USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 761 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 138 THR OG1 : rot -108:sc= 0.713 USER MOD Set 1.2: A 140 SER OG : rot 170:sc= -4.06! USER MOD Set 2.1: A 128 ASN : amide:sc= -4.05! C(o=-9.7!,f=-7.1!) USER MOD Set 2.2: A 131 ASN : amide:sc= -3.59! C(o=-9.7!,f=-20!) USER MOD Set 2.3: A 148 ASN : amide:sc= -2.04! C(o=-9.7!,f=-7.9!) USER MOD Set 3.1: A 56 TYR OH : rot 38:sc= -1.1 USER MOD Set 3.2: A 118 HIS : no HE2:sc= -7.79! C(o=-8.9!,f=-10!) USER MOD Single : A 41 GLN : amide:sc= -0.222 X(o=-0.22,f=-0.011) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 121:sc= 0.161 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -1.16 X(o=-1.2,f=-1.6!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -19:sc= 0.403 USER MOD Single : A 82 ASN : amide:sc= -0.687 K(o=-0.69,f=-1.9!) USER MOD Single : A 85 SER OG : rot -140:sc= -0.217 USER MOD Single : A 86 ASN : amide:sc= -3.4 K(o=-3.4,f=-5.2!) USER MOD Single : A 87 ASN : amide:sc= -0.584 K(o=-0.58,f=0) USER MOD Single : A 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 MET CE :methyl -110:sc= -3.53! (180deg=-5.58!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -5.08! C(o=-5.1!,f=-7!) USER MOD Single : A 96 THR OG1 : rot 76:sc= 0.888 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -140:sc= -0.568 USER MOD Single : A 102 THR OG1 : rot -32:sc= 0.473 USER MOD Single : A 106 ASN : amide:sc= -4.03 X(o=-4,f=-4.2!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 162:sc= -2.51! USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 66:sc= 0.158 USER MOD Single : A 125 GLN : amide:sc= 1.02 K(o=1,f=-0.32) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 HIS : no HE2:sc= -2.24! K(o=-2.2!,f=-0.58) USER MOD Single : A 146 SER OG : rot -143:sc= -2.53! USER MOD Single : A 150 HIS : no HD1:sc= -9.56! C(o=-9.6!,f=-11!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 37 6.282 -9.885 7.159 1.00 0.00 N ATOM 14 CA PHE A 37 7.347 -9.126 6.512 1.00 0.00 C ATOM 15 C PHE A 37 8.713 -9.511 7.073 1.00 0.00 C ATOM 16 O PHE A 37 9.664 -8.733 7.001 1.00 0.00 O ATOM 17 CB PHE A 37 7.115 -7.623 6.693 1.00 0.00 C ATOM 18 CG PHE A 37 5.679 -7.210 6.540 1.00 0.00 C ATOM 19 CD1 PHE A 37 4.953 -7.588 5.423 1.00 0.00 C ATOM 20 CD2 PHE A 37 5.057 -6.444 7.512 1.00 0.00 C ATOM 21 CE1 PHE A 37 3.630 -7.211 5.278 1.00 0.00 C ATOM 22 CE2 PHE A 37 3.736 -6.063 7.374 1.00 0.00 C ATOM 23 CZ PHE A 37 3.021 -6.447 6.255 1.00 0.00 C ATOM 0 HA PHE A 37 7.331 -9.365 5.449 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.465 -7.327 7.682 1.00 0.00 H new ATOM 0 HB3 PHE A 37 7.719 -7.081 5.965 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.425 -8.184 4.656 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.611 -6.141 8.388 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.074 -7.513 4.403 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.263 -5.466 8.139 1.00 0.00 H new ATOM 0 HZ PHE A 37 1.988 -6.150 6.145 1.00 0.00 H new ATOM 33 N ALA A 38 8.804 -10.714 7.632 1.00 0.00 N ATOM 34 CA ALA A 38 10.056 -11.197 8.204 1.00 0.00 C ATOM 35 C ALA A 38 11.038 -11.605 7.112 1.00 0.00 C ATOM 36 O ALA A 38 12.247 -11.410 7.247 1.00 0.00 O ATOM 37 CB ALA A 38 9.791 -12.364 9.143 1.00 0.00 C ATOM 0 H ALA A 38 8.027 -11.371 7.701 1.00 0.00 H new ATOM 0 HA ALA A 38 10.505 -10.383 8.772 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.734 -12.715 9.563 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.133 -12.040 9.949 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.316 -13.175 8.591 1.00 0.00 H new ATOM 43 N ASP A 39 10.513 -12.173 6.033 1.00 0.00 N ATOM 44 CA ASP A 39 11.343 -12.612 4.917 1.00 0.00 C ATOM 45 C ASP A 39 11.118 -11.745 3.679 1.00 0.00 C ATOM 46 O ASP A 39 11.654 -12.029 2.608 1.00 0.00 O ATOM 47 CB ASP A 39 11.050 -14.076 4.585 1.00 0.00 C ATOM 48 CG ASP A 39 11.937 -15.034 5.357 1.00 0.00 C ATOM 49 OD1 ASP A 39 12.996 -15.425 4.821 1.00 0.00 O ATOM 50 OD2 ASP A 39 11.574 -15.392 6.496 1.00 0.00 O ATOM 0 H ASP A 39 9.515 -12.341 5.907 1.00 0.00 H new ATOM 0 HA ASP A 39 12.386 -12.510 5.218 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.005 -14.294 4.807 1.00 0.00 H new ATOM 0 HB3 ASP A 39 11.189 -14.238 3.516 1.00 0.00 H new ATOM 55 N ALA A 40 10.325 -10.686 3.827 1.00 0.00 N ATOM 56 CA ALA A 40 10.039 -9.785 2.717 1.00 0.00 C ATOM 57 C ALA A 40 11.295 -9.042 2.279 1.00 0.00 C ATOM 58 O ALA A 40 12.042 -8.522 3.108 1.00 0.00 O ATOM 59 CB ALA A 40 8.948 -8.799 3.105 1.00 0.00 C ATOM 0 H ALA A 40 9.870 -10.432 4.704 1.00 0.00 H new ATOM 0 HA ALA A 40 9.689 -10.383 1.876 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.745 -8.133 2.267 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.040 -9.344 3.363 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.276 -8.213 3.963 1.00 0.00 H new ATOM 65 N GLN A 41 11.523 -8.992 0.970 1.00 0.00 N ATOM 66 CA GLN A 41 12.689 -8.308 0.425 1.00 0.00 C ATOM 67 C GLN A 41 12.639 -6.820 0.749 1.00 0.00 C ATOM 68 O GLN A 41 11.625 -6.316 1.233 1.00 0.00 O ATOM 69 CB GLN A 41 12.767 -8.515 -1.090 1.00 0.00 C ATOM 70 CG GLN A 41 13.759 -9.590 -1.505 1.00 0.00 C ATOM 71 CD GLN A 41 15.198 -9.123 -1.408 1.00 0.00 C ATOM 72 OE1 GLN A 41 16.025 -9.756 -0.752 1.00 0.00 O ATOM 73 NE2 GLN A 41 15.503 -8.008 -2.062 1.00 0.00 N ATOM 0 H GLN A 41 10.916 -9.417 0.269 1.00 0.00 H new ATOM 0 HA GLN A 41 13.581 -8.733 0.885 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.778 -8.781 -1.464 1.00 0.00 H new ATOM 0 HB3 GLN A 41 13.045 -7.573 -1.564 1.00 0.00 H new ATOM 0 HG2 GLN A 41 13.623 -10.468 -0.874 1.00 0.00 H new ATOM 0 HG3 GLN A 41 13.549 -9.897 -2.529 1.00 0.00 H new ATOM 0 HE21 GLN A 41 14.785 -7.516 -2.593 1.00 0.00 H new ATOM 0 HE22 GLN A 41 16.455 -7.644 -2.033 1.00 0.00 H new ATOM 82 N THR A 42 13.735 -6.121 0.479 1.00 0.00 N ATOM 83 CA THR A 42 13.804 -4.689 0.745 1.00 0.00 C ATOM 84 C THR A 42 14.566 -3.964 -0.359 1.00 0.00 C ATOM 85 O THR A 42 15.356 -4.567 -1.086 1.00 0.00 O ATOM 86 CB THR A 42 14.465 -4.423 2.102 1.00 0.00 C ATOM 87 OG1 THR A 42 14.963 -5.624 2.665 1.00 0.00 O ATOM 88 CG2 THR A 42 13.525 -3.799 3.111 1.00 0.00 C ATOM 0 H THR A 42 14.584 -6.520 0.078 1.00 0.00 H new ATOM 0 HA THR A 42 12.784 -4.305 0.769 1.00 0.00 H new ATOM 0 HB THR A 42 15.273 -3.721 1.896 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.382 -5.431 3.530 1.00 0.00 H new ATOM 0 HG21 THR A 42 14.055 -3.637 4.050 1.00 0.00 H new ATOM 0 HG22 THR A 42 13.163 -2.845 2.729 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.680 -4.466 3.282 1.00 0.00 H new ATOM 96 N ARG A 43 14.317 -2.666 -0.475 1.00 0.00 N ATOM 97 CA ARG A 43 14.969 -1.842 -1.486 1.00 0.00 C ATOM 98 C ARG A 43 14.708 -0.367 -1.209 1.00 0.00 C ATOM 99 O ARG A 43 13.734 -0.020 -0.546 1.00 0.00 O ATOM 100 CB ARG A 43 14.462 -2.218 -2.880 1.00 0.00 C ATOM 101 CG ARG A 43 15.051 -1.371 -3.997 1.00 0.00 C ATOM 102 CD ARG A 43 14.401 -1.687 -5.336 1.00 0.00 C ATOM 103 NE ARG A 43 13.682 -0.536 -5.880 1.00 0.00 N ATOM 104 CZ ARG A 43 14.207 0.330 -6.745 1.00 0.00 C ATOM 105 NH1 ARG A 43 15.462 0.197 -7.157 1.00 0.00 N ATOM 106 NH2 ARG A 43 13.475 1.338 -7.196 1.00 0.00 N ATOM 0 H ARG A 43 13.664 -2.158 0.122 1.00 0.00 H new ATOM 0 HA ARG A 43 16.044 -2.020 -1.446 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.694 -3.266 -3.070 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.376 -2.124 -2.899 1.00 0.00 H new ATOM 0 HG2 ARG A 43 14.915 -0.315 -3.765 1.00 0.00 H new ATOM 0 HG3 ARG A 43 16.125 -1.547 -4.062 1.00 0.00 H new ATOM 0 HD2 ARG A 43 15.166 -2.005 -6.045 1.00 0.00 H new ATOM 0 HD3 ARG A 43 13.711 -2.522 -5.216 1.00 0.00 H new ATOM 0 HE ARG A 43 12.719 -0.387 -5.578 1.00 0.00 H new ATOM 0 HH11 ARG A 43 16.033 -0.574 -6.811 1.00 0.00 H new ATOM 0 HH12 ARG A 43 15.855 0.866 -7.820 1.00 0.00 H new ATOM 0 HH21 ARG A 43 12.511 1.450 -6.881 1.00 0.00 H new ATOM 0 HH22 ARG A 43 13.875 2.002 -7.858 1.00 0.00 H new ATOM 120 N LYS A 44 15.581 0.501 -1.707 1.00 0.00 N ATOM 121 CA LYS A 44 15.425 1.930 -1.488 1.00 0.00 C ATOM 122 C LYS A 44 14.435 2.539 -2.470 1.00 0.00 C ATOM 123 O LYS A 44 14.439 2.227 -3.660 1.00 0.00 O ATOM 124 CB LYS A 44 16.774 2.638 -1.594 1.00 0.00 C ATOM 125 CG LYS A 44 17.160 3.360 -0.320 1.00 0.00 C ATOM 126 CD LYS A 44 18.343 4.289 -0.537 1.00 0.00 C ATOM 127 CE LYS A 44 18.809 4.913 0.768 1.00 0.00 C ATOM 128 NZ LYS A 44 17.947 6.056 1.175 1.00 0.00 N ATOM 0 H LYS A 44 16.397 0.241 -2.261 1.00 0.00 H new ATOM 0 HA LYS A 44 15.030 2.068 -0.482 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.544 1.907 -1.840 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.740 3.354 -2.416 1.00 0.00 H new ATOM 0 HG2 LYS A 44 16.309 3.934 0.045 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.407 2.630 0.451 1.00 0.00 H new ATOM 0 HD2 LYS A 44 19.165 3.734 -0.990 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.065 5.076 -1.239 1.00 0.00 H new ATOM 0 HE2 LYS A 44 18.805 4.157 1.554 1.00 0.00 H new ATOM 0 HE3 LYS A 44 19.838 5.255 0.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 18.298 6.454 2.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 17.971 6.789 0.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 16.969 5.725 1.303 1.00 0.00 H new ATOM 142 N LEU A 45 13.586 3.412 -1.946 1.00 0.00 N ATOM 143 CA LEU A 45 12.571 4.083 -2.746 1.00 0.00 C ATOM 144 C LEU A 45 13.168 5.251 -3.523 1.00 0.00 C ATOM 145 O LEU A 45 13.991 6.001 -3.001 1.00 0.00 O ATOM 146 CB LEU A 45 11.447 4.583 -1.835 1.00 0.00 C ATOM 147 CG LEU A 45 10.134 4.946 -2.540 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.789 3.922 -3.611 1.00 0.00 C ATOM 149 CD2 LEU A 45 9.005 5.054 -1.527 1.00 0.00 C ATOM 0 H LEU A 45 13.581 3.674 -0.960 1.00 0.00 H new ATOM 0 HA LEU A 45 12.170 3.368 -3.464 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.238 3.815 -1.090 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.804 5.461 -1.296 1.00 0.00 H new ATOM 0 HG LEU A 45 10.264 5.913 -3.026 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.854 4.203 -4.095 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.586 3.889 -4.353 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.679 2.939 -3.153 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.079 5.312 -2.041 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.882 4.099 -1.016 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.243 5.828 -0.798 1.00 0.00 H new ATOM 161 N THR A 46 12.742 5.401 -4.774 1.00 0.00 N ATOM 162 CA THR A 46 13.228 6.482 -5.623 1.00 0.00 C ATOM 163 C THR A 46 12.453 7.768 -5.350 1.00 0.00 C ATOM 164 O THR A 46 11.308 7.725 -4.901 1.00 0.00 O ATOM 165 CB THR A 46 13.095 6.100 -7.099 1.00 0.00 C ATOM 166 OG1 THR A 46 11.749 6.215 -7.527 1.00 0.00 O ATOM 167 CG2 THR A 46 13.555 4.690 -7.399 1.00 0.00 C ATOM 0 H THR A 46 12.061 4.787 -5.221 1.00 0.00 H new ATOM 0 HA THR A 46 14.280 6.650 -5.393 1.00 0.00 H new ATOM 0 HB THR A 46 13.741 6.795 -7.636 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.695 6.854 -8.268 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.433 4.486 -8.463 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.605 4.584 -7.127 1.00 0.00 H new ATOM 0 HG23 THR A 46 12.958 3.982 -6.823 1.00 0.00 H new ATOM 175 N PRO A 47 13.064 8.934 -5.620 1.00 0.00 N ATOM 176 CA PRO A 47 12.415 10.229 -5.402 1.00 0.00 C ATOM 177 C PRO A 47 11.099 10.338 -6.161 1.00 0.00 C ATOM 178 O PRO A 47 10.120 10.883 -5.651 1.00 0.00 O ATOM 179 CB PRO A 47 13.432 11.249 -5.930 1.00 0.00 C ATOM 180 CG PRO A 47 14.388 10.461 -6.761 1.00 0.00 C ATOM 181 CD PRO A 47 14.422 9.085 -6.162 1.00 0.00 C ATOM 0 HA PRO A 47 12.159 10.385 -4.354 1.00 0.00 H new ATOM 0 HB2 PRO A 47 12.942 12.022 -6.522 1.00 0.00 H new ATOM 0 HB3 PRO A 47 13.946 11.752 -5.111 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.063 10.426 -7.801 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.379 10.915 -6.752 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.647 8.324 -6.909 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.180 9.001 -5.383 1.00 0.00 H new ATOM 189 N GLU A 48 11.077 9.804 -7.378 1.00 0.00 N ATOM 190 CA GLU A 48 9.875 9.832 -8.198 1.00 0.00 C ATOM 191 C GLU