USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 579 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 10 GLN : amide:sc= 0.635 K(o=1.5,f=-4.3) USER MOD Set 1.2: A 100 LYS NZ :NH3+ 171:sc= 0.909 (180deg=-0.0351) USER MOD Single : A 6 SER OG : rot 28:sc= 0.112 USER MOD Single : A 12 HIS : no HD1:sc= -0.847 K(o=-0.85,f=-1.9!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot -55:sc= -0.6! USER MOD Single : A 30 THR OG1 : rot -101:sc= 0.524 USER MOD Single : A 32 GLN :FLIP amide:sc= -0.104 F(o=-0.72,f=-0.1) USER MOD Single : A 36 GLN :FLIP amide:sc= 0 F(o=-0.89,f=0) USER MOD Single : A 37 GLN : amide:sc= -0.693 K(o=-0.69,f=-2.2!) USER MOD Single : A 38 THR OG1 : rot 96:sc= 1.22 USER MOD Single : A 40 CYS SG : rot -19:sc= 0.00483 USER MOD Single : A 41 LYS NZ :NH3+ -143:sc= -1.52 (180deg=-2.58!) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 49:sc= 0.225 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -1.72! X(o=-1.7!,f=-1.2) USER MOD Single : A 85 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 87 CYS SG : rot 180:sc= 0 USER MOD Single : A 90 GLN :FLIP amide:sc= -0.685 F(o=-3.3!,f=-0.69) USER MOD Single : A 92 GLN :FLIP amide:sc= 0 F(o=-0.6,f=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 159:sc= -0.132 (180deg=-0.643) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ -165:sc= -0.0257 (180deg=-0.232) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 70 N SER A 6 -221.336 76.089 59.274 1.00 0.00 N ATOM 71 CA SER A 6 -222.188 77.207 58.920 1.00 0.00 C ATOM 72 C SER A 6 -223.293 76.741 57.981 1.00 0.00 C ATOM 73 O SER A 6 -223.047 76.032 57.008 1.00 0.00 O ATOM 74 CB SER A 6 -221.387 78.344 58.274 1.00 0.00 C ATOM 75 OG SER A 6 -220.282 78.727 59.080 1.00 0.00 O ATOM 0 HA SER A 6 -222.632 77.595 59.837 1.00 0.00 H new ATOM 0 HB2 SER A 6 -221.031 78.028 57.293 1.00 0.00 H new ATOM 0 HB3 SER A 6 -222.038 79.204 58.115 1.00 0.00 H new ATOM 0 HG SER A 6 -219.989 77.962 59.618 1.00 0.00 H new ATOM 81 N PHE A 7 -224.507 77.125 58.307 1.00 0.00 N ATOM 82 CA PHE A 7 -225.665 76.807 57.514 1.00 0.00 C ATOM 83 C PHE A 7 -226.220 78.112 56.957 1.00 0.00 C ATOM 84 O PHE A 7 -225.952 79.185 57.505 1.00 0.00 O ATOM 85 CB PHE A 7 -226.694 76.065 58.384 1.00 0.00 C ATOM 86 CG PHE A 7 -227.601 76.940 59.202 1.00 0.00 C ATOM 87 CD1 PHE A 7 -227.195 77.425 60.431 1.00 0.00 C ATOM 88 CD2 PHE A 7 -228.869 77.260 58.746 1.00 0.00 C ATOM 89 CE1 PHE A 7 -228.034 78.214 61.188 1.00 0.00 C ATOM 90 CE2 PHE A 7 -229.712 78.048 59.500 1.00 0.00 C ATOM 91 CZ PHE A 7 -229.294 78.526 60.725 1.00 0.00 C ATOM 0 H PHE A 7 -224.716 77.673 59.141 1.00 0.00 H new ATOM 0 HA PHE A 7 -225.412 76.148 56.683 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -227.308 75.440 57.736 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -226.159 75.396 59.058 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -226.210 77.183 60.802 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -229.201 76.888 57.788 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -227.704 78.588 62.146 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -230.698 78.291 59.133 1.00 0.00 H new ATOM 0 HZ PHE A 7 -229.952 79.143 61.319 1.00 0.00 H new ATOM 101 N PHE A 8 -226.961 78.035 55.877 1.00 0.00 N ATOM 102 CA PHE A 8 -227.459 79.241 55.232 1.00 0.00 C ATOM 103 C PHE A 8 -228.789 79.669 55.830 1.00 0.00 C ATOM 104 O PHE A 8 -229.685 78.849 56.023 1.00 0.00 O ATOM 105 CB PHE A 8 -227.602 79.038 53.724 1.00 0.00 C ATOM 106 CG PHE A 8 -226.298 79.091 52.985 1.00 0.00 C ATOM 107 CD1 PHE A 8 -225.797 80.301 52.534 1.00 0.00 C ATOM 108 CD2 PHE A 8 -225.577 77.935 52.736 1.00 0.00 C ATOM 109 CE1 PHE A 8 -224.599 80.359 51.851 1.00 0.00 C ATOM 110 CE2 PHE A 8 -224.379 77.987 52.052 1.00 0.00 C ATOM 111 CZ PHE A 8 -223.890 79.200 51.608 1.00 0.00 C ATOM 0 H PHE A 8 -227.234 77.162 55.425 1.00 0.00 H new ATOM 0 HA PHE A 8 -226.730 80.032 55.407 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -228.076 78.074 53.539 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -228.268 79.803 53.324 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -226.350 81.210 52.719 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -225.956 76.984 53.080 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -224.217 81.309 51.508 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -223.824 77.080 51.864 1.00 0.00 H new ATOM 0 HZ PHE A 8 -222.954 79.242 51.071 1.00 0.00 H new ATOM 121 N VAL A 9 -228.915 80.950 56.125 1.00 0.00 N ATOM 122 CA VAL A 9 -230.143 81.475 56.697 1.00 0.00 C ATOM 123 C VAL A 9 -230.752 82.505 55.781 1.00 0.00 C ATOM 124 O VAL A 9 -230.072 83.424 55.342 1.00 0.00 O ATOM 125 CB VAL A 9 -229.928 82.183 58.050 1.00 0.00 C ATOM 126 CG1 VAL A 9 -231.246 82.365 58.784 1.00 0.00 C ATOM 127 CG2 VAL A 9 -228.933 81.453 58.915 1.00 0.00 C ATOM 0 H VAL A 9 -228.184 81.646 55.979 1.00 0.00 H new ATOM 0 HA VAL A 9 -230.788 80.607 56.835 1.00 0.00 H new ATOM 0 HB VAL A 9 -229.514 83.168 57.835 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -231.067 82.867 59.735 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -231.920 82.969 58.177 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -231.698 81.390 58.968 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -228.811 81.985 59.858 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -229.294 80.444 59.112 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -227.973 81.401 58.401 1.00 0.00 H new ATOM 137 N GLN A 10 -232.019 82.357 55.490 1.00 0.00 N ATOM 138 CA GLN A 10 -232.768 83.445 54.935 1.00 0.00 C ATOM 139 C GLN A 10 -233.507 84.125 56.077 1.00 0.00 C ATOM 140 O GLN A 10 -234.441 83.562 56.643 1.00 0.00 O ATOM 141 CB GLN A 10 -233.760 82.942 53.904 1.00 0.00 C ATOM 142 CG GLN A 10 -233.149 82.143 52.771 1.00 0.00 C ATOM 143 CD GLN A 10 -234.169 81.804 51.697 1.00 0.00 C ATOM 144 OE1 GLN A 10 -235.369 81.684 51.972 1.00 0.00 O ATOM 145 NE2 GLN A 10 -233.703 81.646 50.471 1.00 0.00 N ATOM 0 H GLN A 10 -232.548 81.496 55.629 1.00 0.00 H new ATOM 0 HA GLN A 10 -232.097 84.145 54.437 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -234.503 82.323 54.407 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -234.290 83.797 53.483 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -232.331 82.711 52.327 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -232.720 81.222 53.167 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -232.706 81.754 50.287 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -234.341 81.416 49.709 1.00 0.00 H new ATOM 154 N VAL A 11 -233.062 85.308 56.441 1.00 0.00 N ATOM 155 CA VAL A 11 -233.700 86.065 57.498 1.00 0.00 C ATOM 156 C VAL A 11 -234.137 87.429 56.987 1.00 0.00 C ATOM 157 O VAL A 11 -233.332 88.221 56.524 1.00 0.00 O ATOM 158 CB VAL A 11 -232.808 86.185 58.777 1.00 0.00 C ATOM 159 CG1 VAL A 11 -231.328 86.179 58.437 1.00 0.00 C ATOM 160 CG2 VAL A 11 -233.159 87.429 59.588 1.00 0.00 C ATOM 0 H VAL A 11 -232.256 85.769 56.018 1.00 0.00 H new ATOM 0 HA VAL A 11 -234.588 85.511 57.803 1.00 0.00 H new ATOM 0 HB VAL A 11 -233.016 85.306 59.387 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -230.744 86.264 59.353 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -231.075 85.248 57.930 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -231.102 87.021 57.783 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -232.520 87.481 60.470 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -233.006 88.318 58.976 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -234.203 87.378 59.899 1.00 0.00 H new ATOM 170 N HIS A 12 -235.434 87.677 57.042 1.00 0.00 N ATOM 171 CA HIS A 12 -235.991 88.927 56.540 1.00 0.00 C ATOM 172 C HIS A 12 -235.724 90.070 57.510 1.00 0.00 C ATOM 173 O HIS A 12 -235.819 89.894 58.727 1.00 0.00 O ATOM 174 CB HIS A 12 -237.509 88.815 56.349 1.00 0.00 C ATOM 175 CG HIS A 12 -237.966 88.253 55.039 1.00 0.00 C ATOM 176 ND1 HIS A 12 -238.185 89.037 53.931 1.00 0.00 N ATOM 177 CD2 HIS A 12 -238.309 86.993 54.678 1.00 0.00 C ATOM 178 CE1 HIS A 12 -238.643 88.291 52.947 1.00 0.00 C ATOM 179 NE2 HIS A 12 -238.731 87.042 53.369 1.00 0.00 N ATOM 0 H HIS A 12 -236.123 87.032 57.428 1.00 0.00 H new ATOM 0 HA HIS A 12 -235.509 89.128 55.583 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -237.911 88.193 57.149 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -237.944 89.807 56.468 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -238.260 86.113 55.302 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -238.903 88.642 51.959 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -239.057 86.248 52.818 1.00 0.00 H new ATOM 287 N LEU A 20 -235.102 90.204 51.984 1.00 0.00 N ATOM 288 CA LEU A 20 -234.694 88.879 52.409 1.00 0.00 C ATOM 289 C LEU A 20 -233.190 88.861 52.623 1.00 0.00 C ATOM 290 O LEU A 20 -232.420 88.844 51.660 1.00 0.00 O ATOM 291 CB LEU A 20 -235.073 87.814 51.376 1.00 0.00 C ATOM 292 CG LEU A 20 -234.737 86.382 51.798 1.00 0.00 C ATOM 293 CD1 LEU A 20 -235.609 85.965 52.963 1.00 0.00 C ATOM 294 CD2 LEU A 20 -234.888 85.414 50.638 1.00 0.00 C ATOM 0 HA LEU A 20 -235.213 88.647 