USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=27 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 102 TYR OH : rot 26:sc= 0.338 USER MOD Set 1.2: A 106 GLN : amide:sc= 0.297 K(o=0.64,f=0.013) USER MOD Set 2.1: A 61 LYS NZ :NH3+ 173:sc= -4.08 (180deg=-2.5) USER MOD Set 2.2: A 100 HIS : no HE2:sc= -2.01! C(o=-6.1!,f=-19!) USER MOD Set 3.1: A 55 SER OG : rot 18:sc= 0.979 USER MOD Set 3.2: A 99 CYS SG : rot -170:sc= 0.143 USER MOD Single : A 1 ATP O2' : rot 27:sc= 0.459 USER MOD Single : A 1 ATP O3' : rot -71:sc= 1.56 USER MOD Single : A 25 SER OG : rot -110:sc= -0.0334 USER MOD Single : A 29 GLN : amide:sc= -1.37! K(o=-1.4!,f=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= -1.36 K(o=-1.4,f=-0.74) USER MOD Single : A 35 SER OG : rot 2:sc= 0.748 USER MOD Single : A 42 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-0.36) USER MOD Single : A 43 ASN : amide:sc=-0.00773 K(o=-0.0077,f=-1.8!) USER MOD Single : A 47 SER OG : rot 15:sc= 0.504! USER MOD Single : A 63 GLN : amide:sc= -3.79! C(o=-3.8!,f=-3.1!) USER MOD Single : A 64 SER OG : rot -154:sc= -2.67! USER MOD Single : A 68 THR OG1 : rot 180:sc= 0.00461 USER MOD Single : A 75 SER OG : rot -160:sc= -2.55! USER MOD Single : A 85 LYS NZ :NH3+ 172:sc= -0.456 (180deg=-1.14!) USER MOD Single : A 88 GLN : amide:sc= -0.0139 K(o=-0.014,f=-1.8!) 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= -0.455 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -0.466 K(o=-0.47,f=-2.1) USER MOD Single : A 109 GLN : amide:sc= -0.33 K(o=-0.33,f=-1.9) USER MOD Single : A 112 THR OG1 : rot -160:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 174:sc= -2.53 (180deg=-2.67!) USER MOD Single : A 119 GLN : amide:sc= -1.47! C(o=-1.5!,f=-7.1!) USER MOD Single : A 120 SER OG : rot 9:sc= -1.4 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 -56:sc= 0.302 USER MOD Single : A 133 THR OG1 : rot -69:sc= 0.823 USER MOD Single : A 137 GLN : amide:sc= -11.8! C(o=-12!,f=-6.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 12.601 3.874 -35.679 1.00 0.00 N ATOM 2 CA GLY A 17 13.028 5.185 -35.114 1.00 0.00 C ATOM 3 C GLY A 17 11.792 6.029 -34.794 1.00 0.00 C ATOM 4 O GLY A 17 10.750 5.512 -34.441 1.00 0.00 O ATOM 0 HA2 GLY A 17 13.619 5.029 -34.211 1.00 0.00 H new ATOM 0 HA3 GLY A 17 13.666 5.710 -35.826 1.00 0.00 H new ATOM 10 N ALA A 18 11.898 7.324 -34.913 1.00 0.00 N ATOM 11 CA ALA A 18 10.729 8.198 -34.615 1.00 0.00 C ATOM 12 C ALA A 18 11.024 9.620 -35.119 1.00 0.00 C ATOM 13 O ALA A 18 12.168 10.021 -35.202 1.00 0.00 O ATOM 14 CB ALA A 18 10.494 8.221 -33.100 1.00 0.00 C ATOM 0 H ALA A 18 12.744 7.814 -35.204 1.00 0.00 H new ATOM 0 HA ALA A 18 9.838 7.816 -35.113 1.00 0.00 H new ATOM 0 HB1 ALA A 18 9.640 8.859 -32.874 1.00 0.00 H new ATOM 0 HB2 ALA A 18 10.295 7.209 -32.747 1.00 0.00 H new ATOM 0 HB3 ALA A 18 11.381 8.611 -32.600 1.00 0.00 H new ATOM 20 N PRO A 19 10.007 10.384 -35.449 1.00 0.00 N ATOM 21 CA PRO A 19 10.182 11.777 -35.943 1.00 0.00 C ATOM 22 C PRO A 19 11.332 12.507 -35.239 1.00 0.00 C ATOM 23 O PRO A 19 12.350 12.801 -35.834 1.00 0.00 O ATOM 24 CB PRO A 19 8.839 12.427 -35.612 1.00 0.00 C ATOM 25 CG PRO A 19 7.839 11.319 -35.750 1.00 0.00 C ATOM 26 CD PRO A 19 8.577 10.014 -35.393 1.00 0.00 C ATOM 0 HA PRO A 19 10.441 11.813 -37.001 1.00 0.00 H new ATOM 0 HB2 PRO A 19 8.836 12.840 -34.603 1.00 0.00 H new ATOM 0 HB3 PRO A 19 8.617 13.248 -36.293 1.00 0.00 H new ATOM 0 HG2 PRO A 19 6.990 11.478 -35.085 1.00 0.00 H new ATOM 0 HG3 PRO A 19 7.445 11.276 -36.766 1.00 0.00 H new ATOM 0 HD2 PRO A 19 8.296 9.655 -34.403 1.00 0.00 H new ATOM 0 HD3 PRO A 19 8.343 9.217 -36.099 1.00 0.00 H new ATOM 34 N GLU A 20 11.177 12.799 -33.976 1.00 0.00 N ATOM 35 CA GLU A 20 12.260 13.507 -33.237 1.00 0.00 C ATOM 36 C GLU A 20 13.392 12.526 -32.928 1.00 0.00 C ATOM 37 O GLU A 20 13.341 11.787 -31.965 1.00 0.00 O ATOM 38 CB GLU A 20 11.701 14.070 -31.929 1.00 0.00 C ATOM 39 CG GLU A 20 12.707 15.052 -31.325 1.00 0.00 C ATOM 40 CD GLU A 20 12.719 16.341 -32.149 1.00 0.00 C ATOM 41 OE1 GLU A 20 11.917 17.213 -31.861 1.00 0.00 O ATOM 42 OE2 GLU A 20 13.532 16.433 -33.055 1.00 0.00 O ATOM 0 H GLU A 20 10.348 12.578 -33.425 1.00 0.00 H new ATOM 0 HA GLU A 20 12.644 14.323 -33.849 1.00 0.00 H new ATOM 0 HB2 GLU A 20 10.752 14.573 -32.113 1.00 0.00 H new ATOM 0 HB3 GLU A 20 11.502 13.260 -31.228 1.00 0.00 H new ATOM 0 HG2 GLU A 20 12.441 15.271 -30.291 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.702 14.607 -31.311 1.00 0.00 H new ATOM 49 N GLY A 21 14.416 12.513 -33.737 1.00 0.00 N ATOM 50 CA GLY A 21 15.551 11.580 -33.488 1.00 0.00 C ATOM 51 C GLY A 21 16.135 11.844 -32.098 1.00 0.00 C ATOM 52 O GLY A 21 16.155 10.973 -31.250 1.00 0.00 O ATOM 0 H GLY A 21 14.516 13.108 -34.559 1.00 0.00 H new ATOM 0 HA2 GLY A 21 15.209 10.548 -33.560 1.00 0.00 H new ATOM 0 HA3 GLY A 21 16.320 11.715 -34.249 1.00 0.00 H new ATOM 56 N PRO A 22 16.608 13.041 -31.867 1.00 0.00 N ATOM 57 CA PRO A 22 17.206 13.434 -30.557 1.00 0.00 C ATOM 58 C PRO A 22 16.351 12.977 -29.368 1.00 0.00 C ATOM 59 O PRO A 22 15.142 13.102 -29.376 1.00 0.00 O ATOM 60 CB PRO A 22 17.262 14.963 -30.638 1.00 0.00 C ATOM 61 CG PRO A 22 17.404 15.258 -32.098 1.00 0.00 C ATOM 62 CD PRO A 22 16.626 14.157 -32.831 1.00 0.00 C ATOM 0 HA PRO A 22 18.180 12.972 -30.393 1.00 0.00 H new ATOM 0 HB2 PRO A 22 16.359 15.415 -30.228 1.00 0.00 H new ATOM 0 HB3 PRO A 22 18.103 15.360 -30.070 1.00 0.00 H new ATOM 0 HG2 PRO A 22 17.004 16.243 -32.337 1.00 0.00 H new ATOM 0 HG3 PRO A 22 18.453 15.259 -32.396 1.00 0.00 H new ATOM 0 HD2 PRO A 22 15.617 14.482 -33.087 1.00 0.00 H new ATOM 0 HD3 PRO A 22 17.115 13.873 -33.763 1.00 0.00 H new ATOM 70 N GLY A 23 16.970 12.450 -28.347 1.00 0.00 N ATOM 71 CA GLY A 23 16.195 11.988 -27.162 1.00 0.00 C ATOM 72 C GLY A 23 15.648 13.201 -26.405 1.00 0.00 C ATOM 73 O GLY A 23 15.837 14.331 -26.810 1.00 0.00 O ATOM 0 H GLY A 23 17.980 12.320 -28.283 1.00 0.00 H new ATOM 0 HA2 GLY A 23 15.375 11.344 -27.479 1.00 0.00 H new ATOM 0 HA3 GLY A 23 16.832 11.394 -26.507 1.00 0.00 H new ATOM 77 N PRO A 24 14.974 12.964 -25.310 1.00 0.00 N ATOM 78 CA PRO A 24 14.386 14.050 -24.473 1.00 0.00 C ATOM 79 C PRO A 24 15.375 15.196 -24.228 1.00 0.00 C ATOM 80 O PRO A 24 15.194 16.298 -24.707 1.00 0.00 O ATOM 81 CB PRO A 24 14.036 13.336 -23.162 1.00 0.00 C ATOM 82 CG PRO A 24 13.765 11.920 -23.564 1.00 0.00 C ATOM 83 CD PRO A 24 14.698 11.630 -24.747 1.00 0.00 C ATOM 0 HA PRO A 24 13.529 14.522 -24.953 1.00 0.00 H new ATOM 0 HB2 PRO A 24 14.857 13.395 -22.447 1.00 0.00 H new ATOM 0 HB3 PRO A 24 13.165 13.786 -22.686 1.00 0.00 H new ATOM 0 HG2 PRO A 24 13.959 11.236 -22.738 1.00 0.00 H new ATOM 0 HG3 PRO A 24 12.721 11.788 -23.849 1.00 0.00 H new ATOM 0 HD2 PRO A 24 15.613 11.135 -24.423 1.00 0.00 H new ATOM 0 HD3 PRO A 24 14.224 10.976 -25.480 1.00 0.00 H new ATOM 91 N SER A 25 16.418 14.944 -23.486 1.00 0.00 N ATOM 92 CA SER A 25 17.415 16.017 -23.211 1.00 0.00 C ATOM 93 C SER A 25 18.303 16.214 -24.441 1.00 0.00 C ATOM 94 O SER A 25 18.069 15.640 -25.486 1.00 0.00 O ATOM 95 CB SER A 25 18.281 15.615 -22.016 1.00 0.00 C ATOM 96 OG SER A 25 19.078 16.720 -21.616 1.00 0.00 O ATOM 0 H SER A 25 16.623 14.041 -23.058 1.00 0.00 H new ATOM 0 HA SER A 25 16.894 16.948 -22.985 1.00 0.00 H new ATOM 0 HB2 SER A 25 17.650 15.290 -21.189 1.00 0.00 H new ATOM 0 HB3 SER A 25 18.918 14.771 -22.282 1.00 0.00 H new ATOM 0 HG SER A 25 20.017 16.542 -21.833 1.00 0.00 H new ATOM 102 N GLY A 26 19.321 17.022 -24.326 1.00 0.00 N ATOM 103 CA GLY A 26 20.223 17.255 -25.489 1.00 0.00 C ATOM 104 C GLY A 26 21.013 18.547 -25.272 1.00 0.00 C ATOM 105 O GLY A 26 21.232 19.313 -26.189 1.00 0.00 O ATOM 0 H GLY A 26 19.567 17.531 -23.477 1.00 0.00 H new ATOM 0 HA2 GLY A 26 20.906 16.414 -25.607 1.00 0.00 H new ATOM 0 HA3 GLY A 26 19.640 17.323 -26.407 1.00 0.00 H new ATOM 109 N GLY A 27 21.441 18.796 -24.064 1.00 0.00 N ATOM 110 CA GLY A 27 22.216 20.039 -23.790 1.00 0.00 C ATOM 111 C GLY A 27 22.831 19.958 -22.391 1.00 0.00 C ATOM 112 O GLY A 27 23.150 18.892 -21.903 1.00 0.00 O ATOM 0 H GLY A 27 21.287 18.193 -23.256 1.00 0.00 H new ATOM 0 HA2 GLY A 27 23.000 20.164 -24.537 1.00 0.00 H new ATOM 0 HA3 GLY A 27 21.565 20.910 -23.863 1.00 0.00 H new ATOM 116 N ALA A 28 23.000 21.077 -21.742 1.00 0.00 N ATOM 117 CA ALA A 28 23.594 21.064 -20.376 1.00 0.00 C ATOM 118 C ALA A 28 22.527 20.654 -19.359 1.00 0.00 C ATOM 119 O ALA A 28 22.829 20.281 -18.243 1.00 0.00 O ATOM 120 CB ALA A 28 24.116 22.460 -20.033 1.00 0.00 C ATOM 0 H ALA A 28 22.752 22.000 -22.099 1.00 0.00 H new ATOM 0 HA ALA A 28 24.418 20.351 -20.345 1.00 0.00 H new ATOM 0 HB1 ALA A 28 24.551 22.450 -19.033 1.00 0.00 H new ATOM 0 HB2 ALA A 28 24.877 22.752 -20.757 1.00 0.00 H new ATOM 0 HB3 ALA A 28 23.293 23.174 -20.064 1.00 0.00 H new ATOM 126 N GLN A 29 21.279 20.721 -19.736 1.00 0.00 N ATOM 127 CA GLN A 29 20.194 20.335 -18.791 1.00 0.00 C ATOM 128 C GLN A 29 20.404 18.890 -18.335 1.00 0.00 C ATOM 129 O GLN A 29 20.336 18.583 -17.161 1.00 0.00 O ATOM 130 CB GLN A 29 18.839 20.457 -19.492 1.00 0.00 C ATOM 131 CG GLN A 29 18.550 21.930 -19.790 1.00 0.00 C ATOM 132 CD GLN A 29 17.174 22.056 -20.447 1.00 0.00 C ATOM 133 OE1 GLN A 29 16.740 23.144 -20.769 1.00 0.00 O ATOM 134 NE2 GLN A 29 16.465 20.982 -20.661 1.00 0.00 N ATOM 0 H GLN A 29 20.965 21.026 -20.657 1.00 0.00 H new ATOM 0 HA GLN A 29 20.216 20.996 -17.924 1.00 0.00 H new ATOM 0 HB2 GLN A 29 18.843 19.882 -20.418 1.00 0.00 H new ATOM 0 HB3 GLN A 29 18.053 20.041 -18.862 1.00 0.00 H new ATOM 0 HG2 GLN A 29 18.580 22.511 -18.868 1.00 0.00 H new ATOM 0 HG3 GLN A 29 19.318 22.337 -20.448 1.00 0.00 H new ATOM 0 HE21 GLN A 29 16.829 20.068 -20.391 1.00 0.00 H new ATOM 0 HE22 GLN A 29 15.547 21.056 -21.099 1.00 0.00 H new ATOM 143 N GLY A 30 20.659 17.999 -19.254 1.00 0.00 N ATOM 144 CA GLY A 30 20.873 16.575 -18.872 1.00 0.00 C ATOM 145 C GLY A 30 22.270 16.413 -18.270 1.00 0.00 C ATOM 146 O GLY A 30 22.883 15.369 -18.371 1.00 0.00 O ATOM 0 H GLY A 30 20.728 18.196 -20.252 1.00 0.00 H new ATOM 0 HA2 GLY A 30 20.117 16.263 -18.152 1.00 0.00 H new ATOM 0 HA3 GLY A 30 20.765 15.933 -19.746 1.00 0.00 H new ATOM 150 N GLY A 31 22.779 17.439 -17.644 1.00 0.00 N ATOM 151 CA GLY A 31 24.136 17.342 -17.036 1.00 0.00 C ATOM 152 C GLY A 31 24.047 16.592 -15.706 1.00 0.00 C ATOM 153 O GLY A 31 25.027 16.430 -15.006 1.00 0.00 O ATOM 0 H GLY A 31 22.314 18.339 -17.527 1.00 0.00 H new ATOM 0 HA2 GLY A 31 24.813 16.823 -17.714 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.547 18.339 -16.877 1.00 0.00 H new ATOM 157 N SER A 32 22.879 16.132 -15.350 1.00 0.00 N ATOM 158 CA SER A 32 22.728 15.393 -14.066 1.00 0.00 C ATOM 159 C SER A 32 23.787 14.291 -13.984 1.00 0.00 C ATOM 160 O SER A 32 24.564 14.095 -14.897 1.00 0.00 O ATOM 161 CB SER A 32 21.334 14.766 -13.998 1.00 0.00 C ATOM 162 OG SER A 32 20.352 15.777 -14.170 1.00 0.00 O ATOM 0 H SER A 32 22.022 16.236 -15.894 1.00 0.00 H new ATOM 0 HA SER A 32 22.856 16.084 -13.233 1.00 0.00 H new ATOM 0 HB2 SER A 32 21.228 14.005 -14.771 1.00 0.00 H new ATOM 0 HB3 SER A 32 21.194 14.267 -13.039 1.00 0.00 H new ATOM 0 HG SER A 32 19.459 15.376 -14.128 1.00 0.00 H new ATOM 168 N ILE A 33 23.824 13.571 -12.896 1.00 0.00 N ATOM 169 CA ILE A 33 24.833 12.483 -12.756 1.00 0.00 C ATOM 170 C ILE A 33 24.506 11.640 -11.522 1.00 0.00 C ATOM 171 O ILE A 33 24.620 10.431 -11.537 1.00 0.00 O ATOM 172 CB ILE A 33 26.226 13.096 -12.601 1.00 0.00 C ATOM 173 CG1 ILE A 33 27.258 11.978 -12.438 1.00 0.00 C ATOM 174 CG2 ILE A 33 26.253 13.998 -11.366 1.00 0.00 C ATOM 175 CD1 ILE A 33 28.667 12.564 -12.555 1.00 0.00 C ATOM 0 H ILE A 33 23.199 13.689 -12.098 1.00 0.00 H new ATOM 0 HA ILE A 33 24.811 11.851 -13.644 1.00 0.00 H new ATOM 0 HB ILE A 33 26.464 13.686 -13.486 1.00 0.00 H new ATOM 0 HG12 ILE A 33 27.134 11.492 -11.470 1.00 0.00 H new ATOM 0 HG13 ILE A 33 27.106 11.214 -13.200 1.00 0.00 H new ATOM 0 HG21 ILE A 33 27.246 14.435 -11.256 1.00 0.00 H new ATOM 0 HG22 ILE A 33 25.517 14.794 -11.481 1.00 0.00 H new ATOM 0 HG23 ILE A 33 26.015 13.409 -10.480 1.00 0.00 H new ATOM 0 HD11 ILE A 33 29.403 11.768 -12.439 1.00 0.00 H new ATOM 0 HD12 ILE A 33 28.787 13.030 -13.533 1.00 0.00 H new ATOM 0 HD13 ILE A 33 28.816 13.312 -11.776 1.00 0.00 H new ATOM 187 N HIS A 34 24.100 12.269 -10.453 1.00 0.00 N ATOM 188 CA HIS A 34 23.766 11.503 -9.220 1.00 0.00 C ATOM 189 C HIS A 34 22.371 10.891 -9.362 1.00 0.00 C ATOM 190 O HIS A 34 21.370 11.555 -9.181 1.00 0.00 O ATOM 191 CB HIS A 34 23.789 12.444 -8.013 1.00 0.00 C ATOM 192 CG HIS A 34 25.080 13.217 -8.004 1.00 0.00 C ATOM 193 ND1 HIS A 34 26.289 12.632 -7.662 1.00 0.00 N ATOM 194 CD2 HIS A 34 25.366 14.528 -8.294 1.00 0.00 C ATOM 195 CE1 HIS A 34 27.238 13.581 -7.753 1.00 0.00 C ATOM 196 NE2 HIS A 34 26.729 14.756 -8.134 1.00 0.00 N ATOM 0 H HIS A 34 23.985 13.280 -10.381 1.00 0.00 H new ATOM 0 HA HIS A 34 24.499 10.709 -9.076 1.00 0.00 H new ATOM 0 HB2 HIS A 34 22.943 13.129 -8.057 1.00 0.00 H new ATOM 0 HB3 HIS A 34 23.689 11.872 -7.091 1.00 0.00 H new ATOM 0 HD2 HIS A 34 24.643 15.270 -8.600 1.00 0.00 H new ATOM 0 HE1 HIS A 34 28.284 13.413 -7.544 1.00 0.00 H new ATOM 0 HE2 HIS A 34 27.232 15.632 -8.277 1.00 0.00 H new ATOM 204 N SER A 35 22.297 9.629 -9.684 1.00 0.00 N ATOM 205 CA SER A 35 20.966 8.976 -9.838 1.00 0.00 C ATOM 206 C SER A 35 21.152 7.463 -9.969 1.00 0.00 C ATOM 207 O SER A 35 21.760 6.982 -10.904 1.00 0.00 O ATOM 208 CB SER A 35 20.275 9.516 -11.091 1.00 0.00 C ATOM 209 OG SER