USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 908 hydrogens (12 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 55 SER OG : rot 20:sc= 1.08 USER MOD Set 1.2: A 99 CYS SG : rot 80:sc= 0.238 USER MOD Single : A 1 ATP O2' : rot 25:sc= 0.458 USER MOD Single : A 1 ATP O3' : rot -63:sc= 1.66 USER MOD Single : A 25 SER OG : rot 180:sc= 0.0332 USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= -2.9! C(o=-2.9!,f=-3.4!) USER MOD Single : A 35 SER OG : rot -134:sc= 0.444 USER MOD Single : A 42 HIS :FLIP no HD1:sc= -0.995 F(o=-2.6!,f=-0.99) USER MOD Single : A 43 ASN : amide:sc= -0.49 K(o=-0.49,f=-8.1!) USER MOD Single : A 47 SER OG : rot 180:sc= 0.0053 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= -8.1! C(o=-8.1!,f=-13!) USER MOD Single : A 64 SER OG : rot 83:sc= 0.315 USER MOD Single : A 68 THR OG1 : rot 71:sc= 0.803 USER MOD Single : A 75 SER OG : rot -43:sc= 0.665 USER MOD Single : A 85 LYS NZ :NH3+ 178:sc= -4.35! (180deg=-4.58!) USER MOD Single : A 88 GLN : amide:sc= -0.0502 K(o=-0.05,f=-1.9!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= -0.413 USER MOD Single : A 100 HIS : no HE2:sc= 0.819 K(o=0.82,f=-5.7!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= -0.273 USER MOD Single : A 106 GLN : amide:sc= -4.31! C(o=-4.3!,f=-5.1!) USER MOD Single : A 107 GLN : amide:sc= -3.56! C(o=-3.6!,f=-9.6!) USER MOD Single : A 109 GLN :FLIP amide:sc= -0.0284 F(o=-1.6!,f=-0.028) USER MOD Single : A 112 THR OG1 : rot -160:sc= -0.0331 USER MOD Single : A 116 LYS NZ :NH3+ -122:sc= -1.27 (180deg=-3.53!) USER MOD Single : A 119 GLN : amide:sc= -1.23! C(o=-1.2!,f=-5.9!) USER MOD Single : A 120 SER OG : rot 14:sc= -0.308 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot -53:sc= 0.441 USER MOD Single : A 133 THR OG1 : rot -81:sc= 0.767 USER MOD Single : A 137 GLN :FLIP amide:sc= -5.47! C(o=-11!,f=-5.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 6.876 -4.625 -27.919 1.00 0.00 N ATOM 2 CA GLY A 17 5.857 -4.383 -28.979 1.00 0.00 C ATOM 3 C GLY A 17 6.531 -3.759 -30.202 1.00 0.00 C ATOM 4 O GLY A 17 5.891 -3.458 -31.190 1.00 0.00 O ATOM 0 HA2 GLY A 17 5.375 -5.321 -29.255 1.00 0.00 H new ATOM 0 HA3 GLY A 17 5.076 -3.721 -28.604 1.00 0.00 H new ATOM 10 N ALA A 18 7.820 -3.562 -30.144 1.00 0.00 N ATOM 11 CA ALA A 18 8.534 -2.957 -31.304 1.00 0.00 C ATOM 12 C ALA A 18 10.031 -3.257 -31.194 1.00 0.00 C ATOM 13 O ALA A 18 10.835 -2.369 -30.985 1.00 0.00 O ATOM 14 CB ALA A 18 8.315 -1.443 -31.305 1.00 0.00 C ATOM 0 H ALA A 18 8.409 -3.794 -29.344 1.00 0.00 H new ATOM 0 HA ALA A 18 8.146 -3.380 -32.231 1.00 0.00 H new ATOM 0 HB1 ALA A 18 8.837 -1.000 -32.153 1.00 0.00 H new ATOM 0 HB2 ALA A 18 7.249 -1.230 -31.384 1.00 0.00 H new ATOM 0 HB3 ALA A 18 8.703 -1.019 -30.379 1.00 0.00 H new ATOM 20 N PRO A 19 10.401 -4.502 -31.334 1.00 0.00 N ATOM 21 CA PRO A 19 11.826 -4.937 -31.251 1.00 0.00 C ATOM 22 C PRO A 19 12.758 -4.032 -32.065 1.00 0.00 C ATOM 23 O PRO A 19 12.671 -3.962 -33.275 1.00 0.00 O ATOM 24 CB PRO A 19 11.797 -6.357 -31.828 1.00 0.00 C ATOM 25 CG PRO A 19 10.422 -6.861 -31.521 1.00 0.00 C ATOM 26 CD PRO A 19 9.497 -5.640 -31.589 1.00 0.00 C ATOM 0 HA PRO A 19 12.213 -4.890 -30.233 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.987 -6.353 -32.901 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.561 -6.986 -31.371 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.116 -7.622 -32.239 1.00 0.00 H new ATOM 0 HG3 PRO A 19 10.387 -7.322 -30.534 1.00 0.00 H new ATOM 0 HD2 PRO A 19 9.014 -5.557 -32.563 1.00 0.00 H new ATOM 0 HD3 PRO A 19 8.704 -5.696 -30.843 1.00 0.00 H new ATOM 34 N GLU A 20 13.649 -3.339 -31.410 1.00 0.00 N ATOM 35 CA GLU A 20 14.584 -2.441 -32.145 1.00 0.00 C ATOM 36 C GLU A 20 15.690 -3.277 -32.792 1.00 0.00 C ATOM 37 O GLU A 20 16.863 -3.049 -32.570 1.00 0.00 O ATOM 38 CB GLU A 20 15.204 -1.440 -31.169 1.00 0.00 C ATOM 39 CG GLU A 20 15.681 -2.179 -29.916 1.00 0.00 C ATOM 40 CD GLU A 20 16.556 -1.246 -29.076 1.00 0.00 C ATOM 41 OE1 GLU A 20 16.404 -0.043 -29.210 1.00 0.00 O ATOM 42 OE2 GLU A 20 17.363 -1.751 -28.313 1.00 0.00 O ATOM 0 H GLU A 20 13.770 -3.356 -30.397 1.00 0.00 H new ATOM 0 HA GLU A 20 14.037 -1.901 -32.918 1.00 0.00 H new ATOM 0 HB2 GLU A 20 16.041 -0.925 -31.642 1.00 0.00 H new ATOM 0 HB3 GLU A 20 14.473 -0.678 -30.899 1.00 0.00 H new ATOM 0 HG2 GLU A 20 14.825 -2.516 -29.332 1.00 0.00 H new ATOM 0 HG3 GLU A 20 16.245 -3.068 -30.198 1.00 0.00 H new ATOM 49 N GLY A 21 15.328 -4.243 -33.590 1.00 0.00 N ATOM 50 CA GLY A 21 16.360 -5.091 -34.250 1.00 0.00 C ATOM 51 C GLY A 21 16.883 -6.127 -33.251 1.00 0.00 C ATOM 52 O GLY A 21 16.438 -6.191 -32.122 1.00 0.00 O ATOM 0 H GLY A 21 14.362 -4.482 -33.814 1.00 0.00 H new ATOM 0 HA2 GLY A 21 15.934 -5.591 -35.119 1.00 0.00 H new ATOM 0 HA3 GLY A 21 17.181 -4.470 -34.610 1.00 0.00 H new ATOM 56 N PRO A 22 17.823 -6.934 -33.668 1.00 0.00 N ATOM 57 CA PRO A 22 18.424 -7.990 -32.803 1.00 0.00 C ATOM 58 C PRO A 22 18.783 -7.464 -31.407 1.00 0.00 C ATOM 59 O PRO A 22 18.566 -8.123 -30.410 1.00 0.00 O ATOM 60 CB PRO A 22 19.683 -8.405 -33.574 1.00 0.00 C ATOM 61 CG PRO A 22 19.347 -8.149 -35.009 1.00 0.00 C ATOM 62 CD PRO A 22 18.420 -6.928 -35.017 1.00 0.00 C ATOM 0 HA PRO A 22 17.735 -8.815 -32.620 1.00 0.00 H new ATOM 0 HB2 PRO A 22 20.550 -7.824 -33.260 1.00 0.00 H new ATOM 0 HB3 PRO A 22 19.924 -9.454 -33.404 1.00 0.00 H new ATOM 0 HG2 PRO A 22 20.248 -7.958 -35.592 1.00 0.00 H new ATOM 0 HG3 PRO A 22 18.856 -9.014 -35.455 1.00 0.00 H new ATOM 0 HD2 PRO A 22 18.972 -6.007 -35.207 1.00 0.00 H new ATOM 0 HD3 PRO A 22 17.658 -7.009 -35.792 1.00 0.00 H new ATOM 70 N GLY A 23 19.330 -6.282 -31.331 1.00 0.00 N ATOM 71 CA GLY A 23 19.701 -5.716 -30.004 1.00 0.00 C ATOM 72 C GLY A 23 21.019 -6.338 -29.533 1.00 0.00 C ATOM 73 O GLY A 23 21.077 -6.975 -28.500 1.00 0.00 O ATOM 0 H GLY A 23 19.536 -5.684 -32.131 1.00 0.00 H new ATOM 0 HA2 GLY A 23 19.802 -4.633 -30.074 1.00 0.00 H new ATOM 0 HA3 GLY A 23 18.913 -5.916 -29.278 1.00 0.00 H new ATOM 77 N PRO A 24 22.070 -6.152 -30.288 1.00 0.00 N ATOM 78 CA PRO A 24 23.415 -6.701 -29.948 1.00 0.00 C ATOM 79 C PRO A 24 24.096 -5.902 -28.830 1.00 0.00 C ATOM 80 O PRO A 24 23.888 -6.152 -27.660 1.00 0.00 O ATOM 81 CB PRO A 24 24.189 -6.574 -31.266 1.00 0.00 C ATOM 82 CG PRO A 24 23.576 -5.392 -31.949 1.00 0.00 C ATOM 83 CD PRO A 24 22.094 -5.394 -31.554 1.00 0.00 C ATOM 0 HA PRO A 24 23.365 -7.723 -29.571 1.00 0.00 H new ATOM 0 HB2 PRO A 24 25.253 -6.421 -31.088 1.00 0.00 H new ATOM 0 HB3 PRO A 24 24.093 -7.476 -31.871 1.00 0.00 H new ATOM 0 HG2 PRO A 24 24.061 -4.467 -31.637 1.00 0.00 H new ATOM 0 HG3 PRO A 24 23.691 -5.464 -33.031 1.00 0.00 H new ATOM 0 HD2 PRO A 24 21.714 -4.381 -31.421 1.00 0.00 H new ATOM 0 HD3 PRO A 24 21.477 -5.869 -32.317 1.00 0.00 H new ATOM 91 N SER A 25 24.909 -4.944 -29.183 1.00 0.00 N ATOM 92 CA SER A 25 25.601 -4.133 -28.143 1.00 0.00 C ATOM 93 C SER A 25 24.637 -3.081 -27.591 1.00 0.00 C ATOM 94 O SER A 25 24.311 -3.077 -26.420 1.00 0.00 O ATOM 95 CB SER A 25 26.815 -3.437 -28.762 1.00 0.00 C ATOM 96 OG SER A 25 26.441 -2.846 -29.999 1.00 0.00 O ATOM 0 H SER A 25 25.124 -4.688 -30.147 1.00 0.00 H new ATOM 0 HA SER A 25 25.930 -4.785 -27.334 1.00 0.00 H new ATOM 0 HB2 SER A 25 27.196 -2.675 -28.083 1.00 0.00 H new ATOM 0 HB3 SER A 25 27.619 -4.156 -28.918 1.00 0.00 H new ATOM 0 HG SER A 25 27.217 -2.398 -30.396 1.00 0.00 H new ATOM 102 N GLY A 26 24.179 -2.187 -28.424 1.00 0.00 N ATOM 103 CA GLY A 26 23.236 -1.137 -27.946 1.00 0.00 C ATOM 104 C GLY A 26 24.020 -0.038 -27.225 1.00 0.00 C ATOM 105 O GLY A 26 25.224 -0.115 -27.080 1.00 0.00 O ATOM 0 H GLY A 26 24.417 -2.138 -29.415 1.00 0.00 H new ATOM 0 HA2 GLY A 26 22.688 -0.715 -28.788 1.00 0.00 H new ATOM 0 HA3 GLY A 26 22.499 -1.574 -27.273 1.00 0.00 H new ATOM 109 N GLY A 27 23.347 0.984 -26.773 1.00 0.00 N ATOM 110 CA GLY A 27 24.054 2.086 -26.062 1.00 0.00 C ATOM 111 C GLY A 27 24.729 3.002 -27.085 1.00 0.00 C ATOM 112 O GLY A 27 24.755 4.207 -26.932 1.00 0.00 O ATOM 0 H GLY A 27 22.338 1.104 -26.865 1.00 0.00 H new ATOM 0 HA2 GLY A 27 23.348 2.656 -25.458 1.00 0.00 H new ATOM 0 HA3 GLY A 27 24.798 1.675 -25.380 1.00 0.00 H new ATOM 116 N ALA A 28 25.276 2.440 -28.129 1.00 0.00 N ATOM 117 CA ALA A 28 25.948 3.279 -29.160 1.00 0.00 C ATOM 118 C ALA A 28 24.957 4.309 -29.705 1.00 0.00 C ATOM 119 O ALA A 28 25.215 5.496 -29.702 1.00 0.00 O ATOM 120 CB ALA A 28 26.438 2.388 -30.303 1.00 0.00 C ATOM 0 H ALA A 28 25.286 1.437 -28.312 1.00 0.00 H new ATOM 0 HA ALA A 28 26.797 3.794 -28.711 1.00 0.00 H new ATOM 0 HB1 ALA A 28 26.930 3.002 -31.058 1.00 0.00 H new ATOM 0 HB2 ALA A 28 27.145 1.654 -29.915 1.00 0.00 H new ATOM 0 HB3 ALA A 28 25.589 1.872 -30.752 1.00 0.00 H new ATOM 126 N GLN A 29 23.822 3.864 -30.173 1.00 0.00 N ATOM 127 CA GLN A 29 22.816 4.818 -30.717 1.00 0.00 C ATOM 128 C GLN A 29 22.214 5.634 -29.571 1.00 0.00 C ATOM 129 O GLN A 29 21.785 5.093 -28.571 1.00 0.00 O ATOM 130 CB GLN A 29 21.706 4.040 -31.427 1.00 0.00 C ATOM 131 CG GLN A 29 20.725 5.022 -32.069 1.00 0.00 C ATOM 132 CD GLN A 29 19.767 4.259 -32.987 1.00 0.00 C ATOM 133 OE1 GLN A 29 19.522 3.086 -32.788 1.00 0.00 O ATOM 134 NE2 GLN A 29 19.213 4.880 -33.992 1.00 0.00 N ATOM 0 H GLN A 29 23.549 2.882 -30.202 1.00 0.00 H new ATOM 0 HA GLN A 29 23.300 5.490 -31.426 1.00 0.00 H new ATOM 0 HB2 GLN A 29 22.134 3.387 -32.188 1.00 0.00 H new ATOM 0 HB3 GLN A 29 21.184 3.400 -30.716 1.00 0.00 H new ATOM 0 HG2 GLN A 29 20.164 5.549 -31.297 1.00 0.00 H new ATOM 0 HG3 GLN A 29 21.269 5.776 -32.639 1.00 0.00 H new ATOM 0 HE21 GLN A 29 19.419 5.865 -34.159 1.00 0.00 H new ATOM 0 HE22 GLN A 29 18.574 4.380 -34.611 1.00 0.00 H new ATOM 143 N GLY A 30 22.178 6.931 -29.708 1.00 0.00 N ATOM 144 CA GLY A 30 21.604 7.779 -28.625 1.00 0.00 C ATOM 145 C GLY A 30 22.338 7.497 -27.313 1.00 0.00 C ATOM 146 O GLY A 30 23.547 7.598 -27.233 1.00 0.00 O ATOM 0 H GLY A 30 22.521 7.440 -30.523 1.00 0.00 H new ATOM 0 HA2 GLY A 30 21.696 8.833 -28.886 1.00 0.00 H new ATOM 0 HA3 GLY A 30 20.540 7.571 -28.511 1.00 0.00 H new ATOM 150 N GLY A 31 21.619 7.144 -26.283 1.00 0.00 N ATOM 151 CA GLY A 31 22.277 6.856 -24.978 1.00 0.00 C ATOM 152 C GLY A 31 21.236 6.909 -23.858 1.00 0.00 C ATOM 153 O GLY A 31 21.367 7.658 -22.911 1.00 0.00 O ATOM 0 H GLY A 31 20.604 7.043 -26.289 1.00 0.00 H new ATOM 0 HA2 GLY A 31 22.748 5.873 -25.005 1.00 0.00 H new ATOM 0 HA3 GLY A 31 23.067 7.583 -24.789 1.00 0.00 H new ATOM 157 N SER A 32 20.202 6.118 -23.958 1.00 0.00 N ATOM 158 CA SER A 32 19.155 6.124 -22.899 1.00 0.00 C ATOM 159 C SER A 32 19.813 5.940 -21.530 1.00 0.00 C ATOM 160 O SER A 32 20.931 5.474 -21.426 1.00 0.00 O ATOM 161 CB SER A 32 18.169 4.981 -23.149 1.00 0.00 C ATOM 162 OG SER A 32 18.883 3.760 -23.274 1.00 0.00 O ATOM 0 H SER A 32 20.038 5.469 -24.727 1.00 0.00 H new ATOM 0 HA SER A 32 18.622 7.074 -22.921 1.00 0.00 H new ATOM 0 HB2 SER A 32 17.456 4.915 -22.327 1.00 0.00 H new ATOM 0 HB3 SER A 32 17.595 5.173 -24.055 1.00 0.00 H new ATOM 0 HG SER A 32 18.252 3.027 -23.432 1.00 0.00 H new ATOM 168 N ILE A 33 19.130 6.301 -20.478 1.00 0.00 N ATOM 169 CA ILE A 33 19.719 6.146 -19.119 1.00 0.00 C ATOM 170 C ILE A 33 18.626 6.333 -18.064 1.00 0.00 C ATOM 171 O ILE A 33 17.580 6.888 -18.333 1.00 0.00 O ATOM 172 CB ILE A 33 20.811 7.197 -18.914 1.00 0.00 C ATOM 173 CG1 ILE A 33 21.435 7.020 -17.527 1.00 0.00 C ATOM 174 CG2 ILE A 33 20.201 8.595 -19.022 1.00 0.00 C ATOM 175 CD1 ILE A 33 22.738 7.818 -17.449 1.00 0.00 C ATOM 0 H ILE A 33 18.190 6.696 -20.502 1.00 0.00 H new ATOM 0 HA ILE A 33 20.150 5.150 -19.022 1.00 0.00 H new ATOM 0 HB ILE A 33 21.579 7.076 -19.678 1.00 0.00 H new ATOM 0 HG12 ILE A 33 20.741 7.360 -16.758 1.00 0.00 H new ATOM 0 HG13 ILE A 33 21.630 5.965 -17.336 1.00 0.00 H new ATOM 0 HG21 ILE A 33 20.979 9.344 -18.876 1.00 0.00 H new ATOM 0 HG22 ILE A 33 19.756 8.722 -20.009 1.00 0.00 H new ATOM 0 HG23 ILE A 33 19.433 8.717 -18.259 1.00 0.00 H new ATOM 0 HD11 ILE A 33 23.183 7.693 -16.462 1.00 0.00 H new ATOM 0 HD12 ILE A 33 23.432 7.457 -18.208 1.00 0.00 H new ATOM 0 HD13 ILE A 33 22.529 8.874 -17.621 1.00 0.00 H new ATOM 187 N HIS A 34 18.862 5.874 -16.865 1.00 0.00 N ATOM 188 CA HIS A 34 17.837 6.026 -15.793 1.00 0.00 C ATOM 189 C HIS A 34 18.508 5.899 -14.424 1.00 0.00 C ATOM 190 O HIS A 34 19.566 5.315 -14.293 1.00 0.00 O ATOM 191 CB HIS A 34 16.775 4.935 -15.944 1.00 0.00 C ATOM 192 CG HIS A 34 15.923 5.228 -17.148 1.00 0.00 C ATOM 193 ND1 HIS A 34 15.134 6.364 -17.236 1.00 0.00 N ATOM 194 CD2 HIS A 34 15.726 4.543 -18.321 1.00 0.00 C ATOM 195 CE1 HIS A 34 14.504 6.329 -18.425 1.00 0.00 C ATOM 196 NE2 HIS A 34 14.830 5.240 -19.126 1.00 0.00 N ATOM 0 H HIS A 34 19.720 5.401 -16.581 1.00 0.00 H new ATOM 0 HA HIS A 34 17.366 7.005 -15.877 1.00 0.00 H new ATOM 0 HB2 HIS A 34 17.252 3.961 -16.051 1.00 0.00 H new ATOM 0 HB3 HIS A 34 16.155 4.890 -15.049 1.00 0.00 H new ATOM 0 HD2 HIS A 34 16.195 3.605 -18.580 1.00 0.00 H new ATOM 0 HE1 HIS A 34 13.818 7.089 -18.770 1.00 0.00 H new ATOM 0 HE2 HIS A 34 14.494 4.976 -20.052 1.00 0.00 H new ATOM 204 N SER A 35 17.903 6.442 -13.403 1.00 0.00 N ATOM 205 CA SER A 35 18.507 6.352 -12.044 1.00 0.00 C ATOM 206 C SER A 35 18.200 4.982 -11.436 1.00 0.00 C ATOM 207 O SER A 35 18.039 4.003 -12.137 1.00 0.00 O ATOM 208 CB SER A 35 17.920 7.448 -11.152 1.00 0.00 C ATOM 209 OG SER A 35 18.607 7.467 -9.910 1.00 0.00 O ATOM 0 H SER A 35 17.016 6.944 -13.452 1.00 0.00 H new ATOM 0 HA SER A 35 19.587 6.482 -12.118 1.00 0.00 H new ATOM 0 HB2 SER