USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 846 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 66 MET CE :methyl 143:sc=-0.00942 (180deg=-1.12) USER MOD Set 1.2: A 90 MET CE :methyl -176:sc=-0.00225 (180deg=-0.0045) USER MOD Single : A 2 SER OG : rot 14:sc= 0.563 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 40:sc= -0.275 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 28 HIS : no HD1:sc= -0.265 X(o=-0.27,f=-0.32) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -175:sc= 0.225 (180deg=0.214) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -0.169 K(o=-0.17,f=-1.6!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -1.52 K(o=-1.5,f=-5.2!) USER MOD Single : A 46 MET CE :methyl -108:sc= -1.55 (180deg=-4.58!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= 0 K(o=0,f=-2.6!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 170:sc= -1.1 USER MOD Single : A 71 MET CE :methyl -165:sc= -1.12 (180deg=-1.7!) USER MOD Single : A 76 THR OG1 : rot -70:sc= 0.442 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -1.07 K(o=-1.1,f=-2.2!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 0.308 -2.091 -0.578 1.00 0.00 N ATOM 19 CA SER A 2 -0.134 -3.003 -1.626 1.00 0.00 C ATOM 20 C SER A 2 -1.608 -3.355 -1.453 1.00 0.00 C ATOM 21 O SER A 2 -2.110 -3.446 -0.332 1.00 0.00 O ATOM 22 CB SER A 2 0.711 -4.278 -1.613 1.00 0.00 C ATOM 23 OG SER A 2 2.029 -4.011 -1.166 1.00 0.00 O ATOM 0 HA SER A 2 -0.008 -2.502 -2.586 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.246 -5.020 -0.963 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.743 -4.707 -2.614 1.00 0.00 H new ATOM 0 HG SER A 2 2.062 -3.121 -0.756 1.00 0.00 H new ATOM 29 N LEU A 3 -2.298 -3.552 -2.571 1.00 0.00 N ATOM 30 CA LEU A 3 -3.716 -3.894 -2.545 1.00 0.00 C ATOM 31 C LEU A 3 -3.934 -5.344 -2.966 1.00 0.00 C ATOM 32 O LEU A 3 -3.480 -5.769 -4.028 1.00 0.00 O ATOM 33 CB LEU A 3 -4.503 -2.961 -3.467 1.00 0.00 C ATOM 34 CG LEU A 3 -4.748 -1.547 -2.939 1.00 0.00 C ATOM 35 CD1 LEU A 3 -4.425 -0.515 -4.008 1.00 0.00 C ATOM 36 CD2 LEU A 3 -6.187 -1.395 -2.467 1.00 0.00 C ATOM 0 H LEU A 3 -1.899 -3.481 -3.507 1.00 0.00 H new ATOM 0 HA LEU A 3 -4.075 -3.773 -1.523 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -3.971 -2.886 -4.415 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -5.468 -3.421 -3.678 1.00 0.00 H new ATOM 0 HG LEU A 3 -4.088 -1.379 -2.088 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.605 0.485 -3.614 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -3.379 -0.607 -4.299 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -5.059 -0.682 -4.879 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -6.343 -0.382 -2.095 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.865 -1.584 -3.299 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -6.385 -2.110 -1.668 1.00 0.00 H new ATOM 48 N LYS A 4 -4.633 -6.100 -2.125 1.00 0.00 N ATOM 49 CA LYS A 4 -4.915 -7.502 -2.410 1.00 0.00 C ATOM 50 C LYS A 4 -5.573 -7.658 -3.777 1.00 0.00 C ATOM 51 O LYS A 4 -5.403 -8.677 -4.445 1.00 0.00 O ATOM 52 CB LYS A 4 -5.820 -8.091 -1.326 1.00 0.00 C ATOM 53 CG LYS A 4 -5.179 -8.122 0.051 1.00 0.00 C ATOM 54 CD LYS A 4 -4.543 -9.471 0.341 1.00 0.00 C ATOM 55 CE LYS A 4 -4.558 -9.787 1.828 1.00 0.00 C ATOM 56 NZ LYS A 4 -3.234 -10.272 2.306 1.00 0.00 N ATOM 0 H LYS A 4 -5.014 -5.765 -1.240 1.00 0.00 H new ATOM 0 HA LYS A 4 -3.969 -8.043 -2.419 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.740 -7.508 -1.276 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -6.100 -9.105 -1.610 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -4.422 -7.340 0.119 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -5.932 -7.903 0.808 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -5.077 -10.250 -0.203 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -3.515 -9.475 -0.022 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -4.841 -8.894 2.386 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -5.316 -10.543 2.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -3.286 -10.476 3.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -2.975 -11.138 1.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -2.514 -9.541 2.136 1.00 0.00 H new ATOM 70 N SER A 5 -6.325 -6.641 -4.186 1.00 0.00 N ATOM 71 CA SER A 5 -7.010 -6.666 -5.473 1.00 0.00 C ATOM 72 C SER A 5 -6.015 -6.839 -6.616 1.00 0.00 C ATOM 73 O SER A 5 -6.367 -7.316 -7.695 1.00 0.00 O ATOM 74 CB SER A 5 -7.815 -5.380 -5.672 1.00 0.00 C ATOM 75 OG SER A 5 -7.080 -4.248 -5.241 1.00 0.00 O ATOM 0 H SER A 5 -6.475 -5.790 -3.645 1.00 0.00 H new ATOM 0 HA SER A 5 -7.691 -7.517 -5.477 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.076 -5.269 -6.725 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.751 -5.443 -5.117 1.00 0.00 H new ATOM 0 HG SER A 5 -6.141 -4.348 -5.504 1.00 0.00 H new ATOM 81 N ASP A 6 -4.769 -6.447 -6.371 1.00 0.00 N ATOM 82 CA ASP A 6 -3.720 -6.559 -7.378 1.00 0.00 C ATOM 83 C ASP A 6 -3.619 -7.988 -7.902 1.00 0.00 C ATOM 84 O ASP A 6 -3.345 -8.209 -9.081 1.00 0.00 O ATOM 85 CB ASP A 6 -2.376 -6.119 -6.796 1.00 0.00 C ATOM 86 CG ASP A 6 -2.249 -4.611 -6.707 1.00 0.00 C ATOM 87 OD1 ASP A 6 -2.829 -3.915 -7.566 1.00 0.00 O ATOM 88 OD2 ASP A 6 -1.569 -4.127 -5.778 1.00 0.00 O ATOM 0 H ASP A 6 -4.461 -6.049 -5.484 1.00 0.00 H new ATOM 0 HA ASP A 6 -3.978 -5.904 -8.210 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -2.255 -6.550 -5.802 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.569 -6.513 -7.414 1.00 0.00 H new ATOM 93 N GLU A 7 -3.842 -8.954 -7.016 1.00 0.00 N ATOM 94 CA GLU A 7 -3.774 -10.362 -7.389 1.00 0.00 C ATOM 95 C GLU A 7 -4.877 -10.716 -8.383 1.00 0.00 C ATOM 96 O GLU A 7 -4.617 -11.306 -9.432 1.00 0.00 O ATOM 97 CB GLU A 7 -3.888 -11.248 -6.147 1.00 0.00 C ATOM 98 CG GLU A 7 -2.695 -12.168 -5.944 1.00 0.00 C ATOM 99 CD GLU A 7 -2.873 -13.512 -6.623 1.00 0.00 C ATOM 100 OE1 GLU A 7 -4.026 -13.980 -6.723 1.00 0.00 O ATOM 101 OE2 GLU A 7 -1.857 -14.096 -7.056 1.00 0.00 O ATOM 0 H GLU A 7 -4.071 -8.787 -6.036 1.00 0.00 H new ATOM 0 HA GLU A 7 -2.809 -10.539 -7.865 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -4.001 -10.614 -5.268 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -4.793 -11.851 -6.223 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -1.798 -11.685 -6.332 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -2.537 -12.322 -4.877 1.00 0.00 H new ATOM 108 N VAL A 8 -6.109 -10.351 -8.044 1.00 0.00 N ATOM 109 CA VAL A 8 -7.252 -10.628 -8.905 1.00 0.00 C ATOM 110 C VAL A 8 -6.975 -10.199 -10.342 1.00 0.00 C ATOM 111 O VAL A 8 -7.176 -10.970 -11.281 1.00 0.00 O ATOM 112 CB VAL A 8 -8.520 -9.913 -8.403 1.00 0.00 C ATOM 113 CG1 VAL A 8 -9.624 -9.984 -9.447 1.00 0.00 C ATOM 114 CG2 VAL A 8 -8.983 -10.513 -7.084 1.00 0.00 C ATOM 0 H VAL A 8 -6.341 -9.863 -7.179 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.416 -11.705 -8.876 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.280 -8.863 -8.235 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.511 -9.473 -9.073 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.288 -9.503 -10.365 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.865 -11.027 -9.651 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.880 -9.996 -6.744 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.205 -11.571 -7.224 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -8.196 -10.403 -6.338 1.00 0.00 H new ATOM 124 N PHE A 9 -6.513 -8.964 -10.506 1.00 0.00 N ATOM 125 CA PHE A 9 -6.208 -8.431 -11.829 1.00 0.00 C ATOM 126 C PHE A 9 -5.139 -9.272 -12.520 1.00 0.00 C ATOM 127 O PHE A 9 -5.163 -9.446 -13.738 1.00 0.00 O ATOM 128 CB PHE A 9 -5.741 -6.979 -11.721 1.00 0.00 C ATOM 129 CG PHE A 9 -6.868 -5.992 -11.610 1.00 0.00 C ATOM 130 CD1 PHE A 9 -7.992 -6.112 -12.411 1.00 0.00 C ATOM 131 CD2 PHE A 9 -6.804 -4.946 -10.704 1.00 0.00 C ATOM 132 CE1 PHE A 9 -9.030 -5.205 -12.312 1.00 0.00 C ATOM 133 CE2 PHE A 9 -7.840 -4.037 -10.599 1.00 0.00 C ATOM 134 CZ PHE A 9 -8.955 -4.167 -11.404 1.00 0.00 C ATOM 0 H PHE A 9 -6.342 -8.313 -9.739 1.00 0.00 H new ATOM 0 HA PHE A 9 -7.118 -8.469 -12.428 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.094 -6.878 -10.850 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -5.139 -6.734 -12.596 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -8.058 -6.923 -13.121 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.934 -4.840 -10.072 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -9.899 -5.308 -12.944 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -7.778 -3.226 -9.888 1.00 0.00 H new ATOM 0 HZ PHE A 9 -9.766 -3.459 -11.324 1.00 0.00 H new ATOM 144 N ALA A 10 -4.202 -9.791 -11.734 1.00 0.00 N ATOM 145 CA ALA A 10 -3.125 -10.614 -12.269 1.00 0.00 C ATOM 146 C ALA A 10 -3.662 -11.932 -12.817 1.00 0.00 C ATOM 147 O ALA A 10 -3.283 -12.364 -13.906 1.00 0.00 O ATOM 148 CB ALA A 10 -2.076 -10.874 -11.198 1.00 0.00 C ATOM 0 H ALA A 10 -4.167 -9.656 -10.724 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.661 -10.070 -13.092 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -1.278 -11.490 -11.612 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.662 -9.925 -10.856 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.536 -11.393 -10.357 1.00 0.00 H new ATOM 154 N LYS A 11 -4.546 -12.567 -12.056 1.00 0.00 N ATOM 155 CA LYS A 11 -5.136 -13.836 -12.464 1.00 0.00 C ATOM 156 C LYS A 11 -6.095 -13.639 -13.634 1.00 0.00 C ATOM 157 O LYS A 11 -6.054 -14.384 -14.614 1.00 0.00 O ATOM 158 CB LYS A 11 -5.876 -14.480 -11.289 1.00 0.00 C ATOM 159 CG LYS A 11 -5.086 -14.464 -9.991 1.00 0.00 C ATOM 160 CD LYS A 11 -3.697 -15.051 -10.176 1.00 0.00 C ATOM 161 CE LYS A 11 -3.761 -16.496 -10.646 1.00 0.00 C ATOM 162 NZ LYS A 11 -2.610 -17.295 -10.142 1.00 0.00 N ATOM 0 H LYS A 11 -4.870 -12.223 -11.152 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.330 -14.496 -12.784 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.821 -13.959 -11.136 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.119 -15.512 -11.544 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -5.004 -13.440 -9.627 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -5.623 -15.031 -9.230 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -3.143 -14.455 -10.901 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.150 -14.997 -9.235 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.693 -16.947 -10.306 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -3.773 -16.523 -11.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -2.690 -18.274 -10.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -1.721 -16.879 -10.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -2.613 -17.291 -9.102 1.00 0.00 H new ATOM 176 N ILE A 12 -6.954 -12.632 -13.526 1.00 0.00 N ATOM 177 CA ILE A 12 -7.920 -12.336 -14.576 1.00 0.00 C ATOM 178 C ILE A 12 -7.220 -12.025 -15.895 1.00 0.00 C ATOM 179 O ILE A 12 -7.671 -12.442 -16.962 1.00 0.00 O ATOM 180 CB ILE A 12 -8.822 -11.147 -14.194 1.00 0.00 C ATOM 181 CG1 ILE A 12 -9.725 -11.521 -13.017 1.00 0.00 C ATOM 182 CG2 ILE A 12 -9.655 -10.708 -15.389 1.00 0.00 C ATOM 183 CD1 ILE A 12 -10.522 -10.357 -12.473 1.00 0.00 C ATOM 0 H ILE A 12 -7.001 -12.007 -12.721 1.00 0.00 H new ATOM 0 HA ILE A 12 -8.538 -13.226 -14.696 1.00 0.00 H new ATOM 0 HB ILE A 12 -8.189 -10.313 -13.891 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -10.413 -12.306 -13.332 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -9.112 -11.937 -12.217 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -10.287 -9.867 -15.103 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -8.994 -10.405 -16.202 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -10.281 -11.536 -15.720 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -11.139 -10.696 -11.641 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -9.841 -9.580 -12.127 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -11.161 -9.955 -13.259 1.00 0.00 H new ATOM 195 N ALA A 13 -6.115 -11.292 -15.814 1.00 0.00 N ATOM 196 CA ALA A 13 -5.350 -10.929 -17.000 1.00 0.00 C ATOM 197 C ALA A 13 -4.819 -12.169 -17.712 1.00 0.00 C ATOM 198 O ALA A 13 -4.870 -12.263 -18.938 1.00 0.00 O ATOM 199 CB ALA A 13 -4.204 -10.001 -16.625 1.00 0.00 C ATOM 0 H ALA A 13 -5.729 -10.938 -14.939 1.00 0.00 H new ATOM 0 HA ALA A 13 -6.016 -10.406 -17.686 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.641 -9.738 -17.520 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -4.604 -9.095 -16.168 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.545 -10.504 -15.917 1.00 0.00 H new ATOM 205 N LYS A 14 -4.308 -13.118 -16.935 1.00 0.00 N ATOM 206 CA LYS A 14 -3.767 -14.353 -17.490 1.00 0.00 C ATOM 207 C LYS A 14 -4.816 -15.077 -18.328 1.00 0.00 C ATOM 208 O LYS A 14 -4.496 -15.685 -19.350 1.00 0.00 O ATOM 209 CB LYS A 14 -3.275 -15.268 -16.367 1.00 0.00 C ATOM 210 CG LYS A 14 -2.153 -14.666 -15.540 1.00 0.00 C ATOM 211 CD LYS A 14 -0.893 -15.514 -15.607 1.00 0.00 C ATOM 212 CE LYS A 14 0.110 -15.107 -14.538 1.00 0.00 C ATOM 213 NZ LYS A 14 1.409 -15.818 -14.698 1.00 0.00 N ATOM 0 H LYS A 14 -4.257 -13.055 -15.918 1.00 0.00 H new ATOM 0 HA LYS A 14 -2.927 -14.096 -18.135 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.112 -15.506 -15.710 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -2.932 -16.208 -16.799 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -1.935 -13.660 -15.899 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -2.475 -14.572 -14.503 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -1.153 -16.565 -15.482 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.437 -15.414 -16.592 1.00 0.00 H new ATOM 0 HE2 LYS A 14 0.276 -14.031 -14.587 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -0.303 -15.321 -13.