A 48 8.781 8.989 -7.552 1.00 0.00 C ATOM 192 O GLU A 48 7.646 9.439 -7.390 1.00 0.00 O ATOM 193 CB GLU A 48 10.177 9.313 -9.605 1.00 0.00 C ATOM 194 CG GLU A 48 10.494 10.415 -10.604 1.00 0.00 C ATOM 195 CD GLU A 48 10.399 9.943 -12.042 1.00 0.00 C ATOM 196 OE1 GLU A 48 10.718 8.765 -12.303 1.00 0.00 O ATOM 197 OE2 GLU A 48 10.004 10.754 -12.907 1.00 0.00 O ATOM 0 H GLU A 48 11.877 9.348 -7.816 1.00 0.00 H new ATOM 0 HA GLU A 48 9.529 10.863 -8.274 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.021 8.624 -9.556 1.00 0.00 H new ATOM 0 HB3 GLU A 48 9.320 8.743 -9.965 1.00 0.00 H new ATOM 0 HG2 GLU A 48 9.806 11.247 -10.452 1.00 0.00 H new ATOM 0 HG3 GLU A 48 11.499 10.794 -10.415 1.00 0.00 H new ATOM 204 N GLU A 49 9.137 7.765 -7.174 1.00 0.00 N ATOM 205 CA GLU A 49 8.193 6.860 -6.533 1.00 0.00 C ATOM 206 C GLU A 49 7.754 7.416 -5.183 1.00 0.00 C ATOM 207 O GLU A 49 6.592 7.291 -4.796 1.00 0.00 O ATOM 208 CB GLU A 49 8.819 5.476 -6.352 1.00 0.00 C ATOM 209 CG GLU A 49 9.058 4.740 -7.660 1.00 0.00 C ATOM 210 CD GLU A 49 10.138 3.682 -7.545 1.00 0.00 C ATOM 211 OE1 GLU A 49 10.980 3.791 -6.630 1.00 0.00 O ATOM 212 OE2 GLU A 49 10.142 2.746 -8.372 1.00 0.00 O ATOM 0 H GLU A 49 10.072 7.379 -7.301 1.00 0.00 H new ATOM 0 HA GLU A 49 7.317 6.767 -7.175 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.768 5.582 -5.826 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.169 4.872 -5.719 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.129 4.271 -7.984 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.339 5.458 -8.431 1.00 0.00 H new ATOM 219 N ARG A 50 8.692 8.037 -4.476 1.00 0.00 N ATOM 220 CA ARG A 50 8.403 8.621 -3.172 1.00 0.00 C ATOM 221 C ARG A 50 7.518 9.852 -3.328 1.00 0.00 C ATOM 222 O ARG A 50 6.648 10.117 -2.497 1.00 0.00 O ATOM 223 CB ARG A 50 9.703 8.992 -2.455 1.00 0.00 C ATOM 224 CG ARG A 50 9.981 8.148 -1.222 1.00 0.00 C ATOM 225 CD ARG A 50 10.927 8.857 -0.267 1.00 0.00 C ATOM 226 NE ARG A 50 12.312 8.421 -0.443 1.00 0.00 N ATOM 227 CZ ARG A 50 13.370 9.213 -0.279 1.00 0.00 C ATOM 228 NH1 ARG A 50 13.217 10.478 0.093 1.00 0.00 N ATOM 229 NH2 ARG A 50 14.591 8.735 -0.481 1.00 0.00 N ATOM 0 H ARG A 50 9.658 8.149 -4.784 1.00 0.00 H new ATOM 0 HA ARG A 50 7.872 7.883 -2.571 1.00 0.00 H new ATOM 0 HB2 ARG A 50 10.535 8.887 -3.152 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.661 10.042 -2.164 1.00 0.00 H new ATOM 0 HG2 ARG A 50 9.044 7.927 -0.711 1.00 0.00 H new ATOM 0 HG3 ARG A 50 10.413 7.193 -1.522 1.00 0.00 H new ATOM 0 HD2 ARG A 50 10.863 9.933 -0.426 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.615 8.667 0.760 1.00 0.00 H new ATOM 0 HE ARG A 50 12.478 7.450 -0.708 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.282 10.852 0.256 1.00 0.00 H new ATOM 0 HH12 ARG A 50 14.034 11.076 0.216 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.718 7.763 -0.761 1.00 0.00 H new ATOM 0 HH22 ARG A 50 15.403 9.340 -0.356 1.00 0.00 H new ATOM 243 N SER A 51 7.744 10.599 -4.403 1.00 0.00 N ATOM 244 CA SER A 51 6.968 11.800 -4.677 1.00 0.00 C ATOM 245 C SER A 51 5.532 11.438 -5.041 1.00 0.00 C ATOM 246 O SER A 51 4.597 12.172 -4.723 1.00 0.00 O ATOM 247 CB SER A 51 7.609 12.602 -5.811 1.00 0.00 C ATOM 248 OG SER A 51 7.022 13.887 -5.923 1.00 0.00 O ATOM 0 H SER A 51 8.460 10.392 -5.099 1.00 0.00 H new ATOM 0 HA SER A 51 6.956 12.413 -3.775 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.679 12.702 -5.630 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.494 12.063 -6.752 1.00 0.00 H new ATOM 0 HG SER A 51 7.450 14.380 -6.654 1.00 0.00 H new ATOM 254 N ALA A 52 5.365 10.299 -5.703 1.00 0.00 N ATOM 255 CA ALA A 52 4.042 9.838 -6.100 1.00 0.00 C ATOM 256 C ALA A 52 3.255 9.356 -4.890 1.00 0.00 C ATOM 257 O ALA A 52 2.085 9.698 -4.717 1.00 0.00 O ATOM 258 CB ALA A 52 4.156 8.730 -7.137 1.00 0.00 C ATOM 0 H ALA A 52 6.128 9.679 -5.975 1.00 0.00 H new ATOM 0 HA ALA A 52 3.505 10.676 -6.545 1.00 0.00 H new ATOM 0 HB1 ALA A 52 3.159 8.396 -7.424 1.00 0.00 H new ATOM 0 HB2 ALA A 52 4.679 9.107 -8.016 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.712 7.893 -6.715 1.00 0.00 H new ATOM 264 N VAL A 53 3.911 8.565 -4.052 1.00 0.00 N ATOM 265 CA VAL A 53 3.282 8.036 -2.848 1.00 0.00 C ATOM 266 C VAL A 53 2.860 9.165 -1.918 1.00 0.00 C ATOM 267 O VAL A 53 1.782 9.123 -1.327 1.00 0.00 O ATOM 268 CB VAL A 53 4.228 7.080 -2.097 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.562 6.531 -0.842 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.665 5.948 -3.012 1.00 0.00 C ATOM 0 H VAL A 53 4.880 8.275 -4.183 1.00 0.00 H new ATOM 0 HA VAL A 53 2.399 7.480 -3.161 1.00 0.00 H new ATOM 0 HB VAL A 53 5.111 7.640 -1.790 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.250 5.859 -0.329 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.299 7.355 -0.179 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.660 5.985 -1.118 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.333 5.279 -2.470 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.789 5.392 -3.347 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.186 6.359 -3.876 1.00 0.00 H new ATOM 280 N GLU A 54 3.711 10.175 -1.794 1.00 0.00 N ATOM 281 CA GLU A 54 3.416 11.315 -0.938 1.00 0.00 C ATOM 282 C GLU A 54 2.278 12.144 -1.526 1.00 0.00 C ATOM 283 O GLU A 54 1.405 12.623 -0.802 1.00 0.00 O ATOM 284 CB GLU A 54 4.668 12.178 -0.738 1.00 0.00 C ATOM 285 CG GLU A 54 5.016 13.057 -1.929 1.00 0.00 C ATOM 286 CD GLU A 54 6.118 14.050 -1.618 1.00 0.00 C ATOM 287 OE1 GLU A 54 7.234 13.610 -1.272 1.00 0.00 O ATOM 288 OE2 GLU A 54 5.865 15.270 -1.719 1.00 0.00 O ATOM 0 H GLU A 54 4.609 10.228 -2.274 1.00 0.00 H new ATOM 0 HA GLU A 54 3.100 10.942 0.036 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.523 12.812 0.137 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.514 11.526 -0.522 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.325 12.427 -2.763 1.00 0.00 H new ATOM 0 HG3 GLU A 54 4.125 13.597 -2.250 1.00 0.00 H new ATOM 295 N ASN A 55 2.290 12.297 -2.846 1.00 0.00 N ATOM 296 CA ASN A 55 1.254 13.054 -3.538 1.00 0.00 C ATOM 297 C ASN A 55 -0.074 12.305 -3.470 1.00 0.00 C ATOM 298 O ASN A 55 -1.138 12.907 -3.310 1.00 0.00 O ATOM 299 CB ASN A 55 1.674 13.308 -4.999 1.00 0.00 C ATOM 300 CG ASN A 55 0.619 12.903 -6.014 1.00 0.00 C ATOM 301 OD1 ASN A 55 -0.522 13.361 -5.961 1.00 0.00 O ATOM 302 ND2 ASN A 55 1.003 12.041 -6.949 1.00 0.00 N ATOM 0 H ASN A 55 3.006 11.906 -3.458 1.00 0.00 H new ATOM 0 HA ASN A 55 1.125 14.019 -3.048 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.899 14.367 -5.125 1.00 0.00 H new ATOM 0 HB3 ASN A 55 2.593 12.760 -5.205 1.00 0.00 H new ATOM 0 HD21 ASN A 55 0.341 11.733 -7.661 1.00 0.00 H new ATOM 0 HD22 ASN A 55 1.960 11.687 -6.954 1.00 0.00 H new ATOM 309 N TYR A 56 0.003 10.985 -3.587 1.00 0.00 N ATOM 310 CA TYR A 56 -1.172 10.135 -3.536 1.00 0.00 C ATOM 311 C TYR A 56 -1.721 10.075 -2.111 1.00 0.00 C ATOM 312 O TYR A 56 -2.919 10.257 -1.885 1.00 0.00 O ATOM 313 CB TYR A 56 -0.804 8.739 -4.048 1.00 0.00 C ATOM 314 CG TYR A 56 -1.782 7.658 -3.665 1.00 0.00 C ATOM 315 CD1 TYR A 56 -1.477 6.751 -2.663 1.00 0.00 C ATOM 316 CD2 TYR A 56 -3.006 7.546 -4.306 1.00 0.00 C ATOM 317 CE1 TYR A 56 -2.365 5.761 -2.307 1.00 0.00 C ATOM 318 CE2 TYR A 56 -3.902 6.557 -3.957 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.578 5.666 -2.956 1.00 0.00 C ATOM 320 OH TYR A 56 -4.471 4.681 -2.602 1.00 0.00 O ATOM 0 H TYR A 56 0.879 10.479 -3.719 1.00 0.00 H new ATOM 0 HA TYR A 56 -1.954 10.548 -4.173 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -0.726 8.773 -5.135 1.00 0.00 H new ATOM 0 HB3 TYR A 56 0.181 8.473 -3.665 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -0.528 6.822 -2.153 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -3.262 8.243 -5.090 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -2.113 5.062 -1.523 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -4.852 6.481 -4.465 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.447 4.551 -1.631 1.00 0.00 H new ATOM 330 N LEU A 57 -0.831 9.842 -1.151 1.00 0.00 N ATOM 331 CA LEU A 57 -1.217 9.782 0.253 1.00 0.00 C ATOM 332 C LEU A 57 -1.745 11.140 0.709 1.00 0.00 C ATOM 333 O LEU A 57 -2.620 11.224 1.571 1.00 0.00 O ATOM 334 CB LEU A 57 -0.016 9.386 1.116 1.00 0.00 C ATOM 335 CG LEU A 57 0.446 7.936 0.971 1.00 0.00 C ATOM 336 CD1 LEU A 57 1.918 7.810 1.334 1.00 0.00 C ATOM 337 CD2 LEU A 57 -0.400 7.024 1.844 1.00 0.00 C ATOM 0 H LEU A 57 0.163 9.692 -1.321 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.001 9.033 0.366 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.819 10.042 0.870 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.266 9.567 2.161 1.00 0.00 H new ATOM 0 HG LEU A 57 0.322 7.632 -0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.232 6.772 1.226 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.511 8.440 0.671 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.067 8.128 2.366 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.060 5.994 1.731 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.303 7.326 2.887 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.445 7.097 1.541 1.00 0.00 H new ATOM 349 N GLU A 58 -1.202 12.206 0.120 1.00 0.00 N ATOM 350 CA GLU A 58 -1.615 13.563 0.460 1.00 0.00 C ATOM 351 C GLU A 58 -3.044 13.815 0.005 1.00 0.00 C ATOM 352 O GLU A 58 -3.881 14.283 0.778 1.00 0.00 O ATOM 353 CB GLU A 58 -0.673 14.586 -0.182 1.00 0.00 C ATOM 354 CG GLU A 58 0.428 15.066 0.750 1.00 0.00 C ATOM 355 CD GLU A 58 0.452 16.575 0.897 1.00 0.00 C ATOM 356 OE1 GLU A 58 -0.617 17.205 0.742 1.00 0.00 O ATOM 357 OE2 GLU A 58 1.539 17.129 1.167 1.00 0.00 O ATOM 0 H GLU A 58 -0.476 12.153 -0.594 1.00 0.00 H new ATOM 0 HA GLU A 58 -1.568 13.673 1.543 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.220 14.144 -1.069 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.255 15.445 -0.516 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.292 14.611 1.731 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.392 14.726 0.372 1.00 0.00 H new ATOM 364 N SER A 59 -3.323 13.480 -1.247 1.00 0.00 N ATOM 365 CA SER A 59 -4.662 13.647 -1.797 1.00 0.00 C ATOM 366 C SER A 59 -5.634 12.719 -1.078 1.00 0.00 C ATOM 367 O SER A 59 -6.832 12.987 -1.001 1.00 0.00 O ATOM 368 CB SER A 59 -4.665 13.354 -3.299 1.00 0.00 C ATOM 369 OG SER A 59 -4.562 14.549 -4.052 1.00 0.00 O ATOM 0 H SER A 59 -2.642 13.092 -1.900 1.00 0.00 H new ATOM 0 HA SER A 59 -4.977 14.680 -1.648 1.00 0.00 H new ATOM 0 HB2 SER A 59 -3.834 12.693 -3.545 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.581 12.829 -3.568 1.00 0.00 H new ATOM 0 HG SER A 59 -4.564 14.334 -5.008 1.00 0.00 H new ATOM 623 N SER A 78 -5.781 7.506 6.581 1.00 0.00 N ATOM 624 CA SER A 78 -4.571 8.022 5.956 1.00 0.00 C ATOM 625 C SER A 78 -3.353 7.736 6.827 1.00 0.00 C ATOM 626 O SER A 78 -3.395 7.898 8.046 1.00 0.00 O ATOM 627 CB SER A 78 -4.698 9.524 5.701 1.00 0.00 C ATOM 628 OG SER A 78 -5.380 10.167 6.764 1.00 0.00 O ATOM 0 HA SER A 78 -4.439 7.516 4.999 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.706 9.961 5.584 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.233 9.693 4.767 1.00 0.00 H new ATOM 0 HG SER A 78 -5.887 9.503 7.276 1.00 0.00 H new ATOM 634 N LEU A 79 -2.275 7.297 6.191 1.00 0.00 N ATOM 635 CA LEU A 79 -1.043 6.969 6.902 1.00 0.00 C ATOM 636 C LEU A 79 0.051 7.993 6.602 1.00 0.00 C ATOM 637 O LEU A 79 0.308 8.320 5.443 1.00 0.00 O ATOM 638 CB LEU A 79 -0.579 5.558 6.522 1.00 0.00 C ATOM 639 CG LEU A 79 -1.059 5.052 5.160 1.00 0.00 C ATOM 640 CD1 LEU A 79 -0.252 3.840 4.726 1.00 0.00 C ATOM 641 CD2 LEU A 79 -2.543 4.712 5.209 1.00 0.00 C ATOM 0 H LEU A 79 -2.227 7.159 5.182 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.244 6.998 7.973 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.511 5.537 6.535 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.920 4.863 7.289 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.910 5.846 4.428 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.608 3.494 3.755 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.801 4.112 4.651 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.369 