USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1034 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 HIS : no HE2:sc= -21.9! C(o=-23!,f=-33!) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -150:sc= -1.19 (180deg=0) USER MOD Set 2.1: A 42 CYS SG : rot 75:sc= 0.552 USER MOD Set 2.2: A 69 CYS SG : rot -135:sc= 0.376 USER MOD Set 2.3: A 72 CYS SG : rot -140:sc= -0.117 USER MOD Set 3.1: A 53 SER OG : rot 180:sc= -1.12 USER MOD Set 3.2: A 55 TYR OH : rot -15:sc= -0.281 USER MOD Single : A 8 THR OG1 : rot 25:sc= 0.398 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 14 GLN : amide:sc=-0.00502 X(o=-0.005,f=-0.19) USER MOD Single : A 15 SER OG : rot -170:sc= -0.646 USER MOD Single : A 22 ASN : amide:sc= -2.04! K(o=-2!,f=-0.68) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -29:sc= 0.214 USER MOD Single : A 41 SER OG : rot -115:sc= 0.197 USER MOD Single : A 46 HIS : no HE2:sc= -4.16! K(o=-4.2!,f=-3.2) USER MOD Single : A 51 ASN : amide:sc= -2.41 X(o=-2.4,f=-2.1) USER MOD Single : A 57 ASN : amide:sc= -4.58! C(o=-4.6!,f=-18!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -1.44! C(o=-1.4!,f=-2.2!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -10.8! C(o=-11!,f=-9.3!) USER MOD Single : A 81 GLN : amide:sc= -0.142 K(o=-0.14,f=-0.89) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc=0.000819 USER MOD Single : A 89 HIS : no HD1:sc= -0.0565 X(o=-0.057,f=0) USER MOD Single : A 91 CYS SG : rot 93:sc= -6.58! USER MOD Single : A 96 GLN : amide:sc= -0.725 K(o=-0.72,f=-4.5!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot -83:sc= -1.26! USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 111 MET CE :methyl 141:sc= -5.54! (180deg=-9.12!) USER MOD Single : A 112 SER OG : rot 180:sc= -0.0434 USER MOD Single : A 115 HIS : no HD1:sc= -1.08 K(o=-1.1,f=-1.6) USER MOD Single : A 121 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.15) USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.0103 USER MOD Single : A 124 THR OG1 : rot -133:sc= 1.12 USER MOD Single : A 126 MET CE :methyl -165:sc= 0 (180deg=-0.25) USER MOD Single : A 127 THR OG1 : rot -57:sc= -0.401! USER MOD Single : A 132 GLN : amide:sc= -6.15! C(o=-6.2!,f=-4.4!) USER MOD Single : A 133 GLN : amide:sc= -0.0327 K(o=-0.033,f=-0.78) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 7.196 15.433 19.190 1.00 0.00 N ATOM 119 CA THR A 8 6.191 16.437 18.852 1.00 0.00 C ATOM 120 C THR A 8 6.865 17.800 18.867 1.00 0.00 C ATOM 121 O THR A 8 6.525 18.672 19.661 1.00 0.00 O ATOM 122 CB THR A 8 5.140 16.353 19.956 1.00 0.00 C ATOM 123 OG1 THR A 8 4.751 15.002 20.134 1.00 0.00 O ATOM 124 CG2 THR A 8 3.922 17.193 19.569 1.00 0.00 C ATOM 0 HA THR A 8 5.741 16.281 17.872 1.00 0.00 H new ATOM 0 HB THR A 8 5.559 16.735 20.887 1.00 0.00 H new ATOM 0 HG1 THR A 8 5.473 14.411 19.834 1.00 0.00 H new ATOM 0 HG21 THR A 8 3.172 17.132 20.358 1.00 0.00 H new ATOM 0 HG22 THR A 8 4.224 18.232 19.435 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.500 16.815 18.638 1.00 0.00 H new ATOM 132 N ASP A 9 7.814 17.999 17.987 1.00 0.00 N ATOM 133 CA ASP A 9 8.515 19.322 17.925 1.00 0.00 C ATOM 134 C ASP A 9 7.476 20.439 17.994 1.00 0.00 C ATOM 135 O ASP A 9 7.725 21.516 18.532 1.00 0.00 O ATOM 136 CB ASP A 9 9.237 19.350 16.575 1.00 0.00 C ATOM 137 CG ASP A 9 8.265 18.964 15.457 1.00 0.00 C ATOM 138 OD1 ASP A 9 7.563 19.841 14.982 1.00 0.00 O ATOM 139 OD2 ASP A 9 8.237 17.798 15.100 1.00 0.00 O ATOM 0 H ASP A 9 8.134 17.306 17.310 1.00 0.00 H new ATOM 0 HA ASP A 9 9.216 19.460 18.748 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.642 20.345 16.390 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.081 18.660 16.590 1.00 0.00 H new ATOM 144 N ASP A 10 6.297 20.183 17.488 1.00 0.00 N ATOM 145 CA ASP A 10 5.226 21.181 17.547 1.00 0.00 C ATOM 146 C ASP A 10 4.978 21.550 19.003 1.00 0.00 C ATOM 147 O ASP A 10 4.944 22.730 19.370 1.00 0.00 O ATOM 148 CB ASP A 10 4.032 20.456 16.944 1.00 0.00 C ATOM 149 CG ASP A 10 4.129 20.479 15.417 1.00 0.00 C ATOM 150 OD1 ASP A 10 4.823 19.637 14.874 1.00 0.00 O ATOM 151 OD2 ASP A 10 3.503 21.337 14.817 1.00 0.00 O ATOM 0 H ASP A 10 6.042 19.307 17.033 1.00 0.00 H new ATOM 0 HA ASP A 10 5.446 22.109 17.020 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.002 19.426 17.300 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.106 20.932 17.266 1.00 0.00 H new ATOM 156 N GLN A 11 4.848 20.577 19.866 1.00 0.00 N ATOM 157 CA GLN A 11 4.652 20.944 21.281 1.00 0.00 C ATOM 158 C GLN A 11 5.992 21.305 21.886 1.00 0.00 C ATOM 159 O GLN A 11 6.060 22.127 22.791 1.00 0.00 O ATOM 160 CB GLN A 11 4.043 19.768 22.015 1.00 0.00 C ATOM 161 CG GLN A 11 3.770 20.242 23.441 1.00 0.00 C ATOM 162 CD GLN A 11 2.265 20.228 23.717 1.00 0.00 C ATOM 163 OE1 GLN A 11 1.512 20.998 23.124 1.00 0.00 O ATOM 164 NE2 GLN A 11 1.783 19.389 24.593 1.00 0.00 N ATOM 0 H GLN A 11 4.869 19.579 19.655 1.00 0.00 H new ATOM 0 HA GLN A 11 3.982 21.800 21.363 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.122 19.443 21.531 1.00 0.00 H new ATOM 0 HB3 GLN A 11 4.722 18.915 22.013 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.285 19.596 24.153 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.164 21.248 23.580 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.408 18.750 25.085 1.00 0.00 H new ATOM 0 HE22 GLN A 11 0.781 19.372 24.786 1.00 0.00 H new ATOM 173 N ARG A 12 7.077 20.756 21.387 1.00 0.00 N ATOM 174 CA ARG A 12 8.383 21.169 21.936 1.00 0.00 C ATOM 175 C ARG A 12 8.396 22.675 21.831 1.00 0.00 C ATOM 176 O ARG A 12 8.750 23.390 22.763 1.00 0.00 O ATOM 177 CB ARG A 12 9.437 20.562 21.019 1.00 0.00 C ATOM 178 CG ARG A 12 9.490 19.038 21.181 1.00 0.00 C ATOM 179 CD ARG A 12 9.420 18.654 22.666 1.00 0.00 C ATOM 180 NE ARG A 12 9.676 17.184 22.700 1.00 0.00 N ATOM 181 CZ ARG A 12 9.426 16.490 23.784 1.00 0.00 C ATOM 182 NH1 ARG A 12 8.946 17.070 24.856 1.00 0.00 N ATOM 183 NH2 ARG A 12 9.657 15.206 23.796 1.00 0.00 N ATOM 0 H ARG A 12 7.104 20.059 20.643 1.00 0.00 H new ATOM 0 HA ARG A 12 8.565 20.855 22.964 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.212 20.814 19.983 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.413 20.990 21.247 1.00 0.00 H new ATOM 0 HG2 ARG A 12 8.661 18.580 20.641 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.410 18.651 20.742 1.00 0.00 H new ATOM 0 HD2 ARG A 12 10.164 19.197 23.249 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.445 18.894 23.090 1.00 0.00 H new ATOM 0 HE ARG A 12 10.048 16.716 21.874 1.00 0.00 H new ATOM 0 HH11 ARG A 12 8.762 18.073 24.854 1.00 0.00 H new ATOM 0 HH12 ARG A 12 8.756 16.518 25.693 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.030 14.747 22.965 1.00 0.00 H new ATOM 0 HH22 ARG A 12 9.464 14.661 24.636 1.00 0.00 H new ATOM 197 N TRP A 13 7.937 23.165 20.707 1.00 0.00 N ATOM 198 CA TRP A 13 7.846 24.622 20.534 1.00 0.00 C ATOM 199 C TRP A 13 6.903 25.163 21.591 1.00 0.00 C ATOM 200 O TRP A 13 7.168 26.188 22.213 1.00 0.00 O ATOM 201 CB TRP A 13 7.243 24.855 19.154 1.00 0.00 C ATOM 202 CG TRP A 13 7.238 26.325 18.906 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.171 27.053 18.508 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.333 27.260 19.072 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.547 28.380 18.416 1.00 0.00 N ATOM 206 CE2 TRP A 13 7.873 28.557 18.757 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.671 27.105 19.460 1.00 0.00 C ATOM 208 CZ2 TRP A 13 8.712 29.666 18.831 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.520 28.214 19.534 1.00 0.00 C ATOM 210 CH2 TRP A 13 10.046 29.494 19.224 1.00 0.00 C ATOM 0 H TRP A 13 7.625 22.610 19.910 1.00 0.00 H new ATOM 0 HA TRP A 13 8.816 25.111 20.626 1.00 0.00 H new ATOM 0 HB2 TRP A 13 7.825 24.340 18.390 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.230 24.455 19.106 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.187 26.662 18.297 1.00 0.00 H new ATOM 0 HE1 TRP A 13 5.922 29.135 18.132 1.00 0.00 H new ATOM 0 HE3 TRP A 13 10.049 26.123 19.703 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 8.338 30.650 18.588 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.549 28.082 19.833 1.00 0.00 H new ATOM 0 HH2 TRP A 13 10.706 30.346 19.287 1.00 0.00 H new ATOM 221 N GLN A 14 5.817 24.470 21.851 1.00 0.00 N ATOM 222 CA GLN A 14 4.905 24.961 22.913 1.00 0.00 C ATOM 223 C GLN A 14 5.708 24.997 24.213 1.00 0.00 C ATOM 224 O GLN A 14 5.535 25.875 25.047 1.00 0.00 O ATOM 225 CB GLN A 14 3.753 23.948 22.969 1.00 0.00 C ATOM 226 CG GLN A 14 2.921 24.172 24.237 1.00 0.00 C ATOM 227 CD GLN A 14 1.438 24.261 23.871 1.00 0.00 C ATOM 228 OE1 GLN A 14 0.642 23.416 24.276 1.00 0.00 O ATOM 229 NE2 GLN A 14 1.022 25.245 23.122 1.00 0.00 N ATOM 0 H GLN A 14 5.535 23.609 21.383 1.00 0.00 H new ATOM 0 HA GLN A 14 4.503 25.959 22.736 1.00 0.00 H new ATOM 0 HB2 GLN A 14 3.122 24.053 22.086 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.149 22.933 22.959 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.084 23.355 24.940 1.00 0.00 H new ATOM 0 HG3 GLN A 14 3.238 25.088 24.735 1.00 0.00 H new ATOM 0 HE21 GLN A 14 1.683 25.945 22.787 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.036 25.314 22.872 1.00 0.00 H new ATOM 238 N SER A 15 6.629 24.078 24.360 1.00 0.00 N ATOM 239 CA SER A 15 7.501 24.060 25.562 1.00 0.00 C ATOM 240 C SER A 15 8.461 25.238 25.481 1.00 0.00 C ATOM 241 O SER A 15 8.847 25.841 26.486 1.00 0.00 O ATOM 242 CB SER A 15 8.271 22.740 25.484 1.00 0.00 C ATOM 243 OG SER A 15 7.435 21.738 24.920 1.00 0.00 O ATOM 0 H SER A 15 6.812 23.333 23.688 1.00 0.00 H new ATOM 0 HA SER A 15 6.943 24.138 26.495 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.168 22.865 24.877 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.599 22.438 26.479 1.00 0.00 H new ATOM 0 HG SER A 15 7.865 20.862 25.013 1.00 0.00 H new ATOM 249 N VAL A 16 8.852 25.568 24.286 1.00 0.00 N ATOM 250 CA VAL A 16 9.800 26.685 24.090 1.00 0.00 C ATOM 251 C VAL A 16 9.150 28.012 24.361 1.00 0.00 C ATOM 252 O VAL A 16 9.758 28.955 24.866 1.00 0.00 O ATOM 253 CB VAL A 16 10.226 26.594 22.627 1.00 0.00 C ATOM 254 CG1 VAL A 16 11.257 27.663 22.336 1.00 0.00 C ATOM 255 CG2 VAL A 16 10.844 25.232 22.339 1.00 0.00 C ATOM 0 H VAL A 16 8.550 25.104 23.429 1.00 0.00 H new ATOM 0 HA VAL A 16 10.644 26.613 24.776 1.00 0.00 H new ATOM 0 HB VAL A 16 9.346 26.734 21.999 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.562 27.599 21.292 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.827 28.646 22.529 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.126 27.515 22.978 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.143 25.182 21.292 1.00 0.00 H new ATOM 0 HG22 VAL A 16 11.719 25.088 22.973 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.113 24.450 22.545 1.00 0.00 H new ATOM 265 N LEU A 17 7.936 28.096 24.021 1.00 0.00 N ATOM 266 CA LEU A 17 7.190 29.338 24.220 1.00 0.00 C ATOM 267 C LEU A 17 6.562 29.323 25.602 1.00 0.00 C ATOM 268 O LEU A 17 6.391 30.351 26.254 1.00 0.00 O ATOM 269 CB LEU A 17 6.141 29.259 23.135 1.00 0.00 C ATOM 270 CG LEU A 17 6.783 29.070 21.746 1.00 0.00 C ATOM 271 CD1 LEU A 17 5.959 29.824 20.721 1.00 0.00 C ATOM 272 CD2 LEU A 17 8.231 29.595 21.694 1.00 0.00 C ATOM 0 H LEU A 17 7.401 27.337 23.598 1.00 0.00 H new ATOM 0 HA LEU A 17 7.787 30.248 24.164 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.464 28.430 23.341 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.541 30.169 23.140 1.00 0.00 H new ATOM 0 HG LEU A 17 6.806 28.001 21.533 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.403 29.698 19.733 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.941 29.434 20.714 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.939 30.883 20.978 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.639 29.439 20.695 1.00 0.00 H new ATOM 0 HD22 LEU A 17 8.241 30.660 21.928 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.839 29.058 22.422 1.00 0.00 H new ATOM 284 N ALA A 18 6.232 28.157 26.048 1.00 0.00 N ATOM 285 CA ALA A 18 5.619 28.010 27.398 1.00 0.00 C ATOM 286 C ALA A 18 6.696 28.082 28.482 1.00 0.00 C ATOM 287 O ALA A 18 6.389 28.204 29.666 1.00 0.00 O ATOM 288 CB ALA A 18 4.953 26.634 27.411 1.00 0.00 C ATOM 0 H ALA A 18 6.359 27.284 25.535 1.00 0.00 H new ATOM 0 HA ALA A 18 4.902 28.806 27.597 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.483 26.466 28.380 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.196 26.589 26.628 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.704 25.864 27.234 1.00 0.00 H new ATOM 294 N ARG A 19 7.955 28.001 28.109 1.00 0.00 N ATOM 295 CA ARG A 19 9.041 28.056 29.122 1.00 0.00 C ATOM 296 C ARG A 19 8.961 26.834 30.013 1.00 0.00 C ATOM 297 O ARG A 19 9.185 26.898 31.218 1.00 0.00 O ATOM 298 CB ARG A 19 8.831 29.347 29.916 1.00 0.00 C ATOM 299 CG ARG A 19 8.461 30.497 28.972 1.00 0.00 C ATOM 300 CD ARG A 19 8.643 31.832 29.699 1.00 0.00 C ATOM 301 NE ARG A 19 7.700 31.776 30.853 1.00 0.00 N ATOM 302 CZ ARG A 19 6.407 31.912 30.672 1.00 0.00 C ATOM 303 NH1 ARG A 19 5.915 32.097 29.474 1.00 0.00 N ATOM 304 NH2 ARG A 19 5.603 31.859 31.699 1.00 0.00 N ATOM 0 H ARG A 19 8.269 27.899 27.144 1.00 0.00 H new ATOM 0 HA ARG A 19 10.030 28.056 28.665 1.00 0.00 H new ATOM 0 HB2 ARG A 19 8.041 29.204 30.653 1.00 0.00 H new ATOM 0 HB3 ARG A 19 9.739 29.596 30.465 1.00 0.00 H new ATOM 0 HG2 ARG A 19 9.089 30.467 28.081 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.429 30.390 28.638 1.00 0.00 H new ATOM 0 HD2 ARG A 19 9.672 31.961 30.036 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.415 32.672 29.044 1.00 0.00 H new ATOM 0 HE ARG A 19 8.064 31.630 31.795 1.00 0.00 H new ATOM 0 HH11 ARG A 19 6.538 32.137 28.667 1.00 0.00 H new ATOM 0 HH12 ARG A 19 4.908 32.201 29.347 1.00 0.00 H new ATOM 0 HH21 ARG A 19 5.981 31.713 32.635 1.00 0.00 H new ATOM 0 HH22 ARG A 19 4.597 31.964 31.565 1.00 0.00 H new ATOM 318 N ASP A 20 8.658 25.716 29.424 1.00 0.00 N ATOM 319 CA ASP A 20 8.573 24.462 30.201 1.00 0.00 C ATOM 320 C ASP A 20 9.975 24.033 30.649 1.00 0.00 C ATOM 321 O ASP A 20 10.788 23.607 29.830 1.00 0.00 O ATOM 322 CB ASP A 20 7.978 23.443 29.227 1.00 0.00 C ATOM 323 CG ASP A 20 7.572 22.179 29.985 1.00 0.00 C ATOM 324 OD1 ASP A 20 7.203 22.297 31.141 1.00 0.00 O ATOM 325 OD2 ASP A 20 7.633 21.114 29.393 1.00 0.00 O ATOM 0 H ASP A 20 8.464 25.620 28.427 1.00 0.00 H new ATOM 0 HA ASP A 20 7.969 24.563 31.103 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.111 23.871 28.724 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.706 23.197 28.454 1.00 0.00 H new ATOM 330 N PRO A 21 10.221 24.135 31.931 1.00 0.00 N ATOM 331 CA PRO A 21 11.535 23.728 32.492 1.00 0.00 C ATOM 332 C PRO A 21 11.658 22.203 32.447 1.00 0.00 C ATOM 333 O PRO A 21 12.597 21.617 32.981 1.00 0.00 O ATOM 334 CB PRO A 21 11.490 24.232 33.932 1.00 0.00 C ATOM 335 CG PRO A 21 10.037 24.317 34.265 1.00 0.00 C ATOM 336 CD PRO A 21 9.311 24.623 32.981 1.00 0.00 C ATOM 0 HA PRO A 21 12.387 24.129 31.944 1.00 0.00 H new ATOM 0 HB2 PRO A 21 12.010 23.551 34.605 1.00 0.00 H new ATOM 0 HB3 PRO A 21 11.974 25.204 34.025 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.684 23.379 34.694 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.856 25.095 35.006 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.346 