USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 928 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: E 31 ASN : amide:sc= -3.53! K(o=-11!,f=-4.1) USER MOD Set 1.2: E 35 HIS : no HE2:sc= -6.97! C(o=-11!,f=-12!) USER MOD Set 2.1: D 31 ASN : amide:sc= -2.98! C(o=-5.3!,f=-10!) USER MOD Set 2.2: D 35 HIS : no HD1:sc= -2.29! K(o=-5.3!,f=-2.1) USER MOD Set 3.1: D 28 SER OG : rot 180:sc= 0 USER MOD Set 3.2: D 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: D 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: D 16 GLN : amide:sc= -0.16 K(o=-0.16,f=-2.4!) USER MOD Set 5.1: D 6 THR OG1 : rot 180:sc= 0.0138 USER MOD Set 5.2: D 8 LYS NZ :NH3+ 159:sc= -0.197 (180deg=-0.419) USER MOD Single : D 3 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.011) USER MOD Single : D 10 TYR OH : rot 107:sc= 0.117 USER MOD Single : D 17 THR OG1 : rot 180:sc= 0.0904 USER MOD Single : D 18 LYS NZ :NH3+ -124:sc= -0.473 (180deg=-2.02) USER MOD Single : D 19 THR OG1 : rot 60:sc= 0.86 USER MOD Single : D 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 26 TYR OH : rot 180:sc= 0 USER MOD Single : D 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 43 THR OG1 : rot 180:sc= 0 USER MOD Single : D 45 ASN : amide:sc= -1.06 K(o=-1.1,f=-0.017) USER MOD Single : D 49 SER OG : rot 180:sc= 0 USER MOD Single : D 51 TYR OH : rot 180:sc= 0 USER MOD Single : D 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 3 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : E 6 THR OG1 : rot 180:sc= 0.0902 USER MOD Single : E 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 10 TYR OH : rot 150:sc= 0 USER MOD Single : E 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : E 16 GLN : amide:sc= -0.0531 X(o=-0.053,f=0) USER MOD Single : E 17 THR OG1 : rot 180:sc= 0.00337 USER MOD Single : E 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 19 THR OG1 : rot -67:sc= -1.5! USER MOD Single : E 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 26 TYR OH : rot 180:sc= 0 USER MOD Single : E 27 GLN : amide:sc= 0 X(o=0,f=-0.0031) USER MOD Single : E 28 SER OG : rot 180:sc= 0 USER MOD Single : E 32 LYS NZ :NH3+ -153:sc= -0.0048 (180deg=-0.81) USER MOD Single : E 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 43 THR OG1 : rot 180:sc= -0.337 USER MOD Single : E 45 ASN : amide:sc= -1.08 K(o=-1.1,f=-2.4!) USER MOD Single : E 49 SER OG : rot 180:sc= 0 USER MOD Single : E 51 TYR OH : rot 180:sc= 0 USER MOD Single : E 56 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.319) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU D 2 -16.873 18.101 -10.203 1.00 0.00 N ATOM 21 CA GLU D 2 -17.443 17.162 -11.210 1.00 0.00 C ATOM 22 C GLU D 2 -18.029 15.938 -10.498 1.00 0.00 C ATOM 23 O GLU D 2 -17.750 15.687 -9.342 1.00 0.00 O ATOM 24 CB GLU D 2 -16.337 16.709 -12.168 1.00 0.00 C ATOM 25 CG GLU D 2 -16.053 17.816 -13.187 1.00 0.00 C ATOM 26 CD GLU D 2 -14.583 18.234 -13.097 1.00 0.00 C ATOM 27 OE1 GLU D 2 -13.819 17.512 -12.477 1.00 0.00 O ATOM 28 OE2 GLU D 2 -14.247 19.268 -13.650 1.00 0.00 O ATOM 0 HA GLU D 2 -18.229 17.668 -11.771 1.00 0.00 H new ATOM 0 HB2 GLU D 2 -15.431 16.475 -11.609 1.00 0.00 H new ATOM 0 HB3 GLU D 2 -16.639 15.797 -12.682 1.00 0.00 H new ATOM 0 HG2 GLU D 2 -16.280 17.464 -14.193 1.00 0.00 H new ATOM 0 HG3 GLU D 2 -16.698 18.674 -12.996 1.00 0.00 H new ATOM 35 N GLN D 3 -18.837 15.173 -11.183 1.00 0.00 N ATOM 36 CA GLN D 3 -19.441 13.964 -10.548 1.00 0.00 C ATOM 37 C GLN D 3 -18.377 12.870 -10.420 1.00 0.00 C ATOM 38 O GLN D 3 -18.025 12.219 -11.383 1.00 0.00 O ATOM 39 CB GLN D 3 -20.592 13.454 -11.419 1.00 0.00 C ATOM 40 CG GLN D 3 -21.914 14.039 -10.918 1.00 0.00 C ATOM 41 CD GLN D 3 -22.640 14.726 -12.076 1.00 0.00 C ATOM 42 OE1 GLN D 3 -23.114 15.836 -11.937 1.00 0.00 O ATOM 43 NE2 GLN D 3 -22.748 14.110 -13.222 1.00 0.00 N ATOM 0 H GLN D 3 -19.105 15.332 -12.154 1.00 0.00 H new ATOM 0 HA GLN D 3 -19.818 14.222 -9.559 1.00 0.00 H new ATOM 0 HB2 GLN D 3 -20.428 13.738 -12.459 1.00 0.00 H new ATOM 0 HB3 GLN D 3 -20.630 12.365 -11.388 1.00 0.00 H new ATOM 0 HG2 GLN D 3 -22.539 13.249 -10.501 1.00 0.00 H new ATOM 0 HG3 GLN D 3 -21.727 14.754 -10.117 1.00 0.00 H new ATOM 0 HE21 GLN D 3 -22.350 13.178 -13.340 1.00 0.00 H new ATOM 0 HE22 GLN D 3 -23.230 14.561 -14.000 1.00 0.00 H new ATOM 52 N ARG D 4 -17.858 12.665 -9.240 1.00 0.00 N ATOM 53 CA ARG D 4 -16.813 11.616 -9.057 1.00 0.00 C ATOM 54 C ARG D 4 -17.419 10.398 -8.348 1.00 0.00 C ATOM 55 O ARG D 4 -17.897 10.493 -7.236 1.00 0.00 O ATOM 56 CB ARG D 4 -15.672 12.189 -8.208 1.00 0.00 C ATOM 57 CG ARG D 4 -14.788 13.090 -9.077 1.00 0.00 C ATOM 58 CD ARG D 4 -13.962 12.226 -10.030 1.00 0.00 C ATOM 59 NE ARG D 4 -12.685 11.841 -9.369 1.00 0.00 N ATOM 60 CZ ARG D 4 -12.459 10.592 -9.068 1.00 0.00 C ATOM 61 NH1 ARG D 4 -12.749 9.655 -9.928 1.00 0.00 N ATOM 62 NH2 ARG D 4 -11.950 10.280 -7.907 1.00 0.00 N ATOM 0 H ARG D 4 -18.112 13.178 -8.395 1.00 0.00 H new ATOM 0 HA ARG D 4 -16.430 11.308 -10.030 1.00 0.00 H new ATOM 0 HB2 ARG D 4 -16.078 12.758 -7.372 1.00 0.00 H new ATOM 0 HB3 ARG D 4 -15.078 11.379 -7.784 1.00 0.00 H new ATOM 0 HG2 ARG D 4 -15.406 13.787 -9.644 1.00 0.00 H new ATOM 0 HG3 ARG D 4 -14.129 13.688 -8.447 1.00 0.00 H new ATOM 0 HD2 ARG D 4 -14.523 11.334 -10.308 1.00 0.00 H new ATOM 0 HD3 ARG D 4 -13.757 12.774 -10.950 1.00 0.00 H new ATOM 0 HE ARG D 4 -11.988 12.553 -9.152 1.00 0.00 H new ATOM 0 HH11 ARG D 4 -13.151 9.900 -10.833 1.00 0.00 H new ATOM 0 HH12 ARG D 4 -12.573 8.677 -9.696 1.00 0.00 H new ATOM 0 HH21 ARG D 4 -11.728 11.013 -7.234 1.00 0.00 H new ATOM 0 HH22 ARG D 4 -11.774 9.303 -7.673 1.00 0.00 H new ATOM 76 N ILE D 5 -17.400 9.252 -8.983 1.00 0.00 N ATOM 77 CA ILE D 5 -17.974 8.030 -8.341 1.00 0.00 C ATOM 78 C ILE D 5 -17.213 6.792 -8.820 1.00 0.00 C ATOM 79 O ILE D 5 -16.632 6.785 -9.886 1.00 0.00 O ATOM 80 CB ILE D 5 -19.446 7.883 -8.731 1.00 0.00 C ATOM 81 CG1 ILE D 5 -20.238 9.092 -8.234 1.00 0.00 C ATOM 82 CG2 ILE D 5 -20.017 6.611 -8.101 1.00 0.00 C ATOM 83 CD1 ILE D 5 -20.322 10.135 -9.348 1.00 0.00 C ATOM 0 H ILE D 5 -17.013 9.110 -9.916 1.00 0.00 H new ATOM 0 HA ILE D 5 -17.886 8.125 -7.259 1.00 0.00 H new ATOM 0 HB ILE D 5 -19.523 7.822 -9.817 