3.043 5.460 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.867 4.354 4.232 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.714 3.936 5.955 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.112 5.603 5.476 1.00 0.00 H new ATOM 653 N ALA A 80 0.687 8.502 7.656 1.00 0.00 N ATOM 654 CA ALA A 80 1.747 9.496 7.511 1.00 0.00 C ATOM 655 C ALA A 80 3.096 8.834 7.257 1.00 0.00 C ATOM 656 O ALA A 80 3.510 7.941 7.995 1.00 0.00 O ATOM 657 CB ALA A 80 1.815 10.377 8.750 1.00 0.00 C ATOM 0 H ALA A 80 0.485 8.241 8.621 1.00 0.00 H new ATOM 0 HA ALA A 80 1.511 10.117 6.647 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.609 11.114 8.629 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.862 10.889 8.885 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.022 9.760 9.624 1.00 0.00 H new ATOM 663 N LEU A 81 3.778 9.279 6.207 1.00 0.00 N ATOM 664 CA LEU A 81 5.078 8.726 5.846 1.00 0.00 C ATOM 665 C LEU A 81 6.132 9.028 6.908 1.00 0.00 C ATOM 666 O LEU A 81 6.085 10.063 7.574 1.00 0.00 O ATOM 667 CB LEU A 81 5.534 9.281 4.494 1.00 0.00 C ATOM 668 CG LEU A 81 4.427 9.427 3.446 1.00 0.00 C ATOM 669 CD1 LEU A 81 4.055 10.891 3.257 1.00 0.00 C ATOM 670 CD2 LEU A 81 4.859 8.812 2.122 1.00 0.00 C ATOM 0 H LEU A 81 3.451 10.023 5.590 1.00 0.00 H new ATOM 0 HA LEU A 81 4.967 7.644 5.777 1.00 0.00 H new ATOM 0 HB2 LEU A 81 5.992 10.257 4.655 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.309 8.628 4.093 1.00 0.00 H new ATOM 0 HG LEU A 81 3.547 8.893 3.803 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.267 10.972 2.508 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.701 11.301 4.203 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.930 11.449 2.924 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.059 8.925 1.390 1.00 0.00 H new ATOM 0 HD22 LEU A 81 5.755 9.317 1.762 1.00 0.00 H new ATOM 0 HD23 LEU A 81 5.072 7.753 2.265 1.00 0.00 H new ATOM 682 N ASN A 82 7.084 8.112 7.050 1.00 0.00 N ATOM 683 CA ASN A 82 8.165 8.254 8.017 1.00 0.00 C ATOM 684 C ASN A 82 9.504 7.936 7.361 1.00 0.00 C ATOM 685 O ASN A 82 9.560 7.635 6.169 1.00 0.00 O ATOM 686 CB ASN A 82 7.941 7.325 9.210 1.00 0.00 C ATOM 687 CG ASN A 82 7.013 7.924 10.248 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.687 9.110 10.197 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.585 7.102 11.197 1.00 0.00 N ATOM 0 H ASN A 82 7.128 7.254 6.500 1.00 0.00 H new ATOM 0 HA ASN A 82 8.176 9.285 8.371 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.525 6.381 8.858 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.901 7.097 9.674 1.00 0.00 H new ATOM 0 HD21 ASN A 82 5.959 7.446 11.925 1.00 0.00 H new ATOM 0 HD22 ASN A 82 6.882 6.126 11.199 1.00 0.00 H new ATOM 696 N ALA A 83 10.582 7.996 8.139 1.00 0.00 N ATOM 697 CA ALA A 83 11.911 7.701 7.612 1.00 0.00 C ATOM 698 C ALA A 83 11.923 6.350 6.902 1.00 0.00 C ATOM 699 O ALA A 83 12.656 6.151 5.933 1.00 0.00 O ATOM 700 CB ALA A 83 12.945 7.726 8.725 1.00 0.00 C ATOM 0 H ALA A 83 10.562 8.244 9.128 1.00 0.00 H new ATOM 0 HA ALA A 83 12.168 8.472 6.885 1.00 0.00 H new ATOM 0 HB1 ALA A 83 13.929 7.504 8.312 1.00 0.00 H new ATOM 0 HB2 ALA A 83 12.959 8.714 9.186 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.689 6.979 9.476 1.00 0.00 H new ATOM 706 N GLU A 84 11.092 5.429 7.384 1.00 0.00 N ATOM 707 CA GLU A 84 10.992 4.102 6.788 1.00 0.00 C ATOM 708 C GLU A 84 10.394 4.194 5.386 1.00 0.00 C ATOM 709 O GLU A 84 10.559 3.290 4.567 1.00 0.00 O ATOM 710 CB GLU A 84 10.136 3.188 7.667 1.00 0.00 C ATOM 711 CG GLU A 84 10.650 1.759 7.744 1.00 0.00 C ATOM 712 CD GLU A 84 9.810 0.793 6.930 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.307 1.200 5.861 1.00 0.00 O ATOM 714 OE2 GLU A 84 9.657 -0.368 7.360 1.00 0.00 O ATOM 0 H GLU A 84 10.479 5.578 8.185 1.00 0.00 H new ATOM 0 HA GLU A 84 11.994 3.679 6.714 1.00 0.00 H new ATOM 0 HB2 GLU A 84 10.092 3.604 8.674 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.117 3.178 7.281 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.680 1.728 7.389 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.662 1.436 8.785 1.00 0.00 H new ATOM 721 N SER A 85 9.704 5.303 5.118 1.00 0.00 N ATOM 722 CA SER A 85 9.082 5.534 3.820 1.00 0.00 C ATOM 723 C SER A 85 10.099 5.417 2.684 1.00 0.00 C ATOM 724 O SER A 85 9.724 5.281 1.520 1.00 0.00 O ATOM 725 CB SER A 85 8.427 6.916 3.786 1.00 0.00 C ATOM 726 OG SER A 85 7.476 7.006 2.740 1.00 0.00 O ATOM 0 H SER A 85 9.563 6.058 5.789 1.00 0.00 H new ATOM 0 HA SER A 85 8.321 4.767 3.676 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.941 7.115 4.741 1.00 0.00 H new ATOM 0 HB3 SER A 85 9.192 7.681 3.652 1.00 0.00 H new ATOM 0 HG SER A 85 7.538 7.887 2.316 1.00 0.00 H new ATOM 732 N ASN A 86 11.385 5.468 3.022 1.00 0.00 N ATOM 733 CA ASN A 86 12.434 5.363 2.018 1.00 0.00 C ATOM 734 C ASN A 86 12.826 3.909 1.779 1.00 0.00 C ATOM 735 O ASN A 86 13.443 3.585 0.767 1.00 0.00 O ATOM 736 CB ASN A 86 13.662 6.161 2.445 1.00 0.00 C ATOM 737 CG ASN A 86 13.316 7.570 2.878 1.00 0.00 C ATOM 738 OD1 ASN A 86 12.371 7.786 3.638 1.00 0.00 O ATOM 739 ND2 ASN A 86 14.082 8.537 2.395 1.00 0.00 N ATOM 0 H ASN A 86 11.722 5.581 3.978 1.00 0.00 H new ATOM 0 HA ASN A 86 12.043 5.773 1.087 1.00 0.00 H new ATOM 0 HB2 ASN A 86 14.160 5.644 3.265 1.00 0.00 H new ATOM 0 HB3 ASN A 86 14.370 6.202 1.618 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.900 9.508 2.650 1.00 0.00 H new ATOM 0 HD22 ASN A 86 14.854 8.311 1.768 1.00 0.00 H new ATOM 746 N ASN A 87 12.470 3.034 2.713 1.00 0.00 N ATOM 747 CA ASN A 87 12.800 1.621 2.582 1.00 0.00 C ATOM 748 C ASN A 87 11.571 0.813 2.177 1.00 0.00 C ATOM 749 O ASN A 87 10.682 0.570 2.991 1.00 0.00 O ATOM 750 CB ASN A 87 13.352 1.086 3.903 1.00 0.00 C ATOM 751 CG ASN A 87 14.311 2.050 4.571 1.00 0.00 C ATOM 752 OD1 ASN A 87 15.265 2.525 3.955 1.00 0.00 O ATOM 753 ND2 ASN A 87 14.060 2.345 5.842 1.00 0.00 N ATOM 0 H ASN A 87 11.958 3.276 3.561 1.00 0.00 H new ATOM 0 HA ASN A 87 13.557 1.519 1.805 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.524 0.877 4.580 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.862 0.140 3.722 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.670 2.989 6.346 1.00 0.00 H new ATOM 0 HD22 ASN A 87 13.257 1.928 6.314 1.00 0.00 H new ATOM 760 N VAL A 88 11.537 0.390 0.918 1.00 0.00 N ATOM 761 CA VAL A 88 10.421 -0.398 0.406 1.00 0.00 C ATOM 762 C VAL A 88 10.572 -1.872 0.771 1.00 0.00 C ATOM 763 O VAL A 88 11.680 -2.409 0.792 1.00 0.00 O ATOM 764 CB VAL A 88 10.295 -0.267 -1.125 1.00 0.00 C ATOM 765 CG1 VAL A 88 9.085 -1.040 -1.633 1.00 0.00 C ATOM 766 CG2 VAL A 88 10.207 1.196 -1.531 1.00 0.00 C ATOM 0 H VAL A 88 12.269 0.579 0.233 1.00 0.00 H new ATOM 0 HA VAL A 88 9.517 -0.004 0.871 1.00 0.00 H new ATOM 0 HB VAL A 88 11.188 -0.695 -1.580 1.00 0.00 H new ATOM 0 HG11 VAL A 88 9.014 -0.935 -2.716 1.00 0.00 H new ATOM 0 HG12 VAL A 88 9.193 -2.094 -1.377 1.00 0.00 H new ATOM 0 HG13 VAL A 88 8.181 -0.645 -1.170 1.00 0.00 H new ATOM 0 HG21 VAL A 88 10.119 1.268 -2.615 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.333 1.651 -1.065 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.106 1.719 -1.205 1.00 0.00 H new ATOM 776 N MET A 89 9.445 -2.520 1.053 1.00 0.00 N ATOM 777 CA MET A 89 9.435 -3.934 1.413 1.00 0.00 C ATOM 778 C MET A 89 8.678 -4.743 0.362 1.00 0.00 C ATOM 779 O MET A 89 7.540 -4.424 0.024 1.00 0.00 O ATOM 780 CB MET A 89 8.796 -4.122 2.794 1.00 0.00 C ATOM 781 CG MET A 89 9.805 -4.404 3.895 1.00 0.00 C ATOM 782 SD MET A 89 10.724 -2.933 4.388 1.00 0.00 S ATOM 783 CE MET A 89 11.339 -3.439 5.992 1.00 0.00 C ATOM 0 H MET A 89 8.522 -2.085 1.039 1.00 0.00 H new ATOM 0 HA MET A 89 10.463 -4.294 1.452 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.232 -3.225 3.050 1.00 0.00 H new ATOM 0 HB3 MET A 89 8.082 -4.945 2.747 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.286 -4.811 4.763 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.504 -5.168 3.555 1.00 0.00 H new ATOM 0 HE1 MET A 89 11.929 -2.632 6.426 1.00 0.00 H new ATOM 0 HE2 MET A 89 10.499 -3.668 6.648 1.00 0.00 H new ATOM 0 HE3 MET A 89 11.964 -4.325 5.879 1.00 0.00 H new ATOM 793 N MET A 90 9.322 -5.785 -0.156 1.00 0.00 N ATOM 794 CA MET A 90 8.712 -6.631 -1.181 1.00 0.00 C ATOM 795 C MET A 90 8.276 -7.969 -0.592 1.00 0.00 C ATOM 796 O MET A 90 9.044 -8.623 0.113 1.00 0.00 O ATOM 797 CB MET A 90 9.688 -6.875 -2.343 1.00 0.00 C ATOM 798 CG MET A 90 10.816 -5.853 -2.452 1.00 0.00 C ATOM 799 SD MET A 90 10.693 -4.832 -3.933 1.00 0.00 S ATOM 800 CE MET A 90 11.209 -3.244 -3.284 1.00 0.00 C ATOM 0 H MET A 90 10.265 -6.065 0.116 1.00 0.00 H new ATOM 0 HA MET A 90 7.834 -6.107 -1.560 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.125 -7.867 -2.231 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.126 -6.877 -3.277 1.00 0.00 H new ATOM 0 HG2 MET A 90 10.804 -5.211 -1.571 1.00 0.00 H new ATOM 0 HG3 MET A 90 11.773 -6.374 -2.454 1.00 0.00 H new ATOM 0 HE1 MET A 90 10.353 -2.569 -3.250 1.00 0.00 H new ATOM 0 HE2 MET A 90 11.608 -3.374 -2.278 1.00 0.00 H new ATOM 0 HE3 MET A 90 11.980 -2.821 -3.928 1.00 0.00 H new ATOM 810 N LEU A 91 7.042 -8.374 -0.882 1.00 0.00 N ATOM 811 CA LEU A 91 6.524 -9.638 -0.372 1.00 0.00 C ATOM 812 C LEU A 91 5.357 -10.156 -1.195 1.00 0.00 C ATOM 813 O LEU A 91 4.492 -9.391 -1.618 1.00 0.00 O ATOM 814 CB LEU A 91 6.054 -9.479 1.075 1.00 0.00 C ATOM 815 CG LEU A 91 4.892 -8.499 1.263 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.755 -9.150 2.033 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.362 -7.239 1.972 1.00 0.00 C ATOM 0 H LEU A 91 6.388 -7.849 -1.463 1.00 0.00 H new ATOM 0 HA LEU A 91 7.343 -10.354 -0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.754 -10.455 1.455 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.896 -9.145 1.682 1.00 0.00 H new ATOM 0 HG LEU A 91 4.521 -8.221 0.276 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.941 -8.435 2.154 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.395 -10.020 1.484 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.112 -9.463 3.014 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.522 -6.556 2.096 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.764 -7.501 2.951 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.138 -6.756 1.379 1.00 0.00 H new ATOM 829 N THR A 92 5.304 -11.472 -1.358 1.00 0.00 N ATOM 830 CA THR A 92 4.199 -12.098 -2.060 1.00 0.00 C ATOM 831 C THR A 92 3.151 -12.447 -1.017 1.00 0.00 C ATOM 832 O THR A 92 3.401 -13.265 -0.131 1.00 0.00 O ATOM 833 CB THR A 92 4.661 -13.351 -2.810 1.00 0.00 C ATOM 834 OG1 THR A 92 3.618 -13.861 -3.622 1.00 0.00 O ATOM 835 CG2 THR A 92 5.116 -14.468 -1.895 1.00 0.00 C ATOM 0 H THR A 92 6.012 -12.121 -1.014 1.00 0.00 H new ATOM 0 HA THR A 92 3.789 -11.420 -2.808 1.00 0.00 H new ATOM 0 HB THR A 92 5.511 -13.028 -3.411 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.932 -14.660 -4.095 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.429 -15.324 -2.493 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.954 -14.123 -1.289 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.293 -14.762 -1.243 1.00 0.00 H new ATOM 843 N HIS A 93 2.003 -11.787 -1.072 1.00 0.00 N ATOM 844 CA HIS A 93 0.976 -12.013 -0.067 1.00 0.00 C ATOM 845 C HIS A 93 -0.411 -11.613 -0.559 1.00 0.00 C ATOM 846 O HIS A 93 -0.553 -10.746 -1.422 1.00 0.00 O ATOM 847 CB HIS A 93 1.343 -11.203 1.178 1.00 0.00 C ATOM 848 CG HIS A 93 1.183 -11.939 2.468 1.00 0.00 C ATOM 849 ND1 HIS A 93 -0.035 -12.375 2.945 1.00 0.00 N ATOM 850 CD2 HIS A 93 2.100 -12.295 3.397 1.00 0.00 C ATOM 851 CE1 HIS A 93 0.138 -12.966 4.113 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.426 -12.933 4.410 1.00 0.00 N ATOM 0 H HIS A 93 1.762 -11.102 -1.789 1.00 0.00 H new ATOM 0 HA HIS A 93 0.935 -13.079 0.158 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.378 -10.873 1.089 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.724 -10.306 1.207 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.163 -12.112 3.351 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.640 -13.402 4.722 1.00 0.00 H new ATOM 0 HE2 HIS A 93 1.850 -13.318 5.254 1.00 0.00 H new ATOM 861 N ALA A 94 -1.431 -12.242 0.016 1.00 0.00 N ATOM 862 CA ALA A 94 -2.813 -11.951 -0.338 1.00 0.00 C ATOM 863 C ALA A 94 -3.311 -10.734 0.432 1.00 0.00 C ATOM 864 O ALA A 94 -3.158 -10.654 1.651 1.00 0.00 O ATOM 865 CB ALA A 94 -3.697 -13.156 -0.055 1.00 0.00 C ATOM 0 H ALA A 94 -1.324 -12.960 0.733 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.860 -11.730 -1.404 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.727 -12.923 -0.325 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.352 -14.007 -0.643 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.647 -13.403 1.005 1.00 0.00 H new ATOM 871 N ILE A 95 -3.898 -9.784 -0.283 1.00 0.00 N ATOM 872 CA ILE A 95 -4.404 -8.567 0.341 1.00 0.00 C ATOM 873 C ILE A 95 -5.867 -8.712 0.747 1.00 0.00 C ATOM 874 O ILE A 95 -6.724 -9.020 -0.081 1.00 0.00 O ATOM 875 CB ILE A 95 -4.272 -7.354 -0.601 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.938 -7.395 -1.349 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.408 -6.057 0.185 1.00 0.00 C ATOM 878 CD1 ILE A 95 -1.732 -7.232 -0.450 1.00 0.00 C ATOM 0 H ILE A 95 -4.036 -9.831 -1.293 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.797 -8.403 1.231 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.075 -7.398 -1.337 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.858 -8.343 -1.881 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.929 -6.606 -2.101 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.313 -5.209 -0.493 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.384 -6.026 0.670 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.625 -6.006 0.942 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.823 -7.271 -1.050 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.787 -6.271 0.062 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.716 -8.036 0.286 1.00 0.00 H new ATOM 890 N THR A 96 -6.147 -8.470 2.024 1.00 0.00 N ATOM 891 CA THR A 96 -7.509 -8.554 2.534 1.00 0.00 C ATOM 892 C THR A 96 -8.198 -7.202 2.390 1.00 0.00 C ATOM 893 O THR A 96 -7.540 -6.162 2.375 1.00 0.00 O ATOM 894 CB THR A 96 -7.517 -9.002 3.998 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.235 -9.454 4.394 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.502 -10.117 4.275 1.00 0.00 C ATOM 0 H THR A 96 -5.449 -8.215 2.723 1.00 0.00 H new ATOM 0 HA THR A 96 -8.053 -9.297 1.951 1.00 0.00 H new ATOM 0 HB THR A 96 -7.817 -8.122 4.567 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.648 -8.684 4.542 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.458 -10.388 5.330 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.509 -9.782 4.028 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.249 -10.985 3.667 1.00 0.00 H new ATOM 904 N ARG A 97 -9.518 -7.219 2.266 1.00 0.00 N ATOM 905 CA ARG A 97 -10.275 -5.983 2.101 1.00 0.00 C ATOM 906 C ARG A 97 -11.265 -5.767 3.239 1.00 0.00 C ATOM 907 O ARG A 97 -12.220 -6.527 3.399 1.00 0.00 O ATOM 908 CB ARG A 97 -11.021 -6.004 0.767 1.00 0.00 C ATOM 909 CG ARG A 97 -10.849 -4.734 -0.047 1.00 0.00 C ATOM 910 CD ARG A 97 -10.696 -5.042 -1.526 1.00 0.00 C ATOM 911 NE ARG A 97 -11.957 -5.460 -2.130 1.00 0.00 N ATOM 912 CZ ARG A 97 -12.935 -4.620 -2.457 1.00 0.00 C ATOM 913 NH1 ARG A 97 -12.803 -3.320 -2.223 1.00 0.00 N ATOM 914 NH2 ARG A 97 -14.048 -5.078 -3.013 1.00 0.00 N ATOM 0 H ARG A 97 -10.084 -8.067 2.276 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.564 -5.157 2.116 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.672 -6.853 0.179 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -12.083 -6.163 0.957 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -11.711 -4.084 0.104 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.973 -4.190 0.306 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -10.321 -4.159 -2.043 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -9.953 -5.828 -1.658 1.00 0.00 H new ATOM 0 HE ARG A 97 -12.096 -6.454 -2.312 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -11.950 -2.963 -1.792 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -13.554 -2.678 -2.475 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -14.156 -6.077 -3.191 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -14.797 -4.432 -3.263 1.00 0.00 H new ATOM 928 N TYR A 98 -11.040 -4.710 4.013 1.00 0.00 N ATOM 929 CA TYR A 98 -11.927 -4.377 5.117 1.00 0.00 C ATOM 930 C TYR A 98 -12.579 -3.020 4.876 1.00 0.00 C ATOM 931 O TYR A 98 -11.981 -1.977 5.144 1.00 0.00 O ATOM 932 CB TYR A 98 -11.150 -4.352 6.435 1.00 0.00 C ATOM 933 CG TYR A 98 -10.809 -5.724 6.968 1.00 0.00 C ATOM 934 CD1 TYR A 98 -9.832 -6.503 6.361 1.00 0.00 C ATOM 935 CD2 TYR A 98 -11.464 -6.241 8.078 1.00 0.00 C ATOM 936 CE1 TYR A 98 -9.517 -7.759 6.846 1.00 0.00 C ATOM 937 CE2 TYR A 98 -11.155 -7.495 8.570 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.181 -8.249 7.950 1.00 0.00 C ATOM 939 OH TYR A 98 -9.871 -9.498 8.437 1.00 0.00 O ATOM 0 H TYR A 98 -10.253 -4.072 3.895 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.703 -5.139 5.180 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.228 -3.789 6.292 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.737 -3.818 7.182 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -9.310 -6.121 5.496 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -12.228 -5.653 8.565 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -8.755 -8.353 6.363 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -11.673 -7.882 9.435 1.00 0.00 H new ATOM 0 HH TYR A 98 -10.429 -9.692 9.219 1.00 0.00 H new ATOM 949 N GLY A 99 -13.805 -3.038 4.364 1.00 0.00 N ATOM 950 CA GLY A 99 -14.511 -1.802 4.094 1.00 0.00 C ATOM 951 C GLY A 99 -15.233 -1.264 5.308 1.00 0.00 C ATOM 952 O GLY A 99 -15.984 -1.985 5.965 1.00 0.00 O ATOM 0 H GLY A 99 -14.321 -3.887 4.132 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.803 -1.054 3.737 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.231 -1.967 3.292 1.00 0.00 H new ATOM 956 N ILE A 100 -15.006 0.010 5.606 1.00 0.00 N ATOM 957 CA ILE A 100 -15.644 0.647 6.752 1.00 0.00 C ATOM 958 C ILE A 100 -15.963 2.117 6.479 1.00 0.00 C ATOM 959 O ILE A 100 -16.214 2.888 7.405 1.00 0.00 O ATOM 960 CB ILE A 100 -14.767 0.541 8.016 1.00 0.00 C ATOM 961 CG1 ILE A 100 -13.497 1.381 7.865 1.00 0.00 C ATOM 962 CG2 ILE A 100 -14.415 -0.912 8.296 1.00 0.00 C ATOM 963 CD1 ILE A 100 -13.652 2.801 8.362 1.00 0.00 C ATOM 0 H ILE A 100 -14.387 0.620 5.072 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.579 0.113 6.922 1.00 0.00 H new ATOM 0 HB ILE A 100 -15.334 0.930 8.862 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -12.685 0.900 8.411 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -13.207 1.401 6.815 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -13.796 -0.970 9.191 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -15.330 -1.485 8.449 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -13.867 -1.323 7.448 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.714 3.339 8.225 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -14.442 3.299 7.800 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -13.912 2.790 9.420 1.00 0.00 H new ATOM 975 N SER A 101 -15.956 2.497 5.205 1.00 0.00 N ATOM 976 CA SER A 101 -16.250 3.873 4.815 1.00 0.00 C ATOM 977 C SER A 101 -17.546 3.947 4.014 1.00 0.00 C ATOM 978 O SER A 101 -18.207 4.985 3.976 1.00 0.00 O ATOM 979 CB SER A 101 -15.099 4.440 3.983 1.00 0.00 C ATOM 980 OG SER A 101 -14.887 5.811 4.273 1.00 0.00 O ATOM 0 H SER A 101 -15.750 1.872 4.425 1.00 0.00 H new ATOM 0 HA SER A 101 -16.368 4.465 5.723 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.188 3.877 4.186 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.319 4.319 2.922 1.00 0.00 H new ATOM 0 HG SER A 101 -14.690 6.294 3.444 1.00 0.00 H new ATOM 986 N THR A 102 -17.897 2.837 3.373 1.00 0.00 N ATOM 987 CA THR A 102 -19.105 2.764 2.564 1.00 0.00 C ATOM 988 C THR A 102 -19.436 1.311 2.236 1.00 0.00 C ATOM 989 O THR A 102 -18.595 0.426 2.387 1.00 0.00 O ATOM 990 CB THR A 102 -18.924 3.560 1.270 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.479 4.876 1.547 1.00 0.00 O ATOM 992 CG2 THR A 102 -20.190 3.669 0.448 1.00 0.00 C ATOM 0 H THR A 102 -17.357 1.972 3.400 1.00 0.00 H new ATOM 0 HA THR A 102 -19.929 3.194 3.133 1.00 0.00 H new ATOM 0 HB THR A 102 -18.184 3.004 0.694 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.847 5.172 2.406 1.00 0.00 H new ATOM 0 HG21 THR A 102 -19.989 4.246 -0.455 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.532 2.671 0.173 1.00 0.00 H new ATOM 0 HG23 THR A 102 -20.962 4.168 1.033 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.662 1.070 1.788 1.00 0.00 N ATOM 1001 CA ASP A 103 -21.092 -0.280 1.441 1.00 0.00 C ATOM 1002 C ASP A 103 -20.971 -0.527 -0.060 1.00 0.00 C ATOM 1003 O ASP A 103 -21.629 -1.413 -0.607 1.00 0.00 O ATOM 1004 CB ASP A 103 -22.534 -0.507 1.888 1.00 0.00 C ATOM 1005 CG ASP A 103 -22.625 -1.032 3.306 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -23.140 -0.302 4.178 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -22.182 -2.175 3.545 1.00 0.00 O ATOM 0 H ASP A 103 -21.374 1.788 1.657 1.00 0.00 H new ATOM 0 HA ASP A 103 -20.440 -0.983 1.959 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -23.086 0.430 1.815 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -23.014 -1.213 1.211 1.00 0.00 H new ATOM 1012 N ASP A 104 -20.125 0.255 -0.722 1.00 0.00 N ATOM 1013 CA ASP A 104 -19.918 0.113 -2.158 1.00 0.00 C ATOM 1014 C ASP A 104 -18.431 0.185 -2.489 1.00 0.00 C ATOM 1015 O ASP A 104 -17.715 1.010 -1.929 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.677 1.204 -2.915 1.00 0.00 C ATOM 1017 CG ASP A 104 -22.170 0.942 -2.964 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -22.704 0.364 -1.994 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -22.805 1.315 -3.973 1.00 0.00 O ATOM 0 H ASP A 104 -19.572 0.993 -0.287 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.300 -0.860 -2.468 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -20.495 2.167 -2.438 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.290 1.274 -3.931 1.00 0.00 H new ATOM 1024 N PRO A 105 -17.950 -0.678 -3.409 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.542 -0.715 -3.819 1.00 0.00 C ATOM 1026 C PRO A 105 -15.892 0.663 -3.856 1.00 0.00 C ATOM 1027 O PRO A 105 -15.807 1.294 -4.909 1.00 0.00 O ATOM 1028 CB PRO A 105 -16.632 -1.311 -5.216 1.00 0.00 C ATOM 1029 CG PRO A 105 -17.761 -2.279 -5.118 1.00 0.00 C ATOM 1030 CD PRO A 105 -18.745 -1.690 -4.134 1.00 0.00 C ATOM 0 HA PRO A 105 -15.920 -1.279 -3.124 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -16.826 -0.544 -5.966 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -15.704 -1.807 -5.500 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.228 -2.430 -6.091 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.409 -3.253 -4.779 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -19.599 -1.241 -4.641 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -19.139 -2.449 -3.458 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.440 1.122 -2.693 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.804 2.428 -2.588 1.00 0.00 C ATOM 1040 C ASN A 106 -13.666 2.421 -1.570 1.00 0.00 C ATOM 1041 O ASN A 106 -13.225 1.363 -1.118 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.837 3.493 -2.206 1.00 0.00 C ATOM 1043 CG ASN A 106 -17.074 3.446 -3.083 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -18.195 3.329 -2.589 1.00 0.00 O ATOM 1045 ND2 ASN A 106 -16.874 3.544 -4.392 1.00 0.00 N ATOM 0 H ASN A 106 -15.503 0.610 -1.813 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.381 2.666 -3.564 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.129 3.354 -1.165 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.381 4.480 -2.280 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -17.668 3.524 -5.032 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -15.927 3.640 -4.757 1.00 0.00 H new ATOM 1052 N LYS A 107 -13.193 3.616 -1.224 1.00 0.00 N ATOM 1053 CA LYS A 107 -12.101 3.780 -0.268 1.00 0.00 C ATOM 1054 C LYS A 107 -12.332 2.946 0.990 1.00 0.00 C ATOM 1055 O LYS A 107 -13.240 3.216 1.774 1.00 0.00 O ATOM 1056 CB LYS A 107 -11.944 5.269 0.079 1.00 0.00 C ATOM 1057 CG LYS A 107 -11.253 5.553 1.409 1.00 0.00 C ATOM 1058 CD LYS A 107 -11.995 6.621 2.195 1.00 0.00 C ATOM 1059 CE LYS A 107 -11.810 6.442 3.693 1.00 0.00 C ATOM 1060 NZ LYS A 107 -11.872 7.741 4.417 1.00 0.00 N ATOM 0 H LYS A 107 -13.554 4.494 -1.597 1.00 0.00 H new ATOM 0 HA LYS A 107 -11.179 3.421 -0.725 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -11.379 5.754 -0.717 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -12.932 5.729 0.095 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -11.199 4.637 1.997 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -10.228 5.877 1.228 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -11.637 7.607 1.899 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -13.057 6.581 1.951 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.581 5.775 4.077 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -10.850 5.964 3.