USER MOD reduce.3.24.130724 H: found=0, std=0, add=922, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 924 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 51 TYR OH : rot 30:sc= 0.234 USER MOD Set 1.2: A 149 SER OG : rot 121:sc= 0.272 USER MOD Set 2.1: A 130 ASN :FLIP amide:sc= 0 F(o=0.12,f=0.68) USER MOD Set 2.2: A 135 THR OG1 : rot -70:sc= 0.684 USER MOD Set 3.1: A 82 GLN : amide:sc= -2.63! C(o=-2.8!,f=-6.7!) USER MOD Set 3.2: A 114 GLN : amide:sc= -0.125 K(o=-2.8,f=-6.4!) USER MOD Set 4.1: A 102 ASN : amide:sc= 0.438 X(o=0.83,f=0.34) USER MOD Set 4.2: A 106 GLN : amide:sc= 0.387 X(o=0.83,f=0.34) USER MOD Set 5.1: A 32 LYS NZ :NH3+ 170:sc= 0.893 (180deg=0) USER MOD Set 5.2: A 34 THR OG1 : rot -100:sc= 0.789 USER MOD Single : A 27 THR OG1 : rot 84:sc= 1.11 USER MOD Single : A 29 GLN : amide:sc= 1.25 K(o=1.3,f=-3.9!) USER MOD Single : A 31 HIS : no HE2:sc= 1.17 K(o=1.2,f=-3.5!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot -154:sc= 0.282 USER MOD Single : A 48 GLN : amide:sc= 0.871 K(o=0.87,f=0) USER MOD Single : A 50 LYS NZ :NH3+ -170:sc= 1.22 (180deg=0.988) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 76 LYS NZ :NH3+ -136:sc= 1.25 (180deg=0.109) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.0543 X(o=-0.054,f=-0.054) USER MOD Single : A 87 TYR OH : rot 180:sc= -0.823 USER MOD Single : A 101 CYS SG : rot 130:sc= -0.041 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 GLN : amide:sc= 0.53 K(o=0.53,f=0) USER MOD Single : A 115 SER OG : rot -48:sc= 0.0159 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0.0832 USER MOD Single : A 137 SER OG : rot -81:sc= 0.239 USER MOD Single : A 138 ASN : amide:sc= 0.456 K(o=0.46,f=-2.6) USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 THR OG1 : rot -51:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 4.598 -0.170 -0.214 1.00 1.00 N ATOM 21 CA ALA A 2 6.013 0.108 -0.491 1.00 1.00 C ATOM 22 C ALA A 2 6.699 -0.711 -1.593 1.00 1.00 C ATOM 23 O ALA A 2 6.193 -1.724 -2.073 1.00 1.00 O ATOM 24 CB ALA A 2 6.769 -0.117 0.820 1.00 1.00 C ATOM 0 HA ALA A 2 6.039 1.128 -0.875 1.00 1.00 H new ATOM 0 HB1 ALA A 2 7.830 0.078 0.666 1.00 1.00 H new ATOM 0 HB2 ALA A 2 6.383 0.559 1.583 1.00 1.00 H new ATOM 0 HB3 ALA A 2 6.633 -1.148 1.146 1.00 1.00 H new ATOM 30 N GLU A 3 7.932 -0.291 -1.888 1.00 1.00 N ATOM 31 CA GLU A 3 8.883 -0.943 -2.788 1.00 1.00 C ATOM 32 C GLU A 3 10.177 -1.263 -2.030 1.00 1.00 C ATOM 33 O GLU A 3 10.763 -0.376 -1.407 1.00 1.00 O ATOM 34 CB GLU A 3 9.192 -0.016 -3.974 1.00 1.00 C ATOM 35 CG GLU A 3 8.394 -0.407 -5.210 1.00 1.00 C ATOM 36 CD GLU A 3 8.820 0.404 -6.449 1.00 1.00 C ATOM 37 OE1 GLU A 3 9.744 -0.037 -7.175 1.00 1.00 O ATOM 38 OE2 GLU A 3 8.210 1.464 -6.723 1.00 1.00 O1- ATOM 0 H GLU A 3 8.314 0.563 -1.481 1.00 1.00 H new ATOM 0 HA GLU A 3 8.447 -1.870 -3.161 1.00 1.00 H new ATOM 0 HB2 GLU A 3 8.962 1.014 -3.702 1.00 1.00 H new ATOM 0 HB3 GLU A 3 10.258 -0.055 -4.200 1.00 1.00 H new ATOM 0 HG2 GLU A 3 8.529 -1.470 -5.408 1.00 1.00 H new ATOM 0 HG3 GLU A 3 7.332 -0.250 -5.021 1.00 1.00 H new ATOM 45 N ILE A 4 10.608 -2.526 -2.086 1.00 1.00 N ATOM 46 CA ILE A 4 11.810 -3.072 -1.470 1.00 1.00 C ATOM 47 C ILE A 4 12.723 -3.747 -2.487 1.00 1.00 C ATOM 48 O ILE A 4 12.415 -4.813 -3.017 1.00 1.00 O ATOM 49 CB ILE A 4 11.480 -4.055 -0.335 1.00 1.00 C ATOM 50 CG1 ILE A 4 10.459 -3.450 0.650 1.00 1.00 C ATOM 51 CG2 ILE A 4 12.749 -4.367 0.457 1.00 1.00 C ATOM 52 CD1 ILE A 4 9.135 -4.180 0.563 1.00 1.00 C ATOM 0 H ILE A 4 10.088 -3.238 -2.599 1.00 1.00 H new ATOM 0 HA ILE A 4 12.341 -2.220 -1.046 1.00 1.00 H new ATOM 0 HB ILE A 4 11.064 -4.954 -0.790 1.00 1.00 H new ATOM 0 HG12 ILE A 4 10.847 -3.510 1.667 1.00 1.00 H new ATOM 0 HG13 ILE A 4 10.313 -2.393 0.427 1.00 1.00 H new ATOM 0 HG21 ILE A 4 12.514 -5.064 1.261 1.00 1.00 H new ATOM 0 HG22 ILE A 4 13.490 -4.814 -0.205 1.00 1.00 H new ATOM 0 HG23 ILE A 4 13.149 -3.446 0.881 1.00 1.00 H new ATOM 0 HD11 ILE A 4 8.429 -3.738 1.266 1.00 1.00 H new ATOM 0 HD12 ILE A 4 8.740 -4.097 -0.449 1.00 1.00 H new ATOM 0 HD13 ILE A 4 9.282 -5.231 0.810 1.00 1.00 H new ATOM 64 N GLY A 5 13.900 -3.180 -2.690 1.00 1.00 N ATOM 65 CA GLY A 5 14.951 -3.837 -3.462 1.00 1.00 C ATOM 66 C GLY A 5 15.850 -4.643 -2.547 1.00 1.00 C ATOM 67 O GLY A 5 16.377 -4.095 -1.588 1.00 1.00 O ATOM 0 H GLY A 5 14.157 -2.261 -2.330 1.00 1.00 H new ATOM 0 HA2 GLY A 5 14.506 -4.490 -4.213 1.00 1.00 H new ATOM 0 HA3 GLY A 5 15.539 -3.091 -3.996 1.00 1.00 H new ATOM 71 N ILE A 6 16.017 -5.935 -2.807 1.00 1.00 N ATOM 72 CA ILE A 6 16.850 -6.819 -2.000 1.00 1.00 C ATOM 73 C ILE A 6 18.151 -7.099 -2.729 1.00 1.00 C ATOM 74 O ILE A 6 18.154 -7.683 -3.808 1.00 1.00 O ATOM 75 CB ILE A 6 16.101 -8.106 -1.681 1.00 1.00 C ATOM 76 CG1 ILE A 6 14.835 -7.740 -0.889 1.00 1.00 C ATOM 77 CG2 ILE A 6 16.961 -9.047 -0.822 1.00 1.00 C ATOM 78 CD1 ILE A 6 13.688 -8.627 -1.275 1.00 1.00 C ATOM 0 H ILE A 6 15.571 -6.404 -3.595 1.00 1.00 H new ATOM 0 HA ILE A 6 17.086 -6.333 -1.053 1.00 1.00 H new ATOM 0 HB ILE A 6 15.855 -8.614 -2.613 1.00 1.00 H new ATOM 0 HG12 ILE A 6 15.029 -7.834 0.179 1.00 1.00 H new ATOM 0 HG13 ILE A 6 14.573 -6.698 -1.075 1.00 1.00 H new ATOM 0 HG21 ILE A 6 16.402 -9.958 -0.609 1.00 1.00 H new ATOM 0 HG22 ILE A 6 17.874 -9.299 -1.361 1.00 1.00 H new ATOM 0 HG23 ILE A 6 17.218 -8.552 0.114 1.00 1.00 H new ATOM 0 HD11 ILE A 6 12.804 -8.349 -0.701 1.00 1.00 H new ATOM 0 HD12 ILE A 6 13.481 -8.512 -2.339 1.00 1.00 H new ATOM 0 HD13 ILE A 6 13.945 -9.665 -1.065 1.00 1.00 H new ATOM 90 N PHE A 7 19.258 -6.713 -2.116 1.00 1.00 N ATOM 91 CA PHE A 7 20.586 -6.711 -2.712 1.00 1.00 C ATOM 92 C PHE A 7 21.392 -7.785 -2.001 1.00 1.00 C ATOM 93 O PHE A 7 21.692 -7.646 -0.812 1.00 1.00 O ATOM 94 CB PHE A 7 21.194 -5.306 -2.576 1.00 1.00 C ATOM 95 CG PHE A 7 20.546 -4.300 -3.511 1.00 1.00 C ATOM 96 CD1 PHE A 7 19.253 -3.808 -3.257 1.00 1.00 C ATOM 97 CD2 PHE A 7 21.216 -3.902 -4.678 1.00 1.00 C ATOM 98 CE1 PHE A 7 18.616 -2.988 -4.201 1.00 1.00 C ATOM 99 CE2 PHE A 7 20.576 -3.092 -5.632 1.00 1.00 C ATOM 100 CZ PHE A 7 19.264 -2.656 -5.398 1.00 1.00 C ATOM 0 H PHE A 7 19.257 -6.379 -1.152 1.00 1.00 H new ATOM 0 HA PHE A 7 20.571 -6.938 -3.778 1.00 1.00 H new ATOM 0 HB2 PHE A 7 21.084 -4.964 -1.547 1.00 1.00 H new ATOM 0 HB3 PHE A 7 22.263 -5.354 -2.784 1.00 1.00 H new ATOM 0 HD1 PHE A 7 18.750 -4.061 -2.335 1.00 1.00 H new ATOM 0 HD2 PHE A 7 22.234 -4.221 -4.845 1.00 1.00 H new ATOM 0 HE1 PHE A 7 17.623 -2.612 -4.004 1.00 1.00 H new ATOM 0 HE2 PHE A 7 21.091 -2.808 -6.538 1.00 1.00 H new ATOM 0 HZ PHE A 7 18.752 -2.063 -6.142 1.00 1.00 H new ATOM 110 N VAL A 8 21.673 -8.886 -2.703 1.00 1.00 N ATOM 111 CA VAL A 8 22.372 -10.024 -2.102 1.00 1.00 C ATOM 112 C VAL A 8 23.855 -10.028 -2.476 1.00 1.00 C ATOM 113 O VAL A 8 24.202 -9.873 -3.646 1.00 1.00 O ATOM 114 CB VAL A 8 21.646 -11.354 -2.354 1.00 1.00 C ATOM 115 CG1 VAL A 8 21.772 -11.901 -3.777 1.00 1.00 C ATOM 116 CG2 VAL A 8 22.103 -12.427 -1.363 1.00 1.00 C ATOM 0 H VAL A 8 21.428 -9.013 -3.685 1.00 1.00 H new ATOM 0 HA VAL A 8 22.346 -9.903 -1.019 1.00 1.00 H new ATOM 0 HB VAL A 8 20.592 -11.116 -2.208 1.00 1.00 H new ATOM 0 HG11 VAL A 8 21.226 -12.841 -3.855 1.00 1.00 H new ATOM 0 HG12 VAL A 8 21.356 -11.181 -4.482 1.00 1.00 H new ATOM 0 HG13 VAL A 8 22.823 -12.071 -4.010 1.00 1.00 H new ATOM 0 HG21 VAL A 8 21.573 -13.358 -1.565 1.00 1.00 H new ATOM 0 HG22 VAL A 8 23.175 -12.589 -1.471 1.00 1.00 H new ATOM 0 HG23 VAL A 8 21.887 -12.099 -0.346 1.00 1.00 H new ATOM 236 N LEU A 17 19.487 -17.909 -1.037 1.00 1.00 N ATOM 237 CA LEU A 17 18.084 -18.272 -0.809 1.00 1.00 C ATOM 238 C LEU A 17 17.323 -17.211 -0.008 1.00 1.00 C ATOM 239 O LEU A 17 16.237 -16.799 -0.403 1.00 1.00 O ATOM 240 CB LEU A 17 18.088 -19.597 -0.024 1.00 1.00 C ATOM 241 CG LEU A 17 16.739 -20.008 0.596 1.00 1.00 C ATOM 242 CD1 LEU A 17 15.676 -20.271 -0.466 1.00 1.00 C ATOM 243 CD2 LEU A 17 16.956 -21.249 1.443 1.00 1.00 C ATOM 0 HA LEU A 17 17.578 -18.359 -1.770 1.00 1.00 H new ATOM 0 HB2 LEU A 17 18.418 -20.393 -0.692 1.00 1.00 H new ATOM 0 HB3 LEU A 17 18.827 -19.523 0.774 1.00 1.00 H new ATOM 0 HG LEU A 17 16.373 -19.186 1.211 1.00 1.00 H new ATOM 0 HD11 LEU A 17 14.742 -20.558 0.017 1.00 1.00 H new ATOM 0 HD12 LEU A 17 15.518 -19.367 -1.054 1.00 1.00 H new ATOM 0 HD13 LEU A 17 16.008 -21.077 -1.121 1.00 1.00 H new ATOM 0 HD21 LEU A 17 16.010 -21.554 1.890 1.00 1.00 H new ATOM 0 HD22 LEU A 17 17.338 -22.055 0.816 1.00 1.00 H new ATOM 0 HD23 LEU A 17 17.676 -21.030 2.231 1.00 1.00 H new ATOM 255 N VAL A 18 17.912 -16.750 1.099 1.00 1.00 N ATOM 256 CA VAL A 18 17.305 -15.764 2.010 1.00 1.00 C ATOM 257 C VAL A 18 16.832 -14.508 1.271 1.00 1.00 C ATOM 258 O VAL A 18 15.814 -13.940 1.646 1.00 1.00 O ATOM 259 CB VAL A 18 18.283 -15.360 3.129 1.00 1.00 C ATOM 260 CG1 VAL A 18 17.667 -14.277 4.027 1.00 1.00 C ATOM 261 CG2 VAL A 18 18.644 -16.568 4.007 1.00 1.00 C ATOM 0 H VAL A 18 18.839 -17.054 1.396 1.00 1.00 H new ATOM 0 HA VAL A 18 16.435 -16.251 2.451 1.00 1.00 H new ATOM 0 HB VAL A 18 19.182 -14.975 2.647 1.00 1.00 H new ATOM 0 HG11 VAL A 18 18.376 -14.007 4.810 1.00 1.00 H new ATOM 0 HG12 VAL A 18 17.435 -13.396 3.428 1.00 1.00 H new ATOM 0 HG13 VAL A 18 16.752 -14.658 4.481 1.00 1.00 H new ATOM 0 HG21 VAL A 18 19.336 -16.255 4.789 1.00 1.00 H new ATOM 0 HG22 VAL A 18 17.739 -16.970 4.462 1.00 1.00 H new ATOM 0 HG23 VAL A 18 19.114 -17.337 3.393 1.00 1.00 H new ATOM 271 N ALA A 19 17.501 -14.071 0.202 1.00 1.00 N ATOM 272 CA ALA A 19 17.012 -12.966 -0.621 1.00 1.00 C ATOM 273 C ALA A 19 15.651 -13.252 -1.271 1.00 1.00 C ATOM 274 O ALA A 19 14.736 -12.433 -1.199 1.00 1.00 O ATOM 275 CB ALA A 19 18.021 -12.707 -1.733 1.00 1.00 C ATOM 0 H ALA A 19 18.386 -14.468 -0.114 1.00 1.00 H new ATOM 0 HA ALA A 19 16.889 -12.106 0.037 1.00 1.00 H new ATOM 0 HB1 ALA A 19 17.671 -11.885 -2.357 1.00 1.00 H new ATOM 0 HB2 ALA A 19 18.985 -12.447 -1.296 1.00 1.00 H new ATOM 0 HB3 ALA A 19 18.129 -13.604 -2.342 1.00 1.00 H new ATOM 281 N GLU A 20 15.527 -14.422 -1.897 1.00 1.00 N ATOM 282 CA GLU A 20 14.295 -14.860 -2.561 1.00 1.00 C ATOM 283 C GLU A 20 13.174 -15.072 -1.537 1.00 1.00 C ATOM 284 O GLU A 20 12.006 -14.787 -1.801 1.00 1.00 O ATOM 285 CB GLU A 20 14.503 -16.170 -3.352 1.00 1.00 C ATOM 286 CG GLU A 20 15.833 -16.271 -4.105 1.00 1.00 C ATOM 287 CD GLU A 20 15.838 -17.505 -5.025 1.00 1.00 C ATOM 288 OE1 GLU A 20 15.394 -17.396 -6.195 1.00 1.00 O ATOM 289 OE2 GLU A 20 16.280 -18.596 -4.590 1.00 1.00 O1- ATOM 0 H GLU A 20 16.286 -15.101 -1.959 1.00 1.00 H new ATOM 0 HA GLU A 20 14.016 -14.071 -3.259 1.00 1.00 H new ATOM 0 HB2 GLU A 20 14.431 -17.009 -2.660 1.00 1.00 H new ATOM 0 HB3 GLU A 20 13.689 -16.276 -4.069 1.00 1.00 H new ATOM 0 HG2 GLU A 20 15.993 -15.369 -4.696 1.00 1.00 H new ATOM 0 HG3 GLU A 20 16.656 -16.337 -3.394 1.00 1.00 H new ATOM 296 N GLU A 21 13.551 -15.509 -0.335 1.00 1.00 N ATOM 297 CA GLU A 21 12.651 -15.641 0.800 1.00 1.00 C ATOM 298 C GLU A 21 12.182 -14.267 1.233 1.00 1.00 C ATOM 299 O GLU A 21 10.988 -14.039 1.386 1.00 1.00 O ATOM 300 CB GLU A 21 13.318 -16.340 1.986 1.00 1.00 C ATOM 301 CG GLU A 21 13.815 -17.757 1.661 1.00 1.00 C ATOM 302 CD GLU A 21 12.718 -18.827 1.821 1.00 1.00 C ATOM 303 OE1 GLU A 21 11.578 -18.633 1.332 1.00 1.00 O ATOM 304 OE2 GLU A 21 12.992 -19.887 2.433 1.00 1.00 O1- ATOM 0 H GLU A 21 14.510 -15.785 -0.124 1.00 1.00 H new ATOM 0 HA GLU A 21 11.807 -16.253 0.482 1.00 1.00 H new ATOM 0 HB2 GLU A 21 14.160 -15.737 2.326 1.00 1.00 H new ATOM 0 HB3 GLU A 21 12.609 -16.393 2.812 1.00 1.00 H new ATOM 0 HG2 GLU A 21 14.191 -17.779 0.638 1.00 1.00 H new ATOM 0 HG3 GLU A 21 14.653 -18.002 2.314 1.00 1.00 H new ATOM 311 N ALA A 22 13.111 -13.327 1.376 1.00 1.00 N ATOM 312 CA ALA A 22 12.811 -12.004 1.852 1.00 1.00 C ATOM 313 C ALA A 22 11.888 -11.241 0.914 1.00 1.00 C ATOM 314 O ALA A 22 10.919 -10.632 1.363 1.00 1.00 O ATOM 315 CB ALA A 22 14.119 -11.263 2.081 1.00 1.00 C ATOM 0 H ALA A 22 14.097 -13.475 1.160 1.00 1.00 H new ATOM 0 HA ALA A 22 12.266 -12.085 2.792 1.00 1.00 H new ATOM 0 HB1 ALA A 22 13.908 -10.257 2.443 1.00 1.00 H new ATOM 0 HB2 ALA A 22 14.715 -11.797 2.821 1.00 1.00 H new ATOM 0 HB3 ALA A 22 14.672 -11.203 1.144 1.00 1.00 H new ATOM 321 N GLU A 23 12.145 -11.334 -0.387 1.00 1.00 N ATOM 322 CA GLU A 23 11.240 -10.836 -1.409 1.00 1.00 C ATOM 323 C GLU A 23 9.849 -11.454 -1.225 1.00 1.00 C ATOM 324 O GLU A 23 8.853 -10.736 -1.153 1.00 1.00 O ATOM 325 CB GLU A 23 11.840 -11.196 -2.783 1.00 1.00 C ATOM 326 CG GLU A 23 10.878 -11.081 -3.966 1.00 1.00 C ATOM 327 CD GLU A 23 10.509 -12.450 -4.568 1.00 1.00 C ATOM 328 OE1 GLU A 23 11.362 -13.048 -5.266 1.00 1.00 O ATOM 329 OE2 GLU A 23 9.355 -12.905 -4.393 1.00 1.00 O1- ATOM 0 H GLU A 23 12.993 -11.760 -0.761 1.00 1.00 H new ATOM 0 HA GLU A 23 11.124 -9.755 -1.334 1.00 1.00 H new ATOM 0 HB2 GLU A 23 12.697 -10.548 -2.968 1.00 1.00 H new ATOM 0 HB3 GLU A 23 12.217 -12.218 -2.740 1.00 1.00 H new ATOM 0 HG2 GLU A 23 9.969 -10.574 -3.642 1.00 1.00 H new ATOM 0 HG3 GLU A 23 11.331 -10.459 -4.738 1.00 1.00 H new ATOM 336 N ALA A 24 9.780 -12.772 -1.071 1.00 1.00 N ATOM 337 CA ALA A 24 8.524 -13.503 -1.019 1.00 1.00 C ATOM 338 C ALA A 24 7.739 -13.240 0.266 1.00 1.00 C ATOM 339 O ALA A 24 6.522 -13.072 0.208 1.00 1.00 O ATOM 340 CB ALA