068 8.660 1.00 0.00 O ATOM 932 CB PHE A 62 7.316 1.122 8.683 1.00 0.00 C ATOM 933 CG PHE A 62 7.054 0.885 10.172 1.00 0.00 C ATOM 934 CD1 PHE A 62 8.042 1.104 11.080 1.00 0.00 C ATOM 935 CD2 PHE A 62 5.832 0.456 10.587 1.00 0.00 C ATOM 936 CE1 PHE A 62 7.799 0.884 12.461 1.00 0.00 C ATOM 937 CE2 PHE A 62 5.588 0.237 11.968 1.00 0.00 C ATOM 938 CZ PHE A 62 6.577 0.455 12.877 1.00 0.00 C ATOM 0 H PHE A 62 8.257 1.662 6.555 1.00 0.00 H new ATOM 0 HA PHE A 62 9.314 0.238 8.765 1.00 0.00 H new ATOM 0 HB2 PHE A 62 7.556 2.174 8.530 1.00 0.00 H new ATOM 0 HB3 PHE A 62 6.401 0.920 8.127 1.00 0.00 H new ATOM 0 HD1 PHE A 62 9.012 1.445 10.750 1.00 0.00 H new ATOM 0 HD2 PHE A 62 5.047 0.282 9.866 1.00 0.00 H new ATOM 0 HE1 PHE A 62 8.584 1.057 13.182 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.617 -0.103 12.297 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.392 0.288 13.928 1.00 0.00 H new ATOM 948 N LEU A 63 7.067 -1.334 6.946 1.00 0.00 N ATOM 949 CA LEU A 63 6.504 -2.643 6.661 1.00 0.00 C ATOM 950 C LEU A 63 7.638 -3.633 6.390 1.00 0.00 C ATOM 951 O LEU A 63 7.750 -4.654 7.066 1.00 0.00 O ATOM 952 CB LEU A 63 5.483 -2.551 5.525 1.00 0.00 C ATOM 953 CG LEU A 63 4.174 -3.315 5.735 1.00 0.00 C ATOM 954 CD1 LEU A 63 2.974 -2.484 5.277 1.00 0.00 C ATOM 955 CD2 LEU A 63 4.221 -4.681 5.048 1.00 0.00 C ATOM 0 H LEU A 63 6.734 -0.585 6.339 1.00 0.00 H new ATOM 0 HA LEU A 63 5.953 -3.017 7.524 1.00 0.00 H new ATOM 0 HB2 LEU A 63 5.245 -1.500 5.362 1.00 0.00 H new ATOM 0 HB3 LEU A 63 5.952 -2.917 4.612 1.00 0.00 H new ATOM 0 HG LEU A 63 4.051 -3.495 6.803 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.057 -3.050 5.437 1.00 0.00 H new ATOM 0 HD12 LEU A 63 2.933 -1.558 5.850 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.076 -2.251 4.217 1.00 0.00 H new ATOM 0 HD21 LEU A 63 3.279 -5.204 5.213 1.00 0.00 H new ATOM 0 HD22 LEU A 63 4.378 -4.545 3.978 1.00 0.00 H new ATOM 0 HD23 LEU A 63 5.039 -5.269 5.463 1.00 0.00 H new ATOM 967 N ALA A 64 8.450 -3.297 5.398 1.00 0.00 N ATOM 968 CA ALA A 64 9.571 -4.144 5.029 1.00 0.00 C ATOM 969 C ALA A 64 10.392 -4.470 6.279 1.00 0.00 C ATOM 970 O ALA A 64 10.680 -5.634 6.551 1.00 0.00 O ATOM 971 CB ALA A 64 10.404 -3.448 3.951 1.00 0.00 C ATOM 0 H ALA A 64 8.354 -2.450 4.839 1.00 0.00 H new ATOM 0 HA ALA A 64 9.218 -5.087 4.611 1.00 0.00 H new ATOM 0 HB1 ALA A 64 11.245 -4.084 3.674 1.00 0.00 H new ATOM 0 HB2 ALA A 64 9.784 -3.265 3.074 1.00 0.00 H new ATOM 0 HB3 ALA A 64 10.778 -2.499 4.336 1.00 0.00 H new ATOM 977 N THR A 65 10.745 -3.420 7.006 1.00 0.00 N ATOM 978 CA THR A 65 11.527 -3.579 8.221 1.00 0.00 C ATOM 979 C THR A 65 10.826 -4.540 9.183 1.00 0.00 C ATOM 980 O THR A 65 11.482 -5.245 9.949 1.00 0.00 O ATOM 981 CB THR A 65 11.764 -2.190 8.816 1.00 0.00 C ATOM 982 OG1 THR A 65 12.856 -1.671 8.060 1.00 0.00 O ATOM 983 CG2 THR A 65 12.298 -2.250 10.248 1.00 0.00 C ATOM 0 H THR A 65 10.504 -2.456 6.777 1.00 0.00 H new ATOM 0 HA THR A 65 12.498 -4.028 8.011 1.00 0.00 H new ATOM 0 HB THR A 65 10.833 -1.624 8.799 1.00 0.00 H new ATOM 0 HG1 THR A 65 12.512 -1.142 7.310 1.00 0.00 H new ATOM 0 HG21 THR A 65 12.449 -1.238 10.623 1.00 0.00 H new ATOM 0 HG22 THR A 65 11.580 -2.769 10.883 1.00 0.00 H new ATOM 0 HG23 THR A 65 13.247 -2.786 10.260 1.00 0.00 H new ATOM 991 N ILE A 66 9.503 -4.538 9.113 1.00 0.00 N ATOM 992 CA ILE A 66 8.707 -5.401 9.968 1.00 0.00 C ATOM 993 C ILE A 66 8.764 -6.834 9.435 1.00 0.00 C ATOM 994 O ILE A 66 8.668 -7.791 10.203 1.00 0.00 O ATOM 995 CB ILE A 66 7.285 -4.854 10.108 1.00 0.00 C ATOM 996 CG1 ILE A 66 7.261 -3.611 11.000 1.00 0.00 C ATOM 997 CG2 ILE A 66 6.327 -5.937 10.607 1.00 0.00 C ATOM 998 CD1 ILE A 66 7.476 -3.986 12.468 1.00 0.00 C ATOM 0 H ILE A 66 8.962 -3.952 8.477 1.00 0.00 H new ATOM 0 HA ILE A 66 9.118 -5.419 10.977 1.00 0.00 H new ATOM 0 HB ILE A 66 6.938 -4.548 9.121 1.00 0.00 H new ATOM 0 HG12 ILE A 66 8.037 -2.915 10.681 1.00 0.00 H new ATOM 0 HG13 ILE A 66 6.306 -3.097 10.888 1.00 0.00 H new ATOM 0 HG21 ILE A 66 5.323 -5.521 10.698 1.00 0.00 H new ATOM 0 HG22 ILE A 66 6.314 -6.766 9.899 1.00 0.00 H new ATOM 0 HG23 ILE A 66 6.660 -6.297 11.581 1.00 0.00 H new ATOM 0 HD11 ILE A 66 7.455 -3.085 13.081 1.00 0.00 H new ATOM 0 HD12 ILE A 66 6.685 -4.663 12.790 1.00 0.00 H new ATOM 0 HD13 ILE A 66 8.442 -4.478 12.580 1.00 0.00 H new ATOM 1010 N MET A 67 8.921 -6.938 8.124 1.00 0.00 N ATOM 1011 CA MET A 67 8.992 -8.238 7.479 1.00 0.00 C ATOM 1012 C MET A 67 10.410 -8.810 7.553 1.00 0.00 C ATOM 1013 O MET A 67 10.608 -9.928 8.026 1.00 0.00 O ATOM 1014 CB MET A 67 8.571 -8.105 6.014 1.00 0.00 C ATOM 1015 CG MET A 67 7.060 -7.896 5.895 1.00 0.00 C ATOM 1016 SD MET A 67 6.364 -9.099 4.775 