A 35 19.841 10.848 -10.857 1.00 0.00 O ATOM 0 H SER A 35 23.100 9.022 -9.847 1.00 0.00 H new ATOM 0 HA SER A 35 20.352 9.192 -8.964 1.00 0.00 H new ATOM 0 HB2 SER A 35 20.961 9.489 -11.937 1.00 0.00 H new ATOM 0 HB3 SER A 35 19.424 8.886 -11.350 1.00 0.00 H new ATOM 0 HG SER A 35 20.111 11.127 -9.957 1.00 0.00 H new ATOM 215 N GLY A 36 20.632 6.709 -9.039 1.00 0.00 N ATOM 216 CA GLY A 36 20.779 5.228 -9.112 1.00 0.00 C ATOM 217 C GLY A 36 20.539 4.623 -7.727 1.00 0.00 C ATOM 218 O GLY A 36 20.820 3.466 -7.488 1.00 0.00 O ATOM 0 H GLY A 36 20.112 7.055 -8.232 1.00 0.00 H new ATOM 0 HA2 GLY A 36 20.068 4.816 -9.829 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.776 4.968 -9.466 1.00 0.00 H new ATOM 222 N ARG A 37 20.020 5.397 -6.813 1.00 0.00 N ATOM 223 CA ARG A 37 19.763 4.866 -5.445 1.00 0.00 C ATOM 224 C ARG A 37 18.936 5.879 -4.652 1.00 0.00 C ATOM 225 O ARG A 37 19.069 7.075 -4.825 1.00 0.00 O ATOM 226 CB ARG A 37 21.096 4.625 -4.733 1.00 0.00 C ATOM 227 CG ARG A 37 20.843 3.909 -3.405 1.00 0.00 C ATOM 228 CD ARG A 37 22.166 3.741 -2.656 1.00 0.00 C ATOM 229 NE ARG A 37 22.843 5.063 -2.541 1.00 0.00 N ATOM 230 CZ ARG A 37 24.085 5.128 -2.144 1.00 0.00 C ATOM 231 NH1 ARG A 37 24.733 4.035 -1.848 1.00 0.00 N ATOM 232 NH2 ARG A 37 24.678 6.286 -2.042 1.00 0.00 N ATOM 0 H ARG A 37 19.763 6.374 -6.955 1.00 0.00 H new ATOM 0 HA ARG A 37 19.215 3.927 -5.516 1.00 0.00 H new ATOM 0 HB2 ARG A 37 21.753 4.025 -5.362 1.00 0.00 H new ATOM 0 HB3 ARG A 37 21.603 5.574 -4.556 1.00 0.00 H new ATOM 0 HG2 ARG A 37 20.140 4.481 -2.799 1.00 0.00 H new ATOM 0 HG3 ARG A 37 20.389 2.935 -3.586 1.00 0.00 H new ATOM 0 HD2 ARG A 37 21.985 3.326 -1.665 1.00 0.00 H new ATOM 0 HD3 ARG A 37 22.808 3.036 -3.184 1.00 0.00 H new ATOM 0 HE ARG A 37 22.336 5.917 -2.772 1.00 0.00 H new ATOM 0 HH11 ARG A 37 24.269 3.130 -1.927 1.00 0.00 H new ATOM 0 HH12 ARG A 37 25.703 4.086 -1.538 1.00 0.00 H new ATOM 0 HH21 ARG A 37 24.171 7.141 -2.272 1.00 0.00 H new ATOM 0 HH22 ARG A 37 25.648 6.336 -1.732 1.00 0.00 H new ATOM 246 N ILE A 38 18.081 5.411 -3.779 1.00 0.00 N ATOM 247 CA ILE A 38 17.239 6.345 -2.968 1.00 0.00 C ATOM 248 C ILE A 38 17.070 5.770 -1.562 1.00 0.00 C ATOM 249 O ILE A 38 16.231 4.926 -1.318 1.00 0.00 O ATOM 250 CB ILE A 38 15.867 6.504 -3.641 1.00 0.00 C ATOM 251 CG1 ILE A 38 16.085 6.997 -5.074 1.00 0.00 C ATOM 252 CG2 ILE A 38 15.004 7.520 -2.872 1.00 0.00 C ATOM 253 CD1 ILE A 38 14.743 7.368 -5.713 1.00 0.00 C ATOM 0 H ILE A 38 17.929 4.420 -3.592 1.00 0.00 H new ATOM 0 HA ILE A 38 17.719 7.321 -2.903 1.00 0.00 H new ATOM 0 HB ILE A 38 15.349 5.545 -3.643 1.00 0.00 H new ATOM 0 HG12 ILE A 38 16.747 7.863 -5.072 1.00 0.00 H new ATOM 0 HG13 ILE A 38 16.575 6.222 -5.663 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.036 7.620 -3.363 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.858 7.173 -1.849 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.506 8.487 -2.859 1.00 0.00 H new ATOM 0 HD11 ILE A 38 14.909 7.717 -6.732 1.00 0.00 H new ATOM 0 HD12 ILE A 38 14.094 6.492 -5.731 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.269 8.159 -5.131 1.00 0.00 H new ATOM 265 N ALA A 39 17.867 6.227 -0.634 1.00 0.00 N ATOM 266 CA ALA A 39 17.768 5.719 0.768 1.00 0.00 C ATOM 267 C ALA A 39 16.860 6.645 1.581 1.00 0.00 C ATOM 268 O ALA A 39 17.302 7.625 2.148 1.00 0.00 O ATOM 269 CB ALA A 39 19.164 5.690 1.393 1.00 0.00 C ATOM 0 H ALA A 39 18.586 6.934 -0.786 1.00 0.00 H new ATOM 0 HA ALA A 39 17.349 4.713 0.766 1.00 0.00 H new ATOM 0 HB1 ALA A 39 19.097 5.320 2.416 1.00 0.00 H new ATOM 0 HB2 ALA A 39 19.810 5.032 0.811 1.00 0.00 H new ATOM 0 HB3 ALA A 39 19.581 6.697 1.398 1.00 0.00 H new ATOM 275 N ALA A 40 15.590 6.344 1.635 1.00 0.00 N ATOM 276 CA ALA A 40 14.634 7.200 2.401 1.00 0.00 C ATOM 277 C ALA A 40 13.580 6.311 3.072 1.00 0.00 C ATOM 278 O ALA A 40 13.662 5.096 3.038 1.00 0.00 O ATOM 279 CB ALA A 40 13.962 8.188 1.435 1.00 0.00 C ATOM 0 H ALA A 40 15.169 5.535 1.178 1.00 0.00 H new ATOM 0 HA ALA A 40 15.165 7.758 3.172 1.00 0.00 H new ATOM 0 HB1 ALA A 40 13.263 8.817 1.986 1.00 0.00 H new ATOM 0 HB2 ALA A 40 14.722 8.814 0.968 1.00 0.00 H new ATOM 0 HB3 ALA A 40 13.424 7.635 0.665 1.00 0.00 H new ATOM 285 N VAL A 41 12.596 6.908 3.687 1.00 0.00 N ATOM 286 CA VAL A 41 11.534 6.104 4.362 1.00 0.00 C ATOM 287 C VAL A 41 10.616 5.506 3.295 1.00 0.00 C ATOM 288 O VAL A 41 10.314 6.135 2.300 1.00 0.00 O ATOM 289 CB VAL A 41 10.711 7.002 5.295 1.00 0.00 C ATOM 290 CG1 VAL A 41 9.670 6.157 6.036 1.00 0.00 C ATOM 291 CG2 VAL A 41 11.634 7.687 6.315 1.00 0.00 C ATOM 0 H VAL A 41 12.480 7.919 3.752 1.00 0.00 H new ATOM 0 HA VAL A 41 11.995 5.310 4.949 1.00 0.00 H new ATOM 0 HB VAL A 41 10.207 7.764 4.700 1.00 0.00 H new ATOM 0 HG11 VAL A 41 9.087 6.797 6.698 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.007 5.681 5.314 1.00 0.00 H new ATOM 0 HG13 VAL A 41 10.175 5.391 6.624 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.041 8.322 6.973 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.147 6.930 6.908 1.00 0.00 H new ATOM 0 HG23 VAL A 41 12.369 8.296 5.789 1.00 0.00 H new ATOM 301 N HIS A 42 10.181 4.291 3.485 1.00 0.00 N ATOM 302 CA HIS A 42 9.294 3.637 2.473 1.00 0.00 C ATOM 303 C HIS A 42 8.290 2.720 3.179 1.00 0.00 C ATOM 304 O HIS A 42 8.588 2.113 4.188 1.00 0.00 O ATOM 305 CB HIS A 42 10.162 2.785 1.532 1.00 0.00 C ATOM 306 CG HIS A 42 10.717 3.622 0.411 1.00 0.00 C ATOM 307 ND1 HIS A 42 10.330 3.434 -0.905 1.00 0.00 N ATOM 308 CD2 HIS A 42 11.641 4.635 0.389 1.00 0.00 C ATOM 309 CE1 HIS A 42 11.016 4.311 -1.658 1.00 0.00 C ATOM 310 NE2 HIS A 42 11.830 5.069 -0.919 1.00 0.00 N ATOM 0 H HIS A 42 10.401 3.718 4.300 1.00 0.00 H new ATOM 0 HA HIS A 42 8.757 4.402 1.912 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.980 2.334 2.094 1.00 0.00 H new ATOM 0 HB3 HIS A 42 9.568 1.968 1.122 1.00 0.00 H new ATOM 0 HD2 HIS A 42 12.146 5.035 1.256 1.00 0.00 H new ATOM 0 HE1 HIS A 42 10.920 4.393 -2.731 1.00 0.00 H new ATOM 0 HE2 HIS A 42 12.455 5.807 -1.244 1.00 0.00 H new ATOM 318 N ASN A 43 7.110 2.592 2.632 1.00 0.00 N ATOM 319 CA ASN A 43 6.097 1.690 3.244 1.00 0.00 C ATOM 320 C ASN A 43 6.352 0.268 2.745 1.00 0.00 C ATOM 321 O ASN A 43 5.873 -0.128 1.701 1.00 0.00 O ATOM 322 CB ASN A 43 4.699 2.133 2.818 1.00 0.00 C ATOM 323 CG ASN A 43 4.372 3.474 3.474 1.00 0.00 C ATOM 324 OD1 ASN A 43 5.104 3.943 4.322 1.00 0.00 O ATOM 325 ND2 ASN A 43 3.296 4.115 3.115 1.00 0.00 N ATOM 0 H ASN A 43 6.806 3.075 1.787 1.00 0.00 H new ATOM 0 HA ASN A 43 6.170 1.726 4.331 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.649 2.224 1.733 1.00 0.00 H new ATOM 0 HB3 ASN A 43 3.963 1.384 3.109 1.00 0.00 H new ATOM 0 HD21 ASN A 43 3.068 5.011 3.546 1.00 0.00 H new ATOM 0 HD22 ASN A 43 2.681 3.721 2.403 1.00 0.00 H new ATOM 332 N VAL A 44 7.112 -0.503 3.476 1.00 0.00 N ATOM 333 CA VAL A 44 7.406 -1.900 3.036 1.00 0.00 C ATOM 334 C VAL A 44 6.295 -2.833 3.574 1.00 0.00 C ATOM 335 O VAL A 44 6.061 -2.875 4.765 1.00 0.00 O ATOM 336 CB VAL A 44 8.792 -2.324 3.571 1.00 0.00 C ATOM 337 CG1 VAL A 44 8.725 -2.678 5.057 1.00 0.00 C ATOM 338 CG2 VAL A 44 9.295 -3.542 2.794 1.00 0.00 C ATOM 0 H VAL A 44 7.542 -0.227 4.359 1.00 0.00 H new ATOM 0 HA VAL A 44 7.426 -1.964 1.948 1.00 0.00 H new ATOM 0 HB VAL A 44 9.474 -1.484 3.440 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.715 -2.973 5.406 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.384 -1.811 5.623 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.028 -3.503 5.203 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.273 -3.838 3.174 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.593 -4.367 2.916 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.378 -3.290 1.737 1.00 0.00 H new ATOM 348 N PRO A 45 5.593 -3.565 2.722 1.00 0.00 N ATOM 349 CA PRO A 45 4.493 -4.469 3.183 1.00 0.00 C ATOM 350 C PRO A 45 4.884 -5.341 4.381 1.00 0.00 C ATOM 351 O PRO A 45 5.996 -5.814 4.486 1.00 0.00 O ATOM 352 CB PRO A 45 4.202 -5.355 1.961 1.00 0.00 C ATOM 353 CG PRO A 45 4.628 -4.550 0.773 1.00 0.00 C ATOM 354 CD PRO A 45 5.748 -3.612 1.248 1.00 0.00 C ATOM 0 HA PRO A 45 3.636 -3.890 3.527 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.753 -6.294 2.017 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.144 -5.609 1.904 1.00 0.00 H new ATOM 0 HG2 PRO A 45 4.982 -5.200 -0.027 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.790 -3.979 0.373 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.730 -3.991 0.964 1.00 0.00 H new ATOM 0 HD3 PRO A 45 5.649 -2.620 0.807 1.00 0.00 H new ATOM 362 N LEU A 46 3.966 -5.565 5.279 1.00 0.00 N ATOM 363 CA LEU A 46 4.277 -6.422 6.454 1.00 0.00 C ATOM 364 C LEU A 46 4.434 -7.872 5.991 1.00 0.00 C ATOM 365 O LEU A 46 5.134 -8.660 6.597 1.00 0.00 O ATOM 366 CB LEU A 46 3.117 -6.367 7.448 1.00 0.00 C ATOM 367 CG LEU A 46 2.924 -4.935 7.998 1.00 0.00 C ATOM 368 CD1 LEU A 46 1.449 -4.715 8.314 1.00 0.00 C ATOM 369 CD2 LEU A 46 3.738 -4.723 9.284 1.00 0.00 C ATOM 0 H LEU A 46 3.017 -5.193 5.250 1.00 0.00 H new ATOM 0 HA LEU A 46 5.194 -6.066 6.923 1.00 0.00 H new ATOM 0 HB2 LEU A 46 2.200 -6.700 6.961 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.307 -7.054 8.272 1.00 0.00 H new ATOM 0 HG LEU A 46 3.268 -4.228 7.243 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.307 -3.707 8.702 1.00 0.00 H new ATOM 0 HD12 LEU A 46 0.860 -4.841 7.406 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.125 -5.440 9.060 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.584 -3.708 9.649 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.412 -5.435 10.042 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.797 -4.876 9.074 1.00 0.00 H new ATOM 381 N SER A 47 3.746 -8.236 4.945 1.00 0.00 N ATOM 382 CA SER A 47 3.799 -9.647 4.454 1.00 0.00 C ATOM 383 C SER A 47 5.146 -9.992 3.795 1.00 0.00 C ATOM 384 O SER A 47 5.414 -11.149 3.538 1.00 0.00 O ATOM 385 CB SER A 47 2.675 -9.866 3.437 1.00 0.00 C ATOM 386 OG SER A 47 2.999 -10.969 2.604 1.00 0.00 O ATOM 0 H SER A 47 3.145 -7.615 4.404 1.00 0.00 H new ATOM 0 HA SER A 47 3.679 -10.300 5.319 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.733 -10.051 3.954 1.00 0.00 H new ATOM 0 HB3 SER A 47 2.536 -8.969 2.833 1.00 0.00 H new ATOM 0 HG SER A 47 3.730 -11.481 3.009 1.00 0.00 H new ATOM 392 N VAL A 48 5.992 -9.025 3.501 1.00 0.00 N ATOM 393 CA VAL A 48 7.305 -9.342 2.840 1.00 0.00 C ATOM 394 C VAL A 48 8.475 -9.025 3.780 1.00 0.00 C ATOM 395 O VAL A 48 9.579 -8.771 3.339 1.00 0.00 O ATOM 396 CB VAL A 48 7.443 -8.528 1.544 1.00 0.00 C ATOM 397 CG1 VAL A 48 6.175 -8.681 0.699 1.00 0.00 C ATOM 398 CG2 VAL A 48 7.672 -7.047 1.857 1.00 0.00 C ATOM 0 H VAL A 48 5.831 -8.036 3.689 1.00 0.00 H new ATOM 0 HA VAL A 48 7.328 -10.406 2.605 1.00 0.00 H new ATOM 0 HB VAL A 48 8.302 -8.906 0.989 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.277 -8.102 -0.219 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.028 -9.732 0.451 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.316 -8.318 1.263 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.767 -6.489 0.926 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.827 -6.661 2.427 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.585 -6.936 2.442 1.00 0.00 H new ATOM 408 N LEU A 49 8.256 -9.058 5.071 1.00 0.00 N ATOM 409 CA LEU A 49 9.366 -8.783 6.034 1.00 0.00 C ATOM 410 C LEU A 49 9.939 -10.114 6.523 1.00 0.00 C ATOM 411 O LEU A 49 9.232 -10.950 7.049 1.00 0.00 O ATOM 412 CB LEU A 49 8.827 -8.010 7.242 1.00 0.00 C ATOM 413 CG LEU A 49 8.491 -6.560 6.858 1.00 0.00 C ATOM 414 CD1 LEU A 49 7.842 -5.871 8.065 1.00 0.00 C ATOM 415 CD2 LEU A 49 9.768 -5.797 6.451 1.00 0.00 C ATOM 0 H LEU A 49 7.354 -9.264 5.500 1.00 0.00 H new ATOM 0 HA LEU A 49 10.137 -8.194 5.537 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.935 -8.505 7.627 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.566 -8.017 8.043 1.00 0.00 H new ATOM 0 HG LEU A 49 7.807 -6.561 6.010 1.00 0.00 H new ATOM 0 HD11 LEU A 49 7.598 -4.840 7.808 1.00 0.00 H new ATOM 0 HD12 LEU A 49 6.931 -6.402 8.341 1.00 0.00 H new ATOM 0 HD13 LEU A 49 8.536 -5.880 8.906 1.00 0.00 H new ATOM 0 HD21 LEU A 49 9.510 -4.773 6.183 1.00 0.00 H new ATOM 0 HD22 LEU A 49 10.468 -5.788 7.286 1.00 0.00 H new ATOM 0 HD23 LEU A 49 10.230 -6.291 5.596 1.00 0.00 H new ATOM 427 N ILE A 50 11.215 -10.319 6.350 1.00 0.00 N ATOM 428 CA ILE A 50 11.840 -11.595 6.800 1.00 0.00 C ATOM 429 C ILE A 50 12.281 -11.475 8.259 1.00 0.00 C ATOM 430 O ILE A 50 13.114 -10.658 8.604 1.00 0.00 O ATOM 431 CB ILE A 50 13.058 -11.882 5.928 1.00 0.00 C ATOM 432 CG1 ILE A 50 12.649 -11.782 4.457 1.00 0.00 C ATOM 433 CG2 ILE A 50 13.594 -13.285 6.222 1.00 0.00 C ATOM 434 CD1 ILE A 50 13.813 -12.219 3.566 1.00 0.00 C ATOM 0 H ILE A 50 11.855 -9.655 5.914 1.00 0.00 H new ATOM 0 HA ILE A 50 11.116 -12.405 6.713 1.00 0.00 H new ATOM 0 HB ILE A 50 13.842 -11.156 6.144 1.00 0.00 H new ATOM 0 HG12 ILE A 50 11.779 -12.410 4.268 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.361 -10.758 4.219 1.00 0.00 H new ATOM 0 HG21 ILE A 50 14.464 -13.481 5.595 1.00 0.00 H new ATOM 0 HG22 ILE A 50 13.881 -13.352 7.271 1.00 0.00 H new ATOM 0 HG23 ILE A 50 12.820 -14.022 6.010 1.00 0.00 H new ATOM 0 HD11 ILE A 50 13.517 -12.146 2.519 1.00 0.00 H new ATOM 0 HD12 ILE A 50 14.672 -11.572 3.746 1.00 0.00 H new ATOM 0 HD13 ILE A 50 14.080 -13.250 3.797 1.00 0.00 H new ATOM 446 N ARG A 51 11.730 -12.298 9.112 1.00 0.00 N ATOM 447 CA ARG A 51 12.107 -12.270 10.560 