USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1011 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 63 MET CE :methyl -172:sc= -0.0843 (180deg=-0.158) USER MOD Set 1.2: A 71 THR OG1 : rot 88:sc= 1.25 USER MOD Set 2.1: A 44 ASN : amide:sc= 0.911 K(o=1.3,f=0.57) USER MOD Set 2.2: A 47 GLN : amide:sc= 0.381 K(o=1.3,f=0.57) USER MOD Single : A 1 MET CE :methyl 163:sc= -0.332 (180deg=-0.925) USER MOD Single : A 1 MET N :NH3+ -169:sc= 0 (180deg=-0.0322) USER MOD Single : A 4 LYS NZ :NH3+ 171:sc=-0.00182 (180deg=-0.0689) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 128:sc= 1.26 USER MOD Single : A 17 MET CE :methyl -165:sc= 0 (180deg=-0.374) USER MOD Single : A 23 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 32 ASN : amide:sc= -0.0137 X(o=-0.014,f=-0.2) USER MOD Single : A 45 LYS NZ :NH3+ -174:sc= 0.606 (180deg=0.441) USER MOD Single : A 51 TYR OH : rot 130:sc= 0 USER MOD Single : A 56 SER OG : rot 76:sc= 0.963 USER MOD Single : A 59 ASN : amide:sc= 1.06 K(o=1.1,f=-1.7) USER MOD Single : A 60 MET CE :methyl 174:sc= 0 (180deg=-0.0321) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 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 79 SER OG : rot -159:sc= 1.32 USER MOD Single : A 85 MET CE :methyl 160:sc= 0 (180deg=-0.244) USER MOD Single : A 87 THR OG1 : rot 38:sc= 1.48 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -0.826 K(o=-0.83,f=-3!) USER MOD Single : A 100 GLN : amide:sc= -0.131 X(o=-0.13,f=-0.14) USER MOD Single : A 104 SER OG : rot -110:sc= -0.423 USER MOD Single : A 106 TYR OH : rot 9:sc= 1.3 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ -122:sc= 0.104 (180deg=0) USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 122 LYS NZ :NH3+ -133:sc= -0.0139 (180deg=-1.05) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 MET CE :methyl -170:sc= 0 (180deg=-0.019) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.346 -19.797 -0.788 1.00 0.00 N ATOM 2 CA MET A 1 18.980 -19.479 -0.344 1.00 0.00 C ATOM 3 C MET A 1 19.056 -18.362 0.683 1.00 0.00 C ATOM 4 O MET A 1 19.466 -18.602 1.825 1.00 0.00 O ATOM 5 CB MET A 1 18.243 -20.706 0.215 1.00 0.00 C ATOM 6 CG MET A 1 17.812 -21.707 -0.867 1.00 0.00 C ATOM 7 SD MET A 1 16.116 -21.549 -1.487 1.00 0.00 S ATOM 8 CE MET A 1 16.171 -20.012 -2.443 1.00 0.00 C ATOM 0 H1 MET A 1 20.305 -20.422 -1.618 1.00 0.00 H new ATOM 0 H2 MET A 1 20.842 -18.919 -1.040 1.00 0.00 H new ATOM 0 H3 MET A 1 20.858 -20.276 -0.020 1.00 0.00 H new ATOM 0 HA MET A 1 18.397 -19.153 -1.206 1.00 0.00 H new ATOM 0 HB2 MET A 1 18.889 -21.213 0.931 1.00 0.00 H new ATOM 0 HB3 MET A 1 17.361 -20.372 0.762 1.00 0.00 H new ATOM 0 HG2 MET A 1 18.494 -21.611 -1.712 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.937 -22.714 -0.469 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.307 -19.964 -3.105 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.155 -19.160 -1.763 1.00 0.00 H new ATOM 0 HE3 MET A 1 17.085 -19.985 -3.037 1.00 0.00 H new ATOM 20 N ALA A 2 18.692 -17.145 0.275 1.00 0.00 N ATOM 21 CA ALA A 2 18.533 -15.983 1.136 1.00 0.00 C ATOM 22 C ALA A 2 17.192 -16.099 1.873 1.00 0.00 C ATOM 23 O ALA A 2 16.593 -17.179 1.945 1.00 0.00 O ATOM 24 CB ALA A 2 18.626 -14.705 0.287 1.00 0.00 C ATOM 0 H ALA A 2 18.493 -16.939 -0.704 1.00 0.00 H new ATOM 0 HA ALA A 2 19.325 -15.935 1.883 1.00 0.00 H new ATOM 0 HB1 ALA A 2 18.507 -13.832 0.929 1.00 0.00 H new ATOM 0 HB2 ALA A 2 19.598 -14.665 -0.204 1.00 0.00 H new ATOM 0 HB3 ALA A 2 17.839 -14.711 -0.467 1.00 0.00 H new ATOM 30 N ASP A 3 16.707 -15.000 2.442 1.00 0.00 N ATOM 31 CA ASP A 3 15.330 -14.876 2.926 1.00 0.00 C ATOM 32 C ASP A 3 14.364 -15.039 1.750 1.00 0.00 C ATOM 33 O ASP A 3 14.789 -15.100 0.594 1.00 0.00 O ATOM 34 CB ASP A 3 15.098 -13.501 3.562 1.00 0.00 C ATOM 35 CG ASP A 3 16.130 -13.155 4.619 1.00 0.00 C ATOM 36 OD1 ASP A 3 16.095 -13.709 5.736 1.00 0.00 O ATOM 37 OD2 ASP A 3 16.996 -12.302 4.323 1.00 0.00 O ATOM 0 H ASP A 3 17.264 -14.157 2.583 1.00 0.00 H new ATOM 0 HA ASP A 3 15.157 -15.649 3.675 1.00 0.00 H new ATOM 0 HB2 ASP A 3 15.115 -12.739 2.783 1.00 0.00 H new ATOM 0 HB3 ASP A 3 14.105 -13.477 4.010 1.00 0.00 H new ATOM 42 N LYS A 4 13.051 -15.041 1.999 1.00 0.00 N ATOM 43 CA LYS A 4 12.077 -15.022 0.909 1.00 0.00 C ATOM 44 C LYS A 4 12.152 -13.744 0.059 1.00 0.00 C ATOM 45 O LYS A 4 11.628 -13.750 -1.053 1.00 0.00 O ATOM 46 CB LYS A 4 10.673 -15.283 1.477 1.00 0.00 C ATOM 47 CG LYS A 4 9.602 -15.297 0.380 1.00 0.00 C ATOM 48 CD LYS A 4 8.343 -16.067 0.777 1.00 0.00 C ATOM 49 CE LYS A 4 7.216 -15.880 -0.250 1.00 0.00 C ATOM 50 NZ LYS A 4 7.648 -16.042 -1.657 1.00 0.00 N ATOM 0 H LYS A 4 12.644 -15.055 2.934 1.00 0.00 H new ATOM 0 HA LYS A 4 12.323 -15.825 0.214 1.00 0.00 H new ATOM 0 HB2 LYS A 4 10.666 -16.238 2.002 1.00 0.00 H new ATOM 0 HB3 LYS A 4 10.430 -14.514 2.211 1.00 0.00 H new ATOM 0 HG2 LYS A 4 9.330 -14.271 0.134 1.00 0.00 H new ATOM 0 HG3 LYS A 4 10.022 -15.741 -0.523 1.00 0.00 H new ATOM 0 HD2 LYS A 4 8.579 -17.127 0.870 1.00 0.00 H new ATOM 0 HD3 LYS A 4 8.003 -15.729 1.756 1.00 0.00 H new ATOM 0 HE2 LYS A 4 6.424 -16.599 -0.039 1.00 0.00 H new ATOM 0 HE3 LYS A 4 6.786 -14.886 -0.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 6.813 -16.053 -2.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 8.267 -15.250 -1.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 8.168 -16.937 -1.760 1.00 0.00 H new ATOM 64 N GLU A 5 12.794 -12.678 0.548 1.00 0.00 N ATOM 65 CA GLU A 5 12.800 -11.357 -0.074 1.00 0.00 C ATOM 66 C GLU A 5 11.366 -10.929 -0.418 1.00 0.00 C ATOM 67 O GLU A 5 11.036 -10.642 -1.571 1.00 0.00 O ATOM 68 CB GLU A 5 13.755 -11.298 -1.285 1.00 0.00 C ATOM 69 CG GLU A 5 15.241 -11.255 -0.902 1.00 0.00 C ATOM 70 CD GLU A 5 16.092 -10.851 -2.112 1.00 0.00 C ATOM 71 OE1 GLU A 5 16.019 -9.678 -2.546 1.00 0.00 O ATOM 72 OE2 GLU A 5 16.845 -11.691 -2.657 1.00 0.00 O ATOM 0 H GLU A 5 13.337 -12.715 1.411 1.00 0.00 H new ATOM 0 HA GLU A 5 13.192 -10.635 0.642 1.00 0.00 H new ATOM 0 HB2 GLU A 5 13.578 -12.167 -1.918 1.00 0.00 H new ATOM 0 HB3 GLU A 5 13.517 -10.416 -1.880 1.00 0.00 H new ATOM 0 HG2 GLU A 5 15.393 -10.545 -0.089 1.00 0.00 H new ATOM 0 HG3 GLU A 5 15.558 -12.232 -0.536 1.00 0.00 H new ATOM 79 N LEU A 6 10.486 -10.882 0.590 1.00 0.00 N ATOM 80 CA LEU A 6 9.221 -10.169 0.439 1.00 0.00 C ATOM 81 C LEU A 6 9.530 -8.705 0.115 1.00 0.00 C ATOM 82 O LEU A 6 10.063 -7.971 0.951 1.00 0.00 O ATOM 83 CB LEU A 6 8.328 -10.323 1.679 1.00 0.00 C ATOM 84 CG LEU A 6 7.024 -9.504 1.526 1.00 0.00 C ATOM 85 CD1 LEU A 6 5.776 -10.333 1.825 1.00 0.00 C ATOM 86 CD2 LEU A 6 7.031 -8.291 2.450 1.00 0.00 C ATOM 0 H LEU A 6 10.626 -11.321 1.500 1.00 0.00 H new ATOM 0 HA LEU A 6 8.649 -10.601 -0.382 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.086 -11.375 1.829 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.869 -9.991 2.565 1.00 0.00 H new ATOM 0 HG LEU A 6 6.989 -9.184 0.485 1.00 0.00 H new ATOM 0 HD11 LEU A 6 4.889 -9.712 1.703 1.00 0.00 H new ATOM 0 HD12 LEU A 6 5.726 -11.176 1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 6 5.822 -10.703 2.849 1.00 0.00 H new ATOM 0 HD21 LEU A 6 6.104 -7.732 2.324 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.117 -8.622 3.485 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.878 -7.650 2.203 1.00 0.00 H new ATOM 98 N LYS A 7 9.213 -8.297 -1.111 1.00 0.00 N ATOM 99 CA LYS A 7 9.386 -6.929 -1.583 1.00 0.00 C ATOM 100 C LYS A 7 8.083 -6.192 -1.281 1.00 0.00 C ATOM 101 O LYS A 7 7.002 -6.704 -1.601 1.00 0.00 O ATOM 102 CB LYS A 7 9.681 -6.933 -3.096 1.00 0.00 C ATOM 103 CG LYS A 7 10.143 -5.550 -3.594 1.00 0.00 C ATOM 104 CD LYS A 7 11.661 -5.336 -3.575 1.00 0.00 C ATOM 105 CE LYS A 7 12.288 -5.838 -4.880 1.00 0.00 C ATOM 106 NZ LYS A 7 13.703 -5.438 -5.006 1.00 0.00 N ATOM 0 H LYS A 7 8.821 -8.921 -1.816 1.00 0.00 H new ATOM 0 HA LYS A 7 10.224 -6.437 -1.089 1.00 0.00 H new ATOM 0 HB2 LYS A 7 10.451 -7.673 -3.314 1.00 0.00 H new ATOM 0 HB3 LYS A 7 8.786 -7.234 -3.640 1.00 0.00 H new ATOM 0 HG2 LYS A 7 9.782 -5.407 -4.613 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.674 -4.782 -2.979 1.00 0.00 H new ATOM 0 HD2 LYS A 7 11.884 -4.277 -3.441 1.00 0.00 H new ATOM 0 HD3 LYS A 7 12.098 -5.864 -2.727 1.00 0.00 H new ATOM 0 HE2 LYS A 7 12.214 -6.925 -4.923 1.00 0.00 H new ATOM 0 HE3 LYS A 7 11.724 -5.446 -5.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 14.087 -5.798 -5.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 13.773 -4.400 -4.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 14.247 -5.833 -4.213 1.00 0.00 H new ATOM 120 N PHE A 8 8.171 -5.004 -0.687 1.00 0.00 N ATOM 121 CA PHE A 8 7.043 -4.085 -0.589 1.00 0.00 C ATOM 122 C PHE A 8 7.005 -3.234 -1.858 1.00 0.00 C ATOM 123 O PHE A 8 8.036 -3.030 -2.496 1.00 0.00 O ATOM 124 CB PHE A 8 7.242 -3.180 0.637 1.00 0.00 C ATOM 125 CG PHE A 8 6.755 -3.728 1.963 1.00 0.00 C ATOM 126 CD1 PHE A 8 7.348 -4.865 2.541 1.00 0.00 C ATOM 127 CD2 PHE A 8 5.728 -3.062 2.652 1.00 0.00 C ATOM 128 CE1 PHE A 8 6.888 -5.341 3.782 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.259 -3.548 3.883 1.00 0.00 C ATOM 130 CZ PHE A 8 5.844 -4.687 4.455 1.00 0.00 C ATOM 0 H PHE A 8 9.028 -4.652 -0.260 1.00 0.00 H new ATOM 0 HA PHE A 8 6.107 -4.634 -0.483 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.305 -2.957 0.729 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.733 -2.234 0.450 1.00 0.00 H new ATOM 0 HD1 PHE A 8 8.155 -5.372 2.033 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.295 -2.167 2.231 1.00 0.00 H new ATOM 0 HE1 PHE A 8 7.342 -6.217 4.221 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.448 -3.045 4.389 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.494 -5.058 5.407 1.00 0.00 H new ATOM 140 N LEU A 9 5.861 -2.637 -2.179 1.00 0.00 N ATOM 141 CA LEU A 9 5.749 -1.568 -3.161 1.00 0.00 C ATOM 142 C LEU A 9 5.057 -0.397 -2.475 1.00 0.00 C ATOM 143 O LEU A 9 4.149 -0.624 -1.670 1.00 0.00 O ATOM 144 CB LEU A 9 4.957 -2.061 -4.386 1.00 0.00 C ATOM 145 CG LEU A 9 5.104 -1.148 -5.617 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.485 -1.266 -6.277 1.00 0.00 C ATOM 147 CD2 LEU A 9 4.037 -1.513 -6.651 1.00 0.00 C ATOM 0 H LEU A 9 4.969 -2.889 -1.754 1.00 0.00 H new ATOM 0 HA LEU A 9 6.728 -1.254 -3.523 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.292 -3.065 -4.646 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.902 -2.135 -4.122 1.00 0.00 H new ATOM 0 HG LEU A 9 4.983 -0.121 -5.271 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.534 -0.601 -7.139 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.256 -0.987 -5.559 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.646 -2.294 -6.602 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.140 -0.867 -7.523 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.163 -2.553 -6.952 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.047 -1.379 -6.215 1.00 0.00 H new ATOM 159 N VAL A 10 5.478 0.829 -2.780 1.00 0.00 N ATOM 160 CA VAL A 10 4.884 2.062 -2.288 1.00 0.00 C ATOM 161 C VAL A 10 4.692 2.959 -3.513 1.00 0.00 C ATOM 162 O VAL A 10 5.679 3.400 -4.107 1.00 0.00 O ATOM 163 CB VAL A 10 5.766 2.703 -1.189 1.00 0.00 C ATOM 164 CG1 VAL A 10 5.090 3.955 -0.604 1.00 0.00 C ATOM 165 CG2 VAL A 10 6.061 1.739 -0.024 1.00 0.00 C ATOM 0 H VAL A 10 6.272 0.993 -3.400 1.00 0.00 H new ATOM 0 HA VAL A 10 3.922 1.890 -1.804 1.00 0.00 H new ATOM 0 HB VAL A 10 6.705 2.962 -1.679 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.729 4.387 0.166 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.931 4.686 -1.396 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.130 3.680 -0.167 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.683 2.242 0.716 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.124 1.430 0.439 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.585 0.861 -0.402 1.00 0.00 H new ATOM 175 N VAL A 11 3.441 3.184 -3.924 1.00 0.00 N ATOM 176 CA VAL A 11 3.088 4.069 -5.036 1.00 0.00 C ATOM 177 C VAL A 11 2.085 5.091 -4.504 1.00 0.00 C ATOM 178 O VAL A 11 0.877 5.034 -4.735 1.00 0.00 O ATOM 179 CB VAL A 11 2.619 3.291 -6.283 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.738 4.181 -7.529 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.459 2.018 -6.476 1.00 0.00 C ATOM 0 H VAL A 11 2.631 2.748 -3.485 1.00 0.00 H new ATOM 0 HA VAL A 11 3.965 4.605 -5.401 1.00 0.00 H new ATOM 0 HB VAL A 11 1.577 3.004 -6.139 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.405 3.626 -8.406 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.116 5.068 -7.404 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.777 4.482 -7.663 1.00 0.00 H new ATOM 0 HG21 VAL A 11 3.112 1.484 -7.361 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.507 2.289 -6.604 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.354 1.377 -5.601 1.00 0.00 H new ATOM 191 N ASP A 12 2.612 5.977 -3.674 1.00 0.00 N ATOM 192 CA ASP A 12 1.980 7.196 -3.202 1.00 0.00 C ATOM 193 C ASP A 12 1.959 8.266 -4.302 1.00 0.00 C ATOM 194 O ASP A 12 2.578 8.124 -5.358 1.00 0.00 O ATOM 195 CB ASP A 12 2.783 7.732 -2.015 1.00 0.00 C ATOM 196 CG ASP A 12 4.184 8.067 -2.507 1.00 0.00 C ATOM 197 OD1 ASP A 12 4.977 7.113 -2.658 1.00 0.00 O ATOM 198 OD2 ASP A 12 4.443 9.229 -2.877 1.00 0.00 O ATOM 0 H ASP A 12 3.549 5.856 -3.289 1.00 0.00 H new ATOM 0 HA ASP A 12 0.953 6.970 -2.913 1.00 0.00 H new ATOM 0 HB2 ASP A 12 2.303 8.618 -1.599 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.826 6.990 -1.218 1.00 0.00 H new ATOM 203 N ASP A 13 1.275 9.371 -4.012 1.00 0.00 N ATOM 204 CA ASP A 13 1.090 10.549 -4.860 1.00 0.00 C ATOM 205 C ASP A 13 2.157 11.644 -4.657 1.00 0.00 C ATOM 206 O ASP A 13 2.338 12.513 -5.514 1.00 0.00 O ATOM 207 CB ASP A 13 -0.314 11.083 -4.540 1.00 0.00 C ATOM 208 CG ASP A 13 -0.595 12.476 -5.094 1.00 0.00 C ATOM 209 OD1 ASP A 13 -0.642 12.647 -6.333 1.00 0.00 O ATOM 210 OD2 ASP A 13 -0.806 13.401 -4.281 1.00 0.00 O ATOM 0 H ASP A 13 0.801 9.475 -3.115 1.00 0.00 H new ATOM 0 HA ASP A 13 1.199 10.262 -5.906 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -1.054 10.389 -4.939 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -0.446 11.101 -3.458 1.00 0.00 H new ATOM 215 N PHE A 14 2.896 11.638 -3.543 1.00 0.00 N ATOM 216 CA PHE A 14 3.727 12.757 -3.101 1.00 0.00 C ATOM 217 C PHE A 14 5.053 12.216 -2.581 1.00 0.00 C ATOM 218 O PHE A 14 5.041 11.606 -1.523 1.00 0.00 O ATOM 219 CB PHE A 14 2.992 13.545 -2.002 1.00 0.00 C ATOM 220 CG PHE A 14 3.722 14.760 -1.439 1.00 0.00 C ATOM 221 CD1 PHE A 14 4.486 15.617 -2.257 1.00 0.00 C ATOM 222 CD2 PHE A 14 3.587 15.071 -0.073 1.00 0.00 C ATOM 223 CE1 PHE A 14 5.082 16.769 -1.712 1.00 0.00 C ATOM 224 CE2 PHE A 14 4.153 16.242 0.464 1.00 0.00 C ATOM 225 CZ PHE A 14 4.896 17.099 -0.361 1.00 0.00 C ATOM 0 H PHE A 14 2.932 10.837 -2.912 1.00 0.00 H new ATOM 0 HA PHE A 14 3.921 13.431 -3.935 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.034 13.876 -2.401 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.776 12.864 -1.179 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.614 15.389 -3.305 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.040 14.400 0.573 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.688 17.405 -2.339 1.00 0.00 H new ATOM 0 HE2 PHE A 14 4.016 16.480 1.508 1.00 0.00 H new ATOM 0 HZ PHE A 14 5.322 18.006 0.041 1.00 0.00 H new ATOM 235 N SER A 15 6.191 12.469 -3.241 1.00 0.00 N ATOM 236 CA SER A 15 7.505 11.959 -2.823 1.00 0.00 C ATOM 237 C SER