USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=12 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 Single : A 10 GLN : amide:sc= -0.139 K(o=-0.14,f=-1.9!) USER MOD Single : A 16 SER OG : rot 180:sc= -0.089 USER MOD Single : A 19 SER OG : rot 180:sc= -0.0579 USER MOD Single : A 24 SER OG : rot 98:sc= 0.495 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot -90:sc= -0.165 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -86:sc= 0.982 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= -0.0249 X(o=-0.025,f=-0.26) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot 170:sc= -1.2 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+ 175:sc= 0 (180deg=-0.013) USER MOD Single : A 68 GLN : amide:sc= -0.739 K(o=-0.74,f=-8!) 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 73 MET CE :methyl -157:sc= -0.299 (180deg=-1.17) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=-0.073) USER MOD ----------------------------------------------------------------- ATOM 104 N GLN A 10 -15.683 -6.576 0.331 1.00 0.00 N ATOM 105 CA GLN A 10 -16.392 -7.058 1.510 1.00 0.00 C ATOM 106 C GLN A 10 -17.514 -8.014 1.117 1.00 0.00 C ATOM 107 O GLN A 10 -17.973 -8.036 -0.025 1.00 0.00 O ATOM 108 CB GLN A 10 -16.963 -5.882 2.305 1.00 0.00 C ATOM 109 CG GLN A 10 -16.029 -5.372 3.391 1.00 0.00 C ATOM 110 CD GLN A 10 -16.739 -4.501 4.408 1.00 0.00 C ATOM 111 OE1 GLN A 10 -17.967 -4.505 4.497 1.00 0.00 O ATOM 112 NE2 GLN A 10 -15.968 -3.748 5.184 1.00 0.00 N ATOM 0 HA GLN A 10 -15.681 -7.598 2.135 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.189 -5.066 1.619 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.905 -6.186 2.761 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -15.572 -6.221 3.900 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -15.220 -4.803 2.932 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -14.954 -3.776 5.076 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -16.390 -3.142 5.888 1.00 0.00 H new ATOM 121 N PRO A 11 -17.969 -8.823 2.085 1.00 0.00 N ATOM 122 CA PRO A 11 -19.043 -9.796 1.864 1.00 0.00 C ATOM 123 C PRO A 11 -20.397 -9.127 1.654 1.00 0.00 C ATOM 124 O PRO A 11 -20.664 -8.039 2.164 1.00 0.00 O ATOM 125 CB PRO A 11 -19.048 -10.618 3.156 1.00 0.00 C ATOM 126 CG PRO A 11 -18.476 -9.708 4.187 1.00 0.00 C ATOM 127 CD PRO A 11 -17.469 -8.851 3.470 1.00 0.00 C ATOM 0 HA PRO A 11 -18.877 -10.390 0.965 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -20.058 -10.932 3.421 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -18.450 -11.523 3.051 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -19.255 -9.097 4.643 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -18.005 -10.275 4.990 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.416 -7.850 3.898 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -16.467 -9.276 3.527 1.00 0.00 H new ATOM 135 N PRO A 12 -21.273 -9.791 0.885 1.00 0.00 N ATOM 136 CA PRO A 12 -22.614 -9.279 0.590 1.00 0.00 C ATOM 137 C PRO A 12 -23.524 -9.298 1.814 1.00 0.00 C ATOM 138 O PRO A 12 -23.098 -9.661 2.910 1.00 0.00 O ATOM 139 CB PRO A 12 -23.135 -10.243 -0.479 1.00 0.00 C ATOM 140 CG PRO A 12 -22.380 -11.506 -0.250 1.00 0.00 C ATOM 141 CD PRO A 12 -21.021 -11.093 0.245 1.00 0.00 C ATOM 0 HA PRO A 12 -22.591 -8.238 0.269 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -24.209 -10.400 -0.381 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -22.961 -9.854 -1.482 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -22.887 -12.136 0.481 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -22.301 -12.085 -1.170 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -20.614 -11.816 0.952 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -20.305 -11.007 -0.572 1.00 0.00 H new ATOM 149 N ALA A 13 -24.779 -8.907 1.619 1.00 0.00 N ATOM 150 CA ALA A 13 -25.749 -8.882 2.707 1.00 0.00 C ATOM 151 C ALA A 13 -26.644 -10.116 2.672 1.00 0.00 C ATOM 152 O ALA A 13 -27.143 -10.562 3.705 1.00 0.00 O ATOM 153 CB ALA A 13 -26.590 -7.616 2.635 1.00 0.00 C ATOM 0 H ALA A 13 -25.148 -8.603 0.718 1.00 0.00 H new ATOM 0 HA ALA A 13 -25.202 -8.888 3.650 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -27.310 -7.611 3.453 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -25.942 -6.743 2.716 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -27.121 -7.586 1.684 1.00 0.00 H new ATOM 159 N ASP A 14 -26.843 -10.664 1.478 1.00 0.00 N ATOM 160 CA ASP A 14 -27.677 -11.848 1.309 1.00 0.00 C ATOM 161 C ASP A 14 -26.857 -13.121 1.488 1.00 0.00 C ATOM 162 O ASP A 14 -27.369 -14.142 1.951 1.00 0.00 O ATOM 163 CB ASP A 14 -28.336 -11.841 -0.071 1.00 0.00 C ATOM 164 CG ASP A 14 -27.331 -11.662 -1.192 1.00 0.00 C ATOM 165 OD1 ASP A 14 -26.617 -12.636 -1.508 1.00 0.00 O ATOM 166 OD2 ASP A 14 -27.258 -10.548 -1.752 1.00 0.00 O ATOM 0 H ASP A 14 -26.438 -10.307 0.613 1.00 0.00 H new ATOM 0 HA ASP A 14 -28.453 -11.827 2.074 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -28.876 -12.776 -0.217 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -29.072 -11.038 -0.115 1.00 0.00 H new ATOM 171 N LEU A 15 -25.583 -13.055 1.119 1.00 0.00 N ATOM 172 CA LEU A 15 -24.691 -14.203 1.238 1.00 0.00 C ATOM 173 C LEU A 15 -25.281 -15.425 0.540 1.00 0.00 C ATOM 174 O LEU A 15 -25.005 -16.563 0.922 1.00 0.00 O ATOM 175 CB LEU A 15 -24.429 -14.520 2.711 1.00 0.00 C ATOM 176 CG LEU A 15 -23.390 -13.643 3.411 1.00 0.00 C ATOM 177 CD1 LEU A 15 -23.968 -13.042 4.683 1.00 0.00 C ATOM 178 CD2 LEU A 15 -22.136 -14.447 3.722 1.00 0.00 C ATOM 0 H LEU A 15 -25.144 -12.218 0.735 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.747 -13.951 0.754 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -25.371 -14.436 3.253 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -24.109 -15.559 2.787 1.00 0.00 H new ATOM 0 HG LEU A 15 -23.119 -12.829 2.739 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.214 -12.421 5.167 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -24.836 -12.431 4.435 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -24.268 -13.842 5.360 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -21.408 -13.807 4.220 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -22.392 -15.282 4.375 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -21.709 -14.829 2.795 1.00 0.00 H new ATOM 190 N SER A 16 -26.091 -15.181 -0.484 1.00 0.00 N ATOM 191 CA SER A 16 -26.721 -16.262 -1.234 1.00 0.00 C ATOM 192 C SER A 16 -26.218 -16.288 -2.675 1.00 0.00 C ATOM 193 O SER A 16 -26.937 -16.690 -3.588 1.00 0.00 O ATOM 194 CB SER A 16 -28.243 -16.104 -1.217 1.00 0.00 C ATOM 195 OG SER A 16 -28.624 -14.798 -1.614 1.00 0.00 O ATOM 0 H SER A 16 -26.327 -14.245 -0.814 1.00 0.00 H new ATOM 0 HA SER A 16 -26.455 -17.205 -0.757 1.00 0.00 H new ATOM 0 HB2 SER A 16 -28.695 -16.837 -1.885 1.00 0.00 H new ATOM 0 HB3 SER A 16 -28.622 -16.308 -0.216 1.00 0.00 H new ATOM 0 HG SER A 16 -29.601 -14.723 -1.596 1.00 0.00 H new ATOM 201 N GLY A 17 -24.975 -15.857 -2.869 1.00 0.00 N ATOM 202 CA GLY A 17 -24.395 -15.839 -4.199 1.00 0.00 C ATOM 203 C GLY A 17 -22.881 -15.905 -4.173 1.00 0.00 C ATOM 204 O GLY A 17 -22.219 -15.525 -5.140 1.00 0.00 O ATOM 0 H GLY A 17 -24.360 -15.520 -2.129 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -24.782 -16.681 -4.772 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -24.707 -14.931 -4.716 1.00 0.00 H new ATOM 208 N LEU A 18 -22.331 -16.385 -3.063 1.00 0.00 N ATOM 209 CA LEU A 18 -20.884 -16.497 -2.914 1.00 0.00 C ATOM 210 C LEU A 18 -20.408 -17.905 -3.258 1.00 0.00 C ATOM 211 O LEU A 18 -21.100 -18.887 -2.990 1.00 0.00 O ATOM 212 CB LEU A 18 -20.470 -16.142 -1.485 1.00 0.00 C ATOM 213 CG LEU A 18 -20.897 -14.761 -0.985 1.00 0.00 C ATOM 214 CD1 LEU A 18 -20.608 -14.618 0.501 1.00 0.00 C ATOM 215 CD2 LEU A 18 -20.194 -13.667 -1.776 1.00 0.00 C ATOM 0 H LEU A 18 -22.864 -16.703 -2.254 1.00 0.00 H new ATOM 0 HA LEU A 18 -20.417 -15.796 -3.606 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.882 -16.893 -0.812 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.385 -16.212 -1.415 1.00 0.00 H new ATOM 0 HG LEU A 18 -21.971 -14.657 -1.136 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.918 -13.629 0.839 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -21.158 -15.379 1.054 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.540 -14.743 0.678 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.510 -12.691 -1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.115 -13.768 -1.657 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.453 -13.757 -2.831 1.00 0.00 H new ATOM 227 N SER A 19 -19.222 -17.995 -3.852 1.00 0.00 N ATOM 228 CA SER A 19 -18.654 -19.282 -4.234 1.00 0.00 C ATOM 229 C SER A 19 -17.858 -19.888 -3.082 1.00 0.00 C ATOM 230 O SER A 19 -17.555 -19.212 -2.099 1.00 0.00 O ATOM 231 CB SER A 19 -17.756 -19.122 -5.462 1.00 0.00 C ATOM 232 OG SER A 19 -17.429 -17.761 -5.681 1.00 0.00 O ATOM 0 H SER A 19 -18.636 -17.192 -4.079 1.00 0.00 H new ATOM 0 HA SER A 19 -19.475 -19.956 -4.479 1.00 0.00 H new ATOM 0 HB2 SER A 19 -16.843 -19.701 -5.326 1.00 0.00 H new ATOM 0 HB3 SER A 19 -18.261 -19.524 -6.340 1.00 0.00 H new ATOM 0 HG SER A 19 -16.853 -17.686 -6.470 1.00 0.00 H new ATOM 238 N ILE A 20 -17.524 -21.168 -3.212 1.00 0.00 N ATOM 239 CA ILE A 20 -16.763 -21.866 -2.183 1.00 0.00 C ATOM 240 C ILE A 20 -15.467 -21.128 -1.863 1.00 0.00 C ATOM 241 O ILE A 20 -14.940 -21.232 -0.756 1.00 0.00 O ATOM 242 CB ILE A 20 -16.428 -23.307 -2.611 1.00 0.00 C ATOM 243 CG1 ILE A 20 -17.711 -24.081 -2.921 1.00 0.00 C ATOM 244 CG2 ILE A 20 -15.628 -24.009 -1.524 1.00 0.00 C ATOM 245 CD1 ILE A 20 -17.462 -25.472 -3.459 1.00 0.00 C ATOM 0 H ILE A 20 -17.768 -21.742 -4.019 1.00 0.00 H new ATOM 0 HA ILE A 20 -17.390 -21.897 -1.292 1.00 0.00 H new ATOM 0 HB ILE A 20 -15.821 -23.271 -3.516 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -18.310 -24.153 -2.014 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -18.298 -23.519 -3.647 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -15.399 -25.026 -1.841 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -14.700 -23.466 -1.347 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -16.212 -24.038 -0.604 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -18.416 -25.962 -3.656 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -16.889 -25.407 -4.384 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -16.902 -26.051 -2.725 1.00 0.00 H new ATOM 257 N GLU A 21 -14.960 -20.383 -2.840 1.00 0.00 N ATOM 258 CA GLU A 21 -13.725 -19.627 -2.661 1.00 0.00 C ATOM 259 C GLU A 21 -14.000 -18.290 -1.978 1.00 0.00 C ATOM 260 O GLU A 21 -13.161 -17.776 -1.239 1.00 0.00 O ATOM 261 CB GLU A 21 -13.045 -19.392 -4.012 1.00 0.00 C ATOM 262 CG GLU A 21 -11.532 -19.295 -3.922 1.00 0.00 C ATOM 263 CD GLU A 21 -10.874 -19.162 -5.282 1.00 0.00 C ATOM 264 OE1 GLU A 21 -10.801 -18.027 -5.798 1.00 0.00 O ATOM 265 OE2 GLU A 21 -10.433 -20.193 -5.830 1.00 0.00 O ATOM 0 H GLU A 21 -15.384 -20.286 -3.763 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.060 -20.211 -2.024 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -13.309 -20.205 -4.689 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -13.434 -18.473 -4.450 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -11.263 -18.437 -3.307 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.144 -20.181 -3.420 1.00 0.00 H new ATOM 272 N GLU A 22 -15.180 -17.734 -2.232 1.00 0.00 N ATOM 273 CA GLU A 22 -15.565 -16.457 -1.642 1.00 0.00 C ATOM 274 C GLU A 22 -15.819 -16.603 -0.145 1.00 0.00 C ATOM 275 O GLU A 22 -15.407 -15.760 0.652 1.00 0.00 O ATOM 276 CB GLU A 22 -16.815 -15.907 -2.332 1.00 0.00 C ATOM 277 CG GLU A 22 -16.576 -15.466 -3.766 1.00 0.00 C ATOM 278 CD GLU A 22 -16.249 -13.989 -3.874 1.00 0.00 C ATOM 279 OE1 GLU A 22 -17.193 -13.172 -3.892 1.00 0.00 O ATOM 280 OE2 GLU A 22 -15.048 -13.651 -3.941 1.00 0.00 O ATOM 0 H GLU A 22 -15.886 -18.147 -2.842 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.742 -15.757 -1.786 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.592 -16.672 -2.321 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.193 -15.060 -1.759 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -15.757 -16.048 -4.190 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.463 -15.683 -4.362 1.00 0.00 H new ATOM 287 N VAL A 23 -16.500 -17.681 0.231 1.00 0.00 N ATOM 288 CA VAL A 23 -16.810 -17.939 1.632 1.00 0.00 C ATOM 289 C VAL A 23 -15.548 -17.914 2.487 1.00 0.00 C ATOM 290 O VAL A 23 -15.574 -17.478 3.638 1.00 0.00 O ATOM 291 CB VAL A 23 -17.510 -19.300 1.811 1.00 0.00 C ATOM 292 CG1 VAL A 23 -17.815 -19.555 3.279 1.00 0.00 C ATOM 293 CG2 VAL A 23 -18.781 -19.358 0.976 1.00 0.00 C ATOM 0 H VAL A 23 -16.847 -18.390 -0.415 1.00 0.00 H new ATOM 0 HA VAL A 23 -17.483 -17.146 1.958 1.00 0.00 H new ATOM 0 HB VAL A 23 -16.837 -20.084 1.463 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -18.309 -20.521 3.386 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -16.886 -19.558 3.848 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -18.469 -18.769 3.657 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -19.263 -20.326 1.114 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -19.460 -18.566 1.292 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -18.531 -19.224 -0.076 1.00 0.00 H new ATOM 303 N SER A 24 -14.443 -18.384 1.917 1.00 0.00 N ATOM 304 CA SER A 24 -13.171 -18.418 2.628 1.00 0.00 C ATOM 305 C SER A 24 -12.798 -17.031 3.142 1.00 0.00 C ATOM 306 O SER A 24 -12.138 -16.894 4.173 1.00 0.00 O ATOM 307 CB SER A 24 -12.065 -18.949 1.713 1.00 0.00 C ATOM 308 OG SER A 24 -12.599 -19.778 0.696 1.00 0.00 O ATOM 0 H SER A 24 -14.403 -18.747 0.964 1.00 0.00 H new ATOM 0 HA SER A 24 -13.279 -19.086 3.482 1.00 0.00 H new ATOM 0 HB2 SER A 24 -11.530 -18.114 1.262 1.00 0.00 H new ATOM 0 HB3 SER A 24 -11.340 -19.511 2.302 1.00 0.00 H new ATOM 0 HG SER A 24 -12.707 -19.258 -0.127 1.00 0.00 H new ATOM 314 N LYS A 25 -13.227 -16.003 2.417 1.00 0.00 N ATOM 315 CA LYS A 25 -12.941 -14.625 2.799 1.00 0.00 C ATOM 316 C LYS A 25 -14.043 -14.069 3.695 1.00 0.00 C ATOM 317 O LYS A 25 -13.802 -13.180 4.511 1.00 0.00 O ATOM 318 CB LYS A 25 -12.793 -13.750 1.552 1.00 0.00 C ATOM 319 CG LYS A 25 -11.703 -14.220 0.605 1.00 0.00 C ATOM 320 CD LYS A 25 -10.802 -13.073 0.179 1.00 0.00 C ATOM 321 CE LYS A 25 -10.441 -13.166 -1.296 1.00 0.00 C ATOM 322 NZ LYS A 25 -9.579 -14.345 -1.583 1.00 0.00 N ATOM 0 H LYS A 25 -13.774 -16.098 1.561 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.004 -14.615 3.356 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.743 -13.730 1.018 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.579 -12.727 1.860 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.106 -14.992 1.090 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.156 -14.674 -0.276 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.302 -12.124 0.373 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.892 -13.082 0.779 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.353 -13.230 -1.890 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.925 -12.256 -1.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.355 -14.373 -2.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -8.697 -14.272 -1.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.081 -15.216 -1.315 1.00 0.00 H new ATOM 336 N SER A 26 -15.251 -14.600 3.539 1.00 0.00 N ATOM 337 CA SER A 26 -16.390 -14.155 4.333 1.00 0.00 C ATOM 338 C SER A 26 -16.069 -14.211 5.823 1.00 0.00 C ATOM 339 O SER A 26 -16.515 -13.364 6.599 1.00 0.00 O ATOM 340 CB SER A 26 -17.617 -15.019 4.032 1.00 0.00 C ATOM 341 OG SER A 26 -18.029 -14.868 2.685 1.00 0.00 O ATOM 0 H SER A 26 -15.466 -15.339 2.870 1.00 0.00 H new ATOM 0 HA SER A 26 -16.607 -13.121 4.064 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.386 -16.066 4.230 1.00 0.00 H new ATOM 0 HB3 SER A 26 -18.434 -14.741 4.699 1.00 0.00 H new ATOM 0 HG SER A 26 -18.678 -14.136 2.621 1.00 0.00 H new ATOM 347 N LEU A 27 -15.291 -15.214 6.217 1.00 0.00 N ATOM 348 CA LEU A 27 -14.908 -15.381 7.615 1.00 0.00 C ATOM 349 C LEU A 27 -13.779 -14.427 7.988 1.00 0.00 C ATOM 350 O LEU A 27 -13.676 -13.989 9.135 1.00 0.00 O ATOM 351 CB LEU A 27 -14.478 -16.826 7.876 1.00 0.00 C ATOM 352 CG LEU A 27 -15.555 -17.893 7.680 1.00 0.00 C ATOM 353 CD1 LEU A 27 -14.954 -19.285 7.792 1.00 0.00 C ATOM 354 CD2 LEU A 27 -16.677 -17.711 8.693 1.00 0.00 C ATOM 0 H LEU A 27 -14.913 -15.923 5.589 1.00 0.00 H new ATOM 0 HA LEU A 27 -15.774 -15.148 8.234 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.640 -17.059 7.219 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.109 -16.895 8.899 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.974 -17.780 6.680 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.736 -20.031 7.650 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.187 -19.413 7.028 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -14.508 -19.410 8.779 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -17.435 -18.479 8.539 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -16.274 -17.797 9.702 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -17.127 -16.727 8.565 1.00 0.00 H new ATOM 366 N ARG A 28 -12.935 -14.106 7.013 1.00 0.00 N ATOM 367 CA ARG A 28 -11.814 -13.202 7.239 1.00 0.00 C ATOM 368 C ARG A 28 -12.295 -11.870 7.805 1.00 0.00 C ATOM 369 O ARG A 28 -11.564 -11.188 8.525 1.00 0.00 O ATOM 370 CB ARG A 28 -11.049 -12.968 5.935 1.00 0.00 C ATOM 371 CG ARG A 28 -9.551 -12.804 6.129 1.00 