1.00 0.00 C ATOM 448 C ARG A 51 12.346 -13.705 11.056 1.00 0.00 C ATOM 449 O ARG A 51 11.425 -14.371 11.485 1.00 0.00 O ATOM 450 CB ARG A 51 10.949 -11.667 11.355 1.00 0.00 C ATOM 451 CG ARG A 51 10.789 -10.196 10.971 1.00 0.00 C ATOM 452 CD ARG A 51 9.544 -9.607 11.643 1.00 0.00 C ATOM 453 NE ARG A 51 9.857 -9.267 13.064 1.00 0.00 N ATOM 454 CZ ARG A 51 9.664 -10.143 14.019 1.00 0.00 C ATOM 455 NH1 ARG A 51 9.204 -11.333 13.743 1.00 0.00 N ATOM 456 NH2 ARG A 51 9.936 -9.824 15.255 1.00 0.00 N ATOM 0 H ARG A 51 11.028 -12.996 8.867 1.00 0.00 H new ATOM 0 HA ARG A 51 13.013 -11.678 10.692 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.028 -12.212 11.148 1.00 0.00 H new ATOM 0 HB3 ARG A 51 11.140 -11.758 12.424 1.00 0.00 H new ATOM 0 HG2 ARG A 51 11.674 -9.635 11.273 1.00 0.00 H new ATOM 0 HG3 ARG A 51 10.706 -10.102 9.888 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.217 -8.715 11.108 1.00 0.00 H new ATOM 0 HD3 ARG A 51 8.723 -10.323 11.602 1.00 0.00 H new ATOM 0 HE ARG A 51 10.225 -8.344 13.293 1.00 0.00 H new ATOM 0 HH11 ARG A 51 8.992 -11.587 12.778 1.00 0.00 H new ATOM 0 HH12 ARG A 51 9.057 -12.009 14.492 1.00 0.00 H new ATOM 0 HH21 ARG A 51 10.297 -8.896 15.474 1.00 0.00 H new ATOM 0 HH22 ARG A 51 9.787 -10.503 16.002 1.00 0.00 H new ATOM 470 N PRO A 52 13.571 -14.173 11.027 1.00 0.00 N ATOM 471 CA PRO A 52 13.933 -15.530 11.505 1.00 0.00 C ATOM 472 C PRO A 52 14.522 -15.507 12.921 1.00 0.00 C ATOM 473 O PRO A 52 15.350 -16.327 13.266 1.00 0.00 O ATOM 474 CB PRO A 52 15.007 -15.923 10.501 1.00 0.00 C ATOM 475 CG PRO A 52 15.765 -14.644 10.264 1.00 0.00 C ATOM 476 CD PRO A 52 14.766 -13.487 10.506 1.00 0.00 C ATOM 0 HA PRO A 52 13.081 -16.207 11.564 1.00 0.00 H new ATOM 0 HB2 PRO A 52 15.656 -16.705 10.895 1.00 0.00 H new ATOM 0 HB3 PRO A 52 14.571 -16.306 9.578 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.617 -14.568 10.939 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.159 -14.610 9.248 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.156 -12.761 11.220 1.00 0.00 H new ATOM 0 HD3 PRO A 52 14.549 -12.944 9.586 1.00 0.00 H new ATOM 484 N LEU A 53 14.127 -14.560 13.734 1.00 0.00 N ATOM 485 CA LEU A 53 14.693 -14.470 15.117 1.00 0.00 C ATOM 486 C LEU A 53 13.590 -14.052 16.109 1.00 0.00 C ATOM 487 O LEU A 53 13.409 -12.882 16.380 1.00 0.00 O ATOM 488 CB LEU A 53 15.817 -13.416 15.098 1.00 0.00 C ATOM 489 CG LEU A 53 16.847 -13.692 16.202 1.00 0.00 C ATOM 490 CD1 LEU A 53 18.059 -12.782 15.988 1.00 0.00 C ATOM 491 CD2 LEU A 53 16.230 -13.409 17.575 1.00 0.00 C ATOM 0 H LEU A 53 13.438 -13.845 13.501 1.00 0.00 H new ATOM 0 HA LEU A 53 15.086 -15.436 15.433 1.00 0.00 H new ATOM 0 HB2 LEU A 53 16.310 -13.422 14.126 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.391 -12.422 15.233 1.00 0.00 H new ATOM 0 HG LEU A 53 17.154 -14.737 16.161 1.00 0.00 H new ATOM 0 HD11 LEU A 53 18.797 -12.970 16.767 1.00 0.00 H new ATOM 0 HD12 LEU A 53 18.500 -12.987 15.013 1.00 0.00 H new ATOM 0 HD13 LEU A 53 17.743 -11.740 16.031 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.967 -13.607 18.353 1.00 0.00 H new ATOM 0 HD22 LEU A 53 15.920 -12.365 17.626 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.363 -14.053 17.724 1.00 0.00 H new ATOM 503 N PRO A 54 12.863 -14.999 16.657 1.00 0.00 N ATOM 504 CA PRO A 54 11.777 -14.704 17.640 1.00 0.00 C ATOM 505 C PRO A 54 12.247 -13.748 18.745 1.00 0.00 C ATOM 506 O PRO A 54 13.421 -13.462 18.868 1.00 0.00 O ATOM 507 CB PRO A 54 11.428 -16.083 18.215 1.00 0.00 C ATOM 508 CG PRO A 54 11.769 -17.043 17.120 1.00 0.00 C ATOM 509 CD PRO A 54 12.986 -16.448 16.405 1.00 0.00 C ATOM 0 HA PRO A 54 10.926 -14.204 17.178 1.00 0.00 H new ATOM 0 HB2 PRO A 54 12.000 -16.292 19.119 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.373 -16.146 18.484 1.00 0.00 H new ATOM 0 HG2 PRO A 54 11.996 -18.030 17.523 1.00 0.00 H new ATOM 0 HG3 PRO A 54 10.932 -17.164 16.432 1.00 0.00 H new ATOM 0 HD2 PRO A 54 13.919 -16.846 16.803 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.973 -16.672 15.338 1.00 0.00 H new ATOM 517 N SER A 55 11.342 -13.247 19.544 1.00 0.00 N ATOM 518 CA SER A 55 11.752 -12.306 20.628 1.00 0.00 C ATOM 519 C SER A 55 10.691 -12.282 21.730 1.00 0.00 C ATOM 520 O SER A 55 9.575 -12.728 21.551 1.00 0.00 O ATOM 521 CB SER A 55 11.904 -10.898 20.042 1.00 0.00 C ATOM 522 OG SER A 55 13.183 -10.771 19.439 1.00 0.00 O ATOM 0 H SER A 55 10.343 -13.447 19.494 1.00 0.00 H new ATOM 0 HA SER A 55 12.700 -12.638 21.051 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.123 -10.713 19.305 1.00 0.00 H new ATOM 0 HB3 SER A 55 11.785 -10.151 20.827 1.00 0.00 H new ATOM 0 HG SER A 55 13.555 -11.662 19.271 1.00 0.00 H new ATOM 528 N VAL A 56 11.036 -11.737 22.868 1.00 0.00 N ATOM 529 CA VAL A 56 10.061 -11.644 23.998 1.00 0.00 C ATOM 530 C VAL A 56 9.413 -10.255 23.962 1.00 0.00 C ATOM 531 O VAL A 56 10.074 -9.245 24.094 1.00 0.00 O ATOM 532 CB VAL A 56 10.787 -11.882 25.343 1.00 0.00 C ATOM 533 CG1 VAL A 56 11.503 -10.609 25.827 1.00 0.00 C ATOM 534 CG2 VAL A 56 9.768 -12.313 26.404 1.00 0.00 C ATOM 0 H VAL A 56 11.959 -11.349 23.065 1.00 0.00 H new ATOM 0 HA VAL A 56 9.289 -12.407 23.898 1.00 0.00 H new ATOM 0 HB VAL A 56 11.532 -12.662 25.190 1.00 0.00 H new ATOM 0 HG11 VAL A 56 12.003 -10.811 26.774 1.00 0.00 H new ATOM 0 HG12 VAL A 56 12.241 -10.302 25.085 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.773 -9.811 25.965 1.00 0.00 H new ATOM 0 HG21 VAL A 56 10.279 -12.481 27.352 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.020 -11.530 26.529 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.280 -13.235 26.087 1.00 0.00 H new ATOM 544 N LEU A 57 8.125 -10.196 23.752 1.00 0.00 N ATOM 545 CA LEU A 57 7.434 -8.875 23.674 1.00 0.00 C ATOM 546 C LEU A 57 6.812 -8.504 25.013 1.00 0.00 C ATOM 547 O LEU A 57 6.335 -9.337 25.758 1.00 0.00 O ATOM 548 CB LEU A 57 6.327 -8.935 22.630 1.00 0.00 C ATOM 549 CG LEU A 57 6.918 -9.302 21.263 1.00 0.00 C ATOM 550 CD1 LEU A 57 5.771 -9.522 20.270 1.00 0.00 C ATOM 551 CD2 LEU A 57 7.832 -8.171 20.762 1.00 0.00 C ATOM 0 H LEU A 57 7.520 -11.008 23.631 1.00 0.00 H new ATOM 0 HA LEU A 57 8.176 -8.124 23.402 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.579 -9.672 22.922 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.819 -7.972 22.570 1.00 0.00 H new ATOM 0 HG LEU A 57 7.509 -10.213 21.353 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.180 -9.784 19.294 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.133 -10.331 20.625 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.184 -8.608 20.184 1.00 0.00 H new ATOM 0 HD21 LEU A 57 8.247 -8.441 19.791 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.254 -7.252 20.667 1.00 0.00 H new ATOM 0 HD23 LEU A 57 8.644 -8.017 21.473 1.00 0.00 H new ATOM 563 N ASP A 58 6.805 -7.237 25.297 1.00 0.00 N ATOM 564 CA ASP A 58 6.212 -6.722 26.558 1.00 0.00 C ATOM 565 C ASP A 58 4.792 -6.206 26.235 1.00 0.00 C ATOM 566 O ASP A 58 4.605 -5.525 25.247 1.00 0.00 O ATOM 567 CB ASP A 58 7.099 -5.575 27.052 1.00 0.00 C ATOM 568 CG ASP A 58 6.353 -4.721 28.080 1.00 0.00 C ATOM 569 OD1 ASP A 58 5.420 -4.043 27.690 1.00 0.00 O ATOM 570 OD2 ASP A 58 6.728 -4.763 29.240 1.00 0.00 O ATOM 0 H ASP A 58 7.196 -6.516 24.691 1.00 0.00 H new ATOM 0 HA ASP A 58 6.150 -7.492 27.327 1.00 0.00 H new ATOM 0 HB2 ASP A 58 8.009 -5.978 27.497 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.404 -4.955 26.209 1.00 0.00 H new ATOM 575 N PRO A 59 3.793 -6.529 27.029 1.00 0.00 N ATOM 576 CA PRO A 59 2.392 -6.080 26.760 1.00 0.00 C ATOM 577 C PRO A 59 2.150 -4.607 27.124 1.00 0.00 C ATOM 578 O PRO A 59 1.174 -4.014 26.713 1.00 0.00 O ATOM 579 CB PRO A 59 1.554 -7.005 27.650 1.00 0.00 C ATOM 580 CG PRO A 59 2.439 -7.295 28.819 1.00 0.00 C ATOM 581 CD PRO A 59 3.867 -7.347 28.260 1.00 0.00 C ATOM 0 HA PRO A 59 2.145 -6.139 25.700 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.627 -6.524 27.963 1.00 0.00 H new ATOM 0 HB3 PRO A 59 1.277 -7.919 27.124 1.00 0.00 H new ATOM 0 HG2 PRO A 59 2.346 -6.522 29.581 1.00 0.00 H new ATOM 0 HG3 PRO A 59 2.168 -8.240 29.289 1.00 0.00 H new ATOM 0 HD2 PRO A 59 4.589 -6.940 28.968 1.00 0.00 H new ATOM 0 HD3 PRO A 59 4.175 -8.370 28.043 1.00 0.00 H new ATOM 589 N ALA A 60 3.020 -4.012 27.895 1.00 0.00 N ATOM 590 CA ALA A 60 2.821 -2.584 28.283 1.00 0.00 C ATOM 591 C ALA A 60 3.434 -1.662 27.224 1.00 0.00 C ATOM 592 O ALA A 60 2.848 -0.672 26.835 1.00 0.00 O ATOM 593 CB ALA A 60 3.491 -2.338 29.638 1.00 0.00 C ATOM 0 H ALA A 60 3.859 -4.452 28.273 1.00 0.00 H new ATOM 0 HA ALA A 60 1.755 -2.371 28.356 1.00 0.00 H new ATOM 0 HB1 ALA A 60 3.351 -1.297 29.930 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.043 -2.989 30.389 1.00 0.00 H new ATOM 0 HB3 ALA A 60 4.557 -2.553 29.561 1.00 0.00 H new ATOM 599 N LYS A 61 4.615 -1.973 26.767 1.00 0.00 N ATOM 600 CA LYS A 61 5.277 -1.116 25.749 1.00 0.00 C ATOM 601 C LYS A 61 4.517 -1.218 24.414 1.00 0.00 C ATOM 602 O LYS A 61 4.468 -0.275 23.649 1.00 0.00 O ATOM 603 CB LYS A 61 6.752 -1.581 25.587 1.00 0.00 C ATOM 604 CG LYS A 61 7.724 -0.385 25.567 1.00 0.00 C ATOM 605 CD LYS A 61 7.735 0.286 24.171 1.00 0.00 C ATOM 606 CE LYS A 61 8.859 -0.301 23.305 1.00 0.00 C ATOM 607 NZ LYS A 61 8.607 -1.751 23.071 1.00 0.00 N ATOM 0 H LYS A 61 5.152 -2.790 27.058 1.00 0.00 H new ATOM 0 HA LYS A 61 5.267 -0.073 26.066 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.015 -2.251 26.406 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.855 -2.150 24.663 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.430 0.342 26.324 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.729 -0.722 25.822 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.773 0.136 23.681 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.874 1.362 24.278 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.911 0.227 22.353 1.00 0.00 H new ATOM 0 HE3 LYS A 61 9.821 -0.164 23.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 9.302 -2.119 22.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.696 -2.268 23.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 7.648 -1.880 22.691 1.00 0.00 H new ATOM 621 N VAL A 62 3.926 -2.348 24.128 1.00 0.00 N ATOM 622 CA VAL A 62 3.178 -2.488 22.844 1.00 0.00 C ATOM 623 C VAL A 62 1.941 -1.584 22.878 1.00 0.00 C ATOM 624 O VAL A 62 1.730 -0.774 21.998 1.00 0.00 O ATOM 625 CB VAL A 62 2.751 -3.953 22.658 1.00 0.00 C ATOM 626 CG1 VAL A 62 1.736 -4.060 21.513 1.00 0.00 C ATOM 627 CG2 VAL A 62 3.982 -4.805 22.329 1.00 0.00 C ATOM 0 H VAL A 62 3.928 -3.176 24.724 1.00 0.00 H new ATOM 0 HA VAL A 62 3.817 -2.193 22.011 1.00 0.00 H new ATOM 0 HB VAL A 62 2.292 -4.312 23.579 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.438 -5.101 21.387 1.00 0.00 H new ATOM 0 HG12 VAL A 62 0.859 -3.457 21.747 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.189 -3.698 20.590 1.00 0.00 H new ATOM 0 HG21 VAL A 62 3.681 -5.844 22.197 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.442 -4.441 21.410 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.701 -4.737 23.146 1.00 0.00 H new ATOM 637 N GLN A 63 1.125 -1.713 23.888 1.00 0.00 N ATOM 638 CA GLN A 63 -0.092 -0.857 23.973 1.00 0.00 C ATOM 639 C GLN A 63 0.323 0.614 23.866 1.00 0.00 C ATOM 640 O GLN A 63 -0.345 1.413 23.241 1.00 0.00 O ATOM 641 CB GLN A 63 -0.799 -1.112 25.319 1.00 0.00 C ATOM 642 CG GLN A 63 -1.696 -2.386 25.240 1.00 0.00 C ATOM 643 CD GLN A 63 -1.343 -3.366 26.365 1.00 0.00 C ATOM 644 OE1 GLN A 63 -1.310 -2.998 27.523 1.00 0.00 O ATOM 645 NE2 GLN A 63 -1.076 -4.608 26.066 1.00 0.00 N ATOM 0 H GLN A 63 1.248 -2.372 24.656 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.777 -1.097 23.160 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -0.057 -1.233 26.108 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -1.409 -0.248 25.584 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -2.746 -2.103 25.313 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.563 -2.871 24.273 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -1.104 -4.916 25.094 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -0.839 -5.271 26.804 1.00 0.00 H new ATOM 654 N SER A 64 1.423 0.974 24.466 1.00 0.00 N ATOM 655 CA SER A 64 1.882 2.390 24.391 1.00 0.00 C ATOM 656 C SER A 64 2.152 2.759 22.929 1.00 0.00 C ATOM 657 O SER A 64 1.877 3.860 22.495 1.00 0.00 O ATOM 658 CB SER A 64 3.167 2.554 25.205 1.00 0.00 C ATOM 659 OG SER A 64 3.444 3.936 25.378 1.00 0.00 O ATOM 0 H SER A 64 2.024 0.350 25.005 1.00 0.00 H new ATOM 0 HA SER A 64 1.111 3.045 24.796 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.060 2.069 26.175 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.998 2.067 24.695 1.00 0.00 H new ATOM 0 HG SER A 64 4.407 4.063 25.507 1.00 0.00 H new ATOM 665 N LEU A 65 2.688 1.844 22.167 1.00 0.00 N ATOM 666 CA LEU A 65 2.976 2.134 20.736 1.00 0.00 C ATOM 667 C LEU A 65 1.659 2.107 19.950 1.00 0.00 C ATOM 668 O LEU A 65 1.363 3.002 19.184 1.00 0.00 O ATOM 669 CB LEU A 65 3.947 1.062 20.205 1.00 0.00 C ATOM 670 CG LEU A 65 5.408 1.541 20.357 1.00 0.00 C ATOM 671 CD1 LEU A 65 6.347 0.332 20.381 1.00 0.00 C ATOM 672 CD2 LEU A 65 5.791 2.454 19.184 1.00 0.00 C ATOM 0 H LEU A 65 2.939 0.905 22.477 1.00 0.00 H new ATOM 0 HA LEU A 65 3.433 3.117 20.623 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.804 0.129 20.751 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.732 0.854 19.157 1.00 0.00 H new ATOM 0 HG LEU A 65 5.499 2.097 21.290 