A 15 7.737 11.984 -1.297 1.00 0.00 C ATOM 238 O SER A 15 8.154 10.968 -0.734 1.00 0.00 O ATOM 239 CB SER A 15 8.620 12.723 -3.556 1.00 0.00 C ATOM 240 OG SER A 15 9.139 11.995 -4.655 1.00 0.00 O ATOM 0 H SER A 15 6.227 13.038 -4.087 1.00 0.00 H new ATOM 0 HA SER A 15 7.527 10.905 -3.102 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.232 13.679 -3.907 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.426 12.944 -2.856 1.00 0.00 H new ATOM 0 HG SER A 15 9.843 12.519 -5.091 1.00 0.00 H new ATOM 246 N THR A 16 7.423 13.084 -0.597 1.00 0.00 N ATOM 247 CA THR A 16 7.519 13.163 0.863 1.00 0.00 C ATOM 248 C THR A 16 6.785 12.002 1.542 1.00 0.00 C ATOM 249 O THR A 16 7.320 11.380 2.456 1.00 0.00 O ATOM 250 CB THR A 16 6.886 14.478 1.339 1.00 0.00 C ATOM 251 OG1 THR A 16 7.446 15.598 0.680 1.00 0.00 O ATOM 252 CG2 THR A 16 7.009 14.671 2.850 1.00 0.00 C ATOM 0 H THR A 16 7.094 13.946 -1.032 1.00 0.00 H new ATOM 0 HA THR A 16 8.574 13.113 1.131 1.00 0.00 H new ATOM 0 HB THR A 16 5.828 14.405 1.086 1.00 0.00 H new ATOM 0 HG1 THR A 16 6.728 16.150 0.305 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.546 15.616 3.135 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.507 13.851 3.364 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.062 14.684 3.131 1.00 0.00 H new ATOM 260 N MET A 17 5.567 11.700 1.101 1.00 0.00 N ATOM 261 CA MET A 17 4.765 10.585 1.563 1.00 0.00 C ATOM 262 C MET A 17 5.585 9.298 1.470 1.00 0.00 C ATOM 263 O MET A 17 5.571 8.529 2.428 1.00 0.00 O ATOM 264 CB MET A 17 3.461 10.506 0.743 1.00 0.00 C ATOM 265 CG MET A 17 2.231 10.200 1.593 1.00 0.00 C ATOM 266 SD MET A 17 0.698 9.776 0.719 1.00 0.00 S ATOM 267 CE MET A 17 0.429 11.232 -0.328 1.00 0.00 C ATOM 0 H MET A 17 5.098 12.252 0.383 1.00 0.00 H new ATOM 0 HA MET A 17 4.485 10.727 2.607 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.309 11.452 0.223 1.00 0.00 H new ATOM 0 HB3 MET A 17 3.567 9.736 -0.021 1.00 0.00 H new ATOM 0 HG2 MET A 17 2.479 9.374 2.259 1.00 0.00 H new ATOM 0 HG3 MET A 17 2.032 11.068 2.222 1.00 0.00 H new ATOM 0 HE1 MET A 17 -0.593 11.224 -0.707 1.00 0.00 H new ATOM 0 HE2 MET A 17 0.592 12.137 0.258 1.00 0.00 H new ATOM 0 HE3 MET A 17 1.126 11.212 -1.165 1.00 0.00 H new ATOM 277 N ARG A 18 6.367 9.079 0.401 1.00 0.00 N ATOM 278 CA ARG A 18 7.188 7.874 0.290 1.00 0.00 C ATOM 279 C ARG A 18 8.353 7.905 1.259 1.00 0.00 C ATOM 280 O ARG A 18 8.677 6.874 1.842 1.00 0.00 O ATOM 281 CB ARG A 18 7.722 7.689 -1.136 1.00 0.00 C ATOM 282 CG ARG A 18 8.077 6.210 -1.397 1.00 0.00 C ATOM 283 CD ARG A 18 7.862 5.760 -2.845 1.00 0.00 C ATOM 284 NE ARG A 18 8.629 6.581 -3.792 1.00 0.00 N ATOM 285 CZ ARG A 18 8.166 7.595 -4.530 1.00 0.00 C ATOM 286 NH1 ARG A 18 6.884 7.937 -4.503 1.00 0.00 N ATOM 287 NH2 ARG A 18 9.017 8.286 -5.279 1.00 0.00 N ATOM 0 H ARG A 18 6.445 9.718 -0.390 1.00 0.00 H new ATOM 0 HA ARG A 18 6.542 7.032 0.539 1.00 0.00 H new ATOM 0 HB2 ARG A 18 6.974 8.021 -1.856 1.00 0.00 H new ATOM 0 HB3 ARG A 18 8.605 8.312 -1.283 1.00 0.00 H new ATOM 0 HG2 ARG A 18 9.120 6.045 -1.128 1.00 0.00 H new ATOM 0 HG3 ARG A 18 7.476 5.582 -0.740 1.00 0.00 H new ATOM 0 HD2 ARG A 18 8.156 4.716 -2.948 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.801 5.818 -3.090 1.00 0.00 H new ATOM 0 HE ARG A 18 9.618 6.354 -3.897 1.00 0.00 H new ATOM 0 HH11 ARG A 18 6.231 7.423 -3.911 1.00 0.00 H new ATOM 0 HH12 ARG A 18 6.551 8.714 -5.074 1.00 0.00 H new ATOM 0 HH21 ARG A 18 10.007 8.040 -5.285 1.00 0.00 H new ATOM 0 HH22 ARG A 18 8.681 9.063 -5.848 1.00 0.00 H new ATOM 301 N ARG A 19 8.999 9.064 1.427 1.00 0.00 N ATOM 302 CA ARG A 19 10.092 9.244 2.384 1.00 0.00 C ATOM 303 C ARG A 19 9.596 8.816 3.763 1.00 0.00 C ATOM 304 O ARG A 19 10.205 7.948 4.399 1.00 0.00 O ATOM 305 CB ARG A 19 10.581 10.709 2.397 1.00 0.00 C ATOM 306 CG ARG A 19 11.158 11.224 1.073 1.00 0.00 C ATOM 307 CD ARG A 19 12.606 10.783 0.880 1.00 0.00 C ATOM 308 NE ARG A 19 13.539 11.550 1.727 1.00 0.00 N ATOM 309 CZ ARG A 19 14.737 12.051 1.398 1.00 0.00 C ATOM 310 NH1 ARG A 19 15.281 11.861 0.198 1.00 0.00 N ATOM 311 NH2 ARG A 19 15.399 12.766 2.298 1.00 0.00 N ATOM 0 H ARG A 19 8.776 9.907 0.899 1.00 0.00 H new ATOM 0 HA ARG A 19 10.944 8.629 2.093 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.747 11.350 2.683 1.00 0.00 H new ATOM 0 HB3 ARG A 19 11.343 10.813 3.170 1.00 0.00 H new ATOM 0 HG2 ARG A 19 10.552 10.857 0.245 1.00 0.00 H new ATOM 0 HG3 ARG A 19 11.103 12.312 1.051 1.00 0.00 H new ATOM 0 HD2 ARG A 19 12.695 9.722 1.113 1.00 0.00 H new ATOM 0 HD3 ARG A 19 12.885 10.904 -0.167 1.00 0.00 H new ATOM 0 HE ARG A 19 13.233 11.721 2.685 1.00 0.00 H new ATOM 0 HH11 ARG A 19 14.783 11.318 -0.508 1.00 0.00 H new ATOM 0 HH12 ARG A 19 16.196 12.258 -0.016 1.00 0.00 H new ATOM 0 HH21 ARG A 19 14.994 12.925 3.221 1.00 0.00 H new ATOM 0 HH22 ARG A 19 16.313 13.156 2.067 1.00 0.00 H new ATOM 325 N ILE A 20 8.487 9.415 4.196 1.00 0.00 N ATOM 326 CA ILE A 20 7.818 9.118 5.446 1.00 0.00 C ATOM 327 C ILE A 20 7.508 7.618 5.470 1.00 0.00 C ATOM 328 O ILE A 20 8.093 6.930 6.295 1.00 0.00 O ATOM 329 CB ILE A 20 6.619 10.079 5.649 1.00 0.00 C ATOM 330 CG1 ILE A 20 7.036 11.397 6.344 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.519 9.474 6.530 1.00 0.00 C ATOM 332 CD1 ILE A 20 8.043 12.272 5.596 1.00 0.00 C ATOM 0 H ILE A 20 8.019 10.146 3.660 1.00 0.00 H new ATOM 0 HA ILE A 20 8.444 9.306 6.318 1.00 0.00 H new ATOM 0 HB ILE A 20 6.251 10.263 4.640 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.138 11.988 6.523 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.456 11.151 7.319 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.705 10.190 6.638 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.142 8.563 6.066 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.928 9.239 7.512 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.256 13.165 6.183 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.965 11.713 5.440 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.627 12.562 4.631 1.00 0.00 H new ATOM 344 N VAL A 21 6.647 7.086 4.594 1.00 0.00 N ATOM 345 CA VAL A 21 6.239 5.678 4.604 1.00 0.00 C ATOM 346 C VAL A 21 7.452 4.741 4.682 1.00 0.00 C ATOM 347 O VAL A 21 7.420 3.817 5.491 1.00 0.00 O ATOM 348 CB VAL A 21 5.337 5.368 3.385 1.00 0.00 C ATOM 349 CG1 VAL A 21 5.074 3.867 3.188 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.964 6.036 3.535 1.00 0.00 C ATOM 0 H VAL A 21 6.209 7.629 3.850 1.00 0.00 H new ATOM 0 HA VAL A 21 5.651 5.497 5.504 1.00 0.00 H new ATOM 0 HB VAL A 21 5.885 5.755 2.526 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.435 3.721 2.317 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.021 3.349 3.035 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.579 3.465 4.072 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.349 5.803 2.666 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.475 5.664 4.436 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.091 7.116 3.610 1.00 0.00 H new ATOM 360 N ARG A 22 8.522 4.955 3.903 1.00 0.00 N ATOM 361 CA ARG A 22 9.684 4.073 3.977 1.00 0.00 C ATOM 362 C ARG A 22 10.350 4.171 5.349 1.00 0.00 C ATOM 363 O ARG A 22 10.727 3.131 5.874 1.00 0.00 O ATOM 364 CB ARG A 22 10.686 4.310 2.832 1.00 0.00 C ATOM 365 CG ARG A 22 11.532 3.036 2.615 1.00 0.00 C ATOM 366 CD ARG A 22 12.749 3.183 1.688 1.00 0.00 C ATOM 367 NE ARG A 22 12.461 3.851 0.404 1.00 0.00 N ATOM 368 CZ ARG A 22 12.839 3.440 -0.817 1.00 0.00 C ATOM 369 NH1 ARG A 22 13.296 2.215 -1.054 1.00 0.00 N ATOM 370 NH2 ARG A 22 12.759 4.273 -1.844 1.00 0.00 N ATOM 0 H ARG A 22 8.603 5.716 3.229 1.00 0.00 H new ATOM 0 HA ARG A 22 9.323 3.053 3.848 1.00 0.00 H new ATOM 0 HB2 ARG A 22 10.154 4.566 1.916 1.00 0.00 H new ATOM 0 HB3 ARG A 22 11.334 5.153 3.070 1.00 0.00 H new ATOM 0 HG2 ARG A 22 11.881 2.686 3.587 1.00 0.00 H new ATOM 0 HG3 ARG A 22 10.884 2.259 2.210 1.00 0.00 H new ATOM 0 HD2 ARG A 22 13.523 3.746 2.211 1.00 0.00 H new ATOM 0 HD3 ARG A 22 13.157 2.193 1.485 1.00 0.00 H new ATOM 0 HE ARG A 22 11.919 4.714 0.449 1.00 0.00 H new ATOM 0 HH11 ARG A 22 13.371 1.542 -0.291 1.00 0.00 H new ATOM 0 HH12 ARG A 22 13.572 1.947 -1.999 1.00 0.00 H new ATOM 0 HH21 ARG A 22 12.411 5.222 -1.705 1.00 0.00 H new ATOM 0 HH22 ARG A 22 13.045 3.966 -2.774 1.00 0.00 H new ATOM 384 N ASN A 23 10.459 5.357 5.962 1.00 0.00 N ATOM 385 CA ASN A 23 10.924 5.459 7.351 1.00 0.00 C ATOM 386 C ASN A 23 10.014 4.656 8.284 1.00 0.00 C ATOM 387 O ASN A 23 10.490 3.817 9.041 1.00 0.00 O ATOM 388 CB ASN A 23 11.007 6.922 7.819 1.00 0.00 C ATOM 389 CG ASN A 23 11.612 7.068 9.216 1.00 0.00 C ATOM 390 OD1 ASN A 23 12.297 6.191 9.730 1.00 0.00 O ATOM 391 ND2 ASN A 23 11.407 8.211 9.846 1.00 0.00 N ATOM 0 H ASN A 23 10.234 6.250 5.524 1.00 0.00 H new ATOM 0 HA ASN A 23 11.930 5.040 7.389 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.606 7.492 7.108 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.007 7.357 7.814 1.00 0.00 H new ATOM 0 HD21 ASN A 23 11.820 8.368 10.766 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.836 8.937 9.413 1.00 0.00 H new ATOM 398 N LEU A 24 8.698 4.878 8.212 1.00 0.00 N ATOM 399 CA LEU A 24 7.726 4.228 9.094 1.00 0.00 C ATOM 400 C LEU A 24 7.702 2.704 8.900 1.00 0.00 C ATOM 401 O LEU A 24 7.325 1.983 9.819 1.00 0.00 O ATOM 402 CB LEU A 24 6.307 4.766 8.856 1.00 0.00 C ATOM 403 CG LEU A 24 6.101 6.294 8.903 1.00 0.00 C ATOM 404 CD1 LEU A 24 4.646 6.555 8.517 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.495 7.008 10.202 1.00 0.00 C ATOM 0 H LEU A 24 8.276 5.516 7.537 1.00 0.00 H new ATOM 0 HA LEU A 24 8.044 4.456 10.111 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.974 4.413 7.880 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.649 4.316 9.599 1.00 0.00 H new ATOM 0 HG LEU A 24 6.804 6.737 8.198 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.451 7.627 8.536 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.461 6.170 7.514 1.00 0.00 H new ATOM 0 HD13 LEU A 24 3.986 6.054 9.225 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.301 8.076 10.104 1.00 0.00 H new ATOM 0 HD22 LEU A 24 5.909 6.607 11.029 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.555 6.849 10.397 1.00 0.00 H new ATOM 417 N LEU A 25 8.071 2.206 7.717 1.00 0.00 N ATOM 418 CA LEU A 25 8.253 0.785 7.443 1.00 0.00 C ATOM 419 C LEU A 25 9.583 0.303 8.001 1.00 0.00 C ATOM 420 O LEU A 25 9.624 -0.742 8.643 1.00 0.00 O ATOM 421 CB LEU A 25 8.194 0.515 5.929 1.00 0.00 C ATOM 422 CG LEU A 25 6.743 0.390 5.438 1.00 0.00 C ATOM 423 CD1 LEU A 25 6.652 0.583 3.923 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.177 -0.989 5.787 1.00 0.00 C ATOM 0 H LEU A 25 8.255 2.797 6.906 1.00 0.00 H new ATOM 0 HA LEU A 25 7.446 0.238 7.930 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.692 1.323 5.394 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.738 -0.402 5.700 1.00 0.00 H new ATOM 0 HG LEU A 25 6.165 1.169 5.935 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.613 0.489 3.606 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.024 1.573 3.659 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.254 -0.175 3.423 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.149 -1.061 5.432 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.780 -1.761 5.310 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.198 -1.128 6.868 1.00 0.00 H new ATOM 436 N LYS A 26 10.672 1.041 7.779 1.00 0.00 N ATOM 437 CA LYS A 26 11.999 0.656 8.246 1.00 0.00 C ATOM 438 C LYS A 26 12.179 0.829 9.748 1.00 0.00 C ATOM 439 O LYS A 26 13.154 0.304 10.288 1.00 0.00 O ATOM 440 CB LYS A 26 13.091 1.376 7.453 1.00 0.00 C ATOM 441 CG LYS A 26 13.182 0.855 6.006 1.00 0.00 C ATOM 442 CD LYS A 26 14.429 1.401 5.302 1.00 0.00 C ATOM 443 CE LYS A 26 15.674 0.670 5.822 1.00 0.00 C ATOM 444 NZ LYS A 26 16.905 1.464 5.673 1.00 0.00 N ATOM 0 H LYS A 26 10.655 1.924 7.269 1.00 0.00 H new ATOM 0 HA LYS A 26 12.097 -0.413 8.060 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.887 2.447 7.442 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.052 1.240 7.950 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.210 -0.235 6.009 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.290 1.149 5.453 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.339 1.266 4.224 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.522 2.472 5.483 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.532 0.423 6.874 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.787 -0.272 5.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.714 0.923 6.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.060 1.679 4.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.812 2.352 6.207 1.00 0.00 H new ATOM 458 N GLU A 27 11.246 1.468 10.448 1.00 0.00 N ATOM 459 CA GLU A 27 11.077 1.318 11.888 1.00 0.00 C ATOM 460 C GLU A 27 10.872 -0.153 12.237 1.00 0.00 C ATOM 461 O GLU A 27 11.349 -0.621 13.268 1.00 0.00 O ATOM 462 CB GLU A 27 9.830 2.090 12.343 1.00 0.00 C ATOM 463 CG GLU A 27 10.110 3.565 12.617 1.00 0.00 C ATOM 464 CD GLU A 27 11.014 3.782 13.833 1.00 0.00 C ATOM 465 OE1 GLU A 27 11.114 2.905 14.720 1.00 0.00 O ATOM 466 OE2 GLU A 27 11.599 4.886 13.930 1.00 0.00 O ATOM 0 H GLU A 27 10.578 2.112 10.025 1.00 0.00 H new ATOM 0 HA GLU A 27 11.968 1.703 12.385 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.059 2.008 11.577 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.432 1.627 13.246 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.577 4.011 11.739 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.166 4.086 12.775 1.00 0.00 H new ATOM 473 N LEU A 28 10.159 -0.882 11.385 1.00 0.00 N ATOM 474 CA LEU A 28 9.600 -2.199 11.650 1.00 0.00 C ATOM 475 C LEU A 28 10.339 -3.295 10.867 1.00 0.00 C ATOM 476 O LEU A 28 10.052 -4.471 11.076 1.00 0.00 O ATOM 477 CB LEU A 28 8.093 -2.172 11.321 1.00 0.00 C ATOM 478 CG LEU A 28 7.290 -1.031 11.986 1.00 0.00 C ATOM 479 CD1 LEU A 28 5.901 -0.920 11.355 1.00 0.00 C ATOM 480 CD2 LEU A 28 7.154 -1.225 13.502 1.00 0.00 C ATOM 0 H LEU A 28 9.946 -0.552 10.444 1.00 0.00 H new ATOM 0 HA LEU A 28 9.730 -2.443 12.704 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.976 -2.094 10.240 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.656 -3.124 11.621 1.00 0.00 H new ATOM 0 HG LEU A 28 7.846 -0.109 11.817 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.347 -0.112 11.834 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.001 -0.710 10.290 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.364 -1.858 11.491 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.582 -0.399 13.925 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.638 -2.164 13.704 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.145 -1.250 13.956 1.00 0.00 H new ATOM 492 N GLY A 29 11.298 -2.940 10.005 1.00 0.00 N ATOM 493 CA GLY A 29 12.160 -3.850 9.259 1.00 0.00 C ATOM 494 C GLY A 29 11.998 -3.574 7.773 1.00 0.00 C ATOM 495 O GLY A 29 12.392 -2.508 7.309 1.00 0.00 O ATOM 0 H GLY A 29 11.500 -1.961 9.802 1.00 0.00 H new ATOM 0 HA2 GLY A 29 13.200 -3.713 9.557 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.898 -4.884 9.481 1.00 0.00 H new ATOM 499 N PHE A 30 11.376 -4.509 7.056 1.00 0.00 N ATOM 500 CA PHE A 30 10.837 -4.392 5.699 1.00 0.00 C ATOM 501 C PHE A 30 11.748 -3.597 4.761 1.00 0.00 C ATOM 502 O PHE A 30 11.332 -2.656 4.080 1.00 0.00 O ATOM 503 CB PHE A 30 9.401 -3.860 5.793 1.00 0.00 C ATOM 504 CG PHE A 30 8.550 -4.630 6.792 1.00 0.00 C ATOM 505 