USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=21 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 6 SER OG : rot -37:sc= 0.779 USER MOD Set 1.2: A 24 LYS NZ :NH3+ -144:sc= 0.607 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 12 HIS : no HD1:sc= -1.13 X(o=-1.1,f=-0.95) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -91:sc= -0.94! USER MOD Single : A 30 THR OG1 : rot -106:sc= -1.48! USER MOD Single : A 32 GLN : amide:sc= -0.59 X(o=-0.59,f=-0.09) USER MOD Single : A 36 GLN :FLIP amide:sc= -0.0046 F(o=-1.1,f=-0.0046) USER MOD Single : A 37 GLN : amide:sc= -2.48! X(o=-2.5!,f=-2.7) USER MOD Single : A 38 THR OG1 : rot 70:sc= 1.27 USER MOD Single : A 40 CYS SG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0264) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -19:sc= 0.497 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN :FLIP amide:sc= -0.362 F(o=-1.6!,f=-0.36) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 87 CYS SG : rot 180:sc= 0 USER MOD Single : A 90 GLN :FLIP amide:sc= -0.0151 F(o=-2!,f=-0.015) USER MOD Single : A 92 GLN :FLIP amide:sc= -0.4 F(o=-2.5,f=-0.4) USER MOD Single : A 93 SER OG : rot -83:sc= 0.561 USER MOD Single : A 94 LYS NZ :NH3+ 159:sc= -0.209 (180deg=-0.837) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.052) USER MOD Single : A 104 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0971) USER MOD Single : A 106 LYS NZ :NH3+ -164:sc= -0.0485 (180deg=-0.302) USER MOD ----------------------------------------------------------------- ATOM 70 N SER A 6 -221.435 75.378 59.240 1.00 0.00 N ATOM 71 CA SER A 6 -222.061 76.585 58.757 1.00 0.00 C ATOM 72 C SER A 6 -223.348 76.221 58.025 1.00 0.00 C ATOM 73 O SER A 6 -223.405 75.217 57.315 1.00 0.00 O ATOM 74 CB SER A 6 -221.101 77.365 57.851 1.00 0.00 C ATOM 75 OG SER A 6 -220.487 76.514 56.896 1.00 0.00 O ATOM 0 HA SER A 6 -222.308 77.232 59.598 1.00 0.00 H new ATOM 0 HB2 SER A 6 -221.645 78.158 57.338 1.00 0.00 H new ATOM 0 HB3 SER A 6 -220.334 77.846 58.458 1.00 0.00 H new ATOM 0 HG SER A 6 -220.301 75.643 57.306 1.00 0.00 H new ATOM 81 N PHE A 7 -224.382 77.012 58.234 1.00 0.00 N ATOM 82 CA PHE A 7 -225.682 76.752 57.650 1.00 0.00 C ATOM 83 C PHE A 7 -226.263 78.068 57.145 1.00 0.00 C ATOM 84 O PHE A 7 -225.895 79.138 57.628 1.00 0.00 O ATOM 85 CB PHE A 7 -226.602 76.086 58.692 1.00 0.00 C ATOM 86 CG PHE A 7 -227.367 77.029 59.573 1.00 0.00 C ATOM 87 CD1 PHE A 7 -226.787 77.572 60.696 1.00 0.00 C ATOM 88 CD2 PHE A 7 -228.680 77.357 59.278 1.00 0.00 C ATOM 89 CE1 PHE A 7 -227.494 78.423 61.513 1.00 0.00 C ATOM 90 CE2 PHE A 7 -229.392 78.208 60.095 1.00 0.00 C ATOM 91 CZ PHE A 7 -228.796 78.744 61.213 1.00 0.00 C ATOM 0 H PHE A 7 -224.344 77.851 58.812 1.00 0.00 H new ATOM 0 HA PHE A 7 -225.591 76.065 56.809 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -227.313 75.448 58.168 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -225.996 75.436 59.324 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -225.764 77.327 60.939 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -229.150 76.942 58.399 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -227.025 78.840 62.392 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -230.417 78.454 59.858 1.00 0.00 H new ATOM 0 HZ PHE A 7 -229.350 79.415 61.853 1.00 0.00 H new ATOM 101 N PHE A 8 -227.149 77.995 56.172 1.00 0.00 N ATOM 102 CA PHE A 8 -227.679 79.200 55.546 1.00 0.00 C ATOM 103 C PHE A 8 -228.932 79.693 56.253 1.00 0.00 C ATOM 104 O PHE A 8 -229.837 78.913 56.563 1.00 0.00 O ATOM 105 CB PHE A 8 -227.981 78.957 54.067 1.00 0.00 C ATOM 106 CG PHE A 8 -226.755 78.869 53.208 1.00 0.00 C ATOM 107 CD1 PHE A 8 -226.122 80.021 52.773 1.00 0.00 C ATOM 108 CD2 PHE A 8 -226.241 77.640 52.829 1.00 0.00 C ATOM 109 CE1 PHE A 8 -224.996 79.949 51.979 1.00 0.00 C ATOM 110 CE2 PHE A 8 -225.115 77.562 52.032 1.00 0.00 C ATOM 111 CZ PHE A 8 -224.492 78.719 51.607 1.00 0.00 C ATOM 0 H PHE A 8 -227.518 77.122 55.796 1.00 0.00 H new ATOM 0 HA PHE A 8 -226.913 79.970 55.631 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -228.550 78.032 53.969 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -228.616 79.763 53.698 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -226.514 80.986 53.058 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -226.725 76.733 53.160 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -224.509 80.855 51.649 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -224.723 76.598 51.742 1.00 0.00 H new ATOM 0 HZ PHE A 8 -223.611 78.661 50.984 1.00 0.00 H new ATOM 121 N VAL A 9 -228.976 80.993 56.511 1.00 0.00 N ATOM 122 CA VAL A 9 -230.147 81.612 57.102 1.00 0.00 C ATOM 123 C VAL A 9 -230.706 82.660 56.177 1.00 0.00 C ATOM 124 O VAL A 9 -230.019 83.611 55.813 1.00 0.00 O ATOM 125 CB VAL A 9 -229.860 82.328 58.431 1.00 0.00 C ATOM 126 CG1 VAL A 9 -231.149 82.609 59.182 1.00 0.00 C ATOM 127 CG2 VAL A 9 -228.909 81.548 59.292 1.00 0.00 C ATOM 0 H VAL A 9 -228.210 81.638 56.318 1.00 0.00 H new ATOM 0 HA VAL A 9 -230.842 80.791 57.277 1.00 0.00 H new ATOM 0 HB VAL A 9 -229.382 83.278 58.190 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -230.921 83.116 60.119 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -231.794 83.243 58.574 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -231.659 81.669 59.393 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -228.733 82.089 60.222 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -229.338 80.571 59.516 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -227.964 81.417 58.764 1.00 0.00 H new ATOM 137 N GLN A 10 -231.938 82.489 55.796 1.00 0.00 N ATOM 138 CA GLN A 10 -232.666 83.544 55.161 1.00 0.00 C ATOM 139 C GLN A 10 -233.470 84.251 56.235 1.00 0.00 C ATOM 140 O GLN A 10 -234.424 83.697 56.773 1.00 0.00 O ATOM 141 CB GLN A 10 -233.572 82.978 54.082 1.00 0.00 C ATOM 142 CG GLN A 10 -232.829 82.229 52.989 1.00 0.00 C ATOM 143 CD GLN A 10 -233.768 81.658 51.946 1.00 0.00 C ATOM 144 OE1 GLN A 10 -234.919 81.336 52.238 1.00 0.00 O ATOM 145 NE2 GLN A 10 -233.287 81.526 50.721 1.00 0.00 N ATOM 0 H GLN A 10 -232.461 81.622 55.916 1.00 0.00 H new ATOM 0 HA GLN A 10 -231.990 84.249 54.678 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -234.295 82.305 54.544 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -234.138 83.793 53.631 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -232.120 82.902 52.507 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -232.249 81.421 53.435 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -232.327 81.804 50.517 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -233.876 81.146 49.980 1.00 0.00 H new ATOM 154 N VAL A 11 -233.061 85.456 56.572 1.00 0.00 N ATOM 155 CA VAL A 11 -233.688 86.199 57.642 1.00 0.00 C ATOM 156 C VAL A 11 -234.147 87.569 57.162 1.00 0.00 C ATOM 157 O VAL A 11 -233.373 88.348 56.627 1.00 0.00 O ATOM 158 CB VAL A 11 -232.767 86.306 58.896 1.00 0.00 C ATOM 159 CG1 VAL A 11 -231.301 86.312 58.509 1.00 0.00 C ATOM 160 CG2 VAL A 11 -233.098 87.534 59.734 1.00 0.00 C ATOM 0 H VAL A 11 -232.291 85.944 56.115 1.00 0.00 H new ATOM 0 HA VAL A 11 -234.573 85.642 57.950 1.00 0.00 H new ATOM 0 HB VAL A 11 -232.957 85.421 59.503 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -230.688 86.388 59.407 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -231.060 85.389 57.982 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -231.100 87.164 57.859 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -232.435 87.574 60.599 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -232.963 88.433 59.132 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -234.133 87.476 60.072 1.00 0.00 H new ATOM 170 N HIS A 12 -235.432 87.836 57.331 1.00 0.00 N ATOM 171 CA HIS A 12 -236.016 89.101 56.893 1.00 0.00 C ATOM 172 C HIS A 12 -235.711 90.209 57.892 1.00 0.00 C ATOM 173 O HIS A 12 -235.590 89.955 59.091 1.00 0.00 O ATOM 174 CB HIS A 12 -237.544 88.995 56.789 1.00 0.00 C ATOM 175 CG HIS A 12 -238.088 88.325 55.570 1.00 0.00 C ATOM 176 ND1 HIS A 12 -238.370 89.002 54.407 1.00 0.00 N ATOM 177 CD2 HIS A 12 -238.485 87.051 55.368 1.00 0.00 C ATOM 178 CE1 HIS A 12 -238.927 88.173 53.545 1.00 0.00 C ATOM 179 NE2 HIS A 12 -239.011 86.976 54.102 1.00 0.00 N ATOM 0 H HIS A 12 -236.094 87.195 57.768 1.00 0.00 H new ATOM 0 HA HIS A 12 -235.583 89.329 55.919 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -237.908 88.457 57.664 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -237.959 90.002 56.838 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -238.404 86.238 56.074 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -239.259 88.429 52.550 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -239.400 86.140 53.666 1.00 0.00 H new ATOM 287 N LEU A 20 -235.656 90.106 52.213 1.00 0.00 N ATOM 288 CA LEU A 20 -235.114 88.868 52.742 1.00 0.00 C ATOM 289 C LEU A 20 -233.596 88.899 52.741 1.00 0.00 C ATOM 290 O LEU A 20 -232.964 88.831 51.682 1.00 0.00 O ATOM 291 CB LEU A 20 -235.608 87.663 51.941 1.00 0.00 C ATOM 292 CG LEU A 20 -235.083 86.314 52.433 1.00 0.00 C ATOM 293 CD1 LEU A 20 -235.507 86.084 53.873 1.00 