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.377 0.673 20.488 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.089 -0.313 21.221 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.245 -0.227 19.451 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.823 2.785 19.302 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.691 1.905 18.248 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.131 3.321 19.168 1.00 0.00 H new ATOM 684 N VAL A 66 0.864 1.094 20.147 1.00 0.00 N ATOM 685 CA VAL A 66 -0.436 1.009 19.432 1.00 0.00 C ATOM 686 C VAL A 66 -1.220 2.299 19.696 1.00 0.00 C ATOM 687 O VAL A 66 -2.019 2.731 18.889 1.00 0.00 O ATOM 688 CB VAL A 66 -1.205 -0.209 19.971 1.00 0.00 C ATOM 689 CG1 VAL A 66 -2.689 -0.114 19.614 1.00 0.00 C ATOM 690 CG2 VAL A 66 -0.616 -1.489 19.371 1.00 0.00 C ATOM 0 H VAL A 66 1.061 0.317 20.777 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.290 0.894 18.358 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.110 -0.229 21.057 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.214 -0.986 20.005 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.111 0.790 20.052 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.801 -0.079 18.530 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.160 -2.353 19.752 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.703 -1.455 18.285 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.435 -1.571 19.648 1.00 0.00 H new ATOM 700 N ASP A 67 -0.991 2.913 20.823 1.00 0.00 N ATOM 701 CA ASP A 67 -1.711 4.178 21.155 1.00 0.00 C ATOM 702 C ASP A 67 -1.126 5.334 20.341 1.00 0.00 C ATOM 703 O ASP A 67 -1.841 6.176 19.835 1.00 0.00 O ATOM 704 CB ASP A 67 -1.544 4.479 22.649 1.00 0.00 C ATOM 705 CG ASP A 67 -2.623 5.468 23.101 1.00 0.00 C ATOM 706 OD1 ASP A 67 -3.767 5.281 22.721 1.00 0.00 O ATOM 707 OD2 ASP A 67 -2.285 6.394 23.819 1.00 0.00 O ATOM 0 H ASP A 67 -0.333 2.593 21.533 1.00 0.00 H new ATOM 0 HA ASP A 67 -2.768 4.064 20.916 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -1.618 3.557 23.226 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -0.554 4.895 22.838 1.00 0.00 H new ATOM 712 N THR A 68 0.172 5.384 20.218 1.00 0.00 N ATOM 713 CA THR A 68 0.807 6.489 19.446 1.00 0.00 C ATOM 714 C THR A 68 0.367 6.399 17.986 1.00 0.00 C ATOM 715 O THR A 68 -0.074 7.366 17.396 1.00 0.00 O ATOM 716 CB THR A 68 2.329 6.357 19.533 1.00 0.00 C ATOM 717 OG1 THR A 68 2.703 6.080 20.875 1.00 0.00 O ATOM 718 CG2 THR A 68 2.982 7.662 19.079 1.00 0.00 C ATOM 0 H THR A 68 0.821 4.707 20.619 1.00 0.00 H new ATOM 0 HA THR A 68 0.503 7.451 19.859 1.00 0.00 H new ATOM 0 HB THR A 68 2.661 5.543 18.888 1.00 0.00 H new ATOM 0 HG1 THR A 68 3.678 5.993 20.932 1.00 0.00 H new ATOM 0 HG21 THR A 68 4.066 7.567 19.141 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.695 7.873 18.049 1.00 0.00 H new ATOM 0 HG23 THR A 68 2.652 8.477 19.723 1.00 0.00 H new ATOM 726 N ILE A 69 0.482 5.241 17.402 1.00 0.00 N ATOM 727 CA ILE A 69 0.071 5.073 15.982 1.00 0.00 C ATOM 728 C ILE A 69 -1.407 5.459 15.835 1.00 0.00 C ATOM 729 O ILE A 69 -1.803 6.084 14.872 1.00 0.00 O ATOM 730 CB ILE A 69 0.277 3.610 15.570 1.00 0.00 C ATOM 731 CG1 ILE A 69 1.741 3.217 15.837 1.00 0.00 C ATOM 732 CG2 ILE A 69 -0.040 3.445 14.076 1.00 0.00 C ATOM 733 CD1 ILE A 69 2.045 1.844 15.230 1.00 0.00 C ATOM 0 H ILE A 69 0.845 4.399 17.849 1.00 0.00 H new ATOM 0 HA ILE A 69 0.673 5.715 15.339 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.387 2.967 16.147 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.409 3.966 15.411 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.929 3.197 16.911 1.00 0.00 H new ATOM 0 HG21 ILE A 69 0.107 2.405 13.786 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.075 3.731 13.890 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.623 4.082 13.491 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.084 1.581 15.428 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.390 1.096 15.676 1.00 0.00 H new ATOM 0 HD13 ILE A 69 1.877 1.877 14.153 1.00 0.00 H new ATOM 745 N ARG A 70 -2.224 5.077 16.779 1.00 0.00 N ATOM 746 CA ARG A 70 -3.679 5.403 16.697 1.00 0.00 C ATOM 747 C ARG A 70 -3.920 6.881 17.055 1.00 0.00 C ATOM 748 O ARG A 70 -4.831 7.504 16.547 1.00 0.00 O ATOM 749 CB ARG A 70 -4.449 4.491 17.678 1.00 0.00 C ATOM 750 CG ARG A 70 -4.915 3.221 16.959 1.00 0.00 C ATOM 751 CD ARG A 70 -5.429 2.212 17.988 1.00 0.00 C ATOM 752 NE ARG A 70 -6.110 1.088 17.285 1.00 0.00 N ATOM 753 CZ ARG A 70 -6.664 0.128 17.973 1.00 0.00 C ATOM 754 NH1 ARG A 70 -6.622 0.151 19.277 1.00 0.00 N ATOM 755 NH2 ARG A 70 -7.260 -0.857 17.358 1.00 0.00 N ATOM 0 H ARG A 70 -1.946 4.551 17.607 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.031 5.236 15.679 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -3.809 4.228 18.520 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -5.308 5.024 18.085 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -5.703 3.462 16.246 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.091 2.789 16.390 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -4.601 1.832 18.586 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -6.122 2.698 18.675 1.00 0.00 H new ATOM 0 HE ARG A 70 -6.143 1.069 16.266 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -6.156 0.920 19.759 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -7.055 -0.600 19.815 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -7.293 -0.877 16.339 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -7.693 -1.607 17.897 1.00 0.00 H new ATOM 769 N GLU A 71 -3.128 7.446 17.926 1.00 0.00 N ATOM 770 CA GLU A 71 -3.338 8.873 18.306 1.00 0.00 C ATOM 771 C GLU A 71 -2.671 9.782 17.275 1.00 0.00 C ATOM 772 O GLU A 71 -3.166 10.843 16.951 1.00 0.00 O ATOM 773 CB GLU A 71 -2.720 9.129 19.682 1.00 0.00 C ATOM 774 CG GLU A 71 -3.057 10.550 20.135 1.00 0.00 C ATOM 775 CD GLU A 71 -2.633 10.735 21.593 1.00 0.00 C ATOM 776 OE1 GLU A 71 -1.439 10.788 21.840 1.00 0.00 O ATOM 777 OE2 GLU A 71 -3.509 10.822 22.438 1.00 0.00 O ATOM 0 H GLU A 71 -2.347 6.983 18.390 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.407 9.085 18.339 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -3.100 8.406 20.404 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.639 8.997 19.637 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -2.546 11.276 19.502 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -4.127 10.732 20.030 1.00 0.00 H new ATOM 784 N ASP A 72 -1.544 9.375 16.764 1.00 0.00 N ATOM 785 CA ASP A 72 -0.831 10.213 15.758 1.00 0.00 C ATOM 786 C ASP A 72 0.123 9.324 14.938 1.00 0.00 C ATOM 787 O ASP A 72 1.221 9.044 15.377 1.00 0.00 O ATOM 788 CB ASP A 72 -0.017 11.275 16.496 1.00 0.00 C ATOM 789 CG ASP A 72 0.460 12.335 15.502 1.00 0.00 C ATOM 790 OD1 ASP A 72 0.890 11.958 14.425 1.00 0.00 O ATOM 791 OD2 ASP A 72 0.388 13.507 15.835 1.00 0.00 O ATOM 0 H ASP A 72 -1.084 8.496 16.999 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.550 10.687 15.090 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.624 11.738 17.274 1.00 0.00 H new ATOM 0 HB3 ASP A 72 0.838 10.814 16.991 1.00 0.00 H new ATOM 796 N PRO A 73 -0.277 8.857 13.770 1.00 0.00 N ATOM 797 CA PRO A 73 0.597 7.969 12.939 1.00 0.00 C ATOM 798 C PRO A 73 1.792 8.703 12.299 1.00 0.00 C ATOM 799 O PRO A 73 2.742 8.082 11.866 1.00 0.00 O ATOM 800 CB PRO A 73 -0.359 7.423 11.865 1.00 0.00 C ATOM 801 CG PRO A 73 -1.422 8.464 11.726 1.00 0.00 C ATOM 802 CD PRO A 73 -1.583 9.104 13.109 1.00 0.00 C ATOM 0 HA PRO A 73 1.064 7.193 13.546 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.160 7.261 10.920 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -0.783 6.464 12.165 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -1.140 9.210 10.983 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -2.360 8.020 11.392 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -1.797 10.170 13.034 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.404 8.652 13.665 1.00 0.00 H new ATOM 810 N ASP A 74 1.757 10.009 12.225 1.00 0.00 N ATOM 811 CA ASP A 74 2.893 10.759 11.602 1.00 0.00 C ATOM 812 C ASP A 74 3.891 11.205 12.677 1.00 0.00 C ATOM 813 O ASP A 74 4.852 11.891 12.388 1.00 0.00 O ATOM 814 CB ASP A 74 2.346 11.993 10.882 1.00 0.00 C ATOM 815 CG ASP A 74 1.459 11.552 9.716 1.00 0.00 C ATOM 816 OD1 ASP A 74 1.789 10.557 9.091 1.00 0.00 O ATOM 817 OD2 ASP A 74 0.466 12.215 9.469 1.00 0.00 O ATOM 0 H ASP A 74 0.992 10.590 12.568 1.00 0.00 H new ATOM 0 HA ASP A 74 3.403 10.106 10.894 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.773 12.608 11.576 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.168 12.607 10.515 1.00 0.00 H new ATOM 822 N SER A 75 3.671 10.833 13.914 1.00 0.00 N ATOM 823 CA SER A 75 4.603 11.248 15.015 1.00 0.00 C ATOM 824 C SER A 75 5.450 10.054 15.467 1.00 0.00 C ATOM 825 O SER A 75 6.078 10.099 16.506 1.00 0.00 O ATOM 826 CB SER A 75 3.783 11.751 16.203 1.00 0.00 C ATOM 827 OG SER A 75 3.007 12.870 15.803 1.00 0.00 O ATOM 0 H SER A 75 2.884 10.257 14.212 1.00 0.00 H new ATOM 0 HA SER A 75 5.259 12.037 14.647 1.00 0.00 H new ATOM 0 HB2 SER A 75 3.133 10.958 16.572 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.445 12.028 17.024 1.00 0.00 H new ATOM 0 HG SER A 75 2.737 13.381 16.595 1.00 0.00 H new ATOM 833 N VAL A 76 5.477 8.987 14.698 1.00 0.00 N ATOM 834 CA VAL A 76 6.286 7.783 15.084 1.00 0.00 C ATOM 835 C VAL A 76 7.446 7.625 14.078 1.00 0.00 C ATOM 836 O VAL A 76 7.244 7.776 12.889 1.00 0.00 O ATOM 837 CB VAL A 76 5.380 6.543 15.036 1.00 0.00 C ATOM 838 CG1 VAL A 76 6.009 5.385 15.825 1.00 0.00 C ATOM 839 CG2 VAL A 76 4.021 6.892 15.649 1.00 0.00 C ATOM 0 H VAL A 76 4.971 8.899 13.817 1.00 0.00 H new ATOM 0 HA VAL A 76 6.690 7.898 16.090 1.00 0.00 H new ATOM 0 HB VAL A 76 5.257 6.234 13.998 1.00 0.00 H new ATOM 0 HG11 VAL A 76 5.353 4.515 15.780 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.977 5.133 15.391 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.144 5.684 16.864 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.372 6.016 15.618 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.158 7.206 16.684 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.563 7.703 15.082 1.00 0.00 H new ATOM 849 N PRO A 77 8.656 7.342 14.526 1.00 0.00 N ATOM 850 CA PRO A 77 9.825 7.196 13.605 1.00 0.00 C ATOM 851 C PRO A 77 9.878 5.827 12.902 1.00 0.00 C ATOM 852 O PRO A 77 9.253 4.878 13.334 1.00 0.00 O ATOM 853 CB PRO A 77 11.028 7.367 14.538 1.00 0.00 C ATOM 854 CG PRO A 77 10.562 6.841 15.860 1.00 0.00 C ATOM 855 CD PRO A 77 9.056 7.133 15.937 1.00 0.00 C ATOM 0 HA PRO A 77 9.785 7.918 12.789 1.00 0.00 H new ATOM 0 HB2 PRO A 77 11.893 6.813 14.174 1.00 0.00 H new ATOM 0 HB3 PRO A 77 11.327 8.413 14.611 1.00 0.00 H new ATOM 0 HG2 PRO A 77 10.755 5.771 15.942 1.00 0.00 H new ATOM 0 HG3 PRO A 77 11.094 7.325 16.680 1.00 0.00 H new ATOM 0 HD2 PRO A 77 8.511 6.303 16.387 1.00 0.00 H new ATOM 0 HD3 PRO A 77 8.851 8.015 16.544 1.00 0.00 H new ATOM 863 N PRO A 78 10.642 5.723 11.834 1.00 0.00 N ATOM 864 CA PRO A 78 10.800 4.448 11.074 1.00 0.00 C ATOM 865 C PRO A 78 11.834 3.527 11.726 1.00 0.00 C ATOM 866 O PRO A 78 12.553 3.921 12.623 1.00 0.00 O ATOM 867 CB PRO A 78 11.303 4.915 9.707 1.00 0.00 C ATOM 868 CG PRO A 78 12.100 6.148 10.003 1.00 0.00 C ATOM 869 CD PRO A 78 11.440 6.811 11.224 1.00 0.00 C ATOM 0 HA PRO A 78 9.875 3.874 11.031 1.00 0.00 H new ATOM 0 HB2 PRO A 78 11.916 4.152 9.227 1.00 0.00 H new ATOM 0 HB3 PRO A 78 10.475 5.130 9.031 1.00 0.00 H new ATOM 0 HG2 PRO A 78 13.140 5.897 10.212 1.00 0.00 H new ATOM 0 HG3 PRO A 78 12.101 6.824 9.148 1.00 0.00 H new ATOM 0 HD2 PRO A 78 12.185 7.198 11.919 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.811 7.651 10.931 1.00 0.00 H new ATOM 877 N ILE A 79 11.924 2.312 11.259 1.00 0.00 N ATOM 878 CA ILE A 79 12.924 1.349 11.817 1.00 0.00 C ATOM 879 C ILE A 79 14.018 1.125 10.774 1.00 0.00 C ATOM 880 O ILE A 79 13.848 1.426 9.609 1.00 0.00 O ATOM 881 CB ILE A 79 12.238 0.011 12.123 1.00 0.00 C ATOM 882 CG1 ILE A 79 11.284 -0.359 10.971 1.00 0.00 C ATOM 883 CG2 ILE A 79 11.450 0.126 13.431 1.00 0.00 C ATOM 884 CD1 ILE A 79 11.059 -1.871 10.957 1.00 0.00 C ATOM 0 H ILE A 79 11.343 1.939 10.508 1.00 0.00 H new ATOM 0 HA ILE A 79 13.352 1.751 12.735 1.00 0.00 H new ATOM 0 HB ILE A 79 12.994 -0.767 12.225 1.00 0.00 H new ATOM 0 HG12 ILE A 79 10.333 0.159 11.092 1.00 0.00 H new ATOM 0 HG13 ILE A 79 11.704 -0.035 10.019 1.00 0.00 H new ATOM 0 HG21 ILE A 79 10.963 -0.825 13.647 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.130 0.379 14.244 1.00 0.00 H new ATOM 0 HG23 ILE A 79 10.695 0.906 13.334 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.384 -2.131 10.142 1.00 0.00 H new ATOM 0 HD12 ILE A 79 12.013 -2.379 10.815 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.620 -2.182 11.905 1.00 0.00 H new ATOM 896 N ASP A 80 15.135 0.587 11.176 1.00 0.00 N ATOM 897 CA ASP A 80 16.234 0.331 10.200 1.00 0.00 C ATOM 898 C ASP A 80 16.040 -1.064 9.607 1.00 0.00 C ATOM 899 O ASP A 80 15.799 -2.021 10.316 1.00 0.00 O ATOM 900 CB ASP A 80 17.587 0.403 10.915 1.00 0.00 C ATOM 901 CG ASP A 80 18.706 0.577 9.885 1.00 0.00 C ATOM 902 OD1 ASP A 80 18.930 1.702 9.469 1.00 0.00 O ATOM 903 OD2 ASP A 80 19.318 -0.416 9.531 1.00 0.00 O ATOM 0 H ASP A 80 15.336 0.313 12.138 1.00 0.00 H new ATOM 0 HA ASP A 80 16.213 1.080 9.409 1.00 0.00 H new ATOM 0 HB2 ASP A 80 17.594 1.236 11.618 1.00 0.00 H new ATOM 0 HB3 ASP A 80 17.751 -0.505 11.495 1.00 0.00 H new ATOM 908 N