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 87 CYS SG : rot 52:sc= -0.564 USER MOD Set 1.2: A 90 GLN : amide:sc= -0.0313 K(o=-0.59,f=-2.9!) USER MOD Set 2.1: A 6 SER OG : rot -30:sc= 1.1 USER MOD Set 2.2: A 24 LYS NZ :NH3+ -161:sc= 0.906 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= -0.186 K(o=-0.19,f=-0.77) USER MOD Single : A 12 HIS : no HE2:sc= -1.4 K(o=-1.4,f=-3!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -94:sc= -0.0567 USER MOD Single : A 30 THR OG1 : rot 110:sc= 0.314 USER MOD Single : A 32 GLN : amide:sc= -0.427 X(o=-0.43,f=-0.033) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= 0.236 K(o=0.24,f=-6.2!) USER MOD Single : A 38 THR OG1 : rot 83:sc= 1.24 USER MOD Single : A 40 CYS SG : rot -21:sc=0.000948 USER MOD Single : A 41 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0348) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -31:sc= 0.31 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -1.13 X(o=-1.1,f=-1.1) USER MOD Single : A 85 GLN :FLIP amide:sc= -0.0416 F(o=-1.4!,f=-0.042) USER MOD Single : A 92 GLN : amide:sc=-0.00242 K(o=-0.0024,f=-0.52) USER MOD Single : A 93 SER OG : rot 5:sc= 1.26 USER MOD Single : A 94 LYS NZ :NH3+ 162:sc= -0.0849 (180deg=-0.108) USER MOD Single : A 96 LYS NZ :NH3+ -166:sc= -0.141 (180deg=-0.513) USER MOD Single : A 100 LYS NZ :NH3+ 178:sc= 0.745 (180deg=0.419) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ -155:sc= 0.614 (180deg=0.414) USER MOD ----------------------------------------------------------------- ATOM 70 N SER A 6 -221.520 75.952 58.921 1.00 0.00 N ATOM 71 CA SER A 6 -222.390 77.101 58.803 1.00 0.00 C ATOM 72 C SER A 6 -223.517 76.795 57.827 1.00 0.00 C ATOM 73 O SER A 6 -223.309 76.170 56.784 1.00 0.00 O ATOM 74 CB SER A 6 -221.592 78.333 58.374 1.00 0.00 C ATOM 75 OG SER A 6 -220.646 78.006 57.372 1.00 0.00 O ATOM 0 HA SER A 6 -222.833 77.321 59.774 1.00 0.00 H new ATOM 0 HB2 SER A 6 -222.272 79.098 58.000 1.00 0.00 H new ATOM 0 HB3 SER A 6 -221.079 78.757 59.238 1.00 0.00 H new ATOM 0 HG SER A 6 -220.357 77.077 57.486 1.00 0.00 H new ATOM 81 N PHE A 7 -224.712 77.211 58.191 1.00 0.00 N ATOM 82 CA PHE A 7 -225.900 76.926 57.423 1.00 0.00 C ATOM 83 C PHE A 7 -226.453 78.230 56.859 1.00 0.00 C ATOM 84 O PHE A 7 -226.205 79.306 57.407 1.00 0.00 O ATOM 85 CB PHE A 7 -226.925 76.213 58.319 1.00 0.00 C ATOM 86 CG PHE A 7 -227.736 77.111 59.209 1.00 0.00 C ATOM 87 CD1 PHE A 7 -227.221 77.567 60.403 1.00 0.00 C ATOM 88 CD2 PHE A 7 -229.024 77.476 58.857 1.00 0.00 C ATOM 89 CE1 PHE A 7 -227.969 78.374 61.234 1.00 0.00 C ATOM 90 CE2 PHE A 7 -229.780 78.287 59.682 1.00 0.00 C ATOM 91 CZ PHE A 7 -229.251 78.735 60.875 1.00 0.00 C ATOM 0 H PHE A 7 -224.885 77.759 59.034 1.00 0.00 H new ATOM 0 HA PHE A 7 -225.669 76.266 56.587 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -227.607 75.647 57.684 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -226.398 75.491 58.943 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -226.218 77.289 60.692 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -229.443 77.123 57.926 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -227.551 78.724 62.166 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -230.782 78.569 59.394 1.00 0.00 H new ATOM 0 HZ PHE A 7 -229.839 79.366 61.525 1.00 0.00 H new ATOM 101 N PHE A 8 -227.181 78.144 55.766 1.00 0.00 N ATOM 102 CA PHE A 8 -227.684 79.340 55.107 1.00 0.00 C ATOM 103 C PHE A 8 -229.020 79.774 55.692 1.00 0.00 C ATOM 104 O PHE A 8 -229.946 78.970 55.827 1.00 0.00 O ATOM 105 CB PHE A 8 -227.809 79.126 53.599 1.00 0.00 C ATOM 106 CG PHE A 8 -226.491 79.188 52.883 1.00 0.00 C ATOM 107 CD1 PHE A 8 -225.973 80.407 52.475 1.00 0.00 C ATOM 108 CD2 PHE A 8 -225.768 78.035 52.621 1.00 0.00 C ATOM 109 CE1 PHE A 8 -224.761 80.477 51.819 1.00 0.00 C ATOM 110 CE2 PHE A 8 -224.554 78.099 51.964 1.00 0.00 C ATOM 111 CZ PHE A 8 -224.049 79.322 51.563 1.00 0.00 C ATOM 0 H PHE A 8 -227.439 77.267 55.314 1.00 0.00 H new ATOM 0 HA PHE A 8 -226.961 80.137 55.283 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -228.271 78.157 53.413 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -228.476 79.882 53.185 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -226.525 81.314 52.673 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -226.157 77.077 52.933 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -224.370 81.434 51.506 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -224.000 77.194 51.764 1.00 0.00 H new ATOM 0 HZ PHE A 8 -223.100 79.374 51.051 1.00 0.00 H new ATOM 121 N VAL A 9 -229.106 81.048 56.039 1.00 0.00 N ATOM 122 CA VAL A 9 -230.310 81.609 56.624 1.00 0.00 C ATOM 123 C VAL A 9 -230.904 82.649 55.706 1.00 0.00 C ATOM 124 O VAL A 9 -230.215 83.563 55.268 1.00 0.00 O ATOM 125 CB VAL A 9 -230.045 82.323 57.962 1.00 0.00 C ATOM 126 CG1 VAL A 9 -231.338 82.530 58.728 1.00 0.00 C ATOM 127 CG2 VAL A 9 -229.036 81.581 58.803 1.00 0.00 C ATOM 0 H VAL A 9 -228.346 81.719 55.923 1.00 0.00 H new ATOM 0 HA VAL A 9 -230.980 80.764 56.781 1.00 0.00 H new ATOM 0 HB VAL A 9 -229.621 83.300 57.731 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -231.126 83.036 59.670 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -232.019 83.139 58.134 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -231.799 81.564 58.931 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -228.877 82.118 59.738 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -229.408 80.579 59.018 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -228.093 81.509 58.261 1.00 0.00 H new ATOM 137 N GLN A 10 -232.170 82.509 55.408 1.00 0.00 N ATOM 138 CA GLN A 10 -232.901 83.590 54.823 1.00 0.00 C ATOM 139 C GLN A 10 -233.736 84.218 55.927 1.00 0.00 C ATOM 140 O GLN A 10 -234.707 83.627 56.392 1.00 0.00 O ATOM 141 CB GLN A 10 -233.784 83.077 53.698 1.00 0.00 C ATOM 142 CG GLN A 10 -233.056 82.190 52.703 1.00 0.00 C ATOM 143 CD GLN A 10 -233.937 81.775 51.543 1.00 0.00 C ATOM 144 OE1 GLN A 10 -233.961 82.428 50.502 1.00 0.00 O ATOM 145 NE2 GLN A 10 -234.683 80.696 51.722 1.00 0.00 N ATOM 0 H GLN A 10 -232.710 81.658 55.562 1.00 0.00 H new ATOM 0 HA GLN A 10 -232.227 84.331 54.393 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -234.616 82.519 54.127 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -234.211 83.928 53.167 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -232.183 82.719 52.321 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -232.691 81.299 53.214 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -234.633 80.182 52.602 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -235.307 80.379 50.980 1.00 0.00 H new ATOM 154 N VAL A 11 -233.335 85.393 56.365 1.00 0.00 N ATOM 155 CA VAL A 11 -233.972 86.055 57.489 1.00 0.00 C ATOM 156 C VAL A 11 -234.316 87.492 57.141 1.00 0.00 C ATOM 157 O VAL A 11 -233.496 88.219 56.623 1.00 0.00 O ATOM 158 CB VAL A 11 -233.090 85.991 58.766 1.00 0.00 C ATOM 159 CG1 VAL A 11 -231.626 86.138 58.421 1.00 0.00 C ATOM 160 CG2 VAL A 11 -233.499 87.040 59.794 1.00 0.00 C ATOM 0 H VAL A 11 -232.561 85.916 55.955 1.00 0.00 H new ATOM 0 HA VAL A 11 -234.898 85.522 57.704 1.00 0.00 H new ATOM 0 HB VAL A 11 -233.248 85.009 59.213 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -231.031 86.090 59.333 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -231.328 85.333 57.750 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -231.462 87.098 57.931 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -232.857 86.960 60.671 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -233.397 88.034 59.359 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -234.536 86.877 60.088 1.00 0.00 H new ATOM 170 N HIS A 12 -235.544 87.882 57.411 1.00 0.00 N ATOM 171 CA HIS A 12 -236.022 89.210 57.045 1.00 0.00 C ATOM 172 C HIS A 12 -235.450 90.281 57.964 1.00 0.00 C ATOM 173 O HIS A 12 -235.377 90.091 59.181 1.00 0.00 O ATOM 174 CB HIS A 12 -237.551 89.259 57.111 1.00 0.00 C ATOM 175 CG HIS A 12 -238.250 88.616 55.959 1.00 0.00 C ATOM 176 ND1 HIS A 12 -239.224 89.259 55.233 1.00 0.00 N ATOM 177 CD2 HIS A 12 -238.126 87.386 55.411 1.00 0.00 C ATOM 178 CE1 HIS A 12 -239.675 88.456 54.292 1.00 0.00 C ATOM 179 NE2 HIS A 12 -239.024 87.308 54.370 1.00 0.00 N ATOM 0 H HIS A 12 -236.236 87.300 57.884 1.00 0.00 H new ATOM 0 HA HIS A 12 -235.687 89.409 56.027 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -237.876 88.774 58.031 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -237.864 90.301 57.172 1.00 0.00 H new ATOM 0 HD1 HIS A 12 -239.548 90.212 55.398 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -237.448 86.609 55.731 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -240.448 88.695 53.576 1.00 0.00 H new ATOM 287 N LEU A 20 -235.434 90.245 52.220 1.00 0.00 N ATOM 288 CA LEU A 20 -235.004 88.926 52.638 1.00 0.00 C ATOM 289 C LEU A 20 -233.495 88.917 52.783 1.00 0.00 C ATOM 290 O LEU A 20 -232.767 88.893 51.788 1.00 0.00 O ATOM 291 CB LEU A 20 -235.439 87.855 51.638 1.00 0.00 C ATOM 292 CG LEU A 20 -235.069 86.425 52.039 1.00 0.00 C ATOM 293 CD1 LEU A 20 -235.796 86.031 53.313 1.00 0.00 C ATOM 