USER MOD reduce.3.24.130724 H: found=0, std=0, add=688, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 686 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 45 THR OG1 : rot 25:sc= -0.311 USER MOD Set 1.2: A 50 HIS : no HD1:sc= -3.62! C(o=-3.9!,f=-7.2!) USER MOD Set 2.1: A 33 THR OG1 : rot 150:sc= 0 USER MOD Set 2.2: A 35 SER OG : rot 150:sc= 0.0226 USER MOD Set 2.3: A 63 THR OG1 : rot -155:sc= -1.71! USER MOD Single : A 1 SER N :NH3+ -168:sc= -0.0243 (180deg=-0.182) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -0.413 X(o=-0.41,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -1.13 K(o=-1.1,f=-2.7) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 78:sc= 1.02 USER MOD Single : A 34 ASN : amide:sc= -0.0254 K(o=-0.025,f=-1.7!) USER MOD Single : A 36 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00436) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0.0986 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= -1.53! USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -161:sc= -3.49! (180deg=-4.23!) USER MOD Single : A 71 ASN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -0.962 -22.758 -23.376 1.00 0.00 N ATOM 2 CA SER A 1 -0.470 -24.130 -23.681 1.00 0.00 C ATOM 3 C SER A 1 -0.690 -25.033 -22.466 1.00 0.00 C ATOM 4 O SER A 1 -0.949 -26.213 -22.596 1.00 0.00 O ATOM 5 CB SER A 1 1.024 -24.074 -24.010 1.00 0.00 C ATOM 6 OG SER A 1 1.203 -23.529 -25.309 1.00 0.00 O ATOM 0 H1 SER A 1 -1.003 -22.201 -24.253 1.00 0.00 H new ATOM 0 H2 SER A 1 -1.912 -22.815 -22.958 1.00 0.00 H new ATOM 0 H3 SER A 1 -0.315 -22.299 -22.704 1.00 0.00 H new ATOM 0 HA SER A 1 -1.016 -24.530 -24.535 1.00 0.00 H new ATOM 0 HB2 SER A 1 1.547 -23.464 -23.273 1.00 0.00 H new ATOM 0 HB3 SER A 1 1.456 -25.074 -23.961 1.00 0.00 H new ATOM 0 HG SER A 1 2.159 -23.491 -25.519 1.00 0.00 H new ATOM 14 N MET A 2 -0.591 -24.488 -21.284 1.00 0.00 N ATOM 15 CA MET A 2 -0.796 -25.316 -20.063 1.00 0.00 C ATOM 16 C MET A 2 -1.859 -24.663 -19.177 1.00 0.00 C ATOM 17 O MET A 2 -2.188 -23.504 -19.337 1.00 0.00 O ATOM 18 CB MET A 2 0.520 -25.419 -19.289 1.00 0.00 C ATOM 19 CG MET A 2 1.546 -26.185 -20.125 1.00 0.00 C ATOM 20 SD MET A 2 3.056 -26.426 -19.157 1.00 0.00 S ATOM 21 CE MET A 2 4.039 -27.207 -20.459 1.00 0.00 C ATOM 0 H MET A 2 -0.377 -23.506 -21.112 1.00 0.00 H new ATOM 0 HA MET A 2 -1.126 -26.314 -20.352 1.00 0.00 H new ATOM 0 HB2 MET A 2 0.896 -24.423 -19.056 1.00 0.00 H new ATOM 0 HB3 MET A 2 0.356 -25.928 -18.339 1.00 0.00 H new ATOM 0 HG2 MET A 2 1.137 -27.149 -20.427 1.00 0.00 H new ATOM 0 HG3 MET A 2 1.771 -25.634 -21.038 1.00 0.00 H new ATOM 0 HE1 MET A 2 5.030 -27.446 -20.073 1.00 0.00 H new ATOM 0 HE2 MET A 2 3.547 -28.123 -20.787 1.00 0.00 H new ATOM 0 HE3 MET A 2 4.133 -26.524 -21.303 1.00 0.00 H new ATOM 31 N GLY A 3 -2.400 -25.397 -18.244 1.00 0.00 N ATOM 32 CA GLY A 3 -3.442 -24.817 -17.349 1.00 0.00 C ATOM 33 C GLY A 3 -4.821 -25.010 -17.981 1.00 0.00 C ATOM 34 O GLY A 3 -5.785 -24.378 -17.596 1.00 0.00 O ATOM 0 H GLY A 3 -2.166 -26.373 -18.062 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -3.407 -25.299 -16.372 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -3.249 -23.756 -17.188 1.00 0.00 H new ATOM 38 N GLY A 4 -4.924 -25.877 -18.951 1.00 0.00 N ATOM 39 CA GLY A 4 -6.242 -26.109 -19.606 1.00 0.00 C ATOM 40 C GLY A 4 -7.260 -26.563 -18.559 1.00 0.00 C ATOM 41 O GLY A 4 -8.443 -26.320 -18.683 1.00 0.00 O ATOM 0 H GLY A 4 -4.153 -26.434 -19.318 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.585 -25.195 -20.090 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.145 -26.865 -20.385 1.00 0.00 H new ATOM 45 N GLN A 5 -6.809 -27.220 -17.525 1.00 0.00 N ATOM 46 CA GLN A 5 -7.750 -27.690 -16.471 1.00 0.00 C ATOM 47 C GLN A 5 -7.487 -26.922 -15.174 1.00 0.00 C ATOM 48 O GLN A 5 -6.362 -26.601 -14.849 1.00 0.00 O ATOM 49 CB GLN A 5 -7.543 -29.185 -16.230 1.00 0.00 C ATOM 50 CG GLN A 5 -7.741 -29.946 -17.542 1.00 0.00 C ATOM 51 CD GLN A 5 -7.922 -31.437 -17.246 1.00 0.00 C ATOM 52 OE1 GLN A 5 -8.615 -32.131 -17.961 1.00 0.00 O ATOM 53 NE2 GLN A 5 -7.321 -31.961 -16.212 1.00 0.00 N ATOM 0 H GLN A 5 -5.828 -27.451 -17.365 1.00 0.00 H new ATOM 0 HA GLN A 5 -8.776 -27.515 -16.796 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -6.541 -29.366 -15.840 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -8.247 -29.544 -15.479 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -8.613 -29.561 -18.070 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -6.881 -29.796 -18.195 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -6.739 -31.378 -15.611 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -7.434 -32.953 -16.005 1.00 0.00 H new ATOM 62 N LYS A 6 -8.518 -26.624 -14.431 1.00 0.00 N ATOM 63 CA LYS A 6 -8.327 -25.877 -13.156 1.00 0.00 C ATOM 64 C LYS A 6 -8.994 -26.641 -12.011 1.00 0.00 C ATOM 65 O LYS A 6 -10.001 -27.296 -12.193 1.00 0.00 O ATOM 66 CB LYS A 6 -8.958 -24.489 -13.279 1.00 0.00 C ATOM 67 CG LYS A 6 -8.285 -23.721 -14.418 1.00 0.00 C ATOM 68 CD LYS A 6 -8.726 -22.257 -14.377 1.00 0.00 C ATOM 69 CE LYS A 6 -10.226 -22.170 -14.662 1.00 0.00 C ATOM 70 NZ LYS A 6 -10.755 -20.874 -14.150 1.00 0.00 N ATOM 0 H LYS A 6 -9.484 -26.866 -14.652 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.261 -25.775 -12.951 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -10.027 -24.580 -13.470 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.846 -23.943 -12.342 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -7.201 -23.788 -14.325 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.551 -24.165 -15.377 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.505 -21.826 -13.400 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.170 -21.678 -15.114 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -10.409 -22.252 -15.733 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -10.746 -23.001 -14.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -11.775 -20.815 -14.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -10.593 -20.814 -13.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -10.266 -20.088 -14.624 1.00 0.00 H new ATOM 84 N ILE A 7 -8.441 -26.562 -10.830 1.00 0.00 N ATOM 85 CA ILE A 7 -9.046 -27.282 -9.674 1.00 0.00 C ATOM 86 C ILE A 7 -9.573 -26.267 -8.658 1.00 0.00 C ATOM 87 O ILE A 7 -8.930 -25.279 -8.364 1.00 0.00 O ATOM 88 CB ILE A 7 -7.985 -28.164 -9.012 1.00 0.00 C ATOM 89 CG1 ILE A 7 -7.434 -29.158 -10.037 1.00 0.00 C ATOM 90 CG2 ILE A 7 -8.616 -28.931 -7.847 1.00 0.00 C ATOM 91 CD1 ILE A 7 -6.245 -29.908 -9.431 1.00 0.00 C ATOM 0 H ILE A 7 -7.597 -26.030 -10.617 1.00 0.00 H new ATOM 0 HA ILE A 7 -9.870 -27.904 -10.024 1.00 0.00 H new ATOM 0 HB ILE A 7 -7.173 -27.539 -8.640 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -8.212 -29.863 -10.330 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -7.124 -28.632 -10.940 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -7.862 -29.560 -7.374 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -9.009 -28.224 -7.116 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -9.427 -29.556 -8.220 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -5.852 -30.616 -10.160 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -5.466 -29.196 -9.160 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -6.570 -30.447 -8.541 1.00 0.00 H new ATOM 103 N ARG A 8 -10.738 -26.502 -8.121 1.00 0.00 N ATOM 104 CA ARG A 8 -11.306 -25.550 -7.125 1.00 0.00 C ATOM 105 C ARG A 8 -11.605 -26.293 -5.821 1.00 0.00 C ATOM 106 O ARG A 8 -12.136 -27.386 -5.826 1.00 0.00 O ATOM 107 CB ARG A 8 -12.599 -24.947 -7.677 1.00 0.00 C ATOM 108 CG ARG A 8 -12.281 -24.096 -8.908 1.00 0.00 C ATOM 109 CD ARG A 8 -13.550 -23.382 -9.376 1.00 0.00 C ATOM 110 NE ARG A 8 -13.313 -22.775 -10.716 1.00 0.00 N ATOM 111 CZ ARG A 8 -14.325 -22.452 -11.475 1.00 0.00 C ATOM 112 NH1 ARG A 8 -15.495 -22.228 -10.941 1.00 0.00 N ATOM 113 NH2 ARG A 8 -14.167 -22.352 -12.766 1.00 0.00 N ATOM 0 H ARG A 8 -11.322 -27.312 -8.329 1.00 0.00 H new ATOM 0 HA ARG A 8 -10.587 -24.754 -6.932 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -13.299 -25.740 -7.941 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -13.082 -24.336 -6.915 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -11.508 -23.366 -8.669 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -11.889 -24.725 -9.707 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -14.380 -24.087 -9.426 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -13.831 -22.610 -8.660 1.00 0.00 H new ATOM 0 HE ARG A 8 -12.360 -22.612 -11.040 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -15.618 -22.305 -9.931 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -16.286 -21.976 -11.533 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -13.253 -22.526 -13.183 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -14.958 -22.100 -13.359 1.00 0.00 H new ATOM 127 N ILE A 9 -11.269 -25.708 -4.704 1.00 0.00 N ATOM 128 CA ILE A 9 -11.534 -26.381 -3.401 1.00 0.00 C ATOM 129 C ILE A 9 -12.564 -25.573 -2.609 1.00 0.00 C ATOM 130 O ILE A 9 -12.475 -24.366 -2.509 1.00 0.00 O ATOM 131 CB ILE A 9 -10.232 -26.473 -2.601 1.00 0.00 C ATOM 132 CG1 ILE A 9 -9.182 -27.226 -3.421 1.00 0.00 C ATOM 133 CG2 ILE A 9 -10.490 -27.221 -1.292 1.00 0.00 C ATOM 134 CD1 ILE A 9 -7.851 -27.228 -2.665 1.00 0.00 C ATOM 0 H ILE A 9 -10.823 -24.793 -4.637 1.00 0.00 H new ATOM 0 HA ILE A 9 -11.921 -27.384 -3.582 1.00 0.00 H new ATOM 0 HB ILE A 9 -9.869 -25.469 -2.380 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.511 -28.249 -3.602 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.058 -26.754 -4.396 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.563 -27.287 -0.722 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.238 -26.685 -0.708 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -10.853 -28.225 -1.512 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -7.102 -27.764 -3.248 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.521 -26.201 -2.507 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -7.981 -27.720 -1.701 1.00 0.00 H new ATOM 146 N LYS A 10 -13.541 -26.230 -2.045 1.00 0.00 N ATOM 147 CA LYS A 10 -14.576 -25.499 -1.261 1.00 0.00 C ATOM 148 C LYS A 10 -14.342 -25.729 0.234 1.00 0.00 C ATOM 149 O LYS A 10 -14.211 -26.850 0.686 1.00 0.00 O ATOM 150 CB LYS A 10 -15.964 -26.012 -1.645 1.00 0.00 C ATOM 151 CG LYS A 10 -16.347 -25.463 -3.020 1.00 0.00 C ATOM 152 CD LYS A 10 -17.756 -25.934 -3.384 1.00 0.00 C ATOM 153 CE LYS A 10 -18.043 -25.601 -4.849 1.00 0.00 C ATOM 154 NZ LYS A 10 -19.459 -25.157 -4.989 1.00 0.00 N ATOM 0 H LYS A 10 -13.667 -27.241 -2.093 1.00 0.00 H new ATOM 0 HA LYS A 10 -14.510 -24.433 -1.479 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -15.969 -27.102 -1.662 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.697 -25.702 -0.900 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -16.307 -24.374 -3.012 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -15.633 -25.803 -3.771 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -17.846 -27.008 -3.220 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -18.490 -25.451 -2.740 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -17.369 -24.817 -5.194 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -17.861 -26.475 -5.