USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 944 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 35 ASN : amide:sc= -4.88! C(o=-7!,f=-12!) USER MOD Set 1.2: A 38 GLN : amide:sc= -2.11 K(o=-7,f=-9!) USER MOD Set 2.1: A 20 ASN : amide:sc= 0 X(o=-0.013,f=-0.33) USER MOD Set 2.2: A 24 ASN :FLIP amide:sc= -0.0129 F(o=-0.62,f=-0.013) USER MOD Single : A 5 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.328) USER MOD Single : A 12 GLN :FLIP amide:sc= -0.585 F(o=-1.8,f=-0.59) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot -30:sc= -3.94! USER MOD Single : A 29 GLN : amide:sc= -0.178 K(o=-0.18,f=-2.8!) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= -0.13 K(o=-0.13,f=-2.1!) USER MOD Single : A 44 THR OG1 : rot 98:sc= 0.801 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 MET CE :methyl -135:sc= -0.238 (180deg=-2.38) USER MOD Single : A 56 LYS NZ :NH3+ -125:sc= 0.15 (180deg=-0.0122) USER MOD Single : A 60 MET CE :methyl 153:sc= -2.92 (180deg=-4.92!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl -161:sc= -6.56! (180deg=-7.19!) USER MOD Single : A 70 LYS NZ :NH3+ -146:sc= -0.665 (180deg=-2.58!) USER MOD Single : A 75 ASN : amide:sc= -0.792 K(o=-0.79,f=-5.6!) USER MOD Single : A 81 MET CE :methyl 156:sc= -1.62 (180deg=-2.66!) USER MOD Single : A 82 THR OG1 : rot -53:sc= 0.439 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot -107:sc= 0.00907! USER MOD Single : A 101 HIS : no HE2:sc= -35.5! C(o=-35!,f=-46!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -159:sc=-0.00401 (180deg=-0.159) USER MOD Single : A 118 TYR OH : rot 150:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 51 N GLU A 4 2.653 -11.948 -2.310 1.00 0.00 N ATOM 52 CA GLU A 4 1.844 -10.706 -2.459 1.00 0.00 C ATOM 53 C GLU A 4 2.720 -9.488 -2.161 1.00 0.00 C ATOM 54 O GLU A 4 2.652 -8.909 -1.095 1.00 0.00 O ATOM 55 CB GLU A 4 0.670 -10.743 -1.477 1.00 0.00 C ATOM 56 CG GLU A 4 1.101 -11.452 -0.192 1.00 0.00 C ATOM 57 CD GLU A 4 -0.115 -11.644 0.716 1.00 0.00 C ATOM 58 OE1 GLU A 4 -1.087 -12.222 0.259 1.00 0.00 O ATOM 59 OE2 GLU A 4 -0.053 -11.212 1.856 1.00 0.00 O ATOM 0 HA GLU A 4 1.464 -10.639 -3.478 1.00 0.00 H new ATOM 0 HB2 GLU A 4 0.338 -9.729 -1.252 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -0.177 -11.263 -1.925 1.00 0.00 H new ATOM 0 HG2 GLU A 4 1.548 -12.418 -0.429 1.00 0.00 H new ATOM 0 HG3 GLU A 4 1.863 -10.866 0.322 1.00 0.00 H new ATOM 66 N LYS A 5 3.541 -9.094 -3.095 1.00 0.00 N ATOM 67 CA LYS A 5 4.419 -7.912 -2.865 1.00 0.00 C ATOM 68 C LYS A 5 3.884 -6.717 -3.656 1.00 0.00 C ATOM 69 O LYS A 5 3.513 -6.837 -4.806 1.00 0.00 O ATOM 70 CB LYS A 5 5.841 -8.235 -3.329 1.00 0.00 C ATOM 71 CG LYS A 5 6.344 -9.486 -2.606 1.00 0.00 C ATOM 72 CD LYS A 5 7.688 -9.912 -3.196 1.00 0.00 C ATOM 73 CE LYS A 5 7.641 -11.398 -3.557 1.00 0.00 C ATOM 74 NZ LYS A 5 7.387 -12.200 -2.328 1.00 0.00 N ATOM 0 H LYS A 5 3.642 -9.539 -4.007 1.00 0.00 H new ATOM 0 HA LYS A 5 4.430 -7.669 -1.803 1.00 0.00 H new ATOM 0 HB2 LYS A 5 5.855 -8.395 -4.407 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.502 -7.393 -3.123 1.00 0.00 H new ATOM 0 HG2 LYS A 5 6.451 -9.284 -1.540 1.00 0.00 H new ATOM 0 HG3 LYS A 5 5.619 -10.293 -2.707 1.00 0.00 H new ATOM 0 HD2 LYS A 5 7.912 -9.319 -4.083 1.00 0.00 H new ATOM 0 HD3 LYS A 5 8.487 -9.727 -2.478 1.00 0.00 H new ATOM 0 HE2 LYS A 5 6.856 -11.580 -4.291 1.00 0.00 H new ATOM 0 HE3 LYS A 5 8.583 -11.702 -4.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 7.761 -13.162 -2.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 7.859 -11.752 -1.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 6.363 -12.247 -2.150 1.00 0.00 H new ATOM 88 N ILE A 6 3.840 -5.563 -3.047 1.00 0.00 N ATOM 89 CA ILE A 6 3.327 -4.362 -3.765 1.00 0.00 C ATOM 90 C ILE A 6 4.016 -3.109 -3.220 1.00 0.00 C ATOM 91 O ILE A 6 4.334 -3.023 -2.050 1.00 0.00 O ATOM 92 CB ILE A 6 1.817 -4.246 -3.550 1.00 0.00 C ATOM 93 CG1 ILE A 6 1.127 -5.496 -4.101 1.00 0.00 C ATOM 94 CG2 ILE A 6 1.291 -3.010 -4.282 1.00 0.00 C ATOM 95 CD1 ILE A 6 -0.380 -5.399 -3.853 1.00 0.00 C ATOM 0 H ILE A 6 4.137 -5.400 -2.085 1.00 0.00 H new ATOM 0 HA ILE A 6 3.537 -4.459 -4.830 1.00 0.00 H new ATOM 0 HB ILE A 6 1.608 -4.154 -2.484 1.00 0.00 H new ATOM 0 HG12 ILE A 6 1.325 -5.593 -5.168 1.00 0.00 H new ATOM 0 HG13 ILE A 6 1.529 -6.388 -3.620 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.215 -2.927 -4.129 1.00 0.00 H new ATOM 0 HG22 ILE A 6 1.783 -2.119 -3.891 1.00 0.00 H new ATOM 0 HG23 ILE A 6 1.500 -3.102 -5.348 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -0.871 -6.289 -4.245 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -0.568 -5.323 -2.782 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -0.775 -4.516 -4.355 1.00 0.00 H new ATOM 107 N LEU A 7 4.249 -2.137 -4.058 1.00 0.00 N ATOM 108 CA LEU A 7 4.915 -0.890 -3.588 1.00 0.00 C ATOM 109 C LEU A 7 4.041 0.316 -3.938 1.00 0.00 C ATOM 110 O LEU A 7 3.555 0.440 -5.043 1.00 0.00 O ATOM 111 CB LEU A 7 6.276 -0.749 -4.274 1.00 0.00 C ATOM 112 CG LEU A 7 7.054 0.404 -3.637 1.00 0.00 C ATOM 113 CD1 LEU A 7 8.221 -0.156 -2.823 1.00 0.00 C ATOM 114 CD2 LEU A 7 7.597 1.319 -4.735 1.00 0.00 C ATOM 0 H LEU A 7 4.007 -2.152 -5.049 1.00 0.00 H new ATOM 0 HA LEU A 7 5.055 -0.937 -2.508 1.00 0.00 H new ATOM 0 HB2 LEU A 7 6.840 -1.677 -4.180 1.00 0.00 H new ATOM 0 HB3 LEU A 7 6.140 -0.565 -5.340 1.00 0.00 H new ATOM 0 HG LEU A 7 6.391 0.971 -2.983 1.00 0.00 H new ATOM 0 HD11 LEU A 7 8.775 0.665 -2.369 1.00 0.00 H new ATOM 0 HD12 LEU A 7 7.838 -0.811 -2.041 1.00 0.00 H new ATOM 0 HD13 LEU A 7 8.883 -0.722 -3.478 1.00 0.00 H new ATOM 0 HD21 LEU A 7 8.152 2.141 -4.282 1.00 0.00 H new ATOM 0 HD22 LEU A 7 8.259 0.750 -5.388 1.00 0.00 H new ATOM 0 HD23 LEU A 7 6.768 1.719 -5.319 1.00 0.00 H new ATOM 126 N ILE A 8 3.834 1.205 -3.005 1.00 0.00 N ATOM 127 CA ILE A 8 2.989 2.399 -3.292 1.00 0.00 C ATOM 128 C ILE A 8 3.886 3.618 -3.514 1.00 0.00 C ATOM 129 O ILE A 8 4.557 4.080 -2.613 1.00 0.00 O ATOM 130 CB ILE A 8 2.058 2.660 -2.107 1.00 0.00 C ATOM 131 CG1 ILE A 8 1.279 1.382 -1.783 1.00 0.00 C ATOM 132 CG2 ILE A 8 1.075 3.777 -2.466 1.00 0.00 C ATOM 133 CD1 ILE A 8 0.184 1.695 -0.762 1.00 0.00 C ATOM 0 H ILE A 8 4.212 1.157 -2.059 1.00 0.00 H new ATOM 0 HA ILE A 8 2.396 2.217 -4.188 1.00 0.00 H new ATOM 0 HB ILE A 8 2.647 2.959 -1.240 1.00 0.00 H new ATOM 0 HG12 ILE A 8 0.837 0.973 -2.692 1.00 0.00 H new ATOM 0 HG13 ILE A 8 1.954 0.623 -1.387 1.00 0.00 H new ATOM 0 HG21 ILE A 8 0.411 3.963 -1.622 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.628 4.687 -2.700 1.00 0.00 H new ATOM 0 HG23 ILE A 8 0.485 3.478 -3.332 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -0.370 0.785 -0.532 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.637 2.084 0.150 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -0.497 2.439 -1.175 1.00 0.00 H new ATOM 145 N VAL A 9 3.905 4.144 -4.709 1.00 0.00 N ATOM 146 CA VAL A 9 4.760 5.332 -4.987 1.00 0.00 C ATOM 147 C VAL A 9 3.879 6.578 -5.102 1.00 0.00 C ATOM 148 O VAL A 9 3.350 6.881 -6.153 1.00 0.00 O ATOM 149 CB VAL A 9 5.517 5.119 -6.299 1.00 0.00 C ATOM 150 CG1 VAL A 9 6.591 6.199 -6.449 1.00 0.00 C ATOM 151 CG2 VAL A 9 6.180 3.740 -6.286 1.00 0.00 C ATOM 0 H VAL A 9 3.365 3.802 -5.504 1.00 0.00 H new ATOM 0 HA VAL A 9 5.473 5.465 -4.174 1.00 0.00 H new ATOM 0 HB VAL A 9 4.820 5.180 -7.135 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.131 6.048 -7.384 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.120 7.182 -6.457 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.288 6.137 -5.613 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.720 3.587 -7.221 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.877 3.679 -5.450 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.416 2.970 -6.178 1.00 0.00 H new ATOM 161 N ASP A 10 3.718 7.303 -4.030 1.00 0.00 N ATOM 162 CA ASP A 10 2.872 8.530 -4.078 1.00 0.00 C ATOM 163 C ASP A 10 3.454 9.588 -3.138 1.00 0.00 C ATOM 164 O ASP A 10 3.523 9.398 -1.941 1.00 0.00 O ATOM 165 CB ASP A 10 1.448 8.184 -3.638 1.00 0.00 C ATOM 166 CG ASP A 10 0.591 9.450 -3.644 1.00 0.00 C ATOM 167 OD1 ASP A 10 0.245 9.903 -4.723 1.00 0.00 O ATOM 168 OD2 ASP A 10 0.294 9.947 -2.570 1.00 0.00 O ATOM 0 H ASP A 10 4.136 7.099 -3.122 1.00 0.00 H new ATOM 0 HA ASP A 10 2.853 8.920 -5.096 1.00 0.00 H new ATOM 0 HB2 ASP A 10 1.020 7.439 -4.308 1.00 0.00 H new ATOM 0 HB3 ASP A 10 1.461 7.745 -2.640 1.00 0.00 H new ATOM 173 N ASP A 11 3.874 10.702 -3.672 1.00 0.00 N ATOM 174 CA ASP A 11 4.451 11.770 -2.808 1.00 0.00 C ATOM 175 C ASP A 11 3.320 12.526 -2.107 1.00 0.00 C ATOM 176 O ASP A 11 3.373 12.781 -0.920 1.00 0.00 O ATOM 177 CB ASP A 11 5.259 12.743 -3.669 1.00 0.00 C ATOM 178 CG ASP A 11 4.306 13.592 -4.512 1.00 0.00 C ATOM 179 OD1 ASP A 11 3.740 13.056 -5.451 1.00 0.00 O ATOM 180 OD2 ASP A 11 4.157 14.762 -4.203 1.00 0.00 O ATOM 0 H ASP A 11 3.843 10.919 -4.668 1.00 0.00 H new ATOM 0 HA ASP A 11 5.104 11.319 -2.061 1.00 0.00 H new ATOM 0 HB2 ASP A 11 5.870 13.385 -3.035 1.00 0.00 H new ATOM 0 HB3 ASP A 11 5.941 12.192 -4.316 1.00 0.00 H new ATOM 185 N GLN A 12 2.298 12.888 -2.833 1.00 0.00 N ATOM 186 CA GLN A 12 1.166 13.629 -2.208 1.00 0.00 C ATOM 187 C GLN A 12 0.608 12.816 -1.039 1.00 0.00 C ATOM 188 O GLN A 12 -0.139 11.875 -1.226 1.00 0.00 O ATOM 189 CB GLN A 12 0.067 13.850 -3.249 1.00 0.00 C ATOM 190 CG GLN A 12 -0.439 12.497 -3.753 1.00 0.00 C ATOM 191 CD GLN A 12 -0.971 12.648 -5.180 1.00 0.00 C ATOM 192 OE1 GLN A 12 -1.563 13.758 -5.528 1.00 0.00 O flip ATOM 193 NE2 GLN A 12 -0.846 11.748 -5.985 1.00 0.00 N flip ATOM 0 H GLN A 12 2.198 12.703 -3.831 1.00 0.00 H new ATOM 0 HA GLN A 12 1.519 14.593 -1.842 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -0.754 14.417 -2.811 1.00 0.00 H new ATOM 0 HB3 GLN A 12 0.453 14.439 -4.081 1.00 0.00 H new ATOM 0 HG2 GLN A 12 0.368 11.764 -3.730 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -1.227 12.125 -3.098 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -0.383 10.881 -5.713 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -1.204 11.859 -6.934 1.00 0.00 H new ATOM 202 N TYR A 13 0.964 13.170 0.165 1.00 0.00 N ATOM 203 CA TYR A 13 0.452 12.417 1.345 1.00 0.00 C ATOM 204 C TYR A 13 -1.052 12.188 1.191 1.00 0.00 C ATOM 205 O TYR A 13 -1.774 13.041 0.713 1.00 0.00 O ATOM 206 CB TYR A 13 0.717 13.223 2.618 1.00 0.00 C ATOM 207 CG TYR A 13 0.983 12.278 3.766 1.00 0.00 C ATOM 208 CD1 TYR A 13 2.218 11.628 3.866 1.00 0.00 C ATOM 209 CD2 TYR A 13 -0.007 12.054 4.730 1.00 0.00 C ATOM 210 CE1 TYR A 13 2.463 10.752 4.930 1.00 0.00 C ATOM 211 CE2 TYR A 13 0.239 11.178 5.794 1.00 0.00 C ATOM 212 CZ TYR A 13 1.474 10.527 5.894 1.00 0.00 C ATOM 213 OH TYR A 13 1.716 9.664 6.943 1.00 0.00 O ATOM 0 H TYR A 13 1.587 13.948 0.383 1.00 0.00 H new ATOM 0 HA TYR A 13 0.961 11.455 1.411 1.00 0.00 H new ATOM 0 HB2 TYR A 13 1.571 13.884 2.472 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.141 13.856 2.845 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.982 11.802 3.123 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -0.960 12.557 4.653 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.416 10.250 5.007 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -0.524 11.004 6.538 1.00 0.00 H new ATOM 0 HH TYR A 13 0.926 9.623 7.522 1.00 0.00 H new ATOM 223 N GLY A 14 -1.531 11.042 1.591 1.00 0.00 N ATOM 224 CA GLY A 14 -2.990 10.760 1.466 1.00 0.00 C ATOM 225 C GLY A 14 -3.192 9.379 0.840 1.00 0.00 C ATOM 226 O GLY A 14 -3.892 8.541 1.373 1.00 0.00 O ATOM 0 H GLY A 14 -0.976 10.289 1.999 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -3.464 10.799 2.447 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -3.467 11.523 0.851 1.00 0.00 H new ATOM 230 N ILE A 15 -2.584 9.135 -0.288 1.00 0.00 N ATOM 231 CA ILE A 15 -2.742 7.809 -0.948 1.00 0.00 C ATOM 232 C ILE A 15 -1.907 6.765 -0.201 1.00 0.00 C ATOM 233 O ILE A 15 -2.403 5.733 0.203 1.00 0.00 O ATOM 234 CB ILE A 15 -2.265 7.902 -2.399 1.00 0.00 C ATOM 235 CG1 ILE A 15 -3.290 8.685 -3.221 1.00 0.00 C ATOM 236 CG2 ILE A 15 -2.114 6.495 -2.983 1.00 0.00 C ATOM 237 CD1 ILE A 15 -2.827 10.135 -3.371 1.00 0.00 C ATOM 0 H ILE A 15 -1.985 9.797 -0.781 1.00 0.00 H new ATOM 0 HA ILE A 15 -3.792 7.516 -0.929 1.00 0.00 H new ATOM 0 HB ILE A 15 -1.302 8.412 -2.431 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.410 8.227 -4.203 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.264 8.652 -2.733 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.774 6.565 -4.016 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.385 5.935 -2.398 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.076 5.983 -2.951 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.558 10.692 -3.957 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.730 10.590 -2.385 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.862 10.158 -3.878 1.00 0.00 H new ATOM 249 N ARG A 16 -0.643 7.027 -0.014 1.00 0.00 N ATOM 250 CA ARG A 16 0.221 6.051 0.706 1.00 0.00 C ATOM 251 C ARG A 16 -0.516 5.525 1.940 1.00 0.00 C ATOM 252 O ARG A 16 -0.261 4.431 2.407 1.00 0.00 O ATOM 253 CB ARG A 16 1.514 6.742 1.143 1.00 0.00 C ATOM 254 CG ARG A 16 2.693 6.162 0.360 1.00 0.00 C ATOM 255 CD ARG A 16 3.239 7.220 -0.600 1.00 0.00 C ATOM 256 NE ARG A 16 4.671 7.488 -0.283 1.00 0.00 N ATOM 257 CZ ARG A 16 4.989 8.250 0.730 1.00 0.00 C ATOM 258 NH1 ARG A 16 4.055 8.782 1.472 1.00 0.00 N ATOM 259 NH2 ARG A 16 6.244 8.480 1.001 1.00 0.00 N ATOM 0 H ARG A 16 -0.171 7.875 -0.329 1.00 0.00 H new ATOM 0 HA ARG A 16 0.457 5.219 0.043 1.00 0.00 H new ATOM 0 HB2 ARG A 16 1.442 7.816 0.969 1.00 0.00 H new ATOM 0 HB3 ARG A 16 1.670 6.602 2.213 1.00 0.00 H new ATOM 0 HG2 ARG A 16 3.476 5.840 1.047 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.375 5.280 -0.197 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.142 