USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 875 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 120 SER OG : rot -113:sc= 1.46 USER MOD Set 1.2: A 122 GLN : amide:sc= 0.516 K(o=2,f=1.2) USER MOD Set 2.1: A 88 HIS : no HD1:sc= -17.1! C(o=-18!,f=-23!) USER MOD Set 2.2: A 105 SER OG : rot -62:sc= -0.116 USER MOD Set 2.3: A 109 THR OG1 : rot -17:sc= -0.713! USER MOD Set 3.1: A 85 SER OG : rot 75:sc= 0.987 USER MOD Set 3.2: A 106 THR OG1 : rot 81:sc= 0.0224 USER MOD Set 4.1: A 71 ASN :FLIP amide:sc= -7.68! C(o=-9.4!,f=-8.8!) USER MOD Set 4.2: A 86 ASN : amide:sc= -1.16 K(o=-8.8,f=-11) USER MOD Set 5.1: A 38 CYS SG : rot 42:sc= 1 USER MOD Set 5.2: A 40 THR OG1 : rot -19:sc= 0.817 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0.1) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 CYS SG : rot 97:sc= -2.4 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.064 USER MOD Single : A 42 GLN : amide:sc= -2.82! C(o=-2.8!,f=-4.3!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 157:sc= -0.333 (180deg=-0.644) USER MOD Single : A 67 THR OG1 : rot 70:sc= 0.372 USER MOD Single : A 74 CYS SG : rot 25:sc= -5.34 USER MOD Single : A 76 TYR OH : rot -83:sc= 0.725 USER MOD Single : A 77 HIS : no HD1:sc= -0.747 X(o=-0.75,f=-0.47) USER MOD Single : A 82 SER OG : rot 180:sc= 0.112 USER MOD Single : A 87 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0179) USER MOD Single : A 90 GLN : amide:sc= -1.76! C(o=-1.8!,f=-3.9!) USER MOD Single : A 102 ASN : amide:sc= -1.14 K(o=-1.1,f=-6.5!) USER MOD Single : A 107 ASN : amide:sc= 0.0151 K(o=0.015,f=-0.95) USER MOD Single : A 112 ASN :FLIP amide:sc=-0.00323 F(o=-1.4,f=-0.0032) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ -142:sc= 0.104 (180deg=-0.153) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -2.72! C(o=-2.7!,f=-4.2!) USER MOD Single : A 121 ASN : amide:sc= -0.427 X(o=-0.43,f=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN :FLIP amide:sc= -0.341 F(o=-1.1,f=-0.34) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot -137:sc= -1.95 USER MOD Single : A 148 ASN :FLIP amide:sc= -0.467 F(o=-1.3,f=-0.47) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 25 N GLN A 16 -25.108 10.203 -27.103 1.00 0.00 N ATOM 26 CA GLN A 16 -24.480 8.978 -27.586 1.00 0.00 C ATOM 27 C GLN A 16 -24.759 8.772 -29.071 1.00 0.00 C ATOM 28 O GLN A 16 -23.850 8.476 -29.848 1.00 0.00 O ATOM 29 CB GLN A 16 -24.979 7.773 -26.788 1.00 0.00 C ATOM 30 CG GLN A 16 -24.118 7.448 -25.577 1.00 0.00 C ATOM 31 CD GLN A 16 -24.802 7.781 -24.266 1.00 0.00 C ATOM 32 OE1 GLN A 16 -25.360 8.866 -24.102 1.00 0.00 O ATOM 33 NE2 GLN A 16 -24.765 6.845 -23.324 1.00 0.00 N ATOM 0 HA GLN A 16 -23.403 9.074 -27.448 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -26.000 7.964 -26.457 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -25.014 6.903 -27.443 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -23.864 6.388 -25.591 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -23.181 8.001 -25.644 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -24.291 5.960 -23.503 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -25.210 7.012 -22.422 1.00 0.00 H new ATOM 42 N ARG A 17 -26.019 8.931 -29.460 1.00 0.00 N ATOM 43 CA ARG A 17 -26.415 8.763 -30.854 1.00 0.00 C ATOM 44 C ARG A 17 -25.732 9.801 -31.738 1.00 0.00 C ATOM 45 O ARG A 17 -25.202 9.473 -32.799 1.00 0.00 O ATOM 46 CB ARG A 17 -27.933 8.873 -30.994 1.00 0.00 C ATOM 47 CG ARG A 17 -28.482 8.180 -32.231 1.00 0.00 C ATOM 48 CD ARG A 17 -29.011 9.180 -33.246 1.00 0.00 C ATOM 49 NE ARG A 17 -28.787 8.738 -34.620 1.00 0.00 N ATOM 50 CZ ARG A 17 -29.439 9.228 -35.673 1.00 0.00 C ATOM 51 NH1 ARG A 17 -30.356 10.175 -35.512 1.00 0.00 N ATOM 52 NH2 ARG A 17 -29.173 8.771 -36.888 1.00 0.00 N ATOM 0 H ARG A 17 -26.783 9.176 -28.831 1.00 0.00 H new ATOM 0 HA ARG A 17 -26.102 7.771 -31.179 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -28.403 8.444 -30.109 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -28.211 9.926 -31.024 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -27.698 7.577 -32.689 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -29.281 7.498 -31.942 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -30.078 9.331 -33.083 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -28.526 10.144 -33.092 1.00 0.00 H new ATOM 0 HE ARG A 17 -28.090 8.011 -34.783 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -30.564 10.530 -34.579 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -30.853 10.547 -36.322 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -28.469 8.044 -37.017 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -29.672 9.146 -37.695 1.00 0.00 H new ATOM 66 N PHE A 18 -25.747 11.054 -31.292 1.00 0.00 N ATOM 67 CA PHE A 18 -25.125 12.139 -32.043 1.00 0.00 C ATOM 68 C PHE A 18 -23.650 11.841 -32.294 1.00 0.00 C ATOM 69 O PHE A 18 -23.111 12.167 -33.351 1.00 0.00 O ATOM 70 CB PHE A 18 -25.270 13.462 -31.290 1.00 0.00 C ATOM 71 CG PHE A 18 -25.001 14.671 -32.141 1.00 0.00 C ATOM 72 CD1 PHE A 18 -25.951 15.125 -33.041 1.00 0.00 C ATOM 73 CD2 PHE A 18 -23.799 15.352 -32.040 1.00 0.00 C ATOM 74 CE1 PHE A 18 -25.707 16.237 -33.826 1.00 0.00 C ATOM 75 CE2 PHE A 18 -23.548 16.463 -32.821 1.00 0.00 C ATOM 76 CZ PHE A 18 -24.503 16.906 -33.716 1.00 0.00 C ATOM 0 H PHE A 18 -26.182 11.342 -30.416 1.00 0.00 H new ATOM 0 HA PHE A 18 -25.633 12.223 -33.004 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -26.279 13.531 -30.884 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -24.585 13.465 -30.442 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -26.893 14.605 -33.131 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -23.049 15.010 -31.342 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -26.456 16.582 -34.524 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -22.607 16.985 -32.732 1.00 0.00 H new ATOM 0 HZ PHE A 18 -24.309 17.774 -34.329 1.00 0.00 H new ATOM 86 N LEU A 19 -23.009 11.212 -31.315 1.00 0.00 N ATOM 87 CA LEU A 19 -21.598 10.861 -31.429 1.00 0.00 C ATOM 88 C LEU A 19 -21.376 9.921 -32.610 1.00 0.00 C ATOM 89 O LEU A 19 -20.324 9.951 -33.251 1.00 0.00 O ATOM 90 CB LEU A 19 -21.107 10.207 -30.134 1.00 0.00 C ATOM 91 CG LEU A 19 -20.118 11.046 -29.321 1.00 0.00 C ATOM 92 CD1 LEU A 19 -20.349 10.849 -27.830 1.00 0.00 C ATOM 93 CD2 LEU A 19 -18.687 10.688 -29.692 1.00 0.00 C ATOM 0 H LEU A 19 -23.443 10.935 -30.435 1.00 0.00 H new ATOM 0 HA LEU A 19 -21.028 11.774 -31.599 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -21.971 9.982 -29.508 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -20.636 9.255 -30.381 1.00 0.00 H new ATOM 0 HG LEU A 19 -20.283 12.097 -29.557 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -19.637 11.453 -27.268 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -21.364 11.154 -27.576 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -20.212 9.798 -27.576 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -17.997 11.294 -29.105 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -18.511 9.633 -29.485 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -18.527 10.881 -30.753 1.00 0.00 H new ATOM 105 N ILE A 20 -22.375 9.092 -32.894 1.00 0.00 N ATOM 106 CA ILE A 20 -22.289 8.145 -34.000 1.00 0.00 C ATOM 107 C ILE A 20 -22.413 8.866 -35.339 1.00 0.00 C ATOM 108 O ILE A 20 -21.772 8.490 -36.318 1.00 0.00 O ATOM 109 CB ILE A 20 -23.373 7.048 -33.916 1.00 0.00 C ATOM 110 CG1 ILE A 20 -23.662 6.679 -32.456 1.00 0.00 C ATOM 111 CG2 ILE A 20 -22.930 5.820 -34.701 1.00 0.00 C ATOM 112 CD1 ILE A 20 -24.572 5.478 -32.297 1.00 0.00 C ATOM 0 H ILE A 20 -23.252 9.057 -32.375 1.00 0.00 H new ATOM 0 HA ILE A 20 -21.312 7.668 -33.925 1.00 0.00 H new ATOM 0 HB ILE A 20 -24.294 7.433 -34.354 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -22.719 6.478 -31.948 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -24.116 7.536 -31.958 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -23.699 5.050 -34.637 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -22.774 6.092 -35.745 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -21.999 5.437 -34.283 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -24.730 5.279 -31.237 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -25.530 5.682 -32.774 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -24.111 4.608 -32.765 1.00 0.00 H new ATOM 124 N GLU A 21 -23.238 9.907 -35.376 1.00 0.00 N ATOM 125 CA GLU A 21 -23.434 10.676 -36.594 1.00 0.00 C ATOM 126 C GLU A 21 -22.104 11.237 -37.087 1.00 0.00 C ATOM 127 O GLU A 21 -21.840 11.282 -38.289 1.00 0.00 O ATOM 128 CB GLU A 21 -24.426 11.814 -36.353 1.00 0.00 C ATOM 129 CG GLU A 21 -24.948 12.448 -37.634 1.00 0.00 C ATOM 130 CD GLU A 21 -26.422 12.795 -37.555 1.00 0.00 C ATOM 131 OE1 GLU A 21 -26.807 13.539 -36.628 1.00 0.00 O ATOM 132 OE2 GLU A 21 -27.189 12.324 -38.419 1.00 0.00 O ATOM 0 H GLU A 21 -23.780 10.235 -34.577 1.00 0.00 H new ATOM 0 HA GLU A 21 -23.841 10.013 -37.358 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -25.269 11.434 -35.776 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -23.945 12.582 -35.747 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -24.377 13.352 -37.847 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -24.784 11.764 -38.467 1.00 0.00 H new ATOM 139 N LYS A 22 -21.266 11.653 -36.142 1.00 0.00 N ATOM 140 CA LYS A 22 -19.953 12.202 -36.462 1.00 0.00 C ATOM 141 C LYS A 22 -19.041 11.130 -37.051 1.00 0.00 C ATOM 142 O LYS A 22 -18.087 11.436 -37.767 1.00 0.00 O ATOM 143 CB LYS A 22 -19.312 12.802 -35.209 1.00 0.00 C ATOM 144 CG LYS A 22 -18.053 13.606 -35.494 1.00 0.00 C ATOM 145 CD LYS A 22 -17.395 14.080 -34.208 1.00 0.00 C ATOM 146 CE LYS A 22 -15.879 14.049 -34.317 1.00 0.00 C ATOM 147 NZ LYS A 22 -15.316 15.394 -34.619 1.00 0.00 N ATOM 0 H LYS A 22 -21.475 11.620 -35.144 1.00 0.00 H new ATOM 0 HA LYS A 22 -20.086 12.986 -37.207 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -20.039 13.445 -34.712 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -19.070 11.998 -34.514 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -17.350 12.995 -36.061 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -18.302 14.466 -36.116 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -17.724 15.094 -33.981 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -17.715 13.448 -33.379 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -15.455 13.680 -33.383 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -15.586 13.349 -35.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -14.280 15.330 -34.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -15.700 15.736 -35.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -15.574 16.057 -33.860 1.00 0.00 H new ATOM 161 N PHE A 23 -19.340 9.870 -36.743 1.00 0.00 N ATOM 162 CA PHE A 23 -18.547 8.748 -37.234 1.00 0.00 C ATOM 163 C PHE A 23 -18.473 8.753 -38.758 1.00 0.00 C ATOM 164 O PHE A 23 -17.398 8.607 -39.340 1.00 0.00 O ATOM 165 CB PHE A 23 -19.154 7.441 -36.757 1.00 0.00 C ATOM 166 CG PHE A 23 -18.155 6.477 -36.196 1.00 0.00 C ATOM 167 CD1 PHE A 23 -16.974 6.214 -36.865 1.00 0.00 C ATOM 168 CD2 PHE A 23 -18.405 5.829 -34.998 1.00 0.00 C ATOM 169 CE1 PHE A 23 -16.056 5.322 -36.349 1.00 0.00 C ATOM 170 CE2 PHE A 23 -17.493 4.935 -34.478 1.00 0.00 C ATOM 171 CZ PHE A 23 -16.316 4.682 -35.154 1.00 0.00 C ATOM 0 H PHE A 23 -20.128 9.601 -36.154 1.00 0.00 H new ATOM 0 HA PHE A 23 -17.535 8.848 -36.841 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -19.904 7.656 -35.996 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -19.673 6.967 -37.590 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -16.768 6.712 -37.801 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -19.324 6.026 -34.465 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -15.136 5.125 -36.879 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -17.699 4.434 -33.544 1.00 0.00 H new ATOM 0 HZ PHE A 23 -15.599 3.984 -34.748 1.00 0.00 H new ATOM 296 N ILE A 32 -9.440 18.585 -30.329 1.00 0.00 N ATOM 297 CA ILE A 32 -8.689 17.386 -30.501 1.00 0.00 C ATOM 298 C ILE A 32 -7.256 17.531 -30.031 1.00 0.00 C ATOM 299 O ILE A 32 -6.630 18.582 -30.173 1.00 0.00 O ATOM 300 CB ILE A 32 -8.752 16.925 -31.960 1.00 0.00 C ATOM 301 CG1 ILE A 32 -10.163 17.103 -32.523 1.00 0.00 C ATOM 302 CG2 ILE A 32 -8.369 15.479 -32.038 1.00 0.00 C ATOM 303 CD1 ILE A 32 -11.240 16.531 -31.622 1.00 0.00 C ATOM 0 HA ILE A 32 -9.144 16.620 -29.873 1.00 0.00 H new ATOM 0 HB ILE A 32 -8.061 17.530 -32.548 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -10.354 18.165 -32.679 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -10.221 16.622 -33.499 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -8.413 15.147 -33.075 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.356 15.350 -31.658 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -9.060 14.887 -31.438 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -12.217 16.689 -32.078 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -11.071 15.463 -31.486 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -11.206 17.029 -30.653 1.00 0.00 H new ATOM 315 N VAL A 33 -6.766 16.456 -29.441 1.00 0.00 N ATOM 316 CA VAL A 33 -5.429 16.395 -28.894 1.00 0.00 C ATOM 317 C VAL A 33 -4.531 15.555 -29.799 1.00 0.00 C ATOM 