24.118 32.938 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.118 25.691 32.877 1.00 0.00 H new ATOM 344 N ASN A 22 10.705 21.552 31.833 1.00 0.00 N ATOM 345 CA ASN A 22 10.710 20.085 31.755 1.00 0.00 C ATOM 346 C ASN A 22 11.181 19.660 30.382 1.00 0.00 C ATOM 347 O ASN A 22 11.519 18.502 30.139 1.00 0.00 O ATOM 348 CB ASN A 22 9.244 19.776 31.925 1.00 0.00 C ATOM 349 CG ASN A 22 8.999 18.305 31.664 1.00 0.00 C ATOM 350 OD1 ASN A 22 8.837 17.509 32.586 1.00 0.00 O ATOM 351 ND2 ASN A 22 8.967 17.904 30.430 1.00 0.00 N ATOM 0 H ASN A 22 9.910 21.998 31.375 1.00 0.00 H new ATOM 0 HA ASN A 22 11.356 19.586 32.477 1.00 0.00 H new ATOM 0 HB2 ASN A 22 8.923 20.035 32.934 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.653 20.381 31.237 1.00 0.00 H new ATOM 0 HD21 ASN A 22 8.806 16.919 30.218 1.00 0.00 H new ATOM 0 HD22 ASN A 22 9.103 18.573 29.673 1.00 0.00 H new ATOM 358 N ALA A 23 11.257 20.597 29.499 1.00 0.00 N ATOM 359 CA ALA A 23 11.764 20.289 28.147 1.00 0.00 C ATOM 360 C ALA A 23 13.129 20.930 27.995 1.00 0.00 C ATOM 361 O ALA A 23 13.842 20.735 27.005 1.00 0.00 O ATOM 362 CB ALA A 23 10.794 20.937 27.176 1.00 0.00 C ATOM 0 H ALA A 23 10.989 21.569 29.654 1.00 0.00 H new ATOM 0 HA ALA A 23 11.847 19.217 27.969 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.118 20.743 26.154 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.797 20.522 27.326 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.769 22.013 27.350 1.00 0.00 H new ATOM 368 N ASP A 24 13.505 21.684 28.983 1.00 0.00 N ATOM 369 CA ASP A 24 14.810 22.350 28.959 1.00 0.00 C ATOM 370 C ASP A 24 15.828 21.298 29.367 1.00 0.00 C ATOM 371 O ASP A 24 15.643 20.619 30.354 1.00 0.00 O ATOM 372 CB ASP A 24 14.662 23.462 30.006 1.00 0.00 C ATOM 373 CG ASP A 24 15.695 24.555 29.767 1.00 0.00 C ATOM 374 OD1 ASP A 24 16.373 24.478 28.765 1.00 0.00 O ATOM 375 OD2 ASP A 24 15.778 25.457 30.584 1.00 0.00 O ATOM 0 H ASP A 24 12.946 21.864 29.817 1.00 0.00 H new ATOM 0 HA ASP A 24 15.124 22.768 28.002 1.00 0.00 H new ATOM 0 HB2 ASP A 24 13.658 23.884 29.958 1.00 0.00 H new ATOM 0 HB3 ASP A 24 14.786 23.048 31.006 1.00 0.00 H new ATOM 380 N GLY A 25 16.856 21.101 28.601 1.00 0.00 N ATOM 381 CA GLY A 25 17.844 20.013 28.933 1.00 0.00 C ATOM 382 C GLY A 25 17.510 18.832 28.017 1.00 0.00 C ATOM 383 O GLY A 25 18.357 18.000 27.698 1.00 0.00 O ATOM 0 H GLY A 25 17.066 21.637 27.759 1.00 0.00 H new ATOM 0 HA2 GLY A 25 18.866 20.354 28.770 1.00 0.00 H new ATOM 0 HA3 GLY A 25 17.767 19.725 29.982 1.00 0.00 H new ATOM 387 N GLU A 26 16.274 18.770 27.572 1.00 0.00 N ATOM 388 CA GLU A 26 15.838 17.691 26.663 1.00 0.00 C ATOM 389 C GLU A 26 16.061 18.131 25.211 1.00 0.00 C ATOM 390 O GLU A 26 16.551 17.366 24.385 1.00 0.00 O ATOM 391 CB GLU A 26 14.348 17.507 26.953 1.00 0.00 C ATOM 392 CG GLU A 26 13.899 16.126 26.470 1.00 0.00 C ATOM 393 CD GLU A 26 14.586 15.049 27.312 1.00 0.00 C ATOM 394 OE1 GLU A 26 14.244 14.929 28.477 1.00 0.00 O ATOM 395 OE2 GLU A 26 15.443 14.365 26.778 1.00 0.00 O ATOM 0 H GLU A 26 15.545 19.441 27.813 1.00 0.00 H new ATOM 0 HA GLU A 26 16.390 16.763 26.810 1.00 0.00 H new ATOM 0 HB2 GLU A 26 14.160 17.609 28.022 1.00 0.00 H new ATOM 0 HB3 GLU A 26 13.771 18.284 26.452 1.00 0.00 H new ATOM 0 HG2 GLU A 26 12.816 16.033 26.553 1.00 0.00 H new ATOM 0 HG3 GLU A 26 14.150 15.997 25.417 1.00 0.00 H new ATOM 402 N PHE A 27 15.726 19.360 24.889 1.00 0.00 N ATOM 403 CA PHE A 27 15.945 19.854 23.491 1.00 0.00 C ATOM 404 C PHE A 27 16.202 21.351 23.472 1.00 0.00 C ATOM 405 O PHE A 27 16.020 22.062 24.459 1.00 0.00 O ATOM 406 CB PHE A 27 14.678 19.545 22.685 1.00 0.00 C ATOM 407 CG PHE A 27 13.569 20.550 22.972 1.00 0.00 C ATOM 408 CD1 PHE A 27 13.568 21.818 22.359 1.00 0.00 C ATOM 409 CD2 PHE A 27 12.525 20.196 23.827 1.00 0.00 C ATOM 410 CE1 PHE A 27 12.521 22.719 22.617 1.00 0.00 C ATOM 411 CE2 PHE A 27 11.476 21.095 24.077 1.00 0.00 C ATOM 412 CZ PHE A 27 11.475 22.350 23.474 1.00 0.00 C ATOM 0 H PHE A 27 15.313 20.038 25.530 1.00 0.00 H new ATOM 0 HA PHE A 27 16.817 19.361 23.063 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.912 19.555 21.621 1.00 0.00 H new ATOM 0 HB3 PHE A 27 14.330 18.540 22.925 1.00 0.00 H new ATOM 0 HD1 PHE A 27 14.370 22.097 21.692 1.00 0.00 H new ATOM 0 HD2 PHE A 27 12.524 19.225 24.299 1.00 0.00 H new ATOM 0 HE1 PHE A 27 12.522 23.695 22.155 1.00 0.00 H new ATOM 0 HE2 PHE A 27 10.669 20.813 24.737 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.667 23.040 23.667 1.00 0.00 H new ATOM 422 N VAL A 28 16.589 21.827 22.338 1.00 0.00 N ATOM 423 CA VAL A 28 16.842 23.278 22.158 1.00 0.00 C ATOM 424 C VAL A 28 16.081 23.726 20.947 1.00 0.00 C ATOM 425 O VAL A 28 15.527 22.913 20.212 1.00 0.00 O ATOM 426 CB VAL A 28 18.342 23.447 21.892 1.00 0.00 C ATOM 427 CG1 VAL A 28 19.078 22.191 22.307 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.603 23.665 20.405 1.00 0.00 C ATOM 0 H VAL A 28 16.746 21.262 21.504 1.00 0.00 H new ATOM 0 HA VAL A 28 16.537 23.855 23.031 1.00 0.00 H new ATOM 0 HB VAL A 28 18.689 24.309 22.462 1.00 0.00 H new ATOM 0 HG11 VAL A 28 20.144 22.314 22.117 1.00 0.00 H new ATOM 0 HG12 VAL A 28 18.918 22.010 23.370 1.00 0.00 H new ATOM 0 HG13 VAL A 28 18.703 21.343 21.734 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.674 23.783 20.237 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.240 22.805 19.842 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.083 24.563 20.072 1.00 0.00 H new ATOM 438 N PHE A 29 16.101 24.979 20.673 1.00 0.00 N ATOM 439 CA PHE A 29 15.430 25.429 19.449 1.00 0.00 C ATOM 440 C PHE A 29 16.289 26.464 18.763 1.00 0.00 C ATOM 441 O PHE A 29 16.668 27.481 19.333 1.00 0.00 O ATOM 442 CB PHE A 29 14.041 25.907 19.853 1.00 0.00 C ATOM 443 CG PHE A 29 13.949 27.417 20.038 1.00 0.00 C ATOM 444 CD1 PHE A 29 13.726 28.253 18.934 1.00 0.00 C ATOM 445 CD2 PHE A 29 14.006 27.971 21.325 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.572 29.638 19.120 1.00 0.00 C ATOM 447 CE2 PHE A 29 13.843 29.354 21.504 1.00 0.00 C ATOM 448 CZ PHE A 29 13.626 30.182 20.404 1.00 0.00 C ATOM 0 H PHE A 29 16.546 25.705 21.234 1.00 0.00 H new ATOM 0 HA PHE A 29 15.299 24.637 18.711 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.323 25.597 19.093 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.752 25.417 20.783 1.00 0.00 H new ATOM 0 HD1 PHE A 29 13.673 27.833 17.941 1.00 0.00 H new ATOM 0 HD2 PHE A 29 14.176 27.333 22.180 1.00 0.00 H new ATOM 0 HE1 PHE A 29 13.412 30.282 18.268 1.00 0.00 H new ATOM 0 HE2 PHE A 29 13.886 29.777 22.497 1.00 0.00 H new ATOM 0 HZ PHE A 29 13.500 31.245 20.545 1.00 0.00 H new ATOM 458 N ALA A 30 16.652 26.158 17.561 1.00 0.00 N ATOM 459 CA ALA A 30 17.572 27.043 16.796 1.00 0.00 C ATOM 460 C ALA A 30 16.848 27.941 15.804 1.00 0.00 C ATOM 461 O ALA A 30 16.286 27.489 14.809 1.00 0.00 O ATOM 462 CB ALA A 30 18.504 26.087 16.055 1.00 0.00 C ATOM 0 H ALA A 30 16.349 25.321 17.063 1.00 0.00 H new ATOM 0 HA ALA A 30 18.094 27.723 17.469 1.00 0.00 H new ATOM 0 HB1 ALA A 30 19.218 26.660 15.463 1.00 0.00 H new ATOM 0 HB2 ALA A 30 19.042 25.471 16.776 1.00 0.00 H new ATOM 0 HB3 ALA A 30 17.919 25.446 15.396 1.00 0.00 H new ATOM 468 N VAL A 31 16.897 29.217 16.047 1.00 0.00 N ATOM 469 CA VAL A 31 16.268 30.190 15.121 1.00 0.00 C ATOM 470 C VAL A 31 17.308 30.528 14.038 1.00 0.00 C ATOM 471 O VAL A 31 18.280 31.247 14.287 1.00 0.00 O ATOM 472 CB VAL A 31 15.965 31.417 15.984 1.00 0.00 C ATOM 473 CG1 VAL A 31 14.891 32.264 15.317 1.00 0.00 C ATOM 474 CG2 VAL A 31 15.469 30.981 17.354 1.00 0.00 C ATOM 0 H VAL A 31 17.353 29.632 16.860 1.00 0.00 H new ATOM 0 HA VAL A 31 15.364 29.824 14.635 1.00 0.00 H new ATOM 0 HB VAL A 31 16.879 32.000 16.095 1.00 0.00 H new ATOM 0 HG11 VAL A 31 14.679 33.136 15.936 1.00 0.00 H new ATOM 0 HG12 VAL A 31 15.241 32.590 14.338 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.983 31.673 15.199 1.00 0.00 H new ATOM 0 HG21 VAL A 31 15.256 31.861 17.961 1.00 0.00 H new ATOM 0 HG22 VAL A 31 14.560 30.390 17.241 1.00 0.00 H new ATOM 0 HG23 VAL A 31 16.235 30.379 17.844 1.00 0.00 H new ATOM 484 N ARG A 32 17.132 29.997 12.860 1.00 0.00 N ATOM 485 CA ARG A 32 18.095 30.239 11.745 1.00 0.00 C ATOM 486 C ARG A 32 18.101 31.705 11.329 1.00 0.00 C ATOM 487 O ARG A 32 19.038 32.199 10.705 1.00 0.00 O ATOM 488 CB ARG A 32 17.500 29.446 10.600 1.00 0.00 C ATOM 489 CG ARG A 32 17.866 27.968 10.731 1.00 0.00 C ATOM 490 CD ARG A 32 17.689 27.276 9.378 1.00 0.00 C ATOM 491 NE ARG A 32 16.223 27.329 9.107 1.00 0.00 N ATOM 492 CZ ARG A 32 15.391 26.557 9.764 1.00 0.00 C ATOM 493 NH1 ARG A 32 15.826 25.722 10.672 1.00 0.00 N ATOM 494 NH2 ARG A 32 14.113 26.623 9.508 1.00 0.00 N ATOM 0 H ARG A 32 16.346 29.394 12.617 1.00 0.00 H new ATOM 0 HA ARG A 32 19.113 29.967 12.023 1.00 0.00 H new ATOM 0 HB2 ARG A 32 16.416 29.560 10.595 1.00 0.00 H new ATOM 0 HB3 ARG A 32 17.866 29.835 9.650 1.00 0.00 H new ATOM 0 HG2 ARG A 32 18.897 27.866 11.071 1.00 0.00 H new ATOM 0 HG3 ARG A 32 17.234 27.491 11.481 1.00 0.00 H new ATOM 0 HD2 ARG A 32 18.254 27.786 8.597 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.048 26.247 9.411 1.00 0.00 H new ATOM 0 HE ARG A 32 15.864 27.973 8.403 1.00 0.00 H new ATOM 0 HH11 ARG A 32 16.824 25.665 10.877 1.00 0.00 H new ATOM 0 HH12 ARG A 32 15.168 25.127 11.175 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.767 27.272 8.801 1.00 0.00 H new ATOM 0 HH22 ARG A 32 13.460 26.026 10.015 1.00 0.00 H new ATOM 508 N THR A 33 17.063 32.393 11.666 1.00 0.00 N ATOM 509 CA THR A 33 16.958 33.837 11.307 1.00 0.00 C ATOM 510 C THR A 33 18.040 34.614 12.043 1.00 0.00 C ATOM 511 O THR A 33 18.545 35.631 11.571 1.00 0.00 O ATOM 512 CB THR A 33 15.561 34.259 11.778 1.00 0.00 C ATOM 513 OG1 THR A 33 15.169 35.440 11.093 1.00 0.00 O ATOM 514 CG2 THR A 33 15.564 34.529 13.286 1.00 0.00 C ATOM 0 H THR A 33 16.266 32.020 12.182 1.00 0.00 H new ATOM 0 HA THR A 33 17.092 34.025 10.242 1.00 0.00 H new ATOM 0 HB THR A 33 14.860 33.453 11.563 1.00 0.00 H new ATOM 0 HG1 THR A 33 14.276 35.710 11.392 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.565 34.827 13.604 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.859 33.624 13.817 1.00 0.00 H new ATOM 0 HG23 THR A 33 16.270 35.328 13.511 1.00 0.00 H new ATOM 522 N THR A 34 18.401 34.137 13.197 1.00 0.00 N ATOM 523 CA THR A 34 19.460 34.827 13.994 1.00 0.00 C ATOM 524 C THR A 34 20.649 33.889 14.222 1.00 0.00 C ATOM 525 O THR A 34 21.674 34.286 14.774 1.00 0.00 O ATOM 526 CB THR A 34 18.797 35.184 15.327 1.00 0.00 C ATOM 527 OG1 THR A 34 19.702 35.944 16.115 1.00 0.00 O ATOM 528 CG2 THR A 34 18.424 33.903 16.071 1.00 0.00 C ATOM 0 H THR A 34 18.011 33.299 13.628 1.00 0.00 H new ATOM 0 HA THR A 34 19.844 35.710 13.483 1.00 0.00 H new ATOM 0 HB THR A 34 17.896 35.769 15.140 1.00 0.00 H new ATOM 0 HG1 THR A 34 20.622 35.695 15.888 1.00 0.00 H new ATOM 0 HG21 THR A 34 17.952 34.158 17.020 1.00 0.00 H new ATOM 0 HG22 THR A 34 17.730 33.320 15.466 1.00 0.00 H new ATOM 0 HG23 THR A 34 19.323 33.316 16.259 1.00 0.00 H new ATOM 536 N GLY A 35 20.533 32.655 13.812 1.00 0.00 N ATOM 537 CA GLY A 35 21.650 31.698 14.011 1.00 0.00 C ATOM 538 C GLY A 35 21.800 31.393 15.501 1.00 0.00 C ATOM 539 O GLY A 35 22.899 31.133 15.983 1.00 0.00 O ATOM 0 H GLY A 35 19.710 32.271 13.347 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.458 30.778 13.458 1.00 0.00 H new ATOM 0 HA3 GLY A 35 22.577 32.118 13.620 1.00 0.00 H new ATOM 543 N ILE A 36 20.720 31.405 16.241 1.00 0.00 N ATOM 544 CA ILE A 36 20.825 31.097 17.703 1.00 0.00 C ATOM 545 C ILE A 36 19.970 29.881 18.018 1.00 0.00 C ATOM 546 O ILE A 36 19.086 29.510 17.256 1.00 0.00 O ATOM 547 CB ILE A 36 20.223 32.298 18.457 1.00 0.00 C ATOM 548 CG1 ILE A 36 21.110 33.529 18.325 1.00 0.00 C ATOM 549 CG2 ILE A 36 20.094 31.967 19.960 1.00 0.00 C ATOM 550 CD1 ILE A 36 20.419 34.692 19.044 1.00 0.00 C ATOM 0 H ILE A 36 19.780 31.612 15.903 1.00 0.00 H new ATOM 0 HA ILE A 36 21.861 30.910 17.986 1.00 0.00 H new ATOM 0 HB ILE A 36 19.245 32.502 18.021 1.00 0.00 H new ATOM 0 HG12 ILE A 36 22.091 33.340 18.762 1.00 0.00 H new ATOM 0 HG13 ILE A 36 21.270 33.772 17.275 1.00 0.00 H new ATOM 0 HG21 ILE A 36 19.668 32.822 20.485 1.00 0.00 H new ATOM 0 HG22 ILE A 36 19.444 31.101 20.087 1.00 0.00 H new ATOM 0 HG23 ILE A 36 21.079 31.744 20.369 1.00 0.00 H new ATOM 0 HD11 ILE A 36 21.036 35.587 18.964 1.00 0.00 H new ATOM 0 HD12 ILE A 36 19.448 34.878 18.585 1.00 0.00 H new ATOM 0 HD13 ILE A 36 20.281 34.439 20.095 1.00 0.00 H new ATOM 562 N PHE A 37 20.170 29.310 19.160 1.00 0.00 N ATOM 563 CA PHE A 37 19.318 28.178 19.588 1.00 0.00 C ATOM 564 C PHE A 37 19.210 28.233 21.097 1.00 0.00 C ATOM 565 O PHE A 37 20.205 28.185 21.819 1.00 0.00 O ATOM 566 CB PHE A 37 19.963 26.883 19.084 1.00 0.00 C ATOM 567 CG PHE A 37 21.016 26.386 20.031 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.629 25.702 21.184 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.368 26.571 19.742 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.590 25.197 22.051 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.333 26.073 20.615 1.00 0.00 C ATOM 572 CZ PHE A 37 22.942 25.380 21.770 1.00 0.00 C ATOM 0 H PHE A 37 20.895 29.580 19.825 1.00 0.00 H new ATOM 0 HA PHE A 37 18.310 28.226 19.176 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.196 26.119 18.958 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.406 27.054 18.103 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.580 25.565 21.403 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.665 27.097 18.847 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.289 24.664 22.941 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.382 26.221 20.402 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.690 24.988 22.443 1.00 0.00 H new ATOM 596 N ARG A 39 16.970 27.403 24.907 1.00 0.00 N ATOM 597 CA ARG A 39 16.278 26.345 25.616 1.00 0.00 C ATOM 598 C ARG A 39 14.791 26.630 25.427 1.00 0.00 C ATOM 599 O ARG A 39 14.437 27.696 24.926 1.00 0.00 O ATOM 600 CB ARG A 39 16.730 26.571 27.048 1.00 0.00 C ATOM 601 CG ARG A 39 18.015 25.771 27.311 1.00 0.00 C ATOM 602 CD ARG A 39 18.552 26.076 28.719 1.00 0.00 C ATOM 603 NE ARG A 39 18.375 27.548 28.901 1.00 0.00 N ATOM 604 CZ ARG A 39 17.922 28.040 30.031 1.00 0.00 C ATOM 605 NH1 ARG A 39 17.612 27.258 31.035 1.00 0.00 N ATOM 606 NH2 ARG A 39 17.779 29.331 30.158 1.00 0.00 N ATOM 0 HA ARG A 39 16.470 25.320 25.299 1.00 0.00 H new ATOM 0 HB2 ARG A 39 16.908 27.632 27.221 1.00 0.00 H new ATOM 0 HB3 ARG A 39 15.948 26.261 27.741 1.00 0.00 H new ATOM 0 HG2 ARG A 39 17.814 24.704 27.214 1.00 0.00 H new ATOM 0 HG3 ARG A 39 18.768 26.023 26.564 1.00 0.00 H new ATOM 0 HD2 ARG A 39 18.004 25.518 29.478 1.00 0.00 H new ATOM 0 HD3 ARG A 39 19.601 25.792 28.810 1.00 0.00 H new ATOM 0 HE ARG A 39 18.610 28.181 28.136 1.00 0.00 H new ATOM 0 HH11 ARG A 39 17.721 26.248 30.947 1.00 0.00 H new ATOM 0 HH12 ARG A 39 17.262 27.659 31.905 1.00 0.00 H new ATOM 0 HH21 ARG A 39 18.018 29.949 29.383 1.00 0.00 H new ATOM 0 HH22 ARG A 39 17.428 29.722 31.032 1.00 0.00 H new ATOM 620 N PRO A 40 13.955 25.720 25.800 1.00 0.00 N ATOM 621 CA PRO A 40 12.514 25.958 25.623 1.00 0.00 C ATOM 622 C PRO A 40 12.033 27.075 26.552 1.00 0.00 C ATOM 623 O PRO A 40 10.915 27.567 26.427 1.00 0.00 O ATOM 