0.00 C ATOM 372 CD ARG A 28 -8.803 -14.087 5.803 1.00 0.00 C ATOM 373 NE ARG A 28 -8.380 -14.135 4.406 1.00 0.00 N ATOM 374 CZ ARG A 28 -7.724 -15.158 3.871 1.00 0.00 C ATOM 375 NH1 ARG A 28 -7.418 -16.214 4.612 1.00 0.00 N ATOM 376 NH2 ARG A 28 -7.374 -15.128 2.591 1.00 0.00 N ATOM 0 H ARG A 28 -13.006 -14.459 6.059 1.00 0.00 H new ATOM 0 HA ARG A 28 -11.147 -13.666 7.966 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -11.230 -13.806 5.262 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.443 -12.077 5.447 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -9.187 -11.998 5.493 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -9.346 -12.514 7.160 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -7.929 -14.171 6.449 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -9.442 -14.944 6.018 1.00 0.00 H new ATOM 0 HE ARG A 28 -8.601 -13.339 3.808 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -7.687 -16.242 5.596 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -6.914 -16.998 4.198 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -7.609 -14.318 2.017 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -6.870 -15.915 2.182 1.00 0.00 H new ATOM 390 N PHE A 29 -13.530 -11.504 7.476 1.00 0.00 N ATOM 391 CA PHE A 29 -14.108 -10.252 7.950 1.00 0.00 C ATOM 392 C PHE A 29 -14.007 -10.147 9.469 1.00 0.00 C ATOM 393 O PHE A 29 -13.541 -9.140 10.002 1.00 0.00 O ATOM 394 CB PHE A 29 -15.572 -10.146 7.516 1.00 0.00 C ATOM 395 CG PHE A 29 -16.206 -8.829 7.864 1.00 0.00 C ATOM 396 CD1 PHE A 29 -16.004 -7.715 7.065 1.00 0.00 C ATOM 397 CD2 PHE A 29 -17.004 -8.706 8.990 1.00 0.00 C ATOM 398 CE1 PHE A 29 -16.586 -6.503 7.382 1.00 0.00 C ATOM 399 CE2 PHE A 29 -17.589 -7.496 9.311 1.00 0.00 C ATOM 400 CZ PHE A 29 -17.379 -6.392 8.507 1.00 0.00 C ATOM 0 H PHE A 29 -14.149 -12.057 6.883 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.545 -9.430 7.509 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -15.635 -10.297 6.438 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -16.141 -10.949 7.985 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.384 -7.795 6.184 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.171 -9.565 9.623 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -16.421 -5.643 6.750 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.210 -7.413 10.190 1.00 0.00 H new ATOM 0 HZ PHE A 29 -17.834 -5.445 8.758 1.00 0.00 H new ATOM 410 N ILE A 30 -14.448 -11.194 10.158 1.00 0.00 N ATOM 411 CA ILE A 30 -14.407 -11.220 11.615 1.00 0.00 C ATOM 412 C ILE A 30 -13.064 -11.737 12.118 1.00 0.00 C ATOM 413 O ILE A 30 -12.642 -11.421 13.230 1.00 0.00 O ATOM 414 CB ILE A 30 -15.532 -12.099 12.194 1.00 0.00 C ATOM 415 CG1 ILE A 30 -15.464 -13.508 11.603 1.00 0.00 C ATOM 416 CG2 ILE A 30 -16.890 -11.469 11.921 1.00 0.00 C ATOM 417 CD1 ILE A 30 -16.408 -14.487 12.265 1.00 0.00 C ATOM 0 H ILE A 30 -14.837 -12.035 9.731 1.00 0.00 H new ATOM 0 HA ILE A 30 -14.548 -10.193 11.953 1.00 0.00 H new ATOM 0 HB ILE A 30 -15.397 -12.172 13.273 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -15.693 -13.458 10.538 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.444 -13.882 11.693 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -17.675 -12.102 12.336 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -16.934 -10.484 12.386 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -17.035 -11.369 10.845 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -16.306 -15.465 11.795 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -16.166 -14.566 13.325 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -17.434 -14.136 12.153 1.00 0.00 H new ATOM 429 N GLY A 31 -12.394 -12.534 11.290 1.00 0.00 N ATOM 430 CA GLY A 31 -11.104 -13.081 11.667 1.00 0.00 C ATOM 431 C GLY A 31 -11.229 -14.367 12.459 1.00 0.00 C ATOM 432 O GLY A 31 -11.325 -14.342 13.687 1.00 0.00 O ATOM 0 H GLY A 31 -12.722 -12.810 10.365 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -10.515 -13.267 10.769 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.560 -12.345 12.259 1.00 0.00 H new ATOM 436 N LEU A 32 -11.229 -15.494 11.757 1.00 0.00 N ATOM 437 CA LEU A 32 -11.345 -16.798 12.402 1.00 0.00 C ATOM 438 C LEU A 32 -10.054 -17.596 12.253 1.00 0.00 C ATOM 439 O LEU A 32 -9.070 -17.105 11.701 1.00 0.00 O ATOM 440 CB LEU A 32 -12.515 -17.582 11.805 1.00 0.00 C ATOM 441 CG LEU A 32 -13.908 -17.001 12.050 1.00 0.00 C ATOM 442 CD1 LEU A 32 -14.978 -17.927 11.493 1.00 0.00 C ATOM 443 CD2 LEU A 32 -14.130 -16.758 13.536 1.00 0.00 C ATOM 0 H LEU A 32 -11.150 -15.532 10.741 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.529 -16.636 13.464 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.361 -17.662 10.729 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.490 -18.595 12.207 1.00 0.00 H new ATOM 0 HG LEU A 32 -13.979 -16.045 11.531 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.963 -17.497 11.677 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.830 -18.050 10.420 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.909 -18.898 11.983 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -15.126 -16.344 13.692 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.039 -17.700 14.076 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.383 -16.055 13.905 1.00 0.00 H new ATOM 455 N SER A 33 -10.066 -18.829 12.749 1.00 0.00 N ATOM 456 CA SER A 33 -8.895 -19.695 12.672 1.00 0.00 C ATOM 457 C SER A 33 -8.658 -20.163 11.240 1.00 0.00 C ATOM 458 O SER A 33 -9.603 -20.441 10.502 1.00 0.00 O ATOM 459 CB SER A 33 -9.068 -20.904 13.593 1.00 0.00 C ATOM 460 OG SER A 33 -8.175 -20.841 14.692 1.00 0.00 O ATOM 0 H SER A 33 -10.873 -19.251 13.208 1.00 0.00 H new ATOM 0 HA SER A 33 -8.027 -19.121 12.996 1.00 0.00 H new ATOM 0 HB2 SER A 33 -10.095 -20.944 13.957 1.00 0.00 H new ATOM 0 HB3 SER A 33 -8.893 -21.821 13.031 1.00 0.00 H new ATOM 0 HG SER A 33 -8.307 -21.624 15.266 1.00 0.00 H new ATOM 466 N GLU A 34 -7.389 -20.246 10.854 1.00 0.00 N ATOM 467 CA GLU A 34 -7.027 -20.679 9.509 1.00 0.00 C ATOM 468 C GLU A 34 -7.586 -22.068 9.216 1.00 0.00 C ATOM 469 O GLU A 34 -7.851 -22.411 8.064 1.00 0.00 O ATOM 470 CB GLU A 34 -5.506 -20.683 9.343 1.00 0.00 C ATOM 471 CG GLU A 34 -4.944 -19.364 8.842 1.00 0.00 C ATOM 472 CD GLU A 34 -4.629 -19.389 7.359 1.00 0.00 C ATOM 473 OE1 GLU A 34 -3.880 -20.290 6.926 1.00 0.00 O ATOM 474 OE2 GLU A 34 -5.131 -18.507 6.631 1.00 0.00 O ATOM 0 H GLU A 34 -6.595 -20.019 11.453 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.461 -19.975 8.799 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.045 -20.924 10.301 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.227 -21.474 8.647 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.661 -18.568 9.044 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.037 -19.125 9.398 1.00 0.00 H new ATOM 481 N ASP A 35 -7.761 -22.862 10.266 1.00 0.00 N ATOM 482 CA ASP A 35 -8.289 -24.214 10.122 1.00 0.00 C ATOM 483 C ASP A 35 -9.778 -24.184 9.792 1.00 0.00 C ATOM 484 O ASP A 35 -10.255 -24.950 8.955 1.00 0.00 O ATOM 485 CB ASP A 35 -8.054 -25.015 11.404 1.00 0.00 C ATOM 486 CG ASP A 35 -7.471 -26.387 11.131 1.00 0.00 C ATOM 487 OD1 ASP A 35 -8.253 -27.317 10.841 1.00 0.00 O ATOM 488 OD2 ASP A 35 -6.233 -26.532 11.207 1.00 0.00 O ATOM 0 H ASP A 35 -7.545 -22.593 11.226 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.763 -24.697 9.299 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -7.380 -24.460 12.057 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.998 -25.124 11.939 1.00 0.00 H new ATOM 493 N VAL A 36 -10.509 -23.294 10.457 1.00 0.00 N ATOM 494 CA VAL A 36 -11.944 -23.164 10.235 1.00 0.00 C ATOM 495 C VAL A 36 -12.243 -22.776 8.791 1.00 0.00 C ATOM 496 O VAL A 36 -13.050 -23.420 8.120 1.00 0.00 O ATOM 497 CB VAL A 36 -12.564 -22.114 11.175 1.00 0.00 C ATOM 498 CG1 VAL A 36 -14.058 -21.983 10.918 1.00 0.00 C ATOM 499 CG2 VAL A 36 -12.295 -22.476 12.628 1.00 0.00 C ATOM 0 H VAL A 36 -10.130 -22.653 11.154 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.387 -24.137 10.447 1.00 0.00 H new ATOM 0 HB VAL A 36 -12.099 -21.150 10.972 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.479 -21.237 11.592 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -14.224 -21.675 9.886 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.543 -22.944 11.092 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.740 -21.723 13.279 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -12.732 -23.450 12.847 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -11.219 -22.514 12.800 1.00 0.00 H new ATOM 509 N ILE A 37 -11.587 -21.722 8.319 1.00 0.00 N ATOM 510 CA ILE A 37 -11.782 -21.250 6.954 1.00 0.00 C ATOM 511 C ILE A 37 -11.596 -22.382 5.949 1.00 0.00 C ATOM 512 O