A 24 8.786 -14.996 -1.228 1.00 1.00 C ATOM 0 H ALA A 24 10.604 -13.366 -0.978 1.00 1.00 H new ATOM 0 HA ALA A 24 7.892 -13.138 -1.829 1.00 1.00 H new ATOM 0 HB1 ALA A 24 7.842 -15.540 -1.188 1.00 1.00 H new ATOM 0 HB2 ALA A 24 9.253 -15.151 -2.200 1.00 1.00 H new ATOM 0 HB3 ALA A 24 9.449 -15.362 -0.444 1.00 1.00 H new ATOM 346 N ILE A 25 8.407 -13.114 1.416 1.00 1.00 N ATOM 347 CA ILE A 25 7.778 -12.757 2.673 1.00 1.00 C ATOM 348 C ILE A 25 7.250 -11.341 2.572 1.00 1.00 C ATOM 349 O ILE A 25 6.091 -11.103 2.904 1.00 1.00 O ATOM 350 CB ILE A 25 8.756 -12.927 3.833 1.00 1.00 C ATOM 351 CG1 ILE A 25 8.941 -14.431 4.127 1.00 1.00 C ATOM 352 CG2 ILE A 25 8.215 -12.230 5.084 1.00 1.00 C ATOM 353 CD1 ILE A 25 10.376 -14.700 4.536 1.00 1.00 C ATOM 0 H ILE A 25 9.413 -13.261 1.492 1.00 1.00 H new ATOM 0 HA ILE A 25 6.940 -13.424 2.874 1.00 1.00 H new ATOM 0 HB ILE A 25 9.713 -12.481 3.562 1.00 1.00 H new ATOM 0 HG12 ILE A 25 8.262 -14.742 4.921 1.00 1.00 H new ATOM 0 HG13 ILE A 25 8.689 -15.018 3.244 1.00 1.00 H new ATOM 0 HG21 ILE A 25 8.920 -12.357 5.905 1.00 1.00 H new ATOM 0 HG22 ILE A 25 8.083 -11.167 4.880 1.00 1.00 H new ATOM 0 HG23 ILE A 25 7.255 -12.668 5.358 1.00 1.00 H new ATOM 0 HD11 ILE A 25 10.502 -15.763 4.743 1.00 1.00 H new ATOM 0 HD12 ILE A 25 11.046 -14.405 3.728 1.00 1.00 H new ATOM 0 HD13 ILE A 25 10.613 -14.126 5.432 1.00 1.00 H new ATOM 365 N LEU A 26 8.056 -10.399 2.077 1.00 1.00 N ATOM 366 CA LEU A 26 7.615 -9.022 2.050 1.00 1.00 C ATOM 367 C LEU A 26 6.444 -8.848 1.065 1.00 1.00 C ATOM 368 O LEU A 26 5.476 -8.138 1.341 1.00 1.00 O ATOM 369 CB LEU A 26 8.811 -8.098 1.760 1.00 1.00 C ATOM 370 CG LEU A 26 9.642 -7.657 2.986 1.00 1.00 C ATOM 371 CD1 LEU A 26 9.699 -6.142 3.150 1.00 1.00 C ATOM 372 CD2 LEU A 26 9.117 -8.137 4.339 1.00 1.00 C ATOM 0 H LEU A 26 8.990 -10.566 1.702 1.00 1.00 H new ATOM 0 HA LEU A 26 7.227 -8.734 3.027 1.00 1.00 H new ATOM 0 HB2 LEU A 26 9.475 -8.605 1.060 1.00 1.00 H new ATOM 0 HB3 LEU A 26 8.440 -7.205 1.257 1.00 1.00 H new ATOM 0 HG LEU A 26 10.608 -8.108 2.758 1.00 1.00 H new ATOM 0 HD11 LEU A 26 10.296 -5.893 4.027 1.00 1.00 H new ATOM 0 HD12 LEU A 26 10.152 -5.697 2.264 1.00 1.00 H new ATOM 0 HD13 LEU A 26 8.689 -5.751 3.276 1.00 1.00 H new ATOM 0 HD21 LEU A 26 9.770 -7.774 5.132 1.00 1.00 H new ATOM 0 HD22 LEU A 26 8.109 -7.753 4.495 1.00 1.00 H new ATOM 0 HD23 LEU A 26 9.097 -9.227 4.356 1.00 1.00 H new ATOM 384 N THR A 27 6.463 -9.608 -0.028 1.00 1.00 N ATOM 385 CA THR A 27 5.375 -9.750 -0.981 1.00 1.00 C ATOM 386 C THR A 27 4.111 -10.361 -0.377 1.00 1.00 C ATOM 387 O THR A 27 3.012 -9.869 -0.626 1.00 1.00 O ATOM 388 CB THR A 27 5.901 -10.538 -2.165 1.00 1.00 C ATOM 389 OG1 THR A 27 6.912 -9.816 -2.835 1.00 1.00 O ATOM 390 CG2 THR A 27 4.812 -10.818 -3.166 1.00 1.00 C ATOM 0 H THR A 27 7.278 -10.166 -0.281 1.00 1.00 H new ATOM 0 HA THR A 27 5.052 -8.761 -1.306 1.00 1.00 H new ATOM 0 HB THR A 27 6.293 -11.474 -1.768 1.00 1.00 H new ATOM 0 HG1 THR A 27 7.772 -9.968 -2.390 1.00 1.00 H new ATOM 0 HG21 THR A 27 5.223 -11.384 -4.002 1.00 1.00 H new ATOM 0 HG22 THR A 27 4.020 -11.397 -2.690 1.00 1.00 H new ATOM 0 HG23 THR A 27 4.403 -9.876 -3.532 1.00 1.00 H new ATOM 398 N ALA A 28 4.254 -11.385 0.464 1.00 1.00 N ATOM 399 CA ALA A 28 3.141 -12.032 1.154 1.00 1.00 C ATOM 400 C ALA A 28 2.478 -11.105 2.193 1.00 1.00 C ATOM 401 O ALA A 28 1.262 -11.140 2.388 1.00 1.00 O ATOM 402 CB ALA A 28 3.656 -13.325 1.793 1.00 1.00 C ATOM 0 H ALA A 28 5.161 -11.794 0.688 1.00 1.00 H new ATOM 0 HA ALA A 28 2.360 -12.266 0.431 1.00 1.00 H new ATOM 0 HB1 ALA A 28 2.839 -13.824 2.314 1.00 1.00 H new ATOM 0 HB2 ALA A 28 4.048 -13.983 1.017 1.00 1.00 H new ATOM 0 HB3 ALA A 28 4.449 -13.089 2.503 1.00 1.00 H new ATOM 408 N GLN A 29 3.281 -10.234 2.814 1.00 1.00 N ATOM 409 CA GLN A 29 2.820 -9.163 3.703 1.00 1.00 C ATOM 410 C GLN A 29 2.114 -8.017 2.964 1.00 1.00 C ATOM 411 O GLN A 29 1.203 -7.397 3.516 1.00 1.00 O ATOM 412 CB GLN A 29 4.008 -8.642 4.519 1.00 1.00 C ATOM 413 CG GLN A 29 4.430 -9.733 5.514 1.00 1.00 C ATOM 414 CD GLN A 29 5.291 -9.238 6.659 1.00 1.00 C ATOM 415 OE1 GLN A 29 5.663 -8.084 6.789 1.00 1.00 O ATOM 416 NE2 GLN A 29 5.626 -10.126 7.553 1.00 1.00 N ATOM 0 H GLN A 29 4.295 -10.255 2.709 1.00 1.00 H new ATOM 0 HA GLN A 29 2.067 -9.588 4.367 1.00 1.00 H new ATOM 0 HB2 GLN A 29 4.838 -8.388 3.860 1.00 1.00 H new ATOM 0 HB3 GLN A 29 3.733 -7.731 5.050 1.00 1.00 H new ATOM 0 HG2 GLN A 29 3.534 -10.199 5.924 1.00 1.00 H new ATOM 0 HG3 GLN A 29 4.975 -10.508 4.975 1.00 1.00 H new ATOM 0 HE21 GLN A 29 5.319 -11.093 7.451 1.00 1.00 H new ATOM 0 HE22 GLN A 29 6.195 -9.853 8.354 1.00 1.00 H new ATOM 425 N GLY A 30 2.494 -7.781 1.706 1.00 1.00 N ATOM 426 CA GLY A 30 1.793 -6.879 0.783 1.00 1.00 C ATOM 427 C GLY A 30 2.645 -5.713 0.283 1.00 1.00 C ATOM 428 O GLY A 30 2.112 -4.651 -0.045 1.00 1.00 O ATOM 0 H GLY A 30 3.315 -8.220 1.290 1.00 1.00 H new ATOM 0 HA2 GLY A 30 1.444 -7.454 -0.075 1.00 1.00 H new ATOM 0 HA3 GLY A 30 0.909 -6.482 1.282 1.00 1.00 H new ATOM 432 N HIS A 31 3.969 -5.894 0.242 1.00 1.00 N ATOM 433 CA HIS A 31 4.926 -4.895 -0.240 1.00 1.00 C ATOM 434 C HIS A 31 5.644 -5.424 -1.486 1.00 1.00 C ATOM 435 O HIS A 31 5.920 -6.615 -1.596 1.00 1.00 O ATOM 436 CB HIS A 31 5.924 -4.541 0.870 1.00 1.00 C ATOM 437 CG HIS A 31 5.367 -4.488 2.268 1.00 1.00 C ATOM 438 ND1 HIS A 31 4.694 -3.452 2.877 1.00 1.00 N ATOM 439 CD2 HIS A 31 5.445 -5.502 3.178 1.00 1.00 C ATOM 440 CE1 HIS A 31 4.355 -3.850 4.116 1.00 1.00 C ATOM 441 NE2 HIS A 31 4.787 -5.102 4.343 1.00 1.00 N ATOM 0 H HIS A 31 4.414 -6.759 0.550 1.00 1.00 H new ATOM 0 HA HIS A 31 4.393 -3.984 -0.514 1.00 1.00 H new ATOM 0 HB2 HIS A 31 6.733 -5.271 0.850 1.00 1.00 H new ATOM 0 HB3 HIS A 31 6.365 -3.571 0.639 1.00 1.00 H new ATOM 0 HD1 HIS A 31 4.489 -2.543 2.462 1.00 1.00 H new ATOM 0 HD2 HIS A 31 5.933 -6.453 3.023 1.00 1.00 H new ATOM 0 HE1 HIS A 31 3.812 -3.248 4.829 1.00 1.00 H new ATOM 449 N LYS A 32 5.992 -4.545 -2.425 1.00 1.00 N ATOM 450 CA LYS A 32 6.599 -4.884 -3.707 1.00 1.00 C ATOM 451 C LYS A 32 8.076 -5.127 -3.488 1.00 1.00 C ATOM 452 O LYS A 32 8.876 -4.199 -3.546 1.00 1.00 O ATOM 453 CB LYS A 32 6.297 -3.752 -4.709 1.00 1.00 C ATOM 454 CG LYS A 32 6.563 -4.100 -6.176 1.00 1.00 C ATOM 455 CD LYS A 32 8.023 -4.372 -6.584 1.00 1.00 C ATOM 456 CE LYS A 32 8.130 -4.503 -8.111 1.00 1.00 C ATOM 457 NZ LYS A 32 9.550 -4.613 -8.562 1.00 1.00 N1+ ATOM 0 H LYS A 32 5.853 -3.541 -2.307 1.00 1.00 H new ATOM 0 HA LYS A 32 6.186 -5.799 -4.131 1.00 1.00 H new ATOM 0 HB2 LYS A 32 5.251 -3.463 -4.603 1.00 1.00 H new ATOM 0 HB3 LYS A 32 6.897 -2.882 -4.443 1.00 1.00 H new ATOM 0 HG2 LYS A 32 5.973 -4.982 -6.426 1.00 1.00 H new ATOM 0 HG3 LYS A 32 6.188 -3.281 -6.790 1.00 1.00 H new ATOM 0 HD2 LYS A 32 8.663 -3.562 -6.235 1.00 1.00 H new ATOM 0 HD3 LYS A 32 8.378 -5.286 -6.107 1.00 1.00 H new ATOM 0 HE2 LYS A 32 7.575 -5.382 -8.440 1.00 1.00 H new ATOM 0 HE3 LYS A 32 7.665 -3.638 -8.583 1.00 1.00 H new ATOM 0 HZ1 LYS A 32 9.575 -4.868 -9.570 1.00 1.00 H new ATOM 0 HZ2 LYS A 32 10.030 -3.701 -8.424 1.00 1.00 H new ATOM 0 HZ3 LYS A 32 10.035 -5.347 -8.007 1.00 1.00 H new ATOM 471 N ALA A 33 8.433 -6.365 -3.191 1.00 1.00 N ATOM 472 CA ALA A 33 9.809 -6.737 -2.920 1.00 1.00 C ATOM 473 C ALA A 33 10.400 -7.529 -4.096 1.00 1.00 C ATOM 474 O ALA A 33 9.688 -8.258 -4.786 1.00 1.00 O ATOM 475 CB ALA A 33 9.855 -7.417 -1.557 1.00 1.00 C ATOM 0 H ALA A 33 7.774 -7.141 -3.131 1.00 1.00 H new ATOM 0 HA ALA A 33 10.465 -5.869 -2.849 1.00 1.00 H new ATOM 0 HB1 ALA A 33 10.881 -7.707 -1.329 1.00 1.00 H new ATOM 0 HB2 ALA A 33 9.495 -6.727 -0.794 1.00 1.00 H new ATOM 0 HB3 ALA A 33 9.222 -8.304 -1.571 1.00 1.00 H new ATOM 481 N THR A 34 11.698 -7.358 -4.342 1.00 1.00 N ATOM 482 CA THR A 34 12.395 -7.917 -5.512 1.00 1.00 C ATOM 483 C THR A 34 13.848 -8.226 -5.196 1.00 1.00 C ATOM 484 O THR A 34 14.465 -7.485 -4.446 1.00 1.00 O ATOM 485 CB THR A 34 12.342 -6.948 -6.702 1.00 1.00 C ATOM 486 OG1 THR A 34 11.008 -6.651 -7.073 1.00 1.00 O ATOM 487 CG2 THR A 34 13.009 -7.604 -7.899 1.00 1.00 C ATOM 0 H THR A 34 12.309 -6.820 -3.728 1.00 1.00 H new ATOM 0 HA THR A 34 11.881 -8.842 -5.773 1.00 1.00 H new ATOM 0 HB THR A 34 12.847 -6.029 -6.406 1.00 1.00 H new ATOM 0 HG1 THR A 34 10.757 -7.191 -7.851 1.00 1.00 H new ATOM 0 HG21 THR A 34 12.977 -6.925 -8.751 1.00 1.00 H new ATOM 0 HG22 THR A 34 14.047 -7.834 -7.657 1.00 1.00 H new ATOM 0 HG23 THR A 34 12.482 -8.525 -8.150 1.00 1.00 H new ATOM 495 N VAL A 35 14.415 -9.274 -5.802 1.00 1.00 N ATOM 496 CA VAL A 35 15.824 -9.644 -5.657 1.00 1.00 C ATOM 497 C VAL A 35 16.738 -9.150 -6.785 1.00 1.00 C ATOM 498 O VAL A 35 16.411 -9.265 -7.966 1.00 1.00 O ATOM 499 CB VAL A 35 15.964 -11.164 -5.475 1.00 1.00 C ATOM 500 CG1 VAL A 35 17.419 -11.617 -5.284 1.00 1.00 C ATOM 501 CG2 VAL A 35 15.169 -11.629 -4.257 1.00 1.00 C ATOM 0 H VAL A 35 13.897 -9.900 -6.418 1.00 1.00 H new ATOM 0 HA VAL A 35 16.168 -9.127 -4.762 1.00 1.00 H new ATOM 0 HB VAL A 35 15.580 -11.609 -6.393 1.00 1.00 H new ATOM 0 HG11 VAL A 35 17.450 -12.700 -5.161 1.00 1.00 H new ATOM 0 HG12 VAL A 35 18.006 -11.334 -6.158 1.00 1.00 H new ATOM 0 HG13 VAL A 35 17.835 -11.139 -4.397 1.00 1.00 H new ATOM 0 HG21 VAL A 35 15.278 -12.707 -4.141 1.00 1.00 H new ATOM 0 HG22 VAL A 35 15.545 -11.129 -3.365 1.00 1.00 H new ATOM 0 HG23 VAL A 35 14.116 -11.383 -4.394 1.00 1.00 H new ATOM 511 N PHE A 36 17.930 -8.692 -6.388 1.00 1.00 N ATOM 512 CA PHE A 36 19.076 -8.353 -7.243 1.00 1.00 C ATOM 513 C PHE A 36 20.309 -9.179 -6.823 1.00 1.00 C ATOM 514 O PHE A 36 20.829 -9.012 -5.718 1.00 1.00 O ATOM 515 CB PHE A 36 19.341 -6.838 -7.160 1.00 1.00 C ATOM 516 CG PHE A 36 18.170 -5.973 -7.587 1.00 1.00 C ATOM 517 CD1 PHE A 36 18.006 -5.631 -8.943 1.00 1.00 C ATOM 518 CD2 PHE A 36 17.231 -5.527 -6.637 1.00 1.00 C ATOM 519 CE1 PHE A 36 16.911 -4.848 -9.348 1.00 1.00 C ATOM 520 CE2 PHE A 36 16.133 -4.747 -7.043 1.00 1.00 C ATOM 521 CZ PHE A 36 15.973 -4.408 -8.399 1.00 1.00 C ATOM 0 H PHE A 36 18.134 -8.538 -5.401 1.00 1.00 H new ATOM 0 HA PHE A 36 18.857 -8.602 -8.281 1.00 1.00 H new ATOM 0 HB2 PHE A 36 19.610 -6.584 -6.135 1.00 1.00 H new ATOM 0 HB3 PHE A 36 20.202 -6.597 -7.784 1.00 1.00 H new ATOM 0 HD1 PHE A 36 18.724 -5.971 -9.674 1.00 1.00 H new ATOM 0 HD2 PHE A 36 17.354 -5.784 -5.595 1.00 1.00 H new ATOM 0 HE1 PHE A 36 16.791 -4.585 -10.388 1.00 1.00 H new ATOM 0 HE2 PHE A 36 15.412 -4.408 -6.313 1.00 1.00 H new ATOM 0 HZ PHE A 36 15.129 -3.810 -8.710 1.00 1.00 H new ATOM 531 N GLU A 37 20.768 -10.082 -7.696 1.00 1.00 N ATOM 532 CA GLU A 37 21.930 -10.955 -7.495 1.00 1.00 C ATOM 533 C GLU A 37 23.176 -10.391 -8.195 1.00 1.00 C ATOM 534 O GLU A 37 23.083 -9.905 -9.324 1.00 1.00 O ATOM 535 CB GLU A 37 21.648 -12.395 -7.962 1.00 1.00 C ATOM 536 CG GLU A 37 20.414 -13.021 -7.298 1.00 1.00 C ATOM 537 CD GLU A 37 20.271 -14.506 -7.681 1.00 1.00 C ATOM 538 OE1 GLU A 37 19.859 -14.803 -8.831 1.00 1.00 O1- ATOM 539 OE2 GLU A 37 20.552 -15.385 -6.832 1.00 1.00 O ATOM 0 H GLU A 37 20.321 -10.231 -8.601 1.00 1.00 H new ATOM 0 HA GLU A 37 22.126 -10.987 -6.423 1.00 1.00 H new ATOM 0 HB2 GLU A 37 21.510 -12.398 -9.043 1.00 1.00 H new ATOM 0 HB3 GLU A 37 22.519 -13.015 -7.750 1.00 1.00 H new ATOM 0 HG2 GLU A 37 20.493 -12.928 -6.215 1.00 1.00 H new ATOM 0 HG3 GLU A 37 19.519 -12.477 -7.600 1.00 1.00 H new ATOM 546 N ASP A 38 24.334 -10.458 -7.523 1.00 1.00 N ATOM 547 CA ASP A 38 25.581 -9.776 -7.932 1.00 1.00 C ATOM 548 C ASP A 38 25.304 -8.311 -8.404 1.00 1.00 C ATOM 549 O ASP A 38 25.626 -7.936 -9.541 1.00 1.00 O ATOM 550 CB ASP A 38 26.320 -10.654 -8.959 1.00 1.00 C ATOM 551 CG ASP A 38 27.719 -10.118 -9.315 1.00 1.00 C ATOM 552 OD1 ASP A 38 28.481 -9.753 -8.390 1.00 1.00 O1- ATOM 553 OD2 ASP A 38 28.082 -10.125 -10.516 1.00 1.00 O ATOM 0 H ASP A 38 24.437 -10.997 -6.663 1.00 1.00 H new ATOM 0 HA ASP A 38 26.248 -9.659 -7.078 1.00 1.00 H new ATOM 0 HB2 ASP A 38 26.415 -11.665 -8.563 1.00 1.00 H new ATOM 0 HB3 ASP A 38 25.721 -10.722 -9.867 1.00 1.00 H new ATOM 558 N PRO A 39 24.657 -7.480 -7.554 1.00 1.00 N ATOM 559 CA PRO A 39 24.094 -6.174 -7.914 1.00 1.00 C ATOM 560 C PRO A 39 25.046 -5.000 -8.203 1.00 1.00 C ATOM 561 O PRO A 39 26.119 -4.854 -7.615 1.00 1.00 O ATOM 562 CB PRO A 39 23.210 -5.801 -6.727 1.00 1.00 C ATOM 563 CG PRO A 39 23.943 -6.429 -5.540 1.00 1.00 C ATOM 564 CD PRO A 39 24.413 -7.747 -6.140 1.00 1.00 C ATOM 0 HA PRO A 39 23.605 -6.309 -8.879 1.00 1.00 H new ATOM 0 HB2 PRO A 39 23.116 -4.721 -6.618 1.00 1.00 H new ATOM 0 HB3 PRO A 39 22.201 -6.199 -6.835 1.00 1.00 H new ATOM 0 HG2 PRO A 39 24.775 -5.813 -5.199 1.00 1.00 H new ATOM 0 HG3 PRO A 39 23.285 -6.579 -4.684 1.00 1.00 H new ATOM 0 HD2 PRO A 39 25.319 -8.099 -5.647 1.00 1.00 H new ATOM 0 HD3 PRO A 39 23.659 -8.524 -6.014 1.00 1.00 H new ATOM 572 N GLU A 40 24.552 -4.089 -9.047 1.00 1.00 N ATOM 573 CA GLU A 40 25.104 -2.765 -9.344 1.00 1.00 C ATOM 574 C GLU A 40 24.494 -1.654 -8.481 1.00 1.00 C ATOM 575 O GLU A 40 23.331 -1.702 -8.090 1.00 1.00 O ATOM 576 CB GLU A 40 24.773 -2.404 -10.804 1.00 1.00 C ATOM 577 CG GLU A 40 25.831 -2.951 -11.737 1.00 1.00 C ATOM 578 CD GLU A 40 25.415 -2.834 -13.217 1.00 1.00 C ATOM 579 OE1 GLU A 40 25.437 -1.710 -13.774 1.00 1.00 O1- ATOM 580 OE2 GLU A 40 25.084 -3.870 -13.845 1.00 1.00 