624 CB PRO A 40 11.879 24.619 25.977 1.00 0.00 C ATOM 625 CG PRO A 40 12.877 23.943 26.857 1.00 0.00 C ATOM 626 CD PRO A 40 14.236 24.422 26.414 1.00 0.00 C ATOM 0 HA PRO A 40 12.253 26.284 24.616 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.928 24.756 26.491 1.00 0.00 H new ATOM 0 HB3 PRO A 40 11.676 24.029 25.083 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.701 24.191 27.904 1.00 0.00 H new ATOM 0 HG3 PRO A 40 12.800 22.859 26.769 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.923 24.516 27.255 1.00 0.00 H new ATOM 0 HD3 PRO A 40 14.693 23.732 25.704 1.00 0.00 H new ATOM 634 N SER A 41 12.832 27.470 27.501 1.00 0.00 N ATOM 635 CA SER A 41 12.393 28.518 28.431 1.00 0.00 C ATOM 636 C SER A 41 13.236 29.811 28.320 1.00 0.00 C ATOM 637 O SER A 41 13.391 30.537 29.300 1.00 0.00 O ATOM 638 CB SER A 41 12.504 27.837 29.794 1.00 0.00 C ATOM 639 OG SER A 41 13.870 27.770 30.182 1.00 0.00 O ATOM 0 H SER A 41 13.770 27.105 27.665 1.00 0.00 H new ATOM 0 HA SER A 41 11.384 28.875 28.225 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.931 28.392 30.537 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.079 26.834 29.747 1.00 0.00 H new ATOM 0 HG SER A 41 14.153 26.833 30.222 1.00 0.00 H new ATOM 645 N CYS A 42 13.767 30.136 27.151 1.00 0.00 N ATOM 646 CA CYS A 42 14.562 31.402 27.020 1.00 0.00 C ATOM 647 C CYS A 42 13.730 32.588 27.499 1.00 0.00 C ATOM 648 O CYS A 42 12.559 32.741 27.155 1.00 0.00 O ATOM 649 CB CYS A 42 14.882 31.595 25.542 1.00 0.00 C ATOM 650 SG CYS A 42 15.927 33.075 25.371 1.00 0.00 S ATOM 0 H CYS A 42 13.682 29.584 26.298 1.00 0.00 H new ATOM 0 HA CYS A 42 15.471 31.339 27.617 1.00 0.00 H new ATOM 0 HB2 CYS A 42 15.397 30.719 25.148 1.00 0.00 H new ATOM 0 HB3 CYS A 42 13.963 31.710 24.967 1.00 0.00 H new ATOM 0 HG CYS A 42 17.133 32.804 25.775 1.00 0.00 H new ATOM 655 N ARG A 43 14.323 33.417 28.283 1.00 0.00 N ATOM 656 CA ARG A 43 13.604 34.613 28.815 1.00 0.00 C ATOM 657 C ARG A 43 13.974 35.902 28.059 1.00 0.00 C ATOM 658 O ARG A 43 13.615 36.995 28.489 1.00 0.00 O ATOM 659 CB ARG A 43 14.032 34.706 30.280 1.00 0.00 C ATOM 660 CG ARG A 43 15.530 35.014 30.371 1.00 0.00 C ATOM 661 CD ARG A 43 15.736 36.528 30.468 1.00 0.00 C ATOM 662 NE ARG A 43 16.661 36.865 29.350 1.00 0.00 N ATOM 663 CZ ARG A 43 16.761 38.095 28.913 1.00 0.00 C ATOM 664 NH1 ARG A 43 16.052 39.055 29.449 1.00 0.00 N ATOM 665 NH2 ARG A 43 17.578 38.367 27.933 1.00 0.00 N ATOM 0 H ARG A 43 15.291 33.327 28.591 1.00 0.00 H new ATOM 0 HA ARG A 43 12.526 34.508 28.696 1.00 0.00 H new ATOM 0 HB2 ARG A 43 13.461 35.485 30.785 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.814 33.768 30.791 1.00 0.00 H new ATOM 0 HG2 ARG A 43 15.961 34.521 31.243 1.00 0.00 H new ATOM 0 HG3 ARG A 43 16.047 34.622 29.495 1.00 0.00 H new ATOM 0 HD2 ARG A 43 14.790 37.062 30.372 1.00 0.00 H new ATOM 0 HD3 ARG A 43 16.163 36.807 31.431 1.00 0.00 H new ATOM 0 HE ARG A 43 17.222 36.130 28.920 1.00 0.00 H new ATOM 0 HH11 ARG A 43 15.412 38.849 30.216 1.00 0.00 H new ATOM 0 HH12 ARG A 43 16.139 40.009 29.100 1.00 0.00 H new ATOM 0 HH21 ARG A 43 18.134 37.623 27.512 1.00 0.00 H new ATOM 0 HH22 ARG A 43 17.660 39.323 27.588 1.00 0.00 H new ATOM 679 N ALA A 44 14.712 35.824 26.979 1.00 0.00 N ATOM 680 CA ALA A 44 15.108 37.096 26.287 1.00 0.00 C ATOM 681 C ALA A 44 14.073 37.554 25.257 1.00 0.00 C ATOM 682 O ALA A 44 13.638 38.704 25.267 1.00 0.00 O ATOM 683 CB ALA A 44 16.431 36.767 25.596 1.00 0.00 C ATOM 0 H ALA A 44 15.051 34.961 26.553 1.00 0.00 H new ATOM 0 HA ALA A 44 15.188 37.916 27.001 1.00 0.00 H new ATOM 0 HB1 ALA A 44 16.792 37.647 25.064 1.00 0.00 H new ATOM 0 HB2 ALA A 44 17.167 36.467 26.342 1.00 0.00 H new ATOM 0 HB3 ALA A 44 16.279 35.952 24.888 1.00 0.00 H new ATOM 689 N ARG A 45 13.673 36.683 24.383 1.00 0.00 N ATOM 690 CA ARG A 45 12.661 37.047 23.333 1.00 0.00 C ATOM 691 C ARG A 45 12.520 35.830 22.397 1.00 0.00 C ATOM 692 O ARG A 45 13.226 34.837 22.568 1.00 0.00 O ATOM 693 CB ARG A 45 13.249 38.277 22.601 1.00 0.00 C ATOM 694 CG ARG A 45 12.137 39.059 21.881 1.00 0.00 C ATOM 695 CD ARG A 45 11.883 40.386 22.620 1.00 0.00 C ATOM 696 NE ARG A 45 12.579 41.445 21.814 1.00 0.00 N ATOM 697 CZ ARG A 45 12.014 41.953 20.745 1.00 0.00 C ATOM 698 NH1 ARG A 45 10.832 41.549 20.352 1.00 0.00 N ATOM 699 NH2 ARG A 45 12.638 42.873 20.062 1.00 0.00 N ATOM 0 H ARG A 45 14.002 35.718 24.342 1.00 0.00 H new ATOM 0 HA ARG A 45 11.673 37.290 23.725 1.00 0.00 H new ATOM 0 HB2 ARG A 45 13.753 38.926 23.317 1.00 0.00 H new ATOM 0 HB3 ARG A 45 14.000 37.954 21.880 1.00 0.00 H new ATOM 0 HG2 ARG A 45 12.425 39.255 20.848 1.00 0.00 H new ATOM 0 HG3 ARG A 45 11.223 38.467 21.850 1.00 0.00 H new ATOM 0 HD2 ARG A 45 10.815 40.592 22.697 1.00 0.00 H new ATOM 0 HD3 ARG A 45 12.275 40.348 23.637 1.00 0.00 H new ATOM 0 HE ARG A 45 13.501 41.773 22.101 1.00 0.00 H new ATOM 0 HH11 ARG A 45 10.338 40.830 20.879 1.00 0.00 H new ATOM 0 HH12 ARG A 45 10.406 41.954 19.518 1.00 0.00 H new ATOM 0 HH21 ARG A 45 13.559 43.193 20.360 1.00 0.00 H new ATOM 0 HH22 ARG A 45 12.204 43.272 19.230 1.00 0.00 H new ATOM 713 N HIS A 46 11.624 35.847 21.440 1.00 0.00 N ATOM 714 CA HIS A 46 11.472 34.643 20.561 1.00 0.00 C ATOM 715 C HIS A 46 11.240 34.972 19.096 1.00 0.00 C ATOM 716 O HIS A 46 10.760 36.039 18.734 1.00 0.00 O ATOM 717 CB HIS A 46 10.235 33.938 21.073 1.00 0.00 C ATOM 718 CG HIS A 46 10.612 32.949 22.117 1.00 0.00 C ATOM 719 ND1 HIS A 46 10.711 31.608 21.827 1.00 0.00 N ATOM 720 CD2 HIS A 46 10.865 33.069 23.456 1.00 0.00 C ATOM 721 CE1 HIS A 46 10.990 30.974 22.962 1.00 0.00 C ATOM 722 NE2 HIS A 46 11.102 31.812 23.995 1.00 0.00 N ATOM 0 H HIS A 46 11.001 36.627 21.231 1.00 0.00 H new ATOM 0 HA HIS A 46 12.390 34.057 20.603 1.00 0.00 H new ATOM 0 HB2 HIS A 46 9.535 34.665 21.485 1.00 0.00 H new ATOM 0 HB3 HIS A 46 9.726 33.436 20.251 1.00 0.00 H new ATOM 0 HD1 HIS A 46 10.592 31.179 20.909 1.00 0.00 H new ATOM 0 HD2 HIS A 46 10.878 33.997 24.008 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.112 29.904 23.039 1.00 0.00 H new ATOM 730 N ALA A 47 11.514 34.010 18.265 1.00 0.00 N ATOM 731 CA ALA A 47 11.280 34.150 16.812 1.00 0.00 C ATOM 732 C ALA A 47 10.295 33.065 16.368 1.00 0.00 C ATOM 733 O ALA A 47 10.118 32.055 17.045 1.00 0.00 O ATOM 734 CB ALA A 47 12.645 33.955 16.157 1.00 0.00 C ATOM 0 H ALA A 47 11.901 33.109 18.545 1.00 0.00 H new ATOM 0 HA ALA A 47 10.855 35.116 16.538 1.00 0.00 H new ATOM 0 HB1 ALA A 47 12.546 34.046 15.075 1.00 0.00 H new ATOM 0 HB2 ALA A 47 13.336 34.714 16.523 1.00 0.00 H new ATOM 0 HB3 ALA A 47 13.029 32.965 16.404 1.00 0.00 H new ATOM 740 N LEU A 48 9.626 33.261 15.267 1.00 0.00 N ATOM 741 CA LEU A 48 8.633 32.264 14.805 1.00 0.00 C ATOM 742 C LEU A 48 9.216 30.846 14.748 1.00 0.00 C ATOM 743 O LEU A 48 10.421 30.648 14.605 1.00 0.00 O ATOM 744 CB LEU A 48 8.223 32.730 13.408 1.00 0.00 C ATOM 745 CG LEU A 48 7.351 33.980 13.522 1.00 0.00 C ATOM 746 CD1 LEU A 48 7.654 34.926 12.358 1.00 0.00 C ATOM 747 CD2 LEU A 48 5.875 33.578 13.477 1.00 0.00 C ATOM 0 H LEU A 48 9.729 34.078 14.665 1.00 0.00 H new ATOM 0 HA LEU A 48 7.790 32.206 15.494 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.109 32.945 12.810 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.677 31.938 12.895 1.00 0.00 H new ATOM 0 HG LEU A 48 7.565 34.484 14.465 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.031 35.817 12.441 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.705 35.214 12.387 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.442 34.422 11.415 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.253 34.469 13.558 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.664 33.073 12.534 1.00 0.00 H new ATOM 0 HD23 LEU A 48 5.656 32.905 14.306 1.00 0.00 H new ATOM 759 N ARG A 49 8.362 29.858 14.832 1.00 0.00 N ATOM 760 CA ARG A 49 8.814 28.435 14.759 1.00 0.00 C ATOM 761 C ARG A 49 9.470 28.202 13.407 1.00 0.00 C ATOM 762 O ARG A 49 10.369 27.384 13.232 1.00 0.00 O ATOM 763 CB ARG A 49 7.513 27.658 14.804 1.00 0.00 C ATOM 764 CG ARG A 49 7.771 26.216 15.253 1.00 0.00 C ATOM 765 CD ARG A 49 7.343 25.241 14.150 1.00 0.00 C ATOM 766 NE ARG A 49 8.617 24.670 13.622 1.00 0.00 N ATOM 767 CZ ARG A 49 8.611 23.582 12.890 1.00 0.00 C ATOM 768 NH1 ARG A 49 7.486 22.974 12.606 1.00 0.00 N ATOM 769 NH2 ARG A 49 9.737 23.100 12.440 1.00 0.00 N ATOM 0 H ARG A 49 7.356 29.979 14.950 1.00 0.00 H new ATOM 0 HA ARG A 49 9.519 28.158 15.543 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.817 28.141 15.490 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.045 27.662 13.820 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.828 26.080 15.480 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.219 26.007 16.169 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.694 24.459 14.545 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.785 25.753 13.366 1.00 0.00 H new ATOM 0 HE ARG A 49 9.502 25.131 13.833 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.603 23.346 12.955 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.493 22.128 12.036 1.00 0.00 H new ATOM 0 HH21 ARG A 49 10.616 23.569 12.658 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.738 22.254 11.870 1.00 0.00 H new ATOM 783 N GLU A 50 8.992 28.938 12.458 1.00 0.00 N ATOM 784 CA GLU A 50 9.471 28.883 11.062 1.00 0.00 C ATOM 785 C GLU A 50 10.982 28.727 10.980 1.00 0.00 C ATOM 786 O GLU A 50 11.507 27.741 10.465 1.00 0.00 O ATOM 787 CB GLU A 50 9.067 30.253 10.557 1.00 0.00 C ATOM 788 CG GLU A 50 9.124 30.272 9.058 1.00 0.00 C ATOM 789 CD GLU A 50 10.573 30.388 8.582 1.00 0.00 C ATOM 790 OE1 GLU A 50 11.054 31.503 8.478 1.00 0.00 O ATOM 791 OE2 GLU A 50 11.176 29.359 8.325 1.00 0.00 O ATOM 0 H GLU A 50 8.244 29.615 12.605 1.00 0.00 H new ATOM 0 HA GLU A 50 9.067 28.040 10.501 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.060 30.494 10.896 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.732 31.014 10.966 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.675 29.363 8.659 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.541 31.110 8.676 1.00 0.00 H new ATOM 798 N ASN A 51 11.680 29.690 11.488 1.00 0.00 N ATOM 799 CA ASN A 51 13.165 29.639 11.470 1.00 0.00 C ATOM 800 C ASN A 51 13.648 28.969 12.741 1.00 0.00 C ATOM 801 O ASN A 51 14.796 29.086 13.128 1.00 0.00 O ATOM 802 CB ASN A 51 13.602 31.102 11.474 1.00 0.00 C ATOM 803 CG ASN A 51 13.219 31.767 10.152 1.00 0.00 C ATOM 804 OD1 ASN A 51 13.604 31.304 9.081 1.00 0.00 O ATOM 805 ND2 ASN A 51 12.474 32.839 10.175 1.00 0.00 N ATOM 0 H ASN A 51 11.284 30.524 11.922 1.00 0.00 H new ATOM 0 HA ASN A 51 13.560 29.088 10.616 1.00 0.00 H new ATOM 0 HB2 ASN A 51 13.132 31.628 12.305 1.00 0.00 H new ATOM 0 HB3 ASN A 51 14.680 31.168 11.625 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.210 33.295 9.302 1.00 0.00 H new ATOM 0 HD22 ASN A 51 12.156 33.220 11.066 1.00 0.00 H new ATOM 812 N VAL A 52 12.778 28.282 13.402 1.00 0.00 N ATOM 813 CA VAL A 52 13.158 27.618 14.670 1.00 0.00 C ATOM 814 C VAL A 52 13.132 26.089 14.522 1.00 0.00 C ATOM 815 O VAL A 52 12.124 25.502 14.131 1.00 0.00 O ATOM 816 CB VAL A 52 12.084 28.103 15.645 1.00 0.00 C ATOM 817 CG1 VAL A 52 11.816 27.049 16.713 1.00 0.00 C ATOM 818 CG2 VAL A 52 12.552 29.391 16.321 1.00 0.00 C ATOM 0 H VAL A 52 11.808 28.148 13.118 1.00 0.00 H new ATOM 0 HA VAL A 52 14.170 27.856 14.997 1.00 0.00 H new ATOM 0 HB VAL A 52 11.166 28.286 15.087 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.049 27.412 17.398 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.473 26.129 16.239 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.733 26.851 17.267 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.786 29.736 17.016 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.477 29.201 16.866 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.727 30.156 15.565 1.00 0.00 H new ATOM 828 N SER A 53 14.213 25.438 14.856 1.00 0.00 N ATOM 829 CA SER A 53 14.258 23.954 14.775 1.00 0.00 C ATOM 830 C SER A 53 14.575 23.401 16.160 1.00 0.00 C ATOM 831 O SER A 53 14.791 24.158 17.097 1.00 0.00 O ATOM 832 CB SER A 53 15.375 23.629 13.788 1.00 0.00 C ATOM 833 OG SER A 53 16.471 24.508 14.009 1.00 0.00 O ATOM 0 H SER A 53 15.073 25.877 15.184 1.00 0.00 H new ATOM 0 HA SER A 53 13.315 23.516 14.448 1.00 0.00 H new ATOM 0 HB2 SER A 53 15.694 22.594 13.911 1.00 0.00 H new ATOM 0 HB3 SER A 53 15.013 23.732 12.765 1.00 0.00 H new ATOM 0 HG SER A 53 17.190 24.300 13.377 1.00 0.00 H new ATOM 839 N PHE A 54 14.567 22.109 16.326 1.00 0.00 N ATOM 840 CA PHE A 54 14.823 21.538 17.653 1.00 0.00 C ATOM 841 C PHE A 54 16.024 20.606 17.641 1.00 0.00 C ATOM 842 O PHE A 54 16.348 19.967 16.642 1.00 0.00 O ATOM 843 CB PHE A 54 13.549 20.786 17.950 1.00 0.00 C ATOM 844 CG PHE A 54 12.429 21.785 17.952 1.00 0.00 C ATOM 845 CD1 PHE A 54 12.330 22.710 18.995 1.00 0.00 C ATOM 846 CD2 PHE A 54 11.522 21.824 16.889 1.00 0.00 C ATOM 847 CE1 PHE A 54 11.325 23.677 18.976 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.510 22.785 16.874 1.00 0.00 C ATOM 849 CZ PHE A 54 10.415 23.712 17.916 1.00 0.00 C ATOM 0 H PHE A 54 14.392 21.428 15.587 1.00 0.00 H new ATOM 0 HA PHE A 54 15.062 22.293 18.401 1.00 0.00 H new ATOM 0 HB2 PHE A 54 13.374 20.015 17.200 1.00 0.00 H new ATOM 0 HB3 PHE A 54 13.616 20.283 18.914 1.00 0.00 H new ATOM 0 HD1 PHE A 54 13.031 22.676 19.815 1.00 0.00 H new ATOM 0 HD2 PHE A 54 11.604 21.112 16.081 1.00 0.00 H new ATOM 0 HE1 PHE A 54 11.250 24.396 19.778 1.00 0.00 H new ATOM 0 HE2 PHE A 54 9.802 22.812 16.059 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.635 24.459 17.902 1.00 0.00 H new ATOM 859 N TYR A 55 16.681 20.533 18.751 1.00 0.00 N ATOM 860 CA TYR A 55 17.880 19.661 18.875 1.00 0.00 C ATOM 861 C TYR A 55 17.776 18.826 20.139 1.00 0.00 C ATOM 862 O TYR A 55 17.129 19.223 21.102 1.00 0.00 O ATOM 863 CB TYR A 55 19.053 20.630 19.002 1.00 0.00 C ATOM 864 CG TYR A 55 19.275 21.307 17.679 1.00 0.00 C ATOM 865 CD1 TYR A 55 18.410 22.324 17.266 1.00 0.00 C ATOM 866 CD2 TYR A 55 20.331 20.906 16.860 1.00 0.00 C ATOM 867 CE1 TYR A 55 18.602 22.942 16.027 1.00 0.00 C ATOM 868 CE2 TYR A 55 20.528 21.525 15.621 1.00 0.00 C ATOM 869 CZ TYR A 55 19.661 22.543 15.202 1.00 0.00 C ATOM 870 OH TYR A 55 19.851 23.152 13.978 1.00 0.00 O ATOM 0 H TYR A 55 16.438 21.048 19.597 1.00 0.00 H new ATOM 0 HA TYR A 55 17.988 18.980 18.031 1.00 0.00 H new ATOM 0 HB2 TYR A 55 18.847 21.371 19.774 1.00 0.00 H new ATOM 0 HB3 TYR A 55 19.952 20.094 19.306 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.594 22.632 17.903 1.00 0.00 H new ATOM 0 HD2 TYR A 55 20.996 20.118 17.182 1.00 0.00 H new ATOM 0 HE1 TYR A 55 17.934 23.727 15.706 1.00 0.00 H new ATOM 0 HE2 TYR A 55 21.348 21.219 14.988 1.00 0.00 H new ATOM 0 HH TYR A 55 19.046 23.654 13.734 1.00 0.00 H new ATOM 880 N ALA A 56 18.423 17.698 20.177 1.00 0.00 N ATOM 881 CA ALA A 56 18.375 16.880 21.415 1.00 0.00 C ATOM 882 C ALA A 56 19.162 17.619 22.489 1.00 0.00 C ATOM 883 O ALA A 56 18.766 17.682 23.650 1.00 0.00 O ATOM 884 CB ALA A 56 19.046 15.559 21.063 1.00 0.00 C ATOM 0 H ALA A 56 18.977 17.311 19.413 1.00 0.00 H new ATOM 0 HA ALA A 56 17.363 16.707 21.783 1.00 0.00 H new ATOM 0 HB1 ALA A 56 19.044 14.906 21.936 1.00 0.00 H new ATOM 0 HB2 ALA A 56 18.501 15.079 20.250 1.00 0.00 H new ATOM 0 