0.00 C ATOM 294 CD2 LEU A 20 -235.575 85.182 51.542 1.00 0.00 C ATOM 0 HA LEU A 20 -235.464 88.769 53.769 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -236.698 87.646 51.969 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -235.318 87.793 50.898 1.00 0.00 H new ATOM 0 HG LEU A 20 -233.994 86.329 52.386 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -235.128 85.121 54.214 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -235.102 86.877 54.502 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -236.595 86.089 53.937 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -235.188 84.233 51.913 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -236.665 85.158 51.552 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -235.225 85.343 50.522 1.00 0.00 H new ATOM 306 N THR A 21 -233.015 89.016 53.922 1.00 0.00 N ATOM 307 CA THR A 21 -231.580 88.943 54.063 1.00 0.00 C ATOM 308 C THR A 21 -231.129 87.483 53.987 1.00 0.00 C ATOM 309 O THR A 21 -231.843 86.590 54.425 1.00 0.00 O ATOM 310 CB THR A 21 -231.110 89.567 55.396 1.00 0.00 C ATOM 311 OG1 THR A 21 -231.655 90.888 55.532 1.00 0.00 O ATOM 312 CG2 THR A 21 -229.590 89.640 55.471 1.00 0.00 C ATOM 0 H THR A 21 -233.520 89.162 54.796 1.00 0.00 H new ATOM 0 HA THR A 21 -231.131 89.512 53.249 1.00 0.00 H new ATOM 0 HB THR A 21 -231.464 88.930 56.207 1.00 0.00 H new ATOM 0 HG1 THR A 21 -231.356 91.280 56.379 1.00 0.00 H new ATOM 0 HG21 THR A 21 -229.294 90.084 56.421 1.00 0.00 H new ATOM 0 HG22 THR A 21 -229.173 88.636 55.394 1.00 0.00 H new ATOM 0 HG23 THR A 21 -229.214 90.253 54.651 1.00 0.00 H new ATOM 320 N VAL A 22 -229.967 87.235 53.405 1.00 0.00 N ATOM 321 CA VAL A 22 -229.431 85.881 53.326 1.00 0.00 C ATOM 322 C VAL A 22 -228.018 85.854 53.909 1.00 0.00 C ATOM 323 O VAL A 22 -227.122 86.537 53.415 1.00 0.00 O ATOM 324 CB VAL A 22 -229.392 85.359 51.870 1.00 0.00 C ATOM 325 CG1 VAL A 22 -228.819 83.948 51.818 1.00 0.00 C ATOM 326 CG2 VAL A 22 -230.780 85.389 51.247 1.00 0.00 C ATOM 0 H VAL A 22 -229.376 87.950 52.981 1.00 0.00 H new ATOM 0 HA VAL A 22 -230.091 85.230 53.900 1.00 0.00 H new ATOM 0 HB VAL A 22 -228.742 86.018 51.294 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -228.801 83.601 50.785 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -227.805 83.952 52.217 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -229.441 83.280 52.414 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -230.728 85.018 50.224 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -231.453 84.758 51.828 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -231.155 86.413 51.243 1.00 0.00 H new ATOM 336 N ILE A 23 -227.834 85.086 54.971 1.00 0.00 N ATOM 337 CA ILE A 23 -226.538 84.969 55.629 1.00 0.00 C ATOM 338 C ILE A 23 -226.134 83.511 55.774 1.00 0.00 C ATOM 339 O ILE A 23 -226.936 82.608 55.538 1.00 0.00 O ATOM 340 CB ILE A 23 -226.539 85.606 57.037 1.00 0.00 C ATOM 341 CG1 ILE A 23 -227.815 85.238 57.798 1.00 0.00 C ATOM 342 CG2 ILE A 23 -226.376 87.117 56.946 1.00 0.00 C ATOM 343 CD1 ILE A 23 -227.831 85.738 59.227 1.00 0.00 C ATOM 0 H ILE A 23 -228.572 84.529 55.401 1.00 0.00 H new ATOM 0 HA ILE A 23 -225.827 85.501 54.996 1.00 0.00 H new ATOM 0 HB ILE A 23 -225.689 85.208 57.592 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -228.675 85.647 57.268 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -227.928 84.154 57.799 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -226.379 87.544 57.949 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -225.432 87.352 56.455 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -227.200 87.538 56.369 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -228.764 85.441 59.706 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -226.991 85.308 59.772 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -227.750 86.825 59.233 1.00 0.00 H new ATOM 355 N LYS A 24 -224.889 83.283 56.158 1.00 0.00 N ATOM 356 CA LYS A 24 -224.444 81.950 56.510 1.00 0.00 C ATOM 357 C LYS A 24 -223.950 81.965 57.950 1.00 0.00 C ATOM 358 O LYS A 24 -222.870 82.477 58.249 1.00 0.00 O ATOM 359 CB LYS A 24 -223.341 81.454 55.572 1.00 0.00 C ATOM 360 CG LYS A 24 -223.358 79.944 55.388 1.00 0.00 C ATOM 361 CD LYS A 24 -222.070 79.428 54.765 1.00 0.00 C ATOM 362 CE LYS A 24 -222.152 77.934 54.482 1.00 0.00 C ATOM 363 NZ LYS A 24 -220.827 77.359 54.125 1.00 0.00 N ATOM 0 H LYS A 24 -224.171 84.004 56.233 1.00 0.00 H new ATOM 0 HA LYS A 24 -225.283 81.261 56.408 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -223.453 81.935 54.600 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -222.371 81.756 55.967 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -223.510 79.463 56.354 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -224.202 79.666 54.757 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -221.871 79.966 53.838 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -221.234 79.628 55.435 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -222.545 77.420 55.359 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -222.855 77.758 53.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -220.952 76.620 53.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -220.213 78.109 53.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -220.389 76.945 54.972 1.00 0.00 H new ATOM 377 N ALA A 25 -224.767 81.429 58.834 1.00 0.00 N ATOM 378 CA ALA A 25 -224.498 81.439 60.258 1.00 0.00 C ATOM 379 C ALA A 25 -223.995 80.080 60.694 1.00 0.00 C ATOM 380 O ALA A 25 -224.018 79.129 59.922 1.00 0.00 O ATOM 381 CB ALA A 25 -225.771 81.824 61.001 1.00 0.00 C ATOM 0 H ALA A 25 -225.643 80.971 58.583 1.00 0.00 H new ATOM 0 HA ALA A 25 -223.725 82.171 60.490 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -225.577 81.834 62.074 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -226.093 82.815 60.681 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -226.554 81.099 60.780 1.00 0.00 H new ATOM 387 N PRO A 26 -223.509 79.968 61.923 1.00 0.00 N ATOM 388 CA PRO A 26 -223.031 78.708 62.446 1.00 0.00 C ATOM 389 C PRO A 26 -224.180 77.794 62.814 1.00 0.00 C ATOM 390 O PRO A 26 -225.201 78.257 63.300 1.00 0.00 O ATOM 391 CB PRO A 26 -222.185 79.098 63.654 1.00 0.00 C ATOM 392 CG PRO A 26 -222.361 80.573 63.856 1.00 0.00 C ATOM 393 CD PRO A 26 -223.421 81.045 62.909 1.00 0.00 C ATOM 0 HA PRO A 26 -222.452 78.141 61.717 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -222.501 78.547 64.540 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -221.136 78.855 63.485 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -222.648 80.785 64.886 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -221.424 81.098 63.671 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -224.372 81.201 63.418 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -223.149 81.993 62.444 1.00 0.00 H new ATOM 401 N ARG A 27 -224.023 76.496 62.574 1.00 0.00 N ATOM 402 CA ARG A 27 -225.109 75.540 62.796 1.00 0.00 C ATOM 403 C ARG A 27 -225.554 75.551 64.266 1.00 0.00 C ATOM 404 O ARG A 27 -226.618 75.048 64.612 1.00 0.00 O ATOM 405 CB ARG A 27 -224.676 74.134 62.380 1.00 0.00 C ATOM 406 CG ARG A 27 -224.386 74.020 60.893 1.00 0.00 C ATOM 407 CD ARG A 27 -224.131 72.582 60.470 1.00 0.00 C ATOM 408 NE ARG A 27 -223.815 72.490 59.045 1.00 0.00 N ATOM 409 CZ ARG A 27 -224.073 71.429 58.281 1.00 0.00 C ATOM 410 NH1 ARG A 27 -224.647 70.348 58.793 1.00 0.00 N ATOM 411 NH2 ARG A 27 -223.741 71.449 56.999 1.00 0.00 N ATOM 0 H ARG A 27 -223.159 76.080 62.227 1.00 0.00 H new ATOM 0 HA ARG A 27 -225.957 75.839 62.181 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -223.785 73.853 62.941 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -225.459 73.424 62.648 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -225.228 74.420 60.328 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -223.517 74.630 60.645 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -223.307 72.171 61.054 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -225.010 71.976 60.689 1.00 0.00 H new ATOM 0 HE ARG A 27 -223.366 73.294 58.605 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -224.896 70.323 59.782 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -224.839 69.542 58.198 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -223.290 72.273 56.602 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -223.936 70.640 56.409 1.00 0.00 H new ATOM 425 N VAL A 28 -224.723 76.132 65.123 1.00 0.00 N ATOM 426 CA VAL A 28 -225.046 76.281 66.533 1.00 0.00 C ATOM 427 C VAL A 28 -225.687 77.639 66.830 1.00 0.00 C ATOM 428 O VAL A 28 -226.219 77.837 67.924 1.00 0.00 O ATOM 429 CB VAL A 28 -223.801 76.115 67.433 1.00 0.00 C ATOM 430 CG1 VAL A 28 -223.195 74.733 67.262 1.00 0.00 C ATOM 431 CG2 VAL A 28 -222.768 77.197 67.135 1.00 0.00 C ATOM 0 H VAL A 28 -223.813 76.510 64.861 1.00 0.00 H new ATOM 0 HA VAL A 28 -225.759 75.488 66.759 1.00 0.00 H new ATOM 0 HB VAL A 28 -224.116 76.224 68.471 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -222.320 74.637 67.905 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -223.931 73.977 67.536 