1.00 0.00 S ATOM 1017 CE MET A 67 5.537 -8.011 3.626 1.00 0.00 C ATOM 0 H MET A 67 9.001 -6.143 7.490 1.00 0.00 H new ATOM 0 HA MET A 67 8.318 -8.918 8.000 1.00 0.00 H new ATOM 0 HB2 MET A 67 9.095 -7.266 5.556 1.00 0.00 H new ATOM 0 HB3 MET A 67 8.862 -9.001 5.465 1.00 0.00 H new ATOM 0 HG2 MET A 67 6.594 -7.987 6.876 1.00 0.00 H new ATOM 0 HG3 MET A 67 6.851 -6.888 5.535 1.00 0.00 H new ATOM 0 HE1 MET A 67 5.046 -8.603 2.854 1.00 0.00 H new ATOM 0 HE2 MET A 67 4.793 -7.418 4.158 1.00 0.00 H new ATOM 0 HE3 MET A 67 6.267 -7.347 3.164 1.00 0.00 H new ATOM 1027 N GLY A 68 11.359 -8.016 7.078 1.00 0.00 N ATOM 1028 CA GLY A 68 12.752 -8.429 7.085 1.00 0.00 C ATOM 1029 C GLY A 68 13.237 -8.742 5.668 1.00 0.00 C ATOM 1030 O GLY A 68 14.160 -8.101 5.168 1.00 0.00 O ATOM 0 H GLY A 68 11.190 -7.089 6.686 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.367 -7.640 7.518 1.00 0.00 H new ATOM 0 HA3 GLY A 68 12.871 -9.309 7.717 1.00 0.00 H new ATOM 1034 N VAL A 69 12.594 -9.729 5.061 1.00 0.00 N ATOM 1035 CA VAL A 69 12.949 -10.136 3.712 1.00 0.00 C ATOM 1036 C VAL A 69 11.685 -10.189 2.851 1.00 0.00 C ATOM 1037 O VAL A 69 10.635 -10.634 3.311 1.00 0.00 O ATOM 1038 CB VAL A 69 13.705 -11.465 3.747 1.00 0.00 C ATOM 1039 CG1 VAL A 69 14.013 -11.959 2.332 1.00 0.00 C ATOM 1040 CG2 VAL A 69 14.984 -11.347 4.578 1.00 0.00 C ATOM 0 H VAL A 69 11.829 -10.259 5.479 1.00 0.00 H new ATOM 0 HA VAL A 69 13.621 -9.408 3.258 1.00 0.00 H new ATOM 0 HB VAL A 69 13.062 -12.203 4.226 1.00 0.00 H new ATOM 0 HG11 VAL A 69 14.551 -12.905 2.386 1.00 0.00 H new ATOM 0 HG12 VAL A 69 13.081 -12.102 1.786 1.00 0.00 H new ATOM 0 HG13 VAL A 69 14.627 -11.222 1.815 1.00 0.00 H new ATOM 0 HG21 VAL A 69 15.502 -12.306 4.586 1.00 0.00 H new ATOM 0 HG22 VAL A 69 15.633 -10.588 4.141 1.00 0.00 H new ATOM 0 HG23 VAL A 69 14.730 -11.063 5.599 1.00 0.00 H new ATOM 1050 N ARG A 70 11.828 -9.728 1.617 1.00 0.00 N ATOM 1051 CA ARG A 70 10.711 -9.717 0.688 1.00 0.00 C ATOM 1052 C ARG A 70 10.245 -11.146 0.402 1.00 0.00 C ATOM 1053 O ARG A 70 10.563 -11.710 -0.644 1.00 0.00 O ATOM 1054 CB ARG A 70 11.097 -9.042 -0.630 1.00 0.00 C ATOM 1055 CG ARG A 70 10.580 -7.602 -0.680 1.00 0.00 C ATOM 1056 CD ARG A 70 11.567 -6.691 -1.412 1.00 0.00 C ATOM 1057 NE ARG A 70 11.843 -7.226 -2.764 1.00 0.00 N ATOM 1058 CZ ARG A 70 12.916 -7.967 -3.073 1.00 0.00 C ATOM 1059 NH1 ARG A 70 13.819 -8.265 -2.130 1.00 0.00 N ATOM 1060 NH2 ARG A 70 13.085 -8.411 -4.327 1.00 0.00 N ATOM 0 H ARG A 70 12.701 -9.359 1.239 1.00 0.00 H new ATOM 0 HA ARG A 70 9.902 -9.152 1.150 1.00 0.00 H new ATOM 0 HB2 ARG A 70 12.181 -9.047 -0.742 1.00 0.00 H new ATOM 0 HB3 ARG A 70 10.688 -9.608 -1.467 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.613 -7.576 -1.183 1.00 0.00 H new ATOM 0 HG3 ARG A 70 10.422 -7.233 0.333 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.158 -5.684 -1.487 1.00 0.00 H new ATOM 0 HD3 ARG A 70 12.495 -6.616 -0.845 1.00 0.00 H new ATOM 0 HE ARG A 70 11.175 -7.018 -3.506 1.00 0.00 H new ATOM 0 HH11 ARG A 70 13.690 -7.928 -1.176 1.00 0.00 H new ATOM 0 HH12 ARG A 70 14.635 -8.829 -2.366 1.00 0.00 H new ATOM 0 HH21 ARG A 70 12.397 -8.185 -5.045 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.902 -8.975 -4.563 1.00 0.00 H new ATOM 1074 N PHE A 71 9.498 -11.692 1.352 1.00 0.00 N ATOM 1075 CA PHE A 71 8.985 -13.044 1.215 1.00 0.00 C ATOM 1076 C PHE A 71 10.125 -14.065 1.202 1.00 0.00 C ATOM 1077 O PHE A 71 10.314 -14.802 2.168 1.00 0.00 O ATOM 1078 CB PHE A 71 8.243 -13.108 -0.121 1.00 0.00 C ATOM 1079 CG PHE A 71 6.765 -13.484 0.005 1.00 0.00 C ATOM 1080 CD1 PHE A 71 6.391 -14.791 -0.030 1.00 0.00 C ATOM 1081 CD2 PHE A 71 5.827 -12.511 0.152 1.00 0.00 C ATOM 1082 CE1 PHE A 71 5.019 -15.139 0.086 1.00 0.00 C ATOM 1083 CE2 PHE A 71 4.455 -12.860 0.269 1.00 0.00 C ATOM 1084 CZ PHE A 71 4.080 -14.167 0.234 1.00 0.00 C ATOM 0 H PHE A 71 9.236 -11.222 2.219 1.00 0.00 H new ATOM 0 HA PHE A 71 8.332 -13.280 2.055 1.00 0.00 H new ATOM 0 HB2 PHE A 71 8.320 -12.139 -0.614 1.00 0.00 H new ATOM 0 HB3 PHE A 71 8.738 -13.834 -0.766 1.00 0.00 H new ATOM 0 HD1 PHE A 71 7.137 -15.564 -0.146 1.00 0.00 H new ATOM 0 HD2 PHE A 71 6.125 -11.473 0.180 1.00 0.00 H new ATOM 0 HE1 PHE A 71 4.721 -16.177 0.057 1.00 0.00 H new ATOM 0 HE2 PHE A 71 3.709 -12.087 0.386 1.00 0.00 H new ATOM 0 HZ PHE A 71 3.037 -14.432 0.324 1.00 0.00 H new ATOM 1094 N LYS A 72 10.855 -14.075 0.096 1.00 0.00 N ATOM 1095 CA LYS A 72 11.971 -14.992 -0.055 1.00 0.00 C ATOM 1096 C LYS A 72 12.723 -14.665 -1.347 1.00 0.00 C ATOM 1097 O LYS A 72 13.007 -15.556 -2.147 1.00 0.00 O ATOM 1098 CB LYS A 72 11.487 -16.442 0.024 1.00 0.00 C ATOM 1099 CG LYS A 72 10.650 -16.809 -1.203 