HB3 ALA A 56 20.074 15.745 20.751 1.00 0.00 H new ATOM 890 N ASN A 57 20.268 18.203 22.113 1.00 0.00 N ATOM 891 CA ASN A 57 21.068 18.958 23.091 1.00 0.00 C ATOM 892 C ASN A 57 21.603 20.235 22.469 1.00 0.00 C ATOM 893 O ASN A 57 21.623 20.421 21.246 1.00 0.00 O ATOM 894 CB ASN A 57 22.238 18.068 23.451 1.00 0.00 C ATOM 895 CG ASN A 57 22.991 17.683 22.189 1.00 0.00 C ATOM 896 OD1 ASN A 57 23.954 18.348 21.820 1.00 0.00 O ATOM 897 ND2 ASN A 57 22.600 16.650 21.501 1.00 0.00 N ATOM 0 H ASN A 57 20.644 18.184 21.165 1.00 0.00 H new ATOM 0 HA ASN A 57 20.465 19.227 23.958 1.00 0.00 H new ATOM 0 HB2 ASN A 57 22.904 18.587 24.140 1.00 0.00 H new ATOM 0 HB3 ASN A 57 21.884 17.173 23.963 1.00 0.00 H new ATOM 0 HD21 ASN A 57 23.095 16.388 20.648 1.00 0.00 H new ATOM 0 HD22 ASN A 57 21.799 16.102 21.814 1.00 0.00 H new ATOM 904 N ALA A 58 22.065 21.102 23.301 1.00 0.00 N ATOM 905 CA ALA A 58 22.637 22.366 22.810 1.00 0.00 C ATOM 906 C ALA A 58 23.876 22.086 21.963 1.00 0.00 C ATOM 907 O ALA A 58 24.234 22.885 21.116 1.00 0.00 O ATOM 908 CB ALA A 58 23.016 23.141 24.068 1.00 0.00 C ATOM 0 H ALA A 58 22.071 20.989 24.315 1.00 0.00 H new ATOM 0 HA ALA A 58 21.939 22.921 22.183 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.452 24.100 23.787 1.00 0.00 H new ATOM 0 HB2 ALA A 58 22.125 23.310 24.673 1.00 0.00 H new ATOM 0 HB3 ALA A 58 23.742 22.567 24.644 1.00 0.00 H new ATOM 914 N SER A 59 24.544 20.971 22.158 1.00 0.00 N ATOM 915 CA SER A 59 25.757 20.707 21.329 1.00 0.00 C ATOM 916 C SER A 59 25.330 20.392 19.903 1.00 0.00 C ATOM 917 O SER A 59 25.979 20.794 18.941 1.00 0.00 O ATOM 918 CB SER A 59 26.459 19.513 21.977 1.00 0.00 C ATOM 919 OG SER A 59 27.818 19.486 21.559 1.00 0.00 O ATOM 0 H SER A 59 24.306 20.250 22.839 1.00 0.00 H new ATOM 0 HA SER A 59 26.428 21.565 21.285 1.00 0.00 H new ATOM 0 HB2 SER A 59 26.402 19.588 23.063 1.00 0.00 H new ATOM 0 HB3 SER A 59 25.961 18.586 21.694 1.00 0.00 H new ATOM 0 HG SER A 59 28.273 18.723 21.973 1.00 0.00 H new ATOM 925 N GLU A 60 24.227 19.716 19.743 1.00 0.00 N ATOM 926 CA GLU A 60 23.739 19.426 18.378 1.00 0.00 C ATOM 927 C GLU A 60 23.449 20.768 17.716 1.00 0.00 C ATOM 928 O GLU A 60 23.916 21.075 16.613 1.00 0.00 O ATOM 929 CB GLU A 60 22.465 18.604 18.582 1.00 0.00 C ATOM 930 CG GLU A 60 22.114 17.865 17.292 1.00 0.00 C ATOM 931 CD GLU A 60 23.281 16.966 16.872 1.00 0.00 C ATOM 932 OE1 GLU A 60 23.491 15.957 17.525 1.00 0.00 O ATOM 933 OE2 GLU A 60 23.947 17.307 15.908 1.00 0.00 O ATOM 0 H GLU A 60 23.647 19.355 20.500 1.00 0.00 H new ATOM 0 HA GLU A 60 24.441 18.880 17.748 1.00 0.00 H new ATOM 0 HB2 GLU A 60 22.608 17.890 19.393 1.00 0.00 H new ATOM 0 HB3 GLU A 60 21.642 19.257 18.873 1.00 0.00 H new ATOM 0 HG2 GLU A 60 21.216 17.265 17.439 1.00 0.00 H new ATOM 0 HG3 GLU A 60 21.892 18.581 16.501 1.00 0.00 H new ATOM 940 N ALA A 61 22.736 21.609 18.415 1.00 0.00 N ATOM 941 CA ALA A 61 22.464 22.969 17.882 1.00 0.00 C ATOM 942 C ALA A 61 23.795 23.657 17.648 1.00 0.00 C ATOM 943 O ALA A 61 24.044 24.266 16.609 1.00 0.00 O ATOM 944 CB ALA A 61 21.717 23.675 18.996 1.00 0.00 C ATOM 0 H ALA A 61 22.332 21.411 19.330 1.00 0.00 H new ATOM 0 HA ALA A 61 21.900 22.965 16.949 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.476 24.691 18.685 1.00 0.00 H new ATOM 0 HB2 ALA A 61 20.796 23.135 19.216 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.341 23.707 19.889 1.00 0.00 H new ATOM 950 N LEU A 62 24.669 23.535 18.607 1.00 0.00 N ATOM 951 CA LEU A 62 26.013 24.132 18.485 1.00 0.00 C ATOM 952 C LEU A 62 26.699 23.519 17.259 1.00 0.00 C ATOM 953 O LEU A 62 27.536 24.143 16.609 1.00 0.00 O ATOM 954 CB LEU A 62 26.715 23.720 19.784 1.00 0.00 C ATOM 955 CG LEU A 62 26.171 24.515 20.982 1.00 0.00 C ATOM 956 CD1 LEU A 62 26.656 23.868 22.282 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.651 25.968 20.944 1.00 0.00 C ATOM 0 H LEU A 62 24.499 23.038 19.481 1.00 0.00 H new ATOM 0 HA LEU A 62 26.018 25.214 18.354 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.572 22.653 19.956 1.00 0.00 H new ATOM 0 HB3 LEU A 62 27.788 23.886 19.690 1.00 0.00 H new ATOM 0 HG LEU A 62 25.082 24.505 20.932 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.272 24.430 23.133 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.296 22.840 22.333 1.00 0.00 H new ATOM 0 HD13 LEU A 62 27.746 23.873 22.306 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.251 26.506 21.803 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.740 25.992 20.976 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.304 26.442 20.026 1.00 0.00 H new ATOM 969 N ALA A 63 26.338 22.304 16.931 1.00 0.00 N ATOM 970 CA ALA A 63 26.928 21.628 15.755 1.00 0.00 C ATOM 971 C ALA A 63 26.282 22.148 14.466 1.00 0.00 C ATOM 972 O ALA A 63 26.833 22.000 13.376 1.00 0.00 O ATOM 973 CB ALA A 63 26.619 20.142 15.951 1.00 0.00 C ATOM 0 H ALA A 63 25.649 21.751 17.441 1.00 0.00 H new ATOM 0 HA ALA A 63 27.999 21.811 15.669 1.00 0.00 H new ATOM 0 HB1 ALA A 63 27.026 19.572 15.116 1.00 0.00 H new ATOM 0 HB2 ALA A 63 27.071 19.796 16.881 1.00 0.00 H new ATOM 0 HB3 ALA A 63 25.540 19.998 15.996 1.00 0.00 H new ATOM 979 N ALA A 64 25.130 22.767 14.569 1.00 0.00 N ATOM 980 CA ALA A 64 24.464 23.305 13.337 1.00 0.00 C ATOM 981 C ALA A 64 25.117 24.610 12.908 1.00 0.00 C ATOM 982 O ALA A 64 24.733 25.237 11.922 1.00 0.00 O ATOM 983 CB ALA A 64 22.992 23.535 13.696 1.00 0.00 C ATOM 0 H ALA A 64 24.626 22.923 15.442 1.00 0.00 H new ATOM 0 HA ALA A 64 24.558 22.607 12.505 1.00 0.00 H new ATOM 0 HB1 ALA A 64 22.463 23.928 12.828 1.00 0.00 H new ATOM 0 HB2 ALA A 64 22.540 22.591 14.000 1.00 0.00 H new ATOM 0 HB3 ALA A 64 22.925 24.250 14.516 1.00 0.00 H new ATOM 989 N GLY A 65 26.095 25.015 13.636 1.00 0.00 N ATOM 990 CA GLY A 65 26.814 26.278 13.312 1.00 0.00 C ATOM 991 C GLY A 65 26.051 27.467 13.895 1.00 0.00 C ATOM 992 O GLY A 65 25.993 28.540 13.297 1.00 0.00 O ATOM 0 H GLY A 65 26.442 24.524 14.460 1.00 0.00 H new ATOM 0 HA2 GLY A 65 27.825 26.247 13.718 1.00 0.00 H new ATOM 0 HA3 GLY A 65 26.908 26.388 12.232 1.00 0.00 H new ATOM 996 N PHE A 66 25.469 27.304 15.053 1.00 0.00 N ATOM 997 CA PHE A 66 24.718 28.433 15.675 1.00 0.00 C ATOM 998 C PHE A 66 25.429 28.969 16.907 1.00 0.00 C ATOM 999 O PHE A 66 26.251 28.295 17.526 1.00 0.00 O ATOM 1000 CB PHE A 66 23.356 27.869 16.085 1.00 0.00 C ATOM 1001 CG PHE A 66 22.508 27.593 14.870 1.00 0.00 C ATOM 1002 CD1 PHE A 66 22.443 28.538 13.838 1.00 0.00 C ATOM 1003 CD2 PHE A 66 21.757 26.416 14.791 1.00 0.00 C ATOM 1004 CE1 PHE A 66 21.634 28.302 12.726 1.00 0.00 C ATOM 1005 CE2 PHE A 66 20.941 26.184 13.679 1.00 0.00 C ATOM 1006 CZ PHE A 66 20.882 27.128 12.648 1.00 0.00 C ATOM 0 H PHE A 66 25.481 26.440 15.594 1.00 0.00 H new ATOM 0 HA PHE A 66 24.631 29.258 14.968 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.494 26.950 16.655 1.00 0.00 H new ATOM 0 HB3 PHE A 66 22.845 28.576 16.738 1.00 0.00 H new ATOM 0 HD1 PHE A 66 23.019 29.449 13.903 1.00 0.00 H new ATOM 0 HD2 PHE A 66 21.807 25.688 15.587 1.00 0.00 H new ATOM 0 HE1 PHE A 66 21.589 29.027 11.926 1.00 0.00 H new ATOM 0 HE2 PHE A 66 20.357 25.277 13.616 1.00 0.00 H new ATOM 0 HZ PHE A 66 20.253 26.948 11.789 1.00 0.00 H new ATOM 1016 N ARG A 67 25.086 30.164 17.293 1.00 0.00 N ATOM 1017 CA ARG A 67 25.684 30.760 18.508 1.00 0.00 C ATOM 1018 C ARG A 67 24.678 30.595 19.645 1.00 0.00 C ATOM 1019 O ARG A 67 23.578 31.141 19.584 1.00 0.00 O ATOM 1020 CB ARG A 67 25.894 32.238 18.175 1.00 0.00 C ATOM 1021 CG ARG A 67 26.965 32.819 19.102 1.00 0.00 C ATOM 1022 CD ARG A 67 27.133 34.315 18.821 1.00 0.00 C ATOM 1023 NE ARG A 67 25.805 34.921 19.128 1.00 0.00 N ATOM 1024 CZ ARG A 67 25.587 36.197 18.918 1.00 0.00 C ATOM 1025 NH1 ARG A 67 26.529 36.966 18.435 1.00 0.00 N ATOM 1026 NH2 ARG A 67 24.417 36.706 19.194 1.00 0.00 N ATOM 0 H ARG A 67 24.410 30.756 16.811 1.00 0.00 H new ATOM 0 HA ARG A 67 26.624 30.297 18.807 1.00 0.00 H new ATOM 0 HB2 ARG A 67 26.199 32.348 17.134 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.959 32.786 18.293 1.00 0.00 H new ATOM 0 HG2 ARG A 67 26.682 32.664 20.143 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.912 32.302 18.949 1.00 0.00 H new ATOM 0 HD2 ARG A 67 27.917 34.747 19.443 1.00 0.00 H new ATOM 0 HD3 ARG A 67 27.416 34.492 17.783 1.00 0.00 H new ATOM 0 HE ARG A 67 25.059 34.337 19.505 1.00 0.00 H new ATOM 0 HH11 ARG A 67 27.445 36.574 18.217 1.00 0.00 H new ATOM 0 HH12 ARG A 67 26.347 37.957 18.276 1.00 0.00 H new ATOM 0 HH21 ARG A 67 23.678 36.112 19.571 1.00 0.00 H new ATOM 0 HH22 ARG A 67 24.241 37.698 19.033 1.00 0.00 H new ATOM 1040 N PRO A 68 25.052 29.839 20.639 1.00 0.00 N ATOM 1041 CA PRO A 68 24.135 29.597 21.774 1.00 0.00 C ATOM 1042 C PRO A 68 23.813 30.907 22.496 1.00 0.00 C ATOM 1043 O PRO A 68 24.678 31.749 22.727 1.00 0.00 O ATOM 1044 CB PRO A 68 24.891 28.596 22.645 1.00 0.00 C ATOM 1045 CG PRO A 68 26.329 28.764 22.269 1.00 0.00 C ATOM 1046 CD PRO A 68 26.341 29.159 20.818 1.00 0.00 C ATOM 0 HA PRO A 68 23.162 29.205 21.478 1.00 0.00 H new ATOM 0 HB2 PRO A 68 24.734 28.797 23.705 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.551 27.577 22.461 1.00 0.00 H new ATOM 0 HG2 PRO A 68 26.805 29.528 22.884 1.00 0.00 H new ATOM 0 HG3 PRO A 68 26.883 27.838 22.425 1.00 0.00 H new ATOM 0 HD2 PRO A 68 27.178 29.818 20.588 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.431 28.290 20.166 1.00 0.00 H new ATOM 1054 N CYS A 69 22.562 31.096 22.829 1.00 0.00 N ATOM 1055 CA CYS A 69 22.130 32.348 23.509 1.00 0.00 C ATOM 1056 C CYS A 69 22.922 32.532 24.809 1.00 0.00 C ATOM 1057 O CYS A 69 22.904 31.682 25.699 1.00 0.00 O ATOM 1058 CB CYS A 69 20.633 32.132 23.731 1.00 0.00 C ATOM 1059 SG CYS A 69 19.947 33.221 25.017 1.00 0.00 S ATOM 0 H CYS A 69 21.814 30.425 22.655 1.00 0.00 H new ATOM 0 HA CYS A 69 22.313 33.260 22.941 1.00 0.00 H new ATOM 0 HB2 CYS A 69 20.103 32.305 22.794 1.00 0.00 H new ATOM 0 HB3 CYS A 69 20.458 31.093 24.010 1.00 0.00 H new ATOM 0 HG CYS A 69 19.177 32.531 25.805 1.00 0.00 H new ATOM 1064 N LYS A 70 23.627 33.628 24.919 1.00 0.00 N ATOM 1065 CA LYS A 70 24.468 33.895 26.136 1.00 0.00 C ATOM 1066 C LYS A 70 23.656 33.807 27.431 1.00 0.00 C ATOM 1067 O LYS A 70 24.188 33.979 28.524 1.00 0.00 O ATOM 1068 CB LYS A 70 25.000 35.317 25.943 1.00 0.00 C ATOM 1069 CG LYS A 70 26.361 35.453 26.633 1.00 0.00 C ATOM 1070 CD LYS A 70 27.317 36.239 25.733 1.00 0.00 C ATOM 1071 CE LYS A 70 27.772 35.352 24.571 1.00 0.00 C ATOM 1072 NZ LYS A 70 29.240 35.582 24.462 1.00 0.00 N ATOM 0 H LYS A 70 23.659 34.362 24.211 1.00 0.00 H new ATOM 0 HA LYS A 70 25.261 33.153 26.232 1.00 0.00 H new ATOM 0 HB2 LYS A 70 25.096 35.539 24.880 1.00 0.00 H new ATOM 0 HB3 LYS A 70 24.297 36.039 26.358 1.00 0.00 H new ATOM 0 HG2 LYS A 70 26.246 35.962 27.590 1.00 0.00 H new ATOM 0 HG3 LYS A 70 26.773 34.466 26.844 1.00 0.00 H new ATOM 0 HD2 LYS A 70 26.822 37.132 25.351 1.00 0.00 H new ATOM 0 HD3 LYS A 70 28.180 36.575 26.307 1.00 0.00 H new ATOM 0 HE2 LYS A 70 27.550 34.303 24.765 1.00 0.00 H new ATOM 0 HE3 LYS A 70 27.261 35.620 23.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 29.625 35.007 23.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 29.420 36.588 24.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 29.701 35.312 25.354 1.00 0.00 H new ATOM 1086 N ARG A 71 22.387 33.558 27.334 1.00 0.00 N ATOM 1087 CA ARG A 71 21.545 33.469 28.552 1.00 0.00 C ATOM 1088 C ARG A 71 21.113 32.025 28.768 1.00 0.00 C ATOM 1089 O ARG A 71 20.981 31.546 29.892 1.00 0.00 O ATOM 1090 CB ARG A 71 20.330 34.306 28.207 1.00 0.00 C ATOM 1091 CG ARG A 71 19.772 34.947 29.479 1.00 0.00 C ATOM 1092 CD ARG A 71 20.767 35.987 30.007 1.00 0.00 C ATOM 1093 NE ARG A 71 19.946 37.198 30.305 1.00 0.00 N ATOM 1094 CZ ARG A 71 20.419 38.156 31.066 1.00 0.00 C ATOM 1095 NH1 ARG A 71 21.620 38.071 31.579 1.00 0.00 N ATOM 1096 NH2 ARG A 71 19.686 39.206 31.314 1.00 0.00 N ATOM 0 H ARG A 71 21.891 33.411 26.455 1.00 0.00 H new ATOM 0 HA ARG A 71 22.060 33.803 29.453 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.600 35.078 27.487 1.00 0.00 H new ATOM 0 HB3 ARG A 71 19.569 33.684 27.737 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.812 35.420 29.270 1.00 0.00 H new ATOM 0 HG3 ARG A 71 19.593 34.183 30.235 1.00 0.00 H new ATOM 0 HD2 ARG A 71 21.276 35.627 30.901 1.00 0.00 H new ATOM 0 HD3 ARG A 71 21.538 36.206 29.268 1.00 0.00 H new ATOM 0 HE ARG A 71 19.008 37.281 29.913 1.00 0.00 H new ATOM 0 HH11 ARG A 71 22.199 37.253 31.389 1.00 0.00 H new ATOM 0 HH12 ARG A 71 21.977 38.822 32.169 1.00 0.00 H new ATOM 0 HH21 ARG A 71 18.749 39.280 30.917 1.00 0.00 H new ATOM 0 HH22 ARG A 71 20.049 39.954 31.905 1.00 0.00 H new ATOM 1110 N CYS A 72 20.875 31.342 27.690 1.00 0.00 N ATOM 1111 CA CYS A 72 20.422 29.916 27.772 1.00 0.00 C ATOM 1112 C CYS A 72 21.613 28.956 27.773 1.00 0.00 C ATOM 1113 O CYS A 72 21.501 27.803 28.184 1.00 0.00 O ATOM 1114 CB CYS A 72 19.593 29.694 26.506 1.00 0.00 C ATOM 1115 SG CYS A 72 17.940 30.374 26.721 1.00 0.00 S ATOM 0 H CYS A 72 20.973 31.707 26.743 1.00 0.00 H new ATOM 0 HA CYS A 72 19.862 29.730 28.688 1.00 0.00 H new ATOM 0 HB2 CYS A 72 20.081 30.168 25.654 1.00 0.00 H new ATOM 0 HB3 CYS A 72 19.530 28.628 26.285 1.00 0.00 H new ATOM 0 HG CYS A 72 17.068 29.571 26.188 1.00 0.00 H new ATOM 1120 N GLN A 73 22.739 29.398 27.293 1.00 0.00 N ATOM 1121 CA GLN A 73 23.929 28.501 27.230 1.00 0.00 C ATOM 1122 C GLN A 73 24.645 28.384 28.596 1.00 0.00 C ATOM 1123 O GLN A 73 25.127 27.307 28.939 1.00 0.00 O ATOM 1124 CB GLN A 73 24.819 29.134 26.138 1.00 0.00 C ATOM 1125 CG GLN A 73 26.213 29.494 26.675 1.00 0.00 C ATOM 1126 CD GLN A 73 27.032 28.217 26.872 1.00 0.00 C ATOM 1127 OE1 GLN A 73 27.014 27.326 26.026 1.00 0.00 O ATOM 1128 NE2 GLN A 73 27.753 28.079 27.950 1.00 0.00 N ATOM 0 H GLN A 73 22.890 30.343 26.940 1.00 0.00 H new ATOM 0 HA GLN A 73 23.663 27.472 26.990 1.00 0.00 H new ATOM 0 HB2 GLN A 73 24.919 28.440 25.303 1.00 0.00 H new ATOM 0 HB3 GLN A 73 24.336 30.031 25.750 1.00 0.00 H new ATOM 0 HG2 GLN A 73 26.721 30.160 25.978 1.00 0.00 H new ATOM 0 HG3 GLN A 73 26.123 30.030 27.620 1.00 0.00 H new ATOM 0 HE21 GLN A 73 27.768 28.819 28.652 1.00 0.00 H new ATOM 0 HE22 GLN A 73 28.302 27.231 28.091 1.00 0.00 H new ATOM 1137 N PRO A 74 24.724 29.467 29.334 1.00 0.00 N ATOM 1138 CA PRO A 74 25.415 29.424 30.646 1.00 0.00 C ATOM 1139 C PRO A 74 24.545 28.781 31.739 1.00 0.00 C ATOM 1140 O PRO A 74 25.038 28.015 32.564 1.00 0.00 O ATOM 1141 CB PRO A 74 25.674 30.891 30.963 1.00 0.00 C ATOM 1142 CG PRO A 74 24.630 31.651 30.207 1.00 0.00 C ATOM 1143 CD PRO A 74 24.199 30.804 29.035 1.00 0.00 C ATOM 0 HA PRO A 74 26.322 28.820 30.610 1.00 0.00 H new ATOM 0 HB2 PRO A 74 25.600 31.081 32.034 1.00 0.00 H new ATOM 0 HB3 PRO A 74 26.676 31.188 30.655 1.00 0.00 H new ATOM 0 HG2 PRO A 74 23.779 31.874 30.851 1.00 0.00 H new ATOM 0 HG3 PRO A 74 25.027 32.606 29.862 1.00 0.00 H new ATOM 0 HD2 PRO A 74 23.114 30.790 28.933 1.00 0.00 H new ATOM 0 HD3 PRO A 74 24.602 31.188 28.098 1.00 0.00 H new ATOM 1151 N ASP A 75 23.273 29.085 31.783 1.00 0.00 N ATOM 1152 CA ASP A 75 22.409 28.493 32.851 1.00 0.00 C ATOM 1153 C ASP A 75 22.107 27.019 32.548 1.00 0.00 C ATOM 1154 O ASP A 75 22.551 26.469 31.543 1.00 0.00 O ATOM 1155 CB ASP A 75 21.133 29.350 32.874 1.00 0.00 C ATOM 1156 CG ASP A 75 20.126 28.848 31.841 1.00 0.00 C ATOM 1157 OD1 ASP A 75 19.562 27.788 32.060 1.00 0.00 O ATOM 1158 OD2 ASP A 75 19.929 29.537 30.854 1.00 0.00 O ATOM 0 H ASP A 75 22.798 29.711 31.133 1.00 0.00 H new ATOM 0 HA ASP A 75 22.897 28.501 33.825 1.00 0.00 H new ATOM 0 HB2 ASP A 75 20.687 29.320 33.868 1.00 0.00 H new ATOM 0 HB3 ASP A 75 21.384 30.391 32.668 1.00 0.00 H new ATOM 1163 N LYS A 76 21.389 26.362 33.423 1.00 0.00 N ATOM 1164 CA LYS A 76 21.089 24.919 33.221 1.00 0.00 C ATOM 1165 C LYS A 76 19.623 24.691 32.826 1.00 0.00 C ATOM 1166 O LYS A 76 18.707 25.322 33.350 1.00 0.00 O ATOM 1167 CB LYS A 76 21.383 24.289 34.582 1.00 0.00 C ATOM 1168 CG LYS A 76 22.833 24.588 34.992 1.00 0.00 C ATOM 1169 CD LYS A 76 23.653 23.293 35.003 1.00 0.00 C ATOM 1170 CE LYS A 76 24.651 23.308 33.843 1.00 0.00 C ATOM 1171 NZ LYS A 76 24.665 21.910 33.331 1.00 0.00 N ATOM 0 H LYS A 76 20.997 26.769 34.272 1.00 0.00 H new ATOM 0 HA LYS A 76 21.679 24.488 32.412 1.00 0.00 H new ATOM 0 HB2 LYS A 76 20.695 24.682 35.331 1.00 0.00 H new ATOM 0 HB3 LYS A 76 21.223 23.212 34.536 1.00 0.00 H new ATOM 0 HG2 LYS A 76 23.276 25.302 34.298 1.00 0.00 H new ATOM 0 HG3 LYS A 76 22.853 25.049 35.980 1.00 0.00 H new ATOM 0 HD2 LYS A 76 24.183 23.194 35.951 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.992 22.431 34.916 1.00 0.00 H new ATOM 0 HE2 LYS A 76 24.344 24.010 33.067 1.00 0.00 H new ATOM 0 HE3 LYS A 76 25.641 23.616 34.