A 35 18.008 8.417 -11.643 1.00 0.00 H new ATOM 0 HB3 SER A 35 16.857 7.269 -10.989 1.00 0.00 H new ATOM 0 HG SER A 35 17.958 7.522 -9.178 1.00 0.00 H new ATOM 215 N GLY A 36 18.119 4.905 -10.136 1.00 0.00 N ATOM 216 CA GLY A 36 17.823 3.599 -9.483 1.00 0.00 C ATOM 217 C GLY A 36 18.241 3.660 -8.012 1.00 0.00 C ATOM 218 O GLY A 36 17.492 3.295 -7.128 1.00 0.00 O ATOM 0 H GLY A 36 18.245 5.691 -9.498 1.00 0.00 H new ATOM 0 HA2 GLY A 36 16.759 3.374 -9.561 1.00 0.00 H new ATOM 0 HA3 GLY A 36 18.357 2.796 -9.991 1.00 0.00 H new ATOM 222 N ARG A 37 19.433 4.120 -7.744 1.00 0.00 N ATOM 223 CA ARG A 37 19.899 4.207 -6.332 1.00 0.00 C ATOM 224 C ARG A 37 19.080 5.267 -5.591 1.00 0.00 C ATOM 225 O ARG A 37 19.232 6.451 -5.819 1.00 0.00 O ATOM 226 CB ARG A 37 21.379 4.597 -6.307 1.00 0.00 C ATOM 227 CG ARG A 37 22.147 3.759 -7.334 1.00 0.00 C ATOM 228 CD ARG A 37 21.962 2.271 -7.029 1.00 0.00 C ATOM 229 NE ARG A 37 22.072 2.044 -5.561 1.00 0.00 N ATOM 230 CZ ARG A 37 23.226 2.173 -4.966 1.00 0.00 C ATOM 231 NH1 ARG A 37 24.284 2.497 -5.658 1.00 0.00 N ATOM 232 NH2 ARG A 37 23.323 1.978 -3.679 1.00 0.00 N ATOM 0 H ARG A 37 20.104 4.439 -8.443 1.00 0.00 H new ATOM 0 HA ARG A 37 19.770 3.240 -5.845 1.00 0.00 H new ATOM 0 HB2 ARG A 37 21.490 5.658 -6.532 1.00 0.00 H new ATOM 0 HB3 ARG A 37 21.791 4.437 -5.311 1.00 0.00 H new ATOM 0 HG2 ARG A 37 21.789 3.981 -8.339 1.00 0.00 H new ATOM 0 HG3 ARG A 37 23.206 4.016 -7.309 1.00 0.00 H new ATOM 0 HD2 ARG A 37 20.989 1.934 -7.387 1.00 0.00 H new ATOM 0 HD3 ARG A 37 22.716 1.685 -7.555 1.00 0.00 H new ATOM 0 HE ARG A 37 21.245 1.788 -5.021 1.00 0.00 H new ATOM 0 HH11 ARG A 37 24.209 2.649 -6.664 1.00 0.00 H new ATOM 0 HH12 ARG A 37 25.186 2.598 -5.193 1.00 0.00 H new ATOM 0 HH21 ARG A 37 22.496 1.725 -3.138 1.00 0.00 H new ATOM 0 HH22 ARG A 37 24.225 2.079 -3.214 1.00 0.00 H new ATOM 246 N ILE A 38 18.210 4.854 -4.703 1.00 0.00 N ATOM 247 CA ILE A 38 17.377 5.839 -3.945 1.00 0.00 C ATOM 248 C ILE A 38 17.190 5.339 -2.513 1.00 0.00 C ATOM 249 O ILE A 38 16.335 4.523 -2.233 1.00 0.00 O ATOM 250 CB ILE A 38 16.013 5.985 -4.635 1.00 0.00 C ATOM 251 CG1 ILE A 38 16.248 6.407 -6.088 1.00 0.00 C ATOM 252 CG2 ILE A 38 15.159 7.048 -3.921 1.00 0.00 C ATOM 253 CD1 ILE A 38 14.916 6.766 -6.754 1.00 0.00 C ATOM 0 H ILE A 38 18.040 3.876 -4.470 1.00 0.00 H new ATOM 0 HA ILE A 38 17.872 6.810 -3.924 1.00 0.00 H new ATOM 0 HB ILE A 38 15.482 5.034 -4.596 1.00 0.00 H new ATOM 0 HG12 ILE A 38 16.923 7.263 -6.122 1.00 0.00 H new ATOM 0 HG13 ILE A 38 16.731 5.598 -6.636 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.196 7.138 -4.423 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.001 6.751 -2.884 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.674 8.008 -3.949 1.00 0.00 H new ATOM 0 HD11 ILE A 38 15.095 7.065 -7.787 1.00 0.00 H new ATOM 0 HD12 ILE A 38 14.255 5.900 -6.736 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.449 7.590 -6.214 1.00 0.00 H new ATOM 265 N ALA A 39 17.988 5.829 -1.604 1.00 0.00 N ATOM 266 CA ALA A 39 17.872 5.397 -0.178 1.00 0.00 C ATOM 267 C ALA A 39 16.998 6.397 0.583 1.00 0.00 C ATOM 268 O ALA A 39 17.432 7.477 0.930 1.00 0.00 O ATOM 269 CB ALA A 39 19.266 5.354 0.451 1.00 0.00 C ATOM 0 H ALA A 39 18.721 6.515 -1.787 1.00 0.00 H new ATOM 0 HA ALA A 39 17.419 4.407 -0.128 1.00 0.00 H new ATOM 0 HB1 ALA A 39 19.186 5.039 1.492 1.00 0.00 H new ATOM 0 HB2 ALA A 39 19.890 4.647 -0.095 1.00 0.00 H new ATOM 0 HB3 ALA A 39 19.716 6.346 0.405 1.00 0.00 H new ATOM 275 N ALA A 40 15.765 6.048 0.837 1.00 0.00 N ATOM 276 CA ALA A 40 14.855 6.979 1.568 1.00 0.00 C ATOM 277 C ALA A 40 13.791 6.174 2.327 1.00 0.00 C ATOM 278 O ALA A 40 13.825 4.956 2.370 1.00 0.00 O ATOM 279 CB ALA A 40 14.187 7.922 0.556 1.00 0.00 C ATOM 0 H ALA A 40 15.347 5.157 0.569 1.00 0.00 H new ATOM 0 HA ALA A 40 15.425 7.567 2.287 1.00 0.00 H new ATOM 0 HB1 ALA A 40 13.520 8.606 1.081 1.00 0.00 H new ATOM 0 HB2 ALA A 40 14.952 8.493 0.031 1.00 0.00 H new ATOM 0 HB3 ALA A 40 13.614 7.337 -0.163 1.00 0.00 H new ATOM 285 N VAL A 41 12.854 6.851 2.934 1.00 0.00 N ATOM 286 CA VAL A 41 11.784 6.146 3.698 1.00 0.00 C ATOM 287 C VAL A 41 10.789 5.531 2.712 1.00 0.00 C ATOM 288 O VAL A 41 10.504 6.090 1.671 1.00 0.00 O ATOM 289 CB VAL A 41 11.059 7.148 4.603 1.00 0.00 C ATOM 290 CG1 VAL A 41 9.899 6.464 5.333 1.00 0.00 C ATOM 291 CG2 VAL A 41 12.039 7.708 5.637 1.00 0.00 C ATOM 0 H VAL A 41 12.783 7.869 2.934 1.00 0.00 H new ATOM 0 HA VAL A 41 12.225 5.360 4.312 1.00 0.00 H new ATOM 0 HB VAL A 41 10.667 7.956 3.985 1.00 0.00 H new ATOM 0 HG11 VAL A 41 9.394 7.188 5.972 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.192 6.069 4.603 1.00 0.00 H new ATOM 0 HG13 VAL A 41 10.284 5.648 5.944 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.522 8.420 6.280 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.434 6.893 6.243 1.00 0.00 H new ATOM 0 HG23 VAL A 41 12.860 8.210 5.125 1.00 0.00 H new ATOM 301 N HIS A 42 10.268 4.379 3.028 1.00 0.00 N ATOM 302 CA HIS A 42 9.298 3.709 2.111 1.00 0.00 C ATOM 303 C HIS A 42 8.328 2.850 2.929 1.00 0.00 C ATOM 304 O HIS A 42 8.588 2.507 4.065 1.00 0.00 O ATOM 305 CB HIS A 42 10.073 2.793 1.149 1.00 0.00 C ATOM 306 CG HIS A 42 10.592 3.577 -0.027 1.00 0.00 C ATOM 307 ND1 HIS A 42 11.602 4.498 -0.146 1.00 0.00 N flip ATOM 308 CD2 HIS A 42 10.061 3.431 -1.298 1.00 0.00 C flip ATOM 309 CE1 HIS A 42 11.700 4.918 -1.469 1.00 0.00 C flip ATOM 310 NE2 HIS A 42 10.749 4.243 -2.120 1.00 0.00 N flip ATOM 0 H HIS A 42 10.472 3.868 3.887 1.00 0.00 H new ATOM 0 HA HIS A 42 8.743 4.464 1.554 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.904 2.324 1.675 1.00 0.00 H new ATOM 0 HB3 HIS A 42 9.423 1.991 0.800 1.00 0.00 H new ATOM 0 HD2 HIS A 42 9.243 2.783 -1.578 1.00 0.00 H new ATOM 0 HE1 HIS A 42 12.395 5.635 -1.881 1.00 0.00 H new ATOM 0 HE2 HIS A 42 10.567 4.333 -3.120 1.00 0.00 H new ATOM 318 N ASN A 43 7.224 2.477 2.337 1.00 0.00 N ATOM 319 CA ASN A 43 6.234 1.608 3.040 1.00 0.00 C ATOM 320 C ASN A 43 6.408 0.181 2.516 1.00 0.00 C ATOM 321 O ASN A 43 5.863 -0.186 1.494 1.00 0.00 O ATOM 322 CB ASN A 43 4.821 2.099 2.741 1.00 0.00 C ATOM 323 CG ASN A 43 4.705 2.416 1.254 1.00 0.00 C ATOM 324 OD1 ASN A 43 5.595 2.114 0.485 1.00 0.00 O ATOM 325 ND2 ASN A 43 3.639 3.016 0.812 1.00 0.00 N ATOM 0 H ASN A 43 6.963 2.740 1.387 1.00 0.00 H new ATOM 0 HA ASN A 43 6.394 1.639 4.118 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.092 1.339 3.021 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.599 2.987 3.333 1.00 0.00 H new ATOM 0 HD21 ASN A 43 3.550 3.233 -0.181 1.00 0.00 H new ATOM 0 HD22 ASN A 43 2.892 3.270 1.458 1.00 0.00 H new ATOM 332 N VAL A 44 7.186 -0.621 3.194 1.00 0.00 N ATOM 333 CA VAL A 44 7.423 -2.021 2.719 1.00 0.00 C ATOM 334 C VAL A 44 6.317 -2.949 3.276 1.00 0.00 C ATOM 335 O VAL A 44 6.108 -2.991 4.472 1.00 0.00 O ATOM 336 CB VAL A 44 8.816 -2.484 3.197 1.00 0.00 C ATOM 337 CG1 VAL A 44 8.788 -2.873 4.677 1.00 0.00 C ATOM 338 CG2 VAL A 44 9.275 -3.692 2.376 1.00 0.00 C ATOM 0 H VAL A 44 7.669 -0.369 4.057 1.00 0.00 H new ATOM 0 HA VAL A 44 7.391 -2.060 1.630 1.00 0.00 H new ATOM 0 HB VAL A 44 9.509 -1.654 3.062 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.782 -3.195 4.987 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.482 -2.013 5.273 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.080 -3.688 4.826 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.259 -4.013 2.719 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.563 -4.508 2.500 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.330 -3.416 1.323 1.00 0.00 H new ATOM 348 N PRO A 45 5.597 -3.686 2.439 1.00 0.00 N ATOM 349 CA PRO A 45 4.508 -4.594 2.923 1.00 0.00 C ATOM 350 C PRO A 45 4.931 -5.477 4.103 1.00 0.00 C ATOM 351 O PRO A 45 6.028 -5.995 4.147 1.00 0.00 O ATOM 352 CB PRO A 45 4.183 -5.462 1.701 1.00 0.00 C ATOM 353 CG PRO A 45 4.534 -4.616 0.523 1.00 0.00 C ATOM 354 CD PRO A 45 5.719 -3.746 0.958 1.00 0.00 C ATOM 0 HA PRO A 45 3.661 -4.020 3.298 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.760 -6.387 1.709 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.130 -5.743 1.685 1.00 0.00 H new ATOM 0 HG2 PRO A 45 4.799 -5.234 -0.335 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.688 -3.999 0.221 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.669 -4.185 0.653 1.00 0.00 H new ATOM 0 HD3 PRO A 45 5.669 -2.752 0.513 1.00 0.00 H new ATOM 362 N LEU A 46 4.054 -5.658 5.053 1.00 0.00 N ATOM 363 CA LEU A 46 4.385 -6.516 6.222 1.00 0.00 C ATOM 364 C LEU A 46 4.537 -7.964 5.759 1.00 0.00 C ATOM 365 O LEU A 46 5.274 -8.744 6.329 1.00 0.00 O ATOM 366 CB LEU A 46 3.240 -6.466 7.237 1.00 0.00 C ATOM 367 CG LEU A 46 3.042 -5.032 7.787 1.00 0.00 C ATOM 368 CD1 LEU A 46 1.560 -4.801 8.073 1.00 0.00 C ATOM 369 CD2 LEU A 46 3.829 -4.831 9.090 1.00 0.00 C ATOM 0 H LEU A 46 3.121 -5.247 5.068 1.00 0.00 H new ATOM 0 HA LEU A 46 5.310 -6.157 6.674 1.00 0.00 H new ATOM 0 HB2 LEU A 46 2.318 -6.808 6.767 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.450 -7.148 8.060 1.00 0.00 H new ATOM 0 HG LEU A 46 3.404 -4.326 7.040 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.417 -3.792 8.460 1.00 0.00 H new ATOM 0 HD12 LEU A 46 0.989 -4.920 7.152 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.215 -5.525 8.811 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.674 -3.816 9.456 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.482 -5.544 9.838 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.891 -4.990 8.902 1.00 0.00 H new ATOM 381 N SER A 47 3.803 -8.328 4.751 1.00 0.00 N ATOM 382 CA SER A 47 3.837 -9.731 4.248 1.00 0.00 C ATOM 383 C SER A 47 5.224 -10.122 3.715 1.00 0.00 C ATOM 384 O SER A 47 5.572 -11.287 3.714 1.00 0.00 O ATOM 385 CB SER A 47 2.810 -9.872 3.124 1.00 0.00 C ATOM 386 OG SER A 47 2.957 -8.795 2.211 1.00 0.00 O ATOM 0 H SER A 47 3.171 -7.707 4.245 1.00 0.00 H new ATOM 0 HA SER A 47 3.604 -10.395 5.080 1.00 0.00 H new ATOM 0 HB2 SER A 47 2.948 -10.822 2.608 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.801 -9.878 3.537 1.00 0.00 H new ATOM 0 HG SER A 47 2.300 -8.886 1.489 1.00 0.00 H new ATOM 392 N VAL A 48 6.012 -9.184 3.241 1.00 0.00 N ATOM 393 CA VAL A 48 7.362 -9.543 2.684 1.00 0.00 C ATOM 394 C VAL A 48 8.483 -9.200 3.673 1.00 0.00 C ATOM 395 O VAL A 48 9.618 -9.009 3.282 1.00 0.00 O ATOM 396 CB VAL A 48 7.592 -8.795 1.362 1.00 0.00 C ATOM 397 CG1 VAL A 48 6.378 -8.982 0.448 1.00 0.00 C ATOM 398 CG2 VAL A 48 7.814 -7.301 1.617 1.00 0.00 C ATOM 0 H VAL A 48 5.783 -8.190 3.215 1.00 0.00 H new ATOM 0 HA VAL A 48 7.381 -10.619 2.509 1.00 0.00 H new ATOM 0 HB VAL A 48 8.482 -9.203 0.882 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.543 -8.451 -0.489 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.237 -10.043 0.243 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.489 -8.585 0.938 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.975 -6.790 0.668 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.937 -6.882 2.111 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.688 -7.167 2.254 1.00 0.00 H new ATOM 408 N LEU A 49 8.199 -9.143 4.949 1.00 0.00 N ATOM 409 CA LEU A 49 9.276 -8.841 5.937 1.00 0.00 C ATOM 410 C LEU A 49 9.908 -10.157 6.385 1.00 0.00 C ATOM 411 O LEU A 49 9.225 -11.118 6.680 1.00 0.00 O ATOM 412 CB LEU A 49 8.692 -8.134 7.165 1.00 0.00 C ATOM 413 CG LEU A 49 8.310 -6.681 6.839 1.00 0.00 C ATOM 414 CD1 LEU A 49 7.672 -6.059 8.087 1.00 0.00 C ATOM 415 CD2 LEU A 49 9.555 -5.864 6.436 1.00 0.00 C ATOM 0 H LEU A 49 7.272 -9.292 5.347 1.00 0.00 H new ATOM 0 HA LEU A 49 10.018 -8.192 5.471 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.813 -8.674 7.515 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.419 -8.148 7.977 1.00 0.00 H new ATOM 0 HG LEU A 49 7.611 -6.670 6.003 1.00 0.00 H new ATOM 0 HD11 LEU A 49 7.393 -5.026 7.877 1.00 0.00 H new ATOM 0 HD12 LEU A 49 6.783 -6.626 8.362 1.00 0.00 H new ATOM 0 HD13 LEU A 49 8.386 -6.082 8.910 1.00 0.00 H new ATOM 0 HD21 LEU A 49 9.260 -4.839 6.210 1.00 0.00 H new ATOM 0 HD22 LEU A 49 10.271 -5.863 7.258 1.00 0.00 H new ATOM 0 HD23 LEU A 49 10.015 -6.312 5.555 1.00 0.00 H new ATOM 427 N ILE A 50 11.210 -10.204 6.436 1.00 0.00 N ATOM 428 CA ILE A 50 11.913 -11.453 6.862 1.00 0.00 C ATOM 429 C ILE A 50 12.393 -11.308 8.306 1.00 0.00 C ATOM 430 O ILE A 50 13.240 -10.489 8.611 1.00 0.00 O ATOM 431 CB ILE A 50 13.116 -11.683 5.953 1.00 0.00 C ATOM 432 CG1 ILE A 50 12.641 -11.745 4.502 1.00 0.00 C ATOM 433 CG2 ILE A 50 13.796 -13.001 6.325 1.00 0.00 C ATOM 434 CD1 ILE A 50 13.850 -11.790 3.568 1.00 0.00 C ATOM 0 H ILE A 50 11.825 -9.425 6.199 1.00 0.00 H new ATOM 0 HA ILE A 50 11.227 -12.298 6.793 1.00 0.00 H new ATOM 0 HB ILE A 50 13.828 -10.866 6.073 1.00 0.00 H new ATOM 0 HG12 ILE A 50 12.018 -12.627 4.350 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.024 -10.876 4.273 1.00 0.00 H new ATOM 0 HG21 ILE A 50 14.655 -13.163 5.674 1.00 0.00 H new ATOM 0 HG22 ILE A 50 14.129 -12.959 7.362 1.00 0.00 H new ATOM 0 HG23 ILE A 50 13.089 -13.822 6.204 1.00 0.00 H new ATOM 0 HD11 ILE A 50 13.509 -11.834 2.534 1.00 0.00 H new ATOM 0 HD12 ILE A 50 14.455 -10.895 3.713 1.00 0.00 H new ATOM 0 HD13 ILE A 50 14.449 -12.673 3.791 1.00 0.00 H new ATOM 446 N ARG A 51 11.857 -12.106 9.196 1.00 0.00 N ATOM 447 CA ARG A 51 12.273 -12.041 10.632 1.00 0.00 C ATOM 448 C ARG A 51 12.524 -13.462 11.162 1.00 0.00 C ATOM 449 O ARG A 51 11.610 -14.121 11.617 1.00 0.00 O ATOM 450 CB ARG A 51 