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= 0.747 K(o=1.7,f=-5.8!) USER MOD Set 1.2: A 100 LYS NZ :NH3+ 159:sc= 0.955 (180deg=-0.492) USER MOD Set 2.1: A 6 SER OG : rot -31:sc= -0.502 USER MOD Set 2.2: A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 HIS :FLIP no HD1:sc= -2.25! C(o=-3.2!,f=-2.3!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -95:sc= -0.632! USER MOD Single : A 30 THR OG1 : rot -86:sc= -0.578 USER MOD Single : A 32 GLN : amide:sc= -0.503 X(o=-0.5,f=-0.036) USER MOD Single : A 36 GLN :FLIP amide:sc= 0 F(o=-0.78,f=0) USER MOD Single : A 37 GLN : amide:sc=-0.00288 K(o=-0.0029,f=-1.3) USER MOD Single : A 38 THR OG1 : rot 67:sc= 1.16 USER MOD Single : A 40 CYS SG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 29:sc= -0.0464 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -1.07 K(o=-1.1,f=-3.3!) USER MOD Single : A 85 GLN : amide:sc= -0.0275 K(o=-0.028,f=-1.1) USER MOD Single : A 87 CYS SG : rot 180:sc= 0 USER MOD Single : A 90 GLN :FLIP amide:sc= -0.753 F(o=-4.2!,f=-0.75) USER MOD Single : A 92 GLN :FLIP amide:sc= -0.145 F(o=-1.3,f=-0.14) USER MOD Single : A 93 SER OG : rot -7:sc= 1.21 USER MOD Single : A 94 LYS NZ :NH3+ 162:sc= -0.159 (180deg=-0.623) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ -171:sc=-0.00799 (180deg=-0.108) USER MOD Single : A 106 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.073) USER MOD ----------------------------------------------------------------- ATOM 70 N SER A 6 -221.862 75.370 58.965 1.00 0.00 N ATOM 71 CA SER A 6 -222.565 76.545 58.519 1.00 0.00 C ATOM 72 C SER A 6 -223.866 76.133 57.859 1.00 0.00 C ATOM 73 O SER A 6 -223.931 75.117 57.167 1.00 0.00 O ATOM 74 CB SER A 6 -221.693 77.369 57.566 1.00 0.00 C ATOM 75 OG SER A 6 -221.230 76.589 56.476 1.00 0.00 O ATOM 0 HA SER A 6 -222.794 77.176 59.378 1.00 0.00 H new ATOM 0 HB2 SER A 6 -222.265 78.217 57.190 1.00 0.00 H new ATOM 0 HB3 SER A 6 -220.841 77.776 58.111 1.00 0.00 H new ATOM 0 HG SER A 6 -221.121 75.658 56.763 1.00 0.00 H new ATOM 81 N PHE A 7 -224.901 76.895 58.119 1.00 0.00 N ATOM 82 CA PHE A 7 -226.204 76.623 57.569 1.00 0.00 C ATOM 83 C PHE A 7 -226.758 77.914 56.995 1.00 0.00 C ATOM 84 O PHE A 7 -226.399 79.005 57.446 1.00 0.00 O ATOM 85 CB PHE A 7 -227.115 76.035 58.659 1.00 0.00 C ATOM 86 CG PHE A 7 -227.788 77.039 59.541 1.00 0.00 C ATOM 87 CD1 PHE A 7 -227.180 77.481 60.694 1.00 0.00 C ATOM 88 CD2 PHE A 7 -229.045 77.523 59.227 1.00 0.00 C ATOM 89 CE1 PHE A 7 -227.803 78.392 61.514 1.00 0.00 C ATOM 90 CE2 PHE A 7 -229.673 78.435 60.045 1.00 0.00 C ATOM 91 CZ PHE A 7 -229.051 78.869 61.193 1.00 0.00 C ATOM 0 H PHE A 7 -224.862 77.720 58.717 1.00 0.00 H new ATOM 0 HA PHE A 7 -226.145 75.885 56.769 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -227.881 75.426 58.179 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -226.522 75.367 59.284 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -226.202 77.108 60.958 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -229.540 77.182 58.330 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -227.310 78.733 62.412 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -230.652 78.809 59.786 1.00 0.00 H new ATOM 0 HZ PHE A 7 -229.542 79.582 61.839 1.00 0.00 H new ATOM 101 N PHE A 8 -227.608 77.801 56.001 1.00 0.00 N ATOM 102 CA PHE A 8 -228.124 78.983 55.329 1.00 0.00 C ATOM 103 C PHE A 8 -229.340 79.543 56.048 1.00 0.00 C ATOM 104 O PHE A 8 -230.284 78.815 56.361 1.00 0.00 O ATOM 105 CB PHE A 8 -228.467 78.685 53.869 1.00 0.00 C ATOM 106 CG PHE A 8 -227.264 78.622 52.976 1.00 0.00 C ATOM 107 CD1 PHE A 8 -226.628 79.787 52.582 1.00 0.00 C ATOM 108 CD2 PHE A 8 -226.769 77.407 52.529 1.00 0.00 C ATOM 109 CE1 PHE A 8 -225.519 79.745 51.760 1.00 0.00 C ATOM 110 CE2 PHE A 8 -225.660 77.357 51.707 1.00 0.00 C ATOM 111 CZ PHE A 8 -225.034 78.529 51.320 1.00 0.00 C ATOM 0 H PHE A 8 -227.958 76.914 55.638 1.00 0.00 H new ATOM 0 HA PHE A 8 -227.336 79.735 55.352 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -229.000 77.736 53.815 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -229.145 79.454 53.499 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -227.004 80.741 52.922 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -227.255 76.490 52.826 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -225.032 80.662 51.462 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -225.282 76.404 51.367 1.00 0.00 H new ATOM 0 HZ PHE A 8 -224.168 78.493 50.675 1.00 0.00 H new ATOM 121 N VAL A 9 -229.308 80.840 56.313 1.00 0.00 N ATOM 122 CA VAL A 9 -230.419 81.514 56.959 1.00 0.00 C ATOM 123 C VAL A 9 -230.989 82.573 56.050 1.00 0.00 C ATOM 124 O VAL A 9 -230.302 83.520 55.683 1.00 0.00 O ATOM 125 CB VAL A 9 -230.023 82.245 58.255 1.00 0.00 C ATOM 126 CG1 VAL A 9 -231.225 82.412 59.171 1.00 0.00 C ATOM 127 CG2 VAL A 9 -228.888 81.554 58.965 1.00 0.00 C ATOM 0 H VAL A 9 -228.520 81.447 56.089 1.00 0.00 H new ATOM 0 HA VAL A 9 -231.134 80.724 57.188 1.00 0.00 H new ATOM 0 HB VAL A 9 -229.668 83.237 57.976 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -230.921 82.931 60.080 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -231.993 82.994 58.661 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -231.624 81.431 59.430 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -228.640 82.102 59.874 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -229.186 80.538 59.224 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -228.016 81.521 58.312 1.00 0.00 H new ATOM 137 N GLN A 10 -232.231 82.422 55.682 1.00 0.00 N ATOM 138 CA GLN A 10 -232.950 83.520 55.108 1.00 0.00 C ATOM 139 C GLN A 10 -233.625 84.254 56.254 1.00 0.00 C ATOM 140 O GLN A 10 -234.555 83.736 56.857 1.00 0.00 O ATOM 141 CB GLN A 10 -233.989 83.021 54.112 1.00 0.00 C ATOM 142 CG GLN A 10 -233.424 82.188 52.978 1.00 0.00 C ATOM 143 CD GLN A 10 -234.465 81.876 51.915 1.00 0.00 C ATOM 144 OE1 GLN A 10 -235.667 81.786 52.197 1.00 0.00 O ATOM 145 NE2 GLN A 10 -234.015 81.716 50.679 1.00 0.00 N ATOM 0 H GLN A 10 -232.761 81.555 55.769 1.00 0.00 H new ATOM 0 HA GLN A 10 -232.274 84.181 54.566 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -234.731 82.428 54.647 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -234.511 83.880 53.690 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -232.590 82.720 52.521 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -233.027 81.255 53.379 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -233.017 81.798 50.485 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -234.667 81.511 49.922 1.00 0.00 H new ATOM 154 N VAL A 11 -233.133 85.429 56.584 1.00 0.00 N ATOM 155 CA VAL A 11 -233.689 86.198 57.677 1.00 0.00 C ATOM 156 C VAL A 11 -234.164 87.561 57.202 1.00 0.00 C ATOM 157 O VAL A 11 -233.387 88.391 56.757 1.00 0.00 O ATOM 158 CB VAL A 11 -232.714 86.313 58.890 1.00 0.00 C ATOM 159 CG1 VAL A 11 -231.266 86.316 58.448 1.00 0.00 C ATOM 160 CG2 VAL A 11 -233.017 87.543 59.740 1.00 0.00 C ATOM 0 H VAL A 11 -232.347 85.874 56.110 1.00 0.00 H new ATOM 0 HA VAL A 11 -234.558 85.649 58.040 1.00 0.00 H new ATOM 0 HB VAL A 11 -232.874 85.429 59.507 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -230.619 86.397 59.322 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -231.045 85.389 57.918 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -231.090 87.163 57.786 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -232.318 87.589 60.575 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -232.914 88.441 59.130 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -234.036 87.479 60.123 1.00 0.00 H new ATOM 170 N HIS A 12 -235.470 87.760 57.276 1.00 0.00 N ATOM 171 CA HIS A 12 -236.088 89.001 56.830 1.00 0.00 C ATOM 172 C HIS A 12 -235.763 90.141 57.781 1.00 0.00 C ATOM 173 O HIS A 12 -235.756 89.956 58.999 1.00 0.00 O ATOM 174 CB HIS A 12 -237.615 88.857 56.780 1.00 0.00 C ATOM 175 CG HIS A 12 -238.185 88.327 55.506 1.00 0.00 C ATOM 176 ND1 HIS A 12 -238.473 87.063 55.119 1.00 0.00 N flip ATOM 177 CD2 HIS A 12 -238.603 89.145 54.481 1.00 0.00 C flip ATOM 178 CE1 HIS A 12 -239.061 87.137 53.876 1.00 0.00 C flip ATOM 179 NE2 HIS A 12 -239.123 88.409 53.518 1.00 0.00 N flip ATOM 0 H HIS A 12 -236.128 87.073 57.644 1.00 0.00 H new ATOM 0 HA HIS A 12 -235.694 89.217 55.837 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -237.924 88.200 57.593 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -238.058 89.834 56.973 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -238.518 90.222 54.467 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -239.412 86.299 53.292 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -239.509 88.762 52.642 1.00 0.00 H new ATOM 287 N LEU A 20 -235.500 90.396 52.323 1.00 0.00 N ATOM 288 CA LEU A 20 -235.057 89.122 52.853 1.00 0.00 C ATOM 289 C LEU A 20 -233.540 89.076 52.900 1.00 0.00 C ATOM 290 O LEU A 20 -232.882 89.024 51.860 1.00 0.00 O ATOM 291 CB LEU A 20 -235.596 87.969 52.004 1.00 0.00 C ATOM 292 CG LEU A 20 -235.153 86.573 52.453 1.00 0.00 C ATOM 293 CD1 LEU A 20 -235.502 86.353 53.913 1.00 0.00 C ATOM 294 CD2 LEU A 20 -235.800 