318 O VAL A 33 -3.450 15.986 -30.202 1.00 0.00 O ATOM 319 CB VAL A 33 -5.499 15.795 -27.468 1.00 0.00 C ATOM 320 CG1 VAL A 33 -4.453 14.729 -27.243 1.00 0.00 C ATOM 321 CG2 VAL A 33 -5.379 16.881 -26.413 1.00 0.00 C ATOM 0 H VAL A 33 -7.295 15.591 -29.328 1.00 0.00 H new ATOM 0 HA VAL A 33 -5.002 17.396 -28.838 1.00 0.00 H new ATOM 0 HB VAL A 33 -6.476 15.321 -27.376 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -4.543 14.339 -26.229 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -4.600 13.919 -27.957 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -3.461 15.158 -27.380 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -5.431 16.432 -25.421 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -4.426 17.396 -26.528 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -6.194 17.595 -26.531 1.00 0.00 H new ATOM 331 N CYS A 34 -5.004 14.357 -30.118 1.00 0.00 N ATOM 332 CA CYS A 34 -4.267 13.440 -30.985 1.00 0.00 C ATOM 333 C CYS A 34 -5.221 12.465 -31.672 1.00 0.00 C ATOM 334 O CYS A 34 -6.379 12.341 -31.279 1.00 0.00 O ATOM 335 CB CYS A 34 -3.216 12.672 -30.181 1.00 0.00 C ATOM 336 SG CYS A 34 -1.600 12.571 -30.986 1.00 0.00 S ATOM 0 H CYS A 34 -5.899 13.994 -29.789 1.00 0.00 H new ATOM 0 HA CYS A 34 -3.761 14.027 -31.751 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -3.097 13.150 -29.209 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -3.582 11.662 -29.996 1.00 0.00 H new ATOM 0 HG CYS A 34 -0.823 13.503 -30.518 1.00 0.00 H new ATOM 342 N ARG A 35 -4.736 11.781 -32.703 1.00 0.00 N ATOM 343 CA ARG A 35 -5.557 10.822 -33.437 1.00 0.00 C ATOM 344 C ARG A 35 -4.882 9.454 -33.488 1.00 0.00 C ATOM 345 O ARG A 35 -3.675 9.355 -33.698 1.00 0.00 O ATOM 346 CB ARG A 35 -5.821 11.331 -34.857 1.00 0.00 C ATOM 347 CG ARG A 35 -7.292 11.335 -35.239 1.00 0.00 C ATOM 348 CD ARG A 35 -7.649 10.137 -36.103 1.00 0.00 C ATOM 349 NE ARG A 35 -8.757 10.427 -37.009 1.00 0.00 N ATOM 350 CZ ARG A 35 -8.626 11.093 -38.155 1.00 0.00 C ATOM 351 NH1 ARG A 35 -7.436 11.538 -38.539 1.00 0.00 N ATOM 352 NH2 ARG A 35 -9.688 11.315 -38.917 1.00 0.00 N ATOM 0 H ARG A 35 -3.781 11.872 -33.049 1.00 0.00 H new ATOM 0 HA ARG A 35 -6.507 10.716 -32.914 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -5.427 12.343 -34.950 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -5.272 10.709 -35.565 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -7.903 11.328 -34.336 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -7.527 12.254 -35.776 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -6.777 9.835 -36.682 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -7.914 9.295 -35.464 1.00 0.00 H new ATOM 0 HE ARG A 35 -9.687 10.100 -36.748 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -6.616 11.370 -37.956 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -7.341 12.047 -39.418 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -10.605 10.976 -38.625 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -9.588 11.825 -39.795 1.00 0.00 H new ATOM 366 N VAL A 36 -5.668 8.397 -33.295 1.00 0.00 N ATOM 367 CA VAL A 36 -5.134 7.039 -33.323 1.00 0.00 C ATOM 368 C VAL A 36 -5.535 6.315 -34.603 1.00 0.00 C ATOM 369 O VAL A 36 -6.720 6.193 -34.915 1.00 0.00 O ATOM 370 CB VAL A 36 -5.612 6.218 -32.112 1.00 0.00 C ATOM 371 CG1 VAL A 36 -4.853 4.901 -32.032 1.00 0.00 C ATOM 372 CG2 VAL A 36 -5.451 7.015 -30.824 1.00 0.00 C ATOM 0 H VAL A 36 -6.671 8.455 -33.119 1.00 0.00 H new ATOM 0 HA VAL A 36 -4.048 7.129 -33.284 1.00 0.00 H new ATOM 0 HB VAL A 36 -6.671 5.996 -32.241 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -5.202 4.332 -31.171 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -5.026 4.326 -32.942 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.787 5.101 -31.927 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -5.795 6.416 -29.980 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.401 7.271 -30.683 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -6.042 7.929 -30.885 1.00 0.00 H new ATOM 382 N ILE A 37 -4.538 5.848 -35.344 1.00 0.00 N ATOM 383 CA ILE A 37 -4.774 5.148 -36.596 1.00 0.00 C ATOM 384 C ILE A 37 -4.061 3.799 -36.621 1.00 0.00 C ATOM 385 O ILE A 37 -2.831 3.739 -36.597 1.00 0.00 O ATOM 386 CB ILE A 37 -4.283 5.990 -37.783 1.00 0.00 C ATOM 387 CG1 ILE A 37 -4.753 7.438 -37.636 1.00 0.00 C ATOM 388 CG2 ILE A 37 -4.767 5.395 -39.097 1.00 0.00 C ATOM 389 CD1 ILE A 37 -4.243 8.354 -38.724 1.00 0.00 C ATOM 0 H ILE A 37 -3.553 5.943 -35.096 1.00 0.00 H new ATOM 0 HA ILE A 37 -5.848 4.983 -36.678 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.193 5.981 -37.789 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -5.843 7.459 -37.636 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.427 7.820 -36.669 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -4.409 6.005 -39.926 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -4.382 4.380 -39.201 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -5.857 5.373 -39.107 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -4.617 9.364 -38.554 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.153 8.363 -38.711 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -4.591 7.997 -39.693 1.00 0.00 H new ATOM 401 N CYS A 38 -4.835 2.720 -36.678 1.00 0.00 N ATOM 402 CA CYS A 38 -4.268 1.377 -36.715 1.00 0.00 C ATOM 403 C CYS A 38 -3.819 1.027 -38.132 1.00 0.00 C ATOM 404 O CYS A 38 -4.608 1.084 -39.074 1.00 0.00 O ATOM 405 CB CYS A 38 -5.288 0.354 -36.218 1.00 0.00 C ATOM 406 SG CYS A 38 -4.676 -1.347 -36.197 1.00 0.00 S ATOM 0 H CYS A 38 -5.854 2.749 -36.700 1.00 0.00 H new ATOM 0 HA CYS A 38 -3.399 1.352 -36.057 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -5.601 0.629 -35.211 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -6.174 0.402 -36.851 1.00 0.00 H new ATOM 0 HG CYS A 38 -3.455 -1.363 -35.750 1.00 0.00 H new ATOM 412 N THR A 39 -2.543 0.678 -38.278 1.00 0.00 N ATOM 413 CA THR A 39 -1.990 0.335 -39.585 1.00 0.00 C ATOM 414 C THR A 39 -2.162 -1.149 -39.897 1.00 0.00 C ATOM 415 O THR A 39 -2.228 -1.540 -41.063 1.00 0.00 O ATOM 416 CB THR A 39 -0.508 0.709 -39.643 1.00 0.00 C ATOM 417 OG1 THR A 39 0.092 0.586 -38.367 1.00 0.00 O ATOM 418 CG2 THR A 39 -0.266 2.122 -40.131 1.00 0.00 C ATOM 0 H THR A 39 -1.874 0.625 -37.509 1.00 0.00 H new ATOM 0 HA THR A 39 -2.539 0.902 -40.336 1.00 0.00 H new ATOM 0 HB THR A 39 -0.063 0.014 -40.356 1.00 0.00 H new ATOM 0 HG1 THR A 39 1.040 0.828 -38.426 1.00 0.00 H new ATOM 0 HG21 THR A 39 0.805 2.323 -40.148 1.00 0.00 H new ATOM 0 HG22 THR A 39 -0.672 2.234 -41.136 1.00 0.00 H new ATOM 0 HG23 THR A 39 -0.756 2.828 -39.460 1.00 0.00 H new ATOM 426 N THR A 40 -2.233 -1.972 -38.857 1.00 0.00 N ATOM 427 CA THR A 40 -2.394 -3.413 -39.037 1.00 0.00 C ATOM 428 C THR A 40 -3.849 -3.784 -39.327 1.00 0.00 C ATOM 429 O THR A 40 -4.164 -4.950 -39.560 1.00 0.00 O ATOM 430 CB THR A 40 -1.897 -4.155 -37.798 1.00 0.00 C ATOM 431 OG1 THR A 40 -2.707 -3.857 -36.675 1.00 0.00 O ATOM 432 CG2 THR A 40 -0.469 -3.814 -37.439 1.00 0.00 C ATOM 0 H THR A 40 -2.182 -1.670 -37.884 1.00 0.00 H new ATOM 0 HA THR A 40 -1.797 -3.711 -39.899 1.00 0.00 H new ATOM 0 HB THR A 40 -1.952 -5.214 -38.050 1.00 0.00 H new ATOM 0 HG1 THR A 40 -3.202 -3.028 -36.840 1.00 0.00 H new ATOM 0 HG21 THR A 40 -0.174 -4.372 -36.551 1.00 0.00 H new ATOM 0 HG22 THR A 40 0.188 -4.078 -38.268 1.00 0.00 H new ATOM 0 HG23 THR A 40 -0.389 -2.745 -37.239 1.00 0.00 H new ATOM 440 N GLY A 41 -4.728 -2.784 -39.324 1.00 0.00 N ATOM 441 CA GLY A 41 -6.132 -3.029 -39.601 1.00 0.00 C ATOM 442 C GLY A 41 -6.793 -3.920 -38.568 1.00 0.00 C ATOM 443 O GLY A 41 -7.034 -5.100 -38.820 1.00 0.00 O ATOM 0 H GLY A 41 -4.492 -1.810 -39.135 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -6.660 -2.076 -39.642 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -6.228 -3.489 -40.584 1.00 0.00 H new ATOM 447 N GLN A 42 -7.091 -3.351 -37.404 1.00 0.00 N ATOM 448 CA GLN A 42 -7.734 -4.097 -36.327 1.00 0.00 C ATOM 449 C GLN A 42 -8.656 -3.193 -35.515 1.00 0.00 C ATOM 450 O GLN A 42 -9.779 -3.571 -35.182 1.00 0.00 O ATOM 451 CB GLN A 42 -6.681 -4.720 -35.410 1.00 0.00 C ATOM 452 CG GLN A 42 -5.772 -5.714 -36.114 1.00 0.00 C ATOM 453 CD GLN A 42 -5.449 -6.920 -35.253 1.00 0.00 C ATOM 454 OE1 GLN A 42 -6.220 -7.289 -34.367 1.00 0.00 O ATOM 455 NE2 GLN A 42 -4.304 -7.539 -35.510 1.00 0.00 N ATOM 0 H GLN A 42 -6.897 -2.374 -37.182 1.00 0.00 H new ATOM 0 HA GLN A 42 -8.332 -4.890 -36.776 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.072 -3.926 -34.978 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -7.183 -5.222 -34.583 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -6.249 -6.047 -37.036 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -4.845 -5.216 -36.397 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -3.696 -7.198 -36.254 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -4.032 -8.356 -34.963 1.00 0.00 H new ATOM 464 N ILE A 43 -8.169 -1.998 -35.193 1.00 0.00 N ATOM 465 CA ILE A 43 -8.939 -1.038 -34.413 1.00 0.00 C ATOM 466 C ILE A 43 -9.389 0.135 -35.285 1.00 0.00 C ATOM 467 O ILE A 43 -8.633 0.605 -36.136 1.00 0.00 O ATOM 468 CB ILE A 43 -8.122 -0.491 -33.221 1.00 0.00 C ATOM 469 CG1 ILE A 43 -7.179 -1.563 -32.662 1.00 0.00 C ATOM 470 CG2 ILE A 43 -9.052 0.012 -32.128 1.00 0.00 C ATOM 471 CD1 ILE A 43 -5.978 -0.993 -31.938 1.00 0.00 C ATOM 0 H ILE A 43 -7.241 -1.672 -35.462 1.00 0.00 H new ATOM 0 HA ILE A 43 -9.812 -1.567 -34.031 1.00 0.00 H new ATOM 0 HB ILE A 43 -7.517 0.341 -33.580 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -7.735 -2.204 -31.978 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -6.834 -2.194 -33.481 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.462 0.394 -31.295 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -9.680 0.810 -32.524 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -9.682 -0.807 -31.781 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -5.355 -1.808 -31.569 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.399 -0.375 -32.624 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -6.314 -0.385 -31.098 1.00 0.00 H new ATOM 483 N PRO A 44 -10.629 0.626 -35.091 1.00 0.00 N ATOM 484 CA PRO A 44 -11.157 1.745 -35.875 1.00 0.00 C ATOM 485 C PRO A 44 -10.548 3.080 -35.459 1.00 0.00 C ATOM 486 O PRO A 44 -10.236 3.294 -34.288 1.00 0.00 O ATOM 487 CB PRO A 44 -12.655 1.714 -35.574 1.00 0.00 C ATOM 488 CG PRO A 44 -12.764 1.087 -34.227 1.00 0.00 C ATOM 489 CD PRO A 44 -11.607 0.132 -34.103 1.00 0.00 C ATOM 0 HA PRO A 44 -10.924 1.649 -36.936 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -13.079 2.718 -35.578 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -13.196 1.136 -36.323 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -12.728 1.844 -33.443 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -13.713 0.562 -34.120 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -11.193 0.136 -33.095 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -11.910 -0.892 -34.319 1.00 0.00 H new ATOM 497 N ILE A 45 -10.375 3.969 -36.430 1.00 0.00 N ATOM 498 CA ILE A 45 -9.794 5.281 -36.172 1.00 0.00 C ATOM 499 C ILE A 45 -10.625 6.077 -35.169 1.00 0.00 C ATOM 500 O ILE A 45 -11.843 6.196 -35.308 1.00 0.00 O ATOM 501 CB ILE A 45 -9.651 6.093 -37.475 1.00 0.00 C ATOM 502 CG1 ILE A 45 -8.751 5.344 -38.456 1.00 0.00 C ATOM 503 CG2 ILE A 45 -9.089 7.479 -37.189 1.00 0.00 C ATOM 504 CD1 ILE A 45 -8.990 5.716 -39.903 1.00 0.00 C ATOM 0 H ILE A 45 -10.629 3.805 -37.404 1.00 0.00 H new ATOM 0 HA ILE A 45 -8.805 5.109 -35.747 1.00 0.00 H new ATOM 0 HB ILE A 45 -10.638 6.215 -37.921 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -7.709 5.544 -38.206 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.908 4.272 -38.334 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.997 8.034 -38.123 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.760 8.012 -36.515 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.108 7.385 -36.724 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -8.316 5.145 -40.542 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -10.022 5.490 -40.171 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -8.805 6.781 -40.040 1.00 0.00 H new ATOM 516 N ARG A 46 -9.952 6.627 -34.164 1.00 0.00 N ATOM 517 CA ARG A 46 -10.610 7.425 -33.135 1.00 0.00 C ATOM 518 C ARG A 46 -9.884 8.754 -32.955 1.00 0.00 C ATOM 519 O ARG A 46 -8.750 8.912 -33.405 1.00 0.00 O ATOM 520 CB ARG A 46 -10.648 6.664 -31.809 1.00 0.00 C ATOM 521 CG ARG A 46 -11.990 6.742 -31.099 1.00 0.00 C ATOM 522 CD ARG A 46 -12.338 5.426 -30.422 1.00 0.00 C ATOM 523 NE ARG A 46 -13.407 5.579 -29.440 1.00 0.00 N ATOM 524 CZ ARG A 46 -14.701 5.601 -29.747 1.00 0.00 C ATOM 525 NH1 ARG A 46 -15.093 5.489 -31.011 1.00 0.00 N ATOM 526 NH2 ARG A 46 -15.608 5.738 -28.789 1.00 0.00 N ATOM 0 H ARG A 46 -8.944 6.534 -34.040 1.00 0.00 H new ATOM 0 HA ARG A 46 -11.634 7.621 -33.453 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -10.405 5.618 -31.993 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -9.875 7.060 -31.151 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -11.964 7.539 -30.356 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -12.768 7.000 -31.817 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -12.641 4.700 -31.176 