USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 561 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 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 33 SER OG : rot 180:sc= 0.00609 USER MOD Set 2.2: A 68 GLN : amide:sc= -0.842 K(o=-0.84,f=-11!) USER MOD Single : A 10 GLN : amide:sc= -0.219 X(o=-0.22,f=-0.55) USER MOD Single : A 16 SER OG : rot 145:sc= 0.00189 USER MOD Single : A 19 SER OG : rot 180:sc= 0.0235 USER MOD Single : A 24 SER OG : rot 93:sc= 1.34 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 49:sc= -0.224 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc=-0.00502 X(o=-0.005,f=-0.18) USER MOD Single : A 52 GLN : amide:sc= -0.0527 X(o=-0.053,f=-0.14) USER MOD Single : A 54 THR OG1 : rot 115:sc= -0.151 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -0.107 X(o=-0.11,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 104 N GLN A 10 -15.744 -6.271 0.842 1.00 0.00 N ATOM 105 CA GLN A 10 -16.388 -6.877 2.001 1.00 0.00 C ATOM 106 C GLN A 10 -17.480 -7.850 1.569 1.00 0.00 C ATOM 107 O GLN A 10 -17.978 -7.803 0.444 1.00 0.00 O ATOM 108 CB GLN A 10 -16.981 -5.795 2.905 1.00 0.00 C ATOM 109 CG GLN A 10 -16.063 -5.386 4.046 1.00 0.00 C ATOM 110 CD GLN A 10 -16.658 -4.291 4.910 1.00 0.00 C ATOM 111 OE1 GLN A 10 -17.731 -4.457 5.490 1.00 0.00 O ATOM 112 NE2 GLN A 10 -15.962 -3.164 5.000 1.00 0.00 N ATOM 0 HA GLN A 10 -15.632 -7.431 2.557 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.212 -4.916 2.303 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.923 -6.155 3.319 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -15.850 -6.257 4.666 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -15.112 -5.045 3.638 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -15.077 -3.070 4.502 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -16.312 -2.392 5.567 1.00 0.00 H new ATOM 121 N PRO A 11 -17.863 -8.754 2.483 1.00 0.00 N ATOM 122 CA PRO A 11 -18.901 -9.755 2.220 1.00 0.00 C ATOM 123 C PRO A 11 -20.290 -9.136 2.108 1.00 0.00 C ATOM 124 O PRO A 11 -20.586 -8.105 2.712 1.00 0.00 O ATOM 125 CB PRO A 11 -18.823 -10.676 3.440 1.00 0.00 C ATOM 126 CG PRO A 11 -18.255 -9.824 4.522 1.00 0.00 C ATOM 127 CD PRO A 11 -17.313 -8.867 3.844 1.00 0.00 C ATOM 0 HA PRO A 11 -18.741 -10.267 1.271 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -19.807 -11.057 3.712 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -18.189 -11.541 3.243 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -19.043 -9.287 5.050 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -17.731 -10.430 5.261 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.289 -7.901 4.349 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -16.292 -9.247 3.834 1.00 0.00 H new ATOM 135 N PRO A 12 -21.163 -9.777 1.317 1.00 0.00 N ATOM 136 CA PRO A 12 -22.535 -9.307 1.108 1.00 0.00 C ATOM 137 C PRO A 12 -23.398 -9.465 2.356 1.00 0.00 C ATOM 138 O PRO A 12 -22.946 -9.991 3.372 1.00 0.00 O ATOM 139 CB PRO A 12 -23.051 -10.207 -0.017 1.00 0.00 C ATOM 140 CG PRO A 12 -22.233 -11.448 0.085 1.00 0.00 C ATOM 141 CD PRO A 12 -20.877 -11.012 0.567 1.00 0.00 C ATOM 0 HA PRO A 12 -22.570 -8.244 0.871 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -24.113 -10.422 0.103 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -22.930 -9.732 -0.991 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -22.684 -12.157 0.779 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -22.162 -11.949 -0.881 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -20.413 -11.768 1.200 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -20.195 -10.829 -0.263 1.00 0.00 H new ATOM 149 N ALA A 13 -24.643 -9.007 2.270 1.00 0.00 N ATOM 150 CA ALA A 13 -25.570 -9.101 3.391 1.00 0.00 C ATOM 151 C ALA A 13 -26.458 -10.334 3.268 1.00 0.00 C ATOM 152 O ALA A 13 -26.827 -10.948 4.270 1.00 0.00 O ATOM 153 CB ALA A 13 -26.421 -7.843 3.479 1.00 0.00 C ATOM 0 H ALA A 13 -25.032 -8.567 1.436 1.00 0.00 H new ATOM 0 HA ALA A 13 -24.985 -9.196 4.306 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -27.109 -7.927 4.321 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -25.776 -6.976 3.623 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -26.989 -7.723 2.557 1.00 0.00 H new ATOM 159 N ASP A 14 -26.798 -10.692 2.035 1.00 0.00 N ATOM 160 CA ASP A 14 -27.642 -11.854 1.781 1.00 0.00 C ATOM 161 C ASP A 14 -26.819 -13.138 1.794 1.00 0.00 C ATOM 162 O ASP A 14 -27.322 -14.206 2.144 1.00 0.00 O ATOM 163 CB ASP A 14 -28.358 -11.706 0.437 1.00 0.00 C ATOM 164 CG ASP A 14 -29.864 -11.821 0.568 1.00 0.00 C ATOM 165 OD1 ASP A 14 -30.342 -12.882 1.021 1.00 0.00 O ATOM 166 OD2 ASP A 14 -30.566 -10.849 0.218 1.00 0.00 O ATOM 0 H ASP A 14 -26.502 -10.194 1.195 1.00 0.00 H new ATOM 0 HA ASP A 14 -28.385 -11.913 2.576 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -28.107 -10.740 -0.001 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -27.996 -12.471 -0.250 1.00 0.00 H new ATOM 171 N LEU A 15 -25.552 -13.026 1.410 1.00 0.00 N ATOM 172 CA LEU A 15 -24.659 -14.179 1.377 1.00 0.00 C ATOM 173 C LEU A 15 -25.265 -15.314 0.558 1.00 0.00 C ATOM 174 O LEU A 15 -25.010 -16.489 0.823 1.00 0.00 O ATOM 175 CB LEU A 15 -24.364 -14.662 2.798 1.00 0.00 C ATOM 176 CG LEU A 15 -23.337 -13.846 3.585 1.00 0.00 C ATOM 177 CD1 LEU A 15 -23.978 -13.227 4.817 1.00 0.00 C ATOM 178 CD2 LEU A 15 -22.153 -14.717 3.978 1.00 0.00 C ATOM 0 H LEU A 15 -25.120 -12.149 1.117 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.727 -13.871 0.904 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -25.299 -14.670 3.359 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -24.015 -15.693 2.745 1.00 0.00 H new ATOM 0 HG LEU A 15 -22.974 -13.041 2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.232 -12.650 5.364 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -24.793 -12.570 4.512 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -24.369 -14.016 5.459 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -21.432 -14.120 4.537 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -22.499 -15.543 4.599 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -21.678 -15.112 3.080 1.00 0.00 H new ATOM 190 N SER A 16 -26.065 -14.955 -0.441 1.00 0.00 N ATOM 191 CA SER A 16 -26.708 -15.943 -1.299 1.00 0.00 C ATOM 192 C SER A 16 -26.130 -15.895 -2.710 1.00 0.00 C ATOM 193 O SER A 16 -26.830 -16.153 -3.688 1.00 0.00 O ATOM 194 CB SER A 16 -28.218 -15.703 -1.345 1.00 0.00 C ATOM 195 OG SER A 16 -28.644 -14.916 -0.246 1.00 0.00 O ATOM 0 H SER A 16 -26.283 -13.987 -0.676 1.00 0.00 H new ATOM 0 HA SER A 16 -26.517 -16.931 -0.881 1.00 0.00 H new ATOM 0 HB2 SER A 16 -28.482 -15.204 -2.277 1.00 0.00 H new ATOM 0 HB3 SER A 16 -28.742 -16.659 -1.336 1.00 0.00 H new ATOM 0 HG SER A 16 -29.377 -14.330 -0.528 1.00 0.00 H new ATOM 201 N GLY A 17 -24.847 -15.563 -2.806 1.00 0.00 N ATOM 202 CA GLY A 17 -24.195 -15.487 -4.101 1.00 0.00 C ATOM 203 C GLY A 17 -22.686 -15.585 -3.997 1.00 0.00 C ATOM 204 O GLY A 17 -21.963 -15.054 -4.841 1.00 0.00 O ATOM 0 H GLY A 17 -24.247 -15.345 -2.011 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -24.565 -16.290 -4.738 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -24.463 -14.547 -4.584 1.00 0.00 H new ATOM 208 N LEU A 18 -22.209 -16.264 -2.960 1.00 0.00 N ATOM 209 CA LEU A 18 -20.775 -16.429 -2.748 1.00 0.00 C ATOM 210 C LEU A 18 -20.337 -17.854 -3.071 1.00 0.00 C ATOM 211 O LEU A 18 -21.007 -18.819 -2.701 1.00 0.00 O ATOM 212 CB LEU A 18 -20.411 -16.087 -1.302 1.00 0.00 C ATOM 213 CG LEU A 18 -20.696 -14.651 -0.860 1.00 0.00 C ATOM 214 CD1 LEU A 18 -20.275 -14.444 0.586 1.00 0.00 C ATOM 215 CD2 LEU A 18 -19.983 -13.662 -1.771 1.00 0.00 C ATOM 0 H LEU A 18 -22.794 -16.709 -2.253 1.00 0.00 H new ATOM 0 HA LEU A 18 -20.253 -15.747 -3.419 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.954 -16.764 -0.642 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.349 -16.286 -1.159 1.00 0.00 H new ATOM 0 HG LEU A 18 -21.769 -14.475 -0.933 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.485 -13.416 0.883 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -20.830 -15.128 1.228 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.207 -14.639 0.686 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.197 -12.645 -1.442 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -18.908 -13.839 -1.729 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.333 -13.793 -2.795 1.00 0.00 H new ATOM 227 N SER A 19 -19.209 -17.979 -3.761 1.00 0.00 N ATOM 228 CA SER A 19 -18.682 -19.286 -4.135 1.00 0.00 C ATOM 229 C SER A 19 -17.932 -19.924 -2.969 1.00 0.00 C ATOM 230 O SER A 19 -17.815 -19.333 -1.895 1.00 0.00 O ATOM 231 CB SER A 19 -17.753 -19.158 -5.344 1.00 0.00 C ATOM 232 OG SER