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -21.239 8.786 -7.931 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -19.756 9.520 -7.355 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -21.066 6.506 -8.379 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -19.459 5.746 -8.459 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -19.934 6.673 -7.016 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -20.886 10.999 -8.996 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -19.317 10.449 -9.629 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -20.823 9.703 -10.214 1.00 0.00 H new ATOM 95 N THR D 6 -17.220 5.739 -8.047 1.00 0.00 N ATOM 96 CA THR D 6 -16.504 4.501 -8.469 1.00 0.00 C ATOM 97 C THR D 6 -17.416 3.682 -9.386 1.00 0.00 C ATOM 98 O THR D 6 -18.616 3.649 -9.212 1.00 0.00 O ATOM 99 CB THR D 6 -16.137 3.671 -7.235 1.00 0.00 C ATOM 100 OG1 THR D 6 -16.080 4.518 -6.094 1.00 0.00 O ATOM 101 CG2 THR D 6 -14.775 3.007 -7.449 1.00 0.00 C ATOM 0 H THR D 6 -17.690 5.683 -7.143 1.00 0.00 H new ATOM 0 HA THR D 6 -15.592 4.770 -9.003 1.00 0.00 H new ATOM 0 HB THR D 6 -16.893 2.901 -7.078 1.00 0.00 H new ATOM 0 HG1 THR D 6 -15.847 3.987 -5.304 1.00 0.00 H new ATOM 0 HG21 THR D 6 -14.516 2.417 -6.570 1.00 0.00 H new ATOM 0 HG22 THR D 6 -14.821 2.356 -8.322 1.00 0.00 H new ATOM 0 HG23 THR D 6 -14.017 3.774 -7.607 1.00 0.00 H new ATOM 109 N LEU D 7 -16.856 3.020 -10.362 1.00 0.00 N ATOM 110 CA LEU D 7 -17.686 2.203 -11.296 1.00 0.00 C ATOM 111 C LEU D 7 -18.671 1.341 -10.500 1.00 0.00 C ATOM 112 O LEU D 7 -19.682 0.905 -11.013 1.00 0.00 O ATOM 113 CB LEU D 7 -16.762 1.304 -12.130 1.00 0.00 C ATOM 114 CG LEU D 7 -17.568 0.161 -12.758 1.00 0.00 C ATOM 115 CD1 LEU D 7 -18.643 0.737 -13.680 1.00 0.00 C ATOM 116 CD2 LEU D 7 -16.630 -0.736 -13.569 1.00 0.00 C ATOM 0 H LEU D 7 -15.854 3.009 -10.554 1.00 0.00 H new ATOM 0 HA LEU D 7 -18.250 2.862 -11.956 1.00 0.00 H new ATOM 0 HB2 LEU D 7 -16.279 1.891 -12.911 1.00 0.00 H new ATOM 0 HB3 LEU D 7 -15.970 0.898 -11.500 1.00 0.00 H new ATOM 0 HG LEU D 7 -18.043 -0.423 -11.970 1.00 0.00 H new ATOM 0 HD11 LEU D 7 -19.215 -0.077 -14.125 1.00 0.00 H new ATOM 0 HD12 LEU D 7 -19.311 1.377 -13.104 1.00 0.00 H new ATOM 0 HD13 LEU D 7 -18.170 1.322 -14.469 1.00 0.00 H new ATOM 0 HD21 LEU D 7 -17.201 -1.549 -14.016 1.00 0.00 H new ATOM 0 HD22 LEU D 7 -16.156 -0.150 -14.356 1.00 0.00 H new ATOM 0 HD23 LEU D 7 -15.864 -1.149 -12.913 1.00 0.00 H new ATOM 128 N LYS D 8 -18.381 1.084 -9.258 1.00 0.00 N ATOM 129 CA LYS D 8 -19.293 0.246 -8.436 1.00 0.00 C ATOM 130 C LYS D 8 -20.453 1.096 -7.917 1.00 0.00 C ATOM 131 O LYS D 8 -21.593 0.676 -7.917 1.00 0.00 O ATOM 132 CB LYS D 8 -18.493 -0.352 -7.273 1.00 0.00 C ATOM 133 CG LYS D 8 -18.437 0.631 -6.096 1.00 0.00 C ATOM 134 CD LYS D 8 -17.510 0.074 -5.015 1.00 0.00 C ATOM 135 CE LYS D 8 -16.615 1.194 -4.477 1.00 0.00 C ATOM 136 NZ LYS D 8 -17.460 2.316 -3.980 1.00 0.00 N ATOM 0 H LYS D 8 -17.548 1.420 -8.775 1.00 0.00 H new ATOM 0 HA LYS D 8 -19.710 -0.561 -9.039 1.00 0.00 H new ATOM 0 HB2 LYS D 8 -18.952 -1.287 -6.952 1.00 0.00 H new ATOM 0 HB3 LYS D 8 -17.482 -0.590 -7.604 1.00 0.00 H new ATOM 0 HG2 LYS D 8 -18.076 1.602 -6.435 1.00 0.00 H new ATOM 0 HG3 LYS D 8 -19.436 0.786 -5.689 1.00 0.00 H new ATOM 0 HD2 LYS D 8 -18.098 -0.356 -4.204 1.00 0.00 H new ATOM 0 HD3 LYS D 8 -16.898 -0.729 -5.426 1.00 0.00 H new ATOM 0 HE2 LYS D 8 -15.986 0.815 -3.671 1.00 0.00 H new ATOM 0 HE3 LYS D 8 -15.948 1.549 -5.263 1.00 0.00 H new ATOM 0 HZ1 LYS D 8 -16.911 2.895 -3.313 1.00 0.00 H new ATOM 0 HZ2 LYS D 8 -17.762 2.905 -4.782 1.00 0.00 H new ATOM 0 HZ3 LYS D 8 -18.298 1.932 -3.497 1.00 0.00 H new ATOM 150 N ASP D 9 -20.174 2.289 -7.483 1.00 0.00 N ATOM 151 CA ASP D 9 -21.261 3.168 -6.972 1.00 0.00 C ATOM 152 C ASP D 9 -22.130 3.624 -8.146 1.00 0.00 C ATOM 153 O ASP D 9 -23.283 3.961 -7.982 1.00 0.00 O ATOM 154 CB ASP D 9 -20.650 4.387 -6.278 1.00 0.00 C ATOM 155 CG ASP D 9 -20.663 4.173 -4.765 1.00 0.00 C ATOM 156 OD1 ASP D 9 -21.745 4.061 -4.210 1.00 0.00 O ATOM 157 OD2 ASP D 9 -19.591 4.122 -4.184 1.00 0.00 O ATOM 0 H ASP D 9 -19.239 2.696 -7.459 1.00 0.00 H new ATOM 0 HA ASP D 9 -21.873 2.619 -6.256 1.00 0.00 H new ATOM 0 HB2 ASP D 9 -19.628 4.542 -6.625 1.00 0.00 H new ATOM 0 HB3 ASP D 9 -21.213 5.284 -6.534 1.00 0.00 H new ATOM 162 N TYR D 10 -21.582 3.641 -9.330 1.00 0.00 N ATOM 163 CA TYR D 10 -22.370 4.079 -10.517 1.00 0.00 C ATOM 164 C TYR D 10 -23.271 2.938 -10.994 1.00 0.00 C ATOM 165 O TYR D 10 -24.353 3.159 -11.500 1.00 0.00 O ATOM 166 CB TYR D 10 -21.407 4.476 -11.641 1.00 0.00 C ATOM 167 CG TYR D 10 -22.180 4.714 -12.915 1.00 0.00 C ATOM 168 CD1 TYR D 10 -23.370 5.449 -12.887 1.00 0.00 C ATOM 169 CD2 TYR D 10 -21.704 4.200 -14.128 1.00 0.00 C ATOM 170 CE1 TYR D 10 -24.085 5.671 -14.068 1.00 0.00 C ATOM 171 CE2 TYR D 10 -22.420 4.420 -15.310 1.00 0.00 C ATOM 172 CZ TYR D 10 -23.610 5.156 -15.280 1.00 0.00 C ATOM 173 OH TYR D 10 -24.316 5.373 -16.446 1.00 0.00 O ATOM 0 H TYR D 10 -20.619 3.369 -9.527 1.00 0.00 H new ATOM 0 HA TYR D 10 -22.991 4.932 -10.245 1.00 0.00 H new ATOM 0 HB2 TYR D 10 -20.860 5.377 -11.363 1.00 0.00 H new ATOM 0 HB3 TYR D 10 -20.668 3.689 -11.794 1.00 0.00 H new ATOM 0 HD1 TYR D 10 -23.737 5.846 -11.952 1.00 0.00 H new ATOM 0 HD2 TYR D 10 -20.784 3.634 -14.151 1.00 0.00 H new ATOM 0 HE1 TYR D 10 -25.003 6.239 -14.045 1.00 0.00 H new ATOM 0 HE2 TYR D 10 -22.054 4.022 -16.245 1.00 0.00 H new ATOM 0 HH TYR D 10 -23.839 6.025 -17.001 1.00 0.00 H new ATOM 183 N ALA D 11 -22.834 1.719 -10.844 1.00 0.00 N ATOM 184 CA ALA D 11 -23.667 0.568 -11.298 1.00 0.00 C ATOM 185 C ALA D 11 -24.741 0.254 -10.251 1.00 0.00 C ATOM 186 O ALA D 11 -25.829 -0.176 -10.579 1.00 0.00 O ATOM 187 CB ALA D 11 -22.774 -0.660 -11.488 1.00 0.00 C ATOM 0 H ALA D 11 -21.937 1.469 -10.427 1.00 0.00 H new ATOM 0 HA ALA D 11 -24.149 0.826 -12.241 1.00 0.00 H new ATOM 0 HB1 ALA D 11 -23.380 -1.503 -11.820 1.00 0.00 H new ATOM 0 HB2 ALA D 11 -22.012 -0.444 -12.237 1.00 0.00 H new ATOM 0 HB3 ALA D 11 -22.292 -0.909 -10.543 1.00 0.00 H new ATOM 193 N MET D 12 -24.441 0.441 -8.994 1.00 0.00 N ATOM 194 CA MET D 12 -25.449 0.123 -7.938 1.00 0.00 C ATOM 195 C MET D 12 -26.381 1.315 -7.675 1.00 0.00 C ATOM 196 O MET