CD1 PHE A 30 8.471 -6.038 6.730 1.00 0.00 C ATOM 506 CD2 PHE A 30 7.934 -3.950 7.860 1.00 0.00 C ATOM 507 CE1 PHE A 30 7.784 -6.754 7.724 1.00 0.00 C ATOM 508 CE2 PHE A 30 7.246 -4.673 8.850 1.00 0.00 C ATOM 509 CZ PHE A 30 7.165 -6.073 8.782 1.00 0.00 C ATOM 0 H PHE A 30 11.223 -5.442 7.438 1.00 0.00 H new ATOM 0 HA PHE A 30 10.803 -5.376 5.230 1.00 0.00 H new ATOM 0 HB2 PHE A 30 9.426 -2.808 6.079 1.00 0.00 H new ATOM 0 HB3 PHE A 30 8.934 -3.912 4.809 1.00 0.00 H new ATOM 0 HD1 PHE A 30 8.941 -6.567 5.914 1.00 0.00 H new ATOM 0 HD2 PHE A 30 7.990 -2.873 7.919 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.732 -7.832 7.673 1.00 0.00 H new ATOM 0 HE2 PHE A 30 6.776 -4.148 9.669 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.628 -6.623 9.541 1.00 0.00 H new ATOM 519 N ASN A 31 13.028 -3.971 4.749 1.00 0.00 N ATOM 520 CA ASN A 31 14.114 -3.126 4.272 1.00 0.00 C ATOM 521 C ASN A 31 14.104 -2.929 2.754 1.00 0.00 C ATOM 522 O ASN A 31 14.926 -2.155 2.257 1.00 0.00 O ATOM 523 CB ASN A 31 15.471 -3.709 4.712 1.00 0.00 C ATOM 524 CG ASN A 31 15.653 -3.679 6.225 1.00 0.00 C ATOM 525 OD1 ASN A 31 14.946 -4.353 6.969 1.00 0.00 O ATOM 526 ND2 ASN A 31 16.597 -2.909 6.725 1.00 0.00 N ATOM 0 H ASN A 31 13.340 -4.885 5.077 1.00 0.00 H new ATOM 0 HA ASN A 31 13.962 -2.144 4.720 1.00 0.00 H new ATOM 0 HB2 ASN A 31 15.553 -4.737 4.359 1.00 0.00 H new ATOM 0 HB3 ASN A 31 16.276 -3.145 4.241 1.00 0.00 H new ATOM 0 HD21 ASN A 31 16.743 -2.871 7.734 1.00 0.00 H new ATOM 0 HD22 ASN A 31 17.182 -2.351 6.104 1.00 0.00 H new ATOM 533 N ASN A 32 13.217 -3.590 2.004 1.00 0.00 N ATOM 534 CA ASN A 32 13.228 -3.658 0.549 1.00 0.00 C ATOM 535 C ASN A 32 11.836 -3.335 0.061 1.00 0.00 C ATOM 536 O ASN A 32 11.057 -4.209 -0.325 1.00 0.00 O ATOM 537 CB ASN A 32 13.736 -5.007 0.022 1.00 0.00 C ATOM 538 CG ASN A 32 15.251 -5.085 0.164 1.00 0.00 C ATOM 539 OD1 ASN A 32 15.967 -4.239 -0.371 1.00 0.00 O ATOM 540 ND2 ASN A 32 15.765 -6.025 0.930 1.00 0.00 N ATOM 0 H ASN A 32 12.443 -4.111 2.415 1.00 0.00 H new ATOM 0 HA ASN A 32 13.935 -2.927 0.156 1.00 0.00 H new ATOM 0 HB2 ASN A 32 13.268 -5.822 0.574 1.00 0.00 H new ATOM 0 HB3 ASN A 32 13.454 -5.128 -1.024 1.00 0.00 H new ATOM 0 HD21 ASN A 32 16.772 -6.060 1.088 1.00 0.00 H new ATOM 0 HD22 ASN A 32 15.156 -6.718 1.365 1.00 0.00 H new ATOM 547 N VAL A 33 11.533 -2.045 0.090 1.00 0.00 N ATOM 548 CA VAL A 33 10.404 -1.521 -0.639 1.00 0.00 C ATOM 549 C VAL A 33 10.900 -1.159 -2.045 1.00 0.00 C ATOM 550 O VAL A 33 12.105 -0.974 -2.267 1.00 0.00 O ATOM 551 CB VAL A 33 9.727 -0.375 0.150 1.00 0.00 C ATOM 552 CG1 VAL A 33 9.725 -0.587 1.685 1.00 0.00 C ATOM 553 CG2 VAL A 33 10.377 0.985 -0.102 1.00 0.00 C ATOM 0 H VAL A 33 12.059 -1.346 0.614 1.00 0.00 H new ATOM 0 HA VAL A 33 9.606 -2.254 -0.757 1.00 0.00 H new ATOM 0 HB VAL A 33 8.704 -0.390 -0.225 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.234 0.257 2.168 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.188 -1.505 1.925 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.752 -0.663 2.043 1.00 0.00 H new ATOM 0 HG21 VAL A 33 9.859 1.749 0.478 1.00 0.00 H new ATOM 0 HG22 VAL A 33 11.424 0.949 0.198 1.00 0.00 H new ATOM 0 HG23 VAL A 33 10.312 1.229 -1.162 1.00 0.00 H new ATOM 563 N GLU A 34 9.966 -1.024 -2.971 1.00 0.00 N ATOM 564 CA GLU A 34 10.156 -0.576 -4.337 1.00 0.00 C ATOM 565 C GLU A 34 9.121 0.511 -4.627 1.00 0.00 C ATOM 566 O GLU A 34 8.219 0.768 -3.822 1.00 0.00 O ATOM 567 CB GLU A 34 10.022 -1.778 -5.292 1.00 0.00 C ATOM 568 CG GLU A 34 11.357 -2.273 -5.839 1.00 0.00 C ATOM 569 CD GLU A 34 11.987 -1.331 -6.873 1.00 0.00 C ATOM 570 OE1 GLU A 34 11.594 -0.145 -6.947 1.00 0.00 O ATOM 571 OE2 GLU A 34 12.864 -1.799 -7.631 1.00 0.00 O ATOM 0 H GLU A 34 8.989 -1.240 -2.773 1.00 0.00 H new ATOM 0 HA GLU A 34 11.151 -0.156 -4.484 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.528 -2.596 -4.767 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.378 -1.499 -6.126 1.00 0.00 H new ATOM 0 HG2 GLU A 34 12.052 -2.406 -5.010 1.00 0.00 H new ATOM 0 HG3 GLU A 34 11.212 -3.253 -6.294 1.00 0.00 H new ATOM 578 N GLU A 35 9.259 1.152 -5.782 1.00 0.00 N ATOM 579 CA GLU A 35 8.608 2.412 -6.115 1.00 0.00 C ATOM 580 C GLU A 35 8.148 2.328 -7.570 1.00 0.00 C ATOM 581 O GLU A 35 8.826 1.685 -8.381 1.00 0.00 O ATOM 582 CB GLU A 35 9.619 3.564 -5.939 1.00 0.00 C ATOM 583 CG GLU A 35 10.389 3.519 -4.609 1.00 0.00 C ATOM 584 CD GLU A 35 11.467 4.589 -4.532 1.00 0.00 C ATOM 585 OE1 GLU A 35 12.624 4.287 -4.911 1.00 0.00 O ATOM 586 OE2 GLU A 35 11.229 5.682 -3.974 1.00 0.00 O ATOM 0 H GLU A 35 9.846 0.797 -6.536 1.00 0.00 H new ATOM 0 HA GLU A 35 7.753 2.597 -5.465 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.333 3.537 -6.762 1.00 0.00 H new ATOM 0 HB3 GLU A 35 9.089 4.514 -6.009 1.00 0.00 H new ATOM 0 HG2 GLU A 35 9.691 3.649 -3.782 1.00 0.00 H new ATOM 0 HG3 GLU A 35 10.846 2.537 -4.489 1.00 0.00 H new ATOM 593 N ALA A 36 7.041 2.988 -7.921 1.00 0.00 N ATOM 594 CA ALA A 36 6.542 3.036 -9.291 1.00 0.00 C ATOM 595 C ALA A 36 6.259 4.484 -9.691 1.00 0.00 C ATOM 596 O ALA A 36 6.240 5.368 -8.831 1.00 0.00 O ATOM 597 CB ALA A 36 5.298 2.156 -9.429 1.00 0.00 C ATOM 0 H ALA A 36 6.465 3.506 -7.257 1.00 0.00 H new ATOM 0 HA ALA A 36 7.300 2.644 -9.969 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.934 2.199 -10.455 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.551 1.126 -9.177 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.522 2.515 -8.753 1.00 0.00 H new ATOM 603 N GLU A 37 6.037 4.731 -10.982 1.00 0.00 N ATOM 604 CA GLU A 37 5.738 6.070 -11.478 1.00 0.00 C ATOM 605 C GLU A 37 4.312 6.497 -11.126 1.00 0.00 C ATOM 606 O GLU A 37 4.066 7.694 -10.960 1.00 0.00 O ATOM 607 CB GLU A 37 5.931 6.161 -13.002 1.00 0.00 C ATOM 608 CG GLU A 37 7.360 5.815 -13.442 1.00 0.00 C ATOM 609 CD GLU A 37 7.789 6.586 -14.694 1.00 0.00 C ATOM 610 OE1 GLU A 37 7.229 6.359 -15.788 1.00 0.00 O ATOM 611 OE2 GLU A 37 8.723 7.416 -14.598 1.00 0.00 O ATOM 0 H GLU A 37 6.059 4.013 -11.707 1.00 0.00 H new ATOM 0 HA GLU A 37 6.439 6.745 -10.988 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.231 5.485 -13.493 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.687 7.170 -13.335 1.00 0.00 H new ATOM 0 HG2 GLU A 37 8.051 6.036 -12.628 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.428 4.745 -13.637 1.00 0.00 H new ATOM 618 N ASP A 38 3.367 5.553 -11.048 1.00 0.00 N ATOM 619 CA ASP A 38 1.930 5.795 -10.869 1.00 0.00 C ATOM 620 C ASP A 38 1.240 4.438 -10.724 1.00 0.00 C ATOM 621 O ASP A 38 1.883 3.412 -10.941 1.00 0.00 O ATOM 622 CB ASP A 38 1.329 6.554 -12.080 1.00 0.00 C ATOM 623 CG ASP A 38 0.886 7.975 -11.728 1.00 0.00 C ATOM 624 OD1 ASP A 38 0.374 8.191 -10.607 1.00 0.00 O ATOM 625 OD2 ASP A 38 1.077 8.882 -12.568 1.00 0.00 O ATOM 0 H ASP A 38 3.591 4.560 -11.110 1.00 0.00 H new ATOM 0 HA ASP A 38 1.777 6.412 -9.983 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.068 6.596 -12.880 1.00 0.00 H new ATOM 0 HB3 ASP A 38 0.475 5.997 -12.465 1.00 0.00 H new ATOM 630 N GLY A 39 -0.056 4.403 -10.403 1.00 0.00 N ATOM 631 CA GLY A 39 -0.853 3.178 -10.270 1.00 0.00 C ATOM 632 C GLY A 39 -0.705 2.211 -11.454 1.00 0.00 C ATOM 633 O GLY A 39 -0.597 1.000 -11.259 1.00 0.00 O ATOM 0 H GLY A 39 -0.596 5.249 -10.223 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.562 2.664 -9.354 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -1.903 3.449 -10.163 1.00 0.00 H new ATOM 637 N VAL A 40 -0.643 2.729 -12.680 1.00 0.00 N ATOM 638 CA VAL A 40 -0.463 1.916 -13.880 1.00 0.00 C ATOM 639 C VAL A 40 0.903 1.204 -13.831 1.00 0.00 C ATOM 640 O VAL A 40 0.983 -0.006 -14.071 1.00 0.00 O ATOM 641 CB VAL A 40 -0.653 2.803 -15.132 1.00 0.00 C ATOM 642 CG1 VAL A 40 -0.581 1.972 -16.421 1.00 0.00 C ATOM 643 CG2 VAL A 40 -2.006 3.545 -15.100 1.00 0.00 C ATOM 0 H VAL A 40 -0.717 3.729 -12.869 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.216 1.130 -13.931 1.00 0.00 H new ATOM 0 HB VAL A 40 0.158 3.531 -15.122 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.718 2.625 -17.283 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.392 1.485 -16.486 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.366 1.215 -16.410 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.106 4.159 -15.995 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.818 2.819 -15.066 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.051 4.182 -14.217 1.00 0.00 H new ATOM 653 N ASP A 41 1.975 1.921 -13.464 1.00 0.00 N ATOM 654 CA ASP A 41 3.287 1.307 -13.261 1.00 0.00 C ATOM 655 C ASP A 41 3.265 0.412 -12.018 1.00 0.00 C ATOM 656 O ASP A 41 4.025 -0.546 -11.956 1.00 0.00 O ATOM 657 CB ASP A 41 4.415 2.344 -13.145 1.00 0.00 C ATOM 658 CG ASP A 41 5.828 1.723 -13.098 1.00 0.00 C ATOM 659 OD1 ASP A 41 6.106 0.640 -13.680 1.00 0.00 O ATOM 660 OD2 ASP A 41 6.740 2.355 -12.511 1.00 0.00 O ATOM 0 H ASP A 41 1.955 2.928 -13.302 1.00 0.00 H new ATOM 0 HA ASP A 41 3.496 0.704 -14.145 1.00 0.00 H new ATOM 0 HB2 ASP A 41 4.356 3.028 -13.992 1.00 0.00 H new ATOM 0 HB3 ASP A 41 4.259 2.938 -12.245 1.00 0.00 H new ATOM 665 N ALA A 42 2.386 0.663 -11.040 1.00 0.00 N ATOM 666 CA ALA A 42 2.279 -0.159 -9.847 1.00 0.00 C ATOM 667 C ALA A 42 1.891 -1.568 -10.265 1.00 0.00 C ATOM 668 O ALA A 42 2.623 -2.504 -9.958 1.00 0.00 O ATOM 669 CB ALA A 42 1.288 0.416 -8.825 1.00 0.00 C ATOM 0 H ALA A 42 1.732 1.445 -11.062 1.00 0.00 H new ATOM 0 HA ALA A 42 3.246 -0.175 -9.344 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.246 -0.236 -7.953 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.616 1.410 -8.520 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.298 0.483 -9.276 1.00 0.00 H new ATOM 675 N LEU A 43 0.788 -1.717 -11.008 1.00 0.00 N ATOM 676 CA LEU A 43 0.329 -3.019 -11.501 1.00 0.00 C ATOM 677 C LEU A 43 1.435 -3.714 -12.319 1.00 0.00 C ATOM 678 O LEU A 43 1.687 -4.925 -12.181 1.00 0.00 O ATOM 679 CB LEU A 43 -0.953 -2.836 -12.330 1.00 0.00 C ATOM 680 CG LEU A 43 -1.774 -4.139 -12.398 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.755 -4.256 -11.227 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.549 -4.217 -13.713 1.00 0.00 C ATOM 0 H LEU A 43 0.190 -0.938 -11.284 1.00 0.00 H new ATOM 0 HA LEU A 43 0.101 -3.663 -10.652 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.561 -2.044 -11.892 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.692 -2.516 -13.339 1.00 0.00 H new ATOM 0 HG LEU A 43 -1.066 -4.966 -12.338 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.314 -5.188 -11.312 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.203 -4.249 -10.287 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.447 -3.414 -11.247 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.123 -5.143 -13.743 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.228 -3.367 -13.786 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.850 -4.196 -14.549 1.00 0.00 H new ATOM 694 N ASN A 44 2.116 -2.930 -13.163 1.00 0.00 N ATOM 695 CA ASN A 44 3.257 -3.389 -13.946 1.00 0.00 C ATOM 696 C ASN A 44 4.392 -3.918 -13.055 1.00 0.00 C ATOM 697 O ASN A 44 4.987 -4.941 -13.380 1.00 0.00 O ATOM 698 CB ASN A 44 3.761 -2.288 -14.883 1.00 0.00 C ATOM 699 CG ASN A 44 5.103 -2.681 -15.482 1.00 0.00 C ATOM 700 OD1 ASN A 44 5.186 -3.630 -16.263 1.00 0.00 O ATOM 701 ND2 ASN A 44 6.161 -1.991 -15.094 1.00 0.00 N ATOM 0 H ASN A 44 1.884 -1.949 -13.319 1.00 0.00 H new ATOM 0 HA ASN A 44 2.912 -4.223 -14.557 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.036 -2.117 -15.678 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.860 -1.351 -14.335 1.00 0.00 H new ATOM 0 HD21 ASN A 44 7.087 -2.238 -15.443 1.00 0.00 H new ATOM 0 HD22 ASN A 44 6.052 -1.211 -14.446 1.00 0.00 H new ATOM 708 N LYS A 45 4.690 -3.271 -11.926 1.00 0.00 N ATOM 709 CA LYS A 45 5.667 -3.784 -10.964 1.00 0.00 C ATOM 710 C LYS A 45 5.184 -5.123 -10.422 1.00 0.00 C ATOM 711 O LYS A 45 5.976 -6.059 -10.372 1.00 0.00 O ATOM 712 CB LYS A 45 5.919 -2.779 -9.826 1.00 0.00 C ATOM 713 CG LYS A 45 6.522 -1.451 -10.314 1.00 0.00 C ATOM 714 CD LYS A 45 8.041 -1.389 -10.155 1.00 0.00 C ATOM 715 CE LYS A 45 8.625 -0.147 -10.837 1.00 0.00 C ATOM 716 NZ LYS A 45 8.491 -0.165 -12.311 1.00 0.00 N ATOM 0 H LYS A 45 4.265 -2.384 -11.655 1.00 0.00 H new ATOM 0 HA LYS A 45 6.620 -3.928 -11.473 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.979 -2.577 -9.313 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.591 -3.229 -9.095 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.266 -1.306 -11.364 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.071 -0.628 -9.760 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.297 -1.378 -9.096 1.00 0.00 H new ATOM 0 HD3 LYS A 45 8.490 -2.286 -10.583 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.128 0.740 -10.446 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.680 -0.062 -10.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 8.994 0.651 -12.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 8.900 -1.045 -12.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.485 -0.114 -12.569 1.00 0.00 H new ATOM 730 N LEU A 46 3.898 -5.258 -10.069 1.00 0.00 N ATOM 731 CA LEU A 46 3.373 -6.510 -9.514 1.00 0.00 C ATOM 732 C LEU A 46 3.600 -7.667 -10.483 1.00 0.00 C ATOM 733 O LEU A 46 4.012 -8.738 -10.037 1.00 0.00 O ATOM 734 CB LEU A 46 1.879 -6.463 -9.150 1.00 0.00 C ATOM 735 CG LEU A 46 1.395 -5.161 -8.516 1.00 0.00 C ATOM 736 CD1 LEU A 46 -0.098 -5.211 -8.259 1.00 0.00 C ATOM 737 CD2 LEU A 46 2.122 -4.735 -7.240 1.00 0.00 C ATOM 0 H LEU A 46 3.204 -4.516 -10.158 1.00 0.00 H new ATOM 0 HA LEU A 46 3.927 -6.660 -8.587 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.297 -6.644 -10.054 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.665 -7.282 -8.463 1.00 0.00 H new ATOM 0 HG LEU A 46 1.637 -4.398 -9.256 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.421 -4.273 -7.807 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.625 -5.360 -9.202 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.323 -6.036 -7.583 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.699 -3.799 -6.875 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.005 -5.507 -6.479 1.00 0.00 H new ATOM 0 HD23 LEU A 46 3.181 -4.595 -7.454 1.00 0.00 H new ATOM 749 N GLN A 47 3.345 -7.479 -11.788 1.00 0.00 N ATOM 750 CA GLN A 47 3.627 -8.567 -12.745 1.00 0.00 C ATOM 751 C GLN A 47 5.124 -8.840 -12.959 1.00 0.00 C ATOM 752 O GLN A 47 5.467 -9.846 -13.584 1.00 0.00 O ATOM 753 CB GLN A 47 2.940 -8.355 -14.108 1.00 0.00 C ATOM 754 CG GLN A 47 3.443 -7.098 -14.834 1.00 0.00 C ATOM 755 CD GLN A 47 2.967 -6.925 -16.273 1.00 0.00 C ATOM 756 OE1 GLN A 47 2.418 -7.834 -16.898 1.00 0.00 O ATOM 757 NE2 GLN A 47 3.233 -5.771 -16.861 1.00 0.00 N ATOM 0 H GLN A 47 2.962 -6.626 -12.194 1.00 0.00 H new ATOM 0 HA GLN A 47 3.200 -9.450 -12.269 1.00 0.00 H new ATOM 0 HB2 GLN A 47 3.113 -9.228 -14.738 1.00 0.00 H new ATOM 0 HB3 GLN A 47 1.863 -8.278 -13.960 1.00 0.00 H new ATOM 0 HG2 GLN A 47 3.134 -6.223 -14.262 1.00 0.00 H new ATOM 0 HG3 GLN A 47 4.533 -7.112 -14.831 1.00 0.00 H new ATOM 0 HE21 GLN A 47 3.688 -5.024 -16.336 1.00 0.00 H new ATOM 0 HE22 GLN A 47 2.983 -5.628 -17.840 1.00 0.00 H new ATOM 766 N ALA A 48 6.010 -7.947 -12.518 1.00 0.00 N ATOM 767 CA ALA A 48 7.441 -7.986 -12.799 1.00 0.00 C ATOM 768 C ALA A 48 8.248 -8.665 -11.689 1.00 0.00 C ATOM 769 O ALA A 48 9.473 -8.764 -11.807 1.00 0.00 O ATOM 770 CB ALA A 48 7.959 -6.557 -13.024 1.00 0.00 C ATOM 0 H ALA