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.066 -15.514 -13.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.254 -16.844 -14.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 1.815 -15.593 -15.629 1.00 0.00 H new ATOM 227 N ARG A 15 -6.069 -15.007 -17.890 1.00 0.00 N ATOM 228 CA ARG A 15 -7.164 -15.656 -18.600 1.00 0.00 C ATOM 229 C ARG A 15 -7.440 -14.958 -19.929 1.00 0.00 C ATOM 230 O ARG A 15 -7.930 -15.575 -20.876 1.00 0.00 O ATOM 231 CB ARG A 15 -8.429 -15.657 -17.740 1.00 0.00 C ATOM 232 CG ARG A 15 -8.288 -16.448 -16.450 1.00 0.00 C ATOM 233 CD ARG A 15 -9.028 -17.774 -16.525 1.00 0.00 C ATOM 234 NE ARG A 15 -8.526 -18.620 -17.604 1.00 0.00 N ATOM 235 CZ ARG A 15 -9.188 -19.665 -18.088 1.00 0.00 C ATOM 236 NH1 ARG A 15 -10.374 -19.990 -17.591 1.00 0.00 N ATOM 237 NH2 ARG A 15 -8.665 -20.387 -19.070 1.00 0.00 N ATOM 0 H ARG A 15 -6.351 -14.507 -17.047 1.00 0.00 H new ATOM 0 HA ARG A 15 -6.871 -16.686 -18.804 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -8.694 -14.628 -17.498 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -9.253 -16.070 -18.321 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -7.233 -16.630 -16.247 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -8.676 -15.861 -15.618 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -8.927 -18.300 -15.575 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -10.091 -17.588 -16.675 1.00 0.00 H new ATOM 0 HE ARG A 15 -7.617 -18.396 -18.008 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -10.779 -19.437 -16.836 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -10.881 -20.793 -17.964 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -7.753 -20.140 -19.455 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -9.175 -21.189 -19.440 1.00 0.00 H new ATOM 251 N LEU A 16 -7.123 -13.670 -19.991 1.00 0.00 N ATOM 252 CA LEU A 16 -7.337 -12.887 -21.203 1.00 0.00 C ATOM 253 C LEU A 16 -6.470 -13.405 -22.346 1.00 0.00 C ATOM 254 O LEU A 16 -6.773 -13.182 -23.518 1.00 0.00 O ATOM 255 CB LEU A 16 -7.028 -11.412 -20.943 1.00 0.00 C ATOM 256 CG LEU A 16 -7.819 -10.750 -19.813 1.00 0.00 C ATOM 257 CD1 LEU A 16 -7.523 -9.260 -19.756 1.00 0.00 C ATOM 258 CD2 LEU A 16 -9.311 -10.993 -19.994 1.00 0.00 C ATOM 0 H LEU A 16 -6.717 -13.145 -19.216 1.00 0.00 H new ATOM 0 HA LEU A 16 -8.384 -12.988 -21.490 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.965 -11.318 -20.719 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.211 -10.855 -21.862 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.510 -11.197 -18.868 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.095 -8.806 -18.946 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.458 -9.107 -19.579 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.804 -8.797 -20.702 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.859 -10.515 -19.182 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.635 -10.573 -20.946 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.509 -12.065 -19.984 1.00 0.00 H new ATOM 270 N GLU A 17 -5.391 -14.100 -21.996 1.00 0.00 N ATOM 271 CA GLU A 17 -4.481 -14.651 -22.994 1.00 0.00 C ATOM 272 C GLU A 17 -5.033 -15.949 -23.575 1.00 0.00 C ATOM 273 O GLU A 17 -4.542 -16.446 -24.588 1.00 0.00 O ATOM 274 CB GLU A 17 -3.104 -14.900 -22.377 1.00 0.00 C ATOM 275 CG GLU A 17 -2.433 -13.640 -21.856 1.00 0.00 C ATOM 276 CD GLU A 17 -0.979 -13.864 -21.488 1.00 0.00 C ATOM 277 OE1 GLU A 17 -0.608 -15.023 -21.207 1.00 0.00 O ATOM 278 OE2 GLU A 17 -0.212 -12.878 -21.480 1.00 0.00 O ATOM 0 H GLU A 17 -5.126 -14.294 -21.030 1.00 0.00 H new ATOM 0 HA GLU A 17 -4.384 -13.925 -23.801 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.206 -15.612 -21.558 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -2.459 -15.363 -23.124 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.496 -12.859 -22.614 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -2.974 -13.280 -20.981 1.00 0.00 H new ATOM 285 N SER A 18 -6.058 -16.493 -22.926 1.00 0.00 N ATOM 286 CA SER A 18 -6.675 -17.735 -23.375 1.00 0.00 C ATOM 287 C SER A 18 -7.851 -17.453 -24.305 1.00 0.00 C ATOM 288 O SER A 18 -8.308 -18.336 -25.031 1.00 0.00 O ATOM 289 CB SER A 18 -7.145 -18.559 -22.175 1.00 0.00 C ATOM 290 OG SER A 18 -6.614 -19.872 -22.218 1.00 0.00 O ATOM 0 H SER A 18 -6.478 -16.093 -22.087 1.00 0.00 H new ATOM 0 HA SER A 18 -5.927 -18.304 -23.927 1.00 0.00 H new ATOM 0 HB2 SER A 18 -6.838 -18.069 -21.251 1.00 0.00 H new ATOM 0 HB3 SER A 18 -8.234 -18.604 -22.165 1.00 0.00 H new ATOM 0 HG SER A 18 -6.928 -20.377 -21.439 1.00 0.00 H new ATOM 296 N ILE A 19 -8.337 -16.217 -24.276 1.00 0.00 N ATOM 297 CA ILE A 19 -9.459 -15.817 -25.115 1.00 0.00 C ATOM 298 C ILE A 19 -9.138 -16.015 -26.593 1.00 0.00 C ATOM 299 O ILE A 19 -8.001 -15.820 -27.023 1.00 0.00 O ATOM 300 CB ILE A 19 -9.844 -14.345 -24.878 1.00 0.00 C ATOM 301 CG1 ILE A 19 -10.187 -14.116 -23.405 1.00 0.00 C ATOM 302 CG2 ILE A 19 -11.014 -13.953 -25.768 1.00 0.00 C ATOM 303 CD1 ILE A 19 -10.406 -12.661 -23.054 1.00 0.00 C ATOM 0 H ILE A 19 -7.971 -15.475 -23.680 1.00 0.00 H new ATOM 0 HA ILE A 19 -10.301 -16.452 -24.839 1.00 0.00 H new ATOM 0 HB ILE A 19 -8.992 -13.716 -25.135 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -11.086 -14.680 -23.158 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -9.382 -14.513 -22.787 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -11.274 -12.910 -25.589 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -10.735 -14.083 -26.814 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -11.872 -14.585 -25.540 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -10.645 -12.574 -21.994 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -9.500 -12.094 -23.269 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -11.231 -12.264 -23.646 1.00 0.00 H new ATOM 315 N ASP A 20 -10.147 -16.402 -27.365 1.00 0.00 N ATOM 316 CA ASP A 20 -9.973 -16.623 -28.796 1.00 0.00 C ATOM 317 C ASP A 20 -10.890 -15.709 -29.603 1.00 0.00 C ATOM 318 O ASP A 20 -11.946 -15.281 -29.138 1.00 0.00 O ATOM 319 CB ASP A 20 -10.255 -18.085 -29.146 1.00 0.00 C ATOM 320 CG ASP A 20 -9.049 -18.780 -29.746 1.00 0.00 C ATOM 321 OD1 ASP A 20 -7.934 -18.600 -29.213 1.00 0.00 O ATOM 322 OD2 ASP A 20 -9.220 -19.504 -30.749 1.00 0.00 O ATOM 0 H ASP A 20 -11.094 -16.569 -27.024 1.00 0.00 H new ATOM 0 HA ASP A 20 -8.940 -16.389 -29.051 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -10.567 -18.617 -28.247 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -11.086 -18.133 -29.850 1.00 0.00 H new ATOM 327 N PRO A 21 -10.477 -15.400 -30.841 1.00 0.00 N ATOM 328 CA PRO A 21 -11.247 -14.533 -31.739 1.00 0.00 C ATOM 329 C PRO A 21 -12.530 -15.196 -32.226 1.00 0.00 C ATOM 330 O PRO A 21 -13.461 -14.521 -32.666 1.00 0.00 O ATOM 331 CB PRO A 21 -10.290 -14.296 -32.910 1.00 0.00 C ATOM 332 CG PRO A 21 -9.384 -15.479 -32.904 1.00 0.00 C ATOM 333 CD PRO A 21 -9.229 -15.874 -31.461 1.00 0.00 C ATOM 0 HA PRO A 21 -11.571 -13.618 -31.243 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.831 -14.216 -33.853 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -9.731 -13.369 -32.783 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -9.805 -16.296 -33.489 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.419 -15.234 -33.347 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.109 -16.952 -31.350 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.354 -15.408 -31.009 1.00 0.00 H new ATOM 341 N ALA A 22 -12.574 -16.522 -32.144 1.00 0.00 N ATOM 342 CA ALA A 22 -13.745 -17.275 -32.574 1.00 0.00 C ATOM 343 C ALA A 22 -14.974 -16.895 -31.756 1.00 0.00 C ATOM 344 O ALA A 22 -16.039 -16.621 -32.308 1.00 0.00 O ATOM 345 CB ALA A 22 -13.480 -18.770 -32.468 1.00 0.00 C ATOM 0 H ALA A 22 -11.812 -17.096 -31.784 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.943 -17.025 -33.616 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.363 -19.320 -32.792 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -12.634 -19.035 -33.102 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -13.252 -19.027 -31.433 1.00 0.00 H new ATOM 351 N ASN A 23 -14.819 -16.880 -30.436 1.00 0.00 N ATOM 352 CA ASN A 23 -15.917 -16.534 -29.541 1.00 0.00 C ATOM 353 C ASN A 23 -15.679 -15.176 -28.887 1.00 0.00 C ATOM 354 O ASN A 23 -14.729 -15.002 -28.124 1.00 0.00 O ATOM 355 CB ASN A 23 -16.084 -17.609 -28.465 1.00 0.00 C ATOM 356 CG ASN A 23 -17.507 -18.125 -28.378 1.00 0.00 C ATOM 357 OD1 ASN A 23 -18.306 -17.643 -27.575 1.00 0.00 O ATOM 358 ND2 ASN A 23 -17.830 -19.111 -29.207 1.00 0.00 N ATOM 0 H ASN A 23 -13.944 -17.103 -29.963 1.00 0.00 H new ATOM 0 HA ASN A 23 -16.831 -16.477 -30.133 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -15.412 -18.440 -28.678 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -15.789 -17.200 -27.498 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -18.773 -19.499 -29.195 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -17.135 -19.480 -29.856 1.00 0.00 H new ATOM 365 N ARG A 24 -16.549 -14.218 -29.191 1.00 0.00 N ATOM 366 CA ARG A 24 -16.433 -12.876 -28.634 1.00 0.00 C ATOM 367 C ARG A 24 -17.775 -12.152 -28.677 1.00 0.00 C ATOM 368 O ARG A 24 -18.044 -11.380 -29.598 1.00 0.00 O ATOM 369 CB ARG A 24 -15.382 -12.072 -29.400 1.00 0.00 C ATOM 370 CG ARG A 24 -13.972 -12.238 -28.856 1.00 0.00 C ATOM 371 CD ARG A 24 -13.196 -10.932 -28.913 1.00 0.00 C ATOM 372 NE ARG A 24 -12.097 -10.989 -29.873 1.00 0.00 N ATOM 373 CZ ARG A 24 -12.253 -10.810 -31.180 1.00 0.00 C ATOM 374 NH1 ARG A 24 -13.456 -10.564 -31.679 1.00 0.00 N ATOM 375 NH2 ARG A 24 -11.204 -10.878 -31.990 1.00 0.00 N ATOM 0 H ARG A 24 -17.342 -14.347 -29.820 1.00 0.00 H new ATOM 0 HA ARG A 24 -16.122 -12.967 -27.593 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -15.397 -12.376 -30.447 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -15.652 -11.016 -29.370 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -14.018 -12.591 -27.826 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -13.446 -13.000 -29.431 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -13.872 -10.121 -29.183 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -12.801 -10.702 -27.923 1.00 0.00 H new ATOM 0 HE ARG A 24 -11.158 -11.177 -29.521 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -14.264 -10.512 -31.059 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -13.573 -10.427 -32.683 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -10.277 -11.068 -31.609 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -11.325 -10.740 -32.993 1.00 0.00 H new ATOM 389 N GLN A 25 -18.612 -12.406 -27.677 1.00 0.00 N ATOM 390 CA GLN A 25 -19.927 -11.779 -27.603 1.00 0.00 C ATOM 391 C GLN A 25 -19.814 -10.263 -27.725 1.00 0.00 C ATOM 392 O GLN A 25 -20.476 -9.646 -28.559 1.00 0.00 O ATOM 393 CB GLN A 25 -20.617 -12.147 -26.288 1.00 0.00 C ATOM 394 CG GLN A 25 -21.933 -12.884 -26.478 1.00 0.00 C ATOM 395 CD GLN A 25 -21.749 -14.382 -26.616 1.00 0.00 C ATOM 396 OE1 GLN A 25 -20.785 -14.847 -27.225 1.00 0.00 O ATOM 397 NE2 GLN A 25 -22.675 -15.147 -26.050 1.00 0.00 N ATOM 0 H GLN A 25 -18.404 -13.041 -26.907 1.00 0.00 H new ATOM 0 HA GLN A 25 -20.526 -12.149 -28.435 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -19.945 -12.768 -25.696 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -20.799 -11.237 -25.715 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -22.586 -12.679 -25.629 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -22.435 -12.500 -27.366 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -23.457 -14.719 -25.555 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -22.604 -16.163 -26.110 1.00 0.00 H new ATOM 406 N VAL A 26 -18.971 -9.668 -26.887 1.00 0.00 N ATOM 407 CA VAL A 26 -18.771 -8.224 -26.901 1.00 0.00 C ATOM 408 C VAL A 26 -17.561 -7.828 -26.062 1.00 0.00 C ATOM 409 O VAL A 26 -17.343 -8.367 -24.977 1.00 0.00 O ATOM 410 CB VAL A 26 -20.013 -7.480 -26.375 1.00 0.00 C ATOM 411 CG1 VAL A 26 -20.222 -7.770 -24.897 1.00 0.00 C ATOM 412 CG2 VAL A 26 -19.880 -5.984 -26.619 1.00 0.00 C ATOM 0 H VAL A 26 -18.416 -10.164 -26.190 1.00 0.00 H new ATOM 0 HA VAL A 26 -18.598 -7.939 -27.939 1.00 0.00 H new ATOM 0 HB VAL A 26 -20.887 -7.838 -26.919 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -21.104 -7.236 -24.543 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -20.364 -8.841 -24.753 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -19.348 -7.441 -24.335 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -20.766 -5.474 -26.241 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -18.997 -5.608 -26.102 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -19.782 -5.797 -27.688 1.00 0.00 H new ATOM 422 N GLU A 27 -16.778 -6.883 -26.572 