D 12 -27.533 1.139 -7.332 1.00 0.00 O ATOM 197 CB MET D 12 -24.724 -0.247 -6.641 1.00 0.00 C ATOM 198 CG MET D 12 -24.402 -1.743 -6.648 1.00 0.00 C ATOM 199 SD MET D 12 -22.983 -2.053 -7.728 1.00 0.00 S ATOM 200 CE MET D 12 -23.170 -3.849 -7.833 1.00 0.00 C ATOM 0 H MET D 12 -23.548 0.798 -8.653 1.00 0.00 H new ATOM 0 HA MET D 12 -26.055 -0.713 -8.287 1.00 0.00 H new ATOM 0 HB2 MET D 12 -23.806 0.333 -6.546 1.00 0.00 H new ATOM 0 HB3 MET D 12 -25.347 -0.002 -5.781 1.00 0.00 H new ATOM 0 HG2 MET D 12 -24.183 -2.083 -5.636 1.00 0.00 H new ATOM 0 HG3 MET D 12 -25.266 -2.310 -6.994 1.00 0.00 H new ATOM 0 HE1 MET D 12 -22.383 -4.260 -8.465 1.00 0.00 H new ATOM 0 HE2 MET D 12 -23.098 -4.281 -6.835 1.00 0.00 H new ATOM 0 HE3 MET D 12 -24.142 -4.089 -8.263 1.00 0.00 H new ATOM 210 N ARG D 13 -25.902 2.522 -7.810 1.00 0.00 N ATOM 211 CA ARG D 13 -26.785 3.698 -7.537 1.00 0.00 C ATOM 212 C ARG D 13 -27.510 4.145 -8.807 1.00 0.00 C ATOM 213 O ARG D 13 -28.577 4.724 -8.746 1.00 0.00 O ATOM 214 CB ARG D 13 -25.952 4.867 -7.010 1.00 0.00 C ATOM 215 CG ARG D 13 -25.610 4.631 -5.539 1.00 0.00 C ATOM 216 CD ARG D 13 -26.489 5.527 -4.665 1.00 0.00 C ATOM 217 NE ARG D 13 -25.844 5.706 -3.334 1.00 0.00 N ATOM 218 CZ ARG D 13 -26.075 4.848 -2.379 1.00 0.00 C ATOM 219 NH1 ARG D 13 -26.652 3.709 -2.651 1.00 0.00 N ATOM 220 NH2 ARG D 13 -25.731 5.130 -1.152 1.00 0.00 N ATOM 0 H ARG D 13 -24.948 2.746 -8.094 1.00 0.00 H new ATOM 0 HA ARG D 13 -27.522 3.397 -6.792 1.00 0.00 H new ATOM 0 HB2 ARG D 13 -25.038 4.968 -7.595 1.00 0.00 H new ATOM 0 HB3 ARG D 13 -26.505 5.800 -7.120 1.00 0.00 H new ATOM 0 HG2 ARG D 13 -25.768 3.584 -5.281 1.00 0.00 H new ATOM 0 HG3 ARG D 13 -24.557 4.848 -5.359 1.00 0.00 H new ATOM 0 HD2 ARG D 13 -26.632 6.495 -5.145 1.00 0.00 H new ATOM 0 HD3 ARG D 13 -27.477 5.081 -4.546 1.00 0.00 H new ATOM 0 HE ARG D 13 -25.223 6.498 -3.170 1.00 0.00 H new ATOM 0 HH11 ARG D 13 -26.922 3.490 -3.610 1.00 0.00 H new ATOM 0 HH12 ARG D 13 -26.833 3.038 -1.905 1.00 0.00 H new ATOM 0 HH21 ARG D 13 -25.282 6.021 -0.940 1.00 0.00 H new ATOM 0 HH22 ARG D 13 -25.911 4.459 -0.405 1.00 0.00 H new ATOM 234 N PHE D 14 -26.946 3.905 -9.957 1.00 0.00 N ATOM 235 CA PHE D 14 -27.621 4.347 -11.210 1.00 0.00 C ATOM 236 C PHE D 14 -28.164 3.138 -11.970 1.00 0.00 C ATOM 237 O PHE D 14 -29.261 3.164 -12.488 1.00 0.00 O ATOM 238 CB PHE D 14 -26.624 5.106 -12.083 1.00 0.00 C ATOM 239 CG PHE D 14 -26.035 6.249 -11.288 1.00 0.00 C ATOM 240 CD1 PHE D 14 -25.222 5.986 -10.178 1.00 0.00 C ATOM 241 CD2 PHE D 14 -26.302 7.571 -11.662 1.00 0.00 C ATOM 242 CE1 PHE D 14 -24.678 7.045 -9.443 1.00 0.00 C ATOM 243 CE2 PHE D 14 -25.757 8.631 -10.927 1.00 0.00 C ATOM 244 CZ PHE D 14 -24.945 8.367 -9.816 1.00 0.00 C ATOM 0 H PHE D 14 -26.054 3.426 -10.084 1.00 0.00 H new ATOM 0 HA PHE D 14 -28.454 5.003 -10.957 1.00 0.00 H new ATOM 0 HB2 PHE D 14 -25.833 4.436 -12.419 1.00 0.00 H new ATOM 0 HB3 PHE D 14 -27.120 5.486 -12.976 1.00 0.00 H new ATOM 0 HD1 PHE D 14 -25.015 4.966 -9.890 1.00 0.00 H new ATOM 0 HD2 PHE D 14 -26.929 7.774 -12.518 1.00 0.00 H new ATOM 0 HE1 PHE D 14 -24.051 6.842 -8.587 1.00 0.00 H new ATOM 0 HE2 PHE D 14 -25.962 9.651 -11.216 1.00 0.00 H new ATOM 0 HZ PHE D 14 -24.525 9.184 -9.248 1.00 0.00 H new ATOM 254 N GLY D 15 -27.414 2.076 -12.035 1.00 0.00 N ATOM 255 CA GLY D 15 -27.904 0.869 -12.760 1.00 0.00 C ATOM 256 C GLY D 15 -26.748 0.207 -13.512 1.00 0.00 C ATOM 257 O GLY D 15 -25.913 0.868 -14.098 1.00 0.00 O ATOM 0 H GLY D 15 -26.486 1.989 -11.620 1.00 0.00 H new ATOM 0 HA2 GLY D 15 -28.342 0.163 -12.054 1.00 0.00 H new ATOM 0 HA3 GLY D 15 -28.691 1.149 -13.460 1.00 0.00 H new ATOM 261 N GLN D 16 -26.697 -1.099 -13.505 1.00 0.00 N ATOM 262 CA GLN D 16 -25.602 -1.810 -14.222 1.00 0.00 C ATOM 263 C GLN D 16 -25.879 -1.780 -15.726 1.00 0.00 C ATOM 264 O GLN D 16 -24.981 -1.634 -16.532 1.00 0.00 O ATOM 265 CB GLN D 16 -25.542 -3.265 -13.745 1.00 0.00 C ATOM 266 CG GLN D 16 -24.628 -3.365 -12.522 1.00 0.00 C ATOM 267 CD GLN D 16 -24.931 -4.659 -11.763 1.00 0.00 C ATOM 268 OE1 GLN D 16 -25.988 -5.236 -11.920 1.00 0.00 O ATOM 269 NE2 GLN D 16 -24.039 -5.144 -10.941 1.00 0.00 N ATOM 0 H GLN D 16 -27.369 -1.704 -13.032 1.00 0.00 H new ATOM 0 HA GLN D 16 -24.651 -1.319 -14.015 1.00 0.00 H new ATOM 0 HB2 GLN D 16 -26.542 -3.618 -13.494 1.00 0.00 H new ATOM 0 HB3 GLN D 16 -25.169 -3.906 -14.544 1.00 0.00 H new ATOM 0 HG2 GLN D 16 -23.583 -3.349 -12.833 1.00 0.00 H new ATOM 0 HG3 GLN D 16 -24.779 -2.505 -11.870 1.00 0.00 H new ATOM 0 HE21 GLN D 16 -23.151 -4.660 -10.809 1.00 0.00 H new ATOM 0 HE22 GLN D 16 -24.231 -6.007 -10.432 1.00 0.00 H new ATOM 278 N THR D 17 -27.117 -1.922 -16.107 1.00 0.00 N ATOM 279 CA THR D 17 -27.466 -1.912 -17.557 1.00 0.00 C ATOM 280 C THR D 17 -27.120 -0.550 -18.168 1.00 0.00 C ATOM 281 O THR D 17 -26.558 -0.468 -19.241 1.00 0.00 O ATOM 282 CB THR D 17 -28.967 -2.172 -17.717 1.00 0.00 C ATOM 283 OG1 THR D 17 -29.446 -2.879 -16.582 1.00 0.00 O ATOM 284 CG2 THR D 17 -29.215 -3.000 -18.980 1.00 0.00 C ATOM 0 H THR D 17 -27.907 -2.045 -15.474 1.00 0.00 H new ATOM 0 HA THR D 17 -26.898 -2.689 -18.069 1.00 0.00 H new ATOM 0 HB THR D 17 -29.493 -1.221 -17.803 1.00 0.00 H new ATOM 0 HG1 THR D 17 -30.407 -3.045 -16.681 1.00 0.00 H new ATOM 0 HG21 THR D 17 -30.284 -3.183 -19.091 1.00 0.00 H new ATOM 0 HG22 THR D 17 -28.848 -2.455 -19.850 1.00 0.00 H new ATOM 0 HG23 THR D 17 -28.690 -3.952 -18.900 1.00 0.00 H new ATOM 292 N LYS D 18 -27.459 0.517 -17.500 1.00 0.00 N ATOM 293 CA LYS D 18 -27.156 1.869 -18.052 1.00 0.00 C ATOM 294 C LYS D 18 -25.651 2.133 -17.976 1.00 0.00 C ATOM 295 O LYS D 18 -25.100 2.861 -18.778 1.00 0.00 O ATOM 296 CB LYS D 18 -27.899 2.925 -17.237 1.00 0.00 C ATOM 297 CG LYS D 18 -27.486 2.807 -15.772 1.00 0.00 C ATOM 298 CD LYS D 18 -27.912 4.068 -15.023 1.00 0.00 C ATOM 299 CE LYS D 18 -29.438 4.122 -14.944 1.00 0.00 C ATOM 300 NZ LYS D 18 -29.970 4.865 -16.122 1.00 0.00 N ATOM 0 H LYS D 18 -27.932 0.513 -16.596 1.00 0.00 H new ATOM 0 HA LYS D 18 -27.477 1.915 -19.093 1.00 0.00 H new ATOM 0 HB2 LYS D 18 -27.668 3.922 -17.614 1.00 0.00 H new ATOM 0 HB3 LYS D 18 -28.976 2.788 -17.336 1.00 0.00 H new ATOM 0 HG2 LYS D 18 -27.949 1.929 -15.322 1.00 0.00 H new ATOM 