O ATOM 0 H GLU A 40 23.699 -4.270 -9.576 1.00 1.00 H new ATOM 0 HA GLU A 40 26.174 -2.825 -9.147 1.00 1.00 H new ATOM 0 HB2 GLU A 40 23.798 -2.809 -11.073 1.00 1.00 H new ATOM 0 HB3 GLU A 40 24.709 -1.321 -10.912 1.00 1.00 H new ATOM 0 HG2 GLU A 40 26.766 -2.413 -11.580 1.00 1.00 H new ATOM 0 HG3 GLU A 40 26.021 -3.997 -11.496 1.00 1.00 H new ATOM 587 N LEU A 41 25.232 -0.557 -8.299 1.00 1.00 N ATOM 588 CA LEU A 41 24.707 0.667 -7.727 1.00 1.00 C ATOM 589 C LEU A 41 23.724 1.325 -8.707 1.00 1.00 C ATOM 590 O LEU A 41 22.783 1.985 -8.271 1.00 1.00 O ATOM 591 CB LEU A 41 25.931 1.502 -7.324 1.00 1.00 C ATOM 592 CG LEU A 41 25.649 2.810 -6.583 1.00 1.00 C ATOM 593 CD1 LEU A 41 25.441 3.955 -7.569 1.00 1.00 C ATOM 594 CD2 LEU A 41 24.554 2.682 -5.532 1.00 1.00 C ATOM 0 H LEU A 41 26.219 -0.501 -8.550 1.00 1.00 H new ATOM 0 HA LEU A 41 24.103 0.519 -6.832 1.00 1.00 H new ATOM 0 HB2 LEU A 41 26.573 0.885 -6.695 1.00 1.00 H new ATOM 0 HB3 LEU A 41 26.497 1.736 -8.226 1.00 1.00 H new ATOM 0 HG LEU A 41 26.536 3.059 -6.000 1.00 1.00 H new ATOM 0 HD11 LEU A 41 25.242 4.876 -7.021 1.00 1.00 H new ATOM 0 HD12 LEU A 41 26.338 4.081 -8.175 1.00 1.00 H new ATOM 0 HD13 LEU A 41 24.594 3.728 -8.217 1.00 1.00 H new ATOM 0 HD21 LEU A 41 24.404 3.645 -5.044 1.00 1.00 H new ATOM 0 HD22 LEU A 41 23.626 2.369 -6.010 1.00 1.00 H new ATOM 0 HD23 LEU A 41 24.848 1.941 -4.789 1.00 1.00 H new ATOM 606 N SER A 42 23.826 1.037 -10.011 1.00 1.00 N ATOM 607 CA SER A 42 22.820 1.466 -10.986 1.00 1.00 C ATOM 608 C SER A 42 21.461 0.787 -10.756 1.00 1.00 C ATOM 609 O SER A 42 20.431 1.342 -11.136 1.00 1.00 O ATOM 610 CB SER A 42 23.298 1.218 -12.421 1.00 1.00 C ATOM 611 OG SER A 42 24.543 1.867 -12.643 1.00 1.00 O ATOM 0 H SER A 42 24.598 0.507 -10.414 1.00 1.00 H new ATOM 0 HA SER A 42 22.684 2.538 -10.841 1.00 1.00 H new ATOM 0 HB2 SER A 42 23.401 0.147 -12.598 1.00 1.00 H new ATOM 0 HB3 SER A 42 22.556 1.588 -13.128 1.00 1.00 H new ATOM 0 HG SER A 42 24.839 1.700 -13.562 1.00 1.00 H new ATOM 617 N ASP A 43 21.439 -0.379 -10.096 1.00 1.00 N ATOM 618 CA ASP A 43 20.222 -1.028 -9.614 1.00 1.00 C ATOM 619 C ASP A 43 19.741 -0.480 -8.258 1.00 1.00 C ATOM 620 O ASP A 43 18.541 -0.534 -7.993 1.00 1.00 O ATOM 621 CB ASP A 43 20.414 -2.551 -9.555 1.00 1.00 C ATOM 622 CG ASP A 43 20.385 -3.213 -10.945 1.00 1.00 C ATOM 623 OD1 ASP A 43 19.469 -2.919 -11.750 1.00 1.00 O1- ATOM 624 OD2 ASP A 43 21.271 -4.053 -11.230 1.00 1.00 O ATOM 0 H ASP A 43 22.286 -0.904 -9.880 1.00 1.00 H new ATOM 0 HA ASP A 43 19.436 -0.795 -10.332 1.00 1.00 H new ATOM 0 HB2 ASP A 43 21.365 -2.774 -9.072 1.00 1.00 H new ATOM 0 HB3 ASP A 43 19.631 -2.987 -8.934 1.00 1.00 H new ATOM 629 N TRP A 44 20.622 0.097 -7.421 1.00 1.00 N ATOM 630 CA TRP A 44 20.234 0.700 -6.136 1.00 1.00 C ATOM 631 C TRP A 44 19.692 2.130 -6.262 1.00 1.00 C ATOM 632 O TRP A 44 18.766 2.493 -5.536 1.00 1.00 O ATOM 633 CB TRP A 44 21.446 0.648 -5.208 1.00 1.00 C ATOM 634 CG TRP A 44 21.271 1.216 -3.835 1.00 1.00 C ATOM 635 CD1 TRP A 44 21.171 2.530 -3.510 1.00 1.00 C ATOM 636 CD2 TRP A 44 21.181 0.483 -2.579 1.00 1.00 C ATOM 637 NE1 TRP A 44 21.041 2.648 -2.136 1.00 1.00 N ATOM 638 CE2 TRP A 44 21.068 1.419 -1.514 1.00 1.00 C ATOM 639 CE3 TRP A 44 21.182 -0.884 -2.236 1.00 1.00 C ATOM 640 CZ2 TRP A 44 21.011 1.025 -0.172 1.00 1.00 C ATOM 641 CZ3 TRP A 44 21.109 -1.297 -0.894 1.00 1.00 C ATOM 642 CH2 TRP A 44 21.038 -0.348 0.141 1.00 1.00 C ATOM 0 H TRP A 44 21.621 0.158 -7.617 1.00 1.00 H new ATOM 0 HA TRP A 44 19.404 0.125 -5.726 1.00 1.00 H new ATOM 0 HB2 TRP A 44 21.752 -0.393 -5.108 1.00 1.00 H new ATOM 0 HB3 TRP A 44 22.267 1.177 -5.692 1.00 1.00 H new ATOM 0 HD1 TRP A 44 21.190 3.352 -4.210 1.00 1.00 H new ATOM 0 HE1 TRP A 44 20.938 3.536 -1.645 1.00 1.00 H new ATOM 0 HE3 TRP A 44 21.240 -1.627 -3.018 1.00 1.00 H new ATOM 0 HZ2 TRP A 44 20.947 1.764 0.613 1.00 1.00 H new ATOM 0 HZ3 TRP A 44 21.107 -2.351 -0.657 1.00 1.00 H new ATOM 0 HH2 TRP A 44 21.004 -0.670 1.171 1.00 1.00 H new ATOM 653 N LEU A 45 20.225 2.949 -7.183 1.00 1.00 N ATOM 654 CA LEU A 45 19.778 4.340 -7.387 1.00 1.00 C ATOM 655 C LEU A 45 18.242 4.496 -7.538 1.00 1.00 C ATOM 656 O LEU A 45 17.703 5.434 -6.947 1.00 1.00 O ATOM 657 CB LEU A 45 20.495 4.943 -8.621 1.00 1.00 C ATOM 658 CG LEU A 45 21.959 5.354 -8.415 1.00 1.00 C ATOM 659 CD1 LEU A 45 22.613 5.647 -9.763 1.00 1.00 C ATOM 660 CD2 LEU A 45 22.081 6.615 -7.559 1.00 1.00 C ATOM 0 H LEU A 45 20.979 2.667 -7.809 1.00 1.00 H new ATOM 0 HA LEU A 45 20.047 4.883 -6.481 1.00 1.00 H new ATOM 0 HB2 LEU A 45 20.453 4.216 -9.432 1.00 1.00 H new ATOM 0 HB3 LEU A 45 19.935 5.819 -8.949 1.00 1.00 H new ATOM 0 HG LEU A 45 22.453 4.525 -7.908 1.00 1.00 H new ATOM 0 HD11 LEU A 45 23.652 5.938 -9.608 1.00 1.00 H new ATOM 0 HD12 LEU A 45 22.576 4.754 -10.387 1.00 1.00 H new ATOM 0 HD13 LEU A 45 22.079 6.458 -10.258 1.00 1.00 H new ATOM 0 HD21 LEU A 45 23.133 6.872 -7.437 1.00 1.00 H new ATOM 0 HD22 LEU A 45 21.561 7.439 -8.048 1.00 1.00 H new ATOM 0 HD23 LEU A 45 21.636 6.435 -6.580 1.00 1.00 H new ATOM 672 N PRO A 46 17.515 3.587 -8.223 1.00 1.00 N ATOM 673 CA PRO A 46 16.044 3.563 -8.261 1.00 1.00 C ATOM 674 C PRO A 46 15.299 3.563 -6.906 1.00 1.00 C ATOM 675 O PRO A 46 14.104 3.866 -6.880 1.00 1.00 O ATOM 676 CB PRO A 46 15.694 2.289 -9.044 1.00 1.00 C ATOM 677 CG PRO A 46 16.866 2.132 -10.009 1.00 1.00 C ATOM 678 CD PRO A 46 18.050 2.632 -9.192 1.00 1.00 C ATOM 0 HA PRO A 46 15.711 4.498 -8.712 1.00 1.00 H new ATOM 0 HB2 PRO A 46 15.598 1.426 -8.385 1.00 1.00 H new ATOM 0 HB3 PRO A 46 14.748 2.391 -9.575 1.00 1.00 H new ATOM 0 HG2 PRO A 46 16.998 1.095 -10.319 1.00 1.00 H new ATOM 0 HG3 PRO A 46 16.724 2.720 -10.916 1.00 1.00 H new ATOM 0 HD2 PRO A 46 18.549 1.805 -8.686 1.00 1.00 H new ATOM 0 HD3 PRO A 46 18.792 3.106 -9.835 1.00 1.00 H new ATOM 686 N TYR A 47 15.964 3.244 -5.787 1.00 1.00 N ATOM 687 CA TYR A 47 15.373 3.106 -4.449 1.00 1.00 C ATOM 688 C TYR A 47 15.741 4.210 -3.447 1.00 1.00 C ATOM 689 O TYR A 47 15.387 4.126 -2.277 1.00 1.00 O ATOM 690 CB TYR A 47 15.679 1.708 -3.886 1.00 1.00 C ATOM 691 CG TYR A 47 15.081 0.545 -4.663 1.00 1.00 C ATOM 692 CD1 TYR A 47 13.775 0.099 -4.373 1.00 1.00 C ATOM 693 CD2 TYR A 47 15.830 -0.097 -5.670 1.00 1.00 C ATOM 694 CE1 TYR A 47 13.199 -0.955 -5.110 1.00 1.00 C ATOM 695 CE2 TYR A 47 15.270 -1.169 -6.392 1.00 1.00 C ATOM 696 CZ TYR A 47 13.950 -1.593 -6.123 1.00 1.00 C ATOM 697 OH TYR A 47 13.402 -2.615 -6.838 1.00 1.00 O ATOM 0 H TYR A 47 16.969 3.068 -5.790 1.00 1.00 H new ATOM 0 HA TYR A 47 14.299 3.229 -4.587 1.00 1.00 H new ATOM 0 HB2 TYR A 47 16.761 1.579 -3.848 1.00 1.00 H new ATOM 0 HB3 TYR A 47 15.316 1.661 -2.859 1.00 1.00 H new ATOM 0 HD1 TYR A 47 13.212 0.569 -3.580 1.00 1.00 H new ATOM 0 HD2 TYR A 47 16.835 0.234 -5.888 1.00 1.00 H new ATOM 0 HE1 TYR A 47 12.188 -1.274 -4.902 1.00 1.00 H new ATOM 0 HE2 TYR A 47 15.851 -1.668 -7.153 1.00 1.00 H new ATOM 0 HH TYR A 47 14.114 -3.198 -7.174 1.00 1.00 H new ATOM 707 N GLN A 48 16.378 5.281 -3.909 1.00 1.00 N ATOM 708 CA GLN A 48 16.765 6.476 -3.119 1.00 1.00 C ATOM 709 C GLN A 48 15.598 7.103 -2.332 1.00 1.00 C ATOM 710 O GLN A 48 15.794 7.633 -1.242 1.00 1.00 O ATOM 711 CB GLN A 48 17.339 7.550 -4.056 1.00 1.00 C ATOM 712 CG GLN A 48 18.799 7.273 -4.440 1.00 1.00 C ATOM 713 CD GLN A 48 19.267 8.241 -5.525 1.00 1.00 C ATOM 714 OE1 GLN A 48 19.983 9.201 -5.277 1.00 1.00 O ATOM 715 NE2 GLN A 48 18.857 8.035 -6.757 1.00 1.00 N ATOM 0 H GLN A 48 16.658 5.357 -4.887 1.00 1.00 H new ATOM 0 HA GLN A 48 17.504 6.132 -2.395 1.00 1.00 H new ATOM 0 HB2 GLN A 48 16.732 7.601 -4.960 1.00 1.00 H new ATOM 0 HB3 GLN A 48 17.272 8.524 -3.571 1.00 1.00 H new ATOM 0 HG2 GLN A 48 19.436 7.370 -3.561 1.00 1.00 H new ATOM 0 HG3 GLN A 48 18.898 6.247 -4.794 1.00 1.00 H new ATOM 0 HE21 GLN A 48 18.260 7.236 -6.969 1.00 1.00 H new ATOM 0 HE22 GLN A 48 19.136 8.674 -7.501 1.00 1.00 H new ATOM 724 N ASP A 49 14.386 7.030 -2.889 1.00 1.00 N ATOM 725 CA ASP A 49 13.132 7.511 -2.280 1.00 1.00 C ATOM 726 C ASP A 49 12.231 6.378 -1.746 1.00 1.00 C ATOM 727 O ASP A 49 11.134 6.634 -1.245 1.00 1.00 O ATOM 728 CB ASP A 49 12.385 8.407 -3.280 1.00 1.00 C ATOM 729 CG ASP A 49 11.738 7.603 -4.423 1.00 1.00 C ATOM 730 OD1 ASP A 49 12.477 7.022 -5.250 1.00 1.00 O ATOM 731 OD2 ASP A 49 10.488 7.535 -4.496 1.00 1.00 O1- ATOM 0 H ASP A 49 14.240 6.620 -3.811 1.00 1.00 H new ATOM 0 HA ASP A 49 13.401 8.096 -1.401 1.00 1.00 H new ATOM 0 HB2 ASP A 49 11.614 8.969 -2.754 1.00 1.00 H new ATOM 0 HB3 ASP A 49 13.079 9.135 -3.700 1.00 1.00 H new ATOM 736 N LYS A 50 12.694 5.125 -1.861 1.00 1.00 N ATOM 737 CA LYS A 50 12.002 3.883 -1.520 1.00 1.00 C ATOM 738 C LYS A 50 12.670 3.194 -0.319 1.00 1.00 C ATOM 739 O LYS A 50 13.461 3.807 0.403 1.00 1.00 O ATOM 740 CB LYS A 50 11.972 2.980 -2.767 1.00 1.00 C ATOM 741 CG LYS A 50 11.239 3.598 -3.960 1.00 1.00 C ATOM 742 CD LYS A 50 9.785 3.973 -3.639 1.00 1.00 C ATOM 743 CE LYS A 50 8.927 4.190 -4.894 1.00 1.00 C ATOM 744 NZ LYS A 50 9.464 5.271 -5.770 1.00 1.00 N1+ ATOM 0 H LYS A 50 13.631 4.945 -2.222 1.00 1.00 H new ATOM 0 HA LYS A 50 10.977 4.097 -1.218 1.00 1.00 H new ATOM 0 HB2 LYS A 50 12.996 2.749 -3.062 1.00 1.00 H new ATOM 0 HB3 LYS A 50 11.494 2.035 -2.508 1.00 1.00 H new ATOM 0 HG2 LYS A 50 11.775 4.489 -4.287 1.00 1.00 H new ATOM 0 HG3 LYS A 50 11.252 2.894 -4.792 1.00 1.00 H new ATOM 0 HD2 LYS A 50 9.338 3.185 -3.033 1.00 1.00 H new ATOM 0 HD3 LYS A 50 9.775 4.882 -3.038 1.00 1.00 H new ATOM 0 HE2 LYS A 50 8.874 3.260 -5.460 1.00 1.00 H new ATOM 0 HE3 LYS A 50 7.909 4.440 -4.596 1.00 1.00 H new ATOM 0 HZ1 LYS A 50 8.768 5.496 -6.510 1.00 1.00 H new ATOM 0 HZ2 LYS A 50 9.650 6.120 -5.199 1.00 1.00 H new ATOM 0 HZ3 LYS A 50 10.349 4.951 -6.213 1.00 1.00 H new ATOM 758 N TYR A 51 12.352 1.914 -0.115 1.00 1.00 N ATOM 759 CA TYR A 51 13.048 1.052 0.842 1.00 1.00 C ATOM 760 C TYR A 51 13.904 -0.002 0.131 1.00 1.00 C ATOM 761 O TYR A 51 13.794 -0.257 -1.070 1.00 1.00 O ATOM 762 CB TYR A 51 12.069 0.429 1.847 1.00 1.00 C ATOM 763 CG TYR A 51 11.015 1.375 2.386 1.00 1.00 C ATOM 764 CD1 TYR A 51 11.352 2.678 2.798 1.00 1.00 C ATOM 765 CD2 TYR A 51 9.682 0.946 2.446 1.00 1.00 C ATOM 766 CE1 TYR A 51 10.356 3.547 3.280 1.00 1.00 C ATOM 767 CE2 TYR A 51 8.693 1.792 2.987 1.00 1.00 C ATOM 768 CZ TYR A 51 9.027 3.097 3.402 1.00 1.00 C ATOM 769 OH TYR A 51 8.077 3.921 3.917 1.00 1.00 O ATOM 0 H TYR A 51 11.597 1.443 -0.614 1.00 1.00 H new ATOM 0 HA TYR A 51 13.734 1.676 1.415 1.00 1.00 H new ATOM 0 HB2 TYR A 51 11.569 -0.414 1.369 1.00 1.00 H new ATOM 0 HB3 TYR A 51 12.639 0.028 2.685 1.00 1.00 H new ATOM 0 HD1 TYR A 51 12.378 3.012 2.744 1.00 1.00 H new ATOM 0 HD2 TYR A 51 9.413 -0.033 2.078 1.00 1.00 H new ATOM 0 HE1 TYR A 51 10.611 4.559 3.557 1.00 1.00 H new ATOM 0 HE2 TYR A 51 7.677 1.439 3.084 1.00 1.00 H new ATOM 0 HH TYR A 51 8.306 4.852 3.712 1.00 1.00 H new ATOM 779 N VAL A 52 14.799 -0.615 0.895 1.00 1.00 N ATOM 780 CA VAL A 52 15.823 -1.547 0.416 1.00 1.00 C ATOM 781 C VAL A 52 16.124 -2.564 1.509 1.00 1.00 C ATOM 782 O VAL A 52 15.848 -2.343 2.687 1.00 1.00 O ATOM 783 CB VAL A 52 17.118 -0.814 -0.018 1.00 1.00 C ATOM 784 CG1 VAL A 52 17.335 -0.901 -1.529 1.00 1.00 C ATOM 785 CG2 VAL A 52 17.163 0.673 0.334 1.00 1.00 C ATOM 0 H VAL A 52 14.837 -0.474 1.905 1.00 1.00 H new ATOM 0 HA VAL A 52 15.437 -2.057 -0.467 1.00 1.00 H new ATOM 0 HB VAL A 52 17.896 -1.333 0.542 1.00 1.00 H new ATOM 0 HG11 VAL A 52 18.252 -0.376 -1.796 1.00 1.00 H new ATOM 0 HG12 VAL A 52 17.416 -1.947 -1.825 1.00 1.00 H new ATOM 0 HG13 VAL A 52 16.491 -0.442 -2.045 1.00 1.00 H new ATOM 0 HG21 VAL A 52 18.106 1.100 -0.009 1.00 1.00 H new ATOM 0 HG22 VAL A 52 16.334 1.187 -0.152 1.00 1.00 H new ATOM 0 HG23 VAL A 52 17.082 0.794 1.414 1.00 1.00 H new ATOM 795 N LEU A 53 16.696 -3.691 1.123 1.00 1.00 N ATOM 796 CA LEU A 53 17.110 -4.755 2.014 1.00 1.00 C ATOM 797 C LEU A 53 18.460 -5.280 1.552 1.00 1.00 C ATOM 798 O LEU A 53 18.661 -5.613 0.392 1.00 1.00 O ATOM 799 CB LEU A 53 16.022 -5.830 1.993 1.00 1.00 C ATOM 800 CG LEU A 53 16.261 -7.057 2.864 1.00 1.00 C ATOM 801 CD1 LEU A 53 16.728 -6.673 4.269 1.00 1.00 C ATOM 802 CD2 LEU A 53 14.997 -7.891 3.039 1.00 1.00 C ATOM 0 H LEU A 53 16.891 -3.896 0.143 1.00 1.00 H new ATOM 0 HA LEU A 53 17.230 -4.410 3.041 1.00 1.00 H new ATOM 0 HB2 LEU A 53 15.083 -5.371 2.301 1.00 1.00 H new ATOM 0 HB3 LEU A 53 15.891 -6.163 0.963 1.00 1.00 H new ATOM 0 HG LEU A 53 17.028 -7.631 2.344 1.00 1.00 H new ATOM 0 HD11 LEU A 53 16.887 -7.576 4.859 1.00 1.00 H new ATOM 0 HD12 LEU A 53 17.661 -6.114 4.202 1.00 1.00 H new ATOM 0 HD13 LEU A 53 15.969 -6.055 4.749 1.00 1.00 H new ATOM 0 HD21 LEU A 53 15.215 -8.755 3.667 1.00 1.00 H new ATOM 0 HD22 LEU A 53 14.224 -7.285 3.511 1.00 1.00 H new ATOM 0 HD23 LEU A 53 14.647 -8.230 2.064 1.00 1.00 H new ATOM 814 N VAL A 54 19.391 -5.374 2.477 1.00 1.00 N ATOM 815 CA VAL A 54 20.720 -5.934 2.251 1.00 1.00 C ATOM 816 C VAL A 54 20.787 -7.311 2.878 1.00 1.00 C ATOM 817 O VAL A 54 20.505 -7.465 4.063 1.00 1.00 O ATOM 818 CB VAL A 54 21.807 -4.976 2.732 1.00 1.00 C ATOM 819 CG1 VAL A 54 23.199 -5.608 2.802 1.00 1.00 C ATOM 820 CG2 VAL A 54 21.874 -3.746 1.824 1.00 1.00 C ATOM 0 H VAL A 54 19.247 -5.056 3.436 1.00 1.00 H new ATOM 0 HA VAL A 54 20.906 -6.057 1.184 1.00 1.00 H