A 19 -16.529 -18.543 -4.984 1.00 0.00 O ATOM 0 H SER A 19 -18.642 -17.191 -4.073 1.00 0.00 H new ATOM 0 HA SER A 19 -19.523 -19.927 -4.398 1.00 0.00 H new ATOM 0 HB2 SER A 19 -17.558 -20.145 -5.763 1.00 0.00 H new ATOM 0 HB3 SER A 19 -18.243 -18.573 -6.122 1.00 0.00 H new ATOM 0 HG SER A 19 -15.953 -18.475 -5.774 1.00 0.00 H new ATOM 238 N ILE A 20 -17.427 -21.133 -3.189 1.00 0.00 N ATOM 239 CA ILE A 20 -16.688 -21.850 -2.158 1.00 0.00 C ATOM 240 C ILE A 20 -15.417 -21.102 -1.772 1.00 0.00 C ATOM 241 O ILE A 20 -14.943 -21.207 -0.641 1.00 0.00 O ATOM 242 CB ILE A 20 -16.314 -23.271 -2.620 1.00 0.00 C ATOM 243 CG1 ILE A 20 -17.559 -24.019 -3.100 1.00 0.00 C ATOM 244 CG2 ILE A 20 -15.634 -24.033 -1.491 1.00 0.00 C ATOM 245 CD1 ILE A 20 -17.270 -25.420 -3.592 1.00 0.00 C ATOM 0 H ILE A 20 -17.516 -21.636 -4.072 1.00 0.00 H new ATOM 0 HA ILE A 20 -17.343 -21.919 -1.290 1.00 0.00 H new ATOM 0 HB ILE A 20 -15.616 -23.194 -3.453 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -18.279 -24.071 -2.283 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -18.028 -23.450 -3.903 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -15.376 -25.035 -1.833 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -14.728 -23.507 -1.191 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -16.311 -24.103 -0.640 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -18.198 -25.890 -3.916 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -16.574 -25.375 -4.430 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -16.829 -26.005 -2.785 1.00 0.00 H new ATOM 257 N GLU A 21 -14.870 -20.346 -2.719 1.00 0.00 N ATOM 258 CA GLU A 21 -13.654 -19.579 -2.476 1.00 0.00 C ATOM 259 C GLU A 21 -13.975 -18.248 -1.804 1.00 0.00 C ATOM 260 O GLU A 21 -13.209 -17.759 -0.975 1.00 0.00 O ATOM 261 CB GLU A 21 -12.909 -19.334 -3.790 1.00 0.00 C ATOM 262 CG GLU A 21 -11.545 -20.000 -3.850 1.00 0.00 C ATOM 263 CD GLU A 21 -11.042 -20.173 -5.270 1.00 0.00 C ATOM 264 OE1 GLU A 21 -11.329 -19.297 -6.113 1.00 0.00 O ATOM 265 OE2 GLU A 21 -10.362 -21.186 -5.539 1.00 0.00 O ATOM 0 H GLU A 21 -15.249 -20.248 -3.661 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.017 -20.158 -1.808 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -13.519 -19.699 -4.617 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -12.786 -18.260 -3.934 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.829 -19.404 -3.285 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.600 -20.975 -3.367 1.00 0.00 H new ATOM 272 N GLU A 22 -15.114 -17.666 -2.169 1.00 0.00 N ATOM 273 CA GLU A 22 -15.535 -16.391 -1.603 1.00 0.00 C ATOM 274 C GLU A 22 -15.771 -16.514 -0.100 1.00 0.00 C ATOM 275 O GLU A 22 -15.583 -15.555 0.650 1.00 0.00 O ATOM 276 CB GLU A 22 -16.810 -15.898 -2.291 1.00 0.00 C ATOM 277 CG GLU A 22 -16.559 -15.232 -3.633 1.00 0.00 C ATOM 278 CD GLU A 22 -16.344 -13.736 -3.511 1.00 0.00 C ATOM 279 OE1 GLU A 22 -17.347 -13.001 -3.397 1.00 0.00 O ATOM 280 OE2 GLU A 22 -15.174 -13.300 -3.529 1.00 0.00 O ATOM 0 H GLU A 22 -15.761 -18.058 -2.854 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.737 -15.668 -1.770 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.485 -16.742 -2.434 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.318 -15.192 -1.634 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -15.684 -15.684 -4.101 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.406 -15.421 -4.292 1.00 0.00 H new ATOM 287 N VAL A 23 -16.183 -17.701 0.333 1.00 0.00 N ATOM 288 CA VAL A 23 -16.444 -17.951 1.746 1.00 0.00 C ATOM 289 C VAL A 23 -15.169 -17.817 2.572 1.00 0.00 C ATOM 290 O VAL A 23 -15.197 -17.322 3.698 1.00 0.00 O ATOM 291 CB VAL A 23 -17.041 -19.354 1.966 1.00 0.00 C ATOM 292 CG1 VAL A 23 -17.299 -19.597 3.445 1.00 0.00 C ATOM 293 CG2 VAL A 23 -18.319 -19.521 1.159 1.00 0.00 C ATOM 0 H VAL A 23 -16.343 -18.505 -0.274 1.00 0.00 H new ATOM 0 HA VAL A 23 -17.165 -17.202 2.073 1.00 0.00 H new ATOM 0 HB VAL A 23 -16.321 -20.096 1.620 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -17.721 -20.593 3.582 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -16.361 -19.521 3.995 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -18.000 -18.851 3.819 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -18.727 -20.518 1.326 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -19.048 -18.773 1.472 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -18.100 -19.392 0.099 1.00 0.00 H new ATOM 303 N SER A 24 -14.053 -18.262 2.004 1.00 0.00 N ATOM 304 CA SER A 24 -12.768 -18.196 2.689 1.00 0.00 C ATOM 305 C SER A 24 -12.478 -16.775 3.163 1.00 0.00 C ATOM 306 O SER A 24 -11.874 -16.569 4.216 1.00 0.00 O ATOM 307 CB SER A 24 -11.647 -18.675 1.764 1.00 0.00 C ATOM 308 OG SER A 24 -12.160 -19.480 0.716 1.00 0.00 O ATOM 0 H SER A 24 -14.013 -18.672 1.071 1.00 0.00 H new ATOM 0 HA SER A 24 -12.815 -18.850 3.560 1.00 0.00 H new ATOM 0 HB2 SER A 24 -11.125 -17.815 1.344 1.00 0.00 H new ATOM 0 HB3 SER A 24 -10.915 -19.243 2.338 1.00 0.00 H new ATOM 0 HG SER A 24 -12.340 -18.920 -0.068 1.00 0.00 H new ATOM 314 N LYS A 25 -12.913 -15.795 2.377 1.00 0.00 N ATOM 315 CA LYS A 25 -12.702 -14.393 2.714 1.00 0.00 C ATOM 316 C LYS A 25 -13.805 -13.884 3.636 1.00 0.00 C ATOM 317 O LYS A 25 -13.592 -12.963 4.426 1.00 0.00 O ATOM 318 CB LYS A 25 -12.654 -13.543 1.442 1.00 0.00 C ATOM 319 CG LYS A 25 -11.371 -13.711 0.646 1.00 0.00 C ATOM 320 CD LYS A 25 -10.773 -12.368 0.262 1.00 0.00 C ATOM 321 CE LYS A 25 -11.544 -11.721 -0.879 1.00 0.00 C ATOM 322 NZ LYS A 25 -10.730 -11.644 -2.124 1.00 0.00 N ATOM 0 H LYS A 25 -13.414 -15.947 1.502 1.00 0.00 H new ATOM 0 HA LYS A 25 -11.749 -14.310 3.236 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.502 -13.804 0.808 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.769 -12.493 1.712 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.649 -14.277 1.234 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.574 -14.291 -0.254 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.778 -11.705 1.128 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.732 -12.502 -0.031 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.452 -12.292 -1.073 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.854 -10.718 -0.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.290 -11.197 -2.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.876 -11.078 -1.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.455 -12.603 -2.419 1.00 0.00 H new ATOM 336 N SER A 26 -14.984 -14.489 3.532 1.00 0.00 N ATOM 337 CA SER A 26 -16.121 -14.095 4.356 1.00 0.00 C ATOM 338 C SER A 26 -15.741 -14.076 5.834 1.00 0.00 C ATOM 339 O SER A 26 -15.892 -13.060 6.513 1.00 0.00 O ATOM 340 CB SER A 26 -17.295 -15.050 4.132 1.00 0.00 C ATOM 341 OG SER A 26 -17.722 -15.025 2.781 1.00 0.00 O ATOM 0 H SER A 26 -15.177 -15.254 2.885 1.00 0.00 H new ATOM 0 HA SER A 26 -16.419 -13.088 4.063 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.001 -16.063 4.405 1.00 0.00 H new ATOM 0 HB3 SER A 26 -18.123 -14.772 4.784 1.00 0.00 H new ATOM 0 HG SER A 26 -16.946 -15.125 2.191 1.00 0.00 H new ATOM 347 N LEU A 27 -15.247 -15.207 6.325 1.00 0.00 N ATOM 348 CA LEU A 27 -14.844 -15.323 7.722 1.00 0.00 C ATOM 349 C LEU A 27 -13.740 -14.324 8.055 1.00 0.00 C ATOM 350 O LEU A 27 -13.651 -13.835 9.182 1.00 0.00 O ATOM 351 CB LEU A 27 -14.368 -16.746 8.020 1.00 0.00 C ATOM 352 CG LEU A 27 -15.435 -17.838 7.956 1.00 0.00 C ATOM 353 CD1 LEU A 27 -14.793 -19.216 8.007 1.00 0.00 C ATOM 354 CD2 LEU A 27 -16.437 -17.673 9.090 1.00 0.00 C ATOM 0 H LEU A 27 -15.116 -16.057 5.776 1.00 0.00 H new ATOM 0 HA LEU A 27 -15.710 -15.099 8.344 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.576 -16.998 7.314 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -13.924 -16.758 9.015 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.968 -17.742 7.010 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.568 -19.981 7.960 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.116 -19.334 7.161 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -14.234 -19.323 8.937 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -17.189 -18.459 9.028 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.919 -17.741 10.046 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -16.922 -16.700 9.009 1.00 0.00 H new ATOM 366 N ARG A 28 -12.903 -14.025 7.068 1.00 0.00 N ATOM 367 CA ARG A 28 -11.805 -13.084 7.256 1.00 0.00 C ATOM 368 C ARG A 28 -12.310 -11.771 7.845 1.00 0.00 C ATOM 369 O ARG A 28 -11.597 -11.097 8.589 1.00 0.00 O ATOM 370 CB ARG A 28 -11.098 -12.820 5.925 1.00 0.00 C ATOM 371 CG ARG A 28 -9.593 -12.656 6.057 1.00 0.00 C ATOM 372 CD ARG A 28 -8.880 -12.999 4.758 1.00 0.00 C ATOM 373 NE ARG A 28 -7.822 -12.042 