1.00 0.00 C ATOM 1100 CD LYS A 72 9.367 -17.534 -0.793 1.00 0.00 C ATOM 1101 CE LYS A 72 9.097 -18.730 -1.709 1.00 0.00 C ATOM 1102 NZ LYS A 72 9.939 -19.883 -1.317 1.00 0.00 N ATOM 0 H LYS A 72 10.695 -13.462 -0.704 1.00 0.00 H new ATOM 0 HA LYS A 72 12.678 -14.870 0.766 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.344 -17.112 0.097 1.00 0.00 H new ATOM 0 HB3 LYS A 72 10.894 -16.582 0.928 1.00 0.00 H new ATOM 0 HG2 LYS A 72 10.400 -15.906 -1.760 1.00 0.00 H new ATOM 0 HG3 LYS A 72 11.234 -17.444 -1.870 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.451 -17.874 0.239 1.00 0.00 H new ATOM 0 HD3 LYS A 72 8.525 -16.843 -0.834 1.00 0.00 H new ATOM 0 HE2 LYS A 72 8.044 -19.006 -1.656 1.00 0.00 H new ATOM 0 HE3 LYS A 72 9.303 -18.457 -2.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 9.744 -20.686 -1.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 10.943 -19.621 -1.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 9.723 -20.153 -0.336 1.00 0.00 H new ATOM 1116 N ARG A 73 13.023 -13.385 -1.511 1.00 0.00 N ATOM 1117 CA ARG A 73 13.737 -12.929 -2.692 1.00 0.00 C ATOM 1118 C ARG A 73 13.245 -13.680 -3.932 1.00 0.00 C ATOM 1119 O ARG A 73 13.875 -14.641 -4.370 1.00 0.00 O ATOM 1120 CB ARG A 73 15.244 -13.141 -2.541 1.00 0.00 C ATOM 1121 CG ARG A 73 15.986 -11.802 -2.515 1.00 0.00 C ATOM 1122 CD ARG A 73 16.539 -11.509 -1.119 1.00 0.00 C ATOM 1123 NE ARG A 73 17.545 -10.426 -1.191 1.00 0.00 N ATOM 1124 CZ ARG A 73 18.768 -10.570 -1.719 1.00 0.00 C ATOM 1125 NH1 ARG A 73 19.144 -11.753 -2.224 1.00 0.00 N ATOM 1126 NH2 ARG A 73 19.615 -9.532 -1.741 1.00 0.00 N ATOM 0 H ARG A 73 12.785 -12.649 -0.846 1.00 0.00 H new ATOM 0 HA ARG A 73 13.542 -11.863 -2.807 1.00 0.00 H new ATOM 0 HB2 ARG A 73 15.447 -13.691 -1.622 1.00 0.00 H new ATOM 0 HB3 ARG A 73 15.614 -13.750 -3.366 1.00 0.00 H new ATOM 0 HG2 ARG A 73 16.802 -11.820 -3.237 1.00 0.00 H new ATOM 0 HG3 ARG A 73 15.311 -11.002 -2.818 1.00 0.00 H new ATOM 0 HD2 ARG A 73 15.728 -11.220 -0.451 1.00 0.00 H new ATOM 0 HD3 ARG A 73 16.990 -12.409 -0.701 1.00 0.00 H new ATOM 0 HE ARG A 73 17.291 -9.512 -0.815 1.00 0.00 H new ATOM 0 HH11 ARG A 73 18.499 -12.543 -2.206 1.00 0.00 H new ATOM 0 HH12 ARG A 73 20.075 -11.863 -2.626 1.00 0.00 H new ATOM 0 HH21 ARG A 73 19.329 -8.632 -1.356 1.00 0.00 H new ATOM 0 HH22 ARG A 73 20.546 -9.642 -2.143 1.00 0.00 H new ATOM 1140 N SER A 74 12.125 -13.212 -4.462 1.00 0.00 N ATOM 1141 CA SER A 74 11.542 -13.827 -5.642 1.00 0.00 C ATOM 1142 C SER A 74 10.279 -13.070 -6.057 1.00 0.00 C ATOM 1143 O SER A 74 9.892 -12.099 -5.409 1.00 0.00 O ATOM 1144 CB SER A 74 11.219 -15.302 -5.393 1.00 0.00 C ATOM 1145 OG SER A 74 10.001 -15.467 -4.673 1.00 0.00 O ATOM 0 H SER A 74 11.606 -12.414 -4.096 1.00 0.00 H new ATOM 0 HA SER A 74 12.272 -13.775 -6.450 1.00 0.00 H new ATOM 0 HB2 SER A 74 11.150 -15.824 -6.347 1.00 0.00 H new ATOM 0 HB3 SER A 74 12.035 -15.763 -4.836 1.00 0.00 H new ATOM 0 HG SER A 74 9.829 -16.422 -4.536 1.00 0.00 H new ATOM 1151 N LYS A 75 9.671 -13.544 -7.135 1.00 0.00 N ATOM 1152 CA LYS A 75 8.459 -12.924 -7.644 1.00 0.00 C ATOM 1153 C LYS A 75 7.419 -14.008 -7.933 1.00 0.00 C ATOM 1154 O LYS A 75 7.092 -14.266 -9.091 1.00 0.00 O ATOM 1155 CB LYS A 75 8.777 -12.038 -8.851 1.00 0.00 C ATOM 1156 CG LYS A 75 9.623 -10.832 -8.438 1.00 0.00 C ATOM 1157 CD LYS A 75 10.081 -10.039 -9.664 1.00 0.00 C ATOM 1158 CE LYS A 75 11.332 -9.217 -9.349 1.00 0.00 C ATOM 1159 NZ LYS A 75 11.332 -7.955 -10.122 1.00 0.00 N ATOM 0 H LYS A 75 9.995 -14.350 -7.670 1.00 0.00 H new ATOM 0 HA LYS A 75 8.027 -12.260 -6.895 1.00 0.00 H new ATOM 0 HB2 LYS A 75 9.309 -12.620 -9.603 1.00 0.00 H new ATOM 0 HB3 LYS A 75 7.849 -11.696 -9.310 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.044 -10.186 -7.778 1.00 0.00 H new ATOM 0 HG3 LYS A 75 10.492 -11.169 -7.873 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.288 -10.723 -10.487 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.280 -9.377 -9.994 1.00 0.00 H new ATOM 0 HE2 LYS A 75 11.370 -8.997 -8.282 1.00 0.00 H new ATOM 0 HE3 LYS A 75 12.224 -9.796 -9.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 12.188 -7.409 -9.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 11.318 -8.171 -11.