new ATOM 0 HB VAL A 54 21.523 -4.698 3.747 1.00 1.00 H new ATOM 0 HG11 VAL A 54 23.918 -4.867 3.152 1.00 1.00 H new ATOM 0 HG12 VAL A 54 23.182 -6.451 3.493 1.00 1.00 H new ATOM 0 HG13 VAL A 54 23.490 -5.957 1.811 1.00 1.00 H new ATOM 0 HG21 VAL A 54 22.654 -3.073 2.180 1.00 1.00 H new ATOM 0 HG22 VAL A 54 22.102 -4.058 0.805 1.00 1.00 H new ATOM 0 HG23 VAL A 54 20.914 -3.230 1.839 1.00 1.00 H new ATOM 830 N VAL A 55 21.162 -8.314 2.086 1.00 1.00 N ATOM 831 CA VAL A 55 21.293 -9.703 2.541 1.00 1.00 C ATOM 832 C VAL A 55 22.712 -10.163 2.209 1.00 1.00 C ATOM 833 O VAL A 55 23.098 -10.208 1.048 1.00 1.00 O ATOM 834 CB VAL A 55 20.174 -10.585 1.940 1.00 1.00 C ATOM 835 CG1 VAL A 55 20.221 -11.976 2.577 1.00 1.00 C ATOM 836 CG2 VAL A 55 18.759 -10.022 2.201 1.00 1.00 C ATOM 0 H VAL A 55 21.387 -8.187 1.099 1.00 1.00 H new ATOM 0 HA VAL A 55 21.157 -9.791 3.619 1.00 1.00 H new ATOM 0 HB VAL A 55 20.352 -10.614 0.865 1.00 1.00 H new ATOM 0 HG11 VAL A 55 19.432 -12.597 2.153 1.00 1.00 H new ATOM 0 HG12 VAL A 55 21.190 -12.434 2.379 1.00 1.00 H new ATOM 0 HG13 VAL A 55 20.075 -11.888 3.654 1.00 1.00 H new ATOM 0 HG21 VAL A 55 18.016 -10.684 1.756 1.00 1.00 H new ATOM 0 HG22 VAL A 55 18.587 -9.954 3.275 1.00 1.00 H new ATOM 0 HG23 VAL A 55 18.674 -9.030 1.757 1.00 1.00 H new ATOM 846 N THR A 56 23.534 -10.444 3.219 1.00 1.00 N ATOM 847 CA THR A 56 24.983 -10.667 3.007 1.00 1.00 C ATOM 848 C THR A 56 25.614 -11.631 4.016 1.00 1.00 C ATOM 849 O THR A 56 25.686 -11.369 5.211 1.00 1.00 O ATOM 850 CB THR A 56 25.746 -9.328 2.888 1.00 1.00 C ATOM 851 OG1 THR A 56 27.115 -9.636 2.783 1.00 1.00 O ATOM 852 CG2 THR A 56 25.567 -8.319 4.027 1.00 1.00 C ATOM 0 H THR A 56 23.234 -10.525 4.191 1.00 1.00 H new ATOM 0 HA THR A 56 25.079 -11.179 2.049 1.00 1.00 H new ATOM 0 HB THR A 56 25.322 -8.829 2.016 1.00 1.00 H new ATOM 0 HG1 THR A 56 27.632 -8.807 2.704 1.00 1.00 H new ATOM 0 HG21 THR A 56 26.156 -7.426 3.818 1.00 1.00 H new ATOM 0 HG22 THR A 56 24.514 -8.048 4.111 1.00 1.00 H new ATOM 0 HG23 THR A 56 25.903 -8.764 4.963 1.00 1.00 H new ATOM 998 N ILE A 68 29.942 -7.338 -3.878 1.00 1.00 N ATOM 999 CA ILE A 68 29.116 -6.378 -3.129 1.00 1.00 C ATOM 1000 C ILE A 68 29.887 -5.108 -2.738 1.00 1.00 C ATOM 1001 O ILE A 68 29.280 -4.077 -2.464 1.00 1.00 O ATOM 1002 CB ILE A 68 28.381 -7.109 -1.999 1.00 1.00 C ATOM 1003 CG1 ILE A 68 27.366 -6.176 -1.327 1.00 1.00 C ATOM 1004 CG2 ILE A 68 29.345 -7.744 -0.988 1.00 1.00 C ATOM 1005 CD1 ILE A 68 26.214 -6.926 -0.660 1.00 1.00 C ATOM 0 HA ILE A 68 28.336 -5.974 -3.774 1.00 1.00 H new ATOM 0 HB ILE A 68 27.830 -7.938 -2.444 1.00 1.00 H new ATOM 0 HG12 ILE A 68 27.878 -5.569 -0.580 1.00 1.00 H new ATOM 0 HG13 ILE A 68 26.962 -5.490 -2.072 1.00 1.00 H new ATOM 0 HG21 ILE A 68 28.774 -8.249 -0.209 1.00 1.00 H new ATOM 0 HG22 ILE A 68 29.982 -8.467 -1.497 1.00 1.00 H new ATOM 0 HG23 ILE A 68 29.964 -6.968 -0.539 1.00 1.00 H new ATOM 0 HD11 ILE A 68 25.530 -6.211 -0.203 1.00 1.00 H new ATOM 0 HD12 ILE A 68 25.680 -7.512 -1.408 1.00 1.00 H new ATOM 0 HD13 ILE A 68 26.609 -7.592 0.107 1.00 1.00 H new ATOM 1017 N VAL A 69 31.218 -5.136 -2.817 1.00 1.00 N ATOM 1018 CA VAL A 69 32.099 -3.957 -2.731 1.00 1.00 C ATOM 1019 C VAL A 69 31.604 -2.796 -3.602 1.00 1.00 C ATOM 1020 O VAL A 69 31.499 -1.689 -3.076 1.00 1.00 O ATOM 1021 CB VAL A 69 33.524 -4.362 -3.163 1.00 1.00 C ATOM 1022 CG1 VAL A 69 34.320 -3.308 -3.953 1.00 1.00 C ATOM 1023 CG2 VAL A 69 34.306 -4.780 -1.921 1.00 1.00 C ATOM 0 H VAL A 69 31.735 -6.005 -2.947 1.00 1.00 H new ATOM 0 HA VAL A 69 32.095 -3.609 -1.698 1.00 1.00 H new ATOM 0 HB VAL A 69 33.395 -5.182 -3.870 1.00 1.00 H new ATOM 0 HG11 VAL A 69 35.304 -3.706 -4.201 1.00 1.00 H new ATOM 0 HG12 VAL A 69 33.786 -3.062 -4.871 1.00 1.00 H new ATOM 0 HG13 VAL A 69 34.434 -2.409 -3.347 1.00 1.00 H new ATOM 0 HG21 VAL A 69 35.317 -5.070 -2.208 1.00 1.00 H new ATOM 0 HG22 VAL A 69 34.353 -3.945 -1.222 1.00 1.00 H new ATOM 0 HG23 VAL A 69 33.808 -5.624 -1.444 1.00 1.00 H new ATOM 1033 N PRO A 70 31.289 -2.990 -4.903 1.00 1.00 N ATOM 1034 CA PRO A 70 30.951 -1.877 -5.784 1.00 1.00 C ATOM 1035 C PRO A 70 29.609 -1.242 -5.402 1.00 1.00 C ATOM 1036 O PRO A 70 29.432 -0.044 -5.590 1.00 1.00 O ATOM 1037 CB PRO A 70 30.963 -2.429 -7.211 1.00 1.00 C ATOM 1038 CG PRO A 70 30.690 -3.911 -6.995 1.00 1.00 C ATOM 1039 CD PRO A 70 31.391 -4.213 -5.689 1.00 1.00 C ATOM 0 HA PRO A 70 31.676 -1.068 -5.693 1.00 1.00 H new ATOM 0 HB2 PRO A 70 30.199 -1.962 -7.833 1.00 1.00 H new ATOM 0 HB3 PRO A 70 31.921 -2.261 -7.703 1.00 1.00 H new ATOM 0 HG2 PRO A 70 29.621 -4.117 -6.934 1.00 1.00 H new ATOM 0 HG3 PRO A 70 31.085 -4.515 -7.812 1.00 1.00 H new ATOM 0 HD2 PRO A 70 30.920 -5.051 -5.175 1.00 1.00 H new ATOM 0 HD3 PRO A 70 32.433 -4.487 -5.856 1.00 1.00 H new ATOM 1047 N LEU A 71 28.683 -2.008 -4.808 1.00 1.00 N ATOM 1048 CA LEU A 71 27.471 -1.483 -4.202 1.00 1.00 C ATOM 1049 C LEU A 71 27.797 -0.710 -2.919 1.00 1.00 C ATOM 1050 O LEU A 71 27.424 0.444 -2.805 1.00 1.00 O ATOM 1051 CB LEU A 71 26.569 -2.695 -3.930 1.00 1.00 C ATOM 1052 CG LEU A 71 25.165 -2.326 -3.447 1.00 1.00 C ATOM 1053 CD1 LEU A 71 24.341 -1.840 -4.628 1.00 1.00 C ATOM 1054 CD2 LEU A 71 24.516 -3.562 -2.840 1.00 1.00 C ATOM 0 H LEU A 71 28.765 -3.022 -4.739 1.00 1.00 H new ATOM 0 HA LEU A 71 26.967 -0.773 -4.858 1.00 1.00 H new ATOM 0 HB2 LEU A 71 26.485 -3.285 -4.842 1.00 1.00 H new ATOM 0 HB3 LEU A 71 27.045 -3.329 -3.182 1.00 1.00 H new ATOM 0 HG LEU A 71 25.220 -1.535 -2.699 1.00 1.00 H new ATOM 0 HD11 LEU A 71 23.339 -1.576 -4.289 1.00 1.00 H new ATOM 0 HD12 LEU A 71 24.818 -0.964 -5.068 1.00 1.00 H new ATOM 0 HD13 LEU A 71 24.274 -2.631 -5.375 1.00 1.00 H new ATOM 0 HD21 LEU A 71 23.514 -3.313 -2.491 1.00 1.00 H new ATOM 0 HD22 LEU A 71 24.453 -4.347 -3.593 1.00 1.00 H new ATOM 0 HD23 LEU A 71 25.116 -3.912 -2.000 1.00 1.00 H new ATOM 1066 N PHE A 72 28.547 -1.298 -1.989 1.00 1.00 N ATOM 1067 CA PHE A 72 28.928 -0.671 -0.717 1.00 1.00 C ATOM 1068 C PHE A 72 29.634 0.675 -0.915 1.00 1.00 C ATOM 1069 O PHE A 72 29.185 1.720 -0.434 1.00 1.00 O ATOM 1070 CB PHE A 72 29.820 -1.663 0.035 1.00 1.00 C ATOM 1071 CG PHE A 72 30.378 -1.145 1.335 1.00 1.00 C ATOM 1072 CD1 PHE A 72 29.567 -1.149 2.479 1.00 1.00 C ATOM 1073 CD2 PHE A 72 31.706 -0.687 1.407 1.00 1.00 C ATOM 1074 CE1 PHE A 72 30.105 -0.740 3.708 1.00 1.00 C ATOM 1075 CE2 PHE A 72 32.237 -0.264 2.640 1.00 1.00 C ATOM 1076 CZ PHE A 72 31.438 -0.300 3.794 1.00 1.00 C ATOM 0 H PHE A 72 28.916 -2.243 -2.097 1.00 1.00 H new ATOM 0 HA PHE A 72 28.031 -0.446 -0.140 1.00 1.00 H new ATOM 0 HB2 PHE A 72 29.246 -2.567 0.236 1.00 1.00 H new ATOM 0 HB3 PHE A 72 30.649 -1.949 -0.613 1.00 1.00 H new ATOM 0 HD1 PHE A 72 28.536 -1.465 2.414 1.00 1.00 H new ATOM 0 HD2 PHE A 72 32.318 -0.660 0.517 1.00 1.00 H new ATOM 0 HE1 PHE A 72 29.490 -0.763 4.596 1.00 1.00 H new ATOM 0 HE2 PHE A 72 33.257 0.087 2.698 1.00 1.00 H new ATOM 0 HZ PHE A 72 31.846 0.009 4.745 1.00 1.00 H new ATOM 1086 N GLN A 73 30.712 0.655 -1.699 1.00 1.00 N ATOM 1087 CA GLN A 73 31.460 1.850 -2.066 1.00 1.00 C ATOM 1088 C GLN A 73 30.651 2.768 -2.982 1.00 1.00 C ATOM 1089 O GLN A 73 30.705 3.981 -2.835 1.00 1.00 O ATOM 1090 CB GLN A 73 32.802 1.483 -2.713 1.00 1.00 C ATOM 1091 CG GLN A 73 33.763 0.811 -1.720 1.00 1.00 C ATOM 1092 CD GLN A 73 35.215 0.890 -2.188 1.00 1.00 C ATOM 1093 OE1 GLN A 73 35.812 -0.084 -2.626 1.00 1.00 O ATOM 1094 NE2 GLN A 73 35.837 2.050 -2.107 1.00 1.00 N ATOM 0 H GLN A 73 31.092 -0.203 -2.100 1.00 1.00 H new ATOM 0 HA GLN A 73 31.661 2.399 -1.146 1.00 1.00 H new ATOM 0 HB2 GLN A 73 32.626 0.813 -3.555 1.00 1.00 H new ATOM 0 HB3 GLN A 73 33.268 2.383 -3.114 1.00 1.00 H new ATOM 0 HG2 GLN A 73 33.670 1.289 -0.745 1.00 1.00 H new ATOM 0 HG3 GLN A 73 33.480 -0.234 -1.591 1.00 1.00 H new ATOM 0 HE21 GLN A 73 35.347 2.867 -1.743 1.00 1.00 H new ATOM 0 HE22 GLN A 73 36.808 2.130 -2.408 1.00 1.00 H new ATOM 1103 N GLY A 74 29.834 2.207 -3.873 1.00 1.00 N ATOM 1104 CA GLY A 74 28.952 2.986 -4.734 1.00 1.00 C ATOM 1105 C GLY A 74 27.894 3.753 -3.941 1.00 1.00 C ATOM 1106 O GLY A 74 27.604 4.897 -4.261 1.00 1.00 O ATOM 0 H GLY A 74 29.767 1.199 -4.016 1.00 1.00 H new ATOM 0 HA2 GLY A 74 29.546 3.689 -5.317 1.00 1.00 H new ATOM 0 HA3 GLY A 74 28.460 2.320 -5.443 1.00 1.00 H new ATOM 1110 N ILE A 75 27.360 3.209 -2.848 1.00 1.00 N ATOM 1111 CA ILE A 75 26.511 3.973 -1.949 1.00 1.00 C ATOM 1112 C ILE A 75 27.377 5.070 -1.297 1.00 1.00 C ATOM 1113 O ILE A 75 27.058 6.251 -1.385 1.00 1.00 O ATOM 1114 CB ILE A 75 25.803 3.011 -0.971 1.00 1.00 C ATOM 1115 CG1 ILE A 75 24.859 1.998 -1.667 1.00 1.00 C ATOM 1116 CG2 ILE A 75 25.000 3.747 0.103 1.00 1.00 C ATOM 1117 CD1 ILE A 75 24.440 0.861 -0.723 1.00 1.00 C ATOM 0 H ILE A 75 27.504 2.239 -2.567 1.00 1.00 H new ATOM 0 HA ILE A 75 25.701 4.489 -2.465 1.00 1.00 H new ATOM 0 HB ILE A 75 26.624 2.463 -0.508 1.00 1.00 H new ATOM 0 HG12 ILE A 75 23.970 2.518 -2.026 1.00 1.00 H new ATOM 0 HG13 ILE A 75 25.358 1.579 -2.541 1.00 1.00 H new ATOM 0 HG21 ILE A 75 24.524 3.021 0.762 1.00 1.00 H new ATOM 0 HG22 ILE A 75 25.668 4.383 0.685 1.00 1.00 H new ATOM 0 HG23 ILE A 75 24.236 4.362 -0.372 1.00 1.00 H new ATOM 0 HD11 ILE A 75 23.779 0.174 -1.252 1.00 1.00 H new ATOM 0 HD12 ILE A 75 25.326 0.324 -0.385 1.00 1.00 H new ATOM 0 HD13 ILE A 75 23.917 1.277 0.138 1.00 1.00 H new ATOM 1129 N LYS A 76 28.526 4.728 -0.713 1.00 1.00 N ATOM 1130 CA LYS A 76 29.280 5.695 0.112 1.00 1.00 C ATOM 1131 C LYS A 76 29.888 6.855 -0.695 1.00 1.00 C ATOM 1132 O LYS A 76 29.991 7.964 -0.175 1.00 1.00 O ATOM 1133 CB LYS A 76 30.294 4.950 0.994 1.00 1.00 C ATOM 1134 CG LYS A 76 31.751 4.892 0.524 1.00 1.00 C ATOM 1135 CD LYS A 76 32.533 3.817 1.301 1.00 1.00 C ATOM 1136 CE LYS A 76 32.714 4.037 2.819 1.00 1.00 C ATOM 1137 NZ LYS A 76 33.306 5.361 3.169 1.00 1.00 N1+ ATOM 0 H LYS A 76 28.956 3.806 -0.789 1.00 1.00 H new ATOM 0 HA LYS A 76 28.572 6.195 0.773 1.00 1.00 H new ATOM 0 HB2 LYS A 76 30.280 5.411 1.981 1.00 1.00 H new ATOM 0 HB3 LYS A 76 29.941 3.926 1.116 1.00 1.00 H new ATOM 0 HG2 LYS A 76 31.785 4.673 -0.543 1.00 1.00 H new ATOM 0 HG3 LYS A 76 32.223 5.865 0.665 1.00 1.00 H new ATOM 0 HD2 LYS A 76 32.029 2.861 1.156 1.00 1.00 H new ATOM 0 HD3 LYS A 76 33.522 3.728 0.852 1.00 1.00 H new ATOM 0 HE2 LYS A 76 31.745 3.942 3.309 1.00 1.00 H new ATOM 0 HE3 LYS A 76 33.351 3.248 3.218 1.00 1.00 H new ATOM 0 HZ1 LYS A 76 34.035 5.233 3.900 1.00 1.00 H new ATOM 0 HZ2 LYS A 76 33.736 5.784 2.322 1.00 1.00 H new ATOM 0 HZ3 LYS A 76 32.561 5.990 3.530 1.00 1.00 H new ATOM 1151 N ASP A 77 30.241 6.603 -1.959 1.00 1.00 N ATOM 1152 CA ASP A 77 30.899 7.538 -2.870 1.00 1.00 C ATOM 1153 C ASP A 77 30.007 8.093 -3.999 1.00 1.00 C ATOM 1154 O ASP A 77 30.129 9.272 -4.339 1.00 1.00 O ATOM 1155 CB ASP A 77 32.169 6.907 -3.465 1.00 1.00 C ATOM 1156 CG ASP A 77 33.260 6.603 -2.419 1.00 1.00 C ATOM 1157 OD1 ASP A 77 33.604 7.508 -1.619 1.00 1.00 O ATOM 1158 OD2 ASP A 77 33.827 5.481 -2.423 1.00 1.00 O1- ATOM 0 H ASP A 77 30.066 5.697 -2.394 1.00 1.00 H new ATOM 0 HA ASP A 77 31.152 8.399 -2.251 1.00 1.00 H new ATOM 0 HB2 ASP A 77 31.900 5.982 -3.975 1.00 1.00 H new ATOM 0 HB3 ASP A 77 32.579 7.579 -4.219 1.00 1.00 H new ATOM 1163 N SER A 78 29.110 7.277 -4.568 1.00 1.00 N ATOM 1164 CA SER A 78 28.249 7.661 -5.708 1.00 1.00 C ATOM 1165 C SER A 78 26.870 8.183 -5.276 1.00 1.00 C ATOM 1166 O SER A 78 26.235 8.910 -6.044 1.00 1.00 O ATOM 1167 CB SER A 78 28.116 6.547 -6.769 1.00 1.00 C ATOM 1168 OG SER A 78 29.395 6.052 -7.154 1.00 1.00 O ATOM 0 H SER A 78 28.956 6.320 -4.251 1.00 1.00 H new ATOM 0 HA SER A 78 28.770 8.493 -6.181 1.00 1.00 H new ATOM 0 HB2 SER A 78 27.511 5.732 -6.371 1.00 1.00 H new ATOM 0 HB3 SER A 78 27.594 6.934 -7.644 1.00 1.00 H new ATOM 0 HG SER A 78 29.284 5.347 -7.825 1.00 1.00 H new ATOM 1174 N LEU A 79 26.410 7.860 -4.058 1.00 1.00 N ATOM 1175 CA LEU A 79 25.223 8.480 -3.446 1.00 1.00 C ATOM 1176 C LEU A 79 25.730 9.670 -2.617 1.00 1.00 C ATOM 1177 O LEU A 79 25.572 10.824 -3.009 1.00 1.00 O ATOM 1178 CB LEU A 79 24.365 7.467 -2.640 1.00 1.00 C ATOM 1179 CG LEU A 79 23.600 6.348 -3.386 1.00 1.00 C ATOM 1180 CD1 LEU A 79 22.139 6.753 -3.569 1.00 1.00 C ATOM 1181 CD2 LEU A 79 24.114 6.024 -4.781 1.00 1.00 C ATOM 0 H LEU A 79 26.853 7.157 -3.466 1.00 1.00 H new ATOM 0 HA LEU A 79 24.530 8.835 -4.209 1.00 1.00 H new ATOM 0 HB2 LEU A 79 25.023 6.985 -1.917 1.00 1.00 H new ATOM 0 HB3 LEU A 79 23.632 8.040 -2.072 1.00 1.00 H new ATOM 0 HG LEU A 79 23.741 5.469 -2.757 1.00 1.00 H new ATOM 0 HD11 LEU A 79 21.605 5.961 -4.095 1.00 1.00 H new ATOM 0 HD12 LEU A 79 21.681 6.913 -2.593 1.00 1.00 H new ATOM 0 HD13 LEU A 79 22.087 7.674 -4.150 1.00 1.00 H new ATOM 0 HD21 LEU A 79 23.510 5.228 -5.216 1.00 1.00 H new ATOM 0 HD22 LEU A 79 24.049 6.913 -5.408 1.00 1.00 H new ATOM 0 HD23 LEU A 79 25.153 5.699 -4.720 1.00 1.00 H new ATOM 1193 N GLY A 80 26.396 9.381 -1.495 1.00 1.00 N ATOM 1194 CA GLY A 80 27.162 10.300 -0.633 1.00 1.00 C ATOM 1195 C GLY A 80 26.320 11.279 0.197 1.00 1.00 C ATOM 1196 O GLY A 80 26.762 11.786 1.227 1.00 1.00 O ATOM 0 H GLY A 80 26.418 8.427 -1.134 1.00 1.00 H new ATOM 0 HA2 GLY A 80 27.775 9.708 0.046 1.00 1.00 H new ATOM 0 HA3 GLY A 80 27.845 10.875 -1.259 1.00 1.00 H new ATOM 1200 N PHE A 81 25.076 11.479 -0.220 