VAL A 81 16.131 -1.184 8.312 1.00 0.00 N ATOM 909 CA VAL A 81 15.942 -2.513 7.652 1.00 0.00 C ATOM 910 C VAL A 81 17.012 -2.695 6.571 1.00 0.00 C ATOM 911 O VAL A 81 17.347 -1.777 5.849 1.00 0.00 O ATOM 912 CB VAL A 81 14.530 -2.559 7.045 1.00 0.00 C ATOM 913 CG1 VAL A 81 14.414 -3.686 6.016 1.00 0.00 C ATOM 914 CG2 VAL A 81 13.514 -2.802 8.165 1.00 0.00 C ATOM 0 H VAL A 81 16.330 -0.413 7.674 1.00 0.00 H new ATOM 0 HA VAL A 81 16.044 -3.323 8.374 1.00 0.00 H new ATOM 0 HB VAL A 81 14.333 -1.610 6.547 1.00 0.00 H new ATOM 0 HG11 VAL A 81 13.406 -3.698 5.601 1.00 0.00 H new ATOM 0 HG12 VAL A 81 15.134 -3.522 5.214 1.00 0.00 H new ATOM 0 HG13 VAL A 81 14.619 -4.642 6.498 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.509 -2.836 7.744 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.734 -3.750 8.656 1.00 0.00 H new ATOM 0 HG23 VAL A 81 13.575 -1.993 8.893 1.00 0.00 H new ATOM 924 N LEU A 82 17.560 -3.876 6.471 1.00 0.00 N ATOM 925 CA LEU A 82 18.625 -4.133 5.458 1.00 0.00 C ATOM 926 C LEU A 82 17.993 -4.506 4.114 1.00 0.00 C ATOM 927 O LEU A 82 17.118 -5.344 4.034 1.00 0.00 O ATOM 928 CB LEU A 82 19.512 -5.286 5.941 1.00 0.00 C ATOM 929 CG LEU A 82 20.101 -4.957 7.332 1.00 0.00 C ATOM 930 CD1 LEU A 82 20.425 -6.254 8.078 1.00 0.00 C ATOM 931 CD2 LEU A 82 21.387 -4.137 7.180 1.00 0.00 C ATOM 0 H LEU A 82 17.315 -4.679 7.051 1.00 0.00 H new ATOM 0 HA LEU A 82 19.225 -3.232 5.331 1.00 0.00 H new ATOM 0 HB2 LEU A 82 18.930 -6.206 5.992 1.00 0.00 H new ATOM 0 HB3 LEU A 82 20.318 -5.458 5.228 1.00 0.00 H new ATOM 0 HG LEU A 82 19.366 -4.381 7.894 1.00 0.00 H new ATOM 0 HD11 LEU A 82 20.840 -6.016 9.058 1.00 0.00 H new ATOM 0 HD12 LEU A 82 19.514 -6.840 8.202 1.00 0.00 H new ATOM 0 HD13 LEU A 82 21.152 -6.831 7.506 1.00 0.00 H new ATOM 0 HD21 LEU A 82 21.793 -3.911 8.166 1.00 0.00 H new ATOM 0 HD22 LEU A 82 22.118 -4.709 6.609 1.00 0.00 H new ATOM 0 HD23 LEU A 82 21.166 -3.207 6.657 1.00 0.00 H new ATOM 943 N TRP A 83 18.443 -3.880 3.058 1.00 0.00 N ATOM 944 CA TRP A 83 17.901 -4.162 1.694 1.00 0.00 C ATOM 945 C TRP A 83 18.979 -4.893 0.888 1.00 0.00 C ATOM 946 O TRP A 83 19.951 -4.298 0.466 1.00 0.00 O ATOM 947 CB TRP A 83 17.582 -2.815 1.049 1.00 0.00 C ATOM 948 CG TRP A 83 17.127 -2.952 -0.372 1.00 0.00 C ATOM 949 CD1 TRP A 83 16.697 -4.084 -0.991 1.00 0.00 C ATOM 950 CD2 TRP A 83 17.052 -1.894 -1.362 1.00 0.00 C ATOM 951 NE1 TRP A 83 16.366 -3.770 -2.304 1.00 0.00 N ATOM 952 CE2 TRP A 83 16.572 -2.432 -2.576 1.00 0.00 C ATOM 953 CE3 TRP A 83 17.359 -0.524 -1.315 1.00 0.00 C ATOM 954 CZ2 TRP A 83 16.403 -1.636 -3.708 1.00 0.00 C ATOM 955 CZ3 TRP A 83 17.191 0.280 -2.454 1.00 0.00 C ATOM 956 CH2 TRP A 83 16.714 -0.277 -3.647 1.00 0.00 C ATOM 0 H TRP A 83 19.177 -3.172 3.083 1.00 0.00 H new ATOM 0 HA TRP A 83 17.005 -4.782 1.732 1.00 0.00 H new ATOM 0 HB2 TRP A 83 16.807 -2.313 1.628 1.00 0.00 H new ATOM 0 HB3 TRP A 83 18.468 -2.180 1.084 1.00 0.00 H new ATOM 0 HD1 TRP A 83 16.625 -5.062 -0.539 1.00 0.00 H new ATOM 0 HE1 TRP A 83 16.014 -4.445 -2.983 1.00 0.00 H new ATOM 0 HE3 TRP A 83 17.726 -0.087 -0.398 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 16.034 -2.068 -4.626 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 17.431 1.332 -2.410 1.00 0.00 H new ATOM 0 HH2 TRP A 83 16.587 0.346 -4.520 1.00 0.00 H new ATOM 967 N ILE A 84 18.828 -6.183 0.690 1.00 0.00 N ATOM 968 CA ILE A 84 19.856 -6.970 -0.068 1.00 0.00 C ATOM 969 C ILE A 84 19.207 -7.653 -1.273 1.00 0.00 C ATOM 970 O ILE A 84 18.052 -8.029 -1.241 1.00 0.00 O ATOM 971 CB ILE A 84 20.458 -8.031 0.861 1.00 0.00 C ATOM 972 CG1 ILE A 84 20.991 -7.353 2.124 1.00 0.00 C ATOM 973 CG2 ILE A 84 21.616 -8.743 0.156 1.00 0.00 C ATOM 974 CD1 ILE A 84 21.551 -8.412 3.072 1.00 0.00 C ATOM 0 H ILE A 84 18.032 -6.727 1.023 1.00 0.00 H new ATOM 0 HA ILE A 84 20.639 -6.299 -0.421 1.00 0.00 H new ATOM 0 HB ILE A 84 19.687 -8.756 1.121 1.00 0.00 H new ATOM 0 HG12 ILE A 84 21.768 -6.635 1.864 1.00 0.00 H new ATOM 0 HG13 ILE A 84 20.193 -6.795 2.615 1.00 0.00 H new ATOM 0 HG21 ILE A 84 22.039 -9.496 0.821 1.00 0.00 H new ATOM 0 HG22 ILE A 84 21.249 -9.225 -0.750 1.00 0.00 H new ATOM 0 HG23 ILE A 84 22.385 -8.016 -0.106 1.00 0.00 H new ATOM 0 HD11 ILE A 84 21.931 -7.930 3.973 1.00 0.00 H new ATOM 0 HD12 ILE A 84 20.761 -9.113 3.342 1.00 0.00 H new ATOM 0 HD13 ILE A 84 22.361 -8.950 2.579 1.00 0.00 H new ATOM 986 N LYS A 85 19.953 -7.810 -2.341 1.00 0.00 N ATOM 987 CA LYS A 85 19.412 -8.463 -3.575 1.00 0.00 C ATOM 988 C LYS A 85 20.053 -9.840 -3.747 1.00 0.00 C ATOM 989 O LYS A 85 21.118 -10.115 -3.230 1.00 0.00 O ATOM 990 CB LYS A 85 19.734 -7.580 -4.794 1.00 0.00 C ATOM 991 CG LYS A 85 18.638 -6.535 -4.972 1.00 0.00 C ATOM 992 CD LYS A 85 19.009 -5.569 -6.105 1.00 0.00 C ATOM 993 CE LYS A 85 17.762 -4.843 -6.619 1.00 0.00 C ATOM 994 NZ LYS A 85 17.354 -3.807 -5.636 1.00 0.00 N ATOM 0 H LYS A 85 20.925 -7.510 -2.410 1.00 0.00 H new ATOM 0 HA LYS A 85 18.332 -8.582 -3.487 1.00 0.00 H new ATOM 0 HB2 LYS A 85 20.698 -7.091 -4.657 1.00 0.00 H new ATOM 0 HB3 LYS A 85 19.813 -8.195 -5.690 1.00 0.00 H new ATOM 0 HG2 LYS A 85 17.691 -7.025 -5.197 1.00 0.00 H new ATOM 0 HG3 LYS A 85 18.498 -5.982 -4.043 1.00 0.00 H new ATOM 0 HD2 LYS A 85 19.739 -4.843 -5.747 1.00 0.00 H new ATOM 0 HD3 LYS A 85 19.479 -6.119 -6.920 1.00 0.00 H new ATOM 0 HE2 LYS A 85 17.968 -4.382 -7.585 1.00 0.00 H new ATOM 0 HE3 LYS A 85 16.951 -5.555 -6.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 16.594 -3.224 -6.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 17.012 -4.267 -4.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 18.170 -3.203 -5.409 1.00 0.00 H new ATOM 1008 N GLY A 86 19.395 -10.712 -4.463 1.00 0.00 N ATOM 1009 CA GLY A 86 19.936 -12.087 -4.672 1.00 0.00 C ATOM 1010 C GLY A 86 20.699 -12.167 -5.994 1.00 0.00 C ATOM 1011 O GLY A 86 20.938 -11.175 -6.654 1.00 0.00 O ATOM 0 H GLY A 86 18.499 -10.530 -4.915 1.00 0.00 H new ATOM 0 HA2 GLY A 86 20.597 -12.353 -3.847 1.00 0.00 H new ATOM 0 HA3 GLY A 86 19.120 -12.809 -4.672 1.00 0.00 H new ATOM 1015 N ALA A 87 21.092 -13.352 -6.372 1.00 0.00 N ATOM 1016 CA ALA A 87 21.855 -13.535 -7.638 1.00 0.00 C ATOM 1017 C ALA A 87 20.969 -13.233 -8.855 1.00 0.00 C ATOM 1018 O ALA A 87 21.443 -13.217 -9.974 1.00 0.00 O ATOM 1019 CB ALA A 87 22.352 -14.985 -7.714 1.00 0.00 C ATOM 0 H ALA A 87 20.915 -14.211 -5.851 1.00 0.00 H new ATOM 0 HA ALA A 87 22.699 -12.845 -7.647 1.00 0.00 H new ATOM 0 HB1 ALA A 87 22.912 -15.130 -8.638 1.00 0.00 H new ATOM 0 HB2 ALA A 87 22.998 -15.193 -6.861 1.00 0.00 H new ATOM 0 HB3 ALA A 87 21.499 -15.663 -7.697 1.00 0.00 H new ATOM 1025 N GLN A 88 19.688 -13.008 -8.657 1.00 0.00 N ATOM 1026 CA GLN A 88 18.775 -12.724 -9.817 1.00 0.00 C ATOM 1027 C GLN A 88 17.957 -11.451 -9.563 1.00 0.00 C ATOM 1028 O GLN A 88 16.837 -11.323 -10.015 1.00 0.00 O ATOM 1029 CB GLN A 88 17.837 -13.917 -10.012 1.00 0.00 C ATOM 1030 CG GLN A 88 18.668 -15.202 -10.026 1.00 0.00 C ATOM 1031 CD GLN A 88 17.819 -16.366 -10.540 1.00 0.00 C ATOM 1032 OE1 GLN A 88 16.705 -16.171 -10.983 1.00 0.00 O ATOM 1033 NE2 GLN A 88 18.303 -17.579 -10.499 1.00 0.00 N ATOM 0 H GLN A 88 19.235 -13.009 -7.743 1.00 0.00 H new ATOM 0 HA GLN A 88 19.373 -12.570 -10.715 1.00 0.00 H new ATOM 0 HB2 GLN A 88 17.100 -13.953 -9.209 1.00 0.00 H new ATOM 0 HB3 GLN A 88 17.285 -13.814 -10.946 1.00 0.00 H new ATOM 0 HG2 GLN A 88 19.544 -15.072 -10.661 1.00 0.00 H new ATOM 0 HG3 GLN A 88 19.031 -15.421 -9.022 1.00 0.00 H new ATOM 0 HE21 GLN A 88 19.239 -17.742 -10.127 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.745 -18.362 -10.839 1.00 0.00 H new ATOM 1042 N GLY A 89 18.520 -10.496 -8.872 1.00 0.00 N ATOM 1043 CA GLY A 89 17.790 -9.216 -8.621 1.00 0.00 C ATOM 1044 C GLY A 89 16.695 -9.401 -7.565 1.00 0.00 C ATOM 1045 O GLY A 89 16.165 -8.440 -7.043 1.00 0.00 O ATOM 0 H GLY A 89 19.456 -10.546 -8.469 1.00 0.00 H new ATOM 0 HA2 GLY A 89 18.493 -8.452 -8.290 1.00 0.00 H new ATOM 0 HA3 GLY A 89 17.346 -8.859 -9.550 1.00 0.00 H new ATOM 1049 N GLY A 90 16.343 -10.614 -7.244 1.00 0.00 N ATOM 1050 CA GLY A 90 15.280 -10.836 -6.228 1.00 0.00 C ATOM 1051 C GLY A 90 15.566 -9.979 -4.998 1.00 0.00 C ATOM 1052 O GLY A 90 16.457 -10.257 -4.221 1.00 0.00 O ATOM 0 H GLY A 90 16.747 -11.462 -7.642 1.00 0.00 H new ATOM 0 HA2 GLY A 90 14.305 -10.581 -6.644 1.00 0.00 H new ATOM 0 HA3 GLY A 90 15.242 -11.889 -5.950 1.00 0.00 H new ATOM 1056 N ASP A 91 14.815 -8.936 -4.822 1.00 0.00 N ATOM 1057 CA ASP A 91 15.031 -8.052 -3.650 1.00 0.00 C ATOM 1058 C ASP A 91 14.467 -8.729 -2.401 1.00 0.00 C ATOM 1059 O ASP A 91 13.373 -9.257 -2.406 1.00 0.00 O ATOM 1060 CB ASP A 91 14.319 -6.711 -3.876 1.00 0.00 C ATOM 1061 CG ASP A 91 15.193 -5.802 -4.740 1.00 0.00 C ATOM 1062 OD1 ASP A 91 16.257 -5.431 -4.276 1.00 0.00 O ATOM 1063 OD2 ASP A 91 14.783 -5.493 -5.847 1.00 0.00 O ATOM 0 H ASP A 91 14.056 -8.655 -5.443 1.00 0.00 H new ATOM 0 HA ASP A 91 16.098 -7.872 -3.519 1.00 0.00 H new ATOM 0 HB2 ASP A 91 13.358 -6.876 -4.362 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.114 -6.231 -2.919 1.00 0.00 H new ATOM 1068 N TYR A 92 15.213 -8.704 -1.331 1.00 0.00 N ATOM 1069 CA TYR A 92 14.753 -9.327 -0.054 1.00 0.00 C ATOM 1070 C TYR A 92 14.907 -8.295 1.062 1.00 0.00 C ATOM 1071 O TYR A 92 15.775 -7.447 1.009 1.00 0.00 O ATOM 1072 CB TYR A 92 15.610 -10.559 0.239 1.00 0.00 C ATOM 1073 CG TYR A 92 15.410 -11.575 -0.865 1.00 0.00 C ATOM 1074 CD1 TYR A 92 14.353 -12.492 -0.790 1.00 0.00 C ATOM 1075 CD2 TYR A 92 16.275 -11.599 -1.969 1.00 0.00 C ATOM 1076 CE1 TYR A 92 14.163 -13.429 -1.812 1.00 0.00 C ATOM 1077 CE2 TYR A 92 16.083 -12.536 -2.989 1.00 0.00 C ATOM 1078 CZ TYR A 92 15.028 -13.451 -2.912 1.00 0.00 C ATOM 1079 OH TYR A 92 14.840 -14.375 -3.920 1.00 0.00 O ATOM 0 H TYR A 92 16.136 -8.272 -1.285 1.00 0.00 H new ATOM 0 HA TYR A 92 13.710 -9.636 -0.126 1.00 0.00 H new ATOM 0 HB2 TYR A 92 16.661 -10.279 0.306 1.00 0.00 H new ATOM 0 HB3 TYR A 92 15.333 -10.990 1.201 1.00 0.00 H new ATOM 0 HD1 TYR A 92 13.684 -12.476 0.058 1.00 0.00 H new ATOM 0 HD2 TYR A 92 17.090 -10.893 -2.031 1.00 0.00 H new ATOM 0 HE1 TYR A 92 13.348 -14.136 -1.752 1.00 0.00 H new ATOM 0 HE2 TYR A 92 16.751 -12.553 -3.838 1.00 0.00 H new ATOM 0 HH TYR A 92 15.527 -14.253 -4.608 1.00 0.00 H new ATOM 1089 N PHE A 93 14.057 -8.341 2.062 1.00 0.00 N ATOM 1090 CA PHE A 93 14.133 -7.341 3.175 1.00 0.00 C ATOM 1091 C PHE A 93 14.329 -8.057 4.510 1.00 0.00 C ATOM 1092 O PHE A 93 13.513 -8.847 4.936 1.00 0.00 O ATOM 1093 CB PHE A 93 12.834 -6.537 3.200 1.00 0.00 C ATOM 1094 CG PHE A 93 12.608 -5.923 1.837 1.00 0.00 C ATOM 1095 CD1 PHE A 93 13.285 -4.750 1.475 1.00 0.00 C ATOM 1096 CD2 PHE A 93 11.728 -6.530 0.933 1.00 0.00 C ATOM 1097 CE1 PHE A 93 13.082 -4.188 0.209 1.00 0.00 C ATOM 1098 CE2 PHE A 93 11.525 -5.966 -0.333 1.00 0.00 C ATOM 1099 CZ PHE A 93 12.201 -4.795 -0.694 1.00 0.00 C ATOM 0 H PHE A 93 13.311 -9.031 2.155 1.00 0.00 H new ATOM 0 HA PHE A 93 14.979 -6.673 3.014 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.997 -7.183 3.465 1.00 0.00 H new ATOM 0 HB3 PHE A 93 12.889 -5.757 3.960 1.00 0.00 H new ATOM 0 HD1 PHE A 93 13.963 -4.280 2.172 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.206 -7.433 1.212 1.00 0.00 H new ATOM 0 HE1 PHE A 93 13.605 -3.286 -0.071 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.847 -6.435 -1.031 1.00 0.00 H new ATOM 0 HZ PHE A 93 12.043 -4.359 -1.670 1.00 0.00 H new ATOM 1109 N TYR A 94 15.422 -7.776 5.166 1.00 0.00 N ATOM 1110 CA TYR A 94 15.727 -8.416 6.477 1.00 0.00 C ATOM 1111 C TYR A 94 15.570 -7.372 7.587 1.00 0.00 C ATOM 1112 O TYR A 94 16.067 -6.269 7.481 1.00 0.00 O ATOM 1113 CB TYR A 94 17.186 -8.909 6.438 1.00 0.00 C ATOM 1114 CG TYR A 94 17.233 -10.376 6.094 1.00 0.00 C ATOM 1115 CD1 TYR A 94 17.170 -11.329 7.112 1.00 0.00 C ATOM 1116 CD2 TYR A 94 17.338 -10.777 4.759 1.00 0.00 C ATOM 1117 CE1 TYR A 94 17.213 -12.689 6.795 1.00 0.00 C ATOM 1118 CE2 TYR A 94 17.381 -12.137 4.442 1.00 0.00 C ATOM 1119 CZ TYR A 94 17.318 -13.095 5.459 1.00 0.00 C ATOM 1120 OH TYR A 94 17.361 -14.438 5.147 1.00 0.00 O ATOM 0 H TYR A 94 16.130 -7.117 4.842 1.00 0.00 H new ATOM 0 HA TYR A 94 15.052 -9.250 6.667 1.00 0.00 H new ATOM 0 HB2 TYR A 94 17.751 -8.337 5.701 1.00 0.00 H new ATOM 0 HB3 TYR A 94 17.660 -8.740 7.405 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.088 -11.016 8.142 1.00 0.00 H new ATOM 0 HD2 TYR A 94 17.386 -10.037 3.974 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.165 -13.428 7.581 1.00 0.00 H new ATOM 0 HE2 TYR A 94 17.463 -12.449 3.411 1.00 0.00 H new ATOM 0 HH TYR A 94 17.433 -14.546 4.176 1.00 0.00 H new ATOM 1130 N SER A 95 14.896 -7.720 8.655 1.00 0.00 N ATOM 1131 CA SER A 95 14.712 -6.759 9.789 1.00 0.00 C ATOM 1132 C SER A 95 15.226 -7.398 11.084 1.00 0.00 C ATOM 1133 O SER A 95 14.928 -8.536 11.390 1.00 0.00 O ATOM 1134 CB SER A 95 13.222 -6.415 9.930 1.00 0.00 C ATOM 1135 OG SER A 95 13.087 -5.104 10.456 1.00 0.00 O ATOM 0 H SER A 95 14.463 -8.633 8.792 1.00 0.00 H new ATOM 0 HA SER A 95 15.273 -5.845 9.592 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.729 -6.482 8.960 1.00 0.00 H new ATOM 0 HB3 SER A 95 12.732 -7.134 10.587 1.00 0.00 H new ATOM 0 HG SER A 95 12.136 -4.883 10.545 1.00 0.00 H new ATOM 1141 N PHE A 96 15.977 -6.658 11.856 1.00 0.00 N ATOM 1142 CA PHE A 96 16.502 -7.181 13.147 1.00 0.00 C ATOM 1143 C PHE A 96 16.293 -6.095 14.202 1.00 0.00 C ATOM 1144 O PHE A 96 17.151 -5.264 14.429 1.00 0.00 O ATOM 1145 CB PHE A 96 17.998 -7.445 13.016 1.00 