6.877 -1.630 1.00 0.00 H new ATOM 0 HD3 ARG A 16 2.658 8.139 -0.514 1.00 0.00 H new ATOM 0 HE ARG A 16 5.405 7.075 -0.859 1.00 0.00 H new ATOM 0 HH11 ARG A 16 3.073 8.603 1.262 1.00 0.00 H new ATOM 0 HH12 ARG A 16 4.308 9.376 2.262 1.00 0.00 H new ATOM 0 HH21 ARG A 16 6.975 8.065 0.423 1.00 0.00 H new ATOM 0 HH22 ARG A 16 6.494 9.074 1.791 1.00 0.00 H new ATOM 273 N ILE A 17 -1.423 6.294 2.476 1.00 0.00 N ATOM 274 CA ILE A 17 -2.170 5.836 3.681 1.00 0.00 C ATOM 275 C ILE A 17 -3.434 5.087 3.256 1.00 0.00 C ATOM 276 O ILE A 17 -3.614 3.928 3.569 1.00 0.00 O ATOM 277 CB ILE A 17 -2.558 7.048 4.530 1.00 0.00 C ATOM 278 CG1 ILE A 17 -1.460 8.109 4.436 1.00 0.00 C ATOM 279 CG2 ILE A 17 -2.727 6.618 5.988 1.00 0.00 C ATOM 280 CD1 ILE A 17 -1.777 9.259 5.393 1.00 0.00 C ATOM 0 H ILE A 17 -1.679 7.219 2.132 1.00 0.00 H new ATOM 0 HA ILE A 17 -1.536 5.168 4.264 1.00 0.00 H new ATOM 0 HB ILE A 17 -3.497 7.462 4.163 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.494 7.670 4.685 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -1.387 8.482 3.414 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -3.003 7.482 6.592 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -3.509 5.862 6.056 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.789 6.203 6.356 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -0.994 10.015 5.326 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -2.735 9.704 5.123 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -1.828 8.880 6.414 1.00 0.00 H new ATOM 292 N LEU A 18 -4.314 5.739 2.549 1.00 0.00 N ATOM 293 CA LEU A 18 -5.568 5.063 2.112 1.00 0.00 C ATOM 294 C LEU A 18 -5.234 3.725 1.447 1.00 0.00 C ATOM 295 O LEU A 18 -5.655 2.678 1.895 1.00 0.00 O ATOM 296 CB LEU A 18 -6.307 5.958 1.113 1.00 0.00 C ATOM 297 CG LEU A 18 -7.450 6.683 1.824 1.00 0.00 C ATOM 298 CD1 LEU A 18 -6.934 8.000 2.409 1.00 0.00 C ATOM 299 CD2 LEU A 18 -8.568 6.974 0.822 1.00 0.00 C ATOM 0 H LEU A 18 -4.219 6.711 2.255 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.200 4.883 2.981 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.618 6.682 0.679 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.698 5.358 0.292 1.00 0.00 H new ATOM 0 HG LEU A 18 -7.835 6.055 2.628 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.749 8.517 2.916 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.136 7.793 3.122 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.549 8.629 1.606 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.384 7.491 1.327 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.182 7.602 0.019 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.936 6.037 0.405 1.00 0.00 H new ATOM 311 N LEU A 19 -4.485 3.753 0.379 1.00 0.00 N ATOM 312 CA LEU A 19 -4.131 2.482 -0.316 1.00 0.00 C ATOM 313 C LEU A 19 -3.449 1.525 0.665 1.00 0.00 C ATOM 314 O LEU A 19 -3.459 0.324 0.482 1.00 0.00 O ATOM 315 CB LEU A 19 -3.179 2.787 -1.474 1.00 0.00 C ATOM 316 CG LEU A 19 -3.761 2.229 -2.773 1.00 0.00 C ATOM 317 CD1 LEU A 19 -5.177 2.774 -2.974 1.00 0.00 C ATOM 318 CD2 LEU A 19 -2.881 2.655 -3.950 1.00 0.00 C ATOM 0 H LEU A 19 -4.103 4.600 -0.042 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.039 2.016 -0.699 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.030 3.863 -1.563 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.202 2.345 -1.281 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.794 1.141 -2.718 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -5.592 2.376 -3.900 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -5.805 2.472 -2.136 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.144 3.862 -3.029 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.295 2.258 -4.877 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.848 3.743 -4.005 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.872 2.268 -3.808 1.00 0.00 H new ATOM 330 N ASN A 20 -2.853 2.044 1.703 1.00 0.00 N ATOM 331 CA ASN A 20 -2.170 1.160 2.689 1.00 0.00 C ATOM 332 C ASN A 20 -3.212 0.394 3.508 1.00 0.00 C ATOM 333 O ASN A 20 -3.360 -0.804 3.373 1.00 0.00 O ATOM 334 CB ASN A 20 -1.309 2.010 3.626 1.00 0.00 C ATOM 335 CG ASN A 20 -0.751 1.130 4.746 1.00 0.00 C ATOM 336 OD1 ASN A 20 -0.149 0.107 4.488 1.00 0.00 O ATOM 337 ND2 ASN A 20 -0.926 1.487 5.989 1.00 0.00 N ATOM 0 H ASN A 20 -2.809 3.042 1.911 1.00 0.00 H new ATOM 0 HA ASN A 20 -1.538 0.449 2.157 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -0.492 2.470 3.069 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -1.903 2.820 4.048 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -0.557 0.907 6.743 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -1.431 2.346 6.207 1.00 0.00 H new ATOM 344 N GLU A 21 -3.931 1.074 4.358 1.00 0.00 N ATOM 345 CA GLU A 21 -4.959 0.383 5.188 1.00 0.00 C ATOM 346 C GLU A 21 -5.812 -0.527 4.301 1.00 0.00 C ATOM 347 O GLU A 21 -6.142 -1.637 4.670 1.00 0.00 O ATOM 348 CB GLU A 21 -5.857 1.426 5.859 1.00 0.00 C ATOM 349 CG GLU A 21 -5.717 1.317 7.379 1.00 0.00 C ATOM 350 CD GLU A 21 -6.972 1.880 8.049 1.00 0.00 C ATOM 351 OE1 GLU A 21 -7.409 2.944 7.642 1.00 0.00 O ATOM 352 OE2 GLU A 21 -7.474 1.237 8.956 1.00 0.00 O ATOM 0 H GLU A 21 -3.851 2.079 4.514 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.463 -0.218 5.950 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.580 2.427 5.528 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -6.895 1.270 5.567 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.574 0.276 7.668 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -4.836 1.865 7.714 1.00 0.00 H new ATOM 359 N VAL A 22 -6.174 -0.066 3.136 1.00 0.00 N ATOM 360 CA VAL A 22 -7.008 -0.905 2.229 1.00 0.00 C ATOM 361 C VAL A 22 -6.303 -2.238 1.970 1.00 0.00 C ATOM 362 O VAL A 22 -6.817 -3.294 2.283 1.00 0.00 O ATOM 363 CB VAL A 22 -7.214 -0.171 0.902 1.00 0.00 C ATOM 364 CG1 VAL A 22 -8.167 -0.975 0.016 1.00 0.00 C ATOM 365 CG2 VAL A 22 -7.813 1.209 1.172 1.00 0.00 C ATOM 0 H VAL A 22 -5.929 0.855 2.772 1.00 0.00 H new ATOM 0 HA VAL A 22 -7.975 -1.092 2.696 1.00 0.00 H new ATOM 0 HB VAL A 22 -6.255 -0.059 0.396 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -8.314 -0.452 -0.929 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -7.741 -1.960 -0.176 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -9.126 -1.087 0.521 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -7.960 1.733 0.228 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -8.772 1.097 1.678 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -7.135 1.783 1.803 1.00 0.00 H new ATOM 375 N PHE A 23 -5.129 -2.199 1.403 1.00 0.00 N ATOM 376 CA PHE A 23 -4.394 -3.465 1.126 1.00 0.00 C ATOM 377 C PHE A 23 -3.939 -4.094 2.445 1.00 0.00 C ATOM 378 O PHE A 23 -3.420 -5.192 2.473 1.00 0.00 O ATOM 379 CB PHE A 23 -3.171 -3.165 0.256 1.00 0.00 C ATOM 380 CG PHE A 23 -3.623 -2.654 -1.092 1.00 0.00 C ATOM 381 CD1 PHE A 23 -4.735 -3.227 -1.722 1.00 0.00 C ATOM 382 CD2 PHE A 23 -2.929 -1.609 -1.713 1.00 0.00 C ATOM 383 CE1 PHE A 23 -5.153 -2.754 -2.971 1.00 0.00 C ATOM 384 CE2 PHE A 23 -3.347 -1.136 -2.962 1.00 0.00 C ATOM 385 CZ PHE A 23 -4.459 -1.708 -3.592 1.00 0.00 C ATOM 0 H PHE A 23 -4.647 -1.346 1.120 1.00 0.00 H new ATOM 0 HA PHE A 23 -5.053 -4.158 0.603 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -2.538 -2.424 0.744 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -2.570 -4.066 0.132 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -5.270 -4.034 -1.244 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -2.071 -1.168 -1.228 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -6.011 -3.196 -3.456 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -2.812 -0.329 -3.440 1.00 0.00 H new ATOM 0 HZ PHE A 23 -4.781 -1.343 -4.556 1.00 0.00 H new ATOM 395 N ASN A 24 -4.133 -3.409 3.540 1.00 0.00 N ATOM 396 CA ASN A 24 -3.711 -3.972 4.853 1.00 0.00 C ATOM 397 C ASN A 24 -4.730 -5.022 5.304 1.00 0.00 C ATOM 398 O ASN A 24 -4.388 -6.153 5.582 1.00 0.00 O ATOM 399 CB ASN A 24 -3.642 -2.850 5.892 1.00 0.00 C ATOM 400 CG ASN A 24 -2.205 -2.336 5.993 1.00 0.00 C ATOM 401 OD1 ASN A 24 -1.437 -2.371 4.939 1.00 0.00 O flip ATOM 402 ND2 ASN A 24 -1.776 -1.899 7.042 1.00 0.00 N flip ATOM 0 H ASN A 24 -4.565 -2.486 3.581 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.729 -4.434 4.753 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.311 -2.037 5.610 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -3.977 -3.217 6.862 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -2.376 -1.871 7.866 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -0.816 -1.560 7.098 1.00 0.00 H new ATOM 409 N LYS A 25 -5.980 -4.655 5.374 1.00 0.00 N ATOM 410 CA LYS A 25 -7.019 -5.633 5.803 1.00 0.00 C ATOM 411 C LYS A 25 -7.355 -6.559 4.633 1.00 0.00 C ATOM 412 O LYS A 25 -8.007 -7.571 4.796 1.00 0.00 O ATOM 413 CB LYS A 25 -8.280 -4.882 6.238 1.00 0.00 C ATOM 414 CG LYS A 25 -8.637 -5.270 7.674 1.00 0.00 C ATOM 415 CD LYS A 25 -10.063 -4.814 7.987 1.00 0.00 C ATOM 416 CE LYS A 25 -11.060 -5.733 7.277 1.00 0.00 C ATOM 417 NZ LYS A 25 -12.412 -5.555 7.878 1.00 0.00 N ATOM 0 H LYS A 25 -6.326 -3.721 5.153 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.642 -6.222 6.639 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.117 -3.806 6.171 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.107 -5.121 5.569 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.553 -6.349 7.802 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.936 -4.811 8.371 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.235 -4.835 9.063 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.206 -3.784 7.662 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.090 -5.502 6.212 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.743 -6.772 7.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.091 -6.179 7.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.377 -5.796 8.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.713 -4.566 7.768 1.00 0.00 H new ATOM 431 N GLU A 26 -6.913 -6.221 3.452 1.00 0.00 N ATOM 432 CA GLU A 26 -7.203 -7.080 2.271 1.00 0.00 C ATOM 433 C GLU A 26 -6.283 -8.301 2.291 1.00 0.00 C ATOM 434 O GLU A 26 -6.705 -9.414 2.046 1.00 0.00 O ATOM 435 CB GLU A 26 -6.963 -6.280 0.989 1.00 0.00 C ATOM 436 CG GLU A 26 -8.280 -5.659 0.520 1.00 0.00 C ATOM 437 CD GLU A 26 -8.962 -6.598 -0.476 1.00 0.00 C ATOM 438 OE1 GLU A 26 -8.323 -7.548 -0.898 1.00 0.00 O ATOM 439 OE2 GLU A 26 -10.112 -6.351 -0.800 1.00 0.00 O ATOM 0 H GLU A 26 -6.363 -5.385 3.255 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.242 -7.408 2.305 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -6.224 -5.499 1.168 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -6.558 -6.930 0.213 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.934 -5.480 1.373 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.092 -4.692 0.054 1.00 0.00 H new ATOM 446 N GLY A 27 -5.026 -8.103 2.583 1.00 0.00 N ATOM 447 CA GLY A 27 -4.078 -9.252 2.618 1.00 0.00 C ATOM 448 C GLY A 27 -2.981 -9.041 1.574 1.00 0.00 C ATOM 449 O GLY A 27 -2.698 -9.910 0.773 1.00 0.00 O ATOM 0 H GLY A 27 -4.615 -7.195 2.799 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.637 -9.343 3.611 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.610 -10.182 2.419 1.00 0.00 H new ATOM 453 N TYR A 28 -2.360 -7.894 1.575 1.00 0.00 N ATOM 454 CA TYR A 28 -1.282 -7.629 0.582 1.00 0.00 C ATOM 455 C TYR A 28 -0.147 -6.852 1.254 1.00 0.00 C ATOM 456 O TYR A 28 -0.376 -5.967 2.054 1.00 0.00 O ATOM 457 CB TYR A 28 -1.847 -6.803 -0.576 1.00 0.00 C ATOM 458 CG TYR A 28 -2.926 -7.590 -1.278 1.00 0.00 C ATOM 459 CD1 TYR A 28 -2.587 -8.482 -2.302 1.00 0.00 C ATOM 460 CD2 TYR A 28 -4.266 -7.427 -0.906 1.00 0.00 C ATOM 461 CE1 TYR A 28 -3.588 -9.212 -2.954 1.00 0.00 C ATOM 462 CE2 TYR A 28 -5.267 -8.157 -1.559 1.00 0.00 C ATOM 463 CZ TYR A 28 -4.927 -9.050 -2.583 1.00 0.00 C ATOM 464 OH TYR A 28 -5.913 -9.769 -3.226 1.00 0.00 O ATOM 0 H TYR A 28 -2.553 -7.129 2.221 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.899 -8.576 0.202 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -2.253 -5.863 -0.202 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -1.052 -6.550 -1.278 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -1.553 -8.607 -2.589 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -4.527 -6.739 -0.116 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -3.326 -9.901 -3.744 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -6.301 -8.031 -1.273 1.00 0.00 H new ATOM 0 HH TYR A 28 -5.638 -9.947 -4.150 1.00 0.00 H new ATOM 474 N GLN A 29 1.076 -7.173 0.932 1.00 0.00 N ATOM 475 CA GLN A 29 2.222 -6.451 1.549 1.00 0.00 C ATOM 476 C GLN A 29 2.582 -5.241 0.684 1.00 0.00 C ATOM 477 O GLN A 29 3.480 -5.294 -0.132 1.00 0.00 O ATOM 478 CB GLN A 29 3.428 -7.389 1.642 1.00 0.00 C ATOM 479 CG GLN A 29 2.990 -8.727 2.240 1.00 0.00 C ATOM 480 CD GLN A 29 2.779 -8.568 3.746 1.00 0.00 C ATOM 481 OE1 GLN A 29 2.983 -7.501 4.291 1.00 0.00 O ATOM 482 NE2 GLN A 29 2.377 -9.593 4.449 1.00 0.00 N ATOM 0 H GLN A 29 1.330 -7.904 0.268 1.00 0.00 H new ATOM 0 HA GLN A 29 1.946 -6.117 2.549 1.00 0.00 H new ATOM 0 HB2 GLN A 29 3.858 -7.544 0.653 1.00 0.00 H new ATOM 0 HB3 GLN A 29 4.205 -6.939 2.260 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.068 -9.065 1.767 1.00 0.00 H new ATOM 0 HG3 GLN A 29 3.745 -9.489 2.046 1.00 0.00 H new ATOM 0 HE21 GLN A 29 2.206 -10.489 3.992 1.00 0.00 H new ATOM 0 HE22 GLN A 29 2.235 -9.497 5.454 1.00 0.00 H new ATOM 491 N THR A 30 1.885 -4.151 0.855 1.00 0.00 N ATOM 492 CA THR A 30 2.184 -2.940 0.039 1.00 0.00 C ATOM 493 C THR A 30 3.227 -2.082 0.759 1.00 0.00 C ATOM 494 O THR A 30 3.349 -2.119 1.967 1.00 0.00 O ATOM 495 CB THR A 30 0.902 -2.128 -0.154 1.00 0.00 C ATOM 496 OG1 THR A 30 0.652 -1.356 