294 CD2 LEU A 20 -235.386 85.452 50.917 1.00 0.00 C ATOM 0 HA LEU A 20 -235.472 88.696 53.595 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -236.520 87.914 51.508 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -234.989 88.075 50.670 1.00 0.00 H new ATOM 0 HG LEU A 20 -233.996 86.386 52.226 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -235.524 85.012 53.587 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -235.514 86.710 54.118 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -236.872 86.088 53.150 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -235.115 84.442 51.224 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -236.452 85.489 50.693 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -234.819 85.725 50.027 1.00 0.00 H new ATOM 306 N THR A 21 -233.030 88.969 54.014 1.00 0.00 N ATOM 307 CA THR A 21 -231.613 88.999 54.281 1.00 0.00 C ATOM 308 C THR A 21 -231.035 87.587 54.238 1.00 0.00 C ATOM 309 O THR A 21 -231.299 86.773 55.116 1.00 0.00 O ATOM 310 CB THR A 21 -231.325 89.631 55.656 1.00 0.00 C ATOM 311 OG1 THR A 21 -231.972 90.907 55.743 1.00 0.00 O ATOM 312 CG2 THR A 21 -229.834 89.800 55.885 1.00 0.00 C ATOM 0 H THR A 21 -233.618 88.991 54.847 1.00 0.00 H new ATOM 0 HA THR A 21 -231.140 89.607 53.510 1.00 0.00 H new ATOM 0 HB THR A 21 -231.713 88.963 56.425 1.00 0.00 H new ATOM 0 HG1 THR A 21 -231.790 91.307 56.619 1.00 0.00 H new ATOM 0 HG21 THR A 21 -229.665 90.248 56.864 1.00 0.00 H new ATOM 0 HG22 THR A 21 -229.347 88.826 55.843 1.00 0.00 H new ATOM 0 HG23 THR A 21 -229.418 90.447 55.113 1.00 0.00 H new ATOM 320 N VAL A 22 -230.251 87.293 53.217 1.00 0.00 N ATOM 321 CA VAL A 22 -229.655 85.974 53.092 1.00 0.00 C ATOM 322 C VAL A 22 -228.256 85.973 53.706 1.00 0.00 C ATOM 323 O VAL A 22 -227.337 86.611 53.189 1.00 0.00 O ATOM 324 CB VAL A 22 -229.575 85.528 51.617 1.00 0.00 C ATOM 325 CG1 VAL A 22 -229.013 84.118 51.505 1.00 0.00 C ATOM 326 CG2 VAL A 22 -230.944 85.608 50.956 1.00 0.00 C ATOM 0 H VAL A 22 -230.013 87.943 52.468 1.00 0.00 H new ATOM 0 HA VAL A 22 -230.291 85.268 53.626 1.00 0.00 H new ATOM 0 HB VAL A 22 -228.899 86.207 51.097 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -228.967 83.827 50.456 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -228.011 84.090 51.934 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -229.658 83.425 52.045 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -230.865 85.289 49.917 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -231.641 84.957 51.483 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -231.307 86.635 50.994 1.00 0.00 H new ATOM 336 N ILE A 23 -228.108 85.271 54.816 1.00 0.00 N ATOM 337 CA ILE A 23 -226.836 85.192 55.517 1.00 0.00 C ATOM 338 C ILE A 23 -226.384 83.750 55.651 1.00 0.00 C ATOM 339 O ILE A 23 -227.116 82.824 55.302 1.00 0.00 O ATOM 340 CB ILE A 23 -226.914 85.801 56.934 1.00 0.00 C ATOM 341 CG1 ILE A 23 -228.123 85.259 57.695 1.00 0.00 C ATOM 342 CG2 ILE A 23 -226.957 87.319 56.863 1.00 0.00 C ATOM 343 CD1 ILE A 23 -228.176 85.708 59.141 1.00 0.00 C ATOM 0 H ILE A 23 -228.861 84.742 55.256 1.00 0.00 H new ATOM 0 HA ILE A 23 -226.123 85.762 54.921 1.00 0.00 H new ATOM 0 HB ILE A 23 -226.016 85.510 57.479 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -229.034 85.579 57.190 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -228.106 84.170 57.661 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -227.012 87.729 57.871 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -226.056 87.686 56.371 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -227.834 87.632 56.296 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -229.059 85.286 59.621 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -227.282 85.365 59.662 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -228.225 86.796 59.183 1.00 0.00 H new ATOM 355 N LYS A 24 -225.176 83.563 56.148 1.00 0.00 N ATOM 356 CA LYS A 24 -224.701 82.242 56.491 1.00 0.00 C ATOM 357 C LYS A 24 -224.313 82.210 57.965 1.00 0.00 C ATOM 358 O LYS A 24 -223.227 82.651 58.345 1.00 0.00 O ATOM 359 CB LYS A 24 -223.510 81.841 55.622 1.00 0.00 C ATOM 360 CG LYS A 24 -223.401 80.338 55.421 1.00 0.00 C ATOM 361 CD LYS A 24 -222.018 79.929 54.943 1.00 0.00 C ATOM 362 CE LYS A 24 -221.950 78.439 54.647 1.00 0.00 C ATOM 363 NZ LYS A 24 -220.550 77.948 54.597 1.00 0.00 N ATOM 0 H LYS A 24 -224.507 84.313 56.322 1.00 0.00 H new ATOM 0 HA LYS A 24 -225.502 81.526 56.308 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -223.597 82.327 54.650 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -222.592 82.208 56.081 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -223.626 79.829 56.358 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -224.147 80.014 54.695 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -221.761 80.492 54.046 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -221.279 80.185 55.702 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -222.500 77.891 55.413 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -222.440 78.235 53.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -220.518 77.040 54.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -219.956 78.642 54.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -220.193 77.817 55.565 1.00 0.00 H new ATOM 377 N ALA A 25 -225.221 81.726 58.790 1.00 0.00 N ATOM 378 CA ALA A 25 -225.003 81.651 60.222 1.00 0.00 C ATOM 379 C ALA A 25 -224.517 80.276 60.591 1.00 0.00 C ATOM 380 O ALA A 25 -224.685 79.332 59.839 1.00 0.00 O ATOM 381 CB ALA A 25 -226.292 81.997 60.961 1.00 0.00 C ATOM 0 H ALA A 25 -226.129 81.374 58.487 1.00 0.00 H new ATOM 0 HA ALA A 25 -224.240 82.372 60.514 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -226.122 81.939 62.036 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -226.603 83.008 60.697 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -227.074 81.292 60.679 1.00 0.00 H new ATOM 387 N PRO A 26 -223.899 80.143 61.750 1.00 0.00 N ATOM 388 CA PRO A 26 -223.353 78.877 62.182 1.00 0.00 C ATOM 389 C PRO A 26 -224.449 77.856 62.426 1.00 0.00 C ATOM 390 O PRO A 26 -225.508 78.195 62.932 1.00 0.00 O ATOM 391 CB PRO A 26 -222.584 79.211 63.460 1.00 0.00 C ATOM 392 CG PRO A 26 -222.651 80.693 63.641 1.00 0.00 C ATOM 393 CD PRO A 26 -223.723 81.209 62.736 1.00 0.00 C ATOM 0 HA PRO A 26 -222.709 78.422 61.429 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -223.021 78.699 64.317 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -221.549 78.879 63.384 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -222.872 80.943 64.679 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -221.692 81.152 63.400 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -224.646 81.404 63.282 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -223.429 82.146 62.263 1.00 0.00 H new ATOM 401 N ARG A 27 -224.193 76.598 62.064 1.00 0.00 N ATOM 402 CA ARG A 27 -225.190 75.526 62.215 1.00 0.00 C ATOM 403 C ARG A 27 -225.522 75.302 63.696 1.00 0.00 C ATOM 404 O ARG A 27 -226.310 74.434 64.050 1.00 0.00 O ATOM 405 CB ARG A 27 -224.678 74.224 61.598 1.00 0.00 C ATOM 406 CG ARG A 27 -224.309 74.368 60.135 1.00 0.00 C ATOM 407 CD ARG A 27 -223.984 73.030 59.492 1.00 0.00 C ATOM 408 NE ARG A 27 -225.136 72.452 58.805 1.00 0.00 N ATOM 409 CZ ARG A 27 -225.155 71.228 58.277 1.00 0.00 C ATOM 410 NH1 ARG A 27 -224.121 70.407 58.437 1.00 0.00 N ATOM 411 NH2 ARG A 27 -226.217 70.828 57.591 1.00 0.00 N ATOM 0 H ARG A 27 -223.306 76.292 61.664 1.00 0.00 H new ATOM 0 HA ARG A 27 -226.096 75.832 61.692 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -223.806 73.882 62.155 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -225.443 73.454 61.700 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -225.134 74.837 59.598 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -223.450 75.032 60.042 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -223.167 73.159 58.782 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -223.634 72.337 60.257 1.00 0.00 H new ATOM 0 HE ARG A 27 -225.979 73.021 58.724 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -223.305 70.712 58.967 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -224.144 69.472 58.030 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -227.012 71.455 57.470 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -226.239 69.893 57.184 1.00 0.00 H new ATOM 425 N VAL A 28 -224.870 76.074 64.550 1.00 0.00 N ATOM 426 CA VAL A 28 -225.084 76.020 65.982 1.00 0.00 C ATOM 427 C VAL A 28 -225.693 77.327 66.485 1.00 0.00 C ATOM 428 O VAL A 28 -226.104 77.416 67.644 1.00 0.00 O ATOM 429 CB VAL A 28 -223.766 75.754 66.741 1.00 0.00 C ATOM 430 CG1 VAL A 28 -223.164 74.426 66.320 1.00 0.00 C ATOM 431 CG2 VAL A 28 -222.773 76.885 66.512 1.00 0.00 C ATOM 0 H VAL A 28 -224.172 76.761 64.264 1.00 0.00 H new ATOM 0 HA VAL A 28 -225.772 75.197 66.173 1.00 0.00 H new ATOM 0 HB VAL A 28 -223.992 75.707 67.806 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -222.236 74.258 66.866 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -223.866 73.622 66.541 