USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=11 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 168:sc= 0 (180deg=-0.173) USER MOD Set 1.2: A 77 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Set 2.1: A 48 ASN : amide:sc= 0.609 K(o=1,f=0.11) USER MOD Set 2.2: A 52 GLN : amide:sc= 0.396 K(o=1,f=0.11) USER MOD Single : A 10 GLN : amide:sc= -0.617 X(o=-0.62,f=-0.14) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0.0368 USER MOD Single : A 24 SER OG : rot 90:sc= 0.544 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 70:sc= -0.553 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 81:sc= 0.926 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 54 THR OG1 : rot 180:sc= 0 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= 0.0241 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.422 K(o=-0.42,f=-7!) 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 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 104 N GLN A 10 -15.288 -6.685 1.464 1.00 0.00 N ATOM 105 CA GLN A 10 -16.196 -7.253 2.453 1.00 0.00 C ATOM 106 C GLN A 10 -17.341 -7.998 1.776 1.00 0.00 C ATOM 107 O GLN A 10 -17.639 -7.792 0.599 1.00 0.00 O ATOM 108 CB GLN A 10 -16.752 -6.152 3.358 1.00 0.00 C ATOM 109 CG GLN A 10 -15.926 -5.921 4.613 1.00 0.00 C ATOM 110 CD GLN A 10 -16.375 -4.700 5.391 1.00 0.00 C ATOM 111 OE1 GLN A 10 -15.643 -3.716 5.502 1.00 0.00 O ATOM 112 NE2 GLN A 10 -17.585 -4.756 5.934 1.00 0.00 N ATOM 0 HA GLN A 10 -15.634 -7.963 3.060 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -16.807 -5.222 2.793 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.771 -6.410 3.646 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -15.993 -6.800 5.254 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -14.878 -5.806 4.337 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -18.158 -5.591 5.817 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -17.941 -3.964 6.468 1.00 0.00 H new ATOM 121 N PRO A 11 -18.001 -8.886 2.535 1.00 0.00 N ATOM 122 CA PRO A 11 -19.125 -9.680 2.028 1.00 0.00 C ATOM 123 C PRO A 11 -20.365 -8.831 1.771 1.00 0.00 C ATOM 124 O PRO A 11 -20.592 -7.809 2.419 1.00 0.00 O ATOM 125 CB PRO A 11 -19.387 -10.682 3.155 1.00 0.00 C ATOM 126 CG PRO A 11 -18.876 -10.013 4.384 1.00 0.00 C ATOM 127 CD PRO A 11 -17.701 -9.183 3.945 1.00 0.00 C ATOM 0 HA PRO A 11 -18.896 -10.146 1.069 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -20.449 -10.911 3.242 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -18.871 -11.625 2.974 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -19.646 -9.390 4.838 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -18.578 -10.747 5.133 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.609 -8.272 4.537 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -16.763 -9.728 4.050 1.00 0.00 H new ATOM 135 N PRO A 12 -21.188 -9.261 0.804 1.00 0.00 N ATOM 136 CA PRO A 12 -22.420 -8.555 0.440 1.00 0.00 C ATOM 137 C PRO A 12 -23.486 -8.653 1.525 1.00 0.00 C ATOM 138 O PRO A 12 -23.241 -9.195 2.602 1.00 0.00 O ATOM 139 CB PRO A 12 -22.881 -9.277 -0.829 1.00 0.00 C ATOM 140 CG PRO A 12 -22.291 -10.641 -0.724 1.00 0.00 C ATOM 141 CD PRO A 12 -20.979 -10.471 -0.009 1.00 0.00 C ATOM 0 HA PRO A 12 -22.252 -7.487 0.302 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -23.969 -9.319 -0.887 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -22.533 -8.763 -1.725 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -22.952 -11.311 -0.173 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -22.144 -11.079 -1.711 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -20.744 -11.336 0.611 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -20.153 -10.347 -0.709 1.00 0.00 H new ATOM 149 N ALA A 13 -24.670 -8.124 1.234 1.00 0.00 N ATOM 150 CA ALA A 13 -25.775 -8.154 2.185 1.00 0.00 C ATOM 151 C ALA A 13 -26.247 -9.582 2.433 1.00 0.00 C ATOM 152 O ALA A 13 -26.600 -9.944 3.556 1.00 0.00 O ATOM 153 CB ALA A 13 -26.926 -7.295 1.684 1.00 0.00 C ATOM 0 H ALA A 13 -24.889 -7.670 0.347 1.00 0.00 H new ATOM 0 HA ALA A 13 -25.418 -7.748 3.131 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -27.744 -7.327 2.404 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -26.587 -6.266 1.565 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -27.273 -7.676 0.724 1.00 0.00 H new ATOM 159 N ASP A 14 -26.251 -10.390 1.379 1.00 0.00 N ATOM 160 CA ASP A 14 -26.680 -11.780 1.482 1.00 0.00 C ATOM 161 C ASP A 14 -25.534 -12.729 1.145 1.00 0.00 C ATOM 162 O ASP A 14 -24.842 -12.552 0.142 1.00 0.00 O ATOM 163 CB ASP A 14 -27.866 -12.041 0.551 1.00 0.00 C ATOM 164 CG ASP A 14 -29.143 -11.389 1.043 1.00 0.00 C ATOM 165 OD1 ASP A 14 -29.360 -10.200 0.729 1.00 0.00 O ATOM 166 OD2 ASP A 14 -29.924 -12.067 1.743 1.00 0.00 O ATOM 0 H ASP A 14 -25.962 -10.106 0.443 1.00 0.00 H new ATOM 0 HA ASP A 14 -26.989 -11.964 2.511 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -27.631 -11.667 -0.445 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -28.022 -13.116 0.459 1.00 0.00 H new ATOM 171 N LEU A 15 -25.339 -13.736 1.990 1.00 0.00 N ATOM 172 CA LEU A 15 -24.276 -14.713 1.782 1.00 0.00 C ATOM 173 C LEU A 15 -24.792 -15.924 1.012 1.00 0.00 C ATOM 174 O LEU A 15 -24.478 -17.066 1.349 1.00 0.00 O ATOM 175 CB LEU A 15 -23.696 -15.158 3.126 1.00 0.00 C ATOM 176 CG LEU A 15 -23.528 -14.063 4.180 1.00 0.00 C ATOM 177 CD1 LEU A 15 -23.134 -14.667 5.519 1.00 0.00 C ATOM 178 CD2 LEU A 15 -22.494 -13.041 3.729 1.00 0.00 C ATOM 0 H LEU A 15 -25.903 -13.897 2.825 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.491 -14.239 1.193 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -24.340 -15.935 3.538 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -22.722 -15.614 2.946 1.00 0.00 H new ATOM 0 HG LEU A 15 -24.484 -13.553 4.301 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.019 -13.873 6.257 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -23.909 -15.359 5.848 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -22.191 -15.203 5.413 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -22.388 -12.270 4.492 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -21.535 -13.536 3.578 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -22.818 -12.584 2.794 1.00 0.00 H new ATOM 190 N SER A 16 -25.584 -15.667 -0.024 1.00 0.00 N ATOM 191 CA SER A 16 -26.145 -16.736 -0.841 1.00 0.00 C ATOM 192 C SER A 16 -25.480 -16.778 -2.213 1.00 0.00 C ATOM 193 O SER A 16 -25.380 -17.834 -2.836 1.00 0.00 O ATOM 194 CB SER A 16 -27.655 -16.547 -0.999 1.00 0.00 C ATOM 195 OG SER A 16 -28.322 -16.711 0.240 1.00 0.00 O ATOM 0 H SER A 16 -25.852 -14.727 -0.317 1.00 0.00 H new ATOM 0 HA SER A 16 -25.955 -17.683 -0.336 1.00 0.00 H new ATOM 0 HB2 SER A 16 -27.861 -15.553 -1.397 1.00 0.00 H new ATOM 0 HB3 SER A 16 -28.041 -17.266 -1.721 1.00 0.00 H new ATOM 0 HG SER A 16 -29.285 -16.584 0.112 1.00 0.00 H new ATOM 201 N GLY A 17 -25.025 -15.618 -2.679 1.00 0.00 N ATOM 202 CA GLY A 17 -24.375 -15.543 -3.974 1.00 0.00 C ATOM 203 C GLY A 17 -22.866 -15.646 -3.872 1.00 0.00 C ATOM 204 O GLY A 17 -22.144 -15.198 -4.764 1.00 0.00 O ATOM 0 H GLY A 17 -25.095 -14.730 -2.183 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -24.749 -16.344 -4.612 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -24.640 -14.602 -4.456 1.00 0.00 H new ATOM 208 N LEU A 18 -22.387 -16.235 -2.782 1.00 0.00 N ATOM 209 CA LEU A 18 -20.953 -16.394 -2.565 1.00 0.00 C ATOM 210 C LEU A 18 -20.509 -17.818 -2.885 1.00 0.00 C ATOM 211 O LEU A 18 -21.189 -18.784 -2.537 1.00 0.00 O ATOM 212 CB LEU A 18 -20.594 -16.048 -1.119 1.00 0.00 C ATOM 213 CG LEU A 18 -20.869 -14.608 -0.686 1.00 0.00 C ATOM 214 CD1 LEU A 18 -20.432 -14.391 0.754 1.00 0.00 C ATOM 215 CD2 LEU A 18 -20.163 -13.628 -1.613 1.00 0.00 C ATOM 0 H LEU A 18 -22.971 -16.611 -2.034 1.00 0.00 H new ATOM 0 HA LEU A 18 -20.431 -15.711 -3.235 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -21.146 -16.717 -0.459 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.534 -16.255 -0.969 1.00 0.00 H new ATOM 0 HG LEU A 18 -21.942 -14.429 -0.749 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.636 -13.360 1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -20.983 -15.068 1.407 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.364 -14.589 0.844 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.370 -12.608 -1.290 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.088 -13.808 -1.582 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.525 -13.766 -2.632 1.00 0.00 H new ATOM 227 N SER A 19 -19.363 -17.941 -3.547 1.00 0.00 N ATOM 228 CA SER A 19 -18.828 -19.247 -3.914 1.00 0.00 C ATOM 229 C SER A 19 -17.944 -19.804 -2.803 1.00 0.00 C ATOM 230 O SER A 19 -17.593 -19.095 -1.859 1.00 0.00 O