1.012 1.00 0.00 O ATOM 497 CG2 THR A 30 -0.273 -3.076 -0.402 1.00 0.00 C ATOM 0 H THR A 30 1.122 -4.047 1.524 1.00 0.00 H new ATOM 0 HA THR A 30 2.573 -3.244 -0.933 1.00 0.00 H new ATOM 0 HB THR A 30 1.018 -1.465 -1.011 1.00 0.00 H new ATOM 0 HG1 THR A 30 -0.168 -0.834 0.889 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.186 -2.496 -0.539 1.00 0.00 H new ATOM 0 HG22 THR A 30 -0.081 -3.667 -1.297 1.00 0.00 H new ATOM 0 HG23 THR A 30 -0.391 -3.741 0.454 1.00 0.00 H new ATOM 505 N PHE A 31 3.981 -1.309 0.025 1.00 0.00 N ATOM 506 CA PHE A 31 5.015 -0.449 0.666 1.00 0.00 C ATOM 507 C PHE A 31 4.736 1.017 0.327 1.00 0.00 C ATOM 508 O PHE A 31 3.629 1.386 -0.014 1.00 0.00 O ATOM 509 CB PHE A 31 6.398 -0.837 0.143 1.00 0.00 C ATOM 510 CG PHE A 31 6.487 -2.338 0.017 1.00 0.00 C ATOM 511 CD1 PHE A 31 6.252 -3.151 1.132 1.00 0.00 C ATOM 512 CD2 PHE A 31 6.805 -2.918 -1.218 1.00 0.00 C ATOM 513 CE1 PHE A 31 6.336 -4.543 1.013 1.00 0.00 C ATOM 514 CE2 PHE A 31 6.888 -4.310 -1.337 1.00 0.00 C ATOM 515 CZ PHE A 31 6.654 -5.123 -0.222 1.00 0.00 C ATOM 0 H PHE A 31 3.925 -1.236 -0.991 1.00 0.00 H new ATOM 0 HA PHE A 31 4.984 -0.587 1.747 1.00 0.00 H new ATOM 0 HB2 PHE A 31 6.576 -0.369 -0.825 1.00 0.00 H new ATOM 0 HB3 PHE A 31 7.170 -0.472 0.820 1.00 0.00 H new ATOM 0 HD1 PHE A 31 6.006 -2.704 2.084 1.00 0.00 H new ATOM 0 HD2 PHE A 31 6.986 -2.291 -2.078 1.00 0.00 H new ATOM 0 HE1 PHE A 31 6.156 -5.170 1.873 1.00 0.00 H new ATOM 0 HE2 PHE A 31 7.133 -4.757 -2.289 1.00 0.00 H new ATOM 0 HZ PHE A 31 6.719 -6.197 -0.314 1.00 0.00 H new ATOM 525 N GLN A 32 5.731 1.857 0.417 1.00 0.00 N ATOM 526 CA GLN A 32 5.518 3.296 0.100 1.00 0.00 C ATOM 527 C GLN A 32 6.765 3.863 -0.583 1.00 0.00 C ATOM 528 O GLN A 32 7.853 3.338 -0.450 1.00 0.00 O ATOM 529 CB GLN A 32 5.249 4.070 1.392 1.00 0.00 C ATOM 530 CG GLN A 32 3.927 3.601 2.002 1.00 0.00 C ATOM 531 CD GLN A 32 3.887 3.974 3.485 1.00 0.00 C ATOM 532 OE1 GLN A 32 4.913 4.050 4.131 1.00 0.00 O ATOM 533 NE2 GLN A 32 2.737 4.209 4.056 1.00 0.00 N ATOM 0 H GLN A 32 6.680 1.609 0.696 1.00 0.00 H new ATOM 0 HA GLN A 32 4.663 3.395 -0.569 1.00 0.00 H new ATOM 0 HB2 GLN A 32 6.064 3.913 2.099 1.00 0.00 H new ATOM 0 HB3 GLN A 32 5.207 5.140 1.186 1.00 0.00 H new ATOM 0 HG2 GLN A 32 3.089 4.061 1.478 1.00 0.00 H new ATOM 0 HG3 GLN A 32 3.823 2.522 1.885 1.00 0.00 H new ATOM 0 HE21 GLN A 32 1.876 4.145 3.513 1.00 0.00 H new ATOM 0 HE22 GLN A 32 2.700 4.457 5.045 1.00 0.00 H new ATOM 542 N ALA A 33 6.614 4.935 -1.312 1.00 0.00 N ATOM 543 CA ALA A 33 7.786 5.543 -2.004 1.00 0.00 C ATOM 544 C ALA A 33 7.378 6.895 -2.593 1.00 0.00 C ATOM 545 O ALA A 33 6.209 7.178 -2.765 1.00 0.00 O ATOM 546 CB ALA A 33 8.255 4.616 -3.128 1.00 0.00 C ATOM 0 H ALA A 33 5.727 5.417 -1.459 1.00 0.00 H new ATOM 0 HA ALA A 33 8.598 5.684 -1.291 1.00 0.00 H new ATOM 0 HB1 ALA A 33 9.112 5.061 -3.633 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.542 3.652 -2.708 1.00 0.00 H new ATOM 0 HB3 ALA A 33 7.445 4.474 -3.844 1.00 0.00 H new ATOM 552 N ALA A 34 8.329 7.733 -2.903 1.00 0.00 N ATOM 553 CA ALA A 34 7.986 9.065 -3.476 1.00 0.00 C ATOM 554 C ALA A 34 8.766 9.285 -4.773 1.00 0.00 C ATOM 555 O ALA A 34 8.195 9.508 -5.822 1.00 0.00 O ATOM 556 CB ALA A 34 8.348 10.160 -2.471 1.00 0.00 C ATOM 0 H ALA A 34 9.326 7.554 -2.785 1.00 0.00 H new ATOM 0 HA ALA A 34 6.917 9.103 -3.688 1.00 0.00 H new ATOM 0 HB1 ALA A 34 8.098 11.135 -2.889 1.00 0.00 H new ATOM 0 HB2 ALA A 34 7.789 10.006 -1.548 1.00 0.00 H new ATOM 0 HB3 ALA A 34 9.416 10.120 -2.258 1.00 0.00 H new ATOM 562 N ASN A 35 10.068 9.227 -4.711 1.00 0.00 N ATOM 563 CA ASN A 35 10.882 9.438 -5.942 1.00 0.00 C ATOM 564 C ASN A 35 11.119 8.095 -6.633 1.00 0.00 C ATOM 565 O ASN A 35 11.422 7.105 -5.998 1.00 0.00 O ATOM 566 CB ASN A 35 12.227 10.061 -5.563 1.00 0.00 C ATOM 567 CG ASN A 35 12.897 9.212 -4.480 1.00 0.00 C ATOM 568 OD1 ASN A 35 13.707 8.357 -4.777 1.00 0.00 O ATOM 569 ND2 ASN A 35 12.591 9.413 -3.228 1.00 0.00 N ATOM 0 H ASN A 35 10.603 9.043 -3.862 1.00 0.00 H new ATOM 0 HA ASN A 35 10.350 10.106 -6.619 1.00 0.00 H new ATOM 0 HB2 ASN A 35 12.871 10.124 -6.440 1.00 0.00 H new ATOM 0 HB3 ASN A 35 12.079 11.079 -5.202 1.00 0.00 H new ATOM 0 HD21 ASN A 35 13.032 8.852 -2.499 1.00 0.00 H new ATOM 0 HD22 ASN A 35 11.911 10.131 -2.978 1.00 0.00 H new ATOM 576 N GLY A 36 10.985 8.053 -7.930 1.00 0.00 N ATOM 577 CA GLY A 36 11.209 6.771 -8.657 1.00 0.00 C ATOM 578 C GLY A 36 12.482 6.108 -8.130 1.00 0.00 C ATOM 579 O GLY A 36 12.615 4.900 -8.139 1.00 0.00 O ATOM 0 H GLY A 36 10.731 8.848 -8.517 1.00 0.00 H new ATOM 0 HA2 GLY A 36 10.355 6.107 -8.519 1.00 0.00 H new ATOM 0 HA3 GLY A 36 11.298 6.957 -9.727 1.00 0.00 H new ATOM 583 N LEU A 37 13.418 6.890 -7.667 1.00 0.00 N ATOM 584 CA LEU A 37 14.681 6.308 -7.136 1.00 0.00 C ATOM 585 C LEU A 37 14.349 5.162 -6.180 1.00 0.00 C ATOM 586 O LEU A 37 14.831 4.057 -6.330 1.00 0.00 O ATOM 587 CB LEU A 37 15.466 7.386 -6.387 1.00 0.00 C ATOM 588 CG LEU A 37 16.868 7.508 -6.986 1.00 0.00 C ATOM 589 CD1 LEU A 37 17.422 8.907 -6.710 1.00 0.00 C ATOM 590 CD2 LEU A 37 17.786 6.463 -6.349 1.00 0.00 C ATOM 0 H LEU A 37 13.362 7.908 -7.634 1.00 0.00 H new ATOM 0 HA LEU A 37 15.283 5.931 -7.963 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.946 8.342 -6.454 1.00 0.00 H new ATOM 0 HB3 LEU A 37 15.532 7.133 -5.329 1.00 0.00 H new ATOM 0 HG LEU A 37 16.818 7.343 -8.062 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.421 8.993 -7.137 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.768 9.653 -7.162 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.472 9.073 -5.634 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.786 6.549 -6.775 1.00 0.00 H new ATOM 0 HD22 LEU A 37 17.835 6.629 -5.273 1.00 0.00 H new ATOM 0 HD23 LEU A 37 17.393 5.465 -6.545 1.00 0.00 H new ATOM 602 N GLN A 38 13.525 5.414 -5.199 1.00 0.00 N ATOM 603 CA GLN A 38 13.164 4.335 -4.239 1.00 0.00 C ATOM 604 C GLN A 38 12.451 3.209 -4.986 1.00 0.00 C ATOM 605 O GLN A 38 12.806 2.057 -4.865 1.00 0.00 O ATOM 606 CB GLN A 38 12.235 4.896 -3.165 1.00 0.00 C ATOM 607 CG GLN A 38 13.057 5.643 -2.115 1.00 0.00 C ATOM 608 CD GLN A 38 12.172 6.684 -1.429 1.00 0.00 C ATOM 609 OE1 GLN A 38 12.665 7.638 -0.860 1.00 0.00 O ATOM 610 NE2 GLN A 38 10.875 6.542 -1.460 1.00 0.00 N ATOM 0 H GLN A 38 13.088 6.318 -5.022 1.00 0.00 H new ATOM 0 HA GLN A 38 14.069 3.949 -3.771 1.00 0.00 H new ATOM 0 HB2 GLN A 38 11.505 5.568 -3.616 1.00 0.00 H new ATOM 0 HB3 GLN A 38 11.675 4.087 -2.695 1.00 0.00 H new ATOM 0 HG2 GLN A 38 13.452 4.942 -1.379 1.00 0.00 H new ATOM 0 HG3 GLN A 38 13.913 6.128 -2.584 1.00 0.00 H new ATOM 0 HE21 GLN A 38 10.461 5.741 -1.937 1.00 0.00 H new ATOM 0 HE22 GLN A 38 10.275 7.232 -1.007 1.00 0.00 H new ATOM 619 N ALA A 39 11.444 3.535 -5.752 1.00 0.00 N ATOM 620 CA ALA A 39 10.701 2.482 -6.504 1.00 0.00 C ATOM 621 C ALA A 39 11.685 1.446 -7.055 1.00 0.00 C ATOM 622 O ALA A 39 11.410 0.262 -7.072 1.00 0.00 O ATOM 623 CB ALA A 39 9.939 3.126 -7.663 1.00 0.00 C ATOM 0 H ALA A 39 11.103 4.487 -5.890 1.00 0.00 H new ATOM 0 HA ALA A 39 9.998 1.989 -5.832 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.396 2.357 -8.213 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.234 3.859 -7.272 1.00 0.00 H new ATOM 0 HB3 ALA A 39 10.644 3.621 -8.331 1.00 0.00 H new ATOM 629 N LEU A 40 12.832 1.880 -7.500 1.00 0.00 N ATOM 630 CA LEU A 40 13.831 0.918 -8.044 1.00 0.00 C ATOM 631 C LEU A 40 14.535 0.200 -6.889 1.00 0.00 C ATOM 632 O LEU A 40 14.713 -1.002 -6.909 1.00 0.00 O ATOM 633 CB LEU A 40 14.865 1.674 -8.880 1.00 0.00 C ATOM 634 CG LEU A 40 14.149 2.601 -9.863 1.00 0.00 C ATOM 635 CD1 LEU A 40 15.122 3.672 -10.359 1.00 0.00 C ATOM 636 CD2 LEU A 40 13.641 1.784 -11.054 1.00 0.00 C ATOM 0 H LEU A 40 13.120 2.858 -7.510 1.00 0.00 H new ATOM 0 HA LEU A 40 13.323 0.185 -8.670 1.00 0.00 H new ATOM 0 HB2 LEU A 40 15.521 2.253 -8.230 1.00 0.00 H new ATOM 0 HB3 LEU A 40 15.495 0.969 -9.422 1.00 0.00 H new ATOM 0 HG LEU A 40 13.307 3.080 -9.363 1.00 0.00 H new ATOM 0 HD11 LEU A 40 14.610 4.332 -11.060 1.00 0.00 H new ATOM 0 HD12 LEU A 40 15.486 4.254 -9.512 1.00 0.00 H new ATOM 0 HD13 LEU A 40 15.964 3.195 -10.860 1.00 0.00 H new ATOM 0 HD21 LEU A 40 13.130 2.443 -11.756 1.00 0.00 H new ATOM 0 HD22 LEU A 40 14.484 1.306 -11.553 1.00 0.00 H new ATOM 0 HD23 LEU A 40 12.947 1.021 -10.702 1.00 0.00 H new ATOM 648 N ASP A 41 14.937 0.927 -5.881 1.00 0.00 N ATOM 649 CA ASP A 41 15.629 0.284 -4.728 1.00 0.00 C ATOM 650 C ASP A 41 14.741 -0.818 -4.145 1.00 0.00 C ATOM 651 O ASP A 41 15.098 -1.978 -4.140 1.00 0.00 O ATOM 652 CB ASP A 41 15.908 1.335 -3.651 1.00 0.00 C ATOM 653 CG ASP A 41 17.022 0.837 -2.728 1.00 0.00 C ATOM 654 OD1 ASP A 41 17.784 -0.013 -3.157 1.00 0.00 O ATOM 655 OD2 ASP A 41 17.095 1.316 -1.608 1.00 0.00 O ATOM 0 H ASP A 41 14.816 1.937 -5.807 1.00 0.00 H new ATOM 0 HA ASP A 41 16.569 -0.150 -5.067 1.00 0.00 H new ATOM 0 HB2 ASP A 41 16.199 2.278 -4.115 1.00 0.00 H new ATOM 0 HB3 ASP A 41 15.003 1.529 -3.075 1.00 0.00 H new ATOM 660 N ILE A 42 13.586 -0.463 -3.654 1.00 0.00 N ATOM 661 CA ILE A 42 12.671 -1.484 -3.071 1.00 0.00 C ATOM 662 C ILE A 42 12.373 -2.565 -4.111 1.00 0.00 C ATOM 663 O ILE A 42 12.513 -3.744 -3.851 1.00 0.00 O ATOM 664 CB ILE A 42 11.364 -0.811 -2.652 1.00 0.00 C ATOM 665 CG1 ILE A 42 11.635 0.171 -1.509 1.00 0.00 C ATOM 666 CG2 ILE A 42 10.370 -1.875 -2.185 1.00 0.00 C ATOM 667 CD1 ILE A 42 10.731 1.398 -1.662 1.00 0.00 C ATOM 0 H ILE A 42 13.235 0.494 -3.631 1.00 0.00 H new ATOM 0 HA ILE A 42 13.146 -1.940 -2.202 1.00 0.00 H new ATOM 0 HB ILE A 42 10.947 -0.271 -3.502 1.00 0.00 H new ATOM 0 HG12 ILE A 42 11.451 -0.312 -0.549 1.00 0.00 H new ATOM 0 HG13 ILE A 42 12.682 0.474 -1.517 1.00 0.00 H new ATOM 0 HG21 ILE A 42 9.438 -1.396 -1.886 1.00 0.00 H new ATOM 0 HG22 ILE A 42 10.174 -2.573 -2.999 1.00 0.00 H new ATOM 0 HG23 ILE A 42 10.788 -2.416 -1.336 1.00 0.00 H new ATOM 0 HD11 ILE A 42 10.925 2.096 -0.848 1.00 0.00 H new ATOM 0 HD12 ILE A 42 10.937 1.885 -2.615 1.00 0.00 H new ATOM 0 HD13 ILE A 42 9.687 1.087 -1.632 1.00 0.00 H new ATOM 679 N VAL A 43 11.956 -2.177 -5.286 1.00 0.00 N ATOM 680 CA VAL A 43 11.642 -3.187 -6.337 1.00 0.00 C ATOM 681 C VAL A 43 12.846 -4.110 -6.542 1.00 0.00 C ATOM 682 O VAL A 43 12.715 -5.218 -7.022 1.00 0.00 O ATOM 683 CB VAL A 43 11.316 -2.471 -7.649 1.00 0.00 C ATOM 684 CG1 VAL A 43 11.292 -3.486 -8.795 1.00 0.00 C ATOM 685 CG2 VAL A 43 9.946 -1.800 -7.536 1.00 0.00 C ATOM 0 H VAL A 43 11.819 -1.205 -5.563 1.00 0.00 H new ATOM 0 HA VAL A 43 10.784 -3.781 -6.023 1.00 0.00 H new ATOM 0 HB VAL A 43 12.077 -1.716 -7.848 1.00 0.00 H new ATOM 0 HG11 VAL A 43 11.060 -2.975 -9.729 1.00 0.00 H new ATOM 0 HG12 VAL A 43 12.267 -3.966 -8.877 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.532 -4.241 -8.596 1.00 0.00 H new ATOM 0 HG21 VAL A 43 9.713 -1.289 -8.470 1.00 0.00 H new ATOM 0 HG22 VAL A 43 9.186 -2.555 -7.336 1.00 0.00 H new ATOM 0 HG23 VAL A 43 9.961 -1.076 -6.721 1.00 0.00 H new ATOM 695 N THR A 44 14.018 -3.662 -6.188 1.00 0.00 N ATOM 696 CA THR A 44 15.227 -4.516 -6.368 1.00 0.00 C ATOM 697 C THR A 44 15.458 -5.361 -5.112 1.00 0.00 C ATOM 698 O THR A 44 16.011 -6.440 -5.173 1.00 0.00 O ATOM 699 CB THR A 44 16.447 -3.624 -6.614 1.00 0.00 C ATOM 700 OG1 THR A 44 16.152 -2.693 -7.645 1.00 0.00 O ATOM 701 CG2 THR A 44 17.639 -4.489 -7.030 1.00 0.00 C ATOM 0 H THR A 44 14.192 -2.743 -5.782 1.00 0.00 H new ATOM 0 HA THR A 44 15.077 -5.177 -7.222 1.00 0.00 H new ATOM 0 HB THR A 44 16.694 -3.086 -5.699 1.00 0.00 H new ATOM 0 HG1 THR A 44 15.889 -1.837 -7.247 1.00 0.00 H new ATOM 0 HG21 THR A 44 18.507 -3.853 -7.205 1.00 0.00 H new ATOM 0 HG22 THR A 44 17.865 -5.202 -6.237 1.00 0.00 H new ATOM 0 HG23 THR A 44 17.395 -5.029 -7.945 1.00 0.00 H new ATOM 709 N LYS A 45 15.041 -4.878 -3.973 1.00 0.00 N ATOM 710 CA LYS A 45 15.243 -5.656 -2.717 1.00 0.00 C ATOM 711 C LYS A 45 14.035 -6.564 -2.476 1.00 0.00 C ATOM 712 O LYS A 45 14.030 -7.379 -1.574 1.00 0.00 O ATOM 713 CB LYS A 45 15.398 -4.692 -1.540 1.00 0.00 C ATOM 714 CG LYS A 45 16.844 -4.198 -1.472 1.00 0.00 C ATOM 715 CD LYS A 45 17.683 -5.181 -0.654 1.00 0.00 C ATOM 716 CE LYS A 45 17.349 -5.025 0.830 1.00 0.00 C ATOM 717 NZ LYS A 45 18.590 -5.192 1.640 1.00 0.00 N ATOM 0 H LYS A 45 14.570 -3.980 -3.858 1.00 0.00 H new ATOM 0 HA LYS A 45 16.142 -6.266 -2.810 1.00 0.00 H new ATOM 0 HB2 LYS A 45 14.719 -3.847 -1.656 1.00 0.00 H new ATOM 0 HB3 LYS A 45 15.129 -5.191 -0.609 1.00 0.00 H new ATOM 0 HG2 LYS A 45 17.254 -4.103 -2.477 1.00 0.00 H new ATOM 0 HG3 LYS A 45 16.880 -3.208 -1.018 1.00 0.00 H new ATOM 0 HD2 LYS A 45 17.483 -6.203 -0.977 1.00 0.00 H new ATOM 0 HD3 LYS A 45 18.744 -4.996 -0.820 1.00 0.00 H new ATOM 0 HE2 LYS A 45 16.911 -4.044 1.014 1.00 0.00 H new ATOM 0 HE3 LYS A 45 16.606 -5.766 1.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 18.363 -5.086 2.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 18.989 -6.138 1.