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -222.957 74.443 65.250 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -221.852 76.676 67.056 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -222.555 76.967 65.447 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -223.200 77.822 66.868 1.00 0.00 H new ATOM 441 N SER A 29 -225.734 78.346 65.615 1.00 0.00 N ATOM 442 CA SER A 29 -226.328 79.637 65.976 1.00 0.00 C ATOM 443 C SER A 29 -227.742 79.457 66.494 1.00 0.00 C ATOM 444 O SER A 29 -228.538 78.708 65.924 1.00 0.00 O ATOM 445 CB SER A 29 -226.341 80.591 64.778 1.00 0.00 C ATOM 446 OG SER A 29 -227.134 80.088 63.718 1.00 0.00 O ATOM 0 H SER A 29 -225.366 78.301 64.665 1.00 0.00 H new ATOM 0 HA SER A 29 -225.713 80.069 66.765 1.00 0.00 H new ATOM 0 HB2 SER A 29 -226.724 81.562 65.090 1.00 0.00 H new ATOM 0 HB3 SER A 29 -225.321 80.749 64.427 1.00 0.00 H new ATOM 0 HG SER A 29 -226.566 79.596 63.089 1.00 0.00 H new ATOM 452 N THR A 30 -228.042 80.108 67.599 1.00 0.00 N ATOM 453 CA THR A 30 -229.397 80.147 68.076 1.00 0.00 C ATOM 454 C THR A 30 -230.035 81.443 67.605 1.00 0.00 C ATOM 455 O THR A 30 -229.446 82.156 66.787 1.00 0.00 O ATOM 456 CB THR A 30 -229.488 80.053 69.602 1.00 0.00 C ATOM 457 OG1 THR A 30 -229.057 81.279 70.203 1.00 0.00 O ATOM 458 CG2 THR A 30 -228.646 78.912 70.141 1.00 0.00 C ATOM 0 H THR A 30 -227.368 80.612 68.175 1.00 0.00 H new ATOM 0 HA THR A 30 -229.922 79.281 67.674 1.00 0.00 H new ATOM 0 HB THR A 30 -230.531 79.864 69.854 1.00 0.00 H new ATOM 0 HG1 THR A 30 -229.827 81.736 70.602 1.00 0.00 H new ATOM 0 HG21 THR A 30 -228.735 78.876 71.227 1.00 0.00 H new ATOM 0 HG22 THR A 30 -228.995 77.970 69.717 1.00 0.00 H new ATOM 0 HG23 THR A 30 -227.603 79.069 69.867 1.00 0.00 H new ATOM 466 N ALA A 31 -231.219 81.761 68.112 1.00 0.00 N ATOM 467 CA ALA A 31 -231.878 83.000 67.739 1.00 0.00 C ATOM 468 C ALA A 31 -231.004 84.186 68.093 1.00 0.00 C ATOM 469 O ALA A 31 -230.747 85.025 67.251 1.00 0.00 O ATOM 470 CB ALA A 31 -233.256 83.104 68.389 1.00 0.00 C ATOM 0 H ALA A 31 -231.736 81.184 68.775 1.00 0.00 H new ATOM 0 HA ALA A 31 -232.029 83.003 66.660 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -233.728 84.041 68.093 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -233.875 82.268 68.065 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -233.150 83.078 69.473 1.00 0.00 H new ATOM 476 N GLN A 32 -230.495 84.206 69.311 1.00 0.00 N ATOM 477 CA GLN A 32 -229.661 85.304 69.787 1.00 0.00 C ATOM 478 C GLN A 32 -228.429 85.505 68.886 1.00 0.00 C ATOM 479 O GLN A 32 -227.979 86.634 68.678 1.00 0.00 O ATOM 480 CB GLN A 32 -229.229 85.014 71.232 1.00 0.00 C ATOM 481 CG GLN A 32 -229.282 86.219 72.154 1.00 0.00 C ATOM 482 CD GLN A 32 -228.189 87.226 71.875 1.00 0.00 C ATOM 483 OE1 GLN A 32 -227.114 87.183 72.476 1.00 0.00 O ATOM 484 NE2 GLN A 32 -228.443 88.119 70.942 1.00 0.00 N ATOM 0 H GLN A 32 -230.645 83.467 69.998 1.00 0.00 H new ATOM 0 HA GLN A 32 -230.241 86.226 69.754 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -229.868 84.231 71.640 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -228.212 84.623 71.223 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -230.252 86.706 72.051 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -229.203 85.882 73.188 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -229.347 88.119 70.469 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -227.736 88.811 70.692 1.00 0.00 H new ATOM 493 N ASP A 33 -227.912 84.422 68.314 1.00 0.00 N ATOM 494 CA ASP A 33 -226.694 84.501 67.509 1.00 0.00 C ATOM 495 C ASP A 33 -227.000 85.134 66.173 1.00 0.00 C ATOM 496 O ASP A 33 -226.387 86.118 65.756 1.00 0.00 O ATOM 497 CB ASP A 33 -226.125 83.106 67.236 1.00 0.00 C ATOM 498 CG ASP A 33 -225.498 82.448 68.445 1.00 0.00 C ATOM 499 OD1 ASP A 33 -224.357 82.804 68.800 1.00 0.00 O ATOM 500 OD2 ASP A 33 -226.141 81.547 69.028 1.00 0.00 O ATOM 0 H ASP A 33 -228.312 83.487 68.391 1.00 0.00 H new ATOM 0 HA ASP A 33 -225.971 85.095 68.067 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -226.924 82.466 66.861 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -225.377 83.178 66.446 1.00 0.00 H new ATOM 505 N VAL A 34 -227.979 84.544 65.526 1.00 0.00 N ATOM 506 CA VAL A 34 -228.438 84.963 64.225 1.00 0.00 C ATOM 507 C VAL A 34 -229.068 86.354 64.312 1.00 0.00 C ATOM 508 O VAL A 34 -229.057 87.118 63.346 1.00 0.00 O ATOM 509 CB VAL A 34 -229.400 83.905 63.670 1.00 0.00 C ATOM 510 CG1 VAL A 34 -230.758 83.982 64.322 1.00 0.00 C ATOM 511 CG2 VAL A 34 -229.470 83.998 62.168 1.00 0.00 C ATOM 0 H VAL A 34 -228.488 83.743 65.899 1.00 0.00 H new ATOM 0 HA VAL A 34 -227.601 85.045 63.531 1.00 0.00 H new ATOM 0 HB VAL A 34 -229.007 82.919 63.919 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -231.408 83.216 63.900 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -230.656 83.821 65.395 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -231.192 84.965 64.143 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -230.156 83.241 61.788 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -229.826 84.987 61.881 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -228.478 83.833 61.747 1.00 0.00 H new ATOM 521 N ILE A 35 -229.598 86.673 65.489 1.00 0.00 N ATOM 522 CA ILE A 35 -230.071 88.014 65.791 1.00 0.00 C ATOM 523 C ILE A 35 -228.950 89.028 65.575 1.00 0.00 C ATOM 524 O ILE A 35 -229.055 89.918 64.736 1.00 0.00 O ATOM 525 CB ILE A 35 -230.553 88.099 67.260 1.00 0.00 C ATOM 526 CG1 ILE A 35 -231.969 87.556 67.395 1.00 0.00 C ATOM 527 CG2 ILE A 35 -230.494 89.524 67.790 1.00 0.00 C ATOM 528 CD1 ILE A 35 -233.037 88.529 66.983 1.00 0.00 C ATOM 0 H ILE A 35 -229.710 86.010 66.256 1.00 0.00 H new ATOM 0 HA ILE A 35 -230.903 88.240 65.124 1.00 0.00 H new ATOM 0 HB ILE A 35 -229.877 87.487 67.857 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -232.061 86.654 66.790 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -232.138 87.264 68.431 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -230.840 89.542 68.823 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -229.467 89.887 67.745 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -231.133 90.165 67.182 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -234.017 88.068 67.108 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -232.974 89.423 67.604 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -232.896 88.803 65.938 1.00 0.00 H new ATOM 540 N GLN A 36 -227.848 88.835 66.285 1.00 0.00 N ATOM 541 CA GLN A 36 -226.744 89.782 66.258 1.00 0.00 C ATOM 542 C GLN A 36 -225.990 89.716 64.934 1.00 0.00 C ATOM 543 O GLN A 36 -225.458 90.718 64.478 1.00 0.00 O ATOM 544 CB GLN A 36 -225.795 89.516 67.426 1.00 0.00 C ATOM 545 CG GLN A 36 -224.655 90.516 67.528 1.00 0.00 C ATOM 546 CD GLN A 36 -223.713 90.207 68.674 1.00 0.00 C ATOM 547 OE1 GLN A 36 -223.902 90.678 69.793 1.00 0.00 O ATOM 548 NE2 GLN A 36 -222.685 89.417 68.400 1.00 0.00 N ATOM 0 H GLN A 36 -227.695 88.028 66.889 1.00 0.00 H new ATOM 0 HA GLN A 36 -227.156 90.786 66.357 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -226.364 89.531 68.356 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -225.379 88.514 67.323 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -224.095 90.520 66.593 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -225.065 91.517 67.659 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -222.564 89.046 67.458 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -222.015 89.180 69.132 1.00 0.00 H new ATOM 557 N GLN A 37 -225.921 88.538 64.321 1.00 0.00 N ATOM 558 CA GLN A 37 -225.293 88.411 63.022 1.00 0.00 C ATOM 559 C GLN A 37 -225.997 89.296 61.993 1.00 0.00 C ATOM 560 O GLN A 37 -225.357 89.863 61.104 1.00 0.00 O ATOM 561 CB GLN A 37 -225.296 86.959 62.562 1.00 0.00 C ATOM 562 CG GLN A 37 -224.237 86.701 61.518 1.00 0.00 C ATOM 563 CD GLN A 37 -224.100 85.241 61.143 1.00 0.00 C ATOM 564 OE1 GLN A 37 -224.331 84.353 61.960 1.00 0.00 O ATOM 565 NE2 GLN A 37 -223.718 84.991 59.901 1.00 0.00 N ATOM 0 H GLN A 37 -226.291 87.668 64.704 1.00 0.00 H new ATOM 0 HA GLN A 37 -224.258 88.742 63.112 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -225.129 86.306 63.418 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -226.276 86.708 62.156 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -224.473 87.277 60.623 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -223.278 87.064 61.887 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -223.538 85.762 59.258 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -223.604 84.027 59.587 1.00 0.00 H new ATOM 574 N THR A 38 -227.310 89.423 62.126 1.00 0.00 N ATOM 575 CA THR A 38 -228.071 90.326 61.278 1.00 0.00 C ATOM 576 C THR A 38 -227.716 91.777 61.624 1.00 0.00 C ATOM 577 O THR A 38 -227.526 92.611 60.733 1.00 0.00 O ATOM 578 CB THR A 38 -229.588 90.088 61.433 1.00 0.00 C ATOM 579 OG1 THR A 38 -229.870 88.686 61.309 1.00 0.00 O ATOM 580 CG2 THR A 38 -230.374 90.845 60.373 1.00 0.00 C ATOM 0 H THR A 38 -227.868 88.913 62.811 1.00 0.00 H new ATOM 0 HA THR A 38 -227.810 90.130 60.238 1.00 0.00 H new ATOM 0 HB THR A 38 -229.888 90.450 