53.339 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -236.143 87.881 51.178 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -234.561 88.034 50.439 1.00 0.00 H new ATOM 0 HG LEU A 20 -233.694 86.355 52.113 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -235.362 84.944 53.255 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -235.437 86.636 53.805 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -236.657 86.014 52.669 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -234.642 84.406 50.971 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -235.916 85.436 50.277 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -234.214 85.704 49.832 1.00 0.00 H new ATOM 306 N THR A 21 -232.765 88.901 53.872 1.00 0.00 N ATOM 307 CA THR A 21 -231.355 88.875 54.170 1.00 0.00 C ATOM 308 C THR A 21 -230.838 87.437 54.177 1.00 0.00 C ATOM 309 O THR A 21 -231.126 86.670 55.084 1.00 0.00 O ATOM 310 CB THR A 21 -231.060 89.538 55.528 1.00 0.00 C ATOM 311 OG1 THR A 21 -231.594 90.869 55.547 1.00 0.00 O ATOM 312 CG2 THR A 21 -229.568 89.578 55.807 1.00 0.00 C ATOM 0 H THR A 21 -233.375 88.951 54.688 1.00 0.00 H new ATOM 0 HA THR A 21 -230.841 89.439 53.391 1.00 0.00 H new ATOM 0 HB THR A 21 -231.536 88.942 56.307 1.00 0.00 H new ATOM 0 HG1 THR A 21 -231.405 91.285 56.414 1.00 0.00 H new ATOM 0 HG21 THR A 21 -229.391 90.052 56.773 1.00 0.00 H new ATOM 0 HG22 THR A 21 -229.174 88.562 55.823 1.00 0.00 H new ATOM 0 HG23 THR A 21 -229.067 90.149 55.025 1.00 0.00 H new ATOM 320 N VAL A 22 -230.068 87.076 53.165 1.00 0.00 N ATOM 321 CA VAL A 22 -229.521 85.732 53.080 1.00 0.00 C ATOM 322 C VAL A 22 -228.108 85.718 53.657 1.00 0.00 C ATOM 323 O VAL A 22 -227.190 86.311 53.088 1.00 0.00 O ATOM 324 CB VAL A 22 -229.482 85.227 51.622 1.00 0.00 C ATOM 325 CG1 VAL A 22 -228.952 83.804 51.559 1.00 0.00 C ATOM 326 CG2 VAL A 22 -230.864 85.311 50.990 1.00 0.00 C ATOM 0 H VAL A 22 -229.808 87.691 52.394 1.00 0.00 H new ATOM 0 HA VAL A 22 -230.169 85.069 53.653 1.00 0.00 H new ATOM 0 HB VAL A 22 -228.805 85.868 51.057 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -228.933 83.468 50.522 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -227.942 83.773 51.969 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -229.600 83.148 52.141 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -230.817 84.951 49.962 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -231.562 84.696 51.558 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -231.205 86.346 50.996 1.00 0.00 H new ATOM 336 N ILE A 23 -227.942 85.059 54.789 1.00 0.00 N ATOM 337 CA ILE A 23 -226.655 85.006 55.465 1.00 0.00 C ATOM 338 C ILE A 23 -226.169 83.575 55.616 1.00 0.00 C ATOM 339 O ILE A 23 -226.870 82.623 55.269 1.00 0.00 O ATOM 340 CB ILE A 23 -226.714 85.635 56.873 1.00 0.00 C ATOM 341 CG1 ILE A 23 -227.941 85.136 57.642 1.00 0.00 C ATOM 342 CG2 ILE A 23 -226.707 87.156 56.785 1.00 0.00 C ATOM 343 CD1 ILE A 23 -227.942 85.538 59.102 1.00 0.00 C ATOM 0 H ILE A 23 -228.687 84.549 55.264 1.00 0.00 H new ATOM 0 HA ILE A 23 -225.966 85.575 54.840 1.00 0.00 H new ATOM 0 HB ILE A 23 -225.825 85.324 57.422 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -228.841 85.524 57.166 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -227.987 84.049 57.572 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -226.749 87.579 57.789 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -225.794 87.488 56.290 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -227.572 87.491 56.213 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -228.839 85.151 59.585 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -227.060 85.127 59.593 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -227.928 86.625 59.180 1.00 0.00 H new ATOM 355 N LYS A 24 -224.965 83.434 56.137 1.00 0.00 N ATOM 356 CA LYS A 24 -224.450 82.140 56.527 1.00 0.00 C ATOM 357 C LYS A 24 -224.076 82.207 58.003 1.00 0.00 C ATOM 358 O LYS A 24 -223.244 83.018 58.406 1.00 0.00 O ATOM 359 CB LYS A 24 -223.237 81.749 55.680 1.00 0.00 C ATOM 360 CG LYS A 24 -223.126 80.252 55.443 1.00 0.00 C ATOM 361 CD LYS A 24 -221.752 79.877 54.907 1.00 0.00 C ATOM 362 CE LYS A 24 -221.621 78.380 54.678 1.00 0.00 C ATOM 363 NZ LYS A 24 -220.251 78.005 54.237 1.00 0.00 N ATOM 0 H LYS A 24 -224.322 84.209 56.300 1.00 0.00 H new ATOM 0 HA LYS A 24 -225.212 81.377 56.365 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -223.295 82.259 54.718 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -222.330 82.100 56.173 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -223.313 79.719 56.375 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -223.893 79.936 54.736 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -221.572 80.404 53.970 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -220.986 80.205 55.610 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -221.864 77.849 55.598 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -222.344 78.063 53.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -220.203 76.976 54.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -220.028 78.492 53.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -219.563 78.284 54.965 1.00 0.00 H new ATOM 377 N ALA A 25 -224.703 81.366 58.797 1.00 0.00 N ATOM 378 CA ALA A 25 -224.593 81.432 60.242 1.00 0.00 C ATOM 379 C ALA A 25 -224.181 80.086 60.766 1.00 0.00 C ATOM 380 O ALA A 25 -224.208 79.115 60.038 1.00 0.00 O ATOM 381 CB ALA A 25 -225.929 81.878 60.827 1.00 0.00 C ATOM 0 H ALA A 25 -225.305 80.615 58.460 1.00 0.00 H new ATOM 0 HA ALA A 25 -223.835 82.158 60.537 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -225.852 81.929 61.913 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -226.188 82.862 60.435 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -226.704 81.162 60.552 1.00 0.00 H new ATOM 387 N PRO A 26 -223.791 79.995 62.025 1.00 0.00 N ATOM 388 CA PRO A 26 -223.289 78.756 62.566 1.00 0.00 C ATOM 389 C PRO A 26 -224.383 77.709 62.661 1.00 0.00 C ATOM 390 O PRO A 26 -225.515 78.018 63.014 1.00 0.00 O ATOM 391 CB PRO A 26 -222.729 79.138 63.933 1.00 0.00 C ATOM 392 CG PRO A 26 -222.894 80.618 64.076 1.00 0.00 C ATOM 393 CD PRO A 26 -223.858 81.062 63.023 1.00 0.00 C ATOM 0 HA PRO A 26 -222.527 78.301 61.933 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -223.259 78.612 64.727 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -221.679 78.858 64.011 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -223.267 80.869 65.069 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -221.936 81.125 63.958 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -224.866 81.174 63.423 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -223.574 82.026 62.600 1.00 0.00 H new ATOM 401 N ARG A 27 -224.046 76.468 62.329 1.00 0.00 N ATOM 402 CA ARG A 27 -225.024 75.378 62.334 1.00 0.00 C ATOM 403 C ARG A 27 -225.495 75.080 63.760 1.00 0.00 C ATOM 404 O ARG A 27 -226.311 74.193 63.988 1.00 0.00 O ATOM 405 CB ARG A 27 -224.436 74.130 61.675 1.00 0.00 C ATOM 406 CG ARG A 27 -224.243 74.312 60.182 1.00 0.00 C ATOM 407 CD ARG A 27 -223.951 73.009 59.462 1.00 0.00 C ATOM 408 NE ARG A 27 -224.082 73.163 58.012 1.00 0.00 N ATOM 409 CZ ARG A 27 -224.725 72.301 57.227 1.00 0.00 C ATOM 410 NH1 ARG A 27 -225.184 71.158 57.723 1.00 0.00 N ATOM 411 NH2 ARG A 27 -224.883 72.568 55.938 1.00 0.00 N ATOM 0 H ARG A 27 -223.105 76.188 62.053 1.00 0.00 H new ATOM 0 HA ARG A 27 -225.893 75.689 61.754 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -223.478 73.893 62.138 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -225.095 73.281 61.854 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -225.140 74.763 59.757 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -223.423 75.009 60.009 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -222.942 72.675 59.705 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -224.636 72.236 59.811 1.00 0.00 H new ATOM 0 HE ARG A 27 -223.655 73.980 57.577 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -225.045 70.937 58.709 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -225.676 70.501 57.118 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -224.512 73.434 55.547 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -225.376 71.907 55.337 1.00 0.00 H new ATOM 425 N VAL A 28 -224.944 75.820 64.717 1.00 0.00 N ATOM 426 CA VAL A 28 -225.368 75.745 66.106 1.00 0.00 C ATOM 427 C VAL A 28 -226.054 77.044 66.541 1.00 0.00 C ATOM 428 O VAL A 28 -226.626 77.101 67.632 1.00 0.00 O ATOM 429 CB VAL A 28 -224.178 75.476 67.056 1.00 0.00 C ATOM 430 CG1 VAL A 28 -223.417 74.234 66.630 1.00 0.00 C ATOM 431 CG2 VAL A 28 -223.246 76.679 67.124 1.00 0.00 C ATOM 0 H VAL A 28 -224.191 76.488 64.549 1.00 0.00 H new ATOM 0 HA VAL A 28 -226.071 74.914 66.171 1.00 0.00 H new ATOM 0 HB VAL A 28 -224.581 75.305 68.054 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -222.585 74.065 67.313 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -224.085 73.373 66.652 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -223.034 74.371 65.619 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -222.419 