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 25.327 21.839 32.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 24.967 21.266 34.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 23.710 21.647 33.013 1.00 0.00 H new ATOM 1185 N ALA A 77 19.396 23.785 31.914 1.00 0.00 N ATOM 1186 CA ALA A 77 18.008 23.468 31.462 1.00 0.00 C ATOM 1187 C ALA A 77 17.403 22.394 32.394 1.00 0.00 C ATOM 1188 O ALA A 77 17.218 22.645 33.574 1.00 0.00 O ATOM 1189 CB ALA A 77 18.224 22.957 30.042 1.00 0.00 C ATOM 0 H ALA A 77 20.126 23.241 31.454 1.00 0.00 H new ATOM 0 HA ALA A 77 17.312 24.306 31.488 1.00 0.00 H new ATOM 0 HB1 ALA A 77 17.264 22.690 29.602 1.00 0.00 H new ATOM 0 HB2 ALA A 77 18.694 23.737 29.442 1.00 0.00 H new ATOM 0 HB3 ALA A 77 18.869 22.079 30.066 1.00 0.00 H new ATOM 1195 N ASN A 78 17.148 21.179 31.936 1.00 0.00 N ATOM 1196 CA ASN A 78 16.641 20.147 32.901 1.00 0.00 C ATOM 1197 C ASN A 78 17.674 19.969 34.005 1.00 0.00 C ATOM 1198 O ASN A 78 17.319 19.716 35.154 1.00 0.00 O ATOM 1199 CB ASN A 78 16.455 18.817 32.151 1.00 0.00 C ATOM 1200 CG ASN A 78 15.130 18.804 31.383 1.00 0.00 C ATOM 1201 OD1 ASN A 78 15.053 18.264 30.282 1.00 0.00 O ATOM 1202 ND2 ASN A 78 14.071 19.361 31.909 1.00 0.00 N ATOM 0 H ASN A 78 17.265 20.870 30.971 1.00 0.00 H new ATOM 0 HA ASN A 78 15.690 20.459 33.332 1.00 0.00 H new ATOM 0 HB2 ASN A 78 17.283 18.666 31.458 1.00 0.00 H new ATOM 0 HB3 ASN A 78 16.478 17.989 32.859 1.00 0.00 H new ATOM 0 HD21 ASN A 78 13.184 19.347 31.406 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.132 19.810 32.823 1.00 0.00 H new ATOM 1209 N PRO A 79 18.926 20.168 33.655 1.00 0.00 N ATOM 1210 CA PRO A 79 20.009 20.095 34.675 1.00 0.00 C ATOM 1211 C PRO A 79 19.729 21.176 35.734 1.00 0.00 C ATOM 1212 O PRO A 79 20.271 21.152 36.837 1.00 0.00 O ATOM 1213 CB PRO A 79 21.252 20.378 33.813 1.00 0.00 C ATOM 1214 CG PRO A 79 20.726 21.172 32.687 1.00 0.00 C ATOM 1215 CD PRO A 79 19.474 20.467 32.326 1.00 0.00 C ATOM 0 HA PRO A 79 20.110 19.162 35.230 1.00 0.00 H new ATOM 0 HB2 PRO A 79 22.009 20.928 34.371 1.00 0.00 H new ATOM 0 HB3 PRO A 79 21.718 19.455 33.468 1.00 0.00 H new ATOM 0 HG2 PRO A 79 20.536 22.205 32.978 1.00 0.00 H new ATOM 0 HG3 PRO A 79 21.427 21.199 31.853 1.00 0.00 H new ATOM 0 HD2 PRO A 79 18.805 21.092 31.735 1.00 0.00 H new ATOM 0 HD3 PRO A 79 19.662 19.564 31.745 1.00 0.00 H new ATOM 1223 N ARG A 80 18.846 22.110 35.414 1.00 0.00 N ATOM 1224 CA ARG A 80 18.468 23.172 36.375 1.00 0.00 C ATOM 1225 C ARG A 80 18.112 22.524 37.716 1.00 0.00 C ATOM 1226 O ARG A 80 18.779 22.728 38.731 1.00 0.00 O ATOM 1227 CB ARG A 80 17.227 23.848 35.799 1.00 0.00 C ATOM 1228 CG ARG A 80 16.864 25.066 36.650 1.00 0.00 C ATOM 1229 CD ARG A 80 17.822 26.216 36.329 1.00 0.00 C ATOM 1230 NE ARG A 80 17.086 27.453 36.718 1.00 0.00 N ATOM 1231 CZ ARG A 80 17.596 28.637 36.474 1.00 0.00 C ATOM 1232 NH1 ARG A 80 18.758 28.757 35.885 1.00 0.00 N ATOM 1233 NH2 ARG A 80 16.935 29.706 36.823 1.00 0.00 N ATOM 0 H ARG A 80 18.375 22.167 34.511 1.00 0.00 H new ATOM 0 HA ARG A 80 19.277 23.886 36.529 1.00 0.00 H new ATOM 0 HB2 ARG A 80 17.412 24.153 34.769 1.00 0.00 H new ATOM 0 HB3 ARG A 80 16.394 23.145 35.778 1.00 0.00 H new ATOM 0 HG2 ARG A 80 15.836 25.369 36.451 1.00 0.00 H new ATOM 0 HG3 ARG A 80 16.923 24.814 37.709 1.00 0.00 H new ATOM 0 HD2 ARG A 80 18.754 26.120 36.886 1.00 0.00 H new ATOM 0 HD3 ARG A 80 18.083 26.228 35.271 1.00 0.00 H new ATOM 0 HE ARG A 80 16.179 27.378 37.178 1.00 0.00 H new ATOM 0 HH11 ARG A 80 19.279 27.924 35.610 1.00 0.00 H new ATOM 0 HH12 ARG A 80 19.143 29.683 35.701 1.00 0.00 H new ATOM 0 HH21 ARG A 80 16.028 29.618 37.282 1.00 0.00 H new ATOM 0 HH22 ARG A 80 17.325 30.630 36.637 1.00 0.00 H new ATOM 1247 N GLN A 81 17.067 21.742 37.730 1.00 0.00 N ATOM 1248 CA GLN A 81 16.626 21.052 38.987 1.00 0.00 C ATOM 1249 C GLN A 81 17.796 20.318 39.679 1.00 0.00 C ATOM 1250 O GLN A 81 17.856 20.238 40.906 1.00 0.00 O ATOM 1251 CB GLN A 81 15.567 20.048 38.534 1.00 0.00 C ATOM 1252 CG GLN A 81 14.349 20.798 37.994 1.00 0.00 C ATOM 1253 CD GLN A 81 13.624 19.922 36.970 1.00 0.00 C ATOM 1254 OE1 GLN A 81 14.258 19.272 36.142 1.00 0.00 O ATOM 1255 NE2 GLN A 81 12.320 19.867 36.983 1.00 0.00 N ATOM 0 H GLN A 81 16.488 21.546 36.913 1.00 0.00 H new ATOM 0 HA GLN A 81 16.245 21.767 39.717 1.00 0.00 H new ATOM 0 HB2 GLN A 81 15.976 19.395 37.763 1.00 0.00 H new ATOM 0 HB3 GLN A 81 15.274 19.411 39.369 1.00 0.00 H new ATOM 0 HG2 GLN A 81 13.675 21.055 38.811 1.00 0.00 H new ATOM 0 HG3 GLN A 81 14.661 21.735 37.532 1.00 0.00 H new ATOM 0 HE21 GLN A 81 11.794 20.406 37.670 1.00 0.00 H new ATOM 0 HE22 GLN A 81 11.827 19.285 36.306 1.00 0.00 H new ATOM 1264 N HIS A 82 18.720 19.773 38.918 1.00 0.00 N ATOM 1265 CA HIS A 82 19.867 19.039 39.536 1.00 0.00 C ATOM 1266 C HIS A 82 20.781 20.044 40.259 1.00 0.00 C ATOM 1267 O HIS A 82 21.228 19.813 41.388 1.00 0.00 O ATOM 1268 CB HIS A 82 20.604 18.383 38.366 1.00 0.00 C ATOM 1269 CG HIS A 82 19.876 17.134 37.952 1.00 0.00 C ATOM 1270 ND1 HIS A 82 18.818 17.157 37.056 1.00 0.00 N ATOM 1271 CD2 HIS A 82 20.040 15.817 38.303 1.00 0.00 C ATOM 1272 CE1 HIS A 82 18.390 15.890 36.900 1.00 0.00 C ATOM 1273 NE2 HIS A 82 19.101 15.034 37.638 1.00 0.00 N ATOM 0 H HIS A 82 18.727 19.806 37.899 1.00 0.00 H new ATOM 0 HA HIS A 82 19.548 18.298 40.269 1.00 0.00 H new ATOM 0 HB2 HIS A 82 20.666 19.076 37.527 1.00 0.00 H new ATOM 0 HB3 HIS A 82 21.627 18.142 38.656 1.00 0.00 H new ATOM 0 HD2 HIS A 82 20.785 15.445 38.991 1.00 0.00 H new ATOM 0 HE1 HIS A 82 17.572 15.601 36.257 1.00 0.00 H new ATOM 0 HE2 HIS A 82 18.982 14.023 37.701 1.00 0.00 H new ATOM 1281 N ARG A 83 21.031 21.172 39.653 1.00 0.00 N ATOM 1282 CA ARG A 83 21.874 22.209 40.317 1.00 0.00 C ATOM 1283 C ARG A 83 21.114 22.768 41.526 1.00 0.00 C ATOM 1284 O ARG A 83 21.707 23.267 42.494 1.00 0.00 O ATOM 1285 CB ARG A 83 22.086 23.295 39.260 1.00 0.00 C ATOM 1286 CG ARG A 83 23.194 24.247 39.716 1.00 0.00 C ATOM 1287 CD ARG A 83 24.556 23.583 39.506 1.00 0.00 C ATOM 1288 NE ARG A 83 25.533 24.479 40.191 1.00 0.00 N ATOM 1289 CZ ARG A 83 25.595 24.524 41.501 1.00 0.00 C ATOM 1290 NH1 ARG A 83 24.801 23.786 42.234 1.00 0.00 N ATOM 1291 NH2 ARG A 83 26.457 25.314 42.079 1.00 0.00 N ATOM 0 H ARG A 83 20.688 21.422 38.725 1.00 0.00 H new ATOM 0 HA ARG A 83 22.826 21.817 40.676 1.00 0.00 H new ATOM 0 HB2 ARG A 83 22.353 22.841 38.306 1.00 0.00 H new ATOM 0 HB3 ARG A 83 21.160 23.848 39.102 1.00 0.00 H new ATOM 0 HG2 ARG A 83 23.141 25.179 39.153 1.00 0.00 H new ATOM 0 HG3 ARG A 83 23.060 24.501 40.767 1.00 0.00 H new ATOM 0 HD2 ARG A 83 24.575 22.580 39.931 1.00 0.00 H new ATOM 0 HD3 ARG A 83 24.788 23.484 38.445 1.00 0.00 H new ATOM 0 HE ARG A 83 26.159 25.062 39.636 1.00 0.00 H new ATOM 0 HH11 ARG A 83 24.124 23.167 41.788 1.00 0.00 H new ATOM 0 HH12 ARG A 83 24.859 23.830 43.251 1.00 0.00 H new ATOM 0 HH21 ARG A 83 27.078 25.892 41.513 1.00 0.00 H new ATOM 0 HH22 ARG A 83 26.510 25.353 43.097 1.00 0.00 H new ATOM 1305 N LEU A 84 19.807 22.666 41.510 1.00 0.00 N ATOM 1306 CA LEU A 84 19.034 23.168 42.657 1.00 0.00 C ATOM 1307 C LEU A 84 19.149 22.136 43.778 1.00 0.00 C ATOM 1308 O LEU A 84 19.217 22.480 44.961 1.00 0.00 O ATOM 1309 CB LEU A 84 17.583 23.301 42.187 1.00 0.00 C ATOM 1310 CG LEU A 84 17.009 24.717 42.458 1.00 0.00 C ATOM 1311 CD1 LEU A 84 17.947 25.596 43.326 1.00 0.00 C ATOM 1312 CD2 LEU A 84 16.768 25.409 41.114 1.00 0.00 C ATOM 0 H LEU A 84 19.258 22.258 40.753 1.00 0.00 H new ATOM 0 HA LEU A 84 19.393 24.130 43.022 1.00 0.00 H new ATOM 0 HB2 LEU A 84 17.527 23.086 41.120 1.00 0.00 H new ATOM 0 HB3 LEU A 84 16.968 22.558 42.695 1.00 0.00 H new ATOM 0 HG LEU A 84 16.081 24.596 43.018 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.490 26.573 43.480 1.00 0.00 H new ATOM 0 HD12 LEU A 84 18.108 25.114 44.291 1.00 0.00 H new ATOM 0 HD13 LEU A 84 18.904 25.719 42.818 1.00 0.00 H new ATOM 0 HD21 LEU A 84 16.364 26.407 41.286 1.00 0.00 H new ATOM 0 HD22 LEU A 84 17.710 25.487 40.571 1.00 0.00 H new ATOM 0 HD23 LEU A 84 16.058 24.826 40.527 1.00 0.00 H new ATOM 1324 N ASP A 85 19.242 20.875 43.429 1.00 0.00 N ATOM 1325 CA ASP A 85 19.431 19.833 44.479 1.00 0.00 C ATOM 1326 C ASP A 85 20.759 20.112 45.185 1.00 0.00 C ATOM 1327 O ASP A 85 20.896 19.984 46.408 1.00 0.00 O ATOM 1328 CB ASP A 85 19.503 18.513 43.721 1.00 0.00 C ATOM 1329 CG ASP A 85 18.101 17.917 43.587 1.00 0.00 C ATOM 1330 OD1 ASP A 85 17.663 17.267 44.522 1.00 0.00 O ATOM 1331 OD2 ASP A 85 17.488 18.121 42.551 1.00 0.00 O ATOM 0 H ASP A 85 19.195 20.528 42.471 1.00 0.00 H new ATOM 0 HA ASP A 85 18.636 19.818 45.225 1.00 0.00 H new ATOM 0 HB2 ASP A 85 19.936 18.673 42.734 1.00 0.00 H new ATOM 0 HB3 ASP A 85 20.156 17.816 44.247 1.00 0.00 H new ATOM 1336 N LYS A 86 21.731 20.538 44.426 1.00 0.00 N ATOM 1337 CA LYS A 86 23.060 20.877 45.017 1.00 0.00 C ATOM 1338 C LYS A 86 22.906 21.987 46.077 1.00 0.00 C ATOM 1339 O LYS A 86 23.422 21.883 47.196 1.00 0.00 O ATOM 1340 CB LYS A 86 23.901 21.378 43.843 1.00 0.00 C ATOM 1341 CG LYS A 86 25.351 21.564 44.296 1.00 0.00 C ATOM 1342 CD LYS A 86 26.002 20.193 44.496 1.00 0.00 C ATOM 1343 CE LYS A 86 26.846 19.841 43.268 1.00 0.00 C ATOM 1344 NZ LYS A 86 26.611 18.387 43.044 1.00 0.00 N ATOM 0 H LYS A 86 21.663 20.667 43.416 1.00 0.00 H new ATOM 0 HA LYS A 86 23.518 20.022 45.514 1.00 0.00 H new ATOM 0 HB2 LYS A 86 23.855 20.666 43.019 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.501 22.322 43.472 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.905 22.137 43.552 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.383 22.133 45.225 1.00 0.00 H new ATOM 0 HD2 LYS A 86 26.627 20.203 45.389 1.00 0.00 H new ATOM 0 HD3 LYS A 86 25.235 19.434 44.652 1.00 0.00 H new ATOM 0 HE2 LYS A 86 26.545 20.428 42.400 1.00 0.00 H new ATOM 0 HE3 LYS A 86 27.902 20.048 43.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 27.157 18.070 42.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 26.913 17.853 43.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 25.598 18.221 42.874 1.00 0.00 H new ATOM 1358 N ILE A 87 22.212 23.049 45.754 1.00 0.00 N ATOM 1359 CA ILE A 87 22.041 24.160 46.754 1.00 0.00 C ATOM 1360 C ILE A 87 21.315 23.641 48.023 1.00 0.00 C ATOM 1361 O ILE A 87 21.673 23.991 49.148 1.00 0.00 O ATOM 1362 CB ILE A 87 21.266 25.281 46.046 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.680 25.349 44.555 1.00 0.00 C ATOM 1364 CG2 ILE A 87 21.617 26.603 46.733 1.00 0.00 C ATOM 1365 CD1 ILE A 87 21.848 26.802 44.095 1.00 0.00 C ATOM 0 H ILE A 87 21.759 23.199 44.853 1.00 0.00 H new ATOM 0 HA ILE A 87 23.001 24.544 47.098 1.00 0.00 H new ATOM 0 HB ILE A 87 20.194 25.091 46.102 1.00 0.00 H new ATOM 0 HG12 ILE A 87 22.615 24.808 44.409 1.00 0.00 H new ATOM 0 HG13 ILE A 87 20.926 24.855 43.942 1.00 0.00 H new ATOM 0 HG21 ILE A 87 21.079 27.418 46.249 1.00 0.00 H new ATOM 0 HG22 ILE A 87 21.332 26.554 47.784 1.00 0.00 H new ATOM 0 HG23 ILE A 87 22.690 26.780 46.656 1.00 0.00 H new ATOM 0 HD11 ILE A 87 22.139 26.820 43.045 1.00 0.00 H new ATOM 0 HD12 ILE A 87 20.905 27.334 44.220 1.00 0.00 H new ATOM 0 HD13 ILE A 87 22.620 27.286 44.693 1.00 0.00 H new ATOM 1377 N THR A 88 20.345 22.771 47.884 1.00 0.00 N ATOM 1378 CA THR A 88 19.678 22.198 49.098 1.00 0.00 C ATOM 1379 C THR A 88 20.782 21.613 49.994 1.00 0.00 C ATOM 1380 O THR A 88 20.829 21.838 51.207 1.00 0.00 O ATOM 1381 CB THR A 88 18.753 21.095 48.579 1.00 0.00 C ATOM 1382 OG1 THR A 88 17.882 21.634 47.594 1.00 0.00 O ATOM 1383 CG2 THR A 88 17.928 20.531 49.737 1.00 0.00 C ATOM 0 H THR A 88 19.987 22.434 46.990 1.00 0.00 H new ATOM 0 HA THR A 88 19.110 22.929 49.674 1.00 0.00 H new ATOM 0 HB THR A 88 19.351 20.297 48.139 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.290 20.928 47.259 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.270 19.746 49.366 1.00 0.00 H new ATOM 0 HG22 THR A 88 18.596 20.118 50.492 1.00 0.00 H new ATOM 0 HG23 THR A 88 17.329 21.327 50.179 1.00 0.00 H new ATOM 1391 N HIS A 89 21.719 20.912 49.400 1.00 0.00 N ATOM 1392 CA HIS A 89 22.862 20.377 50.201 1.00 0.00 C ATOM 1393 C HIS A 89 23.527 21.568 50.906 1.00 0.00 C ATOM 1394 O HIS A 89 23.907 21.497 52.075 1.00 0.00 O ATOM 1395 CB HIS A 89 23.813 19.739 49.187 1.00 0.00 C ATOM 1396 CG HIS A 89 24.665 18.713 49.883 1.00 0.00 C ATOM 1397 ND1 HIS A 89 25.190 17.614 49.221 1.00 0.00 N ATOM 1398 CD2 HIS A 89 25.089 18.604 51.184 1.00 0.00 C ATOM 1399 CE1 HIS A 89 25.893 16.897 50.118 1.00 0.00 C ATOM 1400 NE2 HIS A 89 25.865 17.458 51.330 1.00 0.00 N ATOM 0 H HIS A 89 21.741 20.690 48.405 1.00 0.00 H new ATOM 0 HA HIS A 89 22.566 19.647 50.955 1.00 0.00 H new ATOM 0 HB2 HIS A 89 23.245 19.272 48.382 1.00 0.00 H new ATOM 0 HB3 HIS A 89 24.443 20.503 48.731 1.00 0.00 H new ATOM 0 HD2 HIS A 89 24.856 19.302 51.975 1.00 0.00 H new ATOM 0 HE1 HIS A 89 26.415 15.981 49.886 1.00 0.00 H new ATOM 0 HE2 HIS A 89 26.316 17.119 52.180 1.00 0.00 H new ATOM 1408 N ALA A 90 23.617 22.688 50.216 1.00 0.00 N ATOM 1409 CA ALA A 90 24.192 23.920 50.840 1.00 0.00 C ATOM 1410 C ALA A 90 23.410 24.197 52.114 1.00 0.00 C ATOM 1411 O ALA A 90 23.962 24.639 53.119 1.00 0.00 O ATOM 1412 CB ALA A 90 23.978 25.066 49.825 1.00 0.00 C ATOM 0 H ALA A 90 23.315 22.797 49.248 1.00 0.00 H new ATOM 0 HA ALA A 90 25.250 23.818 51.081 1.00 0.00 H new ATOM 0 HB1 ALA A 90 24.381 25.993 50.232 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.489 24.827 48.893 1.00 0.00 H new ATOM 0 HB3 ALA A 90 22.912 25.188 49.633 1.00 0.00 H new ATOM 1418 N CYS A 91 22.129 23.904 52.106 1.00 0.00 N ATOM 1419 CA CYS A 91 21.326 24.128 53.341 1.00 0.00 C ATOM 1420 C CYS A 91 21.895 23.237 54.442 1.00 0.00 C ATOM 1421 O CYS A 91 22.186 23.694 55.550 1.00 0.00 O ATOM 1422 CB CYS A 91 19.881 23.711 53.022 1.00 0.00 C ATOM 1423 SG CYS A 91 19.080 23.101 54.539 1.00 0.00 S ATOM 0 H