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -222.899 74.592 66.223 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -221.901 77.060 67.781 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -222.459 77.127 66.092 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -223.205 78.178 67.319 1.00 0.00 H new ATOM 441 N SER A 29 -225.633 78.578 65.877 1.00 0.00 N ATOM 442 CA SER A 29 -226.243 79.895 66.093 1.00 0.00 C ATOM 443 C SER A 29 -227.705 79.756 66.481 1.00 0.00 C ATOM 444 O SER A 29 -228.483 79.055 65.830 1.00 0.00 O ATOM 445 CB SER A 29 -226.116 80.795 64.861 1.00 0.00 C ATOM 446 OG SER A 29 -226.804 80.259 63.750 1.00 0.00 O ATOM 0 H SER A 29 -225.184 78.455 64.969 1.00 0.00 H new ATOM 0 HA SER A 29 -225.698 80.366 66.911 1.00 0.00 H new ATOM 0 HB2 SER A 29 -226.511 81.785 65.091 1.00 0.00 H new ATOM 0 HB3 SER A 29 -225.063 80.922 64.610 1.00 0.00 H new ATOM 0 HG SER A 29 -226.194 79.698 63.227 1.00 0.00 H new ATOM 452 N THR A 30 -228.060 80.381 67.579 1.00 0.00 N ATOM 453 CA THR A 30 -229.435 80.444 67.994 1.00 0.00 C ATOM 454 C THR A 30 -229.945 81.851 67.782 1.00 0.00 C ATOM 455 O THR A 30 -229.202 82.689 67.269 1.00 0.00 O ATOM 456 CB THR A 30 -229.605 79.963 69.446 1.00 0.00 C ATOM 457 OG1 THR A 30 -230.934 80.217 69.927 1.00 0.00 O ATOM 458 CG2 THR A 30 -228.595 80.604 70.379 1.00 0.00 C ATOM 0 H THR A 30 -227.407 80.855 68.203 1.00 0.00 H new ATOM 0 HA THR A 30 -230.035 79.766 67.387 1.00 0.00 H new ATOM 0 HB THR A 30 -229.429 78.887 69.438 1.00 0.00 H new ATOM 0 HG1 THR A 30 -230.916 80.967 70.557 1.00 0.00 H new ATOM 0 HG21 THR A 30 -228.752 80.236 71.393 1.00 0.00 H new ATOM 0 HG22 THR A 30 -227.586 80.351 70.053 1.00 0.00 H new ATOM 0 HG23 THR A 30 -228.720 81.687 70.363 1.00 0.00 H new ATOM 466 N ALA A 31 -231.204 82.100 68.132 1.00 0.00 N ATOM 467 CA ALA A 31 -231.839 83.370 67.829 1.00 0.00 C ATOM 468 C ALA A 31 -230.956 84.525 68.241 1.00 0.00 C ATOM 469 O ALA A 31 -230.641 85.359 67.420 1.00 0.00 O ATOM 470 CB ALA A 31 -233.201 83.466 68.500 1.00 0.00 C ATOM 0 H ALA A 31 -231.801 81.436 68.626 1.00 0.00 H new ATOM 0 HA ALA A 31 -231.987 83.425 66.750 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -233.658 84.426 68.259 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -233.841 82.659 68.142 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -233.081 83.382 69.580 1.00 0.00 H new ATOM 476 N GLN A 32 -230.488 84.519 69.480 1.00 0.00 N ATOM 477 CA GLN A 32 -229.640 85.593 69.971 1.00 0.00 C ATOM 478 C GLN A 32 -228.393 85.783 69.083 1.00 0.00 C ATOM 479 O GLN A 32 -227.989 86.914 68.818 1.00 0.00 O ATOM 480 CB GLN A 32 -229.234 85.303 71.419 1.00 0.00 C ATOM 481 CG GLN A 32 -229.208 86.532 72.315 1.00 0.00 C ATOM 482 CD GLN A 32 -228.102 87.501 71.960 1.00 0.00 C ATOM 483 OE1 GLN A 32 -226.998 87.429 72.497 1.00 0.00 O ATOM 484 NE2 GLN A 32 -228.387 88.413 71.047 1.00 0.00 N ATOM 0 H GLN A 32 -230.681 83.785 70.161 1.00 0.00 H new ATOM 0 HA GLN A 32 -230.207 86.523 69.934 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -229.927 84.574 71.840 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -228.246 84.843 71.423 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -230.168 87.044 72.247 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -229.088 86.216 73.351 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -229.315 88.439 70.625 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -227.679 89.090 70.764 1.00 0.00 H new ATOM 493 N ASP A 33 -227.810 84.693 68.580 1.00 0.00 N ATOM 494 CA ASP A 33 -226.571 84.800 67.804 1.00 0.00 C ATOM 495 C ASP A 33 -226.855 85.440 66.463 1.00 0.00 C ATOM 496 O ASP A 33 -226.248 86.436 66.069 1.00 0.00 O ATOM 497 CB ASP A 33 -225.959 83.422 67.534 1.00 0.00 C ATOM 498 CG ASP A 33 -225.439 82.724 68.770 1.00 0.00 C ATOM 499 OD1 ASP A 33 -224.387 83.133 69.300 1.00 0.00 O ATOM 500 OD2 ASP A 33 -226.065 81.733 69.197 1.00 0.00 O ATOM 0 H ASP A 33 -228.166 83.744 68.692 1.00 0.00 H new ATOM 0 HA ASP A 33 -225.876 85.403 68.389 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -226.710 82.789 67.061 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -225.142 83.533 66.821 1.00 0.00 H new ATOM 505 N VAL A 34 -227.812 84.844 65.790 1.00 0.00 N ATOM 506 CA VAL A 34 -228.238 85.250 64.472 1.00 0.00 C ATOM 507 C VAL A 34 -228.880 86.639 64.529 1.00 0.00 C ATOM 508 O VAL A 34 -228.849 87.392 63.555 1.00 0.00 O ATOM 509 CB VAL A 34 -229.180 84.184 63.903 1.00 0.00 C ATOM 510 CG1 VAL A 34 -230.580 84.327 64.445 1.00 0.00 C ATOM 511 CG2 VAL A 34 -229.127 84.193 62.398 1.00 0.00 C ATOM 0 H VAL A 34 -228.328 84.043 66.154 1.00 0.00 H new ATOM 0 HA VAL A 34 -227.382 85.331 63.802 1.00 0.00 H new ATOM 0 HB VAL A 34 -228.837 83.203 64.234 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -231.217 83.553 64.017 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -230.562 84.224 65.530 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -230.974 85.308 64.180 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -229.801 83.431 62.006 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -229.432 85.172 62.029 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -228.110 83.982 62.068 1.00 0.00 H new ATOM 521 N ILE A 35 -229.442 86.972 65.687 1.00 0.00 N ATOM 522 CA ILE A 35 -229.943 88.312 65.958 1.00 0.00 C ATOM 523 C ILE A 35 -228.825 89.335 65.750 1.00 0.00 C ATOM 524 O ILE A 35 -228.934 90.226 64.912 1.00 0.00 O ATOM 525 CB ILE A 35 -230.474 88.405 67.410 1.00 0.00 C ATOM 526 CG1 ILE A 35 -231.878 87.810 67.511 1.00 0.00 C ATOM 527 CG2 ILE A 35 -230.472 89.838 67.918 1.00 0.00 C ATOM 528 CD1 ILE A 35 -232.973 88.725 67.049 1.00 0.00 C ATOM 0 H ILE A 35 -229.562 86.320 66.462 1.00 0.00 H new ATOM 0 HA ILE A 35 -230.761 88.526 65.270 1.00 0.00 H new ATOM 0 HB ILE A 35 -229.799 87.826 68.041 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -231.914 86.893 66.922 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -232.067 87.531 68.547 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -230.851 89.862 68.940 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -229.455 90.229 67.899 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -231.109 90.451 67.280 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -233.935 88.224 67.155 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -232.968 89.632 67.653 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -232.813 88.985 66.003 1.00 0.00 H new ATOM 540 N GLN A 36 -227.724 89.156 66.476 1.00 0.00 N ATOM 541 CA GLN A 36 -226.577 90.055 66.386 1.00 0.00 C ATOM 542 C GLN A 36 -225.876 89.910 65.035 1.00 0.00 C ATOM 543 O GLN A 36 -225.342 90.877 64.507 1.00 0.00 O ATOM 544 CB GLN A 36 -225.599 89.754 67.531 1.00 0.00 C ATOM 545 CG GLN A 36 -224.202 90.337 67.344 1.00 0.00 C ATOM 546 CD GLN A 36 -224.162 91.851 67.420 1.00 0.00 C ATOM 547 OE1 GLN A 36 -225.010 92.432 68.254 1.00 0.00 O flip ATOM 548 NE2 GLN A 36 -223.352 92.495 66.753 1.00 0.00 N flip ATOM 0 H GLN A 36 -227.602 88.390 67.138 1.00 0.00 H new ATOM 0 HA GLN A 36 -226.928 91.083 66.473 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -226.018 90.140 68.460 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -225.515 88.673 67.645 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -223.540 89.925 68.106 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -223.811 90.019 66.377 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -222.714 92.012 66.120 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -223.319 93.511 66.833 1.00 0.00 H new ATOM 557 N GLN A 37 -225.867 88.704 64.480 1.00 0.00 N ATOM 558 CA GLN A 37 -225.295 88.485 63.170 1.00 0.00 C ATOM 559 C GLN A 37 -226.028 89.323 62.126 1.00 0.00 C ATOM 560 O GLN A 37 -225.406 89.937 61.259 1.00 0.00 O ATOM 561 CB GLN A 37 -225.351 87.006 62.807 1.00 0.00 C ATOM 562 CG GLN A 37 -224.336 86.635 61.755 1.00 0.00 C ATOM 563 CD GLN A 37 -224.201 85.138 61.563 1.00 0.00 C ATOM 564 OE1 GLN A 37 -224.401 84.359 62.493 1.00 0.00 O ATOM 565 NE2 GLN A 37 -223.848 84.728 60.355 1.00 0.00 N ATOM 0 H GLN A 37 -226.250 87.868 64.921 1.00 0.00 H new ATOM 0 HA GLN A 37 -224.250 88.794 63.189 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -225.178 86.408 63.702 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -226.350 86.760 62.447 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -224.619 87.093 60.807 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -223.366 87.049 62.032 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -223.692 85.408 59.611 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -223.732 83.732 60.168 1.00 0.00 H new ATOM 574 N THR A 38 -227.351 89.364 62.228 1.00 0.00 N ATOM 575 CA THR A 38 -228.150 90.215 61.358 1.00 0.00 C ATOM 576 C THR A 38 -227.878 91.690 61.672 1.00 0.00 C ATOM 577 O THR A 38 -227.816 92.522 60.772 1.00 0.00 O ATOM 578 CB THR A 38 -229.655 89.911 61.498 1.00 0.00 C ATOM 579 OG1 THR A 38 -229.878 88.502 61.357 1.00 0.00 O ATOM 580 CG2 THR A 38 -230.463 90.654 60.444 1.00 0.00 C ATOM 0 H THR A 38 -227.890 88.820 62.902 1.00 0.00 H new ATOM 0 HA THR A 38 -227.862 90.006 60.328 1.00 0.00 H new ATOM 0 HB THR A 38 -229.979 