62.416 1.00 0.00 H new ATOM 0 HG1 THR A 38 -229.710 88.243 62.168 1.00 0.00 H new ATOM 0 HG21 THR A 38 -231.439 90.658 60.507 1.00 0.00 H new ATOM 0 HG22 THR A 38 -230.178 91.913 60.468 1.00 0.00 H new ATOM 0 HG23 THR A 38 -230.068 90.507 59.383 1.00 0.00 H new ATOM 588 N LEU A 39 -227.583 92.052 62.928 1.00 0.00 N ATOM 589 CA LEU A 39 -227.100 93.349 63.416 1.00 0.00 C ATOM 590 C LEU A 39 -225.755 93.699 62.777 1.00 0.00 C ATOM 591 O LEU A 39 -225.507 94.844 62.408 1.00 0.00 O ATOM 592 CB LEU A 39 -226.930 93.328 64.949 1.00 0.00 C ATOM 593 CG LEU A 39 -228.157 93.720 65.781 1.00 0.00 C ATOM 594 CD1 LEU A 39 -229.269 92.696 65.675 1.00 0.00 C ATOM 595 CD2 LEU A 39 -227.777 93.933 67.238 1.00 0.00 C ATOM 0 H LEU A 39 -227.805 91.387 63.669 1.00 0.00 H new ATOM 0 HA LEU A 39 -227.841 94.100 63.143 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -226.625 92.324 65.244 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -226.112 94.000 65.210 1.00 0.00 H new ATOM 0 HG LEU A 39 -228.532 94.658 65.371 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -230.117 93.016 66.281 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -229.580 92.603 64.635 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -228.910 91.731 66.034 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -228.663 94.210 67.808 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -227.358 93.012 67.643 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -227.037 94.730 67.308 1.00 0.00 H new ATOM 607 N CYS A 40 -224.898 92.692 62.662 1.00 0.00 N ATOM 608 CA CYS A 40 -223.558 92.853 62.106 1.00 0.00 C ATOM 609 C CYS A 40 -223.607 93.177 60.614 1.00 0.00 C ATOM 610 O CYS A 40 -222.762 93.910 60.100 1.00 0.00 O ATOM 611 CB CYS A 40 -222.745 91.575 62.339 1.00 0.00 C ATOM 612 SG CYS A 40 -221.042 91.638 61.732 1.00 0.00 S ATOM 0 H CYS A 40 -225.112 91.738 62.952 1.00 0.00 H new ATOM 0 HA CYS A 40 -223.078 93.690 62.613 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -222.727 91.362 63.408 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -223.257 90.742 61.857 1.00 0.00 H new ATOM 0 HG CYS A 40 -220.937 92.569 60.831 1.00 0.00 H new ATOM 618 N LYS A 41 -224.595 92.634 59.919 1.00 0.00 N ATOM 619 CA LYS A 41 -224.744 92.897 58.494 1.00 0.00 C ATOM 620 C LYS A 41 -225.256 94.318 58.277 1.00 0.00 C ATOM 621 O LYS A 41 -224.905 94.985 57.302 1.00 0.00 O ATOM 622 CB LYS A 41 -225.699 91.882 57.865 1.00 0.00 C ATOM 623 CG LYS A 41 -225.691 91.894 56.345 1.00 0.00 C ATOM 624 CD LYS A 41 -226.624 90.839 55.785 1.00 0.00 C ATOM 625 CE LYS A 41 -226.437 90.657 54.289 1.00 0.00 C ATOM 626 NZ LYS A 41 -226.696 91.912 53.535 1.00 0.00 N ATOM 0 H LYS A 41 -225.301 92.013 60.314 1.00 0.00 H new ATOM 0 HA LYS A 41 -223.771 92.798 58.012 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -225.434 90.884 58.213 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -226.711 92.083 58.216 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -225.992 92.878 55.985 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -224.678 91.718 55.982 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -226.446 89.890 56.292 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -227.657 91.121 55.991 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -225.420 90.319 54.090 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -227.108 89.876 53.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -226.623 91.725 52.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -227.651 92.259 53.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -225.995 92.631 53.806 1.00 0.00 H new ATOM 640 N ALA A 42 -226.069 94.782 59.213 1.00 0.00 N ATOM 641 CA ALA A 42 -226.602 96.134 59.173 1.00 0.00 C ATOM 642 C ALA A 42 -225.782 97.054 60.063 1.00 0.00 C ATOM 643 O ALA A 42 -226.260 98.090 60.536 1.00 0.00 O ATOM 644 CB ALA A 42 -228.059 96.129 59.602 1.00 0.00 C ATOM 0 H ALA A 42 -226.376 94.235 60.017 1.00 0.00 H new ATOM 0 HA ALA A 42 -226.541 96.508 58.151 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -228.451 97.145 59.570 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -228.635 95.496 58.927 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -228.138 95.742 60.618 1.00 0.00 H new ATOM 852 N ASP A 56 -233.083 93.633 72.779 1.00 0.00 N ATOM 853 CA ASP A 56 -234.468 94.051 72.567 1.00 0.00 C ATOM 854 C ASP A 56 -235.049 93.397 71.329 1.00 0.00 C ATOM 855 O ASP A 56 -236.164 93.712 70.909 1.00 0.00 O ATOM 856 CB ASP A 56 -234.559 95.576 72.437 1.00 0.00 C ATOM 857 CG ASP A 56 -234.087 96.300 73.686 1.00 0.00 C ATOM 858 OD1 ASP A 56 -234.895 96.465 74.624 1.00 0.00 O ATOM 859 OD2 ASP A 56 -232.911 96.718 73.741 1.00 0.00 O ATOM 0 HA ASP A 56 -235.047 93.733 73.434 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -233.960 95.900 71.586 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -235.591 95.858 72.227 1.00 0.00 H new ATOM 864 N TYR A 57 -234.315 92.455 70.772 1.00 0.00 N ATOM 865 CA TYR A 57 -234.730 91.796 69.550 1.00 0.00 C ATOM 866 C TYR A 57 -235.131 90.346 69.816 1.00 0.00 C ATOM 867 O TYR A 57 -234.627 89.704 70.738 1.00 0.00 O ATOM 868 CB TYR A 57 -233.595 91.816 68.516 1.00 0.00 C ATOM 869 CG TYR A 57 -233.311 93.169 67.906 1.00 0.00 C ATOM 870 CD1 TYR A 57 -232.723 94.187 68.647 1.00 0.00 C ATOM 871 CD2 TYR A 57 -233.617 93.420 66.575 1.00 0.00 C ATOM 872 CE1 TYR A 57 -232.453 95.417 68.078 1.00 0.00 C ATOM 873 CE2 TYR A 57 -233.352 94.646 65.999 1.00 0.00 C ATOM 874 CZ TYR A 57 -232.769 95.642 66.753 1.00 0.00 C ATOM 875 OH TYR A 57 -232.505 96.867 66.184 1.00 0.00 O ATOM 0 H TYR A 57 -233.425 92.128 71.148 1.00 0.00 H new ATOM 0 HA TYR A 57 -235.591 92.339 69.162 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -232.685 91.450 68.991 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -233.840 91.118 67.716 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -232.473 94.014 69.683 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -234.071 92.642 65.980 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -231.997 96.199 68.667 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -233.600 94.824 64.963 1.00 0.00 H new ATOM 0 HH TYR A 57 -232.787 96.859 65.245 1.00 0.00 H new ATOM 885 N VAL A 58 -236.052 89.858 69.006 1.00 0.00 N ATOM 886 CA VAL A 58 -236.386 88.444 68.951 1.00 0.00 C ATOM 887 C VAL A 58 -236.269 87.975 67.521 1.00 0.00 C ATOM 888 O VAL A 58 -236.296 88.781 66.589 1.00 0.00 O ATOM 889 CB VAL A 58 -237.814 88.119 69.433 1.00 0.00 C ATOM 890 CG1 VAL A 58 -237.826 87.724 70.895 1.00 0.00 C ATOM 891 CG2 VAL A 58 -238.740 89.300 69.220 1.00 0.00 C ATOM 0 H VAL A 58 -236.594 90.435 68.362 1.00 0.00 H new ATOM 0 HA VAL A 58 -235.691 87.938 69.621 1.00 0.00 H new ATOM 0 HB VAL A 58 -238.169 87.276 68.841 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -238.847 87.501 71.203 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -237.203 86.841 71.038 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -237.436 88.545 71.497 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -239.741 89.045 69.568 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -238.369 90.159 69.780 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -238.777 89.547 68.159 1.00 0.00 H new ATOM 901 N LEU A 59 -236.142 86.685 67.348 1.00 0.00 N ATOM 902 CA LEU A 59 -236.023 86.110 66.032 1.00 0.00 C ATOM 903 C LEU A 59 -237.229 85.205 65.794 1.00 0.00 C ATOM 904 O LEU A 59 -237.642 84.465 66.680 1.00 0.00 O ATOM 905 CB LEU A 59 -234.684 85.363 65.941 1.00 0.00 C ATOM 906 CG LEU A 59 -234.127 85.072 64.543 1.00 0.00 C ATOM 907 CD1 LEU A 59 -235.040 84.158 63.759 1.00 0.00 C ATOM 908 CD2 LEU A 59 -233.875 86.365 63.783 1.00 0.00 C ATOM 0 H LEU A 59 -236.118 86.007 68.109 1.00 0.00 H new ATOM 0 HA LEU A 59 -236.022 86.871 65.251 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -233.938 85.942 66.486 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -234.793 84.413 66.464 1.00 0.00 H new ATOM 0 HG LEU A 59 -233.175 84.556 64.669 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -234.612 83.974 62.773 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -235.150 83.212 64.289 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -236.017 84.628 63.648 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -233.480 86.134 62.794 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -234.810 86.915 63.681 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -233.154 86.973 64.329 1.00 0.00 H new ATOM 920 N LEU A 60 -237.822 85.317 64.620 1.00 0.00 N ATOM 921 CA LEU A 60 -239.022 84.566 64.276 1.00 0.00 C ATOM 922 C LEU A 60 -238.653 83.337 63.459 1.00 0.00 C ATOM 923 O LEU A 60 -237.896 83.442 62.497 1.00 0.00 O ATOM 924 CB LEU A 60 -239.990 85.426 63.437 1.00 0.00 C ATOM 925 CG LEU A 60 -240.670 86.642 64.117 1.00 0.00 C ATOM 926 CD1 LEU A 60 -241.801 86.202 65.011 1.00 0.00 C ATOM 927 CD2 LEU A 60 -239.687 87.503 64.899 1.00 0.00 C ATOM 0 H LEU A 60 -237.488 85.930 63.876 1.00 0.00 H new ATOM 0 HA LEU A 60 -239.506 84.274 65.208 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -239.442 85.794 62.570 