76.461 67.799 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -222.855 76.893 66.129 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -223.796 77.545 67.492 1.00 0.00 H new ATOM 441 N SER A 29 -225.992 78.081 65.685 1.00 0.00 N ATOM 442 CA SER A 29 -226.545 79.408 66.006 1.00 0.00 C ATOM 443 C SER A 29 -227.942 79.334 66.598 1.00 0.00 C ATOM 444 O SER A 29 -228.783 78.534 66.184 1.00 0.00 O ATOM 445 CB SER A 29 -226.578 80.299 64.764 1.00 0.00 C ATOM 446 OG SER A 29 -227.363 79.726 63.739 1.00 0.00 O ATOM 0 H SER A 29 -225.562 78.023 64.762 1.00 0.00 H new ATOM 0 HA SER A 29 -225.882 79.838 66.757 1.00 0.00 H new ATOM 0 HB2 SER A 29 -226.979 81.278 65.027 1.00 0.00 H new ATOM 0 HB3 SER A 29 -225.562 80.458 64.401 1.00 0.00 H new ATOM 0 HG SER A 29 -227.038 78.822 63.545 1.00 0.00 H new ATOM 452 N THR A 30 -228.168 80.170 67.593 1.00 0.00 N ATOM 453 CA THR A 30 -229.481 80.347 68.157 1.00 0.00 C ATOM 454 C THR A 30 -229.938 81.770 67.921 1.00 0.00 C ATOM 455 O THR A 30 -229.176 82.579 67.388 1.00 0.00 O ATOM 456 CB THR A 30 -229.507 79.975 69.647 1.00 0.00 C ATOM 457 OG1 THR A 30 -230.784 80.274 70.232 1.00 0.00 O ATOM 458 CG2 THR A 30 -228.411 80.681 70.422 1.00 0.00 C ATOM 0 H THR A 30 -227.444 80.742 68.028 1.00 0.00 H new ATOM 0 HA THR A 30 -230.177 79.671 67.661 1.00 0.00 H new ATOM 0 HB THR A 30 -229.331 78.901 69.708 1.00 0.00 H new ATOM 0 HG1 THR A 30 -230.724 81.112 70.737 1.00 0.00 H new ATOM 0 HG21 THR A 30 -228.463 80.392 71.472 1.00 0.00 H new ATOM 0 HG22 THR A 30 -227.439 80.400 70.016 1.00 0.00 H new ATOM 0 HG23 THR A 30 -228.542 81.760 70.336 1.00 0.00 H new ATOM 466 N ALA A 31 -231.179 82.063 68.289 1.00 0.00 N ATOM 467 CA ALA A 31 -231.797 83.334 67.961 1.00 0.00 C ATOM 468 C ALA A 31 -230.909 84.497 68.337 1.00 0.00 C ATOM 469 O ALA A 31 -230.621 85.322 67.498 1.00 0.00 O ATOM 470 CB ALA A 31 -233.159 83.454 68.630 1.00 0.00 C ATOM 0 H ALA A 31 -231.778 81.430 68.819 1.00 0.00 H new ATOM 0 HA ALA A 31 -231.938 83.366 66.881 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -233.607 84.414 68.373 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -233.806 82.647 68.286 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -233.040 83.387 69.711 1.00 0.00 H new ATOM 476 N GLN A 32 -230.419 84.526 69.563 1.00 0.00 N ATOM 477 CA GLN A 32 -229.595 85.639 70.011 1.00 0.00 C ATOM 478 C GLN A 32 -228.354 85.815 69.118 1.00 0.00 C ATOM 479 O GLN A 32 -227.939 86.942 68.837 1.00 0.00 O ATOM 480 CB GLN A 32 -229.184 85.426 71.471 1.00 0.00 C ATOM 481 CG GLN A 32 -229.262 86.686 72.316 1.00 0.00 C ATOM 482 CD GLN A 32 -228.237 87.732 71.926 1.00 0.00 C ATOM 483 OE1 GLN A 32 -228.567 88.527 70.930 1.00 0.00 O flip ATOM 484 NE2 GLN A 32 -227.148 87.804 72.496 1.00 0.00 N flip ATOM 0 H GLN A 32 -230.574 83.800 70.262 1.00 0.00 H new ATOM 0 HA GLN A 32 -230.184 86.553 69.936 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -229.825 84.663 71.912 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -228.164 85.042 71.500 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -230.260 87.114 72.227 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -229.121 86.422 73.364 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -226.931 87.169 73.264 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -226.462 88.499 72.200 1.00 0.00 H new ATOM 493 N ASP A 33 -227.797 84.715 68.617 1.00 0.00 N ATOM 494 CA ASP A 33 -226.571 84.797 67.829 1.00 0.00 C ATOM 495 C ASP A 33 -226.865 85.396 66.472 1.00 0.00 C ATOM 496 O ASP A 33 -226.241 86.365 66.036 1.00 0.00 O ATOM 497 CB ASP A 33 -225.954 83.411 67.629 1.00 0.00 C ATOM 498 CG ASP A 33 -224.994 83.018 68.732 1.00 0.00 C ATOM 499 OD1 ASP A 33 -225.446 82.436 69.741 1.00 0.00 O ATOM 500 OD2 ASP A 33 -223.780 83.265 68.584 1.00 0.00 O ATOM 0 H ASP A 33 -228.167 83.772 68.740 1.00 0.00 H new ATOM 0 HA ASP A 33 -225.868 85.427 68.373 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -226.752 82.671 67.570 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -225.428 83.389 66.674 1.00 0.00 H new ATOM 505 N VAL A 34 -227.843 84.799 65.826 1.00 0.00 N ATOM 506 CA VAL A 34 -228.310 85.219 64.520 1.00 0.00 C ATOM 507 C VAL A 34 -228.931 86.616 64.603 1.00 0.00 C ATOM 508 O VAL A 34 -228.902 87.377 63.635 1.00 0.00 O ATOM 509 CB VAL A 34 -229.297 84.176 63.977 1.00 0.00 C ATOM 510 CG1 VAL A 34 -230.622 84.249 64.684 1.00 0.00 C ATOM 511 CG2 VAL A 34 -229.435 84.308 62.481 1.00 0.00 C ATOM 0 H VAL A 34 -228.346 83.994 66.199 1.00 0.00 H new ATOM 0 HA VAL A 34 -227.472 85.284 63.826 1.00 0.00 H new ATOM 0 HB VAL A 34 -228.896 83.183 64.182 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -231.295 83.496 64.274 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -230.477 84.064 65.748 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -231.055 85.239 64.543 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -230.138 83.561 62.113 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -229.803 85.304 62.236 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -228.464 84.154 62.011 1.00 0.00 H new ATOM 521 N ILE A 35 -229.465 86.953 65.776 1.00 0.00 N ATOM 522 CA ILE A 35 -230.006 88.281 66.039 1.00 0.00 C ATOM 523 C ILE A 35 -228.941 89.348 65.791 1.00 0.00 C ATOM 524 O ILE A 35 -229.096 90.199 64.919 1.00 0.00 O ATOM 525 CB ILE A 35 -230.503 88.385 67.504 1.00 0.00 C ATOM 526 CG1 ILE A 35 -231.887 87.761 67.658 1.00 0.00 C ATOM 527 CG2 ILE A 35 -230.526 89.828 67.993 1.00 0.00 C ATOM 528 CD1 ILE A 35 -232.952 88.422 66.835 1.00 0.00 C ATOM 0 H ILE A 35 -229.534 86.313 66.567 1.00 0.00 H new ATOM 0 HA ILE A 35 -230.845 88.444 65.363 1.00 0.00 H new ATOM 0 HB ILE A 35 -229.795 87.831 68.120 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -231.832 86.708 67.383 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -232.177 87.801 68.708 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -230.880 89.857 69.023 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -229.520 90.245 67.943 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -231.194 90.415 67.363 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -233.905 87.919 67.001 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -233.039 89.469 67.125 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -232.688 88.359 65.779 1.00 0.00 H new ATOM 540 N GLN A 36 -227.832 89.249 66.514 1.00 0.00 N ATOM 541 CA GLN A 36 -226.770 90.244 66.427 1.00 0.00 C ATOM 542 C GLN A 36 -226.001 90.092 65.118 1.00 0.00 C ATOM 543 O GLN A 36 -225.506 91.070 64.562 1.00 0.00 O ATOM 544 CB GLN A 36 -225.833 90.124 67.629 1.00 0.00 C ATOM 545 CG GLN A 36 -224.770 91.209 67.690 1.00 0.00 C ATOM 546 CD GLN A 36 -223.931 91.136 68.950 1.00 0.00 C ATOM 547 OE1 GLN A 36 -223.758 89.938 69.482 1.00 0.00 O flip ATOM 548 NE2 GLN A 36 -223.441 92.151 69.443 1.00 0.00 N flip ATOM 0 H GLN A 36 -227.645 88.489 67.168 1.00 0.00 H new ATOM 0 HA GLN A 36 -227.218 91.237 66.441 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -226.425 90.157 68.544 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -225.344 89.150 67.600 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -224.119 91.124 66.820 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -225.250 92.186 67.634 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -223.597 93.058 69.003 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -222.879 92.086 70.292 1.00 0.00 H new ATOM 557 N GLN A 37 -225.888 88.861 64.633 1.00 0.00 N ATOM 558 CA GLN A 37 -225.280 88.608 63.345 1.00 0.00 C ATOM 559 C GLN A 37 -226.020 89.377 62.254 1.00 0.00 C ATOM 560 O GLN A 37 -225.400 89.978 61.375 1.00 0.00 O ATOM 561 CB GLN A 37 -225.292 87.116 63.042 1.00 0.00 C ATOM 562 CG GLN A 37 -224.249 86.729 62.028 1.00 0.00 C ATOM 563 CD GLN A 37 -224.243 85.251 61.710 1.00 0.00 C ATOM 564 OE1 GLN A 37 -224.559 84.414 62.557 1.00 0.00 O ATOM 565 NE2 GLN A 37 -223.891 84.923 60.480 1.00 0.00 N ATOM 0 H GLN A 37 -226.212 88.025 65.119 1.00 0.00 H new ATOM 0 HA GLN A 37 -224.245 88.949 63.372 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -225.123 86.559 63.964 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -226.277 86.831 62.673 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -224.419 87.290 61.109 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -223.266 87.017 62.400 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -223.637 85.650 59.811 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -223.873 83.943 60.199 1.00 0.00 H new ATOM 574 N THR A 38 -227.347 89.369 62.323 1.00 0.00 N ATOM 575 CA THR A 38 -228.157 90.144 61.396 1.00 0.00 C ATOM 576 C THR A 38 -227.933 91.637 61.628 1.00 0.00 C ATOM 577 O THR A 38 -227.867 92.412 60.682 1.00 0.00 O ATOM 578 CB THR A 38 -229.656 89.810 61.526 1.00 0.00 C ATOM 579 OG1 THR A 38 -229.851 88.395 61.391 1.00 0.00 O ATOM 580 CG2 THR A 38 -230.468 90.532 60.458 1.00 0.00 C ATOM 0 H THR A 38 -227.881 88.836 63.009 1.00 0.00 H new ATOM 0 HA THR A 38 -227.846 89.880 60.385 1.00 0.00 H new ATOM 0 HB THR A 38 -229.995 90.140 62.508 1.00 0.00 H new ATOM 0 HG1 THR A 38 -229.890 