85.506 51.581 1.00 0.00 C ATOM 0 HA LEU A 20 -235.445 89.014 53.866 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -236.685 88.009 52.014 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -235.281 88.119 50.972 1.00 0.00 H new ATOM 0 HG LEU A 20 -234.071 86.498 52.343 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -235.181 85.357 54.218 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -234.996 87.100 54.525 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -236.580 86.444 54.047 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -235.476 84.520 51.912 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -236.885 85.578 51.663 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -235.504 85.656 50.543 1.00 0.00 H new ATOM 306 N THR A 21 -232.989 89.112 54.101 1.00 0.00 N ATOM 307 CA THR A 21 -231.554 89.074 54.269 1.00 0.00 C ATOM 308 C THR A 21 -231.057 87.629 54.285 1.00 0.00 C ATOM 309 O THR A 21 -231.279 86.902 55.243 1.00 0.00 O ATOM 310 CB THR A 21 -231.137 89.777 55.579 1.00 0.00 C ATOM 311 OG1 THR A 21 -231.756 91.070 55.653 1.00 0.00 O ATOM 312 CG2 THR A 21 -229.623 89.934 55.669 1.00 0.00 C ATOM 0 H THR A 21 -233.517 89.168 54.972 1.00 0.00 H new ATOM 0 HA THR A 21 -231.103 89.600 53.427 1.00 0.00 H new ATOM 0 HB THR A 21 -231.467 89.157 56.413 1.00 0.00 H new ATOM 0 HG1 THR A 21 -231.491 91.513 56.486 1.00 0.00 H new ATOM 0 HG21 THR A 21 -229.364 90.432 56.603 1.00 0.00 H new ATOM 0 HG22 THR A 21 -229.153 88.951 55.640 1.00 0.00 H new ATOM 0 HG23 THR A 21 -229.269 90.531 54.829 1.00 0.00 H new ATOM 320 N VAL A 22 -230.381 87.211 53.229 1.00 0.00 N ATOM 321 CA VAL A 22 -229.887 85.843 53.151 1.00 0.00 C ATOM 322 C VAL A 22 -228.445 85.771 53.649 1.00 0.00 C ATOM 323 O VAL A 22 -227.534 86.306 53.017 1.00 0.00 O ATOM 324 CB VAL A 22 -229.961 85.291 51.711 1.00 0.00 C ATOM 325 CG1 VAL A 22 -229.511 83.834 51.665 1.00 0.00 C ATOM 326 CG2 VAL A 22 -231.370 85.434 51.157 1.00 0.00 C ATOM 0 H VAL A 22 -230.162 87.791 52.419 1.00 0.00 H new ATOM 0 HA VAL A 22 -230.526 85.229 53.786 1.00 0.00 H new ATOM 0 HB VAL A 22 -229.284 85.875 51.087 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -229.572 83.467 50.641 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -228.482 83.760 52.017 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -230.157 83.233 52.305 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -231.403 85.040 50.141 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -232.066 84.878 51.785 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -231.652 86.487 51.147 1.00 0.00 H new ATOM 336 N ILE A 23 -228.248 85.121 54.785 1.00 0.00 N ATOM 337 CA ILE A 23 -226.925 84.986 55.378 1.00 0.00 C ATOM 338 C ILE A 23 -226.563 83.527 55.583 1.00 0.00 C ATOM 339 O ILE A 23 -227.396 82.636 55.424 1.00 0.00 O ATOM 340 CB ILE A 23 -226.819 85.696 56.744 1.00 0.00 C ATOM 341 CG1 ILE A 23 -227.970 85.279 57.664 1.00 0.00 C ATOM 342 CG2 ILE A 23 -226.787 87.209 56.564 1.00 0.00 C ATOM 343 CD1 ILE A 23 -227.818 85.783 59.083 1.00 0.00 C ATOM 0 H ILE A 23 -228.994 84.675 55.319 1.00 0.00 H new ATOM 0 HA ILE A 23 -226.236 85.455 54.675 1.00 0.00 H new ATOM 0 HB ILE A 23 -225.884 85.392 57.215 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -228.908 85.652 57.252 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -228.038 84.191 57.678 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -226.712 87.690 57.539 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -225.925 87.485 55.956 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -227.701 87.536 56.068 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -228.668 85.451 59.680 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -226.897 85.389 59.512 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -227.780 86.872 59.080 1.00 0.00 H new ATOM 355 N LYS A 24 -225.314 83.293 55.927 1.00 0.00 N ATOM 356 CA LYS A 24 -224.871 81.974 56.315 1.00 0.00 C ATOM 357 C LYS A 24 -224.352 82.030 57.747 1.00 0.00 C ATOM 358 O LYS A 24 -223.353 82.691 58.033 1.00 0.00 O ATOM 359 CB LYS A 24 -223.780 81.474 55.371 1.00 0.00 C ATOM 360 CG LYS A 24 -223.824 79.975 55.132 1.00 0.00 C ATOM 361 CD LYS A 24 -222.600 79.509 54.361 1.00 0.00 C ATOM 362 CE LYS A 24 -222.660 78.025 54.042 1.00 0.00 C ATOM 363 NZ LYS A 24 -221.454 77.577 53.299 1.00 0.00 N ATOM 0 H LYS A 24 -224.584 84.006 55.945 1.00 0.00 H new ATOM 0 HA LYS A 24 -225.708 81.278 56.256 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -223.874 81.989 54.415 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -222.806 81.740 55.782 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -223.877 79.453 56.087 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -224.727 79.718 54.578 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -222.518 80.076 53.434 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -221.703 79.719 54.944 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -222.750 77.456 54.968 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -223.551 77.815 53.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -221.528 76.559 53.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -221.382 78.102 52.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -220.606 77.755 53.874 1.00 0.00 H new ATOM 377 N ALA A 25 -225.052 81.359 58.641 1.00 0.00 N ATOM 378 CA ALA A 25 -224.732 81.383 60.054 1.00 0.00 C ATOM 379 C ALA A 25 -224.316 79.999 60.508 1.00 0.00 C ATOM 380 O ALA A 25 -224.472 79.032 59.775 1.00 0.00 O ATOM 381 CB ALA A 25 -225.941 81.886 60.836 1.00 0.00 C ATOM 0 H ALA A 25 -225.859 80.781 58.407 1.00 0.00 H new ATOM 0 HA ALA A 25 -223.898 82.061 60.238 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -225.704 81.905 61.900 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -226.197 82.892 60.503 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -226.787 81.221 60.665 1.00 0.00 H new ATOM 387 N PRO A 26 -223.766 79.880 61.711 1.00 0.00 N ATOM 388 CA PRO A 26 -223.318 78.604 62.227 1.00 0.00 C ATOM 389 C PRO A 26 -224.482 77.742 62.667 1.00 0.00 C ATOM 390 O PRO A 26 -225.463 78.250 63.184 1.00 0.00 O ATOM 391 CB PRO A 26 -222.400 78.968 63.392 1.00 0.00 C ATOM 392 CG PRO A 26 -222.486 80.454 63.571 1.00 0.00 C ATOM 393 CD PRO A 26 -223.566 80.967 62.667 1.00 0.00 C ATOM 0 HA PRO A 26 -222.802 78.009 61.474 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -222.708 78.452 64.301 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -221.374 78.663 63.184 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -222.709 80.701 64.609 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -221.532 80.923 63.330 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -224.479 81.187 63.220 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -223.266 81.888 62.168 1.00 0.00 H new ATOM 401 N ARG A 27 -224.377 76.437 62.449 1.00 0.00 N ATOM 402 CA ARG A 27 -225.468 75.511 62.757 1.00 0.00 C ATOM 403 C ARG A 27 -225.825 75.578 64.249 1.00 0.00 C ATOM 404 O ARG A 27 -226.895 75.152 64.672 1.00 0.00 O ATOM 405 CB ARG A 27 -225.074 74.088 62.362 1.00 0.00 C ATOM 406 CG ARG A 27 -224.862 73.931 60.868 1.00 0.00 C ATOM 407 CD ARG A 27 -224.526 72.501 60.493 1.00 0.00 C ATOM 408 NE ARG A 27 -224.326 72.351 59.054 1.00 0.00 N ATOM 409 CZ ARG A 27 -223.300 71.707 58.507 1.00 0.00 C ATOM 410 NH1 ARG A 27 -222.381 71.137 59.275 1.00 0.00 N ATOM 411 NH2 ARG A 27 -223.205 71.629 57.188 1.00 0.00 N ATOM 0 H ARG A 27 -223.546 75.992 62.059 1.00 0.00 H new ATOM 0 HA ARG A 27 -226.348 75.802 62.183 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -224.159 73.810 62.885 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -225.851 73.397 62.689 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -225.762 74.243 60.339 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -224.057 74.590 60.544 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -223.624 72.189 61.020 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -225.330 71.841 60.819 1.00 0.00 H new ATOM 0 HE ARG A 27 -225.017 72.767 58.430 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -222.460 71.192 60.290 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -221.596 70.644 58.850 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -223.917 72.062 56.599 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -222.420 71.136 56.761 1.00 0.00 H new ATOM 425 N VAL A 28 -224.910 76.114 65.042 1.00 0.00 N ATOM 426 CA VAL A 28 -225.150 76.331 66.461 1.00 0.00 C ATOM 427 C VAL A 28 -225.770 77.703 66.738 1.00 0.00 C ATOM 428 O VAL A 28 -226.268 77.935 67.840 1.00 0.00 O ATOM 429 CB VAL A 28 -223.856 76.195 67.293 1.00 0.00 C ATOM 430 CG1 VAL A 28 -223.307 74.783 67.193 1.00 0.00 C ATOM 431 CG2 VAL A 28 -222.814 77.214 66.851 1.00 0.00 C ATOM 0 H VAL A 28 -223.987 76.409 64.724 1.00 0.00 H new ATOM 0 HA VAL A 28 -225.854 75.555 66.762 1.00 0.00 H new ATOM 0 HB VAL A 28 -224.098 76.397 68.336 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -222.395 74.704 67.785 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -224.047 74.077 67.571 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -223.084 