0.00 C ATOM 1146 CG PHE A 96 18.233 -8.684 12.184 1.00 0.00 C ATOM 1147 CD1 PHE A 96 17.935 -9.944 12.709 1.00 0.00 C ATOM 1148 CD2 PHE A 96 18.771 -8.574 10.901 1.00 0.00 C ATOM 1149 CE1 PHE A 96 18.172 -11.095 11.948 1.00 0.00 C ATOM 1150 CE2 PHE A 96 19.015 -9.720 10.141 1.00 0.00 C ATOM 1151 CZ PHE A 96 18.715 -10.982 10.663 1.00 0.00 C ATOM 0 H PHE A 96 16.252 -5.699 11.641 1.00 0.00 H new ATOM 0 HA PHE A 96 15.991 -8.104 13.420 1.00 0.00 H new ATOM 0 HB2 PHE A 96 18.488 -6.588 12.553 1.00 0.00 H new ATOM 0 HB3 PHE A 96 18.441 -7.571 14.004 1.00 0.00 H new ATOM 0 HD1 PHE A 96 17.521 -10.030 13.703 1.00 0.00 H new ATOM 0 HD2 PHE A 96 18.999 -7.600 10.495 1.00 0.00 H new ATOM 0 HE1 PHE A 96 17.936 -12.068 12.352 1.00 0.00 H new ATOM 0 HE2 PHE A 96 19.435 -9.631 9.150 1.00 0.00 H new ATOM 0 HZ PHE A 96 18.902 -11.869 10.075 1.00 0.00 H new ATOM 1161 N GLY A 97 15.159 -6.093 14.842 1.00 0.00 N ATOM 1162 CA GLY A 97 14.864 -5.063 15.887 1.00 0.00 C ATOM 1163 C GLY A 97 13.454 -4.515 15.658 1.00 0.00 C ATOM 1164 O GLY A 97 12.665 -5.095 14.939 1.00 0.00 O ATOM 0 H GLY A 97 14.411 -6.769 14.687 1.00 0.00 H new ATOM 0 HA2 GLY A 97 14.941 -5.502 16.882 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.595 -4.256 15.838 1.00 0.00 H new ATOM 1168 N GLY A 98 13.132 -3.400 16.254 1.00 0.00 N ATOM 1169 CA GLY A 98 11.773 -2.816 16.059 1.00 0.00 C ATOM 1170 C GLY A 98 10.704 -3.904 16.220 1.00 0.00 C ATOM 1171 O GLY A 98 9.558 -3.715 15.865 1.00 0.00 O ATOM 0 H GLY A 98 13.750 -2.868 16.867 1.00 0.00 H new ATOM 0 HA2 GLY A 98 11.604 -2.019 16.783 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.700 -2.367 15.068 1.00 0.00 H new ATOM 1175 N CYS A 99 11.066 -5.043 16.749 1.00 0.00 N ATOM 1176 CA CYS A 99 10.069 -6.134 16.923 1.00 0.00 C ATOM 1177 C CYS A 99 8.822 -5.582 17.620 1.00 0.00 C ATOM 1178 O CYS A 99 7.709 -5.796 17.185 1.00 0.00 O ATOM 1179 CB CYS A 99 10.683 -7.246 17.775 1.00 0.00 C ATOM 1180 SG CYS A 99 12.375 -7.566 17.218 1.00 0.00 S ATOM 0 H CYS A 99 12.010 -5.263 17.067 1.00 0.00 H new ATOM 0 HA CYS A 99 9.789 -6.533 15.948 1.00 0.00 H new ATOM 0 HB2 CYS A 99 10.683 -6.956 18.826 1.00 0.00 H new ATOM 0 HB3 CYS A 99 10.084 -8.153 17.695 1.00 0.00 H new ATOM 0 HG CYS A 99 12.825 -8.642 17.792 1.00 0.00 H new ATOM 1186 N HIS A 100 9.000 -4.875 18.699 1.00 0.00 N ATOM 1187 CA HIS A 100 7.824 -4.312 19.419 1.00 0.00 C ATOM 1188 C HIS A 100 7.014 -3.429 18.466 1.00 0.00 C ATOM 1189 O HIS A 100 5.799 -3.463 18.462 1.00 0.00 O ATOM 1190 CB HIS A 100 8.309 -3.486 20.620 1.00 0.00 C ATOM 1191 CG HIS A 100 8.633 -4.407 21.770 1.00 0.00 C ATOM 1192 ND1 HIS A 100 9.749 -5.230 21.764 1.00 0.00 N ATOM 1193 CD2 HIS A 100 7.991 -4.656 22.961 1.00 0.00 C ATOM 1194 CE1 HIS A 100 9.746 -5.929 22.914 1.00 0.00 C ATOM 1195 NE2 HIS A 100 8.697 -5.617 23.681 1.00 0.00 N ATOM 0 H HIS A 100 9.907 -4.662 19.114 1.00 0.00 H new ATOM 0 HA HIS A 100 7.189 -5.123 19.776 1.00 0.00 H new ATOM 0 HB2 HIS A 100 9.191 -2.908 20.344 1.00 0.00 H new ATOM 0 HB3 HIS A 100 7.541 -2.773 20.918 1.00 0.00 H new ATOM 0 HD1 HIS A 100 10.446 -5.294 21.022 1.00 0.00 H new ATOM 0 HD2 HIS A 100 7.079 -4.179 23.288 1.00 0.00 H new ATOM 0 HE1 HIS A 100 10.500 -6.654 23.184 1.00 0.00 H new ATOM 1203 N ARG A 101 7.666 -2.643 17.656 1.00 0.00 N ATOM 1204 CA ARG A 101 6.910 -1.774 16.712 1.00 0.00 C ATOM 1205 C ARG A 101 6.196 -2.649 15.676 1.00 0.00 C ATOM 1206 O ARG A 101 5.141 -2.303 15.186 1.00 0.00 O ATOM 1207 CB ARG A 101 7.863 -0.786 16.021 1.00 0.00 C ATOM 1208 CG ARG A 101 8.258 0.309 17.019 1.00 0.00 C ATOM 1209 CD ARG A 101 9.111 1.379 16.326 1.00 0.00 C ATOM 1210 NE ARG A 101 10.533 0.930 16.285 1.00 0.00 N ATOM 1211 CZ ARG A 101 11.496 1.807 16.185 1.00 0.00 C ATOM 1212 NH1 ARG A 101 11.215 3.079 16.097 1.00 0.00 N ATOM 1213 NH2 ARG A 101 12.740 1.413 16.171 1.00 0.00 N ATOM 0 H ARG A 101 8.682 -2.565 17.606 1.00 0.00 H new ATOM 0 HA ARG A 101 6.167 -1.199 17.264 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.751 -1.307 15.663 1.00 0.00 H new ATOM 0 HB3 ARG A 101 7.380 -0.344 15.149 1.00 0.00 H new ATOM 0 HG2 ARG A 101 7.363 0.765 17.442 1.00 0.00 H new ATOM 0 HG3 ARG A 101 8.814 -0.129 17.848 1.00 0.00 H new ATOM 0 HD2 ARG A 101 8.744 1.553 15.315 1.00 0.00 H new ATOM 0 HD3 ARG A 101 9.032 2.325 16.861 1.00 0.00 H new ATOM 0 HE ARG A 101 10.754 -0.065 16.335 1.00 0.00 H new ATOM 0 HH11 ARG A 101 10.243 3.388 16.106 1.00 0.00 H new ATOM 0 HH12 ARG A 101 11.967 3.763 16.019 1.00 0.00 H new ATOM 0 HH21 ARG A 101 12.961 0.420 16.238 1.00 0.00 H new ATOM 0 HH22 ARG A 101 13.491 2.099 16.093 1.00 0.00 H new ATOM 1227 N TYR A 102 6.746 -3.789 15.349 1.00 0.00 N ATOM 1228 CA TYR A 102 6.074 -4.677 14.361 1.00 0.00 C ATOM 1229 C TYR A 102 4.773 -5.201 14.983 1.00 0.00 C ATOM 1230 O TYR A 102 3.737 -5.227 14.350 1.00 0.00 O ATOM 1231 CB TYR A 102 7.010 -5.841 14.007 1.00 0.00 C ATOM 1232 CG TYR A 102 6.256 -6.906 13.248 1.00 0.00 C ATOM 1233 CD1 TYR A 102 5.552 -7.880 13.957 1.00 0.00 C ATOM 1234 CD2 TYR A 102 6.265 -6.926 11.847 1.00 0.00 C ATOM 1235 CE1 TYR A 102 4.852 -8.877 13.274 1.00 0.00 C ATOM 1236 CE2 TYR A 102 5.566 -7.927 11.160 1.00 0.00 C ATOM 1237 CZ TYR A 102 4.858 -8.902 11.874 1.00 0.00 C ATOM 1238 OH TYR A 102 4.168 -9.888 11.198 1.00 0.00 O ATOM 0 H TYR A 102 7.628 -4.141 15.723 1.00 0.00 H new ATOM 0 HA TYR A 102 5.842 -4.129 13.448 1.00 0.00 H new ATOM 0 HB2 TYR A 102 7.843 -5.477 13.406 1.00 0.00 H new ATOM 0 HB3 TYR A 102 7.435 -6.265 14.917 1.00 0.00 H new ATOM 0 HD1 TYR A 102 5.548 -7.863 15.037 1.00 0.00 H new ATOM 0 HD2 TYR A 102 6.809 -6.172 11.298 1.00 0.00 H new ATOM 0 HE1 TYR A 102 4.306 -9.628 13.825 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.573 -7.947 10.080 1.00 0.00 H new ATOM 0 HH TYR A 102 3.431 -10.213 11.756 1.00 0.00 H new ATOM 1248 N ALA A 103 4.821 -5.608 16.224 1.00 0.00 N ATOM 1249 CA ALA A 103 3.590 -6.118 16.898 1.00 0.00 C ATOM 1250 C ALA A 103 2.512 -5.034 16.884 1.00 0.00 C ATOM 1251 O ALA A 103 1.375 -5.283 16.540 1.00 0.00 O ATOM 1252 CB ALA A 103 3.914 -6.482 18.350 1.00 0.00 C ATOM 0 H ALA A 103 5.662 -5.609 16.802 1.00 0.00 H new ATOM 0 HA ALA A 103 3.231 -7.001 16.369 1.00 0.00 H new ATOM 0 HB1 ALA A 103 3.015 -6.854 18.841 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.683 -7.254 18.369 1.00 0.00 H new ATOM 0 HB3 ALA A 103 4.275 -5.597 18.875 1.00 0.00 H new ATOM 1258 N ALA A 104 2.856 -3.833 17.262 1.00 0.00 N ATOM 1259 CA ALA A 104 1.842 -2.744 17.274 1.00 0.00 C ATOM 1260 C ALA A 104 1.260 -2.581 15.870 1.00 0.00 C ATOM 1261 O ALA A 104 0.060 -2.517 15.687 1.00 0.00 O ATOM 1262 CB ALA A 104 2.499 -1.434 17.716 1.00 0.00 C ATOM 0 H ALA A 104 3.792 -3.561 17.562 1.00 0.00 H new ATOM 0 HA ALA A 104 1.044 -2.996 17.972 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.754 -0.638 17.724 1.00 0.00 H new ATOM 0 HB2 ALA A 104 2.912 -1.554 18.717 1.00 0.00 H new ATOM 0 HB3 ALA A 104 3.299 -1.176 17.022 1.00 0.00 H new ATOM 1268 N TYR A 105 2.100 -2.518 14.876 1.00 0.00 N ATOM 1269 CA TYR A 105 1.601 -2.367 13.486 1.00 0.00 C ATOM 1270 C TYR A 105 0.812 -3.629 13.102 1.00 0.00 C ATOM 1271 O TYR A 105 -0.167 -3.566 12.385 1.00 0.00 O ATOM 1272 CB TYR A 105 2.810 -2.187 12.544 1.00 0.00 C ATOM 1273 CG TYR A 105 3.062 -0.718 12.268 1.00 0.00 C ATOM 1274 CD1 TYR A 105 2.387 -0.082 11.222 1.00 0.00 C ATOM 1275 CD2 TYR A 105 3.972 0.001 13.053 1.00 0.00 C ATOM 1276 CE1 TYR A 105 2.619 1.273 10.958 1.00 0.00 C ATOM 1277 CE2 TYR A 105 4.205 1.357 12.791 1.00 0.00 C ATOM 1278 CZ TYR A 105 3.528 1.993 11.743 1.00 0.00 C ATOM 1279 OH TYR A 105 3.757 3.329 11.484 1.00 0.00 O ATOM 0 H TYR A 105 3.115 -2.565 14.969 1.00 0.00 H new ATOM 0 HA TYR A 105 0.948 -1.498 13.404 1.00 0.00 H new ATOM 0 HB2 TYR A 105 3.697 -2.635 12.993 1.00 0.00 H new ATOM 0 HB3 TYR A 105 2.628 -2.712 11.606 1.00 0.00 H new ATOM 0 HD1 TYR A 105 1.685 -0.637 10.617 1.00 0.00 H new ATOM 0 HD2 TYR A 105 4.494 -0.490 13.861 1.00 0.00 H new ATOM 0 HE1 TYR A 105 2.097 1.763 10.149 1.00 0.00 H new ATOM 0 HE2 TYR A 105 4.906 1.912 13.397 1.00 0.00 H new ATOM 0 HH TYR A 105 4.414 3.678 12.122 1.00 0.00 H new ATOM 1289 N GLN A 106 1.237 -4.772 13.569 1.00 0.00 N ATOM 1290 CA GLN A 106 0.526 -6.030 13.232 1.00 0.00 C ATOM 1291 C GLN A 106 -0.826 -6.065 13.951 1.00 0.00 C ATOM 1292 O GLN A 106 -1.808 -6.548 13.424 1.00 0.00 O ATOM 1293 CB GLN A 106 1.375 -7.220 13.685 1.00 0.00 C ATOM 1294 CG GLN A 106 0.805 -8.509 13.089 1.00 0.00 C ATOM 1295 CD GLN A 106 1.324 -9.727 13.872 1.00 0.00 C ATOM 1296 OE1 GLN A 106 2.150 -10.465 13.373 1.00 0.00 O ATOM 1297 NE2 GLN A 106 0.882 -9.977 15.082 1.00 0.00 N ATOM 0 H GLN A 106 2.051 -4.885 14.173 1.00 0.00 H new ATOM 0 HA GLN A 106 0.362 -6.081 12.156 1.00 0.00 H new ATOM 0 HB2 GLN A 106 2.409 -7.085 13.366 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.382 -7.282 14.773 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -0.284 -8.483 13.121 1.00 0.00 H new ATOM 0 HG3 GLN A 106 1.091 -8.592 12.040 1.00 0.00 H new ATOM 0 HE21 GLN A 106 0.189 -9.363 15.509 1.00 0.00 H new ATOM 0 HE22 GLN A 106 1.232 -10.786 15.596 1.00 0.00 H new ATOM 1306 N GLN A 107 -0.880 -5.560 15.153 1.00 0.00 N ATOM 1307 CA GLN A 107 -2.162 -5.566 15.911 1.00 0.00 C ATOM 1308 C GLN A 107 -3.165 -4.634 15.228 1.00 0.00 C ATOM 1309 O GLN A 107 -4.359 -4.860 15.259 1.00 0.00 O ATOM 1310 CB GLN A 107 -1.901 -5.085 17.344 1.00 0.00 C ATOM 1311 CG GLN A 107 -3.233 -4.904 18.086 1.00 0.00 C ATOM 1312 CD GLN A 107 -2.999 -4.955 19.599 1.00 0.00 C ATOM 1313 OE1 GLN A 107 -1.967 -4.531 20.081 1.00 0.00 O ATOM 1314 NE2 GLN A 107 -3.921 -5.462 20.372 1.00 0.00 N ATOM 0 H GLN A 107 -0.089 -5.143 15.644 1.00 0.00 H new ATOM 0 HA GLN A 107 -2.571 -6.576 15.934 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.277 -5.806 17.871 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -1.354 -4.143 17.326 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.686 -3.951 17.811 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -3.933 -5.686 17.791 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -4.787 -5.818 19.967 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -3.775 -5.502 21.381 1.00 0.00 H new ATOM 1323 N LEU A 108 -2.690 -3.587 14.611 1.00 0.00 N ATOM 1324 CA LEU A 108 -3.611 -2.637 13.927 1.00 0.00 C ATOM 1325 C LEU A 108 -3.968 -3.175 12.539 1.00 0.00 C ATOM 1326 O LEU A 108 -4.625 -2.518 11.756 1.00 0.00 O ATOM 1327 CB LEU A 108 -2.920 -1.279 13.799 1.00 0.00 C ATOM 1328 CG LEU A 108 -2.685 -0.698 15.204 1.00 0.00 C ATOM 1329 CD1 LEU A 108 -1.797 0.548 15.100 1.00 0.00 C ATOM 1330 CD2 LEU A 108 -4.032 -0.334 15.863 1.00 0.00 C ATOM 0 H LEU A 108 -1.700 -3.348 14.551 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.527 -2.526 14.508 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.971 -1.388 13.274 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -3.534 -0.599 13.209 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.187 -1.446 15.822 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.630 0.960 16.095 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.840 0.277 14.655 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -2.289 1.294 14.476 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -3.852 0.076 16.857 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -4.547 0.408 15.252 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.650 -1.228 15.946 1.00 0.00 H new ATOM 1342 N GLN A 109 -3.550 -4.372 12.236 1.00 0.00 N ATOM 1343 CA GLN A 109 -3.872 -4.967 10.909 1.00 0.00 C ATOM 1344 C GLN A 109 -3.504 -3.993 9.785 1.00 0.00 C ATOM 1345 O GLN A 109 -4.014 -4.087 8.686 1.00 0.00 O ATOM 1346 CB GLN A 109 -5.369 -5.275 10.841 1.00 0.00 C ATOM 1347 CG GLN A 109 -5.810 -5.962 12.136 1.00 0.00 C ATOM 1348 CD GLN A 109 -4.991 -7.237 12.342 1.00 0.00 C ATOM 1349 OE1 GLN A 109 -4.509 -7.824 11.394 1.00 0.00 O ATOM 1350 NE2 GLN A 109 -4.812 -7.694 13.551 1.00 0.00 N ATOM 0 H GLN A 109 -2.997 -4.966 12.853 1.00 0.00 H new ATOM 0 HA GLN A 109 -3.297 -5.885 10.785 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -5.934 -4.354 10.695 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -5.580 -5.918 9.986 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -5.673 -5.289 12.982 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -6.872 -6.203 12.089 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -5.216 -7.202 14.347 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -4.268 -8.544 13.700 1.00 0.00 H new ATOM 1359 N ARG A 110 -2.619 -3.068 10.037 1.00 0.00 N ATOM 1360 CA ARG A 110 -2.228 -2.116 8.966 1.00 0.00 C ATOM 1361 C ARG A 110 -1.705 -2.917 7.776 1.00 0.00 C ATOM 1362 O ARG A 110 -1.256 -4.035 7.920 1.00 0.00 O ATOM 1363 CB ARG A 110 -1.133 -1.179 9.490 1.00 0.00 C ATOM 1364 CG ARG A 110 -1.755 -0.089 10.382 1.00 0.00 C ATOM 1365 CD ARG A 110 -2.639 0.862 9.551 1.00 0.00 C ATOM 1366 NE ARG A 110 -2.577 2.228 10.143 1.00 0.00 N ATOM 1367 CZ ARG A 110 -1.484 2.933 10.044 1.00 0.00 C ATOM 1368 NH1 ARG A 110 -0.444 2.443 9.427 1.00 0.00 N ATOM 1369 NH2 ARG A 110 -1.430 4.130 10.562 1.00 0.00 N ATOM 0 H ARG A 110 -2.153 -2.932 10.934 1.00 0.00 H new ATOM 0 HA ARG A 110 -3.085 -1.517 8.660 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -0.397 -1.748 10.057 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -0.606 -0.719 8.654 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -2.351 -0.553 11.168 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -0.965 0.479 10.874 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -2.297 