1.00 0.00 N ATOM 423 CA GLU A 27 -15.589 -6.415 -25.868 1.00 0.00 C ATOM 424 C GLU A 27 -15.513 -4.891 -25.882 1.00 0.00 C ATOM 425 O GLU A 27 -15.472 -4.270 -26.945 1.00 0.00 O ATOM 426 CB GLU A 27 -14.328 -7.006 -26.503 1.00 0.00 C ATOM 427 CG GLU A 27 -14.070 -8.451 -26.112 1.00 0.00 C ATOM 428 CD GLU A 27 -13.691 -8.601 -24.651 1.00 0.00 C ATOM 429 OE1 GLU A 27 -13.718 -7.586 -23.924 1.00 0.00 O ATOM 430 OE2 GLU A 27 -13.368 -9.733 -24.234 1.00 0.00 O ATOM 0 H GLU A 27 -16.945 -6.427 -27.469 1.00 0.00 H new ATOM 0 HA GLU A 27 -15.656 -6.748 -24.832 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -14.413 -6.942 -27.588 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.468 -6.401 -26.214 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -14.962 -9.043 -26.315 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.271 -8.855 -26.734 1.00 0.00 H new ATOM 437 N HIS A 28 -15.494 -4.295 -24.695 1.00 0.00 N ATOM 438 CA HIS A 28 -15.423 -2.843 -24.569 1.00 0.00 C ATOM 439 C HIS A 28 -14.460 -2.441 -23.456 1.00 0.00 C ATOM 440 O HIS A 28 -13.976 -3.287 -22.704 1.00 0.00 O ATOM 441 CB HIS A 28 -16.811 -2.265 -24.292 1.00 0.00 C ATOM 442 CG HIS A 28 -17.559 -1.884 -25.533 1.00 0.00 C ATOM 443 ND1 HIS A 28 -17.155 -0.868 -26.373 1.00 0.00 N ATOM 444 CD2 HIS A 28 -18.692 -2.390 -26.074 1.00 0.00 C ATOM 445 CE1 HIS A 28 -18.007 -0.765 -27.377 1.00 0.00 C ATOM 446 NE2 HIS A 28 -18.949 -1.677 -27.219 1.00 0.00 N ATOM 0 H HIS A 28 -15.527 -4.794 -23.806 1.00 0.00 H new ATOM 0 HA HIS A 28 -15.051 -2.439 -25.511 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -17.396 -2.997 -23.735 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -16.709 -1.387 -23.655 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -19.283 -3.203 -25.679 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.944 -0.056 -28.189 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -19.739 -1.827 -27.846 1.00 0.00 H new ATOM 454 N VAL A 29 -14.186 -1.144 -23.357 1.00 0.00 N ATOM 455 CA VAL A 29 -13.281 -0.629 -22.336 1.00 0.00 C ATOM 456 C VAL A 29 -13.946 -0.626 -20.964 1.00 0.00 C ATOM 457 O VAL A 29 -15.134 -0.331 -20.839 1.00 0.00 O ATOM 458 CB VAL A 29 -12.813 0.800 -22.670 1.00 0.00 C ATOM 459 CG1 VAL A 29 -13.982 1.647 -23.149 1.00 0.00 C ATOM 460 CG2 VAL A 29 -12.142 1.436 -21.462 1.00 0.00 C ATOM 0 H VAL A 29 -14.578 -0.430 -23.972 1.00 0.00 H new ATOM 0 HA VAL A 29 -12.416 -1.292 -22.316 1.00 0.00 H new ATOM 0 HB VAL A 29 -12.082 0.745 -23.476 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -13.632 2.653 -23.380 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -14.414 1.199 -24.044 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -14.739 1.697 -22.367 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -11.817 2.445 -21.715 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -12.849 1.480 -20.634 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -11.278 0.840 -21.170 1.00 0.00 H new ATOM 470 N TYR A 30 -13.171 -0.957 -19.937 1.00 0.00 N ATOM 471 CA TYR A 30 -13.684 -0.995 -18.573 1.00 0.00 C ATOM 472 C TYR A 30 -12.670 -0.414 -17.593 1.00 0.00 C ATOM 473 O TYR A 30 -11.518 -0.846 -17.544 1.00 0.00 O ATOM 474 CB TYR A 30 -14.030 -2.431 -18.176 1.00 0.00 C ATOM 475 CG TYR A 30 -15.186 -3.014 -18.958 1.00 0.00 C ATOM 476 CD1 TYR A 30 -16.499 -2.697 -18.635 1.00 0.00 C ATOM 477 CD2 TYR A 30 -14.964 -3.882 -20.020 1.00 0.00 C ATOM 478 CE1 TYR A 30 -17.558 -3.228 -19.346 1.00 0.00 C ATOM 479 CE2 TYR A 30 -16.016 -4.416 -20.738 1.00 0.00 C ATOM 480 CZ TYR A 30 -17.311 -4.087 -20.397 1.00 0.00 C ATOM 481 OH TYR A 30 -18.363 -4.617 -21.108 1.00 0.00 O ATOM 0 H TYR A 30 -12.185 -1.203 -20.024 1.00 0.00 H new ATOM 0 HA TYR A 30 -14.588 -0.387 -18.535 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -13.152 -3.060 -18.319 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -14.271 -2.457 -17.113 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -16.696 -2.024 -17.814 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -13.951 -4.144 -20.289 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -18.573 -2.972 -19.081 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -15.825 -5.088 -21.562 1.00 0.00 H new ATOM 0 HH TYR A 30 -18.018 -5.201 -21.815 1.00 0.00 H new ATOM 491 N LYS A 31 -13.107 0.568 -16.812 1.00 0.00 N ATOM 492 CA LYS A 31 -12.240 1.208 -15.830 1.00 0.00 C ATOM 493 C LYS A 31 -12.564 0.725 -14.420 1.00 0.00 C ATOM 494 O LYS A 31 -13.731 0.567 -14.060 1.00 0.00 O ATOM 495 CB LYS A 31 -12.387 2.730 -15.905 1.00 0.00 C ATOM 496 CG LYS A 31 -11.159 3.433 -16.456 1.00 0.00 C ATOM 497 CD LYS A 31 -10.828 4.684 -15.659 1.00 0.00 C ATOM 498 CE LYS A 31 -11.556 5.903 -16.207 1.00 0.00 C ATOM 499 NZ LYS A 31 -10.672 6.734 -17.071 1.00 0.00 N ATOM 0 H LYS A 31 -14.057 0.938 -16.840 1.00 0.00 H new ATOM 0 HA LYS A 31 -11.210 0.936 -16.060 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -13.246 2.973 -16.530 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -12.599 3.116 -14.908 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.309 2.752 -16.435 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.329 3.699 -17.499 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.102 4.534 -14.615 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -9.752 4.859 -15.685 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.425 5.580 -16.780 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.927 6.507 -15.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.177 7.597 -17.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -9.814 6.993 -16.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -10.407 6.193 -17.918 1.00 0.00 H new ATOM 513 N PHE A 32 -11.524 0.492 -13.626 1.00 0.00 N ATOM 514 CA PHE A 32 -11.699 0.027 -12.255 1.00 0.00 C ATOM 515 C PHE A 32 -11.139 1.040 -11.261 1.00 0.00 C ATOM 516 O PHE A 32 -10.018 1.525 -11.419 1.00 0.00 O ATOM 517 CB PHE A 32 -11.013 -1.327 -12.062 1.00 0.00 C ATOM 518 CG PHE A 32 -11.620 -2.430 -12.882 1.00 0.00 C ATOM 519 CD1 PHE A 32 -12.875 -2.929 -12.573 1.00 0.00 C ATOM 520 CD2 PHE A 32 -10.936 -2.966 -13.961 1.00 0.00 C ATOM 521 CE1 PHE A 32 -13.436 -3.944 -13.325 1.00 0.00 C ATOM 522 CE2 PHE A 32 -11.492 -3.981 -14.717 1.00 0.00 C ATOM 523 CZ PHE A 32 -12.744 -4.470 -14.399 1.00 0.00 C ATOM 0 H PHE A 32 -10.552 0.617 -13.908 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.767 -0.085 -12.069 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -9.959 -1.231 -12.321 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.059 -1.601 -11.008 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.421 -2.520 -11.735 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -9.957 -2.586 -14.214 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -14.414 -4.326 -13.073 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -10.948 -4.391 -15.555 1.00 0.00 H new ATOM 0 HZ PHE A 32 -13.181 -5.262 -14.989 1.00 0.00 H new ATOM 533 N ARG A 33 -11.927 1.354 -10.238 1.00 0.00 N ATOM 534 CA ARG A 33 -11.511 2.311 -9.220 1.00 0.00 C ATOM 535 C ARG A 33 -11.247 1.609 -7.891 1.00 0.00 C ATOM 536 O ARG A 33 -12.164 1.073 -7.268 1.00 0.00 O ATOM 537 CB ARG A 33 -12.580 3.389 -9.036 1.00 0.00 C ATOM 538 CG ARG A 33 -12.516 4.495 -10.077 1.00 0.00 C ATOM 539 CD ARG A 33 -13.643 5.499 -9.894 1.00 0.00 C ATOM 540 NE ARG A 33 -13.244 6.848 -10.287 1.00 0.00 N ATOM 541 CZ ARG A 33 -14.062 7.894 -10.258 1.00 0.00 C ATOM 542 NH1 ARG A 33 -15.317 7.748 -9.855 1.00 0.00 N ATOM 543 NH2 ARG A 33 -13.626 9.090 -10.631 1.00 0.00 N ATOM 0 H ARG A 33 -12.856 0.960 -10.092 1.00 0.00 H new ATOM 0 HA ARG A 33 -10.586 2.780 -9.554 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -13.564 2.923 -9.074 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.474 3.829 -8.044 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.556 5.007 -10.007 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.573 4.060 -11.075 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -14.504 5.189 -10.486 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -13.958 5.504 -8.851 1.00 0.00 H new ATOM 0 HE ARG A 33 -12.285 6.995 -10.601 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -15.656 6.831 -9.566 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -15.943 8.553 -9.834 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -12.661 9.207 -10.941 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -14.255 9.892 -10.608 1.00 0.00 H new ATOM 557 N ILE A 34 -9.989 1.618 -7.463 1.00 0.00 N ATOM 558 CA ILE A 34 -9.605 0.983 -6.208 1.00 0.00 C ATOM 559 C ILE A 34 -9.668 1.973 -5.050 1.00 0.00 C ATOM 560 O ILE A 34 -8.907 2.940 -5.002 1.00 0.00 O ATOM 561 CB ILE A 34 -8.185 0.392 -6.288 1.00 0.00 C ATOM 562 CG1 ILE A 34 -8.077 -0.578 -7.466 1.00 0.00 C ATOM 563 CG2 ILE A 34 -7.828 -0.307 -4.984 1.00 0.00 C ATOM 564 CD1 ILE A 34 -8.916 -1.826 -7.299 1.00 0.00 C ATOM 0 H ILE A 34 -9.219 2.058 -7.967 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.316 0.176 -6.031 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.478 1.206 -6.447 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.381 -0.065 -8.378 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.034 -0.866 -7.595 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.822 -0.720 -5.056 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -7.869 0.410 -4.164 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.538 -1.113 -4.797 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.791 -2.468 -8.171 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.597 -2.362 -6.405 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.965 -1.548 -7.200 1.00 0.00 H new ATOM 576 N THR A 35 -10.579 1.724 -4.115 1.00 0.00 N ATOM 577 CA THR A 35 -10.741 2.592 -2.955 1.00 0.00 C ATOM 578 C THR A 35 -10.281 1.896 -1.679 1.00 0.00 C ATOM 579 O THR A 35 -10.454 0.688 -1.524 1.00 0.00 O ATOM 580 CB THR A 35 -12.207 3.034 -2.785 1.00 0.00 C ATOM 581 OG1 THR A 35 -13.016 1.914 -2.407 1.00 0.00 O ATOM 582 CG2 THR A 35 -12.742 3.640 -4.074 1.00 0.00 C ATOM 0 H THR A 35 -11.216 0.928 -4.138 1.00 0.00 H new ATOM 0 HA THR A 35 -10.122 3.472 -3.129 1.00 0.00 H new ATOM 0 HB THR A 35 -12.247 3.791 -2.002 1.00 0.00 H new ATOM 0 HG1 THR A 35 -13.946 2.204 -2.299 1.00 0.00 H new ATOM 0 HG21 THR A 35 -13.779 3.945 -3.930 1.00 0.00 H new ATOM 0 HG22 THR A 35 -12.142 4.509 -4.344 1.00 0.00 H new ATOM 0 HG23 THR A 35 -12.689 2.901 -4.873 1.00 0.00 H new ATOM 590 N GLN A 36 -9.695 2.668 -0.769 1.00 0.00 N ATOM 591 CA GLN A 36 -9.210 2.124 0.494 1.00 0.00 C ATOM 592 C GLN A 36 -10.200 2.400 1.621 1.00 0.00 C ATOM 593 O GLN A 36 -10.245 3.502 2.166 1.00 0.00 O ATOM 594 CB GLN A 36 -7.846 2.722 0.841 1.00 0.00 C ATOM 595 CG GLN A 36 -6.832 1.692 1.312 1.00 0.00 C ATOM 596 CD GLN A 36 -6.834 1.517 2.818 1.00 0.00 C ATOM 597 OE1 GLN A 36 -7.119 2.455 3.563 1.00 0.00 O ATOM 598 NE2 GLN A 36 -6.516 0.312 3.275 1.00 0.00 N ATOM 0 H GLN A 36 -9.545 3.670 -0.883 1.00 0.00 H new ATOM 0 HA GLN A 36 -9.108 1.045 0.380 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -7.450 3.235 -0.035 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.976 3.474 1.619 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -7.046 0.734 0.838 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.836 1.993 0.986 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -6.286 -0.437 2.622 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -6.501 0.135 4.279 1.00 0.00 H new ATOM 607 N GLY A 37 -10.994 1.390 1.966 1.00 0.00 N ATOM 608 CA GLY A 37 -11.973 1.544 3.026 1.00 0.00 C ATOM 609 C GLY A 37 -13.245 2.215 2.547 1.00 0.00 C ATOM 610 O GLY A 37 -14.334 1.919 3.037 1.00 0.00 O ATOM 0 H GLY A 37 -10.976 0.468 1.530 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -12.215 0.564 3.438 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -11.539 2.131 3.835 1.00 0.00 H new ATOM 614 N GLY A 38 -13.107 3.125 1.587 1.00 0.00 N ATOM 615 CA GLY A 38 -14.262 3.827 1.059 1.00 0.00 C ATOM 616 C GLY A 38 -13.878 5.056 0.259 1.00 0.00 C ATOM 617 O GLY A 38 -14.742 5.810 -0.189 1.00 0.00 O ATOM 0 H GLY A 38 -12.216 3.388 1.166 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -14.837 3.150 0.426 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -14.912 4.122 1.883 1.00 0.00 H new ATOM 621 N LYS A 39 -12.577 5.260 0.079 1.00 0.00 N ATOM 622 CA LYS A 39 -12.079 6.406 -0.672 1.00 0.00 C ATOM 623 C LYS A 39 -11.133 5.959 -1.782 1.00 0.00 C ATOM 624 O LYS A 39 -10.221 5.164 -1.552 1.00 0.00 O ATOM 625 CB LYS A 39 -11.360 7.381 0.263 1.00 0.00 C ATOM 626 CG LYS A 39 -10.865 8.637 -0.432 1.00 0.00 C ATOM 627 CD LYS A 39 -10.151 9.566 0.535 1.00 0.00 C ATOM 628 CE LYS A 39 -9.706 10.849 -0.149 1.00 0.00 C ATOM 629 NZ LYS A 39 -9.969 12.048 0.694 1.00 0.00 N ATOM 0 H LYS A 39 -11.848 4.646 0.443 1.00 0.00 H new ATOM 0 HA LYS A 39 -12.932 6.910 -1.126 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.037 7.665 1.069 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.513 6.872 0.723 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -10.188 8.363 -1.241 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -11.708 9.160 -0.884 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -10.814 9.807 1.366 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -9.284 9.057 0.956 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.641 10.790 -0.374 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -10.227 10.953 -1.