A 48 5.741 -7.153 -11.937 1.00 0.00 H new ATOM 0 HA ALA A 48 7.577 -8.585 -13.699 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.028 -6.586 -13.234 1.00 0.00 H new ATOM 0 HB2 ALA A 48 7.436 -6.109 -13.869 1.00 0.00 H new ATOM 0 HB3 ALA A 48 7.781 -5.960 -12.129 1.00 0.00 H new ATOM 776 N GLY A 49 7.628 -9.096 -10.591 1.00 0.00 N ATOM 777 CA GLY A 49 8.331 -9.694 -9.465 1.00 0.00 C ATOM 778 C GLY A 49 7.383 -10.519 -8.611 1.00 0.00 C ATOM 779 O GLY A 49 6.186 -10.594 -8.893 1.00 0.00 O ATOM 0 H GLY A 49 6.618 -9.038 -10.460 1.00 0.00 H new ATOM 0 HA2 GLY A 49 9.141 -10.326 -9.830 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.786 -8.911 -8.858 1.00 0.00 H new ATOM 783 N GLY A 50 7.905 -11.120 -7.544 1.00 0.00 N ATOM 784 CA GLY A 50 7.105 -11.679 -6.468 1.00 0.00 C ATOM 785 C GLY A 50 6.969 -10.621 -5.385 1.00 0.00 C ATOM 786 O GLY A 50 7.662 -10.693 -4.364 1.00 0.00 O ATOM 0 H GLY A 50 8.909 -11.231 -7.405 1.00 0.00 H new ATOM 0 HA2 GLY A 50 6.123 -11.975 -6.837 1.00 0.00 H new ATOM 0 HA3 GLY A 50 7.578 -12.576 -6.068 1.00 0.00 H new ATOM 790 N TYR A 51 6.118 -9.622 -5.603 1.00 0.00 N ATOM 791 CA TYR A 51 5.789 -8.658 -4.562 1.00 0.00 C ATOM 792 C TYR A 51 4.934 -9.341 -3.503 1.00 0.00 C ATOM 793 O TYR A 51 4.290 -10.356 -3.778 1.00 0.00 O ATOM 794 CB TYR A 51 5.063 -7.453 -5.168 1.00 0.00 C ATOM 795 CG TYR A 51 6.031 -6.509 -5.838 1.00 0.00 C ATOM 796 CD1 TYR A 51 6.503 -6.760 -7.141 1.00 0.00 C ATOM 797 CD2 TYR A 51 6.523 -5.415 -5.109 1.00 0.00 C ATOM 798 CE1 TYR A 51 7.469 -5.912 -7.711 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.462 -4.550 -5.687 1.00 0.00 C ATOM 800 CZ TYR A 51 7.942 -4.795 -6.993 1.00 0.00 C ATOM 801 OH TYR A 51 8.845 -3.960 -7.573 1.00 0.00 O ATOM 0 H TYR A 51 5.645 -9.461 -6.492 1.00 0.00 H new ATOM 0 HA TYR A 51 6.703 -8.293 -4.094 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.326 -7.797 -5.894 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.518 -6.924 -4.387 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.124 -7.602 -7.701 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.177 -5.240 -4.101 1.00 0.00 H new ATOM 0 HE1 TYR A 51 7.849 -6.117 -8.701 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.819 -3.695 -5.133 1.00 0.00 H new ATOM 0 HH TYR A 51 8.539 -3.033 -7.483 1.00 0.00 H new ATOM 811 N GLY A 52 4.905 -8.764 -2.303 1.00 0.00 N ATOM 812 CA GLY A 52 4.062 -9.257 -1.222 1.00 0.00 C ATOM 813 C GLY A 52 3.278 -8.164 -0.507 1.00 0.00 C ATOM 814 O GLY A 52 2.526 -8.483 0.408 1.00 0.00 O ATOM 0 H GLY A 52 5.463 -7.946 -2.056 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.362 -9.989 -1.625 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.686 -9.778 -0.496 1.00 0.00 H new ATOM 818 N PHE A 53 3.442 -6.891 -0.885 1.00 0.00 N ATOM 819 CA PHE A 53 2.788 -5.751 -0.250 1.00 0.00 C ATOM 820 C PHE A 53 2.617 -4.646 -1.281 1.00 0.00 C ATOM 821 O PHE A 53 3.564 -4.379 -2.022 1.00 0.00 O ATOM 822 CB PHE A 53 3.662 -5.242 0.907 1.00 0.00 C ATOM 823 CG PHE A 53 3.120 -5.582 2.272 1.00 0.00 C ATOM 824 CD1 PHE A 53 3.387 -6.835 2.853 1.00 0.00 C ATOM 825 CD2 PHE A 53 2.356 -4.632 2.967 1.00 0.00 C ATOM 826 CE1 PHE A 53 2.894 -7.143 4.128 1.00 0.00 C ATOM 827 CE2 PHE A 53 1.890 -4.927 4.254 1.00 0.00 C ATOM 828 CZ PHE A 53 2.151 -6.185 4.833 1.00 0.00 C ATOM 0 H PHE A 53 4.049 -6.623 -1.660 1.00 0.00 H new ATOM 0 HA PHE A 53 1.814 -6.049 0.138 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.662 -5.664 0.808 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.763 -4.160 0.825 1.00 0.00 H new ATOM 0 HD1 PHE A 53 3.975 -7.563 2.314 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.129 -3.679 2.512 1.00 0.00 H new ATOM 0 HE1 PHE A 53 3.085 -8.112 4.565 1.00 0.00 H new ATOM 0 HE2 PHE A 53 1.328 -4.187 4.805 1.00 0.00 H new ATOM 0 HZ PHE A 53 1.778 -6.412 5.821 1.00 0.00 H new ATOM 838 N VAL A 54 1.452 -3.994 -1.311 1.00 0.00 N ATOM 839 CA VAL A 54 1.117 -3.013 -2.341 1.00 0.00 C ATOM 840 C VAL A 54 0.494 -1.785 -1.657 1.00 0.00 C ATOM 841 O VAL A 54 -0.722 -1.651 -1.563 1.00 0.00 O ATOM 842 CB VAL A 54 0.189 -3.666 -3.396 1.00 0.00 C ATOM 843 CG1 VAL A 54 0.226 -2.911 -4.726 1.00 0.00 C ATOM 844 CG2 VAL A 54 0.538 -5.121 -3.706 1.00 0.00 C ATOM 0 H VAL A 54 0.715 -4.133 -0.620 1.00 0.00 H new ATOM 0 HA VAL A 54 2.004 -2.676 -2.878 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.801 -3.623 -2.941 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.437 -3.399 -5.440 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.102 -1.883 -4.570 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.244 -2.912 -5.117 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.154 -5.510 -4.452 1.00 0.00 H new ATOM 0 HG22 VAL A 54 1.556 -5.177 -4.091 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.462 -5.715 -2.796 1.00 0.00 H new ATOM 854 N ILE A 55 1.322 -0.906 -1.095 1.00 0.00 N ATOM 855 CA ILE A 55 0.835 0.298 -0.430 1.00 0.00 C ATOM 856 C ILE A 55 0.705 1.363 -1.524 1.00 0.00 C ATOM 857 O ILE A 55 1.580 1.459 -2.394 1.00 0.00 O ATOM 858 CB ILE A 55 1.825 0.664 0.699 1.00 0.00 C ATOM 859 CG1 ILE A 55 1.576 -0.264 1.912 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.653 2.110 1.185 1.00 0.00 C ATOM 861 CD1 ILE A 55 2.867 -0.781 2.535 1.00 0.00 C ATOM 0 H ILE A 55 2.337 -1.007 -1.088 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.137 0.181 0.050 1.00 0.00 H new ATOM 0 HB ILE A 55 2.830 0.548 0.292 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.005 0.277 2.667 1.00 0.00 H new ATOM 0 HG13 ILE A 55 0.966 -1.110 1.597 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.372 2.315 1.978 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.823 2.796 0.355 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.642 2.247 1.568 1.00 0.00 H new ATOM 0 HD11 ILE A 55 2.630 -1.426 3.381 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.428 -1.348 1.792 1.00 0.00 H new ATOM 0 HD13 ILE A 55 3.468 0.061 2.878 1.00 0.00 H new ATOM 873 N SER A 56 -0.351 2.180 -1.496 1.00 0.00 N ATOM 874 CA SER A 56 -0.500 3.252 -2.472 1.00 0.00 C ATOM 875 C SER A 56 -1.240 4.451 -1.892 1.00 0.00 C ATOM 876 O SER A 56 -1.880 4.344 -0.845 1.00 0.00 O ATOM 877 CB SER A 56 -1.223 2.711 -3.719 1.00 0.00 C ATOM 878 OG SER A 56 -2.578 2.373 -3.452 1.00 0.00 O ATOM 0 H SER A 56 -1.106 2.118 -0.814 1.00 0.00 H new ATOM 0 HA SER A 56 0.494 3.602 -2.752 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.187 3.459 -4.511 1.00 0.00 H new ATOM 0 HB3 SER A 56 -0.697 1.831 -4.088 1.00 0.00 H new ATOM 0 HG SER A 56 -3.115 3.191 -3.399 1.00 0.00 H new ATOM 884 N ASP A 57 -1.197 5.570 -2.616 1.00 0.00 N ATOM 885 CA ASP A 57 -2.187 6.635 -2.466 1.00 0.00 C ATOM 886 C ASP A 57 -3.442 6.171 -3.241 1.00 0.00 C ATOM 887 O ASP A 57 -3.658 4.969 -3.454 1.00 0.00 O ATOM 888 CB ASP A 57 -1.611 7.995 -2.921 1.00 0.00 C ATOM 889 CG ASP A 57 -2.542 9.181 -2.627 1.00 0.00 C ATOM 890 OD1 ASP A 57 -2.627 9.619 -1.460 1.00 0.00 O ATOM 891 OD2 ASP A 57 -3.265 9.650 -3.527 1.00 0.00 O ATOM 0 H ASP A 57 -0.481 5.762 -3.317 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.463 6.807 -1.426 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.655 8.161 -2.424 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -1.411 7.956 -3.992 1.00 0.00 H new ATOM 896 N TRP A 58 -4.293 7.105 -3.644 1.00 0.00 N ATOM 897 CA TRP A 58 -5.546 6.909 -4.327 1.00 0.00 C ATOM 898 C TRP A 58 -5.548 7.662 -5.658 1.00 0.00 C ATOM 899 O TRP A 58 -6.042 7.135 -6.654 1.00 0.00 O ATOM 900 CB TRP A 58 -6.646 7.437 -3.402 1.00 0.00 C ATOM 901 CG TRP A 58 -8.031 7.178 -3.883 1.00 0.00 C ATOM 902 CD1 TRP A 58 -8.656 7.827 -4.890 1.00 0.00 C ATOM 903 CD2 TRP A 58 -8.973 6.183 -3.399 1.00 0.00 C ATOM 904 NE1 TRP A 58 -9.918 7.303 -5.057 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.177 6.304 -4.149 1.00 0.00 C ATOM 906 CE3 TRP A 58 -8.927 5.194 -2.397 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.305 5.518 -3.885 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -10.045 4.386 -2.141 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.231 4.562 -2.862 1.00 0.00 C ATOM 0 H TRP A 58 -4.101 8.094 -3.485 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.709 5.855 -4.552 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -6.525 6.983 -2.418 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.513 8.512 -3.276 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -8.232 8.631 -5.473 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.579 7.617 -5.767 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -8.024 5.057 -1.821 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.212 5.645 -4.457 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -9.990 3.621 -1.380 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.095 3.958 -2.629 1.00 0.00 H new ATOM 920 N ASN A 59 -5.033 8.892 -5.680 1.00 0.00 N ATOM 921 CA ASN A 59 -5.332 9.894 -6.701 1.00 0.00 C ATOM 922 C ASN A 59 -4.446 9.737 -7.945 1.00 0.00 C ATOM 923 O ASN A 59 -3.919 10.730 -8.463 1.00 0.00 O ATOM 924 CB ASN A 59 -5.197 11.300 -6.080 1.00 0.00 C ATOM 925 CG ASN A 59 -6.256 11.655 -5.039 1.00 0.00 C ATOM 926 OD1 ASN A 59 -7.234 10.943 -4.819 1.00 0.00 O ATOM 927 ND2 ASN A 59 -6.087 12.792 -4.384 1.00 0.00 N ATOM 0 H ASN A 59 -4.381 9.226 -4.971 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.356 9.749 -7.044 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -4.214 11.382 -5.617 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -5.235 12.039 -6.881 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -6.772 13.086 -3.688 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -5.272 13.374 -4.575 1.00 0.00 H new ATOM 934 N MET A 60 -4.240 8.511 -8.431 1.00 0.00 N ATOM 935 CA MET A 60 -3.407 8.252 -9.607 1.00 0.00 C ATOM 936 C MET A 60 -4.303 8.265 -10.853 1.00 0.00 C ATOM 937 O MET A 60 -5.454 7.829 -10.766 1.00 0.00 O ATOM 938 CB MET A 60 -2.666 6.914 -9.469 1.00 0.00 C ATOM 939 CG MET A 60 -1.664 6.910 -8.301 1.00 0.00 C ATOM 940 SD MET A 60 -2.338 6.489 -6.667 1.00 0.00 S ATOM 941 CE MET A 60 -2.586 4.705 -6.870 1.00 0.00 C ATOM 0 H MET A 60 -4.646 7.670 -8.020 1.00 0.00 H new ATOM 0 HA MET A 60 -2.648 9.029 -9.699 1.00 0.00 H new ATOM 0 HB2 MET A 60 -3.392 6.114 -9.323 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.137 6.698 -10.397 1.00 0.00 H new ATOM 0 HG2 MET A 60 -0.868 6.204 -8.535 1.00 0.00 H new ATOM 0 HG3 MET A 60 -1.206 7.897 -8.239 1.00 0.00 H new ATOM 0 HE1 MET A 60 -2.896 4.270 -5.920 1.00 0.00 H new ATOM 0 HE2 MET A 60 -3.358 4.528 -7.619 1.00 0.00 H new ATOM 0 HE3 MET A 60 -1.653 4.242 -7.193 1.00 0.00 H new ATOM 951 N PRO A 61 -3.840 8.761 -12.012 1.00 0.00 N ATOM 952 CA PRO A 61 -4.662 8.830 -13.212 1.00 0.00 C ATOM 953 C PRO A 61 -4.886 7.444 -13.814 1.00 0.00 C ATOM 954 O PRO A 61 -4.082 6.531 -13.619 1.00 0.00 O ATOM 955 CB PRO A 61 -3.903 9.732 -14.177 1.00 0.00 C ATOM 956 CG PRO A 61 -2.446 9.533 -13.773 1.00 0.00 C ATOM 957 CD PRO A 61 -2.516 9.299 -12.267 1.00 0.00 C ATOM 0 HA PRO A 61 -5.655 9.223 -12.992 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -4.075 9.446 -15.215 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -4.209 10.774 -14.079 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -2.000 8.683 -14.290 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -1.841 10.407 -14.015 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -1.742 8.603 -11.943 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -2.359 10.228 -11.719 1.00 0.00 H new ATOM 965 N ASN A 62 -5.943 7.330 -14.624 1.00 0.00 N ATOM 966 CA ASN A 62 -6.499 6.102 -15.189 1.00 0.00 C ATOM 967 C ASN A 62 -6.811 5.070 -14.109 1.00 0.00 C ATOM 968 O ASN A 62 -7.971 4.899 -13.730 1.00 0.00 O ATOM 969 CB ASN A 62 -5.647 5.547 -16.353 1.00 0.00 C ATOM 970 CG ASN A 62 -6.447 5.559 -17.644 1.00 0.00 C ATOM 971 OD1 ASN A 62 -7.156 4.609 -17.968 1.00 0.00 O ATOM 972 ND2 ASN A 62 -6.398 6.648 -18.385 1.00 0.00 N ATOM 0 H ASN A 62 -6.468 8.153 -14.921 1.00 0.00 H new ATOM 0 HA ASN A 62 -7.458 6.359 -15.639 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -4.745 6.147 -16.471 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.326 4.530 -16.125 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -6.953 6.709 -19.239 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -5.805 7.429 -18.105 1.00 0.00 H new ATOM 979 N MET A 63 -5.788 4.380 -13.616 1.00 0.00 N ATOM 980 CA MET A 63 -5.887 3.401 -12.561 1.00 0.00 C ATOM 981 C MET A 63 -5.679 4.130 -11.232 1.00 0.00 C ATOM 982 O MET A 63 -4.557 4.190 -10.724 1.00 0.00 O ATOM 983 CB MET A 63 -4.887 2.266 -12.839 1.00 0.00 C ATOM 984 CG MET A 63 -5.084 1.085 -11.887 1.00 0.00 C ATOM 985 SD MET A 63 -4.213 -0.436 -12.362 1.00 0.00 S ATOM 986 CE MET A 63 -5.272 -0.979 -13.735 1.00 0.00 C ATOM 0 H MET A 63 -4.835 4.498 -13.959 1.00 0.00 H new ATOM 0 HA MET A 63 -6.866 2.923 -12.511 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.002 1.926 -13.868 1.00 0.00 H new ATOM 0 HB3 MET A 63 -3.870 2.646 -12.740 1.00 0.00 H new ATOM 0 HG2 MET A 63 -4.752 1.380 -10.892 1.00 0.00 H new ATOM 0 HG3 MET A 63 -6.150 0.869 -11.816 1.00 0.00 H new ATOM 0 HE1 MET A 63 -4.968 -1.975 -14.057 1.00 0.00 H new ATOM 0 HE2 MET A 63 -6.311 -1.005 -13.405 1.00 0.00 H new ATOM 0 HE3 MET A 63 -5.173 -0.283 -14.568 1.00 0.00 H new ATOM 996 N ASP A 64 -6.769 4.679 -10.678 1.00 0.00 N ATOM 997 CA ASP A 64 -6.799 5.174 -9.297 1.00 0.00 C ATOM 998 C ASP A 64 -6.383 4.029 -8.368 1.00 0.00 C ATOM 999 O ASP A 64 -6.479 2.857 -8.738 1.00 0.00 O ATOM 1000 CB ASP A 64 -8.208 5.602 -8.837 1.00 0.00 C ATOM 1001 CG ASP A 64 -8.962 6.628 -9.680 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -8.736 7.846 -9.520 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -9.898 6.224 -10.411 1.00 0.00 O ATOM 0 H ASP A 64 -7.653 4.792 -11.175 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.135 6.037 -9.258 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -8.824 4.705 -8.774 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.121 6.001 -7.826 1.00 0.00 H new ATOM 1008 N GLY A 65 -6.064 4.323 -7.108 1.00 0.00 N ATOM 1009 CA GLY A 65 -5.795 3.299 -6.101 1.00 0.00 C ATOM 1010 C GLY A 65 -6.947 2.297 -5.964 1.00 0.00 C ATOM 1011 O GLY A 65 -6.710 1.127 -5.665 1.00 0.00 O ATOM 0 H GLY A 65 -5.985 5.278 -6.757 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.882 2.765 -6.365 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.617 3.778 -5.138 1.00 0.00 H new ATOM 1015 N LEU A 66 -8.194 2.715 -6.210 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.353 1.833 -6.093 1.00 0.00 C ATOM 1017 C LEU A 66 -9.503 0.934 -7.319 1.00 0.00 C ATOM 1018 O LEU A 66 -10.001 -0.190 -7.214 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.612 2.683 -5.848 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.734 2.056 -4.999 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.679 1.120 -5.738 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -11.211 1.284 -3.786 1.00 0.00 C ATOM 0 H LEU A 66 -8.424 3.668 -6.493 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.208 1.166 -5.243 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.304 3.611 -5.367 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -11.032 2.951 -6.818 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.292 2.942 -4.696 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.428 0.737 -5.045 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -13.174 1.664 -6.543 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.113 