90.244 62.484 1.00 0.00 H new ATOM 0 HG1 THR A 38 -229.518 88.034 62.139 1.00 0.00 H new ATOM 0 HG21 THR A 38 -231.521 90.422 60.566 1.00 0.00 H new ATOM 0 HG22 THR A 38 -230.312 91.727 60.559 1.00 0.00 H new ATOM 0 HG23 THR A 38 -230.136 90.346 59.451 1.00 0.00 H new ATOM 588 N LEU A 39 -227.687 91.996 62.956 1.00 0.00 N ATOM 589 CA LEU A 39 -227.268 93.333 63.384 1.00 0.00 C ATOM 590 C LEU A 39 -225.980 93.747 62.672 1.00 0.00 C ATOM 591 O LEU A 39 -225.837 94.887 62.225 1.00 0.00 O ATOM 592 CB LEU A 39 -227.045 93.364 64.903 1.00 0.00 C ATOM 593 CG LEU A 39 -228.202 93.910 65.744 1.00 0.00 C ATOM 594 CD1 LEU A 39 -229.440 93.033 65.653 1.00 0.00 C ATOM 595 CD2 LEU A 39 -227.776 94.086 67.192 1.00 0.00 C ATOM 0 H LEU A 39 -227.816 91.334 63.721 1.00 0.00 H new ATOM 0 HA LEU A 39 -228.060 94.035 63.123 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -226.826 92.350 65.238 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -226.159 93.965 65.107 1.00 0.00 H new ATOM 0 HG LEU A 39 -228.466 94.885 65.334 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -230.234 93.460 66.266 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -229.771 92.978 64.616 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -229.204 92.031 66.012 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -228.612 94.475 67.773 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -227.467 93.124 67.600 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -226.942 94.786 67.243 1.00 0.00 H new ATOM 607 N CYS A 40 -225.059 92.799 62.563 1.00 0.00 N ATOM 608 CA CYS A 40 -223.759 93.030 61.949 1.00 0.00 C ATOM 609 C CYS A 40 -223.889 93.166 60.435 1.00 0.00 C ATOM 610 O CYS A 40 -223.159 93.932 59.801 1.00 0.00 O ATOM 611 CB CYS A 40 -222.812 91.875 62.303 1.00 0.00 C ATOM 612 SG CYS A 40 -221.135 92.038 61.642 1.00 0.00 S ATOM 0 H CYS A 40 -225.193 91.845 62.899 1.00 0.00 H new ATOM 0 HA CYS A 40 -223.349 93.963 62.335 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -222.753 91.792 63.388 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -223.244 90.944 61.935 1.00 0.00 H new ATOM 0 HG CYS A 40 -220.424 91.011 62.003 1.00 0.00 H new ATOM 618 N LYS A 41 -224.824 92.423 59.864 1.00 0.00 N ATOM 619 CA LYS A 41 -225.060 92.446 58.426 1.00 0.00 C ATOM 620 C LYS A 41 -225.774 93.729 58.009 1.00 0.00 C ATOM 621 O LYS A 41 -225.461 94.321 56.975 1.00 0.00 O ATOM 622 CB LYS A 41 -225.899 91.228 58.026 1.00 0.00 C ATOM 623 CG LYS A 41 -226.124 91.085 56.525 1.00 0.00 C ATOM 624 CD LYS A 41 -224.829 90.768 55.791 1.00 0.00 C ATOM 625 CE LYS A 41 -225.070 90.458 54.320 1.00 0.00 C ATOM 626 NZ LYS A 41 -225.621 91.628 53.585 1.00 0.00 N ATOM 0 H LYS A 41 -225.437 91.791 60.378 1.00 0.00 H new ATOM 0 HA LYS A 41 -224.097 92.412 57.916 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -225.409 90.327 58.395 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -226.868 91.290 58.522 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -226.851 90.294 56.339 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -226.549 92.008 56.131 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -224.147 91.614 55.876 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -224.342 89.917 56.266 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -224.133 90.148 53.857 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -225.761 89.619 54.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -225.706 91.395 52.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -226.559 91.867 53.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -224.984 92.442 53.700 1.00 0.00 H new ATOM 640 N ALA A 42 -226.718 94.162 58.832 1.00 0.00 N ATOM 641 CA ALA A 42 -227.591 95.271 58.482 1.00 0.00 C ATOM 642 C ALA A 42 -227.112 96.604 59.039 1.00 0.00 C ATOM 643 O ALA A 42 -227.757 97.633 58.816 1.00 0.00 O ATOM 644 CB ALA A 42 -229.001 94.974 58.956 1.00 0.00 C ATOM 0 H ALA A 42 -226.899 93.759 59.751 1.00 0.00 H new ATOM 0 HA ALA A 42 -227.574 95.369 57.397 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -229.656 95.805 58.694 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -229.361 94.063 58.478 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -229.001 94.840 60.038 1.00 0.00 H new ATOM 852 N ASP A 56 -233.337 93.875 72.575 1.00 0.00 N ATOM 853 CA ASP A 56 -234.735 94.228 72.314 1.00 0.00 C ATOM 854 C ASP A 56 -235.274 93.507 71.091 1.00 0.00 C ATOM 855 O ASP A 56 -236.379 93.791 70.633 1.00 0.00 O ATOM 856 CB ASP A 56 -234.902 95.739 72.125 1.00 0.00 C ATOM 857 CG ASP A 56 -234.682 96.511 73.410 1.00 0.00 C ATOM 858 OD1 ASP A 56 -235.607 96.552 74.249 1.00 0.00 O ATOM 859 OD2 ASP A 56 -233.581 97.065 73.599 1.00 0.00 O ATOM 0 HA ASP A 56 -235.305 93.913 73.188 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -234.197 96.088 71.370 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -235.903 95.946 71.747 1.00 0.00 H new ATOM 864 N TYR A 57 -234.515 92.562 70.578 1.00 0.00 N ATOM 865 CA TYR A 57 -234.932 91.828 69.397 1.00 0.00 C ATOM 866 C TYR A 57 -235.243 90.378 69.745 1.00 0.00 C ATOM 867 O TYR A 57 -234.710 89.831 70.710 1.00 0.00 O ATOM 868 CB TYR A 57 -233.836 91.848 68.326 1.00 0.00 C ATOM 869 CG TYR A 57 -233.591 93.189 67.676 1.00 0.00 C ATOM 870 CD1 TYR A 57 -232.929 94.205 68.349 1.00 0.00 C ATOM 871 CD2 TYR A 57 -234.002 93.422 66.370 1.00 0.00 C ATOM 872 CE1 TYR A 57 -232.684 95.418 67.738 1.00 0.00 C ATOM 873 CE2 TYR A 57 -233.766 94.634 65.754 1.00 0.00 C ATOM 874 CZ TYR A 57 -233.105 95.631 66.442 1.00 0.00 C ATOM 875 OH TYR A 57 -232.858 96.840 65.830 1.00 0.00 O ATOM 0 H TYR A 57 -233.610 92.283 70.956 1.00 0.00 H new ATOM 0 HA TYR A 57 -235.828 92.314 69.012 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -232.904 91.506 68.777 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -234.097 91.129 67.550 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -232.601 94.045 69.365 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -234.515 92.642 65.827 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -232.164 96.199 68.273 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -234.097 94.801 64.740 1.00 0.00 H new ATOM 0 HH TYR A 57 -233.219 96.825 64.919 1.00 0.00 H new ATOM 885 N VAL A 58 -236.107 89.774 68.952 1.00 0.00 N ATOM 886 CA VAL A 58 -236.360 88.341 69.001 1.00 0.00 C ATOM 887 C VAL A 58 -236.527 87.819 67.587 1.00 0.00 C ATOM 888 O VAL A 58 -237.089 88.499 66.727 1.00 0.00 O ATOM 889 CB VAL A 58 -237.614 87.957 69.820 1.00 0.00 C ATOM 890 CG1 VAL A 58 -237.256 87.678 71.266 1.00 0.00 C ATOM 891 CG2 VAL A 58 -238.666 89.055 69.775 1.00 0.00 C ATOM 0 H VAL A 58 -236.659 90.265 68.249 1.00 0.00 H new ATOM 0 HA VAL A 58 -235.502 87.892 69.502 1.00 0.00 H new ATOM 0 HB VAL A 58 -238.023 87.054 69.366 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -238.157 87.410 71.819 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -236.544 86.854 71.312 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -236.810 88.569 71.709 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -239.534 88.752 70.361 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -238.251 89.974 70.190 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -238.968 89.227 68.742 1.00 0.00 H new ATOM 901 N LEU A 59 -236.028 86.629 67.335 1.00 0.00 N ATOM 902 CA LEU A 59 -236.096 86.064 66.004 1.00 0.00 C ATOM 903 C LEU A 59 -237.336 85.187 65.861 1.00 0.00 C ATOM 904 O LEU A 59 -237.773 84.545 66.815 1.00 0.00 O ATOM 905 CB LEU A 59 -234.832 85.260 65.701 1.00 0.00 C ATOM 906 CG LEU A 59 -234.734 84.723 64.274 1.00 0.00 C ATOM 907 CD1 LEU A 59 -234.311 85.825 63.317 1.00 0.00 C ATOM 908 CD2 LEU A 59 -233.772 83.553 64.206 1.00 0.00 C ATOM 0 H LEU A 59 -235.573 86.036 68.029 1.00 0.00 H new ATOM 0 HA LEU A 59 -236.166 86.879 65.284 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -233.964 85.889 65.897 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -234.779 84.420 66.394 1.00 0.00 H new ATOM 0 HG LEU A 59 -235.720 84.369 63.973 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -234.247 85.424 62.306 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -235.045 86.630 63.342 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -233.337 86.213 63.616 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -233.717 83.186 63.181 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -232.782 83.876 64.529 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -234.124 82.754 64.859 1.00 0.00 H new ATOM 920 N LEU A 60 -237.910 85.196 64.672 1.00 0.00 N ATOM 921 CA LEU A 60 -239.090 84.400 64.369 1.00 0.00 C ATOM 922 C LEU A 60 -238.708 83.231 63.476 1.00 0.00 C ATOM 923 O LEU A 60 -238.052 83.421 62.461 1.00 0.00 O ATOM 924 CB LEU A 60 -240.142 85.242 63.627 1.00 0.00 C ATOM 925 CG LEU A 60 -240.962 86.251 64.456 1.00 0.00 C ATOM 926 CD1 LEU A 60 -241.969 85.528 65.322 1.00 0.00 C ATOM 927 CD2 LEU A 60 -240.073 87.146 65.306 1.00 0.00 C ATOM 0 H LEU A 60 -237.573 85.754 63.888 1.00 0.00 H new ATOM 0 HA LEU A 60 -239.504 84.044 65.312 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -239.634 85.792 62.835 