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -240.777 84.771 63.062 1.00 0.00 H new ATOM 0 HG LEU A 60 -241.072 87.257 63.312 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -242.259 87.076 65.475 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -242.547 85.672 64.419 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -241.415 85.540 65.786 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -240.218 88.339 65.354 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -239.219 86.903 65.679 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -238.920 87.884 64.224 1.00 0.00 H new ATOM 939 N GLU A 61 -239.165 82.177 63.841 1.00 0.00 N ATOM 940 CA GLU A 61 -239.042 81.005 63.000 1.00 0.00 C ATOM 941 C GLU A 61 -240.329 80.852 62.189 1.00 0.00 C ATOM 942 O GLU A 61 -241.333 80.305 62.642 1.00 0.00 O ATOM 943 CB GLU A 61 -238.714 79.729 63.812 1.00 0.00 C ATOM 944 CG GLU A 61 -239.889 79.121 64.572 1.00 0.00 C ATOM 945 CD GLU A 61 -239.574 77.777 65.185 1.00 0.00 C ATOM 946 OE1 GLU A 61 -239.319 76.822 64.427 1.00 0.00 O ATOM 947 OE2 GLU A 61 -239.614 77.662 66.430 1.00 0.00 O ATOM 0 H GLU A 61 -239.663 82.026 64.718 1.00 0.00 H new ATOM 0 HA GLU A 61 -238.199 81.141 62.322 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -238.315 78.977 63.131 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -237.924 79.965 64.525 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -240.198 79.808 65.360 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -240.735 79.013 63.893 1.00 0.00 H new ATOM 954 N GLU A 62 -240.345 81.437 61.020 1.00 0.00 N ATOM 955 CA GLU A 62 -241.439 81.220 60.127 1.00 0.00 C ATOM 956 C GLU A 62 -241.165 80.000 59.270 1.00 0.00 C ATOM 957 O GLU A 62 -240.154 79.934 58.589 1.00 0.00 O ATOM 958 CB GLU A 62 -241.594 82.428 59.228 1.00 0.00 C ATOM 959 CG GLU A 62 -243.002 82.672 58.770 1.00 0.00 C ATOM 960 CD GLU A 62 -243.052 83.449 57.476 1.00 0.00 C ATOM 961 OE1 GLU A 62 -242.722 84.651 57.472 1.00 0.00 O ATOM 962 OE2 GLU A 62 -243.385 82.845 56.439 1.00 0.00 O ATOM 0 H GLU A 62 -239.617 82.061 60.671 1.00 0.00 H new ATOM 0 HA GLU A 62 -242.350 81.063 60.704 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -241.237 83.311 59.758 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -240.955 82.302 58.354 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -243.511 81.717 58.639 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -243.544 83.218 59.542 1.00 0.00 H new ATOM 969 N VAL A 63 -242.056 79.036 59.314 1.00 0.00 N ATOM 970 CA VAL A 63 -242.006 77.927 58.375 1.00 0.00 C ATOM 971 C VAL A 63 -243.209 77.996 57.438 1.00 0.00 C ATOM 972 O VAL A 63 -244.362 77.924 57.869 1.00 0.00 O ATOM 973 CB VAL A 63 -241.944 76.551 59.083 1.00 0.00 C ATOM 974 CG1 VAL A 63 -242.812 76.552 60.325 1.00 0.00 C ATOM 975 CG2 VAL A 63 -242.346 75.445 58.123 1.00 0.00 C ATOM 0 H VAL A 63 -242.823 78.993 59.985 1.00 0.00 H new ATOM 0 HA VAL A 63 -241.085 78.022 57.799 1.00 0.00 H new ATOM 0 HB VAL A 63 -240.918 76.363 59.398 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -242.756 75.577 60.809 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -242.460 77.320 61.014 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -243.845 76.760 60.047 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -242.298 74.484 58.635 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -243.364 75.619 57.773 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -241.666 75.437 57.271 1.00 0.00 H new ATOM 985 N VAL A 64 -242.931 78.163 56.157 1.00 0.00 N ATOM 986 CA VAL A 64 -243.980 78.324 55.168 1.00 0.00 C ATOM 987 C VAL A 64 -244.473 76.977 54.665 1.00 0.00 C ATOM 988 O VAL A 64 -243.705 76.189 54.115 1.00 0.00 O ATOM 989 CB VAL A 64 -243.500 79.161 53.963 1.00 0.00 C ATOM 990 CG1 VAL A 64 -244.627 79.369 52.961 1.00 0.00 C ATOM 991 CG2 VAL A 64 -242.942 80.496 54.423 1.00 0.00 C ATOM 0 H VAL A 64 -241.985 78.191 55.777 1.00 0.00 H new ATOM 0 HA VAL A 64 -244.798 78.848 55.663 1.00 0.00 H new ATOM 0 HB VAL A 64 -242.702 78.608 53.467 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -244.263 79.962 52.122 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -244.975 78.402 52.598 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -245.452 79.893 53.444 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -242.610 81.069 53.557 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -243.717 81.052 54.951 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -242.098 80.327 55.092 1.00 0.00 H new ATOM 1199 N SER A 77 -247.972 80.705 55.845 1.00 0.00 N ATOM 1200 CA SER A 77 -246.761 80.976 56.586 1.00 0.00 C ATOM 1201 C SER A 77 -246.995 80.787 58.077 1.00 0.00 C ATOM 1202 O SER A 77 -247.631 81.619 58.727 1.00 0.00 O ATOM 1203 CB SER A 77 -246.309 82.403 56.289 1.00 0.00 C ATOM 1204 OG SER A 77 -247.391 83.311 56.419 1.00 0.00 O ATOM 0 HA SER A 77 -245.982 80.278 56.280 1.00 0.00 H new ATOM 0 HB2 SER A 77 -245.508 82.685 56.972 1.00 0.00 H new ATOM 0 HB3 SER A 77 -245.902 82.458 55.279 1.00 0.00 H new ATOM 0 HG SER A 77 -248.227 82.860 56.180 1.00 0.00 H new ATOM 1210 N SER A 78 -246.511 79.679 58.615 1.00 0.00 N ATOM 1211 CA SER A 78 -246.607 79.448 60.039 1.00 0.00 C ATOM 1212 C SER A 78 -245.447 80.150 60.723 1.00 0.00 C ATOM 1213 O SER A 78 -244.335 79.628 60.781 1.00 0.00 O ATOM 1214 CB SER A 78 -246.581 77.946 60.337 1.00 0.00 C ATOM 1215 OG SER A 78 -247.568 77.265 59.577 1.00 0.00 O ATOM 0 H SER A 78 -246.053 78.935 58.089 1.00 0.00 H new ATOM 0 HA SER A 78 -247.549 79.847 60.417 1.00 0.00 H new ATOM 0 HB2 SER A 78 -245.595 77.542 60.107 1.00 0.00 H new ATOM 0 HB3 SER A 78 -246.754 77.778 61.400 1.00 0.00 H new ATOM 0 HG SER A 78 -247.534 76.307 59.780 1.00 0.00 H new ATOM 1221 N GLN A 79 -245.710 81.344 61.224 1.00 0.00 N ATOM 1222 CA GLN A 79 -244.666 82.153 61.815 1.00 0.00 C ATOM 1223 C GLN A 79 -244.680 81.996 63.328 1.00 0.00 C ATOM 1224 O GLN A 79 -245.732 82.087 63.959 1.00 0.00 O ATOM 1225 CB GLN A 79 -244.858 83.620 61.427 1.00 0.00 C ATOM 1226 CG GLN A 79 -243.683 84.507 61.797 1.00 0.00 C ATOM 1227 CD GLN A 79 -243.849 85.938 61.319 1.00 0.00 C ATOM 1228 OE1 GLN A 79 -243.385 86.880 61.962 1.00 0.00 O ATOM 1229 NE2 GLN A 79 -244.486 86.113 60.170 1.00 0.00 N ATOM 0 H GLN A 79 -246.636 81.772 61.232 1.00 0.00 H new ATOM 0 HA GLN A 79 -243.699 81.818 61.440 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -245.026 83.683 60.352 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -245.757 84.001 61.913 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -243.558 84.503 62.880 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -242.771 84.090 61.370 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -244.857 85.308 59.665 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -244.605 87.052 59.791 1.00 0.00 H new ATOM 1238 N ARG A 80 -243.519 81.756 63.900 1.00 0.00 N ATOM 1239 CA ARG A 80 -243.389 81.604 65.333 1.00 0.00 C ATOM 1240 C ARG A 80 -242.320 82.562 65.839 1.00 0.00 C ATOM 1241 O ARG A 80 -241.478 82.992 65.067 1.00 0.00 O ATOM 1242 CB ARG A 80 -242.991 80.168 65.661 1.00 0.00 C ATOM 1243 CG ARG A 80 -243.151 79.840 67.133 1.00 0.00 C ATOM 1244 CD ARG A 80 -242.407 78.575 67.526 1.00 0.00 C ATOM 1245 NE ARG A 80 -242.349 78.416 68.981 1.00 0.00 N ATOM 1246 CZ ARG A 80 -241.262 78.022 69.647 1.00 0.00 C ATOM 1247 NH1 ARG A 80 -240.145 77.720 68.998 1.00 0.00 N ATOM 1248 NH2 ARG A 80 -241.289 77.927 70.972 1.00 0.00 N ATOM 0 H ARG A 80 -242.642 81.661 63.387 1.00 0.00 H new ATOM 0 HA ARG A 80 -244.340 81.829 65.815 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -243.600 79.483 65.072 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -241.954 80.006 65.367 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -242.785 80.675 67.731 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -244.210 79.723 67.364 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -242.900 77.709 67.084 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -241.395 78.606 67.122 1.00 0.00 H new ATOM 0 HE ARG A 80 -243.192 78.619 69.518 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -240.112 77.788 67.981 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -239.319 77.420 69.516 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -242.142 78.155 71.482 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -240.457 77.626 71.479 1.00 0.00 H new ATOM 1262 N VAL A 81 -242.352 82.910 67.114 1.00 0.00 N ATOM 1263 CA VAL A 81 -241.303 83.743 67.679 1.00 0.00 C ATOM 1264 C VAL A 81 -240.459 82.915 68.640 1.00 0.00 C ATOM 1265 O VAL A 81 -240.985 82.078 69.375 1.00 0.00 O ATOM 1266 CB VAL A 81 -241.861 84.978 68.413 1.00 0.00 C ATOM 1267 CG1 VAL A 81 -240.960 86.187 68.171 1.00 0.00 C ATOM 1268 CG2 VAL A 81 -243.296 85.274 67.997 1.00 0.00 C ATOM 0 H VAL A 81 -243.082 82.634 67.770 1.00 0.00 H new ATOM 0 HA VAL A 81 -240.693 84.106 66.852 1.00 0.00 H new ATOM 0 HB VAL A 81 -241.873 84.761 69.481 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -241.365 87.053 68.695 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -239.958 85.974 68.543 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -240.914 