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -11.451 5.025 -29.932 1.00 0.00 H new ATOM 0 HE ARG A 46 -13.146 5.675 -28.459 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -14.400 5.385 -31.753 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -16.087 5.507 -31.240 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -15.313 5.827 -27.817 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -16.600 5.755 -29.025 1.00 0.00 H new ATOM 540 N ASP A 47 -10.537 9.708 -32.301 1.00 0.00 N ATOM 541 CA ASP A 47 -9.933 11.017 -32.079 1.00 0.00 C ATOM 542 C ASP A 47 -9.758 11.315 -30.593 1.00 0.00 C ATOM 543 O ASP A 47 -10.731 11.389 -29.843 1.00 0.00 O ATOM 544 CB ASP A 47 -10.780 12.116 -32.727 1.00 0.00 C ATOM 545 CG ASP A 47 -11.038 11.855 -34.199 1.00 0.00 C ATOM 546 OD1 ASP A 47 -11.929 11.036 -34.509 1.00 0.00 O ATOM 547 OD2 ASP A 47 -10.350 12.469 -35.042 1.00 0.00 O ATOM 0 H ASP A 47 -11.476 9.602 -31.918 1.00 0.00 H new ATOM 0 HA ASP A 47 -8.946 10.999 -32.541 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -11.732 12.194 -32.202 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -10.274 13.075 -32.614 1.00 0.00 H new ATOM 552 N LEU A 48 -8.510 11.518 -30.187 1.00 0.00 N ATOM 553 CA LEU A 48 -8.191 11.849 -28.803 1.00 0.00 C ATOM 554 C LEU A 48 -8.307 13.355 -28.618 1.00 0.00 C ATOM 555 O LEU A 48 -7.813 14.116 -29.448 1.00 0.00 O ATOM 556 CB LEU A 48 -6.767 11.388 -28.458 1.00 0.00 C ATOM 557 CG LEU A 48 -6.649 9.992 -27.839 1.00 0.00 C ATOM 558 CD1 LEU A 48 -7.590 9.009 -28.516 1.00 0.00 C ATOM 559 CD2 LEU A 48 -5.213 9.495 -27.923 1.00 0.00 C ATOM 0 H LEU A 48 -7.698 11.459 -30.801 1.00 0.00 H new ATOM 0 HA LEU A 48 -8.888 11.339 -28.138 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -6.167 11.413 -29.368 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -6.329 12.109 -27.767 1.00 0.00 H new ATOM 0 HG LEU A 48 -6.936 10.064 -26.790 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -7.483 8.027 -28.055 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -8.618 9.353 -28.403 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -7.344 8.941 -29.576 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -5.145 8.502 -27.479 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -4.905 9.447 -28.967 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -4.559 10.179 -27.383 1.00 0.00 H new ATOM 571 N SER A 49 -8.968 13.799 -27.552 1.00 0.00 N ATOM 572 CA SER A 49 -9.126 15.228 -27.331 1.00 0.00 C ATOM 573 C SER A 49 -8.974 15.639 -25.886 1.00 0.00 C ATOM 574 O SER A 49 -9.196 14.868 -24.956 1.00 0.00 O ATOM 575 CB SER A 49 -10.472 15.720 -27.818 1.00 0.00 C ATOM 576 OG SER A 49 -11.250 14.670 -28.365 1.00 0.00 O ATOM 0 H SER A 49 -9.394 13.202 -26.843 1.00 0.00 H new ATOM 0 HA SER A 49 -8.319 15.685 -27.904 1.00 0.00 H new ATOM 0 HB2 SER A 49 -11.012 16.179 -26.990 1.00 0.00 H new ATOM 0 HB3 SER A 49 -10.325 16.494 -28.571 1.00 0.00 H new ATOM 0 HG SER A 49 -12.112 15.025 -28.667 1.00 0.00 H new ATOM 582 N ALA A 50 -8.630 16.896 -25.736 1.00 0.00 N ATOM 583 CA ALA A 50 -8.459 17.507 -24.421 1.00 0.00 C ATOM 584 C ALA A 50 -8.875 18.973 -24.447 1.00 0.00 C ATOM 585 O ALA A 50 -8.627 19.680 -25.424 1.00 0.00 O ATOM 586 CB ALA A 50 -7.017 17.370 -23.955 1.00 0.00 C ATOM 0 H ALA A 50 -8.459 17.531 -26.516 1.00 0.00 H new ATOM 0 HA ALA A 50 -9.103 16.983 -23.715 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.907 17.831 -22.973 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.754 16.314 -23.892 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -6.356 17.867 -24.665 1.00 0.00 H new ATOM 821 N LYS A 64 -4.699 15.545 -19.173 1.00 0.00 N ATOM 822 CA LYS A 64 -5.576 14.441 -19.552 1.00 0.00 C ATOM 823 C LYS A 64 -4.793 13.285 -20.159 1.00 0.00 C ATOM 824 O LYS A 64 -3.877 13.493 -20.954 1.00 0.00 O ATOM 825 CB LYS A 64 -6.632 14.918 -20.538 1.00 0.00 C ATOM 826 CG LYS A 64 -7.946 14.184 -20.379 1.00 0.00 C ATOM 827 CD LYS A 64 -9.115 15.043 -20.801 1.00 0.00 C ATOM 828 CE LYS A 64 -9.450 14.786 -22.248 1.00 0.00 C ATOM 829 NZ LYS A 64 -10.717 15.449 -22.660 1.00 0.00 N ATOM 0 HA LYS A 64 -6.061 14.083 -18.644 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -6.797 15.987 -20.400 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -6.264 14.781 -21.555 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -7.929 13.272 -20.976 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -8.072 13.882 -19.339 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -9.981 14.826 -20.175 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -8.873 16.096 -20.657 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -8.634 15.143 -22.877 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -9.534 13.712 -22.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -10.718 15.586 -23.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -11.525 14.853 -22.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -10.795 16.373 -22.188 1.00 0.00 H new ATOM 843 N VAL A 65 -5.158 12.063 -19.777 1.00 0.00 N ATOM 844 CA VAL A 65 -4.489 10.880 -20.284 1.00 0.00 C ATOM 845 C VAL A 65 -5.483 9.818 -20.742 1.00 0.00 C ATOM 846 O VAL A 65 -6.501 9.574 -20.095 1.00 0.00 O ATOM 847 CB VAL A 65 -3.590 10.256 -19.218 1.00 0.00 C ATOM 848 CG1 VAL A 65 -2.712 9.168 -19.818 1.00 0.00 C ATOM 849 CG2 VAL A 65 -2.749 11.317 -18.525 1.00 0.00 C ATOM 0 H VAL A 65 -5.913 11.872 -19.118 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.892 11.209 -21.134 1.00 0.00 H new ATOM 0 HB VAL A 65 -4.230 9.794 -18.466 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -2.081 8.739 -19.039 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.341 8.388 -20.246 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.084 9.597 -20.599 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -2.118 10.846 -17.771 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -2.121 11.821 -19.260 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -3.404 12.045 -18.047 1.00 0.00 H new ATOM 859 N TRP A 66 -5.162 9.193 -21.860 1.00 0.00 N ATOM 860 CA TRP A 66 -6.000 8.138 -22.438 1.00 0.00 C ATOM 861 C TRP A 66 -5.467 6.746 -22.138 1.00 0.00 C ATOM 862 O TRP A 66 -4.266 6.507 -22.220 1.00 0.00 O ATOM 863 CB TRP A 66 -6.080 8.266 -23.947 1.00 0.00 C ATOM 864 CG TRP A 66 -6.901 9.410 -24.408 1.00 0.00 C ATOM 865 CD1 TRP A 66 -8.178 9.428 -24.896 1.00 0.00 C ATOM 866 CD2 TRP A 66 -6.446 10.723 -24.416 1.00 0.00 C ATOM 867 NE1 TRP A 66 -8.523 10.726 -25.216 1.00 0.00 N ATOM 868 CE2 TRP A 66 -7.457 11.540 -24.921 1.00 0.00 C ATOM 869 CE3 TRP A 66 -5.253 11.263 -24.033 1.00 0.00 C ATOM 870 CZ2 TRP A 66 -7.287 12.909 -25.052 1.00 0.00 C ATOM 871 CZ3 TRP A 66 -5.066 12.614 -24.151 1.00 0.00 C ATOM 872 CH2 TRP A 66 -6.082 13.436 -24.661 1.00 0.00 C ATOM 0 H TRP A 66 -4.319 9.395 -22.397 1.00 0.00 H new ATOM 0 HA TRP A 66 -6.982 8.264 -21.982 1.00 0.00 H new ATOM 0 HB2 TRP A 66 -5.072 8.370 -24.347 1.00 0.00 H new ATOM 0 HB3 TRP A 66 -6.493 7.345 -24.359 1.00 0.00 H new ATOM 0 HD1 TRP A 66 -8.816 8.564 -25.013 1.00 0.00 H new ATOM 0 HE1 TRP A 66 -9.416 11.028 -25.605 1.00 0.00 H new ATOM 0 HE3 TRP A 66 -4.467 10.633 -23.642 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 -8.072 13.537 -25.446 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 -4.126 13.052 -23.848 1.00 0.00 H new ATOM 0 HH2 TRP A 66 -5.913 14.499 -24.747 1.00 0.00 H new ATOM 883 N THR A 67 -6.372 5.819 -21.849 1.00 0.00 N ATOM 884 CA THR A 67 -5.990 4.433 -21.607 1.00 0.00 C ATOM 885 C THR A 67 -6.456 3.569 -22.776 1.00 0.00 C ATOM 886 O THR A 67 -7.633 3.572 -23.136 1.00 0.00 O ATOM 887 CB THR A 67 -6.576 3.912 -20.298 1.00 0.00 C ATOM 888 OG1 THR A 67 -7.052 4.978 -19.496 1.00 0.00 O ATOM 889 CG2 THR A 67 -5.578 3.121 -19.474 1.00 0.00 C ATOM 0 H THR A 67 -7.373 6.001 -21.777 1.00 0.00 H new ATOM 0 HA THR A 67 -4.904 4.384 -21.523 1.00 0.00 H new ATOM 0 HB THR A 67 -7.392 3.250 -20.589 1.00 0.00 H new ATOM 0 HG1 THR A 67 -7.847 5.371 -19.913 1.00 0.00 H new ATOM 0 HG21 THR A 67 -6.055 2.778 -18.556 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.234 2.260 -20.047 1.00 0.00 H new ATOM 0 HG23 THR A 67 -4.727 3.755 -19.226 1.00 0.00 H new ATOM 897 N PHE A 68 -5.518 2.848 -23.372 1.00 0.00 N ATOM 898 CA PHE A 68 -5.807 1.987 -24.518 1.00 0.00 C ATOM 899 C PHE A 68 -5.644 0.518 -24.153 1.00 0.00 C ATOM 900 O PHE A 68 -4.773 0.162 -23.360 1.00 0.00 O ATOM 901 CB PHE A 68 -4.863 2.309 -25.683 1.00 0.00 C ATOM 902 CG PHE A 68 -5.176 3.574 -26.436 1.00 0.00 C ATOM 903 CD1 PHE A 68 -5.476 4.751 -25.768 1.00 0.00 C ATOM 904 CD2 PHE A 68 -5.147 3.586 -27.822 1.00 0.00 C ATOM 905 CE1 PHE A 68 -5.744 5.911 -26.471 1.00 0.00 C ATOM 906 CE2 PHE A 68 -5.416 4.743 -28.527 1.00 0.00 C ATOM 907 CZ PHE A 68 -5.715 5.906 -27.850 1.00 0.00 C ATOM 0 H PHE A 68 -4.541 2.840 -23.080 1.00 0.00 H new ATOM 0 HA PHE A 68 -6.839 2.173 -24.814 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -3.846 2.379 -25.296 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -4.881 1.475 -26.384 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -5.501 4.762 -24.688 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -4.911 2.678 -28.358 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -5.976 6.822 -25.940 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.392 4.736 -29.607 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.926 6.812 -28.399 1.00 0.00 H new ATOM 917 N GLY A 69 -6.475 -0.335 -24.745 1.00 0.00 N ATOM 918 CA GLY A 69 -6.387 -1.755 -24.473 1.00 0.00 C ATOM 919 C GLY A 69 -7.635 -2.515 -24.886 1.00 0.00 C ATOM 920 O GLY A 69 -8.505 -1.973 -25.569 1.00 0.00 O ATOM 0 H GLY A 69 -7.205 -0.068 -25.406 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -5.526 -2.168 -24.999 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.212 -1.905 -23.408 1.00 0.00 H new ATOM 924 N ARG A 70 -7.719 -3.779 -24.477 1.00 0.00 N ATOM 925 CA ARG A 70 -8.862 -4.626 -24.814 1.00 0.00 C ATOM 926 C ARG A 70 -10.020 -4.436 -23.835 1.00 0.00 C ATOM 927 O ARG A 70 -10.984 -5.201 -23.853 1.00 0.00 O ATOM 928 CB ARG A 70 -8.443 -6.098 -24.828 1.00 0.00 C ATOM 929 CG ARG A 70 -7.107 -6.348 -25.508 1.00 0.00 C ATOM 930 CD ARG A 70 -6.438 -7.604 -24.972 1.00 0.00 C ATOM 931 NE ARG A 70 -7.374 -8.721 -24.857 1.00 0.00 N ATOM 932 CZ ARG A 70 -7.183 -9.771 -24.061 1.00 0.00 C ATOM 933 NH1 ARG A 70 -6.091 -9.855 -23.309 1.00 0.00 N ATOM 934 NH2 ARG A 70 -8.085 -10.741 -24.017 1.00 0.00 N ATOM 0 H ARG A 70 -7.008 -4.241 -23.910 1.00 0.00 H new ATOM 0 HA ARG A 70 -9.205 -4.329 -25.805 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -8.392 -6.461 -23.802 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -9.213 -6.681 -25.334 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -7.257 -6.444 -26.583 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -6.452 -5.491 -25.353 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -5.617 -7.886 -25.631 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -6.004 -7.394 -23.995 1.00 0.00 H new ATOM 0 HE ARG A 70 -8.224 -8.694 -25.420 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -5.393 -9.112 -23.339 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -5.951 -10.662 -22.701 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -8.925 -10.683 -24.593 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -7.939 -11.546 -23.407 1.00 0.00 H new ATOM 948 N ASN A 71 -9.926 -3.423 -22.981 1.00 0.00 N ATOM 949 CA ASN A 71 -10.974 -3.156 -22.002 1.00 0.00 C ATOM 950 C ASN A 71 -11.976 -2.132 -22.533 1.00 0.00 C ATOM 951 O ASN A 71 -11.586 -1.103 -23.085 1.00 0.00 O ATOM 952 CB ASN A 71 -10.361 -2.653 -20.694 1.00 0.00 C ATOM 953 CG ASN A 71 -11.353 -2.666 -19.548 1.00 0.00 C ATOM 954 OD1 ASN A 71 -11.978 -3.814 -19.320 1.00 0.00 O flip ATOM 955 ND2 ASN A 71 -11.555 -1.655 -18.876 1.00 0.00 N flip ATOM 0 H ASN A 71 -9.139 -2.776 -22.946 1.00 0.00 H new ATOM 0 HA ASN A 71 -11.504 -4.090 -21.815 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -9.503 -3.274 -20.436 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -9.989 -1.639 -20.837 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -11.052 -0.793 -19.087 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -12.226 -1.679 -18.108 1.00 0.00 H new ATOM 962 N PRO A 72 -13.285 -2.390 -22.361 1.00 0.00 N ATOM 963 CA PRO A 72 -14.335 -1.473 -22.814 1.00 0.00 C ATOM 964 C PRO A 72 -14.323 -0.169 -22.023 1.00 0.00 C ATOM 965 O PRO A 72 -14.976 0.804 -22.399 1.00 0.00 O ATOM 966 CB PRO A 72 -15.641 -2.241 -22.552 1.00 0.00 C ATOM 967 CG PRO A 72 -15.234 -3.648 -22.272 1.00 0.00 C ATOM 968 CD PRO A 72 -13.845 -3.577 -21.705 1.00 0.00 C ATOM 0 HA PRO A 72 -14.204 -1.190 -23.859 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -16.183 -1.815 -21.708 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -16.305 -2.190 -23.415 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -15.919 -4.118 -21.567 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.253 -4.247 -23.182 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -13.856 -3.472 -20.620 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.269 -4.474 -21.932 1.00 0.00 H new ATOM 976 N ALA A 73 -13.554 -0.153 -20.936 1.00 0.00 N ATOM 977 CA ALA A 73 -13.428 1.025 -20.105 1.00 0.00 C ATOM 978 C ALA A 73 -12.403 1.939 -20.706 1.00 0.00 C ATOM 979 O ALA A 73 -12.580 3.155 -20.780 1.00 