87.984 62.280 1.00 0.00 H new ATOM 0 HG21 THR A 38 -231.523 90.280 60.571 1.00 0.00 H new ATOM 0 HG22 THR A 38 -230.338 91.609 60.568 1.00 0.00 H new ATOM 0 HG23 THR A 38 -230.125 90.224 59.470 1.00 0.00 H new ATOM 588 N LEU A 39 -227.790 92.026 62.894 1.00 0.00 N ATOM 589 CA LEU A 39 -227.432 93.402 63.251 1.00 0.00 C ATOM 590 C LEU A 39 -226.161 93.841 62.518 1.00 0.00 C ATOM 591 O LEU A 39 -226.087 94.944 61.979 1.00 0.00 O ATOM 592 CB LEU A 39 -227.223 93.515 64.767 1.00 0.00 C ATOM 593 CG LEU A 39 -228.439 93.953 65.589 1.00 0.00 C ATOM 594 CD1 LEU A 39 -229.646 93.068 65.341 1.00 0.00 C ATOM 595 CD2 LEU A 39 -228.097 93.965 67.064 1.00 0.00 C ATOM 0 H LEU A 39 -227.917 91.406 63.694 1.00 0.00 H new ATOM 0 HA LEU A 39 -228.250 94.057 62.950 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -226.889 92.547 65.139 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -226.414 94.223 64.949 1.00 0.00 H new ATOM 0 HG LEU A 39 -228.701 94.961 65.268 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -230.483 93.417 65.945 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -229.917 93.110 64.286 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -229.406 92.040 65.613 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -228.970 94.278 67.637 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -227.797 92.965 67.376 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -227.277 94.661 67.242 1.00 0.00 H new ATOM 607 N CYS A 40 -225.169 92.958 62.493 1.00 0.00 N ATOM 608 CA CYS A 40 -223.910 93.212 61.795 1.00 0.00 C ATOM 609 C CYS A 40 -224.139 93.372 60.290 1.00 0.00 C ATOM 610 O CYS A 40 -223.461 94.154 59.619 1.00 0.00 O ATOM 611 CB CYS A 40 -222.935 92.060 62.060 1.00 0.00 C ATOM 612 SG CYS A 40 -221.353 92.196 61.197 1.00 0.00 S ATOM 0 H CYS A 40 -225.212 92.049 62.953 1.00 0.00 H new ATOM 0 HA CYS A 40 -223.486 94.142 62.172 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -222.745 92.002 63.132 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -223.412 91.124 61.770 1.00 0.00 H new ATOM 0 HG CYS A 40 -221.473 93.018 60.197 1.00 0.00 H new ATOM 618 N LYS A 41 -225.106 92.628 59.779 1.00 0.00 N ATOM 619 CA LYS A 41 -225.431 92.625 58.358 1.00 0.00 C ATOM 620 C LYS A 41 -226.301 93.832 57.985 1.00 0.00 C ATOM 621 O LYS A 41 -226.342 94.246 56.825 1.00 0.00 O ATOM 622 CB LYS A 41 -226.149 91.312 58.027 1.00 0.00 C ATOM 623 CG LYS A 41 -226.715 91.212 56.619 1.00 0.00 C ATOM 624 CD LYS A 41 -225.635 91.218 55.550 1.00 0.00 C ATOM 625 CE LYS A 41 -226.183 90.715 54.222 1.00 0.00 C ATOM 626 NZ LYS A 41 -227.404 91.461 53.799 1.00 0.00 N ATOM 0 H LYS A 41 -225.691 92.006 60.338 1.00 0.00 H new ATOM 0 HA LYS A 41 -224.513 92.702 57.775 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -225.451 90.488 58.179 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -226.964 91.175 58.738 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -227.301 90.297 56.532 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -227.396 92.045 56.446 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -225.244 92.228 55.428 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -224.802 90.590 55.866 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -225.416 90.812 53.454 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -226.418 89.654 54.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -228.069 90.806 53.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -227.857 91.887 54.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -227.138 92.210 53.129 1.00 0.00 H new ATOM 640 N ALA A 42 -226.975 94.404 58.972 1.00 0.00 N ATOM 641 CA ALA A 42 -227.949 95.457 58.721 1.00 0.00 C ATOM 642 C ALA A 42 -227.442 96.842 59.117 1.00 0.00 C ATOM 643 O ALA A 42 -228.075 97.851 58.787 1.00 0.00 O ATOM 644 CB ALA A 42 -229.246 95.140 59.444 1.00 0.00 C ATOM 0 H ALA A 42 -226.865 94.157 59.955 1.00 0.00 H new ATOM 0 HA ALA A 42 -228.123 95.487 57.645 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -229.972 95.931 59.253 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -229.641 94.190 59.083 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -229.058 95.071 60.515 1.00 0.00 H new ATOM 852 N ASP A 56 -233.069 93.733 72.533 1.00 0.00 N ATOM 853 CA ASP A 56 -234.484 94.047 72.326 1.00 0.00 C ATOM 854 C ASP A 56 -235.060 93.306 71.134 1.00 0.00 C ATOM 855 O ASP A 56 -236.186 93.575 70.716 1.00 0.00 O ATOM 856 CB ASP A 56 -234.677 95.550 72.120 1.00 0.00 C ATOM 857 CG ASP A 56 -234.360 96.348 73.367 1.00 0.00 C ATOM 858 OD1 ASP A 56 -234.984 96.089 74.417 1.00 0.00 O ATOM 859 OD2 ASP A 56 -233.483 97.232 73.311 1.00 0.00 O ATOM 0 HA ASP A 56 -235.014 93.725 73.222 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -234.038 95.887 71.304 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -235.707 95.744 71.820 1.00 0.00 H new ATOM 864 N TYR A 57 -234.318 92.351 70.610 1.00 0.00 N ATOM 865 CA TYR A 57 -234.737 91.643 69.413 1.00 0.00 C ATOM 866 C TYR A 57 -235.047 90.186 69.719 1.00 0.00 C ATOM 867 O TYR A 57 -234.487 89.598 70.645 1.00 0.00 O ATOM 868 CB TYR A 57 -233.647 91.689 68.336 1.00 0.00 C ATOM 869 CG TYR A 57 -233.484 93.016 67.637 1.00 0.00 C ATOM 870 CD1 TYR A 57 -232.870 94.093 68.263 1.00 0.00 C ATOM 871 CD2 TYR A 57 -233.927 93.180 66.333 1.00 0.00 C ATOM 872 CE1 TYR A 57 -232.701 95.295 67.605 1.00 0.00 C ATOM 873 CE2 TYR A 57 -233.768 94.379 65.670 1.00 0.00 C ATOM 874 CZ TYR A 57 -233.154 95.435 66.308 1.00 0.00 C ATOM 875 OH TYR A 57 -232.983 96.628 65.647 1.00 0.00 O ATOM 0 H TYR A 57 -233.423 92.046 70.992 1.00 0.00 H new ATOM 0 HA TYR A 57 -235.636 92.141 69.048 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -232.695 91.420 68.794 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -233.867 90.928 67.588 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -232.520 93.989 69.279 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -234.405 92.354 65.828 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -232.217 96.122 68.103 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -234.123 94.490 64.656 1.00 0.00 H new ATOM 0 HH TYR A 57 -233.357 96.558 64.744 1.00 0.00 H new ATOM 885 N VAL A 58 -235.940 89.621 68.927 1.00 0.00 N ATOM 886 CA VAL A 58 -236.217 88.194 68.941 1.00 0.00 C ATOM 887 C VAL A 58 -236.379 87.715 67.513 1.00 0.00 C ATOM 888 O VAL A 58 -236.919 88.430 66.670 1.00 0.00 O ATOM 889 CB VAL A 58 -237.492 87.818 69.727 1.00 0.00 C ATOM 890 CG1 VAL A 58 -237.190 87.652 71.200 1.00 0.00 C ATOM 891 CG2 VAL A 58 -238.580 88.864 69.557 1.00 0.00 C ATOM 0 H VAL A 58 -236.498 90.142 68.251 1.00 0.00 H new ATOM 0 HA VAL A 58 -235.376 87.716 69.443 1.00 0.00 H new ATOM 0 HB VAL A 58 -237.848 86.871 69.321 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -238.104 87.387 71.731 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -236.451 86.862 71.333 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -236.797 88.587 71.598 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -239.462 88.567 70.124 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -238.221 89.826 69.923 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -238.839 88.951 68.502 1.00 0.00 H new ATOM 901 N LEU A 59 -235.902 86.522 67.233 1.00 0.00 N ATOM 902 CA LEU A 59 -236.012 85.979 65.897 1.00 0.00 C ATOM 903 C LEU A 59 -237.254 85.107 65.790 1.00 0.00 C ATOM 904 O LEU A 59 -237.626 84.414 66.737 1.00 0.00 O ATOM 905 CB LEU A 59 -234.764 85.181 65.535 1.00 0.00 C ATOM 906 CG LEU A 59 -234.728 84.657 64.103 1.00 0.00 C ATOM 907 CD1 LEU A 59 -234.401 85.780 63.132 1.00 0.00 C ATOM 908 CD2 LEU A 59 -233.731 83.524 63.981 1.00 0.00 C ATOM 0 H LEU A 59 -235.438 85.913 67.907 1.00 0.00 H new ATOM 0 HA LEU A 59 -236.101 86.805 65.191 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -233.889 85.810 65.698 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -234.681 84.335 66.218 1.00 0.00 H new ATOM 0 HG LEU A 59 -235.714 84.269 63.848 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -234.380 85.387 62.115 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -235.162 86.557 63.205 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -233.427 86.202 63.378 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -233.717 83.161 62.953 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -232.738 83.882 64.253 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -234.019 82.712 64.649 1.00 0.00 H new ATOM 920 N LEU A 60 -237.903 85.175 64.645 1.00 0.00 N ATOM 921 CA LEU A 60 -239.110 84.412 64.389 1.00 0.00 C ATOM 922 C LEU A 60 -238.799 83.268 63.435 1.00 0.00 C ATOM 923 O LEU A 60 -238.268 83.494 62.358 1.00 0.00 O ATOM 924 CB LEU A 60 -240.190 85.306 63.747 1.00 0.00 C ATOM 925 CG LEU A 60 -240.883 86.347 64.652 1.00 0.00 C ATOM 926 CD1 LEU A 60 -241.841 85.669 65.606 1.00 0.00 C ATOM 927 CD2 LEU A 60 -239.882 87.196 65.420 1.00 0.00 C ATOM 0 H LEU A 60 -237.609 85.761 63.864 1.00 0.00 H new ATOM 0 HA LEU A 60 -239.478 84.024 65.339 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -239.734 85.837 62.911 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -240.960 84.657 63.330 