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -19.655 -24.930 -5.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -20.094 -25.919 -4.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -19.617 -24.312 -4.404 1.00 0.00 H new ATOM 168 N LEU A 11 -14.288 -24.678 1.004 1.00 0.00 N ATOM 169 CA LEU A 11 -14.063 -24.838 2.468 1.00 0.00 C ATOM 170 C LEU A 11 -15.321 -24.416 3.229 1.00 0.00 C ATOM 171 O LEU A 11 -15.907 -23.387 2.956 1.00 0.00 O ATOM 172 CB LEU A 11 -12.886 -23.961 2.902 1.00 0.00 C ATOM 173 CG LEU A 11 -11.632 -24.369 2.125 1.00 0.00 C ATOM 174 CD1 LEU A 11 -11.736 -23.863 0.685 1.00 0.00 C ATOM 175 CD2 LEU A 11 -10.398 -23.758 2.793 1.00 0.00 C ATOM 0 H LEU A 11 -14.390 -23.715 0.683 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.840 -25.882 2.688 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.114 -22.911 2.719 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -12.714 -24.068 3.973 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.544 -25.455 2.122 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -10.843 -24.154 0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -12.615 -24.298 0.209 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.824 -22.777 0.687 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -9.504 -24.048 2.241 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -10.486 -22.672 2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -10.323 -24.119 3.819 1.00 0.00 H new ATOM 187 N LYS A 12 -15.742 -25.202 4.181 1.00 0.00 N ATOM 188 CA LYS A 12 -16.961 -24.846 4.959 1.00 0.00 C ATOM 189 C LYS A 12 -16.648 -24.912 6.455 1.00 0.00 C ATOM 190 O LYS A 12 -15.976 -25.812 6.919 1.00 0.00 O ATOM 191 CB LYS A 12 -18.084 -25.830 4.629 1.00 0.00 C ATOM 192 CG LYS A 12 -18.433 -25.726 3.143 1.00 0.00 C ATOM 193 CD LYS A 12 -19.634 -26.623 2.838 1.00 0.00 C ATOM 194 CE LYS A 12 -19.903 -26.620 1.331 1.00 0.00 C ATOM 195 NZ LYS A 12 -21.255 -27.188 1.067 1.00 0.00 N ATOM 0 H LYS A 12 -15.294 -26.077 4.454 1.00 0.00 H new ATOM 0 HA LYS A 12 -17.276 -23.836 4.697 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -17.774 -26.847 4.870 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -18.963 -25.612 5.236 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -18.662 -24.692 2.884 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -17.579 -26.025 2.536 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -19.439 -27.639 3.181 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -20.513 -26.268 3.376 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -19.841 -25.604 0.942 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -19.143 -27.206 0.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -21.438 -27.186 0.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -21.298 -28.164 1.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -21.974 -26.611 1.548 1.00 0.00 H new ATOM 209 N ALA A 13 -17.129 -23.967 7.214 1.00 0.00 N ATOM 210 CA ALA A 13 -16.858 -23.977 8.679 1.00 0.00 C ATOM 211 C ALA A 13 -17.735 -22.929 9.366 1.00 0.00 C ATOM 212 O ALA A 13 -18.044 -21.898 8.803 1.00 0.00 O ATOM 213 CB ALA A 13 -15.384 -23.653 8.928 1.00 0.00 C ATOM 0 H ALA A 13 -17.698 -23.188 6.883 1.00 0.00 H new ATOM 0 HA ALA A 13 -17.085 -24.963 9.084 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -15.186 -23.660 10.000 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -14.759 -24.400 8.438 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -15.155 -22.667 8.523 1.00 0.00 H new ATOM 219 N TYR A 14 -18.139 -23.184 10.580 1.00 0.00 N ATOM 220 CA TYR A 14 -18.996 -22.203 11.303 1.00 0.00 C ATOM 221 C TYR A 14 -18.236 -20.885 11.467 1.00 0.00 C ATOM 222 O TYR A 14 -18.802 -19.815 11.366 1.00 0.00 O ATOM 223 CB TYR A 14 -19.357 -22.759 12.682 1.00 0.00 C ATOM 224 CG TYR A 14 -20.192 -24.007 12.519 1.00 0.00 C ATOM 225 CD1 TYR A 14 -21.562 -23.903 12.252 1.00 0.00 C ATOM 226 CD2 TYR A 14 -19.594 -25.268 12.636 1.00 0.00 C ATOM 227 CE1 TYR A 14 -22.335 -25.060 12.101 1.00 0.00 C ATOM 228 CE2 TYR A 14 -20.368 -26.425 12.485 1.00 0.00 C ATOM 229 CZ TYR A 14 -21.738 -26.321 12.217 1.00 0.00 C ATOM 230 OH TYR A 14 -22.501 -27.462 12.068 1.00 0.00 O ATOM 0 H TYR A 14 -17.912 -24.030 11.103 1.00 0.00 H new ATOM 0 HA TYR A 14 -19.908 -22.028 10.732 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -18.450 -22.986 13.243 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -19.908 -22.012 13.254 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -22.023 -22.930 12.163 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -18.537 -25.348 12.842 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -23.392 -24.980 11.895 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -19.908 -27.398 12.575 1.00 0.00 H new ATOM 0 HH TYR A 14 -21.932 -28.252 12.178 1.00 0.00 H new ATOM 240 N ASP A 15 -16.958 -20.953 11.721 1.00 0.00 N ATOM 241 CA ASP A 15 -16.166 -19.704 11.892 1.00 0.00 C ATOM 242 C ASP A 15 -15.464 -19.358 10.577 1.00 0.00 C ATOM 243 O ASP A 15 -14.741 -20.160 10.018 1.00 0.00 O ATOM 244 CB ASP A 15 -15.119 -19.909 12.989 1.00 0.00 C ATOM 245 CG ASP A 15 -15.820 -20.055 14.342 1.00 0.00 C ATOM 246 OD1 ASP A 15 -16.999 -19.754 14.411 1.00 0.00 O ATOM 247 OD2 ASP A 15 -15.164 -20.467 15.284 1.00 0.00 O ATOM 0 H ASP A 15 -16.429 -21.820 11.817 1.00 0.00 H new ATOM 0 HA ASP A 15 -16.833 -18.889 12.173 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -14.524 -20.798 12.778 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -14.431 -19.064 13.013 1.00 0.00 H new ATOM 252 N HIS A 16 -15.671 -18.170 10.077 1.00 0.00 N ATOM 253 CA HIS A 16 -15.016 -17.775 8.799 1.00 0.00 C ATOM 254 C HIS A 16 -13.517 -17.579 9.035 1.00 0.00 C ATOM 255 O HIS A 16 -12.710 -17.762 8.145 1.00 0.00 O ATOM 256 CB HIS A 16 -15.628 -16.466 8.296 1.00 0.00 C ATOM 257 CG HIS A 16 -15.272 -15.351 9.241 1.00 0.00 C ATOM 258 ND1 HIS A 16 -15.926 -15.169 10.449 1.00 0.00 N ATOM 259 CD2 HIS A 16 -14.332 -14.352 9.169 1.00 0.00 C ATOM 260 CE1 HIS A 16 -15.377 -14.098 11.050 1.00 0.00 C ATOM 261 NE2 HIS A 16 -14.401 -13.562 10.313 1.00 0.00 N ATOM 0 H HIS A 16 -16.265 -17.456 10.499 1.00 0.00 H new ATOM 0 HA HIS A 16 -15.168 -18.557 8.055 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -15.259 -16.241 7.295 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -16.711 -16.563 8.222 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -13.644 -14.202 8.350 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -15.688 -13.718 12.012 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -13.829 -12.748 10.540 1.00 0.00 H new ATOM 269 N GLU A 17 -13.138 -17.208 10.227 1.00 0.00 N ATOM 270 CA GLU A 17 -11.690 -17.002 10.518 1.00 0.00 C ATOM 271 C GLU A 17 -10.945 -18.327 10.354 1.00 0.00 C ATOM 272 O GLU A 17 -9.827 -18.367 9.880 1.00 0.00 O ATOM 273 CB GLU A 17 -11.525 -16.498 11.952 1.00 0.00 C ATOM 274 CG GLU A 17 -12.266 -15.169 12.116 1.00 0.00 C ATOM 275 CD GLU A 17 -12.027 -14.622 13.524 1.00 0.00 C ATOM 276 OE1 GLU A 17 -11.492 -15.355 14.341 1.00 0.00 O ATOM 277 OE2 GLU A 17 -12.382 -13.480 13.763 1.00 0.00 O ATOM 0 H GLU A 17 -13.767 -17.039 11.012 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.281 -16.266 9.826 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.917 -17.234 12.654 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.468 -16.368 12.183 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.918 -14.452 11.372 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -13.333 -15.312 11.946 1.00 0.00 H new ATOM 284 N LEU A 18 -11.554 -19.414 10.742 1.00 0.00 N ATOM 285 CA LEU A 18 -10.880 -20.736 10.608 1.00 0.00 C ATOM 286 C LEU A 18 -10.690 -21.062 9.125 1.00 0.00 C ATOM 287 O LEU A 18 -9.672 -21.588 8.721 1.00 0.00 O ATOM 288 CB LEU A 18 -11.742 -21.816 11.262 1.00 0.00 C ATOM 289 CG LEU A 18 -11.939 -21.484 12.742 1.00 0.00 C ATOM 290 CD1 LEU A 18 -12.650 -22.648 13.435 1.00 0.00 C ATOM 291 CD2 LEU A 18 -10.577 -21.254 13.400 1.00 0.00 C ATOM 0 H LEU A 18 -12.490 -19.443 11.146 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.908 -20.701 11.100 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.708 -21.879 10.761 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.265 -22.790 11.157 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.543 -20.582 12.834 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -12.791 -22.412 14.490 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -13.621 -22.812 12.967 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -12.046 -23.550 13.342 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -10.718 -21.017 14.455 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -9.972 -22.156 13.308 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -10.070 -20.425 12.907 1.00 0.00 H new ATOM 303 N LEU A 19 -11.663 -20.754 8.311 1.00 0.00 N ATOM 304 CA LEU A 19 -11.536 -21.046 6.856 1.00 0.00 C ATOM 305 C LEU A 19 -10.447 -20.159 6.251 1.00 0.00 C ATOM 306 O LEU A 19 -9.709 -20.572 5.378 1.00 0.00 O ATOM 307 CB LEU A 19 -12.868 -20.764 6.161 1.00 0.00 C ATOM 308 CG LEU A 19 -13.964 -21.631 6.786 1.00 0.00 C ATOM 309 CD1 LEU A 19 -15.275 -21.423 6.025 1.00 0.00 C ATOM 310 CD2 LEU A 19 -13.556 -23.104 6.705 1.00 0.00 C ATOM 0 H LEU A 19 -12.539 -20.313 8.591 1.00 0.00 H new ATOM 0 HA LEU A 19 -11.269 -22.094 6.718 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -13.125 -19.709 6.258 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -12.786 -20.976 5.095 1.00 0.00 H new ATOM 0 HG LEU A 19 -14.101 -21.348 7.830 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -16.056 -22.040 6.470 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -15.566 -20.374 6.081 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -15.139 -21.706 4.981 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -14.336 -23.722 7.150 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -13.420 -23.387 5.661 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -12.622 -23.253 7.246 1.00 0.00 H new ATOM 322 N ASP A 20 -10.339 -18.941 6.706 1.00 0.00 N ATOM 323 CA ASP A 20 -9.296 -18.029 6.157 1.00 0.00 C ATOM 324 C ASP A 20 -7.911 -18.617 6.430 1.00 0.00 C ATOM 325 O ASP A 20 -7.047 -18.619 5.575 1.00 0.00 O ATOM 326 CB ASP A 20 -9.410 -16.660 6.827 1.00 0.00 C ATOM 327 CG ASP A 20 -8.540 -15.649 6.076 1.00 0.00 C ATOM 328 OD1 ASP A 20 -7.975 -16.024 5.062 1.00 0.00 O ATOM 329 OD2 ASP A 20 -8.453 -14.521 6.529 1.00 0.00 O ATOM 0 H ASP A 20 -10.928 -18.538 7.434 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.439 -17.919 5.082 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -10.449 -16.330 6.830 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.094 -16.725 7.868 1.00 0.00 H new ATOM 334 N GLU A 21 -7.692 -19.118 7.615 1.00 0.00 N ATOM 335 CA GLU A 21 -6.361 -19.705 7.940 1.00 0.00 C ATOM 336 C GLU A 21 -6.149 -20.975 7.113 1.00 0.00 C ATOM 337 O GLU A 21 -5.070 -21.231 6.618 1.00 0.00 O ATOM 338 CB GLU A 21 -6.309 -20.052 9.430 1.00 0.00 C ATOM 339 CG GLU A 21 -6.408 -18.769 10.256 1.00 0.00 C ATOM 340 CD GLU A 21 -6.277 -19.108 11.742 1.00 0.00 C ATOM 341 OE1 GLU A 21 -6.281 -20.284 12.064 1.00 0.00 O ATOM 342 OE2 GLU A 21 -6.173 -18.184 12.534 1.00 0.00 O ATOM 0 H GLU A 21 -8.376 -19.146 8.371 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.577 -18.984 7.706 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.126 -20.726 9.686 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.381 -20.575 9.660 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.624 -18.072 9.960 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.361 -18.275 10.067 1.00 0.00 H new ATOM 349 N SER A 22 -7.171 -21.772 6.960 1.00 0.00 N ATOM 350 CA SER A 22 -7.027 -23.024 6.165 1.00 0.00 C ATOM 351 C SER A 22 -6.739 -22.670 4.704 1.00 0.00 C ATOM 352 O SER A 22 -5.915 -23.286 4.057 1.00 0.00 O ATOM 353 CB SER A 22 -8.323 -23.833 6.248 1.00 0.00 C ATOM 354 OG SER A 22 -8.127 -25.103 5.643 1.00 0.00 O ATOM 0 H SER A 22 -8.099 -21.610 7.351 1.00 0.00 H new ATOM 0 HA SER A 22 -6.203 -23.616 6.565 1.00 0.00 H new ATOM 0 HB2 SER A 22 -8.621 -23.956 7.289 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.130 -23.300 5.746 1.00 0.00 H new ATOM 0 HG SER A 22 -8.956 -25.623 5.697 1.00 0.00 H new ATOM 360 N ALA A 23 -7.410 -21.681 4.179 1.00 0.00 N ATOM 361 CA ALA A 23 -7.174 -21.289 2.762 1.00 0.00 C ATOM 362 C ALA A 23 -5.778 -20.679 2.628 1.00 0.00 C ATOM 363 O ALA A 23 -5.066 -20.934 1.676 1.00 0.00 O ATOM 364 CB ALA A 23 -8.224 -20.261 2.335 1.00 0.00 C ATOM 0 H ALA A 23 -8.112 -21.128 4.671 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.248 -22.170 2.124 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.051 -19.974 1.298 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -9.219 -20.696 2.430 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -8.151 -19.380 2.972 1.00 0.00 H new ATOM 370 N LYS A 24 -5.379 -19.873 3.575 1.00 0.00 N ATOM 371 CA LYS A 24 -4.029 -19.248 3.500 1.00 0.00 C ATOM 372 C LYS A 24 -2.962 -20.344 3.446 1.00 0.00 C ATOM 373 O LYS A 24 -2.070 -20.315 2.622 1.00 0.00 O ATOM 374 CB LYS A 24 -3.802 -18.376 4.737 1.00 0.00 C ATOM 375 CG LYS A 24 -2.479 -17.622 4.595 1.00 0.00 C ATOM 376 CD LYS A 24 -2.226 -16.796 5.857 1.00 0.00 C ATOM 377 CE LYS A 24 -0.968 -15.945 5.667 1.00 0.00 C ATOM 378 NZ LYS A 24 -1.331 -14.501 5.716 1.00 0.00 N ATOM 0 H LYS A 24 -5.929 -19.621 4.396 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.963 -18.632 2.603 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.624 -17.670 4.853 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.785 -18.996 5.634 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -1.662 -18.326 4.438 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.511 -16.971 3.721 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -3.083 -16.155 6.063 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -2.106 -17.454 6.717 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -0.240 -16.174 6.445 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.498 -16.180 4.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.476 -13.923 5.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -2.010 -14.288 4.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.761 -14.282 6.637 1.00 0.00 H new ATOM 392 N LYS A 25 -3.048 -21.312 4.318 1.00 0.00 N ATOM 393 CA LYS A 25 -2.040 -22.408 4.315 1.00 0.00 C ATOM 394 C LYS A 25 -2.052 -23.109 2.954 1.00 0.00 C ATOM 395 O LYS A 25 -1.020 -23.387 2.379 1.00 0.00 O ATOM 396 CB LYS A 25 -2.382 -23.419 5.412 1.00 0.00 C ATOM 397 CG LYS A 25 -2.233 -22.753 6.782 1.00 0.00 C ATOM 398 CD LYS A 25 -2.420 -23.801 7.881 1.00 0.00 C ATOM 399 CE LYS A 25 -2.392 -23.116 9.250 1.00 0.00 C ATOM 400 NZ LYS A 25 -1.022 -23.215 9.828 1.00 0.00 N ATOM 0 H LYS A 25 -3.773 -21.390 5.032 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.050 -21.991 4.501 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -3.401 -23.783 5.281 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.723 -24.284 5.343 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.250 -22.291 6.869 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -2.970 -21.958 6.894 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -3.367 -24.323 7.743 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -1.631 -24.551 7.821 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -2.682 -22.070 9.151 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -3.115 -23.585 9.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -1.003 -22.750 10.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -0.763 -24.216 9.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.343 -22.748 9.193 1.00 0.00 H new ATOM 414 N ILE A 26 -3.215 -23.398 2.437 1.00 0.00 N ATOM 415 CA ILE A 26 -3.294 -24.079 1.114 1.00 0.00 C ATOM 416 C ILE A 26 -2.683 -23.178 0.039 1.00 0.00 C ATOM 417 O ILE A 26 -1.897 -23.615 -0.778 1.00 0.00 O ATOM 418 CB ILE A 26 -4.758 -24.359 0.771 1.00 0.00 C ATOM 419 CG1 ILE A 26 -5.365 -25.278 1.833 1.00 0.00 C ATOM 420 CG2 ILE A 26 -4.841 -25.038 -0.597 1.00 0.00 C ATOM 421 CD1 ILE A 26 -6.860 -25.455 1.561 1.00 0.00 C ATOM 0 H ILE A 26 -4.114 -23.192 2.874 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.744 -25.019 1.157 1.00 0.00 H new ATOM 0 HB ILE A 26 -5.310 -23.419 0.745 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.865 -26.246 1.820 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -5.213 -24.854 2.826 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -5.884 -25.238 -0.841 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -4.409 -24.384 -1.355 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.288 -25.977 -0.571 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -7.292 -26.110 2.318 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -7.354 -24.484 1.596 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -7.000 -25.898 0.575 1.00 0.00 H new ATOM 433 N VAL A 27 -3.036 -21.922 0.034 1.00 0.00 N ATOM 434 CA VAL A 27 -2.475 -20.994 -0.987 1.00 0.00 C ATOM 435 C VAL A 27 -0.954 -20.932 -0.838 1.00 0.00 C ATOM 436 O VAL A 27 -0.220 -21.051 -1.800 1.00 0.00 O ATOM 437 CB VAL A 27 -3.065 -19.597 -0.785 1.00 0.00 C ATOM 438 CG1 VAL A 27 -2.359 -18.606 -1.712 1.00 0.00 C ATOM 439 CG2 VAL A 27 -4.560 -19.622 -1.109 1.00 0.00 C ATOM 0 H VAL A 27 -3.689 -21.498 0.693 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.728 -21.354 -1.984 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.923 -19.290 0.251 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.779 -17.611 -1.568 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.294 -18.587 -1.481 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.500 -18.913 -2.748 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.980 -18.627 -0.965 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.703 -19.930 -2.145 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.064 -20.328 -0.448 1.00 0.00 H new ATOM 449 N GLU A 28 -0.472 -20.746 0.360 1.00 0.00 N ATOM 450 CA GLU A 28 1.001 -20.676 0.570 1.00 0.00 C ATOM 451 C GLU A 28 1.645 -21.984 0.106 1.00 0.00 C ATOM 452 O GLU A 28 2.622 -21.983 -0.618 1.00 0.00 O ATOM 453 CB GLU A 28 1.295 -20.463 2.056 1.00 0.00 C ATOM 454 CG GLU A 28 2.793 -20.216 2.249 1.00 0.00 C ATOM 455 CD GLU A 28 3.098 -20.064 3.741 1.00 0.00 C ATOM 456 OE1 GLU A 28 2.169 -20.158 4.527 1.00 0.00 O ATOM 457 OE2 GLU A 28 4.253 -19.856 4.071 1.00 0.00 O ATOM 0 H GLU A 28 -1.036 -20.639 1.203 1.00 0.00 H new ATOM 0 HA GLU A 28 1.410 -19.845 -0.004 1.00 0.00 H new ATOM 0 HB2 GLU A 28 0.724 -19.614 2.433 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.983 -21.337 2.628 1.00 0.00 H new ATOM 0 HG2 GLU A 28 3.366 -21.045 1.833 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.096 -19.317 1.712 1.00 0.00 H new ATOM 464 N VAL A 29 1.107 -23.100 0.514 1.00 0.00 N ATOM 465 CA VAL A 29 1.690 -24.406 0.095 1.00 0.00 C ATOM 466 C VAL A 29 1.452 -24.613 -1.401 1.00 0.00 C ATOM 467 O VAL A 29 2.325 -25.054 -2.122 1.00 0.00 O ATOM 468 CB VAL A 29 1.022 -25.538 0.880 1.00 0.00 C ATOM 469 CG1 VAL A 29 1.727 -26.859 0.569 1.00 0.00 C ATOM 470 CG2 VAL A 29 1.122 -25.247 2.379 1.00 0.00 C ATOM 0 H VAL A 29 0.289 -23.164 1.120 1.00 0.00 H new ATOM 0 HA VAL A 29 2.761 -24.408 0.296 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.027 -25.610 0.593 1.00 0.00 H new ATOM 0 HG11 VAL A 29 1.252 -27.665 1.128 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.656 -27.067 -0.499 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.776 -26.788 0.856 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.647 -26.053 2.939 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.171 -25.175 2.667 1.00 0.00 H new ATOM 0 HG23 VAL A 29 0.620 -24.305 2.601 1.00 0.00 H new ATOM 480 N ALA A 30 0.278 -24.297 -1.875 1.00 0.00 N ATOM 481 CA ALA A 30 -0.014 -24.475 -3.325 1.00 0.00 C ATOM 482 C ALA A 30 0.882 -23.543 -4.143 1.00 0.00 C ATOM 