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.651 12.902 0.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.988 12.119 0.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.451 11.962 1.592 1.00 0.00 H new ATOM 643 N VAL A 40 -11.354 6.476 -2.986 1.00 0.00 N ATOM 644 CA VAL A 40 -10.520 6.132 -4.131 1.00 0.00 C ATOM 645 C VAL A 40 -9.048 6.403 -3.840 1.00 0.00 C ATOM 646 O VAL A 40 -8.695 7.443 -3.283 1.00 0.00 O ATOM 647 CB VAL A 40 -10.937 6.921 -5.387 1.00 0.00 C ATOM 648 CG1 VAL A 40 -9.928 6.716 -6.506 1.00 0.00 C ATOM 649 CG2 VAL A 40 -12.332 6.511 -5.834 1.00 0.00 C ATOM 0 H VAL A 40 -12.104 7.135 -3.194 1.00 0.00 H new ATOM 0 HA VAL A 40 -10.661 5.067 -4.316 1.00 0.00 H new ATOM 0 HB VAL A 40 -10.957 7.982 -5.139 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -10.239 7.281 -7.385 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.948 7.063 -6.180 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.873 5.657 -6.757 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -12.611 7.078 -6.722 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -12.342 5.446 -6.066 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -13.045 6.715 -5.035 1.00 0.00 H new ATOM 659 N VAL A 41 -8.192 5.460 -4.221 1.00 0.00 N ATOM 660 CA VAL A 41 -6.757 5.597 -4.003 1.00 0.00 C ATOM 661 C VAL A 41 -5.973 5.245 -5.262 1.00 0.00 C ATOM 662 O VAL A 41 -4.747 5.348 -5.293 1.00 0.00 O ATOM 663 CB VAL A 41 -6.277 4.701 -2.845 1.00 0.00 C ATOM 664 CG1 VAL A 41 -6.692 5.291 -1.506 1.00 0.00 C ATOM 665 CG2 VAL A 41 -6.819 3.288 -3.006 1.00 0.00 C ATOM 0 H VAL A 41 -8.468 4.593 -4.682 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.575 6.640 -3.745 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.188 4.654 -2.872 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.344 4.645 -0.700 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.251 6.281 -1.393 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.778 5.370 -1.464 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -6.470 2.668 -2.180 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.909 3.314 -3.006 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -6.467 2.868 -3.948 1.00 0.00 H new ATOM 675 N LYS A 42 -6.690 4.829 -6.301 1.00 0.00 N ATOM 676 CA LYS A 42 -6.063 4.463 -7.566 1.00 0.00 C ATOM 677 C LYS A 42 -7.114 4.075 -8.601 1.00 0.00 C ATOM 678 O LYS A 42 -8.250 3.755 -8.256 1.00 0.00 O ATOM 679 CB LYS A 42 -5.085 3.305 -7.357 1.00 0.00 C ATOM 680 CG LYS A 42 -3.768 3.481 -8.092 1.00 0.00 C ATOM 681 CD LYS A 42 -2.883 2.253 -7.955 1.00 0.00 C ATOM 682 CE LYS A 42 -1.480 2.625 -7.501 1.00 0.00 C ATOM 683 NZ LYS A 42 -0.603 2.986 -8.649 1.00 0.00 N ATOM 0 H LYS A 42 -7.706 4.737 -6.292 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.516 5.330 -7.937 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -4.885 3.197 -6.291 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -5.555 2.379 -7.688 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -3.962 3.674 -9.147 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.245 4.353 -7.699 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -3.327 1.561 -7.239 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.831 1.732 -8.911 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.533 3.464 -6.807 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.041 1.789 -6.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.344 3.233 -8.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.531 2.177 -9.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -1.009 3.800 -9.153 1.00 0.00 H new ATOM 697 N ASN A 43 -6.725 4.104 -9.872 1.00 0.00 N ATOM 698 CA ASN A 43 -7.633 3.754 -10.957 1.00 0.00 C ATOM 699 C ASN A 43 -6.899 2.993 -12.057 1.00 0.00 C ATOM 700 O ASN A 43 -5.879 3.454 -12.570 1.00 0.00 O ATOM 701 CB ASN A 43 -8.278 5.015 -11.537 1.00 0.00 C ATOM 702 CG ASN A 43 -8.654 6.018 -10.464 1.00 0.00 C ATOM 703 OD1 ASN A 43 -9.417 5.708 -9.549 1.00 0.00 O ATOM 704 ND2 ASN A 43 -8.118 7.228 -10.571 1.00 0.00 N ATOM 0 H ASN A 43 -5.787 4.366 -10.175 1.00 0.00 H new ATOM 0 HA ASN A 43 -8.412 3.109 -10.551 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -7.589 5.481 -12.241 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -9.169 4.738 -12.100 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -8.334 7.945 -9.878 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -7.490 7.441 -11.346 1.00 0.00 H new ATOM 711 N TRP A 44 -7.426 1.827 -12.414 1.00 0.00 N ATOM 712 CA TRP A 44 -6.821 1.002 -13.454 1.00 0.00 C ATOM 713 C TRP A 44 -7.645 1.051 -14.736 1.00 0.00 C ATOM 714 O TRP A 44 -8.853 1.287 -14.700 1.00 0.00 O ATOM 715 CB TRP A 44 -6.688 -0.444 -12.973 1.00 0.00 C ATOM 716 CG TRP A 44 -5.626 -0.628 -11.931 1.00 0.00 C ATOM 717 CD1 TRP A 44 -5.760 -0.446 -10.584 1.00 0.00 C ATOM 718 CD2 TRP A 44 -4.269 -1.029 -12.152 1.00 0.00 C ATOM 719 NE1 TRP A 44 -4.567 -0.709 -9.954 1.00 0.00 N ATOM 720 CE2 TRP A 44 -3.638 -1.069 -10.893 1.00 0.00 C ATOM 721 CE3 TRP A 44 -3.527 -1.358 -13.289 1.00 0.00 C ATOM 722 CZ2 TRP A 44 -2.300 -1.426 -10.744 1.00 0.00 C ATOM 723 CZ3 TRP A 44 -2.200 -1.711 -13.139 1.00 0.00 C ATOM 724 CH2 TRP A 44 -1.597 -1.744 -11.874 1.00 0.00 C ATOM 0 H TRP A 44 -8.270 1.432 -11.999 1.00 0.00 H new ATOM 0 HA TRP A 44 -5.829 1.399 -13.667 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -7.645 -0.774 -12.569 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -6.464 -1.084 -13.826 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.669 -0.141 -10.087 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -4.401 -0.646 -8.950 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -3.983 -1.337 -14.268 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -1.834 -1.451 -9.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -1.617 -1.966 -14.012 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -0.558 -2.026 -11.790 1.00 0.00 H new ATOM 735 N VAL A 45 -6.985 0.826 -15.867 1.00 0.00 N ATOM 736 CA VAL A 45 -7.657 0.844 -17.161 1.00 0.00 C ATOM 737 C VAL A 45 -7.600 -0.526 -17.829 1.00 0.00 C ATOM 738 O VAL A 45 -6.614 -1.251 -17.696 1.00 0.00 O ATOM 739 CB VAL A 45 -7.033 1.889 -18.104 1.00 0.00 C ATOM 740 CG1 VAL A 45 -5.585 1.537 -18.408 1.00 0.00 C ATOM 741 CG2 VAL A 45 -7.844 2.001 -19.386 1.00 0.00 C ATOM 0 H VAL A 45 -5.985 0.629 -15.914 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.697 1.111 -16.973 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.049 2.858 -17.606 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.161 2.287 -19.076 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.014 1.513 -17.480 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.541 0.559 -18.886 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.389 2.744 -20.041 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.862 1.035 -19.891 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.863 2.304 -19.146 1.00 0.00 H new ATOM 751 N MET A 46 -8.662 -0.873 -18.547 1.00 0.00 N ATOM 752 CA MET A 46 -8.732 -2.156 -19.238 1.00 0.00 C ATOM 753 C MET A 46 -8.719 -1.960 -20.750 1.00 0.00 C ATOM 754 O MET A 46 -9.641 -1.372 -21.317 1.00 0.00 O ATOM 755 CB MET A 46 -9.992 -2.916 -18.820 1.00 0.00 C ATOM 756 CG MET A 46 -10.069 -4.324 -19.390 1.00 0.00 C ATOM 757 SD MET A 46 -10.726 -5.516 -18.208 1.00 0.00 S ATOM 758 CE MET A 46 -12.419 -5.658 -18.776 1.00 0.00 C ATOM 0 H MET A 46 -9.486 -0.284 -18.666 1.00 0.00 H new ATOM 0 HA MET A 46 -7.855 -2.740 -18.958 1.00 0.00 H new ATOM 0 HB2 MET A 46 -10.030 -2.971 -17.732 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.869 -2.354 -19.141 1.00 0.00 H new ATOM 0 HG2 MET A 46 -10.697 -4.317 -20.281 1.00 0.00 H new ATOM 0 HG3 MET A 46 -9.074 -4.640 -19.704 1.00 0.00 H new ATOM 0 HE1 MET A 46 -13.083 -5.164 -18.067 1.00 0.00 H new ATOM 0 HE2 MET A 46 -12.516 -5.186 -19.753 1.00 0.00 H new ATOM 0 HE3 MET A 46 -12.690 -6.711 -18.854 1.00 0.00 H new ATOM 768 N ASP A 47 -7.670 -2.455 -21.398 1.00 0.00 N ATOM 769 CA ASP A 47 -7.539 -2.335 -22.845 1.00 0.00 C ATOM 770 C ASP A 47 -8.743 -2.948 -23.553 1.00 0.00 C ATOM 771 O ASP A 47 -9.757 -3.255 -22.924 1.00 0.00 O ATOM 772 CB ASP A 47 -6.253 -3.014 -23.320 1.00 0.00 C ATOM 773 CG ASP A 47 -5.419 -2.116 -24.212 1.00 0.00 C ATOM 774 OD1 ASP A 47 -5.796 -1.934 -25.389 1.00 0.00 O ATOM 775 OD2 ASP A 47 -4.391 -1.594 -23.734 1.00 0.00 O ATOM 0 H ASP A 47 -6.898 -2.943 -20.944 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.495 -1.275 -23.094 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.662 -3.311 -22.454 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.506 -3.926 -23.862 1.00 0.00 H new ATOM 780 N LEU A 48 -8.626 -3.123 -24.864 1.00 0.00 N ATOM 781 CA LEU A 48 -9.706 -3.698 -25.659 1.00 0.00 C ATOM 782 C LEU A 48 -9.158 -4.386 -26.905 1.00 0.00 C ATOM 783 O LEU A 48 -9.420 -5.566 -27.142 1.00 0.00 O ATOM 784 CB LEU A 48 -10.705 -2.611 -26.060 1.00 0.00 C ATOM 785 CG LEU A 48 -12.146 -3.073 -26.284 1.00 0.00 C ATOM 786 CD1 LEU A 48 -12.971 -1.962 -26.913 1.00 0.00 C ATOM 787 CD2 LEU A 48 -12.177 -4.321 -27.154 1.00 0.00 C ATOM 0 H LEU A 48 -7.794 -2.875 -25.400 1.00 0.00 H new ATOM 0 HA LEU A 48 -10.216 -4.444 -25.049 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -10.707 -1.844 -25.286 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -10.349 -2.139 -26.976 1.00 0.00 H new ATOM 0 HG LEU A 48 -12.583 -3.318 -25.316 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -13.993 -2.309 -27.065 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -12.977 -1.095 -26.253 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -12.536 -1.684 -27.873 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.210 -4.635 -27.303 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -11.722 -4.103 -28.120 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -11.622 -5.120 -26.663 1.00 0.00 H new ATOM 799 N LYS A 49 -8.394 -3.643 -27.698 1.00 0.00 N ATOM 800 CA LYS A 49 -7.805 -4.181 -28.918 1.00 0.00 C ATOM 801 C LYS A 49 -6.680 -5.159 -28.594 1.00 0.00 C ATOM 802 O LYS A 49 -6.387 -6.062 -29.376 1.00 0.00 O ATOM 803 CB LYS A 49 -7.272 -3.046 -29.795 1.00 0.00 C ATOM 804 CG LYS A 49 -8.041 -2.866 -31.092 1.00 0.00 C ATOM 805 CD LYS A 49 -7.603 -1.614 -31.832 1.00 0.00 C ATOM 806 CE LYS A 49 -8.298 -1.490 -33.179 1.00 0.00 C ATOM 807 NZ LYS A 49 -8.966 -0.168 -33.339 1.00 0.00 N ATOM 0 H LYS A 49 -8.168 -2.665 -27.517 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.583 -4.717 -29.461 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -7.307 -2.115 -29.230 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -6.225 -3.239 -30.027 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.890 -3.737 -31.729 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -9.108 -2.808 -30.878 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -7.824 -0.736 -31.225 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -6.523 -1.636 -31.979 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -7.569 -1.628 -33.978 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.037 -2.285 -33.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -9.428 -0.123 -34.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -9.679 -0.047 -32.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -8.257 0.590 -33.267 1.00 0.00 H new ATOM 821 N ASN A 50 -6.055 -4.972 -27.436 1.00 0.00 N ATOM 822 CA ASN A 50 -4.963 -5.839 -27.009 1.00 0.00 C ATOM 823 C ASN A 50 -5.432 -6.816 -25.935 1.00 0.00 C ATOM 824 O ASN A 50 -4.846 -7.882 -25.752 1.00 0.00 O ATOM 825 CB ASN A 50 -3.798 -5.002 -26.478 1.00 0.00 C ATOM 826 CG ASN A 50 -2.480 -5.752 -26.522 1.00 0.00 C ATOM 827 OD1 ASN A 50 -2.005 -6.253 -25.503 1.00 0.00 O ATOM 828 ND2 ASN A 50 -1.883 -5.831 -27.705 1.00 0.00 N ATOM 0 H ASN A 50 -6.286 -4.228 -26.777 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.627 -6.411 -27.874 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -3.713 -4.088 -27.066 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -4.008 -4.702 -25.451 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -0.994 -6.322 -27.796 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -2.314 -5.400 -28.523 1.00 0.00 H new ATOM 835 N VAL A 51 -6.494 -6.444 -25.227 1.00 0.00 N ATOM 836 CA VAL A 51 -7.044 -7.287 -24.173 1.00 0.00 C ATOM 837 C VAL A 51 -6.063 -7.429 -23.015 1.00 0.00 C ATOM 838 O VAL A 51 -5.875 -8.519 -22.475 1.00 0.00 O ATOM 839 CB VAL A 51 -7.401 -8.689 -24.703 1.00 0.00 C ATOM 840 CG1 VAL A 51 -8.333 -9.404 -23.738 1.00 0.00 C ATOM 841 CG2 VAL A 51 -8.025 -8.591 -26.087 1.00 0.00 C ATOM 0 H VAL A 51 -6.991 -5.564 -25.365 1.00 0.00 H new ATOM 0 HA VAL A 51 -7.952 -6.798 -23.819 1.00 0.00 H new ATOM 0 HB VAL A 51 -6.484 -9.273 -24.783 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -8.574 -10.392 -24.130 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -7.844 -9.507 -22.769 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -9.250 -8.826 -23.622 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -8.271 -9.590 -26.447 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -8.933 -7.990 -26.035 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -7.319 -8.123 -26.772 1.00 0.00 H new ATOM 851 N LYS A 52 -5.439 -6.318 -22.636 1.00 0.00 N ATOM 852 CA LYS A 52 -4.477 -6.316 -21.541 1.00 0.00 C ATOM 853 C LYS A 52 -4.914 -5.360 -20.435 1.00 0.00 C ATOM 854 O LYS A 52 -5.927 -4.670 -20.561 1.00 0.00 O ATOM 855 CB LYS A 52 -3.090 -5.921 -22.053 1.00 0.00 C ATOM 856 CG LYS A 52 -1.951 -6.591 -21.303 1.00 0.00 C ATOM 857 CD LYS A 52 -1.138 -7.493 -22.216 1.00 0.00 C ATOM 858 CE LYS A 52 0.294 -7.638 -21.724 1.00 0.00 C ATOM 859 NZ LYS A 52 0.468 -8.844 -20.868 1.00 0.00 N ATOM 0 H LYS A 52 -5.583 -5.407 -23.072 1.00 0.00 H new ATOM 0 HA LYS A 52 -4.431 -7.324 -21.129 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -3.016 -6.175 -23.110 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -2.978 -4.839 -21.976 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.302 -5.830 -20.870 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.353 -7.176 -20.476 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -1.607 -8.476 -22.270 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -1.137 -7.084 -23.226 1.00 0.00 H new ATOM 0 HE2 LYS A 52 0.967 -7.700 -22.579 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.576 -6.749 -21.