1.00 0.00 H new ATOM 0 HG LEU A 60 -241.445 87.016 64.000 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -242.320 86.419 66.235 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -242.602 85.133 65.038 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -241.293 84.965 66.233 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -240.416 87.914 66.043 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -239.269 86.553 66.051 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -239.243 87.730 64.717 1.00 0.00 H new ATOM 939 N GLU A 61 -239.112 82.046 63.812 1.00 0.00 N ATOM 940 CA GLU A 61 -239.008 80.950 62.875 1.00 0.00 C ATOM 941 C GLU A 61 -240.335 80.831 62.124 1.00 0.00 C ATOM 942 O GLU A 61 -241.264 80.132 62.529 1.00 0.00 O ATOM 943 CB GLU A 61 -238.606 79.634 63.577 1.00 0.00 C ATOM 944 CG GLU A 61 -239.703 78.987 64.410 1.00 0.00 C ATOM 945 CD GLU A 61 -239.322 77.635 64.969 1.00 0.00 C ATOM 946 OE1 GLU A 61 -239.536 76.622 64.275 1.00 0.00 O ATOM 947 OE2 GLU A 61 -238.835 77.581 66.114 1.00 0.00 O ATOM 0 H GLU A 61 -239.435 81.790 64.745 1.00 0.00 H new ATOM 0 HA GLU A 61 -238.212 81.151 62.158 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -238.278 78.922 62.820 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -237.750 79.831 64.222 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -239.961 79.652 65.234 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -240.597 78.878 63.796 1.00 0.00 H new ATOM 954 N GLU A 62 -240.470 81.600 61.066 1.00 0.00 N ATOM 955 CA GLU A 62 -241.627 81.515 60.250 1.00 0.00 C ATOM 956 C GLU A 62 -241.424 80.442 59.201 1.00 0.00 C ATOM 957 O GLU A 62 -240.472 80.482 58.432 1.00 0.00 O ATOM 958 CB GLU A 62 -241.813 82.882 59.631 1.00 0.00 C ATOM 959 CG GLU A 62 -243.088 83.073 58.876 1.00 0.00 C ATOM 960 CD GLU A 62 -242.942 82.844 57.386 1.00 0.00 C ATOM 961 OE1 GLU A 62 -242.416 83.746 56.691 1.00 0.00 O ATOM 962 OE2 GLU A 62 -243.370 81.784 56.903 1.00 0.00 O ATOM 0 H GLU A 62 -239.782 82.289 60.763 1.00 0.00 H new ATOM 0 HA GLU A 62 -242.517 81.240 60.817 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -241.763 83.631 60.422 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -240.978 83.074 58.957 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -243.841 82.390 59.269 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -243.455 84.085 59.047 1.00 0.00 H new ATOM 969 N VAL A 63 -242.304 79.466 59.200 1.00 0.00 N ATOM 970 CA VAL A 63 -242.271 78.419 58.195 1.00 0.00 C ATOM 971 C VAL A 63 -243.452 78.561 57.237 1.00 0.00 C ATOM 972 O VAL A 63 -244.615 78.397 57.628 1.00 0.00 O ATOM 973 CB VAL A 63 -242.235 77.006 58.834 1.00 0.00 C ATOM 974 CG1 VAL A 63 -243.025 76.982 60.127 1.00 0.00 C ATOM 975 CG2 VAL A 63 -242.746 75.954 57.863 1.00 0.00 C ATOM 0 H VAL A 63 -243.054 79.372 59.884 1.00 0.00 H new ATOM 0 HA VAL A 63 -241.349 78.534 57.626 1.00 0.00 H new ATOM 0 HB VAL A 63 -241.197 76.767 59.067 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -242.987 75.982 60.558 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -242.596 77.697 60.829 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -244.062 77.250 59.925 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -242.710 74.973 58.337 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -243.774 76.185 57.585 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -242.121 75.949 56.970 1.00 0.00 H new ATOM 985 N VAL A 64 -243.142 78.897 55.989 1.00 0.00 N ATOM 986 CA VAL A 64 -244.155 79.046 54.955 1.00 0.00 C ATOM 987 C VAL A 64 -244.810 77.708 54.661 1.00 0.00 C ATOM 988 O VAL A 64 -244.204 76.816 54.062 1.00 0.00 O ATOM 989 CB VAL A 64 -243.573 79.623 53.643 1.00 0.00 C ATOM 990 CG1 VAL A 64 -244.668 79.802 52.596 1.00 0.00 C ATOM 991 CG2 VAL A 64 -242.857 80.941 53.899 1.00 0.00 C ATOM 0 H VAL A 64 -242.189 79.072 55.670 1.00 0.00 H new ATOM 0 HA VAL A 64 -244.894 79.750 55.337 1.00 0.00 H new ATOM 0 HB VAL A 64 -242.845 78.910 53.257 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -244.235 80.209 51.682 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -245.127 78.837 52.381 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -245.425 80.488 52.975 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -242.457 81.326 52.961 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -243.560 81.662 54.317 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -242.041 80.781 54.603 1.00 0.00 H new ATOM 1199 N SER A 77 -248.175 81.358 56.267 1.00 0.00 N ATOM 1200 CA SER A 77 -246.876 81.516 56.895 1.00 0.00 C ATOM 1201 C SER A 77 -246.995 81.305 58.399 1.00 0.00 C ATOM 1202 O SER A 77 -247.507 82.165 59.119 1.00 0.00 O ATOM 1203 CB SER A 77 -246.312 82.906 56.583 1.00 0.00 C ATOM 1204 OG SER A 77 -247.267 83.922 56.844 1.00 0.00 O ATOM 0 HA SER A 77 -246.190 80.768 56.497 1.00 0.00 H new ATOM 0 HB2 SER A 77 -245.419 83.081 57.183 1.00 0.00 H new ATOM 0 HB3 SER A 77 -246.007 82.951 55.537 1.00 0.00 H new ATOM 0 HG SER A 77 -247.649 83.790 57.737 1.00 0.00 H new ATOM 1210 N SER A 78 -246.555 80.152 58.872 1.00 0.00 N ATOM 1211 CA SER A 78 -246.640 79.851 60.285 1.00 0.00 C ATOM 1212 C SER A 78 -245.467 80.490 61.013 1.00 0.00 C ATOM 1213 O SER A 78 -244.356 79.965 61.004 1.00 0.00 O ATOM 1214 CB SER A 78 -246.662 78.336 60.517 1.00 0.00 C ATOM 1215 OG SER A 78 -246.873 78.024 61.888 1.00 0.00 O ATOM 0 H SER A 78 -246.139 79.416 58.301 1.00 0.00 H new ATOM 0 HA SER A 78 -247.569 80.262 60.680 1.00 0.00 H new ATOM 0 HB2 SER A 78 -247.451 77.886 59.914 1.00 0.00 H new ATOM 0 HB3 SER A 78 -245.719 77.902 60.184 1.00 0.00 H new ATOM 0 HG SER A 78 -246.884 77.051 62.004 1.00 0.00 H new ATOM 1221 N GLN A 79 -245.715 81.626 61.644 1.00 0.00 N ATOM 1222 CA GLN A 79 -244.652 82.354 62.305 1.00 0.00 C ATOM 1223 C GLN A 79 -244.586 81.947 63.770 1.00 0.00 C ATOM 1224 O GLN A 79 -245.606 81.907 64.463 1.00 0.00 O ATOM 1225 CB GLN A 79 -244.899 83.862 62.189 1.00 0.00 C ATOM 1226 CG GLN A 79 -243.720 84.715 62.622 1.00 0.00 C ATOM 1227 CD GLN A 79 -244.042 86.199 62.662 1.00 0.00 C ATOM 1228 OE1 GLN A 79 -243.179 87.040 62.410 1.00 0.00 O ATOM 1229 NE2 GLN A 79 -245.276 86.536 63.004 1.00 0.00 N ATOM 0 H GLN A 79 -246.636 82.059 61.711 1.00 0.00 H new ATOM 0 HA GLN A 79 -243.703 82.116 61.825 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -245.147 84.101 61.155 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -245.767 84.125 62.794 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -243.390 84.394 63.610 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -242.888 84.548 61.938 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -245.965 85.812 63.206 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -245.537 87.520 63.066 1.00 0.00 H new ATOM 1238 N ARG A 80 -243.386 81.640 64.226 1.00 0.00 N ATOM 1239 CA ARG A 80 -243.150 81.258 65.604 1.00 0.00 C ATOM 1240 C ARG A 80 -242.059 82.153 66.171 1.00 0.00 C ATOM 1241 O ARG A 80 -241.214 82.610 65.423 1.00 0.00 O ATOM 1242 CB ARG A 80 -242.707 79.795 65.661 1.00 0.00 C ATOM 1243 CG ARG A 80 -242.699 79.235 67.072 1.00 0.00 C ATOM 1244 CD ARG A 80 -241.957 77.909 67.167 1.00 0.00 C ATOM 1245 NE ARG A 80 -241.852 77.453 68.556 1.00 0.00 N ATOM 1246 CZ ARG A 80 -240.697 77.293 69.213 1.00 0.00 C ATOM 1247 NH1 ARG A 80 -239.535 77.431 68.587 1.00 0.00 N ATOM 1248 NH2 ARG A 80 -240.704 76.971 70.500 1.00 0.00 N ATOM 0 H ARG A 80 -242.545 81.649 63.648 1.00 0.00 H new ATOM 0 HA ARG A 80 -244.063 81.371 66.189 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -243.373 79.195 65.041 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -241.708 79.706 65.235 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -242.234 79.957 67.744 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -243.726 79.099 67.411 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -242.476 77.156 66.574 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -240.959 78.017 66.742 1.00 0.00 H new ATOM 0 HE ARG A 80 -242.717 77.244 69.055 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -239.515 77.662 67.594 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -238.662 77.306 69.099 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -241.590 76.845 70.989 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -239.823 76.849 71.000 1.00 0.00 H new ATOM 1262 N VAL A 81 -242.063 82.427 67.465 1.00 0.00 N ATOM 1263 CA VAL A 81 -241.017 83.263 68.037 1.00 0.00 C ATOM 1264 C VAL A 81 -240.060 82.418 68.870 1.00 0.00 C ATOM 1265 O VAL A 81 -240.472 81.460 69.525 1.00 0.00 O ATOM 1266 CB VAL A 81 -241.574 84.410 68.900 1.00 0.00 C ATOM 1267 CG1 VAL A 81 -240.744 85.680 68.694 1.00 0.00 C ATOM 1268 CG2 VAL A 81 -243.047 84.663 68.603 1.00 0.00 C ATOM 0 H VAL A 81 -242.762 82.092 68.128 1.00 0.00 H new ATOM 0 HA VAL A 81 -240.486 83.713 67.198 1.00 0.00 H new ATOM 0 HB VAL A 81 -241.500 84.115 69.947 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -241.149 86.483 69.310 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -239.710 85.489 68.980 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -240.782 85.973 67.645 