CYS A 91 21.616 23.526 51.309 1.00 0.00 H new ATOM 0 HA CYS A 91 21.355 25.168 53.667 1.00 0.00 H new ATOM 0 HB2 CYS A 91 19.326 24.559 52.620 1.00 0.00 H new ATOM 0 HB3 CYS A 91 19.875 22.935 52.257 1.00 0.00 H new ATOM 0 HG CYS A 91 18.460 24.081 55.126 1.00 0.00 H new ATOM 1429 N ARG A 92 22.072 21.976 54.154 1.00 0.00 N ATOM 1430 CA ARG A 92 22.641 21.055 55.182 1.00 0.00 C ATOM 1431 C ARG A 92 23.894 21.684 55.804 1.00 0.00 C ATOM 1432 O ARG A 92 24.015 21.801 57.020 1.00 0.00 O ATOM 1433 CB ARG A 92 23.004 19.780 54.419 1.00 0.00 C ATOM 1434 CG ARG A 92 22.902 18.576 55.358 1.00 0.00 C ATOM 1435 CD ARG A 92 21.447 18.109 55.430 1.00 0.00 C ATOM 1436 NE ARG A 92 21.290 17.547 56.804 1.00 0.00 N ATOM 1437 CZ ARG A 92 21.775 16.366 57.106 1.00 0.00 C ATOM 1438 NH1 ARG A 92 22.410 15.652 56.210 1.00 0.00 N ATOM 1439 NH2 ARG A 92 21.624 15.897 58.315 1.00 0.00 N ATOM 0 H ARG A 92 21.849 21.545 53.257 1.00 0.00 H new ATOM 0 HA ARG A 92 21.942 20.854 55.994 1.00 0.00 H new ATOM 0 HB2 ARG A 92 22.334 19.649 53.569 1.00 0.00 H new ATOM 0 HB3 ARG A 92 24.015 19.858 54.019 1.00 0.00 H new ATOM 0 HG2 ARG A 92 23.538 17.767 55.000 1.00 0.00 H new ATOM 0 HG3 ARG A 92 23.259 18.845 56.352 1.00 0.00 H new ATOM 0 HD2 ARG A 92 20.758 18.936 55.261 1.00 0.00 H new ATOM 0 HD3 ARG A 92 21.235 17.357 54.669 1.00 0.00 H new ATOM 0 HE ARG A 92 20.800 18.088 57.517 1.00 0.00 H new ATOM 0 HH11 ARG A 92 22.533 16.013 55.264 1.00 0.00 H new ATOM 0 HH12 ARG A 92 22.782 14.735 56.459 1.00 0.00 H new ATOM 0 HH21 ARG A 92 21.131 16.448 59.018 1.00 0.00 H new ATOM 0 HH22 ARG A 92 21.999 14.980 58.557 1.00 0.00 H new ATOM 1453 N LEU A 93 24.819 22.097 54.981 1.00 0.00 N ATOM 1454 CA LEU A 93 26.071 22.735 55.498 1.00 0.00 C ATOM 1455 C LEU A 93 25.754 23.952 56.384 1.00 0.00 C ATOM 1456 O LEU A 93 26.441 24.206 57.386 1.00 0.00 O ATOM 1457 CB LEU A 93 26.830 23.177 54.243 1.00 0.00 C ATOM 1458 CG LEU A 93 27.959 22.187 53.937 1.00 0.00 C ATOM 1459 CD1 LEU A 93 28.945 22.150 55.107 1.00 0.00 C ATOM 1460 CD2 LEU A 93 27.373 20.789 53.719 1.00 0.00 C ATOM 0 H LEU A 93 24.764 22.021 53.965 1.00 0.00 H new ATOM 0 HA LEU A 93 26.646 22.047 56.118 1.00 0.00 H new ATOM 0 HB2 LEU A 93 26.146 23.235 53.396 1.00 0.00 H new ATOM 0 HB3 LEU A 93 27.241 24.176 54.389 1.00 0.00 H new ATOM 0 HG LEU A 93 28.481 22.506 53.035 1.00 0.00 H new ATOM 0 HD11 LEU A 93 29.746 21.445 54.885 1.00 0.00 H new ATOM 0 HD12 LEU A 93 29.367 23.143 55.258 1.00 0.00 H new ATOM 0 HD13 LEU A 93 28.425 21.835 56.012 1.00 0.00 H new ATOM 0 HD21 LEU A 93 28.178 20.087 53.502 1.00 0.00 H new ATOM 0 HD22 LEU A 93 26.847 20.471 54.619 1.00 0.00 H new ATOM 0 HD23 LEU A 93 26.676 20.813 52.881 1.00 0.00 H new ATOM 1472 N LEU A 94 24.732 24.705 56.024 1.00 0.00 N ATOM 1473 CA LEU A 94 24.344 25.940 56.795 1.00 0.00 C ATOM 1474 C LEU A 94 23.770 25.562 58.168 1.00 0.00 C ATOM 1475 O LEU A 94 23.589 26.409 59.041 1.00 0.00 O ATOM 1476 CB LEU A 94 23.239 26.594 55.922 1.00 0.00 C ATOM 1477 CG LEU A 94 23.824 27.698 55.025 1.00 0.00 C ATOM 1478 CD1 LEU A 94 23.872 27.216 53.570 1.00 0.00 C ATOM 1479 CD2 LEU A 94 22.928 28.940 55.093 1.00 0.00 C ATOM 0 H LEU A 94 24.141 24.512 55.215 1.00 0.00 H new ATOM 0 HA LEU A 94 25.192 26.600 56.979 1.00 0.00 H new ATOM 0 HB2 LEU A 94 22.762 25.834 55.304 1.00 0.00 H new ATOM 0 HB3 LEU A 94 22.465 27.015 56.564 1.00 0.00 H new ATOM 0 HG LEU A 94 24.830 27.937 55.371 1.00 0.00 H new ATOM 0 HD11 LEU A 94 24.287 28.002 52.940 1.00 0.00 H new ATOM 0 HD12 LEU A 94 24.499 26.327 53.502 1.00 0.00 H new ATOM 0 HD13 LEU A 94 22.864 26.975 53.233 1.00 0.00 H new ATOM 0 HD21 LEU A 94 23.342 29.723 54.457 1.00 0.00 H new ATOM 0 HD22 LEU A 94 21.926 28.685 54.748 1.00 0.00 H new ATOM 0 HD23 LEU A 94 22.878 29.297 56.122 1.00 0.00 H new ATOM 1491 N GLU A 95 23.510 24.303 58.376 1.00 0.00 N ATOM 1492 CA GLU A 95 22.980 23.849 59.692 1.00 0.00 C ATOM 1493 C GLU A 95 23.827 22.674 60.189 1.00 0.00 C ATOM 1494 O GLU A 95 23.629 22.162 61.289 1.00 0.00 O ATOM 1495 CB GLU A 95 21.539 23.400 59.423 1.00 0.00 C ATOM 1496 CG GLU A 95 21.019 22.590 60.618 1.00 0.00 C ATOM 1497 CD GLU A 95 21.208 21.094 60.349 1.00 0.00 C ATOM 1498 OE1 GLU A 95 22.005 20.759 59.487 1.00 0.00 O ATOM 1499 OE2 GLU A 95 20.552 20.307 61.012 1.00 0.00 O ATOM 0 H GLU A 95 23.643 23.563 57.687 1.00 0.00 H new ATOM 0 HA GLU A 95 23.012 24.630 60.451 1.00 0.00 H new ATOM 0 HB2 GLU A 95 20.902 24.269 59.255 1.00 0.00 H new ATOM 0 HB3 GLU A 95 21.499 22.796 58.517 1.00 0.00 H new ATOM 0 HG2 GLU A 95 21.553 22.877 61.524 1.00 0.00 H new ATOM 0 HG3 GLU A 95 19.965 22.809 60.787 1.00 0.00 H new ATOM 1506 N GLN A 96 24.778 22.246 59.401 1.00 0.00 N ATOM 1507 CA GLN A 96 25.642 21.121 59.823 1.00 0.00 C ATOM 1508 C GLN A 96 26.794 21.652 60.670 1.00 0.00 C ATOM 1509 O GLN A 96 26.979 21.238 61.814 1.00 0.00 O ATOM 1510 CB GLN A 96 26.167 20.509 58.523 1.00 0.00 C ATOM 1511 CG GLN A 96 27.045 19.300 58.847 1.00 0.00 C ATOM 1512 CD GLN A 96 26.160 18.100 59.188 1.00 0.00 C ATOM 1513 OE1 GLN A 96 25.006 18.263 59.576 1.00 0.00 O ATOM 1514 NE2 GLN A 96 26.642 16.894 59.066 1.00 0.00 N ATOM 0 H GLN A 96 24.989 22.633 58.481 1.00 0.00 H new ATOM 0 HA GLN A 96 25.108 20.386 60.425 1.00 0.00 H new ATOM 0 HB2 GLN A 96 25.334 20.207 57.888 1.00 0.00 H new ATOM 0 HB3 GLN A 96 26.741 21.250 57.966 1.00 0.00 H new ATOM 0 HG2 GLN A 96 27.684 19.063 57.996 1.00 0.00 H new ATOM 0 HG3 GLN A 96 27.703 19.530 59.685 1.00 0.00 H new ATOM 0 HE21 GLN A 96 27.600 16.758 58.744 1.00 0.00 H new ATOM 0 HE22 GLN A 96 26.061 16.087 59.293 1.00 0.00 H new ATOM 1523 N GLU A 97 27.578 22.562 60.144 1.00 0.00 N ATOM 1524 CA GLU A 97 28.709 23.096 60.965 1.00 0.00 C ATOM 1525 C GLU A 97 28.243 24.285 61.817 1.00 0.00 C ATOM 1526 O GLU A 97 27.060 24.437 62.110 1.00 0.00 O ATOM 1527 CB GLU A 97 29.781 23.514 59.952 1.00 0.00 C ATOM 1528 CG GLU A 97 29.290 24.700 59.118 1.00 0.00 C ATOM 1529 CD GLU A 97 30.431 25.205 58.228 1.00 0.00 C ATOM 1530 OE1 GLU A 97 31.573 24.885 58.519 1.00 0.00 O ATOM 1531 OE2 GLU A 97 30.142 25.905 57.273 1.00 0.00 O ATOM 0 H GLU A 97 27.488 22.950 59.205 1.00 0.00 H new ATOM 0 HA GLU A 97 29.095 22.356 61.666 1.00 0.00 H new ATOM 0 HB2 GLU A 97 30.699 23.783 60.474 1.00 0.00 H new ATOM 0 HB3 GLU A 97 30.020 22.675 59.298 1.00 0.00 H new ATOM 0 HG2 GLU A 97 28.441 24.400 58.504 1.00 0.00 H new ATOM 0 HG3 GLU A 97 28.943 25.500 59.772 1.00 0.00 H new ATOM 1538 N THR A 98 29.153 25.146 62.194 1.00 0.00 N ATOM 1539 CA THR A 98 28.771 26.347 62.997 1.00 0.00 C ATOM 1540 C THR A 98 28.808 27.581 62.080 1.00 0.00 C ATOM 1541 O THR A 98 27.770 28.186 61.819 1.00 0.00 O ATOM 1542 CB THR A 98 29.795 26.426 64.143 1.00 0.00 C ATOM 1543 OG1 THR A 98 29.425 25.507 65.162 1.00 0.00 O ATOM 1544 CG2 THR A 98 29.829 27.843 64.728 1.00 0.00 C ATOM 0 H THR A 98 30.147 25.069 61.980 1.00 0.00 H new ATOM 0 HA THR A 98 27.764 26.294 63.411 1.00 0.00 H new ATOM 0 HB THR A 98 30.783 26.179 63.756 1.00 0.00 H new ATOM 0 HG1 THR A 98 30.075 25.551 65.894 1.00 0.00 H new ATOM 0 HG21 THR A 98 30.557 27.885 65.538 1.00 0.00 H new ATOM 0 HG22 THR A 98 30.111 28.552 63.949 1.00 0.00 H new ATOM 0 HG23 THR A 98 28.843 28.101 65.114 1.00 0.00 H new ATOM 1552 N PRO A 99 29.969 27.868 61.536 1.00 0.00 N ATOM 1553 CA PRO A 99 30.101 28.972 60.553 1.00 0.00 C ATOM 1554 C PRO A 99 29.293 28.581 59.312 1.00 0.00 C ATOM 1555 O PRO A 99 29.242 27.412 58.957 1.00 0.00 O ATOM 1556 CB PRO A 99 31.600 29.042 60.266 1.00 0.00 C ATOM 1557 CG PRO A 99 32.106 27.683 60.604 1.00 0.00 C ATOM 1558 CD PRO A 99 31.267 27.206 61.758 1.00 0.00 C ATOM 0 HA PRO A 99 29.731 29.939 60.894 1.00 0.00 H new ATOM 0 HB2 PRO A 99 31.794 29.290 59.222 1.00 0.00 H new ATOM 0 HB3 PRO A 99 32.085 29.808 60.871 1.00 0.00 H new ATOM 0 HG2 PRO A 99 32.017 27.010 59.751 1.00 0.00 H new ATOM 0 HG3 PRO A 99 33.161 27.715 60.875 1.00 0.00 H new ATOM 0 HD2 PRO A 99 31.169 26.120 61.761 1.00 0.00 H new ATOM 0 HD3 PRO A 99 31.704 27.489 62.716 1.00 0.00 H new ATOM 1566 N VAL A 100 28.621 29.491 58.671 1.00 0.00 N ATOM 1567 CA VAL A 100 27.793 29.071 57.497 1.00 0.00 C ATOM 1568 C VAL A 100 28.701 28.827 56.292 1.00 0.00 C ATOM 1569 O VAL A 100 29.783 29.402 56.183 1.00 0.00 O ATOM 1570 CB VAL A 100 26.868 30.258 57.227 1.00 0.00 C ATOM 1571 CG1 VAL A 100 25.868 29.896 56.131 1.00 0.00 C ATOM 1572 CG2 VAL A 100 26.108 30.626 58.505 1.00 0.00 C ATOM 0 H VAL A 100 28.604 30.486 58.896 1.00 0.00 H new ATOM 0 HA VAL A 100 27.237 28.152 57.682 1.00 0.00 H new ATOM 0 HB VAL A 100 27.469 31.109 56.904 1.00 0.00 H new ATOM 0 HG11 VAL A 100 25.211 30.745 55.943 1.00 0.00 H new ATOM 0 HG12 VAL A 100 26.406 29.643 55.217 1.00 0.00 H new ATOM 0 HG13 VAL A 100 25.272 29.041 56.450 1.00 0.00 H new ATOM 0 HG21 VAL A 100 25.451 31.472 58.306 1.00 0.00 H new ATOM 0 HG22 VAL A 100 25.513 29.774 58.833 1.00 0.00 H new ATOM 0 HG23 VAL A 100 26.819 30.894 59.287 1.00 0.00 H new ATOM 1582 N THR A 101 28.303 27.948 55.404 1.00 0.00 N ATOM 1583 CA THR A 101 29.178 27.635 54.235 1.00 0.00 C ATOM 1584 C THR A 101 28.596 28.182 52.934 1.00 0.00 C ATOM 1585 O THR A 101 27.718 27.608 52.294 1.00 0.00 O ATOM 1586 CB THR A 101 29.257 26.114 54.176 1.00 0.00 C ATOM 1587 OG1 THR A 101 28.459 25.551 55.208 1.00 0.00 O ATOM 1588 CG2 THR A 101 30.708 25.661 54.351 1.00 0.00 C ATOM 0 H THR A 101 27.419 27.440 55.438 1.00 0.00 H new ATOM 0 HA THR A 101 30.159 28.096 54.351 1.00 0.00 H new ATOM 0 HB THR A 101 28.888 25.777 53.207 1.00 0.00 H new ATOM 0 HG1 THR A 101 28.967 25.542 56.046 1.00 0.00 H new ATOM 0 HG21 THR A 101 30.757 24.573 54.308 1.00 0.00 H new ATOM 0 HG22 THR A 101 31.320 26.084 53.554 1.00 0.00 H new ATOM 0 HG23 THR A 101 31.082 26.003 55.316 1.00 0.00 H new ATOM 1596 N LEU A 102 29.122 29.293 52.567 1.00 0.00 N ATOM 1597 CA LEU A 102 28.747 30.013 51.353 1.00 0.00 C ATOM 1598 C LEU A 102 30.053 30.351 50.660 1.00 0.00 C ATOM 1599 O LEU A 102 30.114 30.535 49.448 1.00 0.00 O ATOM 1600 CB LEU A 102 28.048 31.288 51.843 1.00 0.00 C ATOM 1601 CG LEU A 102 27.122 30.965 53.027 1.00 0.00 C ATOM 1602 CD1 LEU A 102 27.603 31.702 54.281 1.00 0.00 C ATOM 1603 CD2 LEU A 102 25.705 31.407 52.690 1.00 0.00 C ATOM 0 H LEU A 102 29.851 29.762 53.104 1.00 0.00 H new ATOM 0 HA LEU A 102 28.097 29.463 50.672 1.00 0.00 H new ATOM 0 HB2 LEU A 102 28.791 32.026 52.144 1.00 0.00 H new ATOM 0 HB3 LEU A 102 27.471 31.730 51.031 1.00 0.00 H new ATOM 0 HG LEU A 102 27.138 29.892 53.216 1.00 0.00 H new ATOM 0 HD11 LEU A 102 26.942 31.469 55.116 1.00 0.00 H new ATOM 0 HD12 LEU A 102 28.618 31.386 54.522 1.00 0.00 H new ATOM 0 HD13 LEU A 102 27.591 32.777 54.098 1.00 0.00 H new ATOM 0 HD21 LEU A 102 25.044 31.180 53.527 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.694 32.480 52.500 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.360 30.878 51.802 1.00 0.00 H new ATOM 1615 N GLU A 103 31.122 30.429 51.440 1.00 0.00 N ATOM 1616 CA GLU A 103 32.470 30.750 50.908 1.00 0.00 C ATOM 1617 C GLU A 103 32.728 30.089 49.554 1.00 0.00 C ATOM 1618 O GLU A 103 33.259 30.725 48.647 1.00 0.00 O ATOM 1619 CB GLU A 103 33.444 30.208 51.955 1.00 0.00 C ATOM 1620 CG GLU A 103 34.753 31.001 51.897 1.00 0.00 C ATOM 1621 CD GLU A 103 35.780 30.235 51.059 1.00 0.00 C ATOM 1622 OE1 GLU A 103 35.426 29.804 49.973 1.00 0.00 O ATOM 1623 OE2 GLU A 103 36.901 30.092 51.518 1.00 0.00 O ATOM 0 H GLU A 103 31.098 30.276 52.448 1.00 0.00 H new ATOM 0 HA GLU A 103 32.579 31.821 50.740 1.00 0.00 H new ATOM 0 HB2 GLU A 103 33.004 30.284 52.950 1.00 0.00 H new ATOM 0 HB3 GLU A 103 33.639 29.151 51.773 1.00 0.00 H new ATOM 0 HG2 GLU A 103 34.575 31.985 51.463 1.00 0.00 H new ATOM 0 HG3 GLU A 103 35.138 31.162 52.904 1.00 0.00 H new ATOM 1630 N ALA A 104 32.402 28.829 49.383 1.00 0.00 N ATOM 1631 CA ALA A 104 32.695 28.194 48.061 1.00 0.00 C ATOM 1632 C ALA A 104 31.803 28.819 46.985 1.00 0.00 C ATOM 1633 O ALA A 104 32.249 29.124 45.877 1.00 0.00 O ATOM 1634 CB ALA A 104 32.361 26.711 48.241 1.00 0.00 C ATOM 0 H ALA A 104 31.959 28.229 50.079 1.00 0.00 H new ATOM 0 HA ALA A 104 33.730 28.335 47.751 1.00 0.00 H new ATOM 0 HB1 ALA A 104 32.552 26.179 47.309 1.00 0.00 H new ATOM 0 HB2 ALA A 104 32.983 26.291 49.032 1.00 0.00 H new ATOM 0 HB3 ALA A 104 31.310 26.605 48.511 1.00 0.00 H new ATOM 1640 N LEU A 105 30.547 29.025 47.293 1.00 0.00 N ATOM 1641 CA LEU A 105 29.629 29.633 46.292 1.00 0.00 C ATOM 1642 C LEU A 105 30.005 31.102 46.075 1.00 0.00 C ATOM 1643 O LEU A 105 30.225 31.545 44.949 1.00 0.00 O ATOM 1644 CB LEU A 105 28.222 29.506 46.896 1.00 0.00 C ATOM 1645 CG LEU A 105 27.108 29.754 45.844 1.00 0.00 C ATOM 1646 CD1 LEU A 105 27.677 30.189 44.485 1.00 0.00 C ATOM 1647 CD2 LEU A 105 26.287 28.472 45.650 1.00 0.00 C ATOM 0 H LEU A 105 30.122 28.798 48.192 1.00 0.00 H new ATOM 0 HA LEU A 105 29.685 29.141 45.321 1.00 0.00 H new ATOM 0 HB2 LEU A 105 28.100 28.511 47.324 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.113 30.219 47.713 1.00 0.00 H new ATOM 0 HG LEU A 105 26.481 30.561 46.222 1.00 0.00 H new ATOM 0 HD11 LEU A 105 26.859 30.350 43.783 1.00 0.00 H new ATOM 0 HD12 LEU A 105 28.240 31.115 44.606 1.00 0.00 H new ATOM 0 HD13 LEU A 105 28.337 29.411 44.101 1.00 0.00 H new ATOM 0 HD21 LEU A 105 25.506 28.649 44.911 1.00 0.00 H new ATOM 0 HD22 LEU A 105 26.940 27.671 45.303 1.00 0.00 H new ATOM 0 HD23 LEU A 105 25.832 28.185 46.598 1.00 0.00 H new ATOM 1659 N ALA A 106 30.086 31.864 47.132 1.00 0.00 N ATOM 1660 CA ALA A 106 30.449 33.305 46.998 1.00 0.00 C ATOM 1661 C ALA A 106 31.744 33.467 46.195 1.00 0.00 C ATOM 1662 O ALA A 106 31.861 34.354 45.350 1.00 0.00 O ATOM 1663 CB ALA A 106 30.649 33.796 48.434 1.00 0.00 C ATOM 0 H ALA A 106 29.916 31.549 48.087 1.00 0.00 H new ATOM 0 HA ALA A 106 29.681 33.870 46.470 1.00 0.00 H new ATOM 0 HB1 ALA A 106 30.920 34.852 48.423 1.00 0.00 H new ATOM 0 HB2 ALA A 106 29.724 33.664 48.996 1.00 0.00 H new ATOM 0 HB3 ALA A 106 31.446 33.222 48.907 1.00 0.00 H new ATOM 1669 N ASP A 107 32.716 32.629 46.441 1.00 0.00 N ATOM 1670 CA ASP A 107 33.997 32.727 45.699 1.00 0.00 C ATOM 1671 C ASP A 107 33.797 32.361 44.225 1.00 0.00 C ATOM 1672 O ASP A 107 34.411 32.945 43.335 1.00 0.00 O ATOM 1673 CB ASP A 107 34.895 31.710 46.391 1.00 0.00 C ATOM 1674 CG ASP A 107 35.654 32.385 47.536 1.00 0.00 C ATOM 1675 OD1 ASP A 107 35.048 33.180 48.235 1.00 0.00 O ATOM 1676 OD2 ASP A 107 36.829 32.094 47.692 1.00 0.00 O ATOM 0 H ASP A 107 32.673 31.878 47.129 1.00 0.00 H new ATOM 0 HA ASP A 107 34.415 33.733 45.707 1.00 0.00 H new ATOM 0 HB2 ASP A 107 34.296 30.885 46.776 1.00 0.00 H new ATOM 0 HB3 ASP A 107 35.599 31.286 45.675 1.00 0.00 H new ATOM 1681 N GLN A 108 32.957 31.397 43.949 1.00 0.00 N ATOM 1682 CA GLN A 108 32.727 30.986 42.530 1.00 0.00 C ATOM 1683 C GLN A 108 31.934 32.053 41.762 1.00 0.00 C ATOM 1684 O GLN A 108 32.137 32.252 40.565 1.00 0.00 O ATOM 1685 CB GLN A 108 31.922 29.689 42.622 1.00 0.00 C ATOM 1686 CG GLN A 108 31.781 29.077 41.227 1.00 0.00 C ATOM 1687 CD GLN A 108 30.951 27.795 41.314 1.00 0.00 C ATOM 1688 OE1 GLN A 108 31.222 26.928 42.141 1.00 0.00 O ATOM 1689 NE2 GLN A 108 29.946 27.626 40.497 1.00 0.00 N ATOM 0 H GLN A 108 32.421 30.877 44.643 1.00 0.00 H new ATOM 0 HA GLN A 108 33.666 30.857 41.992 1.00 0.00 H new ATOM 0 HB2 GLN A 108 32.419 28.986 43.291 1.00 0.00 H new ATOM 0 HB3 GLN A 108 30.937 