11.138 -11.413 11.444 1.00 0.00 C ATOM 451 CG ARG A 51 10.930 -9.968 10.993 1.00 0.00 C ATOM 452 CD ARG A 51 9.739 -9.363 11.740 1.00 0.00 C ATOM 453 NE ARG A 51 9.757 -7.881 11.585 1.00 0.00 N ATOM 454 CZ ARG A 51 10.586 -7.161 12.290 1.00 0.00 C ATOM 455 NH1 ARG A 51 11.399 -7.739 13.132 1.00 0.00 N ATOM 456 NH2 ARG A 51 10.602 -5.864 12.154 1.00 0.00 N ATOM 0 H ARG A 51 11.144 -12.805 8.988 1.00 0.00 H new ATOM 0 HA ARG A 51 13.183 -11.448 10.722 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.220 -11.984 11.308 1.00 0.00 H new ATOM 0 HB3 ARG A 51 11.377 -11.443 12.507 1.00 0.00 H new ATOM 0 HG2 ARG A 51 11.829 -9.383 11.187 1.00 0.00 H new ATOM 0 HG3 ARG A 51 10.753 -9.934 9.918 1.00 0.00 H new ATOM 0 HD2 ARG A 51 8.806 -9.769 11.349 1.00 0.00 H new ATOM 0 HD3 ARG A 51 9.785 -9.630 12.796 1.00 0.00 H new ATOM 0 HE ARG A 51 9.121 -7.429 10.928 1.00 0.00 H new ATOM 0 HH11 ARG A 51 11.386 -8.753 13.239 1.00 0.00 H new ATOM 0 HH12 ARG A 51 12.047 -7.176 13.683 1.00 0.00 H new ATOM 0 HH21 ARG A 51 9.966 -5.412 11.496 1.00 0.00 H new ATOM 0 HH22 ARG A 51 11.250 -5.301 12.705 1.00 0.00 H new ATOM 470 N PRO A 52 13.751 -13.926 11.135 1.00 0.00 N ATOM 471 CA PRO A 52 14.122 -15.269 11.645 1.00 0.00 C ATOM 472 C PRO A 52 14.711 -15.200 13.059 1.00 0.00 C ATOM 473 O PRO A 52 15.553 -15.996 13.425 1.00 0.00 O ATOM 474 CB PRO A 52 15.199 -15.679 10.652 1.00 0.00 C ATOM 475 CG PRO A 52 15.951 -14.403 10.391 1.00 0.00 C ATOM 476 CD PRO A 52 14.941 -13.248 10.590 1.00 0.00 C ATOM 0 HA PRO A 52 13.276 -15.953 11.720 1.00 0.00 H new ATOM 0 HB2 PRO A 52 15.850 -16.450 11.064 1.00 0.00 H new ATOM 0 HB3 PRO A 52 14.766 -16.083 9.737 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.794 -14.303 11.075 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.358 -14.393 9.380 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.324 -12.493 11.277 1.00 0.00 H new ATOM 0 HD3 PRO A 52 14.720 -12.741 9.651 1.00 0.00 H new ATOM 484 N LEU A 53 14.300 -14.237 13.845 1.00 0.00 N ATOM 485 CA LEU A 53 14.862 -14.096 15.224 1.00 0.00 C ATOM 486 C LEU A 53 13.748 -13.689 16.206 1.00 0.00 C ATOM 487 O LEU A 53 13.534 -12.518 16.453 1.00 0.00 O ATOM 488 CB LEU A 53 15.950 -13.006 15.178 1.00 0.00 C ATOM 489 CG LEU A 53 16.977 -13.208 16.299 1.00 0.00 C ATOM 490 CD1 LEU A 53 18.148 -12.247 16.077 1.00 0.00 C ATOM 491 CD2 LEU A 53 16.331 -12.923 17.659 1.00 0.00 C ATOM 0 H LEU A 53 13.599 -13.541 13.591 1.00 0.00 H new ATOM 0 HA LEU A 53 15.286 -15.042 15.562 1.00 0.00 H new ATOM 0 HB2 LEU A 53 16.452 -13.029 14.211 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.489 -12.023 15.275 1.00 0.00 H new ATOM 0 HG LEU A 53 17.333 -14.238 16.286 1.00 0.00 H new ATOM 0 HD11 LEU A 53 18.885 -12.382 16.869 1.00 0.00 H new ATOM 0 HD12 LEU A 53 18.611 -12.454 15.112 1.00 0.00 H new ATOM 0 HD13 LEU A 53 17.784 -11.220 16.092 1.00 0.00 H new ATOM 0 HD21 LEU A 53 17.067 -13.069 18.449 1.00 0.00 H new ATOM 0 HD22 LEU A 53 15.972 -11.894 17.683 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.493 -13.603 17.814 1.00 0.00 H new ATOM 503 N PRO A 54 13.046 -14.644 16.771 1.00 0.00 N ATOM 504 CA PRO A 54 11.950 -14.362 17.746 1.00 0.00 C ATOM 505 C PRO A 54 12.397 -13.385 18.842 1.00 0.00 C ATOM 506 O PRO A 54 13.565 -13.075 18.967 1.00 0.00 O ATOM 507 CB PRO A 54 11.627 -15.742 18.335 1.00 0.00 C ATOM 508 CG PRO A 54 12.003 -16.708 17.258 1.00 0.00 C ATOM 509 CD PRO A 54 13.210 -16.093 16.544 1.00 0.00 C ATOM 0 HA PRO A 54 11.090 -13.885 17.276 1.00 0.00 H new ATOM 0 HB2 PRO A 54 12.193 -15.926 19.248 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.571 -15.826 18.592 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.252 -17.683 17.677 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.176 -16.861 16.565 1.00 0.00 H new ATOM 0 HD2 PRO A 54 14.150 -16.460 16.957 1.00 0.00 H new ATOM 0 HD3 PRO A 54 13.213 -16.335 15.481 1.00 0.00 H new ATOM 517 N SER A 55 11.480 -12.894 19.632 1.00 0.00 N ATOM 518 CA SER A 55 11.867 -11.936 20.708 1.00 0.00 C ATOM 519 C SER A 55 10.786 -11.900 21.790 1.00 0.00 C ATOM 520 O SER A 55 9.675 -12.352 21.595 1.00 0.00 O ATOM 521 CB SER A 55 12.023 -10.536 20.105 1.00 0.00 C ATOM 522 OG SER A 55 13.298 -10.425 19.489 1.00 0.00 O ATOM 0 H SER A 55 10.485 -13.113 19.580 1.00 0.00 H new ATOM 0 HA SER A 55 12.809 -12.258 21.152 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.236 -10.354 19.373 1.00 0.00 H new ATOM 0 HB3 SER A 55 11.916 -9.780 20.882 1.00 0.00 H new ATOM 0 HG SER A 55 13.654 -11.320 19.310 1.00 0.00 H new ATOM 528 N VAL A 56 11.108 -11.342 22.928 1.00 0.00 N ATOM 529 CA VAL A 56 10.110 -11.242 24.037 1.00 0.00 C ATOM 530 C VAL A 56 9.444 -9.863 23.966 1.00 0.00 C ATOM 531 O VAL A 56 10.088 -8.842 24.099 1.00 0.00 O ATOM 532 CB VAL A 56 10.813 -11.447 25.400 1.00 0.00 C ATOM 533 CG1 VAL A 56 11.506 -10.159 25.874 1.00 0.00 C ATOM 534 CG2 VAL A 56 9.779 -11.871 26.449 1.00 0.00 C ATOM 0 H VAL A 56 12.025 -10.949 23.139 1.00 0.00 H new ATOM 0 HA VAL A 56 9.350 -12.016 23.934 1.00 0.00 H new ATOM 0 HB VAL A 56 11.570 -12.221 25.275 1.00 0.00 H new ATOM 0 HG11 VAL A 56 11.990 -10.338 26.834 1.00 0.00 H new ATOM 0 HG12 VAL A 56 12.255 -9.858 25.141 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.766 -9.366 25.983 1.00 0.00 H new ATOM 0 HG21 VAL A 56 10.273 -12.016 27.410 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.019 -11.095 26.545 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.308 -12.804 26.139 1.00 0.00 H new ATOM 544 N LEU A 57 8.160 -9.826 23.725 1.00 0.00 N ATOM 545 CA LEU A 57 7.448 -8.518 23.612 1.00 0.00 C ATOM 546 C LEU A 57 6.743 -8.169 24.915 1.00 0.00 C ATOM 547 O LEU A 57 6.246 -9.018 25.629 1.00 0.00 O ATOM 548 CB LEU A 57 6.405 -8.594 22.505 1.00 0.00 C ATOM 549 CG LEU A 57 7.077 -8.980 21.182 1.00 0.00 C ATOM 550 CD1 LEU A 57 5.997 -9.181 20.114 1.00 0.00 C ATOM 551 CD2 LEU A 57 8.046 -7.868 20.742 1.00 0.00 C ATOM 0 H LEU A 57 7.571 -10.649 23.601 1.00 0.00 H new ATOM 0 HA LEU A 57 8.188 -7.750 23.386 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.641 -9.328 22.763 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.902 -7.633 22.401 1.00 0.00 H new ATOM 0 HG LEU A 57 7.640 -9.904 21.314 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.466 -9.456 19.169 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.319 -9.975 20.427 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.436 -8.255 19.985 1.00 0.00 H new ATOM 0 HD21 LEU A 57 8.520 -8.149 19.801 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.495 -6.938 20.607 1.00 0.00 H new ATOM 0 HD23 LEU A 57 8.811 -7.729 21.506 1.00 0.00 H new ATOM 563 N ASP A 58 6.692 -6.904 25.207 1.00 0.00 N ATOM 564 CA ASP A 58 6.020 -6.413 26.439 1.00 0.00 C ATOM 565 C ASP A 58 4.626 -5.878 26.042 1.00 0.00 C ATOM 566 O ASP A 58 4.503 -5.164 25.068 1.00 0.00 O ATOM 567 CB ASP A 58 6.882 -5.284 27.013 1.00 0.00 C ATOM 568 CG ASP A 58 6.077 -4.444 28.009 1.00 0.00 C ATOM 569 OD1 ASP A 58 5.121 -3.818 27.587 1.00 0.00 O ATOM 570 OD2 ASP A 58 6.433 -4.442 29.175 1.00 0.00 O ATOM 0 H ASP A 58 7.099 -6.169 24.628 1.00 0.00 H new ATOM 0 HA ASP A 58 5.902 -7.201 27.183 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.758 -5.704 27.508 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.246 -4.650 26.204 1.00 0.00 H new ATOM 575 N PRO A 59 3.577 -6.220 26.763 1.00 0.00 N ATOM 576 CA PRO A 59 2.196 -5.753 26.423 1.00 0.00 C ATOM 577 C PRO A 59 1.948 -4.282 26.794 1.00 0.00 C ATOM 578 O PRO A 59 1.060 -3.645 26.266 1.00 0.00 O ATOM 579 CB PRO A 59 1.298 -6.682 27.249 1.00 0.00 C ATOM 580 CG PRO A 59 2.119 -7.027 28.450 1.00 0.00 C ATOM 581 CD PRO A 59 3.574 -7.078 27.967 1.00 0.00 C ATOM 0 HA PRO A 59 2.009 -5.795 25.350 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.369 -6.187 27.532 1.00 0.00 H new ATOM 0 HB3 PRO A 59 1.025 -7.574 26.685 1.00 0.00 H new ATOM 0 HG2 PRO A 59 1.994 -6.281 29.235 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.813 -7.985 28.869 1.00 0.00 H new ATOM 0 HD2 PRO A 59 4.261 -6.704 28.726 1.00 0.00 H new ATOM 0 HD3 PRO A 59 3.882 -8.097 27.733 1.00 0.00 H new ATOM 589 N ALA A 60 2.712 -3.737 27.697 1.00 0.00 N ATOM 590 CA ALA A 60 2.493 -2.313 28.089 1.00 0.00 C ATOM 591 C ALA A 60 3.180 -1.384 27.087 1.00 0.00 C ATOM 592 O ALA A 60 2.657 -0.349 26.725 1.00 0.00 O ATOM 593 CB ALA A 60 3.075 -2.075 29.484 1.00 0.00 C ATOM 0 H ALA A 60 3.475 -4.211 28.180 1.00 0.00 H new ATOM 0 HA ALA A 60 1.423 -2.104 28.096 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.916 -1.036 29.772 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.580 -2.730 30.201 1.00 0.00 H new ATOM 0 HB3 ALA A 60 4.144 -2.289 29.474 1.00 0.00 H new ATOM 599 N LYS A 61 4.353 -1.738 26.646 1.00 0.00 N ATOM 600 CA LYS A 61 5.081 -0.874 25.682 1.00 0.00 C ATOM 601 C LYS A 61 4.430 -0.976 24.291 1.00 0.00 C ATOM 602 O LYS A 61 4.441 -0.032 23.528 1.00 0.00 O ATOM 603 CB LYS A 61 6.564 -1.318 25.634 1.00 0.00 C ATOM 604 CG LYS A 61 7.489 -0.099 25.699 1.00 0.00 C ATOM 605 CD LYS A 61 8.940 -0.536 25.472 1.00 0.00 C ATOM 606 CE LYS A 61 9.398 -1.458 26.608 1.00 0.00 C ATOM 607 NZ LYS A 61 10.886 -1.456 26.677 1.00 0.00 N ATOM 0 H LYS A 61 4.840 -2.593 26.914 1.00 0.00 H new ATOM 0 HA LYS A 61 5.032 0.167 26.000 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.777 -1.988 26.467 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.753 -1.878 24.718 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.197 0.631 24.944 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.394 0.390 26.669 1.00 0.00 H new ATOM 0 HD2 LYS A 61 9.027 -1.053 24.516 1.00 0.00 H new ATOM 0 HD3 LYS A 61 9.587 0.339 25.421 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.978 -1.121 27.556 1.00 0.00 H new ATOM 0 HE3 LYS A 61 9.032 -2.471 26.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.199 -2.081 27.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.276 -1.796 25.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 11.224 -0.489 26.857 1.00 0.00 H new ATOM 621 N VAL A 62 3.856 -2.104 23.955 1.00 0.00 N ATOM 622 CA VAL A 62 3.210 -2.229 22.615 1.00 0.00 C ATOM 623 C VAL A 62 1.928 -1.400 22.615 1.00 0.00 C ATOM 624 O VAL A 62 1.709 -0.569 21.758 1.00 0.00 O ATOM 625 CB VAL A 62 2.869 -3.697 22.330 1.00 0.00 C ATOM 626 CG1 VAL A 62 2.036 -3.787 21.047 1.00 0.00 C ATOM 627 CG2 VAL A 62 4.158 -4.501 22.153 1.00 0.00 C ATOM 0 H VAL A 62 3.807 -2.935 24.544 1.00 0.00 H new ATOM 0 HA VAL A 62 3.892 -1.871 21.844 1.00 0.00 H new ATOM 0 HB VAL A 62 2.300 -4.103 23.166 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.793 -4.830 20.843 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.115 -3.217 21.170 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.607 -3.378 20.213 1.00 0.00 H new ATOM 0 HG21 VAL A 62 3.912 -5.543 21.951 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.729 -4.094 21.318 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.753 -4.439 23.064 1.00 0.00 H new ATOM 637 N GLN A 63 1.085 -1.621 23.582 1.00 0.00 N ATOM 638 CA GLN A 63 -0.185 -0.852 23.664 1.00 0.00 C ATOM 639 C GLN A 63 0.127 0.643 23.539 1.00 0.00 C ATOM 640 O GLN A 63 -0.587 1.384 22.893 1.00 0.00 O ATOM 641 CB GLN A 63 -0.842 -1.143 25.018 1.00 0.00 C ATOM 642 CG GLN A 63 -1.611 -2.476 24.979 1.00 0.00 C ATOM 643 CD GLN A 63 -0.819 -3.565 24.237 1.00 0.00 C ATOM 644 OE1 GLN A 63 -0.449 -3.402 23.093 1.00 0.00 O ATOM 645 NE2 GLN A 63 -0.562 -4.690 24.846 1.00 0.00 N ATOM 0 H GLN A 63 1.222 -2.307 24.325 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.862 -1.141 22.860 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -0.080 -1.181 25.796 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -1.523 -0.333 25.278 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -1.819 -2.806 25.997 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -2.573 -2.327 24.489 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -0.871 -4.832 25.808 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -0.052 -5.428 24.360 1.00 0.00 H new ATOM 654 N SER A 64 1.191 1.088 24.149 1.00 0.00 N ATOM 655 CA SER A 64 1.552 2.531 24.059 1.00 0.00 C ATOM 656 C SER A 64 1.842 2.889 22.600 1.00 0.00 C ATOM 657 O SER A 64 1.451 3.933 22.117 1.00 0.00 O ATOM 658 CB SER A 64 2.796 2.800 24.908 1.00 0.00 C ATOM 659 OG SER A 64 2.466 2.678 26.284 1.00 0.00 O ATOM 0 H SER A 64 1.826 0.515 24.705 1.00 0.00 H new ATOM 0 HA SER A 64 0.725 3.138 24.427 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.586 2.095 24.649 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.180 3.799 24.702 1.00 0.00 H new ATOM 0 HG SER A 64 2.493 1.734 26.544 1.00 0.00 H new ATOM 665 N LEU A 65 2.523 2.028 21.891 1.00 0.00 N ATOM 666 CA LEU A 65 2.834 2.311 20.466 1.00 0.00 C ATOM 667 C LEU A 65 1.540 2.203 19.650 1.00 0.00 C ATOM 668 O LEU A 65 1.268 3.013 18.787 1.00 0.00 O ATOM 669 CB LEU A 65 3.868 1.281 19.976 1.00 0.00 C ATOM 670 CG LEU A 65 5.302 1.806 20.214 1.00 0.00 C ATOM 671 CD1 LEU A 65 6.276 0.626 20.300 1.00 0.00 C ATOM 672 CD2 LEU A 65 5.726 2.725 19.061 1.00 0.00 C ATOM 0 H LEU A 65 2.877 1.138 22.242 1.00 0.00 H new ATOM 0 HA LEU A 65 3.245 3.314 20.349 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.727 0.336 20.501 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.718 1.081 18.915 1.00 0.00 H new ATOM 0 HG LEU A 65 5.319 2.368 21.148 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.286 1.000 20.468 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.988 -0.024 21.126 