86.398 67.103 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -243.657 86.151 68.534 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -243.332 85.465 66.925 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -243.928 84.418 68.234 1.00 0.00 H new ATOM 1278 N LEU A 82 -239.156 83.138 68.615 1.00 0.00 N ATOM 1279 CA LEU A 82 -238.218 82.343 69.394 1.00 0.00 C ATOM 1280 C LEU A 82 -237.787 83.063 70.653 1.00 0.00 C ATOM 1281 O LEU A 82 -237.738 84.292 70.700 1.00 0.00 O ATOM 1282 CB LEU A 82 -236.970 82.059 68.568 1.00 0.00 C ATOM 1283 CG LEU A 82 -237.212 81.411 67.214 1.00 0.00 C ATOM 1284 CD1 LEU A 82 -236.104 81.794 66.263 1.00 0.00 C ATOM 1285 CD2 LEU A 82 -237.304 79.902 67.352 1.00 0.00 C ATOM 0 H LEU A 82 -238.719 83.871 68.057 1.00 0.00 H new ATOM 0 HA LEU A 82 -238.727 81.418 69.666 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -236.438 82.998 68.412 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -236.312 81.412 69.148 1.00 0.00 H new ATOM 0 HG LEU A 82 -238.161 81.769 66.814 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -236.280 81.328 65.293 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -236.083 82.878 66.147 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -235.148 81.453 66.661 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -237.477 79.457 66.372 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -236.372 79.517 67.766 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -238.129 79.647 68.017 1.00 0.00 H new ATOM 1297 N LEU A 83 -237.480 82.282 71.671 1.00 0.00 N ATOM 1298 CA LEU A 83 -236.716 82.775 72.791 1.00 0.00 C ATOM 1299 C LEU A 83 -235.278 82.930 72.313 1.00 0.00 C ATOM 1300 O LEU A 83 -234.879 82.272 71.349 1.00 0.00 O ATOM 1301 CB LEU A 83 -236.800 81.793 73.965 1.00 0.00 C ATOM 1302 CG LEU A 83 -236.100 82.237 75.252 1.00 0.00 C ATOM 1303 CD1 LEU A 83 -236.733 83.510 75.799 1.00 0.00 C ATOM 1304 CD2 LEU A 83 -236.145 81.124 76.290 1.00 0.00 C ATOM 0 H LEU A 83 -237.751 81.301 71.741 1.00 0.00 H new ATOM 0 HA LEU A 83 -237.106 83.730 73.143 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -237.851 81.612 74.189 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -236.372 80.841 73.650 1.00 0.00 H new ATOM 0 HG LEU A 83 -235.057 82.451 75.021 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -236.220 83.807 76.714 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -236.647 84.306 75.059 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -237.786 83.329 76.016 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -235.643 81.454 77.200 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -237.183 80.879 76.516 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -235.641 80.240 75.898 1.00 0.00 H new ATOM 1316 N ASP A 84 -234.509 83.784 72.964 1.00 0.00 N ATOM 1317 CA ASP A 84 -233.140 84.074 72.531 1.00 0.00 C ATOM 1318 C ASP A 84 -232.322 82.795 72.344 1.00 0.00 C ATOM 1319 O ASP A 84 -231.469 82.716 71.461 1.00 0.00 O ATOM 1320 CB ASP A 84 -232.462 85.001 73.540 1.00 0.00 C ATOM 1321 CG ASP A 84 -233.221 86.302 73.721 1.00 0.00 C ATOM 1322 OD1 ASP A 84 -232.976 87.256 72.952 1.00 0.00 O ATOM 1323 OD2 ASP A 84 -234.083 86.366 74.625 1.00 0.00 O ATOM 0 H ASP A 84 -234.803 84.294 73.797 1.00 0.00 H new ATOM 0 HA ASP A 84 -233.191 84.571 71.562 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -232.381 84.493 74.501 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -231.447 85.218 73.207 1.00 0.00 H new ATOM 1328 N GLN A 85 -232.601 81.781 73.155 1.00 0.00 N ATOM 1329 CA GLN A 85 -231.887 80.526 73.080 1.00 0.00 C ATOM 1330 C GLN A 85 -232.768 79.395 72.546 1.00 0.00 C ATOM 1331 O GLN A 85 -232.440 78.221 72.725 1.00 0.00 O ATOM 1332 CB GLN A 85 -231.365 80.161 74.466 1.00 0.00 C ATOM 1333 CG GLN A 85 -232.441 80.145 75.542 1.00 0.00 C ATOM 1334 CD GLN A 85 -231.928 79.637 76.876 1.00 0.00 C ATOM 1335 OE1 GLN A 85 -230.971 78.722 76.833 1.00 0.00 O flip ATOM 1336 NE2 GLN A 85 -232.400 80.052 77.935 1.00 0.00 N flip ATOM 0 H GLN A 85 -233.323 81.811 73.875 1.00 0.00 H new ATOM 0 HA GLN A 85 -231.058 80.652 72.383 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -230.895 79.178 74.420 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -230.590 80.872 74.751 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -232.836 81.153 75.669 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -233.269 79.517 75.213 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -233.136 80.758 77.923 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -232.055 79.690 78.824 1.00 0.00 H new ATOM 1345 N GLU A 86 -233.864 79.738 71.864 1.00 0.00 N ATOM 1346 CA GLU A 86 -234.743 78.719 71.284 1.00 0.00 C ATOM 1347 C GLU A 86 -234.045 77.985 70.148 1.00 0.00 C ATOM 1348 O GLU A 86 -234.553 76.982 69.651 1.00 0.00 O ATOM 1349 CB GLU A 86 -236.043 79.344 70.783 1.00 0.00 C ATOM 1350 CG GLU A 86 -237.267 78.887 71.556 1.00 0.00 C ATOM 1351 CD GLU A 86 -237.483 77.388 71.470 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -236.935 76.656 72.318 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -238.203 76.941 70.552 1.00 0.00 O ATOM 0 H GLU A 86 -234.161 80.700 71.701 1.00 0.00 H new ATOM 0 HA GLU A 86 -234.982 78.000 72.068 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -235.965 80.429 70.849 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -236.174 79.097 69.730 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -237.161 79.176 72.602 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -238.148 79.400 71.171 1.00 0.00 H new ATOM 1360 N CYS A 87 -232.880 78.506 69.751 1.00 0.00 N ATOM 1361 CA CYS A 87 -232.039 77.877 68.748 1.00 0.00 C ATOM 1362 C CYS A 87 -232.687 77.923 67.367 1.00 0.00 C ATOM 1363 O CYS A 87 -233.636 77.206 67.101 1.00 0.00 O ATOM 1364 CB CYS A 87 -231.743 76.438 69.172 1.00 0.00 C ATOM 1365 SG CYS A 87 -230.773 76.306 70.694 1.00 0.00 S ATOM 0 H CYS A 87 -232.500 79.377 70.121 1.00 0.00 H new ATOM 0 HA CYS A 87 -231.102 78.429 68.675 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -232.686 75.908 69.307 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -231.207 75.935 68.367 1.00 0.00 H new ATOM 0 HG CYS A 87 -231.332 77.016 71.628 1.00 0.00 H new ATOM 1371 N VAL A 88 -232.173 78.774 66.484 1.00 0.00 N ATOM 1372 CA VAL A 88 -232.737 78.889 65.146 1.00 0.00 C ATOM 1373 C VAL A 88 -232.402 77.676 64.306 1.00 0.00 C ATOM 1374 O VAL A 88 -233.191 77.278 63.461 1.00 0.00 O ATOM 1375 CB VAL A 88 -232.280 80.157 64.399 1.00 0.00 C ATOM 1376 CG1 VAL A 88 -232.879 81.385 65.045 1.00 0.00 C ATOM 1377 CG2 VAL A 88 -230.766 80.261 64.353 1.00 0.00 C ATOM 0 H VAL A 88 -231.378 79.386 66.668 1.00 0.00 H new ATOM 0 HA VAL A 88 -233.815 78.958 65.291 1.00 0.00 H new ATOM 0 HB VAL A 88 -232.635 80.089 63.371 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -232.550 82.275 64.509 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -233.967 81.321 65.009 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -232.553 81.445 66.084 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -230.480 81.167 63.819 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -230.373 80.299 65.369 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -230.357 79.392 63.838 1.00 0.00 H new ATOM 1387 N PHE A 89 -231.249 77.070 64.533 1.00 0.00 N ATOM 1388 CA PHE A 89 -230.914 75.883 63.759 1.00 0.00 C ATOM 1389 C PHE A 89 -231.759 74.717 64.248 1.00 0.00 C ATOM 1390 O PHE A 89 -232.221 73.887 63.461 1.00 0.00 O ATOM 1391 CB PHE A 89 -229.416 75.546 63.800 1.00 0.00 C ATOM 1392 CG PHE A 89 -229.075 74.347 62.955 1.00 0.00 C ATOM 1393 CD1 PHE A 89 -228.776 74.498 61.610 1.00 0.00 C ATOM 1394 CD2 PHE A 89 -229.071 73.072 63.498 1.00 0.00 C ATOM 1395 CE1 PHE A 89 -228.475 73.401 60.825 1.00 0.00 C ATOM 1396 CE2 PHE A 89 -228.774 71.971 62.718 1.00 0.00 C ATOM 1397 CZ PHE A 89 -228.476 72.137 61.378 1.00 0.00 C ATOM 0 H PHE A 89 -230.552 77.363 65.218 1.00 0.00 H new ATOM 0 HA PHE A 89 -231.140 76.086 62.712 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -228.843 76.406 63.454 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -229.117 75.358 64.831 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -228.778 75.484 61.170 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -229.303 72.937 64.544 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -228.239 73.533 59.779 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -228.775 70.983 63.154 1.00 0.00 H new ATOM 0 HZ PHE A 89 -228.244 71.278 60.765 1.00 0.00 H new ATOM 1407 N GLN A 90 -231.981 74.676 65.555 1.00 0.00 N ATOM 1408 CA GLN A 90 -232.903 73.718 66.137 1.00 0.00 C ATOM 1409 C GLN A 90 -234.311 73.959 65.596 1.00 0.00 C ATOM 1410 O GLN A 90 -235.000 73.028 65.192 1.00 0.00 O ATOM 1411 CB GLN A 90 -232.895 73.828 67.661 1.00 0.00 C ATOM 1412 CG GLN A 90 -231.649 73.261 68.317 1.00 0.00 C ATOM 1413 CD GLN A 90 -231.832 73.012 69.802 1.00 0.00 C ATOM 1414 OE1 GLN A 90 -232.620 73.683 70.468 1.00 0.00 O ATOM 1415 NE2 GLN A 90 -231.098 72.044 70.327 1.00 0.00 N ATOM 0 H GLN A 90 -231.534 75.296 66.230 1.00 0.00 H new ATOM 0 HA GLN A 90 -232.585 