29.889 43.045 1.00 0.00 H new ATOM 0 HG2 GLN A 108 31.302 29.788 40.553 1.00 0.00 H new ATOM 0 HG3 GLN A 108 32.765 28.858 40.813 1.00 0.00 H new ATOM 0 HE21 GLN A 108 29.721 28.346 39.810 1.00 0.00 H new ATOM 0 HE22 GLN A 108 29.387 26.774 40.546 1.00 0.00 H new ATOM 1698 N VAL A 109 31.028 32.733 42.414 1.00 0.00 N ATOM 1699 CA VAL A 109 30.216 33.773 41.708 1.00 0.00 C ATOM 1700 C VAL A 109 30.830 35.167 41.883 1.00 0.00 C ATOM 1701 O VAL A 109 30.490 36.098 41.156 1.00 0.00 O ATOM 1702 CB VAL A 109 28.839 33.721 42.374 1.00 0.00 C ATOM 1703 CG1 VAL A 109 27.868 34.628 41.614 1.00 0.00 C ATOM 1704 CG2 VAL A 109 28.310 32.288 42.357 1.00 0.00 C ATOM 0 H VAL A 109 30.814 32.615 43.404 1.00 0.00 H new ATOM 0 HA VAL A 109 30.170 33.584 40.636 1.00 0.00 H new ATOM 0 HB VAL A 109 28.928 34.062 43.406 1.00 0.00 H new ATOM 0 HG11 VAL A 109 26.888 34.590 42.089 1.00 0.00 H new ATOM 0 HG12 VAL A 109 28.240 35.653 41.629 1.00 0.00 H new ATOM 0 HG13 VAL A 109 27.784 34.288 40.582 1.00 0.00 H new ATOM 0 HG21 VAL A 109 27.330 32.256 42.832 1.00 0.00 H new ATOM 0 HG22 VAL A 109 28.225 31.944 41.326 1.00 0.00 H new ATOM 0 HG23 VAL A 109 28.998 31.640 42.900 1.00 0.00 H new ATOM 1714 N ALA A 110 31.711 35.333 42.843 1.00 0.00 N ATOM 1715 CA ALA A 110 32.348 36.671 43.088 1.00 0.00 C ATOM 1716 C ALA A 110 31.387 37.565 43.877 1.00 0.00 C ATOM 1717 O ALA A 110 31.365 38.783 43.713 1.00 0.00 O ATOM 1718 CB ALA A 110 32.649 37.276 41.711 1.00 0.00 C ATOM 0 H ALA A 110 32.019 34.593 43.473 1.00 0.00 H new ATOM 0 HA ALA A 110 33.264 36.577 43.672 1.00 0.00 H new ATOM 0 HB1 ALA A 110 33.115 38.253 41.837 1.00 0.00 H new ATOM 0 HB2 ALA A 110 33.326 36.619 41.165 1.00 0.00 H new ATOM 0 HB3 ALA A 110 31.720 37.386 41.151 1.00 0.00 H new ATOM 1724 N MET A 111 30.584 36.973 44.733 1.00 0.00 N ATOM 1725 CA MET A 111 29.613 37.783 45.535 1.00 0.00 C ATOM 1726 C MET A 111 29.556 37.306 46.999 1.00 0.00 C ATOM 1727 O MET A 111 30.098 36.264 47.361 1.00 0.00 O ATOM 1728 CB MET A 111 28.251 37.600 44.849 1.00 0.00 C ATOM 1729 CG MET A 111 28.033 36.131 44.464 1.00 0.00 C ATOM 1730 SD MET A 111 27.456 35.201 45.904 1.00 0.00 S ATOM 1731 CE MET A 111 26.509 33.958 44.994 1.00 0.00 C ATOM 0 H MET A 111 30.560 35.969 44.909 1.00 0.00 H new ATOM 0 HA MET A 111 29.911 38.831 45.570 1.00 0.00 H new ATOM 0 HB2 MET A 111 27.454 37.929 45.517 1.00 0.00 H new ATOM 0 HB3 MET A 111 28.199 38.226 43.958 1.00 0.00 H new ATOM 0 HG2 MET A 111 27.303 36.061 43.658 1.00 0.00 H new ATOM 0 HG3 MET A 111 28.962 35.701 44.090 1.00 0.00 H new ATOM 0 HE1 MET A 111 26.637 32.984 45.467 1.00 0.00 H new ATOM 0 HE2 MET A 111 25.453 34.228 45.001 1.00 0.00 H new ATOM 0 HE3 MET A 111 26.865 33.911 43.965 1.00 0.00 H new ATOM 1741 N SER A 112 28.915 38.077 47.844 1.00 0.00 N ATOM 1742 CA SER A 112 28.807 37.731 49.303 1.00 0.00 C ATOM 1743 C SER A 112 27.832 36.567 49.552 1.00 0.00 C ATOM 1744 O SER A 112 27.116 36.141 48.649 1.00 0.00 O ATOM 1745 CB SER A 112 28.291 39.008 49.970 1.00 0.00 C ATOM 1746 OG SER A 112 29.354 39.626 50.684 1.00 0.00 O ATOM 0 H SER A 112 28.453 38.948 47.582 1.00 0.00 H new ATOM 0 HA SER A 112 29.767 37.402 49.701 1.00 0.00 H new ATOM 0 HB2 SER A 112 27.897 39.691 49.218 1.00 0.00 H new ATOM 0 HB3 SER A 112 27.471 38.772 50.648 1.00 0.00 H new ATOM 0 HG SER A 112 29.028 40.445 51.111 1.00 0.00 H new ATOM 1752 N PRO A 113 27.830 36.085 50.781 1.00 0.00 N ATOM 1753 CA PRO A 113 26.940 34.960 51.174 1.00 0.00 C ATOM 1754 C PRO A 113 25.476 35.375 51.042 1.00 0.00 C ATOM 1755 O PRO A 113 24.617 34.554 50.710 1.00 0.00 O ATOM 1756 CB PRO A 113 27.326 34.681 52.628 1.00 0.00 C ATOM 1757 CG PRO A 113 27.924 35.963 53.106 1.00 0.00 C ATOM 1758 CD PRO A 113 28.638 36.549 51.919 1.00 0.00 C ATOM 0 HA PRO A 113 27.053 34.076 50.547 1.00 0.00 H new ATOM 0 HB2 PRO A 113 26.457 34.402 53.223 1.00 0.00 H new ATOM 0 HB3 PRO A 113 28.039 33.859 52.699 1.00 0.00 H new ATOM 0 HG2 PRO A 113 27.154 36.641 53.473 1.00 0.00 H new ATOM 0 HG3 PRO A 113 28.615 35.789 53.931 1.00 0.00 H new ATOM 0 HD2 PRO A 113 28.677 37.637 51.969 1.00 0.00 H new ATOM 0 HD3 PRO A 113 29.667 36.196 51.853 1.00 0.00 H new ATOM 1766 N PHE A 114 25.164 36.633 51.231 1.00 0.00 N ATOM 1767 CA PHE A 114 23.748 37.040 51.053 1.00 0.00 C ATOM 1768 C PHE A 114 23.390 36.955 49.579 1.00 0.00 C ATOM 1769 O PHE A 114 22.279 36.553 49.231 1.00 0.00 O ATOM 1770 CB PHE A 114 23.596 38.462 51.582 1.00 0.00 C ATOM 1771 CG PHE A 114 23.690 38.477 53.094 1.00 0.00 C ATOM 1772 CD1 PHE A 114 24.156 37.361 53.803 1.00 0.00 C ATOM 1773 CD2 PHE A 114 23.309 39.627 53.783 1.00 0.00 C ATOM 1774 CE1 PHE A 114 24.245 37.404 55.197 1.00 0.00 C ATOM 1775 CE2 PHE A 114 23.393 39.671 55.177 1.00 0.00 C ATOM 1776 CZ PHE A 114 23.865 38.561 55.885 1.00 0.00 C ATOM 0 H PHE A 114 25.813 37.374 51.494 1.00 0.00 H new ATOM 0 HA PHE A 114 23.073 36.383 51.602 1.00 0.00 H new ATOM 0 HB2 PHE A 114 24.371 39.100 51.157 1.00 0.00 H new ATOM 0 HB3 PHE A 114 22.637 38.873 51.267 1.00 0.00 H new ATOM 0 HD1 PHE A 114 24.447 36.467 53.271 1.00 0.00 H new ATOM 0 HD2 PHE A 114 22.948 40.487 53.238 1.00 0.00 H new ATOM 0 HE1 PHE A 114 24.607 36.545 55.742 1.00 0.00 H new ATOM 0 HE2 PHE A 114 23.093 40.562 55.708 1.00 0.00 H new ATOM 0 HZ PHE A 114 23.936 38.597 56.962 1.00 0.00 H new ATOM 1786 N HIS A 115 24.294 37.271 48.684 1.00 0.00 N ATOM 1787 CA HIS A 115 23.911 37.129 47.263 1.00 0.00 C ATOM 1788 C HIS A 115 23.790 35.635 46.904 1.00 0.00 C ATOM 1789 O HIS A 115 22.951 35.254 46.091 1.00 0.00 O ATOM 1790 CB HIS A 115 24.928 37.827 46.389 1.00 0.00 C ATOM 1791 CG HIS A 115 24.262 37.936 45.054 1.00 0.00 C ATOM 1792 ND1 HIS A 115 24.841 37.462 43.899 1.00 0.00 N ATOM 1793 CD2 HIS A 115 22.997 38.352 44.705 1.00 0.00 C ATOM 1794 CE1 HIS A 115 23.938 37.586 42.917 1.00 0.00 C ATOM 1795 NE2 HIS A 115 22.785 38.126 43.351 1.00 0.00 N ATOM 0 H HIS A 115 25.239 37.606 48.871 1.00 0.00 H new ATOM 0 HA HIS A 115 22.941 37.597 47.093 1.00 0.00 H new ATOM 0 HB2 HIS A 115 25.185 38.809 46.786 1.00 0.00 H new ATOM 0 HB3 HIS A 115 25.855 37.257 46.325 1.00 0.00 H new ATOM 0 HD2 HIS A 115 22.278 38.788 45.382 1.00 0.00 H new ATOM 0 HE1 HIS A 115 24.115 37.287 41.895 1.00 0.00 H new ATOM 0 HE2 HIS A 115 21.945 38.325 42.808 1.00 0.00 H new ATOM 1803 N LEU A 116 24.559 34.772 47.531 1.00 0.00 N ATOM 1804 CA LEU A 116 24.411 33.307 47.256 1.00 0.00 C ATOM 1805 C LEU A 116 22.966 32.928 47.594 1.00 0.00 C ATOM 1806 O LEU A 116 22.291 32.236 46.834 1.00 0.00 O ATOM 1807 CB LEU A 116 25.418 32.599 48.178 1.00 0.00 C ATOM 1808 CG LEU A 116 24.889 31.221 48.627 1.00 0.00 C ATOM 1809 CD1 LEU A 116 24.319 30.440 47.434 1.00 0.00 C ATOM 1810 CD2 LEU A 116 26.035 30.420 49.243 1.00 0.00 C ATOM 0 H LEU A 116 25.275 35.017 48.214 1.00 0.00 H new ATOM 0 HA LEU A 116 24.607 33.028 46.221 1.00 0.00 H new ATOM 0 HB2 LEU A 116 26.367 32.475 47.657 1.00 0.00 H new ATOM 0 HB3 LEU A 116 25.613 33.219 49.053 1.00 0.00 H new ATOM 0 HG LEU A 116 24.095 31.375 49.358 1.00 0.00 H new ATOM 0 HD11 LEU A 116 23.952 29.472 47.775 1.00 0.00 H new ATOM 0 HD12 LEU A 116 23.498 31.003 46.989 1.00 0.00 H new ATOM 0 HD13 LEU A 116 25.101 30.290 46.690 1.00 0.00 H new ATOM 0 HD21 LEU A 116 25.667 29.445 49.562 1.00 0.00 H new ATOM 0 HD22 LEU A 116 26.824 30.286 48.503 1.00 0.00 H new ATOM 0 HD23 LEU A 116 26.433 30.957 50.104 1.00 0.00 H new ATOM 1822 N HIS A 117 22.461 33.422 48.696 1.00 0.00 N ATOM 1823 CA HIS A 117 21.037 33.143 49.054 1.00 0.00 C ATOM 1824 C HIS A 117 20.154 33.666 47.909 1.00 0.00 C ATOM 1825 O HIS A 117 19.243 32.988 47.439 1.00 0.00 O ATOM 1826 CB HIS A 117 20.764 33.918 50.351 1.00 0.00 C ATOM 1827 CG HIS A 117 21.889 33.698 51.329 1.00 0.00 C ATOM 1828 ND1 HIS A 117 22.193 34.616 52.320 1.00 0.00 N ATOM 1829 CD2 HIS A 117 22.808 32.689 51.458 1.00 0.00 C ATOM 1830 CE1 HIS A 117 23.262 34.149 52.992 1.00 0.00 C ATOM 1831 NE2 HIS A 117 23.675 32.978 52.508 1.00 0.00 N ATOM 0 H HIS A 117 22.971 34.004 49.361 1.00 0.00 H new ATOM 0 HA HIS A 117 20.831 32.082 49.197 1.00 0.00 H new ATOM 0 HB2 HIS A 117 20.662 34.981 50.134 1.00 0.00 H new ATOM 0 HB3 HIS A 117 19.821 33.590 50.789 1.00 0.00 H new ATOM 0 HD1 HIS A 117 21.697 35.488 52.507 1.00 0.00 H new ATOM 0 HD2 HIS A 117 22.853 31.805 50.839 1.00 0.00 H new ATOM 0 HE1 HIS A 117 23.728 34.660 53.821 1.00 0.00 H new ATOM 1839 N ARG A 118 20.451 34.850 47.422 1.00 0.00 N ATOM 1840 CA ARG A 118 19.683 35.433 46.269 1.00 0.00 C ATOM 1841 C ARG A 118 19.762 34.494 45.050 1.00 0.00 C ATOM 1842 O ARG A 118 18.788 34.328 44.316 1.00 0.00 O ATOM 1843 CB ARG A 118 20.371 36.766 45.968 1.00 0.00 C ATOM 1844 CG ARG A 118 19.327 37.825 45.583 1.00 0.00 C ATOM 1845 CD ARG A 118 18.204 37.910 46.636 1.00 0.00 C ATOM 1846 NE ARG A 118 18.816 37.514 47.942 1.00 0.00 N ATOM 1847 CZ ARG A 118 19.681 38.292 48.547 1.00 0.00 C ATOM 1848 NH1 ARG A 118 20.032 39.436 48.022 1.00 0.00 N ATOM 1849 NH2 ARG A 118 20.197 37.922 49.686 1.00 0.00 N ATOM 0 H ARG A 118 21.200 35.444 47.777 1.00 0.00 H new ATOM 0 HA ARG A 118 18.626 35.565 46.500 1.00 0.00 H new ATOM 0 HB2 ARG A 118 20.933 37.099 46.841 1.00 0.00 H new ATOM 0 HB3 ARG A 118 21.088 36.639 45.157 1.00 0.00 H new ATOM 0 HG2 ARG A 118 19.811 38.797 45.484 1.00 0.00 H new ATOM 0 HG3 ARG A 118 18.899 37.581 44.610 1.00 0.00 H new ATOM 0 HD2 ARG A 118 17.797 38.920 46.689 1.00 0.00 H new ATOM 0 HD3 ARG A 118 17.379 37.247 46.377 1.00 0.00 H new ATOM 0 HE ARG A 118 18.556 36.625 48.369 1.00 0.00 H new ATOM 0 HH11 ARG A 118 19.632 39.733 47.132 1.00 0.00 H new ATOM 0 HH12 ARG A 118 20.706 40.032 48.502 1.00 0.00 H new ATOM 0 HH21 ARG A 118 19.927 37.031 50.103 1.00 0.00 H new ATOM 0 HH22 ARG A 118 20.870 38.524 50.160 1.00 0.00 H new ATOM 1863 N LEU A 119 20.882 33.835 44.844 1.00 0.00 N ATOM 1864 CA LEU A 119 21.005 32.860 43.702 1.00 0.00 C ATOM 1865 C LEU A 119 20.130 31.620 44.006 1.00 0.00 C ATOM 1866 O LEU A 119 19.343 31.171 43.176 1.00 0.00 O ATOM 1867 CB LEU A 119 22.494 32.489 43.665 1.00 0.00 C ATOM 1868 CG LEU A 119 22.763 31.399 42.616 1.00 0.00 C ATOM 1869 CD1 LEU A 119 22.467 30.023 43.217 1.00 0.00 C ATOM 1870 CD2 LEU A 119 21.879 31.616 41.381 1.00 0.00 C ATOM 0 H LEU A 119 21.720 33.929 45.418 1.00 0.00 H new ATOM 0 HA LEU A 119 20.673 33.266 42.747 1.00 0.00 H new ATOM 0 HB2 LEU A 119 23.088 33.374 43.436 1.00 0.00 H new ATOM 0 HB3 LEU A 119 22.810 32.139 44.648 1.00 0.00 H new ATOM 0 HG LEU A 119 23.810 31.452 42.316 1.00 0.00 H new ATOM 0 HD11 LEU A 119 22.658 29.251 42.471 1.00 0.00 H new ATOM 0 HD12 LEU A 119 23.109 29.858 44.083 1.00 0.00 H new ATOM 0 HD13 LEU A 119 21.423 29.978 43.526 1.00 0.00 H new ATOM 0 HD21 LEU A 119 22.081 30.836 40.647 1.00 0.00 H new ATOM 0 HD22 LEU A 119 20.830 31.576 41.673 1.00 0.00 H new ATOM 0 HD23 LEU A 119 22.097 32.590 40.944 1.00 0.00 H new ATOM 1882 N PHE A 120 20.231 31.093 45.212 1.00 0.00 N ATOM 1883 CA PHE A 120 19.389 29.909 45.642 1.00 0.00 C ATOM 1884 C PHE A 120 17.904 30.211 45.303 1.00 0.00 C ATOM 1885 O PHE A 120 17.175 29.358 44.810 1.00 0.00 O ATOM 1886 CB PHE A 120 19.643 29.858 47.179 1.00 0.00 C ATOM 1887 CG PHE A 120 19.509 28.452 47.778 1.00 0.00 C ATOM 1888 CD1 PHE A 120 18.779 27.461 47.112 1.00 0.00 C ATOM 1889 CD2 PHE A 120 20.085 28.157 49.045 1.00 0.00 C ATOM 1890 CE1 PHE A 120 18.622 26.195 47.682 1.00 0.00 C ATOM 1891 CE2 PHE A 120 19.910 26.887 49.619 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.177 25.908 48.931 1.00 0.00 C ATOM 0 H PHE A 120 20.870 31.436 45.929 1.00 0.00 H new ATOM 0 HA PHE A 120 19.627 28.963 45.156 1.00 0.00 H new ATOM 0 HB2 PHE A 120 20.643 30.238 47.386 1.00 0.00 H new ATOM 0 HB3 PHE A 120 18.939 30.525 47.677 1.00 0.00 H new ATOM 0 HD1 PHE A 120 18.334 27.676 46.152 1.00 0.00 H new ATOM 0 HD2 PHE A 120 20.657 28.910 49.566 1.00 0.00 H new ATOM 0 HE1 PHE A 120 18.068 25.434 47.153 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.338 26.665 50.586 1.00 0.00 H new ATOM 0 HZ PHE A 120 19.042 24.930 49.369 1.00 0.00 H new ATOM 1902 N LYS A 121 17.480 31.433 45.521 1.00 0.00 N ATOM 1903 CA LYS A 121 16.076 31.876 45.189 1.00 0.00 C ATOM 1904 C LYS A 121 15.898 31.950 43.666 1.00 0.00 C ATOM 1905 O LYS A 121 14.918 31.462 43.107 1.00 0.00 O ATOM 1906 CB LYS A 121 16.016 33.286 45.805 1.00 0.00 C ATOM 1907 CG LYS A 121 15.069 34.216 45.029 1.00 0.00 C ATOM 1908 CD LYS A 121 13.617 33.881 45.361 1.00 0.00 C ATOM 1909 CE LYS A 121 12.844 35.172 45.646 1.00 0.00 C ATOM 1910 NZ LYS A 121 12.118 35.475 44.381 1.00 0.00 N ATOM 0 H LYS A 121 18.061 32.166 45.927 1.00 0.00 H new ATOM 0 HA LYS A 121 15.301 31.206 45.561 1.00 0.00 H new ATOM 0 HB2 LYS A 121 15.685 33.215 46.841 1.00 0.00 H new ATOM 0 HB3 LYS A 121 17.017 33.718 45.819 1.00 0.00 H new ATOM 0 HG2 LYS A 121 15.278 35.255 45.283 1.00 0.00 H new ATOM 0 HG3 LYS A 121 15.239 34.110 43.958 1.00 0.00 H new ATOM 0 HD2 LYS A 121 13.157 33.346 44.530 1.00 0.00 H new ATOM 0 HD3 LYS A 121 13.574 33.221 46.227 1.00 0.00 H new ATOM 0 HE2 LYS A 121 12.151 35.042 46.477 1.00 0.00 H new ATOM 0 HE3 LYS A 121 13.519 35.984 45.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 11.791 36.462 44.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 12.756 35.335 43.