USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 985 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 65 LYS NZ :NH3+ 150:sc= 1.16 (180deg=-0.0887) USER MOD Set 1.2: A 68 SER OG : rot -40:sc= 2.11 USER MOD Set 2.1: A 29 GLN : amide:sc= 0 X(o=-0.023,f=-0.29) USER MOD Set 2.2: A 31 LYS NZ :NH3+ -132:sc= -0.0234 (180deg=-0.889) USER MOD Set 3.1: A 27 SER OG : rot -91:sc= -1.73! USER MOD Set 3.2: A 109 MET CE :methyl 172:sc= -0.138 (180deg=-0.21) USER MOD Set 3.3: A 112 HIS : no HE2:sc= -4.72! C(o=-6.6!,f=-13!) USER MOD Single : A 1 PHE N :NH3+ -129:sc= 0.0603 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= -2.53! C(o=-2.5!,f=-2.8!) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 170:sc= -1.31! USER MOD Single : A 23 TYR OH : rot 156:sc= -1.32! USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -0.151 K(o=-0.15,f=-1.5!) USER MOD Single : A 34 GLN : amide:sc= -1.59 X(o=-1.6,f=-1.3) USER MOD Single : A 37 LYS NZ :NH3+ -156:sc= -0.0519 (180deg=-0.308) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 MET CE :methyl 146:sc= -3.94! (180deg=-7.32!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.875 K(o=-0.88,f=-4.6!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.434) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 167:sc=-0.00367 (180deg=-0.132) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 153:sc= -7.04! (180deg=-9.53!) USER MOD Single : A 73 THR OG1 : rot 50:sc= -1.13 USER MOD Single : A 75 LYS NZ :NH3+ 174:sc= -0.0083 (180deg=-0.0325) USER MOD Single : A 77 LYS NZ :NH3+ -140:sc= -0.082 (180deg=-1.24) USER MOD Single : A 79 SER OG : rot 76:sc= 1.04 USER MOD Single : A 82 THR OG1 : rot -80:sc= -1.5 USER MOD Single : A 83 SER OG : rot -62:sc= 1.15 USER MOD Single : A 84 ASN : amide:sc= -0.108 X(o=-0.11,f=0) USER MOD Single : A 87 ASN : amide:sc= -0.532 K(o=-0.53,f=-3!) USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 96 THR OG1 : rot 93:sc= -0.124 USER MOD Single : A 97 ASN : amide:sc= -0.259 X(o=-0.26,f=0) USER MOD Single : A 98 THR OG1 : rot 120:sc= -1.01 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl -141:sc= -0.0198 (180deg=-0.706) USER MOD Single : A 110 SER OG : rot 75:sc= 0.303 USER MOD Single : A 118 CYS SG : rot 180:sc= 0.0185 USER MOD Single : A 119 THR OG1 : rot 92:sc= 0.0285 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 1 -9.320 8.787 29.388 1.00 0.00 N ATOM 2 CA PHE A 1 -9.362 7.322 29.640 1.00 0.00 C ATOM 3 C PHE A 1 -8.941 6.537 28.401 1.00 0.00 C ATOM 4 O PHE A 1 -8.614 7.120 27.368 1.00 0.00 O ATOM 5 CB PHE A 1 -10.785 6.937 30.050 1.00 0.00 C ATOM 6 CG PHE A 1 -10.841 5.794 31.022 1.00 0.00 C ATOM 7 CD1 PHE A 1 -10.169 5.862 32.232 1.00 0.00 C ATOM 8 CD2 PHE A 1 -11.566 4.651 30.725 1.00 0.00 C ATOM 9 CE1 PHE A 1 -10.220 4.811 33.128 1.00 0.00 C ATOM 10 CE2 PHE A 1 -11.621 3.598 31.618 1.00 0.00 C ATOM 11 CZ PHE A 1 -10.946 3.677 32.821 1.00 0.00 C ATOM 0 H1 PHE A 1 -8.775 9.253 30.141 1.00 0.00 H new ATOM 0 H2 PHE A 1 -8.867 8.968 28.469 1.00 0.00 H new ATOM 0 H3 PHE A 1 -10.289 9.165 29.377 1.00 0.00 H new ATOM 0 HA PHE A 1 -8.662 7.077 30.438 1.00 0.00 H new ATOM 0 HB2 PHE A 1 -11.274 7.805 30.493 1.00 0.00 H new ATOM 0 HB3 PHE A 1 -11.352 6.673 29.158 1.00 0.00 H new ATOM 0 HD1 PHE A 1 -9.599 6.746 32.478 1.00 0.00 H new ATOM 0 HD2 PHE A 1 -12.094 4.582 29.785 1.00 0.00 H new ATOM 0 HE1 PHE A 1 -9.692 4.876 34.068 1.00 0.00 H new ATOM 0 HE2 PHE A 1 -12.191 2.714 31.376 1.00 0.00 H new ATOM 0 HZ PHE A 1 -10.986 2.854 33.519 1.00 0.00 H new ATOM 22 N ALA A 2 -8.953 5.212 28.515 1.00 0.00 N ATOM 23 CA ALA A 2 -8.573 4.342 27.406 1.00 0.00 C ATOM 24 C ALA A 2 -7.087 4.478 27.085 1.00 0.00 C ATOM 25 O ALA A 2 -6.299 3.573 27.358 1.00 0.00 O ATOM 26 CB ALA A 2 -9.414 4.652 26.175 1.00 0.00 C ATOM 0 H ALA A 2 -9.222 4.717 29.365 1.00 0.00 H new ATOM 0 HA ALA A 2 -8.760 3.311 27.707 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -9.118 3.995 25.357 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -10.468 4.494 26.405 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -9.259 5.690 25.880 1.00 0.00 H new ATOM 32 N LYS A 3 -6.713 5.613 26.503 1.00 0.00 N ATOM 33 CA LYS A 3 -5.323 5.865 26.144 1.00 0.00 C ATOM 34 C LYS A 3 -5.130 7.311 25.699 1.00 0.00 C ATOM 35 O LYS A 3 -5.927 7.845 24.927 1.00 0.00 O ATOM 36 CB LYS A 3 -4.880 4.913 25.032 1.00 0.00 C ATOM 37 CG LYS A 3 -3.372 4.748 24.938 1.00 0.00 C ATOM 38 CD LYS A 3 -2.908 3.468 25.614 1.00 0.00 C ATOM 39 CE LYS A 3 -1.470 3.134 25.251 1.00 0.00 C ATOM 40 NZ LYS A 3 -1.266 1.669 25.077 1.00 0.00 N ATOM 0 H LYS A 3 -7.353 6.372 26.270 1.00 0.00 H new ATOM 0 HA LYS A 3 -4.709 5.690 27.027 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -5.334 3.936 25.199 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -5.257 5.281 24.078 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -3.071 4.737 23.890 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -2.882 5.604 25.402 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -2.996 3.574 26.695 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -3.559 2.644 25.321 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -1.199 3.650 24.330 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -0.804 3.503 26.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.273 1.484 24.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.500 1.178 25.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -1.883 1.321 24.315 1.00 0.00 H new ATOM 54 N LEU A 4 -4.068 7.941 26.191 1.00 0.00 N ATOM 55 CA LEU A 4 -3.772 9.326 25.844 1.00 0.00 C ATOM 56 C LEU A 4 -3.571 9.479 24.340 1.00 0.00 C ATOM 57 O LEU A 4 -3.730 8.521 23.582 1.00 0.00 O ATOM 58 CB LEU A 4 -2.523 9.805 26.588 1.00 0.00 C ATOM 59 CG LEU A 4 -2.551 9.593 28.103 1.00 0.00 C ATOM 60 CD1 LEU A 4 -1.200 9.930 28.713 1.00 0.00 C ATOM 61 CD2 LEU A 4 -3.649 10.433 28.737 1.00 0.00 C ATOM 0 H LEU A 4 -3.398 7.514 26.831 1.00 0.00 H new ATOM 0 HA LEU A 4 -4.622 9.939 26.143 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -1.655 9.288 26.180 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -2.384 10.867 26.388 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.764 8.543 28.301 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -1.238 9.773 29.791 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -0.434 9.286 28.280 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -0.957 10.972 28.506 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.655 10.270 29.815 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -3.466 11.487 28.530 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.614 10.144 28.321 1.00 0.00 H new ATOM 73 N VAL A 5 -3.222 10.687 23.913 1.00 0.00 N ATOM 74 CA VAL A 5 -3.000 10.963 22.499 1.00 0.00 C ATOM 75 C VAL A 5 -1.847 11.942 22.301 1.00 0.00 C ATOM 76 O VAL A 5 -1.816 12.690 21.324 1.00 0.00 O ATOM 77 CB VAL A 5 -4.264 11.538 21.834 1.00 0.00 C ATOM 78 CG1 VAL A 5 -5.306 10.449 21.635 1.00 0.00 C ATOM 79 CG2 VAL A 5 -4.829 12.682 22.662 1.00 0.00 C ATOM 0 H VAL A 5 -3.087 11.491 24.526 1.00 0.00 H new ATOM 0 HA VAL A 5 -2.750 10.012 22.029 1.00 0.00 H new ATOM 0 HB VAL A 5 -3.991 11.929 20.854 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -6.192 10.875 21.164 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -4.897 9.666 20.997 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -5.578 10.024 22.601 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -5.722 13.076 22.177 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -5.087 12.318 23.657 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -4.083 13.473 22.747 1.00 0.00 H new ATOM 89 N ARG A 6 -0.899 11.932 23.234 1.00 0.00 N ATOM 90 CA ARG A 6 0.255 12.819 23.160 1.00 0.00 C ATOM 91 C ARG A 6 1.327 12.261 22.222 1.00 0.00 C ATOM 92 O ARG A 6 1.850 12.982 21.373 1.00 0.00 O ATOM 93 CB ARG A 6 0.845 13.052 24.553 1.00 0.00 C ATOM 94 CG ARG A 6 -0.203 13.301 25.625 1.00 0.00 C ATOM 95 CD ARG A 6 0.372 13.117 27.020 1.00 0.00 C ATOM 96 NE ARG A 6 -0.499 13.678 28.051 1.00 0.00 N ATOM 97 CZ ARG A 6 -0.568 14.975 28.339 1.00 0.00 C ATOM 98 NH1 ARG A 6 0.182 15.849 27.677 1.00 0.00 N ATOM 99 NH2 ARG A 6 -1.387 15.400 29.291 1.00 0.00 N ATOM 0 H ARG A 6 -0.908 11.319 24.049 1.00 0.00 H new ATOM 0 HA ARG A 6 -0.087 13.772 22.756 1.00 0.00 H new ATOM 0 HB2 ARG A 6 1.442 12.185 24.835 1.00 0.00 H new ATOM 0 HB3 ARG A 6 1.522 13.906 24.513 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -0.596 14.313 25.523 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -1.040 12.618 25.482 1.00 0.00 H new ATOM 0 HD2 ARG A 6 0.523 12.055 27.212 1.00 0.00 H new ATOM 0 HD3 ARG A 6 1.351 13.593 27.074 1.00 0.00 H new ATOM 0 HE ARG A 6 -1.089 13.037 28.581 1.00 0.00 H new ATOM 0 HH11 ARG A 6 0.814 15.527 26.944 1.00 0.00 H new ATOM 0 HH12 ARG A 6 0.126 16.842 27.901 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -1.964 14.733 29.803 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -1.440 16.394 29.512 1.00 0.00 H new ATOM 113 N PRO A 7 1.676 10.967 22.361 1.00 0.00 N ATOM 114 CA PRO A 7 2.690 10.333 21.518 1.00 0.00 C ATOM 115 C PRO A 7 2.132 9.901 20.163 1.00 0.00 C ATOM 116 O PRO A 7 0.921 9.925 19.945 1.00 0.00 O ATOM 117 CB PRO A 7 3.103 9.117 22.341 1.00 0.00 C ATOM 118 CG PRO A 7 1.874 8.741 23.098 1.00 0.00 C ATOM 119 CD PRO A 7 1.113 10.020 23.345 1.00 0.00 C ATOM 0 HA PRO A 7 3.512 11.008 21.279 1.00 0.00 H new ATOM 0 HB2 PRO A 7 3.440 8.301 21.701 1.00 0.00 H new ATOM 0 HB3 PRO A 7 3.926 9.355 23.014 1.00 0.00 H new ATOM 0 HG2 PRO A 7 1.270 8.034 22.530 1.00 0.00 H new ATOM 0 HG3 PRO A 7 2.132 8.255 24.039 1.00 0.00 H new ATOM 0 HD2 PRO A 7 0.042 9.882 23.198 1.00 0.00 H new ATOM 0 HD3 PRO A 7 1.251 10.376 24.366 1.00 0.00 H new ATOM 127 N PRO A 8 3.014 9.497 19.232 1.00 0.00 N ATOM 128 CA PRO A 8 2.602 9.056 17.895 1.00 0.00 C ATOM 129 C PRO A 8 1.715 7.817 17.943 1.00 0.00 C ATOM 130 O PRO A 8 1.441 7.280 19.017 1.00 0.00 O ATOM 131 CB PRO A 8 3.927 8.740 17.190 1.00 0.00 C ATOM 132 CG PRO A 8 4.911 8.533 18.289 1.00 0.00 C ATOM 133 CD PRO A 8 4.475 9.434 19.407 1.00 0.00 C ATOM 0 HA PRO A 8 2.008 9.814 17.385 1.00 0.00 H new ATOM 0 HB2 PRO A 8 3.839 7.850 16.566 1.00 0.00 H new ATOM 0 HB3 PRO A 8 4.231 9.558 16.537 1.00 0.00 H new ATOM 0 HG2 PRO A 8 4.925 7.491 18.610 1.00 0.00 H new ATOM 0 HG3 PRO A 8 5.921 8.779 17.960 1.00 0.00 H new ATOM 0 HD2 PRO A 8 4.748 9.029 20.381 1.00 0.00 H new ATOM 0 HD3 PRO A 8 4.933 10.420 19.332 1.00 0.00 H new ATOM 141 N VAL A 9 1.269 7.367 16.776 1.00 0.00 N ATOM 142 CA VAL A 9 0.411 6.191 16.688 1.00 0.00 C ATOM 143 C VAL A 9 0.925 5.210 15.638 1.00 0.00 C ATOM 144 O VAL A 9 1.071 4.021 15.912 1.00 0.00 O ATOM 145 CB VAL A 9 -1.041 6.575 16.346 1.00 0.00 C ATOM 146 CG1 VAL A 9 -1.753 7.119 17.575 1.00 0.00 C ATOM 147 CG2 VAL A 9 -1.079 7.585 15.209 1.00 0.00 C ATOM 0 H VAL A 9 1.487 7.798 15.878 1.00 0.00 H new ATOM 0 HA VAL A 9 0.431 5.715 17.668 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.564 5.677 16.017 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -2.777 7.385 17.314 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -1.763 6.359 18.356 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -1.229 8.004 17.937 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -2.114 7.841 14.985 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -0.538 8.484 15.503 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -0.612 7.154 14.324 1.00 0.00 H new ATOM 157 N GLN A 10 1.196 5.723 14.439 1.00 0.00 N ATOM 158 CA GLN A 10 1.696 4.909 13.328 1.00 0.00 C ATOM 159 C GLN A 10 0.551 4.222 12.578 1.00 0.00 C ATOM 160 O GLN A 10 0.135 4.690 11.518 1.00 0.00 O ATOM 161 CB GLN A 10 2.720 3.871 13.814 1.00 0.00 C ATOM 162 CG GLN A 10 4.017 3.881 13.021 1.00 0.00 C ATOM 163 CD GLN A 10 4.398 2.507 12.506 1.00 0.00 C ATOM 164 OE1 GLN A 10 4.016 1.487 13.081 1.00 0.00 O ATOM 165 NE2 GLN A 10 5.156 2.471 11.417 1.00 0.00 N ATOM 0 H GLN A 10 1.077 6.710 14.209 1.00 0.00 H new ATOM 0 HA GLN A 10 2.198 5.584 12.634 1.00 0.00 H new ATOM 0 HB2 GLN A 10 2.944 4.058 14.864 1.00 0.00 H new ATOM 0 HB3 GLN A 10 2.275 2.878 13.755 1.00 0.00 H new ATOM 0 HG2 GLN A 10 3.918 4.566 12.179 1.00 0.00 H new ATOM 0 HG3 GLN A 10 4.820 4.264 13.650 1.00 0.00 H new ATOM 0 HE21 GLN A 10 5.450 3.340 10.972 1.00 0.00 H new ATOM 0 HE22 GLN A 10 5.444 1.574 11.025 1.00 0.00 H new ATOM 174 N ILE A 11 0.049 3.111 13.116 1.00 0.00 N ATOM 175 CA ILE A 11 -1.039 2.381 12.466 1.00 0.00 C ATOM 176 C ILE A 11 -2.393 2.748 13.067 1.00 0.00 C ATOM 177 O ILE A 11 -3.321 1.941 13.075 1.00 0.00 O ATOM 178 CB ILE A 11 -0.829 0.845 12.543 1.00 0.00 C ATOM 179 CG1 ILE A 11 -1.192 0.283 13.924 1.00 0.00 C ATOM 180 CG2 ILE A 11 0.610 0.489 12.203 1.00 0.00 C ATOM 181 CD1 ILE A 11 -1.797 -1.102 13.870 1.00 0.00 C ATOM 0 H ILE A 11 0.374 2.700 13.991 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.030 2.676 11.417 1.00 0.00 H new ATOM 0 HB ILE A 11 -1.499 0.391 11.812 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -0.296 0.256 14.544 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -1.895 0.960 14.410 1.00 0.00 H new ATOM 0 HG21 ILE A 11 0.741 -0.592 12.261 1.00 0.00 H new ATOM 0 HG22 ILE A 11 0.840 0.828 11.193 1.00 0.00 H new ATOM 0 HG23 ILE A 11 1.282 0.975 12.911 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.029 -1.437 14.881 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.711 -1.077 13.277 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.087 -1.792 13.413 1.00 0.00 H new ATOM 193 N TYR A 12 -2.494 3.967 13.581 1.00 0.00 N ATOM 194 CA TYR A 12 -3.728 4.436 14.197 1.00 0.00 C ATOM 195 C TYR A 12 -3.916 5.930 13.955 1.00 0.00 C ATOM 196 O TYR A 12 -4.266 6.676 14.870 1.00 0.00 O ATOM 197 CB TYR A 12 -3.719 4.154 15.709 1.00 0.00 C ATOM 198 CG TYR A 12 -2.829 3.000 16.141 1.00 0.00 C ATOM 199 CD1 TYR A 12 -1.466 2.985 15.851 1.00 0.00 C ATOM 200 CD2 TYR A 12 -3.355 1.928 16.852 1.00 0.00 C ATOM 201 CE1 TYR A 12 -0.660 1.938 16.255 1.00 0.00 C ATOM 202 CE2 TYR A 12 -2.554 0.876 17.257 1.00 0.00 C ATOM 203 CZ TYR A 12 -1.209 0.887 16.957 1.00 0.00 C ATOM 204 OH TYR A 12 -0.409 -0.158 17.361 1.00 0.00 O ATOM 0 H TYR A 12 -1.736 4.649 13.583 1.00 0.00 H new ATOM 0 HA TYR A 12 -4.558 3.897 13.740 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -3.398 5.056 16.230 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -4.740 3.947 16.031 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -1.032 3.807 15.301 