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -240.840 84.558 63.144 1.00 0.00 H new ATOM 0 HG LEU A 60 -241.494 86.894 63.755 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -242.539 86.255 65.901 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -242.647 84.955 64.690 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -241.447 84.853 66.000 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -240.692 87.841 65.873 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -239.492 86.533 65.995 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -239.397 87.706 64.660 1.00 0.00 H new ATOM 939 N GLU A 61 -239.108 82.034 63.845 1.00 0.00 N ATOM 940 CA GLU A 61 -238.993 80.908 62.946 1.00 0.00 C ATOM 941 C GLU A 61 -240.290 80.799 62.146 1.00 0.00 C ATOM 942 O GLU A 61 -241.249 80.125 62.526 1.00 0.00 O ATOM 943 CB GLU A 61 -238.661 79.604 63.703 1.00 0.00 C ATOM 944 CG GLU A 61 -239.802 79.031 64.535 1.00 0.00 C ATOM 945 CD GLU A 61 -239.436 77.748 65.246 1.00 0.00 C ATOM 946 OE1 GLU A 61 -239.128 76.756 64.559 1.00 0.00 O ATOM 947 OE2 GLU A 61 -239.482 77.722 66.495 1.00 0.00 O ATOM 0 H GLU A 61 -239.513 81.816 64.755 1.00 0.00 H new ATOM 0 HA GLU A 61 -238.161 81.068 62.260 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -238.347 78.852 62.979 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -237.811 79.790 64.359 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -240.113 79.771 65.272 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -240.659 78.848 63.887 1.00 0.00 H new ATOM 954 N GLU A 62 -240.355 81.542 61.068 1.00 0.00 N ATOM 955 CA GLU A 62 -241.488 81.476 60.203 1.00 0.00 C ATOM 956 C GLU A 62 -241.298 80.357 59.200 1.00 0.00 C ATOM 957 O GLU A 62 -240.308 80.315 58.486 1.00 0.00 O ATOM 958 CB GLU A 62 -241.617 82.803 59.477 1.00 0.00 C ATOM 959 CG GLU A 62 -242.987 83.059 58.921 1.00 0.00 C ATOM 960 CD GLU A 62 -243.000 84.167 57.883 1.00 0.00 C ATOM 961 OE1 GLU A 62 -242.479 83.949 56.766 1.00 0.00 O ATOM 962 OE2 GLU A 62 -243.523 85.261 58.177 1.00 0.00 O ATOM 0 H GLU A 62 -239.631 82.198 60.776 1.00 0.00 H new ATOM 0 HA GLU A 62 -242.391 81.279 60.781 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -241.357 83.609 60.164 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -240.893 82.833 58.663 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -243.370 82.142 58.473 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -243.662 83.322 59.735 1.00 0.00 H new ATOM 969 N VAL A 63 -242.241 79.443 59.164 1.00 0.00 N ATOM 970 CA VAL A 63 -242.219 78.370 58.190 1.00 0.00 C ATOM 971 C VAL A 63 -243.447 78.463 57.288 1.00 0.00 C ATOM 972 O VAL A 63 -244.584 78.359 57.753 1.00 0.00 O ATOM 973 CB VAL A 63 -242.141 76.977 58.866 1.00 0.00 C ATOM 974 CG1 VAL A 63 -242.948 76.961 60.148 1.00 0.00 C ATOM 975 CG2 VAL A 63 -242.611 75.900 57.909 1.00 0.00 C ATOM 0 H VAL A 63 -243.038 79.420 59.801 1.00 0.00 H new ATOM 0 HA VAL A 63 -241.319 78.484 57.585 1.00 0.00 H new ATOM 0 HB VAL A 63 -241.102 76.771 59.123 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -242.881 75.975 60.608 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -242.554 77.710 60.835 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -243.991 77.187 59.924 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -242.551 74.928 58.398 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -243.643 76.097 57.618 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -241.978 75.900 57.022 1.00 0.00 H new ATOM 985 N VAL A 64 -243.213 78.696 56.001 1.00 0.00 N ATOM 986 CA VAL A 64 -244.296 78.765 55.033 1.00 0.00 C ATOM 987 C VAL A 64 -244.970 77.413 54.897 1.00 0.00 C ATOM 988 O VAL A 64 -244.433 76.480 54.299 1.00 0.00 O ATOM 989 CB VAL A 64 -243.817 79.269 53.652 1.00 0.00 C ATOM 990 CG1 VAL A 64 -244.951 79.236 52.634 1.00 0.00 C ATOM 991 CG2 VAL A 64 -243.252 80.678 53.772 1.00 0.00 C ATOM 0 H VAL A 64 -242.283 78.840 55.607 1.00 0.00 H new ATOM 0 HA VAL A 64 -245.018 79.490 55.408 1.00 0.00 H new ATOM 0 HB VAL A 64 -243.029 78.602 53.301 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -244.587 79.596 51.672 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -245.313 78.214 52.526 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -245.765 79.875 52.975 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -242.918 81.021 52.793 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -244.025 81.349 54.148 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -242.408 80.674 54.462 1.00 0.00 H new ATOM 1199 N SER A 77 -247.935 81.451 56.065 1.00 0.00 N ATOM 1200 CA SER A 77 -246.632 81.442 56.690 1.00 0.00 C ATOM 1201 C SER A 77 -246.794 81.312 58.195 1.00 0.00 C ATOM 1202 O SER A 77 -247.183 82.259 58.880 1.00 0.00 O ATOM 1203 CB SER A 77 -245.861 82.709 56.316 1.00 0.00 C ATOM 1204 OG SER A 77 -246.734 83.824 56.215 1.00 0.00 O ATOM 0 HA SER A 77 -246.057 80.588 56.332 1.00 0.00 H new ATOM 0 HB2 SER A 77 -245.096 82.908 57.066 1.00 0.00 H new ATOM 0 HB3 SER A 77 -245.346 82.559 55.367 1.00 0.00 H new ATOM 0 HG SER A 77 -247.655 83.509 56.103 1.00 0.00 H new ATOM 1210 N SER A 78 -246.534 80.114 58.696 1.00 0.00 N ATOM 1211 CA SER A 78 -246.662 79.839 60.109 1.00 0.00 C ATOM 1212 C SER A 78 -245.480 80.444 60.845 1.00 0.00 C ATOM 1213 O SER A 78 -244.389 79.876 60.872 1.00 0.00 O ATOM 1214 CB SER A 78 -246.738 78.324 60.344 1.00 0.00 C ATOM 1215 OG SER A 78 -246.954 78.014 61.710 1.00 0.00 O ATOM 0 H SER A 78 -246.232 79.316 58.137 1.00 0.00 H new ATOM 0 HA SER A 78 -247.580 80.286 60.491 1.00 0.00 H new ATOM 0 HB2 SER A 78 -247.545 77.903 59.744 1.00 0.00 H new ATOM 0 HB3 SER A 78 -245.813 77.857 60.007 1.00 0.00 H new ATOM 0 HG SER A 78 -246.998 77.041 61.822 1.00 0.00 H new ATOM 1221 N GLN A 79 -245.696 81.608 61.426 1.00 0.00 N ATOM 1222 CA GLN A 79 -244.630 82.332 62.084 1.00 0.00 C ATOM 1223 C GLN A 79 -244.641 81.991 63.569 1.00 0.00 C ATOM 1224 O GLN A 79 -245.693 82.010 64.210 1.00 0.00 O ATOM 1225 CB GLN A 79 -244.830 83.833 61.875 1.00 0.00 C ATOM 1226 CG GLN A 79 -243.572 84.653 62.093 1.00 0.00 C ATOM 1227 CD GLN A 79 -243.832 86.148 62.038 1.00 0.00 C ATOM 1228 OE1 GLN A 79 -245.043 86.552 62.388 1.00 0.00 O flip ATOM 1229 NE2 GLN A 79 -242.954 86.933 61.681 1.00 0.00 N flip ATOM 0 H GLN A 79 -246.604 82.072 61.455 1.00 0.00 H new ATOM 0 HA GLN A 79 -243.666 82.048 61.662 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -245.194 84.004 60.862 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -245.605 84.185 62.556 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -243.140 84.399 63.061 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -242.834 84.388 61.335 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -242.033 86.583 61.419 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -243.148 87.934 61.647 1.00 0.00 H new ATOM 1238 N ARG A 80 -243.483 81.658 64.105 1.00 0.00 N ATOM 1239 CA ARG A 80 -243.362 81.245 65.486 1.00 0.00 C ATOM 1240 C ARG A 80 -242.196 81.990 66.131 1.00 0.00 C ATOM 1241 O ARG A 80 -241.158 82.130 65.516 1.00 0.00 O ATOM 1242 CB ARG A 80 -243.130 79.735 65.495 1.00 0.00 C ATOM 1243 CG ARG A 80 -243.280 79.092 66.853 1.00 0.00 C ATOM 1244 CD ARG A 80 -241.980 79.130 67.635 1.00 0.00 C ATOM 1245 NE ARG A 80 -242.142 78.646 69.002 1.00 0.00 N ATOM 1246 CZ ARG A 80 -241.143 78.163 69.737 1.00 0.00 C ATOM 1247 NH1 ARG A 80 -239.945 77.974 69.196 1.00 0.00 N ATOM 1248 NH2 ARG A 80 -241.357 77.827 71.002 1.00 0.00 N ATOM 0 H ARG A 80 -242.600 81.667 63.594 1.00 0.00 H new ATOM 0 HA ARG A 80 -244.262 81.477 66.055 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -243.832 79.267 64.805 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -242.128 79.531 65.118 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -244.059 79.606 67.416 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -243.603 78.058 66.733 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -241.233 78.523 67.123 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -241.601 80.152 67.656 1.00 0.00 H new ATOM 0 HE ARG A 80 -243.073 78.680 69.418 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -239.788 78.199 68.214 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -239.182 77.604 69.763 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -242.285 77.939 71.409 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -240.593 77.457 71.568 1.00 0.00 H new ATOM 1262 N VAL A 81 -242.347 82.475 67.353 1.00 0.00 N ATOM 1263 CA VAL A 81 -241.299 83.304 67.940 1.00 0.00 C ATOM 1264 C VAL A 81 -240.392 82.496 68.863 1.00 0.00 C ATOM 1265 O VAL A 81 -240.857 81.686 69.666 1.00 0.00 O ATOM 1266 CB VAL A 81 -241.853 84.510 68.718 1.00 0.00 C ATOM 1267 CG1 VAL A 81 -240.972 85.736 68.486 1.00 0.00 C ATOM 1268 CG2 VAL A 81 -243.302 84.798 68.347 1.00 0.00 C ATOM 0 H VAL A 81 -243.161 82.317 67.947 1.00 0.00 H new ATOM 0 HA VAL A 81 -240.722 83.678 67.094 1.00 0.00 H new ATOM 0 HB VAL A 81 -241.836 84.265 69.780 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -241.374 86.583 69.042 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -239.959 85.526 68.828 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -240.954 