ILE A 37 -12.414 -22.566 5.048 1.00 0.00 O ATOM 513 CB ILE A 37 -10.808 -20.107 6.609 1.00 0.00 C ATOM 514 CG1 ILE A 37 -10.987 -18.943 7.585 1.00 0.00 C ATOM 515 CG2 ILE A 37 -11.024 -19.642 5.176 1.00 0.00 C ATOM 516 CD1 ILE A 37 -9.977 -17.833 7.394 1.00 0.00 C ATOM 0 H ILE A 37 -10.916 -21.178 8.862 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.804 -20.877 6.892 1.00 0.00 H new ATOM 0 HB ILE A 37 -9.787 -20.479 6.700 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -11.991 -18.534 7.469 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -10.912 -19.320 8.605 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -10.329 -18.834 4.947 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.851 -20.474 4.493 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.047 -19.284 5.060 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -10.164 -17.042 8.120 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.971 -18.227 7.539 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -10.067 -17.429 6.386 1.00 0.00 H new ATOM 528 N SER A 38 -10.516 -23.139 6.111 1.00 0.00 N ATOM 529 CA SER A 38 -10.221 -24.252 5.217 1.00 0.00 C ATOM 530 C SER A 38 -11.193 -25.406 5.448 1.00 0.00 C ATOM 531 O SER A 38 -11.458 -26.199 4.544 1.00 0.00 O ATOM 532 CB SER A 38 -8.784 -24.733 5.424 1.00 0.00 C ATOM 533 OG SER A 38 -8.479 -24.854 6.802 1.00 0.00 O ATOM 0 H SER A 38 -9.830 -23.002 6.854 1.00 0.00 H new ATOM 0 HA SER A 38 -10.335 -23.902 4.191 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.645 -25.696 4.932 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.092 -24.033 4.956 1.00 0.00 H new ATOM 0 HG SER A 38 -8.178 -23.988 7.148 1.00 0.00 H new ATOM 539 N PHE A 39 -11.722 -25.492 6.664 1.00 0.00 N ATOM 540 CA PHE A 39 -12.663 -26.548 7.015 1.00 0.00 C ATOM 541 C PHE A 39 -13.959 -26.408 6.221 1.00 0.00 C ATOM 542 O PHE A 39 -14.666 -27.388 5.987 1.00 0.00 O ATOM 543 CB PHE A 39 -12.965 -26.514 8.515 1.00 0.00 C ATOM 544 CG PHE A 39 -12.500 -27.739 9.248 1.00 0.00 C ATOM 545 CD1 PHE A 39 -12.978 -28.993 8.904 1.00 0.00 C ATOM 546 CD2 PHE A 39 -11.584 -27.636 10.283 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.551 -30.122 9.577 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.153 -28.762 10.959 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.638 -30.006 10.606 1.00 0.00 C ATOM 0 H PHE A 39 -11.515 -24.843 7.423 1.00 0.00 H new ATOM 0 HA PHE A 39 -12.206 -27.505 6.765 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.490 -25.636 8.953 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -14.040 -26.400 8.659 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -13.693 -29.089 8.100 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.203 -26.665 10.564 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.931 -31.094 9.298 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.438 -28.669 11.763 1.00 0.00 H new ATOM 0 HZ PHE A 39 -11.304 -30.887 11.134 1.00 0.00 H new ATOM 559 N PHE A 40 -14.263 -25.182 5.809 1.00 0.00 N ATOM 560 CA PHE A 40 -15.474 -24.912 5.042 1.00 0.00 C ATOM 561 C PHE A 40 -15.296 -25.320 3.582 1.00 0.00 C ATOM 562 O PHE A 40 -16.026 -26.167 3.069 1.00 0.00 O ATOM 563 CB PHE A 40 -15.837 -23.428 5.128 1.00 0.00 C ATOM 564 CG PHE A 40 -16.689 -23.087 6.316 1.00 0.00 C ATOM 565 CD1 PHE A 40 -16.373 -23.573 7.574 1.00 0.00 C ATOM 566 CD2 PHE A 40 -17.808 -22.281 6.175 1.00 0.00 C ATOM 567 CE1 PHE A 40 -17.156 -23.261 8.670 1.00 0.00 C ATOM 568 CE2 PHE A 40 -18.593 -21.965 7.267 1.00 0.00 C ATOM 569 CZ PHE A 40 -18.268 -22.456 8.516 1.00 0.00 C ATOM 0 H PHE A 40 -13.688 -24.360 5.993 1.00 0.00 H new ATOM 0 HA PHE A 40 -16.284 -25.503 5.470 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -14.920 -22.840 5.168 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -16.363 -23.138 4.219 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -15.505 -24.203 7.700 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -18.069 -21.896 5.200 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -16.899 -23.646 9.646 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -19.461 -21.334 7.144 1.00 0.00 H new ATOM 0 HZ PHE A 40 -18.882 -22.211 9.370 1.00 0.00 H new ATOM 579 N VAL A 41 -14.319 -24.710 2.919 1.00 0.00 N ATOM 580 CA VAL A 41 -14.043 -25.009 1.518 1.00 0.00 C ATOM 581 C VAL A 41 -13.876 -26.508 1.299 1.00 0.00 C ATOM 582 O VAL A 41 -14.484 -27.087 0.398 1.00 0.00 O ATOM 583 CB VAL A 41 -12.774 -24.285 1.029 1.00 0.00 C ATOM 584 CG1 VAL A 41 -12.527 -24.577 -0.443 1.00 0.00 C ATOM 585 CG2 VAL A 41 -12.888 -22.788 1.273 1.00 0.00 C ATOM 0 H VAL A 41 -13.705 -24.006 3.329 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.899 -24.654 0.944 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.921 -24.658 1.596 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -11.627 -24.057 -0.771 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -12.398 -25.650 -0.584 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -13.379 -24.233 -1.030 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.983 -22.292 0.922 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.750 -22.396 0.733 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -13.013 -22.602 2.340 1.00 0.00 H new ATOM 595 N THR A 42 -13.048 -27.134 2.130 1.00 0.00 N ATOM 596 CA THR A 42 -12.800 -28.566 2.028 1.00 0.00 C ATOM 597 C THR A 42 -14.095 -29.360 2.166 1.00 0.00 C ATOM 598 O THR A 42 -14.202 -30.480 1.670 1.00 0.00 O ATOM 599 CB THR A 42 -11.803 -29.042 3.100 1.00 0.00 C ATOM 600 OG1 THR A 42 -11.416 -30.396 2.843 1.00 0.00 O ATOM 601 CG2 THR A 42 -12.412 -28.939 4.490 1.00 0.00 C ATOM 0 H THR A 42 -12.538 -26.671 2.882 1.00 0.00 H new ATOM 0 HA THR A 42 -12.372 -28.742 1.041 1.00 0.00 H new ATOM 0 HB THR A 42 -10.924 -28.399 3.057 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.781 -30.690 3.529 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.689 -29.281 5.230 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.678 -27.902 4.695 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.306 -29.560 4.542 1.00 0.00 H new ATOM 609 N GLU A 43 -15.075 -28.770 2.844 1.00 0.00 N ATOM 610 CA GLU A 43 -16.362 -29.424 3.047 1.00 0.00 C ATOM 611 C GLU A 43 -17.373 -28.975 1.995 1.00 0.00 C ATOM 612 O GLU A 43 -18.583 -29.042 2.211 1.00 0.00 O ATOM 613 CB GLU A 43 -16.898 -29.120 4.448 1.00 0.00 C ATOM 614 CG GLU A 43 -16.409 -30.089 5.511 1.00 0.00 C ATOM 615 CD GLU A 43 -17.270 -31.333 5.607 1.00 0.00 C ATOM 616 OE1 GLU A 43 -18.468 -31.201 5.935 1.00 0.00 O ATOM 617 OE2 GLU A 43 -16.747 -32.438 5.354 1.00 0.00 O ATOM 0 H GLU A 43 -15.002 -27.842 3.261 1.00 0.00 H new ATOM 0 HA GLU A 43 -16.214 -30.499 2.948 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -16.605 -28.108 4.728 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -17.988 -29.141 4.423 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.382 -30.379 5.288 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -16.396 -29.586 6.478 1.00 0.00 H new ATOM 624 N LYS A 44 -16.867 -28.515 0.856 1.00 0.00 N ATOM 625 CA LYS A 44 -17.722 -28.055 -0.231 1.00 0.00 C ATOM 626 C LYS A 44 -18.674 -26.965 0.250 1.00 0.00 C ATOM 627 O LYS A 44 -19.749 -26.770 -0.319 1.00 0.00 O ATOM 628 CB LYS A 44 -18.521 -29.225 -0.809 1.00 0.00 C ATOM 629 CG LYS A 44 -18.861 -29.062 -2.281 1.00 0.00 C ATOM 630 CD LYS A 44 -20.363 -29.074 -2.511 1.00 0.00 C ATOM 631 CE LYS A 44 -20.721 -28.531 -3.886 1.00 0.00 C ATOM 632 NZ LYS A 44 -21.382 -29.561 -4.734 1.00 0.00 N ATOM 0 H LYS A 44 -15.868 -28.451 0.662 1.00 0.00 H new ATOM 0 HA LYS A 44 -17.084 -27.638 -1.010 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -17.951 -30.144 -0.676 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -19.445 -29.338 -0.242 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -18.443 -28.126 -2.650 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -18.398 -29.866 -2.854 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -20.739 -30.092 -2.412 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -20.854 -28.476 -1.743 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -21.383 -27.672 -3.776 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -19.818 -28.176 -4.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -21.610 -29.152 -5.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -20.741 -30.370 -4.