483 O ALA A 30 1.495 -23.947 -5.112 1.00 0.00 O ATOM 484 CB ALA A 30 -1.481 -24.137 -3.595 1.00 0.00 C ATOM 0 H ALA A 30 -0.492 -23.923 -1.320 1.00 0.00 H new ATOM 0 HA ALA A 30 0.179 -25.509 -3.610 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -1.695 -24.267 -4.656 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -2.120 -24.800 -3.012 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -1.675 -23.103 -3.310 1.00 0.00 H new ATOM 490 N LYS A 31 0.963 -22.298 -3.762 1.00 0.00 N ATOM 491 CA LYS A 31 1.818 -21.340 -4.518 1.00 0.00 C ATOM 492 C LYS A 31 3.239 -21.898 -4.624 1.00 0.00 C ATOM 493 O LYS A 31 3.880 -21.800 -5.651 1.00 0.00 O ATOM 494 CB LYS A 31 1.850 -19.998 -3.785 1.00 0.00 C ATOM 495 CG LYS A 31 2.412 -18.921 -4.716 1.00 0.00 C ATOM 496 CD LYS A 31 2.365 -17.564 -4.012 1.00 0.00 C ATOM 497 CE LYS A 31 3.244 -17.607 -2.760 1.00 0.00 C ATOM 498 NZ LYS A 31 2.390 -17.452 -1.549 1.00 0.00 N ATOM 0 H LYS A 31 0.474 -21.902 -2.959 1.00 0.00 H new ATOM 0 HA LYS A 31 1.408 -21.198 -5.518 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.846 -19.725 -3.460 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.465 -20.076 -2.888 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.438 -19.164 -4.993 1.00 0.00 H new ATOM 0 HG3 LYS A 31 1.833 -18.884 -5.639 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.712 -16.781 -4.686 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.338 -17.319 -3.740 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.788 -18.551 -2.716 1.00 0.00 H new ATOM 0 HE3 LYS A 31 3.988 -16.812 -2.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.986 -17.481 -0.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.890 -16.541 -1.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 1.696 -18.226 -1.512 1.00 0.00 H new ATOM 512 N SER A 32 3.737 -22.483 -3.569 1.00 0.00 N ATOM 513 CA SER A 32 5.117 -23.045 -3.611 1.00 0.00 C ATOM 514 C SER A 32 5.209 -24.087 -4.728 1.00 0.00 C ATOM 515 O SER A 32 6.234 -24.243 -5.361 1.00 0.00 O ATOM 516 CB SER A 32 5.440 -23.706 -2.269 1.00 0.00 C ATOM 517 OG SER A 32 5.204 -22.782 -1.217 1.00 0.00 O ATOM 0 H SER A 32 3.249 -22.596 -2.681 1.00 0.00 H new ATOM 0 HA SER A 32 5.830 -22.243 -3.802 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.824 -24.595 -2.132 1.00 0.00 H new ATOM 0 HB3 SER A 32 6.480 -24.033 -2.254 1.00 0.00 H new ATOM 0 HG SER A 32 4.242 -22.730 -1.037 1.00 0.00 H new ATOM 523 N THR A 33 4.146 -24.803 -4.974 1.00 0.00 N ATOM 524 CA THR A 33 4.176 -25.834 -6.049 1.00 0.00 C ATOM 525 C THR A 33 4.169 -25.146 -7.416 1.00 0.00 C ATOM 526 O THR A 33 3.686 -24.040 -7.563 1.00 0.00 O ATOM 527 CB THR A 33 2.946 -26.736 -5.926 1.00 0.00 C ATOM 528 OG1 THR A 33 2.845 -27.214 -4.592 1.00 0.00 O ATOM 529 CG2 THR A 33 3.081 -27.918 -6.887 1.00 0.00 C ATOM 0 H THR A 33 3.259 -24.719 -4.477 1.00 0.00 H new ATOM 0 HA THR A 33 5.079 -26.436 -5.949 1.00 0.00 H new ATOM 0 HB THR A 33 2.050 -26.169 -6.177 1.00 0.00 H new ATOM 0 HG1 THR A 33 1.902 -27.361 -4.368 1.00 0.00 H new ATOM 0 HG21 THR A 33 2.205 -28.560 -6.799 1.00 0.00 H new ATOM 0 HG22 THR A 33 3.159 -27.549 -7.909 1.00 0.00 H new ATOM 0 HG23 THR A 33 3.976 -28.489 -6.638 1.00 0.00 H new ATOM 537 N ASN A 34 4.700 -25.791 -8.418 1.00 0.00 N ATOM 538 CA ASN A 34 4.724 -25.174 -9.774 1.00 0.00 C ATOM 539 C ASN A 34 3.319 -24.683 -10.135 1.00 0.00 C ATOM 540 O ASN A 34 3.155 -23.732 -10.872 1.00 0.00 O ATOM 541 CB ASN A 34 5.180 -26.213 -10.800 1.00 0.00 C ATOM 542 CG ASN A 34 6.622 -26.627 -10.500 1.00 0.00 C ATOM 543 OD1 ASN A 34 7.332 -25.934 -9.797 1.00 0.00 O ATOM 544 ND2 ASN A 34 7.088 -27.735 -11.006 1.00 0.00 N ATOM 0 H ASN A 34 5.119 -26.719 -8.356 1.00 0.00 H new ATOM 0 HA ASN A 34 5.416 -24.332 -9.778 1.00 0.00 H new ATOM 0 HB2 ASN A 34 4.526 -27.084 -10.767 1.00 0.00 H new ATOM 0 HB3 ASN A 34 5.111 -25.801 -11.807 1.00 0.00 H new ATOM 0 HD21 ASN A 34 8.048 -28.020 -10.812 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.493 -28.316 -11.596 1.00 0.00 H new ATOM 551 N SER A 35 2.307 -25.326 -9.621 1.00 0.00 N ATOM 552 CA SER A 35 0.916 -24.896 -9.935 1.00 0.00 C ATOM 553 C SER A 35 0.632 -23.552 -9.262 1.00 0.00 C ATOM 554 O SER A 35 1.275 -23.179 -8.301 1.00 0.00 O ATOM 555 CB SER A 35 -0.072 -25.943 -9.416 1.00 0.00 C ATOM 556 OG SER A 35 -0.195 -25.820 -8.007 1.00 0.00 O ATOM 0 H SER A 35 2.383 -26.130 -8.998 1.00 0.00 H new ATOM 0 HA SER A 35 0.804 -24.793 -11.014 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.044 -25.808 -9.890 1.00 0.00 H new ATOM 0 HB3 SER A 35 0.273 -26.944 -9.676 1.00 0.00 H new ATOM 0 HG SER A 35 -1.094 -26.096 -7.732 1.00 0.00 H new ATOM 562 N LYS A 36 -0.326 -22.818 -9.761 1.00 0.00 N ATOM 563 CA LYS A 36 -0.650 -21.498 -9.150 1.00 0.00 C ATOM 564 C LYS A 36 -2.082 -21.524 -8.613 1.00 0.00 C ATOM 565 O LYS A 36 -2.981 -22.053 -9.237 1.00 0.00 O ATOM 566 CB LYS A 36 -0.522 -20.401 -10.210 1.00 0.00 C ATOM 567 CG LYS A 36 -0.674 -19.031 -9.546 1.00 0.00 C ATOM 568 CD LYS A 36 -0.609 -17.937 -10.613 1.00 0.00 C ATOM 569 CE LYS A 36 -0.549 -16.565 -9.936 1.00 0.00 C ATOM 570 NZ LYS A 36 -1.895 -16.215 -9.401 1.00 0.00 N ATOM 0 H LYS A 36 -0.898 -23.076 -10.565 1.00 0.00 H new ATOM 0 HA LYS A 36 0.041 -21.295 -8.332 1.00 0.00 H new ATOM 0 HB2 LYS A 36 0.446 -20.471 -10.706 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.284 -20.532 -10.978 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.623 -18.977 -9.012 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.115 -18.883 -8.809 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.268 -18.081 -11.244 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -1.482 -17.996 -11.263 1.00 0.00 H new ATOM 0 HE2 LYS A 36 0.183 -16.578 -9.128 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.222 -15.809 -10.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.862 -15.269 -8.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.589 -16.220 -10.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -2.175 -16.912 -8.682 1.00 0.00 H new ATOM 584 N VAL A 37 -2.303 -20.958 -7.457 1.00 0.00 N ATOM 585 CA VAL A 37 -3.677 -20.951 -6.882 1.00 0.00 C ATOM 586 C VAL A 37 -4.165 -19.508 -6.738 1.00 0.00 C ATOM 587 O VAL A 37 -3.410 -18.619 -6.398 1.00 0.00 O ATOM 588 CB VAL A 37 -3.659 -21.622 -5.508 1.00 0.00 C ATOM 589 CG1 VAL A 37 -5.084 -21.703 -4.961 1.00 0.00 C ATOM 590 CG2 VAL A 37 -3.080 -23.032 -5.637 1.00 0.00 C ATOM 0 H VAL A 37 -1.591 -20.501 -6.887 1.00 0.00 H new ATOM 0 HA VAL A 37 -4.349 -21.497 -7.544 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.042 -21.037 -4.826 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -5.071 -22.181 -3.982 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -5.496 -20.698 -4.869 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -5.703 -22.287 -5.642 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -3.067 -23.511 -4.658 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -3.696 -23.617 -6.319 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -2.063 -22.974 -6.026 1.00 0.00 H new ATOM 600 N SER A 38 -5.422 -19.269 -6.994 1.00 0.00 N ATOM 601 CA SER A 38 -5.957 -17.884 -6.871 1.00 0.00 C ATOM 602 C SER A 38 -6.987 -17.833 -5.742 1.00 0.00 C ATOM 603 O SER A 38 -7.754 -18.755 -5.546 1.00 0.00 O ATOM 604 CB SER A 38 -6.622 -17.475 -8.187 1.00 0.00 C ATOM 605 OG SER A 38 -6.762 -16.062 -8.228 1.00 0.00 O ATOM 0 H SER A 38 -6.101 -19.973 -7.283 1.00 0.00 H new ATOM 0 HA SER A 38 -5.140 -17.198 -6.648 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.023 -17.816 -9.031 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.599 -17.951 -8.276 1.00 0.00 H new ATOM 0 HG SER A 38 -7.186 -15.800 -9.072 1.00 0.00 H new ATOM 611 N GLY A 39 -7.013 -16.762 -4.997 1.00 0.00 N ATOM 612 CA GLY A 39 -7.994 -16.652 -3.881 1.00 0.00 C ATOM 613 C GLY A 39 -7.264 -16.260 -2.595 1.00 0.00 C ATOM 614 O GLY A 39 -6.223 -15.634 -2.629 1.00 0.00 O ATOM 0 H GLY A 39 -6.397 -15.958 -5.113 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.753 -15.908 -4.122 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -8.511 -17.601 -3.743 1.00 0.00 H new ATOM 618 N PRO A 40 -7.826 -16.640 -1.439 1.00 0.00 N ATOM 619 CA PRO A 40 -9.083 -17.397 -1.380 1.00 0.00 C ATOM 620 C PRO A 40 -10.283 -16.540 -1.791 1.00 0.00 C ATOM 621 O PRO A 40 -10.368 -15.374 -1.460 1.00 0.00 O ATOM 622 CB PRO A 40 -9.199 -17.781 0.095 1.00 0.00 C ATOM 623 CG PRO A 40 -8.406 -16.745 0.818 1.00 0.00 C ATOM 624 CD PRO A 40 -7.280 -16.360 -0.100 1.00 0.00 C ATOM 0 HA PRO A 40 -9.079 -18.250 -2.059 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -10.238 -17.785 0.423 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.804 -18.781 0.276 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -9.024 -15.880 1.059 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -8.023 -17.136 1.761 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -7.010 -15.310 0.013 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -6.381 -16.944 0.098 1.00 0.00 H new ATOM 632 N ILE A 41 -11.212 -17.108 -2.511 1.00 0.00 N ATOM 633 CA ILE A 41 -12.403 -16.324 -2.943 1.00 0.00 C ATOM 634 C ILE A 41 -13.514 -16.471 -1.901 1.00 0.00 C ATOM 635 O ILE A 41 -13.877 -17.566 -1.518 1.00 0.00 O ATOM 636 CB ILE A 41 -12.897 -16.849 -4.292 1.00 0.00 C ATOM 637 CG1 ILE A 41 -11.716 -16.956 -5.261 1.00 0.00 C ATOM 638 CG2 ILE A 41 -13.939 -15.886 -4.864 1.00 0.00 C ATOM 639 CD1 ILE A 41 -11.857 -18.229 -6.097 1.00 0.00 C ATOM 0 H ILE A 41 -11.197 -18.080 -2.818 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.131 -15.273 -3.040 1.00 0.00 H new ATOM 0 HB ILE A 41 -13.347 -17.832 -4.156 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.685 -16.082 -5.912 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -10.777 -16.974 -4.707 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.291 -16.260 -5.825 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.780 -15.808 -4.175 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -13.489 -14.902 -5.000 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -11.017 -18.306 -6.787 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -11.867 -19.098 -5.438 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -12.788 -18.192 -6.662 1.00 0.00 H new ATOM 651 N PRO A 42 -14.060 -15.340 -1.434 1.00 0.00 N ATOM 652 CA PRO A 42 -15.132 -15.331 -0.430 1.00 0.00 C ATOM 653 C PRO A 42 -16.459 -15.835 -1.006 1.00 0.00 C ATOM 654 O PRO A 42 -16.833 -15.502 -2.113 1.00 0.00 O ATOM 655 CB PRO A 42 -15.255 -13.856 -0.050 1.00 0.00 C ATOM 656 CG PRO A 42 -14.744 -13.116 -1.240 1.00 0.00 C ATOM 657 CD PRO A 42 -13.674 -13.979 -1.848 1.00 0.00 C ATOM 0 HA PRO A 42 -14.907 -15.985 0.412 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -16.289 -13.588 0.169 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -14.670 -13.626 0.841 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -15.545 -12.929 -1.955 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -14.342 -12.145 -0.951 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -13.647 -13.881 -2.933 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -12.684 -13.712 -1.479 1.00 0.00 H new ATOM 665 N LEU A 43 -17.173 -16.634 -0.262 1.00 0.00 N ATOM 666 CA LEU A 43 -18.475 -17.159 -0.762 1.00 0.00 C ATOM 667 C LEU A 43 -19.601 -16.679 0.157 1.00 0.00 C ATOM 668 O LEU A 43 -19.362 -16.037 1.160 1.00 0.00 O ATOM 669 CB LEU A 43 -18.438 -18.688 -0.769 1.00 0.00 C ATOM 670 CG LEU A 43 -18.500 -19.192 -2.213 1.00 0.00 C ATOM 671 CD1 LEU A 43 -17.095 -19.177 -2.819 1.00 0.00 C ATOM 672 CD2 LEU A 43 -19.048 -20.621 -2.230 1.00 0.00 C ATOM 0 H LEU A 43 -16.910 -16.947 0.673 1.00 0.00 H new ATOM 0 HA LEU A 43 -18.651 -16.796 -1.775 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -17.527 -19.043 -0.287 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -19.276 -19.086 -0.197 1.00 0.00 H new ATOM 0 HG LEU A 43 -19.154 -18.545 -2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -17.138 -19.536 -3.847 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -16.704 -18.160 -2.806 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -16.440 -19.825 -2.236 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -19.093 -20.981 -3.258 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -18.394 -21.269 -1.647 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -20.049 -20.632 -1.798 1.00 0.00 H new ATOM 684 N PRO A 44 -20.856 -16.999 -0.196 1.00 0.00 N ATOM 685 CA PRO A 44 -22.025 -16.602 0.597 1.00 0.00 C ATOM 686 C PRO A 44 -22.097 -17.364 1.924 1.00 0.00 C ATOM 687 O PRO A 44 -21.767 -18.532 1.997 1.00 0.00 O ATOM 688 CB PRO A 44 -23.209 -16.983 -0.292 1.00 0.00 C ATOM 689 CG PRO A 44 -22.686 -18.074 -1.166 1.00 0.00 C ATOM 690 CD PRO A 44 -21.232 -17.772 -1.393 1.00 0.00 C ATOM 0 HA PRO A 44 -21.999 -15.545 0.863 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -24.058 -17.323 0.302 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -23.552 -16.133 -0.881 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -22.811 -19.047 -0.691 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -23.228 -18.109 -2.111 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -20.641 -18.683 -1.485 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -21.078 -17.199 -2.307 1.00 0.00 H new ATOM 698 N THR A 45 -22.522 -16.714 2.971 1.00 0.00 N ATOM 699 CA THR A 45 -22.611 -17.401 4.290 1.00 0.00 C ATOM 700 C THR A 45 -24.081 -17.583 4.676 1.00 0.00 C ATOM 701 O THR A 45 -24.965 -16.995 4.085 1.00 0.00 O ATOM 702 CB THR A 45 -21.905 -16.559 5.355 1.00 0.00 C ATOM 703 OG1 THR A 45 -21.880 -17.273 6.582 1.00 0.00 O ATOM 704 CG2 THR A 45 -22.655 -15.239 5.545 1.00 0.00 C ATOM 0 H THR A 45 -22.812 -15.736 2.971 1.00 0.00 H new ATOM 0 HA THR A 45 -22.131 -18.377 4.221 1.00 0.00 H new ATOM 0 HB THR A 45 -20.884 -16.351 5.035 1.00 0.00 H new ATOM 0 HG1 THR A 45 -21.933 -18.235 6.402 1.00 0.00 H new ATOM 0 HG21 THR A 45 -22.151 -14.640 6.304 1.00 0.00 H new ATOM 0 HG22 THR A 45 -22.672 -14.691 4.603 1.00 0.00 H new ATOM 0 HG23 THR A 45 -23.677 -15.444 5.864 1.00 0.00 H new ATOM 712 N GLU A 46 -24.347 -18.392 5.664 1.00 0.00 N ATOM 713 CA GLU A 46 -25.758 -18.611 6.090 1.00 0.00 C ATOM 714 C GLU A 46 -25.811 -18.756 7.613 1.00 0.00 C ATOM 715 O GLU A 46 -25.097 -19.546 8.195 1.00 0.00 O ATOM 716 CB GLU A 46 -26.296 -19.886 5.437 1.00 0.00 C ATOM 717 CG GLU A 46 -27.750 -20.102 5.859 1.00 0.00 C ATOM 718 CD GLU A 46 -28.216 -21.482 5.392 1.00 0.00 C ATOM 719 OE1 GLU A 46 -27.406 -22.201 4.829 1.00 0.00 O ATOM 720 OE2 GLU A 46 -29.376 -21.798 5.605 1.00 0.00 O ATOM 0 H GLU A 46 -23.648 -18.911 6.195 1.00 0.00 H new ATOM 0 HA GLU A 46 -26.368 -17.761 5.783 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -26.229 -19.807 4.352 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -25.690 -20.742 5.733 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -27.841 -20.023 6.942 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -28.384 -19.327 5.428 1.00 0.00 H new ATOM 727 N SER A 47 -26.650 -17.995 8.262 1.00 0.00 N ATOM 728 CA SER A 47 -26.744 -18.090 9.746 1.00 0.00 C ATOM 729 C SER A 47 -25.351 -17.910 10.354 1.00 0.00 C ATOM 730 O SER A 47 -24.939 -16.812 10.671 1.00 0.00 O ATOM 731 CB SER A 47 -27.296 -19.463 10.137 1.00 0.00 C ATOM 732 OG SER A 47 -27.169 -19.642 11.540 1.00 0.00 O ATOM 0 H SER A 47 -27.273 -17.313 7.829 1.00 0.00 H new ATOM 0 HA SER A 47 -27.410 -17.312 10.119 1.00 0.00 H new ATOM 0 HB2 SER A 47 -28.342 -19.543 9.843 1.00 0.00 H new ATOM 0 HB3 SER A 47 -26.755 -20.248 9.609 1.00 0.00 H new ATOM 0 HG SER A 47 -27.524 -20.520 11.791 1.00 0.00 H new ATOM 738 N ARG A 48 -24.623 -18.980 10.515 1.00 0.00 N ATOM 739 CA ARG A 48 -23.257 -18.870 11.100 1.00 0.00 C ATOM 740 C ARG A 48 -22.301 -19.785 10.331 1.00 0.00 C ATOM 741 O ARG A 48 -21.281 -20.202 10.842 1.00 0.00 O ATOM 742 CB ARG A 48 -23.297 -19.292 12.570 1.00 0.00 C ATOM 743 CG ARG A 48 -24.218 -18.350 13.348 1.00 0.00 C ATOM 744 CD ARG A 48 -24.153 -18.688 14.838 1.00 0.00 C ATOM 745 NE ARG A 48 -24.419 -20.142 15.030 1.00 0.00 N ATOM 746 CZ ARG A 48 -25.633 -20.558 15.266 1.00 0.00 C ATOM 747 NH1 ARG A 48 -26.488 -20.665 14.286 1.00 0.00 N ATOM 748 NH2 ARG A 48 -25.993 -20.864 16.482 1.00 0.00 N ATOM 0 H ARG A 48 -24.915 -19.925 10.267 1.00 0.00 H new ATOM 0 HA ARG A 48 -22.911 -17.839 11.028 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -23.654 -20.318 12.655 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -22.293 -19.268 12.994 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -23.918 -17.315 13.186 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -25.242 -18.445 12.987 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -23.172 -18.431 15.238 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -24.886 -18.098 15.388 1.00 0.00 H new ATOM 0 HE ARG A 48 -23.652 -20.812 14.977 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -26.207 -20.423 13.336 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -27.437 -20.990 14.470 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -25.325 -20.778 17.248 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -26.942 -21.189 16.666 1.00 0.00 H new ATOM 762 N VAL A 49 -22.623 -20.101 9.107 1.00 0.00 N ATOM 763 CA VAL A 49 -21.734 -20.990 8.307 1.00 0.00 C ATOM 764 C VAL A 49 -21.113 -20.190 7.158 1.00 0.00 C ATOM 765 O VAL A 49 -21.807 -19.640 6.327 1.00 0.00 O ATOM 766 CB VAL A 49 -22.552 -22.149 7.736 1.00 0.00 C ATOM 767 CG1 VAL A 49 -21.631 -23.080 6.943 1.00 0.00 C ATOM 768 CG2 VAL A 49 -23.201 -22.928 8.880 1.00 0.00 C ATOM 0 H VAL A 49 -23.464 -19.782 8.626 1.00 0.00 H new ATOM 0 HA VAL A 49 -20.943 -21.383 8.946 1.00 0.00 H new ATOM 0 HB VAL A 49 -23.328 -21.757 7.078 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -22.213 -23.907 6.535 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -21.168 -22.525 6.127 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -20.856 -23.472 7.601 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -23.784 -23.754 8.473 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -22.426 -23.321 9.538 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -23.856 -22.266 9.446 1.00 0.00 H new ATOM 778 N HIS A 50 -19.812 -20.123 7.106 1.00 0.00 N ATOM 779 CA HIS A 50 -19.149 -19.362 6.010 1.00 0.00 C ATOM 780 C HIS A 50 -18.478 -20.341 5.045 1.00 0.00 C ATOM 781 O HIS A 50 -18.090 -21.428 5.420 1.00 0.00 O ATOM 782 CB HIS A 50 -18.096 -18.425 6.604 1.00 0.00 C ATOM 783 CG HIS A 50 -18.748 -17.509 7.601 1.00 0.00 C ATOM 784 ND1 HIS A 50 -19.406 -16.350 7.220 1.00 0.00 N ATOM 785 CD2 HIS A 50 -18.854 -17.566 8.969 1.00 0.00 C ATOM 786 CE1 HIS A 50 -19.874 -15.762 8.336 1.00 0.00 C ATOM 787 NE2 HIS A 50 -19.565 -16.462 9.431 1.00 0.00 N ATOM 0 H HIS A 50 -19.179 -20.562 7.775 1.00 0.00 H new ATOM 0 HA HIS A 50 -19.893 -18.775 5.472 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -17.309 -19.004 7.086 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -17.624 -17.842 5.813 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -18.447 -18.349 9.592 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -20.431 -14.837 8.345 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -19.800 -16.236 10.398 1.00 0.00 H new ATOM 795 N LYS A 51 -18.338 -19.964 3.803 1.00 0.00 N ATOM 796 CA LYS A 51 -17.694 -20.878 2.818 1.00 0.00 C ATOM 797 C LYS A 51 -16.674 -20.099 1.985 1.00 0.00 C ATOM 798 O LYS A 51 -16.859 -18.937 1.685 1.00 0.00 O ATOM 799 CB LYS A 51 -18.761 -21.467 1.895 1.00 0.00 C ATOM 800 CG LYS A 51 -19.772 -22.262 2.724 1.00 0.00 C ATOM 801 CD LYS A 51 -20.677 -23.066 1.790 1.00 0.00 C ATOM 802 CE LYS A 51 -21.462 -22.109 0.890 1.00 0.00 C ATOM 803 NZ LYS A 51 -22.424 -22.884 0.058 1.00 0.00 N ATOM 0 H LYS A 51 -18.641 -19.065 3.429 1.00 0.00 H new ATOM 0 HA LYS A 51 -17.188 -21.683 3.350 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -19.268 -20.669 1.352 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -18.296 -22.114 1.151 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -19.251 -22.932 3.408 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -20.370 -21.585 3.334 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -20.079 -23.745 1.182 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -21.364 -23.680 2.372 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -21.997 -21.378 1.497 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -20.778 -21.552 0.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -22.957 -22.233 -0.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -21.903 -23.565 -0.