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.408 1.916 17.092 1.00 0.00 H new ATOM 0 HE1 TYR A 12 0.395 1.943 16.022 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -2.981 0.050 17.806 1.00 0.00 H new ATOM 0 HH TYR A 12 -0.950 -0.816 17.845 1.00 0.00 H new ATOM 214 N GLY A 13 -3.675 6.366 12.722 1.00 0.00 N ATOM 215 CA GLY A 13 -3.816 7.765 12.395 1.00 0.00 C ATOM 216 C GLY A 13 -4.660 7.993 11.165 1.00 0.00 C ATOM 217 O GLY A 13 -5.829 7.610 11.112 1.00 0.00 O ATOM 0 H GLY A 13 -3.385 5.771 11.946 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -4.264 8.288 13.240 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -2.828 8.199 12.239 1.00 0.00 H new ATOM 221 N ILE A 14 -4.045 8.605 10.168 1.00 0.00 N ATOM 222 CA ILE A 14 -4.706 8.882 8.904 1.00 0.00 C ATOM 223 C ILE A 14 -4.223 7.891 7.859 1.00 0.00 C ATOM 224 O ILE A 14 -4.981 7.455 6.994 1.00 0.00 O ATOM 225 CB ILE A 14 -4.435 10.326 8.425 1.00 0.00 C ATOM 226 CG1 ILE A 14 -5.330 10.675 7.229 1.00 0.00 C ATOM 227 CG2 ILE A 14 -2.963 10.513 8.078 1.00 0.00 C ATOM 228 CD1 ILE A 14 -4.925 10.002 5.933 1.00 0.00 C ATOM 0 H ILE A 14 -3.077 8.923 10.211 1.00 0.00 H new ATOM 0 HA ILE A 14 -5.781 8.778 9.049 1.00 0.00 H new ATOM 0 HB ILE A 14 -4.677 11.008 9.240 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.357 10.396 7.465 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -5.318 11.755 7.084 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -2.795 11.537 7.743 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -2.353 10.315 8.960 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -2.686 9.821 7.283 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -5.608 10.302 5.138 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.910 10.300 5.670 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -4.965 8.920 6.057 1.00 0.00 H new ATOM 240 N GLU A 15 -2.952 7.522 7.972 1.00 0.00 N ATOM 241 CA GLU A 15 -2.352 6.560 7.069 1.00 0.00 C ATOM 242 C GLU A 15 -2.798 5.152 7.445 1.00 0.00 C ATOM 243 O GLU A 15 -2.882 4.269 6.591 1.00 0.00 O ATOM 244 CB GLU A 15 -0.824 6.665 7.115 1.00 0.00 C ATOM 245 CG GLU A 15 -0.194 6.960 5.764 1.00 0.00 C ATOM 246 CD GLU A 15 0.286 8.394 5.645 1.00 0.00 C ATOM 247 OE1 GLU A 15 -0.532 9.313 5.857 1.00 0.00 O ATOM 248 OE2 GLU A 15 1.481 8.597 5.340 1.00 0.00 O ATOM 0 H GLU A 15 -2.318 7.880 8.686 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.680 6.776 6.052 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -0.543 7.450 7.817 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.415 5.731 7.501 1.00 0.00 H new ATOM 0 HG2 GLU A 15 0.647 6.285 5.604 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.920 6.757 4.977 1.00 0.00 H new ATOM 255 N GLY A 16 -3.097 4.951 8.729 1.00 0.00 N ATOM 256 CA GLY A 16 -3.544 3.645 9.181 1.00 0.00 C ATOM 257 C GLY A 16 -4.961 3.345 8.737 1.00 0.00 C ATOM 258 O GLY A 16 -5.291 2.202 8.422 1.00 0.00 O ATOM 0 H GLY A 16 -3.038 5.663 9.457 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.873 2.878 8.794 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -3.487 3.599 10.269 1.00 0.00 H new ATOM 262 N ARG A 17 -5.798 4.377 8.701 1.00 0.00 N ATOM 263 CA ARG A 17 -7.184 4.219 8.280 1.00 0.00 C ATOM 264 C ARG A 17 -7.263 4.043 6.770 1.00 0.00 C ATOM 265 O ARG A 17 -8.171 3.389 6.263 1.00 0.00 O ATOM 266 CB ARG A 17 -8.016 5.427 8.713 1.00 0.00 C ATOM 267 CG ARG A 17 -9.500 5.283 8.416 1.00 0.00 C ATOM 268 CD ARG A 17 -10.171 6.637 8.256 1.00 0.00 C ATOM 269 NE ARG A 17 -10.727 7.124 9.515 1.00 0.00 N ATOM 270 CZ ARG A 17 -11.548 8.168 9.609 1.00 0.00 C ATOM 271 NH1 ARG A 17 -11.910 8.836 8.521 1.00 0.00 N ATOM 272 NH2 ARG A 17 -12.009 8.544 10.795 1.00 0.00 N ATOM 0 H ARG A 17 -5.540 5.330 8.958 1.00 0.00 H new ATOM 0 HA ARG A 17 -7.589 3.327 8.758 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -7.882 5.585 9.783 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -7.638 6.317 8.210 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -9.635 4.699 7.505 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -9.981 4.730 9.223 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -9.447 7.358 7.877 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -10.966 6.562 7.514 1.00 0.00 H new ATOM 0 HE ARG A 17 -10.471 6.636 10.373 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -11.559 8.550 7.607 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.539 9.635 8.599 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -11.734 8.033 11.634 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -12.638 9.344 10.868 1.00 0.00 H new ATOM 286 N TYR A 18 -6.298 4.618 6.056 1.00 0.00 N ATOM 287 CA TYR A 18 -6.253 4.508 4.602 1.00 0.00 C ATOM 288 C TYR A 18 -6.444 3.060 4.176 1.00 0.00 C ATOM 289 O TYR A 18 -7.155 2.768 3.213 1.00 0.00 O ATOM 290 CB TYR A 18 -4.913 5.027 4.076 1.00 0.00 C ATOM 291 CG TYR A 18 -5.003 6.366 3.386 1.00 0.00 C ATOM 292 CD1 TYR A 18 -5.781 7.387 3.910 1.00 0.00 C ATOM 293 CD2 TYR A 18 -4.302 6.609 2.212 1.00 0.00 C ATOM 294 CE1 TYR A 18 -5.863 8.614 3.283 1.00 0.00 C ATOM 295 CE2 TYR A 18 -4.377 7.832 1.578 1.00 0.00 C ATOM 296 CZ TYR A 18 -5.159 8.833 2.116 1.00 0.00 C ATOM 297 OH TYR A 18 -5.236 10.054 1.488 1.00 0.00 O ATOM 0 H TYR A 18 -5.538 5.164 6.461 1.00 0.00 H new ATOM 0 HA TYR A 18 -7.060 5.110 4.184 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -4.213 5.105 4.908 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -4.500 4.297 3.379 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -6.332 7.220 4.824 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.688 5.828 1.788 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -6.475 9.399 3.703 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -3.826 8.005 0.665 1.00 0.00 H new ATOM 0 HH TYR A 18 -4.680 10.042 0.681 1.00 0.00 H new ATOM 307 N ALA A 19 -5.807 2.160 4.909 1.00 0.00 N ATOM 308 CA ALA A 19 -5.903 0.739 4.626 1.00 0.00 C ATOM 309 C ALA A 19 -7.285 0.215 4.984 1.00 0.00 C ATOM 310 O ALA A 19 -7.890 -0.537 4.223 1.00 0.00 O ATOM 311 CB ALA A 19 -4.829 -0.024 5.387 1.00 0.00 C ATOM 0 H ALA A 19 -5.216 2.391 5.707 1.00 0.00 H new ATOM 0 HA ALA A 19 -5.746 0.587 3.558 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.913 -1.088 5.166 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.845 0.333 5.084 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -4.959 0.135 6.457 1.00 0.00 H new ATOM 317 N THR A 20 -7.783 0.619 6.146 1.00 0.00 N ATOM 318 CA THR A 20 -9.096 0.182 6.597 1.00 0.00 C ATOM 319 C THR A 20 -10.201 0.807 5.754 1.00 0.00 C ATOM 320 O THR A 20 -11.290 0.245 5.633 1.00 0.00 O ATOM 321 CB THR A 20 -9.299 0.509 8.075 1.00 0.00 C ATOM 322 OG1 THR A 20 -8.213 1.265 8.580 1.00 0.00 O ATOM 323 CG2 THR A 20 -9.434 -0.727 8.933 1.00 0.00 C ATOM 0 H THR A 20 -7.300 1.245 6.790 1.00 0.00 H new ATOM 0 HA THR A 20 -9.148 -0.900 6.475 1.00 0.00 H new ATOM 0 HB THR A 20 -10.226 1.080 8.124 1.00 0.00 H new ATOM 0 HG1 THR A 20 -8.435 1.599 9.474 1.00 0.00 H new ATOM 0 HG21 THR A 20 -9.576 -0.434 9.973 1.00 0.00 H new ATOM 0 HG22 THR A 20 -10.293 -1.309 8.599 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.531 -1.331 8.846 1.00 0.00 H new ATOM 331 N ALA A 21 -9.920 1.962 5.161 1.00 0.00 N ATOM 332 CA ALA A 21 -10.901 2.635 4.323 1.00 0.00 C ATOM 333 C ALA A 21 -10.687 2.293 2.853 1.00 0.00 C ATOM 334 O ALA A 21 -11.384 2.805 1.978 1.00 0.00 O ATOM 335 CB ALA A 21 -10.850 4.140 4.539 1.00 0.00 C ATOM 0 H ALA A 21 -9.027 2.448 5.245 1.00 0.00 H new ATOM 0 HA ALA A 21 -11.891 2.282 4.611 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.591 4.624 3.903 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -11.065 4.365 5.584 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.857 4.511 4.285 1.00 0.00 H new ATOM 341 N LEU A 22 -9.738 1.401 2.594 1.00 0.00 N ATOM 342 CA LEU A 22 -9.450 0.963 1.237 1.00 0.00 C ATOM 343 C LEU A 22 -9.699 -0.523 1.141 1.00 0.00 C ATOM 344 O LEU A 22 -10.237 -1.017 0.150 1.00 0.00 O ATOM 345 CB LEU A 22 -8.009 1.293 0.846 1.00 0.00 C ATOM 346 CG LEU A 22 -7.690 1.114 -0.639 1.00 0.00 C ATOM 347 CD1 LEU A 22 -6.813 2.252 -1.139 1.00 0.00 C ATOM 348 CD2 LEU A 22 -7.017 -0.229 -0.880 1.00 0.00 C ATOM 0 H LEU A 22 -9.154 0.967 3.309 1.00 0.00 H new ATOM 0 HA LEU A 22 -10.105 1.491 0.544 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -7.799 2.325 1.126 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -7.336 0.662 1.426 1.00 0.00 H new ATOM 0 HG LEU A 22 -8.626 1.134 -1.198 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.597 2.107 -2.197 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -7.333 3.200 -1.002 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.879 2.266 -0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.797 -0.340 -1.942 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.089 -0.279 -0.310 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -7.682 -1.032 -0.561 1.00 0.00 H new ATOM 360 N TYR A 23 -9.341 -1.227 2.201 1.00 0.00 N ATOM 361 CA TYR A 23 -9.562 -2.644 2.264 1.00 0.00 C ATOM 362 C TYR A 23 -11.007 -2.907 2.682 1.00 0.00 C ATOM 363 O TYR A 23 -11.528 -3.996 2.468 1.00 0.00 O ATOM 364 CB TYR A 23 -8.560 -3.297 3.223 1.00 0.00 C ATOM 365 CG TYR A 23 -9.181 -3.939 4.440 1.00 0.00 C ATOM 366 CD1 TYR A 23 -9.907 -5.110 4.320 1.00 0.00 C ATOM 367 CD2 TYR A 23 -9.046 -3.371 5.698 1.00 0.00 C ATOM 368 CE1 TYR A 23 -10.483 -5.710 5.419 1.00 0.00 C ATOM 369 CE2 TYR A 23 -9.619 -3.956 6.803 1.00 0.00 C ATOM 370 CZ TYR A 23 -10.337 -5.128 6.663 1.00 0.00 C ATOM 371 OH TYR A 23 -10.912 -5.713 7.767 1.00 0.00 O ATOM 0 H TYR A 23 -8.895 -0.830 3.028 1.00 0.00 H new ATOM 0 HA TYR A 23 -9.403 -3.090 1.282 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -7.995 -4.053 2.678 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -7.846 -2.542 3.551 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -10.025 -5.563 3.347 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -8.483 -2.456 5.812 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -11.043 -6.627 5.308 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -9.508 -3.501 7.776 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.431 -5.432 8.574 1.00 0.00 H new ATOM 381 N SER A 24 -11.668 -1.889 3.258 1.00 0.00 N ATOM 382 CA SER A 24 -13.062 -2.033 3.665 1.00 0.00 C ATOM 383 C SER A 24 -13.862 -2.605 2.505 1.00 0.00 C ATOM 384 O SER A 24 -14.696 -3.492 2.682 1.00 0.00 O ATOM 385 CB SER A 24 -13.640 -0.683 4.099 1.00 0.00 C ATOM 386 OG SER A 24 -15.055 -0.689 4.036 1.00 0.00 O ATOM 0 H SER A 24 -11.261 -0.973 3.447 1.00 0.00 H new ATOM 0 HA SER A 24 -13.120 -2.711 4.516 1.00 0.00 H new ATOM 0 HB2 SER A 24 -13.319 -0.457 5.116 1.00 0.00 H new ATOM 0 HB3 SER A 24 -13.248 0.107 3.458 1.00 0.00 H new ATOM 0 HG SER A 24 -15.399 0.184 4.320 1.00 0.00 H new ATOM 392 N ALA A 25 -13.557 -2.117 1.307 1.00 0.00 N ATOM 393 CA ALA A 25 -14.200 -2.604 0.101 1.00 0.00 C ATOM 394 C ALA A 25 -13.615 -3.962 -0.247 1.00 0.00 C ATOM 395 O ALA A 25 -14.316 -4.860 -0.713 1.00 0.00 O ATOM 396 CB ALA A 25 -14.008 -1.622 -1.046 1.00 0.00 C ATOM 0 H ALA A 25 -12.866 -1.383 1.150 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.272 -2.702 0.271 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.498 -2.007 -1.940 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.445 -0.660 -0.778 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.943 -1.495 -1.242 1.00 0.00 H new ATOM 402 N ALA A 26 -12.317 -4.103 0.008 1.00 0.00 N ATOM 403 CA ALA A 26 -11.616 -5.353 -0.247 1.00 0.00 C ATOM 404 C ALA A 26 -12.201 -6.484 0.593 1.00 0.00 C ATOM 405 O ALA A 26 -12.360 -7.605 0.117 1.00 0.00 O ATOM 406 CB ALA A 26 -10.134 -5.195 0.053 1.00 0.00 C ATOM 0 H ALA A 26 -11.730 -3.363 0.392 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.741 -5.605 -1.300 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -9.621 -6.137 -0.142 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.715 -4.415 -0.583 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -10.002 -4.919 1.099 1.00 0.00 H new ATOM 412 N SER A 27 -12.520 -6.176 1.848 1.00 0.00 N ATOM 413 CA SER A 27 -13.090 -7.160 2.761 1.00 0.00 C ATOM 414 C SER A 27 -14.385 -7.728 2.194 1.00 0.00 C ATOM 415 O SER A 27 -14.588 -8.941 2.174 1.00 0.00 O ATOM 416 CB SER A 27 -13.355 -6.524 4.125 1.00 0.00 C ATOM 417 OG SER A 27 -13.124 -7.450 5.170 1.00 0.00 O ATOM 0 H SER A 27 -12.392 -5.250 2.255 1.00 0.00 H new ATOM 0 HA SER A 27 -12.374 -7.973 2.881 1.00 0.00 H new ATOM 0 HB2 SER A 27 -12.711 -5.654 4.256 1.00 0.00 H new ATOM 0 HB3 SER A 27 -14.384 -6.168 4.171 1.00 0.00 H new ATOM 0 HG SER A 27 -13.957 -7.922 5.379 1.00 0.00 H new ATOM 423 N LYS A 28 -15.259 -6.838 1.724 1.00 0.00 N ATOM 424 CA LYS A 28 -16.533 -7.252 1.145 1.00 0.00 C ATOM 425 C LYS A 28 -16.308 -8.306 0.069 1.00 0.00 C ATOM 426 O LYS A 28 -17.133 -9.199 -0.126 1.00 0.00 O ATOM 427 CB LYS A 28 -17.265 -6.045 0.553 1.00 0.00 C ATOM 428 CG LYS A 28 -18.772 -6.227 0.475 1.00 0.00 C ATOM 429 CD LYS A 28 -19.504 -4.916 0.715 1.00 0.00 C ATOM 430 CE LYS A 28 -21.007 -5.124 0.792 1.00 0.00 C ATOM 431 NZ LYS A 28 -21.642 -4.227 1.796 1.00 0.00 N ATOM 0 H LYS A 28 -15.107 -5.829 1.734 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.148 -7.683 1.935 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -17.044 -5.165 1.157 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -16.878 -5.851 -0.447 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -19.042 -6.622 -0.505 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -19.090 -6.963 1.214 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -19.150 -4.465 1.642 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -19.273 -4.217 -0.088 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -21.449 -4.942 -0.188 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -21.217 -6.162 1.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -22.667 -4.401 1.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -21.239 -4.417 2.