1.00 1.00 N ATOM 1201 CA PHE A 81 23.993 12.185 0.468 1.00 1.00 C ATOM 1202 C PHE A 81 22.663 11.587 -0.009 1.00 1.00 C ATOM 1203 O PHE A 81 22.527 11.258 -1.191 1.00 1.00 O ATOM 1204 CB PHE A 81 24.049 13.692 0.167 1.00 1.00 C ATOM 1205 CG PHE A 81 22.908 14.463 0.804 1.00 1.00 C ATOM 1206 CD1 PHE A 81 22.980 14.823 2.163 1.00 1.00 C ATOM 1207 CD2 PHE A 81 21.748 14.762 0.058 1.00 1.00 C ATOM 1208 CE1 PHE A 81 21.895 15.478 2.773 1.00 1.00 C ATOM 1209 CE2 PHE A 81 20.663 15.412 0.674 1.00 1.00 C ATOM 1210 CZ PHE A 81 20.736 15.773 2.029 1.00 1.00 C ATOM 0 H PHE A 81 24.769 11.122 -1.125 1.00 1.00 H new ATOM 0 HA PHE A 81 24.093 12.066 1.547 1.00 1.00 H new ATOM 0 HB2 PHE A 81 24.997 14.094 0.525 1.00 1.00 H new ATOM 0 HB3 PHE A 81 24.025 13.843 -0.912 1.00 1.00 H new ATOM 0 HD1 PHE A 81 23.867 14.597 2.736 1.00 1.00 H new ATOM 0 HD2 PHE A 81 21.693 14.492 -0.986 1.00 1.00 H new ATOM 0 HE1 PHE A 81 21.951 15.756 3.815 1.00 1.00 H new ATOM 0 HE2 PHE A 81 19.773 15.634 0.104 1.00 1.00 H new ATOM 0 HZ PHE A 81 19.905 16.276 2.500 1.00 1.00 H new ATOM 1220 N GLN A 82 21.701 11.394 0.902 1.00 1.00 N ATOM 1221 CA GLN A 82 20.468 10.640 0.623 1.00 1.00 C ATOM 1222 C GLN A 82 19.257 11.368 1.244 1.00 1.00 C ATOM 1223 O GLN A 82 19.245 11.571 2.459 1.00 1.00 O ATOM 1224 CB GLN A 82 20.608 9.198 1.159 1.00 1.00 C ATOM 1225 CG GLN A 82 22.010 8.606 0.882 1.00 1.00 C ATOM 1226 CD GLN A 82 22.171 7.114 1.038 1.00 1.00 C ATOM 1227 OE1 GLN A 82 22.527 6.618 2.085 1.00 1.00 O ATOM 1228 NE2 GLN A 82 21.970 6.337 0.001 1.00 1.00 N ATOM 0 H GLN A 82 21.754 11.756 1.854 1.00 1.00 H new ATOM 0 HA GLN A 82 20.303 10.582 -0.453 1.00 1.00 H new ATOM 0 HB2 GLN A 82 20.418 9.191 2.232 1.00 1.00 H new ATOM 0 HB3 GLN A 82 19.850 8.565 0.697 1.00 1.00 H new ATOM 0 HG2 GLN A 82 22.294 8.872 -0.136 1.00 1.00 H new ATOM 0 HG3 GLN A 82 22.721 9.094 1.549 1.00 1.00 H new ATOM 0 HE21 GLN A 82 21.670 6.739 -0.887 1.00 1.00 H new ATOM 0 HE22 GLN A 82 22.113 5.330 0.083 1.00 1.00 H new ATOM 1237 N PRO A 83 18.237 11.754 0.451 1.00 1.00 N ATOM 1238 CA PRO A 83 17.165 12.642 0.914 1.00 1.00 C ATOM 1239 C PRO A 83 16.039 11.961 1.712 1.00 1.00 C ATOM 1240 O PRO A 83 15.501 12.560 2.644 1.00 1.00 O ATOM 1241 CB PRO A 83 16.641 13.306 -0.364 1.00 1.00 C ATOM 1242 CG PRO A 83 16.869 12.233 -1.431 1.00 1.00 C ATOM 1243 CD PRO A 83 18.185 11.609 -1.001 1.00 1.00 C ATOM 0 HA PRO A 83 17.560 13.351 1.642 1.00 1.00 H new ATOM 0 HB2 PRO A 83 15.587 13.571 -0.278 1.00 1.00 H new ATOM 0 HB3 PRO A 83 17.183 14.224 -0.593 1.00 1.00 H new ATOM 0 HG2 PRO A 83 16.061 11.502 -1.449 1.00 1.00 H new ATOM 0 HG3 PRO A 83 16.932 12.663 -2.431 1.00 1.00 H new ATOM 0 HD2 PRO A 83 18.234 10.560 -1.291 1.00 1.00 H new ATOM 0 HD3 PRO A 83 19.029 12.110 -1.475 1.00 1.00 H new ATOM 1251 N ASN A 84 15.670 10.724 1.350 1.00 1.00 N ATOM 1252 CA ASN A 84 14.476 10.025 1.867 1.00 1.00 C ATOM 1253 C ASN A 84 14.676 8.505 2.086 1.00 1.00 C ATOM 1254 O ASN A 84 13.699 7.765 2.220 1.00 1.00 O ATOM 1255 CB ASN A 84 13.297 10.306 0.902 1.00 1.00 C ATOM 1256 CG ASN A 84 12.800 11.742 0.946 1.00 1.00 C ATOM 1257 OD1 ASN A 84 12.233 12.201 1.928 1.00 1.00 O ATOM 1258 ND2 ASN A 84 12.986 12.499 -0.115 1.00 1.00 N ATOM 0 H ASN A 84 16.199 10.168 0.678 1.00 1.00 H new ATOM 0 HA ASN A 84 14.265 10.416 2.862 1.00 1.00 H new ATOM 0 HB2 ASN A 84 13.608 10.069 -0.116 1.00 1.00 H new ATOM 0 HB3 ASN A 84 12.472 9.638 1.147 1.00 1.00 H new ATOM 0 HD21 ASN A 84 12.658 13.465 -0.116 1.00 1.00 H new ATOM 0 HD22 ASN A 84 13.458 12.120 -0.936 1.00 1.00 H new ATOM 1265 N LEU A 85 15.921 8.008 2.117 1.00 1.00 N ATOM 1266 CA LEU A 85 16.187 6.565 2.098 1.00 1.00 C ATOM 1267 C LEU A 85 16.051 5.920 3.470 1.00 1.00 C ATOM 1268 O LEU A 85 16.534 6.456 4.462 1.00 1.00 O ATOM 1269 CB LEU A 85 17.597 6.327 1.550 1.00 1.00 C ATOM 1270 CG LEU A 85 18.046 4.854 1.494 1.00 1.00 C ATOM 1271 CD1 LEU A 85 17.145 4.065 0.561 1.00 1.00 C ATOM 1272 CD2 LEU A 85 19.469 4.813 0.955 1.00 1.00 C ATOM 0 H LEU A 85 16.760 8.587 2.155 1.00 1.00 H new ATOM 0 HA LEU A 85 15.438 6.099 1.457 1.00 1.00 H new ATOM 0 HB2 LEU A 85 17.653 6.744 0.545 1.00 1.00 H new ATOM 0 HB3 LEU A 85 18.306 6.882 2.165 1.00 1.00 H new ATOM 0 HG LEU A 85 17.993 4.416 2.491 1.00 1.00 H new ATOM 0 HD11 LEU A 85 17.473 3.026 0.531 1.00 1.00 H new ATOM 0 HD12 LEU A 85 16.118 4.111 0.922 1.00 1.00 H new ATOM 0 HD13 LEU A 85 17.196 4.491 -0.441 1.00 1.00 H new ATOM 0 HD21 LEU A 85 19.810 3.779 0.906 1.00 1.00 H new ATOM 0 HD22 LEU A 85 19.493 5.251 -0.043 1.00 1.00 H new ATOM 0 HD23 LEU A 85 20.125 5.380 1.616 1.00 1.00 H new ATOM 1284 N ARG A 86 15.470 4.723 3.485 1.00 1.00 N ATOM 1285 CA ARG A 86 15.396 3.772 4.607 1.00 1.00 C ATOM 1286 C ARG A 86 15.685 2.359 4.093 1.00 1.00 C ATOM 1287 O ARG A 86 15.445 2.082 2.927 1.00 1.00 O ATOM 1288 CB ARG A 86 14.006 3.828 5.259 1.00 1.00 C ATOM 1289 CG ARG A 86 13.357 5.227 5.302 1.00 1.00 C ATOM 1290 CD ARG A 86 12.678 5.464 6.641 1.00 1.00 C ATOM 1291 NE ARG A 86 11.670 4.419 6.912 1.00 1.00 N ATOM 1292 CZ ARG A 86 10.363 4.472 6.691 1.00 1.00 C ATOM 1293 NH1 ARG A 86 9.790 5.532 6.201 1.00 1.00 N1+ ATOM 1294 NH2 ARG A 86 9.598 3.449 6.939 1.00 1.00 N ATOM 0 H ARG A 86 15.002 4.359 2.655 1.00 1.00 H new ATOM 0 HA ARG A 86 16.139 4.041 5.358 1.00 1.00 H new ATOM 0 HB2 ARG A 86 13.342 3.153 4.719 1.00 1.00 H new ATOM 0 HB3 ARG A 86 14.085 3.450 6.278 1.00 1.00 H new ATOM 0 HG2 ARG A 86 14.116 5.991 5.134 1.00 1.00 H new ATOM 0 HG3 ARG A 86 12.628 5.320 4.497 1.00 1.00 H new ATOM 0 HD2 ARG A 86 13.424 5.470 7.436 1.00 1.00 H new ATOM 0 HD3 ARG A 86 12.201 6.444 6.643 1.00 1.00 H new ATOM 0 HE ARG A 86 12.021 3.552 7.318 1.00 1.00 H new ATOM 0 HH11 ARG A 86 10.348 6.355 5.975 1.00 1.00 H new ATOM 0 HH12 ARG A 86 8.782 5.540 6.043 1.00 1.00 H new ATOM 0 HH21 ARG A 86 10.001 2.588 7.309 1.00 1.00 H new ATOM 0 HH22 ARG A 86 8.595 3.508 6.763 1.00 1.00 H new ATOM 1308 N TYR A 87 16.165 1.449 4.931 1.00 1.00 N ATOM 1309 CA TYR A 87 16.520 0.080 4.522 1.00 1.00 C ATOM 1310 C TYR A 87 16.576 -0.880 5.722 1.00 1.00 C ATOM 1311 O TYR A 87 16.560 -0.429 6.868 1.00 1.00 O ATOM 1312 CB TYR A 87 17.861 0.085 3.755 1.00 1.00 C ATOM 1313 CG TYR A 87 19.079 -0.322 4.541 1.00 1.00 C ATOM 1314 CD1 TYR A 87 19.455 0.425 5.670 1.00 1.00 C ATOM 1315 CD2 TYR A 87 19.827 -1.444 4.141 1.00 1.00 C ATOM 1316 CE1 TYR A 87 20.606 0.053 6.393 1.00 1.00 C ATOM 1317 CE2 TYR A 87 20.959 -1.823 4.870 1.00 1.00 C ATOM 1318 CZ TYR A 87 21.313 -1.105 6.014 1.00 1.00 C ATOM 1319 OH TYR A 87 22.300 -1.600 6.784 1.00 1.00 O ATOM 0 H TYR A 87 16.323 1.633 5.922 1.00 1.00 H new ATOM 0 HA TYR A 87 15.736 -0.285 3.858 1.00 1.00 H new ATOM 0 HB2 TYR A 87 17.768 -0.582 2.898 1.00 1.00 H new ATOM 0 HB3 TYR A 87 18.027 1.088 3.362 1.00 1.00 H new ATOM 0 HD1 TYR A 87 18.867 1.276 5.981 1.00 1.00 H new ATOM 0 HD2 TYR A 87 19.528 -2.012 3.272 1.00 1.00 H new ATOM 0 HE1 TYR A 87 20.942 0.649 7.228 1.00 1.00 H new ATOM 0 HE2 TYR A 87 21.555 -2.665 4.550 1.00 1.00 H new ATOM 0 HH TYR A 87 22.672 -2.403 6.363 1.00 1.00 H new ATOM 1329 N GLY A 88 16.691 -2.183 5.469 1.00 1.00 N ATOM 1330 CA GLY A 88 16.967 -3.212 6.482 1.00 1.00 C ATOM 1331 C GLY A 88 18.122 -4.134 6.109 1.00 1.00 C ATOM 1332 O GLY A 88 18.617 -4.120 4.983 1.00 1.00 O ATOM 0 H GLY A 88 16.593 -2.567 4.529 1.00 1.00 H new ATOM 0 HA2 GLY A 88 17.192 -2.726 7.431 1.00 1.00 H new ATOM 0 HA3 GLY A 88 16.069 -3.810 6.635 1.00 1.00 H new ATOM 1336 N VAL A 89 18.543 -4.977 7.055 1.00 1.00 N ATOM 1337 CA VAL A 89 19.765 -5.783 6.955 1.00 1.00 C ATOM 1338 C VAL A 89 19.612 -7.192 7.516 1.00 1.00 C ATOM 1339 O VAL A 89 19.139 -7.387 8.636 1.00 1.00 O ATOM 1340 CB VAL A 89 20.959 -5.162 7.714 1.00 1.00 C ATOM 1341 CG1 VAL A 89 22.190 -5.060 6.825 1.00 1.00 C ATOM 1342 CG2 VAL A 89 20.678 -3.835 8.434 1.00 1.00 C ATOM 0 H VAL A 89 18.036 -5.122 7.928 1.00 1.00 H new ATOM 0 HA VAL A 89 19.951 -5.814 5.881 1.00 1.00 H new ATOM 0 HB VAL A 89 21.155 -5.867 8.522 1.00 1.00 H new ATOM 0 HG11 VAL A 89 23.011 -4.619 7.390 1.00 1.00 H new ATOM 0 HG12 VAL A 89 22.477 -6.055 6.485 1.00 1.00 H new ATOM 0 HG13 VAL A 89 21.965 -4.433 5.962 1.00 1.00 H new ATOM 0 HG21 VAL A 89 21.585 -3.492 8.932 1.00 1.00 H new ATOM 0 HG22 VAL A 89 20.358 -3.088 7.708 1.00 1.00 H new ATOM 0 HG23 VAL A 89 19.891 -3.982 9.174 1.00 1.00 H new ATOM 1352 N ILE A 90 20.182 -8.150 6.792 1.00 1.00 N ATOM 1353 CA ILE A 90 20.374 -9.536 7.214 1.00 1.00 C ATOM 1354 C ILE A 90 21.837 -9.895 6.930 1.00 1.00 C ATOM 1355 O ILE A 90 22.205 -10.254 5.811 1.00 1.00 O ATOM 1356 CB ILE A 90 19.370 -10.423 6.454 1.00 1.00 C ATOM 1357 CG1 ILE A 90 17.897 -10.096 6.795 1.00 1.00 C ATOM 1358 CG2 ILE A 90 19.570 -11.923 6.687 1.00 1.00 C ATOM 1359 CD1 ILE A 90 17.061 -10.144 5.527 1.00 1.00 C ATOM 0 H ILE A 90 20.539 -7.975 5.853 1.00 1.00 H new ATOM 0 HA ILE A 90 20.186 -9.688 8.277 1.00 1.00 H new ATOM 0 HB ILE A 90 19.575 -10.191 5.409 1.00 1.00 H new ATOM 0 HG12 ILE A 90 17.514 -10.811 7.523 1.00 1.00 H new ATOM 0 HG13 ILE A 90 17.829 -9.108 7.251 1.00 1.00 H new ATOM 0 HG21 ILE A 90 18.826 -12.482 6.119 1.00 1.00 H new ATOM 0 HG22 ILE A 90 20.569 -12.212 6.360 1.00 1.00 H new ATOM 0 HG23 ILE A 90 19.458 -12.144 7.748 1.00 1.00 H new ATOM 0 HD11 ILE A 90 16.023 -9.914 5.767 1.00 1.00 H new ATOM 0 HD12 ILE A 90 17.440 -9.412 4.814 1.00 1.00 H new ATOM 0 HD13 ILE A 90 17.120 -11.141 5.090 1.00 1.00 H new ATOM 1371 N ALA A 91 22.670 -9.783 7.957 1.00 1.00 N ATOM 1372 CA ALA A 91 24.058 -10.212 7.968 1.00 1.00 C ATOM 1373 C ALA A 91 24.180 -11.680 8.416 1.00 1.00 C ATOM 1374 O ALA A 91 23.418 -12.149 9.262 1.00 1.00 O ATOM 1375 CB ALA A 91 24.794 -9.276 8.923 1.00 1.00 C ATOM 0 H ALA A 91 22.381 -9.371 8.844 1.00 1.00 H new ATOM 0 HA ALA A 91 24.491 -10.163 6.969 1.00 1.00 H new ATOM 0 HB1 ALA A 91 25.846 -9.556 8.968 1.00 1.00 H new ATOM 0 HB2 ALA A 91 24.707 -8.250 8.566 1.00 1.00 H new ATOM 0 HB3 ALA A 91 24.355 -9.353 9.918 1.00 1.00 H new ATOM 1381 N LEU A 92 25.142 -12.415 7.858 1.00 1.00 N ATOM 1382 CA LEU A 92 25.394 -13.811 8.224 1.00 1.00 C ATOM 1383 C LEU A 92 26.888 -14.133 8.277 1.00 1.00 C ATOM 1384 O LEU A 92 27.694 -13.492 7.596 1.00 1.00 O ATOM 1385 CB LEU A 92 24.720 -14.781 7.236 1.00 1.00 C ATOM 1386 CG LEU A 92 23.283 -14.479 6.782 1.00 1.00 C ATOM 1387 CD1 LEU A 92 23.169 -13.559 5.572 1.00 1.00 C ATOM 1388 CD2 LEU A 92 22.644 -15.795 6.370 1.00 1.00 C ATOM 0 H LEU A 92 25.771 -12.059 7.138 1.00 1.00 H new ATOM 0 HA LEU A 92 24.968 -13.942 9.219 1.00 1.00 H new ATOM 0 HB2 LEU A 92 25.345 -14.835 6.345 1.00 1.00 H new ATOM 0 HB3 LEU A 92 24.724 -15.772 7.689 1.00 1.00 H new ATOM 0 HG LEU A 92 22.803 -13.978 7.622 1.00 1.00 H new ATOM 0 HD11 LEU A 92 22.117 -13.406 5.329 1.00 1.00 H new ATOM 0 HD12 LEU A 92 23.632 -12.599 5.800 1.00 1.00 H new ATOM 0 HD13 LEU A 92 23.676 -14.013 4.721 1.00 1.00 H new ATOM 0 HD21 LEU A 92 21.620 -15.615 6.041 1.00 1.00 H new ATOM 0 HD22 LEU A 92 23.215 -16.237 5.553 1.00 1.00 H new ATOM 0 HD23 LEU A 92 22.638 -16.478 7.219 1.00 1.00 H new ATOM 1400 N GLY A 93 27.239 -15.179 9.025 1.00 1.00 N ATOM 1401 CA GLY A 93 28.590 -15.727 8.977 1.00 1.00 C ATOM 1402 C GLY A 93 28.864 -16.837 9.986 1.00 1.00 C ATOM 1403 O GLY A 93 28.087 -17.089 10.902 1.00 1.00 O ATOM 0 H GLY A 93 26.609 -15.660 9.667 1.00 1.00 H new ATOM 0 HA2 GLY A 93 28.776 -16.112 7.974 1.00 1.00 H new ATOM 0 HA3 GLY A 93 29.302 -14.918 9.145 1.00 1.00 H new ATOM 1512 N CYS A 101 29.430 -10.839 11.793 1.00 1.00 N ATOM 1513 CA CYS A 101 28.435 -10.329 10.837 1.00 1.00 C ATOM 1514 C CYS A 101 28.744 -8.898 10.342 1.00 1.00 C ATOM 1515 O CYS A 101 27.878 -8.205 9.810 1.00 1.00 O ATOM 1516 CB CYS A 101 27.051 -10.456 11.498 1.00 1.00 C ATOM 1517 SG CYS A 101 26.434 -12.154 11.304 1.00 1.00 S ATOM 0 HA CYS A 101 28.463 -10.926 9.925 1.00 1.00 H new ATOM 0 HB2 CYS A 101 27.118 -10.202 12.556 1.00 1.00 H new ATOM 0 HB3 CYS A 101 26.354 -9.751 11.044 1.00 1.00 H new ATOM 0 HG CYS A 101 26.041 -12.607 12.457 1.00 1.00 H new ATOM 1523 N ASN A 102 29.982 -8.433 10.520 1.00 1.00 N ATOM 1524 CA ASN A 102 30.441 -7.070 10.232 1.00 1.00 C ATOM 1525 C ASN A 102 30.159 -6.586 8.802 1.00 1.00 C ATOM 1526 O ASN A 102 29.862 -5.411 8.650 1.00 1.00 O ATOM 1527 CB ASN A 102 31.908 -6.997 10.661 1.00 1.00 C ATOM 1528 CG ASN A 102 32.519 -5.636 10.407 1.00 1.00 C ATOM 1529 OD1 ASN A 102 32.281 -4.649 11.088 1.00 1.00 O ATOM 1530 ND2 ASN A 102 33.307 -5.562 9.372 1.00 1.00 N ATOM 0 H ASN A 102 30.729 -9.024 10.886 1.00 1.00 H new ATOM 0 HA ASN A 102 29.856 -6.353 10.807 1.00 1.00 H new ATOM 0 HB2 ASN A 102 31.985 -7.234 11.722 1.00 1.00 H new ATOM 0 HB3 ASN A 102 32.479 -7.754 10.123 1.00 1.00 H new ATOM 0 HD21 ASN A 102 33.735 -4.671 9.120 1.00 1.00 H new ATOM 0 HD22 ASN A 102 33.496 -6.395 8.814 1.00 1.00 H new ATOM 1537 N GLY A 103 30.118 -7.436 7.774 1.00 1.00 N ATOM 1538 CA GLY A 103 29.807 -7.009 6.399 1.00 1.00 C ATOM 1539 C GLY A 103 28.446 -6.317 6.272 1.00 1.00 C ATOM 1540 O GLY A 103 28.351 -5.261 5.656 1.00 1.00 O ATOM 0 H GLY A 103 30.298 -8.436 7.865 1.00 1.00 H new ATOM 0 HA2 GLY A 103 30.586 -6.330 6.052 1.00 1.00 H new ATOM 0 HA3 GLY A 103 29.827 -7.879 5.743 1.00 1.00 H new ATOM 1544 N GLY A 104 27.409 -6.829 6.947 1.00 1.00 N ATOM 1545 CA GLY A 104 26.090 -6.170 7.004 1.00 1.00 C ATOM 1546 C