4.445 1.00 0.00 N ATOM 374 CZ ARG A 28 -6.687 -11.952 5.129 1.00 0.00 C ATOM 375 NH1 ARG A 28 -6.463 -12.757 6.158 1.00 0.00 N ATOM 376 NH2 ARG A 28 -5.772 -11.055 4.783 1.00 0.00 N ATOM 0 H ARG A 28 -12.964 -14.420 6.130 1.00 0.00 H new ATOM 0 HA ARG A 28 -11.095 -13.527 7.955 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -11.307 -13.644 5.243 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.515 -11.919 5.474 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -9.361 -11.629 6.341 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -9.224 -13.299 6.857 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -8.454 -13.999 4.832 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -9.603 -13.020 3.942 1.00 0.00 H new ATOM 0 HE ARG A 28 -7.962 -11.408 3.658 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -7.163 -13.448 6.427 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -5.590 -12.685 6.681 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -5.940 -10.434 3.991 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -4.901 -10.986 5.309 1.00 0.00 H new ATOM 390 N PHE A 29 -13.545 -11.412 7.508 1.00 0.00 N ATOM 391 CA PHE A 29 -14.145 -10.179 8.003 1.00 0.00 C ATOM 392 C PHE A 29 -14.054 -10.102 9.524 1.00 0.00 C ATOM 393 O PHE A 29 -13.746 -9.050 10.085 1.00 0.00 O ATOM 394 CB PHE A 29 -15.608 -10.086 7.563 1.00 0.00 C ATOM 395 CG PHE A 29 -16.253 -8.772 7.899 1.00 0.00 C ATOM 396 CD1 PHE A 29 -15.843 -7.605 7.276 1.00 0.00 C ATOM 397 CD2 PHE A 29 -17.268 -8.705 8.839 1.00 0.00 C ATOM 398 CE1 PHE A 29 -16.435 -6.394 7.583 1.00 0.00 C ATOM 399 CE2 PHE A 29 -17.864 -7.497 9.150 1.00 0.00 C ATOM 400 CZ PHE A 29 -17.446 -6.340 8.522 1.00 0.00 C ATOM 0 H PHE A 29 -14.149 -11.958 6.894 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.592 -9.340 7.581 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -15.666 -10.245 6.486 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -16.173 -10.890 8.035 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.052 -7.641 6.542 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.597 -9.606 9.334 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -16.107 -5.491 7.089 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.656 -7.458 9.883 1.00 0.00 H new ATOM 0 HZ PHE A 29 -17.909 -5.395 8.765 1.00 0.00 H new ATOM 410 N ILE A 30 -14.324 -11.222 10.185 1.00 0.00 N ATOM 411 CA ILE A 30 -14.272 -11.282 11.640 1.00 0.00 C ATOM 412 C ILE A 30 -12.913 -11.778 12.122 1.00 0.00 C ATOM 413 O ILE A 30 -12.475 -11.449 13.223 1.00 0.00 O ATOM 414 CB ILE A 30 -15.371 -12.201 12.205 1.00 0.00 C ATOM 415 CG1 ILE A 30 -15.283 -13.590 11.568 1.00 0.00 C ATOM 416 CG2 ILE A 30 -16.745 -11.591 11.970 1.00 0.00 C ATOM 417 CD1 ILE A 30 -16.233 -14.596 12.178 1.00 0.00 C ATOM 0 H ILE A 30 -14.581 -12.101 9.736 1.00 0.00 H new ATOM 0 HA ILE A 30 -14.435 -10.267 12.003 1.00 0.00 H new ATOM 0 HB ILE A 30 -15.220 -12.304 13.280 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -15.492 -13.506 10.502 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.263 -13.961 11.665 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -17.511 -12.252 12.375 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -16.803 -10.622 12.466 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -16.907 -11.461 10.900 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -16.116 -15.557 11.678 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -16.010 -14.710 13.239 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -17.259 -14.247 12.058 1.00 0.00 H new ATOM 429 N GLY A 31 -12.248 -12.571 11.287 1.00 0.00 N ATOM 430 CA GLY A 31 -10.944 -13.098 11.644 1.00 0.00 C ATOM 431 C GLY A 31 -11.038 -14.356 12.486 1.00 0.00 C ATOM 432 O GLY A 31 -11.156 -14.285 13.710 1.00 0.00 O ATOM 0 H GLY A 31 -12.589 -12.858 10.370 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -10.381 -13.314 10.736 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.386 -12.339 12.192 1.00 0.00 H new ATOM 436 N LEU A 32 -10.988 -15.510 11.830 1.00 0.00 N ATOM 437 CA LEU A 32 -11.070 -16.789 12.525 1.00 0.00 C ATOM 438 C LEU A 32 -9.821 -17.628 12.272 1.00 0.00 C ATOM 439 O LEU A 32 -8.907 -17.200 11.567 1.00 0.00 O ATOM 440 CB LEU A 32 -12.314 -17.558 12.075 1.00 0.00 C ATOM 441 CG LEU A 32 -13.659 -16.940 12.455 1.00 0.00 C ATOM 442 CD1 LEU A 32 -14.804 -17.838 12.014 1.00 0.00 C ATOM 443 CD2 LEU A 32 -13.725 -16.687 13.954 1.00 0.00 C ATOM 0 H LEU A 32 -10.891 -15.586 10.817 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.141 -16.589 13.594 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.279 -17.664 10.991 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.267 -18.563 12.495 1.00 0.00 H new ATOM 0 HG LEU A 32 -13.756 -15.984 11.940 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.753 -17.381 12.293 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.768 -17.968 10.932 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.712 -18.810 12.500 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.690 -16.247 14.207 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -13.606 -17.630 14.488 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -12.927 -16.003 14.243 1.00 0.00 H new ATOM 455 N SER A 33 -9.790 -18.824 12.851 1.00 0.00 N ATOM 456 CA SER A 33 -8.652 -19.721 12.690 1.00 0.00 C ATOM 457 C SER A 33 -8.595 -20.276 11.270 1.00 0.00 C ATOM 458 O SER A 33 -9.625 -20.582 10.670 1.00 0.00 O ATOM 459 CB SER A 33 -8.736 -20.871 13.695 1.00 0.00 C ATOM 460 OG SER A 33 -9.292 -20.435 14.924 1.00 0.00 O ATOM 0 H SER A 33 -10.540 -19.194 13.435 1.00 0.00 H new ATOM 0 HA SER A 33 -7.742 -19.151 12.876 1.00 0.00 H new ATOM 0 HB2 SER A 33 -9.345 -21.675 13.282 1.00 0.00 H new ATOM 0 HB3 SER A 33 -7.741 -21.281 13.868 1.00 0.00 H new ATOM 0 HG SER A 33 -9.337 -21.189 15.549 1.00 0.00 H new ATOM 466 N GLU A 34 -7.382 -20.402 10.739 1.00 0.00 N ATOM 467 CA GLU A 34 -7.190 -20.918 9.389 1.00 0.00 C ATOM 468 C GLU A 34 -7.837 -22.292 9.235 1.00 0.00 C ATOM 469 O GLU A 34 -8.221 -22.689 8.135 1.00 0.00 O ATOM 470 CB GLU A 34 -5.698 -21.005 9.060 1.00 0.00 C ATOM 471 CG GLU A 34 -5.062 -19.658 8.760 1.00 0.00 C ATOM 472 CD GLU A 34 -3.644 -19.786 8.238 1.00 0.00 C ATOM 473 OE1 GLU A 34 -3.476 -20.203 7.073 1.00 0.00 O ATOM 474 OE2 GLU A 34 -2.703 -19.469 8.995 1.00 0.00 O ATOM 0 H GLU A 34 -6.519 -20.154 11.223 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.669 -20.230 8.693 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.176 -21.465 9.899 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.562 -21.661 8.201 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.669 -19.129 8.025 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -5.058 -19.052 9.666 1.00 0.00 H new ATOM 481 N ASP A 35 -7.954 -23.012 10.345 1.00 0.00 N ATOM 482 CA ASP A 35 -8.554 -24.341 10.335 1.00 0.00 C ATOM 483 C ASP A 35 -10.035 -24.266 9.977 1.00 0.00 C ATOM 484 O ASP A 35 -10.524 -25.033 9.148 1.00 0.00 O ATOM 485 CB ASP A 35 -8.380 -25.013 11.697 1.00 0.00 C ATOM 486 CG ASP A 35 -6.947 -25.435 11.956 1.00 0.00 C ATOM 487 OD1 ASP A 35 -6.061 -25.036 11.172 1.00 0.00 O ATOM 488 OD2 ASP A 35 -6.711 -26.165 12.942 1.00 0.00 O ATOM 0 H ASP A 35 -7.641 -22.698 11.264 1.00 0.00 H new ATOM 0 HA ASP A 35 -8.045 -24.936 9.577 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -8.701 -24.327 12.481 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -9.029 -25.887 11.753 1.00 0.00 H new ATOM 493 N VAL A 36 -10.745 -23.335 10.608 1.00 0.00 N ATOM 494 CA VAL A 36 -12.170 -23.159 10.356 1.00 0.00 C ATOM 495 C VAL A 36 -12.431 -22.811 8.895 1.00 0.00 C ATOM 496 O VAL A 36 -13.240 -23.456 8.228 1.00 0.00 O ATOM 497 CB VAL A 36 -12.765 -22.055 11.250 1.00 0.00 C ATOM 498 CG1 VAL A 36 -14.245 -21.867 10.952 1.00 0.00 C ATOM 499 CG2 VAL A 36 -12.547 -22.384 12.719 1.00 0.00 C ATOM 0 H VAL A 36 -10.356 -22.691 11.297 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.653 -24.107 10.592 1.00 0.00 H new ATOM 0 HB VAL A 36 -12.252 -21.118 11.031 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.649 -21.083 11.593 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -14.373 -21.583 9.907 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.776 -22.800 11.142 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.974 -21.593 13.336 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -13.032 -23.331 12.956 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -11.479 -22.464 12.919 1.00 0.00 H new ATOM 509 N ILE A 37 -11.740 -21.788 8.404 1.00 0.00 N ATOM 510 CA ILE A 37 -11.896 -21.355 7.021 1.00 0.00 C ATOM 511 C ILE A 37 -11.738 -22.526 6.057 1.00 0.00 C ATOM 512 O ILE A 37 -12.574 -22.737 5.179 1.00 0.00 O ATOM 513 CB ILE A 37 -10.876 -20.261 6.655 