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -21.464 -3.236 1.537 1.00 0.00 H new ATOM 445 N GLN A 29 -15.175 -8.199 -0.618 1.00 0.00 N ATOM 446 CA GLN A 29 -14.824 -9.147 -1.665 1.00 0.00 C ATOM 447 C GLN A 29 -14.050 -10.320 -1.076 1.00 0.00 C ATOM 448 O GLN A 29 -14.261 -11.468 -1.465 1.00 0.00 O ATOM 449 CB GLN A 29 -13.991 -8.459 -2.749 1.00 0.00 C ATOM 450 CG GLN A 29 -14.784 -7.473 -3.591 1.00 0.00 C ATOM 451 CD GLN A 29 -13.896 -6.594 -4.450 1.00 0.00 C ATOM 452 OE1 GLN A 29 -13.410 -7.018 -5.497 1.00 0.00 O ATOM 453 NE2 GLN A 29 -13.680 -5.361 -4.008 1.00 0.00 N ATOM 0 H GLN A 29 -14.485 -7.464 -0.467 1.00 0.00 H new ATOM 0 HA GLN A 29 -15.743 -9.522 -2.116 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.159 -7.935 -2.278 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -13.561 -9.218 -3.402 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -15.475 -8.021 -4.231 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -15.387 -6.844 -2.936 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -14.104 -5.051 -3.133 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -13.090 -4.723 -4.543 1.00 0.00 H new ATOM 462 N ASN A 30 -13.145 -10.010 -0.140 1.00 0.00 N ATOM 463 CA ASN A 30 -12.310 -11.012 0.526 1.00 0.00 C ATOM 464 C ASN A 30 -10.929 -11.033 -0.101 1.00 0.00 C ATOM 465 O ASN A 30 -10.273 -12.074 -0.165 1.00 0.00 O ATOM 466 CB ASN A 30 -12.936 -12.411 0.466 1.00 0.00 C ATOM 467 CG ASN A 30 -12.380 -13.340 1.528 1.00 0.00 C ATOM 468 OD1 ASN A 30 -11.974 -12.899 2.604 1.00 0.00 O ATOM 469 ND2 ASN A 30 -12.357 -14.634 1.231 1.00 0.00 N ATOM 0 H ASN A 30 -12.972 -9.056 0.176 1.00 0.00 H new ATOM 0 HA ASN A 30 -12.231 -10.732 1.577 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -14.016 -12.328 0.589 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -12.760 -12.843 -0.519 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -11.993 -15.306 1.907 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -12.704 -14.956 0.327 1.00 0.00 H new ATOM 476 N LYS A 31 -10.493 -9.868 -0.566 1.00 0.00 N ATOM 477 CA LYS A 31 -9.191 -9.740 -1.193 1.00 0.00 C ATOM 478 C LYS A 31 -8.113 -9.405 -0.166 1.00 0.00 C ATOM 479 O LYS A 31 -6.973 -9.135 -0.535 1.00 0.00 O ATOM 480 CB LYS A 31 -9.231 -8.669 -2.284 1.00 0.00 C ATOM 481 CG LYS A 31 -9.462 -9.235 -3.677 1.00 0.00 C ATOM 482 CD LYS A 31 -10.938 -9.235 -4.042 1.00 0.00 C ATOM 483 CE LYS A 31 -11.369 -10.571 -4.627 1.00 0.00 C ATOM 484 NZ LYS A 31 -12.534 -10.428 -5.544 1.00 0.00 N ATOM 0 H LYS A 31 -11.026 -9.000 -0.519 1.00 0.00 H new ATOM 0 HA LYS A 31 -8.940 -10.700 -1.645 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -10.022 -7.956 -2.054 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.291 -8.117 -2.275 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -8.906 -8.646 -4.407 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -9.074 -10.252 -3.726 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.533 -9.016 -3.155 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -11.136 -8.441 -4.762 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -10.534 -11.016 -5.168 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.626 -11.255 -3.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -13.253 -11.141 -5.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -12.942 -9.477 -5.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -12.222 -10.566 -6.526 1.00 0.00 H new ATOM 498 N LEU A 32 -8.467 -9.430 1.124 1.00 0.00 N ATOM 499 CA LEU A 32 -7.511 -9.141 2.185 1.00 0.00 C ATOM 500 C LEU A 32 -6.179 -9.834 1.919 1.00 0.00 C ATOM 501 O LEU A 32 -5.122 -9.327 2.282 1.00 0.00 O ATOM 502 CB LEU A 32 -8.082 -9.588 3.531 1.00 0.00 C ATOM 503 CG LEU A 32 -9.022 -8.580 4.195 1.00 0.00 C ATOM 504 CD1 LEU A 32 -8.216 -7.550 4.972 1.00 0.00 C ATOM 505 CD2 LEU A 32 -9.905 -7.906 3.153 1.00 0.00 C ATOM 0 H LEU A 32 -9.408 -9.648 1.452 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.333 -8.066 2.210 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -8.619 -10.526 3.389 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.255 -9.795 4.210 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.671 -9.109 4.893 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -8.893 -6.837 5.441 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -7.629 -8.052 5.741 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.548 -7.022 4.292 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -10.567 -7.192 3.644 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.280 -7.383 2.430 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.501 -8.660 2.639 1.00 0.00 H new ATOM 517 N GLU A 33 -6.242 -10.985 1.262 1.00 0.00 N ATOM 518 CA GLU A 33 -5.038 -11.736 0.928 1.00 0.00 C ATOM 519 C GLU A 33 -4.303 -11.066 -0.228 1.00 0.00 C ATOM 520 O GLU A 33 -3.074 -11.068 -0.285 1.00 0.00 O ATOM 521 CB GLU A 33 -5.392 -13.179 0.560 1.00 0.00 C ATOM 522 CG GLU A 33 -5.480 -14.108 1.760 1.00 0.00 C ATOM 523 CD GLU A 33 -5.902 -15.514 1.378 1.00 0.00 C ATOM 524 OE1 GLU A 33 -5.694 -15.899 0.207 1.00 0.00 O ATOM 525 OE2 GLU A 33 -6.438 -16.230 2.249 1.00 0.00 O ATOM 0 H GLU A 33 -7.111 -11.418 0.950 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.385 -11.749 1.801 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.346 -13.187 0.034 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -4.643 -13.563 -0.132 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.511 -14.146 2.258 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -6.192 -13.701 2.479 1.00 0.00 H new ATOM 532 N GLN A 34 -5.072 -10.482 -1.141 1.00 0.00 N ATOM 533 CA GLN A 34 -4.513 -9.788 -2.297 1.00 0.00 C ATOM 534 C GLN A 34 -4.169 -8.340 -1.954 1.00 0.00 C ATOM 535 O GLN A 34 -3.455 -7.672 -2.702 1.00 0.00 O ATOM 536 CB GLN A 34 -5.502 -9.826 -3.464 1.00 0.00 C ATOM 537 CG GLN A 34 -5.360 -11.060 -4.341 1.00 0.00 C ATOM 538 CD GLN A 34 -4.872 -10.731 -5.738 1.00 0.00 C ATOM 539 OE1 GLN A 34 -5.352 -11.290 -6.724 1.00 0.00 O ATOM 540 NE2 GLN A 34 -3.909 -9.820 -5.830 1.00 0.00 N ATOM 0 H GLN A 34 -6.091 -10.476 -1.102 1.00 0.00 H new ATOM 0 HA GLN A 34 -3.595 -10.299 -2.587 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -6.518 -9.785 -3.070 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -5.362 -8.936 -4.078 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -4.665 -11.756 -3.872 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -6.323 -11.567 -4.407 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -3.540 -9.381 -4.986 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -3.539 -9.559 -6.744 1.00 0.00 H new ATOM 549 N VAL A 35 -4.677 -7.858 -0.822 1.00 0.00 N ATOM 550 CA VAL A 35 -4.416 -6.488 -0.394 1.00 0.00 C ATOM 551 C VAL A 35 -3.440 -6.455 0.776 1.00 0.00 C ATOM 552 O VAL A 35 -2.712 -5.480 0.963 1.00 0.00 O ATOM 553 CB VAL A 35 -5.709 -5.746 0.027 1.00 0.00 C ATOM 554 CG1 VAL A 35 -5.664 -4.299 -0.435 1.00 0.00 C ATOM 555 CG2 VAL A 35 -6.965 -6.443 -0.499 1.00 0.00 C ATOM 0 H VAL A 35 -5.269 -8.394 -0.188 1.00 0.00 H new ATOM 0 HA VAL A 35 -3.984 -5.981 -1.257 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.760 -5.767 1.116 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.580 -3.791 -0.131 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.806 -3.800 0.015 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.574 -4.266 -1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -7.849 -5.890 -0.181 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.932 -6.479 -1.588 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.011 -7.458 -0.104 1.00 0.00 H new ATOM 565 N GLU A 36 -3.425 -7.529 1.555 1.00 0.00 N ATOM 566 CA GLU A 36 -2.531 -7.627 2.702 1.00 0.00 C ATOM 567 C GLU A 36 -1.196 -8.191 2.260 1.00 0.00 C ATOM 568 O GLU A 36 -0.138 -7.738 2.695 1.00 0.00 O ATOM 569 CB GLU A 36 -3.138 -8.506 3.797 1.00 0.00 C ATOM 570 CG GLU A 36 -2.394 -8.429 5.121 1.00 0.00 C ATOM 571 CD GLU A 36 -1.485 -9.622 5.347 1.00 0.00 C ATOM 572 OE1 GLU A 36 -0.538 -9.806 4.556 1.00 0.00 O ATOM 573 OE2 GLU A 36 -1.723 -10.372 6.318 1.00 0.00 O ATOM 0 H GLU A 36 -4.021 -8.344 1.414 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.385 -6.629 3.114 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -4.175 -8.211 3.955 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.149 -9.541 3.456 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -1.801 -7.515 5.148 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.115 -8.366 5.936 1.00 0.00 H new ATOM 580 N LYS A 37 -1.254 -9.169 1.363 1.00 0.00 N ATOM 581 CA LYS A 37 -0.047 -9.772 0.833 1.00 0.00 C ATOM 582 C LYS A 37 0.637 -8.774 -0.079 1.00 0.00 C ATOM 583 O LYS A 37 1.863 -8.688 -0.117 1.00 0.00 O ATOM 584 CB LYS A 37 -0.367 -11.061 0.074 1.00 0.00 C ATOM 585 CG LYS A 37 0.847 -11.942 -0.169 1.00 0.00 C ATOM 586 CD LYS A 37 0.442 -13.351 -0.574 1.00 0.00 C ATOM 587 CE LYS A 37 0.497 -14.305 0.607 1.00 0.00 C ATOM 588 NZ LYS A 37 1.891 -14.530 1.078 1.00 0.00 N ATOM 0 H LYS A 37 -2.122 -9.556 0.992 1.00 0.00 H new ATOM 0 HA LYS A 37 0.617 -10.033 1.657 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -1.110 -11.628 0.635 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -0.818 -10.806 -0.885 1.00 0.00 H new ATOM 0 HG2 LYS A 37 1.467 -11.502 -0.950 1.00 0.00 H new ATOM 0 HG3 LYS A 37 1.455 -11.983 0.735 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -0.567 -13.337 -0.985 1.00 0.00 H new ATOM 0 HD3 LYS A 37 1.103 -13.708 -1.363 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -0.102 -13.904 1.425 1.00 0.00 H new ATOM 0 HE3 LYS A 37 0.052 -15.259 0.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 1.947 -15.443 1.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 2.536 -14.539 0.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 2.165 -13.766 1.728 1.00 0.00 H new ATOM 602 N GLU A 38 -0.172 -7.992 -0.790 1.00 0.00 N ATOM 603 CA GLU A 38 0.359 -6.974 -1.665 1.00 0.00 C ATOM 604 C GLU A 38 0.937 -5.845 -0.826 1.00 0.00 C ATOM 605 O GLU A 38 2.073 -5.420 -1.034 1.00 0.00 O ATOM 606 CB GLU A 38 -0.743 -6.451 -2.581 1.00 0.00 C ATOM 607 CG GLU A 38 -0.906 -7.253 -3.862 1.00 0.00 C ATOM 608 CD GLU A 38 -1.086 -8.737 -3.605 1.00 0.00 C ATOM 609 OE1 GLU A 38 -0.186 -9.346 -2.989 1.00 0.00 O ATOM 610 OE2 GLU A 38 -2.125 -9.291 -4.021 1.00 0.00 O ATOM 0 H GLU A 38 -1.190 -8.050 -0.772 1.00 0.00 H new ATOM 0 HA GLU A 38 1.149 -7.397 -2.285 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.688 -6.456 -2.037 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -0.528 -5.414 -2.837 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.767 -6.877 -4.414 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.031 -7.101 -4.494 1.00 0.00 H new ATOM 617 N LEU A 39 0.154 -5.374 0.141 1.00 0.00 N ATOM 618 CA LEU A 39 0.592 -4.303 1.028 1.00 0.00 C ATOM 619 C LEU A 39 1.979 -4.598 1.588 1.00 0.00 C ATOM 620 O LEU A 39 2.778 -3.686 1.803 1.00 0.00 O ATOM 621 CB LEU A 39 -0.410 -4.113 2.170 1.00 0.00 C ATOM 622 CG LEU A 39 -1.400 -2.962 1.975 1.00 0.00 C ATOM 623 CD1 LEU A 39 -2.743 -3.295 2.609 1.00 0.00 C ATOM 624 CD2 LEU A 39 -0.836 -1.673 2.557 1.00 0.00 C ATOM 0 H LEU A 39 -0.787 -5.718 0.329 1.00 0.00 H new ATOM 0 HA LEU A 39 0.644 -3.381 0.449 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -0.972 -5.038 2.298 1.00 0.00 H new ATOM 0 HB3 LEU A 39 0.143 -3.945 3.094 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.556 -2.819 0.906 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -3.432 -2.464 2.459 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -3.151 -4.193 2.146 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -2.609 -3.467 3.677 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -1.552 -0.864 2.410 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -0.651 -1.805 3.623 1.00 0.00 H new ATOM 0 HD23 LEU A 39 0.099 -1.426 2.055 1.00 0.00 H new ATOM 636 N LEU A 40 2.267 -5.879 1.812 1.00 0.00 N ATOM 637 CA LEU A 40 3.568 -6.280 2.332 1.00 0.00 C ATOM 638 C LEU A 40 4.677 -5.872 1.367 1.00 0.00 C ATOM 639 O LEU A 40 5.826 -5.684 1.767 1.00 0.00 O ATOM 640 CB LEU A 40 3.606 -7.792 2.567 1.00 0.00 C ATOM 641 CG LEU A 40 4.626 -8.261 3.606 1.00 0.00 C ATOM 642 CD1 LEU A 40 4.132 -9.514 4.311 1.00 0.00 C ATOM 643 CD2 LEU A 40 5.975 -8.512 2.950 1.00 0.00 C ATOM 0 H LEU A 40 1.621 -6.650 1.642 1.00 0.00 H new ATOM 0 HA LEU A 40 3.729 -5.773 3.284 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.615 -8.121 2.879 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.822 -8.286 1.620 1.00 0.00 H new ATOM 0 HG LEU A 40 4.747 -7.475 4.351 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.871 -9.833 5.046 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.188 -9.301 4.813 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.982 -10.308 3.579 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.689 -8.845 3.703 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.870 -9.281 2.184 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.334 -7.590 2.492 1.00 0.00 H new ATOM 655 N ARG A 41 4.320 -5.732 0.094 1.00 0.00 N ATOM 656 CA ARG A 41 5.275 -5.341 -0.934 1.00 0.00 C ATOM 657 C ARG A 41 5.697 -3.886 -0.757 1.00 0.00 C ATOM 658 O ARG A 41 6.886 -3.576 -0.718 1.00 0.00 O ATOM 659 CB ARG A 41 4.669 -5.544 -2.324 1.00 0.00 C ATOM 660 CG ARG A 41 4.310 -6.991 -2.626 1.00 0.00 C ATOM 661 CD ARG A 41 5.552 -7.858 -2.763 1.00 0.00 C ATOM 662 NE ARG A 41 5.455 -9.082 -1.973 1.00 0.00 N ATOM 663 CZ ARG A 41 6.391 -10.029 -1.956 1.00 0.00 C ATOM 664 NH1 ARG A 41 7.493 -9.895 -2.682 1.00 0.00 N ATOM 665 NH2 ARG A 41 6.224 -11.111 -1.209 1.00 0.00 N ATOM 0 H ARG A 41 3.372 -5.885 -0.250 1.00 0.00 H new ATOM 0 HA ARG A 41 6.159 -5.971 -0.835 1.00 0.00 H new ATOM 0 HB2 ARG A 41 3.773 -4.930 -2.414 1.00 0.00 H new ATOM 0 HB3 ARG A 41 5.375 -5.189 -3.075 1.00 0.00 H new ATOM 0 HG2 ARG A 41 3.677 -7.383 -1.830 1.00 0.00 H new ATOM 0 HG3 ARG A 41 3.729 -7.038 -3.547 1.00 0.00 H new ATOM 0 HD2 ARG A 41 5.701 -8.114 -3.812 1.00 0.00 H new ATOM 0 HD3 ARG A 41 6.427 -7.290 -2.446 1.00 0.00 H new ATOM 0 HE ARG A 41 4.622 -9.220 -1.401 1.00 0.00 H new ATOM 0 HH11 ARG A 41 7.627 -9.063 -3.257 1.00 0.00 H new ATOM 0 HH12 ARG A 41 8.207 -10.624 -2.665 1.00 0.00 H new ATOM 0 HH21 ARG A 41 5.379 -11.218 -0.648 1.00 0.00 H new ATOM 0 HH22 ARG A 41 6.940 -11.837 -1.195 1.00 0.00 H new ATOM 679 N VAL A 42 4.713 -2.998 -0.648 1.00 0.00 N ATOM 680 CA VAL A 42 4.985 -1.576 -0.474 1.00 0.00 C ATOM 681 C VAL A 42 5.828 -1.329 0.772 1.00 0.00 C ATOM 682 O VAL A 42 6.589 -0.363 0.838 1.00 0.00 O ATOM 683 CB VAL A 42 3.683 -0.758 -0.368 1.00 0.00 C ATOM 684 CG1 VAL A 42 3.985 0.733 -0.371 1.00 0.00 C ATOM 685 CG2 VAL A 42 2.731 -1.113 -1.500 1.00 0.00 C ATOM 0 H VAL A 42 3.722 -3.238 -0.677 1.00 0.00 H new ATOM 0 HA VAL A 42 5.536 -1.251 -1.357 1.00 0.00 H new ATOM 0 HB VAL A 42 3.199 -1.008 0.576 1.00 0.00 H new ATOM 0 HG11 VAL A 42 3.053 1.293 -0.295 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.624 0.976 0.477 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.494 0.999 -1.297 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.818 -0.524 -1.406 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.206 -0.896 -2.457 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.485 -2.174 -1.450 1.00 0.00 H new ATOM 695 N GLY A 43 5.691 -2.209 1.760 1.00 0.00 N ATOM 696 CA GLY A 43 6.450 -2.068 2.987 1.00 0.00 C ATOM 697 C GLY A 43 7.892 -2.499 2.823 1.00 0.00 C ATOM 698 O GLY A 43 8.801 -1.872 3.366 1.00 0.00 O ATOM 0 H GLY A 43 5.068 -3.016 1.731 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.419 -1.029 3.314 1.00 0.00 H new ATOM 0 HA3 GLY A 43 5.982 -2.663 3.771 1.00 0.00 H new ATOM 702 N GLN A 44 8.101 -3.572 2.067 1.00 0.00 N ATOM 703 CA GLN A 44 9.444 -4.085 1.827 1.00 0.00 C ATOM 704 C GLN A 44 10.162 -3.243 0.779 1.00 0.00 C ATOM 705 O GLN A 44 11.386 -3.105 0.811 1.00 0.00 O ATOM 706 CB GLN A 44 9.383 -5.545 1.373 1.00 0.00 C ATOM 707 CG GLN A 44 9.431 -6.541 2.520 1.00 0.00 C ATOM 708 CD GLN A 44 10.201 -7.798 2.167 1.00 0.00 C ATOM 709 OE1 GLN A 44 9.620 -8.869 1.995 1.00 0.00 O ATOM 710 NE2 GLN A 44 11.519 -7.673 2.059 1.00 0.00 N ATOM 0 H GLN A 44 7.358 -4.102 1.611 1.00 0.00 H new ATOM 0 HA GLN A 44 10.003 -4.028 2.761 1.00 0.00 H new ATOM 0 HB2 GLN A 44 8.466 -5.702 0.805 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.215 -5.742 0.697 1.00 0.00 H new ATOM 0 HG2 GLN A 44 9.891 -6.069 3.388 1.00 0.00 H new ATOM 0 HG3 GLN A 44 8.414 -6.810 2.806 1.00 0.00 H new ATOM 0 HE21 GLN A 44 11.959 -6.765 2.210 1.00 0.00 H new ATOM 0 HE22 GLN A 44 12.091 -8.485 1.825 1.00 0.00 H new ATOM 719 N ILE A 45 9.395 -2.675 -0.145 1.00 0.00 N ATOM 720 CA ILE A 45 9.960 -1.841 -1.198 1.00 0.00 C ATOM 721 C ILE A 45 10.377 -0.483 -0.646 1.00 0.00 C ATOM 722 O ILE A 45 11.347 0.114 -1.109 1.00 0.00 O ATOM 723 CB ILE A 45 8.957 -1.639 -2.355 1.00 0.00 C ATOM 724 CG1 ILE A 45 8.577 -2.988 -2.968 1.00 0.00 C ATOM 725 CG2 ILE A 45 9.536 -0.711 -3.417 1.00 0.00 C ATOM 726 CD1 ILE A 45 7.228 -2.983 -3.652 1.00 0.00 C ATOM 0 H ILE A 45 8.381 -2.777 -0.186 1.00 0.00 H new ATOM 0 HA ILE A 45 10.838 -2.358 -1.584 1.00 0.00 H new ATOM 0 HB ILE A 45 8.057 -1.173 -1.954 1.00 0.00 H new ATOM 0 HG12 ILE A 45 9.340 -3.278 -3.690 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.575 -3.746 -2.185 1.00 0.00 H new ATOM 0 HG21 ILE A 45 8.812 -0.583 -4.222 1.00 0.00 H new ATOM 0 HG22 ILE A 45 9.758 0.259 -2.971 1.00 0.00 H new ATOM 0 HG23 ILE A 45 10.452 -1.144 -3.818 1.00 0.00 H new ATOM 0 HD11 ILE A 45 7.025 -3.972 -4.063 1.00 0.00 H new ATOM 0 HD12 ILE A 45 6.454 -2.725 -2.929 1.00 0.00 H new ATOM 0 HD13 ILE A 45 7.231 -2.249 -4.458 1.00 0.00 H new ATOM 738 N LEU A 46 9.643 -0.005 0.351 1.00 0.00 N ATOM 739 CA LEU A 46 9.944 1.279 0.968 1.00 0.00 C ATOM 740 C LEU A 46 11.128 1.148 1.918 1.00 0.00 C ATOM 741 O LEU A 46 12.032 1.983 1.923 1.00 0.00 O ATOM 742 CB LEU A 46 8.725 1.803 1.726 1.00 0.00 C ATOM 743 CG LEU A 46 7.865 2.804 0.954 1.00 0.00 C ATOM 744 CD1 LEU A 46 8.631 4.097 0.720 1.00 0.00 C ATOM 745 CD2 LEU A 46 7.400 2.205 -0.367 1.00 0.00 C ATOM 0 H LEU A 46 8.837 -0.487 0.748 1.00 0.00 H new ATOM 0 HA LEU A 46 10.201 1.987 0.180 1.00 0.00 H new ATOM 0 HB2 LEU A 46 8.102 0.956 2.011 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.064 2.274 2.648 1.00 0.00 H new ATOM 0 HG LEU A 46 6.983 3.033 1.552 1.00 0.00 H new ATOM 0 HD11 LEU A 46 8.003 4.797 0.169 1.00 0.00 H new ATOM 0 HD12 LEU A 46 8.908 4.535 1.679 1.00 0.00 H new ATOM 0 HD13 LEU A 46 9.532 3.887 0.144 1.00 0.00 H new ATOM 0 HD21 LEU A 46 6.789 2.933 -0.902 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.267 1.944 -0.973 1.00 0.00 H new ATOM 0 HD23 LEU A 46 6.810 1.309 -0.173 1.00 0.00 H new ATOM 757 N LYS A 47 11.112 0.089 2.718 1.00 0.00 N ATOM 758 CA LYS A 47 12.182 -0.163 3.673 1.00 0.00 C ATOM 759 C LYS A 47 13.450 -0.620 2.959 1.00 0.00 C ATOM 760 O LYS A 47 14.549 -0.517 3.505 1.00 0.00 O ATOM 761 CB LYS A 47 11.746 -1.219 4.690 1.00 0.00 C ATOM 762 CG LYS A 47 12.774 -1.473 5.780 1.00 0.00 C ATOM 763 CD LYS A 47 13.650 -2.672 5.451 1.00 0.00 C ATOM 764 CE LYS A 47 12.869 -3.973 5.536 1.00 0.00 C ATOM 765 NZ LYS A 47 13.739 -5.119 5.917 1.00 0.00 N ATOM 0 H LYS A 47 10.369 -0.609 2.724 1.00 0.00 H new ATOM 0 HA LYS A 47 12.397 0.769 4.196 1.00 0.00 H new ATOM 0 HB2 LYS A 47 10.810 -0.903 5.151 1.00 0.00 H new ATOM 0 HB3 LYS A 47 11.544 -2.154 4.167 1.00 0.00 H new ATOM 0 HG2 LYS A 47 13.398 -0.588 5.906 1.00 0.00 H new ATOM 0 HG3 LYS A 47 12.265 -1.642 6.729 1.00 0.00 H new ATOM 0 HD2 LYS A 47 14.062 -2.559 4.448 1.00 0.00 H new ATOM 0 HD3 LYS A 47 14.494 -2.707 6.140 1.00 0.00 H new ATOM 0 HE2 LYS A 47 12.067 -3.868 6.266 1.00 0.00 H new ATOM 0 HE3 LYS A 47 12.399 -4.178 4.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 13.169 -5.987 5.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 14.490 -5.236 5.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 14.167 -4.936 6.847 1.00 0.00 H new ATOM 779 N GLU A 48 13.294 -1.125 1.738 1.00 0.00 N ATOM 780 CA GLU A 48 14.431 -1.594 0.958 1.00 0.00 C ATOM 781 C GLU A 48 15.446 -0.471 0.748 1.00 0.00 C ATOM 782 O GLU A 48 15.071 0.670 0.478 1.00 0.00 O ATOM 783 CB GLU A 48 13.963 -2.138 -0.393 1.00 0.00 C ATOM 784 CG GLU A 48 13.781 -3.647 -0.412 1.00 0.00 C ATOM 785 CD GLU A 48 15.037 -4.380 -0.841 1.00 0.00 C ATOM 786 OE1 GLU A 48 15.471 -4.186 -1.996 1.00 0.00 O ATOM 787 OE2 GLU A 48 15.584 -5.148 -0.023 1.00 0.00 O ATOM 0 H GLU A 48 12.393 -1.219 1.270 1.00 0.00 H new ATOM 0 HA GLU A 48 14.915 -2.397 1.514 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.019 -1.663 -0.659 1.00 0.00 H new ATOM 0 HB3 GLU A 48 14.687 -1.858 -1.158 1.00 0.00 H new ATOM 0 HG2 GLU A 48 13.488 -3.987 0.581 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.966 -3.903 -1.089 1.00 0.00 H new ATOM 794 N PRO A 49 16.751 -0.777 0.869 1.00 0.00 N ATOM 795 CA PRO A 49 17.813 0.219 0.690 1.00 0.00 C ATOM 796 C PRO A 49 17.959 0.653 -0.765 1.00 0.00 C ATOM 797 O PRO A 49 18.029 1.846 -1.062 1.00 0.00 O ATOM 798 CB PRO A 49 19.072 -0.513 1.159 1.00 0.00 C ATOM 799 CG PRO A 49 18.770 -1.957 0.954 1.00 0.00 C ATOM 800 CD PRO A 49 17.293 -2.112 1.189 1.00 0.00 C ATOM 0 HA PRO A 49 17.608 1.136 1.242 1.00 0.00 H new ATOM 0 HB2 PRO A 49 19.946 -0.206 0.584 1.00 0.00 H new ATOM 0 HB3 PRO A 49 19.288 -0.299 2.206 1.00 0.00 H new ATOM 0 HG2 PRO A 49 19.039 -2.272 -0.054 1.00 0.00 H new ATOM 0 HG3 PRO A 49 19.342 -2.577 1.645 1.00 0.00 H new ATOM 0 HD2 PRO A 49 16.864 -2.883 0.550 1.00 0.00 H new ATOM 0 HD3 PRO A 49 17.078 -2.396 2.219 1.00 0.00 H new ATOM 808 N LYS A 50 18.002 -0.321 -1.669 1.00 0.00 N ATOM 809 CA LYS A 50 18.138 -0.036 -3.092 1.00 0.00 C ATOM 810 C LYS A 50 16.947 0.775 -3.595 1.00 0.00 C ATOM 811 O LYS A 50 17.078 1.587 -4.510 1.00 0.00 O ATOM 812 CB LYS A 50 18.256 -1.337 -3.886 1.00 0.00 C ATOM 813 CG LYS A 50 19.124 -1.216 -5.127 1.00 0.00 C ATOM 814 CD LYS A 50 20.598 -1.119 -4.769 1.00 0.00 C ATOM 815 CE LYS A 50 21.459 -0.909 -6.004 1.00 0.00 C ATOM 816 NZ LYS A 50 21.789 -2.196 -6.676 1.00 0.00 N ATOM 0 H LYS A 50 17.945 -1.314 -1.441 1.00 0.00 H new ATOM 0 HA LYS A 50 19.045 0.551 -3.237 1.00 0.00 H new ATOM 0 HB2 LYS A 50 18.668 -2.112 -3.239 1.00 0.00 H new ATOM 0 HB3 LYS A 50 17.259 -1.665 -4.181 1.00 0.00 H new ATOM 0 HG2 LYS A 50 18.961 -2.080 -5.772 1.00 0.00 H new ATOM 0 HG3 LYS A 50 18.828 -0.334 -5.695 1.00 0.00 H new ATOM 0 HD2 LYS A 50 20.751 -0.294 -4.073 1.00 0.00 H new ATOM 0 HD3 LYS A 50 20.910 -2.030 -4.257 1.00 0.00 H new ATOM 0 HE2 LYS A 50 20.937 -0.257 -6.704 1.00 0.00 H new ATOM 0 HE3 LYS A 50 22.381 -0.400 -5.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 22.377 -2.010 -7.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 22.310 -2.808 -6.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 20.911 -2.670 -6.968 1.00 0.00 H new ATOM 830 N MET A 51 15.788 0.548 -2.987 1.00 0.00 N ATOM 831 CA MET A 51 14.572 1.257 -3.368 1.00 0.00 C ATOM 832 C MET A 51 14.532 2.642 -2.734 1.00 0.00 C ATOM 833 O MET A 51 14.012 3.591 -3.322 1.00 0.00 O ATOM 834 CB MET A 51 13.339 0.458 -2.943 1.00 0.00 C ATOM 835 CG MET A 51 13.173 -0.853 -3.693 1.00 0.00 C ATOM 836 SD MET A 51 13.048 -0.623 -5.477 1.00 0.00 S ATOM 837 CE MET A 51 11.469 0.213 -5.601 1.00 0.00 C ATOM 0 H MET A 51 15.665 -0.122 -2.228 1.00 0.00 H new ATOM 0 HA MET A 51 14.570 1.370 -4.452 1.00 0.00 H new ATOM 0 HB2 MET A 51 13.402 0.250 -1.875 1.00 0.00 H new ATOM 0 HB3 MET A 51 12.450 1.070 -3.097 1.00 0.00 H new ATOM 0 HG2 MET A 51 14.020 -1.502 -3.473 1.00 0.00 H new ATOM 0 HG3 MET A 51 12.279 -1.362 -3.333 1.00 0.00 H new ATOM 0 HE1 MET A 51 11.498 0.924 -6.426 1.00 0.00 H new ATOM 0 HE2 MET A 51 10.682 -0.520 -5.781 1.00 0.00 H new ATOM 0 HE3 MET A 51 11.264 0.744 -4.671 1.00 0.00 H new ATOM 847 N ALA A 52 15.081 2.750 -1.528 1.00 0.00 N ATOM 848 CA ALA A 52 15.107 4.019 -0.807 1.00 0.00 C ATOM 849 C ALA A 52 15.693 5.133 -1.669 1.00 0.00 C ATOM 850 O ALA A 52 15.237 6.274 -1.619 1.00 0.00 O ATOM 851 CB ALA A 52 15.902 3.871 0.483 1.00 0.00 C ATOM 0 H ALA A 52 15.514 1.973 -1.029 1.00 0.00 H new ATOM 0 HA ALA A 52 14.080 4.292 -0.562 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.915 4.823 1.013 1.00 0.00 H new ATOM 0 HB2 ALA A 52 15.437 3.112 1.112 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.924 3.572 0.249 1.00 0.00 H new ATOM 857 N ALA A 53 16.704 4.791 -2.461 1.00 0.00 N ATOM 858 CA ALA A 53 17.349 5.763 -3.335 1.00 0.00 C ATOM 859 C ALA A 53 16.401 6.238 -4.434 1.00 0.00 C ATOM 860 O ALA A 53 16.664 7.238 -5.100 1.00 0.00 O ATOM 861 CB ALA A 53 18.608 5.165 -3.946 1.00 0.00 C ATOM 0 H ALA A 53 17.093 3.850 -2.515 1.00 0.00 H new ATOM 0 HA ALA A 53 17.622 6.629 -2.732 1.00 0.00 H new ATOM 0 HB1 ALA A 53 19.081 5.900 -4.597 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.300 4.885 -3.152 1.00 0.00 H new ATOM 0 HB3 ALA A 53 18.346 4.281 -4.527 1.00 0.00 H new ATOM 867 N SER A 54 15.298 5.516 -4.623 1.00 0.00 N ATOM 868 CA SER A 54 14.320 5.870 -5.645 1.00 0.00 C ATOM 869 C SER A 54 13.022 6.368 -5.016 1.00 0.00 C ATOM 870 O SER A 54 12.512 7.427 -5.382 1.00 0.00 O ATOM 871 CB SER A 54 14.032 4.664 -6.543 1.00 0.00 C ATOM 872 OG SER A 54 15.214 4.206 -7.176 1.00 0.00 O ATOM 0 H SER A 54 15.061 4.684 -4.082 1.00 0.00 H new ATOM 0 HA SER A 54 14.741 6.675 -6.247 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.599 3.859 -5.949 1.00 0.00 H new ATOM 0 HB3 SER A 54 13.294 4.936 -7.297 1.00 0.00 H new ATOM 0 HG SER A 54 15.004 3.434 -7.742 1.00 0.00 H new ATOM 878 N LEU A 55 12.489 5.598 -4.074 1.00 0.00 N ATOM 879 CA LEU A 55 11.248 5.963 -3.402 1.00 0.00 C ATOM 880 C LEU A 55 11.399 7.281 -2.650 1.00 0.00 C ATOM 881 O LEU A 55 10.578 8.187 -2.795 1.00 0.00 O ATOM 882 CB LEU A 55 10.821 4.855 -2.438 1.00 0.00 C ATOM 883 CG LEU A 55 10.128 3.661 -3.095 1.00 0.00 C ATOM 884 CD1 LEU A 55 10.381 2.390 -2.297 1.00 0.00 C ATOM 885 CD2 LEU A 55 8.636 3.919 -3.232 1.00 0.00 C ATOM 0 H LEU A 55 12.897 4.718 -3.759 1.00 0.00 H new ATOM 0 HA LEU A 55 10.477 6.090 -4.162 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.702 4.497 -1.906 1.00 0.00 H new ATOM 0 HB3 LEU A 55 10.150 5.281 -1.693 1.00 0.00 H new ATOM 0 HG LEU A 55 10.546 3.528 -4.093 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.880 1.551 -2.780 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.453 2.196 -2.252 1.00 0.00 H new ATOM 0 HD13 LEU A 55 9.992 2.512 -1.286 1.00 0.00 H new ATOM 0 HD21 LEU A 55 8.160 3.058 -3.702 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.202 4.080 -2.245 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.475 4.804 -3.848 1.00 0.00 H new ATOM 897 N LEU A 56 12.453 7.383 -1.848 1.00 0.00 N ATOM 898 CA LEU A 56 12.709 8.594 -1.075 1.00 0.00 C ATOM 899 C LEU A 56 13.416 9.655 -1.921 1.00 0.00 C ATOM 900 O LEU A 56 13.711 10.746 -1.437 1.00 0.00 O ATOM 901 CB LEU A 56 13.554 8.265 0.158 1.00 0.00 C ATOM 902 CG LEU A 56 13.949 9.471 1.015 1.00 0.00 C ATOM 903 CD1 LEU A 56 13.902 9.114 2.493 1.00 0.00 C ATOM 904 CD2 LEU A 56 15.335 9.971 0.626 1.00 0.00 C ATOM 0 H LEU A 56 13.143 6.644 -1.716 1.00 0.00 H new ATOM 0 HA LEU A 56 11.747 8.997 -0.757 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.001 7.562 0.781 1.00 0.00 H new ATOM 0 HB3 LEU A 56 14.462 7.757 -0.168 1.00 0.00 H new ATOM 0 HG LEU A 56 13.233 10.272 0.834 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.186 9.983 3.086 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.891 8.806 2.761 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.595 8.297 2.692 1.00 0.00 H new ATOM 0 HD21 LEU A 56 15.600 10.828 1.245 1.00 0.00 H new ATOM 0 HD22 LEU A 56 16.065 9.175 0.777 1.00 0.00 H new ATOM 0 HD23 LEU A 56 15.334 10.268 -0.423 1.00 0.00 H new ATOM 916 N ASN A 57 13.687 9.331 -3.184 1.00 0.00 N ATOM 917 CA ASN A 57 14.358 10.262 -4.082 1.00 0.00 C ATOM 918 C ASN A 57 13.472 11.468 -4.382 1.00 0.00 C ATOM 919 O ASN A 57 12.348 11.315 -4.861 1.00 0.00 O ATOM 920 CB ASN A 57 14.731 9.558 -5.387 1.00 0.00 C ATOM 921 CG ASN A 57 16.048 10.048 -5.955 1.00 0.00 C ATOM 922 OD1 ASN A 57 16.799 10.758 -5.286 1.00 0.00 O ATOM 923 ND2 ASN A 57 16.334 9.673 -7.195 1.00 0.00 N ATOM 0 H ASN A 57 13.452 8.432 -3.606 1.00 0.00 H new ATOM 0 HA ASN A 57 15.264 10.614 -3.589 1.00 0.00 H new ATOM 0 HB2 ASN A 57 14.792 8.484 -5.212 1.00 0.00 H new ATOM 0 HB3 ASN A 57 13.941 9.717 -6.121 1.00 0.00 H new ATOM 0 HD21 ASN A 57 17.206 9.974 -7.631 1.00 0.00 H new ATOM 0 HD22 ASN A 57 15.682 9.084 -7.713 1.00 0.00 H new ATOM 930 N PRO A 58 13.963 12.692 -4.115 1.00 0.00 N ATOM 931 CA PRO A 58 13.199 13.918 -4.375 1.00 0.00 C ATOM 932 C PRO A 58 12.777 14.032 -5.838 1.00 0.00 C ATOM 933 O PRO A 58 11.882 14.806 -6.179 1.00 0.00 O ATOM 934 CB PRO A 58 14.179 15.041 -4.014 1.00 0.00 C ATOM 935 CG PRO A 58 15.172 14.409 -3.102 1.00 0.00 C ATOM 936 CD PRO A 58 15.294 12.982 -3.551 1.00 0.00 C ATOM 0 HA PRO A 58 12.272 13.948 -3.802 1.00 0.00 H new ATOM 0 HB2 PRO A 58 14.662 15.445 -4.904 1.00 0.00 H new ATOM 0 HB3 PRO A 58 13.667 15.870 -3.526 1.00 0.00 H new ATOM 0 HG2 PRO A 58 16.133 14.919 -3.158 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.841 14.465 -2.065 1.00 0.00 H new ATOM 0 HD2 PRO A 58 16.082 12.860 -4.294 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.533 12.318 -2.721 1.00 0.00 H new ATOM 944 N TYR A 59 