85.975 67.423 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -243.660 85.656 68.916 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -243.368 85.016 67.281 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -243.917 83.928 68.578 1.00 0.00 H new ATOM 1278 N LEU A 82 -239.099 82.754 68.745 1.00 0.00 N ATOM 1279 CA LEU A 82 -238.072 82.012 69.466 1.00 0.00 C ATOM 1280 C LEU A 82 -237.700 82.706 70.762 1.00 0.00 C ATOM 1281 O LEU A 82 -238.079 83.851 71.006 1.00 0.00 O ATOM 1282 CB LEU A 82 -236.830 81.916 68.595 1.00 0.00 C ATOM 1283 CG LEU A 82 -237.096 81.534 67.146 1.00 0.00 C ATOM 1284 CD1 LEU A 82 -235.890 81.857 66.308 1.00 0.00 C ATOM 1285 CD2 LEU A 82 -237.446 80.067 67.032 1.00 0.00 C ATOM 0 H LEU A 82 -238.728 83.489 68.143 1.00 0.00 H new ATOM 0 HA LEU A 82 -238.464 81.022 69.699 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -236.314 82.876 68.614 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -236.153 81.182 69.031 1.00 0.00 H new ATOM 0 HG LEU A 82 -237.947 82.109 66.781 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -236.083 81.582 65.271 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -235.681 82.925 66.368 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -235.030 81.298 66.677 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -237.632 79.817 65.987 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -236.618 79.465 67.407 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -238.341 79.860 67.619 1.00 0.00 H new ATOM 1297 N LEU A 83 -236.957 81.994 71.585 1.00 0.00 N ATOM 1298 CA LEU A 83 -236.384 82.559 72.788 1.00 0.00 C ATOM 1299 C LEU A 83 -234.883 82.717 72.581 1.00 0.00 C ATOM 1300 O LEU A 83 -234.387 82.469 71.478 1.00 0.00 O ATOM 1301 CB LEU A 83 -236.665 81.668 74.008 1.00 0.00 C ATOM 1302 CG LEU A 83 -238.134 81.572 74.452 1.00 0.00 C ATOM 1303 CD1 LEU A 83 -238.965 80.757 73.471 1.00 0.00 C ATOM 1304 CD2 LEU A 83 -238.225 80.963 75.841 1.00 0.00 C ATOM 0 H LEU A 83 -236.734 81.009 71.438 1.00 0.00 H new ATOM 0 HA LEU A 83 -236.840 83.530 72.982 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -236.307 80.662 73.788 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -236.077 82.040 74.847 1.00 0.00 H new ATOM 0 HG LEU A 83 -238.539 82.584 74.474 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -239.997 80.711 73.819 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -238.933 81.228 72.488 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -238.560 79.747 73.403 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -239.270 80.901 76.143 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -237.791 79.963 75.829 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -237.679 81.587 76.548 1.00 0.00 H new ATOM 1316 N ASP A 84 -234.172 83.117 73.629 1.00 0.00 N ATOM 1317 CA ASP A 84 -232.721 83.308 73.569 1.00 0.00 C ATOM 1318 C ASP A 84 -232.026 82.125 72.899 1.00 0.00 C ATOM 1319 O ASP A 84 -231.283 82.300 71.929 1.00 0.00 O ATOM 1320 CB ASP A 84 -232.171 83.516 74.982 1.00 0.00 C ATOM 1321 CG ASP A 84 -230.654 83.525 75.053 1.00 0.00 C ATOM 1322 OD1 ASP A 84 -230.041 84.584 74.797 1.00 0.00 O ATOM 1323 OD2 ASP A 84 -230.069 82.480 75.407 1.00 0.00 O ATOM 0 H ASP A 84 -234.580 83.318 74.542 1.00 0.00 H new ATOM 0 HA ASP A 84 -232.519 84.192 72.965 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -232.550 84.460 75.374 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -232.551 82.726 75.630 1.00 0.00 H new ATOM 1328 N GLN A 85 -232.278 80.919 73.389 1.00 0.00 N ATOM 1329 CA GLN A 85 -231.675 79.744 72.807 1.00 0.00 C ATOM 1330 C GLN A 85 -232.707 78.695 72.399 1.00 0.00 C ATOM 1331 O GLN A 85 -232.803 77.627 73.007 1.00 0.00 O ATOM 1332 CB GLN A 85 -230.632 79.149 73.752 1.00 0.00 C ATOM 1333 CG GLN A 85 -230.975 79.270 75.225 1.00 0.00 C ATOM 1334 CD GLN A 85 -229.859 78.766 76.116 1.00 0.00 C ATOM 1335 OE1 GLN A 85 -229.120 77.851 75.751 1.00 0.00 O ATOM 1336 NE2 GLN A 85 -229.720 79.368 77.282 1.00 0.00 N ATOM 0 H GLN A 85 -232.892 80.736 74.183 1.00 0.00 H new ATOM 0 HA GLN A 85 -231.176 80.062 71.891 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -230.499 78.095 73.508 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -229.676 79.641 73.573 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -231.185 80.313 75.463 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -231.885 78.707 75.432 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -230.354 80.122 77.545 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -228.978 79.079 77.920 1.00 0.00 H new ATOM 1345 N GLU A 86 -233.511 79.022 71.389 1.00 0.00 N ATOM 1346 CA GLU A 86 -234.306 78.018 70.698 1.00 0.00 C ATOM 1347 C GLU A 86 -233.410 77.241 69.740 1.00 0.00 C ATOM 1348 O GLU A 86 -233.694 76.092 69.396 1.00 0.00 O ATOM 1349 CB GLU A 86 -235.429 78.694 69.917 1.00 0.00 C ATOM 1350 CG GLU A 86 -236.258 77.745 69.060 1.00 0.00 C ATOM 1351 CD GLU A 86 -237.015 76.716 69.870 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -237.820 77.116 70.735 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -236.830 75.504 69.635 1.00 0.00 O ATOM 0 H GLU A 86 -233.627 79.971 71.035 1.00 0.00 H new ATOM 0 HA GLU A 86 -234.742 77.335 71.427 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -236.090 79.201 70.620 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -234.998 79.462 69.275 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -236.967 78.325 68.469 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -235.601 77.233 68.357 1.00 0.00 H new ATOM 1360 N CYS A 87 -232.314 77.896 69.348 1.00 0.00 N ATOM 1361 CA CYS A 87 -231.382 77.388 68.348 1.00 0.00 C ATOM 1362 C CYS A 87 -231.980 77.526 66.951 1.00 0.00 C ATOM 1363 O CYS A 87 -233.044 76.998 66.674 1.00 0.00 O ATOM 1364 CB CYS A 87 -230.987 75.946 68.664 1.00 0.00 C ATOM 1365 SG CYS A 87 -229.903 75.766 70.100 1.00 0.00 S ATOM 0 H CYS A 87 -232.049 78.806 69.724 1.00 0.00 H new ATOM 0 HA CYS A 87 -230.470 77.984 68.375 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -231.892 75.363 68.832 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -230.490 75.519 67.793 1.00 0.00 H new ATOM 0 HG CYS A 87 -229.630 74.508 70.283 1.00 0.00 H new ATOM 1371 N VAL A 88 -231.290 78.252 66.076 1.00 0.00 N ATOM 1372 CA VAL A 88 -231.828 78.587 64.760 1.00 0.00 C ATOM 1373 C VAL A 88 -231.776 77.383 63.848 1.00 0.00 C ATOM 1374 O VAL A 88 -232.709 77.114 63.095 1.00 0.00 O ATOM 1375 CB VAL A 88 -231.058 79.759 64.111 1.00 0.00 C ATOM 1376 CG1 VAL A 88 -231.531 80.011 62.690 1.00 0.00 C ATOM 1377 CG2 VAL A 88 -231.220 81.011 64.941 1.00 0.00 C ATOM 0 H VAL A 88 -230.356 78.620 66.254 1.00 0.00 H new ATOM 0 HA VAL A 88 -232.864 78.895 64.901 1.00 0.00 H new ATOM 0 HB VAL A 88 -230.003 79.487 64.072 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -230.970 80.841 62.262 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -231.370 79.116 62.089 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -232.593 80.257 62.698 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -230.673 81.830 64.474 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -232.277 81.270 65.006 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -230.827 80.837 65.943 1.00 0.00 H new ATOM 1387 N PHE A 89 -230.691 76.642 63.936 1.00 0.00 N ATOM 1388 CA PHE A 89 -230.542 75.457 63.097 1.00 0.00 C ATOM 1389 C PHE A 89 -231.463 74.364 63.622 1.00 0.00 C ATOM 1390 O PHE A 89 -232.015 73.568 62.862 1.00 0.00 O ATOM 1391 CB PHE A 89 -229.075 75.003 63.030 1.00 0.00 C ATOM 1392 CG PHE A 89 -228.868 73.714 62.284 1.00 0.00 C ATOM 1393 CD1 PHE A 89 -228.882 73.692 60.898 1.00 0.00 C ATOM 1394 CD2 PHE A 89 -228.659 72.525 62.965 1.00 0.00 C ATOM 1395 CE1 PHE A 89 -228.692 72.511 60.205 1.00 0.00 C ATOM 1396 CE2 PHE A 89 -228.469 71.341 62.278 1.00 0.00 C ATOM 1397 CZ PHE A 89 -228.486 71.334 60.896 1.00 0.00 C ATOM 0 H PHE A 89 -229.910 76.828 64.565 1.00 0.00 H new ATOM 0 HA PHE A 89 -230.831 75.692 62.073 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -228.484 75.786 62.554 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -228.694 74.889 64.045 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -229.044 74.610 60.352 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -228.644 72.524 64.045 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -228.705 72.509 59.125 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -228.307 70.421 62.821 1.00 0.00 H new ATOM 0 HZ PHE A 89 -228.338 70.409 60.358 1.00 0.00 H new ATOM 1407 N GLN A 90 -231.646 74.364 64.933 1.00 0.00 N ATOM 1408 CA GLN A 90 -232.585 73.466 65.581 1.00 0.00 C ATOM 1409 C GLN A 90 -234.027 73.852 65.252 1.00 0.00 C ATOM 1410 O GLN A 90 -234.901 72.994 65.156 1.00 0.00 O ATOM 1411 CB GLN A 90 -232.370 73.490 67.089 1.00 0.00 C ATOM 1412 CG GLN A 90 -231.128 72.749 67.549 1.00 0.00 C ATOM 1413 CD GLN A 90 -231.219 72.291 68.995 1.00 0.00 C ATOM 1414 OE1 GLN A 90 -231.950 73.032 69.819 1.00 0.00 O flip ATOM 1415 NE2 GLN A 90 -230.642 71.271 69.367 1.00 0.00 N flip ATOM 0 H GLN A 90 -231.150 74.984 65.574 1.00 0.00 H new ATOM 0 HA GLN A 90 -232.408 