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.248 0.062 19.368 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.738 3.089 19.239 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.700 2.169 18.124 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.042 3.571 19.000 1.00 0.00 H new ATOM 684 N VAL A 66 0.739 1.214 19.931 1.00 0.00 N ATOM 685 CA VAL A 66 -0.540 1.052 19.194 1.00 0.00 C ATOM 686 C VAL A 66 -1.348 2.348 19.323 1.00 0.00 C ATOM 687 O VAL A 66 -2.023 2.768 18.405 1.00 0.00 O ATOM 688 CB VAL A 66 -1.315 -0.117 19.819 1.00 0.00 C ATOM 689 CG1 VAL A 66 -2.759 -0.130 19.317 1.00 0.00 C ATOM 690 CG2 VAL A 66 -0.637 -1.438 19.444 1.00 0.00 C ATOM 0 H VAL A 66 0.919 0.508 20.645 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.358 0.845 18.139 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.318 0.004 20.902 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.294 -0.965 19.770 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.248 0.805 19.590 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.766 -0.240 18.233 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.187 -2.268 19.888 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.628 -1.547 18.360 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.387 -1.440 19.818 1.00 0.00 H new ATOM 700 N ASP A 67 -1.278 2.980 20.462 1.00 0.00 N ATOM 701 CA ASP A 67 -2.030 4.246 20.671 1.00 0.00 C ATOM 702 C ASP A 67 -1.315 5.400 19.956 1.00 0.00 C ATOM 703 O ASP A 67 -1.939 6.334 19.495 1.00 0.00 O ATOM 704 CB ASP A 67 -2.098 4.537 22.176 1.00 0.00 C ATOM 705 CG ASP A 67 -3.241 3.737 22.811 1.00 0.00 C ATOM 706 OD1 ASP A 67 -3.768 2.863 22.144 1.00 0.00 O ATOM 707 OD2 ASP A 67 -3.567 4.014 23.954 1.00 0.00 O ATOM 0 H ASP A 67 -0.727 2.670 21.262 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.037 4.148 20.265 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -1.152 4.274 22.649 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.252 5.603 22.342 1.00 0.00 H new ATOM 712 N THR A 68 -0.014 5.350 19.871 1.00 0.00 N ATOM 713 CA THR A 68 0.729 6.450 19.197 1.00 0.00 C ATOM 714 C THR A 68 0.404 6.448 17.703 1.00 0.00 C ATOM 715 O THR A 68 0.031 7.455 17.136 1.00 0.00 O ATOM 716 CB THR A 68 2.234 6.241 19.394 1.00 0.00 C ATOM 717 OG1 THR A 68 2.486 5.885 20.746 1.00 0.00 O ATOM 718 CG2 THR A 68 2.979 7.532 19.057 1.00 0.00 C ATOM 0 H THR A 68 0.565 4.596 20.239 1.00 0.00 H new ATOM 0 HA THR A 68 0.434 7.406 19.629 1.00 0.00 H new ATOM 0 HB THR A 68 2.580 5.444 18.736 1.00 0.00 H new ATOM 0 HG1 THR A 68 2.157 4.977 20.912 1.00 0.00 H new ATOM 0 HG21 THR A 68 4.049 7.382 19.198 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.784 7.804 18.020 1.00 0.00 H new ATOM 0 HG23 THR A 68 2.636 8.332 19.713 1.00 0.00 H new ATOM 726 N ILE A 69 0.542 5.321 17.064 1.00 0.00 N ATOM 727 CA ILE A 69 0.241 5.245 15.607 1.00 0.00 C ATOM 728 C ILE A 69 -1.215 5.666 15.371 1.00 0.00 C ATOM 729 O ILE A 69 -1.525 6.362 14.425 1.00 0.00 O ATOM 730 CB ILE A 69 0.461 3.805 15.121 1.00 0.00 C ATOM 731 CG1 ILE A 69 1.893 3.368 15.478 1.00 0.00 C ATOM 732 CG2 ILE A 69 0.261 3.734 13.598 1.00 0.00 C ATOM 733 CD1 ILE A 69 2.249 2.058 14.767 1.00 0.00 C ATOM 0 H ILE A 69 0.851 4.447 17.489 1.00 0.00 H new ATOM 0 HA ILE A 69 0.900 5.913 15.053 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.257 3.141 15.604 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.599 4.147 15.191 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.981 3.239 16.557 1.00 0.00 H new ATOM 0 HG21 ILE A 69 0.418 2.710 13.258 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -0.753 4.048 13.349 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.976 4.394 13.106 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.265 1.765 15.032 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.554 1.277 15.075 1.00 0.00 H new ATOM 0 HD13 ILE A 69 2.181 2.199 13.688 1.00 0.00 H new ATOM 745 N ARG A 70 -2.110 5.238 16.219 1.00 0.00 N ATOM 746 CA ARG A 70 -3.550 5.599 16.042 1.00 0.00 C ATOM 747 C ARG A 70 -3.797 7.048 16.500 1.00 0.00 C ATOM 748 O ARG A 70 -4.643 7.736 15.965 1.00 0.00 O ATOM 749 CB ARG A 70 -4.420 4.625 16.873 1.00 0.00 C ATOM 750 CG ARG A 70 -4.913 3.469 15.994 1.00 0.00 C ATOM 751 CD ARG A 70 -5.817 2.552 16.819 1.00 0.00 C ATOM 752 NE ARG A 70 -6.254 1.399 15.981 1.00 0.00 N ATOM 753 CZ ARG A 70 -6.828 0.368 16.538 1.00 0.00 C ATOM 754 NH1 ARG A 70 -7.021 0.346 17.828 1.00 0.00 N ATOM 755 NH2 ARG A 70 -7.210 -0.641 15.804 1.00 0.00 N ATOM 0 H ARG A 70 -1.908 4.652 17.029 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.816 5.521 14.988 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -3.841 4.233 17.710 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -5.272 5.158 17.296 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -5.459 3.858 15.135 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.064 2.907 15.604 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -5.283 2.194 17.699 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -6.685 3.105 17.176 1.00 0.00 H new ATOM 0 HE ARG A 70 -6.104 1.416 14.972 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -6.723 1.135 18.402 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -7.470 -0.460 18.263 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -7.060 -0.624 14.795 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -7.659 -1.447 16.239 1.00 0.00 H new ATOM 769 N GLU A 71 -3.082 7.514 17.490 1.00 0.00 N ATOM 770 CA GLU A 71 -3.300 8.908 17.978 1.00 0.00 C ATOM 771 C GLU A 71 -2.480 9.889 17.139 1.00 0.00 C ATOM 772 O GLU A 71 -2.902 10.997 16.873 1.00 0.00 O ATOM 773 CB GLU A 71 -2.858 9.005 19.439 1.00 0.00 C ATOM 774 CG GLU A 71 -3.236 10.379 19.995 1.00 0.00 C ATOM 775 CD GLU A 71 -2.864 10.450 21.477 1.00 0.00 C ATOM 776 OE1 GLU A 71 -1.684 10.561 21.767 1.00 0.00 O ATOM 777 OE2 GLU A 71 -3.765 10.392 22.297 1.00 0.00 O ATOM 0 H GLU A 71 -2.357 6.991 17.981 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.358 9.157 17.891 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -3.333 8.220 20.027 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.781 8.853 19.515 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -2.718 11.162 19.441 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -4.305 10.553 19.869 1.00 0.00 H new ATOM 784 N ASP A 72 -1.308 9.494 16.728 1.00 0.00 N ATOM 785 CA ASP A 72 -0.451 10.405 15.913 1.00 0.00 C ATOM 786 C ASP A 72 0.495 9.568 15.034 1.00 0.00 C ATOM 787 O ASP A 72 1.555 9.177 15.483 1.00 0.00 O ATOM 788 CB ASP A 72 0.383 11.277 16.858 1.00 0.00 C ATOM 789 CG ASP A 72 0.965 12.463 16.085 1.00 0.00 C ATOM 790 OD1 ASP A 72 1.733 12.227 15.167 1.00 0.00 O ATOM 791 OD2 ASP A 72 0.631 13.586 16.424 1.00 0.00 O ATOM 0 H ASP A 72 -0.904 8.578 16.921 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.078 11.032 15.279 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.237 11.635 17.680 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.187 10.687 17.298 1.00 0.00 H new ATOM 796 N PRO A 73 0.134 9.272 13.801 1.00 0.00 N ATOM 797 CA PRO A 73 1.008 8.448 12.910 1.00 0.00 C ATOM 798 C PRO A 73 2.300 9.179 12.497 1.00 0.00 C ATOM 799 O PRO A 73 3.271 8.559 12.111 1.00 0.00 O ATOM 800 CB PRO A 73 0.118 8.147 11.691 1.00 0.00 C ATOM 801 CG PRO A 73 -0.892 9.250 11.661 1.00 0.00 C ATOM 802 CD PRO A 73 -1.121 9.669 13.117 1.00 0.00 C ATOM 0 HA PRO A 73 1.360 7.548 13.414 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.704 8.124 10.772 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -0.364 7.174 11.786 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -0.532 10.090 11.068 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -1.822 8.912 11.204 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -1.301 10.741 13.201 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -1.987 9.166 13.547 1.00 0.00 H new ATOM 810 N ASP A 74 2.322 10.485 12.569 1.00 0.00 N ATOM 811 CA ASP A 74 3.551 11.238 12.174 1.00 0.00 C ATOM 812 C ASP A 74 4.536 11.310 13.352 1.00 0.00 C ATOM 813 O ASP A 74 5.727 11.458 13.161 1.00 0.00 O ATOM 814 CB ASP A 74 3.162 12.656 11.750 1.00 0.00 C ATOM 815 CG ASP A 74 4.426 13.464 11.448 1.00 0.00 C ATOM 816 OD1 ASP A 74 5.233 12.993 10.665 1.00 0.00 O ATOM 817 OD2 ASP A 74 4.564 14.540 12.006 1.00 0.00 O ATOM 0 H ASP A 74 1.543 11.063 12.884 1.00 0.00 H new ATOM 0 HA ASP A 74 4.031 10.720 11.344 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.521 12.621 10.869 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.589 13.139 12.541 1.00 0.00 H new ATOM 822 N SER A 75 4.057 11.211 14.564 1.00 0.00 N ATOM 823 CA SER A 75 4.979 11.279 15.738 1.00 0.00 C ATOM 824 C SER A 75 5.674 9.926 15.922 1.00 0.00 C ATOM 825 O SER A 75 6.203 9.633 16.977 1.00 0.00 O ATOM 826 CB SER A 75 4.183 11.614 17.003 1.00 0.00 C ATOM 827 OG SER A 75 5.082 11.865 18.073 1.00 0.00 O ATOM 0 H SER A 75 3.071 11.086 14.792 1.00 0.00 H new ATOM 0 HA SER A 75 5.725 12.054 15.563 1.00 0.00 H new ATOM 0 HB2 SER A 75 3.554 12.487 16.830 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.519 10.788 17.258 1.00 0.00 H new ATOM 0 HG SER A 75 5.795 11.193 18.066 1.00 0.00 H new ATOM 833 N VAL A 76 5.672 9.096 14.903 1.00 0.00 N ATOM 834 CA VAL A 76 6.324 7.749 14.998 1.00 0.00 C ATOM 835 C VAL A 76 7.360 7.623 13.858 1.00 0.00 C ATOM 836 O VAL A 76 6.988 7.592 12.702 1.00 0.00 O ATOM 837 CB VAL A 76 5.235 6.673 14.835 1.00 0.00 C ATOM 838 CG1 VAL A 76 5.697 5.342 15.446 1.00 0.00 C ATOM 839 CG2 VAL A 76 3.962 7.142 15.545 1.00 0.00 C ATOM 0 H VAL A 76 5.242 9.297 14.000 1.00 0.00 H new ATOM 0 HA VAL A 76 6.824 7.624 15.959 1.00 0.00 H new ATOM 0 HB VAL A 76 5.041 6.521 13.773 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.915 4.593 15.321 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.604 5.006 14.943 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.901 5.480 16.508 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.184 6.386 15.435 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.171 7.296 16.604 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.623 8.079 15.103 1.00 0.00 H new ATOM 849 N PRO A 77 8.646 7.574 14.155 1.00 0.00 N ATOM 850 CA PRO A 77 9.692 7.479 13.094 1.00 0.00 C ATOM 851 C PRO A 77 9.814 6.067 12.494 1.00 0.00 C ATOM 852 O PRO A 77 9.362 5.099 13.074 1.00 0.00 O ATOM 853 CB PRO A 77 10.985 7.885 13.818 1.00 0.00 C ATOM 854 CG PRO A 77 10.759 7.543 15.261 1.00 0.00 C ATOM 855 CD PRO A 77 9.243 7.603 15.506 1.00 0.00 C ATOM 0 HA PRO A 77 9.455 8.114 12.241 1.00 0.00 H new ATOM 0 HB2 PRO A 77 11.845 7.348 13.417 1.00 0.00 H new ATOM 0 HB3 PRO A 77 11.187 8.949 13.694 1.00 0.00 H new ATOM 0 HG2 PRO A 77 11.147 6.550 15.487 1.00 0.00 H new ATOM 0 HG3 PRO A 77 11.282 8.245 15.910 1.00 0.00 H new ATOM 0 HD2 PRO A 77 8.905 6.759 16.107 1.00 0.00 H new ATOM 0 HD3 PRO A 77 8.964 8.509 16.043 1.00 0.00 H new ATOM 863 N PRO A 78 10.428 5.955 11.336 1.00 0.00 N ATOM 864 CA PRO A 78 10.620 4.645 10.644 1.00 0.00 C ATOM 865 C PRO A 78 11.751 3.824 11.268 1.00 0.00 C ATOM 866 O PRO A 78 12.494 4.303 12.102 1.00 0.00 O ATOM 867 CB PRO A 78 10.976 5.050 9.210 1.00 0.00 C ATOM 868 CG PRO A 78 11.661 6.372 9.351 1.00 0.00 C ATOM 869 CD PRO A 78 11.010 7.068 10.554 1.00 0.00 C ATOM 0 HA PRO A 78 9.736 4.011 10.712 1.00 0.00 H new ATOM 0 HB2 PRO A 78 11.628 4.314 8.740 1.00 0.00 H new ATOM 0 HB3 PRO A 78 10.085 5.130 8.588 1.00 0.00 H new ATOM 0 HG2 PRO A 78 12.731 6.240 9.510 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.544 6.969 8.446 1.00 0.00 H new ATOM 0 HD2 PRO A 78 11.742 7.626 11.137 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.245 7.778 10.239 1.00 0.00 H new ATOM 877 N ILE A 79 11.881 2.589 10.861 1.00 0.00 N ATOM 878 CA ILE A 79 12.960 1.707 11.410 1.00 0.00 C ATOM 879 C ILE A 79 14.006 1.452 10.324 1.00 0.00 C ATOM 880 O ILE A 79 13.790 1.733 9.164 1.00 0.00 O ATOM 881 CB ILE A 79 12.343 0.374 11.838 1.00 0.00 C ATOM 882 CG1 ILE A 79 11.360 -0.097 10.760 1.00 0.00 C ATOM 883 CG2 ILE A 79 11.601 0.554 13.166 1.00 0.00 C ATOM 884 CD1 ILE A 79 11.049 -1.578 10.970 1.00 0.00 C ATOM 0 H ILE A 79 11.281 2.147 10.165 1.00 0.00 H new ATOM 0 HA ILE A 79 13.432 2.189 12.266 1.00 0.00 H new ATOM 0 HB ILE A 79 13.130 -0.369 11.964 1.00 0.00 H new ATOM 0 HG12 ILE A 79 10.442 0.489 10.808 1.00 0.00 H new ATOM 0 HG13 ILE A 79 11.787 0.060 9.769 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.162 -0.397 13.469 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.301 0.891 13.931 1.00 0.00 H new ATOM 0 HG23 ILE A 79 10.812 1.296 13.044 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.350 -1.915 10.205 1.00 0.00 H new ATOM 0 HD12 ILE A 79 11.970 -2.157 10.901 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.605 -1.720 11.955 1.00 0.00 H new ATOM 896 N ASP A 80 15.138 0.910 10.689 1.00 0.00 N ATOM 897 CA ASP A 80 16.195 0.626 9.673 1.00 0.00 C ATOM 898 C ASP A 80 16.009 -0.798 9.154 1.00 0.00 C ATOM 899 O ASP A 80 15.698 -1.707 9.897 1.00 0.00 O ATOM 900 CB ASP A 80 17.579 0.770 10.315 1.00 0.00 C ATOM 901 CG ASP A 80 18.654 0.219 9.373 1.00 0.00 C ATOM 902 OD1 ASP A 80 18.723 -0.991 9.227 1.00 0.00 O ATOM 903 OD2 ASP A 80 19.389 1.016 8.814 1.00 0.00 O ATOM 0 H ASP A 80 15.377 0.652 11.646 1.00 0.00 H new ATOM 0 HA ASP A 80 16.115 1.332 8.846 1.00 0.00 H new ATOM 0 HB2 ASP A 80 17.779 1.819 10.535 1.00 0.00 H new ATOM 0 HB3 ASP A 80 17.606 0.234 11.264 1.00 0.00 H new ATOM 908 N VAL A 81 16.188 -0.993 7.877 1.00 0.00 N ATOM 909 CA VAL A 81 16.016 -2.356 