1.00 0.00 C ATOM 514 CG1 ILE A 37 -11.027 -19.058 7.588 1.00 0.00 C ATOM 515 CG2 ILE A 37 -11.050 -19.839 5.204 1.00 0.00 C ATOM 516 CD1 ILE A 37 -9.974 -17.993 7.376 1.00 0.00 C ATOM 0 H ILE A 37 -11.067 -21.244 8.943 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.902 -20.946 6.930 1.00 0.00 H new ATOM 0 HB ILE A 37 -9.872 -20.666 6.777 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -12.013 -18.617 7.442 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -10.981 -19.402 8.621 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -10.322 -19.065 4.960 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.896 -20.700 4.554 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.057 -19.449 5.057 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -10.143 -17.171 8.071 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.986 -18.419 7.551 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -10.033 -17.621 6.353 1.00 0.00 H new ATOM 528 N SER A 38 -10.661 -23.285 6.229 1.00 0.00 N ATOM 529 CA SER A 38 -10.391 -24.435 5.373 1.00 0.00 C ATOM 530 C SER A 38 -11.416 -25.540 5.609 1.00 0.00 C ATOM 531 O SER A 38 -11.709 -26.333 4.714 1.00 0.00 O ATOM 532 CB SER A 38 -8.981 -24.968 5.630 1.00 0.00 C ATOM 533 OG SER A 38 -8.188 -24.898 4.457 1.00 0.00 O ATOM 0 H SER A 38 -9.961 -23.125 6.953 1.00 0.00 H new ATOM 0 HA SER A 38 -10.465 -24.110 4.335 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.510 -24.391 6.426 1.00 0.00 H new ATOM 0 HB3 SER A 38 -9.036 -26.001 5.974 1.00 0.00 H new ATOM 0 HG SER A 38 -7.291 -25.243 4.648 1.00 0.00 H new ATOM 539 N PHE A 39 -11.959 -25.586 6.821 1.00 0.00 N ATOM 540 CA PHE A 39 -12.951 -26.594 7.177 1.00 0.00 C ATOM 541 C PHE A 39 -14.213 -26.436 6.334 1.00 0.00 C ATOM 542 O PHE A 39 -14.974 -27.387 6.151 1.00 0.00 O ATOM 543 CB PHE A 39 -13.301 -26.493 8.663 1.00 0.00 C ATOM 544 CG PHE A 39 -12.938 -27.721 9.449 1.00 0.00 C ATOM 545 CD1 PHE A 39 -13.403 -28.968 9.064 1.00 0.00 C ATOM 546 CD2 PHE A 39 -12.134 -27.628 10.573 1.00 0.00 C ATOM 547 CE1 PHE A 39 -13.070 -30.100 9.784 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.798 -28.756 11.297 1.00 0.00 C ATOM 549 CZ PHE A 39 -12.268 -29.993 10.903 1.00 0.00 C ATOM 0 H PHE A 39 -11.729 -24.937 7.573 1.00 0.00 H new ATOM 0 HA PHE A 39 -12.522 -27.576 6.978 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.788 -25.632 9.091 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -14.371 -26.309 8.765 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -14.033 -29.057 8.191 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.765 -26.663 10.887 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -13.437 -31.067 9.472 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -11.168 -28.670 12.170 1.00 0.00 H new ATOM 0 HZ PHE A 39 -12.009 -30.875 11.469 1.00 0.00 H new ATOM 559 N PHE A 40 -14.430 -25.228 5.824 1.00 0.00 N ATOM 560 CA PHE A 40 -15.600 -24.944 5.002 1.00 0.00 C ATOM 561 C PHE A 40 -15.291 -25.161 3.523 1.00 0.00 C ATOM 562 O PHE A 40 -16.103 -25.716 2.783 1.00 0.00 O ATOM 563 CB PHE A 40 -16.074 -23.507 5.230 1.00 0.00 C ATOM 564 CG PHE A 40 -17.038 -23.369 6.373 1.00 0.00 C ATOM 565 CD1 PHE A 40 -16.785 -23.984 7.589 1.00 0.00 C ATOM 566 CD2 PHE A 40 -18.198 -22.623 6.232 1.00 0.00 C ATOM 567 CE1 PHE A 40 -17.670 -23.858 8.643 1.00 0.00 C ATOM 568 CE2 PHE A 40 -19.086 -22.494 7.283 1.00 0.00 C ATOM 569 CZ PHE A 40 -18.823 -23.113 8.489 1.00 0.00 C ATOM 0 H PHE A 40 -13.811 -24.430 5.966 1.00 0.00 H new ATOM 0 HA PHE A 40 -16.394 -25.631 5.294 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -15.208 -22.872 5.417 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -16.547 -23.140 4.319 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -15.886 -24.569 7.714 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -18.410 -22.138 5.291 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -17.460 -24.341 9.586 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -19.986 -21.909 7.161 1.00 0.00 H new ATOM 0 HZ PHE A 40 -19.517 -23.015 9.310 1.00 0.00 H new ATOM 579 N VAL A 41 -14.112 -24.717 3.100 1.00 0.00 N ATOM 580 CA VAL A 41 -13.695 -24.862 1.710 1.00 0.00 C ATOM 581 C VAL A 41 -13.467 -26.327 1.355 1.00 0.00 C ATOM 582 O VAL A 41 -13.614 -26.728 0.200 1.00 0.00 O ATOM 583 CB VAL A 41 -12.405 -24.070 1.426 1.00 0.00 C ATOM 584 CG1 VAL A 41 -11.975 -24.250 -0.022 1.00 0.00 C ATOM 585 CG2 VAL A 41 -12.602 -22.597 1.752 1.00 0.00 C ATOM 0 H VAL A 41 -13.429 -24.254 3.699 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.501 -24.463 1.094 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.613 -24.458 2.066 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -11.062 -23.683 -0.204 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -11.791 -25.306 -0.218 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -12.763 -23.890 -0.683 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.681 -22.052 1.546 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.408 -22.193 1.139 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -12.859 -22.489 2.806 1.00 0.00 H new ATOM 595 N THR A 42 -13.107 -27.124 2.356 1.00 0.00 N ATOM 596 CA THR A 42 -12.858 -28.545 2.150 1.00 0.00 C ATOM 597 C THR A 42 -14.160 -29.339 2.161 1.00 0.00 C ATOM 598 O THR A 42 -14.238 -30.427 1.591 1.00 0.00 O ATOM 599 CB THR A 42 -11.915 -29.113 3.228 1.00 0.00 C ATOM 600 OG1 THR A 42 -11.517 -30.443 2.880 1.00 0.00 O ATOM 601 CG2 THR A 42 -12.594 -29.121 4.590 1.00 0.00 C ATOM 0 H THR A 42 -12.981 -26.809 3.318 1.00 0.00 H new ATOM 0 HA THR A 42 -12.383 -28.644 1.174 1.00 0.00 H new ATOM 0 HB THR A 42 -11.034 -28.474 3.282 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.917 -30.796 3.570 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.910 -29.526 5.335 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.869 -28.103 4.865 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.490 -29.740 4.546 1.00 0.00 H new ATOM 609 N GLU A 43 -15.179 -28.787 2.812 1.00 0.00 N ATOM 610 CA GLU A 43 -16.477 -29.445 2.896 1.00 0.00 C ATOM 611 C GLU A 43 -17.418 -28.933 1.809 1.00 0.00 C ATOM 612 O GLU A 43 -18.639 -29.016 1.939 1.00 0.00 O ATOM 613 CB GLU A 43 -17.101 -29.218 4.275 1.00 0.00 C ATOM 614 CG GLU A 43 -16.693 -30.256 5.306 1.00 0.00 C ATOM 615 CD GLU A 43 -17.671 -31.412 5.389 1.00 0.00 C ATOM 616 OE1 GLU A 43 -18.893 -31.159 5.359 1.00 0.00 O ATOM 617 OE2 GLU A 43 -17.212 -32.570 5.482 1.00 0.00 O ATOM 0 H GLU A 43 -15.131 -27.886 3.288 1.00 0.00 H new ATOM 0 HA GLU A 43 -16.324 -30.514 2.746 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -16.816 -28.229 4.635 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -18.187 -29.222 4.178 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.703 -30.639 5.058 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -16.615 -29.780 6.284 1.00 0.00 H new ATOM 624 N LYS A 44 -16.840 -28.402 0.737 1.00 0.00 N ATOM 625 CA LYS A 44 -17.625 -27.877 -0.374 1.00 0.00 C ATOM 626 C LYS A 44 -18.641 -26.850 0.115 1.00 0.00 C ATOM 627 O LYS A 44 -19.692 -26.662 -0.498 1.00 0.00 O ATOM 628 CB LYS A 44 -18.343 -29.015 -1.101 1.00 0.00 C ATOM 629 CG LYS A 44 -18.580 -28.741 -2.577 1.00 0.00 C ATOM 630 CD LYS A 44 -19.657 -29.649 -3.147 1.00 0.00 C ATOM 631 CE LYS A 44 -20.799 -28.846 -3.752 1.00 0.00 C ATOM 632 NZ LYS A 44 -21.659 -29.684 -4.633 1.00 0.00 N ATOM 0 H LYS A 44 -15.830 -28.324 0.614 1.00 0.00 H new ATOM 0 HA LYS A 44 -16.943 -27.385 -1.067 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -17.756 -29.928 -0.999 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -19.302 -29.197 -0.615 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -18.872 -27.700 -2.712 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -17.651 -28.886 -3.129 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -19.223 -30.297 -3.908 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -20.043 -30.297 -2.360 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -21.405 -28.418 -2.954 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -20.393 -28.013 -4.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -22.425 -29.101 -5.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -21.086 -30.072 -5.