74.552 66.151 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -221.913 77.097 67.453 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -222.572 77.055 65.800 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -223.210 78.221 66.984 1.00 0.00 H new ATOM 441 N SER A 29 -225.741 78.615 65.756 1.00 0.00 N ATOM 442 CA SER A 29 -226.318 79.948 65.957 1.00 0.00 C ATOM 443 C SER A 29 -227.770 79.849 66.392 1.00 0.00 C ATOM 444 O SER A 29 -228.580 79.135 65.794 1.00 0.00 O ATOM 445 CB SER A 29 -226.206 80.821 64.704 1.00 0.00 C ATOM 446 OG SER A 29 -226.972 80.303 63.637 1.00 0.00 O ATOM 0 H SER A 29 -225.333 78.458 64.834 1.00 0.00 H new ATOM 0 HA SER A 29 -225.740 80.426 66.748 1.00 0.00 H new ATOM 0 HB2 SER A 29 -226.540 81.833 64.934 1.00 0.00 H new ATOM 0 HB3 SER A 29 -225.161 80.891 64.402 1.00 0.00 H new ATOM 0 HG SER A 29 -226.403 79.746 63.066 1.00 0.00 H new ATOM 452 N THR A 30 -228.077 80.533 67.470 1.00 0.00 N ATOM 453 CA THR A 30 -229.424 80.604 67.963 1.00 0.00 C ATOM 454 C THR A 30 -229.952 82.008 67.778 1.00 0.00 C ATOM 455 O THR A 30 -229.222 82.871 67.285 1.00 0.00 O ATOM 456 CB THR A 30 -229.495 80.139 69.427 1.00 0.00 C ATOM 457 OG1 THR A 30 -230.789 80.394 69.997 1.00 0.00 O ATOM 458 CG2 THR A 30 -228.416 80.797 70.273 1.00 0.00 C ATOM 0 H THR A 30 -227.398 81.053 68.026 1.00 0.00 H new ATOM 0 HA THR A 30 -230.060 79.927 67.393 1.00 0.00 H new ATOM 0 HB THR A 30 -229.324 79.062 69.426 1.00 0.00 H new ATOM 0 HG1 THR A 30 -230.817 81.308 70.350 1.00 0.00 H new ATOM 0 HG21 THR A 30 -228.496 80.446 71.302 1.00 0.00 H new ATOM 0 HG22 THR A 30 -227.434 80.538 69.876 1.00 0.00 H new ATOM 0 HG23 THR A 30 -228.544 81.879 70.248 1.00 0.00 H new ATOM 466 N ALA A 31 -231.209 82.228 68.140 1.00 0.00 N ATOM 467 CA ALA A 31 -231.879 83.478 67.832 1.00 0.00 C ATOM 468 C ALA A 31 -231.038 84.667 68.239 1.00 0.00 C ATOM 469 O ALA A 31 -230.733 85.495 67.405 1.00 0.00 O ATOM 470 CB ALA A 31 -233.244 83.536 68.501 1.00 0.00 C ATOM 0 H ALA A 31 -231.783 81.555 68.648 1.00 0.00 H new ATOM 0 HA ALA A 31 -232.020 83.521 66.752 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -233.729 84.481 68.257 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -233.859 82.710 68.145 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -233.123 83.459 69.582 1.00 0.00 H new ATOM 476 N GLN A 32 -230.591 84.704 69.485 1.00 0.00 N ATOM 477 CA GLN A 32 -229.798 85.826 69.966 1.00 0.00 C ATOM 478 C GLN A 32 -228.533 86.041 69.116 1.00 0.00 C ATOM 479 O GLN A 32 -228.134 87.181 68.869 1.00 0.00 O ATOM 480 CB GLN A 32 -229.427 85.599 71.435 1.00 0.00 C ATOM 481 CG GLN A 32 -229.566 86.838 72.303 1.00 0.00 C ATOM 482 CD GLN A 32 -228.553 87.909 71.979 1.00 0.00 C ATOM 483 OE1 GLN A 32 -227.480 87.975 72.576 1.00 0.00 O ATOM 484 NE2 GLN A 32 -228.871 88.731 71.001 1.00 0.00 N ATOM 0 H GLN A 32 -230.762 83.975 70.178 1.00 0.00 H new ATOM 0 HA GLN A 32 -230.400 86.730 69.878 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -230.059 84.810 71.842 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -228.398 85.243 71.489 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -230.569 87.247 72.182 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -229.462 86.554 73.350 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -229.772 88.641 70.532 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -228.216 89.458 70.712 1.00 0.00 H new ATOM 493 N ASP A 33 -227.928 84.965 68.620 1.00 0.00 N ATOM 494 CA ASP A 33 -226.673 85.100 67.882 1.00 0.00 C ATOM 495 C ASP A 33 -226.930 85.645 66.493 1.00 0.00 C ATOM 496 O ASP A 33 -226.328 86.632 66.068 1.00 0.00 O ATOM 497 CB ASP A 33 -225.949 83.759 67.766 1.00 0.00 C ATOM 498 CG ASP A 33 -225.074 83.465 68.964 1.00 0.00 C ATOM 499 OD1 ASP A 33 -223.943 83.995 69.024 1.00 0.00 O ATOM 500 OD2 ASP A 33 -225.513 82.708 69.852 1.00 0.00 O ATOM 0 H ASP A 33 -228.275 84.010 68.711 1.00 0.00 H new ATOM 0 HA ASP A 33 -226.042 85.794 68.438 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -226.684 82.962 67.653 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -225.337 83.758 66.864 1.00 0.00 H new ATOM 505 N VAL A 34 -227.838 84.983 65.805 1.00 0.00 N ATOM 506 CA VAL A 34 -228.266 85.369 64.474 1.00 0.00 C ATOM 507 C VAL A 34 -228.919 86.754 64.513 1.00 0.00 C ATOM 508 O VAL A 34 -228.886 87.501 63.531 1.00 0.00 O ATOM 509 CB VAL A 34 -229.206 84.296 63.909 1.00 0.00 C ATOM 510 CG1 VAL A 34 -230.607 84.435 64.453 1.00 0.00 C ATOM 511 CG2 VAL A 34 -229.161 84.304 62.401 1.00 0.00 C ATOM 0 H VAL A 34 -228.307 84.149 66.159 1.00 0.00 H new ATOM 0 HA VAL A 34 -227.405 85.440 63.809 1.00 0.00 H new ATOM 0 HB VAL A 34 -228.856 83.319 64.241 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -231.241 83.657 64.028 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -230.587 84.335 65.538 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -231.006 85.414 64.186 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -229.832 83.538 62.013 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -229.474 85.281 62.033 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -228.144 84.099 62.066 1.00 0.00 H new ATOM 521 N ILE A 35 -229.493 87.090 65.669 1.00 0.00 N ATOM 522 CA ILE A 35 -230.017 88.426 65.920 1.00 0.00 C ATOM 523 C ILE A 35 -228.918 89.468 65.702 1.00 0.00 C ATOM 524 O ILE A 35 -229.045 90.348 64.854 1.00 0.00 O ATOM 525 CB ILE A 35 -230.554 88.546 67.369 1.00 0.00 C ATOM 526 CG1 ILE A 35 -231.951 87.950 67.498 1.00 0.00 C ATOM 527 CG2 ILE A 35 -230.558 89.987 67.849 1.00 0.00 C ATOM 528 CD1 ILE A 35 -232.980 88.586 66.611 1.00 0.00 C ATOM 0 H ILE A 35 -229.606 86.445 66.451 1.00 0.00 H new ATOM 0 HA ILE A 35 -230.837 88.604 65.225 1.00 0.00 H new ATOM 0 HB ILE A 35 -229.875 87.976 68.003 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -231.901 86.885 67.271 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -232.277 88.040 68.534 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -230.941 90.030 68.869 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -229.542 90.381 67.826 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -231.194 90.586 67.197 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -233.944 88.102 66.767 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -233.063 89.646 66.852 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -232.682 88.473 65.569 1.00 0.00 H new ATOM 540 N GLN A 36 -227.816 89.321 66.432 1.00 0.00 N ATOM 541 CA GLN A 36 -226.715 90.281 66.367 1.00 0.00 C ATOM 542 C GLN A 36 -225.962 90.163 65.045 1.00 0.00 C ATOM 543 O GLN A 36 -225.437 91.151 64.541 1.00 0.00 O ATOM 544 CB GLN A 36 -225.757 90.078 67.543 1.00 0.00 C ATOM 545 CG GLN A 36 -224.624 91.095 67.591 1.00 0.00 C ATOM 546 CD GLN A 36 -223.744 90.942 68.816 1.00 0.00 C ATOM 547 OE1 GLN A 36 -223.608 89.719 69.309 1.00 0.00 O flip ATOM 548 NE2 GLN A 36 -223.184 91.919 69.317 1.00 0.00 N flip ATOM 0 H GLN A 36 -227.660 88.546 67.076 1.00 0.00 H new ATOM 0 HA GLN A 36 -227.139 91.283 66.429 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -226.322 90.132 68.474 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -225.332 89.076 67.485 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -224.012 90.992 66.695 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -225.044 92.101 67.575 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -223.313 92.845 68.909 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -222.592 91.801 70.139 1.00 0.00 H new ATOM 557 N GLN A 37 -225.887 88.955 64.494 1.00 0.00 N ATOM 558 CA GLN A 37 -225.275 88.757 63.195 1.00 0.00 C ATOM 559 C GLN A 37 -225.970 89.627 62.150 1.00 0.00 C ATOM 560 O GLN A 37 -225.327 90.192 61.265 1.00 0.00 O ATOM 561 CB GLN A 37 -225.351 87.287 62.794 1.00 0.00 C ATOM 562 CG GLN A 37 -224.336 86.927 61.736 1.00 0.00 C ATOM 563 CD GLN A 37 -224.336 85.453 61.377 1.00 0.00 C ATOM 564 OE1 GLN A 37 -224.635 84.595 62.207 1.00 0.00 O ATOM 565 NE2 GLN A 37 -223.998 85.153 60.133 1.00 0.00 N ATOM 0 H GLN A 37 -226.243 88.104 64.930 1.00 0.00 H new ATOM 0 HA GLN A 37 -224.226 89.048 63.253 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -225.191 86.664 63.674 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -226.352 87.065 62.424 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -224.535 87.512 60.838 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -223.343 87.208 62.086 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -223.757 85.896 59.477 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -223.978 84.179 59.831 1.00 0.00 H new ATOM 574 N THR A 38 -227.285 89.749 62.278 1.00 0.00 N ATOM 575 CA THR A 38 -228.057 90.620 61.406 1.00 0.00 C ATOM 576 C THR A 38 -227.753 92.086 61.729 1.00 0.00 C ATOM 577 O THR A 38 -227.637 92.916 60.832 1.00 0.00 O ATOM 578 CB THR A 38 -229.568 90.345 61.546 1.00 0.00 C ATOM 579 OG1 THR A 38 -229.819 88.940 61.420 1.00 0.00 O ATOM 580 CG2 THR A 38 -230.359 91.092 60.485 1.00 0.00 C ATOM 0 H THR A 38 -227.838 89.255 62.978 1.00 0.00 H new ATOM 0 HA THR A 38 -227.770 90.414 60.375 1.00 0.00 H new ATOM 0 HB THR A 38 -229.886 90.693 62.529 1.00 0.00 