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -11.742 7.577 5.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -11.120 8.369 4.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -12.798 8.186 4.254 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.494 1.930 1.161 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.577 1.030 2.303 1.00 0.00 C ATOM 1076 C TRP A 108 -10.182 0.678 2.815 1.00 0.00 C ATOM 1077 O TRP A 108 -9.178 1.106 2.246 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.328 -0.233 1.910 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.778 0.013 1.633 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.581 0.952 2.213 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.598 -0.694 0.706 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.850 0.871 1.695 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.888 -0.139 0.772 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.361 -1.745 -0.172 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.941 -0.603 -0.008 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.405 -2.208 -0.951 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.682 -1.638 -0.863 1.00 0.00 C ATOM 0 H TRP A 108 -10.739 1.708 0.512 1.00 0.00 H new ATOM 0 HA TRP A 108 -12.118 1.532 3.105 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.863 -0.665 1.024 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -12.236 -0.968 2.710 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -14.265 1.656 2.969 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.636 1.466 1.956 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.380 -2.191 -0.244 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.925 -0.163 0.059 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -15.233 -3.023 -1.639 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.478 -2.024 -1.483 1.00 0.00 H new ATOM 1098 N ARG A 109 -10.126 -0.095 3.894 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.850 -0.495 4.481 1.00 0.00 C ATOM 1100 C ARG A 109 -8.466 -1.891 4.016 1.00 0.00 C ATOM 1101 O ARG A 109 -9.326 -2.758 3.856 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.946 -0.486 6.009 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.325 0.737 6.658 1.00 0.00 C ATOM 1104 CD ARG A 109 -9.386 1.675 7.212 1.00 0.00 C ATOM 1105 NE ARG A 109 -10.257 2.201 6.162 1.00 0.00 N ATOM 1106 CZ ARG A 109 -11.097 3.218 6.335 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -11.175 3.830 7.510 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -11.858 3.629 5.330 1.00 0.00 N ATOM 0 H ARG A 109 -10.947 -0.457 4.380 1.00 0.00 H new ATOM 0 HA ARG A 109 -8.089 0.215 4.158 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.996 -0.545 6.297 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.458 -1.379 6.399 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.659 0.424 7.462 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.715 1.268 5.927 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -9.988 1.145 7.950 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -8.902 2.503 7.730 1.00 0.00 H new ATOM 0 HE ARG A 109 -10.218 1.762 5.242 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -10.589 3.521 8.286 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -11.821 4.609 7.637 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -11.800 3.165 4.423 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -12.502 4.409 5.464 1.00 0.00 H new ATOM 1122 N TYR A 110 -7.171 -2.113 3.804 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.699 -3.412 3.363 1.00 0.00 C ATOM 1124 C TYR A 110 -5.862 -4.057 4.447 1.00 0.00 C ATOM 1125 O TYR A 110 -5.464 -3.395 5.403 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.912 -3.276 2.069 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.792 -2.939 0.893 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -7.198 -3.924 0.003 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -7.219 -1.634 0.672 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -8.003 -3.618 -1.078 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -8.025 -1.321 -0.405 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.414 -2.316 -1.276 1.00 0.00 C ATOM 1133 OH TYR A 110 -9.214 -2.006 -2.349 1.00 0.00 O ATOM 0 H TYR A 110 -6.440 -1.413 3.931 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.557 -4.055 3.168 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -5.156 -2.500 2.187 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.384 -4.208 1.869 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.880 -4.945 0.158 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.916 -0.853 1.353 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.309 -4.394 -1.764 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -8.348 -0.303 -0.564 1.00 0.00 H new ATOM 0 HH TYR A 110 -9.641 -1.137 -2.198 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.626 -5.354 4.323 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.862 -6.060 5.339 1.00 0.00 C ATOM 1145 C TYR A 111 -3.904 -7.084 4.748 1.00 0.00 C ATOM 1146 O TYR A 111 -4.302 -7.975 3.999 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.815 -6.744 6.316 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.354 -5.812 7.377 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -5.963 -5.945 8.703 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -7.248 -4.794 7.053 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -6.446 -5.090 9.677 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -7.734 -3.937 8.021 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.330 -4.088 9.330 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.812 -3.236 10.298 1.00 0.00 O ATOM 0 H TYR A 111 -5.946 -5.930 3.544 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.256 -5.319 5.860 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.649 -7.171 5.760 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.296 -7.572 6.799 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -5.271 -6.728 8.978 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -7.566 -4.673 6.028 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -6.133 -5.206 10.704 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -8.427 -3.153 7.754 1.00 0.00 H new ATOM 0 HH TYR A 111 -8.422 -2.588 9.889 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.640 -6.961 5.127 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.608 -7.882 4.682 1.00 0.00 C ATOM 1166 C LEU A 112 -1.318 -8.879 5.794 1.00 0.00 C ATOM 1167 O LEU A 112 -0.673 -8.540 6.787 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.337 -7.114 4.311 1.00 0.00 C ATOM 1169 CG LEU A 112 0.578 -7.819 3.311 1.00 0.00 C ATOM 1170 CD1 LEU A 112 0.818 -9.261 3.731 1.00 0.00 C ATOM 1171 CD2 LEU A 112 -0.022 -7.757 1.915 1.00 0.00 C ATOM 0 H LEU A 112 -2.304 -6.225 5.748 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.954 -8.417 3.797 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.623 -6.147 3.898 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.229 -6.917 5.222 1.00 0.00 H new ATOM 0 HG LEU A 112 1.540 -7.306 3.296 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.472 -9.747 3.007 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.288 -9.280 4.714 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.134 -9.791 3.773 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.640 -8.263 1.212 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.995 -8.248 1.915 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -0.141 -6.716 1.616 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.820 -10.099 5.645 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.632 -11.119 6.666 1.00 0.00 C ATOM 1185 C ASP A 113 -2.374 -10.703 7.944 1.00 0.00 C ATOM 1186 O ASP A 113 -3.578 -10.448 7.901 1.00 0.00 O ATOM 1187 CB ASP A 113 -0.134 -11.339 6.923 1.00 0.00 C ATOM 1188 CG ASP A 113 0.144 -12.643 7.647 1.00 0.00 C ATOM 1189 OD1 ASP A 113 0.770 -13.536 7.039 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.262 -12.769 8.821 1.00 0.00 O ATOM 0 H ASP A 113 -2.356 -10.403 4.833 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.047 -12.067 6.325 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.399 -11.334 5.972 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.256 -10.509 7.512 1.00 0.00 H new ATOM 1195 N SER A 114 -1.670 -10.616 9.072 1.00 0.00 N ATOM 1196 CA SER A 114 -2.293 -10.212 10.325 1.00 0.00 C ATOM 1197 C SER A 114 -2.066 -8.724 10.593 1.00 0.00 C ATOM 1198 O SER A 114 -2.196 -8.265 11.728 1.00 0.00 O ATOM 1199 CB SER A 114 -1.739 -11.041 11.485 1.00 0.00 C ATOM 1200 OG SER A 114 -2.061 -12.412 11.331 1.00 0.00 O ATOM 0 H SER A 114 -0.673 -10.819 9.141 1.00 0.00 H new ATOM 0 HA SER A 114 -3.365 -10.388 10.241 1.00 0.00 H new ATOM 0 HB2 SER A 114 -0.657 -10.922 11.537 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.146 -10.672 12.427 1.00 0.00 H new ATOM 0 HG SER A 114 -1.599 -12.770 10.544 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.717 -7.976 9.547 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.462 -6.546 9.686 1.00 0.00 C ATOM 1208 C VAL A 115 -2.340 -5.727 8.745 1.00 0.00 C ATOM 1209 O VAL A 115 -2.780 -6.218 7.705 1.00 0.00 O ATOM 1210 CB VAL A 115 0.016 -6.211 9.404 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.306 -4.752 9.718 1.00 0.00 C ATOM 1212 CG2 VAL A 115 0.936 -7.127 10.198 1.00 0.00 C ATOM 0 H VAL A 115 -1.605 -8.336 8.599 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.702 -6.286 10.717 1.00 0.00 H new ATOM 0 HB VAL A 115 0.206 -6.374 8.343 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.355 -4.537 9.512 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.324 -4.114 9.098 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.096 -4.557 10.770 1.00 0.00 H new ATOM 0 HG21 VAL A 115 1.974 -6.874 9.984 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.744 -7.001 11.263 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.750 -8.163 9.916 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.581 -4.473 9.114 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.396 -3.578 8.300 1.00 0.00 C ATOM 1224 C GLU A 116 -2.519 -2.791 7.333 1.00 0.00 C ATOM 1225 O GLU A 116 -1.479 -2.258 7.721 1.00 0.00 O ATOM 1226 CB GLU A 116 -4.181 -2.613 9.192 1.00 0.00 C ATOM 1227 CG GLU A 116 -3.307 -1.825 10.152 1.00 0.00 C ATOM 1228 CD GLU A 116 -3.881 -0.460 10.475 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -4.595 0.101 9.619 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -3.616 0.048 11.585 1.00 0.00 O ATOM 0 H GLU A 116 -2.223 -4.053 9.972 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.099 -4.182 7.727 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.733 -1.916 8.561 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.917 -3.178 9.764 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -3.185 -2.392 11.075 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -2.314 -1.704 9.718 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.933 -2.725 6.072 1.00 0.00 N ATOM 1238 CA VAL A 117 -2.166 -2.007 5.063 1.00 0.00 C ATOM 1239 C VAL A 117 -3.053 -1.153 4.161 1.00 0.00 C ATOM 1240 O VAL A 117 -4.287 -1.283 4.147 