0 HG3 LYS D 18 -26.407 2.673 -15.696 1.00 0.00 H new ATOM 0 HD2 LYS D 18 -27.485 4.070 -14.020 1.00 0.00 H new ATOM 0 HD3 LYS D 18 -27.532 4.953 -15.533 1.00 0.00 H new ATOM 0 HE2 LYS D 18 -29.848 3.112 -14.922 1.00 0.00 H new ATOM 0 HE3 LYS D 18 -29.748 4.612 -14.021 1.00 0.00 H new ATOM 0 HZ1 LYS D 18 -30.559 5.658 -15.795 1.00 0.00 H new ATOM 0 HZ2 LYS D 18 -29.178 5.232 -16.688 1.00 0.00 H new ATOM 0 HZ3 LYS D 18 -30.545 4.224 -16.706 1.00 0.00 H new ATOM 314 N THR D 19 -24.982 1.551 -17.019 1.00 0.00 N ATOM 315 CA THR D 19 -23.514 1.774 -16.897 1.00 0.00 C ATOM 316 C THR D 19 -22.799 1.105 -18.073 1.00 0.00 C ATOM 317 O THR D 19 -21.767 1.560 -18.526 1.00 0.00 O ATOM 318 CB THR D 19 -23.012 1.180 -15.576 1.00 0.00 C ATOM 319 OG1 THR D 19 -23.717 1.776 -14.495 1.00 0.00 O ATOM 320 CG2 THR D 19 -21.515 1.460 -15.423 1.00 0.00 C ATOM 0 H THR D 19 -25.388 0.932 -16.317 1.00 0.00 H new ATOM 0 HA THR D 19 -23.305 2.844 -16.909 1.00 0.00 H new ATOM 0 HB THR D 19 -23.180 0.103 -15.575 1.00 0.00 H new ATOM 0 HG1 THR D 19 -24.676 1.598 -14.592 1.00 0.00 H new ATOM 0 HG21 THR D 19 -21.160 1.037 -14.483 1.00 0.00 H new ATOM 0 HG22 THR D 19 -20.973 1.006 -16.253 1.00 0.00 H new ATOM 0 HG23 THR D 19 -21.344 2.537 -15.424 1.00 0.00 H new ATOM 328 N ALA D 20 -23.342 0.030 -18.577 1.00 0.00 N ATOM 329 CA ALA D 20 -22.695 -0.663 -19.729 1.00 0.00 C ATOM 330 C ALA D 20 -23.057 0.061 -21.026 1.00 0.00 C ATOM 331 O ALA D 20 -22.298 0.068 -21.976 1.00 0.00 O ATOM 332 CB ALA D 20 -23.187 -2.109 -19.797 1.00 0.00 C ATOM 0 H ALA D 20 -24.205 -0.398 -18.242 1.00 0.00 H new ATOM 0 HA ALA D 20 -21.613 -0.655 -19.597 1.00 0.00 H new ATOM 0 HB1 ALA D 20 -22.714 -2.615 -20.639 1.00 0.00 H new ATOM 0 HB2 ALA D 20 -22.929 -2.625 -18.872 1.00 0.00 H new ATOM 0 HB3 ALA D 20 -24.269 -2.119 -19.929 1.00 0.00 H new ATOM 338 N LYS D 21 -24.206 0.679 -21.076 1.00 0.00 N ATOM 339 CA LYS D 21 -24.606 1.407 -22.313 1.00 0.00 C ATOM 340 C LYS D 21 -23.908 2.764 -22.334 1.00 0.00 C ATOM 341 O LYS D 21 -23.696 3.353 -23.376 1.00 0.00 O ATOM 342 CB LYS D 21 -26.124 1.610 -22.326 1.00 0.00 C ATOM 343 CG LYS D 21 -26.771 0.537 -23.201 1.00 0.00 C ATOM 344 CD LYS D 21 -27.007 -0.721 -22.366 1.00 0.00 C ATOM 345 CE LYS D 21 -27.499 -1.851 -23.270 1.00 0.00 C ATOM 346 NZ LYS D 21 -27.349 -3.152 -22.561 1.00 0.00 N ATOM 0 H LYS D 21 -24.884 0.711 -20.314 1.00 0.00 H new ATOM 0 HA LYS D 21 -24.318 0.828 -23.190 1.00 0.00 H new ATOM 0 HB2 LYS D 21 -26.518 1.554 -21.311 1.00 0.00 H new ATOM 0 HB3 LYS D 21 -26.366 2.602 -22.708 1.00 0.00 H new ATOM 0 HG2 LYS D 21 -27.715 0.902 -23.605 1.00 0.00 H new ATOM 0 HG3 LYS D 21 -26.128 0.308 -24.051 1.00 0.00 H new ATOM 0 HD2 LYS D 21 -26.084 -1.017 -21.867 1.00 0.00 H new ATOM 0 HD3 LYS D 21 -27.741 -0.520 -21.586 1.00 0.00 H new ATOM 0 HE2 LYS D 21 -28.543 -1.689 -23.538 1.00 0.00 H new ATOM 0 HE3 LYS D 21 -26.929 -1.863 -24.199 1.00 0.00 H new ATOM 0 HZ1 LYS D 21 -27.683 -3.922 -23.175 1.00 0.00 H new ATOM 0 HZ2 LYS D 21 -26.348 -3.306 -22.326 1.00 0.00 H new ATOM 0 HZ3 LYS D 21 -27.911 -3.137 -21.686 1.00 0.00 H new ATOM 360 N ASP D 22 -23.542 3.260 -21.186 1.00 0.00 N ATOM 361 CA ASP D 22 -22.849 4.574 -21.123 1.00 0.00 C ATOM 362 C ASP D 22 -21.379 4.385 -21.493 1.00 0.00 C ATOM 363 O ASP D 22 -20.787 5.202 -22.170 1.00 0.00 O ATOM 364 CB ASP D 22 -22.947 5.129 -19.700 1.00 0.00 C ATOM 365 CG ASP D 22 -23.569 6.526 -19.733 1.00 0.00 C ATOM 366 OD1 ASP D 22 -23.099 7.343 -20.507 1.00 0.00 O ATOM 367 OD2 ASP D 22 -24.503 6.753 -18.983 1.00 0.00 O ATOM 0 H ASP D 22 -23.694 2.808 -20.284 1.00 0.00 H new ATOM 0 HA ASP D 22 -23.316 5.270 -21.820 1.00 0.00 H new ATOM 0 HB2 ASP D 22 -23.552 4.466 -19.082 1.00 0.00 H new ATOM 0 HB3 ASP D 22 -21.956 5.172 -19.247 1.00 0.00 H new ATOM 372 N LEU D 23 -20.786 3.311 -21.052 1.00 0.00 N ATOM 373 CA LEU D 23 -19.353 3.063 -21.374 1.00 0.00 C ATOM 374 C LEU D 23 -19.250 2.275 -22.682 1.00 0.00 C ATOM 375 O LEU D 23 -18.180 2.107 -23.233 1.00 0.00 O ATOM 376 CB LEU D 23 -18.705 2.271 -20.235 1.00 0.00 C ATOM 377 CG LEU D 23 -18.645 3.146 -18.981 1.00 0.00 C ATOM 378 CD1 LEU D 23 -19.033 2.314 -17.760 1.00 0.00 C ATOM 379 CD2 LEU D 23 -17.223 3.684 -18.796 1.00 0.00 C ATOM 0 H LEU D 23 -21.233 2.593 -20.482 1.00 0.00 H new ATOM 0 HA LEU D 23 -18.835 4.015 -21.490 1.00 0.00 H new ATOM 0 HB2 LEU D 23 -19.278 1.366 -20.034 1.00 0.00 H new ATOM 0 HB3 LEU D 23 -17.702 1.956 -20.521 1.00 0.00 H new ATOM 0 HG LEU D 23 -19.338 3.980 -19.091 1.00 0.00 H new ATOM 0 HD11 LEU D 23 -18.990 2.937 -16.867 1.00 0.00 H new ATOM 0 HD12 LEU D 23 -20.046 1.931 -17.887 1.00 0.00 H new ATOM 0 HD13 LEU D 23 -18.340 1.479 -17.654 1.00 0.00 H new ATOM 0 HD21 LEU D 23 -17.183 4.307 -17.902 1.00 0.00 H new ATOM 0 HD22 LEU D 23 -16.530 2.850 -18.688 1.00 0.00 H new ATOM 0 HD23 LEU D 23 -16.943 4.279 -19.665 1.00 0.00 H new ATOM 391 N GLY D 24 -20.355 1.801 -23.191 1.00 0.00 N ATOM 392 CA GLY D 24 -20.322 1.034 -24.469 1.00 0.00 C ATOM 393 C GLY D 24 -19.689 -0.339 -24.235 1.00 0.00 C ATOM 394 O GLY D 24 -19.185 -0.963 -25.147 1.00 0.00 O ATOM 0 H GLY D 24 -21.280 1.912 -22.776 1.00 0.00 H new ATOM 0 HA2 GLY D 24 -21.333 0.916 -24.859 1.00 0.00 H new ATOM 0 HA3 GLY D 24 -19.753 1.584 -25.219 1.00 0.00 H new ATOM 398 N VAL D 25 -19.712 -0.817 -23.022 1.00 0.00 N ATOM 399 CA VAL D 25 -19.111 -2.152 -22.738 1.00 0.00 C ATOM 400 C VAL D 25 -20.222 -3.157 -22.430 1.00 0.00 C ATOM 401 O VAL D 25 -21.393 -2.867 -22.582 1.00 0.00 O ATOM 402 CB VAL D 25 -18.166 -2.043 -21.539 1.00 0.00 C ATOM 403 CG1 VAL D 25 -16.821 -1.481 -22.004 1.00 0.00 C ATOM 404 CG2 VAL D 25 -18.773 -1.107 -20.491 1.00 0.00 C ATOM 0 H VAL D 25 -20.120 -0.343 -22.216 1.00 0.00 H new ATOM 0 HA VAL D 25 -18.550 -2.491 -23.609 1.00 0.00 H new ATOM 0 HB VAL D 25 -18.019 -3.030 -21.101 1.00 0.00 H new ATOM 0 HG11 VAL D 25 -16.146 -1.402 -21.152 1.00 0.00 H new ATOM 0 HG12 VAL D 25 -16.387 -2.146 -22.751 1.00 0.00 H new ATOM 0 HG13 VAL D 25 -16.971 -0.494 -22.441 1.00 0.00 H new ATOM 0 HG21 VAL D 25 -18.099 -1.030 -19.638 1.00 0.00 H new ATOM 0 HG22 VAL D 25 -18.920 -0.119 -20.927 1.00 0.00 H new ATOM 0 HG23 VAL D 25 -19.733 -1.504 -20.161 1.00 0.00 H new ATOM 414 N TYR D 26 -19.870 -4.339 -22.000 1.00 