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -22.067 -30.464 -4.080 1.00 0.00 H new ATOM 646 N ILE A 45 -18.320 -26.188 1.222 1.00 0.00 N ATOM 647 CA ILE A 45 -19.205 -25.178 1.791 1.00 0.00 C ATOM 648 C ILE A 45 -19.123 -23.872 1.008 1.00 0.00 C ATOM 649 O ILE A 45 -18.050 -23.282 0.875 1.00 0.00 O ATOM 650 CB ILE A 45 -18.866 -24.901 3.267 1.00 0.00 C ATOM 651 CG1 ILE A 45 -18.747 -26.216 4.041 1.00 0.00 C ATOM 652 CG2 ILE A 45 -19.924 -24.005 3.894 1.00 0.00 C ATOM 653 CD1 ILE A 45 -20.039 -27.002 4.100 1.00 0.00 C ATOM 0 H ILE A 45 -17.455 -26.333 1.742 1.00 0.00 H new ATOM 0 HA ILE A 45 -20.219 -25.574 1.728 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.907 -24.385 3.314 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -17.977 -26.833 3.577 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -18.415 -26.002 5.057 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -19.671 -23.818 4.938 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -19.965 -23.058 3.355 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -20.896 -24.496 3.839 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -19.880 -27.921 4.664 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -20.807 -26.404 4.591 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -20.362 -27.248 3.088 1.00 0.00 H new ATOM 665 N ASP A 46 -20.263 -23.424 0.494 1.00 0.00 N ATOM 666 CA ASP A 46 -20.322 -22.185 -0.273 1.00 0.00 C ATOM 667 C ASP A 46 -21.237 -21.170 0.404 1.00 0.00 C ATOM 668 O ASP A 46 -21.756 -21.416 1.493 1.00 0.00 O ATOM 669 CB ASP A 46 -20.812 -22.463 -1.695 1.00 0.00 C ATOM 670 CG ASP A 46 -22.044 -23.346 -1.720 1.00 0.00 C ATOM 671 OD1 ASP A 46 -23.136 -22.850 -1.372 1.00 0.00 O ATOM 672 OD2 ASP A 46 -21.917 -24.533 -2.087 1.00 0.00 O ATOM 0 H ASP A 46 -21.159 -23.901 0.595 1.00 0.00 H new ATOM 0 HA ASP A 46 -19.316 -21.767 -0.319 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -21.036 -21.518 -2.190 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -20.015 -22.941 -2.264 1.00 0.00 H new ATOM 677 N GLY A 47 -21.430 -20.027 -0.247 1.00 0.00 N ATOM 678 CA GLY A 47 -22.282 -18.991 0.307 1.00 0.00 C ATOM 679 C GLY A 47 -23.678 -19.494 0.619 1.00 0.00 C ATOM 680 O GLY A 47 -24.140 -19.396 1.755 1.00 0.00 O ATOM 0 H GLY A 47 -21.011 -19.800 -1.149 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -21.828 -18.600 1.218 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -22.347 -18.162 -0.398 1.00 0.00 H new ATOM 684 N ASN A 48 -24.351 -20.032 -0.393 1.00 0.00 N ATOM 685 CA ASN A 48 -25.704 -20.549 -0.221 1.00 0.00 C ATOM 686 C ASN A 48 -25.746 -21.609 0.876 1.00 0.00 C ATOM 687 O ASN A 48 -26.763 -21.781 1.549 1.00 0.00 O ATOM 688 CB ASN A 48 -26.217 -21.140 -1.536 1.00 0.00 C ATOM 689 CG ASN A 48 -27.681 -20.827 -1.778 1.00 0.00 C ATOM 690 OD1 ASN A 48 -28.100 -19.672 -1.710 1.00 0.00 O ATOM 691 ND2 ASN A 48 -28.467 -21.859 -2.063 1.00 0.00 N ATOM 0 H ASN A 48 -23.982 -20.121 -1.340 1.00 0.00 H new ATOM 0 HA ASN A 48 -26.348 -19.721 0.074 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -25.623 -20.750 -2.363 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -26.076 -22.221 -1.525 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -29.461 -21.710 -2.236 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -28.076 -22.800 -2.109 1.00 0.00 H new ATOM 698 N LEU A 49 -24.635 -22.315 1.051 1.00 0.00 N ATOM 699 CA LEU A 49 -24.543 -23.358 2.068 1.00 0.00 C ATOM 700 C LEU A 49 -24.377 -22.751 3.457 1.00 0.00 C ATOM 701 O LEU A 49 -24.967 -23.225 4.428 1.00 0.00 O ATOM 702 CB LEU A 49 -23.372 -24.293 1.763 1.00 0.00 C ATOM 703 CG LEU A 49 -23.507 -25.727 2.276 1.00 0.00 C ATOM 704 CD1 LEU A 49 -23.617 -25.744 3.792 1.00 0.00 C ATOM 705 CD2 LEU A 49 -24.713 -26.407 1.644 1.00 0.00 C ATOM 0 H LEU A 49 -23.785 -22.185 0.502 1.00 0.00 H new ATOM 0 HA LEU A 49 -25.470 -23.931 2.051 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -23.232 -24.327 0.683 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -22.467 -23.860 2.189 1.00 0.00 H new ATOM 0 HG LEU A 49 -22.612 -26.280 1.992 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -23.712 -26.773 4.138 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -22.723 -25.296 4.227 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -24.494 -25.175 4.100 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -24.794 -27.427 2.020 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -25.617 -25.854 1.898 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -24.593 -26.428 0.561 1.00 0.00 H new ATOM 717 N LEU A 50 -23.571 -21.698 3.544 1.00 0.00 N ATOM 718 CA LEU A 50 -23.329 -21.024 4.815 1.00 0.00 C ATOM 719 C LEU A 50 -24.622 -20.446 5.381 1.00 0.00 C ATOM 720 O LEU A 50 -24.945 -20.648 6.551 1.00 0.00 O ATOM 721 CB LEU A 50 -22.295 -19.911 4.635 1.00 0.00 C ATOM 722 CG LEU A 50 -22.107 -18.970 5.826 1.00 0.00 C ATOM 723 CD1 LEU A 50 -21.833 -19.763 7.094 1.00 0.00 C ATOM 724 CD2 LEU A 50 -20.978 -17.986 5.555 1.00 0.00 C ATOM 0 H LEU A 50 -23.075 -21.293 2.750 1.00 0.00 H new ATOM 0 HA LEU A 50 -22.943 -21.760 5.520 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -21.333 -20.370 4.405 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.580 -19.315 3.768 1.00 0.00 H new ATOM 0 HG LEU A 50 -23.028 -18.405 5.968 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.702 -19.077 7.931 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -22.674 -20.427 7.297 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -20.927 -20.355 6.964 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -20.858 -17.324 6.413 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -20.051 -18.534 5.387 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.215 -17.394 4.671 1.00 0.00 H new ATOM 736 N VAL A 51 -25.360 -19.728 4.541 1.00 0.00 N ATOM 737 CA VAL A 51 -26.620 -19.123 4.955 1.00 0.00 C ATOM 738 C VAL A 51 -27.623 -20.186 5.389 1.00 0.00 C ATOM 739 O VAL A 51 -28.520 -19.918 6.188 1.00 0.00 O ATOM 740 CB VAL A 51 -27.239 -18.281 3.823 1.00 0.00 C ATOM 741 CG1 VAL A 51 -26.348 -17.093 3.494 1.00 0.00 C ATOM 742 CG2 VAL A 51 -27.474 -19.139 2.589 1.00 0.00 C ATOM 0 H VAL A 51 -25.107 -19.551 3.569 1.00 0.00 H new ATOM 0 HA VAL A 51 -26.395 -18.472 5.800 1.00 0.00 H new ATOM 0 HB VAL A 51 -28.202 -17.900 4.162 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -26.801 -16.510 2.692 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -26.235 -16.467 4.379 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -25.369 -17.450 3.174 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -27.912 -18.528 1.799 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -26.525 -19.550 2.246 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -28.154 -19.954 2.837 1.00 0.00 H new ATOM 752 N GLN A 52 -27.465 -21.394 4.857 1.00 0.00 N ATOM 753 CA GLN A 52 -28.357 -22.498 5.189 1.00 0.00 C ATOM 754 C GLN A 52 -27.888 -23.216 6.450 1.00 0.00 C ATOM 755 O GLN A 52 -28.695 -23.775 7.195 1.00 0.00 O ATOM 756 CB GLN A 52 -28.436 -23.486 4.024 1.00 0.00 C ATOM 757 CG GLN A 52 -29.325 -23.014 2.885 1.00 0.00 C ATOM 758 CD GLN A 52 -29.148 -23.840 1.626 1.00 0.00 C ATOM 759 OE1 GLN A 52 -28.995 -23.298 0.531 1.00 0.00 O ATOM 760 NE2 GLN A 52 -29.169 -25.159 1.775 1.00 0.00 N ATOM 0 H GLN A 52 -26.727 -21.633 4.194 1.00 0.00 H new ATOM 0 HA GLN A 52 -29.349 -22.087 5.375 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -27.431 -23.663 3.640 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -28.809 -24.441 4.393 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -30.367 -23.058 3.200 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -29.103 -21.970 2.664 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -29.298 -25.566 2.701 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -29.056 -25.766 0.963 1.00 0.00 H new ATOM 769 N LEU A 53 -26.581 -23.199 6.683 1.00 0.00 N ATOM 770 CA LEU A 53 -26.003 -23.849 7.854 1.00 0.00 C ATOM 771 C LEU A 53 -26.648 -23.333 9.137 1.00 0.00 C ATOM 772 O LEU A 53 -26.946 -22.144 9.261 1.00 0.00 O ATOM 773 CB LEU A 53 -24.492 -23.615 7.899 1.00 0.00 C ATOM 774 CG LEU A 53 -23.624 -24.722 7.301 1.00 0.00 C ATOM 775 CD1 LEU A 53 -22.190 -24.243 7.133 1.00 0.00 C ATOM 776 CD2 LEU A 53 -23.673 -25.968 8.172 1.00 0.00 C ATOM 0 H LEU A 53 -25.900 -22.742 6.076 1.00 0.00 H new ATOM 0 HA LEU A 53 -26.196 -24.919 7.777 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -24.273 -22.685 7.374 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -24.197 -23.471 8.939 1.00 0.00 H new ATOM 0 HG LEU A 53 -24.019 -24.976 6.317 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -21.586 -25.044 6.706 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -22.170 -23.380 6.468 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.784 -23.961 8.105 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -23.049 -26.745 7.731 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -23.304 -25.729 9.169 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -24.701 -26.323 8.241 1.00 0.00 H new ATOM 788 N THR A 54 -26.859 -24.234 10.091 1.00 0.00 N ATOM 789 CA THR A 54 -27.467 -23.870 11.365 1.00 0.00 C ATOM 790 C THR A 54 -26.436 -23.877 12.488 1.00 0.00 C ATOM 791 O THR A 54 -25.241 -24.038 12.244 