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 10.490 -7.396 -9.875 1.00 0.00 H new ATOM 1173 N LYS A 76 6.929 -14.614 -6.862 1.00 0.00 N ATOM 1174 CA LYS A 76 5.933 -15.664 -6.986 1.00 0.00 C ATOM 1175 C LYS A 76 4.535 -15.051 -6.883 1.00 0.00 C ATOM 1176 O LYS A 76 3.680 -15.564 -6.163 1.00 0.00 O ATOM 1177 CB LYS A 76 6.195 -16.774 -5.966 1.00 0.00 C ATOM 1178 CG LYS A 76 5.732 -16.356 -4.569 1.00 0.00 C ATOM 1179 CD LYS A 76 4.577 -17.236 -4.088 1.00 0.00 C ATOM 1180 CE LYS A 76 4.704 -17.538 -2.593 1.00 0.00 C ATOM 1181 NZ LYS A 76 3.623 -18.449 -2.155 1.00 0.00 N ATOM 0 H LYS A 76 7.203 -14.398 -5.904 1.00 0.00 H new ATOM 0 HA LYS A 76 6.001 -16.139 -7.965 1.00 0.00 H new ATOM 0 HB2 LYS A 76 5.673 -17.682 -6.269 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.259 -17.010 -5.945 1.00 0.00 H new ATOM 0 HG2 LYS A 76 6.565 -16.428 -3.869 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.417 -15.313 -4.583 1.00 0.00 H new ATOM 0 HD2 LYS A 76 3.628 -16.736 -4.282 1.00 0.00 H new ATOM 0 HD3 LYS A 76 4.567 -18.169 -4.652 1.00 0.00 H new ATOM 0 HE2 LYS A 76 5.674 -17.991 -2.388 1.00 0.00 H new ATOM 0 HE3 LYS A 76 4.659 -16.610 -2.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 3.724 -18.644 -1.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 2.700 -18.003 -2.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 3.684 -19.341 -2.686 1.00 0.00 H new ATOM 1195 N ILE A 77 4.346 -13.962 -7.613 1.00 0.00 N ATOM 1196 CA ILE A 77 3.067 -13.273 -7.612 1.00 0.00 C ATOM 1197 C ILE A 77 2.592 -13.089 -6.169 1.00 0.00 C ATOM 1198 O ILE A 77 1.847 -13.917 -5.647 1.00 0.00 O ATOM 1199 CB ILE A 77 2.062 -14.008 -8.501 1.00 0.00 C ATOM 1200 CG1 ILE A 77 2.592 -14.145 -9.930 1.00 0.00 C ATOM 1201 CG2 ILE A 77 0.693 -13.326 -8.461 1.00 0.00 C ATOM 1202 CD1 ILE A 77 2.949 -15.599 -10.245 1.00 0.00 C ATOM 0 H ILE A 77 5.057 -13.540 -8.209 1.00 0.00 H new ATOM 0 HA ILE A 77 3.171 -12.277 -8.043 1.00 0.00 H new ATOM 0 HB ILE A 77 1.931 -15.016 -8.107 1.00 0.00 H new ATOM 0 HG12 ILE A 77 1.841 -13.790 -10.636 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.472 -13.515 -10.057 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.003 -13.868 -9.101 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.318 -13.323 -7.438 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.787 -12.300 -8.815 1.00 0.00 H new ATOM 0 HD11 ILE A 77 3.323 -15.669 -11.266 1.00 0.00 H new ATOM 0 HD12 ILE A 77 3.718 -15.943 -9.553 1.00 0.00 H new ATOM 0 HD13 ILE A 77 2.061 -16.223 -10.140 1.00 0.00 H new ATOM 1214 N MET A 78 3.043 -11.999 -5.566 1.00 0.00 N ATOM 1215 CA MET A 78 2.674 -11.697 -4.194 1.00 0.00 C ATOM 1216 C MET A 78 3.594 -10.628 -3.601 1.00 0.00 C ATOM 1217 O MET A 78 3.124 -9.623 -3.070 1.00 0.00 O ATOM 1218 CB MET A 78 2.759 -12.970 -3.349 1.00 0.00 C ATOM 1219 CG MET A 78 1.370 -13.412 -2.882 1.00 0.00 C ATOM 1220 SD MET A 78 1.488 -14.954 -1.991 1.00 0.00 S ATOM 1221 CE MET A 78 0.028 -15.778 -2.603 1.00 0.00 C ATOM 0 H MET A 78 3.660 -11.314 -6.002 1.00 0.00 H new ATOM 0 HA MET A 78 1.653 -11.315 -4.189 1.00 0.00 H new ATOM 0 HB2 MET A 78 3.222 -13.767 -3.931 1.00 0.00 H new ATOM 0 HB3 MET A 78 3.399 -12.795 -2.484 1.00 0.00 H new ATOM 0 HG2 MET A 78 0.931 -12.646 -2.243 1.00 0.00 H new ATOM 0 HG3 MET A 78 0.708 -13.528 -3.740 1.00 0.00 H new ATOM 0 HE1 MET A 78 -0.052 -16.764 -2.145 1.00 0.00 H new ATOM 0 HE2 MET A 78 -0.854 -15.189 -2.353 1.00 0.00 H new ATOM 0 HE3 MET A 78 0.098 -15.886 -3.685 1.00 0.00 H new ATOM 1231 N PRO A 79 4.924 -10.888 -3.714 1.00 0.00 N ATOM 1232 CA PRO A 79 5.915 -9.960 -3.196 1.00 0.00 C ATOM 1233 C PRO A 79 6.043 -8.733 -4.100 1.00 0.00 C ATOM 1234 O PRO A 79 5.653 -7.631 -3.716 1.00 0.00 O ATOM 1235 CB PRO A 79 7.200 -10.768 -3.105 1.00 0.00 C ATOM 1236 CG PRO A 79 6.999 -11.975 -4.006 1.00 0.00 C ATOM 1237 CD PRO A 79 5.518 -12.068 -4.337 1.00 0.00 C ATOM 0 HA PRO A 79 5.644 -9.556 -2.221 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.057 -10.177 -3.429 1.00 0.00 H new ATOM 0 HB3 PRO A 79 7.396 -11.076 -2.078 1.00 0.00 H new ATOM 0 HG2 PRO A 79 7.588 -11.873 -4.917 1.00 0.00 H new ATOM 0 HG3 PRO A 79 7.337 -12.884 -3.508 1.00 0.00 H new ATOM 0 HD2 PRO A 79 5.353 -12.073 -5.414 1.00 0.00 H new ATOM 0 HD3 PRO A 79 5.081 -12.986 -3.943 1.00 0.00 H new ATOM 1245 N ALA A 80 6.591 -8.964 -5.284 1.00 0.00 N ATOM 1246 CA ALA A 80 6.775 -7.891 -6.246 1.00 0.00 C ATOM 1247 C ALA A 80 5.514 -7.025 -6.285 1.00 0.00 C ATOM 1248 O ALA A 80 5.600 -5.798 -6.312 1.00 0.00 O ATOM 1249 CB ALA A 80 7.117 -8.484 -7.614 1.00 0.00 C ATOM 0 H ALA A 80 6.914 -9.879 -5.599 1.00 0.00 H new ATOM 0 HA ALA A 80 7.606 -7.250 -5.952 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.255 -7.679 -8.335 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.036 -9.065 -7.539 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.304 -9.131 -7.944 1.00 0.00 H new ATOM 1255 N GLY A 81 4.373 -7.698 -6.288 1.00 0.00 N ATOM 1256 CA GLY A 81 3.096 -7.005 -6.323 1.00 0.00 C ATOM 1257 C GLY A 81 3.117 -5.770 -5.420 1.00 0.00 C ATOM 1258 O GLY A 81 2.779 -4.671 -5.858 1.00 0.00 O ATOM 0 H GLY A 81 4.306 -8.716 -6.267 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.868 -6.708 -7.346 1.00 0.00 H new ATOM 0 HA3 GLY A 81 2.303 -7.681 -6.003 1.00 0.00 H new ATOM 1262 N LEU A 82 3.518 -5.992 -4.177 1.00 0.00 N ATOM 1263 CA LEU A 82 3.587 -4.910 -3.209 1.00 0.00 C ATOM 1264 C LEU A 82 4.331 -3.725 -3.828 1.00 0.00 C ATOM 1265 O LEU A 82 3.853 -2.593 -3.777 1.00 0.00 O ATOM 1266 CB LEU A 82 4.200 -5.404 -1.897 1.00 0.00 C ATOM 1267 CG LEU A 82 3.441 -5.035 -0.621 1.00 0.00 C ATOM 1268 CD1 LEU A 82 2.324 -6.041 -0.337 1.00 0.00 C ATOM 1269 CD2 LEU A 82 4.398 -4.891 0.564 1.00 0.00 C ATOM 0 H LEU A 82 3.798 -6.905 -3.818 1.00 0.00 H new ATOM 0 HA LEU A 82 2.586 -4.561 -2.955 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.284 -6.490 -1.945 1.00 0.00 H new ATOM 0 HB3 LEU A 82 5.213 -5.009 -1.821 1.00 0.00 H new ATOM 0 HG LEU A 82 2.969 -4.064 -0.773 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.800 -5.755 0.575 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.622 -6.050 -1.171 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.753 -7.035 -0.213 1.00 0.00 H new ATOM 0 HD21 LEU A 82 3.833 -4.628 1.458 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.919 -5.834 0.728 1.00 0.00 H new ATOM 0 HD23 LEU A 82 5.125 -4.107 0.351 1.00 0.00 H new ATOM 1281 N VAL A 83 5.489 -4.026 -4.397 1.00 0.00 N ATOM 1282 CA VAL A 83 6.304 -3.000 -5.025 1.00 0.00 C ATOM 1283 C VAL A 83 5.484 -2.296 -6.108 1.00 0.00 C ATOM 1284 O VAL A 83 5.604 -1.086 -6.294 1.00 0.00 O ATOM 1285 CB VAL A 83 7.599 -3.614 -5.559 1.00 0.00 C ATOM 1286 CG1 VAL A 83 8.403 -2.588 -6.359 1.00 0.00 C ATOM 1287 CG2 VAL A 83 8.437 -4.202 -4.422 1.00 0.00 C ATOM 0 H VAL A 83 5.882 -4.966 -4.436 1.00 0.00 H new ATOM 0 HA VAL A 83 6.596 -2.244 -4.296 1.00 0.00 H new ATOM 0 HB VAL A 83 7.331 -4.428 -6.232 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.319 -3.050 -6.727 1.00 0.00 H new ATOM 0 HG12 VAL A 83 7.809 -2.238 -7.203 1.00 0.00 H new ATOM 0 HG13 VAL A 83 8.655 -1.743 -5.718 1.00 0.00 H new ATOM 0 HG21 VAL A 83 9.352 -4.632 -4.829 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.691 -3.415 -3.712 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.866 -4.979 -3.913 1.00 0.00 H new ATOM 1297 N ALA A 84 4.670 -3.084 -6.795 1.00 0.00 N ATOM 1298 CA ALA A 84 3.831 -2.551 -7.855 1.00 0.00 C ATOM 1299 C ALA A 84 2.783 -1.616 -7.248 1.00 0.00 C ATOM 1300 O ALA A 84 2.344 -0.667 -7.896 1.00 0.00 O ATOM 1301 CB ALA A 84 3.200 -3.706 -8.636 1.00 0.00 C ATOM 0 H ALA A 84 4.574 -4.087 -6.638 1.00 0.00 H new ATOM 0 HA ALA A 84 4.425 -1.968 -8.559 1.00 0.00 H new ATOM 0 HB1 ALA A 84 2.571 -3.307 -9.431 1.00 0.00 H new ATOM 0 HB2 ALA A 84 3.986 -4.323 -9.071 1.00 0.00 H new ATOM 0 HB3 ALA A 84 2.593 -4.312 -7.963 1.00 0.00 H new ATOM 1307 N GLY A 85 2.412 -1.917 -6.012 1.00 0.00 N ATOM 1308 CA GLY A 85 1.424 -1.115 -5.311 1.00 0.00 C ATOM 1309 C GLY A 85 1.999 0.249 -4.924 1.00 0.00 C ATOM 1310 O GLY A 85 1.369 1.280 -5.150 1.00 0.00 O ATOM 0 H GLY A 85 2.778 -2.705 -5.478 1.00 0.00 H new ATOM 0 HA2 GLY A 85 0.547 -0.978 -5.943 1.00 0.00 H new ATOM 0 HA3 GLY A 85 1.092 -1.641 -4.416 1.00 0.00 H new ATOM 1314 N LEU A 86 3.191 0.210 -4.346 1.00 0.00 N ATOM 1315 CA LEU A 86 3.859 1.430 -3.924 1.00 0.00 C ATOM 1316 C LEU A 86 4.066 2.338 -5.138 1.00 0.00 C ATOM 1317 O LEU A 86 3.731 3.521 -5.097 1.00 0.00 O ATOM 1318 CB LEU A 86 5.151 1.101 -3.174 1.00 0.00 C ATOM 1319 CG LEU A 86 5.010 0.164 -1.972 1.00 0.00 C ATOM 1320 CD1 LEU A 86 6.372 -0.378 -1.537 1.00 0.00 C ATOM 1321 CD2 LEU A 86 4.273 0.855 -0.823 1.00 0.00 C ATOM 0 H LEU A 86 3.711 -0.647 -4.160 1.00 0.00 H new ATOM 0 HA LEU A 86 3.239 1.980 -3.216 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.852 0.653 -3.878 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.596 2.035 -2.831 1.00 0.00 H new ATOM 0 HG LEU A 86 4.406 -0.691 -2.274 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.243 -1.041 -0.681 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.823 -0.932 -2.360 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.022 0.452 -1.259 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.186 0.168 0.019 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.830 1.740 -0.513 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.278 1.150 -1.155 1.00 0.00 H new ATOM 1333 N SER A 87 4.618 1.750 -6.189 1.00 0.00 N ATOM 1334 CA SER A 87 4.874 2.491 -7.413 1.00 0.00 C ATOM 1335 C SER A 87 3.579 3.131 -7.918 1.00 0.00 C ATOM 1336 O SER A 87 3.537 4.331 -8.182 1.00 0.00 O ATOM 1337 CB SER A 87 5.474 1.586 -8.490 1.00 0.00 C ATOM 1338 OG SER A 87 6.898 1.557 -8.430 1.00 0.00 O ATOM 0 H SER A 87 4.895 0.769 -6.219 1.00 0.00 H new ATOM 0 