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 19.285 -4.469 1.364 1.00 0.00 H new ATOM 731 N GLU A 46 13.012 -6.432 -3.274 1.00 0.00 N ATOM 732 CA GLU A 46 11.807 -7.288 -3.088 1.00 0.00 C ATOM 733 C GLU A 46 11.313 -7.776 -4.452 1.00 0.00 C ATOM 734 O GLU A 46 10.846 -8.889 -4.590 1.00 0.00 O ATOM 735 CB GLU A 46 10.703 -6.474 -2.408 1.00 0.00 C ATOM 736 CG GLU A 46 11.281 -5.744 -1.195 1.00 0.00 C ATOM 737 CD GLU A 46 10.384 -5.984 0.022 1.00 0.00 C ATOM 738 OE1 GLU A 46 9.194 -5.737 -0.087 1.00 0.00 O ATOM 739 OE2 GLU A 46 10.902 -6.413 1.040 1.00 0.00 O ATOM 0 H GLU A 46 12.958 -5.768 -4.047 1.00 0.00 H new ATOM 0 HA GLU A 46 12.063 -8.145 -2.465 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.281 -5.756 -3.111 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.891 -7.131 -2.097 1.00 0.00 H new ATOM 0 HG2 GLU A 46 12.291 -6.099 -0.991 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.354 -4.676 -1.401 1.00 0.00 H new ATOM 746 N ARG A 47 11.413 -6.953 -5.459 1.00 0.00 N ATOM 747 CA ARG A 47 10.950 -7.372 -6.811 1.00 0.00 C ATOM 748 C ARG A 47 9.466 -7.746 -6.749 1.00 0.00 C ATOM 749 O ARG A 47 9.107 -8.888 -6.959 1.00 0.00 O ATOM 750 CB ARG A 47 11.762 -8.582 -7.277 1.00 0.00 C ATOM 751 CG ARG A 47 13.095 -8.110 -7.860 1.00 0.00 C ATOM 752 CD ARG A 47 13.843 -9.304 -8.457 1.00 0.00 C ATOM 753 NE ARG A 47 14.024 -10.350 -7.411 1.00 0.00 N ATOM 754 CZ ARG A 47 14.880 -10.167 -6.440 1.00 0.00 C ATOM 755 NH1 ARG A 47 15.581 -9.066 -6.382 1.00 0.00 N ATOM 756 NH2 ARG A 47 15.034 -11.086 -5.528 1.00 0.00 N ATOM 0 H ARG A 47 11.795 -6.009 -5.404 1.00 0.00 H new ATOM 0 HA ARG A 47 11.089 -6.550 -7.513 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.938 -9.259 -6.441 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.203 -9.141 -8.027 1.00 0.00 H new ATOM 0 HG2 ARG A 47 12.922 -7.356 -8.627 1.00 0.00 H new ATOM 0 HG3 ARG A 47 13.698 -7.641 -7.083 1.00 0.00 H new ATOM 0 HD2 ARG A 47 13.286 -9.711 -9.301 1.00 0.00 H new ATOM 0 HD3 ARG A 47 14.813 -8.985 -8.839 1.00 0.00 H new ATOM 0 HE ARG A 47 13.479 -11.211 -7.453 1.00 0.00 H new ATOM 0 HH11 ARG A 47 15.461 -8.347 -7.095 1.00 0.00 H new ATOM 0 HH12 ARG A 47 16.248 -8.926 -5.623 1.00 0.00 H new ATOM 0 HH21 ARG A 47 14.487 -11.946 -5.573 1.00 0.00 H new ATOM 0 HH22 ARG A 47 15.701 -10.945 -4.770 1.00 0.00 H new ATOM 770 N PRO A 48 8.647 -6.766 -6.462 1.00 0.00 N ATOM 771 CA PRO A 48 7.190 -6.953 -6.366 1.00 0.00 C ATOM 772 C PRO A 48 6.569 -7.041 -7.763 1.00 0.00 C ATOM 773 O PRO A 48 7.149 -6.604 -8.738 1.00 0.00 O ATOM 774 CB PRO A 48 6.713 -5.698 -5.629 1.00 0.00 C ATOM 775 CG PRO A 48 7.807 -4.625 -5.846 1.00 0.00 C ATOM 776 CD PRO A 48 9.098 -5.381 -6.210 1.00 0.00 C ATOM 0 HA PRO A 48 6.908 -7.872 -5.853 1.00 0.00 H new ATOM 0 HB2 PRO A 48 5.753 -5.359 -6.019 1.00 0.00 H new ATOM 0 HB3 PRO A 48 6.572 -5.900 -4.567 1.00 0.00 H new ATOM 0 HG2 PRO A 48 7.523 -3.937 -6.643 1.00 0.00 H new ATOM 0 HG3 PRO A 48 7.948 -4.028 -4.945 1.00 0.00 H new ATOM 0 HD2 PRO A 48 9.577 -4.951 -7.090 1.00 0.00 H new ATOM 0 HD3 PRO A 48 9.826 -5.340 -5.400 1.00 0.00 H new ATOM 784 N ASP A 49 5.396 -7.603 -7.868 1.00 0.00 N ATOM 785 CA ASP A 49 4.744 -7.721 -9.202 1.00 0.00 C ATOM 786 C ASP A 49 3.767 -6.560 -9.402 1.00 0.00 C ATOM 787 O ASP A 49 3.190 -6.399 -10.460 1.00 0.00 O ATOM 788 CB ASP A 49 3.985 -9.047 -9.282 1.00 0.00 C ATOM 789 CG ASP A 49 4.975 -10.189 -9.511 1.00 0.00 C ATOM 790 OD1 ASP A 49 6.119 -9.903 -9.822 1.00 0.00 O ATOM 791 OD2 ASP A 49 4.571 -11.333 -9.374 1.00 0.00 O ATOM 0 H ASP A 49 4.862 -7.985 -7.088 1.00 0.00 H new ATOM 0 HA ASP A 49 5.506 -7.689 -9.981 1.00 0.00 H new ATOM 0 HB2 ASP A 49 3.427 -9.215 -8.361 1.00 0.00 H new ATOM 0 HB3 ASP A 49 3.258 -9.014 -10.094 1.00 0.00 H new ATOM 796 N LEU A 50 3.572 -5.752 -8.397 1.00 0.00 N ATOM 797 CA LEU A 50 2.628 -4.607 -8.537 1.00 0.00 C ATOM 798 C LEU A 50 3.314 -3.317 -8.079 1.00 0.00 C ATOM 799 O LEU A 50 3.789 -3.217 -6.966 1.00 0.00 O ATOM 800 CB LEU A 50 1.390 -4.859 -7.676 1.00 0.00 C ATOM 801 CG LEU A 50 0.144 -4.380 -8.423 1.00 0.00 C ATOM 802 CD1 LEU A 50 -0.058 -5.230 -9.678 1.00 0.00 C ATOM 803 CD2 LEU A 50 -1.077 -4.520 -7.511 1.00 0.00 C ATOM 0 H LEU A 50 4.024 -5.834 -7.486 1.00 0.00 H new ATOM 0 HA LEU A 50 2.331 -4.508 -9.581 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.304 -5.921 -7.446 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.482 -4.334 -6.725 1.00 0.00 H new ATOM 0 HG LEU A 50 0.269 -3.336 -8.709 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.946 -4.888 -10.210 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.813 -5.134 -10.327 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.185 -6.275 -9.393 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.967 -4.180 -8.040 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.201 -5.565 -7.227 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.934 -3.915 -6.616 1.00 0.00 H new ATOM 815 N VAL A 51 3.367 -2.330 -8.931 1.00 0.00 N ATOM 816 CA VAL A 51 4.020 -1.047 -8.544 1.00 0.00 C ATOM 817 C VAL A 51 3.109 0.124 -8.918 1.00 0.00 C ATOM 818 O VAL A 51 2.793 0.335 -10.072 1.00 0.00 O ATOM 819 CB VAL A 51 5.353 -0.910 -9.280 1.00 0.00 C ATOM 820 CG1 VAL A 51 6.109 0.308 -8.746 1.00 0.00 C ATOM 821 CG2 VAL A 51 6.193 -2.169 -9.052 1.00 0.00 C ATOM 0 H VAL A 51 2.987 -2.356 -9.877 1.00 0.00 H new ATOM 0 HA VAL A 51 4.196 -1.041 -7.468 1.00 0.00 H new ATOM 0 HB VAL A 51 5.167 -0.784 -10.347 1.00 0.00 H new ATOM 0 HG11 VAL A 51 7.059 0.405 -9.271 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.512 1.206 -8.907 1.00 0.00 H new ATOM 0 HG13 VAL A 51 6.295 0.182 -7.679 1.00 0.00 H new ATOM 0 HG21 VAL A 51 7.144 -2.072 -9.576 1.00 0.00 H new ATOM 0 HG22 VAL A 51 6.378 -2.295 -7.985 1.00 0.00 H new ATOM 0 HG23 VAL A 51 5.656 -3.038 -9.432 1.00 0.00 H new ATOM 831 N LEU A 52 2.688 0.891 -7.950 1.00 0.00 N ATOM 832 CA LEU A 52 1.801 2.050 -8.246 1.00 0.00 C ATOM 833 C LEU A 52 2.656 3.290 -8.511 1.00 0.00 C ATOM 834 O LEU A 52 3.325 3.794 -7.630 1.00 0.00 O ATOM 835 CB LEU A 52 0.885 2.309 -7.049 1.00 0.00 C ATOM 836 CG LEU A 52 0.154 1.019 -6.676 1.00 0.00 C ATOM 837 CD1 LEU A 52 0.575 0.581 -5.272 1.00 0.00 C ATOM 838 CD2 LEU A 52 -1.356 1.264 -6.702 1.00 0.00 C ATOM 0 H LEU A 52 2.921 0.764 -6.965 1.00 0.00 H new ATOM 0 HA LEU A 52 1.196 1.830 -9.126 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.470 2.666 -6.201 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.165 3.090 -7.291 1.00 0.00 H new ATOM 0 HG LEU A 52 0.409 0.237 -7.392 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.054 -0.339 -5.006 1.00 0.00 H new ATOM 0 HD12 LEU A 52 1.651 0.407 -5.252 1.00 0.00 H new ATOM 0 HD13 LEU A 52 0.321 1.362 -4.556 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.878 0.345 -6.436 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.610 2.046 -5.986 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.657 1.576 -7.702 1.00 0.00 H new ATOM 850 N LEU A 53 2.641 3.783 -9.719 1.00 0.00 N ATOM 851 CA LEU A 53 3.456 4.989 -10.041 1.00 0.00 C ATOM 852 C LEU A 53 2.542 6.211 -10.152 1.00 0.00 C ATOM 853 O LEU A 53 1.532 6.186 -10.828 1.00 0.00 O ATOM 854 CB LEU A 53 4.180 4.772 -11.371 1.00 0.00 C ATOM 855 CG LEU A 53 5.685 4.665 -11.122 1.00 0.00 C ATOM 856 CD1 LEU A 53 5.955 3.585 -10.074 1.00 0.00 C ATOM 857 CD2 LEU A 53 6.392 4.292 -12.428 1.00 0.00 C ATOM 0 H LEU A 53 2.100 3.404 -10.496 1.00 0.00 H new ATOM 0 HA LEU A 53 4.187 5.155 -9.250 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.815 3.864 -11.852 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.971 5.599 -12.050 1.00 0.00 H new ATOM 0 HG LEU A 53 6.061 5.623 -10.763 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.028 3.510 -9.897 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.452 3.847 -9.143 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.578 2.627 -10.433 1.00 0.00 H new ATOM 0 HD21 LEU A 53 7.465 4.215 -12.252 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.014 3.334 -12.786 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.201 5.060 -13.177 1.00 0.00 H new ATOM 869 N ASP A 54 2.891 7.283 -9.494 1.00 0.00 N ATOM 870 CA ASP A 54 2.046 8.510 -9.562 1.00 0.00 C ATOM 871 C ASP A 54 2.769 9.575 -10.389 1.00 0.00 C ATOM 872 O ASP A 54 3.719 10.184 -9.938 1.00 0.00 O ATOM 873 CB ASP A 54 1.801 9.039 -8.148 1.00 0.00 C ATOM 874 CG ASP A 54 0.695 10.096 -8.183 1.00 0.00 C ATOM 875 OD1 ASP A 54 -0.393 9.772 -8.630 1.00 0.00 O ATOM 876 OD2 ASP A 54 0.954 11.211 -7.762 1.00 0.00 O ATOM 0 H ASP A 54 3.725 7.362 -8.912 1.00 0.00 H new ATOM 0 HA ASP A 54 1.090 8.272 -10.029 1.00 0.00 H new ATOM 0 HB2 ASP A 54 1.516 8.221 -7.487 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.718 9.470 -7.745 1.00 0.00 H new ATOM 881 N MET A 55 2.328 9.806 -11.595 1.00 0.00 N ATOM 882 CA MET A 55 2.994 10.831 -12.449 1.00 0.00 C ATOM 883 C MET A 55 2.673 12.229 -11.915 1.00 0.00 C ATOM 884 O MET A 55 3.169 13.221 -12.412 1.00 0.00 O ATOM 885 CB MET A 55 2.488 10.707 -13.888 1.00 0.00 C ATOM 886 CG MET A 55 2.178 9.241 -14.199 1.00 0.00 C ATOM 887 SD MET A 55 2.087 9.012 -15.993 1.00 0.00 S ATOM 888 CE MET A 55 3.868 9.011 -16.313 1.00 0.00 C ATOM 0 H MET A 55 1.536 9.330 -12.026 1.00 0.00 H new ATOM 0 HA MET A 55 4.072 10.673 -12.429 1.00 0.00 H new ATOM 0 HB2 MET A 55 1.593 11.315 -14.023 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.239 11.086 -14.582 1.00 0.00 H new ATOM 0 HG2 MET A 55 2.950 8.597 -13.778 1.00 0.00 H new ATOM 0 HG3 MET A 55 1.235 8.951 -13.736 1.00 0.00 H new ATOM 0 HE1 MET A 55 4.083 9.639 -17.178 1.00 0.00 H new ATOM 0 HE2 MET A 55 4.394 9.401 -15.442 1.00 0.00 H new ATOM 0 HE3 MET A 55 4.201 7.993 -16.513 1.00 0.00 H new ATOM 898 N LYS A 56 1.846 12.320 -10.908 1.00 0.00 N ATOM 899 CA LYS A 56 1.498 13.655 -10.349 1.00 0.00 C ATOM 900 C LYS A 56 2.543 14.061 -9.307 1.00 0.00 C ATOM 901 O LYS A 56 2.334 14.969 -8.526 1.00 0.00 O ATOM 902 CB LYS A 56 0.120 13.589 -9.689 1.00 0.00 C ATOM 903 CG LYS A 56 -0.865 12.898 -10.632 1.00 0.00 C ATOM 904 CD LYS A 56 -2.297 13.269 -10.238 1.00 0.00 C ATOM 905 CE LYS A 56 -3.248 12.142 -10.647 1.00 0.00 C ATOM 906 NZ LYS A 56 -3.796 11.489 -9.425 1.00 0.00 N ATOM 0 H LYS A 56 1.397 11.527 -10.450 1.00 0.00 H new ATOM 0 HA LYS A 56 1.481 14.391 -11.153 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.182 13.043 -8.747 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -0.230 14.594 -9.453 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.671 13.199 -11.662 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.732 11.817 -10.585 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -2.357 13.438 -9.163 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.589 14.200 -10.724 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -4.060 12.540 -11.256 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.720 11.410 -11.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.607 10.467 -9.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -3.342 11.894 -8.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -4.822 11.650 -9.376 1.00 0.00 H new ATOM 920 N ILE A 57 3.667 13.396 -9.286 1.00 0.00 N ATOM 921 CA ILE A 57 4.721 13.746 -8.294 1.00 0.00 C ATOM 922 C ILE A 57 5.402 15.056 -8.714 1.00 0.00 C ATOM 923 O ILE A 57 5.769 15.215 -9.861 1.00 0.00 O ATOM 924 CB ILE A 57 5.760 12.625 -8.243 1.00 0.00 C ATOM 925 CG1 ILE A 57 5.155 11.401 -7.550 1.00 0.00 C ATOM 926 CG2 ILE A 57 6.986 13.098 -7.460 1.00 0.00 C ATOM 927 CD1 ILE A 57 6.177 10.261 -7.543 1.00 0.00 C ATOM 0 H ILE A 57 3.900 12.626 -9.913 1.00 0.00 H new ATOM 0 HA ILE A 57 4.270 13.871 -7.310 1.00 0.00 H new ATOM 0 HB ILE A 57 6.058 12.360 -9.258 1.00 0.00 H new ATOM 0 HG12 ILE A 57 4.868 11.653 -6.529 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.248 11.088 -8.068 1.00 0.00 H new ATOM 0 HG21 ILE A 57 7.726 12.298 -7.424 1.00 0.00 H new ATOM 0 HG22 ILE A 57 7.418 13.970 -7.952 1.00 0.00 H new ATOM 0 HG23 ILE A 57 6.689 13.363 -6.445 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.747 9.390 -7.050 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.442 10.004 -8.568 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.071 10.577 -7.006 1.00 0.00 H new ATOM 939 N PRO A 58 5.551 15.957 -7.772 1.00 0.00 N ATOM 940 CA PRO A 58 6.187 17.264 -8.016 1.00 0.00 C ATOM 941 C PRO A 58 7.717 17.134 -8.003 1.00 0.00 C ATOM 942 O PRO A 58 8.411 17.967 -7.455 1.00 0.00 O ATOM 943 CB PRO A 58 5.714 18.116 -6.837 1.00 0.00 C ATOM 944 CG PRO A 58 5.328 17.128 -5.710 1.00 0.00 C ATOM 945 CD PRO A 58 5.092 15.762 -6.382 1.00 0.00 C ATOM 0 HA PRO A 58 5.925 17.689 -8.985 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.502 18.793 -6.507 1.00 0.00 H new ATOM 0 HB3 PRO A 58 4.862 18.733 -7.121 1.00 0.00 H new ATOM 0 HG2 PRO A 58 6.121 17.061 -4.965 1.00 0.00 H new ATOM 0 HG3 PRO A 58 4.431 17.464 -5.191 1.00 0.00 H new ATOM 0 HD2 PRO A 58 5.654 14.971 -5.885 1.00 0.00 H new ATOM 0 HD3 PRO A 58 4.041 15.477 -6.346 1.00 0.00 H new ATOM 953 N GLY A 59 8.247 16.102 -8.601 1.00 0.00 N ATOM 954 CA GLY A 59 9.727 15.931 -8.616 1.00 0.00 C ATOM 955 C GLY A 59 10.188 15.575 -10.030 1.00 0.00 C ATOM 956 O GLY A 59 11.015 16.250 -10.611 1.00 0.00 O ATOM 0 H GLY A 59 7.720 15.371 -9.079 1.00 0.00 H new ATOM 0 HA2 GLY A 59 10.213 16.849 -8.285 1.00 0.00 H new ATOM 0 HA3 GLY A 59 10.020 15.146 -7.919 1.00 0.00 H new ATOM 960 N MET A 60 9.662 14.520 -10.587 1.00 0.00 N ATOM 961 CA MET A 60 10.072 14.122 -11.963 1.00 0.00 C ATOM 962 C MET A 60 8.972 13.270 -12.598 1.00 0.00 C ATOM 963 O MET A 60 7.940 13.029 -12.005 1.00 0.00 O ATOM 964 CB MET A 60 11.370 13.314 -11.895 1.00 0.00 C ATOM 965 CG MET A 60 11.100 11.968 -11.218 1.00 0.00 C ATOM 966 SD MET A 60 10.878 12.222 -9.439 1.00 0.00 S ATOM 967 CE MET A 60 9.217 11.513 -9.315 1.00 0.00 C ATOM 0 H MET A 60 8.966 13.916 -10.149 1.00 0.00 H new ATOM 0 HA MET A 60 10.232 15.015 -12.567 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.765 13.155 -12.899 1.00 0.00 H new ATOM 0 HB3 MET A 60 12.126 13.867 -11.339 1.00 0.00 H new ATOM 0 HG2 MET A 60 10.209 11.506 -11.644 1.00 0.00 H new ATOM 0 HG3 MET A 60 11.930 11.285 -11.398 1.00 0.00 H new ATOM 0 HE1 MET A 60 9.061 11.125 -8.308 1.00 0.00 H new ATOM 0 HE2 MET A 60 8.476 12.284 -9.526 1.00 0.00 H new ATOM 0 HE3 MET A 60 9.113 10.702 -10.036 1.00 0.00 H new ATOM 977 N ASP A 61 9.185 12.811 -13.801 1.00 0.00 N ATOM 978 CA ASP A 61 8.150 11.974 -14.473 1.00 0.00 C ATOM 979 C ASP A 61 8.394 10.500 -14.146 1.00 0.00 C ATOM 980 O ASP A 61 9.520 10.050 -14.066 1.00 0.00 O ATOM 981 CB ASP A 61 8.234 12.181 -15.987 1.00 0.00 C ATOM 982 CG ASP A 61 7.945 13.646 -16.319 1.00 0.00 C ATOM 983 OD1 ASP A 61 6.780 