72.712 65.863 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -232.994 74.877 67.939 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -233.769 73.310 68.057 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -231.378 72.326 67.826 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -230.819 73.951 68.168 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -230.457 71.513 69.737 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -231.173 71.829 71.321 1.00 0.00 H new ATOM 1424 N ALA A 91 -234.715 75.223 65.573 1.00 0.00 N ATOM 1425 CA ALA A 91 -235.999 75.624 65.015 1.00 0.00 C ATOM 1426 C ALA A 91 -236.121 75.172 63.568 1.00 0.00 C ATOM 1427 O ALA A 91 -237.140 74.630 63.161 1.00 0.00 O ATOM 1428 CB ALA A 91 -236.153 77.133 65.106 1.00 0.00 C ATOM 0 H ALA A 91 -234.162 75.998 65.940 1.00 0.00 H new ATOM 0 HA ALA A 91 -236.792 75.148 65.591 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -237.115 77.426 64.687 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -236.103 77.442 66.150 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -235.351 77.615 64.546 1.00 0.00 H new ATOM 1434 N GLN A 92 -235.052 75.369 62.814 1.00 0.00 N ATOM 1435 CA GLN A 92 -235.014 75.019 61.405 1.00 0.00 C ATOM 1436 C GLN A 92 -235.289 73.531 61.202 1.00 0.00 C ATOM 1437 O GLN A 92 -235.958 73.141 60.248 1.00 0.00 O ATOM 1438 CB GLN A 92 -233.651 75.384 60.826 1.00 0.00 C ATOM 1439 CG GLN A 92 -233.708 75.761 59.365 1.00 0.00 C ATOM 1440 CD GLN A 92 -232.337 75.977 58.763 1.00 0.00 C ATOM 1441 OE1 GLN A 92 -231.363 75.342 59.161 1.00 0.00 O ATOM 1442 NE2 GLN A 92 -232.249 76.879 57.798 1.00 0.00 N ATOM 0 H GLN A 92 -234.185 75.777 63.163 1.00 0.00 H new ATOM 0 HA GLN A 92 -235.793 75.579 60.887 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -233.233 76.216 61.393 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -232.972 74.540 60.951 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -234.224 74.976 58.812 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -234.297 76.671 59.252 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -233.081 77.385 57.496 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -231.349 77.068 57.357 1.00 0.00 H new ATOM 1451 N SER A 93 -234.779 72.705 62.106 1.00 0.00 N ATOM 1452 CA SER A 93 -235.002 71.264 62.025 1.00 0.00 C ATOM 1453 C SER A 93 -236.419 70.892 62.483 1.00 0.00 C ATOM 1454 O SER A 93 -236.872 69.762 62.283 1.00 0.00 O ATOM 1455 CB SER A 93 -233.950 70.503 62.843 1.00 0.00 C ATOM 1456 OG SER A 93 -233.936 70.915 64.199 1.00 0.00 O ATOM 0 H SER A 93 -234.212 73.003 62.899 1.00 0.00 H new ATOM 0 HA SER A 93 -234.902 70.971 60.980 1.00 0.00 H new ATOM 0 HB2 SER A 93 -234.153 69.433 62.791 1.00 0.00 H new ATOM 0 HB3 SER A 93 -232.965 70.662 62.405 1.00 0.00 H new ATOM 0 HG SER A 93 -234.659 71.558 64.353 1.00 0.00 H new ATOM 1462 N LYS A 94 -237.117 71.845 63.098 1.00 0.00 N ATOM 1463 CA LYS A 94 -238.493 71.640 63.525 1.00 0.00 C ATOM 1464 C LYS A 94 -239.434 71.877 62.354 1.00 0.00 C ATOM 1465 O LYS A 94 -240.575 71.403 62.343 1.00 0.00 O ATOM 1466 CB LYS A 94 -238.854 72.607 64.655 1.00 0.00 C ATOM 1467 CG LYS A 94 -237.883 72.599 65.821 1.00 0.00 C ATOM 1468 CD LYS A 94 -238.341 73.522 66.944 1.00 0.00 C ATOM 1469 CE LYS A 94 -237.271 73.658 68.018 1.00 0.00 C ATOM 1470 NZ LYS A 94 -237.701 74.537 69.137 1.00 0.00 N ATOM 0 H LYS A 94 -236.746 72.771 63.311 1.00 0.00 H new ATOM 0 HA LYS A 94 -238.593 70.616 63.884 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -238.907 73.617 64.249 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -239.849 72.359 65.025 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -237.782 71.583 66.203 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -236.897 72.909 65.475 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -238.577 74.505 66.536 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -239.257 73.132 67.387 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -237.025 72.671 68.409 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -236.361 74.060 67.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -237.096 74.365 69.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -237.618 75.533 68.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -238.690 74.329 69.381 1.00 0.00 H new ATOM 1484 N TRP A 95 -238.943 72.624 61.375 1.00 0.00 N ATOM 1485 CA TRP A 95 -239.737 73.002 60.217 1.00 0.00 C ATOM 1486 C TRP A 95 -240.133 71.799 59.394 1.00 0.00 C ATOM 1487 O TRP A 95 -239.508 70.739 59.452 1.00 0.00 O ATOM 1488 CB TRP A 95 -238.990 73.988 59.320 1.00 0.00 C ATOM 1489 CG TRP A 95 -238.747 75.311 59.958 1.00 0.00 C ATOM 1490 CD1 TRP A 95 -239.050 75.678 61.232 1.00 0.00 C ATOM 1491 CD2 TRP A 95 -238.162 76.445 59.338 1.00 0.00 C ATOM 1492 NE1 TRP A 95 -238.668 76.974 61.452 1.00 0.00 N ATOM 1493 CE2 TRP A 95 -238.122 77.475 60.294 1.00 0.00 C ATOM 1494 CE3 TRP A 95 -237.661 76.683 58.059 1.00 0.00 C ATOM 1495 CZ2 TRP A 95 -237.597 78.729 60.002 1.00 0.00 C ATOM 1496 CZ3 TRP A 95 -237.146 77.924 57.771 1.00 0.00 C ATOM 1497 CH2 TRP A 95 -237.116 78.932 58.733 1.00 0.00 C ATOM 0 H TRP A 95 -237.988 72.983 61.362 1.00 0.00 H new ATOM 0 HA TRP A 95 -240.636 73.480 60.607 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -238.033 73.552 59.033 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -239.561 74.136 58.403 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -239.523 75.040 61.964 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -238.771 77.483 62.330 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -237.677 75.907 57.309 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -237.569 79.512 60.745 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -236.758 78.122 56.783 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -236.704 79.896 58.473 1.00 0.00 H new ATOM 1508 N LYS A 96 -241.190 71.979 58.631 1.00 0.00 N ATOM 1509 CA LYS A 96 -241.653 70.952 57.709 1.00 0.00 C ATOM 1510 C LYS A 96 -242.041 71.600 56.397 1.00 0.00 C ATOM 1511 O LYS A 96 -242.760 71.033 55.578 1.00 0.00 O ATOM 1512 CB LYS A 96 -242.806 70.158 58.318 1.00 0.00 C ATOM 1513 CG LYS A 96 -242.360 69.355 59.525 1.00 0.00 C ATOM 1514 CD LYS A 96 -243.438 68.428 60.050 1.00 0.00 C ATOM 1515 CE LYS A 96 -242.938 67.670 61.269 1.00 0.00 C ATOM 1516 NZ LYS A 96 -241.606 67.045 61.021 1.00 0.00 N ATOM 0 H LYS A 96 -241.751 72.831 58.628 1.00 0.00 H new ATOM 0 HA LYS A 96 -240.849 70.241 57.517 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -243.604 70.841 58.610 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -243.221 69.486 57.567 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -241.481 68.768 59.259 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -242.058 70.039 60.318 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -244.326 69.004 60.311 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -243.732 67.724 59.271 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -242.869 68.350 62.118 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -243.658 66.897 61.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -241.404 66.351 61.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -241.613 66.567 60.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -240.871 67.781 61.024 1.00 0.00 H new ATOM 1530 N GLY A 97 -241.521 72.799 56.230 1.00 0.00 N ATOM 1531 CA GLY A 97 -241.715 73.575 55.031 1.00 0.00 C ATOM 1532 C GLY A 97 -240.643 74.632 54.957 1.00 0.00 C ATOM 1533 O GLY A 97 -239.965 74.884 55.956 1.00 0.00 O ATOM 0 H GLY A 97 -240.946 73.263 56.933 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -241.671 72.930 54.153 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -242.702 74.038 55.037 1.00 0.00 H new ATOM 1537 N ALA A 98 -240.467 75.253 53.812 1.00 0.00 N ATOM 1538 CA ALA A 98 -239.390 76.211 53.665 1.00 0.00 C ATOM 1539 C ALA A 98 -239.831 77.592 54.116 1.00 0.00 C ATOM 1540 O ALA A 98 -240.585 78.269 53.421 1.00 0.00 O ATOM 1541 CB ALA A 98 -238.884 76.244 52.231 1.00 0.00 C ATOM 0 H ALA A 98 -241.043 75.117 52.982 1.00 0.00 H new ATOM 0 HA ALA A 98 -238.566 75.894 54.304 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -238.076 76.971 52.147 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -238.515 75.257 51.953 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -239.698 76.528 51.564 1.00 0.00 H new ATOM 1547 N GLY A 99 -239.374 78.004 55.291 1.00 0.00 N ATOM 1548 CA GLY A 99 -239.745 79.299 55.797 1.00 0.00 C ATOM 1549 C GLY A 99 -238.597 80.281 55.746 1.00 0.00 C ATOM 1550 O GLY A 99 -237.741 80.214 54.863 1.00 0.00 O ATOM 0 H GLY A 99 -238.756 77.463 55.896 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -240.581 79.689 55.216 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -240.091 79.200 56.826 1.00 0.00 H new ATOM 1554 N LYS A 100 -238.581 81.183 56.711 1.00 0.00 N ATOM 1555 CA LYS A 100 -237.509 82.157 56.871 1.00 0.00 C ATOM 1556 C LYS A 100 -237.395 82.490 58.334 1.00 0.00 C ATOM 1557 O LYS A 100 -238.366 82.366 59.077 1.00 0.00 O ATOM 1558 CB LYS A 100 -237.764 83.467 56.129 1.00 0.00 C ATOM 1559 CG LYS A 100 -238.066 83.307 54.658 1.00 0.00 C ATOM 1560 CD LYS A 100 -239.371 83.985 54.322 1.00 0.00 C ATOM 1561 CE LYS A 100 -240.551 83.271 54.966 1.00 0.00 C ATOM 1562 NZ LYS A 100 -241.840 83.979 54.737 1.00 0.00 N ATOM 0 H LYS A 100 -239.317 81.263 57.413 1.00 0.00 H new ATOM 0 HA LYS A 100 -236.605 81.708 56.459 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -238.599 83.982 56.604 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -236.890 84.108 56.239 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -237.260 83.737 54.064 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -238.120 82.249 54.403 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -239.342 85.021 54.660 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -239.503 84.007 53.240 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -240.620 82.259 54.568 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -240.376 83.180 56.