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -23.084 -23.396 0.677 1.00 0.00 H new ATOM 817 N ARG A 52 -15.599 -20.735 1.608 1.00 0.00 N ATOM 818 CA ARG A 52 -14.566 -20.039 0.791 1.00 0.00 C ATOM 819 C ARG A 52 -14.199 -20.914 -0.409 1.00 0.00 C ATOM 820 O ARG A 52 -14.203 -22.127 -0.327 1.00 0.00 O ATOM 821 CB ARG A 52 -13.321 -19.791 1.645 1.00 0.00 C ATOM 822 CG ARG A 52 -13.661 -18.807 2.766 1.00 0.00 C ATOM 823 CD ARG A 52 -12.382 -18.420 3.511 1.00 0.00 C ATOM 824 NE ARG A 52 -12.732 -17.603 4.706 1.00 0.00 N ATOM 825 CZ ARG A 52 -12.485 -16.321 4.716 1.00 0.00 C ATOM 826 NH1 ARG A 52 -11.264 -15.891 4.551 1.00 0.00 N ATOM 827 NH2 ARG A 52 -13.458 -15.470 4.893 1.00 0.00 N ATOM 0 H ARG A 52 -15.391 -21.708 1.831 1.00 0.00 H new ATOM 0 HA ARG A 52 -14.958 -19.084 0.440 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -12.963 -20.730 2.067 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -12.517 -19.392 1.027 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -14.136 -17.918 2.352 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -14.374 -19.258 3.456 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -11.840 -19.316 3.815 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -11.721 -17.856 2.853 1.00 0.00 H new ATOM 0 HE ARG A 52 -13.165 -18.045 5.517 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -10.503 -16.556 4.414 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -11.071 -14.890 4.559 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -14.412 -15.806 5.024 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -13.265 -14.469 4.901 1.00 0.00 H new ATOM 841 N LEU A 53 -13.883 -20.314 -1.523 1.00 0.00 N ATOM 842 CA LEU A 53 -13.522 -21.119 -2.724 1.00 0.00 C ATOM 843 C LEU A 53 -12.116 -20.742 -3.193 1.00 0.00 C ATOM 844 O LEU A 53 -11.784 -19.580 -3.322 1.00 0.00 O ATOM 845 CB LEU A 53 -14.527 -20.839 -3.845 1.00 0.00 C ATOM 846 CG LEU A 53 -14.393 -21.908 -4.932 1.00 0.00 C ATOM 847 CD1 LEU A 53 -13.048 -21.752 -5.642 1.00 0.00 C ATOM 848 CD2 LEU A 53 -14.476 -23.297 -4.296 1.00 0.00 C ATOM 0 H LEU A 53 -13.859 -19.303 -1.654 1.00 0.00 H new ATOM 0 HA LEU A 53 -13.545 -22.179 -2.470 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -15.541 -20.837 -3.446 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -14.349 -19.851 -4.269 1.00 0.00 H new ATOM 0 HG LEU A 53 -15.200 -21.791 -5.655 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -12.954 -22.514 -6.416 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -12.989 -20.763 -6.097 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -12.240 -21.867 -4.920 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -14.381 -24.058 -5.070 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -13.670 -23.414 -3.571 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -15.436 -23.410 -3.793 1.00 0.00 H new ATOM 860 N ILE A 54 -11.289 -21.716 -3.453 1.00 0.00 N ATOM 861 CA ILE A 54 -9.906 -21.418 -3.919 1.00 0.00 C ATOM 862 C ILE A 54 -9.711 -21.996 -5.322 1.00 0.00 C ATOM 863 O ILE A 54 -9.874 -23.179 -5.544 1.00 0.00 O ATOM 864 CB ILE A 54 -8.896 -22.052 -2.961 1.00 0.00 C ATOM 865 CG1 ILE A 54 -9.144 -21.537 -1.542 1.00 0.00 C ATOM 866 CG2 ILE A 54 -7.477 -21.681 -3.398 1.00 0.00 C ATOM 867 CD1 ILE A 54 -8.191 -22.237 -0.571 1.00 0.00 C ATOM 0 H ILE A 54 -11.512 -22.707 -3.363 1.00 0.00 H new ATOM 0 HA ILE A 54 -9.753 -20.339 -3.943 1.00 0.00 H new ATOM 0 HB ILE A 54 -9.010 -23.136 -2.978 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -8.992 -20.458 -1.503 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -10.178 -21.724 -1.252 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.757 -22.132 -2.716 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.300 -22.049 -4.409 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -7.363 -20.597 -3.381 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.368 -21.870 0.440 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -8.365 -23.313 -0.602 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -7.161 -22.028 -0.858 1.00 0.00 H new ATOM 879 N ASP A 55 -9.368 -21.171 -6.273 1.00 0.00 N ATOM 880 CA ASP A 55 -9.169 -21.677 -7.660 1.00 0.00 C ATOM 881 C ASP A 55 -7.709 -22.094 -7.850 1.00 0.00 C ATOM 882 O ASP A 55 -6.805 -21.496 -7.302 1.00 0.00 O ATOM 883 CB ASP A 55 -9.518 -20.572 -8.660 1.00 0.00 C ATOM 884 CG ASP A 55 -11.003 -20.229 -8.541 1.00 0.00 C ATOM 885 OD1 ASP A 55 -11.723 -21.002 -7.930 1.00 0.00 O ATOM 886 OD2 ASP A 55 -11.397 -19.199 -9.063 1.00 0.00 O ATOM 0 H ASP A 55 -9.217 -20.170 -6.150 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.816 -22.538 -7.828 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -8.912 -19.687 -8.466 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -9.289 -20.899 -9.674 1.00 0.00 H new ATOM 891 N ILE A 56 -7.472 -23.115 -8.628 1.00 0.00 N ATOM 892 CA ILE A 56 -6.072 -23.571 -8.858 1.00 0.00 C ATOM 893 C ILE A 56 -5.811 -23.662 -10.362 1.00 0.00 C ATOM 894 O ILE A 56 -6.560 -24.275 -11.096 1.00 0.00 O ATOM 895 CB ILE A 56 -5.872 -24.948 -8.221 1.00 0.00 C ATOM 896 CG1 ILE A 56 -6.142 -24.860 -6.718 1.00 0.00 C ATOM 897 CG2 ILE A 56 -4.433 -25.413 -8.455 1.00 0.00 C ATOM 898 CD1 ILE A 56 -5.963 -26.243 -6.087 1.00 0.00 C ATOM 0 H ILE A 56 -8.189 -23.654 -9.115 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.378 -22.860 -8.409 1.00 0.00 H new ATOM 0 HB ILE A 56 -6.563 -25.661 -8.672 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.460 -24.146 -6.256 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -7.154 -24.495 -6.540 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -4.289 -26.394 -8.002 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -4.241 -25.477 -9.526 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.742 -24.700 -8.004 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.155 -26.182 -5.016 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -6.663 -26.944 -6.542 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.943 -26.590 -6.253 1.00 0.00 H new ATOM 910 N ILE A 57 -4.755 -23.054 -10.830 1.00 0.00 N ATOM 911 CA ILE A 57 -4.451 -23.107 -12.287 1.00 0.00 C ATOM 912 C ILE A 57 -3.212 -23.974 -12.523 1.00 0.00 C ATOM 913 O ILE A 57 -2.272 -23.952 -11.755 1.00 0.00 O ATOM 914 CB ILE A 57 -4.187 -21.691 -12.804 1.00 0.00 C ATOM 915 CG1 ILE A 57 -5.393 -20.801 -12.493 1.00 0.00 C ATOM 916 CG2 ILE A 57 -3.962 -21.734 -14.317 1.00 0.00 C ATOM 917 CD1 ILE A 57 -5.058 -19.349 -12.844 1.00 0.00 C ATOM 0 H ILE A 57 -4.091 -22.524 -10.266 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.300 -23.537 -12.818 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.301 -21.286 -12.316 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -6.261 -21.133 -13.063 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -5.655 -20.880 -11.438 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.774 -20.726 -14.686 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -3.103 -22.368 -14.539 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -4.848 -22.139 -14.805 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -5.916 -18.714 -12.623 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -4.202 -19.020 -12.255 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -4.817 -19.277 -13.905 1.00 0.00 H new ATOM 929 N ASP A 58 -3.206 -24.737 -13.582 1.00 0.00 N ATOM 930 CA ASP A 58 -2.030 -25.605 -13.870 1.00 0.00 C ATOM 931 C ASP A 58 -1.647 -26.385 -12.611 1.00 0.00 C ATOM 932 O ASP A 58 -0.563 -26.235 -12.083 1.00 0.00 O ATOM 933 CB ASP A 58 -0.851 -24.736 -14.311 1.00 0.00 C ATOM 934 CG ASP A 58 -0.369 -25.191 -15.689 1.00 0.00 C ATOM 935 OD1 ASP A 58 -0.679 -26.309 -16.064 1.00 0.00 O ATOM 936 OD2 ASP A 58 0.300 -24.412 -16.348 1.00 0.00 O ATOM 0 H ASP A 58 -3.965 -24.796 -14.260 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.283 -26.306 -14.666 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.151 -23.689 -14.346 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -0.040 -24.811 -13.587 1.00 0.00 H new ATOM 941 N PRO A 59 -2.561 -27.235 -12.123 1.00 0.00 N ATOM 942 CA PRO A 59 -2.327 -28.048 -10.923 1.00 0.00 C ATOM 943 C PRO A 59 -1.288 -29.146 -11.174 1.00 0.00 C ATOM 944 O PRO A 59 -1.197 -29.690 -12.257 1.00 0.00 O ATOM 945 CB PRO A 59 -3.693 -28.675 -10.643 1.00 0.00 C ATOM 946 CG PRO A 59 -4.378 -28.690 -11.968 1.00 0.00 C ATOM 947 CD PRO A 59 -3.894 -27.473 -12.704 1.00 0.00 C ATOM 0 HA PRO A 59 -1.938 -27.454 -10.096 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -3.592 -29.682 -10.238 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -4.255 -28.092 -9.913 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -4.139 -29.599 -12.520 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -5.461 -28.666 -11.847 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -3.839 -27.648 -13.779 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -4.557 -26.621 -12.553 1.00 0.00 H new ATOM 955 N SER A 60 -0.504 -29.472 -10.183 1.00 0.00 N ATOM 956 CA SER A 60 0.527 -30.532 -10.367 1.00 0.00 C ATOM 957 C SER A 60 0.420 -31.550 -9.229 1.00 0.00 C ATOM 958 O SER A 60 -0.221 -31.306 -8.225 1.00 0.00 O ATOM 959 CB SER A 60 1.919 -29.892 -10.357 1.00 0.00 C ATOM 960 OG SER A 60 2.796 -30.665 -9.551 1.00 0.00 O ATOM 0 H SER A 60 -0.533 -29.050 -9.255 1.00 0.00 H new ATOM 0 HA SER A 60 0.367 -31.038 -11.319 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.307 -29.826 -11.374 1.00 0.00 H new ATOM 0 HB3 SER A 60 1.859 -28.874 -9.973 1.00 0.00 H new ATOM 0 HG SER A 60 3.686 -30.254 -9.548 1.00 0.00 H new ATOM 966 N PRO A 61 1.066 -32.714 -9.393 1.00 0.00 N ATOM 967 CA PRO A 61 1.049 -33.778 -8.381 1.00 0.00 C ATOM 968 C PRO A 61 1.798 -33.363 -7.113 1.00 0.00 C ATOM 969 O PRO A 61 1.539 -33.860 -6.034 1.00 0.00 O ATOM 970 CB PRO A 61 1.773 -34.936 -9.070 1.00 0.00 C ATOM 971 CG PRO A 61 2.637 -34.279 -10.092 1.00 0.00 C ATOM 972 CD PRO A 61 1.866 -33.083 -10.572 1.00 0.00 C ATOM 0 HA PRO A 61 0.038 -34.026 -8.058 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.366 -35.512 -8.360 1.00 0.00 H new ATOM 0 HB3 PRO A 61 1.068 -35.627 -9.531 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.593 -33.981 -9.662 1.00 0.00 H new ATOM 0 HG3 PRO A 61 2.856 -34.959 -10.915 1.00 0.00 H new ATOM 0 HD2 PRO A 61 2.527 -32.273 -10.881 1.00 0.00 H new ATOM 0 HD3 PRO A 61 1.236 -33.325 -11.428 1.00 0.00 H new ATOM 980 N LYS A 62 2.721 -32.449 -7.233 1.00 0.00 N ATOM 981 CA LYS A 62 3.479 -31.996 -6.033 1.00 0.00 C ATOM 982 C LYS A 62 2.517 -31.307 -5.066 1.00 0.00 C ATOM 983 O LYS A 62 2.737 -31.274 -3.871 1.00 0.00 O ATOM 984 CB LYS A 62 4.571 -31.013 -6.459 1.00 0.00 C ATOM 985 CG LYS A 62 5.564 -31.722 -7.383 1.00 0.00 C ATOM 986 CD LYS A 62 6.701 -30.763 -7.741 1.00 0.00 C ATOM 987 CE LYS A 62 7.636 -31.436 -8.750 1.00 0.00 C ATOM 988 NZ LYS A 62 8.733 -32.132 -8.020 1.00 0.00 N ATOM 0 H LYS A 62 2.983 -31.997 -8.109 1.00 0.00 H new ATOM 0 HA LYS A 62 3.940 -32.854 -5.543 1.00 0.00 H new ATOM 0 HB2 LYS A 62 4.127 -30.159 -6.971 1.00 0.00 H new ATOM 0 HB3 LYS A 62 5.088 -30.625 -5.582 1.00 0.00 H new ATOM 0 HG2 LYS A 62 5.963 -32.610 -6.893 1.00 0.00 H new ATOM 0 HG3 LYS A 62 5.059 -32.058 -8.288 1.00 0.00 H new ATOM 0 HD2 LYS A 62 6.296 -29.843 -8.162 1.00 0.00 H new ATOM 0 HD3 LYS A 62 7.255 -30.487 -6.844 1.00 0.00 H new ATOM 0 HE2 LYS A 62 7.080 -32.149 -9.359 1.00 0.00 H new ATOM 0 HE3 LYS A 62 8.051 -30.692 -9.