13.995 -16.409 1.00 0.00 O ATOM 984 OD2 ASP A 61 8.895 14.395 -16.479 1.00 0.00 O ATOM 0 H ASP A 61 10.030 12.979 -14.347 1.00 0.00 H new ATOM 0 HA ASP A 61 7.161 12.265 -14.119 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.224 11.904 -16.348 1.00 0.00 H new ATOM 0 HB3 ASP A 61 7.518 11.534 -16.493 1.00 0.00 H new ATOM 989 N GLY A 62 7.349 9.744 -13.956 1.00 0.00 N ATOM 990 CA GLY A 62 7.521 8.299 -13.635 1.00 0.00 C ATOM 991 C GLY A 62 7.860 7.529 -14.913 1.00 0.00 C ATOM 992 O GLY A 62 8.209 6.365 -14.874 1.00 0.00 O ATOM 0 H GLY A 62 6.382 10.064 -14.009 1.00 0.00 H new ATOM 0 HA2 GLY A 62 8.315 8.171 -12.899 1.00 0.00 H new ATOM 0 HA3 GLY A 62 6.608 7.903 -13.191 1.00 0.00 H new ATOM 996 N ILE A 63 7.759 8.167 -16.046 1.00 0.00 N ATOM 997 CA ILE A 63 8.075 7.470 -17.326 1.00 0.00 C ATOM 998 C ILE A 63 9.446 6.801 -17.215 1.00 0.00 C ATOM 999 O ILE A 63 9.585 5.612 -17.420 1.00 0.00 O ATOM 1000 CB ILE A 63 8.093 8.486 -18.468 1.00 0.00 C ATOM 1001 CG1 ILE A 63 6.671 8.989 -18.726 1.00 0.00 C ATOM 1002 CG2 ILE A 63 8.635 7.821 -19.735 1.00 0.00 C ATOM 1003 CD1 ILE A 63 5.730 7.795 -18.895 1.00 0.00 C ATOM 0 H ILE A 63 7.471 9.141 -16.142 1.00 0.00 H new ATOM 0 HA ILE A 63 7.316 6.713 -17.526 1.00 0.00 H new ATOM 0 HB ILE A 63 8.733 9.326 -18.196 1.00 0.00 H new ATOM 0 HG12 ILE A 63 6.339 9.613 -17.896 1.00 0.00 H new ATOM 0 HG13 ILE A 63 6.651 9.611 -19.621 1.00 0.00 H new ATOM 0 HG21 ILE A 63 8.648 8.546 -20.549 1.00 0.00 H new ATOM 0 HG22 ILE A 63 9.648 7.462 -19.553 1.00 0.00 H new ATOM 0 HG23 ILE A 63 7.996 6.981 -20.007 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.717 8.153 -19.079 1.00 0.00 H new ATOM 0 HD12 ILE A 63 6.059 7.189 -19.739 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.742 7.191 -17.988 1.00 0.00 H new ATOM 1015 N GLU A 64 10.461 7.556 -16.892 1.00 0.00 N ATOM 1016 CA GLU A 64 11.821 6.962 -16.769 1.00 0.00 C ATOM 1017 C GLU A 64 11.785 5.809 -15.765 1.00 0.00 C ATOM 1018 O GLU A 64 12.415 4.788 -15.953 1.00 0.00 O ATOM 1019 CB GLU A 64 12.802 8.032 -16.283 1.00 0.00 C ATOM 1020 CG GLU A 64 12.633 9.300 -17.122 1.00 0.00 C ATOM 1021 CD GLU A 64 12.625 8.933 -18.607 1.00 0.00 C ATOM 1022 OE1 GLU A 64 13.528 8.228 -19.028 1.00 0.00 O ATOM 1023 OE2 GLU A 64 11.717 9.363 -19.299 1.00 0.00 O ATOM 0 H GLU A 64 10.406 8.558 -16.708 1.00 0.00 H new ATOM 0 HA GLU A 64 12.144 6.587 -17.740 1.00 0.00 H new ATOM 0 HB2 GLU A 64 12.623 8.253 -15.231 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.825 7.665 -16.362 1.00 0.00 H new ATOM 0 HG2 GLU A 64 11.703 9.803 -16.856 1.00 0.00 H new ATOM 0 HG3 GLU A 64 13.444 9.997 -16.913 1.00 0.00 H new ATOM 1030 N ILE A 65 11.049 5.963 -14.697 1.00 0.00 N ATOM 1031 CA ILE A 65 10.971 4.875 -13.683 1.00 0.00 C ATOM 1032 C ILE A 65 10.572 3.568 -14.368 1.00 0.00 C ATOM 1033 O ILE A 65 11.358 2.648 -14.481 1.00 0.00 O ATOM 1034 CB ILE A 65 9.926 5.237 -12.626 1.00 0.00 C ATOM 1035 CG1 ILE A 65 10.208 6.642 -12.089 1.00 0.00 C ATOM 1036 CG2 ILE A 65 9.992 4.230 -11.476 1.00 0.00 C ATOM 1037 CD1 ILE A 65 9.297 6.924 -10.893 1.00 0.00 C ATOM 0 H ILE A 65 10.499 6.795 -14.484 1.00 0.00 H new ATOM 0 HA ILE A 65 11.943 4.753 -13.205 1.00 0.00 H new ATOM 0 HB ILE A 65 8.933 5.212 -13.075 1.00 0.00 H new ATOM 0 HG12 ILE A 65 11.253 6.726 -11.791 1.00 0.00 H new ATOM 0 HG13 ILE A 65 10.039 7.382 -12.871 1.00 0.00 H new ATOM 0 HG21 ILE A 65 9.247 4.488 -10.723 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.791 3.229 -11.857 1.00 0.00 H new ATOM 0 HG23 ILE A 65 10.985 4.255 -11.027 1.00 0.00 H new ATOM 0 HD11 ILE A 65 9.498 7.925 -10.511 1.00 0.00 H new ATOM 0 HD12 ILE A 65 8.255 6.857 -11.206 1.00 0.00 H new ATOM 0 HD13 ILE A 65 9.488 6.191 -10.109 1.00 0.00 H new ATOM 1049 N LEU A 66 9.354 3.476 -14.828 1.00 0.00 N ATOM 1050 CA LEU A 66 8.904 2.229 -15.507 1.00 0.00 C ATOM 1051 C LEU A 66 9.992 1.743 -16.465 1.00 0.00 C ATOM 1052 O LEU A 66 10.356 0.584 -16.470 1.00 0.00 O ATOM 1053 CB LEU A 66 7.622 2.512 -16.293 1.00 0.00 C ATOM 1054 CG LEU A 66 6.473 2.779 -15.321 1.00 0.00 C ATOM 1055 CD1 LEU A 66 5.237 3.229 -16.101 1.00 0.00 C ATOM 1056 CD2 LEU A 66 6.151 1.497 -14.550 1.00 0.00 C ATOM 0 H LEU A 66 8.651 4.212 -14.763 1.00 0.00 H new ATOM 0 HA LEU A 66 8.712 1.460 -14.759 1.00 0.00 H new ATOM 0 HB2 LEU A 66 7.766 3.373 -16.946 1.00 0.00 H new ATOM 0 HB3 LEU A 66 7.381 1.663 -16.933 1.00 0.00 H new ATOM 0 HG LEU A 66 6.764 3.562 -14.621 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.418 3.419 -15.407 1.00 0.00 H new ATOM 0 HD12 LEU A 66 5.466 4.142 -16.651 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.944 2.447 -16.802 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.332 1.686 -13.856 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.860 0.714 -15.251 1.00 0.00 H new ATOM 0 HD23 LEU A 66 7.031 1.177 -13.993 1.00 0.00 H new ATOM 1068 N LYS A 67 10.515 2.620 -17.279 1.00 0.00 N ATOM 1069 CA LYS A 67 11.578 2.208 -18.240 1.00 0.00 C ATOM 1070 C LYS A 67 12.584 1.293 -17.536 1.00 0.00 C ATOM 1071 O LYS A 67 12.808 0.170 -17.943 1.00 0.00 O ATOM 1072 CB LYS A 67 12.300 3.451 -18.763 1.00 0.00 C ATOM 1073 CG LYS A 67 12.130 3.540 -20.281 1.00 0.00 C ATOM 1074 CD LYS A 67 13.177 2.661 -20.965 1.00 0.00 C ATOM 1075 CE LYS A 67 12.976 2.713 -22.481 1.00 0.00 C ATOM 1076 NZ LYS A 67 14.269 2.426 -23.164 1.00 0.00 N ATOM 0 H LYS A 67 10.252 3.605 -17.320 1.00 0.00 H new ATOM 0 HA LYS A 67 11.124 1.671 -19.073 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.897 4.345 -18.288 1.00 0.00 H new ATOM 0 HB3 LYS A 67 13.359 3.404 -18.507 1.00 0.00 H new ATOM 0 HG2 LYS A 67 11.128 3.218 -20.565 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.237 4.574 -20.609 1.00 0.00 H new ATOM 0 HD2 LYS A 67 14.179 3.004 -20.708 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.092 1.634 -20.611 1.00 0.00 H new ATOM 0 HE2 LYS A 67 12.223 1.985 -22.784 1.00 0.00 H new ATOM 0 HE3 LYS A 67 12.607 3.695 -22.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 14.133 2.461 -24.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.975 3.136 -22.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 14.603 1.480 -22.891 1.00 0.00 H new ATOM 1090 N ARG A 68 13.196 1.765 -16.484 1.00 0.00 N ATOM 1091 CA ARG A 68 14.189 0.922 -15.759 1.00 0.00 C ATOM 1092 C ARG A 68 13.498 -0.331 -15.214 1.00 0.00 C ATOM 1093 O ARG A 68 14.091 -1.387 -15.122 1.00 0.00 O ATOM 1094 CB ARG A 68 14.783 1.721 -14.597 1.00 0.00 C ATOM 1095 CG ARG A 68 16.074 2.403 -15.053 1.00 0.00 C ATOM 1096 CD ARG A 68 15.757 3.810 -15.562 1.00 0.00 C ATOM 1097 NE ARG A 68 16.470 4.814 -14.722 1.00 0.00 N ATOM 1098 CZ ARG A 68 16.527 6.063 -15.099 1.00 0.00 C ATOM 1099 NH1 ARG A 68 15.960 6.440 -16.214 1.00 0.00 N ATOM 1100 NH2 ARG A 68 17.152 6.938 -14.360 1.00 0.00 N ATOM 0 H ARG A 68 13.051 2.697 -16.096 1.00 0.00 H new ATOM 0 HA ARG A 68 14.984 0.628 -16.445 1.00 0.00 H new ATOM 0 HB2 ARG A 68 14.067 2.467 -14.252 1.00 0.00 H new ATOM 0 HB3 ARG A 68 14.986 1.060 -13.754 1.00 0.00 H new ATOM 0 HG2 ARG A 68 16.782 2.455 -14.226 1.00 0.00 H new ATOM 0 HG3 ARG A 68 16.548 1.818 -15.841 1.00 0.00 H new ATOM 0 HD2 ARG A 68 16.062 3.909 -16.604 1.00 0.00 H new ATOM 0 HD3 ARG A 68 14.682 3.988 -15.527 1.00 0.00 H new ATOM 0 HE ARG A 68 16.914 4.525 -13.851 1.00 0.00 H new ATOM 0 HH11 ARG A 68 15.471 5.758 -16.793 1.00 0.00 H new ATOM 0 HH12 ARG A 68 16.007 7.416 -16.505 1.00 0.00 H new ATOM 0 HH21 ARG A 68 17.595 6.646 -13.489 1.00 0.00 H new ATOM 0 HH22 ARG A 68 17.197 7.914 -14.653 1.00 0.00 H new ATOM 1114 N MET A 69 12.250 -0.220 -14.850 1.00 0.00 N ATOM 1115 CA MET A 69 11.524 -1.404 -14.309 1.00 0.00 C ATOM 1116 C MET A 69 11.373 -2.459 -15.407 1.00 0.00 C ATOM 1117 O MET A 69 11.217 -3.633 -15.136 1.00 0.00 O ATOM 1118 CB MET A 69 10.142 -0.971 -13.818 1.00 0.00 C ATOM 1119 CG MET A 69 10.299 0.111 -12.748 1.00 0.00 C ATOM 1120 SD MET A 69 8.677 0.808 -12.348 1.00 0.00 S ATOM 1121 CE MET A 69 8.154 -0.486 -11.196 1.00 0.00 C ATOM 0 H MET A 69 11.702 0.639 -14.904 1.00 0.00 H new ATOM 0 HA MET A 69 12.088 -1.828 -13.478 1.00 0.00 H new ATOM 0 HB2 MET A 69 9.551 -0.591 -14.651 1.00 0.00 H new ATOM 0 HB3 MET A 69 9.604 -1.827 -13.409 1.00 0.00 H new ATOM 0 HG2 MET A 69 10.755 -0.312 -11.853 1.00 0.00 H new ATOM 0 HG3 MET A 69 10.966 0.896 -13.105 1.00 0.00 H new ATOM 0 HE1 MET A 69 7.071 -0.453 -11.079 1.00 0.00 H new ATOM 0 HE2 MET A 69 8.447 -1.461 -11.586 1.00 0.00 H new ATOM 0 HE3 MET A 69 8.628 -0.325 -10.228 1.00 0.00 H new ATOM 1131 N LYS A 70 11.420 -2.051 -16.646 1.00 0.00 N ATOM 1132 CA LYS A 70 11.281 -3.033 -17.760 1.00 0.00 C ATOM 1133 C LYS A 70 12.645 -3.663 -18.039 1.00 0.00 C ATOM 1134 O LYS A 70 12.761 -4.853 -18.256 1.00 0.00 O ATOM 1135 CB LYS A 70 10.787 -2.328 -19.031 1.00 0.00 C ATOM 1136 CG LYS A 70 10.071 -1.022 -18.670 1.00 0.00 C ATOM 1137 CD LYS A 70 8.845 -0.847 -19.568 1.00 0.00 C ATOM 1138 CE LYS A 70 7.749 -0.110 -18.799 1.00 0.00 C ATOM 1139 NZ LYS A 70 7.483 -0.815 -17.513 1.00 0.00 N ATOM 0 H LYS A 70 11.548 -1.081 -16.935 1.00 0.00 H new ATOM 0 HA LYS A 70 10.560 -3.799 -17.474 1.00 0.00 H new ATOM 0 HB2 LYS A 70 11.630 -2.119 -19.690 1.00 0.00 H new ATOM 0 HB3 LYS A 70 10.109 -2.983 -19.578 1.00 0.00 H new ATOM 0 HG2 LYS A 70 9.769 -1.038 -17.623 1.00 0.00 H new ATOM 0 HG3 LYS A 70 10.749 -0.177 -18.793 1.00 0.00 H new ATOM 0 HD2 LYS A 70 9.114 -0.287 -20.464 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.481 -1.820 -19.898 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.054 0.918 -18.606 1.00 0.00 H new ATOM 0 HE3 LYS A 70 6.838 -0.065 -19.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.474 -0.735 -17.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.738 -1.819 -17.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.052 -0.384 -16.757 1.00 0.00 H new ATOM 1153 N VAL A 71 13.678 -2.868 -18.034 1.00 0.00 N ATOM 1154 CA VAL A 71 15.040 -3.408 -18.299 1.00 0.00 C ATOM 1155 C VAL A 71 15.406 -4.425 -17.217 1.00 0.00 C ATOM 1156 O VAL A 71 16.117 -5.378 -17.462 1.00 0.00 O ATOM 1157 CB VAL A 71 16.046 -2.257 -18.284 1.00 0.00 C ATOM 1158 CG1 VAL A 71 17.314 -2.675 -19.031 1.00 0.00 C ATOM 1159 CG2 VAL A 71 15.427 -1.036 -18.967 1.00 0.00 C ATOM 0 H VAL A 71 13.637 -1.864 -17.857 1.00 0.00 H new ATOM 0 HA VAL A 71 15.059 -3.898 -19.272 1.00 0.00 H new ATOM 0 HB VAL A 71 16.301 -2.008 -17.254 1.00 0.00 H new ATOM 0 HG11 VAL A 71 18.030 -1.854 -19.020 1.00 0.00 H new ATOM 0 HG12 VAL A 71 17.753 -3.546 -18.544 1.00 0.00 H new ATOM 0 HG13 VAL A 71 17.063 -2.924 -20.062 1.00 0.00 H new ATOM 0 HG21 VAL A 71 16.142 -0.213 -18.958 1.00 0.00 H new ATOM 0 HG22 VAL A 71 15.173 -1.285 -19.997 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.525 -0.739 -18.433 1.00 0.00 H new ATOM 1169 N ILE A 72 14.924 -4.230 -16.019 1.00 0.00 N ATOM 1170 CA ILE A 72 15.244 -5.186 -14.923 1.00 0.00 C ATOM 1171 C ILE A 72 14.278 -6.372 -14.983 1.00 0.00 C ATOM 1172 O ILE A 72 14.660 -7.507 -14.779 1.00 0.00 O ATOM 1173 CB ILE A 72 15.100 -4.481 -13.573 1.00 0.00 C ATOM 1174 CG1 ILE A 72 15.813 -3.128 -13.629 1.00 0.00 C ATOM 1175 CG2 ILE A 72 15.731 -5.343 -12.478 1.00 0.00 C ATOM 1176 CD1 ILE A 72 15.224 -2.197 -12.568 1.00 0.00 C ATOM 0 H ILE A 72 14.323 -3.450 -15.753 1.00 0.00 H new ATOM 0 HA ILE A 72 16.267 -5.543 -15.040 1.00 0.00 H new ATOM 0 HB ILE A 72 14.044 -4.329 -13.352 1.00 0.00 H new ATOM 0 HG12 ILE A 72 16.881 -3.261 -13.459 1.00 0.00 H new ATOM 0 HG13 ILE A 72 15.700 -2.686 -14.619 1.00 0.00 H new ATOM 0 HG21 ILE A 72 15.629 -4.841 -11.516 1.00 0.00 H new ATOM 0 HG22 ILE A 72 15.227 -6.309 -12.439 1.00 0.00 H new ATOM 0 HG23 ILE A 72 16.788 -5.494 -12.698 1.00 0.00 H new ATOM 0 HD11 ILE A 72 15.732 -1.233 -12.607 1.00 0.00 H new ATOM 0 HD12 ILE A 72 14.160 -2.055 -12.759 1.00 0.00 H new ATOM 0 HD13 ILE A 72 15.360 -2.638 -11.581 1.00 0.00 H new ATOM 1188 N ASP A 73 13.028 -6.117 -15.263 1.00 0.00 N ATOM 1189 CA ASP A 73 12.039 -7.230 -15.337 1.00 0.00 C ATOM 1190 C ASP A 73 11.038 -6.946 -16.459 1.00 0.00 C ATOM 1191 O ASP A 73 10.508 -5.859 -16.570 1.00 0.00 O ATOM 1192 CB ASP A 73 11.296 -7.341 -14.004 1.00 0.00 C ATOM 1193 CG ASP A 73 11.618 -8.687 -13.351 1.00 0.00 C ATOM 1194 OD1 ASP A 73 11.963 -9.607 -14.075 1.00 0.00 O ATOM 1195 OD2 ASP A 73 11.514 -8.775 -12.139 1.00 0.00 O ATOM 0 H ASP A 73 12.650 -5.187 -15.443 1.00 0.00 H new ATOM 0 HA ASP A 73 12.558 -8.167 -15.541 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.589 -6.525 -13.343 1.00 0.00 H new ATOM 0 HB3 ASP A 73 10.222 -7.251 -14.166 1.00 0.00 H new ATOM 1200 N GLU A 74 10.774 -7.916 -17.290 1.00 0.00 N ATOM 1201 CA GLU A 74 9.807 -7.701 -18.404 1.00 0.00 C ATOM 1202 C GLU A 74 8.396 -8.064 -17.934 1.00 0.00 C ATOM 1203 O GLU A 74 7.413 -7.597 -18.473 1.00 0.00 O ATOM 1204 CB GLU A 74 10.193 -8.584 -19.593 1.00 0.00 C ATOM 1205 CG GLU A 74 11.444 -8.015 -20.266 1.00 0.00 C ATOM 1206 CD GLU A 74 12.194 -9.140 -20.981 1.00 0.00 C ATOM 1207 OE1 GLU A 74 11.539 -9.955 -21.612 1.00 0.00 O ATOM 1208 OE2 GLU A 74 13.410 -9.168 -20.888 1.00 0.00 O ATOM 0 H GLU A 74 11.186 -8.848 -17.246 1.00 0.00 H new ATOM 0 HA GLU A 74 9.830 -6.654 -18.707 1.00 0.00 H new ATOM 0 HB2 GLU A 74 10.380 -9.604 -19.257 1.00 0.00 H new ATOM 0 HB3 GLU A 74 9.371 -8.630 -20.308 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.165 -7.239 -20.979 1.00 0.00 H new ATOM 0 HG3 GLU A 74 12.090 -7.548 -19.522 1.00 0.00 H new ATOM 1215 N ASN A 75 8.290 -8.894 -16.934 1.00 0.00 N ATOM 1216 CA ASN A 75 6.943 -9.287 -16.432 1.00 0.00 C ATOM 1217 C ASN A 75 6.603 -8.465 -15.187 1.00 0.00 C ATOM 1218 O ASN A 75 6.175 -8.995 -14.180 1.00 0.00 O ATOM 1219 CB ASN A 75 6.943 -10.775 -16.077 1.00 0.00 C ATOM 1220 CG ASN A 75 7.774 -10.999 -14.811 1.00 0.00 C ATOM 1221 OD1 ASN A 75 8.697 -10.258 -14.538 1.00 0.00 O ATOM 1222 ND2 ASN A 75 7.481 -11.996 -14.022 