H new ATOM 0 HG1 THR A 38 -229.434 88.469 62.188 1.00 0.00 H new ATOM 0 HG21 THR A 38 -231.421 90.880 60.607 1.00 0.00 H new ATOM 0 HG22 THR A 38 -230.188 92.163 60.591 1.00 0.00 H new ATOM 0 HG23 THR A 38 -230.036 90.769 59.495 1.00 0.00 H new ATOM 588 N LEU A 39 -227.595 92.383 63.018 1.00 0.00 N ATOM 589 CA LEU A 39 -227.175 93.714 63.468 1.00 0.00 C ATOM 590 C LEU A 39 -225.871 94.132 62.788 1.00 0.00 C ATOM 591 O LEU A 39 -225.718 95.272 62.345 1.00 0.00 O ATOM 592 CB LEU A 39 -226.968 93.727 64.992 1.00 0.00 C ATOM 593 CG LEU A 39 -228.170 94.135 65.845 1.00 0.00 C ATOM 594 CD1 LEU A 39 -229.343 93.191 65.656 1.00 0.00 C ATOM 595 CD2 LEU A 39 -227.770 94.202 67.309 1.00 0.00 C ATOM 0 H LEU A 39 -227.752 91.717 63.775 1.00 0.00 H new ATOM 0 HA LEU A 39 -227.963 94.417 63.199 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -226.654 92.730 65.301 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -226.145 94.405 65.218 1.00 0.00 H new ATOM 0 HG LEU A 39 -228.493 95.123 65.516 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -230.176 93.516 66.279 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -229.649 93.196 64.610 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -229.048 92.182 65.943 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -228.632 94.493 67.909 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -227.415 93.224 67.634 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -226.975 94.937 67.436 1.00 0.00 H new ATOM 607 N CYS A 40 -224.939 93.194 62.718 1.00 0.00 N ATOM 608 CA CYS A 40 -223.634 93.434 62.122 1.00 0.00 C ATOM 609 C CYS A 40 -223.749 93.575 60.606 1.00 0.00 C ATOM 610 O CYS A 40 -223.071 94.398 59.994 1.00 0.00 O ATOM 611 CB CYS A 40 -222.685 92.284 62.478 1.00 0.00 C ATOM 612 SG CYS A 40 -221.005 92.482 61.840 1.00 0.00 S ATOM 0 H CYS A 40 -225.066 92.246 63.072 1.00 0.00 H new ATOM 0 HA CYS A 40 -223.234 94.367 62.520 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -222.640 92.188 63.563 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -223.100 91.353 62.092 1.00 0.00 H new ATOM 0 HG CYS A 40 -220.283 91.461 62.196 1.00 0.00 H new ATOM 618 N LYS A 41 -224.627 92.780 60.013 1.00 0.00 N ATOM 619 CA LYS A 41 -224.807 92.768 58.565 1.00 0.00 C ATOM 620 C LYS A 41 -225.544 94.023 58.097 1.00 0.00 C ATOM 621 O LYS A 41 -225.392 94.457 56.957 1.00 0.00 O ATOM 622 CB LYS A 41 -225.594 91.514 58.160 1.00 0.00 C ATOM 623 CG LYS A 41 -225.653 91.249 56.659 1.00 0.00 C ATOM 624 CD LYS A 41 -224.298 90.829 56.110 1.00 0.00 C ATOM 625 CE LYS A 41 -224.413 90.230 54.714 1.00 0.00 C ATOM 626 NZ LYS A 41 -224.817 91.234 53.697 1.00 0.00 N ATOM 0 H LYS A 41 -225.231 92.129 60.515 1.00 0.00 H new ATOM 0 HA LYS A 41 -223.826 92.754 58.090 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -225.147 90.649 58.650 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -226.612 91.604 58.539 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -226.386 90.469 56.455 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -225.992 92.147 56.144 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -223.634 91.693 56.081 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -223.844 90.100 56.782 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -223.456 89.794 54.429 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -225.141 89.419 54.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -224.881 90.777 52.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -225.743 91.633 53.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -224.110 91.996 53.661 1.00 0.00 H new ATOM 640 N ALA A 42 -226.329 94.610 58.989 1.00 0.00 N ATOM 641 CA ALA A 42 -227.205 95.713 58.626 1.00 0.00 C ATOM 642 C ALA A 42 -226.734 97.053 59.186 1.00 0.00 C ATOM 643 O ALA A 42 -227.505 98.015 59.222 1.00 0.00 O ATOM 644 CB ALA A 42 -228.618 95.418 59.096 1.00 0.00 C ATOM 0 H ALA A 42 -226.377 94.340 59.971 1.00 0.00 H new ATOM 0 HA ALA A 42 -227.181 95.801 57.540 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -229.273 96.246 58.823 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -228.975 94.502 58.624 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -228.623 95.294 60.179 1.00 0.00 H new ATOM 852 N ASP A 56 -232.722 93.584 72.598 1.00 0.00 N ATOM 853 CA ASP A 56 -234.097 94.053 72.412 1.00 0.00 C ATOM 854 C ASP A 56 -234.747 93.346 71.235 1.00 0.00 C ATOM 855 O ASP A 56 -235.885 93.642 70.870 1.00 0.00 O ATOM 856 CB ASP A 56 -234.158 95.570 72.173 1.00 0.00 C ATOM 857 CG ASP A 56 -233.855 96.390 73.416 1.00 0.00 C ATOM 858 OD1 ASP A 56 -232.669 96.533 73.774 1.00 0.00 O ATOM 859 OD2 ASP A 56 -234.809 96.913 74.032 1.00 0.00 O ATOM 0 HA ASP A 56 -234.636 93.823 73.331 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -233.448 95.836 71.390 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -235.150 95.833 71.806 1.00 0.00 H new ATOM 864 N TYR A 57 -234.035 92.395 70.654 1.00 0.00 N ATOM 865 CA TYR A 57 -234.527 91.694 69.480 1.00 0.00 C ATOM 866 C TYR A 57 -234.872 90.248 69.817 1.00 0.00 C ATOM 867 O TYR A 57 -234.349 89.680 70.775 1.00 0.00 O ATOM 868 CB TYR A 57 -233.480 91.694 68.359 1.00 0.00 C ATOM 869 CG TYR A 57 -233.201 93.037 67.729 1.00 0.00 C ATOM 870 CD1 TYR A 57 -232.399 93.980 68.360 1.00 0.00 C ATOM 871 CD2 TYR A 57 -233.718 93.346 66.480 1.00 0.00 C ATOM 872 CE1 TYR A 57 -232.130 95.198 67.765 1.00 0.00 C ATOM 873 CE2 TYR A 57 -233.458 94.560 65.880 1.00 0.00 C ATOM 874 CZ TYR A 57 -232.662 95.482 66.525 1.00 0.00 C ATOM 875 OH TYR A 57 -232.394 96.694 65.928 1.00 0.00 O ATOM 0 H TYR A 57 -233.116 92.091 70.975 1.00 0.00 H new ATOM 0 HA TYR A 57 -235.422 92.219 69.144 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -232.546 91.299 68.758 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -233.809 91.008 67.579 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -231.980 93.758 69.330 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -234.335 92.623 65.968 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -231.507 95.923 68.268 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -233.876 94.787 64.910 1.00 0.00 H new ATOM 0 HH TYR A 57 -232.842 96.736 65.058 1.00 0.00 H new ATOM 885 N VAL A 58 -235.755 89.675 69.020 1.00 0.00 N ATOM 886 CA VAL A 58 -236.051 88.251 69.059 1.00 0.00 C ATOM 887 C VAL A 58 -236.293 87.763 67.646 1.00 0.00 C ATOM 888 O VAL A 58 -236.807 88.501 66.805 1.00 0.00 O ATOM 889 CB VAL A 58 -237.282 87.892 69.920 1.00 0.00 C ATOM 890 CG1 VAL A 58 -236.879 87.630 71.359 1.00 0.00 C ATOM 891 CG2 VAL A 58 -238.323 89.000 69.879 1.00 0.00 C ATOM 0 H VAL A 58 -236.293 90.187 68.321 1.00 0.00 H new ATOM 0 HA VAL A 58 -235.190 87.766 69.519 1.00 0.00 H new ATOM 0 HB VAL A 58 -237.717 86.985 69.501 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -237.763 87.379 71.945 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -236.173 86.800 71.394 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -236.410 88.522 71.774 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -239.178 88.719 70.494 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -237.888 89.923 70.263 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -238.651 89.153 68.851 1.00 0.00 H new ATOM 901 N LEU A 59 -235.917 86.533 67.376 1.00 0.00 N ATOM 902 CA LEU A 59 -236.035 86.001 66.036 1.00 0.00 C ATOM 903 C LEU A 59 -237.281 85.133 65.906 1.00 0.00 C ATOM 904 O LEU A 59 -237.718 84.500 66.869 1.00 0.00 O ATOM 905 CB LEU A 59 -234.786 85.201 65.683 1.00 0.00 C ATOM 906 CG LEU A 59 -234.726 84.695 64.243 1.00 0.00 C ATOM 907 CD1 LEU A 59 -234.333 85.818 63.299 1.00 0.00 C ATOM 908 CD2 LEU A 59 -233.759 83.531 64.130 1.00 0.00 C ATOM 0 H LEU A 59 -235.529 85.885 68.062 1.00 0.00 H new ATOM 0 HA LEU A 59 -236.130 86.833 65.338 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -233.910 85.823 65.870 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -234.719 84.346 66.355 1.00 0.00 H new ATOM 0 HG LEU A 59 -235.718 84.344 63.957 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -234.295 85.439 62.278 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -235.069 86.620 63.361 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -233.352 86.203 63.579 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -233.728 83.182 63.098 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -232.763 83.854 64.434 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -234.090 82.719 64.777 1.00 0.00 H new ATOM 920 N LEU A 60 -237.860 85.138 64.720 1.00 0.00 N ATOM 921 CA LEU A 60 -239.038 84.341 64.425 1.00 0.00 C ATOM 922 C LEU A 60 -238.648 83.158 63.552 1.00 0.00 C ATOM 923 O LEU A 60 -237.921 83.323 62.583 1.00 0.00 O ATOM 924 CB LEU A 60 -240.090 85.175 63.671 1.00 0.00 C ATOM 925 CG LEU A 60 -240.879 86.227 64.478 1.00 0.00 C ATOM 926 CD1 LEU A 60 -241.966 85.565 65.289 1.00 0.00 C ATOM 927 CD2 LEU A 60 -239.978 87.057 65.379 1.00 0.00 C ATOM 0 H LEU A 60 -237.527 85.695 63.933 1.00 0.00 H new ATOM 0 HA LEU A 60 -239.460 83.998 65.370 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -239.587 85.688 62.851 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -240.807 