0.00 O ATOM 980 CB ALA A 73 -13.013 0.656 -18.695 1.00 0.00 C ATOM 0 H ALA A 73 -13.008 -0.953 -20.615 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.396 1.523 -20.055 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.926 1.560 -18.093 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.763 -0.002 -18.255 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -12.051 0.144 -18.721 1.00 0.00 H new ATOM 986 N CYS A 74 -11.323 1.314 -21.146 1.00 0.00 N ATOM 987 CA CYS A 74 -10.230 2.005 -21.761 1.00 0.00 C ATOM 988 C CYS A 74 -10.732 3.057 -22.722 1.00 0.00 C ATOM 989 O CYS A 74 -11.661 2.824 -23.495 1.00 0.00 O ATOM 990 CB CYS A 74 -9.366 1.009 -22.500 1.00 0.00 C ATOM 991 SG CYS A 74 -7.701 0.819 -21.830 1.00 0.00 S ATOM 0 H CYS A 74 -11.191 0.305 -21.080 1.00 0.00 H new ATOM 0 HA CYS A 74 -9.646 2.501 -20.986 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -9.862 0.038 -22.488 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -9.291 1.316 -23.543 1.00 0.00 H new ATOM 0 HG CYS A 74 -7.699 1.148 -20.572 1.00 0.00 H new ATOM 997 N ASP A 75 -10.099 4.205 -22.683 1.00 0.00 N ATOM 998 CA ASP A 75 -10.467 5.293 -23.569 1.00 0.00 C ATOM 999 C ASP A 75 -10.389 4.829 -25.025 1.00 0.00 C ATOM 1000 O ASP A 75 -10.978 5.445 -25.913 1.00 0.00 O ATOM 1001 CB ASP A 75 -9.551 6.497 -23.349 1.00 0.00 C ATOM 1002 CG ASP A 75 -9.615 7.019 -21.927 1.00 0.00 C ATOM 1003 OD1 ASP A 75 -9.383 6.224 -20.991 1.00 0.00 O ATOM 1004 OD2 ASP A 75 -9.899 8.222 -21.748 1.00 0.00 O ATOM 0 H ASP A 75 -9.327 4.414 -22.050 1.00 0.00 H new ATOM 0 HA ASP A 75 -11.491 5.594 -23.346 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -8.524 6.217 -23.585 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -9.830 7.294 -24.039 1.00 0.00 H new ATOM 1009 N TYR A 76 -9.666 3.728 -25.263 1.00 0.00 N ATOM 1010 CA TYR A 76 -9.529 3.183 -26.607 1.00 0.00 C ATOM 1011 C TYR A 76 -9.852 1.693 -26.627 1.00 0.00 C ATOM 1012 O TYR A 76 -9.202 0.901 -25.945 1.00 0.00 O ATOM 1013 CB TYR A 76 -8.116 3.415 -27.135 1.00 0.00 C ATOM 1014 CG TYR A 76 -8.034 3.489 -28.643 1.00 0.00 C ATOM 1015 CD1 TYR A 76 -8.330 4.667 -29.317 1.00 0.00 C ATOM 1016 CD2 TYR A 76 -7.656 2.382 -29.392 1.00 0.00 C ATOM 1017 CE1 TYR A 76 -8.250 4.740 -30.694 1.00 0.00 C ATOM 1018 CE2 TYR A 76 -7.573 2.448 -30.771 1.00 0.00 C ATOM 1019 CZ TYR A 76 -7.872 3.629 -31.416 1.00 0.00 C ATOM 1020 OH TYR A 76 -7.791 3.697 -32.788 1.00 0.00 O ATOM 0 H TYR A 76 -9.171 3.203 -24.542 1.00 0.00 H new ATOM 0 HA TYR A 76 -10.239 3.700 -27.253 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -7.728 4.342 -26.713 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -7.470 2.610 -26.784 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -8.628 5.540 -28.755 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -7.423 1.455 -28.889 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -8.483 5.664 -31.203 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -7.276 1.579 -31.339 1.00 0.00 H new ATOM 0 HH TYR A 76 -8.681 3.560 -33.175 1.00 0.00 H new ATOM 1030 N HIS A 77 -10.853 1.315 -27.414 1.00 0.00 N ATOM 1031 CA HIS A 77 -11.251 -0.084 -27.522 1.00 0.00 C ATOM 1032 C HIS A 77 -10.612 -0.731 -28.746 1.00 0.00 C ATOM 1033 O HIS A 77 -10.994 -0.444 -29.881 1.00 0.00 O ATOM 1034 CB HIS A 77 -12.775 -0.201 -27.600 1.00 0.00 C ATOM 1035 CG HIS A 77 -13.319 -1.409 -26.905 1.00 0.00 C ATOM 1036 ND1 HIS A 77 -14.527 -1.987 -27.235 1.00 0.00 N ATOM 1037 CD2 HIS A 77 -12.813 -2.153 -25.893 1.00 0.00 C ATOM 1038 CE1 HIS A 77 -14.741 -3.033 -26.455 1.00 0.00 C ATOM 1039 NE2 HIS A 77 -13.716 -3.155 -25.633 1.00 0.00 N ATOM 0 H HIS A 77 -11.403 1.956 -27.986 1.00 0.00 H new ATOM 0 HA HIS A 77 -10.904 -0.608 -26.631 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -13.222 0.692 -27.163 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -13.076 -0.228 -28.647 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -11.874 -1.989 -25.385 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -15.607 -3.678 -26.485 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -13.611 -3.877 -24.920 1.00 0.00 H new ATOM 1088 N ILE A 81 -6.559 -9.108 -27.827 1.00 0.00 N ATOM 1089 CA ILE A 81 -5.388 -9.952 -28.041 1.00 0.00 C ATOM 1090 C ILE A 81 -4.837 -10.475 -26.716 1.00 0.00 C ATOM 1091 O ILE A 81 -4.561 -9.703 -25.799 1.00 0.00 O ATOM 1092 CB ILE A 81 -4.274 -9.190 -28.782 1.00 0.00 C ATOM 1093 CG1 ILE A 81 -4.843 -8.467 -30.003 1.00 0.00 C ATOM 1094 CG2 ILE A 81 -3.164 -10.145 -29.196 1.00 0.00 C ATOM 1095 CD1 ILE A 81 -5.480 -9.396 -31.015 1.00 0.00 C ATOM 0 HA ILE A 81 -5.712 -10.793 -28.654 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.854 -8.445 -28.106 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -5.585 -7.741 -29.672 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.044 -7.907 -30.489 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -2.384 -9.591 -29.719 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -2.741 -10.618 -28.309 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -3.570 -10.911 -29.857 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -5.862 -8.814 -31.854 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.736 -10.107 -31.375 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -6.301 -9.937 -30.546 1.00 0.00 H new ATOM 1107 N SER A 82 -4.678 -11.790 -26.623 1.00 0.00 N ATOM 1108 CA SER A 82 -4.162 -12.413 -25.408 1.00 0.00 C ATOM 1109 C SER A 82 -2.818 -11.810 -25.010 1.00 0.00 C ATOM 1110 O SER A 82 -2.492 -11.726 -23.826 1.00 0.00 O ATOM 1111 CB SER A 82 -4.018 -13.924 -25.608 1.00 0.00 C ATOM 1112 OG SER A 82 -3.992 -14.257 -26.985 1.00 0.00 O ATOM 0 H SER A 82 -4.898 -12.446 -27.373 1.00 0.00 H new ATOM 0 HA SER A 82 -4.873 -12.224 -24.604 1.00 0.00 H new ATOM 0 HB2 SER A 82 -3.102 -14.271 -25.129 1.00 0.00 H new ATOM 0 HB3 SER A 82 -4.847 -14.439 -25.122 1.00 0.00 H new ATOM 0 HG SER A 82 -3.898 -15.227 -27.085 1.00 0.00 H new ATOM 1118 N ARG A 83 -2.042 -11.390 -26.004 1.00 0.00 N ATOM 1119 CA ARG A 83 -0.736 -10.794 -25.753 1.00 0.00 C ATOM 1120 C ARG A 83 -0.874 -9.377 -25.200 1.00 0.00 C ATOM 1121 O ARG A 83 0.048 -8.857 -24.571 1.00 0.00 O ATOM 1122 CB ARG A 83 0.092 -10.775 -27.039 1.00 0.00 C ATOM 1123 CG ARG A 83 0.774 -12.099 -27.341 1.00 0.00 C ATOM 1124 CD ARG A 83 2.071 -11.897 -28.108 1.00 0.00 C ATOM 1125 NE ARG A 83 2.965 -13.046 -27.988 1.00 0.00 N ATOM 1126 CZ ARG A 83 3.743 -13.273 -26.933 1.00 0.00 C ATOM 1127 NH1 ARG A 83 3.744 -12.433 -25.904 1.00 0.00 N ATOM 1128 NH2 ARG A 83 4.525 -14.343 -26.906 1.00 0.00 N ATOM 0 H ARG A 83 -2.295 -11.452 -26.990 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.226 -11.403 -25.007 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -0.556 -10.510 -27.875 1.00 0.00 H new ATOM 0 HB3 ARG A 83 0.849 -9.995 -26.963 1.00 0.00 H new ATOM 0 HG2 ARG A 83 0.980 -12.624 -26.408 1.00 0.00 H new ATOM 0 HG3 ARG A 83 0.102 -12.731 -27.921 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.846 -11.722 -29.160 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.576 -11.005 -27.737 1.00 0.00 H new ATOM 0 HE ARG A 83 2.994 -13.714 -28.759 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.145 -11.607 -25.919 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.343 -12.614 -25.099 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.530 -14.991 -27.694 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.122 -14.518 -26.098 1.00 0.00 H new ATOM 1142 N LEU A 84 -2.024 -8.753 -25.439 1.00 0.00 N ATOM 1143 CA LEU A 84 -2.268 -7.395 -24.962 1.00 0.00 C ATOM 1144 C LEU A 84 -3.094 -7.406 -23.679 1.00 0.00 C ATOM 1145 O LEU A 84 -3.870 -8.331 -23.437 1.00 0.00 O ATOM 1146 CB LEU A 84 -2.977 -6.570 -26.035 1.00 0.00 C ATOM 1147 CG LEU A 84 -2.326 -6.606 -27.417 1.00 0.00 C ATOM 1148 CD1 LEU A 84 -3.266 -6.030 -28.464 1.00 0.00 C ATOM 1149 CD2 LEU A 84 -1.008 -5.845 -27.404 1.00 0.00 C ATOM 0 H LEU A 84 -2.799 -9.164 -25.958 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.303 -6.937 -24.745 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.004 -6.925 -26.125 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.026 -5.534 -25.701 1.00 0.00 H new ATOM 0 HG LEU A 84 -2.121 -7.645 -27.675 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.786 -6.064 -29.442 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.184 -6.616 -28.490 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.503 -4.996 -28.211 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.558 -5.881 -28.396 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.190 -4.807 -27.125 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.331 -6.302 -26.682 1.00 0.00 H new ATOM 1161 N SER A 85 -2.917 -6.375 -22.854 1.00 0.00 N ATOM 1162 CA SER A 85 -3.645 -6.281 -21.588 1.00 0.00 C ATOM 1163 C SER A 85 -4.878 -5.384 -21.706 1.00 0.00 C ATOM 1164 O SER A 85 -5.011 -4.623 -22.665 1.00 0.00 O ATOM 1165 CB SER A 85 -2.720 -5.748 -20.492 1.00 0.00 C ATOM 1166 OG SER A 85 -1.370 -6.090 -20.754 1.00 0.00 O ATOM 0 H SER A 85 -2.281 -5.598 -23.037 1.00 0.00 H new ATOM 0 HA SER A 85 -3.986 -7.283 -21.328 1.00 0.00 H new ATOM 0 HB2 SER A 85 -2.818 -4.664 -20.424 1.00 0.00 H new ATOM 0 HB3 SER A 85 -3.021 -6.156 -19.527 1.00 0.00 H new ATOM 0 HG SER A 85 -1.022 -5.522 -21.473 1.00 0.00 H new ATOM 1172 N ASN A 86 -5.773 -5.471 -20.711 1.00 0.00 N ATOM 1173 CA ASN A 86 -6.994 -4.656 -20.685 1.00 0.00 C ATOM 1174 C ASN A 86 -6.670 -3.228 -21.094 1.00 0.00 C ATOM 1175 O ASN A 86 -7.255 -2.679 -22.024 1.00 0.00 O ATOM 1176 CB ASN A 86 -7.605 -4.666 -19.283 1.00 0.00 C ATOM 1177 CG ASN A 86 -8.865 -5.504 -19.202 1.00 0.00 C ATOM 1178 OD1 ASN A 86 -9.853 -5.102 -18.589 1.00 0.00 O ATOM 1179 ND2 ASN A 86 -8.837 -6.678 -19.823 1.00 0.00 N ATOM 0 H ASN A 86 -5.673 -6.099 -19.913 1.00 0.00 H new ATOM 0 HA ASN A 86 -7.713 -5.077 -21.387 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -6.872 -5.050 -18.574 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -7.833 -3.643 -18.983 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -9.656 -7.285 -19.803 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -7.996 -6.972 -20.320 1.00 0.00 H new ATOM 1186 N LYS A 87 -5.689 -2.664 -20.403 1.00 0.00 N ATOM 1187 CA LYS A 87 -5.193 -1.326 -20.680 1.00 0.00 C ATOM 1188 C LYS A 87 -3.733 -1.465 -21.065 1.00 0.00 C ATOM 1189 O LYS A 87 -2.838 -1.340 -20.233 1.00 0.00 O ATOM 1190 CB LYS A 87 -5.352 -0.417 -19.458 1.00 0.00 C ATOM 1191 CG LYS A 87 -6.714 -0.532 -18.788 1.00 0.00 C ATOM 1192 CD LYS A 87 -6.628 -1.283 -17.469 1.00 0.00 C ATOM 1193 CE LYS A 87 -7.520 -0.651 -16.412 1.00 0.00 C ATOM 1194 NZ LYS A 87 -8.958 -0.701 -16.794 1.00 0.00 N ATOM 0 H LYS A 87 -5.212 -3.127 -19.629 1.00 0.00 H new ATOM 0 HA LYS A 87 -5.762 -0.866 -21.488 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -4.577 -0.660 -18.731 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.191 0.618 -19.761 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.120 0.465 -18.614 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.406 -1.046 -19.455 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -6.921 -2.322 -17.620 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.596 -1.290 -17.119 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.379 -1.167 -15.462 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -7.221 0.386 -16.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -9.538 -0.337 -16.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -9.113 -0.116 -17.