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 9.369 -32.590 -8.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 9.269 -31.441 -7.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 8.328 -32.852 -7.389 1.00 0.00 H new ATOM 1002 N THR A 63 1.446 -30.757 -5.574 1.00 0.00 N ATOM 1003 CA THR A 63 0.467 -30.073 -4.684 1.00 0.00 C ATOM 1004 C THR A 63 -0.258 -31.118 -3.835 1.00 0.00 C ATOM 1005 O THR A 63 -0.531 -30.907 -2.671 1.00 0.00 O ATOM 1006 CB THR A 63 -0.552 -29.309 -5.535 1.00 0.00 C ATOM 1007 OG1 THR A 63 0.134 -28.402 -6.389 1.00 0.00 O ATOM 1008 CG2 THR A 63 -1.503 -28.535 -4.623 1.00 0.00 C ATOM 0 H THR A 63 1.208 -30.753 -6.566 1.00 0.00 H new ATOM 0 HA THR A 63 0.991 -29.373 -4.034 1.00 0.00 H new ATOM 0 HB THR A 63 -1.125 -30.014 -6.137 1.00 0.00 H new ATOM 0 HG1 THR A 63 -0.465 -27.665 -6.632 1.00 0.00 H new ATOM 0 HG21 THR A 63 -2.227 -27.992 -5.230 1.00 0.00 H new ATOM 0 HG22 THR A 63 -2.027 -29.232 -3.969 1.00 0.00 H new ATOM 0 HG23 THR A 63 -0.934 -27.829 -4.019 1.00 0.00 H new ATOM 1016 N ILE A 64 -0.572 -32.247 -4.411 1.00 0.00 N ATOM 1017 CA ILE A 64 -1.276 -33.307 -3.636 1.00 0.00 C ATOM 1018 C ILE A 64 -0.356 -33.817 -2.525 1.00 0.00 C ATOM 1019 O ILE A 64 -0.772 -34.007 -1.400 1.00 0.00 O ATOM 1020 CB ILE A 64 -1.641 -34.464 -4.569 1.00 0.00 C ATOM 1021 CG1 ILE A 64 -2.557 -33.954 -5.684 1.00 0.00 C ATOM 1022 CG2 ILE A 64 -2.365 -35.552 -3.772 1.00 0.00 C ATOM 1023 CD1 ILE A 64 -2.767 -35.062 -6.718 1.00 0.00 C ATOM 0 H ILE A 64 -0.371 -32.480 -5.383 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.185 -32.896 -3.197 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.732 -34.877 -5.007 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -3.516 -33.643 -5.268 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.116 -33.077 -6.159 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.625 -36.377 -4.436 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.713 -35.917 -2.979 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.273 -35.138 -3.334 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.419 -34.699 -7.512 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -1.805 -35.351 -7.142 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.226 -35.926 -6.237 1.00 0.00 H new ATOM 1035 N ASP A 65 0.892 -34.039 -2.833 1.00 0.00 N ATOM 1036 CA ASP A 65 1.838 -34.534 -1.795 1.00 0.00 C ATOM 1037 C ASP A 65 1.869 -33.548 -0.626 1.00 0.00 C ATOM 1038 O ASP A 65 1.879 -33.935 0.527 1.00 0.00 O ATOM 1039 CB ASP A 65 3.240 -34.655 -2.397 1.00 0.00 C ATOM 1040 CG ASP A 65 4.181 -35.296 -1.375 1.00 0.00 C ATOM 1041 OD1 ASP A 65 4.227 -36.514 -1.323 1.00 0.00 O ATOM 1042 OD2 ASP A 65 4.840 -34.557 -0.661 1.00 0.00 O ATOM 0 H ASP A 65 1.297 -33.899 -3.759 1.00 0.00 H new ATOM 0 HA ASP A 65 1.510 -35.511 -1.440 1.00 0.00 H new ATOM 0 HB2 ASP A 65 3.207 -35.258 -3.305 1.00 0.00 H new ATOM 0 HB3 ASP A 65 3.611 -33.670 -2.682 1.00 0.00 H new ATOM 1047 N ALA A 66 1.883 -32.274 -0.912 1.00 0.00 N ATOM 1048 CA ALA A 66 1.912 -31.265 0.184 1.00 0.00 C ATOM 1049 C ALA A 66 0.608 -31.340 0.981 1.00 0.00 C ATOM 1050 O ALA A 66 0.601 -31.226 2.190 1.00 0.00 O ATOM 1051 CB ALA A 66 2.064 -29.865 -0.415 1.00 0.00 C ATOM 0 H ALA A 66 1.876 -31.889 -1.857 1.00 0.00 H new ATOM 0 HA ALA A 66 2.754 -31.471 0.845 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.085 -29.127 0.387 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.993 -29.811 -0.983 1.00 0.00 H new ATOM 0 HB3 ALA A 66 1.222 -29.659 -1.076 1.00 0.00 H new ATOM 1057 N LEU A 67 -0.496 -31.531 0.311 1.00 0.00 N ATOM 1058 CA LEU A 67 -1.798 -31.614 1.032 1.00 0.00 C ATOM 1059 C LEU A 67 -1.792 -32.834 1.955 1.00 0.00 C ATOM 1060 O LEU A 67 -2.241 -32.774 3.082 1.00 0.00 O ATOM 1061 CB LEU A 67 -2.934 -31.748 0.016 1.00 0.00 C ATOM 1062 CG LEU A 67 -4.278 -31.745 0.749 1.00 0.00 C ATOM 1063 CD1 LEU A 67 -4.646 -30.311 1.137 1.00 0.00 C ATOM 1064 CD2 LEU A 67 -5.359 -32.318 -0.169 1.00 0.00 C ATOM 0 H LEU A 67 -0.553 -31.633 -0.702 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.945 -30.711 1.625 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.896 -30.926 -0.699 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.820 -32.671 -0.553 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.203 -32.356 1.649 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.603 -30.309 1.659 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.876 -29.902 1.791 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.722 -29.699 0.238 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.317 -32.317 0.352 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -5.434 -31.707 -1.068 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -5.098 -33.340 -0.445 1.00 0.00 H new ATOM 1076 N MET A 68 -1.286 -33.943 1.485 1.00 0.00 N ATOM 1077 CA MET A 68 -1.250 -35.166 2.335 1.00 0.00 C ATOM 1078 C MET A 68 -0.330 -34.926 3.534 1.00 0.00 C ATOM 1079 O MET A 68 -0.539 -35.457 4.606 1.00 0.00 O ATOM 1080 CB MET A 68 -0.722 -36.343 1.514 1.00 0.00 C ATOM 1081 CG MET A 68 -1.777 -36.765 0.490 1.00 0.00 C ATOM 1082 SD MET A 68 -1.213 -38.250 -0.379 1.00 0.00 S ATOM 1083 CE MET A 68 0.306 -37.548 -1.066 1.00 0.00 C ATOM 0 H MET A 68 -0.896 -34.054 0.549 1.00 0.00 H new ATOM 0 HA MET A 68 -2.256 -35.393 2.688 1.00 0.00 H new ATOM 0 HB2 MET A 68 0.201 -36.061 1.006 1.00 0.00 H new ATOM 0 HB3 MET A 68 -0.482 -37.179 2.170 1.00 0.00 H new ATOM 0 HG2 MET A 68 -2.726 -36.961 0.989 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.952 -35.958 -0.222 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.645 -38.162 -1.901 1.00 0.00 H new ATOM 0 HE2 MET A 68 0.112 -36.534 -1.416 1.00 0.00 H new ATOM 0 HE3 MET A 68 1.077 -37.525 -0.296 1.00 0.00 H new ATOM 1093 N ARG A 69 0.689 -34.131 3.360 1.00 0.00 N ATOM 1094 CA ARG A 69 1.622 -33.858 4.490 1.00 0.00 C ATOM 1095 C ARG A 69 0.922 -32.980 5.529 1.00 0.00 C ATOM 1096 O ARG A 69 1.208 -33.051 6.708 1.00 0.00 O ATOM 1097 CB ARG A 69 2.862 -33.133 3.963 1.00 0.00 C ATOM 1098 CG ARG A 69 3.674 -34.087 3.082 1.00 0.00 C ATOM 1099 CD ARG A 69 4.982 -33.408 2.668 1.00 0.00 C ATOM 1100 NE ARG A 69 5.862 -33.257 3.861 1.00 0.00 N ATOM 1101 CZ ARG A 69 7.042 -33.814 3.876 1.00 0.00 C ATOM 1102 NH1 ARG A 69 7.869 -33.619 2.885 1.00 0.00 N ATOM 1103 NH2 ARG A 69 7.397 -34.565 4.883 1.00 0.00 N ATOM 0 H ARG A 69 0.916 -33.659 2.485 1.00 0.00 H new ATOM 0 HA ARG A 69 1.919 -34.800 4.951 1.00 0.00 H new ATOM 0 HB2 ARG A 69 2.567 -32.254 3.390 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.472 -32.781 4.795 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.886 -35.009 3.624 1.00 0.00 H new ATOM 0 HG3 ARG A 69 3.099 -34.362 2.198 1.00 0.00 H new ATOM 0 HD2 ARG A 69 5.486 -34.000 1.904 1.00 0.00 H new ATOM 0 HD3 ARG A 69 4.775 -32.432 2.230 1.00 0.00 H new ATOM 0 HE ARG A 69 5.542 -32.718 4.666 1.00 0.00 H new ATOM 0 HH11 ARG A 69 7.593 -33.031 2.099 1.00 0.00 H new ATOM 0 HH12 ARG A 69 8.791 -34.055 2.897 1.00 0.00 H new ATOM 0 HH21 ARG A 69 6.752 -34.717 5.658 1.00 0.00 H new ATOM 0 HH22 ARG A 69 8.319 -35.000 4.894 1.00 0.00 H new ATOM 1117 N ILE A 70 0.007 -32.155 5.102 1.00 0.00 N ATOM 1118 CA ILE A 70 -0.711 -31.274 6.066 1.00 0.00 C ATOM 1119 C ILE A 70 -2.160 -31.745 6.208 1.00 0.00 C ATOM 1120 O ILE A 70 -2.818 -32.062 5.238 1.00 0.00 O ATOM 1121 CB ILE A 70 -0.692 -29.834 5.552 1.00 0.00 C ATOM 1122 CG1 ILE A 70 0.753 -29.392 5.322 1.00 0.00 C ATOM 1123 CG2 ILE A 70 -1.348 -28.917 6.586 1.00 0.00 C ATOM 1124 CD1 ILE A 70 0.765 -28.007 4.671 1.00 0.00 C ATOM 0 H ILE A 70 -0.275 -32.052 4.127 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.217 -31.321 7.037 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.242 -29.776 4.613 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.292 -29.365 6.269 1.00 0.00 H new ATOM 0 HG13 ILE A 70 1.267 -30.110 4.683 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.335 -27.890 6.221 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.379 -29.232 6.749 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.798 -28.975 7.525 1.00 0.00 H new ATOM 0 HD11 ILE A 70 1.795 -27.691 4.507 1.00 0.00 H new ATOM 0 HD12 ILE A 70 0.242 -28.049 3.716 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.267 -27.293 5.326 1.00 0.00 H new ATOM 1136 N ASN A 71 -2.661 -31.794 7.412 1.00 0.00 N ATOM 1137 CA ASN A 71 -4.067 -32.244 7.616 1.00 0.00 C ATOM 1138 C ASN A 71 -4.936 -31.042 7.992 1.00 0.00 C ATOM 1139 O ASN A 71 -4.565 -30.228 8.813 1.00 0.00 O ATOM 1140 CB ASN A 71 -4.112 -33.279 8.742 1.00 0.00 C ATOM 1141 CG ASN A 71 -3.319 -34.519 8.327 1.00 0.00 C ATOM 1142 OD1 ASN A 71 -3.028 -34.708 7.163 1.00 0.00 O ATOM 1143 ND2 ASN A 71 -2.952 -35.379 9.238 1.00 0.00 N ATOM 0 H ASN A 71 -2.158 -31.542 8.263 1.00 0.00 H new ATOM 0 HA ASN A 71 -4.444 -32.692 6.696 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -3.694 -32.856 9.656 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -5.145 -33.551 8.959 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.421 -36.209 8.972 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -3.196 -35.221 10.216 1.00 0.00 H new ATOM 1150 N LEU A 72 -6.093 -30.926 7.398 1.00 0.00 N ATOM 1151 CA LEU A 72 -6.984 -29.777 7.723 1.00 0.00 C ATOM 1152 C LEU A 72 -7.381 -29.840 9.199 1.00 0.00 C ATOM 1153 O LEU A 72 -7.541 -30.904 9.762 1.00 0.00 O ATOM 1154 CB LEU A 72 -8.241 -29.843 6.853 1.00 0.00 C ATOM 1155 CG LEU A 72 -8.043 -28.982 5.605 1.00 0.00 C ATOM 1156 CD1 LEU A 72 -6.907 -29.560 4.761 1.00 0.00 C ATOM 1157 CD2 LEU A 72 -9.335 -28.971 4.783 1.00 0.00 C ATOM 0 H LEU A 72 -6.459 -31.577 6.703 