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.457 -8.907 -20.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.155 -8.774 -20.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.224 -9.695 -21.414 1.00 0.00 H new ATOM 873 N LEU A 53 -4.143 -5.322 -19.354 1.00 0.00 N ATOM 874 CA LEU A 53 -4.450 -4.448 -18.227 1.00 0.00 C ATOM 875 C LEU A 53 -3.215 -3.663 -17.795 1.00 0.00 C ATOM 876 O LEU A 53 -2.154 -4.238 -17.555 1.00 0.00 O ATOM 877 CB LEU A 53 -4.984 -5.268 -17.051 1.00 0.00 C ATOM 878 CG LEU A 53 -6.355 -4.855 -16.513 1.00 0.00 C ATOM 879 CD1 LEU A 53 -7.428 -5.064 -17.570 1.00 0.00 C ATOM 880 CD2 LEU A 53 -6.689 -5.636 -15.250 1.00 0.00 C ATOM 0 H LEU A 53 -3.301 -5.886 -19.234 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.215 -3.740 -18.546 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -5.035 -6.313 -17.356 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.263 -5.209 -16.236 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.322 -3.795 -16.263 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -8.397 -4.765 -17.169 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -7.196 -4.461 -18.448 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.461 -6.116 -17.852 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -7.668 -5.330 -14.881 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.704 -6.702 -15.475 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.935 -5.436 -14.489 1.00 0.00 H new ATOM 892 N VAL A 54 -3.363 -2.346 -17.696 1.00 0.00 N ATOM 893 CA VAL A 54 -2.261 -1.481 -17.289 1.00 0.00 C ATOM 894 C VAL A 54 -2.768 -0.276 -16.506 1.00 0.00 C ATOM 895 O VAL A 54 -3.960 0.031 -16.523 1.00 0.00 O ATOM 896 CB VAL A 54 -1.456 -0.987 -18.506 1.00 0.00 C ATOM 897 CG1 VAL A 54 -0.034 -0.634 -18.099 1.00 0.00 C ATOM 898 CG2 VAL A 54 -1.459 -2.037 -19.608 1.00 0.00 C ATOM 0 H VAL A 54 -4.235 -1.854 -17.892 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.610 -2.078 -16.650 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.932 -0.086 -18.892 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.519 -0.287 -18.972 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.056 0.154 -17.347 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.456 -1.516 -17.686 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.886 -1.672 -20.460 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.009 -2.957 -19.235 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.485 -2.235 -19.919 1.00 0.00 H new ATOM 908 N GLU A 55 -1.855 0.404 -15.820 1.00 0.00 N ATOM 909 CA GLU A 55 -2.211 1.577 -15.030 1.00 0.00 C ATOM 910 C GLU A 55 -2.298 2.820 -15.911 1.00 0.00 C ATOM 911 O GLU A 55 -1.280 3.395 -16.296 1.00 0.00 O ATOM 912 CB GLU A 55 -1.186 1.799 -13.916 1.00 0.00 C ATOM 913 CG GLU A 55 0.255 1.763 -14.398 1.00 0.00 C ATOM 914 CD GLU A 55 1.066 2.945 -13.903 1.00 0.00 C ATOM 915 OE1 GLU A 55 0.891 4.055 -14.448 1.00 0.00 O ATOM 916 OE2 GLU A 55 1.875 2.759 -12.971 1.00 0.00 O ATOM 0 H GLU A 55 -0.864 0.163 -15.795 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.189 1.400 -14.584 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -1.378 2.762 -13.444 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.323 1.036 -13.150 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.724 0.839 -14.061 1.00 0.00 H new ATOM 0 HG3 GLU A 55 0.269 1.748 -15.488 1.00 0.00 H new ATOM 923 N SER A 56 -3.523 3.230 -16.226 1.00 0.00 N ATOM 924 CA SER A 56 -3.745 4.402 -17.065 1.00 0.00 C ATOM 925 C SER A 56 -5.107 5.026 -16.776 1.00 0.00 C ATOM 926 O SER A 56 -5.921 4.458 -16.048 1.00 0.00 O ATOM 927 CB SER A 56 -3.648 4.023 -18.544 1.00 0.00 C ATOM 928 OG SER A 56 -2.950 5.012 -19.279 1.00 0.00 O ATOM 0 H SER A 56 -4.377 2.768 -15.913 1.00 0.00 H new ATOM 0 HA SER A 56 -2.972 5.135 -16.834 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.139 3.064 -18.644 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.649 3.897 -18.957 1.00 0.00 H new ATOM 0 HG SER A 56 -2.900 4.745 -20.221 1.00 0.00 H new ATOM 934 N ASP A 57 -5.346 6.199 -17.352 1.00 0.00 N ATOM 935 CA ASP A 57 -6.610 6.902 -17.158 1.00 0.00 C ATOM 936 C ASP A 57 -7.318 7.124 -18.491 1.00 0.00 C ATOM 937 O ASP A 57 -8.202 7.973 -18.602 1.00 0.00 O ATOM 938 CB ASP A 57 -6.370 8.244 -16.464 1.00 0.00 C ATOM 939 CG ASP A 57 -7.166 8.382 -15.181 1.00 0.00 C ATOM 940 OD1 ASP A 57 -6.696 7.887 -14.135 1.00 0.00 O ATOM 941 OD2 ASP A 57 -8.257 8.987 -15.223 1.00 0.00 O ATOM 0 H ASP A 57 -4.682 6.683 -17.957 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.248 6.284 -16.526 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.308 8.351 -16.243 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.637 9.054 -17.143 1.00 0.00 H new ATOM 946 N ASP A 58 -6.922 6.356 -19.500 1.00 0.00 N ATOM 947 CA ASP A 58 -7.519 6.468 -20.826 1.00 0.00 C ATOM 948 C ASP A 58 -9.041 6.413 -20.744 1.00 0.00 C ATOM 949 O ASP A 58 -9.601 5.772 -19.856 1.00 0.00 O ATOM 950 CB ASP A 58 -7.004 5.353 -21.737 1.00 0.00 C ATOM 951 CG ASP A 58 -7.853 5.183 -22.981 1.00 0.00 C ATOM 952 OD1 ASP A 58 -7.948 6.145 -23.771 1.00 0.00 O ATOM 953 OD2 ASP A 58 -8.422 4.087 -23.166 1.00 0.00 O ATOM 0 H ASP A 58 -6.190 5.649 -19.425 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.231 7.432 -21.246 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -5.977 5.572 -22.029 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -6.985 4.415 -21.183 1.00 0.00 H new ATOM 958 N ALA A 59 -9.704 7.091 -21.675 1.00 0.00 N ATOM 959 CA ALA A 59 -11.161 7.118 -21.708 1.00 0.00 C ATOM 960 C ALA A 59 -11.739 5.712 -21.588 1.00 0.00 C ATOM 961 O ALA A 59 -11.087 4.730 -21.941 1.00 0.00 O ATOM 962 CB ALA A 59 -11.647 7.783 -22.987 1.00 0.00 C ATOM 0 H ALA A 59 -9.255 7.629 -22.416 1.00 0.00 H new ATOM 0 HA ALA A 59 -11.509 7.699 -20.854 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -12.737 7.796 -22.999 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -11.271 8.805 -23.031 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -11.282 7.225 -23.849 1.00 0.00 H new ATOM 968 N ALA A 60 -12.966 5.623 -21.086 1.00 0.00 N ATOM 969 CA ALA A 60 -13.633 4.337 -20.921 1.00 0.00 C ATOM 970 C ALA A 60 -15.136 4.465 -21.144 1.00 0.00 C ATOM 971 O ALA A 60 -15.663 5.570 -21.258 1.00 0.00 O ATOM 972 CB ALA A 60 -13.348 3.770 -19.538 1.00 0.00 C ATOM 0 H ALA A 60 -13.519 6.426 -20.786 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.239 3.652 -21.671 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.852 2.810 -19.428 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.274 3.632 -19.415 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -13.714 4.461 -18.779 1.00 0.00 H new ATOM 978 N GLU A 61 -15.819 3.326 -21.205 1.00 0.00 N ATOM 979 CA GLU A 61 -17.262 3.312 -21.416 1.00 0.00 C ATOM 980 C GLU A 61 -18.003 3.120 -20.096 1.00 0.00 C ATOM 981 O GLU A 61 -19.191 3.422 -19.989 1.00 0.00 O ATOM 982 CB GLU A 61 -17.646 2.201 -22.395 1.00 0.00 C ATOM 983 CG GLU A 61 -18.085 0.915 -21.715 1.00 0.00 C ATOM 984 CD GLU A 61 -18.566 -0.131 -22.702 1.00 0.00 C ATOM 985 OE1 GLU A 61 -18.788 0.220 -23.879 1.00 0.00 O ATOM 986 OE2 GLU A 61 -18.721 -1.302 -22.295 1.00 0.00 O ATOM 0 H GLU A 61 -15.397 2.402 -21.111 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.551 4.274 -21.838 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -18.452 2.556 -23.036 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -16.795 1.988 -23.042 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.253 0.510 -21.139 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.884 1.137 -21.008 1.00 0.00 H new ATOM 993 N ALA A 62 -17.292 2.615 -19.093 1.00 0.00 N ATOM 994 CA ALA A 62 -17.881 2.383 -17.780 1.00 0.00 C ATOM 995 C ALA A 62 -16.812 2.378 -16.692 1.00 0.00 C ATOM 996 O ALA A 62 -15.635 2.134 -16.964 1.00 0.00 O ATOM 997 CB ALA A 62 -18.652 1.072 -17.771 1.00 0.00 C ATOM 0 H ALA A 62 -16.307 2.359 -19.165 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.572 3.199 -17.570 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -19.086 0.912 -16.784 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.447 1.113 -18.515 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -17.976 0.251 -18.007 1.00 0.00 H new ATOM 1003 N THR A 63 -17.228 2.648 -15.458 1.00 0.00 N ATOM 1004 CA THR A 63 -16.306 2.675 -14.330 1.00 0.00 C ATOM 1005 C THR A 63 -16.842 1.856 -13.162 1.00 0.00 C ATOM 1006 O THR A 63 -17.987 2.027 -12.744 1.00 0.00 O ATOM 1007 CB THR A 63 -16.044 4.117 -13.854 1.00 0.00 C ATOM 1008 OG1 THR A 63 -15.674 4.940 -14.965 1.00 0.00 O ATOM 1009 CG2 THR A 63 -14.943 4.148 -12.805 1.00 0.00 C ATOM 0 H THR A 63 -18.198 2.851 -15.215 1.00 0.00 H new ATOM 0 HA THR A 63 -15.369 2.238 -14.676 1.00 0.00 H new ATOM 0 HB THR A 63 -16.961 4.501 -13.408 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.511 5.855 -14.654 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.775 5.176 -12.484 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.240 3.544 -11.948 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.023 3.746 -13.231 1.00 0.00 H new ATOM 1017 N LEU A 64 -16.007 0.965 -12.638 1.00 0.00 N ATOM 1018 CA LEU A 64 -16.397 0.118 -11.516 1.00 0.00 C ATOM 1019 C LEU A 64 -15.563 0.436 -10.279 1.00 0.00 C ATOM 1020 O LEU A 64 -14.377 0.112 -10.215 1.00 0.00 O ATOM 1021 CB LEU A 64 -16.239 -1.358 -11.886 1.00 0.00 C ATOM 1022 CG LEU A 64 -17.524 -2.097 -12.259 1.00 0.00 C ATOM 1023 CD1 LEU A 64 -17.363 -2.807 -13.595 1.00 0.00 C ATOM 1024 CD2 LEU A 64 -17.905 -3.088 -11.169 1.00 0.00 C ATOM 0 H LEU A 64 -15.056 0.810 -12.972 1.00 0.00 H new ATOM 0 HA LEU A 64 -17.444 0.319 -11.288 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -15.546 -1.430 -12.724 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -15.777 -1.875 -11.045 1.00 0.00 H new ATOM 0 HG LEU A 64 -18.327 -1.366 -12.354 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -18.288 -3.328 -13.844 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -17.138 -2.075 -14.371 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -16.548 -3.527 -13.528 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -18.822 -3.605 -11.452 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -17.103 -3.815 -11.042 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -18.063 -2.555 -10.232 1.00 0.00 H new ATOM 1036 N THR A 65 -16.193 1.070 -9.294 1.00 0.00 N ATOM 1037 CA THR A 65 -15.510 1.431 -8.058 1.00 0.00 C ATOM 1038 C THR A 65 -15.958 0.542 -6.904 1.00 0.00 C ATOM 1039 O THR A 65 -17.152 0.409 -6.638 1.00 0.00 O ATOM 1040 CB THR A 65 -15.764 2.904 -7.686 1.00 0.00 C ATOM 1041 OG1 THR A 65 -15.696 3.724 -8.857 1.00 0.00 O ATOM 1042 CG2 THR A 65 -14.746 3.386 -6.663 1.00 0.00 C ATOM 0 H THR A 65 -17.175 1.344 -9.329 1.00 0.00 H new ATOM 0 HA THR A 65 -14.444 1.287 -8.231 1.00 0.00 H new ATOM 0 HB THR A 65 -16.760 2.979 -7.248 1.00 0.00 H new ATOM 0 HG1 THR A 65 -16.015 4.626 -8.644 1.00 0.00 H new ATOM 0 HG21 THR A 65 -14.945 4.429 -6.415 1.00 0.00 H new ATOM 0 HG22 THR A 65 -14.821 2.778 -5.761 1.00 0.00 H new ATOM 0 HG23 THR A 65 -13.742 3.297 -7.079 1.00 0.00 H new ATOM 1050 N MET A 66 -14.993 -0.063 -6.220 1.00 0.00 N ATOM 1051 CA MET A 66 -15.289 -0.938 -5.091 1.00 0.00 C ATOM 1052 C MET A 66 -14.070 -1.090 -4.187 1.00 0.00 C ATOM 1053 O MET A 66 -12.932 -0.997 -4.644 1.00 0.00 O ATOM 1054 CB MET A 66 -15.744 -2.311 -5.589 1.00 0.00 C ATOM 1055 CG MET A 66 -14.667 -3.070 -6.347 1.00 0.00 C ATOM 1056 SD MET A 66 -15.185 -3.534 -8.011 1.00 0.00 S ATOM 1057 CE MET A 66 -15.776 -5.201 -7.730 1.00 0.00 C ATOM 0 H MET A 66 -13.999 0.036 -6.427 1.00 0.00 H new ATOM 0 HA MET A 66 -16.094 -0.484 -4.512 1.00 0.00 H new ATOM 0 HB2 MET A 66 -16.067 -2.909 -4.737 1.00 0.00 H new ATOM 0 HB3 MET A 66 -16.612 -2.184 -6.236 1.00 0.00 H new ATOM 0 HG2 MET A 66 -13.769 -2.455 -6.408 1.00 0.00 H new ATOM 0 HG3 MET A 66 -14.400 -3.968 -5.790 1.00 0.00 H new ATOM 0 HE1 MET A 66 -16.650 -5.387 -8.354 1.00 0.00 H new ATOM 0 HE2 MET A 66 -14.991 -5.913 -7.984 1.00 0.00 H new