GLY A 104 26.041 -4.997 7.984 1.00 1.00 C ATOM 1547 O GLY A 104 25.486 -3.951 7.657 1.00 1.00 O ATOM 0 H GLY A 104 27.456 -7.705 7.467 1.00 1.00 H new ATOM 0 HA2 GLY A 104 25.826 -5.814 6.008 1.00 1.00 H new ATOM 0 HA3 GLY A 104 25.337 -6.904 7.289 1.00 1.00 H new ATOM 1551 N LYS A 105 26.712 -5.097 9.140 1.00 1.00 N ATOM 1552 CA LYS A 105 26.852 -3.972 10.094 1.00 1.00 C ATOM 1553 C LYS A 105 27.527 -2.738 9.478 1.00 1.00 C ATOM 1554 O LYS A 105 27.157 -1.601 9.758 1.00 1.00 O ATOM 1555 CB LYS A 105 27.632 -4.412 11.321 1.00 1.00 C ATOM 1556 CG LYS A 105 26.922 -5.542 12.091 1.00 1.00 C ATOM 1557 CD LYS A 105 27.549 -5.529 13.483 1.00 1.00 C ATOM 1558 CE LYS A 105 27.009 -6.618 14.423 1.00 1.00 C ATOM 1559 NZ LYS A 105 27.625 -6.509 15.783 1.00 1.00 N1+ ATOM 0 H LYS A 105 27.174 -5.954 9.445 1.00 1.00 H new ATOM 0 HA LYS A 105 25.839 -3.683 10.374 1.00 1.00 H new ATOM 0 HB2 LYS A 105 28.623 -4.749 11.017 1.00 1.00 H new ATOM 0 HB3 LYS A 105 27.775 -3.558 11.983 1.00 1.00 H new ATOM 0 HG2 LYS A 105 25.847 -5.370 12.141 1.00 1.00 H new ATOM 0 HG3 LYS A 105 27.068 -6.505 11.602 1.00 1.00 H new ATOM 0 HD2 LYS A 105 28.628 -5.650 13.385 1.00 1.00 H new ATOM 0 HD3 LYS A 105 27.378 -4.553 13.938 1.00 1.00 H new ATOM 0 HE2 LYS A 105 25.926 -6.529 14.503 1.00 1.00 H new ATOM 0 HE3 LYS A 105 27.218 -7.602 14.003 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 27.243 -7.256 16.398 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 28.657 -6.617 15.707 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 27.404 -5.578 16.191 1.00 1.00 H new ATOM 1573 N GLN A 106 28.486 -2.966 8.581 1.00 1.00 N ATOM 1574 CA GLN A 106 29.115 -1.908 7.795 1.00 1.00 C ATOM 1575 C GLN A 106 28.144 -1.285 6.781 1.00 1.00 C ATOM 1576 O GLN A 106 28.197 -0.075 6.576 1.00 1.00 O ATOM 1577 CB GLN A 106 30.418 -2.394 7.135 1.00 1.00 C ATOM 1578 CG GLN A 106 31.524 -2.700 8.161 1.00 1.00 C ATOM 1579 CD GLN A 106 32.012 -1.509 8.986 1.00 1.00 C ATOM 1580 OE1 GLN A 106 32.024 -0.362 8.555 1.00 1.00 O ATOM 1581 NE2 GLN A 106 32.435 -1.744 10.213 1.00 1.00 N ATOM 0 H GLN A 106 28.850 -3.897 8.379 1.00 1.00 H new ATOM 0 HA GLN A 106 29.387 -1.111 8.487 1.00 1.00 H new ATOM 0 HB2 GLN A 106 30.212 -3.291 6.550 1.00 1.00 H new ATOM 0 HB3 GLN A 106 30.774 -1.634 6.439 1.00 1.00 H new ATOM 0 HG2 GLN A 106 31.158 -3.466 8.845 1.00 1.00 H new ATOM 0 HG3 GLN A 106 32.377 -3.126 7.632 1.00 1.00 H new ATOM 0 HE21 GLN A 106 32.429 -2.695 10.581 1.00 1.00 H new ATOM 0 HE22 GLN A 106 32.768 -0.974 10.794 1.00 1.00 H new ATOM 1590 N PHE A 107 27.200 -2.049 6.205 1.00 1.00 N ATOM 1591 CA PHE A 107 26.141 -1.502 5.354 1.00 1.00 C ATOM 1592 C PHE A 107 25.220 -0.555 6.157 1.00 1.00 C ATOM 1593 O PHE A 107 24.842 0.506 5.660 1.00 1.00 O ATOM 1594 CB PHE A 107 25.368 -2.626 4.627 1.00 1.00 C ATOM 1595 CG PHE A 107 25.800 -2.812 3.190 1.00 1.00 C ATOM 1596 CD1 PHE A 107 25.235 -2.051 2.143 1.00 1.00 C ATOM 1597 CD2 PHE A 107 26.762 -3.792 2.900 1.00 1.00 C ATOM 1598 CE1 PHE A 107 25.612 -2.307 0.812 1.00 1.00 C ATOM 1599 CE2 PHE A 107 27.158 -4.019 1.577 1.00 1.00 C ATOM 1600 CZ PHE A 107 26.584 -3.279 0.530 1.00 1.00 C ATOM 0 H PHE A 107 27.154 -3.062 6.319 1.00 1.00 H new ATOM 0 HA PHE A 107 26.603 -0.897 4.573 1.00 1.00 H new ATOM 0 HB2 PHE A 107 25.509 -3.563 5.166 1.00 1.00 H new ATOM 0 HB3 PHE A 107 24.302 -2.401 4.653 1.00 1.00 H new ATOM 0 HD1 PHE A 107 24.516 -1.276 2.363 1.00 1.00 H new ATOM 0 HD2 PHE A 107 27.198 -4.372 3.700 1.00 1.00 H new ATOM 0 HE1 PHE A 107 25.152 -1.754 0.006 1.00 1.00 H new ATOM 0 HE2 PHE A 107 27.908 -4.766 1.360 1.00 1.00 H new ATOM 0 HZ PHE A 107 26.890 -3.458 -0.490 1.00 1.00 H new ATOM 1610 N ASP A 108 24.939 -0.877 7.428 1.00 1.00 N ATOM 1611 CA ASP A 108 24.182 -0.014 8.346 1.00 1.00 C ATOM 1612 C ASP A 108 24.901 1.308 8.619 1.00 1.00 C ATOM 1613 O ASP A 108 24.320 2.383 8.440 1.00 1.00 O ATOM 1614 CB ASP A 108 23.865 -0.821 9.619 1.00 1.00 C ATOM 1615 CG ASP A 108 23.544 0.047 10.844 1.00 1.00 C ATOM 1616 OD1 ASP A 108 24.477 0.514 11.540 1.00 1.00 O1- ATOM 1617 OD2 ASP A 108 22.343 0.210 11.143 1.00 1.00 O ATOM 0 H ASP A 108 25.235 -1.756 7.853 1.00 1.00 H new ATOM 0 HA ASP A 108 23.240 0.284 7.886 1.00 1.00 H new ATOM 0 HB2 ASP A 108 23.018 -1.477 9.419 1.00 1.00 H new ATOM 0 HB3 ASP A 108 24.716 -1.461 9.853 1.00 1.00 H new ATOM 1622 N ALA A 109 26.191 1.235 8.938 1.00 1.00 N ATOM 1623 CA ALA A 109 27.031 2.414 9.085 1.00 1.00 C ATOM 1624 C ALA A 109 27.073 3.277 7.816 1.00 1.00 C ATOM 1625 O ALA A 109 27.108 4.497 7.922 1.00 1.00 O ATOM 1626 CB ALA A 109 28.448 1.967 9.424 1.00 1.00 C ATOM 0 H ALA A 109 26.681 0.355 9.101 1.00 1.00 H new ATOM 0 HA ALA A 109 26.603 3.024 9.880 1.00 1.00 H new ATOM 0 HB1 ALA A 109 29.088 2.842 9.537 1.00 1.00 H new ATOM 0 HB2 ALA A 109 28.438 1.402 10.356 1.00 1.00 H new ATOM 0 HB3 ALA A 109 28.833 1.337 8.622 1.00 1.00 H new ATOM 1632 N LEU A 110 27.033 2.666 6.629 1.00 1.00 N ATOM 1633 CA LEU A 110 27.146 3.336 5.335 1.00 1.00 C ATOM 1634 C LEU A 110 26.057 4.397 5.173 1.00 1.00 C ATOM 1635 O LEU A 110 26.284 5.557 4.833 1.00 1.00 O ATOM 1636 CB LEU A 110 27.016 2.260 4.237 1.00 1.00 C ATOM 1637 CG LEU A 110 27.778 2.608 2.956 1.00 1.00 C ATOM 1638 CD1 LEU A 110 27.391 3.977 2.453 1.00 1.00 C ATOM 1639 CD2 LEU A 110 29.285 2.495 3.185 1.00 1.00 C ATOM 0 H LEU A 110 26.917 1.656 6.542 1.00 1.00 H new ATOM 0 HA LEU A 110 28.107 3.844 5.260 1.00 1.00 H new ATOM 0 HB2 LEU A 110 27.384 1.310 4.624 1.00 1.00 H new ATOM 0 HB3 LEU A 110 25.962 2.120 3.998 1.00 1.00 H new ATOM 0 HG LEU A 110 27.504 1.891 2.182 1.00 1.00 H new ATOM 0 HD11 LEU A 110 27.946 4.200 1.542 1.00 1.00 H new ATOM 0 HD12 LEU A 110 26.322 3.998 2.241 1.00 1.00 H new ATOM 0 HD13 LEU A 110 27.625 4.723 3.212 1.00 1.00 H new ATOM 0 HD21 LEU A 110 29.813 2.746 2.265 1.00 1.00 H new ATOM 0 HD22 LEU A 110 29.586 3.184 3.975 1.00 1.00 H new ATOM 0 HD23 LEU A 110 29.533 1.475 3.479 1.00 1.00 H new ATOM 1651 N LEU A 111 24.825 3.998 5.433 1.00 1.00 N ATOM 1652 CA LEU A 111 23.687 4.903 5.305 1.00 1.00 C ATOM 1653 C LEU A 111 23.753 6.023 6.336 1.00 1.00 C ATOM 1654 O LEU A 111 23.558 7.191 5.992 1.00 1.00 O ATOM 1655 CB LEU A 111 22.405 4.073 5.394 1.00 1.00 C ATOM 1656 CG LEU A 111 22.267 3.014 4.283 1.00 1.00 C ATOM 1657 CD1 LEU A 111 20.782 2.745 4.094 1.00 1.00 C ATOM 1658 CD2 LEU A 111 22.798 3.387 2.899 1.00 1.00 C ATOM 0 H LEU A 111 24.582 3.054 5.734 1.00 1.00 H new ATOM 0 HA LEU A 111 23.705 5.406 4.338 1.00 1.00 H new ATOM 0 HB2 LEU A 111 22.373 3.575 6.363 1.00 1.00 H new ATOM 0 HB3 LEU A 111 21.546 4.743 5.352 1.00 1.00 H new ATOM 0 HG LEU A 111 22.869 2.173 4.627 1.00 1.00 H new ATOM 0 HD11 LEU A 111 20.644 1.998 3.313 1.00 1.00 H new ATOM 0 HD12 LEU A 111 20.357 2.376 5.028 1.00 1.00 H new ATOM 0 HD13 LEU A 111 20.279 3.668 3.806 1.00 1.00 H new ATOM 0 HD21 LEU A 111 22.639 2.556 2.212 1.00 1.00 H new ATOM 0 HD22 LEU A 111 22.270 4.267 2.532 1.00 1.00 H new ATOM 0 HD23 LEU A 111 23.864 3.605 2.965 1.00 1.00 H new ATOM 1670 N GLN A 112 24.150 5.677 7.558 1.00 1.00 N ATOM 1671 CA GLN A 112 24.336 6.634 8.642 1.00 1.00 C ATOM 1672 C GLN A 112 25.564 7.551 8.442 1.00 1.00 C ATOM 1673 O GLN A 112 25.634 8.609 9.068 1.00 1.00 O ATOM 1674 CB GLN A 112 24.433 5.873 9.980 1.00 1.00 C ATOM 1675 CG GLN A 112 23.289 4.881 10.283 1.00 1.00 C ATOM 1676 CD GLN A 112 22.048 5.515 10.910 1.00 1.00 C ATOM 1677 OE1 GLN A 112 21.970 5.727 12.113 1.00 1.00 O ATOM 1678 NE2 GLN A 112 21.018 5.819 10.147 1.00 1.00 N ATOM 0 H GLN A 112 24.353 4.714 7.825 1.00 1.00 H new ATOM 0 HA GLN A 112 23.469 7.295 8.648 1.00 1.00 H new ATOM 0 HB2 GLN A 112 25.375 5.325 9.995 1.00 1.00 H new ATOM 0 HB3 GLN A 112 24.476 6.604 10.788 1.00 1.00 H new ATOM 0 HG2 GLN A 112 22.999 4.386 9.356 1.00 1.00 H new ATOM 0 HG3 GLN A 112 23.664 4.108 10.953 1.00 1.00 H new ATOM 0 HE21 GLN A 112 21.061 5.651 9.142 1.00 1.00 H new ATOM 0 HE22 GLN A 112 20.178 6.222 10.561 1.00 1.00 H new ATOM 1687 N GLU A 113 26.512 7.206 7.554 1.00 1.00 N ATOM 1688 CA GLU A 113 27.669 8.042 7.213 1.00 1.00 C ATOM 1689 C GLU A 113 27.261 9.175 6.251 1.00 1.00 C ATOM 1690 O GLU A 113 27.949 10.193 6.158 1.00 1.00 O ATOM 1691 CB GLU A 113 28.870 7.185 6.723 1.00 1.00 C ATOM 1692 CG GLU A 113 29.145 7.164 5.216 1.00 1.00 C ATOM 1693 CD GLU A 113 30.467 6.449 4.865 1.00 1.00 C ATOM 1694 OE1 GLU A 113 30.723 5.322 5.354 1.00 1.00 O ATOM 1695 OE2 GLU A 113 31.256 7.001 4.059 1.00 1.00 O1- ATOM 0 H GLU A 113 26.493 6.322 7.046 1.00 1.00 H new ATOM 0 HA GLU A 113 28.028 8.535 8.117 1.00 1.00 H new ATOM 0 HB2 GLU A 113 29.768 7.543 7.226 1.00 1.00 H new ATOM 0 HB3 GLU A 113 28.709 6.158 7.052 1.00 1.00 H new ATOM 0 HG2 GLU A 113 28.320 6.666 4.707 1.00 1.00 H new ATOM 0 HG3 GLU A 113 29.179 8.187 4.842 1.00 1.00 H new ATOM 1702 N GLN A 114 26.123 9.001 5.560 1.00 1.00 N ATOM 1703 CA GLN A 114 25.563 9.946 4.612 1.00 1.00 C ATOM 1704 C GLN A 114 24.477 10.790 5.283 1.00 1.00 C ATOM 1705 O GLN A 114 24.712 11.933 5.672 1.00 1.00 O ATOM 1706 CB GLN A 114 25.074 9.177 3.388 1.00 1.00 C ATOM 1707 CG GLN A 114 26.227 8.531 2.604 1.00 1.00 C ATOM 1708 CD GLN A 114 25.597 7.518 1.690 1.00 1.00 C ATOM 1709 OE1 GLN A 114 25.205 7.792 0.570 1.00 1.00 O ATOM 1710 NE2 GLN A 114 25.293 6.376 2.244 1.00 1.00 N ATOM 0 H GLN A 114 25.554 8.160 5.659 1.00 1.00 H new ATOM 0 HA GLN A 114 26.319 10.654 4.272 1.00 1.00 H new ATOM 0 HB2 GLN A 114 24.374 8.403 3.704 1.00 1.00 H new ATOM 0 HB3 GLN A 114 24.526 9.854 2.732 1.00 1.00 H new ATOM 0 HG2 GLN A 114 26.778 9.280 2.035 1.00 1.00 H new ATOM 0 HG3 GLN A 114 26.939 8.056 3.279 1.00 1.00 H new ATOM 0 HE21 GLN A 114 25.628 6.159 3.183 1.00 1.00 H new ATOM 0 HE22 GLN A 114 24.720 5.700 1.738 1.00 1.00 H new ATOM 1719 N SER A 115 23.292 10.188 5.405 1.00 1.00 N ATOM 1720 CA SER A 115 22.105 10.747 6.083 1.00 1.00 C ATOM 1721 C SER A 115 20.934 9.747 6.146 1.00 1.00 C ATOM 1722 O SER A 115 19.873 10.047 6.699 1.00 1.00 O ATOM 1723 CB SER A 115 21.605 12.001 5.335 1.00 1.00 C ATOM 1724 OG SER A 115 20.896 12.865 6.212 1.00 1.00 O ATOM 0 H SER A 115 23.119 9.259 5.021 1.00 1.00 H new ATOM 0 HA SER A 115 22.420 10.989 7.098 1.00 1.00 H new ATOM 0 HB2 SER A 115 22.452 12.532 4.901 1.00 1.00 H new ATOM 0 HB3 SER A 115 20.958 11.703 4.510 1.00 1.00 H new ATOM 0 HG SER A 115 20.240 12.346 6.723 1.00 1.00 H new ATOM 1730 N ALA A 116 21.084 8.559 5.547 1.00 1.00 N ATOM 1731 CA ALA A 116 19.978 7.632 5.343 1.00 1.00 C ATOM 1732 C ALA A 116 19.622 6.818 6.591 1.00 1.00 C ATOM 1733 O ALA A 116 20.448 6.520 7.455 1.00 1.00 O ATOM 1734 CB ALA A 116 20.255 6.775 4.117 1.00 1.00 C ATOM 0 H ALA A 116 21.978 8.219 5.192 1.00 1.00 H new ATOM 0 HA ALA A 116 19.077 8.215 5.154 1.00 1.00 H new ATOM 0 HB1 ALA A 116 19.428 6.081 3.964 1.00 1.00 H new ATOM 0 HB2 ALA A 116 20.358 7.416 3.241 1.00 1.00 H new ATOM 0 HB3 ALA A 116 21.177 6.213 4.267 1.00 1.00 H new ATOM 1740 N GLN A 117 18.347 6.448 6.633 1.00 1.00 N ATOM 1741 CA GLN A 117 17.657 5.867 7.784 1.00 1.00 C ATOM 1742 C GLN A 117 17.756 4.336 7.858 1.00 1.00 C ATOM 1743 O GLN A 117 18.114 3.662 6.893 1.00 1.00 O ATOM 1744 CB GLN A 117 16.187 6.337 7.757 1.00 1.00 C ATOM 1745 CG GLN A 117 16.034 7.864 7.880 1.00 1.00 C ATOM 1746 CD GLN A 117 14.690 8.360 7.351 1.00 1.00 C ATOM 1747 OE1 GLN A 117 13.743 8.593 8.087 1.00 1.00 O ATOM 1748 NE2 GLN A 117 14.554 8.520 6.049 1.00 1.00 N ATOM 0 H GLN A 117 17.733 6.550 5.825 1.00 1.00 H new ATOM 0 HA GLN A 117 18.154 6.219 8.688 1.00 1.00 H new ATOM 0 HB2 GLN A 117 15.724 6.006 6.827 1.00 1.00 H new ATOM 0 HB3 GLN A 117 15.644 5.858 8.572 1.00 1.00 H new ATOM 0 HG2 GLN A 117 16.139 8.154 8.926 1.00 1.00 H new ATOM 0 HG3 GLN A 117 16.840 8.352 7.332 1.00 1.00 H new ATOM 0 HE21 GLN A 117 15.339 8.328 5.427 1.00 1.00 H new ATOM 0 HE22 GLN A 117 13.664 8.836 5.664 1.00 1.00 H new ATOM 1757 N ARG A 118 17.357 3.789 9.010 1.00 1.00 N ATOM 1758 CA ARG A 118 17.320 2.356 9.338 1.00 1.00 C ATOM 1759 C ARG A 118 15.893 1.906 9.662 1.00 1.00 C ATOM 1760 O ARG A 118 15.102 2.679 10.202 1.00 1.00 O ATOM 1761 CB ARG A 118 18.289 2.092 10.512 1.00 1.00 C ATOM 1762 CG ARG A 118 19.426 1.109 10.184 1.00 1.00 C ATOM 1763 CD ARG A 118 19.161 -0.394 10.428 1.00 1.00 C ATOM 1764 NE ARG A 118 18.614 -0.658 11.780 1.00 1.00 N ATOM 1765 CZ ARG A 118 19.210 -0.502 12.952 1.00 1.00 C ATOM 1766 NH1 ARG A 118 20.465 -0.198 13.080 1.00 1.00 N1+ ATOM 1767 NH2 ARG A 118 18.518 -0.643 14.045 1.00 1.00 N ATOM 0 H ARG A 118 17.032 4.366 9.786 1.00 1.00 H new ATOM 0 HA ARG A 118 17.642 1.770 8.477 1.00 1.00 H new ATOM 0 HB2 ARG A 118 18.724 3.040 10.829 1.00 1.00 H new ATOM 0 HB3 ARG A 118 17.721 1.703 11.357 1.00 1.00 H new ATOM 0 HG2 ARG A 118 19.690 1.238 9.134 1.00 1.00 H new ATOM 0 HG3 ARG A 118 20.299 1.396 10.770 1.00 1.00 H new ATOM 0 HD2 ARG A 118 18.462 -0.764 9.678 1.00 1.00 H new ATOM 0 HD3 ARG A 118 20.090 -0.950 10.300 1.00 1.00 H new ATOM 0 HE ARG A 118 17.655 -1.004 11.812 1.00 1.00 H new ATOM 0 HH11 ARG A 118 21.045 -0.067 12.251 1.00 1.00 H new ATOM 0 HH12 ARG A 118 20.871 -0.090 14.009 1.00 1.00 H new ATOM 0 HH21 ARG A 118 17.525 -0.872 13.994 1.00 1.00 H new ATOM 0 HH22 ARG A 118 18.968 -0.525 14.953 1.00 1.00 H new ATOM 1781 N VAL A 119 15.581 0.654 9.338 1.00 1.00 N ATOM 1782 CA VAL A 119 14.264 0.020 9.561 1.00 1.00 C ATOM 1783 C