0.288 -6.157 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.051 0.867 -3.230 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.561 0.476 -4.122 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.648 1.958 -3.141 1.00 0.00 H new ATOM 1034 N GLU A 67 -9.052 1.397 -8.483 1.00 0.00 N ATOM 1035 CA GLU A 67 -8.970 0.581 -9.684 1.00 0.00 C ATOM 1036 C GLU A 67 -7.812 -0.395 -9.538 1.00 0.00 C ATOM 1037 O GLU A 67 -7.996 -1.581 -9.797 1.00 0.00 O ATOM 1038 CB GLU A 67 -8.804 1.465 -10.929 1.00 0.00 C ATOM 1039 CG GLU A 67 -10.029 2.352 -11.183 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.310 1.519 -11.250 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.426 0.610 -12.108 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -12.147 1.658 -10.329 1.00 0.00 O ATOM 0 H GLU A 67 -8.732 2.356 -8.616 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.895 0.018 -9.810 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.922 2.094 -10.810 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.630 0.833 -11.800 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.115 3.094 -10.389 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.898 2.899 -12.117 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.655 0.069 -9.058 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.485 -0.744 -8.749 1.00 0.00 C ATOM 1051 C LEU A 68 -5.898 -1.886 -7.822 1.00 0.00 C ATOM 1052 O LEU A 68 -5.650 -3.046 -8.142 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.393 0.156 -8.136 1.00 0.00 C ATOM 1054 CG LEU A 68 -3.078 -0.559 -7.779 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.350 -1.100 -9.016 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -2.150 0.419 -7.047 1.00 0.00 C ATOM 0 H LEU A 68 -6.506 1.060 -8.868 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.070 -1.192 -9.651 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -4.172 0.960 -8.838 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.792 0.621 -7.234 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.333 -1.407 -7.144 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.429 -1.595 -8.709 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -2.991 -1.815 -9.532 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.112 -0.275 -9.688 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.218 -0.085 -6.793 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.938 1.271 -7.692 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.635 0.767 -6.135 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.593 -1.576 -6.722 1.00 0.00 N ATOM 1069 CA LEU A 69 -7.126 -2.554 -5.781 1.00 0.00 C ATOM 1070 C LEU A 69 -8.044 -3.532 -6.502 1.00 0.00 C ATOM 1071 O LEU A 69 -7.787 -4.729 -6.432 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.829 -1.840 -4.611 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.819 -2.691 -3.779 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.372 -4.076 -3.277 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -9.207 -1.894 -2.532 1.00 0.00 C ATOM 0 H LEU A 69 -6.803 -0.613 -6.459 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.307 -3.135 -5.357 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -7.064 -1.452 -3.939 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -8.369 -0.981 -5.010 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.618 -2.893 -4.492 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.182 -4.537 -2.713 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.118 -4.707 -4.129 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.499 -3.966 -2.634 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.905 -2.476 -1.931 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.314 -1.679 -1.945 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.679 -0.958 -2.831 1.00 0.00 H new ATOM 1087 N LYS A 70 -9.122 -3.091 -7.161 1.00 0.00 N ATOM 1088 CA LYS A 70 -10.049 -4.088 -7.723 1.00 0.00 C ATOM 1089 C LYS A 70 -9.405 -4.894 -8.855 1.00 0.00 C ATOM 1090 O LYS A 70 -9.773 -6.056 -9.026 1.00 0.00 O ATOM 1091 CB LYS A 70 -11.401 -3.503 -8.154 1.00 0.00 C ATOM 1092 CG LYS A 70 -12.252 -3.020 -6.968 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.733 -2.834 -7.352 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.418 -1.875 -6.370 1.00 0.00 C ATOM 1095 NZ LYS A 70 -15.841 -1.640 -6.680 1.00 0.00 N ATOM 0 H LYS A 70 -9.368 -2.113 -7.314 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.266 -4.772 -6.902 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.229 -2.669 -8.834 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.957 -4.258 -8.709 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.177 -3.739 -6.153 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.853 -2.076 -6.597 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.807 -2.442 -8.366 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -14.242 -3.798 -7.345 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.335 -2.279 -5.361 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -13.890 -0.922 -6.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.245 -0.985 -5.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.926 -1.227 -7.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -16.357 -2.542 -6.647 1.00 0.00 H new ATOM 1109 N THR A 71 -8.449 -4.335 -9.596 1.00 0.00 N ATOM 1110 CA THR A 71 -7.667 -5.059 -10.589 1.00 0.00 C ATOM 1111 C THR A 71 -6.876 -6.161 -9.882 1.00 0.00 C ATOM 1112 O THR A 71 -7.028 -7.334 -10.220 1.00 0.00 O ATOM 1113 CB THR A 71 -6.774 -4.074 -11.364 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.581 -3.080 -11.955 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.973 -4.737 -12.484 1.00 0.00 C ATOM 0 H THR A 71 -8.194 -3.350 -9.520 1.00 0.00 H new ATOM 0 HA THR A 71 -8.312 -5.538 -11.326 1.00 0.00 H new ATOM 0 HB THR A 71 -6.072 -3.662 -10.639 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.705 -2.341 -11.323 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.365 -3.987 -12.990 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.325 -5.505 -12.062 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.657 -5.193 -13.200 1.00 0.00 H new ATOM 1123 N ILE A 72 -6.074 -5.808 -8.871 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.290 -6.725 -8.043 1.00 0.00 C ATOM 1125 C ILE A 72 -6.216 -7.836 -7.534 1.00 0.00 C ATOM 1126 O ILE A 72 -5.974 -9.016 -7.769 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.623 -5.907 -6.905 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.390 -5.172 -7.464 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -4.183 -6.751 -5.700 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -2.819 -4.144 -6.479 1.00 0.00 C ATOM 0 H ILE A 72 -5.950 -4.833 -8.598 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.491 -7.208 -8.605 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.383 -5.214 -6.545 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.618 -5.901 -7.711 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.661 -4.669 -8.392 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.727 -6.105 -4.950 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.051 -7.250 -5.269 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.459 -7.498 -6.024 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.952 -3.656 -6.924 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.579 -3.397 -6.252 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.520 -4.648 -5.560 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.305 -7.444 -6.871 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.239 -8.329 -6.192 1.00 0.00 C ATOM 1144 C ARG A 73 -8.837 -9.374 -7.135 1.00 0.00 C ATOM 1145 O ARG A 73 -9.175 -10.456 -6.667 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.314 -7.449 -5.519 1.00 0.00 C ATOM 1147 CG ARG A 73 -10.145 -8.185 -4.461 1.00 0.00 C ATOM 1148 CD ARG A 73 -11.423 -8.810 -5.032 1.00 0.00 C ATOM 1149 NE ARG A 73 -11.930 -9.856 -4.136 1.00 0.00 N ATOM 1150 CZ ARG A 73 -13.201 -10.067 -3.776 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -14.174 -9.230 -4.136 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -13.500 -11.132 -3.046 1.00 0.00 N ATOM 0 H ARG A 73 -7.566 -6.461 -6.792 1.00 0.00 H new ATOM 0 HA ARG A 73 -7.716 -8.910 -5.432 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -8.828 -6.591 -5.054 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -9.983 -7.059 -6.286 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.536 -8.967 -4.008 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -10.412 -7.488 -3.667 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -12.182 -8.040 -5.167 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -11.220 -9.233 -6.016 1.00 0.00 H new ATOM 0 HE ARG A 73 -11.236 -10.493 -3.744 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -13.957 -8.407 -4.698 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -15.136 -9.412 -3.849 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -12.765 -11.780 -2.765 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -14.466 -11.303 -2.765 1.00 0.00 H new ATOM 1166 N ALA A 74 -8.996 -9.050 -8.422 1.00 0.00 N ATOM 1167 CA ALA A 74 -9.741 -9.851 -9.381 1.00 0.00 C ATOM 1168 C ALA A 74 -9.236 -11.296 -9.427 1.00 0.00 C ATOM 1169 O ALA A 74 -10.031 -12.217 -9.217 1.00 0.00 O ATOM 1170 CB ALA A 74 -9.685 -9.186 -10.759 1.00 0.00 C ATOM 0 H ALA A 74 -8.599 -8.203 -8.829 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.782 -9.900 -9.060 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.244 -9.787 -11.476 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.124 -8.190 -10.701 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.647 -9.106 -11.083 1.00 0.00 H new ATOM 1176 N ASP A 75 -7.947 -11.493 -9.732 1.00 0.00 N ATOM 1177 CA ASP A 75 -7.189 -12.733 -9.541 1.00 0.00 C ATOM 1178 C ASP A 75 -5.719 -12.492 -9.909 1.00 0.00 C ATOM 1179 O ASP A 75 -5.295 -11.338 -9.999 1.00 0.00 O ATOM 1180 CB ASP A 75 -7.760 -13.941 -10.319 1.00 0.00 C ATOM 1181 CG ASP A 75 -7.748 -15.217 -9.464 1.00 0.00 C ATOM 1182 OD1 ASP A 75 -6.985 -15.309 -8.475 1.00 0.00 O ATOM 1183 OD2 ASP A 75 -8.575 -16.112 -9.760 1.00 0.00 O ATOM 0 H ASP A 75 -7.376 -10.752 -10.140 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.275 -13.000 -8.488 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -8.780 -13.723 -10.635 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -7.174 -14.102 -11.224 1.00 0.00 H new ATOM 1188 N GLY A 76 -4.943 -13.553 -10.158 1.00 0.00 N ATOM 1189 CA GLY A 76 -3.656 -13.477 -10.844 1.00 0.00 C ATOM 1190 C GLY A 76 -2.498 -13.566 -9.863 1.00 0.00 C ATOM 1191 O GLY A 76 -1.487 -12.885 -10.040 1.00 0.00 O ATOM 0 H GLY A 76 -5.199 -14.501 -9.883 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -3.581 -14.285 -11.571 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -3.593 -12.541 -11.400 1.00 0.00 H new ATOM 1195 N ALA A 77 -2.679 -14.333 -8.784 1.00 0.00 N ATOM 1196 CA ALA A 77 -1.963 -14.325 -7.510 1.00 0.00 C ATOM 1197 C ALA A 77 -2.276 -13.066 -6.699 1.00 0.00 C ATOM 1198 O ALA A 77 -2.437 -13.143 -5.478 1.00 0.00 O ATOM 1199 CB ALA A 77 -0.455 -14.520 -7.693 1.00 0.00 C ATOM 0 H ALA A 77 -3.407 -15.048 -8.784 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.323 -15.181 -6.938 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.034 -14.507 -6.719 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -0.268 -15.477 -8.180 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.056 -13.715 -8.310 1.00 0.00 H new ATOM 1205 N MET A 78 -2.420 -11.927 -7.382 1.00 0.00 N ATOM 1206 CA MET A 78 -2.644 -10.612 -6.797 1.00 0.00 C ATOM 1207 C MET A 78 -3.949 -10.547 -5.996 1.00 0.00 C ATOM 1208 O MET A 78 -4.082 -9.709 -5.111 1.00 0.00 O ATOM 1209 CB MET A 78 -2.576 -9.506 -7.870 1.00 0.00 C ATOM 1210 CG MET A 78 -1.554 -9.768 -8.981 1.00 0.00 C ATOM 1211 SD MET A 78 -1.151 -8.336 -10.017 1.00 0.00 S ATOM 1212 CE MET A 78 0.094 -9.102 -11.089 1.00 0.00 C ATOM 0 H MET A 78 -2.381 -11.900 -8.401 1.00 0.00 H new ATOM 0 HA MET A 78 -1.836 -10.435 -6.087 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.562 -9.391 -8.319 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.334 -8.560 -7.385 1.00 0.00 H new ATOM 0 HG2 MET A 78 -0.635 -10.137 -8.526 1.00 0.00 H new ATOM 0 HG3 MET A 78 -1.934 -10.564 -9.622 1.00 0.00 H new ATOM 0 HE1 MET A 78 0.463 -8.365 -11.802 1.00 0.00 H new ATOM 0 HE2 MET A 78 0.923 -9.466 -10.482 1.00 0.00 H new ATOM 0 HE3 MET A 78 -0.354 -9.936 -11.629 1.00 0.00 H new ATOM 1222 N SER A 79 -4.844 -11.507 -6.200 1.00 0.00 N ATOM 1223 CA SER A 79 -6.046 -11.769 -5.419 1.00 0.00 C ATOM 1224 C SER A 79 -5.781 -11.701 -3.907 1.00 0.00 C ATOM 1225 O SER A 79 -6.640 -11.228 -3.157 1.00 0.00 O ATOM 1226 CB SER A 79 -6.629 -13.137 -5.838 1.00 0.00 C ATOM 1227 OG SER A 79 -5.731 -13.890 -6.658 1.00 0.00 O ATOM 0 H SER A 79 -4.741 -12.169 -6.969 1.00 0.00 H new ATOM 0 HA SER A 79 -6.778 -10.988 -5.628 1.00 0.00 H new ATOM 0 HB2 SER A 79 -6.870 -13.714 -4.945 1.00 0.00 H new ATOM 0 HB3 SER A 79 -7.563 -12.980 -6.378 1.00 0.00 H new ATOM 0 HG SER A 79 -6.234 -14.564 -7.161 1.00 0.00 H new ATOM 1233 N ALA A 80 -4.585 -12.115 -3.465 1.00 0.00 N ATOM 1234 CA ALA A 80 -4.166 -12.168 -2.070 1.00 0.00 C ATOM 1235 C ALA A 80 -3.074 -11.148 -1.714 1.00 0.00 C ATOM 1236 O ALA A 80 -2.555 -11.196 -0.591 1.00 0.00 O ATOM 1237 CB ALA A 80 -3.669 -13.582 -1.779 1.00 0.00 C ATOM 0 H ALA A 80 -3.856 -12.435 -4.103 1.00 0.00 H new ATOM 0 HA ALA A 80 -5.028 -11.908 -1.455 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.349 -13.648 -0.739 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.474 -14.295 -1.957 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.828 -13.814 -2.433 1.00 0.00 H new ATOM 1243 N LEU A 81 -2.672 -10.255 -2.626 1.00 0.00 N ATOM 1244 CA LEU A 81 -1.756 -9.167 -2.284 1.00 0.00 C ATOM 1245 C LEU A 81 -2.484 -8.236 -1.314 1.00 0.00 C ATOM 1246 O LEU A 81 -3.573 -7.772 -1.666 1.00 0.00 O ATOM 1247 CB LEU A 81 -1.331 -8.350 -3.519 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.074 -8.847 -4.258 1.00 0.00 C ATOM 1249 CD1 LEU A 81 0.178 -7.986 -5.511 1.00 0.00 C ATOM 1250 CD2 LEU A 81 1.173 -8.789 -3.362 1.00 0.00 C ATOM 0 H LEU A 81 -2.967 -10.266 -3.602 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.855 -9.598 -1.847 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.162 -8.337 -4.225 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.161 -7.319 -3.207 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.254 -9.884 -4.540 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.069 -8.345 -6.026 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.681 -8.056 -6.179 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.324 -6.947 -5.215 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.038 -9.148 -3.919 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.346 -7.760 -3.045 1.00 0.00 H new ATOM 0 HD23 LEU A 81 1.020 -9.418 -2.485 1.00 0.00 H new ATOM 1262 N PRO A 82 -1.929 -7.933 -0.127 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.488 -6.901 0.718 1.00 0.00 C ATOM 1264 C PRO A 82 -2.264 -5.542 0.047 1.00 0.00 C ATOM 1265 O PRO A 82 -1.118 -5.180 -0.249 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.766 -7.015 2.062 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.414 -7.619 1.695 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.725 -8.486 0.473 1.00 0.00 C ATOM 0 HA PRO A 82 -3.562 -7.007 0.872 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.654 -6.042 2.540 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.313 -7.651 2.758 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.320 -6.847 1.462 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -0.005 -8.212 2.513 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.104 -8.471 -0.235 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -0.878 -9.526 0.763 1.00 0.00 H new ATOM 1276 N VAL A 83 -3.347 -4.788 -0.161 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.268 -3.394 -0.581 1.00 0.00 C ATOM 1278 C VAL A 83 -3.589 -2.515 0.625 1.00 0.00 C ATOM 1279 O VAL A 83 -4.471 -2.856 1.423 1.00 0.00 O ATOM 1280 CB VAL A 83 -4.130 -3.083 -1.825 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -4.084 -4.171 -2.912 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.598 -2.846 -1.475 1.00 0.00 C ATOM 0 H VAL A 83 -4.300 -5.130 -0.042 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.255 -3.174 -0.917 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.679 -2.173 -2.221 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.715 -3.875 -3.750 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -3.058 -4.297 -3.258 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.446 -5.113 -2.500 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.159 -2.632 -2.385 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -6.007 -3.737 -0.998 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.677 -2.000 -0.792 1.00 0.00 H new ATOM 1292 N LEU A 84 -2.901 -1.385 0.769 1.00 0.00 N ATOM 1293 CA LEU A 84 -3.061 -0.496 1.912 1.00 0.00 C ATOM 1294 C LEU A 84 -3.070 0.937 1.404 1.00 0.00 C ATOM 1295 O LEU A 84 -2.053 1.434 0.914 1.00 0.00 O ATOM 1296 CB LEU A 84 -1.949 -0.767 2.937 1.00 0.00 C ATOM 1297 CG LEU A 84 -1.953 0.152 4.173 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.326 0.232 4.838 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -0.933 -0.355 5.202 1.00 0.00 C ATOM 0 H LEU A 84 -2.213 -1.060 0.090 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.005 -0.674 2.427 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.032 -1.801 3.273 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.985 -0.671 2.437 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.688 1.151 3.827 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.273 0.892 5.704 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.053 0.624 4.126 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.633 -0.763 5.159 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.940 0.299 6.074 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.196 -1.368 5.506 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.062 -0.356 4.758 1.00 0.00 H new ATOM 1311 N MET A 85 -4.236 1.574 1.514 1.00 0.00 N ATOM 1312 CA MET A 85 -4.413 2.963 1.116 1.00 0.00 C ATOM 1313 C MET A 85 -3.725 3.818 2.185 1.00 0.00 C ATOM 1314 O MET A 85 -4.079 3.697 3.359 1.00 0.00 O ATOM 1315 CB MET A 85 -5.912 3.307 1.006 1.00 0.00 C ATOM 1316 CG MET A 85 -6.728 2.354 0.119 1.00 0.00 C ATOM 1317 SD MET A 85 -6.406 2.520 -1.653 1.00 0.00 S ATOM 1318 CE MET A 85 -7.501 1.212 -2.253 1.00 0.00 C ATOM 0 H MET A 85 -5.082 1.138 1.882 1.00 0.00 H new ATOM 0 HA MET A 85 -3.976 3.151 0.136 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.344 3.309 2.007 1.00 0.00 H new ATOM 0 HB3 MET A 85 -6.010 4.319 0.614 1.00 0.00 H new ATOM 0 HG2 MET A 85 -6.517 1.328 0.419 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.789 2.527 0.301 1.00 0.00 H new ATOM 0 HE1 MET A 85 -7.721 1.377 -3.308 1.00 0.00 H new ATOM 0 HE2 MET A 85 -7.013 0.245 -2.131 1.00 0.00 H new ATOM 0 HE3 MET A 85 -8.430 1.225 -1.682 1.00 0.00 H new ATOM 1328 N VAL A 86 -2.761 4.657 1.814 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.058 5.595 2.683 1.00 0.00 C ATOM 1330 C VAL A 86 -2.117 6.928 1.949 1.00 0.00 C ATOM 1331 O VAL A 86 -1.421 7.101 0.954 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.608 5.131 2.954 1.00 0.00 C ATOM 1333 CG1 VAL A 86 0.125 6.105 3.891 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.550 3.733 3.585 1.00 0.00 C ATOM 0 H VAL A 86 -2.433 4.703 0.849 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.514 5.669 3.670 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.120 5.105 1.980 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.141 5.750 4.062 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.158 7.094 3.434 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.404 6.162 4.842 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.490 3.454 3.755 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.084 3.740 4.535 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.014 3.011 2.913 1.00 0.00 H new ATOM 1344 N THR A 87 -3.003 7.833 2.370 1.00 0.00 N ATOM 1345 CA THR A 87 -3.399 8.943 1.516 1.00 0.00 C ATOM 1346 C THR A 87 -3.647 10.234 2.306 1.00 0.00 C ATOM 1347 O THR A 87 -3.581 10.263 3.544 1.00 0.00 O ATOM 1348 CB THR A 87 -4.589 8.460 0.655 1.00 0.00 C ATOM 1349 OG1 THR A 87 -4.966 9.439 -0.286 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.822 8.049 1.469 1.00 0.00 C ATOM 0 H THR A 87 -3.452 7.816 3.286 1.00 0.00 H new ATOM 0 HA THR A 87 -2.589 9.230 0.846 1.00 0.00 H new ATOM 0 HB THR A 87 -4.224 7.567 0.148 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.166 9.889 -0.628 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.612 7.723 0.793 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.559 7.232 2.141 1.00 0.00 H new ATOM 0 HG23 THR A 87 -6.173 8.900 2.053 1.00 0.00 H new ATOM 1358 N ALA A 88 -3.851 11.340 1.586 1.00 0.00 N ATOM 1359 CA ALA A 88 -4.442 12.563 2.110 1.00 0.00 C ATOM 1360 C ALA A 88 -5.967 12.443 2.158 1.00 0.00 C ATOM 1361 O ALA A 88 -6.616 13.167 2.912 1.00 0.00 O ATOM 1362 CB ALA A 88 -4.088 13.728 1.181 1.00 0.00 C ATOM 0 H ALA A 88 -3.602 11.406 0.599 1.00 0.00 H new ATOM 0 HA ALA A 88 -4.056 12.733 3.115 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -4.527 14.648 1.567 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.005 13.837 1.130 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.480 13.530 0.183 1.00 0.00 H new ATOM 1368 N GLU A 89 -6.549 11.577 1.324 1.00 0.00 N ATOM 1369 CA GLU A 89 -7.976 11.492 1.061 1.00 0.00 C ATOM 1370 C GLU A 89 -8.706 10.877 2.257 1.00 0.00 C ATOM 1371 O GLU A 89 -8.856 9.660 2.343 1.00 0.00 O ATOM 1372 CB GLU A 89 -8.208 10.652 -0.207 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.667 11.304 -1.488 1.00 0.00 C ATOM 1374 CD GLU A 89 -8.567 12.417 -2.026 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -9.803 12.237 -2.101 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -8.056 13.474 -2.457 1.00 0.00 O ATOM 0 H GLU A 89 -6.011 10.891 0.795 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.375 12.494 0.905 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.736 9.678 -0.078 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.277 10.475 -0.324 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.676 11.712 -1.289 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.549 10.539 -2.255 1.00 0.00 H new ATOM 1383 N ALA A 90 -9.237 11.706 3.155 1.00 0.00 N ATOM 1384 CA ALA A 90 -10.213 11.271 4.150 1.00 0.00 C ATOM 1385 C ALA A 90 -11.599 11.038 3.528 1.00 0.00 C ATOM 1386 O ALA A 90 -12.557 10.815 4.267 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.342 12.316 5.258 1.00 0.00 C ATOM 0 H ALA A 90 -9.002 12.697 3.212 1.00 0.00 H new ATOM 0 HA ALA A 90 -9.852 10.328 4.560 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.073 11.979 5.993 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.376 12.453 5.744 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.669 13.263 4.829 1.00 0.00 H new ATOM 1393 N LYS A 91 -11.737 11.176 2.200 1.00 0.00 N ATOM 1394 CA LYS A 91 -13.003 11.180 1.480 1.00 0.00 C ATOM 1395 C LYS A 91 -13.837 9.987 1.910 1.00 0.00 C ATOM 1396 O LYS A 91 -13.451 8.843 1.676 1.00 0.00 O ATOM 1397 CB LYS A 91 -12.754 11.228 -0.034 1.00 0.00 C ATOM 1398 CG LYS A 91 -14.056 11.122 -0.855 1.00 0.00 C ATOM 1399 CD LYS A 91 -14.017 11.966 -2.136 1.00 0.00 C ATOM 1400 CE LYS A 91 -12.901 11.530 -3.095 1.00 0.00 C ATOM 1401 NZ LYS A 91 -12.550 12.611 -4.037 1.00 0.00 N ATOM 0 H LYS A 91 -10.934 11.292 1.582 1.00 0.00 H new ATOM 0 HA LYS A 91 -13.573 12.076 1.727 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -12.246 12.159 -0.285 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.085 10.414 -0.314 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -14.232 10.079 -1.117 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -14.896 11.442 -0.239 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -14.978 11.892 -2.645 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -13.876 13.014 -1.872 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -12.019 11.243 -2.523 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -13.221 10.649 -3.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -11.793 12.286 -4.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -13.387 12.867 -4.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -12.222 13.442 -3.505 1.00 0.00 H new ATOM 1415 N LYS A 92 -14.984 10.256 2.532 1.00 0.00 N ATOM 1416 CA LYS A 92 -15.848 9.231 3.099 1.00 0.00 C ATOM 1417 C LYS A 92 -16.105 8.113 2.104 1.00 0.00 C ATOM 1418 O LYS A 92 -15.851 6.949 2.377 1.00 0.00 O ATOM 1419 CB LYS A 92 -17.153 9.879 3.591 1.00 0.00 C ATOM 1420 CG LYS A 92 -17.974 10.701 2.569 1.00 0.00 C ATOM 1421 CD LYS A 92 -18.738 11.827 3.278 1.00 0.00 C ATOM 1422 CE LYS A 92 -19.573 12.697 2.330 1.00 0.00 C ATOM 1423 NZ LYS A 92 -20.849 12.066 1.941 1.00 0.00 N ATOM 0 H LYS A 92 -15.340 11.204 2.656 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.348 8.773 3.952 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -17.795 9.088 3.980 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -16.909 10.532 4.429 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -17.310 11.123 1.815 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -18.675 10.049 2.048 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -19.395 11.391 4.030 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -18.026 12.461 3.806 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -19.779 13.654 2.810 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -18.991 12.909 1.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -21.369 12.700 1.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -20.658 11.166 1.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -21.421 11.887 2.791 1.00 0.00 H new ATOM 1437 N GLU A 93 -16.558 8.483 0.919 1.00 0.00 N ATOM 1438 CA GLU A 93 -16.832 7.539 -0.155 1.00 0.00 C ATOM 1439 C GLU A 93 -15.609 6.748 -0.614 1.00 0.00 C ATOM 1440 O GLU A 93 -15.770 5.643 -1.124 1.00 0.00 O ATOM 1441 CB GLU A 93 -17.427 8.282 -1.344 1.00 0.00 C ATOM 1442 CG GLU A 93 -18.902 8.562 -1.065 1.00 0.00 C ATOM 1443 CD GLU A 93 -19.603 9.083 -2.307 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -19.564 10.310 -2.539 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -20.238 8.275 -3.023 1.00 0.00 O ATOM 0 H GLU A 93 -16.748 9.454 0.671 1.00 0.00 H new ATOM 0 HA GLU A 93 -17.536 6.812 0.249 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -16.891 9.216 -1.511 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -17.321 7.687 -2.251 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -19.391 7.649 -0.724 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -18.991 9.292 -0.260 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.395 7.269 -0.447 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.176 6.507 -0.708 1.00 0.00 C ATOM 1454 C ASN A 94 -12.975 5.468 0.391 1.00 0.00 C ATOM 1455 O ASN A 94 -12.628 4.329 0.080 1.00 0.00 O ATOM 1456 CB ASN A 94 -11.933 7.395 -0.851 1.00 0.00 C ATOM 1457 CG ASN A 94 -11.920 8.239 -2.120 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -12.911 8.339 -2.843 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -10.803 8.893 -2.386 1.00 0.00 N ATOM 0 H ASN A 94 -14.229 8.224 -0.129 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.304 6.007 -1.668 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -11.869 8.056 0.014 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.044 6.764 -0.837 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -10.749 9.497 -3.206 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -9.995 8.794 -1.771 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.242 5.809 1.662 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.214 4.825 2.752 1.00 0.00 C ATOM 1468 C ILE A 95 -14.247 3.725 2.433 1.00 0.00 C ATOM 1469 O ILE A 95 -13.902 2.543 2.505 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.461 5.479 4.143 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.196 6.183 4.697 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -13.856 4.414 5.192 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -12.061 7.631 4.207 1.00 0.00 C ATOM 0 H ILE A 95 -13.479 6.756 1.958 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.220 4.383 2.817 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.259 6.205 3.985 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.228 6.174 5.786 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.312 5.619 4.399 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -14.023 4.896 6.155 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -14.770 3.912 4.874 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -13.054 3.682 5.287 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -11.158 8.074 4.626 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.999 7.643 3.119 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.930 8.206 4.527 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.492 4.091 2.089 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.537 3.132 1.720 1.00 0.00 C ATOM 1487 C ILE A 96 -16.027 2.269 0.568 1.00 0.00 C ATOM 1488 O ILE A 96 -15.984 1.051 0.714 1.00 0.00 O ATOM 1489 CB ILE A 96 -17.897 3.817 1.404 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.692 4.133 2.695 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.814 2.968 0.502 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -18.577 5.580 3.163 1.00 0.00 C ATOM 0 H ILE A 96 -15.800 5.063 2.060 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.746 2.490 2.576 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.625 4.733 0.879 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.743 3.900 2.527 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.344 3.476 3.492 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.745 3.505 0.321 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.315 2.778 -0.448 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -19.032 2.020 0.994 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -19.163 5.716 4.072 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -17.532 5.815 3.366 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -18.954 6.245 2.386 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.640 2.866 -0.560 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.242 2.136 -1.754 1.00 0.00 C ATOM 1506 C ALA A 97 -14.088 1.179 -1.455 1.00 0.00 C ATOM 1507 O ALA A 97 -14.094 0.046 -1.936 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.862 3.126 -2.848 1.00 0.00 C ATOM 0 H ALA A 97 -15.595 3.879 -0.667 1.00 0.00 H new ATOM 0 HA ALA A 97 -16.082 1.532 -2.097 