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -243.409 85.479 69.229 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -243.166 84.931 67.553 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -243.621 83.761 68.814 1.00 0.00 H new ATOM 1278 N LEU A 82 -238.787 82.777 68.833 1.00 0.00 N ATOM 1279 CA LEU A 82 -237.740 82.003 69.488 1.00 0.00 C ATOM 1280 C LEU A 82 -237.315 82.627 70.803 1.00 0.00 C ATOM 1281 O LEU A 82 -237.364 83.847 70.977 1.00 0.00 O ATOM 1282 CB LEU A 82 -236.531 81.919 68.570 1.00 0.00 C ATOM 1283 CG LEU A 82 -236.815 81.352 67.188 1.00 0.00 C ATOM 1284 CD1 LEU A 82 -235.726 81.777 66.228 1.00 0.00 C ATOM 1285 CD2 LEU A 82 -236.923 79.838 67.239 1.00 0.00 C ATOM 0 H LEU A 82 -238.449 83.610 68.350 1.00 0.00 H new ATOM 0 HA LEU A 82 -238.140 81.010 69.696 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -236.108 82.917 68.457 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -235.770 81.303 69.050 1.00 0.00 H new ATOM 0 HG LEU A 82 -237.769 81.744 66.836 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -235.933 81.369 65.239 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -235.695 82.865 66.172 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -234.764 81.404 66.580 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -237.126 79.454 66.239 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -235.986 79.419 67.605 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -237.734 79.553 67.909 1.00 0.00 H new ATOM 1297 N LEU A 83 -236.895 81.773 71.721 1.00 0.00 N ATOM 1298 CA LEU A 83 -236.278 82.216 72.954 1.00 0.00 C ATOM 1299 C LEU A 83 -234.802 82.483 72.690 1.00 0.00 C ATOM 1300 O LEU A 83 -234.304 82.167 71.604 1.00 0.00 O ATOM 1301 CB LEU A 83 -236.433 81.162 74.061 1.00 0.00 C ATOM 1302 CG LEU A 83 -237.860 80.906 74.556 1.00 0.00 C ATOM 1303 CD1 LEU A 83 -238.673 80.134 73.528 1.00 0.00 C ATOM 1304 CD2 LEU A 83 -237.831 80.155 75.875 1.00 0.00 C ATOM 0 H LEU A 83 -236.973 80.760 71.631 1.00 0.00 H new ATOM 0 HA LEU A 83 -236.771 83.127 73.293 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -236.022 80.220 73.697 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -235.825 81.467 74.912 1.00 0.00 H new ATOM 0 HG LEU A 83 -238.341 81.872 74.707 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -239.680 79.969 73.910 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -238.726 80.706 72.602 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -238.196 79.173 73.334 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -238.851 79.979 76.216 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -237.324 79.200 75.739 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -237.297 80.746 76.619 1.00 0.00 H new ATOM 1316 N ASP A 84 -234.113 83.048 73.674 1.00 0.00 N ATOM 1317 CA ASP A 84 -232.686 83.362 73.554 1.00 0.00 C ATOM 1318 C ASP A 84 -231.908 82.169 73.003 1.00 0.00 C ATOM 1319 O ASP A 84 -231.145 82.292 72.039 1.00 0.00 O ATOM 1320 CB ASP A 84 -232.131 83.753 74.927 1.00 0.00 C ATOM 1321 CG ASP A 84 -230.696 84.242 74.883 1.00 0.00 C ATOM 1322 OD1 ASP A 84 -229.777 83.413 74.739 1.00 0.00 O ATOM 1323 OD2 ASP A 84 -230.480 85.462 75.036 1.00 0.00 O ATOM 0 H ASP A 84 -234.520 83.302 74.574 1.00 0.00 H new ATOM 0 HA ASP A 84 -232.572 84.194 72.860 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -232.760 84.534 75.355 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -232.193 82.893 75.593 1.00 0.00 H new ATOM 1328 N GLN A 85 -232.141 81.006 73.593 1.00 0.00 N ATOM 1329 CA GLN A 85 -231.423 79.807 73.230 1.00 0.00 C ATOM 1330 C GLN A 85 -232.356 78.709 72.714 1.00 0.00 C ATOM 1331 O GLN A 85 -232.149 77.529 73.000 1.00 0.00 O ATOM 1332 CB GLN A 85 -230.638 79.311 74.437 1.00 0.00 C ATOM 1333 CG GLN A 85 -231.449 79.244 75.723 1.00 0.00 C ATOM 1334 CD GLN A 85 -230.622 78.788 76.906 1.00 0.00 C ATOM 1335 OE1 GLN A 85 -229.669 78.027 76.755 1.00 0.00 O ATOM 1336 NE2 GLN A 85 -230.985 79.247 78.091 1.00 0.00 N ATOM 0 H GLN A 85 -232.831 80.873 74.333 1.00 0.00 H new ATOM 0 HA GLN A 85 -230.741 80.052 72.415 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -230.243 78.319 74.217 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -229.782 79.967 74.594 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -231.870 80.227 75.935 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -232.287 78.561 75.585 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -231.783 79.877 78.171 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -230.467 78.971 78.925 1.00 0.00 H new ATOM 1345 N GLU A 86 -233.377 79.084 71.937 1.00 0.00 N ATOM 1346 CA GLU A 86 -234.233 78.089 71.299 1.00 0.00 C ATOM 1347 C GLU A 86 -233.466 77.381 70.183 1.00 0.00 C ATOM 1348 O GLU A 86 -233.801 76.259 69.795 1.00 0.00 O ATOM 1349 CB GLU A 86 -235.496 78.744 70.739 1.00 0.00 C ATOM 1350 CG GLU A 86 -236.478 77.760 70.115 1.00 0.00 C ATOM 1351 CD GLU A 86 -236.993 76.716 71.090 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -236.219 75.817 71.479 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -238.180 76.783 71.460 1.00 0.00 O ATOM 0 H GLU A 86 -233.625 80.053 71.739 1.00 0.00 H new ATOM 0 HA GLU A 86 -234.531 77.355 72.047 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -235.999 79.285 71.541 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -235.209 79.481 69.989 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -237.324 78.313 69.707 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -235.993 77.256 69.279 1.00 0.00 H new ATOM 1360 N CYS A 87 -232.420 78.054 69.702 1.00 0.00 N ATOM 1361 CA CYS A 87 -231.545 77.537 68.663 1.00 0.00 C ATOM 1362 C CYS A 87 -232.191 77.615 67.281 1.00 0.00 C ATOM 1363 O CYS A 87 -233.284 77.104 67.054 1.00 0.00 O ATOM 1364 CB CYS A 87 -231.109 76.117 69.003 1.00 0.00 C ATOM 1365 SG CYS A 87 -229.821 76.032 70.268 1.00 0.00 S ATOM 0 H CYS A 87 -232.158 78.984 70.030 1.00 0.00 H new ATOM 0 HA CYS A 87 -230.657 78.168 68.623 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -231.977 75.552 69.343 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -230.748 75.631 68.097 1.00 0.00 H new ATOM 0 HG CYS A 87 -229.516 74.789 70.494 1.00 0.00 H new ATOM 1371 N VAL A 88 -231.485 78.260 66.359 1.00 0.00 N ATOM 1372 CA VAL A 88 -231.994 78.529 65.026 1.00 0.00 C ATOM 1373 C VAL A 88 -231.942 77.272 64.187 1.00 0.00 C ATOM 1374 O VAL A 88 -232.856 76.983 63.423 1.00 0.00 O ATOM 1375 CB VAL A 88 -231.187 79.651 64.334 1.00 0.00 C ATOM 1376 CG1 VAL A 88 -231.615 79.843 62.888 1.00 0.00 C ATOM 1377 CG2 VAL A 88 -231.341 80.946 65.098 1.00 0.00 C ATOM 0 H VAL A 88 -230.541 78.611 66.519 1.00 0.00 H new ATOM 0 HA VAL A 88 -233.028 78.860 65.122 1.00 0.00 H new ATOM 0 HB VAL A 88 -230.138 79.353 64.332 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -231.024 80.640 62.437 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -231.457 78.917 62.336 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -232.671 80.110 62.854 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -230.769 81.731 64.603 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -232.393 81.228 65.128 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -230.972 80.815 66.115 1.00 0.00 H new ATOM 1387 N PHE A 89 -230.873 76.510 64.346 1.00 0.00 N ATOM 1388 CA PHE A 89 -230.741 75.267 63.597 1.00 0.00 C ATOM 1389 C PHE A 89 -231.705 74.239 64.172 1.00 0.00 C ATOM 1390 O PHE A 89 -232.283 73.426 63.448 1.00 0.00 O ATOM 1391 CB PHE A 89 -229.291 74.763 63.608 1.00 0.00 C ATOM 1392 CG PHE A 89 -229.090 73.474 62.861 1.00 0.00 C ATOM 1393 CD1 PHE A 89 -228.918 73.479 61.485 1.00 0.00 C ATOM 1394 CD2 PHE A 89 -229.072 72.262 63.531 1.00 0.00 C ATOM 1395 CE1 PHE A 89 -228.733 72.298 60.794 1.00 0.00 C ATOM 1396 CE2 PHE A 89 -228.888 71.079 62.843 1.00 0.00 C ATOM 1397 CZ PHE A 89 -228.719 71.097 61.474 1.00 0.00 C ATOM 0 H PHE A 89 -230.097 76.722 64.973 1.00 0.00 H new ATOM 0 HA PHE A 89 -230.997 75.442 62.552 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -228.647 75.528 63.174 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -228.972 74.627 64.641 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -228.929 74.416 60.948 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -229.203 72.242 64.603 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -228.599 72.314 59.722 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -228.876 70.140 63.376 1.00 0.00 H new ATOM 0 HZ PHE A 89 -228.576 70.172 60.935 1.00 0.00 H new ATOM 1407 N GLN A 90 -231.901 74.318 65.482 1.00 0.00 N ATOM 1408 CA GLN A 90 -232.886 73.496 66.169 1.00 0.00 C ATOM 1409 C GLN A 90 -234.303 73.880 65.753 1.00 0.00 C ATOM 1410 O GLN A 90 -235.209 73.048 65.766 1.00 0.00 O ATOM 1411 CB GLN A 90 -232.735 73.647 67.681 1.00 0.00 C ATOM 1412 CG GLN A 90 -231.605 72.829 68.278 1.00 0.00 C ATOM 1413 CD GLN A 90 -231.747 72.644 69.779 1.00 0.00 C ATOM 1414 OE1 GLN A 90 -232.395 73.587 70.447 1.00 0.00 O flip ATOM 1415 NE2 GLN A 90 -231.290 71.644 70.332 1.00 0.00 N flip ATOM 0 H GLN A 90 -231.385 74.950 66.094 1.00 0.00 H new ATOM 0 HA GLN A 90 -232.712 72.457 65.890 