84.487 63.224 1.00 0.00 H new ATOM 0 HG LEU A 60 -241.334 86.908 63.759 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -242.512 86.322 65.852 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -242.652 85.044 64.621 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -241.520 84.850 65.981 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -240.580 87.783 65.926 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -239.468 86.403 66.086 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -239.240 87.581 64.772 1.00 0.00 H new ATOM 939 N GLU A 61 -239.116 81.975 63.893 1.00 0.00 N ATOM 940 CA GLU A 61 -238.965 80.839 63.010 1.00 0.00 C ATOM 941 C GLU A 61 -240.235 80.710 62.163 1.00 0.00 C ATOM 942 O GLU A 61 -241.198 80.028 62.509 1.00 0.00 O ATOM 943 CB GLU A 61 -238.645 79.546 63.795 1.00 0.00 C ATOM 944 CG GLU A 61 -239.823 78.941 64.548 1.00 0.00 C ATOM 945 CD GLU A 61 -239.483 77.666 65.286 1.00 0.00 C ATOM 946 OE1 GLU A 61 -239.356 76.617 64.628 1.00 0.00 O ATOM 947 OE2 GLU A 61 -239.371 77.708 66.526 1.00 0.00 O ATOM 0 H GLU A 61 -239.600 81.777 64.768 1.00 0.00 H new ATOM 0 HA GLU A 61 -238.114 80.997 62.348 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -238.258 78.802 63.098 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -237.849 79.760 64.508 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -240.201 79.673 65.261 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -240.628 78.738 63.842 1.00 0.00 H new ATOM 954 N GLU A 62 -240.271 81.440 61.074 1.00 0.00 N ATOM 955 CA GLU A 62 -241.385 81.356 60.182 1.00 0.00 C ATOM 956 C GLU A 62 -241.160 80.218 59.207 1.00 0.00 C ATOM 957 O GLU A 62 -240.158 80.176 58.512 1.00 0.00 O ATOM 958 CB GLU A 62 -241.496 82.669 59.429 1.00 0.00 C ATOM 959 CG GLU A 62 -242.874 82.967 58.916 1.00 0.00 C ATOM 960 CD GLU A 62 -242.892 84.148 57.967 1.00 0.00 C ATOM 961 OE1 GLU A 62 -242.662 83.938 56.754 1.00 0.00 O ATOM 962 OE2 GLU A 62 -243.117 85.285 58.433 1.00 0.00 O ATOM 0 H GLU A 62 -239.541 82.094 60.791 1.00 0.00 H new ATOM 0 HA GLU A 62 -242.305 81.170 60.737 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -241.181 83.480 60.086 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -240.803 82.653 58.588 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -243.267 82.088 58.406 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -243.536 83.170 59.757 1.00 0.00 H new ATOM 969 N VAL A 63 -242.084 79.285 59.174 1.00 0.00 N ATOM 970 CA VAL A 63 -242.012 78.188 58.229 1.00 0.00 C ATOM 971 C VAL A 63 -243.152 78.286 57.222 1.00 0.00 C ATOM 972 O VAL A 63 -244.327 78.137 57.569 1.00 0.00 O ATOM 973 CB VAL A 63 -242.018 76.813 58.941 1.00 0.00 C ATOM 974 CG1 VAL A 63 -242.973 76.826 60.119 1.00 0.00 C ATOM 975 CG2 VAL A 63 -242.364 75.702 57.966 1.00 0.00 C ATOM 0 H VAL A 63 -242.896 79.262 59.790 1.00 0.00 H new ATOM 0 HA VAL A 63 -241.065 78.267 57.696 1.00 0.00 H new ATOM 0 HB VAL A 63 -241.016 76.620 59.323 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -242.963 75.851 60.606 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -242.662 77.591 60.831 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -243.981 77.046 59.768 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -242.362 74.746 58.489 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -243.353 75.883 57.544 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -241.626 75.679 57.164 1.00 0.00 H new ATOM 985 N VAL A 64 -242.794 78.566 55.977 1.00 0.00 N ATOM 986 CA VAL A 64 -243.773 78.694 54.914 1.00 0.00 C ATOM 987 C VAL A 64 -244.362 77.332 54.576 1.00 0.00 C ATOM 988 O VAL A 64 -243.742 76.519 53.891 1.00 0.00 O ATOM 989 CB VAL A 64 -243.167 79.334 53.645 1.00 0.00 C ATOM 990 CG1 VAL A 64 -244.206 79.439 52.536 1.00 0.00 C ATOM 991 CG2 VAL A 64 -242.591 80.705 53.966 1.00 0.00 C ATOM 0 H VAL A 64 -241.829 78.709 55.680 1.00 0.00 H new ATOM 0 HA VAL A 64 -244.562 79.354 55.274 1.00 0.00 H new ATOM 0 HB VAL A 64 -242.361 78.690 53.293 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -243.753 79.893 51.655 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -244.571 78.443 52.284 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -245.038 80.056 52.874 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -242.168 81.143 53.062 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -243.382 81.352 54.347 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -241.810 80.604 54.720 1.00 0.00 H new ATOM 1199 N SER A 77 -247.596 81.119 55.677 1.00 0.00 N ATOM 1200 CA SER A 77 -246.368 81.234 56.439 1.00 0.00 C ATOM 1201 C SER A 77 -246.668 81.063 57.919 1.00 0.00 C ATOM 1202 O SER A 77 -247.216 81.959 58.564 1.00 0.00 O ATOM 1203 CB SER A 77 -245.701 82.586 56.182 1.00 0.00 C ATOM 1204 OG SER A 77 -245.372 82.744 54.812 1.00 0.00 O ATOM 0 HA SER A 77 -245.680 80.451 56.122 1.00 0.00 H new ATOM 0 HB2 SER A 77 -246.369 83.389 56.493 1.00 0.00 H new ATOM 0 HB3 SER A 77 -244.798 82.670 56.787 1.00 0.00 H new ATOM 0 HG SER A 77 -246.001 82.230 54.263 1.00 0.00 H new ATOM 1210 N SER A 78 -246.343 79.897 58.450 1.00 0.00 N ATOM 1211 CA SER A 78 -246.556 79.630 59.854 1.00 0.00 C ATOM 1212 C SER A 78 -245.425 80.255 60.647 1.00 0.00 C ATOM 1213 O SER A 78 -244.333 79.700 60.736 1.00 0.00 O ATOM 1214 CB SER A 78 -246.634 78.123 60.110 1.00 0.00 C ATOM 1215 OG SER A 78 -247.034 77.845 61.442 1.00 0.00 O ATOM 0 H SER A 78 -245.931 79.124 57.928 1.00 0.00 H new ATOM 0 HA SER A 78 -247.504 80.066 60.170 1.00 0.00 H new ATOM 0 HB2 SER A 78 -247.340 77.670 59.414 1.00 0.00 H new ATOM 0 HB3 SER A 78 -245.662 77.669 59.918 1.00 0.00 H new ATOM 0 HG SER A 78 -247.076 76.875 61.575 1.00 0.00 H new ATOM 1221 N GLN A 79 -245.686 81.419 61.208 1.00 0.00 N ATOM 1222 CA GLN A 79 -244.653 82.173 61.884 1.00 0.00 C ATOM 1223 C GLN A 79 -244.681 81.849 63.376 1.00 0.00 C ATOM 1224 O GLN A 79 -245.740 81.860 64.003 1.00 0.00 O ATOM 1225 CB GLN A 79 -244.883 83.668 61.654 1.00 0.00 C ATOM 1226 CG GLN A 79 -243.674 84.533 61.961 1.00 0.00 C ATOM 1227 CD GLN A 79 -243.953 86.012 61.757 1.00 0.00 C ATOM 1228 OE1 GLN A 79 -243.415 86.865 62.464 1.00 0.00 O ATOM 1229 NE2 GLN A 79 -244.772 86.332 60.764 1.00 0.00 N ATOM 0 H GLN A 79 -246.605 81.862 61.208 1.00 0.00 H new ATOM 0 HA GLN A 79 -243.675 81.903 61.486 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -245.175 83.825 60.616 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -245.718 83.996 62.273 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -243.362 84.364 62.992 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -242.843 84.231 61.323 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -245.200 85.598 60.199 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -244.974 87.312 60.565 1.00 0.00 H new ATOM 1238 N ARG A 80 -243.520 81.549 63.927 1.00 0.00 N ATOM 1239 CA ARG A 80 -243.390 81.210 65.334 1.00 0.00 C ATOM 1240 C ARG A 80 -242.300 82.082 65.938 1.00 0.00 C ATOM 1241 O ARG A 80 -241.411 82.509 65.220 1.00 0.00 O ATOM 1242 CB ARG A 80 -243.014 79.734 65.462 1.00 0.00 C ATOM 1243 CG ARG A 80 -243.122 79.197 66.878 1.00 0.00 C ATOM 1244 CD ARG A 80 -242.508 77.810 67.004 1.00 0.00 C ATOM 1245 NE ARG A 80 -242.704 77.241 68.338 1.00 0.00 N ATOM 1246 CZ ARG A 80 -241.715 76.940 69.186 1.00 0.00 C ATOM 1247 NH1 ARG A 80 -240.444 77.124 68.844 1.00 0.00 N ATOM 1248 NH2 ARG A 80 -242.010 76.424 70.373 1.00 0.00 N ATOM 0 H ARG A 80 -242.639 81.533 63.413 1.00 0.00 H new ATOM 0 HA ARG A 80 -244.330 81.381 65.859 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -243.660 79.146 64.810 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -241.992 79.596 65.108 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -242.622 79.880 67.565 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -244.171 79.159 67.173 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -242.951 77.149 66.259 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -241.441 77.865 66.787 1.00 0.00 H new ATOM 0 HE ARG A 80 -243.661 77.062 68.642 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -240.213 77.499 67.924 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -239.700 76.890 69.501 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -242.983 76.261 70.630 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -241.263 76.191 71.028 1.00 0.00 H new ATOM 1262 N VAL A 81 -242.350 82.369 67.229 1.00 0.00 N ATOM 1263 CA VAL A 81 -241.320 83.206 67.825 1.00 0.00 C ATOM 1264 C VAL A 81 -240.398 82.378 68.709 1.00 0.00 C ATOM 1265 O VAL A 81 -240.836 81.439 69.372 1.00 0.00 O ATOM 1266 CB VAL A 81 -241.890 84.376 68.649 1.00 0.00 C ATOM 1267 CG1 VAL A 81 -241.000 85.607 68.485 1.00 0.00 C ATOM 1268 CG2 VAL A 81 -243.330 84.686 68.262 1.00 0.00 C ATOM 0 H VAL A 81 -243.073 82.045 67.871 1.00 0.00 H new ATOM 0 HA VAL A 81 -240.762 83.631 66.991 1.00 0.00 H new ATOM 0 HB VAL A 81 -241.898 84.084 69.699 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -241.408 86.431 69.070 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -239.993 85.377 68.834 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -240.963 85.892 