VAL A 119 14.452 -1.205 10.461 1.00 1.00 C ATOM 1784 O VAL A 119 15.296 -2.046 10.158 1.00 1.00 O ATOM 1785 CB VAL A 119 13.606 -0.342 8.210 1.00 1.00 C ATOM 1786 CG1 VAL A 119 12.183 -0.862 8.391 1.00 1.00 C ATOM 1787 CG2 VAL A 119 13.481 0.872 7.287 1.00 1.00 C ATOM 0 H VAL A 119 16.252 0.024 8.898 1.00 1.00 H new ATOM 0 HA VAL A 119 13.590 0.714 10.063 1.00 1.00 H new ATOM 0 HB VAL A 119 14.258 -1.102 7.779 1.00 1.00 H new ATOM 0 HG11 VAL A 119 11.758 -1.105 7.417 1.00 1.00 H new ATOM 0 HG12 VAL A 119 12.199 -1.757 9.013 1.00 1.00 H new ATOM 0 HG13 VAL A 119 11.574 -0.096 8.872 1.00 1.00 H new ATOM 0 HG21 VAL A 119 13.013 0.570 6.350 1.00 1.00 H new ATOM 0 HG22 VAL A 119 12.869 1.634 7.769 1.00 1.00 H new ATOM 0 HG23 VAL A 119 14.472 1.278 7.084 1.00 1.00 H new ATOM 1797 N GLY A 120 13.679 -1.306 11.549 1.00 1.00 N ATOM 1798 CA GLY A 120 13.830 -2.329 12.608 1.00 1.00 C ATOM 1799 C GLY A 120 15.259 -2.474 13.158 1.00 1.00 C ATOM 1800 O GLY A 120 16.083 -1.564 13.047 1.00 1.00 O ATOM 0 H GLY A 120 12.907 -0.663 11.728 1.00 1.00 H new ATOM 0 HA2 GLY A 120 13.161 -2.082 13.432 1.00 1.00 H new ATOM 0 HA3 GLY A 120 13.507 -3.292 12.213 1.00 1.00 H new ATOM 1804 N GLU A 121 15.567 -3.628 13.755 1.00 1.00 N ATOM 1805 CA GLU A 121 16.923 -4.045 14.139 1.00 1.00 C ATOM 1806 C GLU A 121 17.365 -5.215 13.248 1.00 1.00 C ATOM 1807 O GLU A 121 16.559 -6.068 12.884 1.00 1.00 O ATOM 1808 CB GLU A 121 16.998 -4.338 15.647 1.00 1.00 C ATOM 1809 CG GLU A 121 16.460 -5.714 16.059 1.00 1.00 C ATOM 1810 CD GLU A 121 16.470 -5.862 17.592 1.00 1.00 C ATOM 1811 OE1 GLU A 121 17.501 -6.297 18.160 1.00 1.00 O1- ATOM 1812 OE2 GLU A 121 15.446 -5.545 18.247 1.00 1.00 O ATOM 0 H GLU A 121 14.858 -4.322 13.993 1.00 1.00 H new ATOM 0 HA GLU A 121 17.633 -3.235 13.971 1.00 1.00 H new ATOM 0 HB2 GLU A 121 18.037 -4.258 15.968 1.00 1.00 H new ATOM 0 HB3 GLU A 121 16.439 -3.569 16.181 1.00 1.00 H new ATOM 0 HG2 GLU A 121 15.445 -5.842 15.682 1.00 1.00 H new ATOM 0 HG3 GLU A 121 17.068 -6.498 15.608 1.00 1.00 H new ATOM 1819 N MET A 122 18.640 -5.257 12.863 1.00 1.00 N ATOM 1820 CA MET A 122 19.157 -6.161 11.854 1.00 1.00 C ATOM 1821 C MET A 122 19.306 -7.601 12.358 1.00 1.00 C ATOM 1822 O MET A 122 19.455 -7.862 13.555 1.00 1.00 O ATOM 1823 CB MET A 122 20.463 -5.602 11.301 1.00 1.00 C ATOM 1824 CG MET A 122 21.624 -5.544 12.263 1.00 1.00 C ATOM 1825 SD MET A 122 21.522 -4.237 13.522 1.00 1.00 S ATOM 1826 CE MET A 122 22.958 -4.664 14.537 1.00 1.00 C ATOM 0 H MET A 122 19.354 -4.645 13.258 1.00 1.00 H new ATOM 0 HA MET A 122 18.428 -6.223 11.046 1.00 1.00 H new ATOM 0 HB2 MET A 122 20.759 -6.207 10.444 1.00 1.00 H new ATOM 0 HB3 MET A 122 20.275 -4.594 10.931 1.00 1.00 H new ATOM 0 HG2 MET A 122 21.705 -6.507 12.768 1.00 1.00 H new ATOM 0 HG3 MET A 122 22.542 -5.405 11.692 1.00 1.00 H new ATOM 0 HE1 MET A 122 23.044 -3.957 15.362 1.00 1.00 H new ATOM 0 HE2 MET A 122 22.836 -5.672 14.934 1.00 1.00 H new ATOM 0 HE3 MET A 122 23.860 -4.621 13.927 1.00 1.00 H new ATOM 1836 N LEU A 123 19.324 -8.538 11.416 1.00 1.00 N ATOM 1837 CA LEU A 123 19.579 -9.948 11.651 1.00 1.00 C ATOM 1838 C LEU A 123 21.064 -10.242 11.527 1.00 1.00 C ATOM 1839 O LEU A 123 21.711 -9.784 10.586 1.00 1.00 O ATOM 1840 CB LEU A 123 18.692 -10.779 10.729 1.00 1.00 C ATOM 1841 CG LEU A 123 18.956 -12.278 10.634 1.00 1.00 C ATOM 1842 CD1 LEU A 123 20.257 -12.522 9.879 1.00 1.00 C ATOM 1843 CD2 LEU A 123 18.899 -12.997 11.982 1.00 1.00 C ATOM 0 H LEU A 123 19.155 -8.325 10.433 1.00 1.00 H new ATOM 0 HA LEU A 123 19.314 -10.228 12.670 1.00 1.00 H new ATOM 0 HB2 LEU A 123 17.659 -10.642 11.049 1.00 1.00 H new ATOM 0 HB3 LEU A 123 18.773 -10.362 9.725 1.00 1.00 H new ATOM 0 HG LEU A 123 18.140 -12.725 10.065 1.00 1.00 H new ATOM 0 HD11 LEU A 123 20.444 -13.594 9.812 1.00 1.00 H new ATOM 0 HD12 LEU A 123 20.179 -12.104 8.875 1.00 1.00 H new ATOM 0 HD13 LEU A 123 21.080 -12.043 10.409 1.00 1.00 H new ATOM 0 HD21 LEU A 123 19.096 -14.059 11.837 1.00 1.00 H new ATOM 0 HD22 LEU A 123 19.650 -12.577 12.651 1.00 1.00 H new ATOM 0 HD23 LEU A 123 17.910 -12.869 12.421 1.00 1.00 H new ATOM 1855 N LEU A 124 21.559 -11.051 12.460 1.00 1.00 N ATOM 1856 CA LEU A 124 22.910 -11.592 12.483 1.00 1.00 C ATOM 1857 C LEU A 124 22.861 -13.131 12.649 1.00 1.00 C ATOM 1858 O LEU A 124 22.478 -13.622 13.715 1.00 1.00 O ATOM 1859 CB LEU A 124 23.693 -10.944 13.635 1.00 1.00 C ATOM 1860 CG LEU A 124 23.422 -9.461 13.979 1.00 1.00 C ATOM 1861 CD1 LEU A 124 24.288 -9.082 15.176 1.00 1.00 C ATOM 1862 CD2 LEU A 124 23.700 -8.484 12.840 1.00 1.00 C ATOM 0 H LEU A 124 21.001 -11.360 13.256 1.00 1.00 H new ATOM 0 HA LEU A 124 23.413 -11.368 11.542 1.00 1.00 H new ATOM 0 HB2 LEU A 124 23.504 -11.531 14.534 1.00 1.00 H new ATOM 0 HB3 LEU A 124 24.755 -11.041 13.408 1.00 1.00 H new ATOM 0 HG LEU A 124 22.356 -9.380 14.191 1.00 1.00 H new ATOM 0 HD11 LEU A 124 24.112 -8.038 15.436 1.00 1.00 H new ATOM 0 HD12 LEU A 124 24.032 -9.716 16.025 1.00 1.00 H new ATOM 0 HD13 LEU A 124 25.339 -9.221 14.923 1.00 1.00 H new ATOM 0 HD21 LEU A 124 23.483 -7.468 13.171 1.00 1.00 H new ATOM 0 HD22 LEU A 124 24.748 -8.554 12.548 1.00 1.00 H new ATOM 0 HD23 LEU A 124 23.068 -8.731 11.987 1.00 1.00 H new ATOM 1874 N ILE A 125 23.200 -13.905 11.611 1.00 1.00 N ATOM 1875 CA ILE A 125 23.179 -15.373 11.637 1.00 1.00 C ATOM 1876 C ILE A 125 24.551 -15.984 11.895 1.00 1.00 C ATOM 1877 O ILE A 125 25.520 -15.645 11.225 1.00 1.00 O ATOM 1878 CB ILE A 125 22.530 -15.932 10.366 1.00 1.00 C ATOM 1879 CG1 ILE A 125 21.018 -15.772 10.488 1.00 1.00 C ATOM 1880 CG2 ILE A 125 22.843 -17.415 10.119 1.00 1.00 C ATOM 1881 CD1 ILE A 125 20.309 -15.808 9.137 1.00 1.00 C ATOM 0 H ILE A 125 23.502 -13.523 10.715 1.00 1.00 H new ATOM 0 HA ILE A 125 22.563 -15.667 12.487 1.00 1.00 H new ATOM 0 HB ILE A 125 22.940 -15.374 9.524 1.00 1.00 H new ATOM 0 HG12 ILE A 125 20.623 -16.566 11.122 1.00 1.00 H new ATOM 0 HG13 ILE A 125 20.796 -14.828 10.985 1.00 1.00 H new ATOM 0 HG21 ILE A 125 22.351 -17.743 9.203 1.00 1.00 H new ATOM 0 HG22 ILE A 125 23.920 -17.548 10.020 1.00 1.00 H new ATOM 0 HG23 ILE A 125 22.480 -18.008 10.958 1.00 1.00 H new ATOM 0 HD11 ILE A 125 19.236 -15.690 9.286 1.00 1.00 H new ATOM 0 HD12 ILE A 125 20.680 -14.997 8.510 1.00 1.00 H new ATOM 0 HD13 ILE A 125 20.504 -16.763 8.649 1.00 1.00 H new ATOM 1893 N ASP A 126 24.585 -16.962 12.792 1.00 1.00 N ATOM 1894 CA ASP A 126 25.720 -17.797 13.164 1.00 1.00 C ATOM 1895 C ASP A 126 25.686 -19.181 12.490 1.00 1.00 C ATOM 1896 O ASP A 126 25.131 -20.152 13.005 1.00 1.00 O ATOM 1897 CB ASP A 126 25.800 -17.854 14.702 1.00 1.00 C ATOM 1898 CG ASP A 126 24.516 -18.277 15.461 1.00 1.00 C ATOM 1899 OD1 ASP A 126 23.381 -18.205 14.925 1.00 1.00 O1- ATOM 1900 OD2 ASP A 126 24.641 -18.590 16.671 1.00 1.00 O ATOM 0 H ASP A 126 23.750 -17.212 13.322 1.00 1.00 H new ATOM 0 HA ASP A 126 26.641 -17.351 12.789 1.00 1.00 H new ATOM 0 HB2 ASP A 126 26.597 -18.546 14.974 1.00 1.00 H new ATOM 0 HB3 ASP A 126 26.097 -16.869 15.062 1.00 1.00 H new ATOM 1905 N ALA A 127 26.330 -19.287 11.323 1.00 1.00 N ATOM 1906 CA ALA A 127 26.313 -20.485 10.478 1.00 1.00 C ATOM 1907 C ALA A 127 27.029 -21.681 11.128 1.00 1.00 C ATOM 1908 O ALA A 127 26.739 -22.845 10.850 1.00 1.00 O ATOM 1909 CB ALA A 127 26.952 -20.137 9.133 1.00 1.00 C ATOM 0 H ALA A 127 26.888 -18.528 10.932 1.00 1.00 H new ATOM 0 HA ALA A 127 25.277 -20.794 10.340 1.00 1.00 H new ATOM 0 HB1 ALA A 127 26.948 -21.017 8.490 1.00 1.00 H new ATOM 0 HB2 ALA A 127 26.385 -19.337 8.657 1.00 1.00 H new ATOM 0 HB3 ALA A 127 27.979 -19.808 9.292 1.00 1.00 H new ATOM 1915 N SER A 128 27.923 -21.345 12.046 1.00 1.00 N ATOM 1916 CA SER A 128 28.630 -22.189 13.000 1.00 1.00 C ATOM 1917 C SER A 128 27.714 -23.056 13.869 1.00 1.00 C ATOM 1918 O SER A 128 28.094 -24.149 14.286 1.00 1.00 O ATOM 1919 CB SER A 128 29.363 -21.233 13.942 1.00 1.00 C ATOM 1920 OG SER A 128 28.608 -20.041 14.182 1.00 1.00 O ATOM 0 H SER A 128 28.201 -20.369 12.153 1.00 1.00 H new ATOM 0 HA SER A 128 29.272 -22.868 12.438 1.00 1.00 H new ATOM 0 HB2 SER A 128 29.560 -21.736 14.889 1.00 1.00 H new ATOM 0 HB3 SER A 128 30.330 -20.971 13.513 1.00 1.00 H new ATOM 0 HG SER A 128 29.106 -19.455 14.789 1.00 1.00 H new ATOM 1926 N GLU A 129 26.512 -22.552 14.147 1.00 1.00 N ATOM 1927 CA GLU A 129 25.537 -23.096 15.086 1.00 1.00 C ATOM 1928 C GLU A 129 24.211 -23.421 14.393 1.00 1.00 C ATOM 1929 O GLU A 129 23.474 -24.309 14.828 1.00 1.00 O ATOM 1930 CB GLU A 129 25.302 -22.079 16.213 1.00 1.00 C ATOM 1931 CG GLU A 129 26.478 -21.960 17.191 1.00 1.00 C ATOM 1932 CD GLU A 129 26.614 -23.214 18.081 1.00 1.00 C ATOM 1933 OE1 GLU A 129 25.783 -23.401 19.006 1.00 1.00 O1- ATOM 1934 OE2 GLU A 129 27.552 -24.022 17.875 1.00 1.00 O ATOM 0 H GLU A 129 26.175 -21.702 13.695 1.00 1.00 H new ATOM 0 HA GLU A 129 25.933 -24.025 15.496 1.00 1.00 H new ATOM 0 HB2 GLU A 129 25.106 -21.101 15.773 1.00 1.00 H new ATOM 0 HB3 GLU A 129 24.408 -22.364 16.767 1.00 1.00 H new ATOM 0 HG2 GLU A 129 27.402 -21.809 16.632 1.00 1.00 H new ATOM 0 HG3 GLU A 129 26.339 -21.081 17.821 1.00 1.00 H new ATOM 1941 N ASN A 130 23.932 -22.716 13.293 1.00 1.00 N ATOM 1942 CA ASN A 130 22.765 -22.909 12.448 1.00 1.00 C ATOM 1943 C ASN A 130 23.122 -22.772 10.950 1.00 1.00 C ATOM 1944 O ASN A 130 22.987 -21.680 10.391 1.00 1.00 O ATOM 1945 CB ASN A 130 21.644 -21.949 12.896 1.00 1.00 C ATOM 1946 CG ASN A 130 20.322 -22.307 12.234 1.00 1.00 C ATOM 1947 OD1 ASN A 130 20.141 -21.912 10.998 1.00 1.00 O flip ATOM 1948 ND2 ASN A 130 19.475 -22.981 12.802 1.00 1.00 N flip ATOM 0 H ASN A 130 24.540 -21.968 12.960 1.00 1.00 H new ATOM 0 HA ASN A 130 22.395 -23.927 12.565 1.00 1.00 H new ATOM 0 HB2 ASN A 130 21.535 -21.992 13.980 1.00 1.00 H new ATOM 0 HB3 ASN A 130 21.916 -20.924 12.643 1.00 1.00 H new ATOM 0 HD21 ASN A 130 19.625 -23.284 13.764 1.00 1.00 H new ATOM 0 HD22 ASN A 130 18.618 -23.241 12.314 1.00 1.00 H new ATOM 1955 N PRO A 131 23.517 -23.861 10.259 1.00 1.00 N ATOM 1956 CA PRO A 131 23.858 -23.844 8.831 1.00 1.00 C ATOM 1957 C PRO A 131 22.630 -23.767 7.891 1.00 1.00 C ATOM 1958 O PRO A 131 22.765 -23.949 6.682 1.00 1.00 O ATOM 1959 CB PRO A 131 24.701 -25.106 8.622 1.00 1.00 C ATOM 1960 CG PRO A 131 24.077 -26.087 9.609 1.00 1.00 C ATOM 1961 CD PRO A 131 23.735 -25.197 10.804 1.00 1.00 C ATOM 0 HA PRO A 131 24.405 -22.939 8.567 1.00 1.00 H new ATOM 0 HB2 PRO A 131 24.641 -25.469 7.596 1.00 1.00 H new ATOM 0 HB3 PRO A 131 25.755 -24.930 8.836 1.00 1.00 H new ATOM 0 HG2 PRO A 131 23.190 -26.567 9.196 1.00 1.00 H new ATOM 0 HG3 PRO A 131 24.771 -26.882 9.882 1.00 1.00 H new ATOM 0 HD2 PRO A 131 22.845 -25.559 11.318 1.00 1.00 H new ATOM 0 HD3 PRO A 131 24.545 -25.194 11.533 1.00 1.00 H new ATOM 1969 N GLU A 132 21.435 -23.492 8.429 1.00 1.00 N ATOM 1970 CA GLU A 132 20.160 -23.328 7.726 1.00 1.00 C ATOM 1971 C GLU A 132 19.673 -21.876 7.849 1.00 1.00 C ATOM 1972 O GLU A 132 18.697 -21.606 8.547 1.00 1.00 O ATOM 1973 CB GLU A 132 19.125 -24.342 8.256 1.00 1.00 C ATOM 1974 CG GLU A 132 19.693 -25.750 8.445 1.00 1.00 C ATOM 1975 CD GLU A 132 18.568 -26.775 8.702 1.00 1.00 C ATOM 1976 OE1 GLU A 132 18.205 -27.012 9.880 1.00 1.00 O1- ATOM 1977 OE2 GLU A 132 18.051 -27.373 7.725 1.00 1.00 O ATOM 0 H GLU A 132 21.328 -23.370 9.436 1.00 1.00 H new ATOM 0 HA GLU A 132 20.298 -23.535 6.665 1.00 1.00 H new ATOM 0 HB2 GLU A 132 18.734 -23.986 9.209 1.00 1.00 H new ATOM 0 HB3 GLU A 132 18.285 -24.388 7.563 1.00 1.00 H new ATOM 0 HG2 GLU A 132 20.257 -26.040 7.558 1.00 1.00 H new ATOM 0 HG3 GLU A 132 20.391 -25.754 9.282 1.00 1.00 H new ATOM 1984 N PRO A 133 20.380 -20.886 7.277 1.00 1.00 N ATOM 1985 CA PRO A 133 20.106 -19.479 7.532 1.00 1.00 C ATOM 1986 C PRO A 133 18.679 -19.010 7.257 1.00 1.00 C ATOM 1987 O PRO A 133 18.251 -18.018 7.848 1.00 1.00 O ATOM 1988 CB PRO A 133 21.111 -18.727 6.650 1.00 1.00 C ATOM 1989 CG PRO A 133 21.499 -19.732 5.569 1.00 1.00 C ATOM 1990 CD PRO A 133 21.523 -21.009 6.397 1.00 1.00 C ATOM 0 HA PRO A 133 20.211 -19.285 8.599 1.00 1.00 H new ATOM 0 HB2 PRO A 133 20.666 -17.831 6.217 1.00 1.00 H new ATOM 0 HB3 PRO A 133 21.980 -18.406 7.224 1.00 1.00 H new ATOM 0 HG2 PRO A 133 20.772 -19.774 4.758 1.00 1.00 H new ATOM 0 HG3 PRO A 133 22.466 -19.508 5.119 1.00 1.00 H new ATOM 0 HD2 PRO A 133 21.445 -21.894 5.766 1.00 1.00 H new ATOM 0 HD3 PRO A 133 22.451 -21.100 6.961 1.00 1.00 H new ATOM 1998 N GLU A 134 17.912 -19.701 6.422 1.00 1.00 N ATOM 1999 CA GLU A 134 16.511 -19.379 6.181 1.00 1.00 C ATOM 2000 C GLU A 134 15.660 -19.564 7.440 1.00 1.00 C ATOM 2001 O GLU A 134 14.662 -18.874 7.612 1.00 1.00 O ATOM 2002 CB GLU A 134 15.987 -20.186 4.980 1.00 1.00 C ATOM 2003 CG GLU A 134 15.858 -21.711 5.172 1.00 1.00 C ATOM 2004 CD GLU A 134 17.118 -22.528 4.797 1.00 1.00 C ATOM 2005 OE1 GLU A 134 18.258 -22.102 5.097 1.00 1.00 O ATOM 2006 OE2 GLU A 134 16.958 -23.636 4.227 1.00 1.00 O1- ATOM 0 H GLU A 134 18.246 -20.505 5.890 1.00 1.00 H new ATOM 0 HA GLU A 134 16.432 -18.322 5.928 1.00 1.00 H new ATOM 0 HB2 GLU A 134 15.007 -19.793 4.708 1.00 1.00 H new ATOM 0 HB3 GLU A 134 16.649 -20.005 4.133 1.00 1.00 H new ATOM 0 HG2 GLU A 134 15.611 -21.911 6.215 1.00 1.00 H new ATOM 0 HG3 GLU A 134 15.021 -22.068 4.572 1.00 1.00 H new ATOM 2013 N THR A 135 16.070 -20.412 8.383 