1.00 0.00 H new ATOM 0 HA LEU A 72 -6.457 -28.843 7.529 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -8.445 -30.875 6.567 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -9.105 -29.492 7.417 1.00 0.00 H new ATOM 0 HG LEU A 72 -7.792 -27.964 5.902 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.766 -28.946 3.871 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -5.987 -29.568 5.346 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -7.157 -30.578 4.463 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -9.195 -28.357 3.893 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -9.586 -29.989 4.486 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -10.145 -28.558 5.384 1.00 0.00 H new ATOM 1169 N PRO A 73 -7.540 -28.669 9.834 1.00 0.00 N ATOM 1170 CA PRO A 73 -7.919 -28.580 11.250 1.00 0.00 C ATOM 1171 C PRO A 73 -9.371 -29.012 11.477 1.00 0.00 C ATOM 1172 O PRO A 73 -10.228 -28.809 10.639 1.00 0.00 O ATOM 1173 CB PRO A 73 -7.761 -27.094 11.569 1.00 0.00 C ATOM 1174 CG PRO A 73 -7.922 -26.408 10.256 1.00 0.00 C ATOM 1175 CD PRO A 73 -7.364 -27.342 9.221 1.00 0.00 C ATOM 0 HA PRO A 73 -7.312 -29.232 11.878 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -8.512 -26.760 12.285 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.786 -26.885 12.009 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.971 -26.190 10.057 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.391 -25.456 10.247 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.900 -27.261 8.275 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -6.315 -27.131 9.012 1.00 0.00 H new ATOM 1183 N ALA A 74 -9.655 -29.603 12.605 1.00 0.00 N ATOM 1184 CA ALA A 74 -11.050 -30.044 12.883 1.00 0.00 C ATOM 1185 C ALA A 74 -11.966 -28.822 12.961 1.00 0.00 C ATOM 1186 O ALA A 74 -11.538 -27.734 13.292 1.00 0.00 O ATOM 1187 CB ALA A 74 -11.091 -30.797 14.215 1.00 0.00 C ATOM 0 H ALA A 74 -8.981 -29.799 13.345 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.389 -30.702 12.082 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -12.112 -31.120 14.419 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.439 -31.669 14.161 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.752 -30.139 15.015 1.00 0.00 H new ATOM 1193 N GLY A 75 -13.224 -28.991 12.659 1.00 0.00 N ATOM 1194 CA GLY A 75 -14.166 -27.838 12.715 1.00 0.00 C ATOM 1195 C GLY A 75 -14.405 -27.300 11.301 1.00 0.00 C ATOM 1196 O GLY A 75 -15.090 -26.316 11.110 1.00 0.00 O ATOM 0 H GLY A 75 -13.640 -29.878 12.376 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -15.111 -28.149 13.161 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -13.757 -27.052 13.350 1.00 0.00 H new ATOM 1200 N VAL A 76 -13.845 -27.937 10.309 1.00 0.00 N ATOM 1201 CA VAL A 76 -14.043 -27.460 8.911 1.00 0.00 C ATOM 1202 C VAL A 76 -14.504 -28.626 8.034 1.00 0.00 C ATOM 1203 O VAL A 76 -14.125 -29.761 8.245 1.00 0.00 O ATOM 1204 CB VAL A 76 -12.724 -26.905 8.370 1.00 0.00 C ATOM 1205 CG1 VAL A 76 -12.929 -26.406 6.938 1.00 0.00 C ATOM 1206 CG2 VAL A 76 -12.257 -25.746 9.252 1.00 0.00 C ATOM 0 H VAL A 76 -13.259 -28.766 10.406 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.800 -26.675 8.899 1.00 0.00 H new ATOM 0 HB VAL A 76 -11.970 -27.692 8.376 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -11.989 -26.011 6.552 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -13.260 -27.232 6.309 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -13.684 -25.619 6.931 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -11.317 -25.351 8.866 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.011 -24.959 9.247 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -12.110 -26.101 10.272 1.00 0.00 H new ATOM 1216 N ASP A 77 -15.320 -28.355 7.053 1.00 0.00 N ATOM 1217 CA ASP A 77 -15.804 -29.448 6.164 1.00 0.00 C ATOM 1218 C ASP A 77 -15.251 -29.242 4.753 1.00 0.00 C ATOM 1219 O ASP A 77 -15.059 -28.127 4.308 1.00 0.00 O ATOM 1220 CB ASP A 77 -17.334 -29.430 6.120 1.00 0.00 C ATOM 1221 CG ASP A 77 -17.888 -29.783 7.501 1.00 0.00 C ATOM 1222 OD1 ASP A 77 -17.124 -30.270 8.318 1.00 0.00 O ATOM 1223 OD2 ASP A 77 -19.067 -29.560 7.719 1.00 0.00 O ATOM 0 H ASP A 77 -15.672 -27.424 6.829 1.00 0.00 H new ATOM 0 HA ASP A 77 -15.462 -30.408 6.551 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -17.688 -28.445 5.815 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -17.696 -30.142 5.378 1.00 0.00 H new ATOM 1228 N VAL A 78 -14.992 -30.307 4.044 1.00 0.00 N ATOM 1229 CA VAL A 78 -14.451 -30.170 2.663 1.00 0.00 C ATOM 1230 C VAL A 78 -15.364 -30.910 1.682 1.00 0.00 C ATOM 1231 O VAL A 78 -15.755 -32.036 1.914 1.00 0.00 O ATOM 1232 CB VAL A 78 -13.046 -30.769 2.604 1.00 0.00 C ATOM 1233 CG1 VAL A 78 -12.443 -30.523 1.220 1.00 0.00 C ATOM 1234 CG2 VAL A 78 -12.165 -30.112 3.669 1.00 0.00 C ATOM 0 H VAL A 78 -15.132 -31.266 4.362 1.00 0.00 H new ATOM 0 HA VAL A 78 -14.407 -29.115 2.393 1.00 0.00 H new ATOM 0 HB VAL A 78 -13.101 -31.842 2.790 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -11.441 -30.950 1.178 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -13.069 -30.992 0.462 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -12.388 -29.451 1.032 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.163 -30.539 3.627 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.110 -29.039 3.484 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -12.594 -30.289 4.655 1.00 0.00 H new ATOM 1244 N GLU A 79 -15.704 -30.286 0.588 1.00 0.00 N ATOM 1245 CA GLU A 79 -16.592 -30.954 -0.405 1.00 0.00 C ATOM 1246 C GLU A 79 -15.818 -31.189 -1.705 1.00 0.00 C ATOM 1247 O GLU A 79 -14.998 -30.386 -2.104 1.00 0.00 O ATOM 1248 CB GLU A 79 -17.803 -30.063 -0.688 1.00 0.00 C ATOM 1249 CG GLU A 79 -18.590 -29.846 0.606 1.00 0.00 C ATOM 1250 CD GLU A 79 -19.081 -31.195 1.136 1.00 0.00 C ATOM 1251 OE1 GLU A 79 -19.078 -32.147 0.372 1.00 0.00 O ATOM 1252 OE2 GLU A 79 -19.452 -31.254 2.297 1.00 0.00 O ATOM 0 H GLU A 79 -15.406 -29.343 0.339 1.00 0.00 H new ATOM 0 HA GLU A 79 -16.930 -31.910 -0.004 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -17.476 -29.105 -1.093 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -18.441 -30.526 -1.441 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -17.960 -29.358 1.350 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -19.437 -29.185 0.423 1.00 0.00 H new ATOM 1259 N ILE A 80 -16.072 -32.284 -2.367 1.00 0.00 N ATOM 1260 CA ILE A 80 -15.351 -32.570 -3.639 1.00 0.00 C ATOM 1261 C ILE A 80 -16.359 -32.660 -4.787 1.00 0.00 C ATOM 1262 O ILE A 80 -17.382 -33.304 -4.677 1.00 0.00 O ATOM 1263 CB ILE A 80 -14.600 -33.897 -3.514 1.00 0.00 C ATOM 1264 CG1 ILE A 80 -13.641 -33.833 -2.324 1.00 0.00 C ATOM 1265 CG2 ILE A 80 -13.805 -34.154 -4.796 1.00 0.00 C ATOM 1266 CD1 ILE A 80 -12.986 -35.200 -2.123 1.00 0.00 C ATOM 0 H ILE A 80 -16.748 -32.993 -2.082 1.00 0.00 H new ATOM 0 HA ILE A 80 -14.640 -31.769 -3.841 1.00 0.00 H new ATOM 0 HB ILE A 80 -15.315 -34.705 -3.360 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.878 -33.074 -2.499 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -14.181 -33.541 -1.423 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -13.269 -35.099 -4.709 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -14.488 -34.201 -5.644 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -13.091 -33.345 -4.950 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -12.303 -35.155 -1.275 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -13.756 -35.947 -1.929 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -12.432 -35.474 -3.021 1.00 0.00 H new ATOM 1278 N LYS A 81 -16.077 -32.019 -5.888 1.00 0.00 N ATOM 1279 CA LYS A 81 -17.020 -32.070 -7.041 1.00 0.00 C ATOM 1280 C LYS A 81 -17.247 -33.527 -7.450 1.00 0.00 C ATOM 1281 O LYS A 81 -18.323 -33.902 -7.870 1.00 0.00 O ATOM 1282 CB LYS A 81 -16.426 -31.296 -8.219 1.00 0.00 C ATOM 1283 CG LYS A 81 -16.307 -29.817 -7.850 1.00 0.00 C ATOM 1284 CD LYS A 81 -15.833 -29.022 -9.069 1.00 0.00 C ATOM 1285 CE LYS A 81 -15.603 -27.564 -8.670 1.00 0.00 C ATOM 1286 NZ LYS A 81 -16.544 -26.689 -9.425 1.00 0.00 N ATOM 0 H LYS A 81 -15.235 -31.463 -6.039 1.00 0.00 H new ATOM 0 HA LYS A 81 -17.971 -31.621 -6.754 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -15.446 -31.698 -8.475 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -17.058 -31.412 -9.100 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -17.270 -29.438 -7.508 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -15.604 -29.692 -7.026 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.912 -29.452 -9.461 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -16.576 -29.079 -9.865 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -15.755 -27.441 -7.598 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -14.573 -27.276 -8.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -16.388 -25.697 -9.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -16.378 -26.800 -10.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -17.523 -26.959 -9.203 1.00 0.00 H new ATOM 1300 N LEU A 82 -16.242 -34.350 -7.332 1.00 0.00 N ATOM 1301 CA LEU A 82 -16.401 -35.782 -7.714 1.00 0.00 C ATOM 1302 C LEU A 82 -16.206 -36.664 -6.480 1.00 0.00 C ATOM 1303 O LEU A 82 -16.010 -37.855 -6.653 1.00 0.00 O ATOM 1304 CB LEU A 82 -15.358 -36.146 -8.772 1.00 0.00 C ATOM 1305 CG LEU A 82 -15.470 -35.180 -9.953 1.00 0.00 C ATOM 1306 CD1 LEU A 82 -14.511 -35.616 -11.062 1.00 0.00 C ATOM 1307 CD2 LEU A 82 -16.904 -35.190 -10.487 1.00 0.00 C ATOM 1308 OXT LEU A 82 -16.256 -36.133 -5.382 1.00 0.00 O ATOM 0 H LEU A 82 -15.317 -34.093 -6.987 1.00 0.00 H new ATOM 0 HA LEU A 82 -17.400 -35.941 -8.119 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -14.357 -36.098 -8.343 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -15.511 -37.171 -9.111 1.00 0.00 H new ATOM 0 HG LEU A 82 -15.212 -34.174 -9.624 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -14.591 -34.928 -11.903 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -13.489 -35.609 -10.683 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -14.769 -36.623 -11.391 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -16.984 -34.502 -11.328 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -17.163 -36.197 -10.816 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -17.588 -34.879 -9.698 1.00 0.00 H new TER 1320 LEU A 82