1.00 0.00 O ATOM 792 CB THR A 54 -28.617 -24.827 11.733 1.00 0.00 C ATOM 793 OG1 THR A 54 -28.092 -26.114 12.076 1.00 0.00 O ATOM 794 CG2 THR A 54 -29.597 -24.965 10.577 1.00 0.00 C ATOM 0 H THR A 54 -26.618 -25.221 10.006 1.00 0.00 H new ATOM 0 HA THR A 54 -27.866 -22.863 11.248 1.00 0.00 H new ATOM 0 HB THR A 54 -29.147 -24.411 12.590 1.00 0.00 H new ATOM 0 HG1 THR A 54 -28.274 -26.300 13.021 1.00 0.00 H new ATOM 0 HG21 THR A 54 -30.400 -25.645 10.860 1.00 0.00 H new ATOM 0 HG22 THR A 54 -30.017 -23.988 10.337 1.00 0.00 H new ATOM 0 HG23 THR A 54 -29.077 -25.361 9.704 1.00 0.00 H new ATOM 802 N GLU A 55 -26.908 -23.702 13.719 1.00 0.00 N ATOM 803 CA GLU A 55 -26.025 -23.688 14.879 1.00 0.00 C ATOM 804 C GLU A 55 -25.843 -25.095 15.442 1.00 0.00 C ATOM 805 O GLU A 55 -24.775 -25.440 15.945 1.00 0.00 O ATOM 806 CB GLU A 55 -26.583 -22.762 15.962 1.00 0.00 C ATOM 807 CG GLU A 55 -25.882 -22.900 17.302 1.00 0.00 C ATOM 808 CD GLU A 55 -25.478 -21.562 17.891 1.00 0.00 C ATOM 809 OE1 GLU A 55 -26.316 -20.635 17.883 1.00 0.00 O ATOM 810 OE2 GLU A 55 -24.327 -21.442 18.358 1.00 0.00 O ATOM 0 H GLU A 55 -27.895 -23.568 13.938 1.00 0.00 H new ATOM 0 HA GLU A 55 -25.052 -23.315 14.558 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -26.500 -21.729 15.623 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -27.645 -22.970 16.094 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -26.541 -23.416 18.001 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -24.995 -23.522 17.181 1.00 0.00 H new ATOM 817 N GLU A 56 -26.896 -25.902 15.352 1.00 0.00 N ATOM 818 CA GLU A 56 -26.853 -27.271 15.853 1.00 0.00 C ATOM 819 C GLU A 56 -25.925 -28.133 15.002 1.00 0.00 C ATOM 820 O GLU A 56 -25.226 -29.006 15.518 1.00 0.00 O ATOM 821 CB GLU A 56 -28.258 -27.876 15.868 1.00 0.00 C ATOM 822 CG GLU A 56 -29.165 -27.285 16.934 1.00 0.00 C ATOM 823 CD GLU A 56 -29.389 -28.230 18.099 1.00 0.00 C ATOM 824 OE1 GLU A 56 -28.465 -29.006 18.420 1.00 0.00 O ATOM 825 OE2 GLU A 56 -30.489 -28.192 18.689 1.00 0.00 O ATOM 0 H GLU A 56 -27.788 -25.632 14.937 1.00 0.00 H new ATOM 0 HA GLU A 56 -26.465 -27.246 16.871 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -28.718 -27.730 14.890 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -28.179 -28.952 16.026 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -28.729 -26.357 17.303 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -30.126 -27.030 16.488 1.00 0.00 H new ATOM 832 N ILE A 57 -25.924 -27.881 13.698 1.00 0.00 N ATOM 833 CA ILE A 57 -25.081 -28.633 12.776 1.00 0.00 C ATOM 834 C ILE A 57 -23.615 -28.244 12.929 1.00 0.00 C ATOM 835 O ILE A 57 -22.722 -29.084 12.806 1.00 0.00 O ATOM 836 CB ILE A 57 -25.510 -28.411 11.313 1.00 0.00 C ATOM 837 CG1 ILE A 57 -26.971 -28.821 11.119 1.00 0.00 C ATOM 838 CG2 ILE A 57 -24.605 -29.191 10.372 1.00 0.00 C ATOM 839 CD1 ILE A 57 -27.582 -28.292 9.840 1.00 0.00 C ATOM 0 H ILE A 57 -26.497 -27.162 13.256 1.00 0.00 H new ATOM 0 HA ILE A 57 -25.202 -29.687 13.026 1.00 0.00 H new ATOM 0 HB ILE A 57 -25.417 -27.351 11.079 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -27.038 -29.909 11.121 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -27.556 -28.464 11.967 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -24.921 -29.024 9.342 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -23.576 -28.855 10.495 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -24.669 -30.254 10.603 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -28.619 -28.622 9.768 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -27.547 -27.203 9.843 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -27.021 -28.670 8.985 1.00 0.00 H new ATOM 851 N LEU A 58 -23.373 -26.966 13.201 1.00 0.00 N ATOM 852 CA LEU A 58 -22.014 -26.465 13.374 1.00 0.00 C ATOM 853 C LEU A 58 -21.364 -27.070 14.614 1.00 0.00 C ATOM 854 O LEU A 58 -20.142 -27.193 14.689 1.00 0.00 O ATOM 855 CB LEU A 58 -22.022 -24.939 13.480 1.00 0.00 C ATOM 856 CG LEU A 58 -22.143 -24.175 12.162 1.00 0.00 C ATOM 857 CD1 LEU A 58 -22.611 -22.750 12.412 1.00 0.00 C ATOM 858 CD2 LEU A 58 -20.816 -24.180 11.418 1.00 0.00 C ATOM 0 H LEU A 58 -24.100 -26.258 13.306 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.431 -26.759 12.502 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -22.850 -24.644 14.125 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.104 -24.625 13.976 1.00 0.00 H new ATOM 0 HG LEU A 58 -22.886 -24.676 11.541 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -22.691 -22.221 11.462 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -23.585 -22.767 12.901 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -21.893 -22.238 13.052 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -20.922 -23.631 10.482 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -20.052 -23.704 12.033 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -20.522 -25.208 11.205 1.00 0.00 H new ATOM 870 N SER A 59 -22.190 -27.447 15.585 1.00 0.00 N ATOM 871 CA SER A 59 -21.696 -28.038 16.823 1.00 0.00 C ATOM 872 C SER A 59 -21.788 -29.560 16.773 1.00 0.00 C ATOM 873 O SER A 59 -21.026 -30.260 17.439 1.00 0.00 O ATOM 874 CB SER A 59 -22.490 -27.506 18.018 1.00 0.00 C ATOM 875 OG SER A 59 -21.749 -27.635 19.220 1.00 0.00 O ATOM 0 H SER A 59 -23.205 -27.354 15.538 1.00 0.00 H new ATOM 0 HA SER A 59 -20.649 -27.759 16.938 1.00 0.00 H new ATOM 0 HB2 SER A 59 -22.743 -26.459 17.853 1.00 0.00 H new ATOM 0 HB3 SER A 59 -23.430 -28.051 18.106 1.00 0.00 H new ATOM 0 HG SER A 59 -22.277 -27.287 19.969 1.00 0.00 H new ATOM 881 N GLU A 60 -22.727 -30.064 15.978 1.00 0.00 N ATOM 882 CA GLU A 60 -22.919 -31.503 15.842 1.00 0.00 C ATOM 883 C GLU A 60 -21.911 -32.096 14.861 1.00 0.00 C ATOM 884 O GLU A 60 -21.157 -33.007 15.204 1.00 0.00 O ATOM 885 CB GLU A 60 -24.343 -31.808 15.373 1.00 0.00 C ATOM 886 CG GLU A 60 -25.372 -31.774 16.491 1.00 0.00 C ATOM 887 CD GLU A 60 -25.975 -33.137 16.770 1.00 0.00 C ATOM 888 OE1 GLU A 60 -26.885 -33.548 16.020 1.00 0.00 O ATOM 889 OE2 GLU A 60 -25.538 -33.793 17.739 1.00 0.00 O ATOM 0 H GLU A 60 -23.366 -29.498 15.419 1.00 0.00 H new ATOM 0 HA GLU A 60 -22.761 -31.959 16.819 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -24.627 -31.086 14.607 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -24.360 -32.792 14.905 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -24.904 -31.395 17.399 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -26.167 -31.076 16.227 1.00 0.00 H new ATOM 896 N ASP A 61 -21.906 -31.574 13.640 1.00 0.00 N ATOM 897 CA ASP A 61 -20.992 -32.050 12.609 1.00 0.00 C ATOM 898 C ASP A 61 -19.626 -31.384 12.743 1.00 0.00 C ATOM 899 O ASP A 61 -18.658 -32.009 13.177 1.00 0.00 O ATOM 900 CB ASP A 61 -21.571 -31.779 11.219 1.00 0.00 C ATOM 901 CG ASP A 61 -22.385 -32.945 10.694 1.00 0.00 C ATOM 902 OD1 ASP A 61 -21.924 -34.098 10.825 1.00 0.00 O ATOM 903 OD2 ASP A 61 -23.484 -32.705 10.151 1.00 0.00 O ATOM 0 H ASP A 61 -22.525 -30.821 13.340 1.00 0.00 H new ATOM 0 HA ASP A 61 -20.866 -33.125 12.739 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -22.199 -30.889 11.257 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -20.758 -31.566 10.525 1.00 0.00 H new ATOM 908 N PHE A 62 -19.555 -30.111 12.366 1.00 0.00 N ATOM 909 CA PHE A 62 -18.307 -29.360 12.442 1.00 0.00 C ATOM 910 C PHE A 62 -17.695 -29.463 13.836 1.00 0.00 C ATOM 911 O PHE A 62 -16.477 -29.569 13.986 1.00 0.00 O ATOM 912 CB PHE A 62 -18.548 -27.892 12.086 1.00 0.00 C ATOM 913 CG PHE A 62 -18.602 -27.635 10.607 1.00 0.00 C ATOM 914 CD1 PHE A 62 -17.435 -27.475 9.876 1.00 0.00 C ATOM 915 CD2 PHE A 62 -19.817 -27.555 9.948 1.00 0.00 C ATOM 916 CE1 PHE A 62 -17.482 -27.237 8.515 1.00 0.00 C ATOM 917 CE2 PHE A 62 -19.870 -27.318 8.587 1.00 0.00 C ATOM 918 CZ PHE A 62 -18.700 -27.160 7.870 1.00 0.00 C ATOM 0 H PHE A 62 -20.347 -29.578 12.005 1.00 0.00 H new ATOM 0 HA PHE A 62 -17.608 -29.791 11.725 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -19.485 -27.566 12.538 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -17.755 -27.285 12.523 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -16.479 -27.537 10.375 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -20.735 -27.679 10.504 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -16.566 -27.111 7.957 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -20.824 -27.257 8.085 1.00 0.00 H new ATOM 0 HZ PHE A 62 -18.738 -26.977 6.806 1.00 0.00 H new ATOM 928 N LYS A 63 -18.548 -29.430 14.854 1.00 0.00 N ATOM 929 CA LYS A 63 -18.094 -29.520 16.237 1.00 0.00 C ATOM 930 C LYS A 63 -17.102 -28.405 16.557 1.00 0.00 C ATOM 931 O LYS A 63 -16.219 -28.570 17.400 1.00 0.00 O ATOM 932 CB LYS A 63 -17.447 -30.882 16.496 1.00 0.00 C ATOM 933 CG LYS A 63 -18.019 -31.608 17.701 1.00 0.00 C ATOM 934 CD LYS A 63 -18.212 -33.089 17.421 1.00 0.00 C ATOM 935 CE LYS A 63 -17.755 -33.942 18.594 1.00 0.00 C ATOM 936 NZ LYS A 63 -18.701 -35.059 18.868 1.00 0.00 N ATOM 0 H LYS A 63 -19.559 -29.342 14.747 1.00 0.00 H new ATOM 0 HA LYS A 63 -18.962 -29.408 16.886 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -17.572 -31.508 15.612 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -16.375 -30.744 16.640 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -17.351 -31.482 18.553 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -18.975 -31.161 17.976 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -19.264 -33.287 17.214 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -17.653 -33.367 16.528 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.765 -34.347 18.385 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -17.662 -33.318 19.