0.00 N ATOM 415 CA TYR D 26 -20.917 -5.357 -21.687 1.00 0.00 C ATOM 416 C TYR D 26 -21.105 -5.443 -20.174 1.00 0.00 C ATOM 417 O TYR D 26 -20.224 -5.109 -19.407 1.00 0.00 O ATOM 418 CB TYR D 26 -20.515 -6.738 -22.228 1.00 0.00 C ATOM 419 CG TYR D 26 -19.039 -6.774 -22.550 1.00 0.00 C ATOM 420 CD1 TYR D 26 -18.561 -6.155 -23.712 1.00 0.00 C ATOM 421 CD2 TYR D 26 -18.149 -7.428 -21.690 1.00 0.00 C ATOM 422 CE1 TYR D 26 -17.195 -6.188 -24.012 1.00 0.00 C ATOM 423 CE2 TYR D 26 -16.781 -7.462 -21.990 1.00 0.00 C ATOM 424 CZ TYR D 26 -16.304 -6.841 -23.152 1.00 0.00 C ATOM 425 OH TYR D 26 -14.957 -6.874 -23.448 1.00 0.00 O ATOM 0 H TYR D 26 -18.908 -4.644 -21.852 1.00 0.00 H new ATOM 0 HA TYR D 26 -21.849 -5.053 -22.164 1.00 0.00 H new ATOM 0 HB2 TYR D 26 -20.751 -7.506 -21.491 1.00 0.00 H new ATOM 0 HB3 TYR D 26 -21.094 -6.967 -23.123 1.00 0.00 H new ATOM 0 HD1 TYR D 26 -19.247 -5.652 -24.377 1.00 0.00 H new ATOM 0 HD2 TYR D 26 -18.517 -7.907 -20.795 1.00 0.00 H new ATOM 0 HE1 TYR D 26 -16.828 -5.709 -24.908 1.00 0.00 H new ATOM 0 HE2 TYR D 26 -16.095 -7.966 -21.326 1.00 0.00 H new ATOM 0 HH TYR D 26 -14.480 -7.366 -22.747 1.00 0.00 H new ATOM 435 N GLN D 27 -22.251 -5.888 -19.738 1.00 0.00 N ATOM 436 CA GLN D 27 -22.502 -5.996 -18.275 1.00 0.00 C ATOM 437 C GLN D 27 -21.618 -7.097 -17.685 1.00 0.00 C ATOM 438 O GLN D 27 -21.265 -7.065 -16.523 1.00 0.00 O ATOM 439 CB GLN D 27 -23.975 -6.333 -18.035 1.00 0.00 C ATOM 440 CG GLN D 27 -24.845 -5.175 -18.530 1.00 0.00 C ATOM 441 CD GLN D 27 -26.085 -5.731 -19.233 1.00 0.00 C ATOM 442 OE1 GLN D 27 -26.337 -5.423 -20.382 1.00 0.00 O ATOM 443 NE2 GLN D 27 -26.877 -6.543 -18.588 1.00 0.00 N ATOM 0 H GLN D 27 -23.025 -6.182 -20.334 1.00 0.00 H new ATOM 0 HA GLN D 27 -22.265 -5.047 -17.793 1.00 0.00 H new ATOM 0 HB2 GLN D 27 -24.240 -7.252 -18.558 1.00 0.00 H new ATOM 0 HB3 GLN D 27 -24.152 -6.508 -16.974 1.00 0.00 H new ATOM 0 HG2 GLN D 27 -25.141 -4.545 -17.691 1.00 0.00 H new ATOM 0 HG3 GLN D 27 -24.277 -4.547 -19.216 1.00 0.00 H new ATOM 0 HE21 GLN D 27 -26.667 -6.802 -17.624 1.00 0.00 H new ATOM 0 HE22 GLN D 27 -27.706 -6.919 -19.048 1.00 0.00 H new ATOM 452 N SER D 28 -21.253 -8.070 -18.475 1.00 0.00 N ATOM 453 CA SER D 28 -20.386 -9.163 -17.951 1.00 0.00 C ATOM 454 C SER D 28 -18.990 -8.603 -17.676 1.00 0.00 C ATOM 455 O SER D 28 -18.237 -9.138 -16.882 1.00 0.00 O ATOM 456 CB SER D 28 -20.295 -10.287 -18.984 1.00 0.00 C ATOM 457 OG SER D 28 -20.402 -11.540 -18.322 1.00 0.00 O ATOM 0 H SER D 28 -21.517 -8.155 -19.457 1.00 0.00 H new ATOM 0 HA SER D 28 -20.811 -9.560 -17.029 1.00 0.00 H new ATOM 0 HB2 SER D 28 -21.090 -10.183 -19.723 1.00 0.00 H new ATOM 0 HB3 SER D 28 -19.349 -10.226 -19.523 1.00 0.00 H new ATOM 0 HG SER D 28 -20.346 -12.264 -18.980 1.00 0.00 H new ATOM 463 N ALA D 29 -18.647 -7.516 -18.311 1.00 0.00 N ATOM 464 CA ALA D 29 -17.310 -6.908 -18.077 1.00 0.00 C ATOM 465 C ALA D 29 -17.381 -6.080 -16.800 1.00 0.00 C ATOM 466 O ALA D 29 -16.500 -6.122 -15.963 1.00 0.00 O ATOM 467 CB ALA D 29 -16.938 -6.007 -19.257 1.00 0.00 C ATOM 0 H ALA D 29 -19.236 -7.023 -18.982 1.00 0.00 H new ATOM 0 HA ALA D 29 -16.554 -7.687 -17.980 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -15.958 -5.564 -19.081 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -16.910 -6.599 -20.172 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -17.681 -5.216 -19.359 1.00 0.00 H new ATOM 473 N ILE D 30 -18.441 -5.343 -16.638 1.00 0.00 N ATOM 474 CA ILE D 30 -18.602 -4.523 -15.411 1.00 0.00 C ATOM 475 C ILE D 30 -18.781 -5.470 -14.223 1.00 0.00 C ATOM 476 O ILE D 30 -18.475 -5.138 -13.094 1.00 0.00 O ATOM 477 CB ILE D 30 -19.835 -3.626 -15.565 1.00 0.00 C ATOM 478 CG1 ILE D 30 -19.471 -2.407 -16.416 1.00 0.00 C ATOM 479 CG2 ILE D 30 -20.317 -3.159 -14.191 1.00 0.00 C ATOM 480 CD1 ILE D 30 -20.707 -1.920 -17.174 1.00 0.00 C ATOM 0 H ILE D 30 -19.207 -5.274 -17.308 1.00 0.00 H new ATOM 0 HA ILE D 30 -17.728 -3.893 -15.249 1.00 0.00 H new ATOM 0 HB ILE D 30 -20.631 -4.191 -16.050 1.00 0.00 H new ATOM 0 HG12 ILE D 30 -19.085 -1.610 -15.781 1.00 0.00 H new ATOM 0 HG13 ILE D 30 -18.680 -2.666 -17.119 1.00 0.00 H new ATOM 0 HG21 ILE D 30 -21.194 -2.522 -14.310 1.00 0.00 H new ATOM 0 HG22 ILE D 30 -20.578 -4.025 -13.583 1.00 0.00 H new ATOM 0 HG23 ILE D 30 -19.524 -2.596 -13.699 1.00 0.00 H new ATOM 0 HD11 ILE D 30 -20.444 -1.052 -17.779 1.00 0.00 H new ATOM 0 HD12 ILE D 30 -21.074 -2.716 -17.822 1.00 0.00 H new ATOM 0 HD13 ILE D 30 -21.485 -1.644 -16.462 1.00 0.00 H new ATOM 492 N ASN D 31 -19.268 -6.655 -14.478 1.00 0.00 N ATOM 493 CA ASN D 31 -19.461 -7.641 -13.379 1.00 0.00 C ATOM 494 C ASN D 31 -18.093 -8.108 -12.890 1.00 0.00 C ATOM 495 O ASN D 31 -17.805 -8.080 -11.713 1.00 0.00 O ATOM 496 CB ASN D 31 -20.255 -8.837 -13.905 1.00 0.00 C ATOM 497 CG ASN D 31 -20.550 -9.804 -12.759 1.00 0.00 C ATOM 498 OD1 ASN D 31 -19.946 -9.722 -11.707 1.00 0.00 O ATOM 499 ND2 ASN D 31 -21.463 -10.721 -12.919 1.00 0.00 N ATOM 0 H ASN D 31 -19.541 -6.982 -15.405 1.00 0.00 H new ATOM 0 HA ASN D 31 -20.008 -7.181 -12.556 1.00 0.00 H new ATOM 0 HB2 ASN D 31 -21.187 -8.497 -14.356 1.00 0.00 H new ATOM 0 HB3 ASN D 31 -19.690 -9.345 -14.686 1.00 0.00 H new ATOM 0 HD21 ASN D 31 -21.671 -11.371 -12.161 1.00 0.00 H new ATOM 0 HD22 ASN D 31 -21.969 -10.788 -13.802 1.00 0.00 H new ATOM 506 N LYS D 32 -17.242 -8.529 -13.787 1.00 0.00 N ATOM 507 CA LYS D 32 -15.890 -8.980 -13.364 1.00 0.00 C ATOM 508 C LYS D 32 -15.145 -7.793 -12.754 1.00 0.00 C ATOM 509 O LYS D 32 -14.283 -7.951 -11.912 1.00 0.00 O ATOM 510 CB LYS D 32 -15.120 -9.504 -14.577 1.00 0.00 C ATOM 511 CG LYS D 32 -15.465 -10.976 -14.802 1.00 0.00 C ATOM 512 CD LYS D 32 -15.656 -11.234 -16.297 1.00 0.00 C ATOM 513 CE LYS D 32 -16.037 -12.699 -16.519 1.00 0.00 C ATOM 514 NZ LYS D 32 -17.518 -12.843 -16.446 1.00 0.00 N ATOM 0 H LYS D 32 -17.426 -8.579 -14.789 1.00 0.00 H new ATOM 0 HA LYS D 32 -15.978 -9.779 -12.628 1.00 0.00 H new ATOM 0 HB2 LYS D 32 -15.374 -8.921 -15.462 1.00 0.00 H new ATOM 0 HB3 LYS D 32 -14.048 -9.391 -14.417 1.00 0.00 H new ATOM 0 HG2 LYS D 32 -14.669 -11.610 -14.412 1.00 0.00 H new ATOM 0 HG3 LYS D 32 -16.374 -11.234 -14.259 1.00 0.00 H new ATOM 0 HD2 LYS D 32 -16.434 -10.581 -16.693 1.00 0.00 H new ATOM 0 HD3 LYS D 32 -14.739 -11.000 -16.837 1.00 0.00 H new ATOM 0 HE2 LYS D 32 -15.675 -13.037 -17.490 1.00 0.00 H new ATOM 0 HE3 LYS D 32 -15.562 -13.328 -15.766 1.00 0.00 H new ATOM 0 HZ1 LYS D 32 -17.778 -13.839 -16.597 1.00 0.00 H new ATOM 0 HZ2 LYS D 32 -17.851 -12.536 -15.510 1.00 0.00 H new ATOM 0 HZ3 LYS D 32 -17.961 -12.255 -17.181 1.00 0.00 H new ATOM 528 N ALA D 33 -15.477 -6.599 -13.167 1.00 0.00 N ATOM 529 CA ALA D 33 -14.797 -5.400 -12.605 1.00 0.00 C ATOM 530 C ALA D 33 -15.191 -5.247 -11.138 1.00 0.00 C ATOM 531 O ALA D 33 -14.387 -4.892 -10.299 1.00 0.00 O ATOM 532 CB ALA D 33 -15.228 -4.155 -13.382 1.00 0.00 C ATOM 0 H ALA D 33 -16.190 -6.404 -13.870 1.00 0.00 H new ATOM 0 HA ALA D 33 -13.716 -5.518 -12.687 1.00 0.00 H new ATOM 0 HB1 ALA D 33 -14.729 -3.278 -12.969 1.00 0.00 H new ATOM 0 HB2 ALA D 33 -14.954 -4.268 -14.431 1.00 0.00 H new ATOM 0 HB3 ALA D 33 -16.308 -4.031 -13.300 1.00 0.00 H new ATOM 538 N ILE D 34 -16.424 -5.522 -10.823 1.00 0.00 N ATOM 539 CA ILE D 34 -16.875 -5.406 -9.411 1.00 0.00 C ATOM 540 C ILE D 34 -16.323 -6.593 -8.621 1.00 0.00 C ATOM 541 O ILE D 34 -16.016 -6.490 -7.450 1.00 0.00 O ATOM 542 CB ILE D 34 -18.404 -5.420 -9.364 1.00 0.00 C ATOM 543 CG1 ILE D 34 -18.946 -4.129 -9.991 1.00 0.00 C ATOM 544 CG2 ILE D 34 -18.868 -5.521 -7.909 1.00 0.00 C ATOM 545 CD1 ILE D 34 -18.718 -2.952 -9.039 1.00 0.00 C ATOM 0 H ILE D 34 -17.140 -5.823 -11.484 1.00 0.00 H new ATOM 0 HA ILE D 34 -16.513 -4.474 -8.977 1.00 0.00 H new ATOM 0 HB ILE D 34 -18.779 -6.278 -9.923 1.00 0.00 H new ATOM 0 HG12 ILE D 34 -18.449 -3.940 -10.943 1.00 0.00 H new ATOM 0 HG13 ILE D 34 -20.010 -4.236 -10.203 1.00 0.00 H new ATOM 0 HG21 ILE D 34 -19.957 -5.531 -7.874 1.00 0.00 H new ATOM 0 HG22 ILE D 34 -18.482 -6.440 -7.467 1.00 0.00 H new ATOM 0 HG23 ILE D 34 -18.495 -4.664 -7.348 1.00 0.00 H new ATOM 0 HD11 ILE D 34 -19.105 -2.039 -9.490 1.00 0.00 H new ATOM 0 HD12 ILE D 34 -19.236 -3.139 -8.098 1.00 0.00 H new ATOM 0 HD13 ILE D 34 -17.651 -2.839 -8.850 1.00 0.00 H new ATOM 557 N HIS D 35 -16.188 -7.718 -9.265 1.00 0.00 N ATOM 558 CA HIS D 35 -15.648 -8.920 -8.579 1.00 0.00 C ATOM 559 C HIS D 35 -14.142 -8.747 -8.381 1.00 0.00 C ATOM 560 O HIS D 35 -13.539 -9.371 -7.531 1.00 0.00 O ATOM 561 CB HIS D 35 -15.922 -10.148 -9.447 1.00 0.00 C ATOM 562 CG HIS D 35 -17.302 -10.665 -9.152 1.00 0.00 C ATOM 563 ND1 HIS D 35 -17.746 -10.889 -7.858 1.00 0.00 N ATOM 564 CD2 HIS D 35 -18.349 -11.001 -9.973 1.00 0.00 C ATOM 565 CE1 HIS D 35 -19.012 -11.341 -7.937 1.00 0.00 C ATOM 566 NE2 HIS D 35 -19.428 -11.427 -9.204 1.00 0.00 N ATOM 0 H HIS D 35 -16.431 -7.855 -10.246 1.00 0.00 H new ATOM 0 HA HIS D 35 -16.125 -9.048 -7.608 1.00 0.00 H new ATOM 0 HB2 HIS D 35 -15.836 -9.889 -10.502 1.00 0.00 H new ATOM 0 HB3 HIS D 35 -15.181 -10.922 -9.247 1.00 0.00 H new ATOM 0 HD2 HIS D 35 -18.337 -10.944 -11.051 1.00 0.00 H new ATOM 0 HE1 HIS D 35 -19.617 -11.602 -7.081 1.00 0.00 H new ATOM 0 HE2 HIS D 35 -20.341 -11.738 -9.536 1.00 0.00 H new ATOM 574 N ALA D 36 -13.533 -7.897 -9.161 1.00 0.00 N ATOM 575 CA ALA D 36 -12.069 -7.672 -9.022 1.00 0.00 C ATOM 576 C ALA D 36 -11.812 -6.723 -7.849 1.00 0.00 C ATOM 577 O ALA D 36 -10.732 -6.684 -7.294 1.00 0.00 O ATOM 578 CB ALA D 36 -11.526 -7.048 -10.309 1.00 0.00 C ATOM 0 H ALA D 36 -13.988 -7.348 -9.890 1.00 0.00 H new ATOM 0 HA ALA D 36 -11.569 -8.623 -8.839 1.00 0.00 H new ATOM 0 HB1 ALA D 36 -10.453 -6.882 -10.209 1.00 0.00 H new ATOM 0 HB2 ALA D 36 -11.713 -7.720 -11.146 1.00 0.00 H new ATOM 0 HB3 ALA D 36 -12.025 -6.096 -10.490 1.00 0.00 H new ATOM 584 N GLY D 37 -12.799 -5.956 -7.468 1.00 0.00 N ATOM 585 CA GLY D 37 -12.612 -5.009 -6.333 1.00 0.00 C ATOM 586 C GLY D 37 -11.311 -4.229 -6.525 1.00 0.00 C ATOM 587 O GLY D 37 -10.682 -3.811 -5.573 1.00 0.00 O ATOM 0 H GLY D 37 -13.726 -5.945 -7.894 1.00 0.00 H new ATOM 0 HA2 GLY D 37 -13.456 -4.321 -6.278 1.00 0.00 H new ATOM 0 HA3 GLY D 37 -12.584 -5.556 -5.391 1.00 0.00 H new ATOM 591 N ARG D 38 -10.903 -4.026 -7.748 1.00 0.00 N ATOM 592 CA ARG D 38 -9.641 -3.271 -7.995 1.00 0.00 C ATOM 593 C ARG D 38 -9.921 -1.770 -7.885 1.00 0.00 C ATOM 594 O ARG D 38 -10.921 -1.354 -7.336 1.00 0.00 O ATOM 595 CB ARG D 38 -9.114 -3.591 -9.396 1.00 0.00 C ATOM 596 CG ARG D 38 -8.906 -5.101 -9.537 1.00 0.00 C ATOM 597 CD ARG D 38 -7.632 -5.370 -10.340 1.00 0.00 C ATOM 598 NE ARG D 38 -6.454 -5.353 -9.428 1.00 0.00 N ATOM 599 CZ ARG D 38 -5.250 -5.246 -9.921 1.00 0.00 C ATOM 600 NH1 ARG D 38 -4.908 -4.171 -10.576 1.00 0.00 N ATOM 601 NH2 ARG D 38 -4.390 -6.215 -9.761 1.00 0.00 N ATOM 0 H ARG D 38 -11.387 -4.349 -8.585 1.00 0.00 H new ATOM 0 HA ARG D 38 -8.894 -3.560 -7.256 1.00 0.00 H new ATOM 0 HB2 ARG D 38 -9.819 -3.239 -10.149 1.00 0.00 H new ATOM 0 HB3 ARG D 38 -8.174 -3.067 -9.570 1.00 0.00 H new ATOM 0 HG2 ARG D 38 -8.831 -5.562 -8.552 1.00 0.00 H new ATOM 0 HG3 ARG D 38 -9.764 -5.552 -10.035 1.00 0.00 H new ATOM 0 HD2 ARG D 38 -7.703 -6.335 -10.841 1.00 0.00 H new ATOM 0 HD3 ARG D 38 -7.514 -4.615 -11.117 1.00 0.00 H new ATOM 0 HE ARG D 38 -6.588 -5.425 -8.419 1.00 0.00 H new ATOM 0 HH11 ARG D 38 -5.581 -3.415 -10.703 1.00 0.00 H new ATOM 0 HH12 ARG D 38 -3.968 -4.086 -10.962 1.00 0.00 H new ATOM 0 HH21 ARG D 38 -4.659 -7.056 -9.251 1.00 0.00 H new ATOM 0 HH22 ARG D 38 -3.449 -6.131 -10.146 1.00 0.00 H new ATOM 615 N LYS D 39 -9.044 -0.954 -8.404 1.00 0.00 N ATOM 616 CA LYS D 39 -9.257 0.519 -8.327 1.00 0.00 C ATOM 617 C LYS D 39 -9.823 1.027 -9.649 1.00 0.00 C ATOM 618 O LYS D 39 -9.127 1.607 -10.457 1.00 0.00 O ATOM 619 CB LYS D 39 -7.925 1.208 -8.040 1.00 0.00 C ATOM 620 CG LYS D 39 -7.237 0.511 -6.866 1.00 0.00 C ATOM 621 CD LYS D 39 -8.160 0.540 -5.646 1.00 0.00 C ATOM 622 CE LYS D 39 -7.410 0.003 -4.426 1.00 0.00 C ATOM 623 NZ LYS D 39 -8.390 -0.515 -3.430 1.00 0.00 N ATOM 0 H LYS D 39 -8.189 -1.244 -8.878 1.00 0.00 H new ATOM 0 HA LYS D 39 -9.963 0.743 -7.527 1.00 0.00 H new ATOM 0 HB2 LYS D 39 -7.287 1.173 -8.923 1.00 0.00 H new ATOM 0 HB3 LYS D 39 -8.090 2.260 -7.807 1.00 0.00 H new ATOM 0 HG2 LYS D 39 -6.997 -0.519 -7.130 1.00 0.00 H new ATOM 0 HG3 LYS D 39 -6.295 1.008 -6.635 1.00 0.00 H new ATOM 0 HD2 LYS D 39 -8.500 1.558 -5.458 1.00 0.00 H new ATOM 0 