67.433 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -243.698 85.517 68.864 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -243.373 84.956 67.207 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -243.951 83.808 68.438 1.00 0.00 H new ATOM 1278 N LEU A 82 -239.126 82.738 68.707 1.00 0.00 N ATOM 1279 CA LEU A 82 -238.103 82.000 69.435 1.00 0.00 C ATOM 1280 C LEU A 82 -237.767 82.676 70.748 1.00 0.00 C ATOM 1281 O LEU A 82 -238.010 83.870 70.933 1.00 0.00 O ATOM 1282 CB LEU A 82 -236.839 81.931 68.593 1.00 0.00 C ATOM 1283 CG LEU A 82 -237.042 81.445 67.164 1.00 0.00 C ATOM 1284 CD1 LEU A 82 -235.833 81.788 66.331 1.00 0.00 C ATOM 1285 CD2 LEU A 82 -237.302 79.953 67.141 1.00 0.00 C ATOM 0 H LEU A 82 -238.771 83.550 68.201 1.00 0.00 H new ATOM 0 HA LEU A 82 -238.489 81.002 69.640 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -236.386 82.922 68.563 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -236.127 81.270 69.088 1.00 0.00 H new ATOM 0 HG LEU A 82 -237.913 81.945 66.741 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -235.984 81.438 65.310 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -235.689 82.868 66.327 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -234.951 81.306 66.753 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -237.445 79.624 66.112 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -236.451 79.429 67.575 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -238.198 79.731 67.720 1.00 0.00 H new ATOM 1297 N LEU A 83 -237.206 81.901 71.657 1.00 0.00 N ATOM 1298 CA LEU A 83 -236.625 82.448 72.864 1.00 0.00 C ATOM 1299 C LEU A 83 -235.146 82.706 72.616 1.00 0.00 C ATOM 1300 O LEU A 83 -234.648 82.456 71.514 1.00 0.00 O ATOM 1301 CB LEU A 83 -236.814 81.498 74.053 1.00 0.00 C ATOM 1302 CG LEU A 83 -238.253 81.337 74.564 1.00 0.00 C ATOM 1303 CD1 LEU A 83 -239.093 80.499 73.609 1.00 0.00 C ATOM 1304 CD2 LEU A 83 -238.257 80.727 75.958 1.00 0.00 C ATOM 0 H LEU A 83 -237.141 80.886 71.580 1.00 0.00 H new ATOM 0 HA LEU A 83 -237.129 83.381 73.114 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -236.438 80.515 73.770 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -236.194 81.852 74.877 1.00 0.00 H new ATOM 0 HG LEU A 83 -238.702 82.329 74.615 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -240.106 80.405 74.002 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -239.126 80.983 72.633 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -238.650 79.508 73.508 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -239.285 80.620 76.305 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -237.780 79.747 75.928 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -237.709 81.376 76.641 1.00 0.00 H new ATOM 1316 N ASP A 84 -234.453 83.196 73.633 1.00 0.00 N ATOM 1317 CA ASP A 84 -233.032 83.526 73.526 1.00 0.00 C ATOM 1318 C ASP A 84 -232.237 82.370 72.923 1.00 0.00 C ATOM 1319 O ASP A 84 -231.507 82.547 71.941 1.00 0.00 O ATOM 1320 CB ASP A 84 -232.483 83.869 74.907 1.00 0.00 C ATOM 1321 CG ASP A 84 -231.076 84.429 74.876 1.00 0.00 C ATOM 1322 OD1 ASP A 84 -230.931 85.659 74.759 1.00 0.00 O ATOM 1323 OD2 ASP A 84 -230.113 83.640 74.998 1.00 0.00 O ATOM 0 H ASP A 84 -234.854 83.377 74.553 1.00 0.00 H new ATOM 0 HA ASP A 84 -232.929 84.386 72.864 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -233.144 84.594 75.382 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -232.495 82.973 75.527 1.00 0.00 H new ATOM 1328 N GLN A 85 -232.391 81.181 73.493 1.00 0.00 N ATOM 1329 CA GLN A 85 -231.676 80.020 73.015 1.00 0.00 C ATOM 1330 C GLN A 85 -232.621 78.914 72.541 1.00 0.00 C ATOM 1331 O GLN A 85 -232.500 77.765 72.964 1.00 0.00 O ATOM 1332 CB GLN A 85 -230.744 79.489 74.103 1.00 0.00 C ATOM 1333 CG GLN A 85 -231.385 79.347 75.476 1.00 0.00 C ATOM 1334 CD GLN A 85 -230.502 78.588 76.448 1.00 0.00 C ATOM 1335 OE1 GLN A 85 -229.742 77.705 76.052 1.00 0.00 O ATOM 1336 NE2 GLN A 85 -230.589 78.927 77.722 1.00 0.00 N ATOM 0 H GLN A 85 -233.006 81.003 74.287 1.00 0.00 H new ATOM 0 HA GLN A 85 -231.086 80.333 72.154 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -230.363 78.516 73.793 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -229.886 80.156 74.185 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -231.598 80.337 75.879 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -232.340 78.831 75.377 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -231.232 79.665 78.011 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -230.014 78.451 78.417 1.00 0.00 H new ATOM 1345 N GLU A 86 -233.567 79.252 71.666 1.00 0.00 N ATOM 1346 CA GLU A 86 -234.380 78.230 71.012 1.00 0.00 C ATOM 1347 C GLU A 86 -233.541 77.494 69.965 1.00 0.00 C ATOM 1348 O GLU A 86 -233.850 76.360 69.581 1.00 0.00 O ATOM 1349 CB GLU A 86 -235.599 78.874 70.356 1.00 0.00 C ATOM 1350 CG GLU A 86 -236.585 77.881 69.758 1.00 0.00 C ATOM 1351 CD GLU A 86 -237.263 77.019 70.800 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -238.294 77.451 71.352 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -236.780 75.898 71.065 1.00 0.00 O ATOM 0 H GLU A 86 -233.787 80.211 71.397 1.00 0.00 H new ATOM 0 HA GLU A 86 -234.723 77.513 71.758 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -236.118 79.482 71.097 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -235.260 79.550 69.571 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -237.344 78.425 69.195 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -236.061 77.240 69.049 1.00 0.00 H new ATOM 1360 N CYS A 87 -232.461 78.160 69.535 1.00 0.00 N ATOM 1361 CA CYS A 87 -231.551 77.654 68.516 1.00 0.00 C ATOM 1362 C CYS A 87 -232.179 77.727 67.128 1.00 0.00 C ATOM 1363 O CYS A 87 -233.260 77.204 66.894 1.00 0.00 O ATOM 1364 CB CYS A 87 -231.099 76.240 68.853 1.00 0.00 C ATOM 1365 SG CYS A 87 -229.867 76.158 70.172 1.00 0.00 S ATOM 0 H CYS A 87 -232.197 79.077 69.894 1.00 0.00 H new ATOM 0 HA CYS A 87 -230.667 78.292 68.503 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -231.969 75.651 69.145 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -230.687 75.777 67.956 1.00 0.00 H new ATOM 0 HG CYS A 87 -229.546 74.917 70.390 1.00 0.00 H new ATOM 1371 N VAL A 88 -231.484 78.385 66.210 1.00 0.00 N ATOM 1372 CA VAL A 88 -232.020 78.652 64.885 1.00 0.00 C ATOM 1373 C VAL A 88 -232.001 77.394 64.041 1.00 0.00 C ATOM 1374 O VAL A 88 -232.966 77.081 63.349 1.00 0.00 O ATOM 1375 CB VAL A 88 -231.221 79.764 64.174 1.00 0.00 C ATOM 1376 CG1 VAL A 88 -231.701 79.967 62.751 1.00 0.00 C ATOM 1377 CG2 VAL A 88 -231.333 81.058 64.943 1.00 0.00 C ATOM 0 H VAL A 88 -230.542 78.745 66.362 1.00 0.00 H new ATOM 0 HA VAL A 88 -233.050 78.988 65.007 1.00 0.00 H new ATOM 0 HB VAL A 88 -230.177 79.453 64.138 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -231.117 80.757 62.279 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -231.578 79.041 62.190 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -232.754 80.249 62.759 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -230.765 81.835 64.432 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -232.380 81.355 65.005 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -230.935 80.920 65.948 1.00 0.00 H new ATOM 1387 N PHE A 89 -230.910 76.658 64.117 1.00 0.00 N ATOM 1388 CA PHE A 89 -230.798 75.434 63.335 1.00 0.00 C ATOM 1389 C PHE A 89 -231.696 74.365 63.944 1.00 0.00 C ATOM 1390 O PHE A 89 -232.282 73.546 63.234 1.00 0.00 O ATOM 1391 CB PHE A 89 -229.338 74.976 63.230 1.00 0.00 C ATOM 1392 CG PHE A 89 -229.155 73.677 62.495 1.00 0.00 C ATOM 1393 CD1 PHE A 89 -229.198 73.639 61.111 1.00 0.00 C ATOM 1394 CD2 PHE A 89 -228.928 72.498 63.187 1.00 0.00 C ATOM 1395 CE1 PHE A 89 -229.027 72.449 60.429 1.00 0.00 C ATOM 1396 CE2 PHE A 89 -228.756 71.304 62.512 1.00 0.00 C ATOM 1397 CZ PHE A 89 -228.802 71.279 61.131 1.00 0.00 C ATOM 0 H PHE A 89 -230.101 76.876 64.699 1.00 0.00 H new ATOM 0 HA PHE A 89 -231.133 75.622 62.315 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -228.760 75.751 62.726 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -228.927 74.874 64.234 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -229.367 74.551 60.558 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -228.885 72.512 64.266 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -229.069 72.433 59.350 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -228.586 70.391 63.064 1.00 0.00 H new ATOM 0 HZ PHE A 89 -228.663 70.348 60.601 1.00 0.00 H new ATOM 1407 N GLN A 90 -231.825 74.407 65.266 1.00 0.00 N ATOM 1408 CA GLN A 90 -232.764 73.553 65.977 1.00 0.00 C ATOM 1409 C GLN A 90 -234.201 73.888 65.580 1.00 0.00 C ATOM 1410 O GLN A 90 -235.025 72.997 65.384 1.00 0.00 O ATOM 1411 CB GLN A 90 -232.585 73.713 67.486 1.00 0.00 C ATOM 1412 CG GLN A 90 -231.412 72.935 68.058 1.00 0.00 C ATOM 1413 CD GLN A 90 -231.517 72.734 69.560 1.00 0.00 C ATOM 1414 OE1 GLN A 90 -232.158 73.667 70.248 1.00 0.00 O flip ATOM 1415 NE2 GLN A 90 -231.030 71.740 70.100 1.00 0.00 N flip ATOM 0 H GLN A 90 -231.286 75.029 65.869 1.00 0.00 H new ATOM 0 HA GLN A 90 -232.562 72.517 65.705 