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -9.229 -1.684 -16.998 1.00 0.00 H new ATOM 1208 N HIS A 88 -3.518 -1.792 -22.330 1.00 0.00 N ATOM 1209 CA HIS A 88 -2.187 -2.032 -22.843 1.00 0.00 C ATOM 1210 C HIS A 88 -1.288 -0.814 -22.746 1.00 0.00 C ATOM 1211 O HIS A 88 -0.131 -0.920 -22.347 1.00 0.00 O ATOM 1212 CB HIS A 88 -2.247 -2.491 -24.291 1.00 0.00 C ATOM 1213 CG HIS A 88 -0.958 -3.089 -24.715 1.00 0.00 C ATOM 1214 ND1 HIS A 88 -0.750 -4.442 -24.754 1.00 0.00 N ATOM 1215 CD2 HIS A 88 0.223 -2.513 -25.015 1.00 0.00 C ATOM 1216 CE1 HIS A 88 0.507 -4.681 -25.047 1.00 0.00 C ATOM 1217 NE2 HIS A 88 1.129 -3.521 -25.213 1.00 0.00 N ATOM 0 H HIS A 88 -4.259 -1.897 -23.023 1.00 0.00 H new ATOM 0 HA HIS A 88 -1.757 -2.814 -22.217 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -3.047 -3.221 -24.411 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -2.488 -1.645 -24.934 1.00 0.00 H new ATOM 0 HD2 HIS A 88 0.419 -1.453 -25.086 1.00 0.00 H new ATOM 0 HE1 HIS A 88 0.959 -5.658 -25.138 1.00 0.00 H new ATOM 0 HE2 HIS A 88 2.114 -3.400 -25.448 1.00 0.00 H new ATOM 1226 N PHE A 89 -1.808 0.338 -23.122 1.00 0.00 N ATOM 1227 CA PHE A 89 -1.002 1.559 -23.076 1.00 0.00 C ATOM 1228 C PHE A 89 -1.838 2.793 -22.743 1.00 0.00 C ATOM 1229 O PHE A 89 -3.064 2.762 -22.820 1.00 0.00 O ATOM 1230 CB PHE A 89 -0.245 1.766 -24.390 1.00 0.00 C ATOM 1231 CG PHE A 89 -1.106 1.715 -25.618 1.00 0.00 C ATOM 1232 CD1 PHE A 89 -1.488 0.499 -26.161 1.00 0.00 C ATOM 1233 CD2 PHE A 89 -1.523 2.882 -26.237 1.00 0.00 C ATOM 1234 CE1 PHE A 89 -2.273 0.449 -27.299 1.00 0.00 C ATOM 1235 CE2 PHE A 89 -2.307 2.838 -27.374 1.00 0.00 C ATOM 1236 CZ PHE A 89 -2.681 1.619 -27.905 1.00 0.00 C ATOM 0 H PHE A 89 -2.763 0.462 -23.457 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.279 1.428 -22.271 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.260 2.731 -24.356 1.00 0.00 H new ATOM 0 HB3 PHE A 89 0.530 1.004 -24.473 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.170 -0.420 -25.691 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.232 3.837 -25.826 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.566 -0.505 -27.712 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.627 3.755 -27.847 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.293 1.582 -28.794 1.00 0.00 H new ATOM 1246 N GLN A 90 -1.159 3.876 -22.360 1.00 0.00 N ATOM 1247 CA GLN A 90 -1.831 5.119 -21.998 1.00 0.00 C ATOM 1248 C GLN A 90 -1.136 6.328 -22.617 1.00 0.00 C ATOM 1249 O GLN A 90 0.089 6.390 -22.654 1.00 0.00 O ATOM 1250 CB GLN A 90 -1.839 5.281 -20.474 1.00 0.00 C ATOM 1251 CG GLN A 90 -3.149 4.897 -19.818 1.00 0.00 C ATOM 1252 CD GLN A 90 -3.171 5.220 -18.337 1.00 0.00 C ATOM 1253 OE1 GLN A 90 -2.913 4.358 -17.497 1.00 0.00 O ATOM 1254 NE2 GLN A 90 -3.479 6.469 -18.009 1.00 0.00 N ATOM 0 H GLN A 90 -0.142 3.914 -22.293 1.00 0.00 H new ATOM 0 HA GLN A 90 -2.851 5.068 -22.379 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -1.041 4.672 -20.050 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -1.613 6.319 -20.228 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -3.967 5.420 -20.313 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -3.323 3.830 -19.957 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -3.686 7.152 -18.738 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -3.509 6.746 -17.028 1.00 0.00 H new ATOM 1263 N ILE A 91 -1.915 7.303 -23.078 1.00 0.00 N ATOM 1264 CA ILE A 91 -1.336 8.510 -23.655 1.00 0.00 C ATOM 1265 C ILE A 91 -1.703 9.727 -22.816 1.00 0.00 C ATOM 1266 O ILE A 91 -2.857 9.897 -22.446 1.00 0.00 O ATOM 1267 CB ILE A 91 -1.800 8.738 -25.100 1.00 0.00 C ATOM 1268 CG1 ILE A 91 -1.590 7.474 -25.938 1.00 0.00 C ATOM 1269 CG2 ILE A 91 -1.046 9.913 -25.699 1.00 0.00 C ATOM 1270 CD1 ILE A 91 -2.876 6.761 -26.291 1.00 0.00 C ATOM 0 H ILE A 91 -2.935 7.282 -23.064 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.255 8.372 -23.661 1.00 0.00 H new ATOM 0 HB ILE A 91 -2.866 8.967 -25.100 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -1.068 7.740 -26.857 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.943 6.789 -25.391 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -1.377 10.073 -26.725 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -1.242 10.809 -25.111 1.00 0.00 H new ATOM 0 HG23 ILE A 91 0.023 9.701 -25.692 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -2.650 5.875 -26.885 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -3.390 6.463 -25.377 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -3.517 7.430 -26.866 1.00 0.00 H new ATOM 1282 N LEU A 92 -0.724 10.568 -22.499 1.00 0.00 N ATOM 1283 CA LEU A 92 -0.983 11.749 -21.686 1.00 0.00 C ATOM 1284 C LEU A 92 -0.681 13.034 -22.447 1.00 0.00 C ATOM 1285 O LEU A 92 0.224 13.080 -23.279 1.00 0.00 O ATOM 1286 CB LEU A 92 -0.150 11.692 -20.406 1.00 0.00 C ATOM 1287 CG LEU A 92 1.355 11.582 -20.627 1.00 0.00 C ATOM 1288 CD1 LEU A 92 2.113 12.209 -19.466 1.00 0.00 C ATOM 1289 CD2 LEU A 92 1.763 10.129 -20.812 1.00 0.00 C ATOM 0 H LEU A 92 0.247 10.455 -22.790 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.043 11.754 -21.433 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.352 12.587 -19.817 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.479 10.839 -19.813 1.00 0.00 H new ATOM 0 HG LEU A 92 1.610 12.127 -21.536 1.00 0.00 H new ATOM 0 HD11 LEU A 92 3.185 12.121 -19.642 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.844 13.262 -19.382 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.853 11.694 -18.541 1.00 0.00 H new ATOM 0 HD21 LEU A 92 2.840 10.071 -20.968 1.00 0.00 H new ATOM 0 HD22 LEU A 92 1.494 9.559 -19.922 1.00 0.00 H new ATOM 0 HD23 LEU A 92 1.248 9.714 -21.678 1.00 0.00 H new ATOM 1301 N LEU A 93 -1.446 14.079 -22.145 1.00 0.00 N ATOM 1302 CA LEU A 93 -1.266 15.375 -22.790 1.00 0.00 C ATOM 1303 C LEU A 93 -1.054 16.466 -21.744 1.00 0.00 C ATOM 1304 O LEU A 93 -1.885 16.657 -20.854 1.00 0.00 O ATOM 1305 CB LEU A 93 -2.480 15.711 -23.661 1.00 0.00 C ATOM 1306 CG LEU A 93 -2.517 17.146 -24.206 1.00 0.00 C ATOM 1307 CD1 LEU A 93 -2.343 17.151 -25.717 1.00 0.00 C ATOM 1308 CD2 LEU A 93 -3.820 17.832 -23.816 1.00 0.00 C ATOM 0 H LEU A 93 -2.198 14.053 -21.456 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.382 15.323 -23.426 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.506 15.019 -24.503 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.384 15.537 -23.078 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.689 17.701 -23.764 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.372 18.177 -26.083 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.384 16.701 -25.974 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -3.148 16.578 -26.178 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -3.829 18.848 -24.211 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -4.662 17.275 -24.228 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -3.903 17.864 -22.730 1.00 0.00 H new ATOM 1375 N LEU A 99 3.279 16.420 -26.295 1.00 0.00 N ATOM 1376 CA LEU A 99 2.536 15.220 -25.925 1.00 0.00 C ATOM 1377 C LEU A 99 3.457 14.185 -25.285 1.00 0.00 C ATOM 1378 O LEU A 99 4.662 14.177 -25.532 1.00 0.00 O ATOM 1379 CB LEU A 99 1.854 14.618 -27.155 1.00 0.00 C ATOM 1380 CG LEU A 99 0.436 15.122 -27.423 1.00 0.00 C ATOM 1381 CD1 LEU A 99 -0.481 14.781 -26.258 1.00 0.00 C ATOM 1382 CD2 LEU A 99 0.445 16.622 -27.677 1.00 0.00 C ATOM 0 HA LEU A 99 1.776 15.504 -25.197 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.469 14.827 -28.031 1.00 0.00 H new ATOM 0 HB3 LEU A 99 1.822 13.535 -27.039 1.00 0.00 H new ATOM 0 HG LEU A 99 0.055 14.624 -28.315 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.486 15.148 -26.467 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.510 13.700 -26.122 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -0.105 15.251 -25.349 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.572 16.965 -27.866 1.00 0.00 H new ATOM 0 HD22 LEU A 99 0.845 17.137 -26.803 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.069 16.841 -28.544 1.00 0.00 H new ATOM 1394 N LEU A 100 2.880 13.310 -24.469 1.00 0.00 N ATOM 1395 CA LEU A 100 3.649 12.268 -23.801 1.00 0.00 C ATOM 1396 C LEU A 100 2.941 10.923 -23.934 1.00 0.00 C ATOM 1397 O LEU A 100 1.713 10.851 -23.894 1.00 0.00 O ATOM 1398 CB LEU A 100 3.851 12.621 -22.325 1.00 0.00 C ATOM 1399 CG LEU A 100 5.155 13.353 -22.002 1.00 0.00 C ATOM 1400 CD1 LEU A 100 5.116 13.908 -20.586 1.00 0.00 C ATOM 1401 CD2 LEU A 100 6.348 12.427 -22.184 1.00 0.00 C ATOM 0 H LEU A 100 1.883 13.302 -24.255 1.00 0.00 H new ATOM 0 HA LEU A 100 4.627 12.195 -24.277 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.015 13.240 -21.999 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.815 11.702 -21.740 1.00 0.00 H new ATOM 0 HG LEU A 100 5.263 14.187 -22.695 1.00 0.00 H new ATOM 0 HD11 LEU A 100 6.051 14.426 -20.372 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.285 14.607 -20.492 1.00 0.00 H new ATOM 0 HD13 LEU A 100 4.984 13.090 -19.878 1.00 0.00 H new ATOM 0 HD21 LEU A 100 7.266 12.966 -21.950 1.00 0.00 H new ATOM 0 HD22 LEU A 100 6.249 11.571 -21.517 1.00 0.00 H new ATOM 0 HD23 LEU A 100 6.385 12.080 -23.217 1.00 0.00 H new ATOM 1413 N LEU A 101 3.722 9.861 -24.096 1.00 0.00 N ATOM 1414 CA LEU A 101 3.166 8.520 -24.242 1.00 0.00 C ATOM 1415 C LEU A 101 3.523 7.661 -23.037 1.00 0.00 C ATOM 1416 O LEU A 101 4.687 7.584 -22.645 1.00 0.00 O ATOM 1417 CB LEU A 101 3.687 7.868 -25.525 1.00 0.00 C ATOM 1418 CG LEU A 101 2.605 7.416 -26.509 1.00 0.00 C ATOM 1419 CD1 LEU A 101 2.937 7.869 -27.924 1.00 0.00 C ATOM 1420 CD2 LEU A 101 2.436 5.904 -26.455 1.00 0.00 C ATOM 0 H LEU A 101 4.741 9.902 -24.130 1.00 0.00 H new ATOM 0 HA LEU A 101 2.081 8.601 -24.303 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.345 8.574 -26.032 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.294 7.004 -25.255 1.00 0.00 H new ATOM 0 HG LEU A 101 1.662 7.880 -26.218 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.154 7.536 -28.606 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.004 8.957 -27.952 1.00 0.00 H new ATOM 0 HD13 LEU A 101 3.891 7.439 -28.229 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.663 5.599 -27.160 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.378 5.423 -26.718 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.146 5.606 -25.447 1.00 0.00 H new ATOM 1432 N ASN A 102 2.520 7.021 -22.443 1.00 0.00 N ATOM 1433 CA ASN A 102 2.757 6.180 -21.276 1.00 0.00 C ATOM 1434 C ASN A 102 2.347 4.736 -21.527 1.00 0.00 C ATOM 1435 O ASN A 102 1.172 4.443 -21.713 1.00 0.00 O ATOM 1436 CB ASN A 102 1.986 6.716 -20.073 1.00 0.00 C ATOM 1437 CG ASN A 102 2.589 6.276 -18.762 1.00 0.00 C ATOM 1438 OD1 ASN A 102 3.807 6.169 -18.626 1.00 0.00 O ATOM 1439 ND2 ASN A 102 1.734 6.018 -17.788 1.00 0.00 N ATOM 0 H ASN A 102 1.547 7.068 -22.746 1.00 0.00 H new ATOM 0 HA ASN A 102 3.828 6.204 -21.074 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.966 7.805 -20.113 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.952 6.376 -20.127 1.00 0.00 H new ATOM 0 HD21 ASN A 102 2.076 5.716 -16.876 1.00 0.00 H new ATOM 0 HD22 ASN A 102 0.732 6.121 -17.948 1.00 0.00 H new ATOM 1446 N ASP A 103 3.317 3.833 -21.507 1.00 0.00 N ATOM 1447 CA ASP A 103 3.034 2.419 -21.711 1.00 0.00 C ATOM 1448 C ASP A 103 2.500 1.799 -20.419 1.00 0.00 C ATOM 1449 O ASP A 103 2.946 2.147 -19.328 1.00 0.00 O ATOM 1450 CB ASP A 103 4.291 1.689 -22.190 1.00 0.00 C ATOM 1451 CG ASP A 103 5.527 2.060 -21.402 1.00 0.00 C ATOM 1452 OD1 ASP A 103 5.408 2.840 -20.434 1.00 0.00 O ATOM 1453 OD2 ASP A 103 6.620 1.572 -21.758 1.00 0.00 O ATOM 0 H ASP A 103 4.301 4.052 -21.353 1.00 0.00 H new ATOM 0 HA ASP A 103 2.270 2.318 -22.482 1.00 0.00 H new ATOM 0 HB2 ASP A 103 4.130 0.613 -22.117 1.00 0.00 H new ATOM 0 HB3 ASP A 103 4.457 1.916 -23.243 1.00 0.00 H new ATOM 1458 N ILE A 104 1.530 0.898 -20.546 1.00 0.00 N ATOM 1459 CA ILE A 104 0.930 0.253 -19.377 1.00 0.00 C ATOM 1460 C ILE A 104 0.479 -1.174 -19.692 1.00 0.00 C ATOM 1461 O ILE A 104 -0.583 -1.606 -19.244 1.00 0.00 O ATOM 1462 CB ILE A 104 -0.298 1.049 -18.868 1.00 0.00 C ATOM 1463 CG1 ILE A 104 -1.370 1.128 -19.953 1.00 0.00 C ATOM 1464 CG2 ILE A 104 0.096 2.448 -18.426 1.00 0.00 C ATOM 1465 CD1 ILE A 104 -2.770 1.283 -19.408 1.00 0.00 C ATOM 0 H ILE A 104 1.143 0.598 -21.441 1.00 0.00 H new ATOM 0 HA ILE A 104 1.701 0.229 -18.607 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.702 0.520 -18.005 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -1.149 1.969 -20.610 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -1.324 0.226 -20.564 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -0.788 2.981 -18.074 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.826 2.383 -17.619 1.00 0.00 H new ATOM 0 HG23 ILE A 104 0.533 2.986 -19.267 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -3.479 1.332 -20.235 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.010 0.429 -18.774 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -2.833 2.199 -18.821 1.00 0.00 H new ATOM 1477 N SER A 105 1.268 -1.901 -20.480 1.00 0.00 N ATOM 1478 CA SER A 105 0.921 -3.244 -20.859 1.00 0.00 C ATOM 1479 C SER A 105 1.634 -4.278 -19.999 1.00 0.00 C ATOM 1480 O SER A 105 2.748 -4.053 -19.529 1.00 0.00 O ATOM 1481 CB SER A 105 1.327 -3.451 -22.300 1.00 0.00 C ATOM 1482 OG SER A 105 1.841 -2.271 -22.873 1.00 0.00 O ATOM 0 H SER A 105 2.153 -1.569 -20.863 1.00 0.00 H new ATOM 0 HA SER A 105 -0.153 -3.373 -20.722 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.077 -4.239 -22.357 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.465 -3.789 -22.876 1.00 0.00 H new ATOM 0 HG SER A 105 1.146 -1.580 -22.877 1.00 0.00 H new ATOM 1488 N THR A 106 0.997 -5.426 -19.833 1.00 0.00 N ATOM 1489 CA THR A 106 1.581 -6.514 -19.072 1.00 0.00 C ATOM 1490 C THR A 106 2.779 -7.090 -19.824 1.00 0.00 C ATOM 1491 O THR A 106 3.733 -7.578 -19.217 1.00 0.00 O ATOM 1492 CB THR A 106 0.538 -7.608 -18.824 1.00 0.00 C ATOM 1493 OG1 THR A 106 -0.497 -7.132 -17.983 1.00 0.00 O ATOM 1494 CG2 THR A 106 1.111 -8.856 -18.183 1.00 0.00 C ATOM 0 H THR A 106 0.074 -5.627 -20.217 1.00 0.00 H new ATOM 0 HA THR A 106 1.918 -6.130 -18.109 1.00 0.00 H new ATOM 0 HB THR A 106 0.159 -7.870 -19.812 1.00 0.00 H new ATOM 0 HG1 THR A 106 -1.133 -6.607 -18.512 1.00 0.00 H new ATOM 0 HG21 THR A 106 0.316 -9.588 -18.037 1.00 0.00 H new ATOM 0 HG22 THR A 106 1.878 -9.279 -18.831 1.00 0.00 H new ATOM 0 HG23 THR A 106 1.551 -8.601 -17.219 1.00 0.00 H new ATOM 1502 N ASN A 107 2.709 -7.044 -21.155 1.00 0.00 N ATOM 1503 CA ASN A 107 3.775 -7.578 -21.997 1.00 0.00 C ATOM 1504 C ASN A 107 4.736 -6.497 -22.500 1.00 0.00 C ATOM 1505 O ASN A 107 5.862 -6.808 -22.892 1.00 0.00 O ATOM 1506 CB ASN A 107 3.172 -8.324 -23.174 1.00 0.00 C ATOM 1507 CG ASN A 107 3.441 -9.811 -23.122 1.00 0.00 C ATOM 1508 OD1 ASN A 107 4.476 -10.251 -22.621 1.00 0.00 O ATOM 1509 ND2 ASN A 107 2.507 -10.592 -23.639 1.00 0.00 N ATOM 0 H ASN A 107 1.926 -6.643 -21.671 1.00 0.00 H new ATOM 0 HA ASN A 107 4.361 -8.259 -21.379 1.00 0.00 H new ATOM 0 HB2 ASN A 107 2.095 -8.154 -23.194 