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.355 -35.617 19.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -19.640 -34.672 19.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -18.770 -35.669 18.029 1.00 0.00 H new ATOM 950 N LEU A 64 -17.255 -27.272 15.882 1.00 0.00 N ATOM 951 CA LEU A 64 -16.374 -26.129 16.096 1.00 0.00 C ATOM 952 C LEU A 64 -16.473 -25.626 17.533 1.00 0.00 C ATOM 953 O LEU A 64 -17.437 -25.922 18.239 1.00 0.00 O ATOM 954 CB LEU A 64 -16.723 -25.001 15.124 1.00 0.00 C ATOM 955 CG LEU A 64 -16.359 -25.241 13.659 1.00 0.00 C ATOM 956 CD1 LEU A 64 -17.455 -24.717 12.743 1.00 0.00 C ATOM 957 CD2 LEU A 64 -15.026 -24.587 13.326 1.00 0.00 C ATOM 0 H LEU A 64 -17.981 -27.120 15.182 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.349 -26.453 15.914 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -17.795 -24.814 15.185 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.222 -24.093 15.458 1.00 0.00 H new ATOM 0 HG LEU A 64 -16.264 -26.315 13.500 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -17.178 -24.897 11.704 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.390 -25.232 12.963 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -17.583 -23.647 12.904 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -14.783 -24.768 12.279 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -15.093 -23.513 13.502 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.245 -25.010 13.958 1.00 0.00 H new ATOM 969 N SER A 65 -15.471 -24.863 17.958 1.00 0.00 N ATOM 970 CA SER A 65 -15.445 -24.320 19.311 1.00 0.00 C ATOM 971 C SER A 65 -16.670 -23.449 19.571 1.00 0.00 C ATOM 972 O SER A 65 -17.284 -22.927 18.641 1.00 0.00 O ATOM 973 CB SER A 65 -14.169 -23.505 19.532 1.00 0.00 C ATOM 974 OG SER A 65 -13.103 -24.332 19.964 1.00 0.00 O ATOM 0 H SER A 65 -14.667 -24.607 17.385 1.00 0.00 H new ATOM 0 HA SER A 65 -15.460 -25.155 20.011 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.891 -23.002 18.606 1.00 0.00 H new ATOM 0 HB3 SER A 65 -14.354 -22.728 20.274 1.00 0.00 H new ATOM 0 HG SER A 65 -12.299 -23.787 20.096 1.00 0.00 H new ATOM 980 N LYS A 66 -17.021 -23.297 20.844 1.00 0.00 N ATOM 981 CA LYS A 66 -18.172 -22.489 21.229 1.00 0.00 C ATOM 982 C LYS A 66 -18.054 -21.074 20.672 1.00 0.00 C ATOM 983 O LYS A 66 -19.015 -20.528 20.127 1.00 0.00 O ATOM 984 CB LYS A 66 -18.298 -22.439 22.753 1.00 0.00 C ATOM 985 CG LYS A 66 -17.025 -22.000 23.455 1.00 0.00 C ATOM 986 CD LYS A 66 -17.142 -22.143 24.964 1.00 0.00 C ATOM 987 CE LYS A 66 -16.918 -20.814 25.669 1.00 0.00 C ATOM 988 NZ LYS A 66 -17.262 -20.888 27.115 1.00 0.00 N ATOM 0 H LYS A 66 -16.524 -23.723 21.626 1.00 0.00 H new ATOM 0 HA LYS A 66 -19.066 -22.952 20.811 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -19.104 -21.756 23.020 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -18.582 -23.426 23.118 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -16.186 -22.597 23.096 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -16.809 -20.962 23.203 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -18.129 -22.529 25.218 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -16.413 -22.872 25.319 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -15.875 -20.516 25.559 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -17.522 -20.043 25.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -17.096 -19.962 27.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -18.263 -21.148 27.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -16.668 -21.606 27.577 1.00 0.00 H new ATOM 1002 N LEU A 67 -16.872 -20.485 20.811 1.00 0.00 N ATOM 1003 CA LEU A 67 -16.628 -19.133 20.319 1.00 0.00 C ATOM 1004 C LEU A 67 -16.659 -19.094 18.795 1.00 0.00 C ATOM 1005 O LEU A 67 -16.950 -18.058 18.198 1.00 0.00 O ATOM 1006 CB LEU A 67 -15.279 -18.621 20.826 1.00 0.00 C ATOM 1007 CG LEU A 67 -15.322 -17.366 21.699 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -15.848 -16.181 20.905 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -16.179 -17.605 22.934 1.00 0.00 C ATOM 0 H LEU A 67 -16.067 -20.922 21.260 1.00 0.00 H new ATOM 0 HA LEU A 67 -17.421 -18.487 20.697 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -14.801 -19.419 21.395 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -14.643 -18.418 19.964 1.00 0.00 H new ATOM 0 HG LEU A 67 -14.307 -17.138 22.024 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -15.871 -15.297 21.543 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -15.195 -15.996 20.052 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -16.855 -16.399 20.550 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -16.198 -16.702 23.544 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -17.194 -17.859 22.629 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -15.759 -18.426 23.515 1.00 0.00 H new ATOM 1021 N GLN A 68 -16.361 -20.230 18.172 1.00 0.00 N ATOM 1022 CA GLN A 68 -16.357 -20.325 16.717 1.00 0.00 C ATOM 1023 C GLN A 68 -17.780 -20.320 16.168 1.00 0.00 C ATOM 1024 O GLN A 68 -18.160 -19.429 15.408 1.00 0.00 O ATOM 1025 CB GLN A 68 -15.629 -21.593 16.270 1.00 0.00 C ATOM 1026 CG GLN A 68 -14.145 -21.384 16.011 1.00 0.00 C ATOM 1027 CD GLN A 68 -13.383 -22.689 15.898 1.00 0.00 C ATOM 1028 OE1 GLN A 68 -13.972 -23.770 15.928 1.00 0.00 O ATOM 1029 NE2 GLN A 68 -12.065 -22.596 15.766 1.00 0.00 N ATOM 0 H GLN A 68 -16.119 -21.097 18.652 1.00 0.00 H new ATOM 0 HA GLN A 68 -15.832 -19.455 16.322 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -15.751 -22.361 17.034 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -16.098 -21.970 15.361 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -14.018 -20.812 15.092 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -13.720 -20.788 16.818 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -11.618 -21.679 15.746 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.500 -23.441 15.685 1.00 0.00 H new ATOM 1038 N VAL A 69 -18.562 -21.322 16.556 1.00 0.00 N ATOM 1039 CA VAL A 69 -19.943 -21.433 16.102 1.00 0.00 C ATOM 1040 C VAL A 69 -20.712 -20.143 16.362 1.00 0.00 C ATOM 1041 O VAL A 69 -21.654 -19.813 15.641 1.00 0.00 O ATOM 1042 CB VAL A 69 -20.670 -22.600 16.798 1.00 0.00 C ATOM 1043 CG1 VAL A 69 -22.115 -22.683 16.331 1.00 0.00 C ATOM 1044 CG2 VAL A 69 -19.942 -23.910 16.539 1.00 0.00 C ATOM 0 H VAL A 69 -18.263 -22.068 17.184 1.00 0.00 H new ATOM 0 HA VAL A 69 -19.910 -21.623 15.029 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.670 -22.417 17.872 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.613 -23.513 16.833 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.629 -21.752 16.572 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -22.140 -22.843 15.253 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.469 -24.724 17.038 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -19.909 -24.102 15.467 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.925 -23.844 16.927 1.00 0.00 H new ATOM 1054 N LYS A 70 -20.305 -19.415 17.396 1.00 0.00 N ATOM 1055 CA LYS A 70 -20.953 -18.159 17.752 1.00 0.00 C ATOM 1056 C LYS A 70 -20.676 -17.087 16.702 1.00 0.00 C ATOM 1057 O LYS A 70 -21.599 -16.466 16.174 1.00 0.00 O ATOM 1058 CB LYS A 70 -20.470 -17.682 19.123 1.00 0.00 C ATOM 1059 CG LYS A 70 -21.586 -17.167 20.016 1.00 0.00 C ATOM 1060 CD LYS A 70 -22.386 -18.308 20.621 1.00 0.00 C ATOM 1061 CE LYS A 70 -23.197 -17.844 21.822 1.00 0.00 C ATOM 1062 NZ LYS A 70 -23.912 -18.974 22.478 1.00 0.00 N ATOM 0 H LYS A 70 -19.528 -19.674 18.003 1.00 0.00 H new ATOM 0 HA LYS A 70 -22.028 -18.333 17.793 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -19.963 -18.505 19.627 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -19.733 -16.891 18.984 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -21.163 -16.555 20.813 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -22.249 -16.523 19.438 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -23.055 -18.724 19.868 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -21.710 -19.107 20.924 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -22.536 -17.365 22.544 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -23.920 -17.093 21.