72.457 65.208 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -232.305 74.527 67.420 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -233.242 73.054 67.577 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -230.969 71.882 66.907 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -230.259 73.397 67.432 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -230.089 70.727 68.704 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -230.716 70.968 70.338 1.00 0.00 H new ATOM 1424 N ALA A 91 -234.270 75.146 65.094 1.00 0.00 N ATOM 1425 CA ALA A 91 -235.584 75.645 64.712 1.00 0.00 C ATOM 1426 C ALA A 91 -235.870 75.302 63.259 1.00 0.00 C ATOM 1427 O ALA A 91 -236.957 74.849 62.914 1.00 0.00 O ATOM 1428 CB ALA A 91 -235.666 77.149 64.929 1.00 0.00 C ATOM 0 H ALA A 91 -233.568 75.874 65.226 1.00 0.00 H new ATOM 0 HA ALA A 91 -236.336 75.167 65.340 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -236.654 77.505 64.639 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -235.494 77.375 65.981 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -234.909 77.646 64.323 1.00 0.00 H new ATOM 1434 N GLN A 92 -234.869 75.500 62.412 1.00 0.00 N ATOM 1435 CA GLN A 92 -234.991 75.217 60.999 1.00 0.00 C ATOM 1436 C GLN A 92 -235.261 73.735 60.746 1.00 0.00 C ATOM 1437 O GLN A 92 -235.914 73.372 59.772 1.00 0.00 O ATOM 1438 CB GLN A 92 -233.720 75.651 60.277 1.00 0.00 C ATOM 1439 CG GLN A 92 -233.969 75.939 58.820 1.00 0.00 C ATOM 1440 CD GLN A 92 -232.774 76.506 58.081 1.00 0.00 C ATOM 1441 OE1 GLN A 92 -231.951 77.268 58.778 1.00 0.00 O flip ATOM 1442 NE2 GLN A 92 -232.604 76.271 56.886 1.00 0.00 N flip ATOM 0 H GLN A 92 -233.956 75.860 62.689 1.00 0.00 H new ATOM 0 HA GLN A 92 -235.841 75.779 60.612 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -233.316 76.541 60.759 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -232.966 74.869 60.368 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -234.281 75.018 58.328 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -234.799 76.641 58.738 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -233.264 75.677 56.384 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -231.803 76.670 56.397 1.00 0.00 H new ATOM 1451 N SER A 93 -234.770 72.883 61.636 1.00 0.00 N ATOM 1452 CA SER A 93 -234.979 71.446 61.506 1.00 0.00 C ATOM 1453 C SER A 93 -236.362 71.036 62.024 1.00 0.00 C ATOM 1454 O SER A 93 -236.760 69.874 61.913 1.00 0.00 O ATOM 1455 CB SER A 93 -233.864 70.688 62.235 1.00 0.00 C ATOM 1456 OG SER A 93 -233.553 71.302 63.468 1.00 0.00 O ATOM 0 H SER A 93 -234.226 73.160 62.453 1.00 0.00 H new ATOM 0 HA SER A 93 -234.942 71.184 60.449 1.00 0.00 H new ATOM 0 HB2 SER A 93 -234.173 69.657 62.407 1.00 0.00 H new ATOM 0 HB3 SER A 93 -232.973 70.654 61.608 1.00 0.00 H new ATOM 0 HG SER A 93 -232.934 72.046 63.316 1.00 0.00 H new ATOM 1462 N LYS A 94 -237.092 71.995 62.587 1.00 0.00 N ATOM 1463 CA LYS A 94 -238.460 71.767 63.030 1.00 0.00 C ATOM 1464 C LYS A 94 -239.419 71.959 61.867 1.00 0.00 C ATOM 1465 O LYS A 94 -240.527 71.422 61.858 1.00 0.00 O ATOM 1466 CB LYS A 94 -238.842 72.767 64.119 1.00 0.00 C ATOM 1467 CG LYS A 94 -237.910 72.800 65.315 1.00 0.00 C ATOM 1468 CD LYS A 94 -238.048 71.567 66.187 1.00 0.00 C ATOM 1469 CE LYS A 94 -237.187 71.691 67.428 1.00 0.00 C ATOM 1470 NZ LYS A 94 -237.451 72.963 68.151 1.00 0.00 N ATOM 0 H LYS A 94 -236.754 72.944 62.747 1.00 0.00 H new ATOM 0 HA LYS A 94 -238.523 70.750 63.417 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -238.879 73.764 63.679 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -239.848 72.535 64.468 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -236.880 72.883 64.968 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -238.118 73.689 65.911 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -239.091 71.433 66.474 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -237.756 70.681 65.623 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -237.380 70.848 68.091 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -236.135 71.642 67.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -237.139 72.872 69.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -236.929 73.737 67.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -238.470 73.171 68.127 1.00 0.00 H new ATOM 1484 N TRP A 95 -238.973 72.739 60.892 1.00 0.00 N ATOM 1485 CA TRP A 95 -239.828 73.206 59.814 1.00 0.00 C ATOM 1486 C TRP A 95 -240.400 72.086 58.972 1.00 0.00 C ATOM 1487 O TRP A 95 -239.771 71.044 58.759 1.00 0.00 O ATOM 1488 CB TRP A 95 -239.075 74.175 58.916 1.00 0.00 C ATOM 1489 CG TRP A 95 -238.836 75.496 59.556 1.00 0.00 C ATOM 1490 CD1 TRP A 95 -239.189 75.880 60.816 1.00 0.00 C ATOM 1491 CD2 TRP A 95 -238.202 76.617 58.955 1.00 0.00 C ATOM 1492 NE1 TRP A 95 -238.813 77.178 61.034 1.00 0.00 N ATOM 1493 CE2 TRP A 95 -238.204 77.656 59.902 1.00 0.00 C ATOM 1494 CE3 TRP A 95 -237.637 76.837 57.705 1.00 0.00 C ATOM 1495 CZ2 TRP A 95 -237.652 78.900 59.630 1.00 0.00 C ATOM 1496 CZ3 TRP A 95 -237.092 78.073 57.435 1.00 0.00 C ATOM 1497 CH2 TRP A 95 -237.105 79.088 58.389 1.00 0.00 C ATOM 0 H TRP A 95 -238.009 73.065 60.828 1.00 0.00 H new ATOM 0 HA TRP A 95 -240.666 73.710 60.295 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -238.118 73.734 58.637 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -239.639 74.321 57.995 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -239.692 75.252 61.537 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -238.961 77.703 61.896 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -237.625 76.055 56.960 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -237.654 79.689 60.368 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -236.648 78.258 56.468 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -236.673 80.047 58.144 1.00 0.00 H new ATOM 1508 N LYS A 96 -241.598 72.337 58.478 1.00 0.00 N ATOM 1509 CA LYS A 96 -242.285 71.408 57.587 1.00 0.00 C ATOM 1510 C LYS A 96 -242.716 72.156 56.337 1.00 0.00 C ATOM 1511 O LYS A 96 -243.592 71.728 55.587 1.00 0.00 O ATOM 1512 CB LYS A 96 -243.480 70.761 58.291 1.00 0.00 C ATOM 1513 CG LYS A 96 -243.069 69.792 59.391 1.00 0.00 C ATOM 1514 CD LYS A 96 -244.270 69.118 60.033 1.00 0.00 C ATOM 1515 CE LYS A 96 -243.838 68.070 61.045 1.00 0.00 C ATOM 1516 NZ LYS A 96 -244.999 67.343 61.620 1.00 0.00 N ATOM 0 H LYS A 96 -242.125 73.187 58.680 1.00 0.00 H new ATOM 0 HA LYS A 96 -241.608 70.602 57.304 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -244.109 71.542 58.719 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -244.085 70.231 57.555 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -242.406 69.033 58.976 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -242.503 70.328 60.153 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -244.891 69.867 60.524 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -244.883 68.651 59.262 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -243.165 67.359 60.566 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -243.277 68.549 61.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -244.662 66.637 62.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -245.629 68.018 62.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -245.521 66.864 60.858 1.00 0.00 H new ATOM 1530 N GLY A 97 -242.056 73.280 56.137 1.00 0.00 N ATOM 1531 CA GLY A 97 -242.293 74.137 55.003 1.00 0.00 C ATOM 1532 C GLY A 97 -241.103 75.052 54.817 1.00 0.00 C ATOM 1533 O GLY A 97 -240.232 75.105 55.690 1.00 0.00 O ATOM 0 H GLY A 97 -241.332 73.624 56.768 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -242.451 73.538 54.106 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -243.198 74.724 55.158 1.00 0.00 H new ATOM 1537 N ALA A 98 -241.040 75.770 53.714 1.00 0.00 N ATOM 1538 CA ALA A 98 -239.889 76.622 53.452 1.00 0.00 C ATOM 1539 C ALA A 98 -240.126 78.035 53.960 1.00 0.00 C ATOM 1540 O ALA A 98 -240.780 78.842 53.299 1.00 0.00 O ATOM 1541 CB ALA A 98 -239.564 76.634 51.969 1.00 0.00 C ATOM 0 H ALA A 98 -241.760 75.784 52.991 1.00 0.00 H new ATOM 0 HA ALA A 98 -239.035 76.212 53.991 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -238.701 77.276 51.791 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -239.337 75.621 51.638 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -240.420 77.014 51.412 1.00 0.00 H new ATOM 1547 N GLY A 99 -239.598 78.342 55.140 1.00 0.00 N ATOM 1548 CA GLY A 99 -239.825 79.644 55.713 1.00 0.00 C ATOM 1549 C GLY A 99 -238.570 80.482 55.734 1.00 0.00 C ATOM 1550 O GLY A 99 -237.685 80.307 54.898 1.00 0.00 O ATOM 0 H GLY A 99 -239.022 77.714 55.702 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -240.596 80.161 55.142 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -240.202 79.531 56.729 1.00 0.00 H new ATOM 1554 N LYS A 100 -238.505 81.390 56.695 1.00 0.00 N ATOM 1555 CA LYS A 100 -237.336 82.230 56.917 1.00 0.00 C ATOM 1556 C LYS A 100 -237.333 82.627 58.370 1.00 0.00 C ATOM 1557 O LYS A 100 -238.384 82.631 59.011 1.00 0.00 O ATOM 1558 CB LYS A 100 -237.332 83.520 56.072 1.00 0.00 C ATOM 1559 CG LYS A 100 -237.674 83.342 54.613 1.00 0.00 C ATOM 1560 CD LYS A 100 -239.177 83.387 54.418 1.00 0.00 C ATOM 1561 CE LYS A 100 -239.542 83.327 52.957 1.00 0.00 C ATOM 1562 NZ LYS A 100 -239.143 82.036 52.326 1.00 0.00 N ATOM 0 H LYS A 100 -239.268 81.567 57.349 1.00 0.00 H new ATOM 0 HA LYS A 100 -236.458 81.654 56.626 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -238.041 84.223 56.510 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -236.345 83.977 56.143 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -237.200 84.126 54.023 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -237.282 82.391 54.253 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -239.639 82.552 54.945 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -239.576 84.301 54.857 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -240.618 83.465 52.848 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -239.060 84.151 52.