1.00 0.00 H new ATOM 0 HB3 ASN A 107 3.576 -7.918 -24.102 1.00 0.00 H new ATOM 0 HD21 ASN A 107 2.628 -11.605 -23.633 1.00 0.00 H new ATOM 0 HD22 ASN A 107 1.665 -10.182 -24.043 1.00 0.00 H new ATOM 1516 N GLY A 108 4.311 -5.231 -22.484 1.00 0.00 N ATOM 1517 CA GLY A 108 5.173 -4.171 -22.936 1.00 0.00 C ATOM 1518 C GLY A 108 4.621 -3.402 -24.122 1.00 0.00 C ATOM 1519 O GLY A 108 3.813 -3.916 -24.896 1.00 0.00 O ATOM 0 H GLY A 108 3.389 -4.932 -22.166 1.00 0.00 H new ATOM 0 HA2 GLY A 108 5.345 -3.478 -22.113 1.00 0.00 H new ATOM 0 HA3 GLY A 108 6.142 -4.592 -23.206 1.00 0.00 H new ATOM 1523 N THR A 109 5.080 -2.165 -24.255 1.00 0.00 N ATOM 1524 CA THR A 109 4.673 -1.277 -25.342 1.00 0.00 C ATOM 1525 C THR A 109 5.886 -0.927 -26.192 1.00 0.00 C ATOM 1526 O THR A 109 6.971 -0.692 -25.661 1.00 0.00 O ATOM 1527 CB THR A 109 4.035 -0.005 -24.784 1.00 0.00 C ATOM 1528 OG1 THR A 109 3.103 -0.318 -23.767 1.00 0.00 O ATOM 1529 CG2 THR A 109 3.313 0.818 -25.829 1.00 0.00 C ATOM 0 H THR A 109 5.749 -1.745 -23.610 1.00 0.00 H new ATOM 0 HA THR A 109 3.934 -1.787 -25.960 1.00 0.00 H new ATOM 0 HB THR A 109 4.866 0.584 -24.395 1.00 0.00 H new ATOM 0 HG1 THR A 109 2.859 -1.265 -23.827 1.00 0.00 H new ATOM 0 HG21 THR A 109 2.885 1.705 -25.362 1.00 0.00 H new ATOM 0 HG22 THR A 109 4.017 1.120 -26.604 1.00 0.00 H new ATOM 0 HG23 THR A 109 2.516 0.222 -26.274 1.00 0.00 H new ATOM 1537 N TRP A 110 5.719 -0.927 -27.508 1.00 0.00 N ATOM 1538 CA TRP A 110 6.836 -0.643 -28.399 1.00 0.00 C ATOM 1539 C TRP A 110 6.665 0.631 -29.203 1.00 0.00 C ATOM 1540 O TRP A 110 5.561 1.000 -29.597 1.00 0.00 O ATOM 1541 CB TRP A 110 7.048 -1.801 -29.362 1.00 0.00 C ATOM 1542 CG TRP A 110 7.969 -2.818 -28.827 1.00 0.00 C ATOM 1543 CD1 TRP A 110 9.241 -3.046 -29.225 1.00 0.00 C ATOM 1544 CD2 TRP A 110 7.686 -3.741 -27.782 1.00 0.00 C ATOM 1545 NE1 TRP A 110 9.780 -4.057 -28.489 1.00 0.00 N ATOM 1546 CE2 TRP A 110 8.840 -4.512 -27.595 1.00 0.00 C ATOM 1547 CE3 TRP A 110 6.565 -3.988 -26.987 1.00 0.00 C ATOM 1548 CZ2 TRP A 110 8.912 -5.522 -26.639 1.00 0.00 C ATOM 1549 CZ3 TRP A 110 6.632 -4.985 -26.038 1.00 0.00 C ATOM 1550 CH2 TRP A 110 7.798 -5.744 -25.870 1.00 0.00 C ATOM 0 H TRP A 110 4.834 -1.118 -27.977 1.00 0.00 H new ATOM 0 HA TRP A 110 7.703 -0.507 -27.753 1.00 0.00 H new ATOM 0 HB2 TRP A 110 6.087 -2.266 -29.583 1.00 0.00 H new ATOM 0 HB3 TRP A 110 7.441 -1.419 -30.304 1.00 0.00 H new ATOM 0 HD1 TRP A 110 9.753 -2.507 -30.009 1.00 0.00 H new ATOM 0 HE1 TRP A 110 10.729 -4.419 -28.586 1.00 0.00 H new ATOM 0 HE3 TRP A 110 5.662 -3.409 -27.113 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 9.810 -6.108 -26.508 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 5.773 -5.184 -25.414 1.00 0.00 H new ATOM 0 HH2 TRP A 110 7.820 -6.520 -25.119 1.00 0.00 H new ATOM 1561 N LEU A 111 7.797 1.262 -29.484 1.00 0.00 N ATOM 1562 CA LEU A 111 7.834 2.461 -30.290 1.00 0.00 C ATOM 1563 C LEU A 111 8.784 2.216 -31.459 1.00 0.00 C ATOM 1564 O LEU A 111 9.988 2.048 -31.270 1.00 0.00 O ATOM 1565 CB LEU A 111 8.283 3.661 -29.443 1.00 0.00 C ATOM 1566 CG LEU A 111 9.267 4.620 -30.118 1.00 0.00 C ATOM 1567 CD1 LEU A 111 8.627 5.276 -31.331 1.00 0.00 C ATOM 1568 CD2 LEU A 111 9.745 5.674 -29.129 1.00 0.00 C ATOM 0 H LEU A 111 8.712 0.952 -29.157 1.00 0.00 H new ATOM 0 HA LEU A 111 6.841 2.694 -30.673 1.00 0.00 H new ATOM 0 HB2 LEU A 111 7.398 4.226 -29.149 1.00 0.00 H new ATOM 0 HB3 LEU A 111 8.741 3.285 -28.528 1.00 0.00 H new ATOM 0 HG LEU A 111 10.131 4.047 -30.455 1.00 0.00 H new ATOM 0 HD11 LEU A 111 9.342 5.954 -31.797 1.00 0.00 H new ATOM 0 HD12 LEU A 111 8.334 4.509 -32.048 1.00 0.00 H new ATOM 0 HD13 LEU A 111 7.746 5.836 -31.019 1.00 0.00 H new ATOM 0 HD21 LEU A 111 10.444 6.348 -29.625 1.00 0.00 H new ATOM 0 HD22 LEU A 111 8.891 6.243 -28.762 1.00 0.00 H new ATOM 0 HD23 LEU A 111 10.243 5.187 -28.291 1.00 0.00 H new ATOM 1580 N ASN A 112 8.231 2.184 -32.662 1.00 0.00 N ATOM 1581 CA ASN A 112 9.015 1.945 -33.870 1.00 0.00 C ATOM 1582 C ASN A 112 10.009 0.790 -33.702 1.00 0.00 C ATOM 1583 O ASN A 112 11.155 0.883 -34.142 1.00 0.00 O ATOM 1584 CB ASN A 112 9.758 3.218 -34.280 1.00 0.00 C ATOM 1585 CG ASN A 112 8.888 4.162 -35.087 1.00 0.00 C ATOM 1586 OD1 ASN A 112 7.739 4.529 -34.531 1.00 0.00 O flip ATOM 1587 ND2 ASN A 112 9.246 4.558 -36.196 1.00 0.00 N flip ATOM 0 H ASN A 112 7.235 2.321 -32.831 1.00 0.00 H new ATOM 0 HA ASN A 112 8.314 1.661 -34.655 1.00 0.00 H new ATOM 0 HB2 ASN A 112 10.114 3.731 -33.387 1.00 0.00 H new ATOM 0 HB3 ASN A 112 10.637 2.949 -34.865 1.00 0.00 H new ATOM 0 HD21 ASN A 112 10.137 4.250 -36.584 1.00 0.00 H new ATOM 0 HD22 ASN A 112 8.651 5.194 -36.727 1.00 0.00 H new ATOM 1594 N GLY A 113 9.562 -0.303 -33.086 1.00 0.00 N ATOM 1595 CA GLY A 113 10.417 -1.449 -32.905 1.00 0.00 C ATOM 1596 C GLY A 113 11.262 -1.379 -31.651 1.00 0.00 C ATOM 1597 O GLY A 113 11.926 -2.353 -31.296 1.00 0.00 O ATOM 0 H GLY A 113 8.619 -0.408 -32.711 1.00 0.00 H new ATOM 0 HA2 GLY A 113 9.803 -2.349 -32.870 1.00 0.00 H new ATOM 0 HA3 GLY A 113 11.073 -1.544 -33.771 1.00 0.00 H new ATOM 1601 N GLN A 114 11.244 -0.238 -30.971 1.00 0.00 N ATOM 1602 CA GLN A 114 12.023 -0.084 -29.751 1.00 0.00 C ATOM 1603 C GLN A 114 11.119 -0.123 -28.525 1.00 0.00 C ATOM 1604 O GLN A 114 10.234 0.717 -28.362 1.00 0.00 O ATOM 1605 CB GLN A 114 12.806 1.231 -29.782 1.00 0.00 C ATOM 1606 CG GLN A 114 14.276 1.055 -30.129 1.00 0.00 C ATOM 1607 CD GLN A 114 15.122 2.230 -29.679 1.00 0.00 C ATOM 1608 OE1 GLN A 114 15.154 3.274 -30.331 1.00 0.00 O ATOM 1609 NE2 GLN A 114 15.817 2.064 -28.558 1.00 0.00 N ATOM 0 H GLN A 114 10.705 0.585 -31.241 1.00 0.00 H new ATOM 0 HA GLN A 114 12.727 -0.914 -29.690 1.00 0.00 H new ATOM 0 HB2 GLN A 114 12.347 1.901 -30.509 1.00 0.00 H new ATOM 0 HB3 GLN A 114 12.726 1.715 -28.809 1.00 0.00 H new ATOM 0 HG2 GLN A 114 14.649 0.143 -29.664 1.00 0.00 H new ATOM 0 HG3 GLN A 114 14.379 0.928 -31.207 1.00 0.00 H new ATOM 0 HE21 GLN A 114 15.761 1.182 -28.049 1.00 0.00 H new ATOM 0 HE22 GLN A 114 16.406 2.819 -28.207 1.00 0.00 H new ATOM 1618 N LYS A 115 11.351 -1.110 -27.669 1.00 0.00 N ATOM 1619 CA LYS A 115 10.578 -1.281 -26.462 1.00 0.00 C ATOM 1620 C LYS A 115 10.951 -0.234 -25.413 1.00 0.00 C ATOM 1621 O LYS A 115 12.110 -0.127 -25.013 1.00 0.00 O ATOM 1622 CB LYS A 115 10.815 -2.704 -25.956 1.00 0.00 C ATOM 1623 CG LYS A 115 10.753 -2.873 -24.443 1.00 0.00 C ATOM 1624 CD LYS A 115 9.341 -2.662 -23.920 1.00 0.00 C ATOM 1625 CE LYS A 115 9.162 -3.267 -22.537 1.00 0.00 C ATOM 1626 NZ LYS A 115 8.983 -4.744 -22.597 1.00 0.00 N ATOM 0 H LYS A 115 12.081 -1.810 -27.799 1.00 0.00 H new ATOM 0 HA LYS A 115 9.517 -1.137 -26.668 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.074 -3.362 -26.410 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.793 -3.038 -26.303 1.00 0.00 H new ATOM 0 HG2 LYS A 115 11.098 -3.871 -24.172 1.00 0.00 H new ATOM 0 HG3 LYS A 115 11.429 -2.162 -23.968 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.122 -1.595 -23.882 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.626 -3.110 -24.610 1.00 0.00 H new ATOM 0 HE2 LYS A 115 10.031 -3.031 -21.922 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.296 -2.816 -22.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 8.283 -5.038 -21.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 8.649 -5.015 -23.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 9.891 -5.212 -22.403 1.00 0.00 H new ATOM 1640 N VAL A 116 9.958 0.537 -24.979 1.00 0.00 N ATOM 1641 CA VAL A 116 10.176 1.580 -23.982 1.00 0.00 C ATOM 1642 C VAL A 116 9.846 1.085 -22.577 1.00 0.00 C ATOM 1643 O VAL A 116 9.201 0.050 -22.407 1.00 0.00 O ATOM 1644 CB VAL A 116 9.333 2.839 -24.287 1.00 0.00 C ATOM 1645 CG1 VAL A 116 9.534 3.274 -25.731 1.00 0.00 C ATOM 1646 CG2 VAL A 116 7.854 2.595 -23.997 1.00 0.00 C ATOM 0 H VAL A 116 8.994 0.459 -25.303 1.00 0.00 H new ATOM 0 HA VAL A 116 11.233 1.841 -24.029 1.00 0.00 H new ATOM 0 HB VAL A 116 9.672 3.642 -23.632 1.00 0.00 H new ATOM 0 HG11 VAL A 116 8.934 4.162 -25.930 1.00 0.00 H new ATOM 0 HG12 VAL A 116 10.586 3.502 -25.899 1.00 0.00 H new ATOM 0 HG13 VAL A 116 9.226 2.470 -26.399 1.00 0.00 H new ATOM 0 HG21 VAL A 116 7.286 3.498 -24.221 1.00 0.00 H new ATOM 0 HG22 VAL A 116 7.492 1.775 -24.617 1.00 0.00 H new ATOM 0 HG23 VAL A 116 7.727 2.338 -22.945 1.00 0.00 H new ATOM 1656 N GLU A 117 10.285 1.836 -21.574 1.00 0.00 N ATOM 1657 CA GLU A 117 10.031 1.481 -20.184 1.00 0.00 C ATOM 1658 C GLU A 117 8.554 1.657 -19.852 1.00 0.00 C ATOM 1659 O GLU A 117 7.973 2.708 -20.122 1.00 0.00 O ATOM 1660 CB GLU A 117 10.879 2.350 -19.253 1.00 0.00 C ATOM 1661 CG GLU A 117 11.204 1.683 -17.927 1.00 0.00 C ATOM 1662 CD GLU A 117 11.388 2.682 -16.801 1.00 0.00 C ATOM 1663 OE1 GLU A 117 10.630 3.674 -16.759 1.00 0.00 O ATOM 1664 OE2 GLU A 117 12.288 2.470 -15.961 1.00 0.00 O ATOM 0 H GLU A 117 10.819 2.696 -21.698 1.00 0.00 H new ATOM 0 HA GLU A 117 10.302 0.435 -20.040 1.00 0.00 H new ATOM 0 HB2 GLU A 117 11.810 2.608 -19.758 1.00 0.00 H new ATOM 0 HB3 GLU A 117 10.351 3.284 -19.061 1.00 0.00 H new ATOM 0 HG2 GLU A 117 10.403 0.991 -17.667 1.00 0.00 H new ATOM 0 HG3 GLU A 117 12.113 1.092 -18.035 1.00 0.00 H new ATOM 1671 N LYS A 118 7.946 0.632 -19.264 1.00 0.00 N ATOM 1672 CA LYS A 118 6.534 0.699 -18.900 1.00 0.00 C ATOM 1673 C LYS A 118 6.272 1.924 -18.033 1.00 0.00 C ATOM 1674 O LYS A 118 7.200 2.520 -17.487 1.00 0.00 O ATOM 1675 CB LYS A 118 6.106 -0.565 -18.162 1.00 0.00 C ATOM 1676 CG LYS A 118 4.608 -0.664 -17.926 1.00 0.00 C ATOM 1677 CD LYS A 118 4.153 -2.111 -17.857 1.00 0.00 C ATOM 1678 CE LYS A 118 2.722 -2.224 -17.358 1.00 0.00 C ATOM 1679 NZ LYS A 118 2.554 -3.352 -16.400 1.00 0.00 N ATOM 0 H LYS A 118 8.404 -0.249 -19.030 1.00 0.00 H new ATOM 0 HA LYS A 118 5.948 0.780 -19.815 1.00 0.00 H new ATOM 0 HB2 LYS A 118 6.432 -1.435 -18.732 1.00 0.00 H new ATOM 0 HB3 LYS A 118 6.619 -0.604 -17.201 1.00 0.00 H new ATOM 0 HG2 LYS A 118 4.350 -0.155 -16.997 1.00 0.00 H new ATOM 0 HG3 LYS A 118 4.077 -0.152 -18.728 1.00 0.00 H new ATOM 0 HD2 LYS A 118 4.231 -2.565 -18.845 1.00 0.00 H new ATOM 0 HD3 LYS A 118 4.815 -2.670 -17.196 1.00 0.00 H new ATOM 0 HE2 LYS A 118 2.432 -1.291 -16.875 1.00 0.00 H new ATOM 0 HE3 LYS A 118 2.052 -2.365 -18.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 1.564 -3.394 -16.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 2.806 -4.246 -16.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 3.174 -3.205 -15.578 1.00 0.00 H new ATOM 1693 N ASN A 119 5.002 2.290 -17.921 1.00 0.00 N ATOM 1694 CA ASN A 119 4.577 3.453 -17.135 1.00 0.00 C ATOM 1695 C ASN A 119 5.608 4.577 -17.182 1.00 0.00 C ATOM 1696 O ASN A 119 5.832 5.277 -16.195 1.00 0.00 O ATOM 1697 CB ASN A 119 4.299 3.060 -15.684 1.00 0.00 C ATOM 1698 CG ASN A 119 3.753 1.651 -15.546 1.00 0.00 C ATOM 1699 OD1 ASN A 119 2.661 1.346 -16.022 1.00 0.00 O ATOM 1700 ND2 ASN A 119 4.518 0.783 -14.891 1.00 0.00 N ATOM 0 H ASN A 119 4.233 1.793 -18.370 1.00 0.00 H new ATOM 0 HA ASN A 119 3.655 3.822 -17.585 1.00 0.00 H new ATOM 0 HB2 ASN A 119 5.220 3.145 -15.107 1.00 0.00 H new ATOM 0 HB3 ASN A 119 3.587 3.764 -15.253 1.00 0.00 H new ATOM 0 HD21 ASN A 119 4.205 -0.180 -14.767 1.00 0.00 H new ATOM 0 HD22 ASN A 119 5.417 1.080 -14.513 1.00 0.00 H new ATOM 1707 N SER A 120 6.229 4.735 -18.341 1.00 0.00 N ATOM 1708 CA SER A 120 7.240 5.768 -18.543 1.00 0.00 C ATOM 1709 C SER A 120 6.737 6.839 -19.507 1.00 0.00 C ATOM 1710 O SER A 120 6.007 6.540 -20.452 1.00 0.00 O ATOM 1711 CB SER A 120 8.536 5.144 -19.070 1.00 0.00 C ATOM 1712 OG SER A 120 8.536 5.076 -20.485 1.00 0.00 O ATOM 0 H SER A 120 6.050 4.158 -19.163 1.00 0.00 H new ATOM 0 HA SER A 120 7.442 6.242 -17.583 1.00 0.00 H new ATOM 0 HB2 SER A 120 9.389 5.732 -18.732 1.00 0.00 H new ATOM 0 HB3 SER A 120 8.655 4.143 -18.656 1.00 0.00 H new ATOM 0 HG SER A 120 8.516 4.138 -20.767 1.00 0.00 H new ATOM 1718 N ASN A 121 7.134 8.084 -19.269 1.00 0.00 N ATOM 1719 CA ASN A 121 6.721 9.190 -20.123 1.00 0.00 C ATOM 1720 C ASN A 121 7.750 9.441 -21.220 1.00 0.00 C ATOM 1721 O ASN A 121 8.939 9.598 -20.945 1.00 0.00 O ATOM 1722 CB ASN A 121 6.521 10.460 -19.296 1.00 0.00 C ATOM 1723 CG ASN A 121 5.490 10.280 -18.201 1.00 0.00 C ATOM 1724 OD1 ASN A 121 5.760 10.539 -17.027 1.00 0.00 O ATOM 1725 ND2 ASN A 121 4.299 9.834 -18.579 1.00 0.00 N ATOM 0 H ASN A 121 7.740 8.352 -18.493 1.00 0.00 H new ATOM 0 HA ASN A 121 5.774 8.919 -20.590 1.00 0.00 H new ATOM 0 HB2 ASN A 121 7.472 10.754 -18.851 1.00 0.00 H new ATOM 0 HB3 ASN A 121 6.211 11.273 -19.953 1.00 0.00 H new ATOM 0 HD21 ASN A 121 3.564 9.693 -17.886 1.00 0.00 H new ATOM 0 HD22 ASN A 121 4.119 9.632 -19.562 1.00 0.00 H new ATOM 1732 N GLN A 122 7.284 9.480 -22.463 1.00 0.00 N ATOM 1733 CA GLN A 122 8.160 9.717 -23.603 1.00 0.00 C ATOM 1734 C GLN A 122 7.608 10.836 -24.476 1.00 0.00 C ATOM 1735 O GLN A 122 6.398 11.048 -24.533 1.00 0.00 O ATOM 1736 CB GLN A 122 8.317 8.440 -24.430 1.00 0.00 C ATOM 1737 CG GLN A 122 8.595 7.203 -23.593 1.00 0.00 C ATOM 1738 CD GLN A 122 9.978 7.220 -22.970 1.00 0.00 C ATOM 1739 OE1 GLN A 122 10.974 7.470 -23.650 1.00 0.00 O ATOM 1740 NE2 GLN A 122 10.046 6.952 -21.672 1.00 0.00 N ATOM 0 H GLN A 122 6.302 9.350 -22.707 1.00 0.00 H new ATOM 0 HA GLN A 122 9.138 10.016 -23.226 1.00 0.00 H new ATOM 0 HB2 GLN A 122 7.408 8.279 -25.010 