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -24.453 -18.617 23.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -24.562 -19.416 21.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -23.221 -19.679 22.804 1.00 0.00 H new ATOM 1076 N LYS A 71 -19.399 -16.876 16.402 1.00 0.00 N ATOM 1077 CA LYS A 71 -18.999 -15.882 15.414 1.00 0.00 C ATOM 1078 C LYS A 71 -19.584 -16.210 14.044 1.00 0.00 C ATOM 1079 O LYS A 71 -19.929 -15.313 13.274 1.00 0.00 O ATOM 1080 CB LYS A 71 -17.473 -15.807 15.324 1.00 0.00 C ATOM 1081 CG LYS A 71 -16.900 -14.482 15.795 1.00 0.00 C ATOM 1082 CD LYS A 71 -15.568 -14.670 16.502 1.00 0.00 C ATOM 1083 CE LYS A 71 -15.652 -14.267 17.966 1.00 0.00 C ATOM 1084 NZ LYS A 71 -15.550 -12.792 18.142 1.00 0.00 N ATOM 0 H LYS A 71 -18.623 -17.381 16.830 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.386 -14.914 15.733 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -17.042 -16.612 15.920 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.170 -15.978 14.291 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.769 -13.817 14.941 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.606 -13.999 16.470 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.260 -15.713 16.428 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -14.803 -14.075 16.003 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -16.594 -14.618 18.386 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -14.853 -14.755 18.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -15.612 -12.558 19.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.640 -12.459 17.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -16.327 -12.327 17.631 1.00 0.00 H new ATOM 1098 N ILE A 72 -19.694 -17.501 13.747 1.00 0.00 N ATOM 1099 CA ILE A 72 -20.240 -17.947 12.471 1.00 0.00 C ATOM 1100 C ILE A 72 -21.739 -17.679 12.391 1.00 0.00 C ATOM 1101 O ILE A 72 -22.230 -17.129 11.406 1.00 0.00 O ATOM 1102 CB ILE A 72 -19.986 -19.449 12.244 1.00 0.00 C ATOM 1103 CG1 ILE A 72 -18.485 -19.746 12.286 1.00 0.00 C ATOM 1104 CG2 ILE A 72 -20.582 -19.892 10.916 1.00 0.00 C ATOM 1105 CD1 ILE A 72 -18.165 -21.214 12.457 1.00 0.00 C ATOM 0 H ILE A 72 -19.412 -18.256 14.372 1.00 0.00 H new ATOM 0 HA ILE A 72 -19.729 -17.379 11.693 1.00 0.00 H new ATOM 0 HB ILE A 72 -20.471 -20.010 13.043 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -18.026 -19.387 11.365 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -18.035 -19.186 13.106 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -20.394 -20.956 10.770 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -21.657 -19.710 10.921 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -20.122 -19.328 10.105 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -17.084 -21.351 12.478 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -18.595 -21.574 13.392 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -18.586 -21.777 11.624 1.00 0.00 H new ATOM 1117 N MET A 73 -22.461 -18.070 13.436 1.00 0.00 N ATOM 1118 CA MET A 73 -23.905 -17.869 13.485 1.00 0.00 C ATOM 1119 C MET A 73 -24.258 -16.403 13.255 1.00 0.00 C ATOM 1120 O MET A 73 -25.025 -16.075 12.350 1.00 0.00 O ATOM 1121 CB MET A 73 -24.461 -18.334 14.832 1.00 0.00 C ATOM 1122 CG MET A 73 -25.358 -19.557 14.730 1.00 0.00 C ATOM 1123 SD MET A 73 -27.108 -19.130 14.662 1.00 0.00 S ATOM 1124 CE MET A 73 -27.422 -19.267 12.904 1.00 0.00 C ATOM 0 H MET A 73 -22.070 -18.527 14.260 1.00 0.00 H new ATOM 0 HA MET A 73 -24.356 -18.462 12.690 1.00 0.00 H new ATOM 0 HB2 MET A 73 -23.630 -18.558 15.501 1.00 0.00 H new ATOM 0 HB3 MET A 73 -25.024 -17.518 15.285 1.00 0.00 H new ATOM 0 HG2 MET A 73 -25.092 -20.125 13.839 1.00 0.00 H new ATOM 0 HG3 MET A 73 -25.179 -20.206 15.587 1.00 0.00 H new ATOM 0 HE1 MET A 73 -28.467 -19.032 12.702 1.00 0.00 H new ATOM 0 HE2 MET A 73 -26.782 -18.569 12.365 1.00 0.00 H new ATOM 0 HE3 MET A 73 -27.209 -20.284 12.574 1.00 0.00 H new ATOM 1134 N GLN A 74 -23.694 -15.527 14.080 1.00 0.00 N ATOM 1135 CA GLN A 74 -23.951 -14.096 13.966 1.00 0.00 C ATOM 1136 C GLN A 74 -23.640 -13.598 12.559 1.00 0.00 C ATOM 1137 O GLN A 74 -24.269 -12.660 12.068 1.00 0.00 O ATOM 1138 CB GLN A 74 -23.117 -13.323 14.989 1.00 0.00 C ATOM 1139 CG GLN A 74 -21.618 -13.466 14.785 1.00 0.00 C ATOM 1140 CD GLN A 74 -20.816 -12.543 15.681 1.00 0.00 C ATOM 1141 OE1 GLN A 74 -20.873 -12.646 16.907 1.00 0.00 O ATOM 1142 NE2 GLN A 74 -20.062 -11.635 15.073 1.00 0.00 N ATOM 0 H GLN A 74 -23.057 -15.783 14.834 1.00 0.00 H new ATOM 0 HA GLN A 74 -25.009 -13.925 14.167 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -23.383 -12.267 14.939 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -23.374 -13.669 15.990 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -21.326 -14.498 14.979 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -21.375 -13.256 13.743 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -20.045 -11.585 14.054 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -19.500 -10.987 15.625 1.00 0.00 H new ATOM 1151 N PHE A 75 -22.665 -14.230 11.914 1.00 0.00 N ATOM 1152 CA PHE A 75 -22.269 -13.850 10.563 1.00 0.00 C ATOM 1153 C PHE A 75 -23.370 -14.182 9.560 1.00 0.00 C ATOM 1154 O PHE A 75 -23.594 -13.443 8.601 1.00 0.00 O ATOM 1155 CB PHE A 75 -20.974 -14.562 10.169 1.00 0.00 C ATOM 1156 CG PHE A 75 -20.362 -14.037 8.902 1.00 0.00 C ATOM 1157 CD1 PHE A 75 -19.638 -12.856 8.904 1.00 0.00 C ATOM 1158 CD2 PHE A 75 -20.513 -14.724 7.708 1.00 0.00 C ATOM 1159 CE1 PHE A 75 -19.074 -12.369 7.739 1.00 0.00 C ATOM 1160 CE2 PHE A 75 -19.951 -14.243 6.540 1.00 0.00 C ATOM 1161 CZ PHE A 75 -19.232 -13.064 6.556 1.00 0.00 C ATOM 0 H PHE A 75 -22.134 -15.008 12.305 1.00 0.00 H new ATOM 0 HA PHE A 75 -22.102 -12.773 10.550 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -20.253 -14.462 10.980 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -21.176 -15.627 10.051 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -19.512 -12.309 9.827 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -21.076 -15.645 7.690 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -18.511 -11.447 7.754 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -20.074 -14.789 5.616 1.00 0.00 H new ATOM 0 HZ PHE A 75 -18.794 -12.686 5.644 1.00 0.00 H new ATOM 1171 N ILE A 76 -24.054 -15.298 9.789 1.00 0.00 N ATOM 1172 CA ILE A 76 -25.132 -15.728 8.907 1.00 0.00 C ATOM 1173 C ILE A 76 -26.350 -14.822 9.045 1.00 0.00 C ATOM 1174 O ILE A 76 -26.751 -14.154 8.092 1.00 0.00 O ATOM 1175 CB ILE A 76 -25.551 -17.181 9.197 1.00 0.00 C ATOM 1176 CG1 ILE A 76 -24.356 -18.123 9.034 1.00 0.00 C ATOM 1177 CG2 ILE A 76 -26.689 -17.598 8.277 1.00 0.00 C ATOM 1178 CD1 ILE A 76 -24.609 -19.517 9.563 1.00 0.00 C ATOM 0 H ILE A 76 -23.881 -15.921 10.578 1.00 0.00 H new ATOM 0 HA ILE A 76 -24.750 -15.665 7.888 1.00 0.00 H new ATOM 0 HB ILE A 76 -25.901 -17.243 10.228 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -24.095 -18.186 7.978 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -23.495 -17.698 9.550 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -26.974 -18.627 8.494 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -27.545 -16.943 8.438 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -26.364 -17.523 7.239 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -23.720 -20.130 9.414 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -24.841 -19.466 10.627 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -25.449 -19.962 9.030 1.00 0.00 H new ATOM 1190 N ASN A 77 -26.934 -14.802 10.239 1.00 0.00 N ATOM 1191 CA ASN A 77 -28.107 -13.976 10.502 1.00 0.00 C ATOM 1192 C ASN A 77 -27.812 -12.507 10.218 1.00 0.00 C ATOM 1193 O ASN A 77 -28.507 -11.864 9.433 1.00 0.00 O ATOM 1194 CB ASN A 77 -28.559 -14.146 11.954 1.00 0.00 C ATOM 1195 CG ASN A 77 -29.857 -14.922 12.068 1.00 0.00 C ATOM 1196 OD1 ASN A 77 -30.934 -14.398 11.782 1.00 0.00 O ATOM 1197 ND2 ASN A 77 -29.760 -16.178 12.489 1.00 0.00 N ATOM 0 H ASN A 77 -26.614 -15.348 11.039 1.00 0.00 H new ATOM 0 HA ASN A 77 -28.908 -14.302 9.838 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -27.780 -14.661 12.516 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -28.685 -13.164 12.410 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -30.599 -16.749 12.586 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -28.846 -16.571 12.715 1.00 0.00 H new