7.282 1.00 0.00 C ATOM 910 C VAL A 81 17.116 -2.599 6.242 1.00 0.00 C ATOM 911 O VAL A 81 17.469 -1.724 5.476 1.00 0.00 O ATOM 912 CB VAL A 81 14.618 -2.436 6.641 1.00 0.00 C ATOM 913 CG1 VAL A 81 14.542 -3.584 5.629 1.00 0.00 C ATOM 914 CG2 VAL A 81 13.574 -2.669 7.740 1.00 0.00 C ATOM 0 H VAL A 81 16.448 -0.264 7.213 1.00 0.00 H new ATOM 0 HA VAL A 81 16.099 -3.126 8.049 1.00 0.00 H new ATOM 0 HB VAL A 81 14.422 -1.499 6.120 1.00 0.00 H new ATOM 0 HG11 VAL A 81 13.544 -3.618 5.191 1.00 0.00 H new ATOM 0 HG12 VAL A 81 15.278 -3.424 4.841 1.00 0.00 H new ATOM 0 HG13 VAL A 81 14.749 -4.528 6.133 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.582 -2.727 7.293 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.793 -3.603 8.258 1.00 0.00 H new ATOM 0 HG23 VAL A 81 13.604 -1.844 8.451 1.00 0.00 H new ATOM 924 N LEU A 82 17.663 -3.787 6.217 1.00 0.00 N ATOM 925 CA LEU A 82 18.745 -4.102 5.238 1.00 0.00 C ATOM 926 C LEU A 82 18.127 -4.580 3.921 1.00 0.00 C ATOM 927 O LEU A 82 17.358 -5.520 3.887 1.00 0.00 O ATOM 928 CB LEU A 82 19.640 -5.209 5.805 1.00 0.00 C ATOM 929 CG LEU A 82 20.173 -4.805 7.195 1.00 0.00 C ATOM 930 CD1 LEU A 82 20.585 -6.057 7.973 1.00 0.00 C ATOM 931 CD2 LEU A 82 21.392 -3.889 7.045 1.00 0.00 C ATOM 0 H LEU A 82 17.405 -4.556 6.836 1.00 0.00 H new ATOM 0 HA LEU A 82 19.338 -3.205 5.057 1.00 0.00 H new ATOM 0 HB2 LEU A 82 19.077 -6.139 5.880 1.00 0.00 H new ATOM 0 HB3 LEU A 82 20.474 -5.395 5.128 1.00 0.00 H new ATOM 0 HG LEU A 82 19.385 -4.277 7.732 1.00 0.00 H new ATOM 0 HD11 LEU A 82 20.961 -5.768 8.954 1.00 0.00 H new ATOM 0 HD12 LEU A 82 19.721 -6.711 8.093 1.00 0.00 H new ATOM 0 HD13 LEU A 82 21.366 -6.585 7.426 1.00 0.00 H new ATOM 0 HD21 LEU A 82 21.761 -3.609 8.032 1.00 0.00 H new ATOM 0 HD22 LEU A 82 22.177 -4.414 6.500 1.00 0.00 H new ATOM 0 HD23 LEU A 82 21.107 -2.991 6.496 1.00 0.00 H new ATOM 943 N TRP A 83 18.465 -3.935 2.836 1.00 0.00 N ATOM 944 CA TRP A 83 17.916 -4.328 1.503 1.00 0.00 C ATOM 945 C TRP A 83 18.988 -5.117 0.746 1.00 0.00 C ATOM 946 O TRP A 83 20.004 -4.572 0.362 1.00 0.00 O ATOM 947 CB TRP A 83 17.580 -3.043 0.747 1.00 0.00 C ATOM 948 CG TRP A 83 17.112 -3.313 -0.652 1.00 0.00 C ATOM 949 CD1 TRP A 83 16.701 -4.505 -1.161 1.00 0.00 C ATOM 950 CD2 TRP A 83 17.002 -2.351 -1.733 1.00 0.00 C ATOM 951 NE1 TRP A 83 16.355 -4.321 -2.492 1.00 0.00 N ATOM 952 CE2 TRP A 83 16.527 -3.010 -2.888 1.00 0.00 C ATOM 953 CE3 TRP A 83 17.274 -0.977 -1.813 1.00 0.00 C ATOM 954 CZ2 TRP A 83 16.329 -2.326 -4.088 1.00 0.00 C ATOM 955 CZ3 TRP A 83 17.077 -0.283 -3.018 1.00 0.00 C ATOM 956 CH2 TRP A 83 16.606 -0.956 -4.153 1.00 0.00 C ATOM 0 H TRP A 83 19.106 -3.142 2.816 1.00 0.00 H new ATOM 0 HA TRP A 83 17.025 -4.947 1.605 1.00 0.00 H new ATOM 0 HB2 TRP A 83 16.807 -2.497 1.288 1.00 0.00 H new ATOM 0 HB3 TRP A 83 18.460 -2.401 0.716 1.00 0.00 H new ATOM 0 HD1 TRP A 83 16.652 -5.438 -0.620 1.00 0.00 H new ATOM 0 HE1 TRP A 83 16.015 -5.064 -3.103 1.00 0.00 H new ATOM 0 HE3 TRP A 83 17.637 -0.450 -0.943 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 15.965 -2.850 -4.960 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 17.290 0.775 -3.070 1.00 0.00 H new ATOM 0 HH2 TRP A 83 16.457 -0.418 -5.077 1.00 0.00 H new ATOM 967 N ILE A 84 18.781 -6.398 0.539 1.00 0.00 N ATOM 968 CA ILE A 84 19.801 -7.231 -0.183 1.00 0.00 C ATOM 969 C ILE A 84 19.139 -7.981 -1.340 1.00 0.00 C ATOM 970 O ILE A 84 18.043 -8.493 -1.224 1.00 0.00 O ATOM 971 CB ILE A 84 20.420 -8.237 0.791 1.00 0.00 C ATOM 972 CG1 ILE A 84 20.883 -7.505 2.053 1.00 0.00 C ATOM 973 CG2 ILE A 84 21.629 -8.908 0.133 1.00 0.00 C ATOM 974 CD1 ILE A 84 21.623 -8.481 2.969 1.00 0.00 C ATOM 0 H ILE A 84 17.948 -6.904 0.839 1.00 0.00 H new ATOM 0 HA ILE A 84 20.579 -6.579 -0.579 1.00 0.00 H new ATOM 0 HB ILE A 84 19.677 -8.990 1.052 1.00 0.00 H new ATOM 0 HG12 ILE A 84 21.537 -6.675 1.785 1.00 0.00 H new ATOM 0 HG13 ILE A 84 20.025 -7.080 2.574 1.00 0.00 H new ATOM 0 HG21 ILE A 84 22.070 -9.624 0.826 1.00 0.00 H new ATOM 0 HG22 ILE A 84 21.310 -9.427 -0.771 1.00 0.00 H new ATOM 0 HG23 ILE A 84 22.369 -8.151 -0.126 1.00 0.00 H new ATOM 0 HD11 ILE A 84 21.952 -7.959 3.867 1.00 0.00 H new ATOM 0 HD12 ILE A 84 20.955 -9.296 3.248 1.00 0.00 H new ATOM 0 HD13 ILE A 84 22.490 -8.885 2.446 1.00 0.00 H new ATOM 986 N LYS A 85 19.807 -8.036 -2.463 1.00 0.00 N ATOM 987 CA LYS A 85 19.254 -8.733 -3.661 1.00 0.00 C ATOM 988 C LYS A 85 19.895 -10.123 -3.783 1.00 0.00 C ATOM 989 O LYS A 85 20.978 -10.364 -3.286 1.00 0.00 O ATOM 990 CB LYS A 85 19.588 -7.872 -4.905 1.00 0.00 C ATOM 991 CG LYS A 85 18.331 -7.551 -5.711 1.00 0.00 C ATOM 992 CD LYS A 85 18.690 -6.511 -6.776 1.00 0.00 C ATOM 993 CE LYS A 85 17.453 -6.134 -7.616 1.00 0.00 C ATOM 994 NZ LYS A 85 16.205 -6.430 -6.863 1.00 0.00 N ATOM 0 H LYS A 85 20.728 -7.620 -2.602 1.00 0.00 H new ATOM 0 HA LYS A 85 18.175 -8.859 -3.575 1.00 0.00 H new ATOM 0 HB2 LYS A 85 20.067 -6.945 -4.590 1.00 0.00 H new ATOM 0 HB3 LYS A 85 20.302 -8.402 -5.536 1.00 0.00 H new ATOM 0 HG2 LYS A 85 17.941 -8.454 -6.180 1.00 0.00 H new ATOM 0 HG3 LYS A 85 17.548 -7.168 -5.056 1.00 0.00 H new ATOM 0 HD2 LYS A 85 19.095 -5.619 -6.297 1.00 0.00 H new ATOM 0 HD3 LYS A 85 19.470 -6.906 -7.427 1.00 0.00 H new ATOM 0 HE2 LYS A 85 17.488 -5.075 -7.872 1.00 0.00 H new ATOM 0 HE3 LYS A 85 17.460 -6.689 -8.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 15.382 -6.139 -7.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 16.150 -7.450 -6.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 16.210 -5.907 -5.964 1.00 0.00 H new ATOM 1008 N GLY A 86 19.229 -11.038 -4.442 1.00 0.00 N ATOM 1009 CA GLY A 86 19.786 -12.414 -4.601 1.00 0.00 C ATOM 1010 C GLY A 86 20.463 -12.556 -5.964 1.00 0.00 C ATOM 1011 O GLY A 86 20.673 -11.594 -6.675 1.00 0.00 O ATOM 0 H GLY A 86 18.319 -10.889 -4.878 1.00 0.00 H new ATOM 0 HA2 GLY A 86 20.505 -12.617 -3.807 1.00 0.00 H new ATOM 0 HA3 GLY A 86 18.988 -13.150 -4.505 1.00 0.00 H new ATOM 1015 N ALA A 87 20.814 -13.760 -6.320 1.00 0.00 N ATOM 1016 CA ALA A 87 21.492 -14.000 -7.625 1.00 0.00 C ATOM 1017 C ALA A 87 20.519 -13.771 -8.793 1.00 0.00 C ATOM 1018 O ALA A 87 20.917 -13.807 -9.941 1.00 0.00 O ATOM 1019 CB ALA A 87 22.004 -15.446 -7.661 1.00 0.00 C ATOM 0 H ALA A 87 20.659 -14.596 -5.757 1.00 0.00 H new ATOM 0 HA ALA A 87 22.324 -13.303 -7.727 1.00 0.00 H new ATOM 0 HB1 ALA A 87 22.502 -15.632 -8.613 1.00 0.00 H new ATOM 0 HB2 ALA A 87 22.710 -15.602 -6.845 1.00 0.00 H new ATOM 0 HB3 ALA A 87 21.164 -16.132 -7.551 1.00 0.00 H new ATOM 1025 N GLN A 88 19.250 -13.554 -8.520 1.00 0.00 N ATOM 1026 CA GLN A 88 18.258 -13.343 -9.630 1.00 0.00 C ATOM 1027 C GLN A 88 17.419 -12.081 -9.378 1.00 0.00 C ATOM 1028 O GLN A 88 16.236 -12.048 -9.654 1.00 0.00 O ATOM 1029 CB GLN A 88 17.343 -14.566 -9.715 1.00 0.00 C ATOM 1030 CG GLN A 88 18.203 -15.834 -9.698 1.00 0.00 C ATOM 1031 CD GLN A 88 17.366 -17.033 -10.148 1.00 0.00 C ATOM 1032 OE1 GLN A 88 16.236 -16.878 -10.566 1.00 0.00 O ATOM 1033 NE2 GLN A 88 17.877 -18.234 -10.079 1.00 0.00 N ATOM 0 H GLN A 88 18.859 -13.514 -7.579 1.00 0.00 H new ATOM 0 HA GLN A 88 18.795 -13.212 -10.569 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.645 -14.573 -8.878 1.00 0.00 H new ATOM 0 HB3 GLN A 88 16.747 -14.528 -10.627 1.00 0.00 H new ATOM 0 HG2 GLN A 88 19.062 -15.711 -10.357 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.593 -16.007 -8.695 1.00 0.00 H new ATOM 0 HE21 GLN A 88 18.826 -18.365 -9.728 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.327 -19.040 -10.376 1.00 0.00 H new ATOM 1042 N GLY A 89 18.029 -11.034 -8.890 1.00 0.00 N ATOM 1043 CA GLY A 89 17.283 -9.761 -8.659 1.00 0.00 C ATOM 1044 C GLY A 89 16.265 -9.902 -7.517 1.00 0.00 C ATOM 1045 O GLY A 89 15.731 -8.924 -7.033 1.00 0.00 O ATOM 0 H GLY A 89 19.017 -11.005 -8.640 1.00 0.00 H new ATOM 0 HA2 GLY A 89 17.987 -8.963 -8.423 1.00 0.00 H new ATOM 0 HA3 GLY A 89 16.767 -9.470 -9.574 1.00 0.00 H new ATOM 1049 N GLY A 90 15.980 -11.099 -7.087 1.00 0.00 N ATOM 1050 CA GLY A 90 14.994 -11.286 -5.992 1.00 0.00 C ATOM 1051 C GLY A 90 15.360 -10.396 -4.807 1.00 0.00 C ATOM 1052 O GLY A 90 16.358 -10.595 -4.145 1.00 0.00 O ATOM 0 H GLY A 90 16.391 -11.959 -7.450 1.00 0.00 H new ATOM 0 HA2 GLY A 90 13.993 -11.041 -6.346 1.00 0.00 H new ATOM 0 HA3 GLY A 90 14.976 -12.331 -5.682 1.00 0.00 H new ATOM 1056 N ASP A 91 14.552 -9.417 -4.538 1.00 0.00 N ATOM 1057 CA ASP A 91 14.830 -8.508 -3.397 1.00 0.00 C ATOM 1058 C ASP A 91 14.387 -9.179 -2.096 1.00 0.00 C ATOM 1059 O ASP A 91 13.305 -9.725 -2.006 1.00 0.00 O ATOM 1060 CB ASP A 91 14.048 -7.208 -3.578 1.00 0.00 C ATOM 1061 CG ASP A 91 14.680 -6.376 -4.690 1.00 0.00 C ATOM 1062 OD1 ASP A 91 15.734 -5.810 -4.455 1.00 0.00 O ATOM 1063 OD2 ASP A 91 14.097 -6.319 -5.760 1.00 0.00 O ATOM 0 H ASP A 91 13.704 -9.204 -5.063 1.00 0.00 H new ATOM 0 HA ASP A 91 15.898 -8.292 -3.358 1.00 0.00 H new ATOM 0 HB2 ASP A 91 13.009 -7.429 -3.822 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.043 -6.643 -2.646 1.00 0.00 H new ATOM 1068 N TYR A 92 15.218 -9.131 -1.088 1.00 0.00 N ATOM 1069 CA TYR A 92 14.870 -9.750 0.230 1.00 0.00 C ATOM 1070 C TYR A 92 15.043 -8.686 1.319 1.00 0.00 C ATOM 1071 O TYR A 92 16.098 -8.099 1.458 1.00 0.00 O ATOM 1072 CB TYR A 92 15.808 -10.931 0.494 1.00 0.00 C ATOM 1073 CG TYR A 92 15.600 -11.987 -0.572 1.00 0.00 C ATOM 1074 CD1 TYR A 92 16.321 -11.926 -1.773 1.00 0.00 C ATOM 1075 CD2 TYR A 92 14.685 -13.028 -0.362 1.00 0.00 C ATOM 1076 CE1 TYR A 92 16.127 -12.903 -2.756 1.00 0.00 C ATOM 1077 CE2 TYR A 92 14.493 -14.004 -1.347 1.00 0.00 C ATOM 1078 CZ TYR A 92 15.214 -13.941 -2.543 1.00 0.00 C ATOM 1079 OH TYR A 92 15.025 -14.904 -3.514 1.00 0.00 O ATOM 0 H TYR A 92 16.134 -8.684 -1.120 1.00 0.00 H new ATOM 0 HA TYR A 92 13.842 -10.111 0.227 1.00 0.00 H new ATOM 0 HB2 TYR A 92 16.845 -10.594 0.490 1.00 0.00 H new ATOM 0 HB3 TYR A 92 15.613 -11.351 1.481 1.00 0.00 H new ATOM 0 HD1 TYR A 92 17.026 -11.125 -1.939 1.00 0.00 H new ATOM 0 HD2 TYR A 92 14.127 -13.077 0.561 1.00 0.00 H new ATOM 0 HE1 TYR A 92 16.683 -12.855 -3.681 1.00 0.00 H new ATOM 0 HE2 TYR A 92 13.788 -14.806 -1.183 1.00 0.00 H new ATOM 0 HH TYR A 92 14.358 -15.552 -3.206 1.00 0.00 H new ATOM 1089 N PHE A 93 14.007 -8.411 2.077 1.00 0.00 N ATOM 1090 CA PHE A 93 14.097 -7.363 3.137 1.00 0.00 C ATOM 1091 C PHE A 93 14.309 -8.009 4.508 1.00 0.00 C ATOM 1092 O PHE A 93 13.518 -8.811 4.964 1.00 0.00 O ATOM 1093 CB PHE A 93 12.797 -6.546 3.139 1.00 0.00 C ATOM 1094 CG PHE A 93 12.595 -5.905 1.779 1.00 0.00 C ATOM 1095 CD1 PHE A 93 13.326 -4.762 1.420 1.00 0.00 C ATOM 1096 CD2 PHE A 93 11.684 -6.461 0.869 1.00 0.00 C ATOM 1097 CE1 PHE A 93 13.147 -4.185 0.158 1.00 0.00 C ATOM 1098 CE2 PHE A 93 11.505 -5.878 -0.391 1.00 0.00 C ATOM 1099 CZ PHE A 93 12.239 -4.742 -0.746 1.00 0.00 C ATOM 0 H PHE A 93 13.100 -8.871 2.004 1.00 0.00 H new ATOM 0 HA PHE A 93 14.945 -6.710 2.930 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.951 -7.191 3.377 1.00 0.00 H new ATOM 0 HB3 PHE A 93 12.840 -5.778 3.911 1.00 0.00 H new ATOM 0 HD1 PHE A 93 14.027 -4.328 2.118 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.120 -7.341 1.141 1.00 0.00 H new ATOM 0 HE1 PHE A 93 13.712 -3.307 -0.118 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.800 -6.305 -1.089 1.00 0.00 H new ATOM 0 HZ PHE A 93 12.104 -4.295 -1.720 1.00 0.00 H new ATOM 1109 N TYR A 94 15.385 -7.652 5.164 1.00 0.00 N ATOM 1110 CA TYR A 94 15.700 -8.214 6.513 1.00 0.00 C ATOM 1111 C TYR A 94 15.533 -7.118 7.567 1.00 0.00 C ATOM 1112 O TYR A 94 16.058 -6.031 7.430 1.00 0.00 O ATOM 1113 CB TYR A 94 17.161 -8.706 6.516 1.00 0.00 C ATOM 1114 CG TYR A 94 17.212 -10.164 6.143 1.00 0.00 C ATOM 1115 CD1 TYR A 94 17.292 -10.541 4.800 1.00 0.00 C ATOM 1116 CD2 TYR A 94 17.173 -11.135 7.146 1.00 0.00 C ATOM 1117 CE1 TYR A 94 17.334 -11.895 4.457 1.00 0.00 C ATOM 1118 CE2 TYR A 94 17.215 -12.490 6.803 1.00 0.00 C ATOM 1119 CZ TYR A 94 17.296 -12.871 5.459 1.00 0.00 C ATOM 1120 OH TYR A 94 17.337 -14.208 5.122 1.00 0.00 O ATOM 0 H TYR A 94 16.071 -6.982 4.815 1.00 0.00 H new ATOM 0 HA TYR A 94 15.028 -9.042 6.739 1.00 0.00 H new ATOM 0 HB2 TYR A 94 17.752 -8.121 5.812 1.00 0.00 H new ATOM 0 HB3 TYR A 94 17.602 -8.558 7.502 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.321 -9.787 4.028 1.00 0.00 H new ATOM 0 HD2 TYR A 94 17.111 -10.840 8.183 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.396 -12.188 3.419 1.00 0.00 H new ATOM 0 HE2 TYR A 94 17.185 -13.243 7.576 1.00 0.00 H new ATOM 0 HH TYR A 94 17.303 -14.752 5.937 1.00 0.00 H new ATOM 1130 N SER A 95 14.819 -7.407 8.625 1.00 0.00 N ATOM 1131 CA SER A 95 14.618 -6.400 9.713 1.00 0.00 C ATOM 1132 C SER A 95 15.145 -6.977 11.033 1.00 0.00 C ATOM 1133 O SER A 95 14.766 -8.055 11.445 1.00 0.00 O ATOM 1134 CB SER A 95 13.120 -6.075 9.834 1.00 0.00 C ATOM 1135 OG SER A 95 12.962 -4.704 10.167 1.00 0.00 O ATOM 0 H SER A 95 14.362 -8.305 8.784 1.00 0.00 H new ATOM 0 HA SER A 95 15.161 -5.484 9.481 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.612 -6.294 8.895 1.00 0.00 H new ATOM 0 HB3 SER A 95 12.661 -6.702 10.598 1.00 0.00 H new ATOM 0 HG SER A 95 12.008 -4.494 10.243 1.00 0.00 H new ATOM 1141 N PHE A 96 16.000 -6.250 11.703 1.00 0.00 N ATOM 1142 CA PHE A 96 16.549 -6.714 13.007 1.00 0.00 C ATOM 1143 C PHE A 96 16.358 -5.580 14.012 1.00 0.00 C ATOM 1144 O PHE A 96 17.223 -4.748 14.198 1.00 0.00 O ATOM 1145 CB PHE A 96 18.044 -6.983 12.856 1.00 0.00 C ATOM 1146 CG PHE A 96 18.261 -8.281 12.113 1.00 