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -232.570 74.699 67.915 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -233.671 73.357 68.159 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -231.575 71.852 67.796 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -230.655 73.319 68.064 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -230.797 70.939 69.784 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -231.405 71.520 71.338 1.00 0.00 H new ATOM 1424 N ALA A 91 -234.488 75.146 65.409 1.00 0.00 N ATOM 1425 CA ALA A 91 -235.767 75.629 64.907 1.00 0.00 C ATOM 1426 C ALA A 91 -235.972 75.187 63.465 1.00 0.00 C ATOM 1427 O ALA A 91 -237.048 74.744 63.081 1.00 0.00 O ATOM 1428 CB ALA A 91 -235.829 77.142 65.012 1.00 0.00 C ATOM 0 H ALA A 91 -233.764 75.862 65.469 1.00 0.00 H new ATOM 0 HA ALA A 91 -236.566 75.203 65.514 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -236.789 77.494 64.634 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -235.718 77.439 66.055 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -235.024 77.581 64.422 1.00 0.00 H new ATOM 1434 N GLN A 92 -234.910 75.293 62.680 1.00 0.00 N ATOM 1435 CA GLN A 92 -234.940 74.948 61.271 1.00 0.00 C ATOM 1436 C GLN A 92 -235.394 73.506 61.051 1.00 0.00 C ATOM 1437 O GLN A 92 -236.107 73.204 60.093 1.00 0.00 O ATOM 1438 CB GLN A 92 -233.548 75.134 60.681 1.00 0.00 C ATOM 1439 CG GLN A 92 -233.570 75.405 59.199 1.00 0.00 C ATOM 1440 CD GLN A 92 -232.269 75.065 58.496 1.00 0.00 C ATOM 1441 OE1 GLN A 92 -231.163 75.114 59.216 1.00 0.00 O flip ATOM 1442 NE2 GLN A 92 -232.266 74.745 57.307 1.00 0.00 N flip ATOM 0 H GLN A 92 -234.001 75.622 63.006 1.00 0.00 H new ATOM 0 HA GLN A 92 -235.656 75.604 60.777 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -233.051 75.961 61.189 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -232.955 74.240 60.873 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -234.378 74.831 58.746 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -233.797 76.458 59.035 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -233.141 74.719 56.784 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -231.388 74.506 56.845 1.00 0.00 H new ATOM 1451 N SER A 93 -234.966 72.623 61.938 1.00 0.00 N ATOM 1452 CA SER A 93 -235.286 71.205 61.825 1.00 0.00 C ATOM 1453 C SER A 93 -236.759 70.924 62.157 1.00 0.00 C ATOM 1454 O SER A 93 -237.268 69.840 61.868 1.00 0.00 O ATOM 1455 CB SER A 93 -234.363 70.387 62.736 1.00 0.00 C ATOM 1456 OG SER A 93 -234.470 70.802 64.086 1.00 0.00 O ATOM 0 H SER A 93 -234.394 72.862 62.748 1.00 0.00 H new ATOM 0 HA SER A 93 -235.125 70.906 60.789 1.00 0.00 H new ATOM 0 HB2 SER A 93 -234.616 69.330 62.658 1.00 0.00 H new ATOM 0 HB3 SER A 93 -233.331 70.494 62.402 1.00 0.00 H new ATOM 0 HG SER A 93 -233.871 70.262 64.643 1.00 0.00 H new ATOM 1462 N LYS A 94 -237.436 71.902 62.758 1.00 0.00 N ATOM 1463 CA LYS A 94 -238.842 71.764 63.124 1.00 0.00 C ATOM 1464 C LYS A 94 -239.733 71.947 61.904 1.00 0.00 C ATOM 1465 O LYS A 94 -240.834 71.395 61.830 1.00 0.00 O ATOM 1466 CB LYS A 94 -239.225 72.834 64.150 1.00 0.00 C ATOM 1467 CG LYS A 94 -238.336 72.890 65.377 1.00 0.00 C ATOM 1468 CD LYS A 94 -238.661 71.792 66.368 1.00 0.00 C ATOM 1469 CE LYS A 94 -237.803 71.926 67.612 1.00 0.00 C ATOM 1470 NZ LYS A 94 -237.932 73.270 68.229 1.00 0.00 N ATOM 0 H LYS A 94 -237.028 72.804 63.002 1.00 0.00 H new ATOM 0 HA LYS A 94 -238.981 70.767 63.541 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -239.207 73.808 63.661 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -240.252 72.658 64.471 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -237.293 72.805 65.072 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -238.449 73.860 65.862 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -239.715 71.840 66.640 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -238.495 70.818 65.908 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -238.092 71.164 68.336 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -236.760 71.743 67.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -237.640 73.224 69.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -237.325 73.945 67.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -238.922 73.584 68.173 1.00 0.00 H new ATOM 1484 N TRP A 95 -239.228 72.719 60.951 1.00 0.00 N ATOM 1485 CA TRP A 95 -240.027 73.236 59.848 1.00 0.00 C ATOM 1486 C TRP A 95 -240.741 72.160 59.051 1.00 0.00 C ATOM 1487 O TRP A 95 -240.194 71.097 58.755 1.00 0.00 O ATOM 1488 CB TRP A 95 -239.165 74.092 58.926 1.00 0.00 C ATOM 1489 CG TRP A 95 -238.825 75.409 59.536 1.00 0.00 C ATOM 1490 CD1 TRP A 95 -239.077 75.799 60.817 1.00 0.00 C ATOM 1491 CD2 TRP A 95 -238.177 76.506 58.901 1.00 0.00 C ATOM 1492 NE1 TRP A 95 -238.640 77.075 61.014 1.00 0.00 N ATOM 1493 CE2 TRP A 95 -238.077 77.537 59.854 1.00 0.00 C ATOM 1494 CE3 TRP A 95 -237.673 76.718 57.620 1.00 0.00 C ATOM 1495 CZ2 TRP A 95 -237.493 78.763 59.560 1.00 0.00 C ATOM 1496 CZ3 TRP A 95 -237.091 77.937 57.331 1.00 0.00 C ATOM 1497 CH2 TRP A 95 -237.007 78.942 58.295 1.00 0.00 C ATOM 0 H TRP A 95 -238.249 73.005 60.921 1.00 0.00 H new ATOM 0 HA TRP A 95 -240.808 73.847 60.301 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -238.246 73.555 58.688 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -239.692 74.254 57.986 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -239.554 75.186 61.567 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -238.719 77.601 61.884 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -237.736 75.945 56.868 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -237.426 79.544 60.302 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -236.694 78.115 56.342 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -236.547 79.884 58.036 1.00 0.00 H new ATOM 1508 N LYS A 96 -241.977 72.474 58.700 1.00 0.00 N ATOM 1509 CA LYS A 96 -242.813 71.587 57.904 1.00 0.00 C ATOM 1510 C LYS A 96 -242.984 72.189 56.516 1.00 0.00 C ATOM 1511 O LYS A 96 -243.836 71.779 55.730 1.00 0.00 O ATOM 1512 CB LYS A 96 -244.174 71.403 58.577 1.00 0.00 C ATOM 1513 CG LYS A 96 -244.066 70.868 59.993 1.00 0.00 C ATOM 1514 CD LYS A 96 -245.411 70.847 60.701 1.00 0.00 C ATOM 1515 CE LYS A 96 -245.245 70.534 62.180 1.00 0.00 C ATOM 1516 NZ LYS A 96 -246.548 70.463 62.890 1.00 0.00 N ATOM 0 H LYS A 96 -242.430 73.351 58.958 1.00 0.00 H new ATOM 0 HA LYS A 96 -242.340 70.609 57.821 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -244.697 72.359 58.594 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -244.779 70.719 57.981 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -243.654 69.859 59.968 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -243.368 71.484 60.560 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -245.903 71.813 60.583 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -246.058 70.101 60.238 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -244.720 69.585 62.292 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -244.622 71.299 62.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -246.385 70.248 63.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -247.039 71.376 62.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -247.134 69.715 62.466 1.00 0.00 H new ATOM 1530 N GLY A 97 -242.142 73.168 56.243 1.00 0.00 N ATOM 1531 CA GLY A 97 -242.196 73.914 55.009 1.00 0.00 C ATOM 1532 C GLY A 97 -240.989 74.822 54.907 1.00 0.00 C ATOM 1533 O GLY A 97 -240.198 74.893 55.848 1.00 0.00 O ATOM 0 H GLY A 97 -241.400 73.466 56.876 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -242.221 73.230 54.161 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -243.111 74.504 54.970 1.00 0.00 H new ATOM 1537 N ALA A 98 -240.840 75.522 53.798 1.00 0.00 N ATOM 1538 CA ALA A 98 -239.681 76.379 53.605 1.00 0.00 C ATOM 1539 C ALA A 98 -239.999 77.817 53.994 1.00 0.00 C ATOM 1540 O ALA A 98 -240.599 78.561 53.220 1.00 0.00 O ATOM 1541 CB ALA A 98 -239.195 76.309 52.163 1.00 0.00 C ATOM 0 H ALA A 98 -241.501 75.516 53.021 1.00 0.00 H new ATOM 0 HA ALA A 98 -238.883 76.020 54.254 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -238.327 76.957 52.040 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -238.918 75.283 51.922 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -239.991 76.637 51.494 1.00 0.00 H new ATOM 1547 N GLY A 99 -239.600 78.201 55.199 1.00 0.00 N ATOM 1548 CA GLY A 99 -239.863 79.541 55.669 1.00 0.00 C ATOM 1549 C GLY A 99 -238.613 80.388 55.689 1.00 0.00 C ATOM 1550 O GLY A 99 -237.707 80.197 54.872 1.00 0.00 O ATOM 0 H GLY A 99 -239.098 77.606 55.858 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -240.609 80.010 55.028 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -240.287 79.497 56.672 1.00 0.00 H new ATOM 1554 N LYS A 100 -238.567 81.316 56.627 1.00 0.00 N ATOM 1555 CA LYS A 100 -237.393 82.136 56.872 1.00 0.00 C ATOM 1556 C LYS A 100 -237.380 82.500 58.334 1.00 0.00 C ATOM 1557 O LYS A 100 -238.423 82.493 58.992 1.00 0.00 O ATOM 1558 CB LYS A 100 -237.365 83.443 56.057 1.00 0.00 C ATOM 1559 CG LYS A 100 -237.408 83.271 54.558 1.00 0.00 C ATOM 1560 CD LYS A 100 -238.835 83.162 54.071 1.00 0.00 C ATOM 1561 CE LYS A 100 -238.901 83.213 52.569 1.00 0.00 C ATOM 1562 NZ LYS A 100 -238.208 82.058 51.934 1.00 0.00 N ATOM 0 H LYS A 100 -239.350 81.524 57.246 1.00 0.00 H new ATOM 0 HA LYS A 100 -236.524 81.552 56.569 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -238.212 84.059 56.360 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -236.461 83.994 56.317 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -236.918 84.117 54.076 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -236.853 82.377 54.274 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -239.273 82.229 54.426 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -239.429 83.973 54.492 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -239.944 83.226 52.254 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -238.450 84.142 52.