ATOM 231 CB SER A 19 -18.030 -19.147 -5.215 1.00 0.00 C ATOM 232 OG SER A 19 -18.230 -17.891 -5.841 1.00 0.00 O ATOM 0 H SER A 19 -18.787 -17.152 -3.840 1.00 0.00 H new ATOM 0 HA SER A 19 -19.667 -19.927 -4.062 1.00 0.00 H new ATOM 0 HB2 SER A 19 -16.969 -19.288 -5.007 1.00 0.00 H new ATOM 0 HB3 SER A 19 -18.331 -19.946 -5.892 1.00 0.00 H new ATOM 0 HG SER A 19 -17.708 -17.852 -6.669 1.00 0.00 H new ATOM 238 N ILE A 20 -17.587 -21.078 -2.922 1.00 0.00 N ATOM 239 CA ILE A 20 -16.743 -21.731 -1.929 1.00 0.00 C ATOM 240 C ILE A 20 -15.439 -20.967 -1.729 1.00 0.00 C ATOM 241 O ILE A 20 -14.840 -21.014 -0.655 1.00 0.00 O ATOM 242 CB ILE A 20 -16.419 -23.182 -2.332 1.00 0.00 C ATOM 243 CG1 ILE A 20 -17.709 -23.979 -2.532 1.00 0.00 C ATOM 244 CG2 ILE A 20 -15.540 -23.840 -1.279 1.00 0.00 C ATOM 245 CD1 ILE A 20 -17.479 -25.379 -3.059 1.00 0.00 C ATOM 0 H ILE A 20 -17.869 -21.679 -3.696 1.00 0.00 H new ATOM 0 HA ILE A 20 -17.304 -21.739 -0.994 1.00 0.00 H new ATOM 0 HB ILE A 20 -15.873 -23.169 -3.275 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -18.240 -24.040 -1.582 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -18.356 -23.440 -3.225 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -15.320 -24.865 -1.578 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -14.609 -23.282 -1.182 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -16.061 -23.845 -0.322 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -18.437 -25.886 -3.176 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -16.976 -25.326 -4.024 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -16.858 -25.935 -2.356 1.00 0.00 H new ATOM 257 N GLU A 21 -15.006 -20.263 -2.770 1.00 0.00 N ATOM 258 CA GLU A 21 -13.772 -19.488 -2.707 1.00 0.00 C ATOM 259 C GLU A 21 -14.008 -18.145 -2.021 1.00 0.00 C ATOM 260 O GLU A 21 -13.100 -17.580 -1.413 1.00 0.00 O ATOM 261 CB GLU A 21 -13.213 -19.263 -4.113 1.00 0.00 C ATOM 262 CG GLU A 21 -11.714 -19.013 -4.139 1.00 0.00 C ATOM 263 CD GLU A 21 -11.331 -17.856 -5.041 1.00 0.00 C ATOM 264 OE1 GLU A 21 -11.803 -16.728 -4.790 1.00 0.00 O ATOM 265 OE2 GLU A 21 -10.560 -18.079 -5.998 1.00 0.00 O ATOM 0 H GLU A 21 -15.491 -20.213 -3.666 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.047 -20.054 -2.122 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -13.438 -20.134 -4.728 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -13.723 -18.413 -4.566 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -11.366 -18.810 -3.126 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.205 -19.916 -4.476 1.00 0.00 H new ATOM 272 N GLU A 22 -15.234 -17.641 -2.125 1.00 0.00 N ATOM 273 CA GLU A 22 -15.588 -16.364 -1.517 1.00 0.00 C ATOM 274 C GLU A 22 -15.787 -16.516 -0.011 1.00 0.00 C ATOM 275 O GLU A 22 -15.541 -15.585 0.756 1.00 0.00 O ATOM 276 CB GLU A 22 -16.861 -15.805 -2.156 1.00 0.00 C ATOM 277 CG GLU A 22 -16.630 -15.172 -3.518 1.00 0.00 C ATOM 278 CD GLU A 22 -16.163 -13.733 -3.421 1.00 0.00 C ATOM 279 OE1 GLU A 22 -14.943 -13.514 -3.266 1.00 0.00 O ATOM 280 OE2 GLU A 22 -17.017 -12.826 -3.502 1.00 0.00 O ATOM 0 H GLU A 22 -15.998 -18.097 -2.624 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.767 -15.668 -1.690 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.590 -16.609 -2.257 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.297 -15.062 -1.488 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -15.888 -15.755 -4.064 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -17.554 -15.212 -4.094 1.00 0.00 H new ATOM 287 N VAL A 23 -16.234 -17.696 0.405 1.00 0.00 N ATOM 288 CA VAL A 23 -16.466 -17.971 1.818 1.00 0.00 C ATOM 289 C VAL A 23 -15.173 -17.864 2.618 1.00 0.00 C ATOM 290 O VAL A 23 -15.173 -17.407 3.761 1.00 0.00 O ATOM 291 CB VAL A 23 -17.070 -19.373 2.025 1.00 0.00 C ATOM 292 CG1 VAL A 23 -17.400 -19.601 3.493 1.00 0.00 C ATOM 293 CG2 VAL A 23 -18.307 -19.553 1.158 1.00 0.00 C ATOM 0 H VAL A 23 -16.443 -18.477 -0.216 1.00 0.00 H new ATOM 0 HA VAL A 23 -17.173 -17.222 2.174 1.00 0.00 H new ATOM 0 HB VAL A 23 -16.332 -20.116 1.724 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -17.826 -20.596 3.620 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -16.490 -19.517 4.088 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -18.121 -18.853 3.824 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -18.721 -20.549 1.317 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -19.052 -18.804 1.426 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -18.036 -19.436 0.109 1.00 0.00 H new ATOM 303 N SER A 24 -14.070 -18.288 2.009 1.00 0.00 N ATOM 304 CA SER A 24 -12.768 -18.243 2.665 1.00 0.00 C ATOM 305 C SER A 24 -12.467 -16.837 3.177 1.00 0.00 C ATOM 306 O SER A 24 -11.861 -16.665 4.235 1.00 0.00 O ATOM 307 CB SER A 24 -11.670 -18.693 1.700 1.00 0.00 C ATOM 308 OG SER A 24 -12.198 -19.518 0.676 1.00 0.00 O ATOM 0 H SER A 24 -14.052 -18.667 1.062 1.00 0.00 H new ATOM 0 HA SER A 24 -12.794 -18.924 3.516 1.00 0.00 H new ATOM 0 HB2 SER A 24 -11.191 -17.820 1.257 1.00 0.00 H new ATOM 0 HB3 SER A 24 -10.900 -19.236 2.248 1.00 0.00 H new ATOM 0 HG SER A 24 -12.479 -18.961 -0.080 1.00 0.00 H new ATOM 314 N LYS A 25 -12.894 -15.834 2.418 1.00 0.00 N ATOM 315 CA LYS A 25 -12.672 -14.442 2.793 1.00 0.00 C ATOM 316 C LYS A 25 -13.816 -13.923 3.659 1.00 0.00 C ATOM 317 O LYS A 25 -13.632 -13.010 4.463 1.00 0.00 O ATOM 318 CB LYS A 25 -12.530 -13.572 1.542 1.00 0.00 C ATOM 319 CG LYS A 25 -11.418 -14.024 0.610 1.00 0.00 C ATOM 320 CD LYS A 25 -10.640 -12.842 0.057 1.00 0.00 C ATOM 321 CE LYS A 25 -11.248 -12.334 -1.242 1.00 0.00 C ATOM 322 NZ LYS A 25 -10.429 -12.720 -2.425 1.00 0.00 N ATOM 0 H LYS A 25 -13.396 -15.959 1.539 1.00 0.00 H new ATOM 0 HA LYS A 25 -11.749 -14.390 3.371 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.474 -13.577 0.997 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.342 -12.542 1.845 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.740 -14.688 1.146 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.843 -14.599 -0.213 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.626 -12.038 0.793 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.604 -13.135 -0.115 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.256 -12.734 -1.352 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.338 -11.249 -1.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.876 -12.356 -3.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.474 -12.318 -2.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.364 -13.757 -2.479 1.00 0.00 H new ATOM 336 N SER A 26 -14.995 -14.512 3.489 1.00 0.00 N ATOM 337 CA SER A 26 -16.169 -14.107 4.254 1.00 0.00 C ATOM 338 C SER A 26 -15.893 -14.183 5.753 1.00 0.00 C ATOM 339 O SER A 26 -16.323 -13.320 6.519 1.00 0.00 O ATOM 340 CB SER A 26 -17.365 -14.992 3.898 1.00 0.00 C ATOM 341 OG SER A 26 -17.948 -14.592 2.670 1.00 0.00 O ATOM 0 H SER A 26 -15.163 -15.271 2.829 1.00 0.00 H new ATOM 0 HA SER A 26 -16.402 -13.074 3.997 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.045 -16.032 3.830 1.00 0.00 H new ATOM 0 HB3 SER A 26 -18.110 -14.939 4.692 1.00 0.00 H new ATOM 0 HG SER A 26 -17.343 -14.816 1.932 1.00 0.00 H new ATOM 347 N LEU A 27 -15.174 -15.221 6.164 1.00 0.00 N ATOM 348 CA LEU A 27 -14.840 -15.412 7.571 1.00 0.00 C ATOM 349 C LEU A 27 -13.720 -14.468 7.997 1.00 0.00 C ATOM 350 O LEU A 27 -13.613 -14.104 9.169 1.00 0.00 O ATOM 351 CB LEU A 27 -14.425 -16.862 7.825 1.00 0.00 C ATOM 352 CG LEU A 27 -15.473 -17.927 7.501 1.00 0.00 C ATOM 353 CD1 LEU A 27 -14.967 -19.308 7.885 1.00 0.00 C ATOM 354 CD2 LEU A 27 -16.783 -17.620 8.211 1.00 0.00 C ATOM 0 H LEU A 27 -14.811 -15.944 5.543 1.00 0.00 H new ATOM 0 HA LEU A 27 -15.726 -15.186 8.164 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.530 -17.071 7.238 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.148 -16.961 8.875 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.654 -17.915 6.426 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.726 -20.053 7.647 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.055 -19.529 7.330 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -14.756 -19.334 8.954 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -17.517 -18.389 7.969 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -16.618 -17.603 9.288 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -17.154 -16.648 7.885 1.00 0.00 H new ATOM 366 N ARG A 28 -12.888 -14.073 7.039 1.00 0.00 N ATOM 367 CA ARG A 28 -11.777 -13.171 7.315 1.00 0.00 C ATOM 368 C ARG A 28 -12.276 -11.868 7.934 1.00 0.00 C ATOM 369 O ARG A 28 -11.576 -11.239 8.728 1.00 0.00 O ATOM 370 CB ARG A 28 -11.003 -12.873 6.029 1.00 0.00 C ATOM 371 CG ARG A 28 -9.534 -13.257 6.100 1.00 0.00 C ATOM 372 CD ARG A 28 -8.925 -13.390 4.713 1.00 0.00 C ATOM 373 NE ARG A 28 -7.725 -14.221 4.720 1.00 0.00 N ATOM 374 CZ ARG A 28 -6.904 -14.335 3.681 1.00 0.00 C ATOM 375 NH1 ARG A 28 -7.154 -13.674 2.559 1.00 0.00 N ATOM 376 NH2 ARG A 28 -5.831 -15.112 3.764 1.00 0.00 N ATOM 0 H ARG A 28 -12.963 -14.364 6.064 1.00 0.00 H new ATOM 0 HA ARG A 28 -11.112 -13.661 8.027 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -11.470 -13.407 5.202 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.081 -11.809 5.806 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -8.987 -12.504 6.668 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -9.429 -14.200 6.637 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -9.661 -13.821 4.034 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -8.678 -12.400 4.329 1.00 0.00 H new ATOM 0 HE ARG A 28 -7.505 -14.743 5.568 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -7.978 -13.076 2.492 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -6.522 -13.763 1.763 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -5.636 -15.622 4.626 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -5.201 -15.199 2.966 1.00 0.00 H new ATOM 390 N PHE A 29 -13.489 -11.470 7.566 1.00 0.00 N ATOM 391 CA PHE A 29 -14.080 -10.242 8.084 1.00 0.00 C ATOM 392 C PHE A 29 -14.035 -10.218 9.609 1.00 0.00 C ATOM 393 O PHE A 29 -13.580 -9.245 10.212 1.00 0.00 O ATOM 394 CB PHE A 29 -15.527 -10.105 7.604 1.00 0.00 C ATOM 395 CG PHE A 29 -16.225 -8.890 8.144 1.00 0.00 C ATOM 396 CD1 PHE A 29 -15.846 -7.620 7.740 1.00 0.00 C ATOM 397 CD2 PHE A 29 -17.261 -9.019 9.055 1.00 0.00 C ATOM 398 CE1 PHE A 29 -16.487 -6.500 8.235 1.00 0.00 C ATOM 399 CE2 PHE A 29 -17.906 -7.902 9.553 1.00 0.00 C ATOM 400 CZ PHE A 29 -17.518 -6.641 9.143 1.00 0.00 C ATOM 0 H PHE A 29 -14.082 -11.980 6.911 1.00 0.00 H new ATOM 0 HA PHE A 29 -13.498 -9.401 7.707 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -15.538 -10.066 6.515 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -16.084 -10.995 7.897 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.040 -7.504 7.030 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -17.568 -10.002 9.379 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -16.182 -5.516 7.912 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -18.713 -8.015 10.262 1.00 0.00 H new ATOM 0 HZ PHE A 29 -18.020 -5.767 9.532 1.00 0.00 H new ATOM 410 N ILE A 30 -14.510 -11.295 10.226 1.00 0.00 N ATOM 411 CA ILE A 30 -14.523 -11.398 11.680 1.00 0.00 C ATOM 412 C ILE A 30 -13.158 -11.817 12.214 1.00 0.00 C ATOM 413 O ILE A 30 -12.800 -11.504 13.349 1.00 0.00 O ATOM 414 CB ILE A 30 -15.582 -12.406 12.164 1.00 0.00 C ATOM 415 CG1 ILE A 30 -15.354 -13.771 11.511 1.00 0.00 C ATOM 416 CG2 ILE A 30 -16.981 -11.893 11.855 1.00 0.00 C ATOM 417 CD1 ILE A 30 -16.237 -14.864 12.072 1.00 0.00 C ATOM 0 H ILE A 30 -14.891 -12.108 9.742 1.00 0.00 H new ATOM 0 HA ILE A 30 -14.773 -10.409 12.064 1.00 0.00 H new ATOM 0 HB ILE A 30 -15.487 -12.520 13.244 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -15.531 -13.686 10.439 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.310 -14.057 11.640 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -17.719 -12.616 12.203 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -17.139 -10.941 12.361 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -17.088 -11.754 10.779 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -16.021 -15.803 11.563 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -16.043 -14.977 13.139 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -17.284 -14.601 11.919 1.00 0.00 H new ATOM 429 N GLY A 31 -12.397 -12.527 11.386 1.00 0.00 N ATOM 430 CA GLY A 31 -11.078 -12.976 11.792 1.00 0.00 C ATOM 431 C GLY A 31 -11.112 -14.324 12.485 1.00 0.00 C ATOM 432 O GLY A 31 -11.145 -14.397 13.714 1.00 0.00 O ATOM 0 H GLY A 31 -12.671 -12.799 10.442 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -10.433 -13.038 10.916 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.636 -12.238 12.461 1.00 0.00 H new ATOM 436 N LEU A 32 -11.107 -15.393 11.697 1.00 0.00 N ATOM 437 CA LEU A 32 -11.140 -16.746 12.242 1.00 0.00 C ATOM 438 C LEU A 32 -9.805 -17.452 12.028 1.00 0.00 C ATOM 439 O LEU A 32 -8.881 -16.889 11.441 1.00 0.00 O ATOM 440 CB LEU A 32 -12.267 -17.551 11.593 1.00 0.00 C ATOM 441 CG LEU A 32 -13.690 -17.114 11.938 1.00 0.00 C ATOM 442 CD1 LEU A 32 -14.706 -18.034 11.278 1.00 0.00 C ATOM 443 CD2 LEU A 32 -13.890 -17.091 13.446 1.00 0.00 C ATOM 0 H LEU A 32 -11.080 -15.350 10.678 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.324 -16.675 13.314 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.145 -17.501 10.511 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.150 -18.596 11.879 1.00 0.00 H new ATOM 0 HG LEU A 32 -13.842 -16.105 11.556 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.714 -17.707 11.535 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.579 -18.000 10.196 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.555 -19.055 11.629 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.909 -16.778 13.673 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -13.718 -18.088 13.851 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.186 -16.391 13.896 1.00 0.00 H new ATOM 455 N SER A 33 -9.713 -18.689 12.505 1.00 0.00 N ATOM 456 CA SER A 33 -8.490 -19.472 12.367 1.00 0.00 C ATOM 457 C SER A 33 -8.378 -20.062 10.964 1.00 0.00 C ATOM 458 O SER A 33 -9.385 -20.356 10.322 1.00 0.00 O ATOM 459 CB SER A 33 -8.457 -20.592 13.408 1.00 0.00 C ATOM 460 OG SER A 33 -7.266 -21.353 13.301 1.00 0.00 O ATOM 0 H SER A 33 -10.470 -19.171 12.990 1.00 0.00 H new ATOM 0 HA SER A 33 -7.642 -18.808 12.531 1.00 0.00 H new ATOM 0 HB2 SER A 33 -8.531 -20.165 14.408 1.00 0.00 H new ATOM 0 HB3 SER A 33 -9.321 -21.243 13.274 1.00 0.00 H new ATOM 0 HG SER A 33 -7.268 -22.061 13.978 1.00 0.00 H new ATOM 466 N GLU A 34 -7.145 -20.231 10.497 1.00 0.00 N ATOM 467 CA GLU A 34 -6.901 -20.785 9.170 1.00 0.00 C ATOM 468 C GLU A 34 -7.529 -22.169 9.035 1.00 0.00 C ATOM 469 O GLU A 34 -7.914 -22.584 7.941 1.00 0.00 O ATOM 470 CB GLU A 34 -5.398 -20.865 8.895 1.00 0.00 C ATOM 471 CG GLU A 34 -4.646 -21.746 9.879 1.00 0.00 C ATOM 472 CD GLU A 34 -3.142 -21.590 9.769 1.00 0.00 C ATOM 473 OE1 GLU A 34 -2.690 -20.531 9.284 1.00 0.00 O ATOM 474 OE2 GLU A 34 -2.417 -22.525 10.168 1.00 0.00 O ATOM 0 H GLU A 34 -6.300 -19.993 11.017 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.362 -20.123 8.437 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.241 -21.246 7.886 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.977 -19.860 8.925 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.960 -21.501 10.894 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.913 -22.788 9.706 1.00 0.00 H new ATOM 481 N ASP A 35 -7.628 -22.879 10.153 1.00 0.00 N ATOM 482 CA ASP A 35 -8.209 -24.217 10.161 1.00 0.00 C ATOM 483 C ASP A 35 -9.703 -24.162 9.856 1.00 0.00 C ATOM 484 O ASP A 35 -10.211 -24.938 9.047 1.00 0.00 O ATOM 485 CB ASP A 35 -7.977 -24.889 11.514 1.00 0.00 C ATOM 486 CG ASP A 35 -7.078 -26.106 11.410 1.00 0.00 C ATOM 487 OD1 ASP A 35 -5.858 -25.927 11.208 1.00 0.00 O ATOM 488 OD2 ASP A 35 -7.594 -27.236 11.531 1.00 0.00 O ATOM 0 H ASP A 35 -7.313 -22.551 11.066 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.719 -24.804 9.384 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -7.532 -24.170 12.202 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.936 -25.185 11.939 1.00 0.00 H new ATOM 493 N VAL A 36 -10.402 -23.240 10.510 1.00 0.00 N ATOM 494 CA VAL A 36 -11.838 -23.083 10.309 1.00 0.00 C ATOM 495 C VAL A 36 -12.155 -22.737 8.859 1.00 0.00 C ATOM 496 O VAL A 36 -12.990 -23.383 8.224 1.00 0.00 O ATOM 497 CB VAL A 36 -12.417 -21.989 11.225 1.00 0.00 C ATOM 498 CG1 VAL A 36 -13.913 -21.839 10.998 1.00 0.00 C ATOM 499 CG2 VAL A 36 -12.119 -22.303 12.684 1.00 0.00 C ATOM 0 H VAL A 36 -9.997 -22.590 11.184 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.299 -24.038 10.561 1.00 0.00 H new ATOM 0 HB VAL A 36 -11.940 -21.041 10.976 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.304 -21.061 11.654 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -14.098 -21.564 9.959 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.411 -22.783 11.218 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.535 -21.520 13.317 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -12.568 -23.260 12.949 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -11.040 -22.354 12.832 1.00 0.00 H new ATOM 509 N ILE A 37 -11.484 -21.714 8.340 1.00 0.00 N ATOM 510 CA ILE A 37 -11.694 -21.283 6.964 1.00 0.00 C ATOM 511 C ILE A 37 -11.543 -22.450 5.993 1.00 0.00 C ATOM 512 O ILE A 37 -12.431 -22.715 5.183 