0.00 C ATOM 1147 CD1 PHE A 96 17.930 -9.495 12.718 1.00 0.00 C ATOM 1148 CD2 PHE A 96 18.814 -8.269 10.830 1.00 0.00 C ATOM 1149 CE1 PHE A 96 18.153 -10.699 12.040 1.00 0.00 C ATOM 1150 CE2 PHE A 96 19.035 -9.469 10.151 1.00 0.00 C ATOM 1151 CZ PHE A 96 18.708 -10.686 10.756 1.00 0.00 C ATOM 0 H PHE A 96 16.345 -5.341 11.395 1.00 0.00 H new ATOM 0 HA PHE A 96 16.046 -7.624 13.335 1.00 0.00 H new ATOM 0 HB2 PHE A 96 18.517 -6.162 12.317 1.00 0.00 H new ATOM 0 HB3 PHE A 96 18.514 -7.033 13.838 1.00 0.00 H new ATOM 0 HD1 PHE A 96 17.502 -9.505 13.709 1.00 0.00 H new ATOM 0 HD2 PHE A 96 19.071 -7.330 10.363 1.00 0.00 H new ATOM 0 HE1 PHE A 96 17.897 -11.638 12.508 1.00 0.00 H new ATOM 0 HE2 PHE A 96 19.459 -9.457 9.158 1.00 0.00 H new ATOM 0 HZ PHE A 96 18.884 -11.615 10.233 1.00 0.00 H new ATOM 1161 N GLY A 97 15.228 -5.541 14.654 1.00 0.00 N ATOM 1162 CA GLY A 97 14.948 -4.464 15.652 1.00 0.00 C ATOM 1163 C GLY A 97 13.507 -3.985 15.468 1.00 0.00 C ATOM 1164 O GLY A 97 12.716 -4.621 14.801 1.00 0.00 O ATOM 0 H GLY A 97 14.473 -6.216 14.531 1.00 0.00 H new ATOM 0 HA2 GLY A 97 15.094 -4.840 16.664 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.642 -3.634 15.517 1.00 0.00 H new ATOM 1168 N GLY A 98 13.160 -2.866 16.043 1.00 0.00 N ATOM 1169 CA GLY A 98 11.769 -2.350 15.888 1.00 0.00 C ATOM 1170 C GLY A 98 10.760 -3.483 16.118 1.00 0.00 C ATOM 1171 O GLY A 98 9.598 -3.366 15.780 1.00 0.00 O ATOM 0 H GLY A 98 13.778 -2.287 16.612 1.00 0.00 H new ATOM 0 HA2 GLY A 98 11.590 -1.543 16.599 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.637 -1.931 14.890 1.00 0.00 H new ATOM 1175 N CYS A 99 11.191 -4.581 16.681 1.00 0.00 N ATOM 1176 CA CYS A 99 10.255 -5.715 16.919 1.00 0.00 C ATOM 1177 C CYS A 99 8.991 -5.203 17.614 1.00 0.00 C ATOM 1178 O CYS A 99 7.886 -5.452 17.176 1.00 0.00 O ATOM 1179 CB CYS A 99 10.943 -6.761 17.800 1.00 0.00 C ATOM 1180 SG CYS A 99 12.659 -6.967 17.262 1.00 0.00 S ATOM 0 H CYS A 99 12.151 -4.740 16.986 1.00 0.00 H new ATOM 0 HA CYS A 99 9.979 -6.167 15.966 1.00 0.00 H new ATOM 0 HB2 CYS A 99 10.913 -6.450 18.844 1.00 0.00 H new ATOM 0 HB3 CYS A 99 10.414 -7.712 17.735 1.00 0.00 H new ATOM 0 HG CYS A 99 13.383 -6.000 17.743 1.00 0.00 H new ATOM 1186 N HIS A 100 9.141 -4.491 18.694 1.00 0.00 N ATOM 1187 CA HIS A 100 7.942 -3.968 19.408 1.00 0.00 C ATOM 1188 C HIS A 100 7.116 -3.107 18.447 1.00 0.00 C ATOM 1189 O HIS A 100 5.902 -3.127 18.473 1.00 0.00 O ATOM 1190 CB HIS A 100 8.392 -3.132 20.617 1.00 0.00 C ATOM 1191 CG HIS A 100 8.699 -4.045 21.781 1.00 0.00 C ATOM 1192 ND1 HIS A 100 9.814 -4.870 21.798 1.00 0.00 N ATOM 1193 CD2 HIS A 100 8.042 -4.282 22.967 1.00 0.00 C ATOM 1194 CE1 HIS A 100 9.794 -5.557 22.956 1.00 0.00 C ATOM 1195 NE2 HIS A 100 8.736 -5.236 23.705 1.00 0.00 N ATOM 0 H HIS A 100 10.039 -4.248 19.113 1.00 0.00 H new ATOM 0 HA HIS A 100 7.329 -4.798 19.760 1.00 0.00 H new ATOM 0 HB2 HIS A 100 9.275 -2.547 20.359 1.00 0.00 H new ATOM 0 HB3 HIS A 100 7.610 -2.425 20.893 1.00 0.00 H new ATOM 0 HD1 HIS A 100 10.521 -4.943 21.066 1.00 0.00 H new ATOM 0 HD2 HIS A 100 7.127 -3.801 23.278 1.00 0.00 H new ATOM 0 HE1 HIS A 100 10.543 -6.280 23.244 1.00 0.00 H new ATOM 1203 N ARG A 101 7.759 -2.356 17.596 1.00 0.00 N ATOM 1204 CA ARG A 101 6.997 -1.507 16.638 1.00 0.00 C ATOM 1205 C ARG A 101 6.291 -2.400 15.611 1.00 0.00 C ATOM 1206 O ARG A 101 5.228 -2.072 15.122 1.00 0.00 O ATOM 1207 CB ARG A 101 7.951 -0.536 15.933 1.00 0.00 C ATOM 1208 CG ARG A 101 8.350 0.573 16.912 1.00 0.00 C ATOM 1209 CD ARG A 101 9.250 1.598 16.211 1.00 0.00 C ATOM 1210 NE ARG A 101 10.657 1.104 16.212 1.00 0.00 N ATOM 1211 CZ ARG A 101 11.649 1.947 16.105 1.00 0.00 C ATOM 1212 NH1 ARG A 101 11.411 3.224 15.978 1.00 0.00 N ATOM 1213 NH2 ARG A 101 12.880 1.513 16.124 1.00 0.00 N ATOM 0 H ARG A 101 8.774 -2.294 17.523 1.00 0.00 H new ATOM 0 HA ARG A 101 6.248 -0.930 17.180 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.837 -1.066 15.584 1.00 0.00 H new ATOM 0 HB3 ARG A 101 7.469 -0.107 15.054 1.00 0.00 H new ATOM 0 HG2 ARG A 101 7.458 1.066 17.299 1.00 0.00 H new ATOM 0 HG3 ARG A 101 8.873 0.143 17.767 1.00 0.00 H new ATOM 0 HD2 ARG A 101 8.910 1.758 15.188 1.00 0.00 H new ATOM 0 HD3 ARG A 101 9.190 2.560 16.721 1.00 0.00 H new ATOM 0 HE ARG A 101 10.845 0.105 16.296 1.00 0.00 H new ATOM 0 HH11 ARG A 101 10.450 3.565 15.962 1.00 0.00 H new ATOM 0 HH12 ARG A 101 12.186 3.881 15.895 1.00 0.00 H new ATOM 0 HH21 ARG A 101 13.068 0.515 16.222 1.00 0.00 H new ATOM 0 HH22 ARG A 101 13.654 2.172 16.040 1.00 0.00 H new ATOM 1227 N TYR A 102 6.861 -3.532 15.288 1.00 0.00 N ATOM 1228 CA TYR A 102 6.204 -4.441 14.307 1.00 0.00 C ATOM 1229 C TYR A 102 4.889 -4.943 14.912 1.00 0.00 C ATOM 1230 O TYR A 102 3.872 -5.001 14.252 1.00 0.00 O ATOM 1231 CB TYR A 102 7.141 -5.623 14.003 1.00 0.00 C ATOM 1232 CG TYR A 102 6.385 -6.728 13.301 1.00 0.00 C ATOM 1233 CD1 TYR A 102 5.693 -7.674 14.060 1.00 0.00 C ATOM 1234 CD2 TYR A 102 6.380 -6.812 11.903 1.00 0.00 C ATOM 1235 CE1 TYR A 102 4.994 -8.706 13.429 1.00 0.00 C ATOM 1236 CE2 TYR A 102 5.679 -7.846 11.268 1.00 0.00 C ATOM 1237 CZ TYR A 102 4.987 -8.794 12.032 1.00 0.00 C ATOM 1238 OH TYR A 102 4.297 -9.813 11.407 1.00 0.00 O ATOM 0 H TYR A 102 7.750 -3.864 15.661 1.00 0.00 H new ATOM 0 HA TYR A 102 5.996 -3.913 13.377 1.00 0.00 H new ATOM 0 HB2 TYR A 102 7.969 -5.287 13.379 1.00 0.00 H new ATOM 0 HB3 TYR A 102 7.573 -6.001 14.930 1.00 0.00 H new ATOM 0 HD1 TYR A 102 5.698 -7.608 15.138 1.00 0.00 H new ATOM 0 HD2 TYR A 102 6.916 -6.081 11.315 1.00 0.00 H new ATOM 0 HE1 TYR A 102 4.459 -9.436 14.019 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.672 -7.912 10.190 1.00 0.00 H new ATOM 0 HH TYR A 102 4.394 -9.726 10.436 1.00 0.00 H new ATOM 1248 N ALA A 103 4.905 -5.299 16.168 1.00 0.00 N ATOM 1249 CA ALA A 103 3.659 -5.788 16.827 1.00 0.00 C ATOM 1250 C ALA A 103 2.589 -4.697 16.771 1.00 0.00 C ATOM 1251 O ALA A 103 1.436 -4.959 16.494 1.00 0.00 O ATOM 1252 CB ALA A 103 3.955 -6.129 18.288 1.00 0.00 C ATOM 0 H ALA A 103 5.729 -5.272 16.768 1.00 0.00 H new ATOM 0 HA ALA A 103 3.301 -6.677 16.308 1.00 0.00 H new ATOM 0 HB1 ALA A 103 3.045 -6.486 18.770 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.718 -6.906 18.333 1.00 0.00 H new ATOM 0 HB3 ALA A 103 4.313 -5.238 18.804 1.00 0.00 H new ATOM 1258 N ALA A 104 2.960 -3.474 17.037 1.00 0.00 N ATOM 1259 CA ALA A 104 1.959 -2.371 17.003 1.00 0.00 C ATOM 1260 C ALA A 104 1.361 -2.267 15.598 1.00 0.00 C ATOM 1261 O ALA A 104 0.162 -2.166 15.429 1.00 0.00 O ATOM 1262 CB ALA A 104 2.640 -1.050 17.370 1.00 0.00 C ATOM 0 H ALA A 104 3.911 -3.192 17.276 1.00 0.00 H new ATOM 0 HA ALA A 104 1.165 -2.579 17.720 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.907 -0.244 17.345 1.00 0.00 H new ATOM 0 HB2 ALA A 104 3.063 -1.125 18.372 1.00 0.00 H new ATOM 0 HB3 ALA A 104 3.435 -0.840 16.655 1.00 0.00 H new ATOM 1268 N TYR A 105 2.187 -2.296 14.589 1.00 0.00 N ATOM 1269 CA TYR A 105 1.672 -2.203 13.199 1.00 0.00 C ATOM 1270 C TYR A 105 0.886 -3.481 12.871 1.00 0.00 C ATOM 1271 O TYR A 105 -0.171 -3.436 12.273 1.00 0.00 O ATOM 1272 CB TYR A 105 2.873 -2.057 12.241 1.00 0.00 C ATOM 1273 CG TYR A 105 3.141 -0.598 11.933 1.00 0.00 C ATOM 1274 CD1 TYR A 105 2.368 0.066 10.973 1.00 0.00 C ATOM 1275 CD2 TYR A 105 4.174 0.084 12.591 1.00 0.00 C ATOM 1276 CE1 TYR A 105 2.621 1.409 10.674 1.00 0.00 C ATOM 1277 CE2 TYR A 105 4.429 1.428 12.288 1.00 0.00 C ATOM 1278 CZ TYR A 105 3.651 2.090 11.331 1.00 0.00 C ATOM 1279 OH TYR A 105 3.903 3.414 11.033 1.00 0.00 O ATOM 0 H TYR A 105 3.200 -2.381 14.670 1.00 0.00 H new ATOM 0 HA TYR A 105 1.012 -1.342 13.090 1.00 0.00 H new ATOM 0 HB2 TYR A 105 3.759 -2.507 12.689 1.00 0.00 H new ATOM 0 HB3 TYR A 105 2.674 -2.598 11.316 1.00 0.00 H new ATOM 0 HD1 TYR A 105 1.575 -0.460 10.462 1.00 0.00 H new ATOM 0 HD2 TYR A 105 4.773 -0.426 13.331 1.00 0.00 H new ATOM 0 HE1 TYR A 105 2.021 1.920 9.936 1.00 0.00 H new ATOM 0 HE2 TYR A 105 5.226 1.953 12.793 1.00 0.00 H new ATOM 0 HH TYR A 105 4.650 3.736 11.579 1.00 0.00 H new ATOM 1289 N GLN A 106 1.399 -4.617 13.256 1.00 0.00 N ATOM 1290 CA GLN A 106 0.696 -5.894 12.968 1.00 0.00 C ATOM 1291 C GLN A 106 -0.676 -5.888 13.647 1.00 0.00 C ATOM 1292 O GLN A 106 -1.690 -6.139 13.026 1.00 0.00 O ATOM 1293 CB GLN A 106 1.534 -7.055 13.512 1.00 0.00 C ATOM 1294 CG GLN A 106 0.935 -8.390 13.058 1.00 0.00 C ATOM 1295 CD GLN A 106 -0.293 -8.726 13.913 1.00 0.00 C ATOM 1296 OE1 GLN A 106 -1.408 -8.438 13.525 1.00 0.00 O ATOM 1297 NE2 GLN A 106 -0.144 -9.326 15.066 1.00 0.00 N ATOM 0 H GLN A 106 2.280 -4.714 13.761 1.00 0.00 H new ATOM 0 HA GLN A 106 0.562 -6.008 11.892 1.00 0.00 H new ATOM 0 HB2 GLN A 106 2.562 -6.969 13.159 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.566 -7.013 14.601 1.00 0.00 H new ATOM 0 HG2 GLN A 106 0.653 -8.334 12.007 1.00 0.00 H new ATOM 0 HG3 GLN A 106 1.679 -9.182 13.147 1.00 0.00 H new ATOM 0 HE21 GLN A 106 0.789 -9.570 15.397 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -0.961 -9.550 15.634 1.00 0.00 H new ATOM 1306 N GLN A 107 -0.712 -5.606 14.919 1.00 0.00 N ATOM 1307 CA GLN A 107 -2.005 -5.585 15.650 1.00 0.00 C ATOM 1308 C GLN A 107 -2.986 -4.639 14.953 1.00 0.00 C ATOM 1309 O GLN A 107 -4.164 -4.918 14.850 1.00 0.00 O ATOM 1310 CB GLN A 107 -1.751 -5.102 17.077 1.00 0.00 C ATOM 1311 CG GLN A 107 -3.022 -5.257 17.918 1.00 0.00 C ATOM 1312 CD GLN A 107 -3.977 -4.092 17.642 1.00 0.00 C ATOM 1313 OE1 GLN A 107 -3.608 -3.126 17.003 1.00 0.00 O ATOM 1314 NE2 GLN A 107 -5.197 -4.142 18.101 1.00 0.00 N ATOM 0 H GLN A 107 0.107 -5.388 15.486 1.00 0.00 H new ATOM 0 HA GLN A 107 -2.436 -6.586 15.665 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -0.938 -5.674 17.524 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -1.438 -4.058 17.066 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.511 -6.202 17.683 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -2.766 -5.285 18.977 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -5.507 -4.952 18.637 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -5.841 -3.371 17.924 1.00 0.00 H new ATOM 1323 N LEU A 108 -2.513 -3.519 14.477 1.00 0.00 N ATOM 1324 CA LEU A 108 -3.426 -2.558 13.794 1.00 0.00 C ATOM 1325 C LEU A 108 -3.813 -3.104 12.417 1.00 0.00 C ATOM 1326 O LEU A 108 -4.412 -2.418 11.613 1.00 0.00 O ATOM 1327 CB LEU A 108 -2.719 -1.209 13.643 1.00 0.00 C ATOM 1328 CG LEU A 108 -2.536 -0.563 15.028 1.00 0.00 C ATOM 1329 CD1 LEU A 108 -1.659 0.690 14.896 1.00 0.00 C ATOM 1330 CD2 LEU A 108 -3.907 -0.181 15.629 1.00 0.00 C ATOM 0 H LEU A 108 -1.537 -3.228 14.531 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.330 -2.426 14.388 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.750 -1.347 13.164 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -3.302 -0.552 12.998 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.052 -1.279 15.692 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.529 1.148 15.877 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.685 0.412 14.493 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -2.139 1.401 14.224 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -3.761 0.275 16.608 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -4.408 0.528 14.970 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.521 -1.076 15.733 1.00 0.00 H new ATOM 1342 N GLN A 109 -3.488 -4.338 12.146 1.00 0.00 N ATOM 1343 CA GLN A 109 -3.846 -4.942 10.829 1.00 0.00 C ATOM 1344 C GLN A 109 -3.529 -3.967 9.691 1.00 0.00 C ATOM 1345 O GLN A 109 -4.251 -3.885 8.717 1.00 0.00 O ATOM 1346 CB GLN A 109 -5.340 -5.271 10.813 1.00 0.00 C ATOM 1347 CG GLN A 109 -5.722 -5.972 12.118 1.00 0.00 C ATOM 1348 CD GLN A 109 -7.106 -6.609 11.970 1.00 0.00 C ATOM 1349 OE1 GLN A 109 -7.778 -6.429 10.866 1.00 0.00 O flip ATOM 1350 NE2 GLN A 109 -7.580 -7.276 12.867 1.00 0.00 N flip ATOM 0 H GLN A 109 -2.987 -4.958 12.783 1.00 0.00 H new ATOM 0 HA GLN A 109 -3.263 -5.852 10.687 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -5.923 -4.358 10.694 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -5.573 -5.911 9.962 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -4.983 -6.735 12.363 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -5.726 -5.256 12.940 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -7.055 -7.417 13.730 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -8.503 -7.696 12.757 1.00 0.00 H new ATOM 1359 N ARG A 110 -2.455 -3.236 9.797 1.00 0.00 N ATOM 1360 CA ARG A 110 -2.098 -2.282 8.712 1.00 0.00 C ATOM 1361 C ARG A 110 -1.593 -3.072 7.508 1.00 0.00 C ATOM 1362 O ARG A 110 -1.191 -4.212 7.623 1.00 0.00 O ATOM 1363 CB ARG A 110 -1.000 -1.333 9.202 1.00 0.00 C ATOM 1364 CG ARG A 110 -1.594 -0.280 10.155 1.00 0.00 C ATOM 1365 CD ARG A 110 -2.581 0.651 9.419 1.00 0.00 C ATOM 1366 NE ARG A 110 -2.183 0.805 7.989 1.00 0.00 N ATOM 1367 CZ ARG A 110 -3.069 1.148 7.092 1.00 0.00 C ATOM 1368 NH1 ARG A 110 -4.308 1.364 7.444 1.00 0.00 N ATOM 1369 NH2 ARG A 110 -2.715 1.278 5.843 1.00 0.00 N ATOM 0 H ARG A 110 -1.810 -3.258 10.587 1.00 0.00 H new ATOM 0 HA ARG A 110 -2.974 -1.697 8.430 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -0.222 -1.899 9.713 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -0.529 -0.840 8.352 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -2.106 -0.779 10.978 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -0.790 0.312 10.592 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -3.590 0.243 9.480 