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.342 -2.974 4.189 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.177 -3.546 4.979 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.225 -4.086 3.644 1.00 0.00 C ATOM 0 H VAL A 117 -3.790 -3.157 5.727 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.492 -1.348 5.610 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.938 -2.417 3.344 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.393 -4.226 4.346 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.469 -2.734 5.314 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.556 -4.088 5.845 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.626 -4.758 3.030 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.661 -4.644 4.473 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.022 -3.654 3.038 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.396 -0.267 3.416 1.00 0.00 N ATOM 1254 CA HIS A 118 -3.074 0.646 2.505 1.00 0.00 C ATOM 1255 C HIS A 118 -2.896 0.225 1.047 1.00 0.00 C ATOM 1256 O HIS A 118 -1.834 0.425 0.458 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.521 2.056 2.698 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.261 3.115 1.939 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -4.131 3.997 2.541 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.252 3.442 0.623 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.624 4.814 1.630 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -4.111 4.496 0.457 1.00 0.00 N ATOM 0 H HIS A 118 -1.381 -0.163 3.428 1.00 0.00 H new ATOM 0 HA HIS A 118 -4.139 0.622 2.734 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.545 2.302 3.760 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.475 2.069 2.392 1.00 0.00 H new ATOM 0 HD1 HIS A 118 -4.358 4.016 3.535 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.674 2.960 -0.152 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -5.330 5.610 1.814 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.951 -0.335 0.466 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.930 -0.760 -0.930 1.00 0.00 C ATOM 1273 C LEU A 119 -4.832 0.157 -1.755 1.00 0.00 C ATOM 1274 O LEU A 119 -6.048 0.163 -1.570 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.399 -2.207 -1.054 1.00 0.00 C ATOM 1276 CG LEU A 119 -4.274 -2.801 -2.450 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -4.074 -4.306 -2.384 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -5.497 -2.455 -3.273 1.00 0.00 C ATOM 0 H LEU A 119 -4.836 -0.506 0.943 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.909 -0.696 -1.306 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.825 -2.821 -0.360 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.442 -2.264 -0.742 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.396 -2.371 -2.933 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.988 -4.706 -3.394 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -3.164 -4.528 -1.827 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -4.927 -4.765 -1.884 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.398 -2.884 -4.270 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.387 -2.859 -2.790 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.588 -1.372 -3.352 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.255 0.962 -2.666 1.00 0.00 N ATOM 1291 CA PRO A 120 -5.027 1.893 -3.490 1.00 0.00 C ATOM 1292 C PRO A 120 -6.228 1.228 -4.165 1.00 0.00 C ATOM 1293 O PRO A 120 -6.146 0.094 -4.631 1.00 0.00 O ATOM 1294 CB PRO A 120 -4.022 2.402 -4.533 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.800 1.561 -4.368 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.819 1.051 -2.956 1.00 0.00 C ATOM 0 HA PRO A 120 -5.457 2.693 -2.887 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.426 2.311 -5.541 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.795 3.456 -4.375 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.799 0.735 -5.079 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.899 2.145 -4.557 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.327 0.082 -2.868 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.309 1.730 -2.273 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.369 1.935 -4.211 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.615 1.428 -4.809 1.00 0.00 C ATOM 1306 C PRO A 121 -8.478 0.948 -6.257 1.00 0.00 C ATOM 1307 O PRO A 121 -9.394 0.319 -6.786 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.563 2.634 -4.742 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.685 3.811 -4.492 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.554 3.289 -3.665 1.00 0.00 C ATOM 0 HA PRO A 121 -8.960 0.544 -4.272 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.119 2.749 -5.672 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.296 2.514 -3.945 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.324 4.239 -5.427 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.224 4.600 -3.968 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.656 3.898 -3.773 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.801 3.270 -2.603 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.356 1.246 -6.905 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.166 0.828 -8.296 1.00 0.00 C ATOM 1320 C PHE A 122 -6.615 -0.591 -8.409 1.00 0.00 C ATOM 1321 O PHE A 122 -6.558 -1.148 -9.506 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.272 1.802 -9.085 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.496 2.786 -8.252 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.150 3.728 -7.470 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.111 2.779 -8.266 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.436 4.640 -6.717 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.393 3.688 -7.514 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.055 4.621 -6.739 1.00 0.00 C ATOM 0 H PHE A 122 -6.576 1.765 -6.502 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.161 0.842 -8.741 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.568 1.221 -9.680 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -6.897 2.357 -9.784 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.230 3.748 -7.450 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.587 2.055 -8.872 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -5.957 5.367 -6.112 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.313 3.670 -7.532 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.494 5.333 -6.152 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.221 -1.186 -7.289 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.697 -2.544 -7.311 1.00 0.00 C ATOM 1340 C TRP A 123 -6.739 -3.542 -6.805 1.00 0.00 C ATOM 1341 O TRP A 123 -6.475 -4.743 -6.731 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.417 -2.621 -6.484 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.355 -1.688 -6.971 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.272 -1.102 -8.201 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.235 -1.225 -6.227 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.160 -0.291 -8.260 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.509 -0.350 -7.055 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.779 -1.463 -4.934 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.348 0.286 -6.619 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.635 -0.833 -4.509 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.067 0.032 -5.344 1.00 0.00 C ATOM 0 H TRP A 123 -6.254 -0.755 -6.365 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.462 -2.810 -8.341 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.648 -2.390 -5.444 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -4.036 -3.642 -6.507 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.974 -1.252 -9.008 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.869 0.262 -9.066 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.315 -2.131 -4.276 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.202 0.954 -7.265 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.273 -1.012 -3.507 1.00 0.00 H new ATOM 0 HH2 TRP A 123 0.960 0.513 -4.974 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.933 -3.040 -6.479 1.00 0.00 N ATOM 1363 CA GLU A 124 -9.023 -3.888 -6.006 1.00 0.00 C ATOM 1364 C GLU A 124 -9.244 -5.048 -6.970 1.00 0.00 C ATOM 1365 O GLU A 124 -9.585 -6.159 -6.562 1.00 0.00 O ATOM 1366 CB GLU A 124 -10.309 -3.064 -5.878 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.898 -3.057 -4.483 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.504 -1.715 -4.120 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -12.748 -1.602 -4.132 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -10.735 -0.775 -3.826 1.00 0.00 O ATOM 0 H GLU A 124 -8.167 -2.049 -6.535 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.757 -4.289 -5.028 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.102 -2.037 -6.179 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -11.051 -3.457 -6.573 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -11.663 -3.830 -4.410 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -10.121 -3.309 -3.762 1.00 0.00 H new ATOM 1377 N GLN A 125 -9.043 -4.771 -8.253 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.211 -5.773 -9.296 1.00 0.00 C ATOM 1379 C GLN A 125 -7.892 -6.486 -9.587 1.00 0.00 C ATOM 1380 O GLN A 125 -7.881 -7.589 -10.133 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.733 -5.115 -10.574 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.952 -3.874 -10.981 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.767 -2.602 -10.844 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.925 -2.545 -11.257 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -9.163 -1.572 -10.262 1.00 0.00 N ATOM 0 H GLN A 125 -8.761 -3.853 -8.597 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.933 -6.511 -8.945 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.697 -5.840 -11.387 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.780 -4.846 -10.433 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.056 -3.795 -10.366 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.621 -3.980 -12.014 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.201 -1.663 -9.934 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.661 -0.690 -10.143 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.784 -5.845 -9.227 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.465 -6.416 -9.459 1.00 0.00 C ATOM 1396 C TYR A 126 -5.059 -7.367 -8.335 1.00 0.00 C ATOM 1397 O TYR A 126 -4.107 -8.133 -8.477 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.424 -5.305 -9.603 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.819 -4.212 -10.580 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -5.866 -4.389 -11.480 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -4.139 -3.003 -10.603 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -6.220 -3.392 -12.369 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -4.488 -2.001 -11.489 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.529 -2.201 -12.370 1.00 0.00 C ATOM 1405 OH TYR A 126 -5.879 -1.206 -13.254 1.00 0.00 O ATOM 0 H TYR A 126 -6.775 -4.931 -8.774 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.512 -6.989 -10.385 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.247 -4.857 -8.625 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.481 -5.745 -9.927 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -6.411 -5.321 -11.484 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -3.322 -2.842 -9.916 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -7.035 -3.546 -13.060 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -3.948 -1.066 -11.491 1.00 0.00 H new ATOM 0 HH TYR A 126 -5.293 -0.431 -13.123 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.780 -7.316 -7.216 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.474 -8.178 -6.081 1.00 0.00 C ATOM 1417 C ILE A 127 -6.101 -9.561 -6.246 1.00 0.00 C ATOM 1418 O ILE A 127 -7.322 -9.714 -6.197 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.943 -7.561 -4.750 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -7.414 -7.150 -4.831 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -5.071 -6.369 -4.383 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -8.206 -7.528 -3.599 1.00 0.00 C ATOM 0 H ILE A 127 -6.574 -6.691 -7.074 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.389 -8.279 -6.055 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.846 -8.314 -3.968 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.476 -6.072 -4.978 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.868 -7.618 -5.705 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -5.415 -5.943 -3.440 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.036 -6.694 -4.279 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.137 -5.615 -5.167 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -9.241 -7.209 -3.720 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -8.173 -8.609 -3.463 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.775 -7.039 -2.725 1.00 0.00 H new ATOM 1434 N ASN A 128 -5.250 -10.561 -6.442 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.696 -11.938 -6.617 1.00 0.00 C ATOM 1436 C ASN A 128 -5.444 -12.760 -5.354 1.00 0.00 C ATOM 1437 O ASN A 128 -5.112 -12.209 -4.304 1.00 0.00 O ATOM 1438 CB ASN A 128 -4.969 -12.574 -7.804 1.00 0.00 C ATOM 1439 CG ASN A 128 -3.473 -12.684 -7.590 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -2.967 -13.748 -7.237 1.00 0.00 O ATOM 1441 ND2 ASN A 128 -2.753 -11.586 -7.806 1.00 0.00 N ATOM 0 H ASN A 128 -4.238 -10.442 -6.484 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.769 -11.928 -6.811 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.379 -13.568 -7.984 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.160 -11.983 -8.700 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -1.741 -11.607 -7.680 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -3.213 -10.724 -8.098 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.595 -14.082 -5.463 1.00 0.00 N ATOM 1449 CA ASP A 129 -5.373 -14.976 -4.327 1.00 0.00 C ATOM 1450 C ASP A 129 -4.057 -14.635 -3.635 1.00 0.00 C ATOM 1451 O ASP A 129 -4.014 -14.418 -2.426 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.359 -16.434 -4.790 1.00 0.00 C ATOM 1453 CG ASP A 129 -6.612 -16.807 -5.559 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -6.957 -16.086 -6.517 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -7.246 -17.823 -5.202 1.00 0.00 O ATOM 0 H ASP A 129 -5.869 -14.555 -6.324 1.00 0.00 H new ATOM 0 HA ASP A 129 -6.189 -14.842 -3.617 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -4.485 -16.605 -5.419 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -5.260 -17.087 -3.923 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.992 -14.564 -4.425 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.675 -14.216 -3.912 1.00 0.00 C ATOM 1462 C GLU A 130 -1.027 -13.194 -4.836 1.00 0.00 C ATOM 1463 O GLU A 130 -0.929 -13.413 -6.041 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.793 -15.463 -3.800 1.00 0.00 C ATOM 1465 CG GLU A 130 0.228 -15.388 -2.677 1.00 0.00 C ATOM 1466 CD GLU A 130 -0.027 -16.411 -1.587 1.00 0.00 C ATOM 1467 OE1 GLU A 130 0.467 -17.550 -1.714 1.00 0.00 O ATOM 1468 OE2 GLU A 130 -0.722 -16.071 -0.605 1.00 0.00 O ATOM 0 H GLU A 130 -3.017 -14.744 -5.429 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.784 -13.787 -2.916 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.429 -16.334 -3.644 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.271 -15.614 -4.745 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.226 -15.541 -3.088 1.00 0.00 H new ATOM 0 HG3 GLU A 130 0.212 -14.388 -2.243 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.605 -12.070 -4.275 1.00 0.00 N ATOM 1476 CA ASN A 131 0.003 -11.017 -5.079 1.00 0.00 C ATOM 1477 C ASN A 131 1.415 -10.683 -4.650 1.00 0.00 C ATOM 1478 O ASN A 131 1.809 -10.883 -3.501 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.818 -9.733 -4.988 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.278 -9.939 -5.300 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.744 -9.564 -6.373 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -3.010 -10.524 -4.359 1.00 0.00 N ATOM 0 H ASN A 131 -0.671 -11.864 -3.278 1.00 0.00 H new ATOM 0 HA ASN A 131 0.028 -11.403 -6.098 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.722 -9.319 -3.984 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.406 -8.996 -5.678 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -4.006 -10.680 -4.511 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.576 -10.818 -3.484 1.00 0.00 H new ATOM 1489 N THR A 132 2.137 -10.091 -5.587 1.00 0.00 N ATOM 1490 CA THR A 132 3.484 -9.614 -5.350 1.00 0.00 C ATOM 1491 C THR A 132 3.364 -8.141 -5.005 1.00 0.00 C ATOM 1492 O THR A 132 3.008 -7.323 -5.861 1.00 0.00 O ATOM 1493 CB THR A 132 4.362 -9.810 -6.588 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.109 -11.067 -7.188 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.844 -9.735 -6.289 1.00 0.00 C ATOM 0 H THR A 132 1.801 -9.928 -6.536 1.00 0.00 H new ATOM 0 HA THR A 132 3.957 -10.171 -4.541 1.00 0.00 H new ATOM 0 HB THR A 132 4.101 -8.992 -7.259 1.00 0.00 H new ATOM 0 HG1 THR A 132 4.679 -11.173 -7.978 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.409 -9.882 -7.210 1.00 0.00 H new ATOM 0 HG22 THR A 132 6.082 -8.757 -5.870 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.110 -10.512 -5.572 1.00 0.00 H new ATOM 1503 N VAL A 133 3.580 -7.811 -3.739 1.00 0.00 N ATOM 1504 CA VAL A 133 3.414 -6.437 -3.290 1.00 0.00 C ATOM 1505 C VAL A 133 4.694 -5.813 -2.761 1.00 0.00 C ATOM 1506 O VAL A 133 5.493 -6.456 -2.081 1.00 0.00 O ATOM 1507 CB VAL A 133 2.327 -6.330 -2.191 1.00 0.00 C ATOM 1508 CG1 VAL A 133 1.072 -5.679 -2.742 1.00 0.00 C ATOM 1509 CG2 VAL A 133 2.003 -7.696 -1.596 1.00 0.00 C ATOM 0 H VAL A 133 3.867 -8.467 -3.013 1.00 0.00 H new ATOM 0 HA VAL A 133 3.111 -5.885 -4.180 1.00 0.00 H new ATOM 0 HB VAL A 133 2.723 -5.703 -1.392 1.00 0.00 H new ATOM 0 HG11 VAL A 133 0.321 -5.613 -1.955 1.00 0.00 H new ATOM 0 HG12 VAL A 133 1.309 -4.678 -3.102 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.683 -6.278 -3.566 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.237 -7.586 -0.828 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.637 -8.357 -2.381 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.903 -8.122 -1.152 1.00 0.00 H new ATOM 1519 N GLU A 134 4.835 -4.526 -3.044 1.00 0.00 N ATOM 1520 CA GLU A 134 5.960 -3.742 -2.574 1.00 0.00 C ATOM 1521 C GLU A 134 5.402 -2.564 -1.801 1.00 0.00 C ATOM 1522 O GLU A 134 4.711 -1.714 -2.365 1.00 0.00 O ATOM 1523 CB GLU A 134 6.829 -3.257 -3.727 1.00 0.00 C ATOM 1524 CG GLU A 134 7.351 -4.374 -4.615 1.00 0.00 C ATOM 1525 CD GLU A 134 6.468 -4.619 -5.823 1.00 0.00 C ATOM 1526 OE1 GLU A 134 5.263 -4.888 -5.632 1.00 0.00 O ATOM 1527 OE2 GLU A 134 6.980 -4.541 -6.959 1.00 0.00 O ATOM 0 H GLU A 134 4.169 -3.998 -3.608 1.00 0.00 H new ATOM 0 HA GLU A 134 6.597 -4.358 -1.940 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.252 -2.561 -4.336 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.675 -2.701 -3.323 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.358 -4.126 -4.950 1.00 0.00 H new ATOM 0 HG3 GLU A 134 7.426 -5.292 -4.032 1.00 0.00 H new ATOM 1534 N LEU A 135 5.649 -2.545 -0.506 1.00 0.00 N ATOM 1535 CA LEU A 135 5.107 -1.496 0.338 1.00 0.00 C ATOM 1536 C LEU A 135 6.101 -1.000 1.374 1.00 0.00 C ATOM 1537 O LEU A 135 7.011 -1.717 1.784 1.00 0.00 O ATOM 1538 CB LEU A 135 3.858 -2.018 1.049 1.00 0.00 C ATOM 1539 CG LEU A 135 4.074 -3.278 1.890 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.752 -2.934 3.206 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.749 -3.985 2.137 1.00 0.00 C ATOM 0 H LEU A 135 6.217 -3.237 -0.017 1.00 0.00 H new ATOM 0 HA LEU A 135 4.866 -0.652 -0.309 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.469 -1.230 1.694 1.00 0.00 H new ATOM 0 HB3 LEU A 135 3.092 -2.225 0.302 1.00 0.00 H new ATOM 0 HG LEU A 135 4.727 -3.954 1.338 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.897 -3.843 3.789 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.719 -2.473 3.007 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.127 -2.239 3.767 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.920 -4.879 2.737 1.00 0.00 H new ATOM 0 HD22 LEU A 135 2.073 -3.315 2.669 1.00 0.00 H new ATOM 0 HD23 LEU A 135 2.304 -4.267 1.183 1.00 0.00 H new ATOM 1553 N ILE A 136 5.880 0.227 1.820 1.00 0.00 N ATOM 1554 CA ILE A 136 6.710 0.841 2.842 1.00 0.00 C ATOM 1555 C ILE A 136 5.902 0.929 4.127 1.00 0.00 C ATOM 1556 O ILE A 136 4.694 0.736 4.096 1.00 0.00 O ATOM 1557 CB ILE A 136 7.204 2.253 2.440 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.873 2.572 0.976 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.700 2.361 2.665 1.00 0.00 C ATOM 1560 CD1 ILE A 136 6.863 4.054 0.671 1.00 0.00 C ATOM 0 H ILE A 136 5.123 0.822 1.484 1.00 0.00 H new ATOM 0 HA ILE A 136 7.597 0.222 2.975 1.00 0.00 H new ATOM 0 HB ILE A 136 6.686 2.979 3.067 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.602 2.081 0.331 1.00 0.00 H new ATOM 0 HG13 ILE A 136 5.897 2.152 0.732 1.00 0.00 H new ATOM 0 HG21 ILE A 136 9.040 3.357 2.380 1.00 0.00 H new ATOM 0 HG22 ILE A 136 8.923 2.189 3.718 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.214 1.615 2.059 1.00 0.00 H new ATOM 0 HD11 ILE A 136 6.622 4.207 -0.381 1.00 0.00 H new ATOM 0 HD12 ILE A 136 6.114 4.548 1.291 1.00 0.00 H new ATOM 0 HD13 ILE A 136 7.845 4.476 0.883 1.00 0.00 H new ATOM 1572 N HIS A 137 6.553 1.192 5.253 1.00 0.00 N ATOM 1573 CA HIS A 137 5.841 1.264 6.526 1.00 0.00 C ATOM 1574 C HIS A 137 5.756 2.691 7.054 1.00 0.00 C ATOM 1575 O HIS A 137 6.772 3.330 7.328 1.00 0.00 O ATOM 1576 CB HIS A 137 6.512 0.343 7.542 1.00 0.00 C ATOM 1577 CG HIS A 137 6.716 -1.042 7.007 1.00 0.00 C ATOM 1578 ND1 HIS A 137 6.245 -2.176 7.633 1.00 0.00 N ATOM 1579 CD2 HIS A 137 7.323 -1.465 5.873 1.00 0.00 C ATOM 1580 CE1 HIS A 137 6.554 -3.236 6.904 1.00 0.00 C ATOM 1581 NE2 HIS A 137 7.207 -2.831 5.834 1.00 0.00 N ATOM 0 H HIS A 137 7.558 1.357 5.313 1.00 0.00 H new ATOM 0 HA HIS A 137 4.817 0.930 6.361 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.475 0.764 7.830 1.00 0.00 H new ATOM 0 HB3 HIS A 137 5.902 0.295 8.444 1.00 0.00 H new ATOM 0 HD1 HIS A 137 5.738 -2.195 8.518 1.00 0.00 H new ATOM 0 HD2 HIS A 137 7.808 -0.842 5.136 1.00 0.00 H new ATOM 0 HE1 HIS A 137 6.312 -4.260 7.145 1.00 0.00 H new ATOM 1590 N THR A 138 4.524 3.186 7.191 1.00 0.00 N ATOM 1591 CA THR A 138 4.287 4.540 7.682 1.00 0.00 C ATOM 1592 C THR A 138 4.280 4.573 9.208 1.00 0.00 C ATOM 1593 O THR A 138 4.756 3.644 9.860 1.00 0.00 O ATOM 1594 CB THR A 138 2.948 5.059 7.154 1.00 0.00 C ATOM 1595 OG1 THR A 138 1.876 4.548 7.924 1.00 0.00 O ATOM 1596 CG2 THR A 138 2.689 4.695 5.713 1.00 0.00 C ATOM 0 H THR A 138 3.675 2.666 6.968 1.00 0.00 H new ATOM 0 HA THR A 138 5.095 5.178 7.324 1.00 0.00 H new ATOM 0 HB THR A 138 3.010 6.145 7.230 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.385 3.881 7.400 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.723 5.095 5.405 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.473 5.117 5.085 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.683 3.610 5.607 1.00 0.00 H new ATOM 1604 N ASP A 139 3.716 5.640 9.771 1.00 0.00 N ATOM 1605 CA ASP A 139 3.626 5.775 11.219 1.00 0.00 C ATOM 1606 C ASP A 139 2.419 5.001 11.744 1.00 0.00 C ATOM 1607 O ASP A 139 2.203 4.904 12.952 1.00 0.00 O ATOM 1608 CB ASP A 139 3.513 7.250 11.611 1.00 0.00 C ATOM 1609 CG ASP A 139 3.799 7.480 13.082 1.00 0.00 C ATOM 1610 OD1 ASP A 139 4.883 8.012 13.400 1.00 0.00 O ATOM 1611 OD2 ASP A 139 2.939 7.129 13.917 1.00 0.00 O ATOM 0 H ASP A 139 3.317 6.419 9.247 1.00 0.00 H new ATOM 0 HA ASP A 139 4.532 5.364 11.664 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.209 7.837 11.012 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.511 7.609 11.378 1.00 0.00 H new ATOM 1616 N SER A 140 1.636 4.452 10.817 1.00 0.00 N ATOM 1617 CA SER A 140 0.450 3.684 11.159 1.00 0.00 C ATOM 1618 C SER A 140 0.517 2.300 10.526 1.00 0.00 C ATOM 1619 O SER