1.00 0.00 H new ATOM 0 HB3 GLN A 122 9.130 8.576 -25.143 1.00 0.00 H new ATOM 0 HG2 GLN A 122 7.846 7.126 -22.805 1.00 0.00 H new ATOM 0 HG3 GLN A 122 8.493 6.316 -24.217 1.00 0.00 H new ATOM 0 HE21 GLN A 122 9.195 6.750 -21.148 1.00 0.00 H new ATOM 0 HE22 GLN A 122 10.950 6.948 -21.199 1.00 0.00 H new ATOM 1749 N LEU A 123 8.496 11.550 -25.157 1.00 0.00 N ATOM 1750 CA LEU A 123 8.081 12.646 -26.023 1.00 0.00 C ATOM 1751 C LEU A 123 7.412 12.109 -27.282 1.00 0.00 C ATOM 1752 O LEU A 123 8.031 11.398 -28.074 1.00 0.00 O ATOM 1753 CB LEU A 123 9.283 13.511 -26.400 1.00 0.00 C ATOM 1754 CG LEU A 123 8.937 14.908 -26.917 1.00 0.00 C ATOM 1755 CD1 LEU A 123 8.682 15.859 -25.757 1.00 0.00 C ATOM 1756 CD2 LEU A 123 10.052 15.437 -27.808 1.00 0.00 C ATOM 0 H LEU A 123 9.503 11.391 -25.127 1.00 0.00 H new ATOM 0 HA LEU A 123 7.362 13.258 -25.479 1.00 0.00 H new ATOM 0 HB2 LEU A 123 9.927 13.612 -25.526 1.00 0.00 H new ATOM 0 HB3 LEU A 123 9.861 12.990 -27.163 1.00 0.00 H new ATOM 0 HG LEU A 123 8.025 14.840 -27.511 1.00 0.00 H new ATOM 0 HD11 LEU A 123 8.437 16.848 -26.144 1.00 0.00 H new ATOM 0 HD12 LEU A 123 7.850 15.488 -25.158 1.00 0.00 H new ATOM 0 HD13 LEU A 123 9.576 15.923 -25.136 1.00 0.00 H new ATOM 0 HD21 LEU A 123 9.789 16.432 -28.167 1.00 0.00 H new ATOM 0 HD22 LEU A 123 10.979 15.490 -27.238 1.00 0.00 H new ATOM 0 HD23 LEU A 123 10.187 14.768 -28.658 1.00 0.00 H new ATOM 1768 N LEU A 124 6.138 12.446 -27.455 1.00 0.00 N ATOM 1769 CA LEU A 124 5.378 11.989 -28.611 1.00 0.00 C ATOM 1770 C LEU A 124 6.035 12.421 -29.914 1.00 0.00 C ATOM 1771 O LEU A 124 6.811 13.374 -29.955 1.00 0.00 O ATOM 1772 CB LEU A 124 3.943 12.515 -28.553 1.00 0.00 C ATOM 1773 CG LEU A 124 3.063 12.150 -29.750 1.00 0.00 C ATOM 1774 CD1 LEU A 124 2.855 10.644 -29.821 1.00 0.00 C ATOM 1775 CD2 LEU A 124 1.725 12.868 -29.664 1.00 0.00 C ATOM 0 H LEU A 124 5.611 13.034 -26.809 1.00 0.00 H new ATOM 0 HA LEU A 124 5.361 10.900 -28.582 1.00 0.00 H new ATOM 0 HB2 LEU A 124 3.471 12.135 -27.647 1.00 0.00 H new ATOM 0 HB3 LEU A 124 3.975 13.601 -28.465 1.00 0.00 H new ATOM 0 HG LEU A 124 3.570 12.470 -30.660 1.00 0.00 H new ATOM 0 HD11 LEU A 124 2.227 10.404 -30.679 1.00 0.00 H new ATOM 0 HD12 LEU A 124 3.820 10.148 -29.928 1.00 0.00 H new ATOM 0 HD13 LEU A 124 2.369 10.300 -28.908 1.00 0.00 H new ATOM 0 HD21 LEU A 124 1.111 12.597 -30.523 1.00 0.00 H new ATOM 0 HD22 LEU A 124 1.214 12.576 -28.746 1.00 0.00 H new ATOM 0 HD23 LEU A 124 1.890 13.945 -29.661 1.00 0.00 H new ATOM 1787 N SER A 125 5.709 11.700 -30.975 1.00 0.00 N ATOM 1788 CA SER A 125 6.245 11.977 -32.300 1.00 0.00 C ATOM 1789 C SER A 125 5.112 12.186 -33.300 1.00 0.00 C ATOM 1790 O SER A 125 4.013 11.660 -33.120 1.00 0.00 O ATOM 1791 CB SER A 125 7.150 10.832 -32.761 1.00 0.00 C ATOM 1792 OG SER A 125 8.510 11.106 -32.468 1.00 0.00 O ATOM 0 H SER A 125 5.067 10.908 -30.943 1.00 0.00 H new ATOM 0 HA SER A 125 6.837 12.891 -32.247 1.00 0.00 H new ATOM 0 HB2 SER A 125 6.849 9.906 -32.271 1.00 0.00 H new ATOM 0 HB3 SER A 125 7.030 10.679 -33.833 1.00 0.00 H new ATOM 0 HG SER A 125 9.067 10.359 -32.771 1.00 0.00 H new ATOM 1798 N GLN A 126 5.378 12.952 -34.351 1.00 0.00 N ATOM 1799 CA GLN A 126 4.365 13.218 -35.366 1.00 0.00 C ATOM 1800 C GLN A 126 4.117 11.963 -36.193 1.00 0.00 C ATOM 1801 O GLN A 126 5.045 11.384 -36.755 1.00 0.00 O ATOM 1802 CB GLN A 126 4.805 14.368 -36.273 1.00 0.00 C ATOM 1803 CG GLN A 126 3.793 14.710 -37.356 1.00 0.00 C ATOM 1804 CD GLN A 126 3.051 16.002 -37.072 1.00 0.00 C ATOM 1805 OE1 GLN A 126 2.072 15.937 -36.178 1.00 0.00 O flip ATOM 1806 NE2 GLN A 126 3.354 17.045 -37.651 1.00 0.00 N flip ATOM 0 H GLN A 126 6.279 13.397 -34.523 1.00 0.00 H new ATOM 0 HA GLN A 126 3.439 13.505 -34.869 1.00 0.00 H new ATOM 0 HB2 GLN A 126 4.985 15.253 -35.663 1.00 0.00 H new ATOM 0 HB3 GLN A 126 5.753 14.107 -36.743 1.00 0.00 H new ATOM 0 HG2 GLN A 126 4.306 14.793 -38.314 1.00 0.00 H new ATOM 0 HG3 GLN A 126 3.075 13.895 -37.448 1.00 0.00 H new ATOM 0 HE21 GLN A 126 4.114 17.048 -38.331 1.00 0.00 H new ATOM 0 HE22 GLN A 126 2.845 17.906 -37.451 1.00 0.00 H new ATOM 1815 N GLY A 127 2.858 11.538 -36.246 1.00 0.00 N ATOM 1816 CA GLY A 127 2.512 10.345 -36.984 1.00 0.00 C ATOM 1817 C GLY A 127 3.227 9.118 -36.447 1.00 0.00 C ATOM 1818 O GLY A 127 3.359 8.112 -37.142 1.00 0.00 O ATOM 0 H GLY A 127 2.073 12.002 -35.789 1.00 0.00 H new ATOM 0 HA2 GLY A 127 1.435 10.188 -36.935 1.00 0.00 H new ATOM 0 HA3 GLY A 127 2.766 10.482 -38.035 1.00 0.00 H new ATOM 1822 N ASP A 128 3.693 9.209 -35.202 1.00 0.00 N ATOM 1823 CA ASP A 128 4.401 8.116 -34.556 1.00 0.00 C ATOM 1824 C ASP A 128 3.580 6.835 -34.590 1.00 0.00 C ATOM 1825 O ASP A 128 2.420 6.838 -35.006 1.00 0.00 O ATOM 1826 CB ASP A 128 4.729 8.488 -33.111 1.00 0.00 C ATOM 1827 CG ASP A 128 5.769 7.578 -32.487 1.00 0.00 C ATOM 1828 OD1 ASP A 128 6.835 7.382 -33.106 1.00 0.00 O ATOM 1829 OD2 ASP A 128 5.516 7.061 -31.378 1.00 0.00 O ATOM 0 H ASP A 128 3.589 10.040 -34.619 1.00 0.00 H new ATOM 0 HA ASP A 128 5.327 7.941 -35.103 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.088 9.517 -33.079 1.00 0.00 H new ATOM 0 HB3 ASP A 128 3.817 8.450 -32.516 1.00 0.00 H new ATOM 1834 N GLU A 129 4.188 5.742 -34.152 1.00 0.00 N ATOM 1835 CA GLU A 129 3.511 4.452 -34.133 1.00 0.00 C ATOM 1836 C GLU A 129 3.945 3.621 -32.928 1.00 0.00 C ATOM 1837 O GLU A 129 5.133 3.532 -32.616 1.00 0.00 O ATOM 1838 CB GLU A 129 3.803 3.694 -35.433 1.00 0.00 C ATOM 1839 CG GLU A 129 3.276 2.266 -35.456 1.00 0.00 C ATOM 1840 CD GLU A 129 4.301 1.278 -35.977 1.00 0.00 C ATOM 1841 OE1 GLU A 129 4.366 1.082 -37.209 1.00 0.00 O ATOM 1842 OE2 GLU A 129 5.038 0.698 -35.152 1.00 0.00 O ATOM 0 H GLU A 129 5.147 5.722 -33.805 1.00 0.00 H new ATOM 0 HA GLU A 129 2.438 4.627 -34.051 1.00 0.00 H new ATOM 0 HB2 GLU A 129 3.366 4.244 -36.267 1.00 0.00 H new ATOM 0 HB3 GLU A 129 4.881 3.674 -35.594 1.00 0.00 H new ATOM 0 HG2 GLU A 129 2.976 1.976 -34.449 1.00 0.00 H new ATOM 0 HG3 GLU A 129 2.383 2.221 -36.080 1.00 0.00 H new ATOM 1849 N ILE A 130 2.973 3.004 -32.262 1.00 0.00 N ATOM 1850 CA ILE A 130 3.248 2.170 -31.102 1.00 0.00 C ATOM 1851 C ILE A 130 2.922 0.715 -31.410 1.00 0.00 C ATOM 1852 O ILE A 130 1.831 0.399 -31.883 1.00 0.00 O ATOM 1853 CB ILE A 130 2.440 2.613 -29.866 1.00 0.00 C ATOM 1854 CG1 ILE A 130 2.460 4.136 -29.721 1.00 0.00 C ATOM 1855 CG2 ILE A 130 2.984 1.950 -28.612 1.00 0.00 C ATOM 1856 CD1 ILE A 130 1.291 4.679 -28.927 1.00 0.00 C ATOM 0 H ILE A 130 1.985 3.068 -32.509 1.00 0.00 H new ATOM 0 HA ILE A 130 4.309 2.279 -30.876 1.00 0.00 H new ATOM 0 HB ILE A 130 1.405 2.299 -30.003 1.00 0.00 H new ATOM 0 HG12 ILE A 130 3.389 4.435 -29.236 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.458 4.588 -30.713 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.403 2.273 -27.748 1.00 0.00 H new ATOM 0 HG22 ILE A 130 2.913 0.867 -28.713 1.00 0.00 H new ATOM 0 HG23 ILE A 130 4.027 2.234 -28.474 1.00 0.00 H new ATOM 0 HD11 ILE A 130 1.368 5.764 -28.863 1.00 0.00 H new ATOM 0 HD12 ILE A 130 0.358 4.410 -29.422 1.00 0.00 H new ATOM 0 HD13 ILE A 130 1.304 4.254 -27.923 1.00 0.00 H new ATOM 1868 N THR A 131 3.874 -0.168 -31.142 1.00 0.00 N ATOM 1869 CA THR A 131 3.685 -1.588 -31.394 1.00 0.00 C ATOM 1870 C THR A 131 3.425 -2.322 -30.085 1.00 0.00 C ATOM 1871 O THR A 131 4.041 -2.023 -29.064 1.00 0.00 O ATOM 1872 CB THR A 131 4.916 -2.167 -32.094 1.00 0.00 C ATOM 1873 OG1 THR A 131 5.163 -1.488 -33.313 1.00 0.00 O ATOM 1874 CG2 THR A 131 4.791 -3.639 -32.407 1.00 0.00 C ATOM 0 H THR A 131 4.784 0.075 -30.750 1.00 0.00 H new ATOM 0 HA THR A 131 2.821 -1.719 -32.045 1.00 0.00 H new ATOM 0 HB THR A 131 5.738 -2.032 -31.391 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.955 -1.870 -33.746 1.00 0.00 H new ATOM 0 HG21 THR A 131 5.699 -3.984 -32.903 1.00 0.00 H new ATOM 0 HG22 THR A 131 4.648 -4.197 -31.482 1.00 0.00 H new ATOM 0 HG23 THR A 131 3.936 -3.800 -33.063 1.00 0.00 H new ATOM 1882 N VAL A 132 2.489 -3.262 -30.108 1.00 0.00 N ATOM 1883 CA VAL A 132 2.141 -4.003 -28.903 1.00 0.00 C ATOM 1884 C VAL A 132 1.894 -5.481 -29.185 1.00 0.00 C ATOM 1885 O VAL A 132 1.599 -5.871 -30.315 1.00 0.00 O ATOM 1886 CB VAL A 132 0.893 -3.407 -28.237 1.00 0.00 C ATOM 1887 CG1 VAL A 132 1.159 -1.978 -27.788 1.00 0.00 C ATOM 1888 CG2 VAL A 132 -0.299 -3.461 -29.182 1.00 0.00 C ATOM 0 H VAL A 132 1.962 -3.528 -30.940 1.00 0.00 H new ATOM 0 HA VAL A 132 2.996 -3.919 -28.232 1.00 0.00 H new ATOM 0 HB VAL A 132 0.656 -4.004 -27.357 1.00 0.00 H new ATOM 0 HG11 VAL A 132 0.263 -1.572 -27.318 1.00 0.00 H new ATOM 0 HG12 VAL A 132 1.981 -1.969 -27.072 1.00 0.00 H new ATOM 0 HG13 VAL A 132 1.424 -1.368 -28.652 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -1.173 -3.034 -28.690 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -0.075 -2.891 -30.083 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.504 -4.497 -29.450 1.00 0.00 H new ATOM 1898 N GLY A 133 2.019 -6.296 -28.141 1.00 0.00 N ATOM 1899 CA GLY A 133 1.810 -7.718 -28.273 1.00 0.00 C ATOM 1900 C GLY A 133 3.016 -8.410 -28.860 1.00 0.00 C ATOM 1901 O GLY A 133 2.890 -9.293 -29.706 1.00 0.00 O ATOM 0 H GLY A 133 2.264 -5.988 -27.200 1.00 0.00 H new ATOM 0 HA2 GLY A 133 1.586 -8.145 -27.295 1.00 0.00 H new ATOM 0 HA3 GLY A 133 0.942 -7.900 -28.907 1.00 0.00 H new ATOM 1905 N VAL A 134 4.191 -7.986 -28.421 1.00 0.00 N ATOM 1906 CA VAL A 134 5.429 -8.537 -28.913 1.00 0.00 C ATOM 1907 C VAL A 134 5.775 -9.868 -28.261 1.00 0.00 C ATOM 1908 O VAL A 134 5.570 -10.074 -27.065 1.00 0.00 O ATOM 1909 CB VAL A 134 6.586 -7.543 -28.735 1.00 0.00 C ATOM 1910 CG1 VAL A 134 7.927 -8.208 -29.021 1.00 0.00 C ATOM 1911 CG2 VAL A 134 6.364 -6.343 -29.642 1.00 0.00 C ATOM 0 H VAL A 134 4.306 -7.255 -27.719 1.00 0.00 H new ATOM 0 HA VAL A 134 5.282 -8.723 -29.977 1.00 0.00 H new ATOM 0 HB VAL A 134 6.608 -7.204 -27.699 1.00 0.00 H new ATOM 0 HG11 VAL A 134 8.729 -7.482 -28.888 1.00 0.00 H new ATOM 0 HG12 VAL A 134 8.074 -9.041 -28.334 1.00 0.00 H new ATOM 0 HG13 VAL A 134 7.939 -8.577 -30.047 1.00 0.00 H new ATOM 0 HG21 VAL A 134 7.184 -5.636 -29.517 1.00 0.00 H new ATOM 0 HG22 VAL A 134 6.325 -6.674 -30.680 1.00 0.00 H new ATOM 0 HG23 VAL A 134 5.424 -5.858 -29.380 1.00 0.00 H new ATOM 1921 N GLY A 135 6.290 -10.764 -29.085 1.00 0.00 N ATOM 1922 CA GLY A 135 6.662 -12.080 -28.648 1.00 0.00 C ATOM 1923 C GLY A 135 6.664 -13.039 -29.816 1.00 0.00 C ATOM 1924 O GLY A 135 7.563 -13.865 -29.964 1.00 0.00 O ATOM 0 H GLY A 135 6.459 -10.590 -30.076 1.00 0.00 H new ATOM 0 HA2 GLY A 135 7.650 -12.053 -28.189 1.00 0.00 H new ATOM 0 HA3 GLY A 135 5.966 -12.427 -27.884 1.00 0.00 H new ATOM 1928 N VAL A 136 5.653 -12.892 -30.667 1.00 0.00 N ATOM 1929 CA VAL A 136 5.514 -13.692 -31.856 1.00 0.00 C ATOM 1930 C VAL A 136 5.361 -12.779 -33.067 1.00 0.00 C ATOM 1931 O VAL A 136 4.614 -11.802 -33.024 1.00 0.00 O ATOM 1932 CB VAL A 136 4.305 -14.640 -31.767 1.00 0.00 C ATOM 1933 CG1 VAL A 136 4.236 -15.544 -32.989 1.00 0.00 C ATOM 1934 CG2 VAL A 136 4.369 -15.464 -30.490 1.00 0.00 C ATOM 0 H VAL A 136 4.908 -12.207 -30.541 1.00 0.00 H new ATOM 0 HA VAL A 136 6.411 -14.304 -31.957 1.00 0.00 H new ATOM 0 HB VAL A 136 3.397 -14.037 -31.742 1.00 0.00 H new ATOM 0 HG11 VAL A 136 3.374 -16.205 -32.904 1.00 0.00 H new ATOM 0 HG12 VAL A 136 4.139 -14.935 -33.887 1.00 0.00 H new ATOM 0 HG13 VAL A 136 5.146 -16.141 -33.052 1.00 0.00 H new ATOM 0 HG21 VAL A 136 3.507 -16.129 -30.443 1.00 0.00 H new ATOM 0 HG22 VAL A 136 5.284 -16.056 -30.484 1.00 0.00 H new ATOM 0 HG23 VAL A 136 4.362 -14.798 -29.627 1.00 0.00 H new ATOM 1944 N GLU A 137 6.081 -13.083 -34.137 1.00 0.00 N ATOM 1945 CA GLU A 137 6.031 -12.267 -35.345 1.00 0.00 C ATOM 1946 C GLU A 137 4.594 -12.016 -35.798 1.00 0.00 C ATOM 1947 O GLU A 137 4.260 -10.923 -36.254 1.00 0.00 O ATOM 1948 CB GLU A 137 6.819 -12.944 -36.470 1.00 0.00 C ATOM 1949 CG GLU A 137 6.539 -14.433 -36.599 1.00 0.00 C ATOM 1950 CD GLU A 137 7.781 -15.281 -36.397 1.00 0.00 C ATOM 1951 OE1 GLU A 137 8.629 -14.903 -35.564 1.00 0.00 O ATOM 1952 OE2 GLU A 137 7.904 -16.324 -37.074 1.00 0.00 O ATOM 0 H GLU A 137 6.706 -13.887 -34.195 1.00 0.00 H new ATOM 0 HA GLU A 137 6.482 -11.303 -35.111 1.00 0.00 H new ATOM 0 HB2 GLU A 137 6.581 -12.455 -37.414 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.885 -12.797 -36.295 1.00 0.00 H new ATOM 0 HG2 GLU A 137 5.784 -14.721 -35.868 1.00 0.00 H new ATOM 0 HG3 GLU A 137 6.122 -14.636 -37.585 1.00 0.00 H new ATOM 1959 N SER A 138 3.753 -13.039 -35.688 1.00 0.00 N ATOM 1960 CA SER A 138 2.369 -12.937 -36.104 1.00 0.00 C ATOM 1961 C SER A 138 1.427 -12.545 -34.962 1.00 0.00 C ATOM 1962 O SER A 138 0.209 -12.551 -35.142 1.00 0.00 O ATOM 1963 CB SER A 138 1.907 -14.259 -36.721 1.00 0.00 C ATOM 1964 OG SER A 138 2.817 -14.704 -37.712 1.00 0.00 O ATOM 0 H SER A 138 4.013 -13.951 -35.311 1.00 0.00 H new ATOM 0 HA SER A 138 2.324 -12.139 -36.845 1.00 0.00 H new ATOM 0 HB2 SER A 138 1.815 -15.015 -35.941 1.00 0.00 H new ATOM 0 HB3 SER A 138 0.918 -14.133 -37.161 1.00 0.00 H new ATOM 0 HG SER A 138 2.501 -15.551 -38.090 1.00 0.00 H new ATOM 1970 N ASP A 139 1.969 -12.219 -33.786 1.00 0.00 N ATOM 1971 CA ASP A 139 1.127 -11.855 -32.659 1.00 0.00 C ATOM 1972 C ASP A 139 1.362 -10.436 -32.175 1.00 0.00 C ATOM 1973 O ASP A 139 1.052 -10.091 -31.036 1.00 0.00 O ATOM 1974 CB ASP A 139 