HA SER A 87 5.598 3.276 -7.192 1.00 0.00 H new ATOM 0 HB2 SER A 87 5.085 0.575 -8.371 1.00 0.00 H new ATOM 0 HB3 SER A 87 5.160 1.935 -9.474 1.00 0.00 H new ATOM 0 HG SER A 87 7.243 0.967 -9.132 1.00 0.00 H new ATOM 1344 N LEU A 88 2.554 2.300 -8.038 1.00 0.00 N ATOM 1345 CA LEU A 88 1.261 2.769 -8.507 1.00 0.00 C ATOM 1346 C LEU A 88 0.836 3.986 -7.683 1.00 0.00 C ATOM 1347 O LEU A 88 0.407 4.996 -8.238 1.00 0.00 O ATOM 1348 CB LEU A 88 0.240 1.629 -8.492 1.00 0.00 C ATOM 1349 CG LEU A 88 -0.197 1.102 -9.860 1.00 0.00 C ATOM 1350 CD1 LEU A 88 0.103 -0.392 -9.994 1.00 0.00 C ATOM 1351 CD2 LEU A 88 -1.670 1.417 -10.124 1.00 0.00 C ATOM 0 H LEU A 88 2.593 1.305 -7.819 1.00 0.00 H new ATOM 0 HA LEU A 88 1.327 3.093 -9.546 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.659 0.800 -7.922 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.646 1.968 -7.956 1.00 0.00 H new ATOM 0 HG LEU A 88 0.384 1.616 -10.625 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -0.218 -0.741 -10.976 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.174 -0.560 -9.881 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.434 -0.942 -9.221 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -1.955 1.031 -11.103 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -2.286 0.948 -9.356 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.821 2.496 -10.101 1.00 0.00 H new ATOM 1363 N MET A 89 0.969 3.850 -6.372 1.00 0.00 N ATOM 1364 CA MET A 89 0.604 4.926 -5.467 1.00 0.00 C ATOM 1365 C MET A 89 1.325 6.223 -5.838 1.00 0.00 C ATOM 1366 O MET A 89 0.697 7.274 -5.957 1.00 0.00 O ATOM 1367 CB MET A 89 0.967 4.532 -4.033 1.00 0.00 C ATOM 1368 CG MET A 89 -0.277 4.500 -3.142 1.00 0.00 C ATOM 1369 SD MET A 89 -0.499 6.081 -2.346 1.00 0.00 S ATOM 1370 CE MET A 89 -1.777 6.773 -3.384 1.00 0.00 C ATOM 0 H MET A 89 1.325 3.010 -5.915 1.00 0.00 H new ATOM 0 HA MET A 89 -0.470 5.094 -5.547 1.00 0.00 H new ATOM 0 HB2 MET A 89 1.445 3.553 -4.031 1.00 0.00 H new ATOM 0 HB3 MET A 89 1.690 5.241 -3.629 1.00 0.00 H new ATOM 0 HG2 MET A 89 -1.156 4.258 -3.739 1.00 0.00 H new ATOM 0 HG3 MET A 89 -0.176 3.716 -2.391 1.00 0.00 H new ATOM 0 HE1 MET A 89 -2.088 7.738 -2.984 1.00 0.00 H new ATOM 0 HE2 MET A 89 -1.392 6.906 -4.395 1.00 0.00 H new ATOM 0 HE3 MET A 89 -2.632 6.097 -3.408 1.00 0.00 H new ATOM 1380 N MET A 90 2.633 6.107 -6.012 1.00 0.00 N ATOM 1381 CA MET A 90 3.446 7.258 -6.367 1.00 0.00 C ATOM 1382 C MET A 90 2.900 7.950 -7.618 1.00 0.00 C ATOM 1383 O MET A 90 2.604 9.143 -7.592 1.00 0.00 O ATOM 1384 CB MET A 90 4.886 6.807 -6.621 1.00 0.00 C ATOM 1385 CG MET A 90 5.501 6.198 -5.359 1.00 0.00 C ATOM 1386 SD MET A 90 5.723 7.462 -4.118 1.00 0.00 S ATOM 1387 CE MET A 90 4.986 6.648 -2.711 1.00 0.00 C ATOM 0 H MET A 90 3.150 5.233 -5.914 1.00 0.00 H new ATOM 0 HA MET A 90 3.418 7.968 -5.540 1.00 0.00 H new ATOM 0 HB2 MET A 90 4.904 6.075 -7.428 1.00 0.00 H new ATOM 0 HB3 MET A 90 5.485 7.657 -6.948 1.00 0.00 H new ATOM 0 HG2 MET A 90 4.856 5.408 -4.974 1.00 0.00 H new ATOM 0 HG3 MET A 90 6.460 5.738 -5.597 1.00 0.00 H new ATOM 0 HE1 MET A 90 4.193 7.274 -2.302 1.00 0.00 H new ATOM 0 HE2 MET A 90 4.568 5.691 -3.022 1.00 0.00 H new ATOM 0 HE3 MET A 90 5.746 6.481 -1.948 1.00 0.00 H new ATOM 1397 N ILE A 91 2.782 7.170 -8.683 1.00 0.00 N ATOM 1398 CA ILE A 91 2.277 7.693 -9.941 1.00 0.00 C ATOM 1399 C ILE A 91 0.953 8.419 -9.691 1.00 0.00 C ATOM 1400 O ILE A 91 0.795 9.578 -10.072 1.00 0.00 O ATOM 1401 CB ILE A 91 2.179 6.578 -10.984 1.00 0.00 C ATOM 1402 CG1 ILE A 91 3.564 6.025 -11.327 1.00 0.00 C ATOM 1403 CG2 ILE A 91 1.428 7.056 -12.228 1.00 0.00 C ATOM 1404 CD1 ILE A 91 3.517 4.508 -11.516 1.00 0.00 C ATOM 0 H ILE A 91 3.027 6.180 -8.700 1.00 0.00 H new ATOM 0 HA ILE A 91 2.970 8.425 -10.355 1.00 0.00 H new ATOM 0 HB ILE A 91 1.602 5.758 -10.555 1.00 0.00 H new ATOM 0 HG12 ILE A 91 3.933 6.497 -12.238 1.00 0.00 H new ATOM 0 HG13 ILE A 91 4.266 6.274 -10.532 1.00 0.00 H new ATOM 0 HG21 ILE A 91 1.372 6.245 -12.954 1.00 0.00 H new ATOM 0 HG22 ILE A 91 0.420 7.363 -11.949 1.00 0.00 H new ATOM 0 HG23 ILE A 91 1.956 7.902 -12.669 1.00 0.00 H new ATOM 0 HD11 ILE A 91 4.514 4.141 -11.759 1.00 0.00 H new ATOM 0 HD12 ILE A 91 3.171 4.037 -10.596 1.00 0.00 H new ATOM 0 HD13 ILE A 91 2.832 4.264 -12.328 1.00 0.00 H new ATOM 1416 N LEU A 92 0.036 7.708 -9.052 1.00 0.00 N ATOM 1417 CA LEU A 92 -1.268 8.270 -8.747 1.00 0.00 C ATOM 1418 C LEU A 92 -1.088 9.562 -7.947 1.00 0.00 C ATOM 1419 O LEU A 92 -1.912 10.471 -8.033 1.00 0.00 O ATOM 1420 CB LEU A 92 -2.149 7.233 -8.048 1.00 0.00 C ATOM 1421 CG LEU A 92 -3.229 6.579 -8.913 1.00 0.00 C ATOM 1422 CD1 LEU A 92 -2.610 5.618 -9.930 1.00 0.00 C ATOM 1423 CD2 