0.885 8.516 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -3.668 0.504 9.539 1.00 0.00 H new ATOM 0 HE ARG A 110 -3.389 2.612 10.626 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -0.485 1.508 9.022 1.00 0.00 H new ATOM 0 HH12 ARG A 110 0.410 2.995 9.350 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -2.243 4.514 11.044 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -0.575 4.681 10.485 1.00 0.00 H new ATOM 1383 N GLU A 111 -1.781 -2.365 6.600 1.00 0.00 N ATOM 1384 CA GLU A 111 -1.306 -3.107 5.395 1.00 0.00 C ATOM 1385 C GLU A 111 0.224 -3.021 5.282 1.00 0.00 C ATOM 1386 O GLU A 111 0.877 -3.994 4.951 1.00 0.00 O ATOM 1387 CB GLU A 111 -1.954 -2.506 4.137 1.00 0.00 C ATOM 1388 CG GLU A 111 -3.381 -3.042 3.981 1.00 0.00 C ATOM 1389 CD GLU A 111 -4.111 -2.243 2.899 1.00 0.00 C ATOM 1390 OE1 GLU A 111 -4.385 -1.078 3.135 1.00 0.00 O ATOM 1391 OE2 GLU A 111 -4.382 -2.810 1.853 1.00 0.00 O ATOM 0 H GLU A 111 -2.151 -1.432 6.418 1.00 0.00 H new ATOM 0 HA GLU A 111 -1.590 -4.155 5.489 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -1.970 -1.419 4.209 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -1.363 -2.758 3.257 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -3.357 -4.098 3.714 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -3.915 -2.965 4.928 1.00 0.00 H new ATOM 1398 N THR A 112 0.806 -1.868 5.531 1.00 0.00 N ATOM 1399 CA THR A 112 2.296 -1.731 5.408 1.00 0.00 C ATOM 1400 C THR A 112 2.878 -1.016 6.625 1.00 0.00 C ATOM 1401 O THR A 112 2.171 -0.574 7.508 1.00 0.00 O ATOM 1402 CB THR A 112 2.616 -0.898 4.163 1.00 0.00 C ATOM 1403 OG1 THR A 112 1.870 0.310 4.212 1.00 0.00 O ATOM 1404 CG2 THR A 112 2.246 -1.671 2.884 1.00 0.00 C ATOM 0 H THR A 112 0.316 -1.019 5.813 1.00 0.00 H new ATOM 0 HA THR A 112 2.731 -2.728 5.336 1.00 0.00 H new ATOM 0 HB THR A 112 3.685 -0.684 4.145 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.811 0.695 3.313 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.481 -1.063 2.010 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.815 -2.600 2.843 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.180 -1.898 2.892 1.00 0.00 H new ATOM 1412 N ILE A 113 4.181 -0.894 6.657 1.00 0.00 N ATOM 1413 CA ILE A 113 4.867 -0.198 7.793 1.00 0.00 C ATOM 1414 C ILE A 113 5.977 0.698 7.211 1.00 0.00 C ATOM 1415 O ILE A 113 6.634 0.302 6.269 1.00 0.00 O ATOM 1416 CB ILE A 113 5.483 -1.254 8.727 1.00 0.00 C ATOM 1417 CG1 ILE A 113 5.949 -0.585 10.020 1.00 0.00 C ATOM 1418 CG2 ILE A 113 6.682 -1.926 8.052 1.00 0.00 C ATOM 1419 CD1 ILE A 113 6.337 -1.652 11.046 1.00 0.00 C ATOM 0 H ILE A 113 4.808 -1.251 5.936 1.00 0.00 H new ATOM 0 HA ILE A 113 4.159 0.409 8.357 1.00 0.00 H new ATOM 0 HB ILE A 113 4.727 -2.007 8.949 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.801 0.064 9.818 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.155 0.046 10.420 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.108 -2.671 8.724 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.357 -2.412 7.132 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.436 -1.175 7.818 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.668 -1.169 11.965 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.474 -2.283 11.258 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.145 -2.264 10.646 1.00 0.00 H new ATOM 1431 N PRO A 114 6.220 1.887 7.739 1.00 0.00 N ATOM 1432 CA PRO A 114 7.291 2.756 7.196 1.00 0.00 C ATOM 1433 C PRO A 114 8.647 2.399 7.808 1.00 0.00 C ATOM 1434 O PRO A 114 8.831 2.453 9.008 1.00 0.00 O ATOM 1435 CB PRO A 114 6.846 4.166 7.585 1.00 0.00 C ATOM 1436 CG PRO A 114 6.054 3.998 8.853 1.00 0.00 C ATOM 1437 CD PRO A 114 5.539 2.540 8.885 1.00 0.00 C ATOM 0 HA PRO A 114 7.425 2.648 6.120 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.704 4.820 7.741 1.00 0.00 H new ATOM 0 HB3 PRO A 114 6.240 4.618 6.800 1.00 0.00 H new ATOM 0 HG2 PRO A 114 6.675 4.205 9.724 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.221 4.700 8.881 1.00 0.00 H new ATOM 0 HD2 PRO A 114 5.787 2.051 9.827 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.455 2.498 8.780 1.00 0.00 H new ATOM 1445 N ALA A 115 9.588 2.010 6.988 1.00 0.00 N ATOM 1446 CA ALA A 115 10.935 1.614 7.501 1.00 0.00 C ATOM 1447 C ALA A 115 12.034 2.234 6.638 1.00 0.00 C ATOM 1448 O ALA A 115 11.950 2.266 5.426 1.00 0.00 O ATOM 1449 CB ALA A 115 11.062 0.091 7.447 1.00 0.00 C ATOM 0 H ALA A 115 9.481 1.949 5.976 1.00 0.00 H new ATOM 0 HA ALA A 115 11.043 1.968 8.526 1.00 0.00 H new ATOM 0 HB1 ALA A 115 12.042 -0.206 7.820 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.287 -0.361 8.065 1.00 0.00 H new ATOM 0 HB3 ALA A 115 10.948 -0.247 6.417 1.00 0.00 H new ATOM 1455 N LYS A 116 13.071 2.715 7.264 1.00 0.00 N ATOM 1456 CA LYS A 116 14.198 3.326 6.505 1.00 0.00 C ATOM 1457 C LYS A 116 14.974 2.215 5.781 1.00 0.00 C ATOM 1458 O LYS A 116 15.575 1.363 6.404 1.00 0.00 O ATOM 1459 CB LYS A 116 15.134 4.056 7.497 1.00 0.00 C ATOM 1460 CG LYS A 116 14.748 5.537 7.596 1.00 0.00 C ATOM 1461 CD LYS A 116 15.724 6.257 8.529 1.00 0.00 C ATOM 1462 CE LYS A 116 15.494 7.767 8.441 1.00 0.00 C ATOM 1463 NZ LYS A 116 14.125 8.091 8.933 1.00 0.00 N ATOM 0 H LYS A 116 13.187 2.711 8.277 1.00 0.00 H new ATOM 0 HA LYS A 116 13.817 4.038 5.773 1.00 0.00 H new ATOM 0 HB2 LYS A 116 15.070 3.589 8.480 1.00 0.00 H new ATOM 0 HB3 LYS A 116 16.169 3.963 7.167 1.00 0.00 H new ATOM 0 HG2 LYS A 116 14.768 5.996 6.607 1.00 0.00 H new ATOM 0 HG3 LYS A 116 13.730 5.634 7.972 1.00 0.00 H new ATOM 0 HD2 LYS A 116 15.582 5.916 9.554 1.00 0.00 H new ATOM 0 HD3 LYS A 116 16.751 6.018 8.253 1.00 0.00 H new ATOM 0 HE2 LYS A 116 16.240 8.294 9.036 1.00 0.00 H new ATOM 0 HE3 LYS A 116 15.611 8.104 7.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 14.004 9.123 8.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 13.419 7.682 8.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 13.995 7.694 9.885 1.00 0.00 H new ATOM 1477 N LEU A 117 14.977 2.220 4.472 1.00 0.00 N ATOM 1478 CA LEU A 117 15.731 1.161 3.734 1.00 0.00 C ATOM 1479 C LEU A 117 17.214 1.535 3.691 1.00 0.00 C ATOM 1480 O LEU A 117 17.571 2.675 3.469 1.00 0.00 O ATOM 1481 CB LEU A 117 15.218 1.031 2.292 1.00 0.00 C ATOM 1482 CG LEU A 117 13.707 0.747 2.261 1.00 0.00 C ATOM 1483 CD1 LEU A 117 13.284 0.455 0.815 1.00 0.00 C ATOM 1484 CD2 LEU A 117 13.371 -0.466 3.137 1.00 0.00 C ATOM 0 H LEU A 117 14.496 2.903 3.887 1.00 0.00 H new ATOM 0 HA LEU A 117 15.588 0.212 4.251 1.00 0.00 H new ATOM 0 HB2 LEU A 117 15.429 1.949 1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 117 15.752 0.227 1.785 1.00 0.00 H new ATOM 0 HG LEU A 117 13.174 1.617 2.644 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.213 0.252 0.783 1.00 0.00 H new ATOM 0 HD12 LEU A 117 13.509 1.318 0.189 1.00 0.00 H new ATOM 0 HD13 LEU A 117 13.829 -0.413 0.445 1.00 0.00 H new ATOM 0 HD21 LEU A 117 12.298 -0.653 3.104 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.903 -1.342 2.766 1.00 0.00 H new ATOM 0 HD23 LEU A 117 13.673 -0.267 4.165 1.00 0.00 H new ATOM 1496 N VAL A 118 18.079 0.574 3.895 1.00 0.00 N ATOM 1497 CA VAL A 118 19.551 0.842 3.863 1.00 0.00 C ATOM 1498 C VAL A 118 20.234 -0.245 3.034 1.00 0.00 C ATOM 1499 O VAL A 118 20.301 -1.391 3.431 1.00 0.00 O ATOM 1500 CB VAL A 118 20.105 0.817 5.290 1.00 0.00 C ATOM 1501 CG1 VAL A 118 21.617 1.050 5.260 1.00 0.00 C ATOM 1502 CG2 VAL A 118 19.436 1.916 6.116 1.00 0.00 C ATOM 0 H VAL A 118 17.826 -0.396 4.085 1.00 0.00 H new ATOM 0 HA VAL A 118 19.740 1.820 3.420 1.00 0.00 H new ATOM 0 HB VAL A 118 19.899 -0.154 5.740 1.00 0.00 H new ATOM 0 HG11 VAL A 118 22.008 1.032 6.277 1.00 0.00 H new ATOM 0 HG12 VAL A 118 22.095 0.265 4.673 1.00 0.00 H new ATOM 0 HG13 VAL A 118 21.827 2.019 4.808 1.00 0.00 H new ATOM 0 HG21 VAL A 118 19.830 1.898 7.132 1.00 0.00 H new ATOM 0 HG22 VAL A 118 19.641 2.887 5.664 1.00 0.00 H new ATOM 0 HG23 VAL A 118 18.359 1.748 6.142 1.00 0.00 H new ATOM 1512 N GLN A 119 20.740 0.102 1.881 1.00 0.00 N ATOM 1513 CA GLN A 119 21.412 -0.919 1.027 1.00 0.00 C ATOM 1514 C GLN A 119 22.411 -1.712 1.872 1.00 0.00 C ATOM 1515 O GLN A 119 23.122 -1.162 2.690 1.00 0.00 O ATOM 1516 CB GLN A 119 22.161 -0.226 -0.116 1.00 0.00 C ATOM 1517 CG GLN A 119 21.156 0.398 -1.085 1.00 0.00 C ATOM 1518 CD GLN A 119 20.486 1.599 -0.412 1.00 0.00 C ATOM 1519 OE1 GLN A 119 21.130 2.349 0.295 1.00 0.00 O ATOM 1520 NE2 GLN A 119 19.214 1.816 -0.600 1.00 0.00 N ATOM 0 H GLN A 119 20.717 1.046 1.495 1.00 0.00 H new ATOM 0 HA GLN A 119 20.660 -1.592 0.615 1.00 0.00 H new ATOM 0 HB2 GLN A 119 22.822 0.543 0.283 1.00 0.00 H new ATOM 0 HB3 GLN A 119 22.789 -0.945 -0.641 1.00 0.00 H new ATOM 0 HG2 GLN A 119 21.661 0.713 -1.998 1.00 0.00 H new ATOM 0 HG3 GLN A 119 20.405 -0.338 -1.373 1.00 0.00 H new ATOM 0 HE21 GLN A 119 18.672 1.188 -1.193 1.00 0.00 H new ATOM 0 HE22 GLN A 119 18.761 2.614 -0.154 1.00 0.00 H new ATOM 1529 N SER A 120 22.471 -3.004 1.680 1.00 0.00 N ATOM 1530 CA SER A 120 23.424 -3.846 2.468 1.00 0.00 C ATOM 1531 C SER A 120 24.014 -4.927 1.558 1.00 0.00 C ATOM 1532 O SER A 120 23.713 -4.991 0.382 1.00 0.00 O ATOM 1533 CB SER A 120 22.673 -4.500 3.631 1.00 0.00 C ATOM 1534 OG SER A 120 22.501 -3.551 4.673 1.00 0.00 O ATOM 0 H SER A 120 21.899 -3.516 1.008 1.00 0.00 H new ATOM 0 HA SER A 120 24.230 -3.226 2.861 1.00 0.00 H new ATOM 0 HB2 SER A 120 21.703 -4.865 3.293 1.00 0.00 H new ATOM 0 HB3 SER A 120 23.229 -5.363 3.998 1.00 0.00 H new ATOM 0 HG SER A 120 22.770 -2.664 4.355 1.00 0.00 H new ATOM 1540 N THR A 121 24.859 -5.771 2.096 1.00 0.00 N ATOM 1541 CA THR A 121 25.490 -6.856 1.279 1.00 0.00 C ATOM 1542 C THR A 121 25.345 -8.192 2.011 1.00 0.00 C ATOM 1543 O THR A 121 25.078 -8.240 3.196 1.00 0.00 O ATOM 1544 CB THR A 121 26.976 -6.538 1.089 1.00 0.00 C ATOM 1545 OG1 THR A 121 27.523 -6.092 2.322 1.00 0.00 O ATOM 1546 CG2 THR A 121 27.137 -5.444 0.033 1.00 0.00 C ATOM 0 H THR A 121 25.142 -5.755 3.076 1.00 0.00 H new ATOM 0 HA THR A 121 25.000 -6.920 0.308 1.00 0.00 H new ATOM 0 HB THR A 121 27.500 -7.435 0.760 1.00 0.00 H new ATOM 0 HG1 THR A 121 28.474 -5.889 2.203 1.00 0.00 H new ATOM 0 HG21 THR A 121 28.195 -5.220 -0.100 1.00 0.00 H new ATOM 0 HG22 THR A 121 26.717 -5.786 -0.913 1.00 0.00 H new ATOM 0 HG23 THR A 121 26.614 -4.545 0.358 1.00 0.00 H new ATOM 1554 N LEU A 122 25.509 -9.283 1.317 1.00 0.00 N ATOM 1555 CA LEU A 122 25.367 -10.604 1.992 1.00 0.00 C ATOM 1556 C LEU A 122 26.333 -10.680 3.185 1.00 0.00 C ATOM 1557 O LEU A 122 26.025 -11.274 4.200 1.00 0.00 O ATOM 1558 CB LEU A 122 25.664 -11.740 1.000 1.00 0.00 C ATOM 1559 CG LEU A 122 25.250 -13.096 1.604 1.00 0.00 C ATOM 1560 CD1 LEU A 122 23.714 -13.195 1.723 1.00 0.00 C ATOM 1561 CD2 LEU A 122 25.759 -14.222 0.700 1.00 0.00 C ATOM 0 H LEU A 122 25.733 -9.319 0.322 1.00 0.00 H new ATOM 0 HA LEU A 122 24.344 -10.713 2.351 1.00 0.00 H new ATOM 0 HB2 LEU A 122 25.125 -11.569 0.068 1.00 0.00 H new ATOM 0 HB3 LEU A 122 26.726 -11.751 0.756 1.00 0.00 H new ATOM 0 HG LEU A 122 25.683 -13.184 2.600 1.00 0.00 H new ATOM 0 HD11 LEU A 122 23.444 -14.160 2.152 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.347 -12.396 2.367 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.266 -13.099 0.734 1.00 0.00 H new ATOM 0 HD21 LEU A 122 25.470 -15.185 1.121 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.325 -14.115 -0.294 1.00 0.00 H new ATOM 0 HD23 LEU A 122 26.845 -14.168 0.629 1.00 0.00 H new ATOM 1573 N SER A 123 27.493 -10.080 3.083 1.00 0.00 N ATOM 1574 CA SER A 123 28.455 -10.121 4.223 1.00 0.00 C ATOM 1575 C SER A 123 27.767 -9.588 5.482 1.00 0.00 C ATOM 1576 O SER A 123 27.861 -10.170 6.545 1.00 0.00 O ATOM 1577 CB SER A 123 29.670 -9.250 3.897 1.00 0.00 C ATOM 1578 OG SER A 123 30.328 -8.886 5.102 1.00 0.00 O ATOM 0 H SER A 123 27.813 -9.566 2.262 1.00 0.00 H new ATOM 0 HA SER A 123 28.781 -11.147 4.391 1.00 0.00 H new ATOM 0 HB2 SER A 123 30.355 -9.792 3.245 1.00 0.00 H new ATOM 0 HB3 SER A 123 29.356 -8.357 3.357 1.00 0.00 H new ATOM 0 HG SER A 123 31.107 -8.329 4.894 1.00 0.00 H new ATOM 1584 N ASP A 124 27.065 -8.491 5.371 1.00 0.00 N ATOM 1585 CA ASP A 124 26.363 -7.932 6.552 1.00 0.00 C ATOM 1586 C ASP A 124 25.457 -9.023 7.139 1.00 0.00 C ATOM 1587 O ASP A 124 25.380 -9.213 8.343 1.00 0.00 O ATOM 1588 CB ASP A 124 25.518 -6.737 6.094 1.00 0.00 C ATOM 1589 CG ASP A 124 26.401 -5.492 5.975 1.00 0.00 C ATOM 1590 OD1 ASP A 124 27.029 -5.139 6.960 1.00 0.00 O ATOM 1591 OD2 ASP A 124 26.435 -4.913 4.901 1.00 0.00 O ATOM 0 H ASP A 124 26.950 -7.960 4.508 1.00 0.00 H new ATOM 0 HA ASP A 124 27.074 -7.604 7.310 1.00 0.00 H new ATOM 0 HB2 ASP A 124 25.052 -6.956 5.133 1.00 0.00 H new ATOM 0 HB3 ASP A 124 24.712 -6.556 6.805 1.00 0.00 H new ATOM 1596 N LEU A 125 24.774 -9.749 6.294 1.00 0.00 N ATOM 1597 CA LEU A 125 23.880 -10.824 6.807 1.00 0.00 C ATOM 1598 C LEU A 125 24.729 -11.888 7.517 1.00 0.00 C ATOM 1599 O LEU A 125 24.295 -12.497 8.470 1.00 0.00 O ATOM 1600 CB LEU A 125 23.071 -11.441 5.636 1.00 0.00 C ATOM 1601 CG LEU A 125 21.625 -11.742 6.076 1.00 0.00 C ATOM 1602 CD1 LEU A 125 20.863 -10.432 6.380 1.00 0.00 C ATOM 1603 CD2 LEU A 125 20.917 -12.511 4.958 1.00 0.00 C ATOM 0 H LEU A 125 24.797 -9.645 5.280 1.00 0.00 H new ATOM 0 HA LEU A 125 23.170 -10.409 7.523 1.00 0.00 H new ATOM 0 HB2 LEU A 125 23.064 -10.754 4.790 1.00 0.00 H new ATOM 0 HB3 LEU A 125 23.553 -12.358 5.298 1.00 0.00 H new ATOM 0 HG LEU A 125 21.644 -12.342 6.986 1.00 0.00 H new ATOM 0 HD11 