1.00 0.00 O ATOM 513 CB ILE A 37 -10.708 -20.169 6.566 1.00 0.00 C ATOM 514 CG1 ILE A 37 -10.854 -18.969 7.505 1.00 0.00 C ATOM 515 CG2 ILE A 37 -10.937 -19.749 5.122 1.00 0.00 C ATOM 516 CD1 ILE A 37 -9.782 -17.919 7.316 1.00 0.00 C ATOM 0 H ILE A 37 -10.791 -21.169 8.852 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.711 -20.895 6.907 1.00 0.00 H new ATOM 0 HB ILE A 37 -9.692 -20.555 6.655 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -11.831 -18.512 7.347 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -10.829 -19.320 8.537 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -10.232 -18.961 4.856 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.787 -20.606 4.466 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -11.956 -19.378 5.008 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.949 -17.099 8.014 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.803 -18.361 7.502 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -9.820 -17.540 6.295 1.00 0.00 H new ATOM 528 N SER A 38 -10.414 -23.145 6.083 1.00 0.00 N ATOM 529 CA SER A 38 -10.146 -24.283 5.211 1.00 0.00 C ATOM 530 C SER A 38 -11.153 -25.403 5.454 1.00 0.00 C ATOM 531 O SER A 38 -11.460 -26.183 4.553 1.00 0.00 O ATOM 532 CB SER A 38 -8.724 -24.802 5.438 1.00 0.00 C ATOM 533 OG SER A 38 -7.778 -23.750 5.358 1.00 0.00 O ATOM 0 H SER A 38 -9.670 -22.940 6.750 1.00 0.00 H new ATOM 0 HA SER A 38 -10.243 -23.949 4.178 1.00 0.00 H new ATOM 0 HB2 SER A 38 -8.660 -25.279 6.416 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.489 -25.564 4.695 1.00 0.00 H new ATOM 0 HG SER A 38 -7.758 -23.263 6.208 1.00 0.00 H new ATOM 539 N PHE A 39 -11.664 -25.475 6.679 1.00 0.00 N ATOM 540 CA PHE A 39 -12.636 -26.499 7.043 1.00 0.00 C ATOM 541 C PHE A 39 -13.908 -26.361 6.212 1.00 0.00 C ATOM 542 O PHE A 39 -14.627 -27.335 5.991 1.00 0.00 O ATOM 543 CB PHE A 39 -12.973 -26.406 8.532 1.00 0.00 C ATOM 544 CG PHE A 39 -12.540 -27.608 9.322 1.00 0.00 C ATOM 545 CD1 PHE A 39 -13.057 -28.862 9.040 1.00 0.00 C ATOM 546 CD2 PHE A 39 -11.615 -27.484 10.346 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.660 -29.970 9.764 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.214 -28.588 11.073 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.737 -29.833 10.783 1.00 0.00 C ATOM 0 H PHE A 39 -11.421 -24.836 7.436 1.00 0.00 H new ATOM 0 HA PHE A 39 -12.194 -27.474 6.838 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.499 -25.517 8.949 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -14.049 -26.276 8.645 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -13.779 -28.975 8.245 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.203 -26.513 10.578 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -13.071 -30.942 9.534 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.492 -28.478 11.868 1.00 0.00 H new ATOM 0 HZ PHE A 39 -11.425 -30.697 11.351 1.00 0.00 H new ATOM 559 N PHE A 40 -14.179 -25.143 5.754 1.00 0.00 N ATOM 560 CA PHE A 40 -15.365 -24.876 4.949 1.00 0.00 C ATOM 561 C PHE A 40 -15.084 -25.122 3.469 1.00 0.00 C ATOM 562 O PHE A 40 -15.890 -25.730 2.765 1.00 0.00 O ATOM 563 CB PHE A 40 -15.836 -23.435 5.158 1.00 0.00 C ATOM 564 CG PHE A 40 -16.784 -23.276 6.312 1.00 0.00 C ATOM 565 CD1 PHE A 40 -16.509 -23.861 7.537 1.00 0.00 C ATOM 566 CD2 PHE A 40 -17.949 -22.540 6.172 1.00 0.00 C ATOM 567 CE1 PHE A 40 -17.380 -23.717 8.600 1.00 0.00 C ATOM 568 CE2 PHE A 40 -18.824 -22.392 7.232 1.00 0.00 C ATOM 569 CZ PHE A 40 -18.538 -22.980 8.448 1.00 0.00 C ATOM 0 H PHE A 40 -13.594 -24.326 5.927 1.00 0.00 H new ATOM 0 HA PHE A 40 -16.152 -25.558 5.270 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -14.967 -22.797 5.321 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -16.322 -23.084 4.248 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -15.604 -24.436 7.663 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -18.176 -22.076 5.224 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -17.155 -24.181 9.549 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -19.730 -21.817 7.109 1.00 0.00 H new ATOM 0 HZ PHE A 40 -19.218 -22.864 9.279 1.00 0.00 H new ATOM 579 N VAL A 41 -13.935 -24.643 3.004 1.00 0.00 N ATOM 580 CA VAL A 41 -13.546 -24.810 1.608 1.00 0.00 C ATOM 581 C VAL A 41 -13.302 -26.278 1.278 1.00 0.00 C ATOM 582 O VAL A 41 -13.469 -26.706 0.135 1.00 0.00 O ATOM 583 CB VAL A 41 -12.276 -24.003 1.279 1.00 0.00 C ATOM 584 CG1 VAL A 41 -11.923 -24.140 -0.194 1.00 0.00 C ATOM 585 CG2 VAL A 41 -12.461 -22.542 1.658 1.00 0.00 C ATOM 0 H VAL A 41 -13.257 -24.136 3.573 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.372 -24.437 1.002 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.449 -24.405 1.865 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -11.023 -23.563 -0.408 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -11.746 -25.189 -0.430 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -12.747 -23.766 -0.802 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -11.554 -21.986 1.419 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.300 -22.125 1.101 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -12.662 -22.466 2.727 1.00 0.00 H new ATOM 595 N THR A 42 -12.905 -27.048 2.286 1.00 0.00 N ATOM 596 CA THR A 42 -12.636 -28.469 2.104 1.00 0.00 C ATOM 597 C THR A 42 -13.924 -29.283 2.158 1.00 0.00 C ATOM 598 O THR A 42 -14.001 -30.377 1.599 1.00 0.00 O ATOM 599 CB THR A 42 -11.662 -28.999 3.173 1.00 0.00 C ATOM 600 OG1 THR A 42 -11.272 -30.340 2.858 1.00 0.00 O ATOM 601 CG2 THR A 42 -12.300 -28.961 4.553 1.00 0.00 C ATOM 0 H THR A 42 -12.762 -26.711 3.238 1.00 0.00 H new ATOM 0 HA THR A 42 -12.179 -28.580 1.121 1.00 0.00 H new ATOM 0 HB THR A 42 -10.781 -28.357 3.181 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.652 -30.669 3.541 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.593 -29.340 5.291 1.00 0.00 H new ATOM 0 HG22 THR A 42 -12.569 -27.934 4.802 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.196 -29.581 4.557 1.00 0.00 H new ATOM 609 N GLU A 43 -14.933 -28.742 2.834 1.00 0.00 N ATOM 610 CA GLU A 43 -16.218 -29.420 2.960 1.00 0.00 C ATOM 611 C GLU A 43 -17.197 -28.933 1.896 1.00 0.00 C ATOM 612 O GLU A 43 -18.413 -29.033 2.062 1.00 0.00 O ATOM 613 CB GLU A 43 -16.806 -29.190 4.354 1.00 0.00 C ATOM 614 CG GLU A 43 -16.354 -30.213 5.382 1.00 0.00 C ATOM 615 CD GLU A 43 -17.237 -31.446 5.405 1.00 0.00 C ATOM 616 OE1 GLU A 43 -17.798 -31.794 4.346 1.00 0.00 O ATOM 617 OE2 GLU A 43 -17.366 -32.062 6.484 1.00 0.00 O ATOM 0 H GLU A 43 -14.885 -27.837 3.302 1.00 0.00 H new ATOM 0 HA GLU A 43 -16.053 -30.488 2.815 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -16.526 -28.194 4.697 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -17.894 -29.210 4.288 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.327 -30.510 5.167 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -16.352 -29.753 6.370 1.00 0.00 H new ATOM 624 N LYS A 44 -16.658 -28.404 0.803 1.00 0.00 N ATOM 625 CA LYS A 44 -17.482 -27.902 -0.291 1.00 0.00 C ATOM 626 C LYS A 44 -18.510 -26.897 0.220 1.00 0.00 C ATOM 627 O LYS A 44 -19.584 -26.744 -0.362 1.00 0.00 O ATOM 628 CB LYS A 44 -18.192 -29.060 -0.996 1.00 0.00 C ATOM 629 CG LYS A 44 -18.545 -28.765 -2.443 1.00 0.00 C ATOM 630 CD LYS A 44 -18.937 -30.029 -3.190 1.00 0.00 C ATOM 631 CE LYS A 44 -17.766 -30.599 -3.976 1.00 0.00 C ATOM 632 NZ LYS A 44 -18.081 -31.936 -4.550 1.00 0.00 N ATOM 0 H LYS A 44 -15.654 -28.312 0.651 1.00 0.00 H new ATOM 0 HA LYS A 44 -16.829 -27.398 -1.003 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -17.554 -29.943 -0.959 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -19.104 -29.302 -0.450 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -19.367 -28.050 -2.479 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -17.694 -28.298 -2.938 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -19.298 -30.774 -2.481 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -19.761 -29.810 -3.870 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -17.500 -29.912 -4.780 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -16.896 -30.680 -3.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.258 -32.290 -5.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -18.310 -32.598 -3.