LEU A 92 -4.285 5.892 -8.044 1.00 0.00 C ATOM 0 H LEU A 92 0.171 6.747 -8.737 1.00 0.00 H new ATOM 0 HA LEU A 92 -1.793 8.533 -9.666 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -1.506 6.448 -7.649 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -2.633 7.711 -7.197 1.00 0.00 H new ATOM 0 HG LEU A 92 -3.735 7.362 -9.477 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.399 5.167 -10.532 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -1.927 6.166 -10.579 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -2.062 4.836 -9.405 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -5.041 5.435 -8.683 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.811 5.122 -7.436 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.757 6.629 -7.394 1.00 0.00 H new ATOM 1435 N ARG A 93 -0.004 9.603 -7.186 1.00 0.00 N ATOM 1436 CA ARG A 93 0.296 10.768 -6.371 1.00 0.00 C ATOM 1437 C ARG A 93 0.803 11.913 -7.249 1.00 0.00 C ATOM 1438 O ARG A 93 0.592 13.083 -6.932 1.00 0.00 O ATOM 1439 CB ARG A 93 1.349 10.442 -5.310 1.00 0.00 C ATOM 1440 CG ARG A 93 0.716 10.342 -3.921 1.00 0.00 C ATOM 1441 CD ARG A 93 1.051 11.572 -3.075 1.00 0.00 C ATOM 1442 NE ARG A 93 -0.170 12.378 -2.849 1.00 0.00 N ATOM 1443 CZ ARG A 93 -1.254 11.933 -2.199 1.00 0.00 C ATOM 1444 NH1 ARG A 93 -1.276 10.687 -1.708 1.00 0.00 N ATOM 1445 NH2 ARG A 93 -2.316 12.734 -2.041 1.00 0.00 N ATOM 0 H ARG A 93 0.678 8.847 -7.117 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.625 11.069 -5.871 1.00 0.00 H new ATOM 0 HB2 ARG A 93 1.841 9.501 -5.558 1.00 0.00 H new ATOM 0 HB3 ARG A 93 2.119 11.213 -5.308 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -0.366 10.246 -4.017 1.00 0.00 H new ATOM 0 HG3 ARG A 93 1.073 9.443 -3.419 1.00 0.00 H new ATOM 0 HD2 ARG A 93 1.474 11.262 -2.120 1.00 0.00 H new ATOM 0 HD3 ARG A 93 1.807 12.175 -3.578 1.00 0.00 H new ATOM 0 HE ARG A 93 -0.187 13.332 -3.211 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -0.468 10.077 -1.829 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -2.101 10.348 -1.213 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -2.300 13.683 -2.415 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -3.141 12.395 -1.546 1.00 0.00 H new ATOM 1459 N LEU A 94 1.462 11.537 -8.335 1.00 0.00 N ATOM 1460 CA LEU A 94 2.001 12.518 -9.261 1.00 0.00 C ATOM 1461 C LEU A 94 0.873 13.435 -9.740 1.00 0.00 C ATOM 1462 O LEU A 94 1.053 14.648 -9.836 1.00 0.00 O ATOM 1463 CB LEU A 94 2.753 11.825 -10.399 1.00 0.00 C ATOM 1464 CG LEU A 94 3.901 12.619 -11.025 1.00 0.00 C ATOM 1465 CD1 LEU A 94 5.095 12.702 -10.072 1.00 0.00 C ATOM 1466 CD2 LEU A 94 4.293 12.036 -12.384 1.00 0.00 C ATOM 0 H LEU A 94 1.635 10.566 -8.594 1.00 0.00 H new ATOM 0 HA LEU A 94 2.736 13.149 -8.761 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.152 10.883 -10.024 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.038 11.579 -11.184 1.00 0.00 H new ATOM 0 HG LEU A 94 3.556 13.638 -11.198 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.897 13.272 -10.542 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.791 13.197 -9.150 1.00 0.00 H new ATOM 0 HD13 LEU A 94 5.449 11.697 -9.844 1.00 0.00 H new ATOM 0 HD21 LEU A 94 5.111 12.619 -12.808 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.612 11.001 -12.258 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.436 12.072 -13.056 1.00 0.00 H new ATOM 1478 N VAL A 95 -0.265 12.820 -10.026 1.00 0.00 N ATOM 1479 CA VAL A 95 -1.422 13.566 -10.492 1.00 0.00 C ATOM 1480 C VAL A 95 -2.127 14.206 -9.294 1.00 0.00 C ATOM 1481 O VAL A 95 -2.450 15.392 -9.321 1.00 0.00 O ATOM 1482 CB VAL A 95 -2.340 12.653 -11.308 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -3.680 13.335 -11.592 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -1.661 12.214 -12.607 1.00 0.00 C ATOM 0 H VAL A 95 -0.411 11.814 -9.944 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.114 14.373 -11.157 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.538 11.760 -10.715 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -4.313 12.665 -12.173 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.173 13.574 -10.650 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -3.509 14.252 -12.155 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.334 11.566 -13.168 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.419 13.092 -13.206 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.745 11.671 -12.373 1.00 0.00 H new ATOM 1494 N LEU A 96 -2.344 13.392 -8.272 1.00 0.00 N ATOM 1495 CA LEU A 96 -3.005 13.864 -7.067 1.00 0.00 C ATOM 1496 C LEU A 96 -2.405 15.210 -6.656 1.00 0.00 C ATOM 1497 O LEU A 96 -3.112 16.079 -6.147 1.00 0.00 O ATOM 1498 