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -232.452 74.770 67.715 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -233.499 73.391 67.986 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -231.353 71.963 67.569 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -230.486 73.463 67.830 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -230.543 71.042 69.538 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -231.114 71.615 71.109 1.00 0.00 H new ATOM 1424 N ALA A 91 -234.492 75.176 65.454 1.00 0.00 N ATOM 1425 CA ALA A 91 -235.806 75.627 65.014 1.00 0.00 C ATOM 1426 C ALA A 91 -236.063 75.191 63.578 1.00 0.00 C ATOM 1427 O ALA A 91 -237.141 74.714 63.243 1.00 0.00 O ATOM 1428 CB ALA A 91 -235.918 77.140 65.140 1.00 0.00 C ATOM 0 H ALA A 91 -233.833 75.929 65.651 1.00 0.00 H new ATOM 0 HA ALA A 91 -236.561 75.171 65.654 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -236.905 77.461 64.807 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -235.774 77.430 66.181 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -235.155 77.614 64.522 1.00 0.00 H new ATOM 1434 N GLN A 92 -235.047 75.326 62.736 1.00 0.00 N ATOM 1435 CA GLN A 92 -235.165 74.974 61.336 1.00 0.00 C ATOM 1436 C GLN A 92 -235.439 73.481 61.151 1.00 0.00 C ATOM 1437 O GLN A 92 -236.059 73.074 60.167 1.00 0.00 O ATOM 1438 CB GLN A 92 -233.894 75.364 60.596 1.00 0.00 C ATOM 1439 CG GLN A 92 -234.148 75.621 59.133 1.00 0.00 C ATOM 1440 CD GLN A 92 -232.916 76.054 58.368 1.00 0.00 C ATOM 1441 OE1 GLN A 92 -232.025 76.756 59.037 1.00 0.00 O flip ATOM 1442 NE2 GLN A 92 -232.774 75.766 57.180 1.00 0.00 N flip ATOM 0 H GLN A 92 -234.129 75.679 63.005 1.00 0.00 H new ATOM 0 HA GLN A 92 -236.012 75.522 60.923 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -233.469 76.258 61.052 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -233.155 74.570 60.701 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -234.547 74.715 58.678 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -234.914 76.390 59.036 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -233.489 75.220 56.699 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -231.942 76.073 56.677 1.00 0.00 H new ATOM 1451 N SER A 93 -234.970 72.666 62.088 1.00 0.00 N ATOM 1452 CA SER A 93 -235.214 71.226 62.028 1.00 0.00 C ATOM 1453 C SER A 93 -236.629 70.891 62.504 1.00 0.00 C ATOM 1454 O SER A 93 -237.072 69.746 62.412 1.00 0.00 O ATOM 1455 CB SER A 93 -234.167 70.456 62.846 1.00 0.00 C ATOM 1456 OG SER A 93 -234.162 70.850 64.209 1.00 0.00 O ATOM 0 H SER A 93 -234.423 72.972 62.893 1.00 0.00 H new ATOM 0 HA SER A 93 -235.124 70.915 60.987 1.00 0.00 H new ATOM 0 HB2 SER A 93 -234.369 69.387 62.778 1.00 0.00 H new ATOM 0 HB3 SER A 93 -233.179 70.622 62.417 1.00 0.00 H new ATOM 0 HG SER A 93 -234.761 71.616 64.330 1.00 0.00 H new ATOM 1462 N LYS A 94 -237.331 71.900 63.012 1.00 0.00 N ATOM 1463 CA LYS A 94 -238.714 71.746 63.429 1.00 0.00 C ATOM 1464 C LYS A 94 -239.640 72.006 62.251 1.00 0.00 C ATOM 1465 O LYS A 94 -240.792 71.572 62.235 1.00 0.00 O ATOM 1466 CB LYS A 94 -239.043 72.749 64.530 1.00 0.00 C ATOM 1467 CG LYS A 94 -238.121 72.697 65.735 1.00 0.00 C ATOM 1468 CD LYS A 94 -238.318 71.437 66.556 1.00 0.00 C ATOM 1469 CE LYS A 94 -237.475 71.477 67.820 1.00 0.00 C ATOM 1470 NZ LYS A 94 -237.764 72.684 68.641 1.00 0.00 N ATOM 0 H LYS A 94 -236.957 72.840 63.144 1.00 0.00 H new ATOM 0 HA LYS A 94 -238.853 70.730 63.798 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -239.010 73.754 64.108 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -240.066 72.577 64.865 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -237.085 72.751 65.400 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -238.299 73.569 66.364 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -239.370 71.330 66.819 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -238.048 70.564 65.961 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -237.665 70.581 68.412 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -236.418 71.464 67.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -237.417 72.536 69.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -237.287 73.509 68.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -238.790 72.852 68.663 1.00 0.00 H new ATOM 1484 N TRP A 95 -239.116 72.733 61.274 1.00 0.00 N ATOM 1485 CA TRP A 95 -239.896 73.191 60.137 1.00 0.00 C ATOM 1486 C TRP A 95 -240.450 72.051 59.305 1.00 0.00 C ATOM 1487 O TRP A 95 -239.843 70.987 59.177 1.00 0.00 O ATOM 1488 CB TRP A 95 -239.063 74.107 59.253 1.00 0.00 C ATOM 1489 CG TRP A 95 -238.867 75.459 59.846 1.00 0.00 C ATOM 1490 CD1 TRP A 95 -239.310 75.899 61.058 1.00 0.00 C ATOM 1491 CD2 TRP A 95 -238.189 76.551 59.240 1.00 0.00 C ATOM 1492 NE1 TRP A 95 -238.946 77.204 61.241 1.00 0.00 N ATOM 1493 CE2 TRP A 95 -238.253 77.630 60.136 1.00 0.00 C ATOM 1494 CE3 TRP A 95 -237.532 76.715 58.022 1.00 0.00 C ATOM 1495 CZ2 TRP A 95 -237.680 78.862 59.847 1.00 0.00 C ATOM 1496 CZ3 TRP A 95 -236.966 77.938 57.735 1.00 0.00 C ATOM 1497 CH2 TRP A 95 -237.042 78.995 58.642 1.00 0.00 C ATOM 0 H TRP A 95 -238.138 73.021 61.249 1.00 0.00 H new ATOM 0 HA TRP A 95 -240.744 73.740 60.547 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -238.090 73.648 59.077 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -239.549 74.208 58.282 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -239.866 75.305 61.768 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -239.155 77.769 62.064 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -237.468 75.899 57.317 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -237.735 79.684 60.546 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -236.456 78.080 56.794 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -236.587 79.941 58.388 1.00 0.00 H new ATOM 1508 N LYS A 96 -241.610 72.306 58.728 1.00 0.00 N ATOM 1509 CA LYS A 96 -242.279 71.341 57.868 1.00 0.00 C ATOM 1510 C LYS A 96 -242.398 71.921 56.466 1.00 0.00 C ATOM 1511 O LYS A 96 -243.126 71.413 55.613 1.00 0.00 O ATOM 1512 CB LYS A 96 -243.661 71.004 58.431 1.00 0.00 C ATOM 1513 CG LYS A 96 -243.618 70.409 59.828 1.00 0.00 C ATOM 1514 CD LYS A 96 -245.013 70.245 60.407 1.00 0.00 C ATOM 1515 CE LYS A 96 -244.973 69.641 61.802 1.00 0.00 C ATOM 1516 NZ LYS A 96 -246.330 69.533 62.398 1.00 0.00 N ATOM 0 H LYS A 96 -242.116 73.185 58.840 1.00 0.00 H new ATOM 0 HA LYS A 96 -241.696 70.421 57.826 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -244.268 71.909 58.449 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -244.156 70.302 57.761 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -243.120 69.440 59.797 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -243.026 71.051 60.480 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -245.508 71.215 60.444 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -245.607 69.609 59.751 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -244.517 68.652 61.757 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -244.342 70.254 62.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -246.260 69.117 63.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -246.756 70.479 62.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -246.925 68.927 61.798 1.00 0.00 H new ATOM 1530 N GLY A 97 -241.661 72.998 56.255 1.00 0.00 N ATOM 1531 CA GLY A 97 -241.673 73.714 54.999 1.00 0.00 C ATOM 1532 C GLY A 97 -240.523 74.694 54.960 1.00 0.00 C ATOM 1533 O GLY A 97 -239.833 74.866 55.967 1.00 0.00 O ATOM 0 H GLY A 97 -241.037 73.399 56.955 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -241.594 73.012 54.169 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -242.618 74.243 54.880 1.00 0.00 H new ATOM 1537 N ALA A 98 -240.308 75.345 53.833 1.00 0.00 N ATOM 1538 CA ALA A 98 -239.179 76.251 53.711 1.00 0.00 C ATOM 1539 C ALA A 98 -239.573 77.675 54.080 1.00 0.00 C ATOM 1540 O ALA A 98 -240.178 78.395 53.284 1.00 0.00 O ATOM 1541 CB ALA A 98 -238.599 76.198 52.306 1.00 0.00 C ATOM 0 H ALA A 98 -240.890 75.267 52.999 1.00 0.00 H new ATOM 0 HA ALA A 98 -238.411 75.926 54.412 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -237.755 76.883 52.235 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -238.263 75.184 52.089 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -239.364 76.488 51.586 1.00 0.00 H new ATOM 1547 N GLY A 99 -239.235 78.079 55.295 1.00 0.00 N ATOM 1548 CA GLY A 99 -239.586 79.401 55.755 1.00 0.00 C ATOM 1549 C GLY A 99 -238.398 80.335 55.753 1.00 0.00 C ATOM 1550 O GLY A 99 -237.534 80.253 54.877 1.00 0.00 O ATOM 0 H GLY A 99 -238.723 77.512 55.970 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -240.370 79.810 55.118 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -239.995 79.337 56.763 1.00 0.00 H new ATOM 1554 N LYS A 100 -238.371 81.226 56.730 1.00 0.00 N ATOM 1555 CA LYS A 100 -237.257 82.132 56.958 1.00 0.00 C ATOM 1556 C LYS A 100 -237.256 82.482 58.422 1.00 0.00 C ATOM 1557 O LYS A 100 -238.297 82.433 59.074 1.00 0.00 O ATOM 1558 CB LYS A 100 -237.348 83.448 56.157 1.00 0.00 C ATOM 1559 CG LYS A 100 -237.541 83.286 54.678 1.00 0.00 C ATOM 1560 CD LYS A 100 -239.012 83.167 54.364 1.00 0.00 C ATOM 1561 CE LYS A 100 -239.220 82.933 52.897 1.00 0.00 C ATOM 1562 NZ LYS A 100 -238.562 81.675 52.433 1.00 0.00 N ATOM 0 H LYS A 100 -239.134 81.342 57.397 1.00 0.00 H new ATOM 0 HA LYS A 100 -236.350 81.624 56.631 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -238.175 84.038 56.552 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -236.437 84.022 56.327 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -237.115 84.140 54.151 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -237.012 82.399 54.328 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -239.446 82.346 54.934 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -239.530 84.076 54.670 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -240.288 82.883 52.686 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -238.823 83.778 52.