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -239.532 81.985 51.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -238.106 81.976 52.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -239.513 81.245 52.891 1.00 0.00 H new ATOM 1576 N PHE A 101 -236.181 82.937 58.907 1.00 0.00 N ATOM 1577 CA PHE A 101 -236.134 83.503 60.231 1.00 0.00 C ATOM 1578 C PHE A 101 -236.332 85.014 60.137 1.00 0.00 C ATOM 1579 O PHE A 101 -235.675 85.683 59.366 1.00 0.00 O ATOM 1580 CB PHE A 101 -234.820 83.113 60.901 1.00 0.00 C ATOM 1581 CG PHE A 101 -234.692 81.619 61.036 1.00 0.00 C ATOM 1582 CD1 PHE A 101 -235.214 80.964 62.139 1.00 0.00 C ATOM 1583 CD2 PHE A 101 -234.084 80.865 60.042 1.00 0.00 C ATOM 1584 CE1 PHE A 101 -235.127 79.591 62.253 1.00 0.00 C ATOM 1585 CE2 PHE A 101 -234.000 79.491 60.147 1.00 0.00 C ATOM 1586 CZ PHE A 101 -234.522 78.853 61.254 1.00 0.00 C ATOM 0 H PHE A 101 -235.275 82.810 58.456 1.00 0.00 H new ATOM 0 HA PHE A 101 -236.938 83.111 60.854 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -233.984 83.500 60.318 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -234.762 83.575 61.887 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -235.695 81.534 62.920 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -233.671 81.360 59.175 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -235.532 79.094 63.122 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -233.527 78.916 59.364 1.00 0.00 H new ATOM 0 HZ PHE A 101 -234.458 77.778 61.339 1.00 0.00 H new ATOM 1596 N ILE A 102 -237.282 85.544 60.879 1.00 0.00 N ATOM 1597 CA ILE A 102 -237.618 86.959 60.778 1.00 0.00 C ATOM 1598 C ILE A 102 -237.038 87.734 61.955 1.00 0.00 C ATOM 1599 O ILE A 102 -237.282 87.398 63.112 1.00 0.00 O ATOM 1600 CB ILE A 102 -239.157 87.178 60.702 1.00 0.00 C ATOM 1601 CG1 ILE A 102 -239.684 86.995 59.270 1.00 0.00 C ATOM 1602 CG2 ILE A 102 -239.544 88.558 61.213 1.00 0.00 C ATOM 1603 CD1 ILE A 102 -239.487 85.610 58.691 1.00 0.00 C ATOM 0 H ILE A 102 -237.837 85.023 61.558 1.00 0.00 H new ATOM 0 HA ILE A 102 -237.178 87.334 59.854 1.00 0.00 H new ATOM 0 HB ILE A 102 -239.614 86.422 61.341 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -240.748 87.230 59.257 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -239.190 87.718 58.621 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -240.625 88.680 61.147 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -239.230 88.663 62.251 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -239.055 89.321 60.607 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -239.890 85.578 57.679 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -238.423 85.374 58.666 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -240.006 84.879 59.311 1.00 0.00 H new ATOM 1615 N LEU A 103 -236.251 88.761 61.655 1.00 0.00 N ATOM 1616 CA LEU A 103 -235.679 89.602 62.693 1.00 0.00 C ATOM 1617 C LEU A 103 -236.703 90.637 63.138 1.00 0.00 C ATOM 1618 O LEU A 103 -236.984 91.596 62.417 1.00 0.00 O ATOM 1619 CB LEU A 103 -234.422 90.314 62.192 1.00 0.00 C ATOM 1620 CG LEU A 103 -233.534 90.896 63.294 1.00 0.00 C ATOM 1621 CD1 LEU A 103 -232.627 89.818 63.858 1.00 0.00 C ATOM 1622 CD2 LEU A 103 -232.723 92.072 62.777 1.00 0.00 C ATOM 0 H LEU A 103 -235.997 89.029 60.704 1.00 0.00 H new ATOM 0 HA LEU A 103 -235.405 88.966 63.535 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -233.833 89.611 61.603 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -234.720 91.120 61.521 1.00 0.00 H new ATOM 0 HG LEU A 103 -234.175 91.264 64.095 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -232.000 90.243 64.641 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -233.233 89.014 64.275 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -231.996 89.421 63.063 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -232.101 92.466 63.581 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -232.088 91.743 61.955 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -233.398 92.852 62.424 1.00 0.00 H new ATOM 1634 N LYS A 104 -237.273 90.435 64.309 1.00 0.00 N ATOM 1635 CA LYS A 104 -238.275 91.347 64.827 1.00 0.00 C ATOM 1636 C LYS A 104 -237.870 91.818 66.218 1.00 0.00 C ATOM 1637 O LYS A 104 -236.904 91.317 66.787 1.00 0.00 O ATOM 1638 CB LYS A 104 -239.646 90.663 64.852 1.00 0.00 C ATOM 1639 CG LYS A 104 -240.804 91.647 64.833 1.00 0.00 C ATOM 1640 CD LYS A 104 -242.143 90.945 64.696 1.00 0.00 C ATOM 1641 CE LYS A 104 -242.257 90.165 63.393 1.00 0.00 C ATOM 1642 NZ LYS A 104 -242.173 91.046 62.199 1.00 0.00 N ATOM 0 H LYS A 104 -237.060 89.647 64.921 1.00 0.00 H new ATOM 0 HA LYS A 104 -238.345 92.218 64.176 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -239.729 89.997 63.993 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -239.719 90.042 65.745 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -240.795 92.235 65.750 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -240.674 92.345 64.006 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -242.282 90.265 65.537 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -242.944 91.682 64.746 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -241.463 89.419 63.348 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -243.204 89.625 63.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -242.407 90.498 61.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -242.846 91.833 62.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -241.208 91.424 62.114 1.00 0.00 H new ATOM 1656 N LEU A 105 -238.584 92.787 66.760 1.00 0.00 N ATOM 1657 CA LEU A 105 -238.317 93.235 68.111 1.00 0.00 C ATOM 1658 C LEU A 105 -239.196 92.471 69.070 1.00 0.00 C ATOM 1659 O LEU A 105 -240.193 91.886 68.673 1.00 0.00 O ATOM 1660 CB LEU A 105 -238.589 94.725 68.298 1.00 0.00 C ATOM 1661 CG LEU A 105 -237.361 95.628 68.397 1.00 0.00 C ATOM 1662 CD1 LEU A 105 -236.583 95.635 67.103 1.00 0.00 C ATOM 1663 CD2 LEU A 105 -237.777 97.038 68.778 1.00 0.00 C ATOM 0 H LEU A 105 -239.346 93.274 66.289 1.00 0.00 H new ATOM 0 HA LEU A 105 -237.260 93.055 68.306 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -239.201 95.069 67.464 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -239.183 94.854 69.203 1.00 0.00 H new ATOM 0 HG LEU A 105 -236.709 95.232 69.175 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -235.715 96.286 67.204 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -236.252 94.622 66.872 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -237.220 96.001 66.298 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -236.893 97.672 68.846 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -238.452 97.436 68.020 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -238.285 97.019 69.742 1.00 0.00 H new ATOM 1675 N LYS A 106 -238.831 92.494 70.331 1.00 0.00 N ATOM 1676 CA LYS A 106 -239.649 91.890 71.368 1.00 0.00 C ATOM 1677 C LYS A 106 -240.608 92.923 71.926 1.00 0.00 C ATOM 1678 O LYS A 106 -241.482 92.627 72.733 1.00 0.00 O ATOM 1679 CB LYS A 106 -238.764 91.323 72.452 1.00 0.00 C ATOM 1680 CG LYS A 106 -237.772 92.318 72.976 1.00 0.00 C ATOM 1681 CD LYS A 106 -236.816 91.692 73.970 1.00 0.00 C ATOM 1682 CE LYS A 106 -237.529 91.283 75.241 1.00 0.00 C ATOM 1683 NZ LYS A 106 -238.067 92.462 75.976 1.00 0.00 N ATOM 0 H LYS A 106 -237.970 92.925 70.669 1.00 0.00 H new ATOM 0 HA LYS A 106 -240.234 91.073 70.947 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -239.386 90.970 73.275 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -238.230 90.456 72.062 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -237.207 92.740 72.145 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -238.302 93.143 73.452 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -236.341 90.820 73.521 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -236.022 92.400 74.208 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -238.345 90.603 74.997 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -236.840 90.736 75.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -238.302 92.186 76.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -237.351 93.216 75.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -238.923 92.808 75.498 1.00 0.00 H new