CB LEU A 96 -2.939 12.800 -5.969 1.00 0.00 C ATOM 1499 CG LEU A 96 -4.284 12.281 -5.457 1.00 0.00 C ATOM 1500 CD1 LEU A 96 -5.050 13.379 -4.716 1.00 0.00 C ATOM 1501 CD2 LEU A 96 -5.108 11.677 -6.596 1.00 0.00 C ATOM 0 H LEU A 96 -2.074 12.409 -8.253 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.066 14.031 -7.254 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.365 11.953 -6.345 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -2.385 13.211 -5.125 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.091 11.483 -4.740 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -6.002 12.983 -4.363 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.462 13.722 -3.865 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -5.233 14.215 -5.392 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -6.059 11.316 -6.205 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -5.293 12.438 -7.354 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -4.560 10.847 -7.041 1.00 0.00 H new ATOM 1513 N LEU A 97 -1.108 15.341 -6.891 1.00 0.00 N ATOM 1514 CA LEU A 97 -0.406 16.566 -6.552 1.00 0.00 C ATOM 1515 C LEU A 97 -1.261 17.768 -6.957 1.00 0.00 C ATOM 1516 O LEU A 97 -1.410 18.716 -6.187 1.00 0.00 O ATOM 1517 CB LEU A 97 0.994 16.571 -7.170 1.00 0.00 C ATOM 1518 CG LEU A 97 2.158 16.751 -6.194 1.00 0.00 C ATOM 1519 CD1 LEU A 97 2.019 18.058 -5.411 1.00 0.00 C ATOM 1520 CD2 LEU A 97 2.291 15.540 -5.269 1.00 0.00 C ATOM 0 H LEU A 97 -0.525 14.618 -7.312 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.254 16.631 -5.475 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.137 15.632 -7.705 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.040 17.370 -7.910 1.00 0.00 H new ATOM 0 HG LEU A 97 3.080 16.817 -6.771 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.859 18.162 -4.724 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.011 18.899 -6.105 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.087 18.046 -4.845 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.126 15.694 -4.586 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.372 15.417 -4.697 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.470 14.645 -5.865 1.00 0.00 H new ATOM 1532 N LEU A 98 -1.801 17.690 -8.164 1.00 0.00 N ATOM 1533 CA LEU A 98 -2.638 18.759 -8.681 1.00 0.00 C ATOM 1534 C LEU A 98 -4.051 18.617 -8.110 1.00 0.00 C ATOM 1535 O LEU A 98 -4.629 19.588 -7.625 1.00 0.00 O ATOM 1536 CB LEU A 98 -2.593 18.784 -10.210 1.00 0.00 C ATOM 1537 CG LEU A 98 -2.147 20.102 -10.846 1.00 0.00 C ATOM 1538 CD1 LEU A 98 -1.916 19.935 -12.349 1.00 0.00 C ATOM 1539 CD2 LEU A 98 -3.144 21.223 -10.541 1.00 0.00 C ATOM 0 H LEU A 98 -1.675 16.902 -8.800 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.259 19.729 -8.358 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.921 17.995 -10.547 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.586 18.539 -10.587 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.193 20.389 -10.403 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.600 20.887 -12.776 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -1.142 19.186 -12.517 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -2.842 19.613 -12.826 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.803 22.149 -11.005 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -4.123 20.957 -10.939 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -3.216 21.362 -9.462 1.00 0.00 H new ATOM 1551 N LEU A 99 -4.565 17.399 -8.186 1.00 0.00 N ATOM 1552 CA LEU A 99 -5.899 17.117 -7.683 1.00 0.00 C ATOM 1553 C LEU A 99 -6.098 17.836 -6.347 1.00 0.00 C ATOM 1554 O LEU A 99 -7.192 18.314 -6.053 1.00 0.00 O ATOM 1555 CB LEU A 99 -6.136 15.607 -7.611 1.00 0.00 C ATOM 1556 CG LEU A 99 -7.553 15.134 -7.941 1.00 0.00 C ATOM 1557 CD1 LEU A 99 -7.549 14.190 -9.146 1.00 0.00 C ATOM 1558 CD2 LEU A 99 -8.219 14.499 -6.718 1.00 0.00 C ATOM 0 H LEU A 99 -4.082 16.596 -8.588 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.654 17.502 -8.368 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.442 15.117 -8.295 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.886 15.268 -6.606 1.00 0.00 H new ATOM 0 HG LEU A 99 -8.148 16.005 -8.215 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -8.568 13.868 -9.360 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -7.143 14.710 -10.014 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -6.933 13.319 -8.924 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -9.225 14.172 -6.980 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -7.633 13.641 -6.389 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -8.274 15.231 -5.913 1.00 0.00 H new TER 1570 LEU A 99