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -18.895 -31.855 -5.192 1.00 0.00 H new ATOM 646 N ILE A 45 -18.173 -26.215 1.310 1.00 0.00 N ATOM 647 CA ILE A 45 -19.066 -25.223 1.896 1.00 0.00 C ATOM 648 C ILE A 45 -19.016 -23.911 1.120 1.00 0.00 C ATOM 649 O ILE A 45 -17.954 -23.307 0.970 1.00 0.00 O ATOM 650 CB ILE A 45 -18.713 -24.949 3.370 1.00 0.00 C ATOM 651 CG1 ILE A 45 -18.561 -26.266 4.134 1.00 0.00 C ATOM 652 CG2 ILE A 45 -19.777 -24.075 4.016 1.00 0.00 C ATOM 653 CD1 ILE A 45 -19.810 -27.119 4.121 1.00 0.00 C ATOM 0 H ILE A 45 -17.289 -26.331 1.805 1.00 0.00 H new ATOM 0 HA ILE A 45 -20.074 -25.635 1.843 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.762 -24.417 3.408 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -17.738 -26.835 3.702 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -18.290 -26.048 5.167 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -19.513 -23.890 5.057 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -19.840 -23.126 3.484 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -20.741 -24.582 3.970 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -19.630 -28.037 4.681 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -20.631 -26.569 4.580 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -20.070 -27.367 3.092 1.00 0.00 H new ATOM 665 N ASP A 46 -20.171 -23.475 0.632 1.00 0.00 N ATOM 666 CA ASP A 46 -20.261 -22.232 -0.126 1.00 0.00 C ATOM 667 C ASP A 46 -21.233 -21.261 0.535 1.00 0.00 C ATOM 668 O ASP A 46 -21.690 -21.490 1.654 1.00 0.00 O ATOM 669 CB ASP A 46 -20.703 -22.517 -1.563 1.00 0.00 C ATOM 670 CG ASP A 46 -22.202 -22.710 -1.679 1.00 0.00 C ATOM 671 OD1 ASP A 46 -22.685 -23.814 -1.350 1.00 0.00 O ATOM 672 OD2 ASP A 46 -22.892 -21.758 -2.101 1.00 0.00 O ATOM 0 H ASP A 46 -21.059 -23.964 0.747 1.00 0.00 H new ATOM 0 HA ASP A 46 -19.272 -21.773 -0.142 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -20.395 -21.692 -2.205 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -20.195 -23.411 -1.926 1.00 0.00 H new ATOM 677 N GLY A 47 -21.544 -20.174 -0.164 1.00 0.00 N ATOM 678 CA GLY A 47 -22.459 -19.183 0.372 1.00 0.00 C ATOM 679 C GLY A 47 -23.825 -19.763 0.682 1.00 0.00 C ATOM 680 O GLY A 47 -24.285 -19.709 1.821 1.00 0.00 O ATOM 0 H GLY A 47 -21.179 -19.962 -1.092 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -22.035 -18.755 1.280 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -22.568 -18.368 -0.344 1.00 0.00 H new ATOM 684 N ASN A 48 -24.475 -20.317 -0.336 1.00 0.00 N ATOM 685 CA ASN A 48 -25.798 -20.907 -0.168 1.00 0.00 C ATOM 686 C ASN A 48 -25.788 -21.957 0.939 1.00 0.00 C ATOM 687 O ASN A 48 -26.808 -22.206 1.583 1.00 0.00 O ATOM 688 CB ASN A 48 -26.270 -21.536 -1.480 1.00 0.00 C ATOM 689 CG ASN A 48 -27.669 -21.093 -1.864 1.00 0.00 C ATOM 690 OD1 ASN A 48 -27.845 -20.243 -2.737 1.00 0.00 O ATOM 691 ND2 ASN A 48 -28.672 -21.669 -1.210 1.00 0.00 N ATOM 0 H ASN A 48 -24.107 -20.370 -1.286 1.00 0.00 H new ATOM 0 HA ASN A 48 -26.489 -20.113 0.115 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -25.576 -21.270 -2.277 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -26.248 -22.622 -1.388 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -29.635 -21.411 -1.424 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -28.479 -22.369 -0.494 1.00 0.00 H new ATOM 698 N LEU A 49 -24.630 -22.571 1.154 1.00 0.00 N ATOM 699 CA LEU A 49 -24.485 -23.595 2.183 1.00 0.00 C ATOM 700 C LEU A 49 -24.379 -22.964 3.568 1.00 0.00 C ATOM 701 O LEU A 49 -25.025 -23.411 4.516 1.00 0.00 O ATOM 702 CB LEU A 49 -23.251 -24.454 1.905 1.00 0.00 C ATOM 703 CG LEU A 49 -23.313 -25.899 2.403 1.00 0.00 C ATOM 704 CD1 LEU A 49 -23.454 -25.937 3.916 1.00 0.00 C ATOM 705 CD2 LEU A 49 -24.463 -26.642 1.739 1.00 0.00 C ATOM 0 H LEU A 49 -23.777 -22.378 0.629 1.00 0.00 H new ATOM 0 HA LEU A 49 -25.373 -24.227 2.159 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -23.078 -24.469 0.829 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -22.386 -23.971 2.360 1.00 0.00 H new ATOM 0 HG LEU A 49 -22.381 -26.396 2.134 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -23.496 -26.973 4.252 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -22.597 -25.442 4.374 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -24.369 -25.423 4.209 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -24.492 -27.668 2.105 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -25.403 -26.145 1.977 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -24.318 -26.646 0.659 1.00 0.00 H new ATOM 717 N LEU A 50 -23.563 -21.921 3.676 1.00 0.00 N ATOM 718 CA LEU A 50 -23.374 -21.226 4.945 1.00 0.00 C ATOM 719 C LEU A 50 -24.701 -20.699 5.480 1.00 0.00 C ATOM 720 O LEU A 50 -25.066 -20.955 6.627 1.00 0.00 O ATOM 721 CB LEU A 50 -22.385 -20.072 4.774 1.00 0.00 C ATOM 722 CG LEU A 50 -22.164 -19.190 6.004 1.00 0.00 C ATOM 723 CD1 LEU A 50 -21.659 -20.021 7.173 1.00 0.00 C ATOM 724 CD2 LEU A 50 -21.189 -18.066 5.685 1.00 0.00 C ATOM 0 H LEU A 50 -23.022 -21.538 2.901 1.00 0.00 H new ATOM 0 HA LEU A 50 -22.971 -21.938 5.665 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -21.423 -20.486 4.471 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.732 -19.440 3.956 1.00 0.00 H new ATOM 0 HG LEU A 50 -23.119 -18.747 6.286 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.508 -19.377 8.039 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -22.392 -20.790 7.417 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -20.715 -20.493 6.903 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -21.043 -17.448 6.571 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -20.233 -18.490 5.377 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.591 -17.454 4.878 1.00 0.00 H new ATOM 736 N VAL A 51 -25.421 -19.962 4.640 1.00 0.00 N ATOM 737 CA VAL A 51 -26.710 -19.401 5.027 1.00 0.00 C ATOM 738 C VAL A 51 -27.668 -20.492 5.491 1.00 0.00 C ATOM 739 O VAL A 51 -28.575 -20.239 6.283 1.00 0.00 O ATOM 740 CB VAL A 51 -27.357 -18.626 3.863 1.00 0.00 C ATOM 741 CG1 VAL A 51 -26.463 -17.476 3.424 1.00 0.00 C ATOM 742 CG2 VAL A 51 -27.648 -19.561 2.699 1.00 0.00 C ATOM 0 H VAL A 51 -25.133 -19.740 3.687 1.00 0.00 H new ATOM 0 HA VAL A 51 -26.521 -18.713 5.851 1.00 0.00 H new ATOM 0 HB VAL A 51 -28.302 -18.207 4.208 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -26.937 -16.941 2.601 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -26.310 -16.794 4.261 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -25.501 -17.868 3.095 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -28.105 -18.998 1.885 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -26.718 -20.010 2.352 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -28.330 -20.346 3.025 1.00 0.00 H new ATOM 752 N GLN A 52 -27.458 -21.706 4.992 1.00 0.00 N ATOM 753 CA GLN A 52 -28.304 -22.837 5.357 1.00 0.00 C ATOM 754 C GLN A 52 -27.815 -23.490 6.645 1.00 0.00 C ATOM 755 O GLN A 52 -28.593 -24.103 7.378 1.00 0.00 O ATOM 756 CB GLN A 52 -28.328 -23.868 4.226 1.00 0.00 C ATOM 757 CG GLN A 52 -29.250 -23.490 3.079 1.00 0.00 C ATOM 758 CD GLN A 52 -29.030 -24.347 1.847 1.00 0.00 C ATOM 759 OE1 GLN A 52 -28.950 -23.838 0.729 1.00 0.00 O ATOM 760 NE2 GLN A 52 -28.932 -25.656 2.047 1.00 0.00 N ATOM 0 H GLN A 52 -26.711 -21.932 4.335 1.00 0.00 H new ATOM 0 HA GLN A 52 -29.315 -22.464 5.522 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -27.316 -23.996 3.841 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -28.640 -24.831 4.630 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -30.286 -23.586 3.404 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -29.093 -22.443 2.821 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -29.004 -26.034 2.991 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -28.784 -26.283 1.256 1.00 0.00 H new ATOM 769 N LEU A 53 -26.521 -23.355 6.917 1.00 0.00 N ATOM 770 CA LEU A 53 -25.928 -23.932 8.118 1.00 0.00 C ATOM 771 C LEU A 53 -26.488 -23.271 9.374 1.00 0.00 C ATOM 772 O LEU A 53 -26.626 -22.049 9.437 1.00 0.00 O ATOM 773 CB LEU A 53 -24.406 -23.779 8.083 1.00 0.00 C ATOM 774 CG LEU A 53 -23.646 -24.820 7.261 1.00 0.00 C ATOM 775 CD1 LEU A 53 -22.160 -24.499 7.235 1.00 0.00 C ATOM 776 CD2 LEU A 53 -23.881 -26.216 7.819 1.00 0.00 C ATOM 0 H LEU A 53 -25.863 -22.851 6.322 1.00 0.00 H new ATOM 0 HA LEU A 53 -26.180 -24.992 8.144 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -24.169 -22.791 7.689 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -24.034 -23.812 9.107 1.00 0.00 H new ATOM 0 HG LEU A 53 -24.021 -24.791 6.238 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -21.636 -25.251 6.645 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -22.008 -23.516 6.788 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -21.770 -24.499 8.253 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -23.332 -26.944 7.221 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -23.534 -26.258 8.851 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -24.946 -26.447 7.785 1.00 0.00 H new ATOM 788 N THR A 54 -26.807 -24.087 10.374 1.00 0.00 N ATOM 789 CA THR A 54 -27.350 -23.582 11.628 1.00 0.00 C ATOM 790 C THR A 54 -26.415 -23.884 12.794 1.00 0.00 C