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -22.257 -29.881 -4.272 1.00 0.00 H new ATOM 646 N ILE A 45 -18.272 -26.255 1.299 1.00 0.00 N ATOM 647 CA ILE A 45 -19.089 -25.183 1.854 1.00 0.00 C ATOM 648 C ILE A 45 -19.020 -23.933 0.984 1.00 0.00 C ATOM 649 O ILE A 45 -17.955 -23.336 0.820 1.00 0.00 O ATOM 650 CB ILE A 45 -18.649 -24.824 3.286 1.00 0.00 C ATOM 651 CG1 ILE A 45 -18.731 -26.054 4.192 1.00 0.00 C ATOM 652 CG2 ILE A 45 -19.509 -23.696 3.837 1.00 0.00 C ATOM 653 CD1 ILE A 45 -20.136 -26.587 4.363 1.00 0.00 C ATOM 0 H ILE A 45 -17.386 -26.403 1.781 1.00 0.00 H new ATOM 0 HA ILE A 45 -20.116 -25.549 1.879 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.613 -24.485 3.258 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -18.100 -26.841 3.780 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -18.325 -25.801 5.172 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -19.186 -23.454 4.849 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -19.405 -22.816 3.202 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -20.553 -24.009 3.854 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -20.117 -27.459 5.017 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -20.767 -25.815 4.804 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -20.538 -26.872 3.391 1.00 0.00 H new ATOM 665 N ASP A 46 -20.161 -23.540 0.430 1.00 0.00 N ATOM 666 CA ASP A 46 -20.231 -22.358 -0.421 1.00 0.00 C ATOM 667 C ASP A 46 -21.097 -21.278 0.219 1.00 0.00 C ATOM 668 O ASP A 46 -21.528 -21.411 1.364 1.00 0.00 O ATOM 669 CB ASP A 46 -20.789 -22.727 -1.797 1.00 0.00 C ATOM 670 CG ASP A 46 -22.201 -23.274 -1.722 1.00 0.00 C ATOM 671 OD1 ASP A 46 -23.137 -22.474 -1.509 1.00 0.00 O ATOM 672 OD2 ASP A 46 -22.371 -24.501 -1.877 1.00 0.00 O ATOM 0 H ASP A 46 -21.051 -24.023 0.555 1.00 0.00 H new ATOM 0 HA ASP A 46 -19.221 -21.966 -0.540 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -20.778 -21.846 -2.439 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -20.140 -23.469 -2.262 1.00 0.00 H new ATOM 677 N GLY A 47 -21.346 -20.206 -0.528 1.00 0.00 N ATOM 678 CA GLY A 47 -22.158 -19.118 -0.015 1.00 0.00 C ATOM 679 C GLY A 47 -23.543 -19.573 0.399 1.00 0.00 C ATOM 680 O GLY A 47 -23.935 -19.416 1.554 1.00 0.00 O ATOM 0 H GLY A 47 -21.000 -20.072 -1.478 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -21.656 -18.667 0.841 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -22.246 -18.344 -0.777 1.00 0.00 H new ATOM 684 N ASN A 48 -24.287 -20.137 -0.547 1.00 0.00 N ATOM 685 CA ASN A 48 -25.638 -20.614 -0.275 1.00 0.00 C ATOM 686 C ASN A 48 -25.638 -21.621 0.872 1.00 0.00 C ATOM 687 O ASN A 48 -26.636 -21.774 1.578 1.00 0.00 O ATOM 688 CB ASN A 48 -26.238 -21.252 -1.529 1.00 0.00 C ATOM 689 CG ASN A 48 -27.716 -20.945 -1.683 1.00 0.00 C ATOM 690 OD1 ASN A 48 -28.134 -19.791 -1.592 1.00 0.00 O ATOM 691 ND2 ASN A 48 -28.514 -21.980 -1.917 1.00 0.00 N ATOM 0 H ASN A 48 -23.977 -20.275 -1.509 1.00 0.00 H new ATOM 0 HA ASN A 48 -26.248 -19.758 0.016 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -25.702 -20.894 -2.408 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -26.096 -22.332 -1.487 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -29.517 -21.835 -2.029 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -28.124 -22.920 -1.985 1.00 0.00 H new ATOM 698 N LEU A 49 -24.514 -22.304 1.052 1.00 0.00 N ATOM 699 CA LEU A 49 -24.383 -23.297 2.113 1.00 0.00 C ATOM 700 C LEU A 49 -24.175 -22.623 3.466 1.00 0.00 C ATOM 701 O LEU A 49 -24.742 -23.044 4.475 1.00 0.00 O ATOM 702 CB LEU A 49 -23.216 -24.240 1.815 1.00 0.00 C ATOM 703 CG LEU A 49 -23.365 -25.674 2.326 1.00 0.00 C ATOM 704 CD1 LEU A 49 -23.549 -25.686 3.836 1.00 0.00 C ATOM 705 CD2 LEU A 49 -24.533 -26.366 1.639 1.00 0.00 C ATOM 0 H LEU A 49 -23.679 -22.189 0.477 1.00 0.00 H new ATOM 0 HA LEU A 49 -25.307 -23.874 2.153 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -23.069 -24.274 0.736 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -22.311 -23.814 2.247 1.00 0.00 H new ATOM 0 HG LEU A 49 -22.453 -26.221 2.087 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -23.653 -26.714 4.182 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -22.681 -25.230 4.312 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -24.445 -25.123 4.098 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -24.624 -27.385 2.015 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -25.453 -25.819 1.846 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -24.360 -26.390 0.563 1.00 0.00 H new ATOM 717 N LEU A 50 -23.359 -21.574 3.479 1.00 0.00 N ATOM 718 CA LEU A 50 -23.078 -20.840 4.707 1.00 0.00 C ATOM 719 C LEU A 50 -24.363 -20.297 5.324 1.00 0.00 C ATOM 720 O LEU A 50 -24.604 -20.454 6.521 1.00 0.00 O ATOM 721 CB LEU A 50 -22.108 -19.691 4.427 1.00 0.00 C ATOM 722 CG LEU A 50 -21.902 -18.692 5.567 1.00 0.00 C ATOM 723 CD1 LEU A 50 -21.523 -19.417 6.849 1.00 0.00 C ATOM 724 CD2 LEU A 50 -20.839 -17.669 5.195 1.00 0.00 C ATOM 0 H LEU A 50 -22.881 -21.213 2.653 1.00 0.00 H new ATOM 0 HA LEU A 50 -22.620 -21.530 5.416 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -21.139 -20.116 4.164 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.465 -19.146 3.553 1.00 0.00 H new ATOM 0 HG LEU A 50 -22.840 -18.164 5.736 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.380 -18.691 7.649 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -22.319 -20.109 7.125 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -20.598 -19.972 6.693 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -20.706 -16.967 6.018 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -19.896 -18.179 4.998 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.152 -17.127 4.303 1.00 0.00 H new ATOM 736 N VAL A 51 -25.186 -19.659 4.498 1.00 0.00 N ATOM 737 CA VAL A 51 -26.448 -19.095 4.961 1.00 0.00 C ATOM 738 C VAL A 51 -27.418 -20.193 5.383 1.00 0.00 C ATOM 739 O VAL A 51 -28.308 -19.967 6.203 1.00 0.00 O ATOM 740 CB VAL A 51 -27.110 -18.231 3.872 1.00 0.00 C ATOM 741 CG1 VAL A 51 -26.252 -17.015 3.560 1.00 0.00 C ATOM 742 CG2 VAL A 51 -27.359 -19.054 2.617 1.00 0.00 C ATOM 0 H VAL A 51 -25.001 -19.520 3.505 1.00 0.00 H new ATOM 0 HA VAL A 51 -26.217 -18.467 5.822 1.00 0.00 H new ATOM 0 HB VAL A 51 -28.072 -17.881 4.246 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -26.736 -16.417 2.788 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -26.130 -16.415 4.462 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -25.274 -17.341 3.206 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -27.827 -18.427 1.858 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -26.411 -19.436 2.238 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -28.017 -19.890 2.855 1.00 0.00 H new ATOM 752 N GLN A 52 -27.239 -21.383 4.817 1.00 0.00 N ATOM 753 CA GLN A 52 -28.100 -22.516 5.135 1.00 0.00 C ATOM 754 C GLN A 52 -27.648 -23.199 6.421 1.00 0.00 C ATOM 755 O GLN A 52 -28.455 -23.787 7.142 1.00 0.00 O ATOM 756 CB GLN A 52 -28.100 -23.522 3.982 1.00 0.00 C ATOM 757 CG GLN A 52 -29.258 -23.339 3.015 1.00 0.00 C ATOM 758 CD GLN A 52 -29.472 -24.547 2.125 1.00 0.00 C ATOM 759 OE1 GLN A 52 -30.501 -25.219 2.208 1.00 0.00 O ATOM 760 NE2 GLN A 52 -28.499 -24.831 1.267 1.00 0.00 N ATOM 0 H GLN A 52 -26.507 -21.587 4.137 1.00 0.00 H new ATOM 0 HA GLN A 52 -29.113 -22.141 5.281 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -27.162 -23.433 3.434 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -28.136 -24.531 4.392 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -30.170 -23.142 3.579 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -29.072 -22.463 2.394 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -27.663 -24.247 1.232 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -28.587 -25.633 0.643 1.00 0.00 H new ATOM 769 N LEU A 53 -26.352 -23.118 6.704 1.00 0.00 N ATOM 770 CA LEU A 53 -25.792 -23.729 7.905 1.00 0.00 C ATOM 771 C LEU A 53 -26.494 -23.213 9.157 1.00 0.00 C ATOM 772 O LEU A 53 -26.922 -22.060 9.212 1.00 0.00 O ATOM 773 CB LEU A 53 -24.292 -23.443 7.994 1.00 0.00 C ATOM 774 CG LEU A 53 -23.382 -24.375 7.193 1.00 0.00 C ATOM 775 CD1 LEU A 53 -22.025 -23.729 6.962 1.00 0.00 C ATOM 776 CD2 LEU A 53 -23.225 -25.710 7.907 1.00 0.00 C ATOM 0 H LEU A 53 -25.670 -22.636 6.119 1.00 0.00 H new ATOM 0 HA LEU A 53 -25.948 -24.806 7.841 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -24.117 -22.421 7.659 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -23.995 -23.490 9.042 1.00 0.00 H new ATOM 0 HG LEU A 53 -23.844 -24.556 6.223 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -21.392 -24.407 6.390 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -22.154 -22.799 6.408 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.555 -23.516 7.922 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -22.574 -26.361 7.323 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -22.786 -25.547 8.891 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -24.202 -26.180 8.019 1.00 0.00 H new ATOM 788 N THR A 54 -26.608 -24.075 10.163 1.00 0.00 N ATOM 789 CA THR A 54 -27.257 -23.707 11.415 1.00 0.00 C ATOM 790 C THR A 54 -26.276 -23.763 12.580 1.00 0.00 C ATOM 791 O THR A 54 -25.078 -23.968 12.385 1.00 0.00 O ATOM 792 CB THR A 54 -28.452 -24.629 11.720 1.00 0.00 C ATOM 793 OG1 THR A 54 -27.987 -25.948 12.027 1.00 0.00 O ATOM 794 CG2 THR A 54 -29.408 -24.685 10.538 1.00 0.00 C ATOM 0 H THR A 54 -26.259 -25.033 10.135 1.00 0.00 H new ATOM 0 HA THR A 54 -27.617 -22.685 11.296 1.00 0.00 H new ATOM 0 HB THR A 54 -28.986 -24.223 12.579 1.00 0.00 H new ATOM 0 HG1 THR A 54 -28.730 -26.484 12.375 1.00 0.00 H new ATOM 0 HG21 THR A 54 -30.244 -25.342 10.777 1.00 0.00 H new ATOM 0 HG22 THR A 54 -29.783 -23.684 10.325 1.00 0.00 H new ATOM 0 HG23 THR A 54 -28.883 -25.069 9.663 1.00 0.00 H new ATOM 802 N GLU A 55 -26.791 -23.581 13.792 1.00 0.00 N ATOM 803 CA GLU A 55 -25.959 -23.611 14.988 1.00 0.00 C ATOM 804 C GLU A 55 -25.846 -25.030 15.537 1.00 0.00 C ATOM 805 O GLU A 55 -24.807 -25.419 16.070 1.00 0.00 O ATOM 806 CB GLU A 55 -26.533 -22.682 16.060 1.00 0.00 C ATOM 807 CG GLU A 55 -25.894 -22.861 17.427 1.00 0.00 C ATOM 808 CD GLU A 55 -25.475 -21.545 18.052 1.00 0.00 C ATOM 809 OE1 GLU A 55 -24.852 -20.724 17.347 1.00 0.00 O ATOM 810 OE2 GLU A 55 -25.772 -21.335 19.247 1.00 0.00 O ATOM 0 H GLU A 55 -27.781 -23.411 13.971 1.00 0.00 H new ATOM 0 HA GLU A 55 -24.962 -23.265 14.714 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -26.403 -21.648 15.740 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -27.606 -22.857 16.144 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -26.597 -23.366 18.089 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -25.022 -23.509 17.334 1.00 0.00 H new ATOM 817 N GLU A 56 -26.922 -25.798 15.402 1.00 0.00 N ATOM 818 CA GLU A 56 -26.944 -27.174 15.885 1.00 0.00 C ATOM 819 C GLU A 56 -26.041 -28.063 15.036 1.00 0.00 C ATOM 820 O GLU A 56 -25.503 -29.061 15.518 1.00 0.00 O ATOM 821 CB GLU A 56 -28.374 -27.719 15.872 1.00 0.00 C ATOM 822 CG GLU A 56 -29.232 -27.206 17.017 1.00 0.00 C ATOM 823 CD GLU A 56 -30.530 -27.976 17.163 1.00 0.00 C ATOM 824 OE1 GLU A 56 -30.858 -28.763 16.251 1.00 0.00 O ATOM 825 OE2 GLU A 56 -31.217 -27.790 18.189 1.00 0.00 O ATOM 0 H GLU A 56 -27.790 -25.491 14.962 1.00 0.00 H new ATOM 0 HA GLU A 56 -26.570 -27.179 16.909 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -28.847 -27.452 14.927 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -28.339 -28.808 15.915 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -28.668 -27.273 17.947 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -29.456 -26.152 16.855 1.00 0.00 H new ATOM 832 N ILE A 57 -25.880 -27.695 13.769 1.00 0.00 N ATOM 833 CA ILE A 57 -25.042 -28.459 12.853 1.00 0.00 C ATOM 834 C ILE A 57 -23.567 -28.124 13.048 1.00 0.00 C ATOM 835 O ILE A 57 -22.696 -28.975 12.865 1.00 0.00 O ATOM 836 CB ILE A 57 -25.427 -28.195 11.386 1.00 0.00 C ATOM 837 CG1 ILE A 57 -26.896 -28.550 11.149 1.00 0.00 C ATOM 838 CG2 ILE A 57 -24.527 -28.989 10.451 1.00 0.00 C ATOM 839 CD1 ILE A 57 -27.467 -27.949 9.884 1.00 0.00 C ATOM 0 H ILE A 57 -26.319 -26.873 13.354 1.00 0.00 H new ATOM 0 HA ILE A 57 -25.206 -29.513 13.079 1.00 0.00 H new ATOM 0 HB ILE A 57 -25.291 -27.134 11.176 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -26.996 -29.634 11.104 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -27.485 -28.211 12.001 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -24.812 -28.792 9.417 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -23.490 -28.692 10.605 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -24.634 -30.053 10.660 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -28.512 -28.243 9.781 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -27.399 -26.862 9.935 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -26.903 -28.308 9.024 1.00 0.00 H new ATOM 851 N LEU A 58 -23.293 -26.879 13.423 1.00 0.00 N ATOM 852 CA LEU A 58 -21.923 -26.431 13.646 1.00 0.00 C ATOM 853 C LEU A 58 -21.307 -27.139 14.848 1.00 0.00 C ATOM 854 O LEU A 58 -20.089 -27.297 14.931 1.00 0.00 O ATOM 855 CB LEU A 58 -21.889 -24.916 13.860 1.00 0.00 C ATOM 856 CG LEU A 58 -21.827 -24.061 12.594 1.00 0.00 C ATOM 857 CD1 LEU A 58 -22.419 -22.684 12.850 1.00 0.00 C ATOM 858 CD2 LEU A 58 -20.393 -23.944 12.099 1.00 0.00 C ATOM 0 H LEU A 58 -24.002 -26.162 13.579 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.337 -26.680 12.761 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -22.776 -24.629 14.425 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.025 -24.676 14.479 1.00 0.00 H new ATOM 0 HG LEU A 58 -22.419 -24.549 11.820 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -22.366 -22.090 11.938 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -23.460 -22.787 13.156 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -21.856 -22.187 13.640 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -20.368 -23.332 11.197 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -19.779 -23.479 12.870 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -20.003 -24.937 11.874 1.00 0.00 H new ATOM 870 N SER A 59 -22.157 -27.566 15.777 1.00 0.00 N ATOM 871 CA SER A 59 -21.696 -28.256 16.975 1.00 0.00 C ATOM 872 C SER A 59 -21.827 -29.768 16.816 1.00 0.00 C ATOM 873 O SER A 59 -21.093 -30.534 17.439 1.00 0.00 O ATOM 874 CB SER A 59 -22.492 -27.791 18.196 1.00 0.00 C ATOM 875 OG SER A 59 -21.841 -28.158 19.400 1.00 0.00 O ATOM 0 H SER A 59 -23.168 -27.446 15.722 1.00 0.00 H new ATOM 0 HA SER A 59 -20.644 -28.013 17.121 1.00 0.00 H new ATOM 0 HB2 SER A 59 -22.617 -26.709 18.162 1.00 0.00 H new ATOM 0 HB3 SER A 59 -23.490 -28.228 18.171 1.00 0.00 H new ATOM 0 HG SER A 59 -22.369 -27.848 20.165 1.00 0.00 H new ATOM 881 N GLU A 60 -22.767 -30.189 15.975 1.00 0.00 N ATOM 882 CA GLU A 60 -22.995 -31.609 15.734 1.00 0.00 C ATOM 883 C GLU A 60 -21.984 -32.160 14.732 1.00 0.00 C ATOM 884 O GLU A 60 -21.270 -33.120 15.019 1.00 0.00 O ATOM 885 CB GLU A 60 -24.417 -31.839 15.219 1.00 0.00 C ATOM 886 CG GLU A 60 -25.461 -31.905 16.322 1.00 0.00 C ATOM 887 CD GLU A 60 -25.955 -33.317 16.574 1.00 0.00 C ATOM 888 OE1 GLU A 60 -26.349 -33.990 15.598 1.00 0.00 O ATOM 889 OE2 GLU A 60 -25.947 -33.748 17.746 1.00 0.00 O ATOM 0 H GLU A 60 -23.382 -29.568 15.450 1.00 0.00 H new ATOM 0 HA GLU A 60 -22.868 -32.137 16.679 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -24.679 -31.036 14.530 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -24.442 -32.768 14.650 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -25.038 -31.502 17.242 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -26.306 -31.270 16.056 1.00 0.00 H new ATOM 896 N ASP A 61 -21.931 -31.544 13.556 1.00 0.00 N ATOM 897 CA ASP A 61 -21.008 -31.971 12.511 1.00 0.00 C ATOM 898 C ASP A 61 -19.642 -31.316 12.691 1.00 0.00 C ATOM 899 O ASP A 61 -18.675 -31.969 13.085 1.00 0.00 O ATOM 900 CB ASP A 61 -21.573 -31.631 11.131 1.00 0.00 C ATOM 901 CG ASP A 61 -22.357 -32.779 10.527 1.00 0.00 C ATOM 902 OD1 ASP A 61 -23.379 -33.178 11.125 1.00 0.00 O ATOM 903 OD2 ASP A 61 -21.950 -33.279 9.458 1.00 0.00 O ATOM 0 H ASP A 61 -22.516 -30.748 13.303 1.00 0.00 H new ATOM 0 HA ASP A 61 -20.886 -33.051 12.588 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -22.219 -30.757 11.212 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -20.755 -31.362 10.463 1.00 0.00 H new ATOM 908 N PHE A 62 -19.569 -30.022 12.398 1.00 0.00 N ATOM 909 CA PHE A 62 -18.321 -29.278 12.526 1.00 0.00 C ATOM 910 C PHE A 62 -17.713 -29.470 13.911 1.00 0.00 C ATOM 911 O PHE A 62 -16.492 -29.485 14.070 1.00 0.00 O ATOM 912 CB PHE A 62 -18.561 -27.789 12.263 1.00 0.00 C ATOM 913 CG PHE A 62 -18.561 -27.430 10.805 1.00 0.00 C ATOM 914 CD1 PHE A 62 -17.371 -27.337 10.101 1.00 0.00 C ATOM 915 CD2 PHE A 62 -19.750 -27.186 10.138 1.00 0.00 C ATOM 916 CE1 PHE A 62 -17.368 -27.006 8.760 1.00 0.00 C ATOM 917 CE2 PHE A 62 -19.753 -26.854 8.796 1.00 0.00 C ATOM 918 CZ PHE A 62 -18.561 -26.765 8.106 1.00 0.00 C ATOM 0 H PHE A 62 -20.359 -29.467 12.070 1.00 0.00 H new ATOM 0 HA PHE A 62 -17.620 -29.662 11.785 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -19.517 -27.501 12.700 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -17.790 -27.210 12.772 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -16.435 -27.525 10.607 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -20.686 -27.256 10.673 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -16.434 -26.936 8.223 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -20.687 -26.664 8.288 1.00 0.00 H new ATOM 0 HZ PHE A 62 -18.561 -26.508 7.057 1.00 0.00 H new ATOM 928 N LYS A 63 -18.573 -29.617 14.914 1.00 0.00 N ATOM 929 CA LYS A 63 -18.123 -29.809 16.287 1.00 0.00 C ATOM 930 C LYS A 63 -17.138 -28.717 16.695 1.00 0.00 C ATOM 931 O LYS A 63 -16.236 -28.949 17.501 1.00 0.00 O ATOM 932 CB LYS A 63 -17.469 -31.184 16.444 1.00 0.00 C ATOM 933 CG LYS A 63 -18.001 -31.979 17.623 1.00 0.00 C ATOM 934 CD LYS A 63 -18.135 -33.455 17.286 1.00 0.00 C ATOM 935 CE LYS A 63 -16.856 -34.217 17.598 1.00 0.00 C ATOM 936 NZ LYS A 63 -17.114 -35.667 17.815 1.00 0.00 N ATOM 0 H LYS A 63 -19.587 -29.607 14.801 1.00 0.00 H new ATOM 0 HA LYS A 63 -18.994 -29.751 16.939 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -17.624 -31.757 15.530 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -16.393 -31.054 16.560 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -17.332 -31.859 18.475 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -18.972 -31.583 17.921 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -18.962 -33.884 17.851 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -18.378 -33.567 16.229 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.150 -34.093 16.777 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -16.389 -33.794 18.