ATOM 0 HE3 MET A 66 -16.047 -5.319 -6.681 1.00 0.00 H new ATOM 1067 N GLU A 67 -14.318 -1.325 -2.902 1.00 0.00 N ATOM 1068 CA GLU A 67 -13.240 -1.489 -1.934 1.00 0.00 C ATOM 1069 C GLU A 67 -12.340 -2.662 -2.315 1.00 0.00 C ATOM 1070 O GLU A 67 -12.776 -3.601 -2.981 1.00 0.00 O ATOM 1071 CB GLU A 67 -13.812 -1.706 -0.532 1.00 0.00 C ATOM 1072 CG GLU A 67 -13.579 -0.535 0.408 1.00 0.00 C ATOM 1073 CD GLU A 67 -13.729 -0.919 1.867 1.00 0.00 C ATOM 1074 OE1 GLU A 67 -12.766 -1.471 2.438 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -14.811 -0.666 2.438 1.00 0.00 O ATOM 0 H GLU A 67 -15.255 -1.406 -2.508 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.642 -0.578 -1.938 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -14.883 -1.891 -0.610 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -13.365 -2.602 -0.101 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -12.579 -0.135 0.243 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -14.284 0.262 0.172 1.00 0.00 H new ATOM 1082 N ASP A 68 -11.084 -2.598 -1.889 1.00 0.00 N ATOM 1083 CA ASP A 68 -10.122 -3.654 -2.184 1.00 0.00 C ATOM 1084 C ASP A 68 -10.690 -5.023 -1.822 1.00 0.00 C ATOM 1085 O ASP A 68 -10.667 -5.949 -2.633 1.00 0.00 O ATOM 1086 CB ASP A 68 -8.817 -3.412 -1.424 1.00 0.00 C ATOM 1087 CG ASP A 68 -7.715 -4.362 -1.849 1.00 0.00 C ATOM 1088 OD1 ASP A 68 -8.021 -5.354 -2.543 1.00 0.00 O ATOM 1089 OD2 ASP A 68 -6.546 -4.113 -1.487 1.00 0.00 O ATOM 0 H ASP A 68 -10.708 -1.826 -1.338 1.00 0.00 H new ATOM 0 HA ASP A 68 -9.918 -3.637 -3.255 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.490 -2.385 -1.587 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.997 -3.524 -0.355 1.00 0.00 H new ATOM 1094 N ASP A 69 -11.197 -5.143 -0.601 1.00 0.00 N ATOM 1095 CA ASP A 69 -11.771 -6.399 -0.131 1.00 0.00 C ATOM 1096 C ASP A 69 -12.882 -6.871 -1.064 1.00 0.00 C ATOM 1097 O ASP A 69 -13.059 -8.071 -1.276 1.00 0.00 O ATOM 1098 CB ASP A 69 -12.314 -6.236 1.289 1.00 0.00 C ATOM 1099 CG ASP A 69 -13.020 -4.910 1.491 1.00 0.00 C ATOM 1100 OD1 ASP A 69 -12.328 -3.873 1.548 1.00 0.00 O ATOM 1101 OD2 ASP A 69 -14.265 -4.910 1.592 1.00 0.00 O ATOM 0 H ASP A 69 -11.223 -4.386 0.082 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.982 -7.151 -0.125 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -13.006 -7.049 1.505 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -11.492 -6.319 2.001 1.00 0.00 H new ATOM 1106 N ILE A 70 -13.627 -5.920 -1.616 1.00 0.00 N ATOM 1107 CA ILE A 70 -14.721 -6.239 -2.525 1.00 0.00 C ATOM 1108 C ILE A 70 -14.199 -6.863 -3.815 1.00 0.00 C ATOM 1109 O ILE A 70 -14.655 -7.928 -4.230 1.00 0.00 O ATOM 1110 CB ILE A 70 -15.549 -4.987 -2.871 1.00 0.00 C ATOM 1111 CG1 ILE A 70 -15.746 -4.120 -1.627 1.00 0.00 C ATOM 1112 CG2 ILE A 70 -16.892 -5.387 -3.463 1.00 0.00 C ATOM 1113 CD1 ILE A 70 -16.318 -4.875 -0.448 1.00 0.00 C ATOM 0 H ILE A 70 -13.493 -4.923 -1.450 1.00 0.00 H new ATOM 0 HA ILE A 70 -15.361 -6.956 -2.010 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.006 -4.404 -3.615 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -14.788 -3.687 -1.340 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -16.409 -3.291 -1.873 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -17.465 -4.491 -3.702 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -16.731 -5.968 -4.371 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -17.443 -5.989 -2.740 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.430 -4.197 0.398 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -17.292 -5.285 -0.716 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -15.645 -5.688 -0.175 1.00 0.00 H new ATOM 1125 N MET A 71 -13.240 -6.192 -4.444 1.00 0.00 N ATOM 1126 CA MET A 71 -12.653 -6.682 -5.686 1.00 0.00 C ATOM 1127 C MET A 71 -12.169 -8.120 -5.528 1.00 0.00 C ATOM 1128 O MET A 71 -12.365 -8.952 -6.414 1.00 0.00 O ATOM 1129 CB MET A 71 -11.491 -5.784 -6.116 1.00 0.00 C ATOM 1130 CG MET A 71 -10.981 -6.079 -7.517 1.00 0.00 C ATOM 1131 SD MET A 71 -10.260 -4.631 -8.313 1.00 0.00 S ATOM 1132 CE MET A 71 -11.668 -3.524 -8.341 1.00 0.00 C ATOM 0 H MET A 71 -12.853 -5.308 -4.114 1.00 0.00 H new ATOM 0 HA MET A 71 -13.424 -6.659 -6.457 1.00 0.00 H new ATOM 0 HB2 MET A 71 -11.810 -4.743 -6.066 1.00 0.00 H new ATOM 0 HB3 MET A 71 -10.671 -5.901 -5.408 1.00 0.00 H new ATOM 0 HG2 MET A 71 -10.234 -6.871 -7.468 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.803 -6.453 -8.127 1.00 0.00 H new ATOM 0 HE1 MET A 71 -11.470 -2.701 -9.028 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.552 -4.068 -8.672 1.00 0.00 H new ATOM 0 HE3 MET A 71 -11.839 -3.128 -7.340 1.00 0.00 H new ATOM 1142 N PHE A 72 -11.535 -8.405 -4.396 1.00 0.00 N ATOM 1143 CA PHE A 72 -11.021 -9.742 -4.123 1.00 0.00 C ATOM 1144 C PHE A 72 -12.146 -10.773 -4.153 1.00 0.00 C ATOM 1145 O PHE A 72 -11.980 -11.872 -4.681 1.00 0.00 O ATOM 1146 CB PHE A 72 -10.320 -9.775 -2.763 1.00 0.00 C ATOM 1147 CG PHE A 72 -9.126 -10.685 -2.726 1.00 0.00 C ATOM 1148 CD1 PHE A 72 -8.041 -10.459 -3.558 1.00 0.00 C ATOM 1149 CD2 PHE A 72 -9.089 -11.765 -1.860 1.00 0.00 C ATOM 1150 CE1 PHE A 72 -6.940 -11.295 -3.526 1.00 0.00 C ATOM 1151 CE2 PHE A 72 -7.991 -12.604 -1.823 1.00 0.00 C ATOM 1152 CZ PHE A 72 -6.915 -12.369 -2.658 1.00 0.00 C ATOM 0 H PHE A 72 -11.365 -7.728 -3.652 1.00 0.00 H new ATOM 0 HA PHE A 72 -10.300 -9.993 -4.901 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -10.005 -8.765 -2.501 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -11.033 -10.094 -2.003 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -8.056 -9.621 -4.239 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -9.928 -11.954 -1.206 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -6.100 -11.108 -4.179 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -7.974 -13.442 -1.142 1.00 0.00 H new ATOM 0 HZ PHE A 72 -6.057 -13.024 -2.632 1.00 0.00 H new ATOM 1162 N ALA A 73 -13.289 -10.410 -3.581 1.00 0.00 N ATOM 1163 CA ALA A 73 -14.441 -11.302 -3.543 1.00 0.00 C ATOM 1164 C ALA A 73 -14.925 -11.634 -4.951 1.00 0.00 C ATOM 1165 O ALA A 73 -15.119 -12.802 -5.290 1.00 0.00 O ATOM 1166 CB ALA A 73 -15.566 -10.677 -2.731 1.00 0.00 C ATOM 0 H ALA A 73 -13.442 -9.504 -3.138 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.134 -12.231 -3.063 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -16.420 -11.354 -2.711 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -15.223 -10.496 -1.712 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.863 -9.732 -3.187 1.00 0.00 H new ATOM 1172 N ILE A 74 -15.117 -10.602 -5.765 1.00 0.00 N ATOM 1173 CA ILE A 74 -15.577 -10.786 -7.135 1.00 0.00 C ATOM 1174 C ILE A 74 -14.488 -11.408 -8.002 1.00 0.00 C ATOM 1175 O ILE A 74 -14.763 -11.939 -9.077 1.00 0.00 O ATOM 1176 CB ILE A 74 -16.019 -9.452 -7.765 1.00 0.00 C ATOM 1177 CG1 ILE A 74 -16.798 -8.616 -6.747 1.00 0.00 C ATOM 1178 CG2 ILE A 74 -16.861 -9.705 -9.007 1.00 0.00 C ATOM 1179 CD1 ILE A 74 -17.968 -9.350 -6.132 1.00 0.00 C ATOM 0 H ILE A 74 -14.961 -9.630 -5.499 1.00 0.00 H new ATOM 0 HA ILE A 74 -16.433 -11.459 -7.092 1.00 0.00 H new ATOM 0 HB ILE A 74 -15.130 -8.895 -8.061 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -16.120 -8.300 -5.954 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -17.162 -7.712 -7.234 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -17.165 -8.752 -9.440 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -16.275 -10.265 -9.736 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -17.747 -10.280 -8.735 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -18.474 -8.697 -5.421 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -18.667 -9.643 -6.916 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -17.608 -10.240 -5.616 1.00 0.00 H new ATOM 1191 N GLY A 75 -13.249 -11.340 -7.526 1.00 0.00 N ATOM 1192 CA GLY A 75 -12.136 -11.903 -8.269 1.00 0.00 C ATOM 1193 C GLY A 75 -11.922 -13.373 -7.968 1.00 0.00 C ATOM 1194 O GLY A 75 -11.642 -14.165 -8.869 1.00 0.00 O ATOM 0 H GLY A 75 -12.995 -10.905 -6.639 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -12.315 -11.776 -9.337 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.227 -11.350 -8.030 1.00 0.00 H new ATOM 1198 N THR A 76 -12.053 -13.741 -6.698 1.00 0.00 N ATOM 1199 CA THR A 76 -11.869 -15.126 -6.280 1.00 0.00 C ATOM 1200 C THR A 76 -13.200 -15.869 -6.242 1.00 0.00 C ATOM 1201 O THR A 76 -13.377 -16.804 -5.462 1.00 0.00 O ATOM 1202 CB THR A 76 -11.206 -15.211 -4.893 1.00 0.00 C ATOM 1203 OG1 THR A 76 -12.109 -14.735 -3.888 1.00 0.00 O ATOM 1204 CG2 THR A 76 -9.923 -14.395 -4.855 1.00 0.00 C ATOM 0 H THR A 76 -12.286 -13.099 -5.940 1.00 0.00 H new ATOM 0 HA THR A 76 -11.215 -15.595 -7.015 1.00 0.00 H new ATOM 0 HB THR A 76 -10.960 -16.255 -4.696 1.00 0.00 H new ATOM 0 HG1 THR A 76 -12.224 -13.767 -3.984 1.00 0.00 H new ATOM 0 HG21 THR A 76 -9.473 -14.471 -3.865 1.00 0.00 H new ATOM 0 HG22 THR A 76 -9.226 -14.778 -5.601 1.00 0.00 H new ATOM 0 HG23 THR A 76 -10.149 -13.351 -5.072 1.00 0.00 H new ATOM 1212 N GLY A 77 -14.133 -15.447 -7.090 1.00 0.00 N ATOM 1213 CA GLY A 77 -15.436 -16.085 -7.136 1.00 0.00 C ATOM 1214 C GLY A 77 -16.042 -16.267 -5.759 1.00 0.00 C ATOM 1215 O GLY A 77 -16.851 -17.168 -5.543 1.00 0.00 O ATOM 0 H GLY A 77 -14.010 -14.675 -7.746 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -16.109 -15.486 -7.749 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -15.344 -17.057 -7.620 1.00 0.00 H new ATOM 1219 N ALA A 78 -15.649 -15.408 -4.823 1.00 0.00 N ATOM 1220 CA ALA A 78 -16.159 -15.478 -3.460 1.00 0.00 C ATOM 1221 C ALA A 78 -17.593 -14.963 -3.383 1.00 0.00 C ATOM 1222 O ALA A 78 -18.529 -15.733 -3.169 1.00 0.00 O ATOM 1223 CB ALA A 78 -15.262 -14.688 -2.519 1.00 0.00 C ATOM 0 H ALA A 78 -14.979 -14.656 -4.985 1.00 0.00 H new ATOM 0 HA ALA A 78 -16.159 -16.524 -3.152 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -15.655 -14.749 -1.504 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -14.254 -15.103 -2.543 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.233 -13.645 -2.834 1.00 0.00 H new ATOM 1229 N LEU A 79 -17.757 -13.656 -3.559 1.00 0.00 N ATOM 1230 CA LEU A 79 -19.077 -13.038 -3.509 1.00 0.00 C ATOM 1231 C LEU A 79 -19.491 -12.526 -4.885 1.00 0.00 C ATOM 1232 O LEU A 79 -18.669 -12.060 -5.674 1.00 0.00 O ATOM 1233 CB LEU A 79 -19.085 -11.887 -2.501 1.00 0.00 C ATOM 1234 CG LEU A 79 -19.385 -12.267 -1.051 1.00 0.00 C ATOM 1235 CD1 LEU A 79 -19.135 -11.085 -0.127 1.00 0.00 C ATOM 1236 CD2 LEU A 79 -20.818 -12.761 -0.914 1.00 0.00 C ATOM 0 H LEU A 79 -16.993 -13.005 -3.737 1.00 0.00 H new ATOM 0 HA LEU A 79 -19.794 -13.796 -3.192 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -18.113 -11.396 -2.533 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -19.824 -11.153 -2.824 1.00 0.00 H new ATOM 0 HG LEU A 79 -18.715 -13.076 -0.761 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -19.354 -11.374 0.901 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -18.092 -10.778 -0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -19.780 -10.255 -0.416 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -21.013 -13.027 0.125 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -21.505 -11.973 -1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -20.963 -13.637 -1.546 1.00 0.00 H new ATOM 1248 N PRO A 80 -20.797 -12.613 -5.181 1.00 0.00 N ATOM 1249 CA PRO A 80 -21.350 -12.162 -6.461 1.00 0.00 C ATOM 1250 C PRO A 80 -21.318 -10.644 -6.603 1.00 0.00 C ATOM 1251 O PRO A 80 -21.758 -9.918 -5.712 1.00 0.00 O ATOM 1252 CB PRO A 80 -22.795 -12.665 -6.420 1.00 0.00 C ATOM 1253 CG PRO A 80 -23.117 -12.774 -4.970 1.00 0.00 C ATOM 1254 CD PRO A 80 -21.833 -13.158 -4.288 1.00 0.00 C ATOM 0 HA PRO A 80 -20.777 -12.539 -7.308 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -23.469 -11.973 -6.924 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -22.893 -13.628 -6.921 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -23.497 -11.829 -4.583 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -23.890 -13.523 -4.797 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -21.766 -12.731 -3.287 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -21.743 -14.239 -4.180 1.00 0.00 H new ATOM 1262 N ALA A 81 -20.796 -10.171 -7.730 1.00 0.00 N ATOM 1263 CA ALA A 81 -20.709 -8.739 -7.989 1.00 0.00 C ATOM 1264 C ALA A 81 -22.083 -8.083 -7.910 1.00 0.00 C ATOM 1265 O ALA A 81 -22.199 -6.893 -7.613 1.00 0.00 O ATOM 1266 CB ALA A 81 -20.080 -8.486 -9.351 1.00 0.00 C ATOM 0 H ALA A 81 -20.427 -10.758 -8.478 1.00 0.00 H new ATOM 0 HA ALA A 81 -20.077 -8.294 -7.221 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -20.021 -7.413 -9.531 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -19.077 -8.913 -9.374 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -20.690 -8.951 -10.125 1.00 0.00 H new ATOM 1272 N LYS A 82 -23.124 -8.865 -8.177 1.00 0.00 N ATOM 1273 CA LYS A 82 -24.491 -8.360 -8.136 1.00 0.00 C ATOM 1274 C LYS A 82 -24.899 -8.010 -6.708 1.00 0.00 C ATOM 1275 O LYS A 82 -25.281 -6.876 -6.424 1.00 0.00 O ATOM 1276 CB LYS A 82 -25.457 -9.398 -8.713 1.00 0.00 C ATOM 1277 CG LYS A 82 -24.937 -10.082 -9.965 1.00 0.00 C ATOM 1278 CD LYS A 82 -24.543 -11.524 -9.690 1.00 0.00 C ATOM 1279 CE LYS A 82 -25.589 -12.497 -10.211 1.00 0.00 C ATOM 1280 NZ LYS A 82 -25.307 -13.896 -9.785 1.00 0.00 N ATOM 0 H LYS A 82 -23.047 -9.852 -8.424 1.00 0.00 H new ATOM 0 HA LYS A 82 -24.536 -7.454 -8.741 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -25.661 -10.154 -7.954 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -26.405 -8.912 -8.942 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -25.703 -10.055 -10.740 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -24.075 -9.535 -10.348 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -23.582 -11.735 -10.159 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -24.413 -11.668 -8.618 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -26.574 -12.199 -9.850 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -25.620 -12.448 -11.