ATOM 791 O THR A 54 -25.512 -24.712 12.677 1.00 0.00 O ATOM 792 CB THR A 54 -28.735 -24.189 11.925 1.00 0.00 C ATOM 793 OG1 THR A 54 -28.731 -25.590 11.625 1.00 0.00 O ATOM 794 CG2 THR A 54 -29.816 -23.495 11.111 1.00 0.00 C ATOM 0 H THR A 54 -26.698 -25.101 10.339 1.00 0.00 H new ATOM 0 HA THR A 54 -27.450 -22.502 11.517 1.00 0.00 H new ATOM 0 HB THR A 54 -28.950 -24.045 12.984 1.00 0.00 H new ATOM 0 HG1 THR A 54 -29.614 -25.968 11.818 1.00 0.00 H new ATOM 0 HG21 THR A 54 -30.785 -23.941 11.338 1.00 0.00 H new ATOM 0 HG22 THR A 54 -29.837 -22.435 11.363 1.00 0.00 H new ATOM 0 HG23 THR A 54 -29.603 -23.612 10.048 1.00 0.00 H new ATOM 802 N GLU A 55 -26.639 -23.208 13.916 1.00 0.00 N ATOM 803 CA GLU A 55 -25.815 -23.406 15.103 1.00 0.00 C ATOM 804 C GLU A 55 -25.851 -24.863 15.554 1.00 0.00 C ATOM 805 O GLU A 55 -24.912 -25.352 16.183 1.00 0.00 O ATOM 806 CB GLU A 55 -26.290 -22.497 16.238 1.00 0.00 C ATOM 807 CG GLU A 55 -25.194 -22.130 17.224 1.00 0.00 C ATOM 808 CD GLU A 55 -25.715 -21.339 18.408 1.00 0.00 C ATOM 809 OE1 GLU A 55 -26.512 -20.403 18.191 1.00 0.00 O ATOM 810 OE2 GLU A 55 -25.325 -21.655 19.551 1.00 0.00 O ATOM 0 H GLU A 55 -27.383 -22.519 14.028 1.00 0.00 H new ATOM 0 HA GLU A 55 -24.787 -23.149 14.847 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -26.704 -21.583 15.811 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -27.099 -22.993 16.775 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -24.714 -23.040 17.583 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -24.429 -21.547 16.711 1.00 0.00 H new ATOM 817 N GLU A 56 -26.941 -25.550 15.229 1.00 0.00 N ATOM 818 CA GLU A 56 -27.100 -26.951 15.603 1.00 0.00 C ATOM 819 C GLU A 56 -26.152 -27.838 14.801 1.00 0.00 C ATOM 820 O GLU A 56 -25.433 -28.664 15.365 1.00 0.00 O ATOM 821 CB GLU A 56 -28.546 -27.400 15.381 1.00 0.00 C ATOM 822 CG GLU A 56 -29.524 -26.823 16.391 1.00 0.00 C ATOM 823 CD GLU A 56 -29.794 -25.348 16.164 1.00 0.00 C ATOM 824 OE1 GLU A 56 -30.197 -24.985 15.039 1.00 0.00 O ATOM 825 OE2 GLU A 56 -29.602 -24.557 17.111 1.00 0.00 O ATOM 0 H GLU A 56 -27.727 -25.160 14.708 1.00 0.00 H new ATOM 0 HA GLU A 56 -26.855 -27.049 16.661 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -28.858 -27.109 14.378 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -28.591 -28.488 15.425 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -30.463 -27.373 16.337 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -29.129 -26.966 17.397 1.00 0.00 H new ATOM 832 N ILE A 57 -26.157 -27.662 13.484 1.00 0.00 N ATOM 833 CA ILE A 57 -25.298 -28.446 12.606 1.00 0.00 C ATOM 834 C ILE A 57 -23.835 -28.050 12.771 1.00 0.00 C ATOM 835 O ILE A 57 -22.932 -28.847 12.515 1.00 0.00 O ATOM 836 CB ILE A 57 -25.700 -28.278 11.128 1.00 0.00 C ATOM 837 CG1 ILE A 57 -27.166 -28.670 10.928 1.00 0.00 C ATOM 838 CG2 ILE A 57 -24.796 -29.113 10.235 1.00 0.00 C ATOM 839 CD1 ILE A 57 -27.739 -28.209 9.607 1.00 0.00 C ATOM 0 H ILE A 57 -26.746 -26.983 13.002 1.00 0.00 H new ATOM 0 HA ILE A 57 -25.424 -29.490 12.892 1.00 0.00 H new ATOM 0 HB ILE A 57 -25.583 -27.230 10.852 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -27.256 -29.754 10.996 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -27.760 -28.249 11.739 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -25.093 -28.984 9.194 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -23.762 -28.791 10.360 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -24.884 -30.164 10.509 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -28.781 -28.521 9.533 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -27.681 -27.122 9.545 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -27.169 -28.650 8.789 1.00 0.00 H new ATOM 851 N LEU A 58 -23.608 -26.814 13.202 1.00 0.00 N ATOM 852 CA LEU A 58 -22.253 -26.311 13.404 1.00 0.00 C ATOM 853 C LEU A 58 -21.615 -26.946 14.635 1.00 0.00 C ATOM 854 O LEU A 58 -20.393 -27.065 14.721 1.00 0.00 O ATOM 855 CB LEU A 58 -22.270 -24.789 13.552 1.00 0.00 C ATOM 856 CG LEU A 58 -22.557 -23.994 12.277 1.00 0.00 C ATOM 857 CD1 LEU A 58 -23.062 -22.601 12.620 1.00 0.00 C ATOM 858 CD2 LEU A 58 -21.311 -23.913 11.407 1.00 0.00 C ATOM 0 H LEU A 58 -24.344 -26.142 13.418 1.00 0.00 H new ATOM 0 HA LEU A 58 -21.658 -26.578 12.530 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -23.020 -24.525 14.298 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.304 -24.471 13.945 1.00 0.00 H new ATOM 0 HG LEU A 58 -23.334 -24.512 11.715 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -23.261 -22.050 11.701 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -23.980 -22.680 13.202 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -22.307 -22.074 13.203 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -21.534 -23.344 10.504 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -20.513 -23.418 11.960 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -20.993 -24.919 11.133 1.00 0.00 H new ATOM 870 N SER A 59 -22.450 -27.354 15.585 1.00 0.00 N ATOM 871 CA SER A 59 -21.968 -27.976 16.812 1.00 0.00 C ATOM 872 C SER A 59 -22.109 -29.494 16.745 1.00 0.00 C ATOM 873 O SER A 59 -21.361 -30.226 17.390 1.00 0.00 O ATOM 874 CB SER A 59 -22.735 -27.434 18.020 1.00 0.00 C ATOM 875 OG SER A 59 -22.100 -27.798 19.233 1.00 0.00 O ATOM 0 H SER A 59 -23.465 -27.265 15.528 1.00 0.00 H new ATOM 0 HA SER A 59 -20.911 -27.732 16.922 1.00 0.00 H new ATOM 0 HB2 SER A 59 -22.804 -26.348 17.954 1.00 0.00 H new ATOM 0 HB3 SER A 59 -23.755 -27.819 18.010 1.00 0.00 H new ATOM 0 HG SER A 59 -22.609 -27.438 19.989 1.00 0.00 H new ATOM 881 N GLU A 60 -23.076 -29.957 15.958 1.00 0.00 N ATOM 882 CA GLU A 60 -23.316 -31.387 15.806 1.00 0.00 C ATOM 883 C GLU A 60 -22.346 -31.999 14.800 1.00 0.00 C ATOM 884 O GLU A 60 -21.629 -32.949 15.112 1.00 0.00 O ATOM 885 CB GLU A 60 -24.758 -31.640 15.360 1.00 0.00 C ATOM 886 CG GLU A 60 -25.778 -31.473 16.473 1.00 0.00 C ATOM 887 CD GLU A 60 -26.682 -32.682 16.622 1.00 0.00 C ATOM 888 OE1 GLU A 60 -26.265 -33.655 17.284 1.00 0.00 O ATOM 889 OE2 GLU A 60 -27.805 -32.655 16.076 1.00 0.00 O ATOM 0 H GLU A 60 -23.705 -29.363 15.417 1.00 0.00 H new ATOM 0 HA GLU A 60 -23.154 -31.861 16.774 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -25.004 -30.955 14.548 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -24.833 -32.651 14.959 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -25.258 -31.295 17.414 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -26.387 -30.591 16.274 1.00 0.00 H new ATOM 896 N ASP A 61 -22.330 -31.446 13.592 1.00 0.00 N ATOM 897 CA ASP A 61 -21.448 -31.936 12.539 1.00 0.00 C ATOM 898 C ASP A 61 -20.041 -31.369 12.701 1.00 0.00 C ATOM 899 O ASP A 61 -19.121 -32.072 13.119 1.00 0.00 O ATOM 900 CB ASP A 61 -22.006 -31.565 11.164 1.00 0.00 C ATOM 901 CG ASP A 61 -22.621 -32.753 10.449 1.00 0.00 C ATOM 902 OD1 ASP A 61 -21.954 -33.805 10.366 1.00 0.00 O ATOM 903 OD2 ASP A 61 -23.769 -32.629 9.974 1.00 0.00 O ATOM 0 H ASP A 61 -22.917 -30.659 13.318 1.00 0.00 H new ATOM 0 HA ASP A 61 -21.394 -33.022 12.620 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -22.758 -30.784 11.279 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -21.206 -31.149 10.551 1.00 0.00 H new ATOM 908 N PHE A 62 -19.881 -30.093 12.366 1.00 0.00 N ATOM 909 CA PHE A 62 -18.586 -29.431 12.473 1.00 0.00 C ATOM 910 C PHE A 62 -18.013 -29.579 13.879 1.00 0.00 C ATOM 911 O PHE A 62 -16.833 -29.885 14.052 1.00 0.00 O ATOM 912 CB PHE A 62 -18.716 -27.948 12.117 1.00 0.00 C ATOM 913 CG PHE A 62 -18.854 -27.696 10.643 1.00 0.00 C ATOM 914 CD1 PHE A 62 -20.089 -27.790 10.022 1.00 0.00 C ATOM 915 CD2 PHE A 62 -17.748 -27.364 9.877 1.00 0.00 C ATOM 916 CE1 PHE A 62 -20.218 -27.559 8.666 1.00 0.00 C ATOM 917 CE2 PHE A 62 -17.871 -27.131 8.520 1.00 0.00 C ATOM 918 CZ PHE A 62 -19.108 -27.227 7.914 1.00 0.00 C ATOM 0 H PHE A 62 -20.632 -29.497 12.018 1.00 0.00 H new ATOM 0 HA PHE A 62 -17.904 -29.908 11.770 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -19.583 -27.534 12.631 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -17.841 -27.415 12.488 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -20.961 -28.047 10.605 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -16.778 -27.286 10.346 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -21.186 -27.638 8.194 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -17.001 -26.874 7.934 1.00 0.00 H new ATOM 0 HZ PHE A 62 -19.207 -27.043 6.854 1.00 0.00 H new ATOM 928 N LYS A 63 -18.858 -29.361 14.881 1.00 0.00 N ATOM 929 CA LYS A 63 -18.438 -29.471 16.274 1.00 0.00 C ATOM 930 C LYS A 63 -17.337 -28.464 16.591 1.00 0.00 C ATOM 931 O LYS A 63 -16.439 -28.741 17.388 1.00 0.00 O ATOM 932 CB LYS A 63 -17.948 -30.890 16.570 1.00 0.00 C ATOM 933 CG LYS A 63 -18.906 -31.973 16.107 1.00 0.00 C ATOM 934 CD LYS A 63 -19.341 -32.863 17.260 1.00 0.00 C ATOM 935 CE LYS A 63 -18.477 -34.111 17.357 1.00 0.00 C ATOM 936 NZ LYS A 63 -19.178 -35.314 16.828 1.00 0.00 N ATOM 0 H LYS A 63 -19.838 -29.107 14.755 1.00 0.00 H new ATOM 0 HA LYS A 63 -19.299 -29.252 16.906 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -16.982 -31.040 16.087 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -17.787 -30.993 17.643 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -19.782 -31.514 15.650 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -18.427 -32.580 15.339 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -19.282 -32.305 18.194 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -20.384 -33.151 17.126 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -17.552 -33.956 16.802 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -18.200 -34.281 18.