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -239.002 81.360 51.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -237.549 81.851 52.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -238.676 80.937 53.157 1.00 0.00 H new ATOM 1576 N PHE A 101 -236.112 82.812 58.953 1.00 0.00 N ATOM 1577 CA PHE A 101 -236.071 83.348 60.285 1.00 0.00 C ATOM 1578 C PHE A 101 -236.246 84.859 60.207 1.00 0.00 C ATOM 1579 O PHE A 101 -235.514 85.536 59.516 1.00 0.00 O ATOM 1580 CB PHE A 101 -234.773 82.926 60.960 1.00 0.00 C ATOM 1581 CG PHE A 101 -234.696 81.431 61.129 1.00 0.00 C ATOM 1582 CD1 PHE A 101 -235.241 80.825 62.249 1.00 0.00 C ATOM 1583 CD2 PHE A 101 -234.110 80.632 60.155 1.00 0.00 C ATOM 1584 CE1 PHE A 101 -235.200 79.453 62.400 1.00 0.00 C ATOM 1585 CE2 PHE A 101 -234.070 79.256 60.301 1.00 0.00 C ATOM 1586 CZ PHE A 101 -234.614 78.669 61.425 1.00 0.00 C ATOM 0 H PHE A 101 -235.207 82.721 58.492 1.00 0.00 H new ATOM 0 HA PHE A 101 -236.883 82.957 60.898 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -233.925 83.270 60.367 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -234.696 83.407 61.935 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -235.703 81.433 63.013 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -233.681 81.089 59.275 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -235.626 78.993 63.280 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -233.614 78.644 59.537 1.00 0.00 H new ATOM 0 HZ PHE A 101 -234.582 77.596 61.543 1.00 0.00 H new ATOM 1596 N ILE A 102 -237.249 85.385 60.878 1.00 0.00 N ATOM 1597 CA ILE A 102 -237.603 86.790 60.730 1.00 0.00 C ATOM 1598 C ILE A 102 -237.066 87.601 61.904 1.00 0.00 C ATOM 1599 O ILE A 102 -237.350 87.295 63.061 1.00 0.00 O ATOM 1600 CB ILE A 102 -239.147 86.976 60.615 1.00 0.00 C ATOM 1601 CG1 ILE A 102 -239.646 86.774 59.172 1.00 0.00 C ATOM 1602 CG2 ILE A 102 -239.573 88.354 61.109 1.00 0.00 C ATOM 1603 CD1 ILE A 102 -239.338 85.421 58.565 1.00 0.00 C ATOM 0 H ILE A 102 -237.836 84.866 61.531 1.00 0.00 H new ATOM 0 HA ILE A 102 -237.147 87.152 59.809 1.00 0.00 H new ATOM 0 HB ILE A 102 -239.600 86.211 61.246 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -240.725 86.925 59.154 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -239.205 87.546 58.541 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -240.654 88.455 61.017 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -239.285 88.471 62.154 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -239.084 89.122 60.510 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -239.731 85.380 57.549 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -238.259 85.269 58.543 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -239.802 84.639 59.165 1.00 0.00 H new ATOM 1615 N LEU A 103 -236.272 88.623 61.599 1.00 0.00 N ATOM 1616 CA LEU A 103 -235.729 89.490 62.631 1.00 0.00 C ATOM 1617 C LEU A 103 -236.820 90.419 63.139 1.00 0.00 C ATOM 1618 O LEU A 103 -237.491 91.092 62.353 1.00 0.00 O ATOM 1619 CB LEU A 103 -234.563 90.325 62.093 1.00 0.00 C ATOM 1620 CG LEU A 103 -233.684 90.966 63.172 1.00 0.00 C ATOM 1621 CD1 LEU A 103 -232.592 90.005 63.610 1.00 0.00 C ATOM 1622 CD2 LEU A 103 -233.081 92.274 62.692 1.00 0.00 C ATOM 0 H LEU A 103 -235.993 88.868 60.649 1.00 0.00 H new ATOM 0 HA LEU A 103 -235.360 88.865 63.444 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -233.939 89.690 61.465 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -234.962 91.112 61.454 1.00 0.00 H new ATOM 0 HG LEU A 103 -234.319 91.188 64.030 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -231.978 90.477 64.377 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -233.045 89.100 64.015 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -231.969 89.747 62.754 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -232.464 92.702 63.482 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -232.467 92.090 61.811 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -233.879 92.971 62.438 1.00 0.00 H new ATOM 1634 N LYS A 104 -237.011 90.442 64.443 1.00 0.00 N ATOM 1635 CA LYS A 104 -238.025 91.283 65.041 1.00 0.00 C ATOM 1636 C LYS A 104 -237.550 91.754 66.407 1.00 0.00 C ATOM 1637 O LYS A 104 -236.524 91.290 66.902 1.00 0.00 O ATOM 1638 CB LYS A 104 -239.340 90.504 65.150 1.00 0.00 C ATOM 1639 CG LYS A 104 -240.569 91.394 65.103 1.00 0.00 C ATOM 1640 CD LYS A 104 -241.849 90.585 65.041 1.00 0.00 C ATOM 1641 CE LYS A 104 -241.932 89.732 63.781 1.00 0.00 C ATOM 1642 NZ LYS A 104 -241.967 90.556 62.542 1.00 0.00 N ATOM 0 H LYS A 104 -236.475 89.886 65.109 1.00 0.00 H new ATOM 0 HA LYS A 104 -238.199 92.159 64.417 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -239.393 89.779 64.338 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -239.344 89.939 66.082 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -240.587 92.035 65.984 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -240.510 92.049 64.233 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -241.912 89.941 65.918 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -242.705 91.259 65.078 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -241.075 89.059 63.743 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -242.825 89.108 63.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -242.176 89.947 61.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -242.705 91.283 62.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -241.044 91.015 62.404 1.00 0.00 H new ATOM 1656 N LEU A 105 -238.262 92.685 67.006 1.00 0.00 N ATOM 1657 CA LEU A 105 -237.942 93.113 68.350 1.00 0.00 C ATOM 1658 C LEU A 105 -238.805 92.363 69.330 1.00 0.00 C ATOM 1659 O LEU A 105 -239.855 91.847 68.969 1.00 0.00 O ATOM 1660 CB LEU A 105 -238.175 94.607 68.558 1.00 0.00 C ATOM 1661 CG LEU A 105 -236.929 95.485 68.640 1.00 0.00 C ATOM 1662 CD1 LEU A 105 -236.203 95.525 67.318 1.00 0.00 C ATOM 1663 CD2 LEU A 105 -237.304 96.890 69.084 1.00 0.00 C ATOM 0 H LEU A 105 -239.062 93.158 66.586 1.00 0.00 H new ATOM 0 HA LEU A 105 -236.884 92.906 68.509 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -238.797 94.972 67.741 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -238.746 94.739 69.477 1.00 0.00 H new ATOM 0 HG LEU A 105 -236.255 95.050 69.379 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -235.320 96.158 67.407 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -235.900 94.516 67.039 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -236.864 95.930 66.552 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -236.406 97.506 69.138 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -238.000 97.325 68.366 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -237.775 96.848 70.066 1.00 0.00 H new ATOM 1675 N LYS A 106 -238.377 92.328 70.568 1.00 0.00 N ATOM 1676 CA LYS A 106 -239.163 91.721 71.628 1.00 0.00 C ATOM 1677 C LYS A 106 -240.086 92.762 72.238 1.00 0.00 C ATOM 1678 O LYS A 106 -240.900 92.480 73.113 1.00 0.00 O ATOM 1679 CB LYS A 106 -238.237 91.113 72.659 1.00 0.00 C ATOM 1680 CG LYS A 106 -237.239 92.091 73.208 1.00 0.00 C ATOM 1681 CD LYS A 106 -236.052 91.396 73.853 1.00 0.00 C ATOM 1682 CE LYS A 106 -236.433 90.668 75.125 1.00 0.00 C ATOM 1683 NZ LYS A 106 -236.770 91.606 76.227 1.00 0.00 N ATOM 0 H LYS A 106 -237.484 92.714 70.873 1.00 0.00 H new ATOM 0 HA LYS A 106 -239.785 90.921 71.225 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -238.831 90.711 73.480 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -237.705 90.274 72.210 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -236.887 92.738 72.405 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -237.727 92.732 73.943 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -235.621 90.687 73.146 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -235.280 92.132 74.076 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -237.286 90.019 74.929 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -235.609 90.026 75.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -236.876 91.075 77.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -236.009 92.307 76.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -237.662 92.094 76.007 1.00 0.00 H new