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -2.601 1.627 9.905 1.00 0.00 H new ATOM 0 HE ARG A 110 -1.215 0.642 7.711 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -4.585 1.265 8.421 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -4.998 1.632 6.742 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -1.747 1.112 5.567 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -3.406 1.546 5.142 1.00 0.00 H new ATOM 1383 N GLU A 111 -1.627 -2.478 6.352 1.00 0.00 N ATOM 1384 CA GLU A 111 -1.163 -3.193 5.127 1.00 0.00 C ATOM 1385 C GLU A 111 0.369 -3.114 5.014 1.00 0.00 C ATOM 1386 O GLU A 111 1.016 -4.086 4.673 1.00 0.00 O ATOM 1387 CB GLU A 111 -1.813 -2.555 3.888 1.00 0.00 C ATOM 1388 CG GLU A 111 -3.214 -3.142 3.682 1.00 0.00 C ATOM 1389 CD GLU A 111 -3.096 -4.563 3.127 1.00 0.00 C ATOM 1390 OE1 GLU A 111 -2.252 -4.775 2.272 1.00 0.00 O ATOM 1391 OE2 GLU A 111 -3.851 -5.414 3.567 1.00 0.00 O ATOM 0 H GLU A 111 -1.957 -1.525 6.198 1.00 0.00 H new ATOM 0 HA GLU A 111 -1.454 -4.241 5.192 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -1.876 -1.474 4.014 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -1.198 -2.738 3.007 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -3.758 -3.153 4.627 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -3.784 -2.518 2.994 1.00 0.00 H new ATOM 1398 N THR A 112 0.956 -1.966 5.276 1.00 0.00 N ATOM 1399 CA THR A 112 2.448 -1.831 5.158 1.00 0.00 C ATOM 1400 C THR A 112 3.019 -1.126 6.385 1.00 0.00 C ATOM 1401 O THR A 112 2.297 -0.710 7.270 1.00 0.00 O ATOM 1402 CB THR A 112 2.772 -0.992 3.920 1.00 0.00 C ATOM 1403 OG1 THR A 112 2.053 0.231 3.988 1.00 0.00 O ATOM 1404 CG2 THR A 112 2.373 -1.746 2.641 1.00 0.00 C ATOM 0 H THR A 112 0.468 -1.119 5.566 1.00 0.00 H new ATOM 0 HA THR A 112 2.888 -2.825 5.079 1.00 0.00 H new ATOM 0 HB THR A 112 3.844 -0.797 3.893 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.993 0.626 3.093 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.610 -1.135 1.770 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.923 -2.686 2.586 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.303 -1.952 2.659 1.00 0.00 H new ATOM 1412 N ILE A 113 4.324 -0.986 6.437 1.00 0.00 N ATOM 1413 CA ILE A 113 4.972 -0.297 7.604 1.00 0.00 C ATOM 1414 C ILE A 113 6.097 0.633 7.111 1.00 0.00 C ATOM 1415 O ILE A 113 6.836 0.262 6.220 1.00 0.00 O ATOM 1416 CB ILE A 113 5.589 -1.339 8.545 1.00 0.00 C ATOM 1417 CG1 ILE A 113 6.034 -0.640 9.828 1.00 0.00 C ATOM 1418 CG2 ILE A 113 6.809 -1.998 7.885 1.00 0.00 C ATOM 1419 CD1 ILE A 113 6.463 -1.682 10.862 1.00 0.00 C ATOM 0 H ILE A 113 4.970 -1.319 5.721 1.00 0.00 H new ATOM 0 HA ILE A 113 4.212 0.282 8.128 1.00 0.00 H new ATOM 0 HB ILE A 113 4.848 -2.107 8.766 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.861 0.038 9.616 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.219 -0.034 10.225 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.236 -2.735 8.565 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.502 -2.490 6.962 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.556 -1.237 7.659 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.780 -1.179 11.776 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.624 -2.342 11.083 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.291 -2.269 10.465 1.00 0.00 H new ATOM 1431 N PRO A 114 6.281 1.812 7.688 1.00 0.00 N ATOM 1432 CA PRO A 114 7.395 2.706 7.259 1.00 0.00 C ATOM 1433 C PRO A 114 8.754 2.104 7.644 1.00 0.00 C ATOM 1434 O PRO A 114 8.953 1.662 8.758 1.00 0.00 O ATOM 1435 CB PRO A 114 7.149 4.035 8.012 1.00 0.00 C ATOM 1436 CG PRO A 114 5.767 3.929 8.586 1.00 0.00 C ATOM 1437 CD PRO A 114 5.488 2.437 8.773 1.00 0.00 C ATOM 0 HA PRO A 114 7.417 2.846 6.178 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.889 4.182 8.799 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.228 4.887 7.337 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.700 4.458 9.536 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.034 4.380 7.918 1.00 0.00 H new ATOM 0 HD2 PRO A 114 5.803 2.087 9.756 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.426 2.210 8.679 1.00 0.00 H new ATOM 1445 N ALA A 115 9.683 2.082 6.735 1.00 0.00 N ATOM 1446 CA ALA A 115 11.024 1.508 7.046 1.00 0.00 C ATOM 1447 C ALA A 115 12.074 2.144 6.137 1.00 0.00 C ATOM 1448 O ALA A 115 11.887 2.267 4.942 1.00 0.00 O ATOM 1449 CB ALA A 115 11.000 -0.003 6.813 1.00 0.00 C ATOM 0 H ALA A 115 9.574 2.437 5.785 1.00 0.00 H new ATOM 0 HA ALA A 115 11.272 1.712 8.088 1.00 0.00 H new ATOM 0 HB1 ALA A 115 11.980 -0.422 7.040 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.251 -0.459 7.461 1.00 0.00 H new ATOM 0 HB3 ALA A 115 10.751 -0.207 5.771 1.00 0.00 H new ATOM 1455 N LYS A 116 13.179 2.548 6.696 1.00 0.00 N ATOM 1456 CA LYS A 116 14.248 3.176 5.873 1.00 0.00 C ATOM 1457 C LYS A 116 15.006 2.079 5.117 1.00 0.00 C ATOM 1458 O LYS A 116 15.717 1.290 5.708 1.00 0.00 O ATOM 1459 CB LYS A 116 15.215 3.946 6.804 1.00 0.00 C ATOM 1460 CG LYS A 116 15.701 5.230 6.123 1.00 0.00 C ATOM 1461 CD LYS A 116 16.568 6.039 7.097 1.00 0.00 C ATOM 1462 CE LYS A 116 17.835 5.250 7.464 1.00 0.00 C ATOM 1463 NZ LYS A 116 17.548 4.358 8.623 1.00 0.00 N ATOM 0 H LYS A 116 13.389 2.470 7.691 1.00 0.00 H new ATOM 0 HA LYS A 116 13.813 3.871 5.155 1.00 0.00 H new ATOM 0 HB2 LYS A 116 14.712 4.191 7.740 1.00 0.00 H new ATOM 0 HB3 LYS A 116 16.067 3.315 7.056 1.00 0.00 H new ATOM 0 HG2 LYS A 116 16.275 4.984 5.229 1.00 0.00 H new ATOM 0 HG3 LYS A 116 14.848 5.826 5.800 1.00 0.00 H new ATOM 0 HD2 LYS A 116 16.843 6.992 6.645 1.00 0.00 H new ATOM 0 HD3 LYS A 116 15.999 6.266 7.998 1.00 0.00 H new ATOM 0 HE2 LYS A 116 18.168 4.659 6.611 1.00 0.00 H new ATOM 0 HE3 LYS A 116 18.645 5.937 7.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 18.197 4.584 9.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 16.567 4.501 8.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 17.680 3.366 8.339 1.00 0.00 H new ATOM 1477 N LEU A 117 14.875 2.024 3.820 1.00 0.00 N ATOM 1478 CA LEU A 117 15.613 0.973 3.061 1.00 0.00 C ATOM 1479 C LEU A 117 17.094 1.348 3.031 1.00 0.00 C ATOM 1480 O LEU A 117 17.450 2.495 2.845 1.00 0.00 O ATOM 1481 CB LEU A 117 15.078 0.865 1.628 1.00 0.00 C ATOM 1482 CG LEU A 117 13.562 0.599 1.633 1.00 0.00 C ATOM 1483 CD1 LEU A 117 13.084 0.389 0.190 1.00 0.00 C ATOM 1484 CD2 LEU A 117 13.241 -0.656 2.460 1.00 0.00 C ATOM 0 H LEU A 117 14.298 2.651 3.259 1.00 0.00 H new ATOM 0 HA LEU A 117 15.475 0.008 3.549 1.00 0.00 H new ATOM 0 HB2 LEU A 117 15.289 1.786 1.085 1.00 0.00 H new ATOM 0 HB3 LEU A 117 15.592 0.060 1.102 1.00 0.00 H new ATOM 0 HG LEU A 117 13.053 1.454 2.077 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.011 0.200 0.186 1.00 0.00 H new ATOM 0 HD12 LEU A 117 13.297 1.282 -0.398 1.00 0.00 H new ATOM 0 HD13 LEU A 117 13.604 -0.464 -0.245 1.00 0.00 H new ATOM 0 HD21 LEU A 117 12.165 -0.830 2.454 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.751 -1.517 2.028 1.00 0.00 H new ATOM 0 HD23 LEU A 117 13.579 -0.512 3.486 1.00 0.00 H new ATOM 1496 N VAL A 118 17.960 0.390 3.235 1.00 0.00 N ATOM 1497 CA VAL A 118 19.426 0.675 3.247 1.00 0.00 C ATOM 1498 C VAL A 118 20.167 -0.422 2.478 1.00 0.00 C ATOM 1499 O VAL A 118 20.336 -1.524 2.963 1.00 0.00 O ATOM 1500 CB VAL A 118 19.902 0.696 4.704 1.00 0.00 C ATOM 1501 CG1 VAL A 118 21.426 0.794 4.760 1.00 0.00 C ATOM 1502 CG2 VAL A 118 19.289 1.900 5.423 1.00 0.00 C ATOM 0 H VAL A 118 17.712 -0.586 3.395 1.00 0.00 H new ATOM 0 HA VAL A 118 19.627 1.636 2.774 1.00 0.00 H new ATOM 0 HB VAL A 118 19.587 -0.226 5.193 1.00 0.00 H new ATOM 0 HG11 VAL A 118 21.752 0.808 5.800 1.00 0.00 H new ATOM 0 HG12 VAL A 118 21.865 -0.066 4.254 1.00 0.00 H new ATOM 0 HG13 VAL A 118 21.750 1.710 4.266 1.00 0.00 H new ATOM 0 HG21 VAL A 118 19.627 1.916 6.459 1.00 0.00 H new ATOM 0 HG22 VAL A 118 19.601 2.818 4.926 1.00 0.00 H new ATOM 0 HG23 VAL A 118 18.202 1.825 5.397 1.00 0.00 H new ATOM 1512 N GLN A 119 20.611 -0.132 1.280 1.00 0.00 N ATOM 1513 CA GLN A 119 21.342 -1.162 0.483 1.00 0.00 C ATOM 1514 C GLN A 119 22.384 -1.851 1.367 1.00 0.00 C ATOM 1515 O GLN A 119 23.119 -1.208 2.090 1.00 0.00 O ATOM 1516 CB GLN A 119 22.059 -0.493 -0.696 1.00 0.00 C ATOM 1517 CG GLN A 119 21.030 0.042 -1.692 1.00 0.00 C ATOM 1518 CD GLN A 119 20.353 1.282 -1.100 1.00 0.00 C ATOM 1519 OE1 GLN A 119 20.996 2.090 -0.460 1.00 0.00 O ATOM 1520 NE2 GLN A 119 19.075 1.469 -1.284 1.00 0.00 N ATOM 0 H GLN A 119 20.499 0.772 0.821 1.00 0.00 H new ATOM 0 HA GLN A 119 20.627 -1.896 0.111 1.00 0.00 H new ATOM 0 HB2 GLN A 119 22.688 0.321 -0.336 1.00 0.00 H new ATOM 0 HB3 GLN A 119 22.716 -1.210 -1.188 1.00 0.00 H new ATOM 0 HG2 GLN A 119 21.516 0.293 -2.635 1.00 0.00 H new ATOM 0 HG3 GLN A 119 20.286 -0.724 -1.911 1.00 0.00 H new ATOM 0 HE21 GLN A 119 18.533 0.792 -1.821 1.00 0.00 H new ATOM 0 HE22 GLN A 119 18.618 2.292 -0.891 1.00 0.00 H new ATOM 1529 N SER A 120 22.453 -3.155 1.313 1.00 0.00 N ATOM 1530 CA SER A 120 23.450 -3.898 2.147 1.00 0.00 C ATOM 1531 C SER A 120 24.042 -5.046 1.326 1.00 0.00 C ATOM 1532 O SER A 120 23.709 -5.231 0.172 1.00 0.00 O ATOM 1533 CB SER A 120 22.753 -4.455 3.391 1.00 0.00 C ATOM 1534 OG SER A 120 22.621 -3.424 4.358 1.00 0.00 O ATOM 0 H SER A 120 21.860 -3.742 0.726 1.00 0.00 H new ATOM 0 HA SER A 120 24.251 -3.225 2.453 1.00 0.00 H new ATOM 0 HB2 SER A 120 21.772 -4.848 3.126 1.00 0.00 H new ATOM 0 HB3 SER A 120 23.328 -5.284 3.803 1.00 0.00 H new ATOM 0 HG SER A 120 22.799 -2.557 3.938 1.00 0.00 H new ATOM 1540 N THR A 121 24.924 -5.814 1.917 1.00 0.00 N ATOM 1541 CA THR A 121 25.561 -6.957 1.191 1.00 0.00 C ATOM 1542 C THR A 121 25.418 -8.235 2.023 1.00 0.00 C ATOM 1543 O THR A 121 25.178 -8.195 3.218 1.00 0.00 O ATOM 1544 CB THR A 121 27.047 -6.651 0.985 1.00 0.00 C ATOM 1545 OG1 THR A 121 27.589 -6.118 2.185 1.00 0.00 O ATOM 1546 CG2 THR A 121 27.210 -5.633 -0.146 1.00 0.00 C ATOM 0 H THR A 121 25.233 -5.696 2.882 1.00 0.00 H new ATOM 0 HA THR A 121 25.074 -7.097 0.226 1.00 0.00 H new ATOM 0 HB THR A 121 27.574 -7.569 0.723 1.00 0.00 H new ATOM 0 HG1 THR A 121 28.541 -5.923 2.056 1.00 0.00 H new ATOM 0 HG21 THR A 121 28.268 -5.417 -0.291 1.00 0.00 H new ATOM 0 HG22 THR A 121 26.794 -6.042 -1.067 1.00 0.00 H new ATOM 0 HG23 THR A 121 26.684 -4.714 0.113 1.00 0.00 H new ATOM 1554 N LEU A 122 25.556 -9.372 1.398 1.00 0.00 N ATOM 1555 CA LEU A 122 25.420 -10.652 2.153 1.00 0.00 C ATOM 1556 C LEU A 122 26.398 -10.664 3.338 1.00 0.00 C ATOM 1557 O LEU A 122 26.194 -11.365 4.309 1.00 0.00 O ATOM 1558 CB LEU A 122 25.712 -11.839 1.220 1.00 0.00 C ATOM 1559 CG LEU A 122 25.352 -13.167 1.912 1.00 0.00 C ATOM 1560 CD1 LEU A 122 23.826 -13.292 2.088 1.00 0.00 C ATOM 1561 CD2 LEU A 122 25.859 -14.331 1.052 1.00 0.00 C ATOM 0 H LEU A 122 25.756 -9.471 0.403 1.00 0.00 H new ATOM 0 HA LEU A 122 24.402 -10.739 2.532 1.00 0.00 H new ATOM 0 HB2 LEU A 122 25.139 -11.735 0.298 1.00 0.00 H new ATOM 0 HB3 LEU A 122 26.766 -11.840 0.942 1.00 0.00 H new ATOM 0 HG LEU A 122 25.820 -13.191 2.896 1.00 0.00 H new ATOM 0 HD11 LEU A 122 23.593 -14.237 2.579 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.461 -12.466 2.699 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.343 -13.261 1.111 1.00 0.00 H new ATOM 0 HD21 LEU A 122 25.609 -15.276 1.534 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.389 -14.289 0.070 1.00 0.00 H new ATOM 0 HD23 LEU A 122 26.941 -14.256 0.940 1.00 0.00 H new ATOM 1573 N SER A 123 27.455 -9.892 3.275 1.00 0.00 N ATOM 1574 CA SER A 123 28.428 -9.867 4.403 1.00 0.00 C ATOM 1575 C SER A 123 27.747 -9.305 5.653 1.00 0.00 C ATOM 1576 O SER A 123 27.829 -9.875 6.723 1.00 0.00 O ATOM 1577 CB SER A 123 29.619 -8.982 4.030 1.00 0.00 C ATOM 1578 OG SER A 123 30.574 -9.005 5.081 1.00 0.00 O ATOM 0 H SER A 123 27.683 -9.280 2.491 1.00 0.00 H new ATOM 0 HA SER A 123 28.777 -10.880 4.604 1.00 0.00 H new ATOM 0 HB2 SER A 123 30.073 -9.336 3.104 1.00 0.00 H new ATOM 0 HB3 SER A 123 29.284 -7.960 3.851 1.00 0.00 H new ATOM 0 HG SER A 123 31.338 -8.439 4.842 1.00 0.00 H new ATOM 1584 N ASP A 124 27.071 -8.192 5.531 1.00 0.00 N ATOM 1585 CA ASP A 124 26.387 -7.609 6.720 1.00 0.00 C ATOM 1586 C ASP A 124 25.459 -8.666 7.322 1.00 0.00 C ATOM 1587 O ASP A 124 25.382 -8.842 8.528 1.00 0.00 O ATOM 1588 CB ASP A 124 25.564 -6.382 6.301 1.00 0.00 C ATOM 1589 CG ASP A 124 25.180 -5.578 7.545 1.00 0.00 C ATOM 1590 OD1 ASP A 124 26.066 -5.268 8.324 1.00 0.00 O ATOM 1591 OD2 ASP A 124 24.005 -5.286 7.698 1.00 0.00 O ATOM 0 H ASP A 124 26.964 -7.665 4.664 1.00 0.00 H new ATOM 0 HA ASP A 124 27.130 -7.301 7.456 1.00 0.00 H new ATOM 0 HB2 ASP A 124 26.141 -5.760 5.616 1.00 0.00 H new ATOM 0 HB3 ASP A 124 24.667 -6.697 5.767 1.00 0.00 H new ATOM 1596 N LEU A 125 24.753 -9.384 6.493 1.00 0.00 N ATOM 1597 CA LEU A 125 23.839 -10.425 7.027 1.00 0.00 C ATOM 1598 C LEU A 125 24.666 -11.476 7.777 1.00 0.00 C ATOM 1599 O LEU A 125 24.267 -11.969 8.809 1.00 0.00 O ATOM 1600 CB LEU A 125 23.060 -11.066 5.864 1.00 0.00 C ATOM 1601 CG LEU A 125 21.687 -11.575 6.348 1.00 0.00 C ATOM 1602 CD1 LEU A 125 20.688 -10.413 6.456 1.00 0.00 C ATOM 1603 CD2 LEU A 125 21.141 -12.593 5.350 1.00 0.00 C ATOM 0 H LEU A 125 24.771 -9.294 5.477 1.00 0.00 H new ATOM 0 HA LEU A 125 23.122 -9.982 7.718 1.00 0.00 H new ATOM 0 HB2 LEU A 125 22.923 -10.337 5.065 1.00 0.00 H new ATOM 0 HB3 LEU A 125 23.634 -11.893 5.446 1.00 0.00 H new ATOM 0 HG LEU A 125 21.816 -12.034 7.328 1.00 0.00 H new ATOM 0 HD11 LEU A 125 19.725 -10.792 6.799 