13.432 13.257 -6.696 1.00 0.00 N ATOM 945 CA TYR A 59 13.139 13.265 -8.125 1.00 0.00 C ATOM 946 C TYR A 59 11.946 12.370 -8.460 1.00 0.00 C ATOM 947 O TYR A 59 11.579 12.230 -9.627 1.00 0.00 O ATOM 948 CB TYR A 59 14.370 12.804 -8.905 1.00 0.00 C ATOM 949 CG TYR A 59 15.631 13.551 -8.532 1.00 0.00 C ATOM 950 CD1 TYR A 59 16.344 13.218 -7.385 1.00 0.00 C ATOM 951 CD2 TYR A 59 16.104 14.591 -9.320 1.00 0.00 C ATOM 952 CE1 TYR A 59 17.492 13.902 -7.038 1.00 0.00 C ATOM 953 CE2 TYR A 59 17.255 15.279 -8.979 1.00 0.00 C ATOM 954 CZ TYR A 59 17.945 14.930 -7.837 1.00 0.00 C ATOM 955 OH TYR A 59 19.088 15.612 -7.494 1.00 0.00 O ATOM 0 H TYR A 59 14.174 12.612 -6.424 1.00 0.00 H new ATOM 0 HA TYR A 59 12.881 14.285 -8.411 1.00 0.00 H new ATOM 0 HB2 TYR A 59 14.523 11.739 -8.732 1.00 0.00 H new ATOM 0 HB3 TYR A 59 14.184 12.930 -9.972 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.994 12.412 -6.756 1.00 0.00 H new ATOM 0 HD2 TYR A 59 15.565 14.868 -10.214 1.00 0.00 H new ATOM 0 HE1 TYR A 59 18.034 13.632 -6.143 1.00 0.00 H new ATOM 0 HE2 TYR A 59 17.611 16.085 -9.604 1.00 0.00 H new ATOM 0 HH TYR A 59 19.269 16.305 -8.163 1.00 0.00 H new ATOM 965 N VAL A 60 11.342 11.765 -7.440 1.00 0.00 N ATOM 966 CA VAL A 60 10.195 10.887 -7.645 1.00 0.00 C ATOM 967 C VAL A 60 9.075 11.607 -8.391 1.00 0.00 C ATOM 968 O VAL A 60 8.290 10.982 -9.106 1.00 0.00 O ATOM 969 CB VAL A 60 9.644 10.356 -6.308 1.00 0.00 C ATOM 970 CG1 VAL A 60 10.622 9.378 -5.679 1.00 0.00 C ATOM 971 CG2 VAL A 60 9.340 11.506 -5.361 1.00 0.00 C ATOM 0 H VAL A 60 11.627 11.867 -6.466 1.00 0.00 H new ATOM 0 HA VAL A 60 10.547 10.047 -8.244 1.00 0.00 H new ATOM 0 HB VAL A 60 8.713 9.825 -6.504 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.216 9.013 -4.735 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.781 8.537 -6.354 1.00 0.00 H new ATOM 0 HG13 VAL A 60 11.572 9.881 -5.495 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.952 11.111 -4.422 1.00 0.00 H new ATOM 0 HG22 VAL A 60 10.253 12.069 -5.168 1.00 0.00 H new ATOM 0 HG23 VAL A 60 8.597 12.163 -5.813 1.00 0.00 H new ATOM 981 N LYS A 61 9.007 12.924 -8.221 1.00 0.00 N ATOM 982 CA LYS A 61 7.984 13.728 -8.880 1.00 0.00 C ATOM 983 C LYS A 61 6.588 13.320 -8.417 1.00 0.00 C ATOM 984 O LYS A 61 6.394 12.228 -7.886 1.00 0.00 O ATOM 985 CB LYS A 61 8.094 13.587 -10.400 1.00 0.00 C ATOM 986 CG LYS A 61 7.955 14.904 -11.145 1.00 0.00 C ATOM 987 CD LYS A 61 9.312 15.530 -11.429 1.00 0.00 C ATOM 988 CE LYS A 61 9.365 16.136 -12.823 1.00 0.00 C ATOM 989 NZ LYS A 61 9.843 15.155 -13.836 1.00 0.00 N ATOM 0 H LYS A 61 9.648 13.457 -7.633 1.00 0.00 H new ATOM 0 HA LYS A 61 8.146 14.771 -8.607 1.00 0.00 H new ATOM 0 HB2 LYS A 61 9.057 13.140 -10.646 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.324 12.899 -10.749 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.426 14.738 -12.084 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.351 15.594 -10.556 1.00 0.00 H new ATOM 0 HD2 LYS A 61 9.520 16.301 -10.688 1.00 0.00 H new ATOM 0 HD3 LYS A 61 10.091 14.774 -11.330 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.373 16.492 -13.102 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.025 17.003 -12.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 10.171 15.662 -14.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 10.628 14.601 -13.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 9.064 14.516 -14.095 1.00 0.00 H new ATOM 1003 N ARG A 62 5.620 14.206 -8.625 1.00 0.00 N ATOM 1004 CA ARG A 62 4.241 13.940 -8.230 1.00 0.00 C ATOM 1005 C ARG A 62 3.425 13.431 -9.415 1.00 0.00 C ATOM 1006 O ARG A 62 2.258 13.785 -9.577 1.00 0.00 O ATOM 1007 CB ARG A 62 3.598 15.204 -7.659 1.00 0.00 C ATOM 1008 CG ARG A 62 2.625 14.932 -6.523 1.00 0.00 C ATOM 1009 CD ARG A 62 1.298 14.401 -7.042 1.00 0.00 C ATOM 1010 NE ARG A 62 0.202 14.664 -6.112 1.00 0.00 N ATOM 1011 CZ ARG A 62 -0.390 15.849 -5.980 1.00 0.00 C ATOM 1012 NH1 ARG A 62 0.003 16.880 -6.717 1.00 0.00 N ATOM 1013 NH2 ARG A 62 -1.380 16.002 -5.111 1.00 0.00 N ATOM 0 H ARG A 62 5.765 15.115 -9.065 1.00 0.00 H new ATOM 0 HA ARG A 62 4.252 13.168 -7.460 1.00 0.00 H new ATOM 0 HB2 ARG A 62 4.383 15.871 -7.302 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.073 15.727 -8.458 1.00 0.00 H new ATOM 0 HG2 ARG A 62 3.062 14.210 -5.833 1.00 0.00 H new ATOM 0 HG3 ARG A 62 2.456 15.850 -5.960 1.00 0.00 H new ATOM 0 HD2 ARG A 62 1.075 14.861 -8.005 1.00 0.00 H new ATOM 0 HD3 ARG A 62 1.379 13.328 -7.213 1.00 0.00 H new ATOM 0 HE ARG A 62 -0.129 13.895 -5.530 1.00 0.00 H new ATOM 0 HH11 ARG A 62 0.762 16.767 -7.389 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -0.454 17.786 -6.612 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -1.688 15.212 -4.544 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -1.834 16.910 -5.010 1.00 0.00 H new ATOM 1027 N SER A 63 4.049 12.596 -10.240 1.00 0.00 N ATOM 1028 CA SER A 63 3.384 12.037 -11.411 1.00 0.00 C ATOM 1029 C SER A 63 4.228 10.932 -12.037 1.00 0.00 C ATOM 1030 O SER A 63 3.710 9.886 -12.426 1.00 0.00 O ATOM 1031 CB SER A 63 3.111 13.133 -12.442 1.00 0.00 C ATOM 1032 OG SER A 63 2.562 12.591 -13.631 1.00 0.00 O ATOM 0 H SER A 63 5.015 12.292 -10.119 1.00 0.00 H new ATOM 0 HA SER A 63 2.435 11.608 -11.089 1.00 0.00 H new ATOM 0 HB2 SER A 63 2.424 13.868 -12.023 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.038 13.659 -12.672 1.00 0.00 H new ATOM 0 HG SER A 63 2.395 13.313 -14.273 1.00 0.00 H new ATOM 1038 N VAL A 64 5.532 11.172 -12.128 1.00 0.00 N ATOM 1039 CA VAL A 64 6.451 10.198 -12.705 1.00 0.00 C ATOM 1040 C VAL A 64 6.416 8.888 -11.928 1.00 0.00 C ATOM 1041 O VAL A 64 6.384 7.807 -12.515 1.00 0.00 O ATOM 1042 CB VAL A 64 7.896 10.734 -12.727 1.00 0.00 C ATOM 1043 CG1 VAL A 64 8.817 9.765 -13.451 1.00 0.00 C ATOM 1044 CG2 VAL A 64 7.946 12.111 -13.372 1.00 0.00 C ATOM 0 H VAL A 64 5.976 12.033 -11.809 1.00 0.00 H new ATOM 0 HA VAL A 64 6.124 10.019 -13.729 1.00 0.00 H new ATOM 0 HB VAL A 64 8.243 10.827 -11.698 1.00 0.00 H new ATOM 0 HG11 VAL A 64 9.832 10.162 -13.455 1.00 0.00 H new ATOM 0 HG12 VAL A 64 8.806 8.802 -12.940 1.00 0.00 H new ATOM 0 HG13 VAL A 64 8.474 9.635 -14.477 1.00 0.00 H new ATOM 0 HG21 VAL A 64 8.974 12.473 -13.378 1.00 0.00 H new ATOM 0 HG22 VAL A 64 7.578 12.047 -14.396 1.00 0.00 H new ATOM 0 HG23 VAL A 64 7.322 12.801 -12.805 1.00 0.00 H new ATOM 1054 N LYS A 65 6.420 8.991 -10.602 1.00 0.00 N ATOM 1055 CA LYS A 65 6.387 7.811 -9.745 1.00 0.00 C ATOM 1056 C LYS A 65 5.134 6.982 -10.011 1.00 0.00 C ATOM 1057 O LYS A 65 5.138 5.762 -9.847 1.00 0.00 O ATOM 1058 CB LYS A 65 6.436 8.224 -8.272 1.00 0.00 C ATOM 1059 CG LYS A 65 6.561 7.050 -7.316 1.00 0.00 C ATOM 1060 CD LYS A 65 7.928 6.392 -7.417 1.00 0.00 C ATOM 1061 CE LYS A 65 7.923 4.999 -6.809 1.00 0.00 C ATOM 1062 NZ LYS A 65 7.229 4.013 -7.684 1.00 0.00 N ATOM 0 H LYS A 65 6.446 9.878 -10.099 1.00 0.00 H new ATOM 0 HA LYS A 65 7.261 7.201 -9.974 1.00 0.00 H new ATOM 0 HB2 LYS A 65 7.280 8.897 -8.120 1.00 0.00 H new ATOM 0 HB3 LYS A 65 5.533 8.785 -8.030 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.395 7.392 -6.294 1.00 0.00 H new ATOM 0 HG3 LYS A 65 5.786 6.316 -7.536 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.228 6.332 -8.463 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.668 7.009 -6.908 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.949 4.674 -6.638 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.432 5.029 -5.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 7.648 3.071 -7.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.219 3.982 -7.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.336 4.296 -8.679 1.00 0.00 H new ATOM 1076 N VAL A 66 4.063 7.653 -10.425 1.00 0.00 N ATOM 1077 CA VAL A 66 2.804 6.979 -10.716 1.00 0.00 C ATOM 1078 C VAL A 66 2.965 5.987 -11.862 1.00 0.00 C ATOM 1079 O VAL A 66 2.436 4.876 -11.813 1.00 0.00 O ATOM 1080 CB VAL A 66 1.696 7.987 -11.075 1.00 0.00 C ATOM 1081 CG1 VAL A 66 0.349 7.288 -11.170 1.00 0.00 C ATOM 1082 CG2 VAL A 66 1.649 9.115 -10.056 1.00 0.00 C ATOM 0 H VAL A 66 4.043 8.663 -10.566 1.00 0.00 H new ATOM 0 HA VAL A 66 2.516 6.442 -9.812 1.00 0.00 H new ATOM 0 HB VAL A 66 1.925 8.419 -12.049 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.421 8.016 -11.424 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.391 6.520 -11.942 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.110 6.827 -10.212 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.860 9.817 -10.326 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.446 8.704 -9.067 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.608 9.634 -10.043 1.00 0.00 H new ATOM 1092 N LYS A 67 3.698 6.394 -12.893 1.00 0.00 N ATOM 1093 CA LYS A 67 3.927 5.537 -14.050 1.00 0.00 C ATOM 1094 C LYS A 67 4.744 4.309 -13.661 1.00 0.00 C ATOM 1095 O LYS A 67 4.471 3.199 -14.118 1.00 0.00 O ATOM 1096 CB LYS A 67 4.646 6.314 -15.155 1.00 0.00 C ATOM 1097 CG LYS A 67 3.704 7.017 -16.116 1.00 0.00 C ATOM 1098 CD LYS A 67 4.293 8.326 -16.617 1.00 0.00 C ATOM 1099 CE LYS A 67 3.265 9.143 -17.385 1.00 0.00 C ATOM 1100 NZ LYS A 67 2.223 9.711 -16.485 1.00 0.00 N ATOM 0 H LYS A 67 4.143 7.310 -12.951 1.00 0.00 H new ATOM 0 HA LYS A 67 2.958 5.205 -14.423 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.304 7.053 -14.698 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.279 5.628 -15.717 1.00 0.00 H new ATOM 0 HG2 LYS A 67 3.493 6.364 -16.963 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.754 7.211 -15.619 1.00 0.00 H new ATOM 0 HD2 LYS A 67 4.663 8.907 -15.772 1.00 0.00 H new ATOM 0 HD3 LYS A 67 5.148 8.119 -17.260 1.00 0.00 H new ATOM 0 HE2 LYS A 67 3.767 9.952 -17.915 1.00 0.00 H new ATOM 0 HE3 LYS A 67 2.791 8.514 -18.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 1.676 10.431 -16.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 1.586 8.952 -16.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.679 10.147 -15.658 1.00 0.00 H new ATOM 1114 N SER A 68 5.744 4.516 -12.811 1.00 0.00 N ATOM 1115 CA SER A 68 6.597 3.425 -12.356 1.00 0.00 C ATOM 1116 C SER A 68 5.790 2.397 -11.571 1.00 0.00 C ATOM 1117 O SER A 68 6.129 1.214 -11.547 1.00 0.00 O ATOM 1118 CB SER A 68 7.736 3.967 -11.490 1.00 0.00 C ATOM 1119 OG SER A 68 7.250 4.438 -10.245 1.00 0.00 O ATOM 0 H SER A 68 5.983 5.429 -12.424 1.00 0.00 H new ATOM 0 HA SER A 68 7.020 2.936 -13.234 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.475 3.183 -11.323 1.00 0.00 H new ATOM 0 HB3 SER A 68 8.243 4.776 -12.016 1.00 0.00 H new ATOM 0 HG SER A 68 6.402 4.909 -10.382 1.00 0.00 H new ATOM 1125 N LEU A 69 4.719 2.856 -10.929 1.00 0.00 N ATOM 1126 CA LEU A 69 3.863 1.975 -10.143 1.00 0.00 C ATOM 1127 C LEU A 69 3.188 0.935 -11.032 1.00 0.00 C ATOM 1128 O LEU A 69 3.065 -0.230 -10.655 1.00 0.00 O ATOM 1129 CB LEU A 69 2.805 2.791 -9.398 1.00 0.00 C ATOM 1130 CG LEU A 69 3.341 3.667 -8.264 1.00 0.00 C ATOM 1131 CD1 LEU A 69 2.352 4.773 -7.932 1.00 0.00 C ATOM 1132 CD2 LEU A 69 3.634 2.823 -7.034 1.00 0.00 C ATOM 0 H LEU A 69 4.424 3.832 -10.938 1.00 0.00 H new ATOM 0 HA LEU A 69 4.488 1.454 -9.418 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.288 3.428 -10.116 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.063 2.106 -8.988 1.00 0.00 H new ATOM 0 HG LEU A 69 4.272 4.128 -8.594 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.750 5.386 -7.123 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.192 5.394 -8.813 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.405 4.333 -7.621 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.014 3.462 -6.237 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.718 2.334 -6.702 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.380 2.067 -7.281 1.00 0.00 H new ATOM 1144 N SER A 70 2.754 1.362 -12.213 1.00 0.00 N ATOM 1145 CA SER A 70 2.093 0.465 -13.156 1.00 0.00 C ATOM 1146 C SER A 70 2.986 -0.724 -13.490 1.00 0.00 C ATOM 1147 O SER A 70 2.520 -1.861 -13.561 1.00 0.00 O ATOM 1148 CB SER A 70 1.722 1.217 -14.435 1.00 0.00 C ATOM 1149 OG SER A 70 1.044 0.368 -15.347 1.00 0.00 O ATOM 0 H SER A 70 2.848 2.323 -12.541 1.00 0.00 H new ATOM 0 HA SER A 70 1.182 0.092 -12.688 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.090 2.070 -14.189 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.624 1.613 -14.903 1.00 0.00 H new ATOM 0 HG SER A 70 0.816 0.872 -16.156 1.00 0.00 H new ATOM 1155 N ASP A 71 4.274 -0.457 -13.687 1.00 0.00 N ATOM 1156 CA ASP A 71 5.229 -1.513 -14.004 1.00 0.00 C ATOM 1157 C ASP A 71 5.775 -2.158 -12.732 1.00 0.00 C ATOM 1158 O ASP A 71 6.656 -3.016 -12.789 1.00 0.00 O ATOM 1159 CB ASP A 71 6.379 -0.957 -14.846 1.00 0.00 C ATOM 1160 CG ASP A 71 7.123 -2.043 -15.597 1.00 0.00 C ATOM 1161 OD1 ASP A 71 6.472 -2.796 -16.351 1.00 0.00 O ATOM 1162 OD2 ASP A 71 8.357 -2.142 -15.430 1.00 0.00 O ATOM 0 H ASP A 71 4.679 0.478 -13.633 1.00 0.00 H new ATOM 0 HA ASP A 71 4.706 -2.278 -14.579 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.986 -0.231 -15.558 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.075 -0.424 -14.198 1.00 0.00 H new ATOM 1167 N MET A 72 5.228 -1.758 -11.588 1.00 0.00 N ATOM 1168 CA MET A 72 5.638 -2.310 -10.306 1.00 0.00 C ATOM 1169 C MET A 72 4.503 -3.147 -9.742 1.00 0.00 C ATOM 1170 O MET A 72 4.723 -4.145 -9.056 1.00 0.00 O ATOM 1171 CB MET A 72 6.008 -1.192 -9.331 1.00 0.00 C ATOM 1172 CG MET A 72 6.441 -1.696 -7.963 1.00 0.00 C ATOM 1173 SD MET A 72 6.163 -0.485 -6.656 1.00 0.00 S ATOM 1174 CE MET A 72 4.407 -0.184 -6.841 1.00 0.00 C ATOM 0 H MET A 72 4.496 -1.050 -11.525 1.00 0.00 H new ATOM 0 HA MET A 72 6.519 -2.936 -10.449 1.00 0.00 H new ATOM 0 HB2 MET A 72 6.814 -0.598 -9.762 1.00 0.00 H new ATOM 0 HB3 MET A 72 5.152 -0.528 -9.210 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.896 -2.610 -7.728 1.00 0.00 H new ATOM 0 HG3 MET A 72 7.499 -1.955 -7.994 1.00 0.00 H new ATOM 0 HE1 MET A 72 3.989 0.129 -5.884 1.00 0.00 H new ATOM 0 HE2 MET A 72 4.248 0.601 -7.580 1.00 0.00 H new ATOM 0 HE3 MET A 72 3.914 -1.098 -7.171 1.00 0.00 H new ATOM 1184 N THR A 73 3.281 -2.734 -10.063 1.00 0.00 N ATOM 1185 CA THR A 73 2.090 -3.432 -9.625 1.00 0.00 C ATOM 1186 C THR A 73 1.903 -4.704 -10.450 1.00 0.00 C ATOM 1187 O THR A 73 1.349 -5.691 -9.970 1.00 0.00 O ATOM 1188 CB THR A 73 0.877 -2.499 -9.763 1.00 0.00 C ATOM 1189 OG1 THR A 73 0.871 -1.524 -8.735 1.00 0.00 O ATOM 1190 CG2 THR A 73 -0.463 -3.196 -9.747 1.00 0.00 C ATOM 0 H THR A 73 3.095 -1.908 -10.632 1.00 0.00 H new ATOM 0 HA THR A 73 2.190 -3.720 -8.579 1.00 0.00 H new ATOM 0 HB THR A 73 0.998 -2.046 -10.747 1.00 0.00 H new ATOM 0 HG1 THR A 73 1.751 -1.096 -8.685 1.00 0.00 H new ATOM 0 HG21 THR A 73 -1.258 -2.458 -9.850 1.00 0.00 H new ATOM 0 HG22 THR A 73 -0.515 -3.903 -10.575 1.00 0.00 H new ATOM 0 HG23 THR A 73 -0.584 -3.731 -8.805 1.00 0.00 H new ATOM 1198 N ALA A 74 2.380 -4.675 -11.693 1.00 0.00 N ATOM 1199 CA ALA A 74 2.271 -5.828 -12.577 1.00 0.00 C ATOM 1200 C ALA A 74 3.507 -6.723 -12.484 1.00 0.00 C ATOM 1201 O ALA A 74 3.629 -7.699 -13.223 1.00 0.00 O ATOM 1202 CB ALA A 74 2.057 -5.372 -14.012 1.00 0.00 C ATOM 0 H ALA A 74 2.844 -3.867 -12.108 1.00 0.00 H new ATOM 0 HA ALA A 74 1.410 -6.415 -12.257 1.00 0.00 H new ATOM 0 HB1 ALA A 74 1.977 -6.243 -14.662 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.140 -4.787 -14.075 1.00 0.00 H new ATOM 0 HB3 ALA A 74 2.901 -4.759 -14.329 1.00 0.00 H new ATOM 1208 N LYS A 75 4.422 -6.388 -11.575 1.00 0.00 N ATOM 1209 CA LYS A 75 5.641 -7.171 -11.401 1.00 0.00 C ATOM 1210 C LYS A 75 5.984 -7.357 -9.922 1.00 0.00 C ATOM 1211 O LYS A 75 7.083 -7.797 -9.586 1.00 0.00 O ATOM 1212 CB LYS A 75 6.809 -6.499 -12.125 1.00 0.00 C ATOM 1213 CG LYS A 75 8.053 -7.368 -12.212 1.00 0.00 C ATOM 1214 CD LYS A 75 9.114 -6.928 -11.217 1.00 0.00 C ATOM 1215 CE LYS A 75 10.139 -6.012 -11.865 1.00 0.00 C ATOM 1216 NZ LYS A 75 9.519 -4.762 -12.384 1.00 0.00 N ATOM 0 H LYS A 75 4.342 -5.584 -10.952 1.00 0.00 H new ATOM 0 HA LYS A 75 5.465 -8.156 -11.833 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.494 -6.229 -13.133 1.00 0.00 H new ATOM 0 HB3 LYS A 75 7.059 -5.572 -11.610 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.785 -8.408 -12.023 1.00 0.00 H new ATOM 0 HG3 LYS A 75 8.460 -7.322 -13.222 1.00 0.00 H new ATOM 0 HD2 LYS A 75 8.640 -6.412 -10.382 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.616 -7.805 -10.807 1.00 0.00 H new ATOM 0 HE2 LYS A 75 10.911 -5.759 -11.138 1.00 0.00 H new ATOM 0 HE3 LYS A 75 10.631 -6.539 -12.