LEU A 125 19.844 -10.667 6.689 1.00 0.00 H new ATOM 0 HD12 LEU A 125 21.370 -9.894 7.181 1.00 0.00 H new ATOM 0 HD13 LEU A 125 20.837 -9.810 5.485 1.00 0.00 H new ATOM 0 HD21 LEU A 125 19.892 -12.729 5.259 1.00 0.00 H new ATOM 0 HD22 LEU A 125 20.908 -11.907 4.050 1.00 0.00 H new ATOM 0 HD23 LEU A 125 21.446 -13.445 4.767 1.00 0.00 H new ATOM 1615 N ARG A 126 25.941 -12.107 7.076 1.00 0.00 N ATOM 1616 CA ARG A 126 26.809 -13.117 7.749 1.00 0.00 C ATOM 1617 C ARG A 126 27.066 -12.673 9.191 1.00 0.00 C ATOM 1618 O ARG A 126 27.167 -13.484 10.090 1.00 0.00 O ATOM 1619 CB ARG A 126 28.142 -13.212 6.993 1.00 0.00 C ATOM 1620 CG ARG A 126 28.941 -14.445 7.457 1.00 0.00 C ATOM 1621 CD ARG A 126 28.525 -15.683 6.649 1.00 0.00 C ATOM 1622 NE ARG A 126 28.867 -16.913 7.417 1.00 0.00 N ATOM 1623 CZ ARG A 126 30.115 -17.270 7.555 1.00 0.00 C ATOM 1624 NH1 ARG A 126 31.063 -16.549 7.021 1.00 0.00 N ATOM 1625 NH2 ARG A 126 30.415 -18.348 8.227 1.00 0.00 N ATOM 0 H ARG A 126 26.366 -11.631 6.280 1.00 0.00 H new ATOM 0 HA ARG A 126 26.320 -14.091 7.750 1.00 0.00 H new ATOM 0 HB2 ARG A 126 27.955 -13.275 5.921 1.00 0.00 H new ATOM 0 HB3 ARG A 126 28.727 -12.308 7.161 1.00 0.00 H new ATOM 0 HG2 ARG A 126 30.009 -14.263 7.333 1.00 0.00 H new ATOM 0 HG3 ARG A 126 28.769 -14.620 8.519 1.00 0.00 H new ATOM 0 HD2 ARG A 126 27.455 -15.655 6.444 1.00 0.00 H new ATOM 0 HD3 ARG A 126 29.034 -15.690 5.685 1.00 0.00 H new ATOM 0 HE ARG A 126 28.126 -17.476 7.835 1.00 0.00 H new ATOM 0 HH11 ARG A 126 30.829 -15.707 6.496 1.00 0.00 H new ATOM 0 HH12 ARG A 126 32.038 -16.828 7.129 1.00 0.00 H new ATOM 0 HH21 ARG A 126 29.674 -18.912 8.644 1.00 0.00 H new ATOM 0 HH22 ARG A 126 31.390 -18.627 8.335 1.00 0.00 H new ATOM 1639 N VAL A 127 27.160 -11.393 9.422 1.00 0.00 N ATOM 1640 CA VAL A 127 27.395 -10.907 10.807 1.00 0.00 C ATOM 1641 C VAL A 127 26.211 -11.325 11.680 1.00 0.00 C ATOM 1642 O VAL A 127 26.363 -11.617 12.850 1.00 0.00 O ATOM 1643 CB VAL A 127 27.514 -9.382 10.804 1.00 0.00 C ATOM 1644 CG1 VAL A 127 27.762 -8.890 12.230 1.00 0.00 C ATOM 1645 CG2 VAL A 127 28.686 -8.965 9.915 1.00 0.00 C ATOM 0 H VAL A 127 27.084 -10.665 8.712 1.00 0.00 H new ATOM 0 HA VAL A 127 28.318 -11.335 11.199 1.00 0.00 H new ATOM 0 HB VAL A 127 26.591 -8.946 10.421 1.00 0.00 H new ATOM 0 HG11 VAL A 127 27.847 -7.803 12.230 1.00 0.00 H new ATOM 0 HG12 VAL A 127 26.930 -9.189 12.868 1.00 0.00 H new ATOM 0 HG13 VAL A 127 28.686 -9.326 12.610 1.00 0.00 H new ATOM 0 HG21 VAL A 127 28.772 -7.878 9.912 1.00 0.00 H new ATOM 0 HG22 VAL A 127 29.608 -9.401 10.300 1.00 0.00 H new ATOM 0 HG23 VAL A 127 28.515 -9.318 8.898 1.00 0.00 H new ATOM 1655 N TYR A 128 25.025 -11.351 11.120 1.00 0.00 N ATOM 1656 CA TYR A 128 23.825 -11.746 11.926 1.00 0.00 C ATOM 1657 C TYR A 128 23.585 -13.258 11.841 1.00 0.00 C ATOM 1658 O TYR A 128 23.335 -13.911 12.835 1.00 0.00 O ATOM 1659 CB TYR A 128 22.579 -11.043 11.383 1.00 0.00 C ATOM 1660 CG TYR A 128 22.694 -9.550 11.563 1.00 0.00 C ATOM 1661 CD1 TYR A 128 22.373 -8.965 12.793 1.00 0.00 C ATOM 1662 CD2 TYR A 128 23.104 -8.750 10.493 1.00 0.00 C ATOM 1663 CE1 TYR A 128 22.467 -7.578 12.953 1.00 0.00 C ATOM 1664 CE2 TYR A 128 23.196 -7.363 10.651 1.00 0.00 C ATOM 1665 CZ TYR A 128 22.878 -6.776 11.881 1.00 0.00 C ATOM 1666 OH TYR A 128 22.968 -5.408 12.038 1.00 0.00 O ATOM 0 H TYR A 128 24.836 -11.117 10.145 1.00 0.00 H new ATOM 0 HA TYR A 128 24.011 -11.459 12.961 1.00 0.00 H new ATOM 0 HB2 TYR A 128 22.452 -11.279 10.326 1.00 0.00 H new ATOM 0 HB3 TYR A 128 21.693 -11.410 11.900 1.00 0.00 H new ATOM 0 HD1 TYR A 128 22.053 -9.584 13.618 1.00 0.00 H new ATOM 0 HD2 TYR A 128 23.350 -9.203 9.544 1.00 0.00 H new ATOM 0 HE1 TYR A 128 22.223 -7.126 13.903 1.00 0.00 H new ATOM 0 HE2 TYR A 128 23.512 -6.745 9.824 1.00 0.00 H new ATOM 0 HH TYR A 128 23.269 -5.001 11.199 1.00 0.00 H new ATOM 1676 N LEU A 129 23.617 -13.807 10.653 1.00 0.00 N ATOM 1677 CA LEU A 129 23.350 -15.263 10.465 1.00 0.00 C ATOM 1678 C LEU A 129 24.565 -15.948 9.847 1.00 0.00 C ATOM 1679 O LEU A 129 24.439 -16.712 8.915 1.00 0.00 O ATOM 1680 CB LEU A 129 22.186 -15.413 9.492 1.00 0.00 C ATOM 1681 CG LEU A 129 20.923 -14.718 10.023 1.00 0.00 C ATOM 1682 CD1 LEU A 129 19.759 -15.016 9.068 1.00 0.00 C ATOM 1683 CD2 LEU A 129 20.579 -15.221 11.435 1.00 0.00 C ATOM 0 H LEU A 129 23.820 -13.298 9.793 1.00 0.00 H new ATOM 0 HA LEU A 129 23.127 -15.714 11.432 1.00 0.00 H new ATOM 0 HB2 LEU A 129 22.459 -14.988 8.526 1.00 0.00 H new ATOM 0 HB3 LEU A 129 21.980 -16.471 9.328 1.00 0.00 H new ATOM 0 HG LEU A 129 21.099 -13.644 10.078 1.00 0.00 H new ATOM 0 HD11 LEU A 129 18.855 -14.528 9.433 1.00 0.00 H new ATOM 0 HD12 LEU A 129 19.998 -14.639 8.074 1.00 0.00 H new ATOM 0 HD13 LEU A 129 19.596 -16.093 9.018 1.00 0.00 H new ATOM 0 HD21 LEU A 129 19.681 -14.716 11.792 1.00 0.00 H new ATOM 0 HD22 LEU A 129 20.403 -16.296 11.405 1.00 0.00 H new ATOM 0 HD23 LEU A 129 21.408 -15.007 12.109 1.00 0.00 H new ATOM 1695 N GLY A 130 25.734 -15.682 10.342 1.00 0.00 N ATOM 1696 CA GLY A 130 26.949 -16.323 9.768 1.00 0.00 C ATOM 1697 C GLY A 130 26.907 -17.844 9.988 1.00 0.00 C ATOM 1698 O GLY A 130 27.916 -18.462 10.265 1.00 0.00 O ATOM 0 H GLY A 130 25.905 -15.047 11.122 1.00 0.00 H new ATOM 0 HA2 GLY A 130 27.014 -16.105 8.702 1.00 0.00 H new ATOM 0 HA3 GLY A 130 27.842 -15.906 10.233 1.00 0.00 H new ATOM 1702 N ALA A 131 25.756 -18.460 9.860 1.00 0.00 N ATOM 1703 CA ALA A 131 25.672 -19.937 10.056 1.00 0.00 C ATOM 1704 C ALA A 131 24.474 -20.490 9.274 1.00 0.00 C ATOM 1705 O ALA A 131 24.618 -21.373 8.451 1.00 0.00 O ATOM 1706 CB ALA A 131 25.511 -20.249 11.548 1.00 0.00 C ATOM 0 H ALA A 131 24.874 -18.002 9.629 1.00 0.00 H new ATOM 0 HA ALA A 131 26.586 -20.406 9.690 1.00 0.00 H new ATOM 0 HB1 ALA A 131 25.450 -21.328 11.690 1.00 0.00 H new ATOM 0 HB2 ALA A 131 26.369 -19.859 12.096 1.00 0.00 H new ATOM 0 HB3 ALA A 131 24.600 -19.782 11.921 1.00 0.00 H new ATOM 1712 N SER A 132 23.294 -19.978 9.520 1.00 0.00 N ATOM 1713 CA SER A 132 22.084 -20.471 8.788 1.00 0.00 C ATOM 1714 C SER A 132 21.747 -19.501 7.654 1.00 0.00 C ATOM 1715 O SER A 132 20.595 -19.257 7.354 1.00 0.00 O ATOM 1716 CB SER A 132 20.903 -20.545 9.757 1.00 0.00 C ATOM 1717 OG SER A 132 19.836 -21.260 9.150 1.00 0.00 O ATOM 0 H SER A 132 23.115 -19.237 10.198 1.00 0.00 H new ATOM 0 HA SER A 132 22.284 -21.460 8.376 1.00 0.00 H new ATOM 0 HB2 SER A 132 21.207 -21.039 10.680 1.00 0.00 H new ATOM 0 HB3 SER A 132 20.576 -19.541 10.025 1.00 0.00 H new ATOM 0 HG SER A 132 19.599 -20.834 8.300 1.00 0.00 H new ATOM 1723 N THR A 133 22.744 -18.939 7.027 1.00 0.00 N ATOM 1724 CA THR A 133 22.481 -17.974 5.920 1.00 0.00 C ATOM 1725 C THR A 133 22.040 -18.748 4.650 1.00 0.00 C ATOM 1726 O THR A 133 22.812 -19.516 4.111 1.00 0.00 O ATOM 1727 CB THR A 133 23.788 -17.195 5.620 1.00 0.00 C ATOM 1728 OG1 THR A 133 24.697 -17.383 6.692 1.00 0.00 O ATOM 1729 CG2 THR A 133 23.502 -15.696 5.457 1.00 0.00 C ATOM 0 H THR A 133 23.729 -19.106 7.233 1.00 0.00 H new ATOM 0 HA THR A 133 21.691 -17.282 6.211 1.00 0.00 H new ATOM 0 HB THR A 133 24.216 -17.572 4.691 1.00 0.00 H new ATOM 0 HG1 THR A 133 24.359 -16.927 7.491 1.00 0.00 H new ATOM 0 HG21 THR A 133 24.433 -15.169 5.247 1.00 0.00 H new ATOM 0 HG22 THR A 133 22.806 -15.546 4.632 1.00 0.00 H new ATOM 0 HG23 THR A 133 23.064 -15.307 6.376 1.00 0.00 H new ATOM 1737 N PRO A 134 20.833 -18.550 4.152 1.00 0.00 N ATOM 1738 CA PRO A 134 20.371 -19.252 2.920 1.00 0.00 C ATOM 1739 C PRO A 134 21.015 -18.668 1.657 1.00 0.00 C ATOM 1740 O PRO A 134 21.829 -17.769 1.720 1.00 0.00 O ATOM 1741 CB PRO A 134 18.849 -19.041 2.914 1.00 0.00 C ATOM 1742 CG PRO A 134 18.615 -17.792 3.710 1.00 0.00 C ATOM 1743 CD PRO A 134 19.789 -17.660 4.694 1.00 0.00 C ATOM 0 HA PRO A 134 20.649 -20.306 2.922 1.00 0.00 H new ATOM 0 HB2 PRO A 134 18.471 -18.935 1.897 1.00 0.00 H new ATOM 0 HB3 PRO A 134 18.333 -19.892 3.358 1.00 0.00 H new ATOM 0 HG2 PRO A 134 18.561 -16.922 3.056 1.00 0.00 H new ATOM 0 HG3 PRO A 134 17.667 -17.848 4.246 1.00 0.00 H new ATOM 0 HD2 PRO A 134 20.140 -16.630 4.756 1.00 0.00 H new ATOM 0 HD3 PRO A 134 19.497 -17.959 5.701 1.00 0.00 H new ATOM 1751 N ASP A 135 20.647 -19.180 0.513 1.00 0.00 N ATOM 1752 CA ASP A 135 21.218 -18.677 -0.773 1.00 0.00 C ATOM 1753 C ASP A 135 20.172 -17.815 -1.477 1.00 0.00 C ATOM 1754 O ASP A 135 19.102 -18.274 -1.826 1.00 0.00 O ATOM 1755 CB ASP A 135 21.580 -19.866 -1.665 1.00 0.00 C ATOM 1756 CG ASP A 135 22.464 -19.388 -2.819 1.00 0.00 C ATOM 1757 OD1 ASP A 135 22.574 -18.186 -2.997 1.00 0.00 O ATOM 1758 OD2 ASP A 135 23.017 -20.233 -3.504 1.00 0.00 O ATOM 0 H ASP A 135 19.967 -19.934 0.412 1.00 0.00 H new ATOM 0 HA ASP A 135 22.112 -18.085 -0.576 1.00 0.00 H new ATOM 0 HB2 ASP A 135 22.103 -20.625 -1.083 1.00 0.00 H new ATOM 0 HB3 ASP A 135 20.674 -20.331 -2.055 1.00 0.00 H new ATOM 1763 N LEU A 136 20.473 -16.568 -1.677 1.00 0.00 N ATOM 1764 CA LEU A 136 19.501 -15.656 -2.347 1.00 0.00 C ATOM 1765 C LEU A 136 19.593 -15.806 -3.867 1.00 0.00 C ATOM 1766 O LEU A 136 20.663 -15.928 -4.429 1.00 0.00 O ATOM 1767 CB LEU A 136 19.821 -14.210 -1.965 1.00 0.00 C ATOM 1768 CG LEU A 136 19.667 -14.014 -0.452 1.00 0.00 C ATOM 1769 CD1 LEU A 136 20.071 -12.580 -0.095 1.00 0.00 C ATOM 1770 CD2 LEU A 136 18.209 -14.264 -0.029 1.00 0.00 C ATOM 0 H LEU A 136 21.355 -16.134 -1.405 1.00 0.00 H new ATOM 0 HA LEU A 136 18.492 -15.915 -2.024 1.00 0.00 H new ATOM 0 HB2 LEU A 136 20.838 -13.963 -2.269 1.00 0.00 H new ATOM 0 HB3 LEU A 136 19.155 -13.530 -2.497 1.00 0.00 H new ATOM 0 HG LEU A 136 20.307 -14.723 0.073 1.00 0.00 H new ATOM 0 HD11 LEU A 136 19.965 -12.429 0.979 1.00 0.00 H new ATOM 0 HD12 LEU A 136 21.108 -12.411 -0.385 1.00 0.00 H new ATOM 0 HD13 LEU A 136 19.427 -11.878 -0.625 1.00 0.00 H new ATOM 0 HD21 LEU A 136 18.113 -14.122 1.047 1.00 0.00 H new ATOM 0 HD22 LEU A 136 17.554 -13.563 -0.548 1.00 0.00 H new ATOM 0 HD23 LEU A 136 17.925 -15.284 -0.287 1.00 0.00 H new ATOM 1782 N GLN A 137 18.464 -15.792 -4.530 1.00 0.00 N ATOM 1783 CA GLN A 137 18.435 -15.928 -6.020 1.00 0.00 C ATOM 1784 C GLN A 137 17.599 -14.790 -6.617 1.00 0.00 C ATOM 1785 O GLN A 137 18.078 -13.668 -6.613 1.00 0.00 O ATOM 1786 CB GLN A 137 17.806 -17.277 -6.386 1.00 0.00 C ATOM 1787 CG GLN A 137 18.371 -18.371 -5.477 1.00 0.00 C ATOM 1788 CD GLN A 137 19.903 -18.350 -5.539 1.00 0.00 C ATOM 1789 OE1 GLN A 137 20.475 -18.343 -6.611 1.00 0.00 O ATOM 1790 NE2 GLN A 137 20.597 -18.341 -4.431 1.00 0.00 N ATOM 1791 OXT GLN A 137 16.499 -15.058 -7.071 1.00 0.00 O ATOM 0 H GLN A 137 17.547 -15.691 -4.096 1.00 0.00 H new ATOM 0 HA GLN A 137 19.449 -15.877 -6.418 1.00 0.00 H new ATOM 0 HB2 GLN A 137 16.722 -17.225 -6.279 1.00 0.00 H new ATOM 0 HB3 GLN A 137 18.013 -17.515 -7.430 1.00 0.00 H new ATOM 0 HG2 GLN A 137 18.036 -18.215 -4.452 1.00 0.00 H new ATOM 0 HG3 GLN A 137 17.998 -19.346 -5.789 1.00 0.00 H new ATOM 0 HE21 GLN A 137 20.119 -18.347 -3.530 1.00 0.00 H new ATOM 0 HE22 GLN A 137 21.616 -18.328 -4.468 1.00 0.00 H new TER 1800 GLN A 137 HETATM 1801 MG MG A 2 17.481 -1.295 24.344 1.00 0.00 MG HETATM 1802 PG ATP A 1 11.988 -3.681 19.547 1.00 0.00 P HETATM 1803 O1G ATP A 1 11.623 -4.700 20.583 1.00 0.00 O HETATM 1804 O2G ATP A 1 10.845 -2.853 19.061 1.00 0.00 O HETATM 1805 O3G ATP A 1 12.921 -4.179 18.481 1.00 0.00 O HETATM 1806 PB ATP A 1 13.228 -1.229 21.636 1.00 0.00 P HETATM 1807 O1B ATP A 1 12.034 -1.158 22.528 1.00 0.00 O HETATM 1808 O2B ATP A 1 14.508 -1.484 22.368 1.00 0.00 O HETATM 1809 O3B ATP A 1 13.058 -2.512 20.510 1.00 0.00 O HETATM 1810 PA ATP A 1 12.982 1.167 19.533 1.00 0.00 P HETATM 1811 O1A ATP A 1 13.494 0.511 18.318 1.00 0.00 O HETATM 1812 O2A ATP A 1 13.416 2.565 19.720 1.00 0.00 O HETATM 1813 O3A ATP A 1 13.457 0.311 20.915 1.00 0.00 O HETATM 1814 O5' ATP A 1 11.302 1.187 19.367 1.00 0.00 O HETATM 1815 C5' ATP A 1 10.434 1.776 20.330 1.00 0.00 C HETATM 1816 C4' ATP A 1 10.529 3.320 20.385 1.00 0.00 C HETATM 1817 O4' ATP A 1 9.226 3.881 20.528 1.00 0.00 O HETATM 1818 C3' ATP A 1 11.361 3.901 21.559 1.00 0.00 C HETATM 1819 O3' ATP A 1 12.527 4.552 21.060 1.00 0.00 O HETATM 1820 C2' ATP A 1 10.440 4.913 22.248 1.00 0.00 C HETATM 1821 O2' ATP A 1 11.200 6.079 22.516 1.00 0.00 O HETATM 1822 C1' ATP A 1 9.341 5.128 21.199 1.00 0.00 C HETATM 1823 N9 ATP A 1 8.037 5.591 21.748 1.00 0.00 N HETATM 1824 C8 ATP A 1 7.349 6.747 21.437 1.00 0.00 C HETATM 1825 N7 ATP A 1 6.189 6.883 22.027 1.00 0.00 N HETATM 1826 C5 ATP A 1 6.097 5.764 22.843 1.00 0.00 C HETATM 1827 C6 ATP A 1 5.139 5.287 23.774 1.00 0.00 C HETATM 1828 N6 ATP A 1 3.981 5.900 24.027 1.00 0.00 N HETATM 1829 N1 ATP A 1 5.409 4.161 24.466 1.00 0.00 N HETATM 1830 C2 ATP A 1 6.560 3.515 24.249 1.00 0.00 C HETATM 1831 N3 ATP A 1 7.531 3.813 23.382 1.00 0.00 N HETATM 1832 C4 ATP A 1 7.262 4.961 22.697 1.00 0.00 C HETATM 0 HO3' ATP A 1 13.154 3.882 20.717 1.00 0.00 H new HETATM 0 HO2' ATP A 1 11.925 6.154 21.861 1.00 0.00 H new HETATM 0 HN62 ATP A 1 3.333 5.505 24.709 1.00 0.00 H new HETATM 0 HN61 ATP A 1 3.743 6.763 23.538 1.00 0.00 H new HETATM 0 H5'2 ATP A 1 9.407 1.491 20.104 1.00 0.00 H new HETATM 0 H5'1 ATP A 1 10.668 1.370 21.314 1.00 0.00 H new HETATM 0 H8 ATP A 1 7.744 7.494 20.748 1.00 0.00 H new HETATM 0 H4' ATP A 1 11.028 3.581 19.452 1.00 0.00 H new HETATM 0 H3' ATP A 1 11.695 3.124 22.246 1.00 0.00 H new HETATM 0 H2' ATP A 1 10.014 4.607 23.204 1.00 0.00 H new HETATM 0 H2 ATP A 1 6.727 2.628 24.861 1.00 0.00 H new HETATM 0 H1' ATP A 1 9.618 5.943 20.530 1.00 0.00 H new