HD3 LYS D 39 -9.048 -0.063 -5.834 1.00 0.00 H new ATOM 0 HE2 LYS D 39 -6.726 -0.791 -4.726 1.00 0.00 H new ATOM 0 HE3 LYS D 39 -6.805 0.793 -3.981 1.00 0.00 H new ATOM 0 HZ1 LYS D 39 -7.881 -0.880 -2.600 1.00 0.00 H new ATOM 0 HZ2 LYS D 39 -9.025 0.254 -3.136 1.00 0.00 H new ATOM 0 HZ3 LYS D 39 -8.949 -1.281 -3.858 1.00 0.00 H new ATOM 637 N ILE D 40 -11.091 0.823 -9.862 1.00 0.00 N ATOM 638 CA ILE D 40 -11.721 1.306 -11.120 1.00 0.00 C ATOM 639 C ILE D 40 -12.599 2.507 -10.793 1.00 0.00 C ATOM 640 O ILE D 40 -13.752 2.373 -10.435 1.00 0.00 O ATOM 641 CB ILE D 40 -12.574 0.197 -11.742 1.00 0.00 C ATOM 642 CG1 ILE D 40 -11.847 -1.144 -11.615 1.00 0.00 C ATOM 643 CG2 ILE D 40 -12.808 0.505 -13.222 1.00 0.00 C ATOM 644 CD1 ILE D 40 -12.855 -2.286 -11.756 1.00 0.00 C ATOM 0 H ILE D 40 -11.719 0.342 -9.218 1.00 0.00 H new ATOM 0 HA ILE D 40 -10.947 1.590 -11.833 1.00 0.00 H new ATOM 0 HB ILE D 40 -13.530 0.143 -11.222 1.00 0.00 H new ATOM 0 HG12 ILE D 40 -11.078 -1.227 -12.383 1.00 0.00 H new ATOM 0 HG13 ILE D 40 -11.343 -1.207 -10.651 1.00 0.00 H new ATOM 0 HG21 ILE D 40 -13.415 -0.284 -13.666 1.00 0.00 H new ATOM 0 HG22 ILE D 40 -13.326 1.459 -13.318 1.00 0.00 H new ATOM 0 HG23 ILE D 40 -11.850 0.559 -13.738 1.00 0.00 H new ATOM 0 HD11 ILE D 40 -12.338 -3.241 -11.666 1.00 0.00 H new ATOM 0 HD12 ILE D 40 -13.608 -2.206 -10.972 1.00 0.00 H new ATOM 0 HD13 ILE D 40 -13.339 -2.226 -12.731 1.00 0.00 H new ATOM 656 N PHE D 41 -12.049 3.680 -10.896 1.00 0.00 N ATOM 657 CA PHE D 41 -12.828 4.903 -10.578 1.00 0.00 C ATOM 658 C PHE D 41 -13.728 5.257 -11.759 1.00 0.00 C ATOM 659 O PHE D 41 -13.623 4.686 -12.827 1.00 0.00 O ATOM 660 CB PHE D 41 -11.852 6.040 -10.277 1.00 0.00 C ATOM 661 CG PHE D 41 -10.709 5.508 -9.431 1.00 0.00 C ATOM 662 CD1 PHE D 41 -10.891 4.370 -8.628 1.00 0.00 C ATOM 663 CD2 PHE D 41 -9.468 6.155 -9.447 1.00 0.00 C ATOM 664 CE1 PHE D 41 -9.835 3.889 -7.845 1.00 0.00 C ATOM 665 CE2 PHE D 41 -8.413 5.670 -8.665 1.00 0.00 C ATOM 666 CZ PHE D 41 -8.598 4.538 -7.864 1.00 0.00 C ATOM 0 H PHE D 41 -11.086 3.845 -11.189 1.00 0.00 H new ATOM 0 HA PHE D 41 -13.460 4.735 -9.706 1.00 0.00 H new ATOM 0 HB2 PHE D 41 -11.467 6.460 -11.206 1.00 0.00 H new ATOM 0 HB3 PHE D 41 -12.365 6.845 -9.751 1.00 0.00 H new ATOM 0 HD1 PHE D 41 -11.846 3.866 -8.615 1.00 0.00 H new ATOM 0 HD2 PHE D 41 -9.324 7.030 -10.064 1.00 0.00 H new ATOM 0 HE1 PHE D 41 -9.977 3.016 -7.226 1.00 0.00 H new ATOM 0 HE2 PHE D 41 -7.456 6.170 -8.680 1.00 0.00 H new ATOM 0 HZ PHE D 41 -7.784 4.166 -7.260 1.00 0.00 H new ATOM 676 N LEU D 42 -14.636 6.170 -11.567 1.00 0.00 N ATOM 677 CA LEU D 42 -15.570 6.529 -12.671 1.00 0.00 C ATOM 678 C LEU D 42 -15.844 8.036 -12.670 1.00 0.00 C ATOM 679 O LEU D 42 -16.549 8.545 -11.822 1.00 0.00 O ATOM 680 CB LEU D 42 -16.883 5.777 -12.447 1.00 0.00 C ATOM 681 CG LEU D 42 -17.464 5.311 -13.780 1.00 0.00 C ATOM 682 CD1 LEU D 42 -16.884 3.944 -14.145 1.00 0.00 C ATOM 683 CD2 LEU D 42 -18.980 5.191 -13.639 1.00 0.00 C ATOM 0 H LEU D 42 -14.773 6.683 -10.696 1.00 0.00 H new ATOM 0 HA LEU D 42 -15.127 6.258 -13.629 1.00 0.00 H new ATOM 0 HB2 LEU D 42 -16.711 4.918 -11.798 1.00 0.00 H new ATOM 0 HB3 LEU D 42 -17.598 6.424 -11.938 1.00 0.00 H new ATOM 0 HG LEU D 42 -17.214 6.029 -14.561 1.00 0.00 H new ATOM 0 HD11 LEU D 42 -17.301 3.614 -15.097 1.00 0.00 H new ATOM 0 HD12 LEU D 42 -15.800 4.020 -14.230 1.00 0.00 H new ATOM 0 HD13 LEU D 42 -17.137 3.222 -13.369 1.00 0.00 H new ATOM 0 HD21 LEU D 42 -19.408 4.859 -14.585 1.00 0.00 H new ATOM 0 HD22 LEU D 42 -19.217 4.467 -12.859 1.00 0.00 H new ATOM 0 HD23 LEU D 42 -19.399 6.161 -13.372 1.00 0.00 H new ATOM 695 N THR D 43 -15.304 8.756 -13.618 1.00 0.00 N ATOM 696 CA THR D 43 -15.551 10.226 -13.670 1.00 0.00 C ATOM 697 C THR D 43 -16.699 10.511 -14.650 1.00 0.00 C ATOM 698 O THR D 43 -16.599 10.254 -15.831 1.00 0.00 O ATOM 699 CB THR D 43 -14.268 10.937 -14.125 1.00 0.00 C ATOM 700 OG1 THR D 43 -14.303 12.291 -13.698 1.00 0.00 O ATOM 701 CG2 THR D 43 -14.140 10.885 -15.651 1.00 0.00 C ATOM 0 H THR D 43 -14.704 8.390 -14.357 1.00 0.00 H new ATOM 0 HA THR D 43 -15.829 10.596 -12.683 1.00 0.00 H new ATOM 0 HB THR D 43 -13.409 10.432 -13.684 1.00 0.00 H new ATOM 0 HG1 THR D 43 -13.484 12.746 -13.986 1.00 0.00 H new ATOM 0 HG21 THR D 43 -13.226 11.393 -15.957 1.00 0.00 H new ATOM 0 HG22 THR D 43 -14.104 9.846 -15.978 1.00 0.00 H new ATOM 0 HG23 THR D 43 -14.999 11.379 -16.105 1.00 0.00 H new ATOM 709 N ILE D 44 -17.795 11.027 -14.168 1.00 0.00 N ATOM 710 CA ILE D 44 -18.945 11.310 -15.073 1.00 0.00 C ATOM 711 C ILE D 44 -18.904 12.768 -15.539 1.00 0.00 C ATOM 712 O ILE D 44 -18.826 13.682 -14.742 1.00 0.00 O ATOM 713 CB ILE D 44 -20.252 11.057 -14.321 1.00 0.00 C ATOM 714 CG1 ILE D 44 -20.083 9.843 -13.405 1.00 0.00 C ATOM 715 CG2 ILE D 44 -21.374 10.785 -15.324 1.00 0.00 C ATOM 716 CD1 ILE D 44 -21.399 9.566 -12.676 1.00 0.00 C ATOM 0 H ILE D 44 -17.945 11.265 -13.188 1.00 0.00 H new ATOM 0 HA ILE D 44 -18.883 10.656 -15.943 1.00 0.00 H new ATOM 0 HB ILE D 44 -20.504 11.933 -13.724 1.00 0.00 H new ATOM 0 HG12 ILE D 44 -19.788 8.971 -13.990 1.00 0.00 H new ATOM 0 HG13 ILE D 44 -19.287 10.027 -12.683 1.00 0.00 H new ATOM 0 HG21 ILE D 44 -22.306 10.605 -14.788 1.00 0.00 H new ATOM 0 HG22 ILE D 44 -21.494 11.648 -15.979 1.00 0.00 H new ATOM 0 HG23 ILE D 44 -21.124 9.908 -15.921 1.00 0.00 H new ATOM 0 HD11 ILE D 44 -21.278 8.701 -12.024 1.00 0.00 H new ATOM 0 HD12 ILE D 44 -21.674 10.435 -12.079 1.00 0.00 H new ATOM 0 HD13 ILE D 44 -22.183 9.364 -13.405 1.00 0.00 H new ATOM 728 N ASN D 45 -18.962 12.991 -16.826 1.00 0.00 N ATOM 729 CA ASN D 45 -18.934 14.388 -17.343 1.00 0.00 C ATOM 730 C ASN D 45 -20.365 14.925 -17.436 1.00 0.00 C ATOM 731 O ASN D 45 -21.285 14.214 -17.799 1.00 0.00 O ATOM 732 CB ASN D 45 -18.291 14.415 -18.731 1.00 0.00 C ATOM 733 CG ASN D 45 -16.773 14.276 -18.598 1.00 0.00 C ATOM 734 OD1 ASN D 45 -16.029 15.082 -19.122 1.00 0.00 O ATOM 735 ND2 ASN D 45 -16.278 13.280 -17.916 1.00 0.00 N ATOM 0 H ASN D 45 -19.027 12.265 -17.540 1.00 0.00 H new ATOM 0 HA ASN D 45 -18.351 15.010 -16.664 1.00 0.00 H new ATOM 0 HB2 ASN D 45 -18.688 13.605 -19.342 1.00 0.00 H new ATOM 0 HB3 ASN D 45 -18.538 15.347 -19.239 1.00 0.00 H new