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -16.218 -36.151 18.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.768 -35.787 18.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -17.536 -36.077 16.957 1.00 0.00 H new ATOM 950 N LEU A 64 -17.318 -27.526 16.135 1.00 0.00 N ATOM 951 CA LEU A 64 -16.447 -26.397 16.442 1.00 0.00 C ATOM 952 C LEU A 64 -16.617 -25.956 17.892 1.00 0.00 C ATOM 953 O LEU A 64 -17.406 -26.534 18.639 1.00 0.00 O ATOM 954 CB LEU A 64 -16.746 -25.226 15.503 1.00 0.00 C ATOM 955 CG LEU A 64 -16.226 -25.364 14.072 1.00 0.00 C ATOM 956 CD1 LEU A 64 -17.093 -24.566 13.110 1.00 0.00 C ATOM 957 CD2 LEU A 64 -14.776 -24.912 13.985 1.00 0.00 C ATOM 0 H LEU A 64 -18.059 -27.317 15.466 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.415 -26.717 16.297 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -17.826 -25.084 15.464 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.321 -24.321 15.937 1.00 0.00 H new ATOM 0 HG LEU A 64 -16.276 -26.415 13.788 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -16.708 -24.676 12.096 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.117 -24.936 13.151 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -17.076 -23.513 13.392 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -14.423 -25.017 12.959 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -14.701 -23.868 14.289 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.163 -25.526 14.644 1.00 0.00 H new ATOM 969 N SER A 65 -15.871 -24.928 18.284 1.00 0.00 N ATOM 970 CA SER A 65 -15.938 -24.410 19.646 1.00 0.00 C ATOM 971 C SER A 65 -17.135 -23.480 19.815 1.00 0.00 C ATOM 972 O SER A 65 -17.674 -22.958 18.840 1.00 0.00 O ATOM 973 CB SER A 65 -14.647 -23.667 19.995 1.00 0.00 C ATOM 974 OG SER A 65 -14.411 -23.685 21.392 1.00 0.00 O ATOM 0 H SER A 65 -15.213 -24.437 17.678 1.00 0.00 H new ATOM 0 HA SER A 65 -16.058 -25.255 20.325 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.807 -24.127 19.475 1.00 0.00 H new ATOM 0 HB3 SER A 65 -14.711 -22.636 19.647 1.00 0.00 H new ATOM 0 HG SER A 65 -13.580 -23.205 21.590 1.00 0.00 H new ATOM 980 N LYS A 66 -17.547 -23.278 21.063 1.00 0.00 N ATOM 981 CA LYS A 66 -18.679 -22.411 21.364 1.00 0.00 C ATOM 982 C LYS A 66 -18.466 -21.016 20.784 1.00 0.00 C ATOM 983 O LYS A 66 -19.410 -20.373 20.324 1.00 0.00 O ATOM 984 CB LYS A 66 -18.890 -22.319 22.877 1.00 0.00 C ATOM 985 CG LYS A 66 -17.685 -21.778 23.627 1.00 0.00 C ATOM 986 CD LYS A 66 -17.476 -22.506 24.944 1.00 0.00 C ATOM 987 CE LYS A 66 -16.211 -22.035 25.646 1.00 0.00 C ATOM 988 NZ LYS A 66 -16.340 -20.639 26.146 1.00 0.00 N ATOM 0 H LYS A 66 -17.113 -23.704 21.882 1.00 0.00 H new ATOM 0 HA LYS A 66 -19.568 -22.844 20.905 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -19.749 -21.679 23.077 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -19.133 -23.309 23.262 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -16.794 -21.881 23.008 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -17.821 -20.713 23.816 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -18.336 -22.341 25.593 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -17.415 -23.579 24.762 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -15.990 -22.700 26.481 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -15.369 -22.097 24.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -15.491 -20.385 26.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -16.441 -19.990 25.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -17.178 -20.565 26.757 1.00 0.00 H new ATOM 1002 N LEU A 67 -17.220 -20.555 20.807 1.00 0.00 N ATOM 1003 CA LEU A 67 -16.883 -19.237 20.282 1.00 0.00 C ATOM 1004 C LEU A 67 -17.066 -19.190 18.768 1.00 0.00 C ATOM 1005 O LEU A 67 -17.589 -18.217 18.227 1.00 0.00 O ATOM 1006 CB LEU A 67 -15.441 -18.876 20.644 1.00 0.00 C ATOM 1007 CG LEU A 67 -15.265 -17.697 21.602 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -15.936 -16.451 21.044 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -15.824 -18.037 22.975 1.00 0.00 C ATOM 0 H LEU A 67 -16.427 -21.074 21.183 1.00 0.00 H new ATOM 0 HA LEU A 67 -17.558 -18.510 20.734 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -14.968 -19.752 21.088 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -14.901 -18.654 19.724 1.00 0.00 H new ATOM 0 HG LEU A 67 -14.199 -17.495 21.706 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -15.800 -15.622 21.739 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -15.488 -16.196 20.084 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -17.001 -16.641 20.909 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.690 -17.186 23.643 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -16.886 -18.267 22.889 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -15.297 -18.902 23.378 1.00 0.00 H new ATOM 1021 N GLN A 68 -16.633 -20.250 18.092 1.00 0.00 N ATOM 1022 CA GLN A 68 -16.750 -20.330 16.641 1.00 0.00 C ATOM 1023 C GLN A 68 -18.210 -20.465 16.220 1.00 0.00 C ATOM 1024 O GLN A 68 -18.688 -19.730 15.355 1.00 0.00 O ATOM 1025 CB GLN A 68 -15.942 -21.513 16.107 1.00 0.00 C ATOM 1026 CG GLN A 68 -14.456 -21.223 15.971 1.00 0.00 C ATOM 1027 CD GLN A 68 -13.592 -22.404 16.366 1.00 0.00 C ATOM 1028 OE1 GLN A 68 -13.976 -23.215 17.210 1.00 0.00 O ATOM 1029 NE2 GLN A 68 -12.416 -22.508 15.757 1.00 0.00 N ATOM 0 H GLN A 68 -16.198 -21.064 18.526 1.00 0.00 H new ATOM 0 HA GLN A 68 -16.352 -19.408 16.218 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -16.078 -22.365 16.773 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -16.338 -21.803 15.134 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -14.237 -20.946 14.940 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -14.199 -20.366 16.593 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -12.138 -21.814 15.064 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.792 -23.282 15.983 1.00 0.00 H new ATOM 1038 N VAL A 69 -18.914 -21.408 16.837 1.00 0.00 N ATOM 1039 CA VAL A 69 -20.320 -21.639 16.526 1.00 0.00 C ATOM 1040 C VAL A 69 -21.139 -20.366 16.706 1.00 0.00 C ATOM 1041 O VAL A 69 -22.174 -20.184 16.064 1.00 0.00 O ATOM 1042 CB VAL A 69 -20.915 -22.749 17.413 1.00 0.00 C ATOM 1043 CG1 VAL A 69 -22.361 -23.024 17.027 1.00 0.00 C ATOM 1044 CG2 VAL A 69 -20.079 -24.016 17.315 1.00 0.00 C ATOM 0 H VAL A 69 -18.534 -22.025 17.555 1.00 0.00 H new ATOM 0 HA VAL A 69 -20.367 -21.953 15.483 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.898 -22.409 18.449 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.764 -23.811 17.664 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.951 -22.116 17.154 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -22.405 -23.342 15.985 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.514 -24.789 17.948 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -20.061 -24.361 16.281 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -19.061 -23.807 17.645 1.00 0.00 H new ATOM 1054 N LYS A 70 -20.668 -19.486 17.584 1.00 0.00 N ATOM 1055 CA LYS A 70 -21.355 -18.227 17.848 1.00 0.00 C ATOM 1056 C LYS A 70 -20.940 -17.159 16.841 1.00 0.00 C ATOM 1057 O LYS A 70 -21.786 -16.499 16.236 1.00 0.00 O ATOM 1058 CB LYS A 70 -21.054 -17.747 19.270 1.00 0.00 C ATOM 1059 CG LYS A 70 -22.109 -16.810 19.832 1.00 0.00 C ATOM 1060 CD LYS A 70 -21.630 -16.128 21.102 1.00 0.00 C ATOM 1061 CE LYS A 70 -22.651 -15.125 21.615 1.00 0.00 C ATOM 1062 NZ LYS A 70 -22.229 -14.516 22.907 1.00 0.00 N ATOM 0 H LYS A 70 -19.814 -19.622 18.124 1.00 0.00 H new ATOM 0 HA LYS A 70 -22.427 -18.399 17.748 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -20.963 -18.613 19.925 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -20.089 -17.240 19.277 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -22.362 -16.056 19.086 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -23.020 -17.370 20.040 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -21.438 -16.878 21.869 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -20.685 -15.620 20.909 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -22.793 -14.340 20.873 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -23.613 -15.620 21.