1.00 1.00 N ATOM 2014 CA THR A 135 15.311 -20.687 9.607 1.00 1.00 C ATOM 2015 C THR A 135 15.358 -19.519 10.597 1.00 1.00 C ATOM 2016 O THR A 135 14.515 -19.406 11.489 1.00 1.00 O ATOM 2017 CB THR A 135 15.780 -21.983 10.279 1.00 1.00 C ATOM 2018 OG1 THR A 135 17.032 -21.829 10.908 1.00 1.00 O ATOM 2019 CG2 THR A 135 15.896 -23.132 9.276 1.00 1.00 C ATOM 0 H THR A 135 16.945 -20.933 8.320 1.00 1.00 H new ATOM 0 HA THR A 135 14.272 -20.815 9.303 1.00 1.00 H new ATOM 0 HB THR A 135 15.021 -22.217 11.026 1.00 1.00 H new ATOM 0 HG1 THR A 135 17.729 -21.723 10.227 1.00 1.00 H new ATOM 0 HG21 THR A 135 16.231 -24.032 9.791 1.00 1.00 H new ATOM 0 HG22 THR A 135 14.924 -23.316 8.819 1.00 1.00 H new ATOM 0 HG23 THR A 135 16.616 -22.868 8.502 1.00 1.00 H new ATOM 2027 N GLU A 136 16.323 -18.619 10.392 1.00 1.00 N ATOM 2028 CA GLU A 136 16.536 -17.384 11.158 1.00 1.00 C ATOM 2029 C GLU A 136 16.040 -16.158 10.409 1.00 1.00 C ATOM 2030 O GLU A 136 15.235 -15.367 10.900 1.00 1.00 O ATOM 2031 CB GLU A 136 18.023 -17.158 11.403 1.00 1.00 C ATOM 2032 CG GLU A 136 18.660 -18.272 12.206 1.00 1.00 C ATOM 2033 CD GLU A 136 18.180 -18.310 13.673 1.00 1.00 C ATOM 2034 OE1 GLU A 136 18.269 -17.272 14.372 1.00 1.00 O1- ATOM 2035 OE2 GLU A 136 17.714 -19.375 14.143 1.00 1.00 O ATOM 0 H GLU A 136 17.013 -18.736 9.650 1.00 1.00 H new ATOM 0 HA GLU A 136 15.985 -17.509 12.090 1.00 1.00 H new ATOM 0 HB2 GLU A 136 18.535 -17.068 10.445 1.00 1.00 H new ATOM 0 HB3 GLU A 136 18.161 -16.213 11.928 1.00 1.00 H new ATOM 0 HG2 GLU A 136 18.437 -19.228 11.732 1.00 1.00 H new ATOM 0 HG3 GLU A 136 19.743 -18.152 12.187 1.00 1.00 H new ATOM 2042 N SER A 137 16.559 -15.992 9.195 1.00 1.00 N ATOM 2043 CA SER A 137 16.236 -14.827 8.379 1.00 1.00 C ATOM 2044 C SER A 137 14.791 -14.802 7.884 1.00 1.00 C ATOM 2045 O SER A 137 14.219 -13.720 7.826 1.00 1.00 O ATOM 2046 CB SER A 137 17.171 -14.730 7.198 1.00 1.00 C ATOM 2047 OG SER A 137 17.071 -15.939 6.482 1.00 1.00 O ATOM 0 H SER A 137 17.204 -16.649 8.756 1.00 1.00 H new ATOM 0 HA SER A 137 16.362 -13.966 9.035 1.00 1.00 H new ATOM 0 HB2 SER A 137 16.902 -13.885 6.564 1.00 1.00 H new ATOM 0 HB3 SER A 137 18.195 -14.565 7.532 1.00 1.00 H new ATOM 0 HG SER A 137 17.620 -16.624 6.918 1.00 1.00 H new ATOM 2053 N ASN A 138 14.149 -15.939 7.594 1.00 1.00 N ATOM 2054 CA ASN A 138 12.746 -15.928 7.159 1.00 1.00 C ATOM 2055 C ASN A 138 11.810 -15.310 8.213 1.00 1.00 C ATOM 2056 O ASN A 138 11.203 -14.281 7.909 1.00 1.00 O ATOM 2057 CB ASN A 138 12.243 -17.311 6.715 1.00 1.00 C ATOM 2058 CG ASN A 138 12.900 -17.870 5.464 1.00 1.00 C ATOM 2059 OD1 ASN A 138 13.818 -17.313 4.886 1.00 1.00 O ATOM 2060 ND2 ASN A 138 12.403 -18.990 4.994 1.00 1.00 N ATOM 0 H ASN A 138 14.570 -16.866 7.651 1.00 1.00 H new ATOM 0 HA ASN A 138 12.721 -15.285 6.279 1.00 1.00 H new ATOM 0 HB2 ASN A 138 12.398 -18.015 7.532 1.00 1.00 H new ATOM 0 HB3 ASN A 138 11.168 -17.251 6.545 1.00 1.00 H new ATOM 0 HD21 ASN A 138 12.785 -19.399 4.141 1.00 1.00 H new ATOM 0 HD22 ASN A 138 11.635 -19.452 5.482 1.00 1.00 H new ATOM 2067 N PRO A 139 11.711 -15.829 9.457 1.00 1.00 N ATOM 2068 CA PRO A 139 10.900 -15.182 10.495 1.00 1.00 C ATOM 2069 C PRO A 139 11.398 -13.775 10.853 1.00 1.00 C ATOM 2070 O PRO A 139 10.606 -12.953 11.312 1.00 1.00 O ATOM 2071 CB PRO A 139 10.961 -16.115 11.708 1.00 1.00 C ATOM 2072 CG PRO A 139 12.307 -16.803 11.532 1.00 1.00 C ATOM 2073 CD PRO A 139 12.384 -16.996 10.021 1.00 1.00 C ATOM 0 HA PRO A 139 9.880 -15.034 10.141 1.00 1.00 H new ATOM 0 HB2 PRO A 139 10.908 -15.563 12.647 1.00 1.00 H new ATOM 0 HB3 PRO A 139 10.138 -16.830 11.711 1.00 1.00 H new ATOM 0 HG2 PRO A 139 13.128 -16.190 11.905 1.00 1.00 H new ATOM 0 HG3 PRO A 139 12.350 -17.753 12.065 1.00 1.00 H new ATOM 0 HD2 PRO A 139 13.418 -17.057 9.683 1.00 1.00 H new ATOM 0 HD3 PRO A 139 11.894 -17.920 9.716 1.00 1.00 H new ATOM 2081 N TRP A 140 12.672 -13.456 10.591 1.00 1.00 N ATOM 2082 CA TRP A 140 13.189 -12.103 10.750 1.00 1.00 C ATOM 2083 C TRP A 140 12.594 -11.161 9.713 1.00 1.00 C ATOM 2084 O TRP A 140 12.119 -10.092 10.070 1.00 1.00 O ATOM 2085 CB TRP A 140 14.716 -12.028 10.714 1.00 1.00 C ATOM 2086 CG TRP A 140 15.199 -10.622 10.895 1.00 1.00 C ATOM 2087 CD1 TRP A 140 15.507 -10.053 12.082 1.00 1.00 C ATOM 2088 CD2 TRP A 140 15.357 -9.560 9.897 1.00 1.00 C ATOM 2089 NE1 TRP A 140 15.931 -8.751 11.871 1.00 1.00 N ATOM 2090 CE2 TRP A 140 15.802 -8.377 10.552 1.00 1.00 C ATOM 2091 CE3 TRP A 140 15.129 -9.465 8.507 1.00 1.00 C ATOM 2092 CZ2 TRP A 140 16.014 -7.173 9.866 1.00 1.00 C ATOM 2093 CZ3 TRP A 140 15.291 -8.247 7.818 1.00 1.00 C ATOM 2094 CH2 TRP A 140 15.760 -7.109 8.488 1.00 1.00 C ATOM 0 H TRP A 140 13.365 -14.129 10.265 1.00 1.00 H new ATOM 0 HA TRP A 140 12.880 -11.784 11.745 1.00 1.00 H new ATOM 0 HB2 TRP A 140 15.131 -12.661 11.498 1.00 1.00 H new ATOM 0 HB3 TRP A 140 15.079 -12.419 9.763 1.00 1.00 H new ATOM 0 HD1 TRP A 140 15.434 -10.538 13.044 1.00 1.00 H new ATOM 0 HE1 TRP A 140 16.295 -8.143 12.604 1.00 1.00 H new ATOM 0 HE3 TRP A 140 14.824 -10.345 7.960 1.00 1.00 H new ATOM 0 HZ2 TRP A 140 16.370 -6.301 10.395 1.00 1.00 H new ATOM 0 HZ3 TRP A 140 15.052 -8.190 6.766 1.00 1.00 H new ATOM 0 HH2 TRP A 140 15.925 -6.189 7.947 1.00 1.00 H new ATOM 2105 N VAL A 141 12.550 -11.570 8.443 1.00 1.00 N ATOM 2106 CA VAL A 141 11.911 -10.789 7.377 1.00 1.00 C ATOM 2107 C VAL A 141 10.406 -10.677 7.677 1.00 1.00 C ATOM 2108 O VAL A 141 9.788 -9.653 7.424 1.00 1.00 O ATOM 2109 CB VAL A 141 12.149 -11.396 5.983 1.00 1.00 C ATOM 2110 CG1 VAL A 141 11.343 -10.567 4.949 1.00 1.00 C ATOM 2111 CG2 VAL A 141 13.627 -11.520 5.502 1.00 1.00 C ATOM 0 H VAL A 141 12.955 -12.450 8.123 1.00 1.00 H new ATOM 0 HA VAL A 141 12.362 -9.797 7.359 1.00 1.00 H new ATOM 0 HB VAL A 141 11.816 -12.430 6.067 1.00 1.00 H new ATOM 0 HG11 VAL A 141 11.497 -10.980 3.952 1.00 1.00 H new ATOM 0 HG12 VAL A 141 10.283 -10.606 5.198 1.00 1.00 H new ATOM 0 HG13 VAL A 141 11.682 -9.531 4.969 1.00 1.00 H new ATOM 0 HG21 VAL A 141 13.650 -11.963 4.506 1.00 1.00 H new ATOM 0 HG22 VAL A 141 14.083 -10.531 5.470 1.00 1.00 H new ATOM 0 HG23 VAL A 141 14.183 -12.154 6.193 1.00 1.00 H new ATOM 2121 N GLU A 142 9.803 -11.707 8.259 1.00 1.00 N ATOM 2122 CA GLU A 142 8.392 -11.752 8.648 1.00 1.00 C ATOM 2123 C GLU A 142 8.078 -10.780 9.812 1.00 1.00 C ATOM 2124 O GLU A 142 7.002 -10.196 9.882 1.00 1.00 O ATOM 2125 CB GLU A 142 8.062 -13.214 8.999 1.00 1.00 C ATOM 2126 CG GLU A 142 6.851 -13.807 8.296 1.00 1.00 C ATOM 2127 CD GLU A 142 5.506 -13.189 8.714 1.00 1.00 C ATOM 2128 OE1 GLU A 142 5.177 -13.189 9.923 1.00 1.00 O ATOM 2129 OE2 GLU A 142 4.762 -12.717 7.822 1.00 1.00 O1- ATOM 0 H GLU A 142 10.300 -12.569 8.483 1.00 1.00 H new ATOM 0 HA GLU A 142 7.762 -11.416 7.825 1.00 1.00 H new ATOM 0 HB2 GLU A 142 8.931 -13.829 8.765 1.00 1.00 H new ATOM 0 HB3 GLU A 142 7.903 -13.282 10.075 1.00 1.00 H new ATOM 0 HG2 GLU A 142 6.975 -13.684 7.220 1.00 1.00 H new ATOM 0 HG3 GLU A 142 6.821 -14.879 8.493 1.00 1.00 H new ATOM 2136 N HIS A 143 9.049 -10.543 10.688 1.00 1.00 N ATOM 2137 CA HIS A 143 9.036 -9.523 11.731 1.00 1.00 C ATOM 2138 C HIS A 143 9.335 -8.122 11.181 1.00 1.00 C ATOM 2139 O HIS A 143 8.487 -7.235 11.227 1.00 1.00 O ATOM 2140 CB HIS A 143 9.987 -9.923 12.870 1.00 1.00 C ATOM 2141 CG HIS A 143 10.154 -8.838 13.906 1.00 1.00 C ATOM 2142 ND1 HIS A 143 9.214 -8.434 14.830 1.00 1.00 N ATOM 2143 CD2 HIS A 143 11.253 -8.036 14.073 1.00 1.00 C ATOM 2144 CE1 HIS A 143 9.735 -7.417 15.541 1.00 1.00 C ATOM 2145 NE2 HIS A 143 10.981 -7.136 15.113 1.00 1.00 N ATOM 0 H HIS A 143 9.912 -11.086 10.690 1.00 1.00 H new ATOM 0 HA HIS A 143 8.027 -9.466 12.139 1.00 1.00 H new ATOM 0 HB2 HIS A 143 9.608 -10.824 13.353 1.00 1.00 H new ATOM 0 HB3 HIS A 143 10.962 -10.172 12.451 1.00 1.00 H new ATOM 0 HD2 HIS A 143 12.169 -8.088 13.503 1.00 1.00 H new ATOM 0 HE1 HIS A 143 9.226 -6.900 16.341 1.00 1.00 H new ATOM 0 HE2 HIS A 143 11.603 -6.412 15.474 1.00 1.00 H new ATOM 2153 N TRP A 144 10.522 -7.927 10.611 1.00 1.00 N ATOM 2154 CA TRP A 144 10.992 -6.682 10.008 1.00 1.00 C ATOM 2155 C TRP A 144 10.061 -6.169 8.919 1.00 1.00 C ATOM 2156 O TRP A 144 9.815 -4.976 8.858 1.00 1.00 O ATOM 2157 CB TRP A 144 12.390 -6.924 9.434 1.00 1.00 C ATOM 2158 CG TRP A 144 12.959 -5.753 8.704 1.00 1.00 C ATOM 2159 CD1 TRP A 144 13.619 -4.731 9.285 1.00 1.00 C ATOM 2160 CD2 TRP A 144 12.959 -5.469 7.270 1.00 1.00 C ATOM 2161 NE1 TRP A 144 14.008 -3.829 8.319 1.00 1.00 N ATOM 2162 CE2 TRP A 144 13.574 -4.202 7.065 1.00 1.00 C ATOM 2163 CE3 TRP A 144 12.512 -6.158 6.122 1.00 1.00 C ATOM 2164 CZ2 TRP A 144 13.682 -3.618 5.795 1.00 1.00 C ATOM 2165 CZ3 TRP A 144 12.677 -5.608 4.836 1.00 1.00 C ATOM 2166 CH2 TRP A 144 13.250 -4.337 4.669 1.00 1.00 C ATOM 0 H TRP A 144 11.217 -8.671 10.554 1.00 1.00 H new ATOM 0 HA TRP A 144 11.015 -5.914 10.781 1.00 1.00 H new ATOM 0 HB2 TRP A 144 13.064 -7.194 10.247 1.00 1.00 H new ATOM 0 HB3 TRP A 144 12.350 -7.777 8.756 1.00 1.00 H new ATOM 0 HD1 TRP A 144 13.813 -4.634 10.343 1.00 1.00 H new ATOM 0 HE1 TRP A 144 14.551 -2.987 8.509 1.00 1.00 H new ATOM 0 HE3 TRP A 144 12.036 -7.121 6.231 1.00 1.00 H new ATOM 0 HZ2 TRP A 144 14.093 -2.626 5.684 1.00 1.00 H new ATOM 0 HZ3 TRP A 144 12.360 -6.169 3.970 1.00 1.00 H new ATOM 0 HH2 TRP A 144 13.358 -3.915 3.681 1.00 1.00 H new ATOM 2177 N GLY A 145 9.458 -7.052 8.130 1.00 1.00 N ATOM 2178 CA GLY A 145 8.451 -6.713 7.136 1.00 1.00 C ATOM 2179 C GLY A 145 7.306 -5.847 7.679 1.00 1.00 C ATOM 2180 O GLY A 145 6.826 -4.948 6.985 1.00 1.00 O ATOM 0 H GLY A 145 9.663 -8.050 8.167 1.00 1.00 H new ATOM 0 HA2 GLY A 145 8.932 -6.187 6.311 1.00 1.00 H new ATOM 0 HA3 GLY A 145 8.034 -7.633 6.727 1.00 1.00 H new ATOM 2184 N THR A 146 6.939 -6.018 8.954 1.00 1.00 N ATOM 2185 CA THR A 146 5.901 -5.224 9.602 1.00 1.00 C ATOM 2186 C THR A 146 6.276 -3.751 9.806 1.00 1.00 C ATOM 2187 O THR A 146 5.395 -2.925 10.064 1.00 1.00 O ATOM 2188 CB THR A 146 5.495 -5.858 10.943 1.00 1.00 C ATOM 2189 OG1 THR A 146 6.470 -5.669 11.940 1.00 1.00 O ATOM 2190 CG2 THR A 146 5.205 -7.364 10.862 1.00 1.00 C ATOM 0 H THR A 146 7.360 -6.718 9.566 1.00 1.00 H new ATOM 0 HA THR A 146 5.054 -5.229 8.916 1.00 1.00 H new ATOM 0 HB THR A 146 4.573 -5.337 11.203 1.00 1.00 H new ATOM 0 HG1 THR A 146 7.345 -5.951 11.600 1.00 1.00 H new ATOM 0 HG21 THR A 146 4.926 -7.734 11.848 1.00 1.00 H new ATOM 0 HG22 THR A 146 4.387 -7.540 10.164 1.00 1.00 H new ATOM 0 HG23 THR A 146 6.096 -7.888 10.516 1.00 1.00 H new ATOM 2198 N LEU A 147 7.557 -3.407 9.651 1.00 1.00 N ATOM 2199 CA LEU A 147 8.093 -2.061 9.722 1.00 1.00 C ATOM 2200 C LEU A 147 7.877 -1.285 8.405 1.00 1.00 C ATOM 2201 O LEU A 147 7.987 -0.056 8.401 1.00 1.00 O ATOM 2202 CB LEU A 147 9.596 -2.131 10.082 1.00 1.00 C ATOM 2203 CG LEU A 147 10.032 -2.693 11.460 1.00 1.00 C ATOM 2204 CD1 LEU A 147 10.095 -1.547 12.472 1.00 1.00 C ATOM 2205 CD2 LEU A 147 9.183 -3.802 12.090 1.00 1.00 C ATOM 0 H LEU A 147 8.279 -4.102 9.463 1.00 1.00 H new ATOM 0 HA LEU A 147 7.557 -1.515 10.498 1.00 1.00 H new ATOM 0 HB2 LEU A 147 10.086 -2.731 9.316 1.00 1.00 H new ATOM 0 HB3 LEU A 147 9.997 -1.121 10.001 1.00 1.00 H new ATOM 0 HG LEU A 147 10.991 -3.161 11.238 1.00 1.00 H new ATOM 0 HD11 LEU A 147 10.401 -1.936 13.443 1.00 1.00 H new ATOM 0 HD12 LEU A 147 10.817 -0.803 12.135 1.00 1.00 H new ATOM 0 HD13 LEU A 147 9.112 -1.085 12.560 1.00 1.00 H new ATOM 0 HD21 LEU A 147 9.614 -4.090 13.049 1.00 1.00 H new ATOM 0 HD22 LEU A 147 8.166 -3.440 12.243 1.00 1.00 H new ATOM 0 HD23 LEU A 147 9.164 -4.667 11.427 1.00 1.00 H new ATOM 2217 N LEU A 148 7.592 -1.976 7.289 1.00 1.00 N ATOM 2218 CA LEU A 148 7.416 -1.400 5.963 1.00 1.00 C ATOM 2219 C LEU A 148 5.949 -0.949 5.746 1.00 1.00 C ATOM 2220 O LEU A 148 5.083 -1.159 6.606 1.00 1.00 O ATOM 2221 CB LEU A 148 7.860 -2.426 4.902 1.00 1.00 C ATOM 2222 CG LEU A 148 9.333 -2.878 4.887 1.00 1.00 C ATOM 2223 CD1 LEU A 148 10.292 -1.826 4.330 1.00 1.00 C ATOM 2224 CD2 LEU A 148 9.929 -3.335 6.207 1.00 1.00 C ATOM 0 H LEU A 148 7.475 -2.989 7.295 1.00 1.00 H new ATOM 0 HA LEU A 148 8.037 -0.510 5.868 1.00 1.00 H new ATOM 0 HB2 LEU A 148 7.242 -3.316 5.022 1.00 1.00 H new ATOM 0 HB3 LEU A 148 7.631 -2.009 3.921 1.00 1.00 H new ATOM 0 HG LEU A 148 9.252 -3.745 4.232 1.00 1.00 H new ATOM 0 HD11 LEU A 148 11.310 -2.215 4.351 1.00 1.00 H new ATOM 0 HD12 LEU A 148 10.015 -1.589 3.303 1.00 1.00 H new ATOM 0 HD13 LEU A 148 10.236 -0.924 4.939 1.00 1.00 H new ATOM 0 HD21 LEU A 148 10.969 -3.625 6.056 1.00 1.00 H new ATOM 0 HD22 LEU A 148 9.881 -2.520 6.929 1.00 1.00 H new ATOM 0 HD23 LEU A 148 9.366 -4.188 6.585 1.00 1.00 H new ATOM 2236 N SER A 149 5.666 -0.329 4.592 1.00 1.00 N ATOM 2237 CA SER A 149 4.393 0.355 4.286 1.00 1.00 C ATOM 2238 C SER A 149 3.413 -0.461 3.441 1.00 1.00 C ATOM 2239 O SER A 149 2.258 -0.654 3.877 1.00 1.00 O ATOM 2240 CB SER A 149 4.608 1.745 3.679 1.00 1.00 C ATOM 2241 OG SER A 149 5.593 2.460 4.413 1.00 1.00 O ATOM 2242 OXT SER A 149 3.792 -0.884 2.322 1.00 1.00 O1- ATOM 0 H SER A 149 6.332 -0.286 3.821 1.00 1.00 H new ATOM 0 HA SER A 149 3.918 0.472 5.260 1.00 1.00 H new ATOM 0 HB2 SER A 149 4.919 1.650 2.638 1.00 1.00 H new ATOM 0 HB3 SER A 149 3.669 2.299 3.682 1.00 1.00 H new ATOM 0 HG SER A 149 6.336 2.697 3.819 1.00 1.00 H new