1.313 -12.831 -31.509 1.00 0.00 C ATOM 1975 CG ASP A 139 0.122 -12.852 -30.571 1.00 0.00 C ATOM 1976 OD1 ASP A 139 -0.630 -11.856 -30.543 1.00 0.00 O ATOM 1977 OD2 ASP A 139 -0.055 -13.865 -29.861 1.00 0.00 O ATOM 0 H ASP A 139 2.971 -12.201 -33.597 1.00 0.00 H new ATOM 0 HA ASP A 139 0.099 -11.906 -33.019 1.00 0.00 H new ATOM 0 HB2 ASP A 139 1.475 -13.832 -31.908 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.209 -12.562 -30.949 1.00 0.00 H new ATOM 1982 N ILE A 140 1.881 -9.623 -33.059 1.00 0.00 N ATOM 1983 CA ILE A 140 2.142 -8.230 -32.769 1.00 0.00 C ATOM 1984 C ILE A 140 1.132 -7.323 -33.458 1.00 0.00 C ATOM 1985 O ILE A 140 0.758 -7.542 -34.610 1.00 0.00 O ATOM 1986 CB ILE A 140 3.555 -7.782 -33.171 1.00 0.00 C ATOM 1987 CG1 ILE A 140 4.615 -8.697 -32.558 1.00 0.00 C ATOM 1988 CG2 ILE A 140 3.791 -6.344 -32.742 1.00 0.00 C ATOM 1989 CD1 ILE A 140 5.751 -9.029 -33.498 1.00 0.00 C ATOM 0 H ILE A 140 2.137 -9.906 -34.005 1.00 0.00 H new ATOM 0 HA ILE A 140 2.052 -8.141 -31.686 1.00 0.00 H new ATOM 0 HB ILE A 140 3.637 -7.847 -34.256 1.00 0.00 H new ATOM 0 HG12 ILE A 140 5.021 -8.220 -31.666 1.00 0.00 H new ATOM 0 HG13 ILE A 140 4.140 -9.623 -32.236 1.00 0.00 H new ATOM 0 HG21 ILE A 140 4.796 -6.038 -33.032 1.00 0.00 H new ATOM 0 HG22 ILE A 140 3.060 -5.696 -33.225 1.00 0.00 H new ATOM 0 HG23 ILE A 140 3.686 -6.265 -31.660 1.00 0.00 H new ATOM 0 HD11 ILE A 140 6.463 -9.682 -32.992 1.00 0.00 H new ATOM 0 HD12 ILE A 140 5.358 -9.535 -34.380 1.00 0.00 H new ATOM 0 HD13 ILE A 140 6.253 -8.110 -33.801 1.00 0.00 H new ATOM 2001 N LEU A 141 0.708 -6.304 -32.735 1.00 0.00 N ATOM 2002 CA LEU A 141 -0.256 -5.331 -33.242 1.00 0.00 C ATOM 2003 C LEU A 141 0.349 -3.931 -33.225 1.00 0.00 C ATOM 2004 O LEU A 141 0.974 -3.531 -32.241 1.00 0.00 O ATOM 2005 CB LEU A 141 -1.535 -5.359 -32.402 1.00 0.00 C ATOM 2006 CG LEU A 141 -2.626 -4.382 -32.848 1.00 0.00 C ATOM 2007 CD1 LEU A 141 -3.646 -5.089 -33.727 1.00 0.00 C ATOM 2008 CD2 LEU A 141 -3.305 -3.751 -31.642 1.00 0.00 C ATOM 0 H LEU A 141 1.018 -6.123 -31.780 1.00 0.00 H new ATOM 0 HA LEU A 141 -0.506 -5.595 -34.269 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -1.943 -6.370 -32.423 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.276 -5.142 -31.366 1.00 0.00 H new ATOM 0 HG LEU A 141 -2.160 -3.588 -33.432 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -4.414 -4.380 -34.035 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -3.149 -5.492 -34.610 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -4.107 -5.903 -33.167 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -4.077 -3.060 -31.980 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.758 -4.531 -31.030 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -2.567 -3.209 -31.051 1.00 0.00 H new ATOM 2020 N SER A 142 0.177 -3.190 -34.316 1.00 0.00 N ATOM 2021 CA SER A 142 0.730 -1.843 -34.403 1.00 0.00 C ATOM 2022 C SER A 142 -0.344 -0.772 -34.456 1.00 0.00 C ATOM 2023 O SER A 142 -1.446 -0.987 -34.961 1.00 0.00 O ATOM 2024 CB SER A 142 1.631 -1.703 -35.605 1.00 0.00 C ATOM 2025 OG SER A 142 2.186 -0.401 -35.680 1.00 0.00 O ATOM 0 H SER A 142 -0.335 -3.495 -35.144 1.00 0.00 H new ATOM 0 HA SER A 142 1.308 -1.695 -33.491 1.00 0.00 H new ATOM 0 HB2 SER A 142 2.432 -2.440 -35.550 1.00 0.00 H new ATOM 0 HB3 SER A 142 1.066 -1.913 -36.513 1.00 0.00 H new ATOM 0 HG SER A 142 2.155 -0.085 -36.607 1.00 0.00 H new ATOM 2031 N LEU A 143 0.013 0.388 -33.933 1.00 0.00 N ATOM 2032 CA LEU A 143 -0.876 1.541 -33.904 1.00 0.00 C ATOM 2033 C LEU A 143 -0.124 2.808 -34.301 1.00 0.00 C ATOM 2034 O LEU A 143 1.059 2.954 -33.998 1.00 0.00 O ATOM 2035 CB LEU A 143 -1.484 1.704 -32.508 1.00 0.00 C ATOM 2036 CG LEU A 143 -2.786 0.935 -32.275 1.00 0.00 C ATOM 2037 CD1 LEU A 143 -3.765 1.180 -33.412 1.00 0.00 C ATOM 2038 CD2 LEU A 143 -2.505 -0.552 -32.121 1.00 0.00 C ATOM 0 H LEU A 143 0.928 0.559 -33.516 1.00 0.00 H new ATOM 0 HA LEU A 143 -1.679 1.376 -34.622 1.00 0.00 H new ATOM 0 HB2 LEU A 143 -0.751 1.380 -31.769 1.00 0.00 H new ATOM 0 HB3 LEU A 143 -1.669 2.763 -32.330 1.00 0.00 H new ATOM 0 HG LEU A 143 -3.239 1.297 -31.352 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -4.684 0.624 -33.227 1.00 0.00 H new ATOM 0 HD12 LEU A 143 -3.991 2.244 -33.475 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -3.323 0.847 -34.351 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -3.442 -1.084 -31.956 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -2.029 -0.928 -33.027 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -1.843 -0.711 -31.270 1.00 0.00 H new ATOM 2050 N VAL A 144 -0.812 3.725 -34.975 1.00 0.00 N ATOM 2051 CA VAL A 144 -0.195 4.979 -35.400 1.00 0.00 C ATOM 2052 C VAL A 144 -0.865 6.175 -34.731 1.00 0.00 C ATOM 2053 O VAL A 144 -2.090 6.268 -34.688 1.00 0.00 O ATOM 2054 CB VAL A 144 -0.267 5.155 -36.929 1.00 0.00 C ATOM 2055 CG1 VAL A 144 0.532 6.377 -37.364 1.00 0.00 C ATOM 2056 CG2 VAL A 144 0.232 3.903 -37.635 1.00 0.00 C ATOM 0 H VAL A 144 -1.792 3.625 -35.238 1.00 0.00 H new ATOM 0 HA VAL A 144 0.851 4.933 -35.097 1.00 0.00 H new ATOM 0 HB VAL A 144 -1.308 5.311 -37.210 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.470 6.486 -38.447 1.00 0.00 H new ATOM 0 HG12 VAL A 144 0.124 7.268 -36.886 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.575 6.253 -37.071 1.00 0.00 H new ATOM 0 HG21 VAL A 144 0.174 4.046 -38.714 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.267 3.712 -37.350 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.386 3.052 -37.348 1.00 0.00 H new ATOM 2066 N ILE A 145 -0.053 7.083 -34.199 1.00 0.00 N ATOM 2067 CA ILE A 145 -0.550 8.252 -33.527 1.00 0.00 C ATOM 2068 C ILE A 145 -0.353 9.499 -34.388 1.00 0.00 C ATOM 2069 O ILE A 145 0.746 9.766 -34.871 1.00 0.00 O ATOM 2070 CB ILE A 145 0.191 8.414 -32.194 1.00 0.00 C ATOM 2071 CG1 ILE A 145 -0.267 7.336 -31.208 1.00 0.00 C ATOM 2072 CG2 ILE A 145 -0.022 9.801 -31.639 1.00 0.00 C ATOM 2073 CD1 ILE A 145 0.114 7.606 -29.767 1.00 0.00 C ATOM 0 H ILE A 145 0.965 7.018 -34.228 1.00 0.00 H new ATOM 0 HA ILE A 145 -1.618 8.131 -33.346 1.00 0.00 H new ATOM 0 HB ILE A 145 1.261 8.287 -32.359 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -1.351 7.238 -31.273 1.00 0.00 H new ATOM 0 HG13 ILE A 145 0.158 6.379 -31.511 1.00 0.00 H new ATOM 0 HG21 ILE A 145 0.510 9.900 -30.693 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.356 10.538 -32.347 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -1.087 9.968 -31.476 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -0.249 6.794 -29.137 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.199 7.673 -29.684 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -0.334 8.545 -29.442 1.00 0.00 H new ATOM 2085 N PHE A 146 -1.431 10.253 -34.574 1.00 0.00 N ATOM 2086 CA PHE A 146 -1.386 11.470 -35.378 1.00 0.00 C ATOM 2087 C PHE A 146 -1.681 12.699 -34.524 1.00 0.00 C ATOM 2088 O PHE A 146 -2.749 12.807 -33.923 1.00 0.00 O ATOM 2089 CB PHE A 146 -2.393 11.376 -36.524 1.00 0.00 C ATOM 2090 CG PHE A 146 -1.791 11.641 -37.872 1.00 0.00 C ATOM 2091 CD1 PHE A 146 -1.513 12.936 -38.278 1.00 0.00 C ATOM 2092 CD2 PHE A 146 -1.503 10.596 -38.735 1.00 0.00 C ATOM 2093 CE1 PHE A 146 -0.960 13.184 -39.519 1.00 0.00 C ATOM 2094 CE2 PHE A 146 -0.950 10.838 -39.976 1.00 0.00 C ATOM 2095 CZ PHE A 146 -0.677 12.134 -40.369 1.00 0.00 C ATOM 0 H PHE A 146 -2.348 10.043 -34.179 1.00 0.00 H new ATOM 0 HA PHE A 146 -0.382 11.572 -35.789 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -2.840 10.382 -36.524 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.199 12.088 -36.348 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -1.731 13.761 -37.616 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.714 9.581 -38.433 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -0.749 14.198 -39.824 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.731 10.015 -40.640 1.00 0.00 H new ATOM 0 HZ PHE A 146 -0.243 12.325 -41.339 1.00 0.00 H new ATOM 2105 N ILE A 147 -0.733 13.626 -34.477 1.00 0.00 N ATOM 2106 CA ILE A 147 -0.899 14.847 -33.701 1.00 0.00 C ATOM 2107 C ILE A 147 -1.647 15.910 -34.496 1.00 0.00 C ATOM 2108 O ILE A 147 -1.344 16.150 -35.665 1.00 0.00 O ATOM 2109 CB ILE A 147 0.446 15.420 -33.254 1.00 0.00 C ATOM 2110 CG1 ILE A 147 1.395 14.310 -32.797 1.00 0.00 C ATOM 2111 CG2 ILE A 147 0.244 16.441 -32.146 1.00 0.00 C ATOM 2112 CD1 ILE A 147 2.847 14.729 -32.788 1.00 0.00 C ATOM 0 H ILE A 147 0.159 13.555 -34.967 1.00 0.00 H new ATOM 0 HA ILE A 147 -1.480 14.576 -32.820 1.00 0.00 H new ATOM 0 HB ILE A 147 0.903 15.918 -34.109 1.00 0.00 H new ATOM 0 HG12 ILE A 147 1.111 13.989 -31.795 1.00 0.00 H new ATOM 0 HG13 ILE A 147 1.277 13.448 -33.454 1.00 0.00 H new ATOM 0 HG21 ILE A 147 1.211 16.840 -31.838 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -0.385 17.254 -32.510 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -0.239 15.963 -31.294 1.00 0.00 H new ATOM 0 HD11 ILE A 147 3.464 13.895 -32.454 1.00 0.00 H new ATOM 0 HD12 ILE A 147 3.147 15.023 -33.794 1.00 0.00 H new ATOM 0 HD13 ILE A 147 2.978 15.572 -32.109 1.00 0.00 H new ATOM 2124 N ASN A 148 -2.623 16.545 -33.856 1.00 0.00 N ATOM 2125 CA ASN A 148 -3.413 17.584 -34.507 1.00 0.00 C ATOM 2126 C ASN A 148 -2.652 18.907 -34.541 1.00 0.00 C ATOM 2127 O ASN A 148 -2.172 19.385 -33.514 1.00 0.00 O ATOM 2128 CB ASN A 148 -4.747 17.766 -33.781 1.00 0.00 C ATOM 2129 CG ASN A 148 -5.865 16.964 -34.417 1.00 0.00 C ATOM 2130 OD1 ASN A 148 -7.006 17.608 -34.636 1.00 0.00 O flip ATOM 2131 ND2 ASN A 148 -5.705 15.779 -34.710 1.00 0.00 N flip ATOM 0 H ASN A 148 -2.886 16.359 -32.888 1.00 0.00 H new ATOM 0 HA ASN A 148 -3.605 17.272 -35.534 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -4.635 17.465 -32.739 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -5.016 18.822 -33.780 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -4.811 15.324 -34.524 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -6.466 15.252 -35.139 1.00 0.00 H new ATOM 2138 N ASP A 149 -2.548 19.493 -35.730 1.00 0.00 N ATOM 2139 CA ASP A 149 -1.845 20.760 -35.898 1.00 0.00 C ATOM 2140 C ASP A 149 -2.669 21.918 -35.346 1.00 0.00 C ATOM 2141 O ASP A 149 -2.120 22.901 -34.848 1.00 0.00 O ATOM 2142 CB ASP A 149 -1.533 21.000 -37.375 1.00 0.00 C ATOM 2143 CG ASP A 149 -0.340 21.915 -37.573 1.00 0.00 C ATOM 2144 OD1 ASP A 149 0.537 21.946 -36.684 1.00 0.00 O ATOM 2145 OD2 ASP A 149 -0.283 22.600 -38.616 1.00 0.00 O ATOM 0 H ASP A 149 -2.941 19.111 -36.590 1.00 0.00 H new ATOM 0 HA ASP A 149 -0.911 20.705 -35.340 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -1.339 20.045 -37.862 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -2.406 21.435 -37.862 1.00 0.00 H new ATOM 2150 N LYS A 150 -3.990 21.797 -35.439 1.00 0.00 N ATOM 2151 CA LYS A 150 -4.887 22.830 -34.951 1.00 0.00 C ATOM 2152 C LYS A 150 -4.673 23.068 -33.461 1.00 0.00 C ATOM 2153 O LYS A 150 -4.596 24.210 -33.005 1.00 0.00 O ATOM 2154 CB LYS A 150 -6.344 22.440 -35.215 1.00 0.00 C ATOM 2155 CG LYS A 150 -6.942 23.118 -36.438 1.00 0.00 C ATOM 2156 CD LYS A 150 -7.601 22.113 -37.371 1.00 0.00 C ATOM 2157 CE LYS A 150 -6.721 21.807 -38.573 1.00 0.00 C ATOM 2158 NZ LYS A 150 -6.739 20.360 -38.921 1.00 0.00 N ATOM 0 H LYS A 150 -4.460 20.990 -35.850 1.00 0.00 H new ATOM 0 HA LYS A 150 -4.666 23.753 -35.486 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -6.405 21.359 -35.342 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -6.943 22.692 -34.340 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -7.677 23.858 -36.121 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -6.160 23.655 -36.975 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -7.808 21.192 -36.827 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -8.560 22.505 -37.711 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -7.060 22.390 -39.429 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -5.698 22.117 -38.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -6.127 20.194 -39.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -6.391 19.804 -38.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -7.712 20.070 -39.148 1.00 0.00 H new ATOM 2172 N PHE A 151 -4.576 21.979 -32.709 1.00 0.00 N ATOM 2173 CA PHE A 151 -4.369 22.054 -31.272 1.00 0.00 C ATOM 2174 C PHE A 151 -3.090 22.819 -30.947 1.00 0.00 C ATOM 2175 O PHE A 151 -3.068 23.660 -30.049 1.00 0.00 O ATOM 2176 CB PHE A 151 -4.301 20.648 -30.674 1.00 0.00 C ATOM 2177 CG PHE A 151 -4.441 20.624 -29.179 1.00 0.00 C ATOM 2178 CD1 PHE A 151 -5.686 20.761 -28.585 1.00 0.00 C ATOM 2179 CD2 PHE A 151 -3.331 20.460 -28.368 1.00 0.00 C ATOM 2180 CE1 PHE A 151 -5.819 20.737 -27.210 1.00 0.00 C ATOM 2181 CE2 PHE A 151 -3.457 20.436 -26.992 1.00 0.00 C ATOM 2182 CZ PHE A 151 -4.704 20.574 -26.413 1.00 0.00 C ATOM 0 H PHE A 151 -4.638 21.029 -33.075 1.00 0.00 H new ATOM 0 HA PHE A 151 -5.212 22.588 -30.834 1.00 0.00 H new ATOM 0 HB2 PHE A 151 -5.088 20.036 -31.114 1.00 0.00 H new ATOM 0 HB3 PHE A 151 -3.351 20.191 -30.949 1.00 0.00 H new ATOM 0 HD1 PHE A 151 -6.562 20.888 -29.204 1.00 0.00 H new ATOM 0 HD2 PHE A 151 -2.355 20.349 -28.816 1.00 0.00 H new ATOM 0 HE1 PHE A 151 -6.794 20.846 -26.759 1.00 0.00 H new ATOM 0 HE2 PHE A 151 -2.583 20.310 -26.371 1.00 0.00 H new ATOM 0 HZ PHE A 151 -4.806 20.554 -25.338 1.00 0.00 H new