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -238.408 82.052 50.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -237.183 82.142 52.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -238.549 81.172 52.359 1.00 0.00 H new ATOM 1576 N PHE A 101 -236.218 82.793 58.855 1.00 0.00 N ATOM 1577 CA PHE A 101 -236.145 83.375 60.168 1.00 0.00 C ATOM 1578 C PHE A 101 -236.329 84.888 60.042 1.00 0.00 C ATOM 1579 O PHE A 101 -235.606 85.543 59.325 1.00 0.00 O ATOM 1580 CB PHE A 101 -234.820 82.991 60.821 1.00 0.00 C ATOM 1581 CG PHE A 101 -234.699 81.501 61.028 1.00 0.00 C ATOM 1582 CD1 PHE A 101 -235.247 80.901 62.150 1.00 0.00 C ATOM 1583 CD2 PHE A 101 -234.059 80.699 60.092 1.00 0.00 C ATOM 1584 CE1 PHE A 101 -235.158 79.536 62.337 1.00 0.00 C ATOM 1585 CE2 PHE A 101 -233.970 79.332 60.276 1.00 0.00 C ATOM 1586 CZ PHE A 101 -234.519 78.751 61.399 1.00 0.00 C ATOM 0 H PHE A 101 -235.319 82.641 58.397 1.00 0.00 H new ATOM 0 HA PHE A 101 -236.938 82.996 60.813 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -233.996 83.338 60.198 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -234.729 83.498 61.781 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -235.750 81.509 62.888 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -233.626 81.148 59.211 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -235.589 79.082 63.218 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -233.470 78.719 59.540 1.00 0.00 H new ATOM 0 HZ PHE A 101 -234.449 77.683 61.545 1.00 0.00 H new ATOM 1596 N ILE A 102 -237.339 85.429 60.691 1.00 0.00 N ATOM 1597 CA ILE A 102 -237.665 86.844 60.546 1.00 0.00 C ATOM 1598 C ILE A 102 -237.161 87.632 61.754 1.00 0.00 C ATOM 1599 O ILE A 102 -237.435 87.272 62.898 1.00 0.00 O ATOM 1600 CB ILE A 102 -239.198 87.062 60.364 1.00 0.00 C ATOM 1601 CG1 ILE A 102 -239.627 86.869 58.900 1.00 0.00 C ATOM 1602 CG2 ILE A 102 -239.621 88.445 60.840 1.00 0.00 C ATOM 1603 CD1 ILE A 102 -239.423 85.472 58.352 1.00 0.00 C ATOM 0 H ILE A 102 -237.952 84.916 61.325 1.00 0.00 H new ATOM 0 HA ILE A 102 -237.166 87.209 59.648 1.00 0.00 H new ATOM 0 HB ILE A 102 -239.697 86.310 60.975 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -240.682 87.128 58.809 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -239.071 87.571 58.279 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -240.695 88.565 60.700 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -239.379 88.556 61.897 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -239.092 89.205 60.265 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -239.755 85.436 57.314 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -238.366 85.212 58.404 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -240.001 84.761 58.943 1.00 0.00 H new ATOM 1615 N LEU A 103 -236.402 88.690 61.496 1.00 0.00 N ATOM 1616 CA LEU A 103 -235.858 89.509 62.569 1.00 0.00 C ATOM 1617 C LEU A 103 -236.914 90.492 63.063 1.00 0.00 C ATOM 1618 O LEU A 103 -237.431 91.300 62.286 1.00 0.00 O ATOM 1619 CB LEU A 103 -234.631 90.284 62.085 1.00 0.00 C ATOM 1620 CG LEU A 103 -233.720 90.806 63.196 1.00 0.00 C ATOM 1621 CD1 LEU A 103 -232.813 89.693 63.699 1.00 0.00 C ATOM 1622 CD2 LEU A 103 -232.905 91.994 62.712 1.00 0.00 C ATOM 0 H LEU A 103 -236.151 88.999 60.557 1.00 0.00 H new ATOM 0 HA LEU A 103 -235.562 88.850 63.386 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -234.047 89.638 61.429 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -234.967 91.129 61.484 1.00 0.00 H new ATOM 0 HG LEU A 103 -234.342 91.144 64.025 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -232.169 90.078 64.490 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -233.421 88.877 64.090 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -232.198 89.325 62.877 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -232.264 92.349 63.519 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -232.289 91.692 61.865 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -233.577 92.795 62.404 1.00 0.00 H new ATOM 1634 N LYS A 104 -237.247 90.413 64.341 1.00 0.00 N ATOM 1635 CA LYS A 104 -238.225 91.315 64.927 1.00 0.00 C ATOM 1636 C LYS A 104 -237.780 91.724 66.329 1.00 0.00 C ATOM 1637 O LYS A 104 -236.764 91.242 66.824 1.00 0.00 O ATOM 1638 CB LYS A 104 -239.605 90.651 64.957 1.00 0.00 C ATOM 1639 CG LYS A 104 -240.740 91.653 65.068 1.00 0.00 C ATOM 1640 CD LYS A 104 -242.096 90.981 65.042 1.00 0.00 C ATOM 1641 CE LYS A 104 -242.413 90.367 63.685 1.00 0.00 C ATOM 1642 NZ LYS A 104 -242.464 91.390 62.607 1.00 0.00 N ATOM 0 H LYS A 104 -236.854 89.733 64.993 1.00 0.00 H new ATOM 0 HA LYS A 104 -238.297 92.214 64.315 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -239.737 90.058 64.052 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -239.652 89.961 65.799 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -240.634 92.219 65.993 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -240.674 92.368 64.248 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -242.128 90.204 65.806 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -242.865 91.710 65.296 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -241.658 89.620 63.440 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -243.370 89.848 63.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -242.923 90.986 61.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -243.007 92.214 62.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -241.497 91.687 62.364 1.00 0.00 H new ATOM 1656 N LEU A 105 -238.521 92.616 66.965 1.00 0.00 N ATOM 1657 CA LEU A 105 -238.211 93.021 68.321 1.00 0.00 C ATOM 1658 C LEU A 105 -239.083 92.262 69.293 1.00 0.00 C ATOM 1659 O LEU A 105 -240.170 91.807 68.944 1.00 0.00 O ATOM 1660 CB LEU A 105 -238.422 94.515 68.544 1.00 0.00 C ATOM 1661 CG LEU A 105 -237.165 95.382 68.536 1.00 0.00 C ATOM 1662 CD1 LEU A 105 -236.495 95.362 67.183 1.00 0.00 C ATOM 1663 CD2 LEU A 105 -237.501 96.807 68.941 1.00 0.00 C ATOM 0 H LEU A 105 -239.340 93.072 66.563 1.00 0.00 H new ATOM 0 HA LEU A 105 -237.157 92.797 68.487 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -239.098 94.884 67.773 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -238.926 94.651 69.501 1.00 0.00 H new ATOM 0 HG LEU A 105 -236.466 94.967 69.262 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -235.603 95.988 67.209 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -236.213 94.340 66.932 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -237.184 95.744 66.430 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -236.594 97.412 68.930 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -238.224 97.224 68.239 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -237.927 96.809 69.944 1.00 0.00 H new ATOM 1675 N LYS A 106 -238.615 92.153 70.514 1.00 0.00 N ATOM 1676 CA LYS A 106 -239.361 91.471 71.555 1.00 0.00 C ATOM 1677 C LYS A 106 -240.237 92.457 72.305 1.00 0.00 C ATOM 1678 O LYS A 106 -241.020 92.099 73.182 1.00 0.00 O ATOM 1679 CB LYS A 106 -238.403 90.751 72.475 1.00 0.00 C ATOM 1680 CG LYS A 106 -237.277 91.619 72.957 1.00 0.00 C ATOM 1681 CD LYS A 106 -236.298 90.838 73.811 1.00 0.00 C ATOM 1682 CE LYS A 106 -236.976 90.297 75.049 1.00 0.00 C ATOM 1683 NZ LYS A 106 -236.034 89.567 75.931 1.00 0.00 N ATOM 0 H LYS A 106 -237.716 92.529 70.816 1.00 0.00 H new ATOM 0 HA LYS A 106 -240.021 90.727 71.109 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -238.953 90.371 73.336 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -237.990 89.888 71.954 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -236.754 92.046 72.101 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -237.680 92.452 73.533 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -235.879 90.015 73.232 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -235.466 91.481 74.098 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -237.426 91.120 75.604 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -237.786 89.630 74.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -236.543 89.214 76.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -235.623 88.765 75.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -235.274 90.209 76.234 1.00 0.00 H new