1.00 0.00 H new ATOM 0 HD12 LEU A 125 21.062 -9.676 7.167 1.00 0.00 H new ATOM 0 HD13 LEU A 125 20.567 -9.945 5.479 1.00 0.00 H new ATOM 0 HD21 LEU A 125 20.171 -12.953 5.692 1.00 0.00 H new ATOM 0 HD22 LEU A 125 21.030 -12.122 4.373 1.00 0.00 H new ATOM 0 HD23 LEU A 125 21.832 -13.432 5.271 1.00 0.00 H new ATOM 1615 N ARG A 126 25.824 -11.806 7.274 1.00 0.00 N ATOM 1616 CA ARG A 126 26.686 -12.809 7.968 1.00 0.00 C ATOM 1617 C ARG A 126 26.949 -12.337 9.397 1.00 0.00 C ATOM 1618 O ARG A 126 26.987 -13.124 10.323 1.00 0.00 O ATOM 1619 CB ARG A 126 28.017 -12.931 7.215 1.00 0.00 C ATOM 1620 CG ARG A 126 28.826 -14.133 7.740 1.00 0.00 C ATOM 1621 CD ARG A 126 28.428 -15.408 6.985 1.00 0.00 C ATOM 1622 NE ARG A 126 28.846 -16.603 7.771 1.00 0.00 N ATOM 1623 CZ ARG A 126 28.667 -17.800 7.282 1.00 0.00 C ATOM 1624 NH1 ARG A 126 28.123 -17.950 6.106 1.00 0.00 N ATOM 1625 NH2 ARG A 126 29.034 -18.846 7.970 1.00 0.00 N ATOM 0 H ARG A 126 26.212 -11.425 6.411 1.00 0.00 H new ATOM 0 HA ARG A 126 26.188 -13.778 7.990 1.00 0.00 H new ATOM 0 HB2 ARG A 126 27.828 -13.050 6.148 1.00 0.00 H new ATOM 0 HB3 ARG A 126 28.595 -12.015 7.336 1.00 0.00 H new ATOM 0 HG2 ARG A 126 29.893 -13.945 7.615 1.00 0.00 H new ATOM 0 HG3 ARG A 126 28.648 -14.263 8.807 1.00 0.00 H new ATOM 0 HD2 ARG A 126 27.350 -15.425 6.822 1.00 0.00 H new ATOM 0 HD3 ARG A 126 28.899 -15.423 6.002 1.00 0.00 H new ATOM 0 HE ARG A 126 29.272 -16.486 8.690 1.00 0.00 H new ATOM 0 HH11 ARG A 126 27.837 -17.132 5.568 1.00 0.00 H new ATOM 0 HH12 ARG A 126 27.983 -18.886 5.724 1.00 0.00 H new ATOM 0 HH21 ARG A 126 29.460 -18.728 8.889 1.00 0.00 H new ATOM 0 HH22 ARG A 126 28.895 -19.782 7.589 1.00 0.00 H new ATOM 1639 N VAL A 127 27.119 -11.059 9.590 1.00 0.00 N ATOM 1640 CA VAL A 127 27.364 -10.549 10.964 1.00 0.00 C ATOM 1641 C VAL A 127 26.185 -10.955 11.849 1.00 0.00 C ATOM 1642 O VAL A 127 26.340 -11.222 13.024 1.00 0.00 O ATOM 1643 CB VAL A 127 27.486 -9.025 10.939 1.00 0.00 C ATOM 1644 CG1 VAL A 127 27.711 -8.512 12.362 1.00 0.00 C ATOM 1645 CG2 VAL A 127 28.676 -8.623 10.067 1.00 0.00 C ATOM 0 H VAL A 127 27.099 -10.349 8.858 1.00 0.00 H new ATOM 0 HA VAL A 127 28.290 -10.969 11.356 1.00 0.00 H new ATOM 0 HB VAL A 127 26.571 -8.594 10.532 1.00 0.00 H new ATOM 0 HG11 VAL A 127 27.798 -7.426 12.348 1.00 0.00 H new ATOM 0 HG12 VAL A 127 26.868 -8.800 12.990 1.00 0.00 H new ATOM 0 HG13 VAL A 127 28.627 -8.944 12.764 1.00 0.00 H new ATOM 0 HG21 VAL A 127 28.763 -7.537 10.049 1.00 0.00 H new ATOM 0 HG22 VAL A 127 29.589 -9.054 10.477 1.00 0.00 H new ATOM 0 HG23 VAL A 127 28.525 -8.992 9.052 1.00 0.00 H new ATOM 1655 N TYR A 128 24.998 -10.999 11.292 1.00 0.00 N ATOM 1656 CA TYR A 128 23.800 -11.384 12.109 1.00 0.00 C ATOM 1657 C TYR A 128 23.566 -12.899 12.061 1.00 0.00 C ATOM 1658 O TYR A 128 23.342 -13.532 13.074 1.00 0.00 O ATOM 1659 CB TYR A 128 22.549 -10.704 11.551 1.00 0.00 C ATOM 1660 CG TYR A 128 22.628 -9.212 11.744 1.00 0.00 C ATOM 1661 CD1 TYR A 128 22.241 -8.640 12.961 1.00 0.00 C ATOM 1662 CD2 TYR A 128 23.072 -8.399 10.698 1.00 0.00 C ATOM 1663 CE1 TYR A 128 22.299 -7.253 13.131 1.00 0.00 C ATOM 1664 CE2 TYR A 128 23.132 -7.012 10.867 1.00 0.00 C ATOM 1665 CZ TYR A 128 22.745 -6.438 12.084 1.00 0.00 C ATOM 1666 OH TYR A 128 22.803 -5.069 12.251 1.00 0.00 O ATOM 0 H TYR A 128 24.806 -10.787 10.313 1.00 0.00 H new ATOM 0 HA TYR A 128 23.988 -11.071 13.136 1.00 0.00 H new ATOM 0 HB2 TYR A 128 22.445 -10.934 10.491 1.00 0.00 H new ATOM 0 HB3 TYR A 128 21.662 -11.095 12.050 1.00 0.00 H new ATOM 0 HD1 TYR A 128 21.898 -9.269 13.769 1.00 0.00 H new ATOM 0 HD2 TYR A 128 23.369 -8.842 9.759 1.00 0.00 H new ATOM 0 HE1 TYR A 128 22.000 -6.811 14.070 1.00 0.00 H new ATOM 0 HE2 TYR A 128 23.477 -6.384 10.059 1.00 0.00 H new ATOM 0 HH TYR A 128 23.135 -4.653 11.428 1.00 0.00 H new ATOM 1676 N LEU A 129 23.574 -13.473 10.884 1.00 0.00 N ATOM 1677 CA LEU A 129 23.308 -14.936 10.735 1.00 0.00 C ATOM 1678 C LEU A 129 24.539 -15.649 10.186 1.00 0.00 C ATOM 1679 O LEU A 129 24.434 -16.484 9.313 1.00 0.00 O ATOM 1680 CB LEU A 129 22.178 -15.117 9.727 1.00 0.00 C ATOM 1681 CG LEU A 129 20.886 -14.442 10.209 1.00 0.00 C ATOM 1682 CD1 LEU A 129 19.765 -14.758 9.208 1.00 0.00 C ATOM 1683 CD2 LEU A 129 20.495 -14.949 11.608 1.00 0.00 C ATOM 0 H LEU A 129 23.756 -12.983 10.008 1.00 0.00 H new ATOM 0 HA LEU A 129 23.050 -15.351 11.709 1.00 0.00 H new ATOM 0 HB2 LEU A 129 22.474 -14.696 8.766 1.00 0.00 H new ATOM 0 HB3 LEU A 129 21.997 -16.180 9.567 1.00 0.00 H new ATOM 0 HG LEU A 129 21.043 -13.365 10.271 1.00 0.00 H new ATOM 0 HD11 LEU A 129 18.840 -14.285 9.537 1.00 0.00 H new ATOM 0 HD12 LEU A 129 20.038 -14.377 8.224 1.00 0.00 H new ATOM 0 HD13 LEU A 129 19.621 -15.837 9.152 1.00 0.00 H new ATOM 0 HD21 LEU A 129 19.577 -14.457 11.930 1.00 0.00 H new ATOM 0 HD22 LEU A 129 20.337 -16.027 11.573 1.00 0.00 H new ATOM 0 HD23 LEU A 129 21.294 -14.722 12.314 1.00 0.00 H new ATOM 1695 N GLY A 130 25.697 -15.332 10.674 1.00 0.00 N ATOM 1696 CA GLY A 130 26.925 -15.999 10.166 1.00 0.00 C ATOM 1697 C GLY A 130 26.898 -17.500 10.500 1.00 0.00 C ATOM 1698 O GLY A 130 27.912 -18.083 10.828 1.00 0.00 O ATOM 0 H GLY A 130 25.851 -14.638 11.405 1.00 0.00 H new ATOM 0 HA2 GLY A 130 27.001 -15.861 9.087 1.00 0.00 H new ATOM 0 HA3 GLY A 130 27.807 -15.537 10.609 1.00 0.00 H new ATOM 1702 N ALA A 131 25.754 -18.137 10.414 1.00 0.00 N ATOM 1703 CA ALA A 131 25.684 -19.597 10.721 1.00 0.00 C ATOM 1704 C ALA A 131 24.529 -20.230 9.933 1.00 0.00 C ATOM 1705 O ALA A 131 24.731 -21.127 9.139 1.00 0.00 O ATOM 1706 CB ALA A 131 25.468 -19.796 12.227 1.00 0.00 C ATOM 0 H ALA A 131 24.869 -17.708 10.145 1.00 0.00 H new ATOM 0 HA ALA A 131 26.618 -20.078 10.431 1.00 0.00 H new ATOM 0 HB1 ALA A 131 25.417 -20.862 12.450 1.00 0.00 H new ATOM 0 HB2 ALA A 131 26.298 -19.350 12.776 1.00 0.00 H new ATOM 0 HB3 ALA A 131 24.536 -19.318 12.527 1.00 0.00 H new ATOM 1712 N SER A 132 23.319 -19.770 10.139 1.00 0.00 N ATOM 1713 CA SER A 132 22.154 -20.345 9.396 1.00 0.00 C ATOM 1714 C SER A 132 21.829 -19.447 8.200 1.00 0.00 C ATOM 1715 O SER A 132 20.681 -19.224 7.870 1.00 0.00 O ATOM 1716 CB SER A 132 20.940 -20.408 10.326 1.00 0.00 C ATOM 1717 OG SER A 132 19.891 -21.121 9.688 1.00 0.00 O ATOM 0 H SER A 132 23.087 -19.020 10.791 1.00 0.00 H new ATOM 0 HA SER A 132 22.399 -21.348 9.048 1.00 0.00 H new ATOM 0 HB2 SER A 132 21.210 -20.898 11.262 1.00 0.00 H new ATOM 0 HB3 SER A 132 20.609 -19.401 10.578 1.00 0.00 H new ATOM 0 HG SER A 132 19.717 -20.728 8.807 1.00 0.00 H new ATOM 1723 N THR A 133 22.834 -18.919 7.559 1.00 0.00 N ATOM 1724 CA THR A 133 22.593 -18.020 6.394 1.00 0.00 C ATOM 1725 C THR A 133 22.180 -18.858 5.156 1.00 0.00 C ATOM 1726 O THR A 133 22.947 -19.679 4.695 1.00 0.00 O ATOM 1727 CB THR A 133 23.906 -17.256 6.084 1.00 0.00 C ATOM 1728 OG1 THR A 133 24.789 -17.382 7.187 1.00 0.00 O ATOM 1729 CG2 THR A 133 23.623 -15.771 5.831 1.00 0.00 C ATOM 0 H THR A 133 23.815 -19.071 7.792 1.00 0.00 H new ATOM 0 HA THR A 133 21.792 -17.318 6.628 1.00 0.00 H new ATOM 0 HB THR A 133 24.357 -17.683 5.188 1.00 0.00 H new ATOM 0 HG1 THR A 133 24.544 -16.732 7.878 1.00 0.00 H new ATOM 0 HG21 THR A 133 24.558 -15.254 5.616 1.00 0.00 H new ATOM 0 HG22 THR A 133 22.948 -15.669 4.981 1.00 0.00 H new ATOM 0 HG23 THR A 133 23.162 -15.333 6.716 1.00 0.00 H new ATOM 1737 N PRO A 134 21.003 -18.648 4.597 1.00 0.00 N ATOM 1738 CA PRO A 134 20.557 -19.396 3.386 1.00 0.00 C ATOM 1739 C PRO A 134 21.151 -18.796 2.107 1.00 0.00 C ATOM 1740 O PRO A 134 21.964 -17.894 2.155 1.00 0.00 O ATOM 1741 CB PRO A 134 19.036 -19.231 3.412 1.00 0.00 C ATOM 1742 CG PRO A 134 18.818 -17.892 4.038 1.00 0.00 C ATOM 1743 CD PRO A 134 19.966 -17.695 5.041 1.00 0.00 C ATOM 0 HA PRO A 134 20.877 -20.438 3.392 1.00 0.00 H new ATOM 0 HB2 PRO A 134 18.615 -19.273 2.408 1.00 0.00 H new ATOM 0 HB3 PRO A 134 18.560 -20.023 3.991 1.00 0.00 H new ATOM 0 HG2 PRO A 134 18.821 -17.105 3.284 1.00 0.00 H new ATOM 0 HG3 PRO A 134 17.851 -17.850 4.540 1.00 0.00 H new ATOM 0 HD2 PRO A 134 20.335 -16.670 5.027 1.00 0.00 H new ATOM 0 HD3 PRO A 134 19.644 -17.904 6.061 1.00 0.00 H new ATOM 1751 N ASP A 135 20.745 -19.290 0.968 1.00 0.00 N ATOM 1752 CA ASP A 135 21.265 -18.764 -0.328 1.00 0.00 C ATOM 1753 C ASP A 135 20.173 -17.943 -1.003 1.00 0.00 C ATOM 1754 O ASP A 135 19.041 -18.367 -1.131 1.00 0.00 O ATOM 1755 CB ASP A 135 21.651 -19.934 -1.228 1.00 0.00 C ATOM 1756 CG ASP A 135 22.500 -19.426 -2.396 1.00 0.00 C ATOM 1757 OD1 ASP A 135 22.740 -18.232 -2.452 1.00 0.00 O ATOM 1758 OD2 ASP A 135 22.895 -20.241 -3.213 1.00 0.00 O ATOM 0 H ASP A 135 20.066 -20.046 0.879 1.00 0.00 H new ATOM 0 HA ASP A 135 22.140 -18.139 -0.151 1.00 0.00 H new ATOM 0 HB2 ASP A 135 22.208 -20.677 -0.657 1.00 0.00 H new ATOM 0 HB3 ASP A 135 20.755 -20.427 -1.604 1.00 0.00 H new ATOM 1763 N LEU A 136 20.511 -16.765 -1.422 1.00 0.00 N ATOM 1764 CA LEU A 136 19.510 -15.876 -2.086 1.00 0.00 C ATOM 1765 C LEU A 136 19.508 -16.112 -3.599 1.00 0.00 C ATOM 1766 O LEU A 136 20.543 -16.219 -4.225 1.00 0.00 O ATOM 1767 CB LEU A 136 19.870 -14.416 -1.809 1.00 0.00 C ATOM 1768 CG LEU A 136 19.841 -14.139 -0.302 1.00 0.00 C ATOM 1769 CD1 LEU A 136 20.283 -12.692 -0.060 1.00 0.00 C ATOM 1770 CD2 LEU A 136 18.419 -14.344 0.247 1.00 0.00 C ATOM 0 H LEU A 136 21.447 -16.368 -1.336 1.00 0.00 H new ATOM 0 HA LEU A 136 18.520 -16.101 -1.689 1.00 0.00 H new ATOM 0 HB2 LEU A 136 20.861 -14.197 -2.207 1.00 0.00 H new ATOM 0 HB3 LEU A 136 19.168 -13.758 -2.320 1.00 0.00 H new ATOM 0 HG LEU A 136 20.515 -14.827 0.209 1.00 0.00 H new ATOM 0 HD11 LEU A 136 20.267 -12.481 1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 136 21.294 -12.552 -0.443 1.00 0.00 H new ATOM 0 HD13 LEU A 136 19.603 -12.013 -0.574 1.00 0.00 H new ATOM 0 HD21 LEU A 136 18.410 -14.144 1.319 1.00 0.00 H new ATOM 0 HD22 LEU A 136 17.733 -13.661 -0.255 1.00 0.00 H new ATOM 0 HD23 LEU A 136 18.104 -15.372 0.067 1.00 0.00 H new ATOM 1782 N GLN A 137 18.338 -16.185 -4.184 1.00 0.00 N ATOM 1783 CA GLN A 137 18.218 -16.406 -5.660 1.00 0.00 C ATOM 1784 C GLN A 137 17.286 -15.346 -6.256 1.00 0.00 C ATOM 1785 O GLN A 137 17.587 -14.173 -6.111 1.00 0.00 O ATOM 1786 CB GLN A 137 17.634 -17.800 -5.912 1.00 0.00 C ATOM 1787 CG GLN A 137 18.282 -18.807 -4.961 1.00 0.00 C ATOM 1788 CD GLN A 137 19.805 -18.752 -5.120 1.00 0.00 C ATOM 1789 OE1 GLN A 137 20.563 -18.628 -4.062 1.00 0.00 O flip ATOM 1790 NE2 GLN A 137 20.312 -18.822 -6.221 1.00 0.00 N flip ATOM 1791 OXT GLN A 137 16.289 -15.726 -6.848 1.00 0.00 O ATOM 0 H GLN A 137 17.447 -16.100 -3.694 1.00 0.00 H new ATOM 0 HA GLN A 137 19.200 -16.330 -6.127 1.00 0.00 H new ATOM 0 HB2 GLN A 137 16.554 -17.786 -5.762 1.00 0.00 H new ATOM 0 HB3 GLN A 137 17.808 -18.097 -6.946 1.00 0.00 H new ATOM 0 HG2 GLN A 137 18.005 -18.581 -3.931 1.00 0.00 H new ATOM 0 HG3 GLN A 137 17.919 -19.812 -5.176 1.00 0.00 H new ATOM 0 HE21 GLN A 137 19.723 -18.919 -7.048 1.00 0.00 H new ATOM 0 HE22 GLN A 137 21.327 -18.784 -6.319 1.00 0.00 H new TER 1800 GLN A 137 HETATM 1801 MG MG A 2 17.710 -0.845 23.721 1.00 0.00 MG HETATM 1802 PG ATP A 1 11.898 -2.596 19.068 1.00 0.00 P HETATM 1803 O1G ATP A 1 13.190 -2.874 18.356 1.00 0.00 O HETATM 1804 O2G ATP A 1 11.211 -3.828 19.575 1.00 0.00 O HETATM 1805 O3G ATP A 1 10.972 -1.572 18.505 1.00 0.00 O HETATM 1806 PB ATP A 1 13.155 -0.551 21.542 1.00 0.00 P HETATM 1807 O1B ATP A 1 12.181 -0.132 22.597 1.00 0.00 O HETATM 1808 O2B ATP A 1 14.430 -1.064 22.130 1.00 0.00 O HETATM 1809 O3B ATP A 1 12.458 -1.851 20.672 1.00 0.00 O HETATM 1810 PA ATP A 1 13.140 1.672 19.242 1.00 0.00 P HETATM 1811 O1A ATP A 1 13.653 0.987 18.044 1.00 0.00 O HETATM 1812 O2A ATP A 1 13.604 3.064 19.400 1.00 0.00 O HETATM 1813 O3A ATP A 1 13.608 0.839 20.644 1.00 0.00 O HETATM 1814 O5' ATP A 1 11.466 1.715 19.070 1.00 0.00 O HETATM 1815 C5' ATP A 1 10.611 2.378 19.990 1.00 0.00 C HETATM 1816 C4' ATP A 1 10.699 3.917 19.873 1.00 0.00 C HETATM 1817 O4' ATP A 1 9.389 4.467 19.934 1.00 0.00 O HETATM 1818 C3' ATP A 1 11.514 4.636 20.980 1.00 0.00 C HETATM 1819 O3' ATP A 1 12.699 5.209 20.432 1.00 0.00 O HETATM 1820 C2' ATP A 1 10.592 5.732 21.519 1.00 0.00 C HETATM 1821 O2' ATP A 1 11.339 6.934 21.591 1.00 0.00 O HETATM 1822 C1' ATP A 1 9.468 5.777 20.472 1.00 0.00 C HETATM 1823 N9 ATP A 1 8.152 6.196 21.015 1.00 0.00 N HETATM 1824 C8 ATP A 1 7.390 7.284 20.650 1.00 0.00 C HETATM 1825 N7 ATP A 1 6.231 7.377 21.253 1.00 0.00 N HETATM 1826 C5 ATP A 1 6.224 6.301 22.133 1.00 0.00 C HETATM 1827 C6 ATP A 1 5.319 5.812 23.110 1.00 0.00 C HETATM 1828 N6 ATP A 1 4.125 6.358 23.353 1.00 0.00 N HETATM 1829 N1 ATP A 1 5.683 4.750 23.860 1.00 0.00 N HETATM 1830 C2 ATP A 1 6.867 4.167 23.645 1.00 0.00 C HETATM 1831 N3 ATP A 1 7.799 4.484 22.746 1.00 0.00 N HETATM 1832 C4 ATP A 1 7.437 5.572 22.010 1.00 0.00 C HETATM 0 HO3' ATP A 1 13.275 4.497 20.083 1.00 0.00 H new HETATM 0 HO2' ATP A 1 12.080 6.897 20.951 1.00 0.00 H new HETATM 0 HN62 ATP A 1 3.518 5.960 24.070 1.00 0.00 H new HETATM 0 HN61 ATP A 1 3.819 7.173 22.822 1.00 0.00 H new HETATM 0 H5'2 ATP A 1 9.582 2.062 19.818 1.00 0.00 H new HETATM 0 H5'1 ATP A 1 10.872 2.078 21.005 1.00 0.00 H new HETATM 0 H8 ATP A 1 7.727 8.014 19.914 1.00 0.00 H new HETATM 0 H4' ATP A 1 11.214 4.082 18.927 1.00 0.00 H new HETATM 0 H3' ATP A 1 11.826 3.947 21.765 1.00 0.00 H new HETATM 0 H2' ATP A 1 10.187 5.568 22.518 1.00 0.00 H new HETATM 0 H2 ATP A 1 7.101 3.320 24.290 1.00 0.00 H new HETATM 0 H1' ATP A 1 9.705 6.531 19.721 1.00 0.00 H new