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.556 -36.143 16.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -20.048 -35.477 17.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -19.420 -35.163 15.828 1.00 0.00 H new ATOM 950 N LEU A 64 -17.411 -27.296 15.963 1.00 0.00 N ATOM 951 CA LEU A 64 -16.420 -26.247 16.180 1.00 0.00 C ATOM 952 C LEU A 64 -16.446 -25.764 17.627 1.00 0.00 C ATOM 953 O LEU A 64 -17.261 -26.219 18.429 1.00 0.00 O ATOM 954 CB LEU A 64 -16.677 -25.073 15.234 1.00 0.00 C ATOM 955 CG LEU A 64 -16.497 -25.360 13.743 1.00 0.00 C ATOM 956 CD1 LEU A 64 -17.692 -24.850 12.953 1.00 0.00 C ATOM 957 CD2 LEU A 64 -15.209 -24.732 13.231 1.00 0.00 C ATOM 0 H LEU A 64 -18.146 -27.051 15.300 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.434 -26.664 15.973 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -17.695 -24.719 15.395 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.009 -24.257 15.510 1.00 0.00 H new ATOM 0 HG LEU A 64 -16.431 -26.439 13.606 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -17.546 -25.063 11.894 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.597 -25.347 13.302 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -17.790 -23.774 13.096 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -15.097 -24.946 12.168 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -15.245 -23.653 13.382 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.361 -25.146 13.776 1.00 0.00 H new ATOM 969 N SER A 65 -15.550 -24.838 17.952 1.00 0.00 N ATOM 970 CA SER A 65 -15.469 -24.294 19.303 1.00 0.00 C ATOM 971 C SER A 65 -16.717 -23.482 19.638 1.00 0.00 C ATOM 972 O SER A 65 -17.369 -22.931 18.751 1.00 0.00 O ATOM 973 CB SER A 65 -14.223 -23.419 19.449 1.00 0.00 C ATOM 974 OG SER A 65 -14.273 -22.655 20.642 1.00 0.00 O ATOM 0 H SER A 65 -14.870 -24.449 17.299 1.00 0.00 H new ATOM 0 HA SER A 65 -15.402 -25.129 20.001 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.332 -24.047 19.453 1.00 0.00 H new ATOM 0 HB3 SER A 65 -14.140 -22.753 18.590 1.00 0.00 H new ATOM 0 HG SER A 65 -13.465 -22.106 20.713 1.00 0.00 H new ATOM 980 N LYS A 66 -17.042 -23.414 20.924 1.00 0.00 N ATOM 981 CA LYS A 66 -18.211 -22.669 21.379 1.00 0.00 C ATOM 982 C LYS A 66 -18.162 -21.226 20.887 1.00 0.00 C ATOM 983 O LYS A 66 -19.198 -20.582 20.717 1.00 0.00 O ATOM 984 CB LYS A 66 -18.295 -22.696 22.907 1.00 0.00 C ATOM 985 CG LYS A 66 -17.030 -22.210 23.594 1.00 0.00 C ATOM 986 CD LYS A 66 -17.346 -21.254 24.732 1.00 0.00 C ATOM 987 CE LYS A 66 -16.081 -20.643 25.314 1.00 0.00 C ATOM 988 NZ LYS A 66 -16.046 -20.750 26.799 1.00 0.00 N ATOM 0 H LYS A 66 -16.513 -23.865 21.670 1.00 0.00 H new ATOM 0 HA LYS A 66 -19.099 -23.146 20.964 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -19.133 -22.077 23.228 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -18.507 -23.714 23.233 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -16.473 -23.064 23.979 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -16.388 -21.712 22.867 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -18.002 -20.461 24.371 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -17.888 -21.785 25.515 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -15.209 -21.144 24.893 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -16.017 -19.594 25.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -15.168 -20.322 27.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -16.864 -20.251 27.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -16.081 -21.752 27.076 1.00 0.00 H new ATOM 1002 N LEU A 67 -16.953 -20.724 20.659 1.00 0.00 N ATOM 1003 CA LEU A 67 -16.769 -19.357 20.185 1.00 0.00 C ATOM 1004 C LEU A 67 -16.987 -19.270 18.678 1.00 0.00 C ATOM 1005 O LEU A 67 -17.662 -18.363 18.191 1.00 0.00 O ATOM 1006 CB LEU A 67 -15.367 -18.858 20.539 1.00 0.00 C ATOM 1007 CG LEU A 67 -15.300 -17.680 21.512 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -16.027 -16.473 20.941 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -15.887 -18.069 22.862 1.00 0.00 C ATOM 0 H LEU A 67 -16.086 -21.243 20.795 1.00 0.00 H new ATOM 0 HA LEU A 67 -17.508 -18.725 20.678 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -14.804 -19.688 20.966 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -14.862 -18.571 19.617 1.00 0.00 H new ATOM 0 HG LEU A 67 -14.253 -17.413 21.656 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -15.968 -15.645 21.648 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -15.562 -16.180 20.000 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -17.072 -16.727 20.766 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.831 -17.219 23.542 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -16.929 -18.364 22.735 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -15.322 -18.903 23.278 1.00 0.00 H new ATOM 1021 N GLN A 68 -16.412 -20.219 17.946 1.00 0.00 N ATOM 1022 CA GLN A 68 -16.545 -20.249 16.494 1.00 0.00 C ATOM 1023 C GLN A 68 -18.007 -20.393 16.085 1.00 0.00 C ATOM 1024 O GLN A 68 -18.529 -19.587 15.314 1.00 0.00 O ATOM 1025 CB GLN A 68 -15.723 -21.399 15.910 1.00 0.00 C ATOM 1026 CG GLN A 68 -14.271 -21.036 15.644 1.00 0.00 C ATOM 1027 CD GLN A 68 -13.332 -22.211 15.831 1.00 0.00 C ATOM 1028 OE1 GLN A 68 -13.770 -23.345 16.029 1.00 0.00 O ATOM 1029 NE2 GLN A 68 -12.032 -21.946 15.769 1.00 0.00 N ATOM 0 H GLN A 68 -15.850 -20.977 18.334 1.00 0.00 H new ATOM 0 HA GLN A 68 -16.168 -19.306 16.099 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -15.757 -22.244 16.597 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -16.183 -21.727 14.978 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -14.176 -20.658 14.626 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -13.974 -20.228 16.313 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -11.713 -20.991 15.603 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.352 -22.697 15.887 1.00 0.00 H new ATOM 1038 N VAL A 69 -18.663 -21.425 16.605 1.00 0.00 N ATOM 1039 CA VAL A 69 -20.066 -21.675 16.294 1.00 0.00 C ATOM 1040 C VAL A 69 -20.919 -20.443 16.576 1.00 0.00 C ATOM 1041 O VAL A 69 -21.925 -20.205 15.908 1.00 0.00 O ATOM 1042 CB VAL A 69 -20.617 -22.864 17.103 1.00 0.00 C ATOM 1043 CG1 VAL A 69 -22.087 -23.092 16.783 1.00 0.00 C ATOM 1044 CG2 VAL A 69 -19.802 -24.118 16.828 1.00 0.00 C ATOM 0 H VAL A 69 -18.246 -22.102 17.244 1.00 0.00 H new ATOM 0 HA VAL A 69 -20.117 -21.914 15.232 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.533 -22.630 18.164 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.459 -23.936 17.364 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -22.657 -22.198 17.036 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -22.199 -23.306 15.720 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -20.205 -24.948 17.408 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -19.852 -24.359 15.766 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -18.764 -23.947 17.113 1.00 0.00 H new ATOM 1054 N LYS A 70 -20.510 -19.662 17.570 1.00 0.00 N ATOM 1055 CA LYS A 70 -21.235 -18.453 17.942 1.00 0.00 C ATOM 1056 C LYS A 70 -20.892 -17.303 17.000 1.00 0.00 C ATOM 1057 O LYS A 70 -21.754 -16.496 16.648 1.00 0.00 O ATOM 1058 CB LYS A 70 -20.908 -18.060 19.384 1.00 0.00 C ATOM 1059 CG LYS A 70 -22.026 -17.300 20.076 1.00 0.00 C ATOM 1060 CD LYS A 70 -21.737 -15.809 20.130 1.00 0.00 C ATOM 1061 CE LYS A 70 -22.944 -15.024 20.622 1.00 0.00 C ATOM 1062 NZ LYS A 70 -22.694 -14.398 21.950 1.00 0.00 N ATOM 0 H LYS A 70 -19.679 -19.845 18.133 1.00 0.00 H new ATOM 0 HA LYS A 70 -22.302 -18.660 17.862 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -20.685 -18.961 19.955 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -20.006 -17.448 19.389 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -22.964 -17.471 19.548 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -22.155 -17.683 21.088 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -20.889 -15.625 20.790 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -21.452 -15.457 19.139 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -23.194 -14.250 19.897 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -23.806 -15.688 20.