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 11.299 34.840 44.290 1.00 0.00 H new ATOM 1924 N ALA A 122 16.839 32.562 42.991 1.00 0.00 N ATOM 1925 CA ALA A 122 16.749 32.687 41.503 1.00 0.00 C ATOM 1926 C ALA A 122 16.629 31.301 40.868 1.00 0.00 C ATOM 1927 O ALA A 122 15.715 31.031 40.090 1.00 0.00 O ATOM 1928 CB ALA A 122 18.056 33.361 41.080 1.00 0.00 C ATOM 0 H ALA A 122 17.669 32.982 43.408 1.00 0.00 H new ATOM 0 HA ALA A 122 15.877 33.260 41.187 1.00 0.00 H new ATOM 0 HB1 ALA A 122 18.066 33.488 39.997 1.00 0.00 H new ATOM 0 HB2 ALA A 122 18.135 34.336 41.561 1.00 0.00 H new ATOM 0 HB3 ALA A 122 18.900 32.739 41.380 1.00 0.00 H new ATOM 1934 N THR A 123 17.542 30.423 41.177 1.00 0.00 N ATOM 1935 CA THR A 123 17.490 29.047 40.580 1.00 0.00 C ATOM 1936 C THR A 123 16.282 28.257 41.148 1.00 0.00 C ATOM 1937 O THR A 123 15.377 27.886 40.405 1.00 0.00 O ATOM 1938 CB THR A 123 18.817 28.396 40.992 1.00 0.00 C ATOM 1939 OG1 THR A 123 19.840 29.384 41.011 1.00 0.00 O ATOM 1940 CG2 THR A 123 19.198 27.310 39.983 1.00 0.00 C ATOM 0 H THR A 123 18.321 30.592 41.814 1.00 0.00 H new ATOM 0 HA THR A 123 17.363 29.065 39.498 1.00 0.00 H new ATOM 0 HB THR A 123 18.705 27.953 41.982 1.00 0.00 H new ATOM 0 HG1 THR A 123 20.689 28.971 41.276 1.00 0.00 H new ATOM 0 HG21 THR A 123 20.141 26.851 40.281 1.00 0.00 H new ATOM 0 HG22 THR A 123 18.418 26.550 39.955 1.00 0.00 H new ATOM 0 HG23 THR A 123 19.307 27.755 38.994 1.00 0.00 H new ATOM 1948 N THR A 124 16.219 28.035 42.448 1.00 0.00 N ATOM 1949 CA THR A 124 15.033 27.321 43.057 1.00 0.00 C ATOM 1950 C THR A 124 13.758 27.986 42.536 1.00 0.00 C ATOM 1951 O THR A 124 12.733 27.340 42.327 1.00 0.00 O ATOM 1952 CB THR A 124 15.177 27.468 44.582 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.494 26.396 45.214 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.580 28.797 45.059 1.00 0.00 C ATOM 0 H THR A 124 16.937 28.317 43.115 1.00 0.00 H new ATOM 0 HA THR A 124 14.986 26.264 42.796 1.00 0.00 H new ATOM 0 HB THR A 124 16.236 27.450 44.840 1.00 0.00 H new ATOM 0 HG1 THR A 124 13.945 26.745 45.947 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.693 28.879 46.140 1.00 0.00 H new ATOM 0 HG22 THR A 124 15.100 29.624 44.576 1.00 0.00 H new ATOM 0 HG23 THR A 124 13.522 28.834 44.801 1.00 0.00 H new ATOM 1962 N GLY A 125 13.822 29.274 42.297 1.00 0.00 N ATOM 1963 CA GLY A 125 12.644 30.018 41.758 1.00 0.00 C ATOM 1964 C GLY A 125 12.011 30.996 42.765 1.00 0.00 C ATOM 1965 O GLY A 125 11.662 32.104 42.362 1.00 0.00 O ATOM 0 H GLY A 125 14.651 29.846 42.455 1.00 0.00 H new ATOM 0 HA2 GLY A 125 12.951 30.573 40.871 1.00 0.00 H new ATOM 0 HA3 GLY A 125 11.888 29.300 41.439 1.00 0.00 H new ATOM 1969 N MET A 126 11.860 30.699 44.038 1.00 0.00 N ATOM 1970 CA MET A 126 11.248 31.766 44.912 1.00 0.00 C ATOM 1971 C MET A 126 11.515 31.599 46.418 1.00 0.00 C ATOM 1972 O MET A 126 10.603 31.766 47.228 1.00 0.00 O ATOM 1973 CB MET A 126 9.742 31.638 44.660 1.00 0.00 C ATOM 1974 CG MET A 126 9.346 32.441 43.421 1.00 0.00 C ATOM 1975 SD MET A 126 7.628 32.986 43.582 1.00 0.00 S ATOM 1976 CE MET A 126 6.865 31.348 43.499 1.00 0.00 C ATOM 0 H MET A 126 12.115 29.822 44.492 1.00 0.00 H new ATOM 0 HA MET A 126 11.682 32.733 44.659 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.476 30.590 44.524 1.00 0.00 H new ATOM 0 HB3 MET A 126 9.189 31.997 45.528 1.00 0.00 H new ATOM 0 HG2 MET A 126 10.003 33.303 43.307 1.00 0.00 H new ATOM 0 HG3 MET A 126 9.463 31.830 42.526 1.00 0.00 H new ATOM 0 HE1 MET A 126 5.796 31.453 43.312 1.00 0.00 H new ATOM 0 HE2 MET A 126 7.320 30.775 42.691 1.00 0.00 H new ATOM 0 HE3 MET A 126 7.019 30.827 44.444 1.00 0.00 H new ATOM 1986 N THR A 127 12.735 31.364 46.830 1.00 0.00 N ATOM 1987 CA THR A 127 13.029 31.285 48.289 1.00 0.00 C ATOM 1988 C THR A 127 14.546 31.214 48.520 1.00 0.00 C ATOM 1989 O THR A 127 15.100 30.120 48.544 1.00 0.00 O ATOM 1990 CB THR A 127 12.372 30.007 48.787 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.160 29.754 48.090 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.067 30.192 50.258 1.00 0.00 C ATOM 0 H THR A 127 13.539 31.224 46.218 1.00 0.00 H new ATOM 0 HA THR A 127 12.652 32.162 48.816 1.00 0.00 H new ATOM 0 HB THR A 127 13.042 29.163 48.622 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.559 30.522 48.190 1.00 0.00 H new ATOM 0 HG21 THR A 127 11.594 29.291 50.648 1.00 0.00 H new ATOM 0 HG22 THR A 127 12.993 30.379 50.801 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.394 31.040 50.386 1.00 0.00 H new ATOM 2000 N PRO A 128 15.200 32.332 48.690 1.00 0.00 N ATOM 2001 CA PRO A 128 16.673 32.270 48.891 1.00 0.00 C ATOM 2002 C PRO A 128 17.073 31.611 50.214 1.00 0.00 C ATOM 2003 O PRO A 128 16.857 30.415 50.408 1.00 0.00 O ATOM 2004 CB PRO A 128 17.076 33.750 48.827 1.00 0.00 C ATOM 2005 CG PRO A 128 15.846 34.509 49.218 1.00 0.00 C ATOM 2006 CD PRO A 128 14.668 33.699 48.746 1.00 0.00 C ATOM 0 HA PRO A 128 17.176 31.649 48.150 1.00 0.00 H new ATOM 0 HB2 PRO A 128 17.902 33.963 49.505 1.00 0.00 H new ATOM 0 HB3 PRO A 128 17.407 34.025 47.826 1.00 0.00 H new ATOM 0 HG2 PRO A 128 15.808 34.654 50.298 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.842 35.499 48.763 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.826 33.775 49.434 1.00 0.00 H new ATOM 0 HD3 PRO A 128 14.314 34.034 47.771 1.00 0.00 H new ATOM 2014 N LYS A 129 17.680 32.342 51.124 1.00 0.00 N ATOM 2015 CA LYS A 129 18.109 31.714 52.401 1.00 0.00 C ATOM 2016 C LYS A 129 16.918 31.091 53.137 1.00 0.00 C ATOM 2017 O LYS A 129 17.084 30.193 53.959 1.00 0.00 O ATOM 2018 CB LYS A 129 18.742 32.810 53.236 1.00 0.00 C ATOM 2019 CG LYS A 129 19.213 32.207 54.562 1.00 0.00 C ATOM 2020 CD LYS A 129 19.785 33.303 55.451 1.00 0.00 C ATOM 2021 CE LYS A 129 21.164 33.696 54.931 1.00 0.00 C ATOM 2022 NZ LYS A 129 21.151 35.185 54.888 1.00 0.00 N ATOM 0 H LYS A 129 17.891 33.336 51.032 1.00 0.00 H new ATOM 0 HA LYS A 129 18.817 30.907 52.213 1.00 0.00 H new ATOM 0 HB2 LYS A 129 19.583 33.253 52.703 1.00 0.00 H new ATOM 0 HB3 LYS A 129 18.023 33.609 53.418 1.00 0.00 H new ATOM 0 HG2 LYS A 129 18.380 31.715 55.065 1.00 0.00 H new ATOM 0 HG3 LYS A 129 19.969 31.444 54.377 1.00 0.00 H new ATOM 0 HD2 LYS A 129 19.123 34.169 55.454 1.00 0.00 H new ATOM 0 HD3 LYS A 129 19.857 32.953 56.481 1.00 0.00 H new ATOM 0 HE2 LYS A 129 21.953 33.327 55.587 1.00 0.00 H new ATOM 0 HE3 LYS A 129 21.348 33.274 53.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 21.776 35.516 54.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 20.182 35.519 54.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 21.486 35.562 55.798 1.00 0.00 H new ATOM 2036 N ALA A 130 15.725 31.529 52.850 1.00 0.00 N ATOM 2037 CA ALA A 130 14.539 30.923 53.535 1.00 0.00 C ATOM 2038 C ALA A 130 14.380 29.471 53.046 1.00 0.00 C ATOM 2039 O ALA A 130 14.045 28.583 53.828 1.00 0.00 O ATOM 2040 CB ALA A 130 13.346 31.776 53.100 1.00 0.00 C ATOM 0 H ALA A 130 15.516 32.270 52.181 1.00 0.00 H new ATOM 0 HA ALA A 130 14.632 30.903 54.621 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.437 31.393 53.563 1.00 0.00 H new ATOM 0 HB2 ALA A 130 13.504 32.809 53.411 1.00 0.00 H new ATOM 0 HB3 ALA A 130 13.246 31.736 52.015 1.00 0.00 H new ATOM 2046 N TRP A 131 14.690 29.182 51.785 1.00 0.00 N ATOM 2047 CA TRP A 131 14.622 27.754 51.339 1.00 0.00 C ATOM 2048 C TRP A 131 15.658 26.979 52.112 1.00 0.00 C ATOM 2049 O TRP A 131 15.412 25.866 52.570 1.00 0.00 O ATOM 2050 CB TRP A 131 14.995 27.730 49.861 1.00 0.00 C ATOM 2051 CG TRP A 131 13.952 27.030 49.044 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.232 26.352 47.910 1.00 0.00 C ATOM 2053 CD2 TRP A 131 12.510 26.889 49.260 1.00 0.00 C ATOM 2054 NE1 TRP A 131 13.062 25.826 47.398 1.00 0.00 N ATOM 2055 CE2 TRP A 131 11.974 26.125 48.193 1.00 0.00 C ATOM 2056 CE3 TRP A 131 11.620 27.347 50.252 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 10.613 25.828 48.115 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 10.250 27.046 50.174 1.00 0.00 C ATOM 2059 CH2 TRP A 131 9.748 26.289 49.109 1.00 0.00 C ATOM 0 H TRP A 131 14.977 29.857 51.076 1.00 0.00 H new ATOM 0 HA TRP A 131 13.633 27.325 51.500 1.00 0.00 H new ATOM 0 HB2 TRP A 131 15.118 28.751 49.499 1.00 0.00 H new ATOM 0 HB3 TRP A 131 15.955 27.229 49.735 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.213 26.239 47.474 1.00 0.00 H new ATOM 0 HE1 TRP A 131 13.008 25.282 46.537 1.00 0.00 H new ATOM 0 HE3 TRP A 131 11.994 27.934 51.078 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 10.231 25.245 47.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 9.579 27.401 50.942 1.00 0.00 H new ATOM 0 HH2 TRP A 131 8.693 26.062 49.056 1.00 0.00 H new ATOM 2070 N GLN A 132 16.814 27.550 52.298 1.00 0.00 N ATOM 2071 CA GLN A 132 17.857 26.835 53.080 1.00 0.00 C ATOM 2072 C GLN A 132 17.313 26.545 54.481 1.00 0.00 C ATOM 2073 O GLN A 132 17.545 25.480 55.050 1.00 0.00 O ATOM 2074 CB GLN A 132 19.048 27.793 53.152 1.00 0.00 C ATOM 2075 CG GLN A 132 20.112 27.211 54.089 1.00 0.00 C ATOM 2076 CD GLN A 132 20.007 27.872 55.464 1.00 0.00 C ATOM 2077 OE1 GLN A 132 19.987 27.189 56.486 1.00 0.00 O ATOM 2078 NE2 GLN A 132 19.939 29.169 55.545 1.00 0.00 N ATOM 0 H GLN A 132 17.079 28.470 51.947 1.00 0.00 H new ATOM 0 HA GLN A 132 18.145 25.886 52.628 1.00 0.00 H new ATOM 0 HB2 GLN A 132 19.467 27.945 52.157 1.00 0.00 H new ATOM 0 HB3 GLN A 132 18.723 28.769 53.514 1.00 0.00 H new ATOM 0 HG2 GLN A 132 19.978 26.133 54.182 1.00 0.00 H new ATOM 0 HG3 GLN A 132 21.106 27.374 53.672 1.00 0.00 H new ATOM 0 HE21 GLN A 132 19.956 29.735 54.696 1.00 0.00 H new ATOM 0 HE22 GLN A 132 19.869 29.620 56.457 1.00 0.00 H new ATOM 2087 N GLN A 133 16.586 27.473 55.044 1.00 0.00 N ATOM 2088 CA GLN A 133 16.017 27.256 56.405 1.00 0.00 C ATOM 2089 C GLN A 133 14.987 26.125 56.368 1.00 0.00 C ATOM 2090 O GLN A 133 14.984 25.240 57.219 1.00 0.00 O ATOM 2091 CB GLN A 133 15.349 28.581 56.777 1.00 0.00 C ATOM 2092 CG GLN A 133 15.378 28.764 58.299 1.00 0.00 C ATOM 2093 CD GLN A 133 13.947 28.823 58.839 1.00 0.00 C ATOM 2094 OE1 GLN A 133 13.094 28.033 58.440 1.00 0.00 O ATOM 2095 NE2 GLN A 133 13.636 29.723 59.731 1.00 0.00 N ATOM 0 H GLN A 133 16.362 28.373 54.619 1.00 0.00 H new ATOM 0 HA GLN A 133 16.779 26.971 57.131 1.00 0.00 H new ATOM 0 HB2 GLN A 133 15.866 29.409 56.291 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.320 28.594 56.419 1.00 0.00 H new ATOM 0 HG2 GLN A 133 15.919 27.940 58.764 1.00 0.00 H new ATOM 0 HG3 GLN A 133 15.912 29.679 58.555 1.00 0.00 H new ATOM 0 HE21 GLN A 133 14.344 30.379 60.062 1.00 0.00 H new ATOM 0 HE22 GLN A 133 12.685 29.771 60.097 1.00 0.00 H new ATOM 2104 N ALA A 134 14.112 26.135 55.394 1.00 0.00 N ATOM 2105 CA ALA A 134 13.087 25.053 55.306 1.00 0.00 C ATOM 2106 C ALA A 134 13.775 23.704 55.131 1.00 0.00 C ATOM 2107 O ALA A 134 13.611 22.798 55.946 1.00 0.00 O ATOM 2108 CB ALA A 134 12.240 25.395 54.079 1.00 0.00 C ATOM 0 H ALA A 134 14.064 26.842 54.660 1.00 0.00 H new ATOM 0 HA ALA A 134 12.475 24.987 56.205 1.00 0.00 H new ATOM 0 HB1 ALA A 134 11.464 24.641 53.951 1.00 0.00 H new ATOM 0 HB2 ALA A 134 11.777 26.372 54.217 1.00 0.00 H new ATOM 0 HB3 ALA A 134 12.875 25.416 53.193 1.00 0.00 H new ATOM 2114 N TRP A 135 14.560 23.559 54.098 1.00 0.00 N ATOM 2115 CA TRP A 135 15.296 22.272 53.877 1.00 0.00 C ATOM 2116 C TRP A 135 15.916 21.800 55.194 1.00 0.00 C ATOM 2117 O TRP A 135 15.779 20.650 55.604 1.00 0.00 O ATOM 2118 CB TRP A 135 16.401 22.659 52.922 1.00 0.00 C ATOM 2119 CG TRP A 135 15.857 23.001 51.583 1.00 0.00 C ATOM 2120 CD1 TRP A 135 16.597 23.571 50.628 1.00 0.00 C ATOM 2121 CD2 TRP A 135 14.525 22.795 51.017 1.00 0.00 C ATOM 2122 NE1 TRP A 135 15.820 23.751 49.499 1.00 0.00 N ATOM 2123 CE2 TRP A 135 14.533 23.283 49.688 1.00 0.00 C ATOM 2124 CE3 TRP A 135 13.326 22.245 51.513 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 13.397 23.227 48.881 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 12.181 22.188 50.700 1.00 0.00 C ATOM 2127 CH2 TRP A 135 12.217 22.678 49.387 1.00 0.00 C ATOM 0 H TRP A 135 14.727 24.277 53.393 1.00 0.00 H new ATOM 0 HA TRP A 135 14.656 21.472 53.504 1.00 0.00 H new ATOM 0 HB2 TRP A 135 16.950 23.511 53.323 1.00 0.00 H new ATOM 0 HB3 TRP A 135 17.111 21.837 52.830 1.00 0.00 H new ATOM 0 HD1 TRP A 135 17.637 23.847 50.723 1.00 0.00 H new ATOM 0 HE1 TRP A 135 16.155 24.176 48.634 1.00 0.00 H new ATOM 0 HE3 TRP A 135 13.287 21.865 52.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 13.430 23.606 47.870 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 11.267 21.764 51.089 1.00 0.00 H new ATOM 0 HH2 TRP A 135 11.333 22.631 48.768 1.00 0.00 H new ATOM 2138 N ARG A 136 16.588 22.691 55.852 1.00 0.00 N ATOM 2139 CA ARG A 136 17.245 22.370 57.164 1.00 0.00 C ATOM 2140 C ARG A 136 16.189 21.927 58.186 1.00 0.00 C ATOM 2141 O ARG A 136 16.442 21.078 59.038 1.00 0.00 O ATOM 2142 CB ARG A 136 17.898 23.705 57.569 1.00 0.00 C ATOM 2143 CG ARG A 136 18.113 23.793 59.086 1.00 0.00 C ATOM 2144 CD ARG A 136 18.029 25.261 59.522 1.00 0.00 C ATOM 2145 NE ARG A 136 19.222 25.482 60.392 1.00 0.00 N ATOM 2146 CZ ARG A 136 19.654 26.696 60.637 1.00 0.00 C ATOM 2147 NH1 ARG A 136 19.052 27.740 60.127 1.00 0.00 N ATOM 2148 NH2 ARG A 136 20.699 26.866 61.402 1.00 0.00 N ATOM 0 H ARG A 136 16.719 23.653 55.538 1.00 0.00 H new ATOM 0 HA ARG A 136 17.967 21.555 57.107 1.00 0.00 H new ATOM 0 HB2 ARG A 136 18.855 23.812 57.059 1.00 0.00 H new ATOM 0 HB3 ARG A 136 17.268 24.532 57.242 1.00 0.00 H new ATOM 0 HG2 ARG A 136 17.359 23.203 59.607 1.00 0.00 H new ATOM 0 HG3 ARG A 136 19.085 23.377 59.353 1.00 0.00 H new ATOM 0 HD2 ARG A 136 18.041 25.929 58.660 1.00 0.00 H new ATOM 0 HD3 ARG A 136 17.104 25.458 60.065 1.00 0.00 H new ATOM 0 HE ARG A 136 19.705 24.682 60.800 1.00 0.00 H new ATOM 0 HH11 ARG A 136 18.235 27.616 59.530 1.00 0.00 H new ATOM 0 HH12 ARG A 136 19.400 28.678 60.327 1.00 0.00 H new ATOM 0 HH21 ARG A 136 21.173 26.058 61.804 1.00 0.00 H new ATOM 0 HH22 ARG A 136 21.041 27.807 61.597 1.00 0.00 H new ATOM 2162 N ALA A 137 15.018 22.497 58.118 1.00 0.00 N ATOM 2163 CA ALA A 137 13.948 22.124 59.087 1.00 0.00 C ATOM 2164 C ALA A 137 13.438 20.712 58.795 1.00 0.00 C ATOM 2165 O ALA A 137 13.093 19.960 59.705 1.00 0.00 O ATOM 2166 CB ALA A 137 12.837 23.154 58.874 1.00 0.00 C ATOM 0 H ALA A 137 14.755 23.206 57.433 1.00 0.00 H new ATOM 0 HA ALA A 137 14.307 22.124 60.116 1.00 0.00 H new ATOM 0 HB1 ALA A 137 12.011 22.945 59.554 1.00 0.00 H new ATOM 0 HB2 ALA A 137 13.225 24.153 59.071 1.00 0.00 H new ATOM 0 HB3 ALA A 137 12.482 23.099 57.845 1.00 0.00 H new ATOM 2172 N ARG A 138 13.395 20.332 57.550 1.00 0.00 N ATOM 2173 CA ARG A 138 12.922 18.961 57.199 1.00 0.00 C ATOM 2174 C ARG A 138 14.116 18.043 56.921 1.00 0.00 C ATOM 2175 O ARG A 138 13.945 16.864 56.617 1.00 0.00 O ATOM 2176 CB ARG A 138 12.079 19.146 55.939 1.00 0.00 C ATOM 2177 CG ARG A 138 10.985 18.077 55.898 1.00 0.00 C ATOM 2178 CD ARG A 138 9.823 18.570 55.033 1.00 0.00 C ATOM 2179 NE ARG A 138 9.323 17.355 54.329 1.00 0.00 N ATOM 2180 CZ ARG A 138 8.526 17.464 53.293 1.00 0.00 C ATOM 2181 NH1 ARG A 138 8.156 18.640 52.855 1.00 0.00 N ATOM 2182 NH2 ARG A 138 8.099 16.388 52.691 1.00 0.00 N ATOM 0 H ARG A 138 13.667 20.912 56.756 1.00 0.00 H new ATOM 0 HA ARG A 138 12.352 18.500 58.006 1.00 0.00 H new ATOM 0 HB2 ARG A 138 11.632 20.140 55.930 1.00 0.00 H new ATOM 0 HB3 ARG A 138 12.709 19.072 55.053 1.00 0.00 H new ATOM 0 HG2 ARG A 138 11.385 17.147 55.493 1.00 0.00 H new ATOM 0 HG3 ARG A 138 10.635 17.861 56.907 1.00 0.00 H new ATOM 0 HD2 ARG A 138 9.041 19.022 55.643 1.00 0.00 H new ATOM 0 HD3 ARG A 138 10.153 19.329 54.324 1.00 0.00 H new ATOM 0 HE ARG A 138 9.603 16.430 54.656 1.00 0.00 H new ATOM 0 HH11 ARG A 138 8.488 19.485 53.320 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.536 18.712 52.048 1.00 0.00 H new ATOM 0 HH21 ARG A 138 8.385 15.468 53.027 1.00 0.00 H new ATOM 0 HH22 ARG A 138 7.479 16.467 51.885 1.00 0.00 H new ATOM 2196 N ARG A 139 15.319 18.549 57.016 1.00 0.00 N ATOM 2197 CA ARG A 139 16.509 17.684 56.751 1.00 0.00 C ATOM 2198 C ARG A 139 17.659 18.052 57.693 1.00 0.00 C ATOM 2199 O ARG A 139 17.448 18.886 58.557 1.00 0.00 O ATOM 2200 CB ARG A 139 16.894 17.973 55.300 1.00 0.00 C ATOM 2201 CG ARG A 139 17.575 16.742 54.698 1.00 0.00 C ATOM 2202 CD ARG A 139 18.056 17.061 53.280 1.00 0.00 C ATOM 2203 NE ARG A 139 18.621 15.779 52.768 1.00 0.00 N ATOM 2204 CZ ARG A 139 17.831 14.796 52.405 1.00 0.00 C ATOM 2205 NH1 ARG A 139 16.530 14.920 52.481 1.00 0.00 N ATOM 2206 NH2 ARG A 139 18.348 13.684 51.960 1.00 0.00 N ATOM 2207 OXT ARG A 139 18.730 17.489 57.534 1.00 0.00 O ATOM 0 H ARG A 139 15.529 19.516 57.264 1.00 0.00 H new ATOM 0 HA ARG A 139 16.293 16.628 56.915 1.00 0.00 H new ATOM 0 HB2 ARG A 139 16.007 18.230 54.721 1.00 0.00 H new ATOM 0 HB3 ARG A 139 17.564 18.831 55.254 1.00 0.00 H new ATOM 0 HG2 ARG A 139 18.418 16.441 55.319 1.00 0.00 H new ATOM 0 HG3 ARG A 139 16.879 15.903 54.676 1.00 0.00 H new ATOM 0 HD2 ARG A 139 17.235 17.409 52.653 1.00 0.00 H new ATOM 0 HD3 ARG A 139 18.808 17.850 53.286 1.00 0.00 H new ATOM 0 HE ARG A 139 19.632 15.665 52.699 1.00 0.00 H new ATOM 0 HH11 ARG A 139 16.120 15.788 52.825 1.00 0.00 H new ATOM 0 HH12 ARG A 139 15.927 14.149 52.196 1.00 0.00 H new ATOM 0 HH21 ARG A 139 19.361 13.582 51.896 1.00 0.00 H new ATOM 0 HH22 ARG A 139 17.739 12.916 51.676 1.00 0.00 H new