1.00 0.00 N ATOM 0 H ASN A 75 9.077 -9.317 -16.443 1.00 0.00 H new ATOM 0 HA ASN A 75 6.199 -9.099 -17.206 1.00 0.00 H new ATOM 0 HB2 ASN A 75 5.922 -11.122 -15.920 1.00 0.00 H new ATOM 0 HB3 ASN A 75 7.354 -11.356 -16.902 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.027 -12.154 -13.175 1.00 0.00 H new ATOM 0 HD22 ASN A 75 6.706 -12.618 -14.252 1.00 0.00 H new ATOM 1229 N ILE A 76 6.790 -7.176 -15.246 1.00 0.00 N ATOM 1230 CA ILE A 76 6.478 -6.322 -14.066 1.00 0.00 C ATOM 1231 C ILE A 76 5.212 -5.509 -14.345 1.00 0.00 C ATOM 1232 O ILE A 76 5.053 -4.935 -15.404 1.00 0.00 O ATOM 1233 CB ILE A 76 7.647 -5.372 -13.801 1.00 0.00 C ATOM 1234 CG1 ILE A 76 7.260 -4.383 -12.697 1.00 0.00 C ATOM 1235 CG2 ILE A 76 7.978 -4.601 -15.080 1.00 0.00 C ATOM 1236 CD1 ILE A 76 8.417 -4.246 -11.707 1.00 0.00 C ATOM 0 H ILE A 76 7.146 -6.677 -16.061 1.00 0.00 H new ATOM 0 HA ILE A 76 6.318 -6.954 -13.192 1.00 0.00 H new ATOM 0 HB ILE A 76 8.518 -5.947 -13.487 1.00 0.00 H new ATOM 0 HG12 ILE A 76 7.022 -3.412 -13.131 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.365 -4.730 -12.181 1.00 0.00 H new ATOM 0 HG21 ILE A 76 8.811 -3.924 -14.891 1.00 0.00 H new ATOM 0 HG22 ILE A 76 8.252 -5.303 -15.867 1.00 0.00 H new ATOM 0 HG23 ILE A 76 7.107 -4.026 -15.394 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.142 -3.542 -10.921 1.00 0.00 H new ATOM 0 HD12 ILE A 76 8.634 -5.218 -11.264 1.00 0.00 H new ATOM 0 HD13 ILE A 76 9.301 -3.880 -12.229 1.00 0.00 H new ATOM 1248 N ARG A 77 4.310 -5.454 -13.403 1.00 0.00 N ATOM 1249 CA ARG A 77 3.056 -4.677 -13.618 1.00 0.00 C ATOM 1250 C ARG A 77 3.135 -3.358 -12.847 1.00 0.00 C ATOM 1251 O ARG A 77 3.639 -3.301 -11.743 1.00 0.00 O ATOM 1252 CB ARG A 77 1.860 -5.489 -13.117 1.00 0.00 C ATOM 1253 CG ARG A 77 1.708 -6.751 -13.967 1.00 0.00 C ATOM 1254 CD ARG A 77 1.838 -7.987 -13.074 1.00 0.00 C ATOM 1255 NE ARG A 77 0.898 -9.042 -13.546 1.00 0.00 N ATOM 1256 CZ ARG A 77 1.193 -9.761 -14.596 1.00 0.00 C ATOM 1257 NH1 ARG A 77 2.313 -9.559 -15.237 1.00 0.00 N ATOM 1258 NH2 ARG A 77 0.366 -10.684 -15.006 1.00 0.00 N ATOM 0 H ARG A 77 4.387 -5.913 -12.495 1.00 0.00 H new ATOM 0 HA ARG A 77 2.935 -4.470 -14.681 1.00 0.00 H new ATOM 0 HB2 ARG A 77 2.002 -5.758 -12.070 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.951 -4.889 -13.172 1.00 0.00 H new ATOM 0 HG2 ARG A 77 0.740 -6.751 -14.467 1.00 0.00 H new ATOM 0 HG3 ARG A 77 2.469 -6.771 -14.747 1.00 0.00 H new ATOM 0 HD2 ARG A 77 2.862 -8.360 -13.098 1.00 0.00 H new ATOM 0 HD3 ARG A 77 1.618 -7.726 -12.039 1.00 0.00 H new ATOM 0 HE ARG A 77 0.022 -9.203 -13.048 1.00 0.00 H new ATOM 0 HH11 ARG A 77 2.960 -8.838 -14.918 1.00 0.00 H new ATOM 0 HH12 ARG A 77 2.540 -10.122 -16.056 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -0.509 -10.843 -14.507 1.00 0.00 H new ATOM 0 HH22 ARG A 77 0.595 -11.246 -15.826 1.00 0.00 H new ATOM 1272 N VAL A 78 2.642 -2.295 -13.422 1.00 0.00 N ATOM 1273 CA VAL A 78 2.689 -0.981 -12.721 1.00 0.00 C ATOM 1274 C VAL A 78 1.372 -0.234 -12.944 1.00 0.00 C ATOM 1275 O VAL A 78 1.007 0.082 -14.058 1.00 0.00 O ATOM 1276 CB VAL A 78 3.845 -0.149 -13.278 1.00 0.00 C ATOM 1277 CG1 VAL A 78 3.881 1.209 -12.577 1.00 0.00 C ATOM 1278 CG2 VAL A 78 5.165 -0.884 -13.032 1.00 0.00 C ATOM 0 H VAL A 78 2.209 -2.280 -14.346 1.00 0.00 H new ATOM 0 HA VAL A 78 2.837 -1.145 -11.654 1.00 0.00 H new ATOM 0 HB VAL A 78 3.703 -0.001 -14.349 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.705 1.802 -12.974 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.941 1.733 -12.750 1.00 0.00 H new ATOM 0 HG13 VAL A 78 4.023 1.062 -11.506 1.00 0.00 H new ATOM 0 HG21 VAL A 78 5.990 -0.292 -13.428 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.306 -1.031 -11.961 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.141 -1.853 -13.531 1.00 0.00 H new ATOM 1288 N ILE A 79 0.658 0.053 -11.890 1.00 0.00 N ATOM 1289 CA ILE A 79 -0.632 0.782 -12.041 1.00 0.00 C ATOM 1290 C ILE A 79 -0.370 2.288 -11.964 1.00 0.00 C ATOM 1291 O ILE A 79 0.166 2.783 -10.993 1.00 0.00 O ATOM 1292 CB ILE A 79 -1.588 0.373 -10.920 1.00 0.00 C ATOM 1293 CG1 ILE A 79 -1.457 -1.129 -10.662 1.00 0.00 C ATOM 1294 CG2 ILE A 79 -3.026 0.699 -11.326 1.00 0.00 C ATOM 1295 CD1 ILE A 79 -2.093 -1.895 -11.818 1.00 0.00 C ATOM 0 H ILE A 79 0.912 -0.186 -10.932 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.080 0.535 -13.003 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.337 0.921 -10.012 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -0.407 -1.403 -10.563 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.945 -1.393 -9.724 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.705 0.406 -10.525 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -3.119 1.770 -11.508 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.280 0.153 -12.235 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.002 -2.966 -11.638 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.147 -1.628 -11.895 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.585 -1.639 -12.748 1.00 0.00 H new ATOM 1307 N ILE A 80 -0.742 3.021 -12.977 1.00 0.00 N ATOM 1308 CA ILE A 80 -0.507 4.494 -12.953 1.00 0.00 C ATOM 1309 C ILE A 80 -1.715 5.190 -12.327 1.00 0.00 C ATOM 1310 O ILE A 80 -2.844 4.793 -12.526 1.00 0.00 O ATOM 1311 CB ILE A 80 -0.309 5.029 -14.378 1.00 0.00 C ATOM 1312 CG1 ILE A 80 -0.040 3.875 -15.350 1.00 0.00 C ATOM 1313 CG2 ILE A 80 0.880 5.992 -14.396 1.00 0.00 C ATOM 1314 CD1 ILE A 80 0.438 4.438 -16.691 1.00 0.00 C ATOM 0 H ILE A 80 -1.197 2.666 -13.818 1.00 0.00 H new ATOM 0 HA ILE A 80 0.390 4.695 -12.367 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.215 5.549 -14.689 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.713 3.205 -14.936 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -0.947 3.287 -15.493 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.024 6.374 -15.407 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.685 6.823 -13.718 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.779 5.466 -14.076 1.00 0.00 H new ATOM 0 HD11 ILE A 80 0.629 3.618 -17.383 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.330 5.091 -17.106 1.00 0.00 H new ATOM 0 HD13 ILE A 80 1.355 5.007 -16.540 1.00 0.00 H new ATOM 1326 N MET A 81 -1.488 6.229 -11.574 1.00 0.00 N ATOM 1327 CA MET A 81 -2.627 6.952 -10.940 1.00 0.00 C ATOM 1328 C MET A 81 -2.669 8.389 -11.467 1.00 0.00 C ATOM 1329 O MET A 81 -2.360 9.329 -10.761 1.00 0.00 O ATOM 1330 CB MET A 81 -2.461 6.974 -9.413 1.00 0.00 C ATOM 1331 CG MET A 81 -1.024 6.604 -9.029 1.00 0.00 C ATOM 1332 SD MET A 81 -0.724 7.060 -7.303 1.00 0.00 S ATOM 1333 CE MET A 81 0.125 5.540 -6.812 1.00 0.00 C ATOM 0 H MET A 81 -0.564 6.609 -11.370 1.00 0.00 H new ATOM 0 HA MET A 81 -3.556 6.438 -11.187 1.00 0.00 H new ATOM 0 HB2 MET A 81 -2.704 7.964 -9.028 1.00 0.00 H new ATOM 0 HB3 MET A 81 -3.159 6.274 -8.954 1.00 0.00 H new ATOM 0 HG2 MET A 81 -0.863 5.535 -9.167 1.00 0.00 H new ATOM 0 HG3 MET A 81 -0.318 7.119 -9.680 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.763 5.741 -5.952 1.00 0.00 H new ATOM 0 HE2 MET A 81 -0.611 4.781 -6.548 1.00 0.00 H new ATOM 0 HE3 MET A 81 0.735 5.180 -7.640 1.00 0.00 H new ATOM 1343 N THR A 82 -3.044 8.564 -12.705 1.00 0.00 N ATOM 1344 CA THR A 82 -3.103 9.937 -13.280 1.00 0.00 C ATOM 1345 C THR A 82 -3.660 9.872 -14.704 1.00 0.00 C ATOM 1346 O THR A 82 -3.311 10.667 -15.554 1.00 0.00 O ATOM 1347 CB THR A 82 -1.694 10.533 -13.317 1.00 0.00 C ATOM 1348 OG1 THR A 82 -1.774 11.916 -13.632 1.00 0.00 O ATOM 1349 CG2 THR A 82 -0.862 9.812 -14.380 1.00 0.00 C ATOM 0 H THR A 82 -3.312 7.815 -13.343 1.00 0.00 H new ATOM 0 HA THR A 82 -3.750 10.561 -12.663 1.00 0.00 H new ATOM 0 HB THR A 82 -1.221 10.410 -12.343 1.00 0.00 H new ATOM 0 HG1 THR A 82 -2.297 12.035 -14.452 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.142 10.237 -14.406 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.801 8.751 -14.137 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.333 9.934 -15.355 1.00 0.00 H new ATOM 1357 N ALA A 83 -4.521 8.929 -14.973 1.00 0.00 N ATOM 1358 CA ALA A 83 -5.092 8.815 -16.346 1.00 0.00 C ATOM 1359 C ALA A 83 -5.492 10.204 -16.850 1.00 0.00 C ATOM 1360 O ALA A 83 -4.805 10.804 -17.652 1.00 0.00 O ATOM 1361 CB ALA A 83 -6.323 7.908 -16.313 1.00 0.00 C ATOM 0 H ALA A 83 -4.853 8.234 -14.304 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.345 8.388 -17.016 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -6.740 7.825 -17.316 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -6.037 6.919 -15.956 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -7.070 8.333 -15.643 1.00 0.00 H new ATOM 1458 N ILE A 90 1.945 7.283 -21.726 1.00 0.00 N ATOM 1459 CA ILE A 90 0.964 6.412 -21.015 1.00 0.00 C ATOM 1460 C ILE A 90 0.162 5.615 -22.048 1.00 0.00 C ATOM 1461 O ILE A 90 -0.088 4.437 -21.881 1.00 0.00 O ATOM 1462 CB ILE A 90 0.022 7.282 -20.162 1.00 0.00 C ATOM 1463 CG1 ILE A 90 -1.299 6.546 -19.911 1.00 0.00 C ATOM 1464 CG2 ILE A 90 -0.270 8.598 -20.879 1.00 0.00 C ATOM 1465 CD1 ILE A 90 -2.249 7.456 -19.128 1.00 0.00 C ATOM 0 HA ILE A 90 1.490 5.720 -20.357 1.00 0.00 H new ATOM 0 HB ILE A 90 0.511 7.485 -19.209 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.753 6.258 -20.859 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.116 5.628 -19.353 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.937 9.205 -20.267 1.00 0.00 H new ATOM 0 HG22 ILE A 90 0.663 9.137 -21.044 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -0.745 8.392 -21.838 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.189 6.933 -18.949 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -1.794 7.722 -18.174 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -2.441 8.362 -19.703 1.00 0.00 H new ATOM 1477 N GLN A 91 -0.243 6.247 -23.112 1.00 0.00 N ATOM 1478 CA GLN A 91 -1.028 5.527 -24.153 1.00 0.00 C ATOM 1479 C GLN A 91 -0.242 4.303 -24.630 1.00 0.00 C ATOM 1480 O GLN A 91 -0.796 3.244 -24.848 1.00 0.00 O ATOM 1481 CB GLN A 91 -1.282 6.463 -25.338 1.00 0.00 C ATOM 1482 CG GLN A 91 -2.736 6.323 -25.796 1.00 0.00 C ATOM 1483 CD GLN A 91 -2.890 6.924 -27.194 1.00 0.00 C ATOM 1484 OE1 GLN A 91 -2.313 7.950 -27.494 1.00 0.00 O ATOM 1485 NE2 GLN A 91 -3.652 6.324 -28.068 1.00 0.00 N ATOM 0 H GLN A 91 -0.065 7.232 -23.307 1.00 0.00 H new ATOM 0 HA GLN A 91 -1.981 5.206 -23.732 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -1.078 7.494 -25.051 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -0.606 6.221 -26.158 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -3.026 5.272 -25.806 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -3.400 6.830 -25.095 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -4.136 5.462 -27.816 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -3.763 6.717 -29.003 1.00 0.00 H new ATOM 1494 N GLU A 92 1.046 4.439 -24.794 1.00 0.00 N ATOM 1495 CA GLU A 92 1.866 3.283 -25.255 1.00 0.00 C ATOM 1496 C GLU A 92 2.366 2.492 -24.045 1.00 0.00 C ATOM 1497 O GLU A 92 2.423 1.278 -24.066 1.00 0.00 O ATOM 1498 CB GLU A 92 3.063 3.797 -26.058 1.00 0.00 C ATOM 1499 CG GLU A 92 2.567 4.634 -27.237 1.00 0.00 C ATOM 1500 CD GLU A 92 2.199 3.710 -28.400 1.00 0.00 C ATOM 1501 OE1 GLU A 92 2.205 2.506 -28.198 1.00 0.00 O ATOM 1502 OE2 GLU A 92 1.918 4.221 -29.471 1.00 0.00 O ATOM 0 H GLU A 92 1.566 5.301 -24.629 1.00 0.00 H new ATOM 0 HA GLU A 92 1.256 2.634 -25.883 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.711 4.397 -25.420 1.00 0.00 H new ATOM 0 HB3 GLU A 92 3.659 2.959 -26.419 1.00 0.00 H new ATOM 0 HG2 GLU A 92 1.700 5.224 -26.939 1.00 0.00 H new ATOM 0 HG3 GLU A 92 3.339 5.337 -27.548 1.00 0.00 H new ATOM 1509 N SER A 93 2.731 3.170 -22.991 1.00 0.00 N ATOM 1510 CA SER A 93 3.231 2.456 -21.781 1.00 0.00 C ATOM 1511 C SER A 93 2.344 1.242 -21.500 1.00 0.00 C ATOM 1512 O SER A 93 2.821 0.189 -21.125 1.00 0.00 O ATOM 1513 CB SER A 93 3.194 3.402 -20.580 1.00 0.00 C ATOM 1514 OG SER A 93 4.455 4.046 -20.451 1.00 0.00 O ATOM 0 H SER A 93 2.705 4.187 -22.915 1.00 0.00 H new ATOM 0 HA SER A 93 4.255 2.125 -21.953 1.00 0.00 H new ATOM 0 HB2 SER A 93 2.406 4.143 -20.710 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.962 2.846 -19.672 1.00 0.00 H new ATOM 0 HG SER A 93 4.434 4.655 -19.683 1.00 0.00 H new ATOM 1520 N LYS A 94 1.060 1.378 -21.677 1.00 0.00 N ATOM 1521 CA LYS A 94 0.147 0.229 -21.419 1.00 0.00 C ATOM 1522 C LYS A 94 0.746 -1.041 -22.024 1.00 0.00 C ATOM 1523 O LYS A 94 0.941 -2.031 -21.347 1.00 0.00 O ATOM 1524 CB LYS A 94 -1.215 0.506 -22.060 1.00 0.00 C ATOM 1525 CG LYS A 94 -2.130 1.186 -21.040 1.00 0.00 C ATOM 1526 CD LYS A 94 -3.538 0.597 -21.144 1.00 0.00 C ATOM 1527 CE LYS A 94 -4.257 0.750 -19.802 1.00 0.00 C ATOM 1528 NZ LYS A 94 -4.906 2.090 -19.736 1.00 0.00 N ATOM 0 H LYS A 94 0.603 2.235 -21.989 1.00 0.00 H new ATOM 0 HA LYS A 94 0.022 0.097 -20.344 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.094 1.142 -22.937 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.664 -0.426 -22.403 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.738 1.044 -20.033 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.160 2.260 -21.222 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -4.099 1.105 -21.929 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -3.484 -0.456 -21.421 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.005 -0.034 -19.687 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -3.548 0.637 -18.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.395 2.194 -18.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.182 2.831 -19.