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -22.951 -13.838 23.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -22.118 -15.262 23.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -21.323 -14.022 22.778 1.00 0.00 H new ATOM 1076 N LYS A 71 -19.634 -16.995 16.664 1.00 0.00 N ATOM 1077 CA LYS A 71 -19.106 -16.009 15.729 1.00 0.00 C ATOM 1078 C LYS A 71 -19.636 -16.257 14.320 1.00 0.00 C ATOM 1079 O LYS A 71 -20.213 -15.365 13.698 1.00 0.00 O ATOM 1080 CB LYS A 71 -17.576 -16.048 15.724 1.00 0.00 C ATOM 1081 CG LYS A 71 -16.932 -14.744 16.163 1.00 0.00 C ATOM 1082 CD LYS A 71 -15.536 -14.971 16.716 1.00 0.00 C ATOM 1083 CE LYS A 71 -15.424 -14.500 18.159 1.00 0.00 C ATOM 1084 NZ LYS A 71 -15.352 -13.016 18.253 1.00 0.00 N ATOM 0 H LYS A 71 -18.921 -17.533 17.156 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.437 -15.023 16.055 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -17.239 -16.849 16.382 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.231 -16.294 14.720 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.882 -14.059 15.317 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.552 -14.268 16.923 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.288 -16.031 16.658 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -14.809 -14.440 16.101 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -16.283 -14.859 18.726 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -14.536 -14.937 18.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -15.276 -12.735 19.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.518 -12.675 17.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -16.211 -12.600 17.840 1.00 0.00 H new ATOM 1098 N ILE A 72 -19.438 -17.474 13.824 1.00 0.00 N ATOM 1099 CA ILE A 72 -19.898 -17.839 12.491 1.00 0.00 C ATOM 1100 C ILE A 72 -21.382 -17.534 12.319 1.00 0.00 C ATOM 1101 O ILE A 72 -21.772 -16.783 11.425 1.00 0.00 O ATOM 1102 CB ILE A 72 -19.656 -19.332 12.201 1.00 0.00 C ATOM 1103 CG1 ILE A 72 -18.169 -19.666 12.338 1.00 0.00 C ATOM 1104 CG2 ILE A 72 -20.159 -19.690 10.810 1.00 0.00 C ATOM 1105 CD1 ILE A 72 -17.879 -21.151 12.320 1.00 0.00 C ATOM 0 H ILE A 72 -18.962 -18.224 14.326 1.00 0.00 H new ATOM 0 HA ILE A 72 -19.322 -17.242 11.784 1.00 0.00 H new ATOM 0 HB ILE A 72 -20.211 -19.923 12.930 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -17.621 -19.187 11.526 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -17.794 -19.242 13.270 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -19.981 -20.748 10.620 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -21.228 -19.485 10.745 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -19.629 -19.094 10.067 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -16.806 -21.313 12.421 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -18.399 -21.633 13.148 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -18.223 -21.578 11.378 1.00 0.00 H new ATOM 1117 N MET A 73 -22.205 -18.120 13.182 1.00 0.00 N ATOM 1118 CA MET A 73 -23.647 -17.907 13.128 1.00 0.00 C ATOM 1119 C MET A 73 -23.978 -16.418 13.144 1.00 0.00 C ATOM 1120 O MET A 73 -24.829 -15.955 12.385 1.00 0.00 O ATOM 1121 CB MET A 73 -24.332 -18.607 14.303 1.00 0.00 C ATOM 1122 CG MET A 73 -24.527 -20.100 14.093 1.00 0.00 C ATOM 1123 SD MET A 73 -25.731 -20.468 12.802 1.00 0.00 S ATOM 1124 CE MET A 73 -27.191 -19.667 13.463 1.00 0.00 C ATOM 0 H MET A 73 -21.899 -18.746 13.927 1.00 0.00 H new ATOM 0 HA MET A 73 -24.017 -18.333 12.195 1.00 0.00 H new ATOM 0 HB2 MET A 73 -23.739 -18.450 15.204 1.00 0.00 H new ATOM 0 HB3 MET A 73 -25.303 -18.143 14.475 1.00 0.00 H new ATOM 0 HG2 MET A 73 -23.571 -20.554 13.833 1.00 0.00 H new ATOM 0 HG3 MET A 73 -24.852 -20.555 15.028 1.00 0.00 H new ATOM 0 HE1 MET A 73 -28.083 -20.121 13.031 1.00 0.00 H new ATOM 0 HE2 MET A 73 -27.212 -19.786 14.546 1.00 0.00 H new ATOM 0 HE3 MET A 73 -27.168 -18.606 13.215 1.00 0.00 H new ATOM 1134 N GLN A 74 -23.301 -15.675 14.013 1.00 0.00 N ATOM 1135 CA GLN A 74 -23.525 -14.239 14.127 1.00 0.00 C ATOM 1136 C GLN A 74 -23.301 -13.545 12.788 1.00 0.00 C ATOM 1137 O GLN A 74 -23.889 -12.499 12.513 1.00 0.00 O ATOM 1138 CB GLN A 74 -22.599 -13.640 15.187 1.00 0.00 C ATOM 1139 CG GLN A 74 -23.245 -13.509 16.556 1.00 0.00 C ATOM 1140 CD GLN A 74 -22.521 -12.523 17.452 1.00 0.00 C ATOM 1141 OE1 GLN A 74 -21.527 -12.864 18.094 1.00 0.00 O ATOM 1142 NE2 GLN A 74 -23.016 -11.292 17.499 1.00 0.00 N ATOM 0 H GLN A 74 -22.593 -16.043 14.648 1.00 0.00 H new ATOM 0 HA GLN A 74 -24.561 -14.081 14.428 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -21.708 -14.263 15.273 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -22.269 -12.656 14.855 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -24.281 -13.192 16.436 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -23.265 -14.486 17.039 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -23.842 -11.053 16.950 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -22.570 -10.585 18.084 1.00 0.00 H new ATOM 1151 N PHE A 75 -22.447 -14.134 11.957 1.00 0.00 N ATOM 1152 CA PHE A 75 -22.145 -13.571 10.646 1.00 0.00 C ATOM 1153 C PHE A 75 -23.220 -13.947 9.631 1.00 0.00 C ATOM 1154 O PHE A 75 -23.463 -13.219 8.669 1.00 0.00 O ATOM 1155 CB PHE A 75 -20.778 -14.058 10.162 1.00 0.00 C ATOM 1156 CG PHE A 75 -20.376 -13.489 8.831 1.00 0.00 C ATOM 1157 CD1 PHE A 75 -19.899 -12.192 8.733 1.00 0.00 C ATOM 1158 CD2 PHE A 75 -20.474 -14.252 7.678 1.00 0.00 C ATOM 1159 CE1 PHE A 75 -19.528 -11.665 7.510 1.00 0.00 C ATOM 1160 CE2 PHE A 75 -20.104 -13.731 6.453 1.00 0.00 C ATOM 1161 CZ PHE A 75 -19.632 -12.435 6.368 1.00 0.00 C ATOM 0 H PHE A 75 -21.952 -15.001 12.168 1.00 0.00 H new ATOM 0 HA PHE A 75 -22.124 -12.485 10.741 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -20.024 -13.795 10.904 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -20.792 -15.146 10.094 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -19.816 -11.585 9.623 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -20.844 -15.265 7.738 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -19.157 -10.653 7.448 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -20.184 -14.336 5.562 1.00 0.00 H new ATOM 0 HZ PHE A 75 -19.345 -12.025 5.411 1.00 0.00 H new ATOM 1171 N ILE A 76 -23.861 -15.090 9.854 1.00 0.00 N ATOM 1172 CA ILE A 76 -24.911 -15.563 8.960 1.00 0.00 C ATOM 1173 C ILE A 76 -26.165 -14.705 9.082 1.00 0.00 C ATOM 1174 O ILE A 76 -26.594 -14.073 8.118 1.00 0.00 O ATOM 1175 CB ILE A 76 -25.276 -17.031 9.248 1.00 0.00 C ATOM 1176 CG1 ILE A 76 -24.038 -17.922 9.124 1.00 0.00 C ATOM 1177 CG2 ILE A 76 -26.370 -17.500 8.301 1.00 0.00 C ATOM 1178 CD1 ILE A 76 -24.286 -19.360 9.521 1.00 0.00 C ATOM 0 H ILE A 76 -23.672 -15.705 10.645 1.00 0.00 H new ATOM 0 HA ILE A 76 -24.520 -15.487 7.945 1.00 0.00 H new ATOM 0 HB ILE A 76 -25.651 -17.103 10.269 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -23.682 -17.894 8.094 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -23.243 -17.514 9.747 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -26.617 -18.539 8.517 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -27.257 -16.881 8.435 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -26.021 -17.416 7.272 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -23.365 -19.933 9.408 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -24.613 -19.399 10.560 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -25.059 -19.786 8.881 1.00 0.00 H new ATOM 1190 N ASN A 77 -26.749 -14.687 10.276 1.00 0.00 N ATOM 1191 CA ASN A 77 -27.955 -13.905 10.526 1.00 0.00 C ATOM 1192 C ASN A 77 -27.633 -12.415 10.588 1.00 0.00 C ATOM 1193 O ASN A 77 -28.440 -11.578 10.186 1.00 0.00 O ATOM 1194 CB ASN A 77 -28.615 -14.351 11.832 1.00 0.00 C ATOM 1195 CG ASN A 77 -29.391 -15.645 11.675 1.00 0.00 C ATOM 1196 OD1 ASN A 77 -30.271 -15.754 10.820 1.00 0.00 O ATOM 1197 ND2 ASN A 77 -29.068 -16.632 12.502 1.00 0.00 N ATOM 0 H ASN A 77 -26.407 -15.205 11.085 1.00 0.00 H new ATOM 0 HA ASN A 77 -28.647 -14.075 9.701 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -27.850 -14.480 12.597 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -29.287 -13.568 12.182 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -29.556 -17.526 12.444 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -28.332 -16.496 13.195 1.00 0.00 H new