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -242.616 83.435 55.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -241.799 84.924 55.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -242.007 84.073 53.715 1.00 0.00 H new ATOM 1576 N PHE A 101 -236.231 82.900 58.759 1.00 0.00 N ATOM 1577 CA PHE A 101 -236.113 83.506 60.056 1.00 0.00 C ATOM 1578 C PHE A 101 -236.393 85.003 59.914 1.00 0.00 C ATOM 1579 O PHE A 101 -236.290 85.547 58.818 1.00 0.00 O ATOM 1580 CB PHE A 101 -234.738 83.193 60.635 1.00 0.00 C ATOM 1581 CG PHE A 101 -234.572 81.719 60.893 1.00 0.00 C ATOM 1582 CD1 PHE A 101 -235.088 81.146 62.044 1.00 0.00 C ATOM 1583 CD2 PHE A 101 -233.927 80.900 59.977 1.00 0.00 C ATOM 1584 CE1 PHE A 101 -234.966 79.792 62.276 1.00 0.00 C ATOM 1585 CE2 PHE A 101 -233.798 79.544 60.207 1.00 0.00 C ATOM 1586 CZ PHE A 101 -234.319 78.990 61.357 1.00 0.00 C ATOM 0 H PHE A 101 -235.360 82.827 58.233 1.00 0.00 H new ATOM 0 HA PHE A 101 -236.841 83.104 60.760 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -233.965 83.532 59.945 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -234.599 83.744 61.565 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -235.592 81.768 62.769 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -233.521 81.328 59.073 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -235.376 79.359 63.176 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -233.290 78.919 59.487 1.00 0.00 H new ATOM 0 HZ PHE A 101 -234.221 77.930 61.539 1.00 0.00 H new ATOM 1596 N ILE A 102 -236.835 85.656 60.973 1.00 0.00 N ATOM 1597 CA ILE A 102 -237.149 87.082 60.890 1.00 0.00 C ATOM 1598 C ILE A 102 -236.587 87.834 62.089 1.00 0.00 C ATOM 1599 O ILE A 102 -236.835 87.459 63.229 1.00 0.00 O ATOM 1600 CB ILE A 102 -238.679 87.358 60.805 1.00 0.00 C ATOM 1601 CG1 ILE A 102 -239.294 86.781 59.524 1.00 0.00 C ATOM 1602 CG2 ILE A 102 -238.964 88.851 60.881 1.00 0.00 C ATOM 1603 CD1 ILE A 102 -239.709 85.332 59.638 1.00 0.00 C ATOM 0 H ILE A 102 -236.985 85.235 61.890 1.00 0.00 H new ATOM 0 HA ILE A 102 -236.684 87.436 59.970 1.00 0.00 H new ATOM 0 HB ILE A 102 -239.139 86.859 61.658 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -240.165 87.377 59.251 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -238.574 86.879 58.712 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -240.039 89.020 60.820 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -238.588 89.246 61.825 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -238.469 89.358 60.053 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -240.134 85.000 58.691 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -238.838 84.722 59.879 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -240.454 85.228 60.427 1.00 0.00 H new ATOM 1615 N LEU A 103 -235.830 88.888 61.830 1.00 0.00 N ATOM 1616 CA LEU A 103 -235.320 89.731 62.899 1.00 0.00 C ATOM 1617 C LEU A 103 -236.398 90.739 63.292 1.00 0.00 C ATOM 1618 O LEU A 103 -236.947 91.430 62.430 1.00 0.00 O ATOM 1619 CB LEU A 103 -234.073 90.483 62.430 1.00 0.00 C ATOM 1620 CG LEU A 103 -233.254 91.138 63.541 1.00 0.00 C ATOM 1621 CD1 LEU A 103 -232.276 90.138 64.129 1.00 0.00 C ATOM 1622 CD2 LEU A 103 -232.522 92.364 63.026 1.00 0.00 C ATOM 0 H LEU A 103 -235.556 89.180 60.892 1.00 0.00 H new ATOM 0 HA LEU A 103 -235.057 89.108 63.754 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -233.431 89.788 61.888 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -234.378 91.254 61.722 1.00 0.00 H new ATOM 0 HG LEU A 103 -233.937 91.462 64.326 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -231.698 90.616 64.920 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -232.825 89.292 64.542 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -231.601 89.787 63.348 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -231.947 92.811 63.836 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -231.848 92.074 62.220 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -233.245 93.089 62.651 1.00 0.00 H new ATOM 1634 N LYS A 104 -236.716 90.813 64.575 1.00 0.00 N ATOM 1635 CA LYS A 104 -237.747 91.732 65.048 1.00 0.00 C ATOM 1636 C LYS A 104 -237.418 92.189 66.466 1.00 0.00 C ATOM 1637 O LYS A 104 -236.449 91.725 67.047 1.00 0.00 O ATOM 1638 CB LYS A 104 -239.111 91.035 65.032 1.00 0.00 C ATOM 1639 CG LYS A 104 -240.282 91.989 64.889 1.00 0.00 C ATOM 1640 CD LYS A 104 -240.540 92.339 63.434 1.00 0.00 C ATOM 1641 CE LYS A 104 -241.262 91.211 62.712 1.00 0.00 C ATOM 1642 NZ LYS A 104 -241.411 91.497 61.260 1.00 0.00 N ATOM 0 H LYS A 104 -236.279 90.252 65.306 1.00 0.00 H new ATOM 0 HA LYS A 104 -237.782 92.600 64.390 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -239.134 90.320 64.210 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -239.229 90.465 65.954 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -241.176 91.537 65.320 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -240.082 92.900 65.453 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -241.136 93.250 63.377 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -239.594 92.546 62.934 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -240.710 90.281 62.845 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -242.246 91.064 63.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -241.907 90.707 60.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -241.959 92.372 61.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -240.471 91.612 60.831 1.00 0.00 H new ATOM 1656 N LEU A 105 -238.211 93.099 67.022 1.00 0.00 N ATOM 1657 CA LEU A 105 -238.070 93.464 68.427 1.00 0.00 C ATOM 1658 C LEU A 105 -239.083 92.717 69.274 1.00 0.00 C ATOM 1659 O LEU A 105 -240.224 92.512 68.864 1.00 0.00 O ATOM 1660 CB LEU A 105 -238.251 94.959 68.670 1.00 0.00 C ATOM 1661 CG LEU A 105 -236.974 95.798 68.699 1.00 0.00 C ATOM 1662 CD1 LEU A 105 -236.256 95.730 67.375 1.00 0.00 C ATOM 1663 CD2 LEU A 105 -237.293 97.242 69.060 1.00 0.00 C ATOM 0 H LEU A 105 -238.952 93.594 66.526 1.00 0.00 H new ATOM 0 HA LEU A 105 -237.053 93.191 68.710 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -238.904 95.356 67.893 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -238.769 95.091 69.620 1.00 0.00 H new ATOM 0 HG LEU A 105 -236.315 95.387 69.464 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -235.351 96.335 67.421 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -235.991 94.695 67.158 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -236.907 96.110 66.588 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -236.372 97.825 69.076 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -237.974 97.660 68.319 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -237.761 97.276 70.044 1.00 0.00 H new ATOM 1675 N LYS A 106 -238.668 92.354 70.469 1.00 0.00 N ATOM 1676 CA LYS A 106 -239.492 91.557 71.367 1.00 0.00 C ATOM 1677 C LYS A 106 -240.433 92.437 72.175 1.00 0.00 C ATOM 1678 O LYS A 106 -241.459 91.981 72.668 1.00 0.00 O ATOM 1679 CB LYS A 106 -238.582 90.747 72.275 1.00 0.00 C ATOM 1680 CG LYS A 106 -237.613 91.604 73.042 1.00 0.00 C ATOM 1681 CD LYS A 106 -236.247 90.948 73.169 1.00 0.00 C ATOM 1682 CE LYS A 106 -236.273 89.712 74.044 1.00 0.00 C ATOM 1683 NZ LYS A 106 -234.934 89.062 74.121 1.00 0.00 N ATOM 0 H LYS A 106 -237.754 92.600 70.849 1.00 0.00 H new ATOM 0 HA LYS A 106 -240.115 90.880 70.782 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -239.191 90.177 72.977 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -238.027 90.026 71.676 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -237.507 92.567 72.543 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -238.013 91.803 74.036 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -235.884 90.679 72.177 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -235.540 91.667 73.583 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -236.604 89.983 75.047 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -237.000 89.002 73.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -235.050 88.053 74.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -234.447 89.162 73.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -234.369 89.517 74.866 1.00 0.00 H new