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -26.043 -14.528 -10.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -24.379 -14.190 -10.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -25.303 -13.948 -8.746 1.00 0.00 H new ATOM 1294 N GLU A 83 -24.812 -8.991 -5.815 1.00 0.00 N ATOM 1295 CA GLU A 83 -25.172 -8.784 -4.417 1.00 0.00 C ATOM 1296 C GLU A 83 -24.385 -7.622 -3.819 1.00 0.00 C ATOM 1297 O GLU A 83 -24.955 -6.731 -3.190 1.00 0.00 O ATOM 1298 CB GLU A 83 -24.916 -10.057 -3.608 1.00 0.00 C ATOM 1299 CG GLU A 83 -25.427 -9.983 -2.179 1.00 0.00 C ATOM 1300 CD GLU A 83 -26.622 -9.062 -2.034 1.00 0.00 C ATOM 1301 OE1 GLU A 83 -27.636 -9.293 -2.726 1.00 0.00 O ATOM 1302 OE2 GLU A 83 -26.545 -8.110 -1.229 1.00 0.00 O ATOM 0 H GLU A 83 -24.496 -9.936 -6.034 1.00 0.00 H new ATOM 0 HA GLU A 83 -26.234 -8.542 -4.374 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -25.391 -10.899 -4.112 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -23.845 -10.258 -3.592 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -25.701 -10.983 -1.843 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -24.625 -9.636 -1.528 1.00 0.00 H new ATOM 1309 N ALA A 84 -23.071 -7.638 -4.021 1.00 0.00 N ATOM 1310 CA ALA A 84 -22.206 -6.586 -3.503 1.00 0.00 C ATOM 1311 C ALA A 84 -22.731 -5.206 -3.886 1.00 0.00 C ATOM 1312 O ALA A 84 -22.713 -4.279 -3.077 1.00 0.00 O ATOM 1313 CB ALA A 84 -20.785 -6.772 -4.014 1.00 0.00 C ATOM 0 H ALA A 84 -22.583 -8.368 -4.540 1.00 0.00 H new ATOM 0 HA ALA A 84 -22.202 -6.656 -2.415 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -20.150 -5.979 -3.619 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -20.404 -7.739 -3.686 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -20.782 -6.731 -5.103 1.00 0.00 H new ATOM 1319 N MET A 85 -23.196 -5.078 -5.124 1.00 0.00 N ATOM 1320 CA MET A 85 -23.726 -3.810 -5.613 1.00 0.00 C ATOM 1321 C MET A 85 -25.001 -3.430 -4.866 1.00 0.00 C ATOM 1322 O MET A 85 -25.302 -2.249 -4.694 1.00 0.00 O ATOM 1323 CB MET A 85 -24.007 -3.895 -7.114 1.00 0.00 C ATOM 1324 CG MET A 85 -23.315 -2.811 -7.924 1.00 0.00 C ATOM 1325 SD MET A 85 -24.171 -2.445 -9.468 1.00 0.00 S ATOM 1326 CE MET A 85 -23.886 -3.959 -10.381 1.00 0.00 C ATOM 0 H MET A 85 -23.217 -5.836 -5.807 1.00 0.00 H new ATOM 0 HA MET A 85 -22.977 -3.038 -5.434 1.00 0.00 H new ATOM 0 HB2 MET A 85 -23.688 -4.871 -7.480 1.00 0.00 H new ATOM 0 HB3 MET A 85 -25.083 -3.829 -7.278 1.00 0.00 H new ATOM 0 HG2 MET A 85 -23.248 -1.902 -7.326 1.00 0.00 H new ATOM 0 HG3 MET A 85 -22.294 -3.123 -8.144 1.00 0.00 H new ATOM 0 HE1 MET A 85 -24.356 -3.887 -11.362 1.00 0.00 H new ATOM 0 HE2 MET A 85 -22.814 -4.114 -10.503 1.00 0.00 H new ATOM 0 HE3 MET A 85 -24.314 -4.799 -9.835 1.00 0.00 H new ATOM 1336 N ALA A 86 -25.747 -4.438 -4.426 1.00 0.00 N ATOM 1337 CA ALA A 86 -26.988 -4.208 -3.696 1.00 0.00 C ATOM 1338 C ALA A 86 -26.709 -3.791 -2.257 1.00 0.00 C ATOM 1339 O ALA A 86 -27.524 -3.116 -1.628 1.00 0.00 O ATOM 1340 CB ALA A 86 -27.857 -5.457 -3.727 1.00 0.00 C ATOM 0 H ALA A 86 -25.514 -5.422 -4.562 1.00 0.00 H new ATOM 0 HA ALA A 86 -27.523 -3.394 -4.185 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -28.780 -5.272 -3.178 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -28.094 -5.710 -4.760 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -27.320 -6.285 -3.264 1.00 0.00 H new ATOM 1346 N GLN A 87 -25.554 -4.197 -1.740 1.00 0.00 N ATOM 1347 CA GLN A 87 -25.170 -3.865 -0.373 1.00 0.00 C ATOM 1348 C GLN A 87 -24.475 -2.509 -0.317 1.00 0.00 C ATOM 1349 O GLN A 87 -23.965 -2.105 0.728 1.00 0.00 O ATOM 1350 CB GLN A 87 -24.250 -4.947 0.197 1.00 0.00 C ATOM 1351 CG GLN A 87 -24.914 -6.309 0.315 1.00 0.00 C ATOM 1352 CD GLN A 87 -24.577 -7.012 1.616 1.00 0.00 C ATOM 1353 OE1 GLN A 87 -24.805 -6.476 2.701 1.00 0.00 O ATOM 1354 NE2 GLN A 87 -24.032 -8.218 1.513 1.00 0.00 N ATOM 0 H GLN A 87 -24.868 -4.756 -2.247 1.00 0.00 H new ATOM 0 HA GLN A 87 -26.076 -3.813 0.230 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -23.369 -5.035 -0.439 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -23.902 -4.635 1.182 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -25.995 -6.190 0.240 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -24.604 -6.934 -0.522 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -23.861 -8.623 0.593 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -23.784 -8.739 2.354 1.00 0.00 H new ATOM 1363 N ASP A 88 -24.458 -1.811 -1.447 1.00 0.00 N ATOM 1364 CA ASP A 88 -23.826 -0.499 -1.527 1.00 0.00 C ATOM 1365 C ASP A 88 -22.323 -0.605 -1.293 1.00 0.00 C ATOM 1366 O ASP A 88 -21.650 0.395 -1.040 1.00 0.00 O ATOM 1367 CB ASP A 88 -24.448 0.453 -0.504 1.00 0.00 C ATOM 1368 CG ASP A 88 -24.988 1.717 -1.143 1.00 0.00 C ATOM 1369 OD1 ASP A 88 -24.226 2.384 -1.874 1.00 0.00 O ATOM 1370 OD2 ASP A 88 -26.172 2.039 -0.913 1.00 0.00 O ATOM 0 H ASP A 88 -24.875 -2.132 -2.321 1.00 0.00 H new ATOM 0 HA ASP A 88 -23.992 -0.103 -2.529 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -25.255 -0.059 0.021 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -23.700 0.718 0.243 1.00 0.00 H new ATOM 1375 N LYS A 89 -21.800 -1.824 -1.378 1.00 0.00 N ATOM 1376 CA LYS A 89 -20.376 -2.063 -1.176 1.00 0.00 C ATOM 1377 C LYS A 89 -19.602 -1.865 -2.475 1.00 0.00 C ATOM 1378 O LYS A 89 -18.374 -1.940 -2.494 1.00 0.00 O ATOM 1379 CB LYS A 89 -20.146 -3.478 -0.642 1.00 0.00 C ATOM 1380 CG LYS A 89 -20.454 -3.628 0.837 1.00 0.00 C ATOM 1381 CD LYS A 89 -19.240 -4.110 1.614 1.00 0.00 C ATOM 1382 CE LYS A 89 -19.592 -4.422 3.060 1.00 0.00 C ATOM 1383 NZ LYS A 89 -20.295 -5.729 3.190 1.00 0.00 N ATOM 0 H LYS A 89 -22.342 -2.663 -1.586 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.012 -1.342 -0.444 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.766 -4.175 -1.206 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -19.108 -3.760 -0.819 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -20.788 -2.671 1.239 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -21.275 -4.333 0.969 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -18.832 -5.001 1.137 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -18.461 -3.348 1.584 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -18.682 -4.438 3.660 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -20.224 -3.629 3.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -20.518 -5.905 4.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -21.176 -5.706 2.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -19.683 -6.490 2.832 1.00 0.00 H new ATOM 1397 N MET A 90 -20.328 -1.611 -3.559 1.00 0.00 N ATOM 1398 CA MET A 90 -19.708 -1.400 -4.862 1.00 0.00 C ATOM 1399 C MET A 90 -20.674 -0.708 -5.818 1.00 0.00 C ATOM 1400 O MET A 90 -21.878 -0.959 -5.786 1.00 0.00 O ATOM 1401 CB MET A 90 -19.253 -2.735 -5.455 1.00 0.00 C ATOM 1402 CG MET A 90 -20.395 -3.585 -5.987 1.00 0.00 C ATOM 1403 SD MET A 90 -19.822 -5.089 -6.799 1.00 0.00 S ATOM 1404 CE MET A 90 -19.348 -4.449 -8.403 1.00 0.00 C ATOM 0 H MET A 90 -21.346 -1.546 -3.561 1.00 0.00 H new ATOM 0 HA MET A 90 -18.839 -0.757 -4.724 1.00 0.00 H new ATOM 0 HB2 MET A 90 -18.547 -2.542 -6.263 1.00 0.00 H new ATOM 0 HB3 MET A 90 -18.717 -3.298 -4.691 1.00 0.00 H new ATOM 0 HG2 MET A 90 -21.058 -3.851 -5.164 1.00 0.00 H new ATOM 0 HG3 MET A 90 -20.982 -2.997 -6.692 1.00 0.00 H new ATOM 0 HE1 MET A 90 -19.039 -5.273 -9.046 1.00 0.00 H new ATOM 0 HE2 MET A 90 -20.196 -3.935 -8.855 1.00 0.00 H new ATOM 0 HE3 MET A 90 -18.520 -3.750 -8.286 1.00 0.00 H new ATOM 1414 N GLU A 91 -20.138 0.163 -6.666 1.00 0.00 N ATOM 1415 CA GLU A 91 -20.954 0.892 -7.630 1.00 0.00 C ATOM 1416 C GLU A 91 -20.365 0.784 -9.034 1.00 0.00 C ATOM 1417 O GLU A 91 -19.207 0.401 -9.206 1.00 0.00 O ATOM 1418 CB GLU A 91 -21.070 2.363 -7.226 1.00 0.00 C ATOM 1419 CG GLU A 91 -22.112 3.132 -8.020 1.00 0.00 C ATOM 1420 CD GLU A 91 -23.450 2.421 -8.069 1.00 0.00 C ATOM 1421 OE1 GLU A 91 -24.184 2.467 -7.059 1.00 0.00 O ATOM 1422 OE2 GLU A 91 -23.764 1.818 -9.116 1.00 0.00 O ATOM 0 H GLU A 91 -19.142 0.381 -6.705 1.00 0.00 H new ATOM 0 HA GLU A 91 -21.948 0.445 -7.636 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -21.317 2.421 -6.166 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -20.100 2.844 -7.354 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.245 4.119 -7.577 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -21.749 3.285 -9.036 1.00 0.00 H new ATOM 1429 N VAL A 92 -21.170 1.124 -10.035 1.00 0.00 N ATOM 1430 CA VAL A 92 -20.729 1.066 -11.424 1.00 0.00 C ATOM 1431 C VAL A 92 -21.347 2.194 -12.244 1.00 0.00 C ATOM 1432 O VAL A 92 -22.500 2.570 -12.031 1.00 0.00 O ATOM 1433 CB VAL A 92 -21.092 -0.283 -12.072 1.00 0.00 C ATOM 1434 CG1 VAL A 92 -20.466 -0.397 -13.454 1.00 0.00 C ATOM 1435 CG2 VAL A 92 -20.652 -1.436 -11.183 1.00 0.00 C ATOM 0 H VAL A 92 -22.131 1.443 -9.910 1.00 0.00 H new ATOM 0 HA VAL A 92 -19.645 1.177 -11.417 1.00 0.00 H new ATOM 0 HB VAL A 92 -22.175 -0.333 -12.184 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -20.733 -1.357 -13.896 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -20.834 0.410 -14.088 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -19.382 -0.326 -13.369 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -20.916 -2.382 -11.656 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -19.573 -1.392 -11.038 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -21.151 -1.362 -10.217 1.00 0.00 H new ATOM 1445 N ASP A 93 -20.573 2.729 -13.181 1.00 0.00 N ATOM 1446 CA ASP A 93 -21.045 3.813 -14.035 1.00 0.00 C ATOM 1447 C ASP A 93 -20.957 3.422 -15.507 1.00 0.00 C ATOM 1448 O ASP A 93 -20.468 2.346 -15.846 1.00 0.00 O ATOM 1449 CB ASP A 93 -20.229 5.082 -13.782 1.00 0.00 C ATOM 1450 CG ASP A 93 -21.105 6.280 -13.471 1.00 0.00 C ATOM 1451 OD1 ASP A 93 -21.719 6.300 -12.384 1.00 0.00 O ATOM 1452 OD2 ASP A 93 -21.174 7.198 -14.314 1.00 0.00 O ATOM 0 H ASP A 93 -19.616 2.430 -13.369 1.00 0.00 H new ATOM 0 HA ASP A 93 -22.089 4.007 -13.791 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -19.544 4.911 -12.952 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -19.619 5.299 -14.659 1.00 0.00 H new ATOM 1457 N GLY A 94 -21.435 4.306 -16.378 1.00 0.00 N ATOM 1458 CA GLY A 94 -21.402 4.034 -17.804 1.00 0.00 C ATOM 1459 C GLY A 94 -22.575 3.189 -18.260 1.00 0.00 C ATOM 1460 O GLY A 94 -23.730 3.572 -18.082 1.00 0.00 O ATOM 0 H GLY A 94 -21.844 5.205 -16.122 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -21.403 4.977 -18.351 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -20.472 3.523 -18.052 1.00 0.00 H new ATOM 1464 N GLN A 95 -22.276 2.036 -18.851 1.00 0.00 N ATOM 1465 CA GLN A 95 -23.315 1.136 -19.337 1.00 0.00 C ATOM 1466 C GLN A 95 -23.589 0.026 -18.327 1.00 0.00 C ATOM 1467 O GLN A 95 -22.862 -0.965 -18.265 1.00 0.00 O ATOM 1468 CB GLN A 95 -22.907 0.529 -20.680 1.00 0.00 C ATOM 1469 CG GLN A 95 -23.394 1.325 -21.880 1.00 0.00 C ATOM 1470 CD GLN A 95 -24.820 0.983 -22.267 1.00 0.00 C ATOM 1471 OE1 GLN A 95 -25.058 0.080 -23.069 1.00 0.00 O ATOM 1472 NE2 GLN A 95 -25.777 1.705 -21.696 1.00 0.00 N ATOM 0 H GLN A 95 -21.324 1.704 -19.004 1.00 0.00 H new ATOM 0 HA GLN A 95 -24.229 1.715 -19.471 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -21.820 0.455 -20.721 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -23.299 -0.486 -20.745 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -23.328 2.390 -21.656 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -22.736 1.136 -22.728 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -25.534 2.444 -21.037 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -26.756 1.520 -21.917 1.00 0.00 H new ATOM 1481 N VAL A 96 -24.644 0.200 -17.536 1.00 0.00 N ATOM 1482 CA VAL A 96 -25.015 -0.786 -16.528 1.00 0.00 C ATOM 1483 C VAL A 96 -25.374 -2.121 -17.172 1.00 0.00 C ATOM 1484 O VAL A 96 -25.218 -3.177 -16.561 1.00 0.00 O ATOM 1485 CB VAL A 96 -26.205 -0.302 -15.680 1.00 0.00 C ATOM 1486 CG1 VAL A 96 -26.449 -1.246 -14.513 1.00 0.00 C ATOM 1487 CG2 VAL A 96 -25.965 1.117 -15.187 1.00 0.00 C ATOM 0 H VAL A 96 -25.256 1.015 -17.574 1.00 0.00 H new ATOM 0 HA VAL A 96 -24.148 -0.919 -15.881 1.00 0.00 H new ATOM 0 HB VAL A 96 -27.097 -0.299 -16.306 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -27.294 -0.887 -13.925 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -26.668 -2.244 -14.892 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -25.560 -1.284 -13.884 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -26.816 1.443 -14.589 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -25.062 1.142 -14.577 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -25.845 1.783 -16.041 1.00 0.00 H new ATOM 1497 N GLU A 97 -25.854 -2.064 -18.411 1.00 0.00 N ATOM 1498 CA GLU A 97 -26.235 -3.269 -19.137 1.00 0.00 C ATOM 1499 C GLU A 97 -25.002 -4.042 -19.595 1.00 0.00 C ATOM 1500 O GLU A 97 -25.034 -5.267 -19.721 1.00 0.00 O ATOM 1501 CB GLU A 97 -27.103 -2.910 -20.346 1.00 0.00 C ATOM 1502 CG GLU A 97 -26.487 -1.850 -21.243 1.00 0.00 C ATOM 1503 CD GLU A 97 -26.873 -2.022 -22.699 1.00 0.00 C ATOM 1504 OE1 GLU A 97 -26.531 -3.072 -23.282 1.00 0.00 O ATOM 1505 OE2 GLU A 97 -27.516 -1.108 -23.256 1.00 0.00 O ATOM 0 H GLU A 97 -25.988 -1.197 -18.932 1.00 0.00 H new ATOM 0 HA GLU A 97 -26.809 -3.903 -18.461 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -27.284 -3.810 -20.933 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -28.073 -2.558 -19.995 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -26.801 -0.864 -20.902 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -25.401 -1.888 -21.152 1.00 0.00 H new ATOM 1512 N LEU A 98 -23.916 -3.318 -19.842 1.00 0.00 N ATOM 1513 CA LEU A 98 -22.670 -3.934 -20.286 1.00 0.00 C ATOM 1514 C LEU A 98 -21.936 -4.583 -19.117 1.00 0.00 C ATOM 1515 O LEU A 98 -21.608 -5.769 -19.160 1.00 0.00 O ATOM 1516 CB LEU A 98 -21.771 -2.891 -20.952 1.00 0.00 C ATOM 1517 CG LEU A 98 -21.892 -2.772 -22.471 1.00 0.00 C ATOM 1518 CD1 LEU A 98 -21.656 -1.336 -22.914 1.00 0.00 C ATOM 1519 CD2 LEU A 98 -20.913 -3.712 -23.160 1.00 0.00 C ATOM 0 H LEU A 98 -23.873 -2.304 -19.742 1.00 0.00 H new ATOM 0 HA LEU A 98 -22.916 -4.709 -21.012 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -21.991 -1.918 -20.513 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -20.735 -3.125 -20.707 1.00 0.00 H new ATOM 0 HG LEU A 98 -22.903 -3.059 -22.759 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -21.746 -1.270 -23.998 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -22.396 -0.685 -22.448 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -20.656 -1.022 -22.613 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -21.013 -3.614 -24.241 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -19.895 -3.457 -22.865 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -21.128 -4.740 -22.868 1.00 0.00 H new ATOM 1531 N ILE A 99 -21.685 -3.799 -18.075 1.00 0.00 N ATOM 1532 CA ILE A 99 -20.993 -4.299 -16.893 1.00 0.00 C ATOM 1533 C ILE A 99 -21.665 -5.556 -16.353 1.00 0.00 C ATOM 1534 O ILE A 99 -21.022 -6.396 -15.724 1.00 0.00 O ATOM 1535 CB ILE A 99 -20.944 -3.237 -15.778 1.00 0.00 C ATOM 1536 CG1 ILE A 99 -22.360 -2.797 -15.401 1.00 0.00 C ATOM 1537 CG2 ILE A 99 -20.113 -2.042 -16.220 1.00 0.00 C ATOM 1538 CD1 ILE A 99 -22.991 -3.650 -14.322 1.00 0.00 C ATOM 0 H ILE A 99 -21.950 -2.815 -18.025 1.00 0.00 H new ATOM 0 HA ILE A 99 -19.975 -4.538 -17.201 1.00 0.00 H new ATOM 0 HB ILE A 99 -20.473 -3.677 -14.899 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -22.332 -1.761 -15.064 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -22.990 -2.826 -16.290 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -20.088 -1.301 -15.421 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -19.097 -2.368 -16.444 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -20.557 -1.600 -17.112 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -23.993 -3.280 -14.106 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -23.051 -4.683 -14.664 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -22.384 -3.602 -13.418 1.00 0.00 H new ATOM 1550 N PHE A 100 -22.965 -5.680 -16.604 1.00 0.00 N ATOM 1551 CA PHE A 100 -23.725 -6.836 -16.144 1.00 0.00 C ATOM 1552 C PHE A 100 -23.364 -8.080 -16.950 1.00 0.00 C ATOM 1553 O PHE A 100 -23.325 -9.190 -16.417 1.00 0.00 O ATOM 1554 CB PHE A 100 -25.227 -6.562 -16.253 1.00 0.00 C ATOM 1555 CG PHE A 100 -25.991 -6.907 -15.007 1.00 0.00 C ATOM 1556 CD1 PHE A 100 -26.020 -8.209 -14.534 1.00 0.00 C ATOM 1557 CD2 PHE A 100 -26.682 -5.929 -14.309 1.00 0.00 C ATOM 1558 CE1 PHE A 100 -26.722 -8.530 -13.388 1.00 0.00 C ATOM 1559 CE2 PHE A 100 -27.385 -6.244 -13.162 1.00 0.00 C ATOM 1560 CZ PHE A 100 -27.406 -7.546 -12.701 1.00 0.00 C ATOM 0 H PHE A 100 -23.513 -4.994 -17.123 1.00 0.00 H new ATOM 0 HA PHE A 100 -23.470 -7.015 -15.099 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -25.380 -5.508 -16.483 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -25.633 -7.133 -17.088 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -25.487 -8.982 -15.068 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -26.671 -4.910 -14.666 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -26.736 -9.549 -13.030 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -27.918 -5.473 -12.626 1.00 0.00 H new ATOM 0 HZ PHE A 100 -27.956 -7.794 -11.805 1.00 0.00 H new ATOM 1570 N LEU A 101 -23.102 -7.888 -18.238 1.00 0.00 N ATOM 1571 CA LEU A 101 -22.745 -8.994 -19.120 1.00 0.00 C ATOM 1572 C LEU A 101 -21.381 -9.567 -18.750 1.00 0.00 C ATOM 1573 O LEU A 101 -20.999 -10.642 -19.215 1.00 0.00 O ATOM 1574 CB LEU A 101 -22.737 -8.528 -20.577 1.00 0.00 C ATOM 1575 CG LEU A 101 -23.983 -8.865 -21.396 1.00 0.00 C ATOM 1576 CD1 LEU A 101 -24.036 -10.355 -21.698 1.00 0.00 C ATOM 1577 CD2 LEU A 101 -25.240 -8.422 -20.662 1.00 0.00 C ATOM 0 H LEU A 101 -23.130 -6.977 -18.695 1.00 0.00 H new ATOM 0 HA LEU A 101 -23.493 -9.778 -19.000 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -22.599 -7.447 -20.591 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -21.871 -8.966 -21.073 1.00 0.00 H new ATOM 0 HG LEU A 101 -23.930 -8.325 -22.342 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -24.930 -10.576 -22.282 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -23.151 -10.643 -22.266 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -24.065 -10.915 -20.763 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -26.117 -8.670 -21.260 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -25.300 -8.933 -19.701 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -25.205 -7.345 -20.498 1.00 0.00 H new ATOM 1589 N LEU A 102 -20.650 -8.844 -17.908 1.00 0.00 N ATOM 1590 CA LEU A 102 -19.328 -9.281 -17.472 1.00 0.00 C ATOM 1591 C LEU A 102 -19.436 -10.284 -16.328 1.00 0.00 C ATOM 1592 O LEU A 102 -18.631 -11.208 -16.222 1.00 0.00 O ATOM 1593 CB LEU A 102 -18.490 -8.079 -17.035 1.00 0.00 C ATOM 1594 CG LEU A 102 -17.873 -7.246 -18.159 1.00 0.00 C ATOM 1595 CD1 LEU A 102 -17.343 -5.927 -17.618 1.00 0.00 C ATOM 1596 CD2 LEU A 102 -16.765 -8.024 -18.853 1.00 0.00 C ATOM 0 H LEU A 102 -20.950 -7.953 -17.514 1.00 0.00 H new ATOM 0 HA LEU A 102 -18.838 -9.770 -18.314 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -19.117 -7.426 -16.428 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -17.686 -8.437 -16.392 1.00 0.00 H new ATOM 0 HG LEU A 102 -18.650 -7.028 -18.892 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -16.908 -5.348 -18.433 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -18.161 -5.363 -17.169 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -16.580 -6.123 -16.864 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -16.337 -7.416 -19.650 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -15.988 -8.274 -18.130 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -17.175 -8.941 -19.277 1.00 0.00 H new ATOM 1608 N GLU A 103 -20.438 -10.095 -15.474 1.00 0.00 N ATOM 1609 CA GLU A 103 -20.651 -10.984 -14.339 1.00 0.00 C ATOM 1610 C GLU A 103 -20.597 -12.445 -14.774 1.00 0.00 C ATOM 1611 O GLU A 103 -19.789 -13.235 -14.285 1.00 0.00 O ATOM 1612 CB GLU A 103 -21.998 -10.687 -13.676 1.00 0.00 C ATOM 1613 CG GLU A 103 -21.888 -10.335 -12.202 1.00 0.00 C ATOM 1614 CD GLU A 103 -21.299 -11.462 -11.376 1.00 0.00 C ATOM 1615 OE1 GLU A 103 -21.371 -12.625 -11.824 1.00 0.00 O ATOM 1616 OE2 GLU A 103 -20.766 -11.180 -10.282 1.00 0.00 O ATOM 0 H GLU A 103 -21.114 -9.335 -15.547 1.00 0.00 H new ATOM 0 HA GLU A 103 -19.853 -10.808 -13.618 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -22.478 -9.862 -14.203 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -22.647 -11.556 -13.786 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -21.269 -9.445 -12.090 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -22.877 -10.086 -11.817 1.00 0.00 H new ATOM 1623 N PRO A 104 -21.477 -12.815 -15.716 1.00 0.00 N ATOM 1624 CA PRO A 104 -21.550 -14.182 -16.238 1.00 0.00 C ATOM 1625 C PRO A 104 -20.338 -14.543 -17.091 1.00 0.00 C ATOM 1626 O PRO A 104 -20.191 -15.685 -17.527 1.00 0.00 O ATOM 1627 CB PRO A 104 -22.820 -14.168 -17.093 1.00 0.00 C ATOM 1628 CG PRO A 104 -22.992 -12.744 -17.492 1.00 0.00 C ATOM 1629 CD PRO A 104 -22.469 -11.926 -16.344 1.00 0.00 C ATOM 0 HA PRO A 104 -21.566 -14.923 -15.439 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -22.717 -14.814 -17.965 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -23.681 -14.528 -16.529 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -22.443 -12.526 -18.408 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -24.040 -12.517 -17.687 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -22.015 -10.996 -16.687 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -23.263 -11.655 -15.648 1.00 0.00 H new ATOM 1637 N PHE A 105 -19.472 -13.562 -17.324 1.00 0.00 N ATOM 1638 CA PHE A 105 -18.273 -13.776 -18.126 1.00 0.00 C ATOM 1639 C PHE A 105 -17.099 -14.197 -17.246 1.00 0.00 C ATOM 1640 O PHE A 105 -16.088 -14.698 -17.739 1.00 0.00 O ATOM 1641 CB PHE A 105 -17.916 -12.505 -18.898 1.00 0.00 C ATOM 1642 CG PHE A 105 -17.171 -12.768 -20.175 1.00 0.00 C ATOM 1643 CD1 PHE A 105 -17.713 -13.588 -21.152 1.00 0.00 C ATOM 1644 CD2 PHE A 105 -15.929 -12.197 -20.399 1.00 0.00 C ATOM 1645 CE1 PHE A 105 -17.030 -13.832 -22.329 1.00 0.00 C ATOM 1646 CE2 PHE A 105 -15.242 -12.437 -21.574 1.00 0.00 C ATOM 1647 CZ PHE A 105 -15.793 -13.257 -22.539 1.00 0.00 C ATOM 0 H PHE A 105 -19.578 -12.612 -16.969 1.00 0.00 H new ATOM 0 HA PHE A 105 -18.479 -14.577 -18.836 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -18.831 -11.959 -19.127 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -17.311 -11.860 -18.260 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -18.680 -14.042 -20.992 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.492 -11.557 -19.647 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -17.464 -14.472 -23.083 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -14.275 -11.984 -21.737 1.00 0.00 H new ATOM 0 HZ PHE A 105 -15.257 -13.448 -23.457 1.00 0.00 H new ATOM 1657 N ILE A 106 -17.241 -13.988 -15.941 1.00 0.00 N ATOM 1658 CA ILE A 106 -16.193 -14.346 -14.993 1.00 0.00 C ATOM 1659 C ILE A 106 -15.814 -15.817 -15.122 1.00 0.00 C ATOM 1660 O ILE A 106 -14.671 -16.198 -14.871 1.00 0.00 O ATOM 1661 CB ILE A 106 -16.628 -14.065 -13.542 1.00 0.00 C ATOM 1662 CG1 ILE A 106 -16.874 -12.568 -13.342 1.00 0.00 C ATOM 1663 CG2 ILE A 106 -15.575 -14.569 -12.567 1.00 0.00 C ATOM 1664 CD1 ILE A 106 -17.563 -12.238 -12.035 1.00 0.00 C ATOM 0 H ILE A 106 -18.071 -13.573 -15.517 1.00 0.00 H new ATOM 0 HA ILE A 106 -15.327 -13.728 -15.231 1.00 0.00 H new ATOM 0 HB ILE A 106 -17.559 -14.597 -13.347 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -15.920 -12.043 -13.383 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -17.480 -12.194 -14.167 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -15.896 -14.363 -11.546 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -15.444 -15.643 -12.697 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -14.629 -14.062 -12.759 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -17.705 -11.160 -11.961 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -18.532 -12.735 -11.999 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -16.948 -12.581 -11.203 1.00 0.00 H new ATOM 1676 N ALA A 107 -16.780 -16.639 -15.516 1.00 0.00 N ATOM 1677 CA ALA A 107 -16.546 -18.069 -15.682 1.00 0.00 C ATOM 1678 C ALA A 107 -15.366 -18.327 -16.612 1.00 0.00 C ATOM 1679 O ALA A 107 -14.612 -19.282 -16.424 1.00 0.00 O ATOM 1680 CB ALA A 107 -17.799 -18.750 -16.214 1.00 0.00 C ATOM 0 H ALA A 107 -17.732 -16.340 -15.726 1.00 0.00 H new ATOM 0 HA ALA A 107 -16.304 -18.489 -14.706 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -17.610 -19.817 -16.333 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -18.619 -18.603 -15.511 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -18.066 -18.319 -17.179 1.00 0.00 H new ATOM 1686 N SER A 108 -15.212 -17.471 -17.618 1.00 0.00 N ATOM 1687 CA SER A 108 -14.126 -17.610 -18.580 1.00 0.00 C ATOM 1688 C SER A 108 -12.856 -16.936 -18.068 1.00 0.00 C ATOM 1689 O SER A 108 -11.745 -17.314 -18.441 1.00 0.00 O ATOM 1690 CB SER A 108 -14.529 -17.007 -19.927 1.00 0.00 C ATOM 1691 OG SER A 108 -14.044 -17.791 -21.003 1.00 0.00 O ATOM 0 H SER A 108 -15.826 -16.674 -17.787 1.00 0.00 H new ATOM 0 HA SER A 108 -13.925 -18.673 -18.711 1.00 0.00 H new ATOM 0 HB2 SER A 108 -15.615 -16.935 -19.986 1.00 0.00 H new ATOM 0 HB3 SER A 108 -14.137 -15.993 -20.007 1.00 0.00 H new ATOM 0 HG SER A 108 -14.317 -17.385 -21.852 1.00 0.00 H new