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.594 2.181 -20.510 1.00 0.00 H new ATOM 1542 N GLU A 95 1.042 -1.021 -23.295 1.00 0.00 N ATOM 1543 CA GLU A 95 1.629 -2.227 -23.943 1.00 0.00 C ATOM 1544 C GLU A 95 2.937 -2.598 -23.240 1.00 0.00 C ATOM 1545 O GLU A 95 3.200 -3.752 -22.966 1.00 0.00 O ATOM 1546 CB GLU A 95 1.911 -1.928 -25.417 1.00 0.00 C ATOM 1547 CG GLU A 95 0.592 -1.891 -26.192 1.00 0.00 C ATOM 1548 CD GLU A 95 0.411 -3.204 -26.955 1.00 0.00 C ATOM 1549 OE1 GLU A 95 0.514 -4.248 -26.331 1.00 0.00 O ATOM 1550 OE2 GLU A 95 0.174 -3.145 -28.150 1.00 0.00 O ATOM 0 H GLU A 95 0.902 -0.221 -23.912 1.00 0.00 H new ATOM 0 HA GLU A 95 0.927 -3.057 -23.868 1.00 0.00 H new ATOM 0 HB2 GLU A 95 2.428 -0.973 -25.513 1.00 0.00 H new ATOM 0 HB3 GLU A 95 2.569 -2.690 -25.834 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -0.241 -1.739 -25.506 1.00 0.00 H new ATOM 0 HG3 GLU A 95 0.590 -1.051 -26.887 1.00 0.00 H new ATOM 1557 N LEU A 96 3.758 -1.626 -22.945 1.00 0.00 N ATOM 1558 CA LEU A 96 5.047 -1.923 -22.260 1.00 0.00 C ATOM 1559 C LEU A 96 4.793 -2.865 -21.081 1.00 0.00 C ATOM 1560 O LEU A 96 5.264 -3.985 -21.058 1.00 0.00 O ATOM 1561 CB LEU A 96 5.663 -0.619 -21.748 1.00 0.00 C ATOM 1562 CG LEU A 96 6.182 0.200 -22.929 1.00 0.00 C ATOM 1563 CD1 LEU A 96 6.660 1.566 -22.435 1.00 0.00 C ATOM 1564 CD2 LEU A 96 7.350 -0.540 -23.587 1.00 0.00 C ATOM 0 H LEU A 96 3.591 -0.641 -23.149 1.00 0.00 H new ATOM 0 HA LEU A 96 5.732 -2.398 -22.963 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.919 -0.046 -21.194 1.00 0.00 H new ATOM 0 HB3 LEU A 96 6.477 -0.836 -21.057 1.00 0.00 H new ATOM 0 HG LEU A 96 5.380 0.337 -23.655 1.00 0.00 H new ATOM 0 HD11 LEU A 96 7.030 2.149 -23.278 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.830 2.094 -21.965 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.461 1.430 -21.709 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.721 0.043 -24.430 1.00 0.00 H new ATOM 0 HD22 LEU A 96 8.150 -0.677 -22.860 1.00 0.00 H new ATOM 0 HD23 LEU A 96 7.011 -1.514 -23.941 1.00 0.00 H new ATOM 1576 N GLY A 97 4.053 -2.421 -20.103 1.00 0.00 N ATOM 1577 CA GLY A 97 3.771 -3.292 -18.927 1.00 0.00 C ATOM 1578 C GLY A 97 2.889 -2.538 -17.931 1.00 0.00 C ATOM 1579 O GLY A 97 3.037 -2.671 -16.733 1.00 0.00 O ATOM 0 H GLY A 97 3.631 -1.493 -20.067 1.00 0.00 H new ATOM 0 HA2 GLY A 97 3.273 -4.206 -19.250 1.00 0.00 H new ATOM 0 HA3 GLY A 97 4.705 -3.589 -18.449 1.00 0.00 H new ATOM 1583 N ALA A 98 1.973 -1.745 -18.416 1.00 0.00 N ATOM 1584 CA ALA A 98 1.083 -0.985 -17.495 1.00 0.00 C ATOM 1585 C ALA A 98 -0.266 -1.701 -17.381 1.00 0.00 C ATOM 1586 O ALA A 98 -1.118 -1.578 -18.238 1.00 0.00 O ATOM 1587 CB ALA A 98 0.865 0.427 -18.045 1.00 0.00 C ATOM 0 H ALA A 98 1.803 -1.591 -19.410 1.00 0.00 H new ATOM 0 HA ALA A 98 1.547 -0.924 -16.511 1.00 0.00 H new ATOM 0 HB1 ALA A 98 0.214 0.983 -17.371 1.00 0.00 H new ATOM 0 HB2 ALA A 98 1.824 0.938 -18.126 1.00 0.00 H new ATOM 0 HB3 ALA A 98 0.402 0.366 -19.030 1.00 0.00 H new ATOM 1593 N LEU A 99 -0.463 -2.451 -16.331 1.00 0.00 N ATOM 1594 CA LEU A 99 -1.754 -3.175 -16.166 1.00 0.00 C ATOM 1595 C LEU A 99 -2.916 -2.207 -16.397 1.00 0.00 C ATOM 1596 O LEU A 99 -3.701 -2.372 -17.310 1.00 0.00 O ATOM 1597 CB LEU A 99 -1.842 -3.748 -14.750 1.00 0.00 C ATOM 1598 CG LEU A 99 -1.031 -5.042 -14.669 1.00 0.00 C ATOM 1599 CD1 LEU A 99 -1.235 -5.688 -13.299 1.00 0.00 C ATOM 1600 CD2 LEU A 99 -1.502 -6.006 -15.761 1.00 0.00 C ATOM 0 H LEU A 99 0.214 -2.593 -15.581 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.808 -3.988 -16.890 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -1.463 -3.023 -14.029 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.882 -3.942 -14.489 1.00 0.00 H new ATOM 0 HG LEU A 99 0.026 -4.818 -14.811 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -0.657 -6.610 -13.242 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.902 -5.002 -12.520 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.292 -5.913 -13.157 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.925 -6.929 -15.705 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.559 -6.230 -15.618 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.358 -5.547 -16.739 1.00 0.00 H new ATOM 1612 N THR A 100 -3.035 -1.197 -15.578 1.00 0.00 N ATOM 1613 CA THR A 100 -4.149 -0.224 -15.755 1.00 0.00 C ATOM 1614 C THR A 100 -3.665 1.182 -15.390 1.00 0.00 C ATOM 1615 O THR A 100 -2.545 1.373 -14.960 1.00 0.00 O ATOM 1616 CB THR A 100 -5.317 -0.613 -14.844 1.00 0.00 C ATOM 1617 OG1 THR A 100 -6.073 0.548 -14.526 1.00 0.00 O ATOM 1618 CG2 THR A 100 -4.779 -1.242 -13.559 1.00 0.00 C ATOM 0 H THR A 100 -2.410 -1.004 -14.796 1.00 0.00 H new ATOM 0 HA THR A 100 -4.478 -0.236 -16.794 1.00 0.00 H new ATOM 0 HB THR A 100 -5.954 -1.333 -15.357 1.00 0.00 H new ATOM 0 HG1 THR A 100 -5.912 0.797 -13.592 1.00 0.00 H new ATOM 0 HG21 THR A 100 -5.612 -1.518 -12.912 1.00 0.00 H new ATOM 0 HG22 THR A 100 -4.200 -2.132 -13.804 1.00 0.00 H new ATOM 0 HG23 THR A 100 -4.141 -0.525 -13.042 1.00 0.00 H new ATOM 1626 N HIS A 101 -4.504 2.167 -15.560 1.00 0.00 N ATOM 1627 CA HIS A 101 -4.101 3.561 -15.227 1.00 0.00 C ATOM 1628 C HIS A 101 -5.289 4.292 -14.592 1.00 0.00 C ATOM 1629 O HIS A 101 -6.127 4.842 -15.279 1.00 0.00 O ATOM 1630 CB HIS A 101 -3.680 4.285 -16.507 1.00 0.00 C ATOM 1631 CG HIS A 101 -3.023 5.592 -16.155 1.00 0.00 C ATOM 1632 ND1 HIS A 101 -1.889 6.048 -16.808 1.00 0.00 N ATOM 1633 CD2 HIS A 101 -3.330 6.552 -15.224 1.00 0.00 C ATOM 1634 CE1 HIS A 101 -1.559 7.235 -16.267 1.00 0.00 C ATOM 1635 NE2 HIS A 101 -2.405 7.588 -15.296 1.00 0.00 N ATOM 0 H HIS A 101 -5.454 2.065 -15.916 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.266 3.546 -14.527 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -2.992 3.663 -17.079 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -4.550 4.462 -17.139 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -1.394 5.571 -17.562 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -4.164 6.510 -14.539 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -0.713 7.830 -16.580 1.00 0.00 H new ATOM 1643 N PHE A 102 -5.370 4.299 -13.290 1.00 0.00 N ATOM 1644 CA PHE A 102 -6.507 4.989 -12.618 1.00 0.00 C ATOM 1645 C PHE A 102 -6.216 6.487 -12.521 1.00 0.00 C ATOM 1646 O PHE A 102 -5.085 6.918 -12.626 1.00 0.00 O ATOM 1647 CB PHE A 102 -6.691 4.416 -11.211 1.00 0.00 C ATOM 1648 CG PHE A 102 -7.392 3.082 -11.297 1.00 0.00 C ATOM 1649 CD1 PHE A 102 -6.830 2.043 -12.051 1.00 0.00 C ATOM 1650 CD2 PHE A 102 -8.602 2.882 -10.624 1.00 0.00 C ATOM 1651 CE1 PHE A 102 -7.479 0.806 -12.130 1.00 0.00 C ATOM 1652 CE2 PHE A 102 -9.251 1.645 -10.703 1.00 0.00 C ATOM 1653 CZ PHE A 102 -8.691 0.607 -11.456 1.00 0.00 C ATOM 0 H PHE A 102 -4.698 3.857 -12.663 1.00 0.00 H new ATOM 0 HA PHE A 102 -7.416 4.834 -13.199 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -5.722 4.299 -10.725 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -7.273 5.106 -10.599 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -5.896 2.197 -12.571 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -9.035 3.683 -10.043 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -7.046 0.005 -12.710 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -10.185 1.491 -10.183 1.00 0.00 H new ATOM 0 HZ PHE A 102 -9.193 -0.347 -11.518 1.00 0.00 H new ATOM 1663 N ALA A 103 -7.228 7.285 -12.320 1.00 0.00 N ATOM 1664 CA ALA A 103 -7.012 8.756 -12.215 1.00 0.00 C ATOM 1665 C ALA A 103 -7.915 9.322 -11.118 1.00 0.00 C ATOM 1666 O ALA A 103 -8.217 8.659 -10.146 1.00 0.00 O ATOM 1667 CB ALA A 103 -7.352 9.419 -13.550 1.00 0.00 C ATOM 0 H ALA A 103 -8.197 6.982 -12.224 1.00 0.00 H new ATOM 0 HA ALA A 103 -5.969 8.955 -11.968 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.194 10.495 -13.473 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -6.710 9.013 -14.332 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -8.395 9.223 -13.799 1.00 0.00 H new ATOM 1673 N LYS A 104 -8.352 10.543 -11.265 1.00 0.00 N ATOM 1674 CA LYS A 104 -9.236 11.147 -10.228 1.00 0.00 C ATOM 1675 C LYS A 104 -10.689 11.107 -10.715 1.00 0.00 C ATOM 1676 O LYS A 104 -10.949 11.248 -11.893 1.00 0.00 O ATOM 1677 CB LYS A 104 -8.819 12.599 -9.983 1.00 0.00 C ATOM 1678 CG LYS A 104 -8.756 13.345 -11.317 1.00 0.00 C ATOM 1679 CD LYS A 104 -7.311 13.757 -11.605 1.00 0.00 C ATOM 1680 CE LYS A 104 -6.895 14.870 -10.641 1.00 0.00 C ATOM 1681 NZ LYS A 104 -6.283 15.990 -11.410 1.00 0.00 N ATOM 0 H LYS A 104 -8.135 11.148 -12.057 1.00 0.00 H new ATOM 0 HA LYS A 104 -9.146 10.584 -9.299 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -9.531 13.085 -9.316 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -7.847 12.631 -9.490 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -9.131 12.709 -12.119 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.397 14.226 -11.283 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -6.648 12.899 -11.494 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.218 14.100 -12.635 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -7.762 15.227 -10.085 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.184 14.486 -9.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -6.000 16.747 -10.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.446 15.644 -11.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -6.975 16.362 -12.091 1.00 0.00 H new ATOM 1695 N PRO A 105 -11.593 10.918 -9.788 1.00 0.00 N ATOM 1696 CA PRO A 105 -11.265 10.748 -8.360 1.00 0.00 C ATOM 1697 C PRO A 105 -10.758 9.327 -8.093 1.00 0.00 C ATOM 1698 O PRO A 105 -11.112 8.392 -8.783 1.00 0.00 O ATOM 1699 CB PRO A 105 -12.601 10.994 -7.653 1.00 0.00 C ATOM 1700 CG PRO A 105 -13.704 10.726 -8.704 1.00 0.00 C ATOM 1701 CD PRO A 105 -13.037 10.854 -10.086 1.00 0.00 C ATOM 0 HA PRO A 105 -10.478 11.420 -8.018 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -12.714 10.333 -6.794 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -12.661 12.016 -7.279 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -14.132 9.732 -8.571 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -14.520 11.441 -8.600 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -13.275 10.002 -10.723 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -13.375 11.748 -10.610 1.00 0.00 H new ATOM 1709 N PHE A 106 -9.932 9.159 -7.096 1.00 0.00 N ATOM 1710 CA PHE A 106 -9.404 7.801 -6.787 1.00 0.00 C ATOM 1711 C PHE A 106 -10.422 7.040 -5.936 1.00 0.00 C ATOM 1712 O PHE A 106 -10.563 7.282 -4.753 1.00 0.00 O ATOM 1713 CB PHE A 106 -8.089 7.928 -6.015 1.00 0.00 C ATOM 1714 CG PHE A 106 -7.098 6.915 -6.533 1.00 0.00 C ATOM 1715 CD1 PHE A 106 -6.736 6.917 -7.884 1.00 0.00 C ATOM 1716 CD2 PHE A 106 -6.539 5.973 -5.660 1.00 0.00 C ATOM 1717 CE1 PHE A 106 -5.815 5.978 -8.364 1.00 0.00 C ATOM 1718 CE2 PHE A 106 -5.618 5.034 -6.140 1.00 0.00 C ATOM 1719 CZ PHE A 106 -5.257 5.036 -7.492 1.00 0.00 C ATOM 0 H PHE A 106 -9.601 9.904 -6.483 1.00 0.00 H new ATOM 0 HA PHE A 106 -9.229 7.259 -7.717 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -7.686 8.935 -6.126 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -8.264 7.770 -4.951 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.167 7.643 -8.557 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.818 5.971 -4.617 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -5.535 5.981 -9.407 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -5.186 4.308 -5.467 1.00 0.00 H new ATOM 0 HZ PHE A 106 -4.548 4.311 -7.863 1.00 0.00 H new ATOM 1729 N ASP A 107 -11.136 6.120 -6.526 1.00 0.00 N ATOM 1730 CA ASP A 107 -12.143 5.345 -5.749 1.00 0.00 C ATOM 1731 C ASP A 107 -11.481 4.098 -5.161 1.00 0.00 C ATOM 1732 O ASP A 107 -11.245 3.126 -5.852 1.00 0.00 O ATOM 1733 CB ASP A 107 -13.290 4.928 -6.671 1.00 0.00 C ATOM 1734 CG ASP A 107 -14.317 4.119 -5.877 1.00 0.00 C ATOM 1735 OD1 ASP A 107 -14.240 4.134 -4.660 1.00 0.00 O ATOM 1736 OD2 ASP A 107 -15.162 3.499 -6.500 1.00 0.00 O ATOM 0 H ASP A 107 -11.065 5.872 -7.513 1.00 0.00 H new ATOM 0 HA ASP A 107 -12.535 5.964 -4.942 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -13.762 5.810 -7.103 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -12.906 4.334 -7.500 1.00 0.00 H new ATOM 1741 N ILE A 108 -11.177 4.118 -3.893 1.00 0.00 N ATOM 1742 CA ILE A 108 -10.527 2.935 -3.261 1.00 0.00 C ATOM 1743 C ILE A 108 -11.209 1.652 -3.744 1.00 0.00 C ATOM 1744 O ILE A 108 -10.609 0.595 -3.777 1.00 0.00 O ATOM 1745 CB ILE A 108 -10.653 3.037 -1.740 1.00 0.00 C ATOM 1746 CG1 ILE A 108 -9.783 4.190 -1.234 1.00 0.00 C ATOM 1747 CG2 ILE A 108 -10.187 1.729 -1.099 1.00 0.00 C ATOM 1748 CD1 ILE A 108 -8.358 4.026 -1.765 1.00 0.00 C ATOM 0 H ILE A 108 -11.351 4.903 -3.266 1.00 0.00 H new ATOM 0 HA ILE A 108 -9.473 2.910 -3.540 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.694 3.221 -1.474 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -10.197 5.143 -1.562 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.777 4.204 -0.144 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.277 1.803 -0.015 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -10.805 0.907 -1.460 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -9.146 1.544 -1.365 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.739 4.847 -1.405 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -7.946 3.080 -1.415 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.373 4.034 -2.855 1.00 0.00 H new ATOM 1760 N ASP A 109 -12.457 1.734 -4.115 1.00 0.00 N ATOM 1761 CA ASP A 109 -13.173 0.517 -4.592 1.00 0.00 C ATOM 1762 C ASP A 109 -12.659 0.131 -5.981 1.00 0.00 C ATOM 1763 O ASP A 109 -12.343 -1.013 -6.240 1.00 0.00 O ATOM 1764 CB ASP A 109 -14.674 0.804 -4.666 1.00 0.00 C ATOM 1765 CG ASP A 109 -15.179 1.238 -3.288 1.00 0.00 C ATOM 1766 OD1 ASP A 109 -14.734 2.271 -2.814 1.00 0.00 O ATOM 1767 OD2 ASP A 109 -16.002 0.531 -2.731 1.00 0.00 O ATOM 0 H ASP A 109 -13.012 2.590 -4.109 1.00 0.00 H new ATOM 0 HA ASP A 109 -12.993 -0.304 -3.898 