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 10.263 -4.121 -12.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 8.875 -4.993 -13.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 8.985 -4.297 -11.622 1.00 0.00 H new ATOM 1230 N GLU A 76 5.044 -7.022 -9.042 1.00 0.00 N ATOM 1231 CA GLU A 76 5.261 -7.161 -7.606 1.00 0.00 C ATOM 1232 C GLU A 76 4.204 -8.062 -6.985 1.00 0.00 C ATOM 1233 O GLU A 76 4.521 -9.030 -6.295 1.00 0.00 O ATOM 1234 CB GLU A 76 5.240 -5.789 -6.930 1.00 0.00 C ATOM 1235 CG GLU A 76 5.652 -5.824 -5.468 1.00 0.00 C ATOM 1236 CD GLU A 76 7.134 -6.091 -5.287 1.00 0.00 C ATOM 1237 OE1 GLU A 76 7.947 -5.253 -5.731 1.00 0.00 O ATOM 1238 OE2 GLU A 76 7.482 -7.138 -4.701 1.00 0.00 O ATOM 0 H GLU A 76 4.128 -6.654 -9.298 1.00 0.00 H new ATOM 0 HA GLU A 76 6.239 -7.617 -7.453 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.907 -5.117 -7.470 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.236 -5.371 -7.006 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.398 -4.873 -5.000 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.082 -6.596 -4.952 1.00 0.00 H new ATOM 1245 N LYS A 77 2.944 -7.732 -7.242 1.00 0.00 N ATOM 1246 CA LYS A 77 1.814 -8.495 -6.720 1.00 0.00 C ATOM 1247 C LYS A 77 0.529 -7.698 -6.906 1.00 0.00 C ATOM 1248 O LYS A 77 -0.532 -8.256 -7.182 1.00 0.00 O ATOM 1249 CB LYS A 77 2.019 -8.832 -5.239 1.00 0.00 C ATOM 1250 CG LYS A 77 2.458 -10.268 -4.998 1.00 0.00 C ATOM 1251 CD LYS A 77 3.414 -10.367 -3.821 1.00 0.00 C ATOM 1252 CE LYS A 77 3.832 -11.806 -3.563 1.00 0.00 C ATOM 1253 NZ LYS A 77 2.663 -12.684 -3.289 1.00 0.00 N ATOM 0 H LYS A 77 2.676 -6.932 -7.815 1.00 0.00 H new ATOM 0 HA LYS A 77 1.741 -9.432 -7.272 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.766 -8.157 -4.821 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.089 -8.650 -4.701 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.583 -10.891 -4.811 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.941 -10.657 -5.894 1.00 0.00 H new ATOM 0 HD2 LYS A 77 4.298 -9.760 -4.016 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.938 -9.960 -2.929 1.00 0.00 H new ATOM 0 HE2 LYS A 77 4.376 -12.186 -4.427 1.00 0.00 H new ATOM 0 HE3 LYS A 77 4.517 -11.838 -2.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.901 -13.351 -2.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.852 -12.102 -2.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.417 -13.214 -4.150 1.00 0.00 H new ATOM 1267 N PHE A 78 0.646 -6.381 -6.763 1.00 0.00 N ATOM 1268 CA PHE A 78 -0.486 -5.479 -6.923 1.00 0.00 C ATOM 1269 C PHE A 78 -1.227 -5.743 -8.207 1.00 0.00 C ATOM 1270 O PHE A 78 -0.784 -6.532 -9.041 1.00 0.00 O ATOM 1271 CB PHE A 78 -0.009 -4.039 -6.928 1.00 0.00 C ATOM 1272 CG PHE A 78 0.927 -3.724 -5.822 1.00 0.00 C ATOM 1273 CD1 PHE A 78 0.717 -4.236 -4.559 1.00 0.00 C ATOM 1274 CD2 PHE A 78 2.030 -2.931 -6.054 1.00 0.00 C ATOM 1275 CE1 PHE A 78 1.596 -3.955 -3.540 1.00 0.00 C ATOM 1276 CE2 PHE A 78 2.919 -2.650 -5.041 1.00 0.00 C ATOM 1277 CZ PHE A 78 2.701 -3.165 -3.777 1.00 0.00 C ATOM 0 H PHE A 78 1.523 -5.913 -6.534 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.160 -5.653 -6.084 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.481 -3.830 -7.879 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -0.873 -3.378 -6.862 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -0.143 -4.861 -4.369 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.199 -2.526 -7.041 1.00 0.00 H new ATOM 0 HE1 PHE A 78 1.421 -4.354 -2.552 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.782 -2.030 -5.233 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.394 -2.949 -2.977 1.00 0.00 H new ATOM 1287 N SER A 79 -2.341 -5.037 -8.367 1.00 0.00 N ATOM 1288 CA SER A 79 -3.168 -5.132 -9.564 1.00 0.00 C ATOM 1289 C SER A 79 -4.652 -5.011 -9.243 1.00 0.00 C ATOM 1290 O SER A 79 -5.385 -4.322 -9.949 1.00 0.00 O ATOM 1291 CB SER A 79 -2.930 -6.437 -10.336 1.00 0.00 C ATOM 1292 OG SER A 79 -1.838 -6.310 -11.231 1.00 0.00 O ATOM 0 H SER A 79 -2.696 -4.382 -7.670 1.00 0.00 H new ATOM 0 HA SER A 79 -2.868 -4.293 -10.192 1.00 0.00 H new ATOM 0 HB2 SER A 79 -2.736 -7.248 -9.634 1.00 0.00 H new ATOM 0 HB3 SER A 79 -3.829 -6.704 -10.891 1.00 0.00 H new ATOM 0 HG SER A 79 -0.997 -6.345 -10.728 1.00 0.00 H new ATOM 1298 N PRO A 80 -5.140 -5.723 -8.217 1.00 0.00 N ATOM 1299 CA PRO A 80 -6.544 -5.718 -7.876 1.00 0.00 C ATOM 1300 C PRO A 80 -6.925 -4.803 -6.720 1.00 0.00 C ATOM 1301 O PRO A 80 -7.520 -3.747 -6.939 1.00 0.00 O ATOM 1302 CB PRO A 80 -6.780 -7.182 -7.513 1.00 0.00 C ATOM 1303 CG PRO A 80 -5.451 -7.694 -7.018 1.00 0.00 C ATOM 1304 CD PRO A 80 -4.405 -6.649 -7.356 1.00 0.00 C ATOM 0 HA PRO A 80 -7.153 -5.330 -8.693 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.548 -7.277 -6.745 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -7.122 -7.750 -8.378 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -5.484 -7.869 -5.943 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -5.208 -8.646 -7.489 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -4.023 -6.155 -6.463 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -3.548 -7.085 -7.869 1.00 0.00 H new ATOM 1312 N LEU A 81 -6.599 -5.194 -5.493 1.00 0.00 N ATOM 1313 CA LEU A 81 -6.942 -4.369 -4.350 1.00 0.00 C ATOM 1314 C LEU A 81 -5.774 -3.477 -3.996 1.00 0.00 C ATOM 1315 O LEU A 81 -5.795 -2.758 -2.997 1.00 0.00 O ATOM 1316 CB LEU A 81 -7.344 -5.232 -3.160 1.00 0.00 C ATOM 1317 CG LEU A 81 -8.843 -5.520 -3.058 1.00 0.00 C ATOM 1318 CD1 LEU A 81 -9.615 -4.236 -2.789 1.00 0.00 C ATOM 1319 CD2 LEU A 81 -9.345 -6.184 -4.330 1.00 0.00 C ATOM 0 H LEU A 81 -6.108 -6.060 -5.270 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.796 -3.744 -4.610 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.809 -6.180 -3.218 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.019 -4.738 -2.244 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.006 -6.203 -2.224 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -10.680 -4.459 -2.719 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -9.274 -3.796 -1.852 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -9.445 -3.532 -3.603 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.413 -6.382 -4.240 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -9.168 -5.524 -5.179 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.814 -7.123 -4.484 1.00 0.00 H new ATOM 1331 N THR A 82 -4.758 -3.529 -4.839 1.00 0.00 N ATOM 1332 CA THR A 82 -3.573 -2.736 -4.655 1.00 0.00 C ATOM 1333 C THR A 82 -3.317 -1.859 -5.870 1.00 0.00 C ATOM 1334 O THR A 82 -2.387 -1.057 -5.874 1.00 0.00 O ATOM 1335 CB THR A 82 -2.380 -3.637 -4.382 1.00 0.00 C ATOM 1336 OG1 THR A 82 -2.798 -4.979 -4.192 1.00 0.00 O ATOM 1337 CG2 THR A 82 -1.617 -3.213 -3.146 1.00 0.00 C ATOM 0 H THR A 82 -4.739 -4.124 -5.667 1.00 0.00 H new ATOM 0 HA THR A 82 -3.722 -2.083 -3.795 1.00 0.00 H new ATOM 0 HB THR A 82 -1.730 -3.554 -5.253 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.134 -5.091 -3.278 1.00 0.00 H new ATOM 0 HG21 THR A 82 -0.773 -3.886 -2.991 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.250 -2.195 -3.276 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.277 -3.253 -2.279 1.00 0.00 H new ATOM 1345 N SER A 83 -4.156 -1.989 -6.900 1.00 0.00 N ATOM 1346 CA SER A 83 -3.994 -1.173 -8.090 1.00 0.00 C ATOM 1347 C SER A 83 -4.806 0.111 -7.969 1.00 0.00 C ATOM 1348 O SER A 83 -5.251 0.685 -8.962 1.00 0.00 O ATOM 1349 CB SER A 83 -4.406 -1.932 -9.345 1.00 0.00 C ATOM 1350 OG SER A 83 -4.386 -1.087 -10.482 1.00 0.00 O ATOM 0 H SER A 83 -4.939 -2.642 -6.929 1.00 0.00 H new ATOM 0 HA SER A 83 -2.937 -0.921 -8.177 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.732 -2.774 -9.502 1.00 0.00 H new ATOM 0 HB3 SER A 83 -5.406 -2.345 -9.212 1.00 0.00 H new ATOM 0 HG SER A 83 -5.027 -0.357 -10.358 1.00 0.00 H new ATOM 1356 N ASN A 84 -4.972 0.550 -6.735 1.00 0.00 N ATOM 1357 CA ASN A 84 -5.701 1.764 -6.415 1.00 0.00 C ATOM 1358 C ASN A 84 -4.996 2.411 -5.247 1.00 0.00 C ATOM 1359 O ASN A 84 -4.690 3.603 -5.259 1.00 0.00 O ATOM 1360 CB ASN A 84 -7.158 1.455 -6.065 1.00 0.00 C ATOM 1361 CG ASN A 84 -7.984 1.102 -7.286 1.00 0.00 C ATOM 1362 OD1 ASN A 84 -8.534 0.005 -7.382 1.00 0.00 O ATOM 1363 ND2 ASN A 84 -8.076 2.034 -8.227 1.00 0.00 N ATOM 0 H ASN A 84 -4.600 0.068 -5.917 1.00 0.00 H new ATOM 0 HA ASN A 84 -5.719 2.434 -7.274 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -7.191 0.628 -5.356 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.600 2.318 -5.568 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -8.619 1.854 -9.071 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -7.603 2.930 -8.106 1.00 0.00 H new ATOM 1370 N LEU A 85 -4.683 1.580 -4.260 1.00 0.00 N ATOM 1371 CA LEU A 85 -3.945 2.026 -3.103 1.00 0.00 C ATOM 1372 C LEU A 85 -2.532 2.385 -3.545 1.00 0.00 C ATOM 1373 O LEU A 85 -1.824 3.119 -2.855 1.00 0.00 O ATOM 1374 CB LEU A 85 -3.903 0.928 -2.034 1.00 0.00 C ATOM 1375 CG LEU A 85 -2.990 1.217 -0.838 1.00 0.00 C ATOM 1376 CD1 LEU A 85 -3.544 2.366 -0.009 1.00 0.00 C ATOM 1377 CD2 LEU A 85 -2.825 -0.029 0.021 1.00 0.00 C ATOM 0 H LEU A 85 -4.934 0.591 -4.246 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.434 2.897 -2.668 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.916 0.762 -1.666 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.578 -0.001 -2.503 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.010 1.507 -1.216 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.883 2.557 0.836 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.611 3.261 -0.627 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -4.536 2.104 0.359 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.173 0.195 0.866 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.800 -0.349 0.389 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.383 -0.827 -0.576 1.00 0.00 H new ATOM 1389 N ILE A 86 -2.124 1.864 -4.715 1.00 0.00 N ATOM 1390 CA ILE A 86 -0.800 2.145 -5.237 1.00 0.00 C ATOM 1391 C ILE A 86 -0.680 3.612 -5.637 1.00 0.00 C ATOM 1392 O ILE A 86 0.249 4.306 -5.222 1.00 0.00 O ATOM 1393 CB ILE A 86 -0.454 1.224 -6.437 1.00 0.00 C ATOM 1394 CG1 ILE A 86 0.636 0.230 -6.033 1.00 0.00 C ATOM 1395 CG2 ILE A 86 -0.013 2.022 -7.661 1.00 0.00 C ATOM 1396 CD1 ILE A 86 0.164 -0.812 -5.045 1.00 0.00 C ATOM 0 H ILE A 86 -2.693 1.254 -5.302 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.082 1.940 -4.443 1.00 0.00 H new ATOM 0 HB ILE A 86 -1.359 0.682 -6.711 1.00 0.00 H new ATOM 0 HG12 ILE A 86 1.010 -0.270 -6.926 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.473 0.777 -5.600 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.219 1.338 -8.477 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -0.816 2.692 -7.967 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.873 2.607 -7.414 1.00 0.00 H new ATOM 0 HD11 ILE A 86 0.988 -1.483 -4.803 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.183 -0.321 -4.136 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.654 -1.384 -5.483 1.00 0.00 H new ATOM 1408 N ASN A 87 -1.629 4.079 -6.440 1.00 0.00 N ATOM 1409 CA ASN A 87 -1.632 5.466 -6.889 1.00 0.00 C ATOM 1410 C ASN A 87 -2.019 6.397 -5.746 1.00 0.00 C ATOM 1411 O ASN A 87 -1.647 7.570 -5.736 1.00 0.00 O ATOM 1412 CB ASN A 87 -2.600 5.645 -8.060 1.00 0.00 C ATOM 1413 CG ASN A 87 -2.062 5.056 -9.350 1.00 0.00 C ATOM 1414 OD1 ASN A 87 -0.860 4.830 -9.489 1.00 0.00 O ATOM 1415 ND2 ASN A 87 -2.953 4.805 -10.302 1.00 0.00 N ATOM 0 H ASN A 87 -2.405 3.519 -6.793 1.00 0.00 H new ATOM 0 HA ASN A 87 -0.626 5.720 -7.222 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -3.551 5.172 -7.817 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -2.799 6.707 -8.204 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -2.651 4.409 -11.192 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -3.940 5.008 -10.143 1.00 0.00 H new ATOM 1422 N LEU A 88 -2.764 5.865 -4.783 1.00 0.00 N ATOM 1423 CA LEU A 88 -3.200 6.644 -3.634 1.00 0.00 C ATOM 1424 C LEU A 88 -2.072 6.786 -2.619 1.00 0.00 C ATOM 1425 O LEU A 88 -1.974 7.798 -1.926 1.00 0.00 O ATOM 1426 CB LEU A 88 -4.416 5.990 -2.976 1.00 0.00 C ATOM 1427 CG LEU A 88 -5.310 6.941 -2.178 1.00 0.00 C ATOM 1428 CD1 LEU A 88 -6.382 7.542 -3.073 1.00 0.00 C ATOM 1429 CD2 LEU A 88 -5.943 6.213 -1.000 1.00 0.00 C ATOM 0 H LEU A 88 -3.078 4.895 -4.777 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.480 7.638 -3.984 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -5.018 5.515 -3.751 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -4.069 5.199 -2.312 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.693 7.752 -1.791 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -7.008 8.216 -2.488 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -5.910 8.097 -3.884 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.997 6.745 -3.490 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.576 6.904 -0.443 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -6.547 5.383 -1.367 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -5.160 5.830 -0.346 1.00 0.00 H new ATOM 1441 N LEU A 89 -1.218 5.769 -2.535 1.00 0.00 N ATOM 1442 CA LEU A 89 -0.100 5.800 -1.602 1.00 0.00 C ATOM 1443 C LEU A 89 0.958 6.794 -2.068 1.00 0.00 C ATOM 1444 O LEU A 89 1.642 7.417 -1.255 1.00 0.00 O ATOM 1445 CB LEU A 89 0.512 4.406 -1.450 1.00 0.00 C ATOM 1446 CG LEU A 89 0.140 3.684 -0.156 1.00 0.00 C ATOM 1447 CD1 LEU A 89 0.233 2.177 -0.339 1.00 0.00 C ATOM 1448 CD2 LEU A 89 1.040 4.142 0.983 1.00 0.00 C ATOM 0 H LEU A 89 -1.279 4.920 -3.098 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.474 6.122 -0.630 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.200 3.793 -2.295 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.597 4.493 -1.503 1.00 0.00 H new ATOM 0 HG LEU A 89 -0.891 3.934 0.096 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.036 1.680 0.593 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.451 1.863 -1.128 1.00 0.00 H new ATOM 0 HD13 LEU A 89 1.252 1.906 -0.614 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.763 3.619 1.898 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.079 3.920 0.738 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.924 5.216 1.129 1.00 0.00 H new ATOM 1460 N ALA A 90 1.080 6.943 -3.382 1.00 0.00 N ATOM 1461 CA ALA A 90 2.046 7.868 -3.959 1.00 0.00 C ATOM 1462 C ALA A 90 1.361 9.147 -4.434 1.00 0.00 C ATOM 1463 O ALA A 90 1.909 9.889 -5.247 1.00 0.00 O ATOM 1464 CB ALA A 90 2.788 7.206 -5.110 1.00 0.00 C ATOM 0 H ALA A 90 0.521 6.435 -4.067 1.00 0.00 H new ATOM 0 HA ALA A 90 2.765 8.136 -3.185 1.00 0.00 H new ATOM 0 HB1 ALA A 90 3.507 7.909 -5.532 1.00 0.00 H new ATOM 0 HB2 ALA A 90 3.314 6.324 -4.744 1.00 0.00 H new ATOM 0 HB3 ALA A 90 2.075 6.910 -5.880 1.00 0.00 H new ATOM 1470 N GLU A 91 0.158 9.399 -3.921 1.00 0.00 N ATOM 1471 CA GLU A 91 -0.597 10.588 -4.296 1.00 0.00 C ATOM 1472 C GLU A 91 -0.235 11.767 -3.399 1.00 0.00 C ATOM 1473 O GLU A 91 0.098 12.848 -3.884 1.00 0.00 O ATOM 1474 CB GLU A 91 -2.101 10.313 -4.211 1.00 0.00 C ATOM 1475 CG GLU A 91 -2.961 11.503 -4.604 1.00 0.00 C ATOM 1476 CD GLU A 91 -4.348 11.095 -5.058 1.00 0.00 C ATOM 1477 OE1 GLU A 91 -5.250 11.000 -4.200 1.00 0.00 O ATOM 1478 OE2 GLU A 91 -4.532 10.870 -6.273 1.00 0.00 O ATOM 0 H GLU A 91 -0.312 8.796 -3.246 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.338 10.842 -5.324 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -2.345 9.470 -4.858 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.350 10.016 -3.192 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.046 12.182 -3.755 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.468 12.054 -5.405 1.00 0.00 H new ATOM 1485 N ASN A 92 -0.304 11.551 -2.089 1.00 0.00 N ATOM 1486 CA ASN A 92 0.015 12.600 -1.126 1.00 0.00 C ATOM 1487 C ASN A 92 1.274 12.258 -0.332 1.00 0.00 C ATOM 1488 O ASN A 92 1.513 12.821 0.736 1.00 0.00 O ATOM 1489 CB ASN A 92 -1.161 12.817 -0.172 1.00 0.00 C ATOM 1490 CG ASN A 92 -2.433 13.203 -0.901 1.00 0.00 C ATOM 1491 OD1 ASN A 92 -2.399 13.935 -1.890 1.00 0.00 O ATOM 1492 ND2 ASN A 92 -3.567 12.711 -0.412 1.00 0.00 N ATOM 0 H ASN A 92 -0.577 10.662 -1.671 1.00 0.00 H new ATOM 0 HA ASN A 92 0.202 13.519 -1.681 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -1.335 11.905 0.399 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -0.905 13.598 0.544 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -4.456 12.937 -0.859 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -3.549 12.108 0.410 1.00 0.00 H new ATOM 1499 N GLY A 93 2.075 11.336 -0.856 1.00 0.00 N ATOM 1500 CA GLY A 93 3.295 10.943 -0.177 1.00 0.00 C ATOM 1501 C GLY A 93 3.028 10.051 1.018 1.00 0.00 C ATOM 1502 O GLY A 93 3.756 10.096 2.010 1.00 0.00 O ATOM 0 H GLY A 93 1.901 10.854 -1.738 1.00 0.00 H new ATOM 0 HA2 GLY A 93 3.946 10.421 -0.878 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.829 11.835 0.151 1.00 0.00 H new ATOM 1506 N ARG A 94 1.981 9.238 0.924 1.00 0.00 N ATOM 1507 CA ARG A 94 1.618 8.332 2.006 1.00 0.00 C ATOM 1508 C ARG A 94 2.767 7.385 2.336 1.00 0.00 C ATOM 1509 O ARG A 94 2.871 6.887 3.456 1.00 0.00 O ATOM 1510 CB ARG A 94 0.371 7.530 1.632 1.00 0.00 C ATOM 1511 CG ARG A 94 -0.822 8.396 1.266 1.00 0.00 C ATOM 1512 CD ARG A 94 -1.407 9.085 2.489 1.00 0.00 C ATOM 1513 NE ARG A 94 -0.668 10.296 2.840 1.00 0.00 N ATOM 1514 CZ ARG A 94 -1.098 11.197 3.720 1.00 0.00 C ATOM 1515 NH1 ARG A 94 -2.261 11.029 4.339 1.00 0.00 N ATOM 1516 NH2 ARG A 94 -0.364 12.269 3.982 1.00 0.00 N ATOM 0 H ARG A 94 1.369 9.188 0.109 1.00 0.00 H new ATOM 0 HA ARG A 94 1.404 8.933 2.890 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.607 6.878 0.791 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.099 6.886 2.468 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.518 9.146 0.535 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -1.587 7.781 0.792 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -2.450 9.339 2.298 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -1.396 8.396 3.333 1.00 0.00 H new ATOM 0 HE ARG A 94 0.230 10.460 2.384 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -2.830 10.206 4.141 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -2.585 11.723 5.012 1.00 0.00 H new ATOM 0 HH21 ARG A 94 0.530 12.403 3.509 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -0.693 12.960 4.656 1.00 0.00 H new ATOM 1530 N LEU A 95 3.633 7.143 1.355 1.00 0.00 N ATOM 1531 CA LEU A 95 4.777 6.258 1.549 1.00 0.00 C ATOM 1532 C LEU A 95 5.603 6.701 2.750 1.00 0.00 C ATOM 1533 O LEU A 95 5.262 7.676 3.422 1.00 0.00 O ATOM 1534 CB LEU A 95 5.649 6.232 0.292 1.00 0.00 C ATOM 1535 CG LEU A 95 4.927 5.806 -0.988 1.00 0.00 C ATOM 1536 CD1 LEU A 95 5.876 5.852 -2.176 1.00 0.00 C ATOM 1537 CD2 LEU A 95 4.336 4.413 -0.828 1.00 0.00 C ATOM 0 H LEU A 95 3.564 7.546 0.421 1.00 0.00 H new ATOM 0 HA LEU A 95 4.402 5.252 1.739 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.070 7.226 0.140 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.485 5.554 0.462 1.00 0.00 H new ATOM 0 HG LEU A 95 4.112 6.505 -1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.345 5.546 -3.078 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.251 6.867 -2.303 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.712 5.176 -2.000 1.00 0.00 H new ATOM 0 HD21 LEU A 95 3.826 4.126 -1.748 1.00 0.00 H new ATOM 0 HD22 LEU A 95 5.134 3.701 -0.618 1.00 0.00 H new ATOM 0 HD23 LEU A 95 3.624 4.413 -0.003 1.00 0.00 H new ATOM 1549 N THR A 96 6.681 5.971 3.026 1.00 0.00 N ATOM 1550 CA THR A 96 7.559 6.270 4.160 1.00 0.00 C ATOM 1551 C THR A 96 6.986 5.668 5.437 1.00 0.00 C ATOM 1552 O THR A 96 7.671 4.935 6.151 1.00 0.00 O ATOM 1553 CB THR A 96 7.758 7.782 4.328 1.00 0.00 C ATOM 1554 OG1 THR A 96 7.658 8.444 3.080 1.00 0.00 O ATOM 1555 CG2 THR A 96 9.097 8.144 4.932 1.00 0.00 C ATOM 0 H THR A 96 6.971 5.162 2.477 1.00 0.00 H new ATOM 0 HA THR A 96 8.534 5.825 3.960 1.00 0.00 H new ATOM 0 HB THR A 96 6.970 8.103 5.009 1.00 0.00 H new ATOM 0 HG1 THR A 96 6.737 8.749 2.944 1.00 0.00 H new ATOM 0 HG21 THR A 96 9.174 9.227 5.024 1.00 0.00 H new ATOM 0 HG22 THR A 96 9.186 7.689 5.919 1.00 0.00 H new ATOM 0 HG23 THR A 96 9.897 7.777 4.290 1.00 0.00 H new ATOM 1563 N ASN A 97 5.718 5.961 5.707 1.00 0.00 N ATOM 1564 CA ASN A 97 5.044 5.425 6.881 1.00 0.00 C ATOM 1565 C ASN A 97 4.269 4.160 6.512 1.00 0.00 C ATOM 1566 O ASN A 97 3.360 3.742 7.230 1.00 0.00 O ATOM 1567 CB ASN A 97 4.095 6.467 7.476 1.00 0.00 C ATOM 1568 CG ASN A 97 4.787 7.788 7.753 1.00 0.00 C ATOM 1569 OD1 ASN A 97 5.167 8.077 8.887 1.00 0.00 O ATOM 1570 ND2 ASN A 97 4.954 8.597 6.713 1.00 0.00 N ATOM 0 H ASN A 97 5.137 6.567 5.127 1.00 0.00 H new ATOM 0 HA ASN A 97 5.797 5.174 7.628 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.264 6.632 6.790 1.00 0.00 H new ATOM 0 HB3 ASN A 97 3.671 6.081 8.403 1.00 0.00 H new ATOM 0 HD21 ASN A 97 5.413 9.499 6.837 1.00 0.00 H new ATOM 0 HD22 ASN A 97 4.623 8.316 5.790 1.00 0.00 H new ATOM 1577 N THR A 98 4.639 3.560 5.379 1.00 0.00 N ATOM 1578 CA THR A 98 3.994 2.347 4.886 1.00 0.00 C ATOM 1579 C THR A 98 3.740 1.339 6.009 1.00 0.00 C ATOM 1580 O THR A 98 2.600 0.938 6.241 1.00 0.00 O ATOM 1581 CB THR A 98 4.849 1.703 3.793 1.00 0.00 C ATOM 1582 OG1 THR A 98 5.924 2.552 3.428 1.00 0.00 O ATOM 1583 CG2 THR A 98 4.069 1.386 2.537 1.00 0.00 C ATOM 0 H THR A 98 5.392 3.902 4.781 1.00 0.00 H new ATOM 0 HA THR A 98 3.027 2.635 4.472 1.00 0.00 H new ATOM 0 HB THR A 98 5.213 0.770 4.223 1.00 0.00 H new ATOM 0 HG1 THR A 98 6.774 2.095 3.597 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.733 0.931 1.802 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.262 0.693 2.775 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.649 2.305 2.128 1.00 0.00 H new ATOM 1591 N PRO A 99 4.800 0.907 6.719 1.00 0.00 N ATOM 1592 CA PRO A 99 4.679 -0.061 7.811 1.00 0.00 C ATOM 1593 C PRO A 99 3.524 0.261 8.753 1.00 0.00 C ATOM 1594 O PRO A 99 2.948 -0.634 9.371 1.00 0.00 O ATOM 1595 CB PRO A 99 6.026 0.040 8.550 1.00 0.00 C ATOM 1596 CG PRO A 99 6.773 1.161 7.897 1.00 0.00 C ATOM 1597 CD PRO A 99 6.195 1.312 6.520 1.00 0.00 C ATOM 0 HA PRO A 99 4.466 -1.062 7.435 1.00 0.00 H new ATOM 0 HB2 PRO A 99 5.875 0.238 9.611 1.00 0.00 H new ATOM 0 HB3 PRO A 99 6.582 -0.894 8.476 1.00 0.00 H new ATOM 0 HG2 PRO A 99 6.664 2.084 8.467 1.00 0.00 H new ATOM 0 HG3 PRO A 99 7.839 0.940 7.848 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.273 2.337 6.157 1.00 0.00 H new ATOM 0 HD3 PRO A 99 6.703 0.677 5.794 1.00 0.00 H new ATOM 1605 N ALA A 100 3.185 1.542 8.857 1.00 0.00 N ATOM 1606 CA ALA A 100 2.093 1.972 9.722 1.00 0.00 C ATOM 1607 C ALA A 100 0.744 1.762 9.042 1.00 0.00 C ATOM 1608 O ALA A 100 -0.261 1.499 9.701 1.00 0.00 O ATOM 1609 CB ALA A 100 2.274 3.429 10.121 1.00 0.00 C ATOM 0 H ALA A 100 3.650 2.298 8.354 1.00 0.00 H new ATOM 0 HA ALA A 100 2.112 1.362 10.625 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.451 3.734 10.767 1.00 0.00 H new ATOM 0 HB2 ALA A 100 3.217 3.545 10.656 1.00 0.00 H new ATOM 0 HB3 ALA A 100 2.285 4.052 9.227 1.00 0.00 H new ATOM 1615 N VAL A 101 0.732 1.875 7.720 1.00 0.00 N ATOM 1616 CA VAL A 101 -0.490 1.689 6.948 1.00 0.00 C ATOM 1617 C VAL A 101 -0.735 0.212 6.650 1.00 0.00 C ATOM 1618 O VAL A 101 -1.836 -0.177 6.261 1.00 0.00 O ATOM 1619 CB VAL A 101 -0.438 2.464 5.618 1.00 0.00 C ATOM 1620 CG1 VAL A 101 -1.786 2.409 4.913 1.00 0.00 C ATOM 1621 CG2 VAL A 101 -0.007 3.904 5.851 1.00 0.00 C ATOM 0 H VAL A 101 1.555 2.095 7.160 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.308 2.076 7.556 1.00 0.00 H new ATOM 0 HB VAL A 101 0.302 1.990 4.974 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -1.729 2.962 3.976 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -2.047 1.371 4.707 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -2.549 2.855 5.551 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.023 4.433 4.899 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.718 4.394 6.516 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.984 3.918 6.306 1.00 0.00 H new ATOM 1631 N ILE A 102 0.300 -0.608 6.827 1.00 0.00 N ATOM 1632 CA ILE A 102 0.192 -2.037 6.568 1.00 0.00 C ATOM 1633 C ILE A 102 -0.085 -2.821 7.850 1.00 0.00 C ATOM 1634 O ILE A 102 -0.767 -3.845 7.822 1.00 0.00 O ATOM 1635 CB ILE A 102 1.475 -2.587 5.914 1.00 0.00 C ATOM 1636 CG1 ILE A 102 1.877 -1.719 4.720 1.00 0.00 C ATOM 1637 CG2 ILE A 102 1.273 -4.032 5.482 1.00 0.00 C ATOM 1638 CD1 ILE A 102 3.328 -1.879 4.320 1.00 0.00 C ATOM 0 H ILE A 102 1.220 -0.305 7.148 1.00 0.00 H new ATOM 0 HA ILE A 102 -0.646 -2.166 5.883 1.00 0.00 H new ATOM 0 HB ILE A 102 2.280 -2.558 6.648 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.244 -1.970 3.869 1.00 0.00 H new ATOM 0 HG13 ILE A 102 1.688 -0.673 4.961 1.00 0.00 H new ATOM 0 HG21 ILE A 102 2.188 -4.406 5.022 1.00 0.00 H new ATOM 0 HG22 ILE A 102 1.029 -4.641 6.352 1.00 0.00 H new ATOM 0 HG23 ILE A 102 0.457 -4.086 4.762 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.544 -1.235 3.468 1.00 0.00 H new ATOM 0 HD12 ILE A 102 3.969 -1.600 5.157 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.518 -2.917 4.047 1.00 0.00 H new ATOM 1650 N SER A 103 0.448 -2.339 8.972 1.00 0.00 N ATOM 1651 CA SER A 103 0.250 -3.012 10.254 1.00 0.00 C ATOM 1652 C SER A 103 -1.218 -2.989 10.660 1.00 0.00 C ATOM 1653 O SER A 103 -1.807 -4.031 10.947 1.00 0.00 O ATOM 1654 CB SER A 103 1.107 -2.360 11.342 1.00 0.00 C ATOM 1655 OG SER A 103 2.054 -3.277 11.863 1.00 0.00 O ATOM 0 H SER A 103 1.015 -1.493 9.019 1.00 0.00 H new ATOM 0 HA SER A 103 0.559 -4.051 10.139 1.00 0.00 H new ATOM 0 HB2 SER A 103 1.624 -1.493 10.931 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.466 -1.998 12.146 1.00 0.00 H new ATOM 0 HG SER A 103 2.590 -2.836 12.555 1.00 0.00 H new ATOM 1661 N ALA A 104 -1.810 -1.799 10.673 1.00 0.00 N ATOM 1662 CA ALA A 104 -3.216 -1.652 11.035 1.00 0.00 C ATOM 1663 C ALA A 104 -4.087 -2.586 10.202 1.00 0.00 C ATOM 1664 O ALA A 104 -5.176 -2.977 10.619 1.00 0.00 O ATOM 1665 CB ALA A 104 -3.661 -0.207 10.855 1.00 0.00 C ATOM 0 H ALA A 104 -1.340 -0.925 10.438 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.331 -1.923 12.084 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -4.712 -0.113 11.129 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -3.060 0.441 11.493 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.530 0.087 9.814 1.00 0.00 H new ATOM 1671 N PHE A 105 -3.593 -2.939 9.021 1.00 0.00 N ATOM 1672 CA PHE A 105 -4.312 -3.825 8.120 1.00 0.00 C ATOM 1673 C PHE A 105 -4.524 -5.196 8.748 1.00 0.00 C ATOM 1674 O PHE A 105 -5.645 -5.702 8.792 1.00 0.00 O ATOM 1675 CB PHE A 105 -3.543 -3.975 6.811 1.00 0.00 C ATOM 1676 CG PHE A 105 -4.407 -4.362 5.650 1.00 0.00 C ATOM 