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.563 2.581 -3.744 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.718 3.761 -3.078 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -14.032 3.745 -2.506 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.116 1.600 -0.642 1.00 0.00 N ATOM 1515 CA ALA A 98 -12.030 0.743 -0.201 1.00 0.00 C ATOM 1516 C ALA A 98 -12.584 -0.463 0.548 1.00 0.00 C ATOM 1517 O ALA A 98 -12.221 -1.596 0.237 1.00 0.00 O ATOM 1518 CB ALA A 98 -11.073 1.524 0.698 1.00 0.00 C ATOM 0 H ALA A 98 -13.066 2.550 -0.274 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.483 0.393 -1.077 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -10.263 0.870 1.022 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.660 2.367 0.144 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.613 1.893 1.570 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.435 -0.242 1.550 1.00 0.00 N ATOM 1525 CA ALA A 99 -14.006 -1.318 2.345 1.00 0.00 C ATOM 1526 C ALA A 99 -14.963 -2.204 1.532 1.00 0.00 C ATOM 1527 O ALA A 99 -15.119 -3.376 1.864 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.698 -0.705 3.566 1.00 0.00 C ATOM 0 H ALA A 99 -13.745 0.689 1.830 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.204 -1.980 2.672 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.133 -1.498 4.174 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -13.969 -0.152 4.158 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.486 -0.028 3.236 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.600 -1.669 0.490 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.439 -2.391 -0.457 1.00 0.00 C ATOM 1536 C GLN A 100 -15.565 -3.317 -1.308 1.00 0.00 C ATOM 1537 O GLN A 100 -15.809 -4.522 -1.350 1.00 0.00 O ATOM 1538 CB GLN A 100 -17.210 -1.383 -1.335 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.398 -0.732 -0.611 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.513 -1.750 -0.396 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -20.070 -2.286 -1.355 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -19.848 -2.040 0.847 1.00 0.00 N ATOM 0 H GLN A 100 -15.540 -0.673 0.276 1.00 0.00 H new ATOM 0 HA GLN A 100 -17.166 -3.003 0.076 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.525 -0.603 -1.668 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.572 -1.892 -2.228 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -18.072 -0.332 0.349 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.772 0.108 -1.196 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.371 -1.582 1.624 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.584 -2.722 1.031 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.533 -2.769 -1.959 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.594 -3.527 -2.769 1.00 0.00 C ATOM 1553 C ALA A 101 -12.894 -4.603 -1.931 1.00 0.00 C ATOM 1554 O ALA A 101 -12.681 -5.722 -2.399 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.566 -2.552 -3.345 1.00 0.00 C ATOM 0 H ALA A 101 -14.330 -1.770 -1.933 1.00 0.00 H new ATOM 0 HA ALA A 101 -14.128 -4.033 -3.574 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.849 -3.099 -3.958 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -13.074 -1.808 -3.958 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -12.041 -2.054 -2.530 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.563 -4.261 -0.686 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.917 -5.142 0.268 1.00 0.00 C ATOM 1563 C GLY A 102 -10.458 -4.777 0.501 1.00 0.00 C ATOM 1564 O GLY A 102 -9.643 -5.685 0.694 1.00 0.00 O ATOM 0 H GLY A 102 -12.746 -3.331 -0.308 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.454 -5.103 1.216 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.979 -6.169 -0.091 1.00 0.00 H new ATOM 1568 N ALA A 103 -10.125 -3.478 0.476 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.766 -2.993 0.691 1.00 0.00 C ATOM 1570 C ALA A 103 -8.297 -3.489 2.046 1.00 0.00 C ATOM 1571 O ALA A 103 -9.076 -3.495 3.006 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.683 -1.460 0.652 1.00 0.00 C ATOM 0 H ALA A 103 -10.801 -2.734 0.304 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.133 -3.371 -0.112 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.652 -1.147 0.817 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -9.020 -1.102 -0.321 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.319 -1.041 1.432 1.00 0.00 H new ATOM 1578 N SER A 104 -7.032 -3.868 2.142 1.00 0.00 N ATOM 1579 CA SER A 104 -6.525 -4.510 3.338 1.00 0.00 C ATOM 1580 C SER A 104 -6.255 -3.485 4.446 1.00 0.00 C ATOM 1581 O SER A 104 -5.987 -3.865 5.589 1.00 0.00 O ATOM 1582 CB SER A 104 -5.318 -5.374 2.967 1.00 0.00 C ATOM 1583 OG SER A 104 -5.482 -5.951 1.683 1.00 0.00 O ATOM 0 H SER A 104 -6.340 -3.741 1.404 1.00 0.00 H new ATOM 0 HA SER A 104 -7.276 -5.178 3.760 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.413 -4.767 2.984 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.188 -6.161 3.710 1.00 0.00 H new ATOM 0 HG SER A 104 -5.621 -6.917 1.774 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.412 -2.190 4.156 1.00 0.00 N ATOM 1590 CA GLY A 105 -6.580 -1.159 5.159 1.00 0.00 C ATOM 1591 C GLY A 105 -6.645 0.214 4.505 1.00 0.00 C ATOM 1592 O GLY A 105 -6.414 0.358 3.298 1.00 0.00 O ATOM 0 H GLY A 105 -6.425 -1.833 3.201 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.492 -1.341 5.727 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -5.751 -1.193 5.866 1.00 0.00 H new ATOM 1596 N TYR A 106 -6.949 1.222 5.322 1.00 0.00 N ATOM 1597 CA TYR A 106 -7.025 2.613 4.912 1.00 0.00 C ATOM 1598 C TYR A 106 -6.396 3.473 6.000 1.00 0.00 C ATOM 1599 O TYR A 106 -6.721 3.306 7.178 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.492 2.998 4.670 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.689 4.170 3.730 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.350 5.480 4.115 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.225 3.942 2.450 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.546 6.543 3.218 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.452 5.006 1.563 1.00 0.00 C ATOM 1606 CZ TYR A 106 -9.112 6.319 1.945 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.331 7.356 1.096 1.00 0.00 O ATOM 0 H TYR A 106 -7.154 1.084 6.312 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.481 2.771 3.981 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -9.019 2.133 4.267 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -8.955 3.236 5.628 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.941 5.668 5.097 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -9.465 2.934 2.145 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.260 7.544 3.506 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -9.886 4.819 0.592 1.00 0.00 H new ATOM 0 HH TYR A 106 -8.908 8.165 1.452 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.518 4.391 5.620 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.783 5.306 6.475 1.00 0.00 C ATOM 1619 C VAL A 107 -4.909 6.684 5.836 1.00 0.00 C ATOM 1620 O VAL A 107 -4.652 6.839 4.642 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.312 4.845 6.564 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.409 5.876 7.240 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -3.178 3.532 7.343 1.00 0.00 C ATOM 0 H VAL A 107 -5.286 4.523 4.636 1.00 0.00 H new ATOM 0 HA VAL A 107 -5.173 5.332 7.493 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.994 4.710 5.530 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.387 5.498 7.274 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.432 6.807 6.674 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.762 6.059 8.255 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -2.129 3.239 7.385 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.557 3.670 8.356 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.753 2.752 6.843 1.00 0.00 H new ATOM 1633 N VAL A 108 -5.279 7.680 6.634 1.00 0.00 N ATOM 1634 CA VAL A 108 -5.215 9.077 6.244 1.00 0.00 C ATOM 1635 C VAL A 108 -4.070 9.716 7.031 1.00 0.00 C ATOM 1636 O VAL A 108 -3.748 9.303 8.153 1.00 0.00 O ATOM 1637 CB VAL A 108 -6.552 9.808 6.523 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -6.653 11.084 5.674 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -7.805 8.977 6.206 1.00 0.00 C ATOM 0 H VAL A 108 -5.635 7.535 7.579 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.039 9.158 5.171 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.531 10.015 7.593 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.598 11.586 5.882 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -5.827 11.751 5.920 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.606 10.822 4.617 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.696 9.563 6.430 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -7.804 8.706 5.150 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -7.804 8.072 6.813 1.00 0.00 H new ATOM 1649 N LYS A 109 -3.473 10.759 6.458 1.00 0.00 N ATOM 1650 CA LYS A 109 -2.704 11.747 7.210 1.00 0.00 C ATOM 1651 C LYS A 109 -3.562 12.236 8.392 1.00 0.00 C ATOM 1652 O LYS A 109 -4.760 12.432 8.185 1.00 0.00 O ATOM 1653 CB LYS A 109 -2.384 12.894 6.238 1.00 0.00 C ATOM 1654 CG LYS A 109 -1.453 13.978 6.795 1.00 0.00 C ATOM 1655 CD LYS A 109 0.017 13.544 6.893 1.00 0.00 C ATOM 1656 CE LYS A 109 0.669 13.420 5.515 1.00 0.00 C ATOM 1657 NZ LYS A 109 2.117 13.174 5.633 1.00 0.00 N ATOM 0 H LYS A 109 -3.509 10.943 5.455 1.00 0.00 H new ATOM 0 HA LYS A 109 -1.777 11.337 7.612 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.930 12.473 5.341 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -3.320 13.362 5.932 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.519 14.862 6.160 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.803 14.270 7.785 1.00 0.00 H new ATOM 0 HD2 LYS A 109 0.570 14.268 7.492 1.00 0.00 H new ATOM 0 HD3 LYS A 109 0.079 12.587 7.411 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.203 12.605 4.961 1.00 0.00 H new ATOM 0 HE3 LYS A 109 0.497 14.333 4.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.534 13.094 4.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 2.563 13.964 6.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 2.277 12.290 6.157 1.00 0.00 H new ATOM 1671 N PRO A 110 -2.998 12.517 9.580 1.00 0.00 N ATOM 1672 CA PRO A 110 -1.624 12.258 10.001 1.00 0.00 C ATOM 1673 C PRO A 110 -1.403 10.764 10.268 1.00 0.00 C ATOM 1674 O PRO A 110 -2.194 10.138 10.978 1.00 0.00 O ATOM 1675 CB PRO A 110 -1.436 13.094 11.269 1.00 0.00 C ATOM 1676 CG PRO A 110 -2.837 13.174 11.872 1.00 0.00 C ATOM 1677 CD PRO A 110 -3.754 13.141 10.654 1.00 0.00 C ATOM 0 HA PRO A 110 -0.899 12.527 9.233 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -0.732 12.624 11.956 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -1.044 14.085 11.039 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -3.033 12.338 12.544 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.973 14.087 12.451 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.661 12.576 10.868 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -4.064 14.148 10.375 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.314 10.193 9.741 1.00 0.00 N ATOM 1686 CA PHE A 111 -0.001 8.773 9.884 1.00 0.00 C ATOM 1687 C PHE A 111 1.468 8.564 10.259 1.00 0.00 C ATOM 1688 O PHE A 111 2.312 9.437 10.013 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.380 8.022 8.602 1.00 0.00 C ATOM 1690 CG PHE A 111 0.492 8.299 7.395 1.00 0.00 C ATOM 1691 CD1 PHE A 111 1.655 7.537 7.195 1.00 0.00 C ATOM 1692 CD2 PHE A 111 0.150 9.295 6.463 1.00 0.00 C ATOM 1693 CE1 PHE A 111 2.490 7.809 6.104 1.00 0.00 C ATOM 1694 CE2 PHE A 111 1.003 9.581 5.383 1.00 0.00 C ATOM 1695 CZ PHE A 111 2.183 8.845 5.209 1.00 0.00 C ATOM 0 H PHE A 111 0.378 10.711 9.200 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.593 8.363 10.702 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -0.353 6.952 8.808 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.410 8.272 8.348 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.905 6.742 7.882 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -0.773 9.843 6.578 1.00 0.00 H new ATOM 0 HE1 PHE A 111 3.379 7.215 5.950 1.00 0.00 H new ATOM 0 HE2 PHE A 111 0.749 10.367 4.688 1.00 0.00 H new ATOM 0 HZ PHE A 111 2.851 9.074 4.392 1.00 0.00 H new ATOM 1705 N THR A 112 1.759 7.408 10.848 1.00 0.00 N ATOM 1706 CA THR A 112 2.935 7.121 11.667 1.00 0.00 C ATOM 1707 C THR A 112 3.246 5.621 11.664 1.00 0.00 C ATOM 1708 O THR A 112 2.444 4.831 11.161 1.00 0.00 O ATOM 1709 CB THR A 112 2.634 7.593 13.101 1.00 0.00 C ATOM 1710 OG1 THR A 112 1.292 7.311 13.451 1.00 0.00 O ATOM 1711 CG2 THR A 112 2.925 9.081 13.264 1.00 0.00 C ATOM 0 H THR A 112 1.145 6.598 10.762 1.00 0.00 H new ATOM 0 HA THR A 112 3.805 7.640 11.264 1.00 0.00 H new ATOM 0 HB THR A 112 3.291 7.044 13.776 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.121 7.617 14.366 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.703 9.385 14.287 1.00 0.00 H new ATOM 0 HG22 THR A 112 3.976 9.272 13.049 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.304 9.651 12.573 1.00 0.00 H new ATOM 1719 N ALA A 113 4.387 5.212 12.231 1.00 0.00 N ATOM 1720 CA ALA A 113 4.760 3.811 12.368 1.00 0.00 C ATOM 1721 C ALA A 113 3.781 3.136 13.317 1.00 0.00 C ATOM 1722 O ALA A 113 3.397 2.006 13.057 1.00 0.00 O ATOM 1723 CB ALA A 113 6.205 3.665 12.849 1.00 0.00 C ATOM 0 H ALA A 113 5.081 5.857 12.610 1.00 0.00 H new ATOM 0 HA ALA A 113 4.708 3.323 11.395 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.453 2.608 12.941 1.00 0.00 H new ATOM 0 HB2 ALA A 113 6.877 4.134 12.130 1.00 0.00 H new ATOM 0 HB3 ALA A 113 6.316 4.150 13.819 1.00 0.00 H new ATOM 1729 N ALA A 114 3.283 3.872 14.318 1.00 0.00 N ATOM 1730 CA ALA A 114 2.185 3.468 15.183 1.00 0.00 C ATOM 1731 C ALA A 114 0.989 2.939 14.383 1.00 0.00 C ATOM 1732 O ALA A 114 0.453 1.878 14.707 1.00 0.00 O ATOM 1733 CB ALA A 114 1.757 4.676 16.023 1.00 0.00 C ATOM 0 H ALA A 114 3.651 4.795 14.550 1.00 0.00 H new ATOM 0 HA ALA A 114 2.529 2.656 15.823 1.00 0.00 H new ATOM 0 HB1 ALA A 114 0.934 4.390 16.678 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.599 5.017 16.626 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.433 5.481 15.364 1.00 0.00 H new ATOM 1739 N THR A 115 0.527 3.682 13.372 1.00 0.00 N ATOM 1740 CA THR A 115 -0.611 3.242 12.572 1.00 0.00 C ATOM 1741 C THR A 115 -0.154 2.178 11.559 1.00 0.00 C ATOM 1742 O THR A 115 -0.894 1.227 11.318 1.00 0.00 O ATOM 1743 CB THR A 115 -1.360 4.467 11.993 1.00 0.00 C ATOM 1744 OG1 THR A 115 -2.761 4.279 12.054 1.00 0.00 O ATOM 1745 CG2 THR A 115 -1.019 4.841 10.550 1.00 0.00 C ATOM 0 H THR A 115 0.921 4.581 13.093 1.00 0.00 H new ATOM 0 HA THR A 115 -1.359 2.736 13.182 1.00 0.00 H new ATOM 0 HB THR A 115 -1.019 5.285 12.627 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.213 5.066 11.684 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.603 5.712 10.252 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.043 5.074 10.476 1.00 0.00 H new ATOM 0 HG23 THR A 115 -1.254 4.004 9.892 1.00 0.00 H new ATOM 1753 N LEU A 116 1.065 2.283 11.008 1.00 0.00 N ATOM 1754 CA LEU A 116 1.632 1.312 10.070 1.00 0.00 C ATOM 1755 C LEU A 116 1.603 -0.080 10.719 1.00 0.00 C ATOM 1756 O LEU A 116 0.978 -0.994 10.181 1.00 0.00 O ATOM 1757 CB LEU A 116 3.062 1.743 9.650 1.00 0.00 C ATOM 1758 CG LEU