A 140 0.723 1.296 11.209 1.00 0.00 O ATOM 1620 CB SER A 140 -0.798 4.420 10.673 1.00 0.00 C ATOM 1621 OG SER A 140 -0.767 4.606 9.264 1.00 0.00 O ATOM 0 H SER A 140 1.808 4.529 9.815 1.00 0.00 H new ATOM 0 HA SER A 140 0.402 3.571 12.242 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.688 3.854 10.949 1.00 0.00 H new ATOM 0 HB3 SER A 140 -0.869 5.388 11.169 1.00 0.00 H new ATOM 0 HG SER A 140 -1.639 4.931 8.958 1.00 0.00 H new ATOM 1627 N LEU A 141 0.350 2.267 9.212 1.00 0.00 N ATOM 1628 CA LEU A 141 0.398 1.025 8.454 1.00 0.00 C ATOM 1629 C LEU A 141 1.247 1.209 7.205 1.00 0.00 C ATOM 1630 O LEU A 141 1.589 2.333 6.840 1.00 0.00 O ATOM 1631 CB LEU A 141 -1.014 0.580 8.068 1.00 0.00 C ATOM 1632 CG LEU A 141 -1.950 1.706 7.625 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -3.035 1.167 6.706 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -2.565 2.393 8.835 1.00 0.00 C ATOM 0 H LEU A 141 0.178 3.096 8.643 1.00 0.00 H new ATOM 0 HA LEU A 141 0.848 0.253 9.078 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.941 -0.149 7.261 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.463 0.069 8.920 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.367 2.442 7.071 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -3.691 1.982 6.401 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.576 0.721 5.824 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.616 0.411 7.234 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.228 3.191 8.502 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.134 1.667 9.415 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -1.774 2.814 9.456 1.00 0.00 H new ATOM 1646 N PRO A 142 1.631 0.110 6.544 1.00 0.00 N ATOM 1647 CA PRO A 142 2.459 0.169 5.347 1.00 0.00 C ATOM 1648 C PRO A 142 1.671 0.552 4.100 1.00 0.00 C ATOM 1649 O PRO A 142 0.593 0.018 3.841 1.00 0.00 O ATOM 1650 CB PRO A 142 3.016 -1.256 5.208 1.00 0.00 C ATOM 1651 CG PRO A 142 2.554 -1.995 6.422 1.00 0.00 C ATOM 1652 CD PRO A 142 1.330 -1.272 6.913 1.00 0.00 C ATOM 0 HA PRO A 142 3.230 0.934 5.440 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.650 -1.732 4.298 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.104 -1.246 5.147 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.323 -3.033 6.181 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.330 -2.010 7.187 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.421 -1.635 6.433 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.191 -1.387 7.988 1.00 0.00 H new ATOM 1660 N LEU A 143 2.232 1.471 3.323 1.00 0.00 N ATOM 1661 CA LEU A 143 1.602 1.923 2.086 1.00 0.00 C ATOM 1662 C LEU A 143 2.097 1.098 0.909 1.00 0.00 C ATOM 1663 O LEU A 143 3.293 1.074 0.616 1.00 0.00 O ATOM 1664 CB LEU A 143 1.905 3.402 1.832 1.00 0.00 C ATOM 1665 CG LEU A 143 0.979 4.100 0.827 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.158 3.533 -0.573 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.468 3.969 1.252 1.00 0.00 C ATOM 0 H LEU A 143 3.125 1.920 3.528 1.00 0.00 H new ATOM 0 HA LEU A 143 0.525 1.795 2.191 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.851 3.935 2.781 1.00 0.00 H new ATOM 0 HB3 LEU A 143 2.931 3.489 1.476 1.00 0.00 H new ATOM 0 HG LEU A 143 1.250 5.156 0.809 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.489 4.048 -1.262 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.190 3.676 -0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 143 0.924 2.468 -0.567 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.107 4.471 0.526 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.738 2.914 1.305 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.602 4.428 2.232 1.00 0.00 H new ATOM 1679 N VAL A 144 1.177 0.429 0.233 1.00 0.00 N ATOM 1680 CA VAL A 144 1.534 -0.388 -0.917 1.00 0.00 C ATOM 1681 C VAL A 144 1.777 0.493 -2.135 1.00 0.00 C ATOM 1682 O VAL A 144 0.840 0.923 -2.807 1.00 0.00 O ATOM 1683 CB VAL A 144 0.446 -1.436 -1.223 1.00 0.00 C ATOM 1684 CG1 VAL A 144 0.974 -2.484 -2.191 1.00 0.00 C ATOM 1685 CG2 VAL A 144 -0.050 -2.092 0.062 1.00 0.00 C ATOM 0 H VAL A 144 0.182 0.435 0.459 1.00 0.00 H new ATOM 0 HA VAL A 144 2.453 -0.922 -0.675 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.397 -0.928 -1.691 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.193 -3.216 -2.396 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.273 -2.002 -3.122 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.835 -2.986 -1.750 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.817 -2.828 -0.178 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.782 -2.586 0.563 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.470 -1.331 0.720 1.00 0.00 H new ATOM 1695 N ILE A 145 3.052 0.780 -2.389 1.00 0.00 N ATOM 1696 CA ILE A 145 3.446 1.638 -3.501 1.00 0.00 C ATOM 1697 C ILE A 145 3.352 0.926 -4.847 1.00 0.00 C ATOM 1698 O ILE A 145 3.157 1.570 -5.878 1.00 0.00 O ATOM 1699 CB ILE A 145 4.881 2.177 -3.307 1.00 0.00 C ATOM 1700 CG1 ILE A 145 5.905 1.039 -3.374 1.00 0.00 C ATOM 1701 CG2 ILE A 145 4.990 2.912 -1.979 1.00 0.00 C ATOM 1702 CD1 ILE A 145 6.996 1.272 -4.396 1.00 0.00 C ATOM 0 H ILE A 145 3.833 0.428 -1.835 1.00 0.00 H new ATOM 0 HA ILE A 145 2.742 2.470 -3.508 1.00 0.00 H new ATOM 0 HB ILE A 145 5.098 2.876 -4.115 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.359 0.911 -2.391 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.388 0.109 -3.611 1.00 0.00 H new ATOM 0 HG21 ILE A 145 6.006 3.287 -1.853 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.290 3.748 -1.967 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.752 2.228 -1.164 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.686 0.428 -4.390 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.552 1.371 -5.386 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.537 2.185 -4.148 1.00 0.00 H new ATOM 1714 N SER A 146 3.489 -0.396 -4.844 1.00 0.00 N ATOM 1715 CA SER A 146 3.411 -1.152 -6.089 1.00 0.00 C ATOM 1716 C SER A 146 2.767 -2.518 -5.882 1.00 0.00 C ATOM 1717 O SER A 146 2.720 -3.039 -4.766 1.00 0.00 O ATOM 1718 CB SER A 146 4.800 -1.315 -6.709 1.00 0.00 C ATOM 1719 OG SER A 146 5.744 -0.466 -6.083 1.00 0.00 O ATOM 0 H SER A 146 3.652 -0.958 -4.009 1.00 0.00 H new ATOM 0 HA SER A 146 2.780 -0.585 -6.773 1.00 0.00 H new ATOM 0 HB2 SER A 146 5.123 -2.352 -6.617 1.00 0.00 H new ATOM 0 HB3 SER A 146 4.754 -1.089 -7.774 1.00 0.00 H new ATOM 0 HG SER A 146 6.374 -0.127 -6.753 1.00 0.00 H new ATOM 1725 N LEU A 147 2.279 -3.090 -6.978 1.00 0.00 N ATOM 1726 CA LEU A 147 1.634 -4.392 -6.954 1.00 0.00 C ATOM 1727 C LEU A 147 2.054 -5.191 -8.179 1.00 0.00 C ATOM 1728 O LEU A 147 2.578 -4.630 -9.139 1.00 0.00 O ATOM 1729 CB LEU A 147 0.111 -4.223 -6.936 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.655 -5.239 -6.088 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -0.944 -4.670 -4.707 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -1.950 -5.640 -6.778 1.00 0.00 C ATOM 0 H LEU A 147 2.321 -2.663 -7.904 1.00 0.00 H new ATOM 0 HA LEU A 147 1.938 -4.927 -6.054 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.122 -3.223 -6.571 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.256 -4.282 -7.961 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.035 -6.128 -5.973 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.490 -5.406 -4.117 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -0.005 -4.430 -4.209 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.545 -3.766 -4.804 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.482 -6.364 -6.161 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.574 -4.758 -6.922 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.723 -6.086 -7.746 1.00 0.00 H new ATOM 1744 N ASN A 148 1.844 -6.500 -8.143 1.00 0.00 N ATOM 1745 CA ASN A 148 2.226 -7.353 -9.262 1.00 0.00 C ATOM 1746 C ASN A 148 1.749 -6.786 -10.610 1.00 0.00 C ATOM 1747 O ASN A 148 0.592 -6.940 -10.995 1.00 0.00 O ATOM 1748 CB ASN A 148 1.698 -8.784 -9.050 1.00 0.00 C ATOM 1749 CG ASN A 148 0.258 -8.986 -9.499 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.006 -9.247 -10.672 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -0.681 -8.880 -8.564 1.00 0.00 N ATOM 0 H ASN A 148 1.415 -6.992 -7.359 1.00 0.00 H new ATOM 0 HA ASN A 148 3.315 -7.382 -9.296 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.338 -9.480 -9.592 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.777 -9.036 -7.993 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -1.662 -9.017 -8.808 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.421 -8.662 -7.602 1.00 0.00 H new ATOM 1758 N GLY A 149 2.668 -6.147 -11.330 1.00 0.00 N ATOM 1759 CA GLY A 149 2.345 -5.596 -12.639 1.00 0.00 C ATOM 1760 C GLY A 149 1.680 -4.229 -12.604 1.00 0.00 C ATOM 1761 O GLY A 149 1.369 -3.670 -13.656 1.00 0.00 O ATOM 0 H GLY A 149 3.632 -6.000 -11.031 1.00 0.00 H new ATOM 0 HA2 GLY A 149 3.261 -5.525 -13.225 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.687 -6.292 -13.159 1.00 0.00 H new ATOM 1765 N HIS A 150 1.458 -3.682 -11.416 1.00 0.00 N ATOM 1766 CA HIS A 150 0.823 -2.371 -11.298 1.00 0.00 C ATOM 1767 C HIS A 150 1.616 -1.460 -10.378 1.00 0.00 C ATOM 1768 O HIS A 150 2.458 -1.917 -9.604 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.608 -2.507 -10.785 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.334 -3.674 -11.368 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.140 -3.588 -12.484 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.360 -4.967 -10.985 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.633 -4.782 -12.760 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.174 -5.637 -11.865 1.00 0.00 N ATOM 0 H HIS A 150 1.704 -4.118 -10.527 1.00 0.00 H new ATOM 0 HA HIS A 150 0.801 -1.925 -12.292 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.590 -2.604 -9.699 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.158 -1.594 -11.014 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -0.838 -5.396 -10.143 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.298 -5.018 -13.578 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.389 -6.634 -11.832 1.00 0.00 H new ATOM 1783 N THR A 151 1.344 -0.165 -10.470 1.00 0.00 N ATOM 1784 CA THR A 151 2.037 0.813 -9.650 1.00 0.00 C ATOM 1785 C THR A 151 1.113 1.960 -9.263 1.00 0.00 C ATOM 1786 O THR A 151 0.155 2.270 -9.971 1.00 0.00 O ATOM 1787 CB THR A 151 3.261 1.335 -10.394 1.00 0.00 C ATOM 1788 OG1 THR A 151 2.881 2.244 -11.412 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.068 0.229 -11.037 1.00 0.00 C ATOM 0 H THR A 151 0.649 0.230 -11.104 1.00 0.00 H new ATOM 0 HA THR A 151 2.361 0.327 -8.730 1.00 0.00 H new ATOM 0 HB THR A 151 3.877 1.830 -9.643 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.681 2.568 -11.876 1.00 0.00 H new ATOM 0 HG21 THR A 151 4.927 0.658 -11.553 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.414 -0.463 -10.269 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.445 -0.307 -11.753 1.00 0.00 H new ATOM 1797 N LEU A 152 1.404 2.577 -8.124 1.00 0.00 N ATOM 1798 CA LEU A 152 0.600 3.681 -7.619 1.00 0.00 C ATOM 1799 C LEU A 152 0.539 4.834 -8.610 1.00 0.00 C ATOM 1800 O LEU A 152 -0.515 5.441 -8.803 1.00 0.00 O ATOM 1801 CB LEU A 152 1.160 4.160 -6.281 1.00 0.00 C ATOM 1802 CG LEU A 152 0.346 3.756 -5.054 1.00 0.00 C ATOM 1803 CD1 LEU A 152 1.057 4.182 -3.778 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -1.042 4.367 -5.119 1.00 0.00 C ATOM 0 H LEU A 152 2.196 2.329 -7.530 1.00 0.00 H new ATOM 0 HA LEU A 152 -0.418 3.318 -7.477 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.173 3.772 -6.169 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.236 5.247 -6.305 1.00 0.00 H new ATOM 0 HG LEU A 152 0.247 2.671 -5.045 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.462 3.886 -2.914 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.034 3.701 -3.728 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.185 5.264 -3.777 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.612 4.071 -4.238 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.960 5.453 -5.150 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.552 4.016 -6.016 1.00 0.00 H new