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -23.539 -13.872 22.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -22.480 -15.139 22.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -21.887 -13.745 21.880 1.00 0.00 H new ATOM 1076 N LYS A 71 -19.629 -17.233 16.593 1.00 0.00 N ATOM 1077 CA LYS A 71 -19.173 -16.184 15.690 1.00 0.00 C ATOM 1078 C LYS A 71 -19.775 -16.362 14.300 1.00 0.00 C ATOM 1079 O LYS A 71 -20.277 -15.408 13.704 1.00 0.00 O ATOM 1080 CB LYS A 71 -17.645 -16.189 15.600 1.00 0.00 C ATOM 1081 CG LYS A 71 -17.018 -14.822 15.813 1.00 0.00 C ATOM 1082 CD LYS A 71 -15.521 -14.926 16.051 1.00 0.00 C ATOM 1083 CE LYS A 71 -15.204 -15.116 17.527 1.00 0.00 C ATOM 1084 NZ LYS A 71 -14.970 -13.817 18.215 1.00 0.00 N ATOM 0 H LYS A 71 -18.903 -17.891 16.875 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.505 -15.226 16.090 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -17.248 -16.881 16.343 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.348 -16.567 14.622 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -17.206 -14.195 14.942 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.490 -14.333 16.665 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.118 -15.763 15.480 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -15.030 -14.024 15.685 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -16.028 -15.640 18.011 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -14.321 -15.746 17.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -14.757 -13.989 19.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.167 -13.328 17.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -15.822 -13.225 18.138 1.00 0.00 H new ATOM 1098 N ILE A 72 -19.723 -17.588 13.790 1.00 0.00 N ATOM 1099 CA ILE A 72 -20.266 -17.890 12.472 1.00 0.00 C ATOM 1100 C ILE A 72 -21.761 -17.595 12.412 1.00 0.00 C ATOM 1101 O ILE A 72 -22.253 -17.027 11.438 1.00 0.00 O ATOM 1102 CB ILE A 72 -20.030 -19.363 12.090 1.00 0.00 C ATOM 1103 CG1 ILE A 72 -18.534 -19.684 12.110 1.00 0.00 C ATOM 1104 CG2 ILE A 72 -20.621 -19.657 10.720 1.00 0.00 C ATOM 1105 CD1 ILE A 72 -18.229 -21.158 11.952 1.00 0.00 C ATOM 0 H ILE A 72 -19.310 -18.388 14.270 1.00 0.00 H new ATOM 0 HA ILE A 72 -19.743 -17.250 11.761 1.00 0.00 H new ATOM 0 HB ILE A 72 -20.529 -19.997 12.823 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -18.042 -19.132 11.310 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -18.108 -19.332 13.049 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -20.446 -20.702 10.465 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -21.693 -19.463 10.737 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -20.148 -19.017 9.975 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -17.150 -21.311 11.975 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -18.692 -21.715 12.767 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -18.625 -21.511 11.000 1.00 0.00 H new ATOM 1117 N MET A 73 -22.477 -17.983 13.462 1.00 0.00 N ATOM 1118 CA MET A 73 -23.916 -17.757 13.531 1.00 0.00 C ATOM 1119 C MET A 73 -24.244 -16.279 13.346 1.00 0.00 C ATOM 1120 O MET A 73 -25.128 -15.923 12.566 1.00 0.00 O ATOM 1121 CB MET A 73 -24.469 -18.250 14.869 1.00 0.00 C ATOM 1122 CG MET A 73 -25.456 -19.398 14.734 1.00 0.00 C ATOM 1123 SD MET A 73 -27.142 -18.834 14.438 1.00 0.00 S ATOM 1124 CE MET A 73 -27.265 -19.049 12.664 1.00 0.00 C ATOM 0 H MET A 73 -22.085 -18.455 14.276 1.00 0.00 H new ATOM 0 HA MET A 73 -24.385 -18.319 12.723 1.00 0.00 H new ATOM 0 HB2 MET A 73 -23.639 -18.568 15.501 1.00 0.00 H new ATOM 0 HB3 MET A 73 -24.958 -17.420 15.379 1.00 0.00 H new ATOM 0 HG2 MET A 73 -25.144 -20.045 13.914 1.00 0.00 H new ATOM 0 HG3 MET A 73 -25.433 -20.000 15.642 1.00 0.00 H new ATOM 0 HE1 MET A 73 -28.306 -18.948 12.357 1.00 0.00 H new ATOM 0 HE2 MET A 73 -26.664 -18.290 12.163 1.00 0.00 H new ATOM 0 HE3 MET A 73 -26.900 -20.039 12.391 1.00 0.00 H new ATOM 1134 N GLN A 74 -23.527 -15.423 14.067 1.00 0.00 N ATOM 1135 CA GLN A 74 -23.743 -13.984 13.982 1.00 0.00 C ATOM 1136 C GLN A 74 -23.455 -13.472 12.574 1.00 0.00 C ATOM 1137 O GLN A 74 -24.032 -12.478 12.134 1.00 0.00 O ATOM 1138 CB GLN A 74 -22.858 -13.253 14.994 1.00 0.00 C ATOM 1139 CG GLN A 74 -23.310 -13.429 16.435 1.00 0.00 C ATOM 1140 CD GLN A 74 -22.919 -12.259 17.316 1.00 0.00 C ATOM 1141 OE1 GLN A 74 -23.769 -11.633 17.950 1.00 0.00 O ATOM 1142 NE2 GLN A 74 -21.627 -11.956 17.359 1.00 0.00 N ATOM 0 H GLN A 74 -22.791 -15.701 14.717 1.00 0.00 H new ATOM 0 HA GLN A 74 -24.789 -13.785 14.214 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -21.834 -13.614 14.896 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -22.846 -12.190 14.753 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -24.393 -13.552 16.460 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -22.876 -14.344 16.839 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -20.957 -12.502 16.817 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -21.305 -11.177 17.934 1.00 0.00 H new ATOM 1151 N PHE A 75 -22.559 -14.158 11.873 1.00 0.00 N ATOM 1152 CA PHE A 75 -22.193 -13.772 10.515 1.00 0.00 C ATOM 1153 C PHE A 75 -23.315 -14.102 9.535 1.00 0.00 C ATOM 1154 O PHE A 75 -23.599 -13.330 8.618 1.00 0.00 O ATOM 1155 CB PHE A 75 -20.905 -14.481 10.090 1.00 0.00 C ATOM 1156 CG PHE A 75 -20.375 -14.017 8.764 1.00 0.00 C ATOM 1157 CD1 PHE A 75 -19.743 -12.789 8.646 1.00 0.00 C ATOM 1158 CD2 PHE A 75 -20.508 -14.808 7.634 1.00 0.00 C ATOM 1159 CE1 PHE A 75 -19.254 -12.359 7.427 1.00 0.00 C ATOM 1160 CE2 PHE A 75 -20.021 -14.383 6.413 1.00 0.00 C ATOM 1161 CZ PHE A 75 -19.394 -13.157 6.309 1.00 0.00 C ATOM 0 H PHE A 75 -22.073 -14.984 12.222 1.00 0.00 H new ATOM 0 HA PHE A 75 -22.028 -12.695 10.502 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -20.143 -14.321 10.853 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -21.089 -15.554 10.043 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -19.631 -12.161 9.517 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -20.998 -15.768 7.709 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -18.763 -11.400 7.349 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -20.131 -15.009 5.540 1.00 0.00 H new ATOM 0 HZ PHE A 75 -19.014 -12.823 5.355 1.00 0.00 H new ATOM 1171 N ILE A 76 -23.948 -15.253 9.735 1.00 0.00 N ATOM 1172 CA ILE A 76 -25.039 -15.684 8.870 1.00 0.00 C ATOM 1173 C ILE A 76 -26.246 -14.763 9.007 1.00 0.00 C ATOM 1174 O ILE A 76 -26.780 -14.272 8.013 1.00 0.00 O ATOM 1175 CB ILE A 76 -25.471 -17.128 9.186 1.00 0.00 C ATOM 1176 CG1 ILE A 76 -24.284 -18.083 9.037 1.00 0.00 C ATOM 1177 CG2 ILE A 76 -26.615 -17.551 8.276 1.00 0.00 C ATOM 1178 CD1 ILE A 76 -24.547 -19.465 9.592 1.00 0.00 C ATOM 0 H ILE A 76 -23.724 -15.903 10.488 1.00 0.00 H new ATOM 0 HA ILE A 76 -24.666 -15.640 7.847 1.00 0.00 H new ATOM 0 HB ILE A 76 -25.820 -17.169 10.218 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -24.026 -18.167 7.981 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -23.418 -17.656 9.543 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -26.909 -18.574 8.512 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -27.465 -16.886 8.427 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -26.292 -17.497 7.236 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -23.663 -20.088 9.452 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -24.775 -19.393 10.655 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -25.392 -19.912 9.069 1.00 0.00 H new ATOM 1190 N ASN A 77 -26.670 -14.533 10.245 1.00 0.00 N ATOM 1191 CA ASN A 77 -27.815 -13.669 10.513 1.00 0.00 C ATOM 1192 C ASN A 77 -27.497 -12.219 10.157 1.00 0.00 C ATOM 1193 O ASN A 77 -28.304 -11.531 9.535 1.00 0.00 O ATOM 1194 CB ASN A 77 -28.222 -13.768 11.984 1.00 0.00 C ATOM 1195 CG ASN A 77 -29.390 -14.711 12.199 1.00 0.00 C ATOM 1196 OD1 ASN A 77 -30.509 -14.277 12.474 1.00 0.00 O ATOM 1197 ND2 ASN A 77 -29.134 -16.008 12.075 1.00 0.00 N ATOM 0 H ASN A 77 -26.239 -14.932 11.079 1.00 0.00 H new ATOM 0 HA ASN A 77 -28.645 -14.004 9.891 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -27.370 -14.110 12.572 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -28.486 -12.777 12.352 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -29.880 -16.690 12.209 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -28.191 -16.322 11.846 1.00 0.00 H new