1677 CD1 PHE A 105 -4.757 -5.685 5.438 1.00 0.00 C ATOM 1678 CD2 PHE A 105 -4.868 -3.401 4.770 1.00 0.00 C ATOM 1679 CE1 PHE A 105 -5.552 -6.040 4.368 1.00 0.00 C ATOM 1680 CE2 PHE A 105 -5.663 -3.749 3.699 1.00 0.00 C ATOM 1681 CZ PHE A 105 -6.005 -5.069 3.498 1.00 0.00 C ATOM 0 H PHE A 105 -2.691 -2.621 8.665 1.00 0.00 H new ATOM 0 HA PHE A 105 -5.288 -3.383 7.922 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -3.043 -3.034 6.583 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -2.764 -4.727 6.941 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -4.404 -6.447 6.117 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.602 -2.365 4.923 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -5.819 -7.075 4.212 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -6.017 -2.989 3.019 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.628 -5.344 2.659 1.00 0.00 H new ATOM 1691 N SER A 106 -3.441 -5.798 9.226 1.00 0.00 N ATOM 1692 CA SER A 106 -3.517 -7.116 9.841 1.00 0.00 C ATOM 1693 C SER A 106 -4.362 -7.080 11.108 1.00 0.00 C ATOM 1694 O SER A 106 -4.987 -8.075 11.476 1.00 0.00 O ATOM 1695 CB SER A 106 -2.115 -7.637 10.161 1.00 0.00 C ATOM 1696 OG SER A 106 -2.018 -9.028 9.911 1.00 0.00 O ATOM 0 H SER A 106 -2.504 -5.396 9.199 1.00 0.00 H new ATOM 0 HA SER A 106 -3.993 -7.792 9.130 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.379 -7.104 9.559 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.878 -7.435 11.206 1.00 0.00 H new ATOM 0 HG SER A 106 -1.112 -9.336 10.122 1.00 0.00 H new ATOM 1702 N THR A 107 -4.381 -5.931 11.774 1.00 0.00 N ATOM 1703 CA THR A 107 -5.157 -5.779 12.997 1.00 0.00 C ATOM 1704 C THR A 107 -6.618 -5.503 12.677 1.00 0.00 C ATOM 1705 O THR A 107 -7.515 -6.075 13.296 1.00 0.00 O ATOM 1706 CB THR A 107 -4.583 -4.655 13.861 1.00 0.00 C ATOM 1707 OG1 THR A 107 -3.189 -4.520 13.647 1.00 0.00 O ATOM 1708 CG2 THR A 107 -4.801 -4.868 15.342 1.00 0.00 C ATOM 0 H THR A 107 -3.870 -5.095 11.489 1.00 0.00 H new ATOM 0 HA THR A 107 -5.097 -6.713 13.555 1.00 0.00 H new ATOM 0 HB THR A 107 -5.118 -3.755 13.557 1.00 0.00 H new ATOM 0 HG1 THR A 107 -2.841 -3.795 14.207 1.00 0.00 H new ATOM 0 HG21 THR A 107 -4.370 -4.035 15.897 1.00 0.00 H new ATOM 0 HG22 THR A 107 -5.870 -4.927 15.548 1.00 0.00 H new ATOM 0 HG23 THR A 107 -4.321 -5.797 15.651 1.00 0.00 H new ATOM 1716 N MET A 108 -6.859 -4.640 11.696 1.00 0.00 N ATOM 1717 CA MET A 108 -8.218 -4.321 11.297 1.00 0.00 C ATOM 1718 C MET A 108 -8.795 -5.466 10.478 1.00 0.00 C ATOM 1719 O MET A 108 -10.011 -5.648 10.413 1.00 0.00 O ATOM 1720 CB MET A 108 -8.251 -3.022 10.496 1.00 0.00 C ATOM 1721 CG MET A 108 -7.757 -1.816 11.277 1.00 0.00 C ATOM 1722 SD MET A 108 -8.953 -1.238 12.495 1.00 0.00 S ATOM 1723 CE MET A 108 -8.329 -2.018 13.980 1.00 0.00 C ATOM 0 H MET A 108 -6.134 -4.154 11.168 1.00 0.00 H new ATOM 0 HA MET A 108 -8.825 -4.183 12.192 1.00 0.00 H new ATOM 0 HB2 MET A 108 -7.640 -3.141 9.601 1.00 0.00 H new ATOM 0 HB3 MET A 108 -9.272 -2.836 10.163 1.00 0.00 H new ATOM 0 HG2 MET A 108 -6.825 -2.072 11.782 1.00 0.00 H new ATOM 0 HG3 MET A 108 -7.531 -1.006 10.583 1.00 0.00 H new ATOM 0 HE1 MET A 108 -9.165 -2.366 14.587 1.00 0.00 H new ATOM 0 HE2 MET A 108 -7.699 -2.865 13.709 1.00 0.00 H new ATOM 0 HE3 MET A 108 -7.742 -1.298 14.550 1.00 0.00 H new ATOM 1733 N MET A 109 -7.908 -6.251 9.870 1.00 0.00 N ATOM 1734 CA MET A 109 -8.325 -7.391 9.076 1.00 0.00 C ATOM 1735 C MET A 109 -8.902 -8.469 9.983 1.00 0.00 C ATOM 1736 O MET A 109 -9.948 -9.037 9.693 1.00 0.00 O ATOM 1737 CB MET A 109 -7.139 -7.948 8.279 1.00 0.00 C ATOM 1738 CG MET A 109 -7.436 -9.262 7.573 1.00 0.00 C ATOM 1739 SD MET A 109 -6.026 -9.879 6.631 1.00 0.00 S ATOM 1740 CE MET A 109 -6.582 -11.533 6.233 1.00 0.00 C ATOM 0 H MET A 109 -6.898 -6.114 9.915 1.00 0.00 H new ATOM 0 HA MET A 109 -9.094 -7.069 8.373 1.00 0.00 H new ATOM 0 HB2 MET A 109 -6.832 -7.210 7.538 1.00 0.00 H new ATOM 0 HB3 MET A 109 -6.295 -8.092 8.954 1.00 0.00 H new ATOM 0 HG2 MET A 109 -7.729 -10.008 8.311 1.00 0.00 H new ATOM 0 HG3 MET A 109 -8.285 -9.126 6.902 1.00 0.00 H new ATOM 0 HE1 MET A 109 -5.884 -11.993 5.534 1.00 0.00 H new ATOM 0 HE2 MET A 109 -6.630 -12.130 7.144 1.00 0.00 H new ATOM 0 HE3 MET A 109 -7.571 -11.485 5.778 1.00 0.00 H new ATOM 1750 N SER A 110 -8.221 -8.742 11.093 1.00 0.00 N ATOM 1751 CA SER A 110 -8.689 -9.753 12.037 1.00 0.00 C ATOM 1752 C SER A 110 -10.135 -9.489 12.446 1.00 0.00 C ATOM 1753 O SER A 110 -10.860 -10.410 12.822 1.00 0.00 O ATOM 1754 CB SER A 110 -7.791 -9.785 13.276 1.00 0.00 C ATOM 1755 OG SER A 110 -6.507 -10.299 12.962 1.00 0.00 O ATOM 0 H SER A 110 -7.351 -8.282 11.359 1.00 0.00 H new ATOM 0 HA SER A 110 -8.642 -10.723 11.542 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.694 -8.779 13.685 1.00 0.00 H new ATOM 0 HB3 SER A 110 -8.253 -10.400 14.048 1.00 0.00 H new ATOM 0 HG SER A 110 -5.995 -9.623 12.470 1.00 0.00 H new ATOM 1761 N VAL A 111 -10.550 -8.230 12.361 1.00 0.00 N ATOM 1762 CA VAL A 111 -11.911 -7.855 12.715 1.00 0.00 C ATOM 1763 C VAL A 111 -12.884 -8.161 11.578 1.00 0.00 C ATOM 1764 O VAL A 111 -14.100 -8.117 11.764 1.00 0.00 O ATOM 1765 CB VAL A 111 -12.009 -6.360 13.070 1.00 0.00 C ATOM 1766 CG1 VAL A 111 -13.386 -6.032 13.626 1.00 0.00 C ATOM 1767 CG2 VAL A 111 -10.920 -5.973 14.059 1.00 0.00 C ATOM 0 H VAL A 111 -9.964 -7.455 12.051 1.00 0.00 H new ATOM 0 HA VAL A 111 -12.182 -8.447 13.589 1.00 0.00 H new ATOM 0 HB VAL A 111 -11.863 -5.779 12.159 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -13.436 -4.971 13.871 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -14.145 -6.268 12.880 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -13.565 -6.621 14.526 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -11.005 -4.913 14.298 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -11.031 -6.560 14.970 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -9.942 -6.168 13.618 1.00 0.00 H new ATOM 1777 N HIS A 112 -12.347 -8.470 10.397 1.00 0.00 N ATOM 1778 CA HIS A 112 -13.168 -8.775 9.245 1.00 0.00 C ATOM 1779 C HIS A 112 -13.597 -10.239 9.251 1.00 0.00 C ATOM 1780 O HIS A 112 -14.636 -10.594 8.693 1.00 0.00 O ATOM 1781 CB HIS A 112 -12.388 -8.446 7.976 1.00 0.00 C ATOM 1782 CG HIS A 112 -11.658 -9.609 7.378 1.00 0.00 C ATOM 1783 ND1 HIS A 112 -10.853 -10.467 8.098 1.00 0.00 N ATOM 1784 CD2 HIS A 112 -11.623 -10.044 6.112 1.00 0.00 C ATOM 1785 CE1 HIS A 112 -10.354 -11.381 7.287 1.00 0.00 C ATOM 1786 NE2 HIS A 112 -10.809 -11.147 6.073 1.00 0.00 N ATOM 0 H HIS A 112 -11.343 -8.513 10.222 1.00 0.00 H new ATOM 0 HA HIS A 112 -14.074 -8.169 9.281 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -13.078 -8.046 7.234 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -11.669 -7.658 8.200 1.00 0.00 H new ATOM 0 HD1 HIS A 112 -10.672 -10.405 9.100 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -12.142 -9.605 5.273 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -9.688 -12.182 7.570 1.00 0.00 H new ATOM 1795 N ARG A 113 -12.787 -11.088 9.878 1.00 0.00 N ATOM 1796 CA ARG A 113 -13.086 -12.511 9.943 1.00 0.00 C ATOM 1797 C ARG A 113 -14.226 -12.781 10.921 1.00 0.00 C ATOM 1798 O ARG A 113 -15.006 -13.715 10.737 1.00 0.00 O ATOM 1799 CB ARG A 113 -11.843 -13.297 10.361 1.00 0.00 C ATOM 1800 CG ARG A 113 -11.777 -14.694 9.762 1.00 0.00 C ATOM 1801 CD ARG A 113 -10.350 -15.084 9.412 1.00 0.00 C ATOM 1802 NE ARG A 113 -10.260 -16.463 8.936 1.00 0.00 N ATOM 1803 CZ ARG A 113 -9.229 -16.943 8.246 1.00 0.00 C ATOM 1804 NH1 ARG A 113 -8.198 -16.161 7.949 1.00 0.00 N ATOM 1805 NH2 ARG A 113 -9.228 -18.208 7.852 1.00 0.00 N ATOM 0 H ARG A 113 -11.923 -10.815 10.346 1.00 0.00 H new ATOM 0 HA ARG A 113 -13.396 -12.838 8.950 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -10.954 -12.741 10.063 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -11.821 -13.375 11.448 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.189 -15.414 10.469 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -12.397 -14.737 8.866 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -9.968 -14.410 8.645 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -9.715 -14.961 10.289 1.00 0.00 H new ATOM 0 HE ARG A 113 -11.033 -17.094 9.145 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -8.194 -15.186 8.250 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -7.410 -16.535 7.420 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -10.017 -18.813 8.078 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -8.438 -18.577 7.323 1.00 0.00 H new ATOM 1819 N GLY A 114 -14.316 -11.957 11.961 1.00 0.00 N ATOM 1820 CA GLY A 114 -15.362 -12.123 12.951 1.00 0.00 C ATOM 1821 C GLY A 114 -16.645 -11.414 12.565 1.00 0.00 C ATOM 1822 O GLY A 114 -17.734 -11.825 12.967 1.00 0.00 O ATOM 0 H GLY A 114 -13.682 -11.177 12.135 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -15.564 -13.185 13.086 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -15.014 -11.740 13.910 1.00 0.00 H new ATOM 1826 N GLU A 115 -16.518 -10.347 11.784 1.00 0.00 N ATOM 1827 CA GLU A 115 -17.677 -9.579 11.344 1.00 0.00 C ATOM 1828 C GLU A 115 -18.161 -10.058 9.978 1.00 0.00 C ATOM 1829 O GLU A 115 -18.429 -9.254 9.085 1.00 0.00 O ATOM 1830 CB GLU A 115 -17.335 -8.089 11.286 1.00 0.00 C ATOM 1831 CG GLU A 115 -18.470 -7.186 11.739 1.00 0.00 C ATOM 1832 CD GLU A 115 -18.288 -6.688 13.160 1.00 0.00 C ATOM 1833 OE1 GLU A 115 -17.632 -5.641 13.342 1.00 0.00 O ATOM 1834 OE2 GLU A 115 -18.801 -7.346 14.089 1.00 0.00 O ATOM 0 H GLU A 115 -15.624 -9.994 11.442 1.00 0.00 H new ATOM 0 HA GLU A 115 -18.479 -9.732 12.066 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.461 -7.901 11.910 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -17.060 -7.828 10.264 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -18.541 -6.332 11.065 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -19.412 -7.729 11.666 1.00 0.00 H new ATOM 1841 N VAL A 116 -18.269 -11.373 9.823 1.00 0.00 N ATOM 1842 CA VAL A 116 -18.721 -11.960 8.567 1.00 0.00 C ATOM 1843 C VAL A 116 -19.441 -13.285 8.806 1.00 0.00 C ATOM 1844 O VAL A 116 -19.214 -13.950 9.816 1.00 0.00 O ATOM 1845 CB VAL A 116 -17.544 -12.196 7.601 1.00 0.00 C ATOM 1846 CG1 VAL A 116 -17.069 -10.879 7.006 1.00 0.00 C ATOM 1847 CG2 VAL A 116 -16.405 -12.909 8.314 1.00 0.00 C ATOM 0 H VAL A 116 -18.050 -12.053 10.551 1.00 0.00 H new ATOM 0 HA VAL A 116 -19.414 -11.249 8.117 1.00 0.00 H new ATOM 0 HB VAL A 116 -17.888 -12.833 6.786 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -16.237 -11.066 6.326 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -17.887 -10.411 6.458 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -16.742 -10.215 7.806 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -15.582 -13.068 7.617 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -16.061 -12.300 9.149 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -16.755 -13.871 8.687 1.00 0.00 H new ATOM 1857 N PRO A 117 -20.323 -13.686 7.873 1.00 0.00 N ATOM 1858 CA PRO A 117 -21.077 -14.939 7.988 1.00 0.00 C ATOM 1859 C PRO A 117 -20.186 -16.166 7.830 1.00 0.00 C ATOM 1860 O PRO A 117 -19.557 -16.359 6.789 1.00 0.00 O ATOM 1861 CB PRO A 117 -22.084 -14.855 6.839 1.00 0.00 C ATOM 1862 CG PRO A 117 -21.447 -13.950 5.842 1.00 0.00 C ATOM 1863 CD PRO A 117 -20.653 -12.952 6.638 1.00 0.00 C ATOM 0 HA PRO A 117 -21.540 -15.049 8.969 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -22.280 -15.839 6.412 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -23.041 -14.458 7.179 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -20.803 -14.509 5.163 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -22.199 -13.452 5.230 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -19.756 -12.636 6.106 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -21.232 -12.053 6.847 1.00 0.00 H new ATOM 1871 N CYS A 118 -20.138 -16.994 8.869 1.00 0.00 N ATOM 1872 CA CYS A 118 -19.324 -18.203 8.844 1.00 0.00 C ATOM 1873 C CYS A 118 -17.850 -17.864 8.650 1.00 0.00 C ATOM 1874 O CYS A 118 -17.501 -16.728 8.330 1.00 0.00 O ATOM 1875 CB CYS A 118 -19.795 -19.139 7.729 1.00 0.00 C ATOM 1876 SG CYS A 118 -19.541 -20.894 8.081 1.00 0.00 S ATOM 0 H CYS A 118 -20.653 -16.850 9.738 1.00 0.00 H new ATOM 0 HA CYS A 118 -19.439 -18.706 9.804 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -20.856 -18.966 7.548 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -19.269 -18.884 6.809 1.00 0.00 H new ATOM 0 HG CYS A 118 -19.973 -21.604 7.081 1.00 0.00 H new ATOM 1882 N THR A 119 -16.988 -18.857 8.844 1.00 0.00 N ATOM 1883 CA THR A 119 -15.551 -18.663 8.689 1.00 0.00 C ATOM 1884 C THR A 119 -15.211 -18.223 7.269 1.00 0.00 C ATOM 1885 O THR A 119 -16.010 -18.391 6.348 1.00 0.00 O ATOM 1886 CB THR A 119 -14.802 -19.954 9.028 1.00 0.00 C ATOM 1887 OG1 THR A 119 -15.421 -20.623 10.112 1.00 0.00 O ATOM 1888 CG2 THR A 119 -13.353 -19.725 9.397 1.00 0.00 C ATOM 0 H THR A 119 -17.260 -19.804 9.109 1.00 0.00 H new ATOM 0 HA THR A 119 -15.239 -17.878 9.378 1.00 0.00 H new ATOM 0 HB THR A 119 -14.838 -20.556 8.120 1.00 0.00 H new ATOM 0 HG1 THR A 119 -16.077 -21.265 9.769 1.00 0.00 H new ATOM 0 HG21 THR A 119 -12.880 -20.680 9.626 1.00 0.00 H new ATOM 0 HG22 THR A 119 -12.835 -19.255 8.561 1.00 0.00 H new ATOM 0 HG23 THR A 119 -13.298 -19.075 10.270 1.00 0.00 H new ATOM 1896 N VAL A 120 -14.021 -17.658 7.100 1.00 0.00 N ATOM 1897 CA VAL A 120 -13.574 -17.192 5.793 1.00 0.00 C ATOM 1898 C VAL A 120 -14.459 -16.061 5.281 1.00 0.00 C ATOM 1899 O VAL A 120 -13.997 -14.900 5.285 1.00 0.00 O ATOM 1900 CB VAL A 120 -13.573 -18.334 4.759 1.00 0.00 C ATOM 1901 CG1 VAL A 120 -12.918 -17.882 3.463 1.00 0.00 C ATOM 1902 CG2 VAL A 120 -12.870 -19.561 5.321 1.00 0.00 C ATOM 1903 OXT VAL A 120 -15.608 -16.344 4.877 1.00 0.00 O ATOM 0 H VAL A 120 -13.348 -17.512 7.852 1.00 0.00 H new ATOM 0 HA VAL A 120 -12.555 -16.825 5.920 1.00 0.00 H new ATOM 0 HB VAL A 120 -14.607 -18.603 4.541 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -12.927 -18.702 2.745 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -13.469 -17.035 3.053 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -11.888 -17.584 3.660 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -12.879 -20.358 4.577 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -11.839 -19.308 5.570 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -13.388 -19.897 6.219 1.00 0.00 H new TER 1913 VAL A 120