A 116 3.636 1.176 8.335 1.00 0.00 C ATOM 1759 CD1 LEU A 116 3.426 -0.326 8.207 1.00 0.00 C ATOM 1760 CD2 LEU A 116 3.083 1.868 7.082 1.00 0.00 C ATOM 0 H LEU A 116 1.693 3.061 11.208 1.00 0.00 H new ATOM 0 HA LEU A 116 1.038 1.272 9.157 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.074 2.831 9.577 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.743 1.469 10.456 1.00 0.00 H new ATOM 0 HG LEU A 116 4.705 1.383 8.394 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.848 -0.673 7.264 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.920 -0.834 9.035 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.359 -0.547 8.230 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.528 1.421 6.193 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.000 1.746 7.047 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.327 2.930 7.115 1.00 0.00 H new ATOM 1772 N GLU A 117 2.236 -0.237 11.884 1.00 0.00 N ATOM 1773 CA GLU A 117 2.372 -1.514 12.573 1.00 0.00 C ATOM 1774 C GLU A 117 1.014 -2.094 12.971 1.00 0.00 C ATOM 1775 O GLU A 117 0.852 -3.314 12.998 1.00 0.00 O ATOM 1776 CB GLU A 117 3.334 -1.410 13.772 1.00 0.00 C ATOM 1777 CG GLU A 117 2.827 -0.665 15.013 1.00 0.00 C ATOM 1778 CD GLU A 117 3.750 -0.883 16.214 1.00 0.00 C ATOM 1779 OE1 GLU A 117 3.854 -2.046 16.667 1.00 0.00 O ATOM 1780 OE2 GLU A 117 4.281 0.097 16.792 1.00 0.00 O ATOM 0 H GLU A 117 2.676 0.538 12.381 1.00 0.00 H new ATOM 0 HA GLU A 117 2.816 -2.217 11.869 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.609 -2.421 14.073 1.00 0.00 H new ATOM 0 HB3 GLU A 117 4.246 -0.919 13.432 1.00 0.00 H new ATOM 0 HG2 GLU A 117 2.757 0.401 14.795 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.822 -1.007 15.259 1.00 0.00 H new ATOM 1787 N GLU A 118 0.024 -1.238 13.230 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.332 -1.672 13.498 1.00 0.00 C ATOM 1789 C GLU A 118 -1.987 -2.217 12.222 1.00 0.00 C ATOM 1790 O GLU A 118 -2.648 -3.256 12.270 1.00 0.00 O ATOM 1791 CB GLU A 118 -2.134 -0.525 14.130 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.622 -0.879 14.107 1.00 0.00 C ATOM 1793 CD GLU A 118 -4.496 -0.037 15.014 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -4.373 1.206 15.023 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -5.403 -0.635 15.635 1.00 0.00 O ATOM 0 H GLU A 118 0.148 -0.226 13.258 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.316 -2.492 14.216 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.804 -0.356 15.155 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.960 0.401 13.582 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -3.987 -0.783 13.084 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.735 -1.926 14.388 1.00 0.00 H new ATOM 1802 N LYS A 119 -1.859 -1.535 11.078 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.443 -2.043 9.835 1.00 0.00 C ATOM 1804 C LYS A 119 -1.761 -3.351 9.423 1.00 0.00 C ATOM 1805 O LYS A 119 -2.453 -4.242 8.915 1.00 0.00 O ATOM 1806 CB LYS A 119 -2.373 -1.002 8.711 1.00 0.00 C ATOM 1807 CG LYS A 119 -3.144 0.304 8.965 1.00 0.00 C ATOM 1808 CD LYS A 119 -4.664 0.174 9.140 1.00 0.00 C ATOM 1809 CE LYS A 119 -5.245 1.577 9.375 1.00 0.00 C ATOM 1810 NZ LYS A 119 -6.683 1.575 9.707 1.00 0.00 N ATOM 0 H LYS A 119 -1.366 -0.647 10.988 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.498 -2.247 10.017 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.326 -0.756 8.533 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.754 -1.456 7.796 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -2.736 0.774 9.860 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.952 0.982 8.133 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.111 -0.278 8.255 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.895 -0.478 9.982 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.695 2.058 10.184 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.088 2.180 8.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -7.200 2.151 9.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -7.043 0.600 9.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.820 1.973 10.658 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.450 -3.476 9.673 1.00 0.00 N ATOM 1825 CA LEU A 120 0.304 -4.718 9.522 1.00 0.00 C ATOM 1826 C LEU A 120 -0.305 -5.799 10.403 1.00 0.00 C ATOM 1827 O LEU A 120 -0.712 -6.823 9.874 1.00 0.00 O ATOM 1828 CB LEU A 120 1.789 -4.555 9.882 1.00 0.00 C ATOM 1829 CG LEU A 120 2.659 -3.749 8.911 1.00 0.00 C ATOM 1830 CD1 LEU A 120 4.091 -3.724 9.442 1.00 0.00 C ATOM 1831 CD2 LEU A 120 2.688 -4.333 7.502 1.00 0.00 C ATOM 0 H LEU A 120 0.124 -2.696 9.993 1.00 0.00 H new ATOM 0 HA LEU A 120 0.247 -5.000 8.471 1.00 0.00 H new ATOM 0 HB2 LEU A 120 1.849 -4.082 10.862 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.224 -5.549 9.980 1.00 0.00 H new ATOM 0 HG LEU A 120 2.224 -2.752 8.847 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.722 -3.153 8.760 1.00 0.00 H new ATOM 0 HD12 LEU A 120 4.106 -3.257 10.427 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.469 -4.744 9.518 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.321 -3.715 6.865 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.087 -5.347 7.536 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.677 -4.355 7.096 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.420 -5.573 11.717 1.00 0.00 N ATOM 1844 CA ASN A 121 -1.054 -6.516 12.643 1.00 0.00 C ATOM 1845 C ASN A 121 -2.430 -6.942 12.131 1.00 0.00 C ATOM 1846 O ASN A 121 -2.748 -8.128 12.132 1.00 0.00 O ATOM 1847 CB ASN A 121 -1.155 -5.907 14.050 1.00 0.00 C ATOM 1848 CG ASN A 121 -2.230 -6.594 14.891 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -3.372 -6.145 14.915 1.00 0.00 O ATOM 1850 ND2 ASN A 121 -1.922 -7.685 15.563 1.00 0.00 N ATOM 0 H ASN A 121 -0.074 -4.727 12.169 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.429 -7.407 12.703 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -0.191 -5.992 14.552 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.381 -4.844 13.970 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -2.636 -8.165 16.110 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -0.970 -8.049 15.536 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.230 -5.993 11.639 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.506 -6.286 11.002 1.00 0.00 C ATOM 1859 C LYS A 122 -4.325 -7.341 9.914 1.00 0.00 C ATOM 1860 O LYS A 122 -4.935 -8.394 10.040 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.177 -4.998 10.501 1.00 0.00 C ATOM 1862 CG LYS A 122 -6.400 -4.609 11.344 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.757 -3.126 11.149 1.00 0.00 C ATOM 1864 CE LYS A 122 -5.936 -2.225 12.077 1.00 0.00 C ATOM 1865 NZ LYS A 122 -6.539 -2.112 13.427 1.00 0.00 N ATOM 0 H LYS A 122 -3.006 -4.999 11.674 1.00 0.00 H new ATOM 0 HA LYS A 122 -5.189 -6.712 11.737 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.453 -4.184 10.519 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.482 -5.130 9.463 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -7.251 -5.231 11.065 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -6.196 -4.802 12.397 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -6.579 -2.841 10.112 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.819 -2.978 11.342 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -4.925 -2.622 12.165 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.851 -1.232 11.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.561 -1.113 13.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.508 -2.488 13.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -5.971 -2.656 14.108 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.536 -7.108 8.863 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.408 -8.088 7.766 1.00 0.00 C ATOM 1881 C ILE A 123 -2.636 -9.361 8.136 1.00 0.00 C ATOM 1882 O ILE A 123 -2.900 -10.417 7.547 1.00 0.00 O ATOM 1883 CB ILE A 123 -2.832 -7.443 6.491 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.496 -6.715 6.738 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -3.917 -6.527 5.915 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -1.052 -5.755 5.637 1.00 0.00 C ATOM 0 H ILE A 123 -2.979 -6.262 8.742 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.428 -8.414 7.564 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.577 -8.215 5.765 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.574 -6.157 7.671 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.716 -7.463 6.878 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.546 -6.050 5.008 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.803 -7.116 5.679 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.174 -5.762 6.648 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.102 -5.298 5.914 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -0.933 -6.303 4.703 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -1.804 -4.977 5.508 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.729 -9.293 9.110 1.00 0.00 N ATOM 1899 CA PHE A 124 -1.090 -10.475 9.658 1.00 0.00 C ATOM 1900 C PHE A 124 -2.191 -11.386 10.181 1.00 0.00 C ATOM 1901 O PHE A 124 -2.375 -12.491 9.687 1.00 0.00 O ATOM 1902 CB PHE A 124 -0.083 -10.125 10.764 1.00 0.00 C ATOM 1903 CG PHE A 124 1.173 -9.338 10.395 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.653 -9.261 9.071 1.00 0.00 C ATOM 1905 CD2 PHE A 124 1.905 -8.702 11.418 1.00 0.00 C ATOM 1906 CE1 PHE A 124 2.821 -8.537 8.769 1.00 0.00 C ATOM 1907 CE2 PHE A 124 3.077 -7.981 11.122 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.532 -7.893 9.795 1.00 0.00 C ATOM 0 H PHE A 124 -1.422 -8.418 9.536 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.514 -10.978 8.881 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.615 -9.557 11.527 1.00 0.00 H new ATOM 0 HB3 PHE A 124 0.237 -11.059 11.226 1.00 0.00 H new ATOM 0 HD1 PHE A 124 1.117 -9.764 8.279 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.563 -8.769 12.440 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.171 -8.476 7.749 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.627 -7.495 11.915 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.426 -7.332 9.565 1.00 0.00 H new ATOM 1918 N GLU A 125 -2.999 -10.893 11.115 1.00 0.00 N ATOM 1919 CA GLU A 125 -3.985 -11.730 11.772 1.00 0.00 C ATOM 1920 C GLU A 125 -5.143 -12.064 10.818 1.00 0.00 C ATOM 1921 O GLU A 125 -5.632 -13.195 10.818 1.00 0.00 O ATOM 1922 CB GLU A 125 -4.513 -11.015 13.020 1.00 0.00 C ATOM 1923 CG GLU A 125 -3.442 -10.583 14.039 1.00 0.00 C ATOM 1924 CD GLU A 125 -2.944 -11.690 14.964 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -2.809 -12.859 14.535 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -2.631 -11.382 16.138 1.00 0.00 O ATOM 0 H GLU A 125 -2.987 -9.923 11.429 1.00 0.00 H new ATOM 0 HA GLU A 125 -3.511 -12.667 12.066 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -5.067 -10.131 12.704 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.223 -11.673 13.522 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -2.590 -10.174 13.496 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -3.848 -9.776 14.649 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.614 -11.086 10.032 1.00 0.00 N ATOM 1934 CA LYS A 126 -6.797 -11.182 9.163 1.00 0.00 C ATOM 1935 C LYS A 126 -6.494 -12.149 8.029 1.00 0.00 C ATOM 1936 O LYS A 126 -7.139 -13.192 7.937 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.228 -9.783 8.652 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.627 -9.607 8.018 1.00 0.00 C ATOM 1939 CD LYS A 126 -9.126 -10.684 7.038 1.00 0.00 C ATOM 1940 CE LYS A 126 -10.119 -10.173 5.987 1.00 0.00 C ATOM 1941 NZ LYS A 126 -11.321 -9.536 6.572 1.00 0.00 N ATOM 0 H LYS A 126 -5.165 -10.171 9.982 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.644 -11.569 9.729 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.160 -9.092 9.492 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.492 -9.462 7.915 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -9.352 -9.534 8.828 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -8.637 -8.651 7.494 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.267 -11.119 6.527 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -9.598 -11.485 7.607 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -9.615 -9.455 5.341 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -10.429 -11.006 5.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -11.949 -9.214 5.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -11.824 -10.225 7.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -11.035 -8.722 7.152 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.580 -11.773 7.130 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.270 -12.561 5.945 1.00 0.00 C ATOM 1957 C LEU A 127 -4.476 -13.810 6.329 1.00 0.00 C ATOM 1958 O LEU A 127 -4.567 -14.830 5.639 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.448 -11.754 4.919 1.00 0.00 C ATOM 1960 CG LEU A 127 -4.886 -10.308 4.597 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.211 -9.807 3.316 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.405 -10.164 4.476 1.00 0.00 C ATOM 0 H LEU A 127 -5.037 -10.913 7.208 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.221 -12.841 5.492 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.418 -11.717 5.275 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.442 -12.315 3.984 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.566 -9.694 5.439 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.535 -8.787 3.109 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.129 -9.826 3.444 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.489 -10.452 2.482 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.655 -9.128 4.249 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -6.769 -10.809 3.676 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.874 -10.453 5.417 1.00 0.00 H new ATOM 1974 N GLY A 128 -3.699 -13.740 7.411 1.00 0.00 N ATOM 1975 CA GLY A 128 -2.612 -14.664 7.678 1.00 0.00 C ATOM 1976 C GLY A 128 -1.309 -14.144 7.067 1.00 0.00 C ATOM 1977 O GLY A 128 -0.479 -14.977 6.688 1.00 0.00 O ATOM 0 H GLY A 128 -3.814 -13.028 8.132 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.491 -14.792 8.754 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -2.849 -15.644 7.265 1.00 0.00 H new ATOM 1981 N MET A 129 -1.132 -12.820 6.872 1.00 0.00 N ATOM 1982 CA MET A 129 0.165 -12.330 6.380 1.00 0.00 C ATOM 1983 C MET A 129 1.236 -12.544 7.445 1.00 0.00 C ATOM 1984 O MET A 129 2.420 -12.464 7.078 1.00 0.00 O ATOM 1985 CB MET A 129 0.124 -10.861 5.920 1.00 0.00 C ATOM 1986 CG MET A 129 -0.530 -10.663 4.548 1.00 0.00 C ATOM 1987 SD MET A 129 0.238 -11.487 3.117 1.00 0.00 S ATOM 1988 CE MET A 129 1.876 -10.707 3.062 1.00 0.00 C ATOM 1989 OXT MET A 129 0.899 -12.793 8.625 1.00 0.00 O ATOM 0 H MET A 129 -1.837 -12.103 7.040 1.00 0.00 H new ATOM 0 HA MET A 129 0.414 -12.911 5.492 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.419 -10.273 6.660 1.00 0.00 H new ATOM 0 HB3 MET A 129 1.141 -10.471 5.887 1.00 0.00 H new ATOM 0 HG2 MET A 129 -1.563 -11.004 4.617 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.560 -9.593 4.342 1.00 0.00 H new ATOM 0 HE1 MET A 129 2.381 -10.985 2.137 1.00 0.00 H new ATOM 0 HE2 MET A 129 1.765 -9.623 3.103 1.00 0.00 H new ATOM 0 HE3 MET A 129 2.468 -11.043 3.913 1.00 0.00 H new TER 1999 MET A 129