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -14.870 1.586 -5.400 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -15.209 -0.086 -4.998 1.00 0.00 H new ATOM 1772 N GLU A 110 -12.571 1.076 -6.876 1.00 0.00 N ATOM 1773 CA GLU A 110 -12.077 0.759 -8.246 1.00 0.00 C ATOM 1774 C GLU A 110 -10.601 0.362 -8.173 1.00 0.00 C ATOM 1775 O GLU A 110 -10.088 -0.320 -9.038 1.00 0.00 O ATOM 1776 CB GLU A 110 -12.232 1.990 -9.142 1.00 0.00 C ATOM 1777 CG GLU A 110 -13.657 2.535 -9.021 1.00 0.00 C ATOM 1778 CD GLU A 110 -13.805 3.778 -9.899 1.00 0.00 C ATOM 1779 OE1 GLU A 110 -13.009 4.690 -9.740 1.00 0.00 O ATOM 1780 OE2 GLU A 110 -14.711 3.799 -10.715 1.00 0.00 O ATOM 0 H GLU A 110 -12.819 2.053 -6.718 1.00 0.00 H new ATOM 0 HA GLU A 110 -12.656 -0.066 -8.661 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -11.513 2.756 -8.853 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -12.019 1.728 -10.178 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -14.376 1.774 -9.326 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -13.876 2.782 -7.982 1.00 0.00 H new ATOM 1787 N ILE A 111 -9.917 0.781 -7.145 1.00 0.00 N ATOM 1788 CA ILE A 111 -8.477 0.427 -7.012 1.00 0.00 C ATOM 1789 C ILE A 111 -8.354 -1.033 -6.576 1.00 0.00 C ATOM 1790 O ILE A 111 -7.715 -1.835 -7.226 1.00 0.00 O ATOM 1791 CB ILE A 111 -7.826 1.330 -5.963 1.00 0.00 C ATOM 1792 CG1 ILE A 111 -8.168 2.792 -6.265 1.00 0.00 C ATOM 1793 CG2 ILE A 111 -6.308 1.144 -5.999 1.00 0.00 C ATOM 1794 CD1 ILE A 111 -7.427 3.244 -7.526 1.00 0.00 C ATOM 0 H ILE A 111 -10.294 1.354 -6.390 1.00 0.00 H new ATOM 0 HA ILE A 111 -7.976 0.565 -7.970 1.00 0.00 H new ATOM 0 HB ILE A 111 -8.201 1.065 -4.974 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -9.243 2.903 -6.404 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -7.889 3.423 -5.421 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -5.845 1.788 -5.251 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -6.064 0.104 -5.784 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -5.932 1.408 -6.988 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -7.672 4.285 -7.739 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -6.352 3.149 -7.370 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -7.728 2.621 -8.368 1.00 0.00 H new ATOM 1806 N ARG A 112 -8.963 -1.384 -5.476 1.00 0.00 N ATOM 1807 CA ARG A 112 -8.884 -2.792 -4.996 1.00 0.00 C ATOM 1808 C ARG A 112 -9.556 -3.716 -6.013 1.00 0.00 C ATOM 1809 O ARG A 112 -9.289 -4.900 -6.063 1.00 0.00 O ATOM 1810 CB ARG A 112 -9.601 -2.911 -3.648 1.00 0.00 C ATOM 1811 CG ARG A 112 -11.042 -2.413 -3.789 1.00 0.00 C ATOM 1812 CD ARG A 112 -11.708 -2.382 -2.413 1.00 0.00 C ATOM 1813 NE ARG A 112 -12.870 -3.316 -2.402 1.00 0.00 N ATOM 1814 CZ ARG A 112 -13.682 -3.341 -1.380 1.00 0.00 C ATOM 1815 NH1 ARG A 112 -13.482 -2.547 -0.362 1.00 0.00 N ATOM 1816 NH2 ARG A 112 -14.698 -4.160 -1.376 1.00 0.00 N ATOM 0 H ARG A 112 -9.512 -0.756 -4.889 1.00 0.00 H new ATOM 0 HA ARG A 112 -7.839 -3.079 -4.880 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -9.595 -3.948 -3.311 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -9.076 -2.327 -2.892 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -11.052 -1.417 -4.232 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -11.600 -3.066 -4.460 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -10.991 -2.668 -1.644 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -12.039 -1.370 -2.180 1.00 0.00 H new ATOM 0 HE ARG A 112 -13.031 -3.937 -3.195 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -12.689 -1.905 -0.364 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -14.118 -2.569 0.435 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -14.857 -4.779 -2.171 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -15.333 -4.181 -0.578 1.00 0.00 H new ATOM 1830 N ASP A 113 -10.429 -3.185 -6.825 1.00 0.00 N ATOM 1831 CA ASP A 113 -11.118 -4.032 -7.839 1.00 0.00 C ATOM 1832 C ASP A 113 -10.142 -4.375 -8.966 1.00 0.00 C ATOM 1833 O ASP A 113 -9.976 -5.523 -9.327 1.00 0.00 O ATOM 1834 CB ASP A 113 -12.314 -3.270 -8.412 1.00 0.00 C ATOM 1835 CG ASP A 113 -13.492 -3.360 -7.441 1.00 0.00 C ATOM 1836 OD1 ASP A 113 -13.306 -3.905 -6.366 1.00 0.00 O ATOM 1837 OD2 ASP A 113 -14.558 -2.881 -7.789 1.00 0.00 O ATOM 0 H ASP A 113 -10.695 -2.200 -6.830 1.00 0.00 H new ATOM 0 HA ASP A 113 -11.466 -4.952 -7.369 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -12.047 -2.227 -8.580 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -12.594 -3.687 -9.379 1.00 0.00 H new ATOM 1842 N ALA A 114 -9.497 -3.389 -9.525 1.00 0.00 N ATOM 1843 CA ALA A 114 -8.534 -3.661 -10.630 1.00 0.00 C ATOM 1844 C ALA A 114 -7.383 -4.520 -10.103 1.00 0.00 C ATOM 1845 O ALA A 114 -7.100 -5.582 -10.623 1.00 0.00 O ATOM 1846 CB ALA A 114 -7.980 -2.337 -11.159 1.00 0.00 C ATOM 0 H ALA A 114 -9.595 -2.407 -9.265 1.00 0.00 H new ATOM 0 HA ALA A 114 -9.044 -4.190 -11.435 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -7.276 -2.534 -11.967 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -8.799 -1.723 -11.534 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -7.470 -1.808 -10.354 1.00 0.00 H new ATOM 1852 N VAL A 115 -6.716 -4.071 -9.076 1.00 0.00 N ATOM 1853 CA VAL A 115 -5.584 -4.862 -8.516 1.00 0.00 C ATOM 1854 C VAL A 115 -6.035 -6.305 -8.281 1.00 0.00 C ATOM 1855 O VAL A 115 -5.405 -7.244 -8.725 1.00 0.00 O ATOM 1856 CB VAL A 115 -5.136 -4.245 -7.191 1.00 0.00 C ATOM 1857 CG1 VAL A 115 -4.148 -5.186 -6.497 1.00 0.00 C ATOM 1858 CG2 VAL A 115 -4.456 -2.901 -7.459 1.00 0.00 C ATOM 0 H VAL A 115 -6.906 -3.189 -8.600 1.00 0.00 H new ATOM 0 HA VAL A 115 -4.752 -4.852 -9.220 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.004 -4.093 -6.550 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -3.829 -4.746 -5.552 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -4.631 -6.144 -6.306 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -3.280 -5.339 -7.138 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -4.136 -2.460 -6.515 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -3.588 -3.054 -8.100 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.159 -2.230 -7.953 1.00 0.00 H new ATOM 1868 N LYS A 116 -7.123 -6.490 -7.584 1.00 0.00 N ATOM 1869 CA LYS A 116 -7.614 -7.872 -7.319 1.00 0.00 C ATOM 1870 C LYS A 116 -7.779 -8.618 -8.645 1.00 0.00 C ATOM 1871 O LYS A 116 -7.472 -9.789 -8.751 1.00 0.00 O ATOM 1872 CB LYS A 116 -8.963 -7.805 -6.601 1.00 0.00 C ATOM 1873 CG LYS A 116 -8.741 -7.454 -5.128 1.00 0.00 C ATOM 1874 CD LYS A 116 -8.961 -8.699 -4.267 1.00 0.00 C ATOM 1875 CE LYS A 116 -10.458 -8.889 -4.014 1.00 0.00 C ATOM 1876 NZ LYS A 116 -10.695 -10.231 -3.413 1.00 0.00 N ATOM 0 H LYS A 116 -7.693 -5.743 -7.187 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.894 -8.399 -6.692 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -9.601 -7.057 -7.072 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -9.479 -8.762 -6.684 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -7.730 -7.072 -4.983 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -9.427 -6.663 -4.824 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -8.552 -9.577 -4.767 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -8.432 -8.597 -3.320 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -10.826 -8.110 -3.347 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -11.010 -8.795 -4.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -11.713 -10.360 -3.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -10.358 -10.968 -4.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -10.180 -10.304 -2.512 1.00 0.00 H new ATOM 1890 N LYS A 117 -8.262 -7.951 -9.657 1.00 0.00 N ATOM 1891 CA LYS A 117 -8.446 -8.623 -10.974 1.00 0.00 C ATOM 1892 C LYS A 117 -7.102 -9.172 -11.458 1.00 0.00 C ATOM 1893 O LYS A 117 -7.020 -10.262 -11.987 1.00 0.00 O ATOM 1894 CB LYS A 117 -8.982 -7.615 -11.992 1.00 0.00 C ATOM 1895 CG LYS A 117 -10.027 -8.292 -12.879 1.00 0.00 C ATOM 1896 CD LYS A 117 -10.711 -7.241 -13.756 1.00 0.00 C ATOM 1897 CE LYS A 117 -11.227 -7.902 -15.036 1.00 0.00 C ATOM 1898 NZ LYS A 117 -10.087 -8.145 -15.964 1.00 0.00 N ATOM 0 H LYS A 117 -8.537 -6.969 -9.629 1.00 0.00 H new ATOM 0 HA LYS A 117 -9.157 -9.443 -10.867 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.424 -6.762 -11.477 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -8.166 -7.230 -12.603 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -9.553 -9.050 -13.503 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -10.766 -8.803 -12.263 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -11.537 -6.781 -13.213 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -10.009 -6.445 -14.003 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -11.723 -8.843 -14.798 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -11.969 -7.263 -15.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -10.446 -8.251 -16.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -9.429 -7.340 -15.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -9.589 -9.013 -15.682 1.00 0.00 H new ATOM 1912 N TYR A 118 -6.048 -8.424 -11.281 1.00 0.00 N ATOM 1913 CA TYR A 118 -4.711 -8.903 -11.733 1.00 0.00 C ATOM 1914 C TYR A 118 -4.123 -9.844 -10.679 1.00 0.00 C ATOM 1915 O TYR A 118 -4.069 -11.043 -10.865 1.00 0.00 O ATOM 1916 CB TYR A 118 -3.778 -7.705 -11.925 1.00 0.00 C ATOM 1917 CG TYR A 118 -4.433 -6.698 -12.839 1.00 0.00 C ATOM 1918 CD1 TYR A 118 -4.578 -6.981 -14.203 1.00 0.00 C ATOM 1919 CD2 TYR A 118 -4.894 -5.481 -12.324 1.00 0.00 C ATOM 1920 CE1 TYR A 118 -5.184 -6.047 -15.050 1.00 0.00 C ATOM 1921 CE2 TYR A 118 -5.501 -4.547 -13.172 1.00 0.00 C ATOM 1922 CZ TYR A 118 -5.645 -4.830 -14.535 1.00 0.00 C ATOM 1923 OH TYR A 118 -6.244 -3.909 -15.371 1.00 0.00 O ATOM 0 H TYR A 118 -6.054 -7.503 -10.843 1.00 0.00 H new ATOM 0 HA TYR A 118 -4.816 -9.436 -12.678 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.555 -7.246 -10.962 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -2.829 -8.034 -12.349 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -4.222 -7.920 -14.601 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -4.781 -5.262 -11.272 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -5.296 -6.265 -16.102 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -5.858 -3.608 -12.774 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.902 -3.388 -14.866 1.00 0.00 H new ATOM 1933 N LEU A 119 -3.683 -9.309 -9.573 1.00 0.00 N ATOM 1934 CA LEU A 119 -3.099 -10.173 -8.507 1.00 0.00 C ATOM 1935 C LEU A 119 -4.231 -10.849 -7.722 1.00 0.00 C ATOM 1936 O LEU A 119 -4.995 -10.182 -7.052 1.00 0.00 O ATOM 1937 CB LEU A 119 -2.269 -9.309 -7.555 1.00 0.00 C ATOM 1938 CG LEU A 119 -1.843 -10.145 -6.348 1.00 0.00 C ATOM 1939 CD1 LEU A 119 -0.835 -11.206 -6.792 1.00 0.00 C ATOM 1940 CD2 LEU A 119 -1.195 -9.234 -5.301 1.00 0.00 C ATOM 0 H LEU A 119 -3.702 -8.311 -9.361 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.464 -10.934 -8.960 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -1.390 -8.922 -8.071 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -2.851 -8.448 -7.227 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.717 -10.632 -5.917 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -0.531 -11.802 -5.931 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.294 -11.854 -7.539 1.00 0.00 H new ATOM 0 HD13 LEU A 119 0.040 -10.719 -7.223 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -0.891 -9.829 -4.440 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -0.321 -8.747 -5.733 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -1.912 -8.477 -4.984 1.00 0.00 H new ATOM 1952 N PRO A 120 -4.310 -12.154 -7.825 1.00 0.00 N ATOM 1953 CA PRO A 120 -5.344 -12.940 -7.130 1.00 0.00 C ATOM 1954 C PRO A 120 -4.979 -13.115 -5.653 1.00 0.00 C ATOM 1955 O PRO A 120 -3.926 -12.700 -5.211 1.00 0.00 O ATOM 1956 CB PRO A 120 -5.326 -14.285 -7.860 1.00 0.00 C ATOM 1957 CG PRO A 120 -3.936 -14.399 -8.529 1.00 0.00 C ATOM 1958 CD PRO A 120 -3.382 -12.965 -8.640 1.00 0.00 C ATOM 0 HA PRO A 120 -6.326 -12.466 -7.146 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -5.491 -15.107 -7.164 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -6.121 -14.334 -8.604 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -3.271 -15.027 -7.936 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -4.016 -14.861 -9.513 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.361 -12.902 -8.263 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -3.360 -12.625 -9.676 1.00 0.00 H new ATOM 1966 N LEU A 121 -5.842 -13.726 -4.888 1.00 0.00 N ATOM 1967 CA LEU A 121 -5.543 -13.927 -3.442 1.00 0.00 C ATOM 1968 C LEU A 121 -6.030 -15.310 -3.007 1.00 0.00 C ATOM 1969 O LEU A 121 -7.149 -15.699 -3.278 1.00 0.00 O ATOM 1970 CB LEU A 121 -6.259 -12.853 -2.619 1.00 0.00 C ATOM 1971 CG LEU A 121 -5.225 -11.983 -1.904 1.00 0.00 C ATOM 1972 CD1 LEU A 121 -5.931 -11.068 -0.901 1.00 0.00 C ATOM 1973 CD2 LEU A 121 -4.230 -12.879 -1.163 1.00 0.00 C ATOM 0 H LEU A 121 -6.740 -14.094 -5.201 1.00 0.00 H new ATOM 0 HA LEU A 121 -4.468 -13.853 -3.280 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -6.881 -12.237 -3.268 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -6.922 -13.320 -1.891 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.693 -11.376 -2.637 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -5.193 -10.448 -0.392 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -6.640 -10.429 -1.428 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -6.464 -11.674 -0.168 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -3.492 -12.259 -0.653 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.762 -13.486 -0.431 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.726 -13.530 -1.877 1.00 0.00 H new