ATOM 0 HD21 ASN D 45 -15.267 13.178 -17.823 1.00 0.00 H new ATOM 0 HD22 ASN D 45 -16.902 12.603 -17.476 1.00 0.00 H new ATOM 742 N ALA D 46 -20.555 16.178 -17.110 1.00 0.00 N ATOM 743 CA ALA D 46 -21.919 16.784 -17.165 1.00 0.00 C ATOM 744 C ALA D 46 -22.628 16.399 -18.468 1.00 0.00 C ATOM 745 O ALA D 46 -23.839 16.448 -18.557 1.00 0.00 O ATOM 746 CB ALA D 46 -21.801 18.307 -17.082 1.00 0.00 C ATOM 0 H ALA D 46 -19.817 16.812 -16.805 1.00 0.00 H new ATOM 0 HA ALA D 46 -22.503 16.409 -16.325 1.00 0.00 H new ATOM 0 HB1 ALA D 46 -22.795 18.752 -17.122 1.00 0.00 H new ATOM 0 HB2 ALA D 46 -21.317 18.584 -16.145 1.00 0.00 H new ATOM 0 HB3 ALA D 46 -21.206 18.672 -17.919 1.00 0.00 H new ATOM 752 N ASP D 47 -21.897 16.017 -19.480 1.00 0.00 N ATOM 753 CA ASP D 47 -22.550 15.633 -20.765 1.00 0.00 C ATOM 754 C ASP D 47 -22.969 14.159 -20.713 1.00 0.00 C ATOM 755 O ASP D 47 -22.962 13.469 -21.712 1.00 0.00 O ATOM 756 CB ASP D 47 -21.566 15.841 -21.919 1.00 0.00 C ATOM 757 CG ASP D 47 -21.101 17.298 -21.939 1.00 0.00 C ATOM 758 OD1 ASP D 47 -21.897 18.149 -22.300 1.00 0.00 O ATOM 759 OD2 ASP D 47 -19.955 17.539 -21.594 1.00 0.00 O ATOM 0 H ASP D 47 -20.879 15.954 -19.473 1.00 0.00 H new ATOM 0 HA ASP D 47 -23.432 16.254 -20.920 1.00 0.00 H new ATOM 0 HB2 ASP D 47 -20.709 15.177 -21.804 1.00 0.00 H new ATOM 0 HB3 ASP D 47 -22.042 15.587 -22.866 1.00 0.00 H new ATOM 764 N GLY D 48 -23.334 13.671 -19.557 1.00 0.00 N ATOM 765 CA GLY D 48 -23.753 12.243 -19.446 1.00 0.00 C ATOM 766 C GLY D 48 -22.630 11.343 -19.963 1.00 0.00 C ATOM 767 O GLY D 48 -22.864 10.242 -20.420 1.00 0.00 O ATOM 0 H GLY D 48 -23.360 14.199 -18.685 1.00 0.00 H new ATOM 0 HA2 GLY D 48 -23.981 11.999 -18.408 1.00 0.00 H new ATOM 0 HA3 GLY D 48 -24.664 12.074 -20.021 1.00 0.00 H new ATOM 771 N SER D 49 -21.412 11.807 -19.899 1.00 0.00 N ATOM 772 CA SER D 49 -20.271 10.978 -20.392 1.00 0.00 C ATOM 773 C SER D 49 -19.702 10.135 -19.252 1.00 0.00 C ATOM 774 O SER D 49 -19.885 10.434 -18.089 1.00 0.00 O ATOM 775 CB SER D 49 -19.177 11.895 -20.938 1.00 0.00 C ATOM 776 OG SER D 49 -18.722 11.390 -22.186 1.00 0.00 O ATOM 0 H SER D 49 -21.156 12.722 -19.528 1.00 0.00 H new ATOM 0 HA SER D 49 -20.627 10.316 -21.181 1.00 0.00 H new ATOM 0 HB2 SER D 49 -19.562 12.907 -21.061 1.00 0.00 H new ATOM 0 HB3 SER D 49 -18.349 11.953 -20.232 1.00 0.00 H new ATOM 0 HG SER D 49 -18.021 11.976 -22.540 1.00 0.00 H new ATOM 782 N VAL D 50 -19.001 9.084 -19.582 1.00 0.00 N ATOM 783 CA VAL D 50 -18.401 8.223 -18.522 1.00 0.00 C ATOM 784 C VAL D 50 -16.952 7.898 -18.882 1.00 0.00 C ATOM 785 O VAL D 50 -16.674 7.277 -19.888 1.00 0.00 O ATOM 786 CB VAL D 50 -19.177 6.910 -18.399 1.00 0.00 C ATOM 787 CG1 VAL D 50 -18.880 6.276 -17.040 1.00 0.00 C ATOM 788 CG2 VAL D 50 -20.676 7.177 -18.514 1.00 0.00 C ATOM 0 H VAL D 50 -18.818 8.784 -20.540 1.00 0.00 H new ATOM 0 HA VAL D 50 -18.444 8.762 -17.576 1.00 0.00 H new ATOM 0 HB VAL D 50 -18.871 6.236 -19.199 1.00 0.00 H new ATOM 0 HG11 VAL D 50 -19.431 5.340 -16.947 1.00 0.00 H new ATOM 0 HG12 VAL D 50 -17.811 6.078 -16.957 1.00 0.00 H new ATOM 0 HG13 VAL D 50 -19.186 6.957 -16.246 1.00 0.00 H new ATOM 0 HG21 VAL D 50 -21.221 6.237 -18.425 1.00 0.00 H new ATOM 0 HG22 VAL D 50 -20.987 7.853 -17.718 1.00 0.00 H new ATOM 0 HG23 VAL D 50 -20.891 7.631 -19.481 1.00 0.00 H new ATOM 798 N TYR D 51 -16.029 8.295 -18.054 1.00 0.00 N ATOM 799 CA TYR D 51 -14.599 7.992 -18.326 1.00 0.00 C ATOM 800 C TYR D 51 -14.007 7.322 -17.088 1.00 0.00 C ATOM 801 O TYR D 51 -13.464 7.970 -16.213 1.00 0.00 O ATOM 802 CB TYR D 51 -13.838 9.284 -18.633 1.00 0.00 C ATOM 803 CG TYR D 51 -12.472 8.941 -19.183 1.00 0.00 C ATOM 804 CD1 TYR D 51 -12.339 7.932 -20.145 1.00 0.00 C ATOM 805 CD2 TYR D 51 -11.341 9.630 -18.731 1.00 0.00 C ATOM 806 CE1 TYR D 51 -11.075 7.612 -20.653 1.00 0.00 C ATOM 807 CE2 TYR D 51 -10.076 9.309 -19.240 1.00 0.00 C ATOM 808 CZ TYR D 51 -9.943 8.301 -20.202 1.00 0.00 C ATOM 809 OH TYR D 51 -8.697 7.984 -20.701 1.00 0.00 O ATOM 0 H TYR D 51 -16.205 8.819 -17.197 1.00 0.00 H new ATOM 0 HA TYR D 51 -14.515 7.330 -19.188 1.00 0.00 H new ATOM 0 HB2 TYR D 51 -14.393 9.884 -19.354 1.00 0.00 H new ATOM 0 HB3 TYR D 51 -13.738 9.884 -17.729 1.00 0.00 H new ATOM 0 HD1 TYR D 51 -13.212 7.401 -20.495 1.00 0.00 H new ATOM 0 HD2 TYR D 51 -11.443 10.409 -17.990 1.00 0.00 H new ATOM 0 HE1 TYR D 51 -10.973 6.833 -21.394 1.00 0.00 H new ATOM 0 HE2 TYR D 51 -9.203 9.840 -18.890 1.00 0.00 H new ATOM 0 HH TYR D 51 -8.021 8.558 -20.283 1.00 0.00 H new ATOM 819 N ALA D 52 -14.126 6.027 -16.999 1.00 0.00 N ATOM 820 CA ALA D 52 -13.589 5.305 -15.814 1.00 0.00 C ATOM 821 C ALA D 52 -12.079 5.118 -15.967 1.00 0.00 C ATOM 822 O ALA D 52 -11.569 4.974 -17.059 1.00 0.00 O ATOM 823 CB ALA D 52 -14.271 3.941 -15.708 1.00 0.00 C ATOM 0 H ALA D 52 -14.574 5.436 -17.699 1.00 0.00 H new ATOM 0 HA ALA D 52 -13.786 5.883 -14.911 1.00 0.00 H new ATOM 0 HB1 ALA D 52 -13.882 3.406 -14.841 1.00 0.00 H new ATOM 0 HB2 ALA D 52 -15.346 4.080 -15.596 1.00 0.00 H new ATOM 0 HB3 ALA D 52 -14.071 3.363 -16.611 1.00 0.00 H new ATOM 829 N GLU D 53 -11.360 5.126 -14.879 1.00 0.00 N ATOM 830 CA GLU D 53 -9.883 4.956 -14.958 1.00 0.00 C ATOM 831 C GLU D 53 -9.433 3.884 -13.969 1.00 0.00 C ATOM 832 O GLU D 53 -10.146 3.523 -13.053 1.00 0.00 O ATOM 833 CB GLU D 53 -9.196 6.281 -14.620 1.00 0.00 C ATOM 834 CG GLU D 53 -8.857 7.025 -15.913 1.00 0.00 C ATOM 835 CD GLU D 53 -8.327 8.421 -15.578 1.00 0.00 C ATOM 836 OE1 GLU D 53 -7.445 8.513 -14.741 1.00 0.00 O ATOM 837 OE2 GLU D 53 -8.813 9.373 -16.165 1.00 0.00 O ATOM 0 H GLU D 53 -11.733 5.243 -13.937 1.00 0.00 H new ATOM 0 HA GLU D 53 -9.611 4.652 -15.969 1.00 0.00 H new ATOM 0 HB2 GLU D 53 -9.848 6.892 -13.997 1.00 0.00 H new ATOM 0 HB3 GLU D 53 -8.288 6.096 -14.046 1.00 0.00 H new ATOM 0 HG2 GLU D 53 -8.111 6.468 -16.480 1.00 0.00 H new ATOM 0 HG3 GLU D 53 -9.743 7.103 -16.543 1.00 0.00 H new ATOM 844 N GLU D 54 -8.246 3.384 -14.146 1.00 0.00 N ATOM 845 CA GLU D 54 -7.721 2.343 -13.222 1.00 0.00 C ATOM 846 C GLU D 54 -6.499 2.912 -12.510 1.00 0.00 C ATOM 847 O GLU D 54 -5.725 3.643 -13.093 1.00 0.00 O ATOM 848 CB GLU D 54 -7.319 1.099 -14.017 1.00 0.00 C ATOM 849 CG GLU D 54 -6.820 0.018 -13.056 1.00 0.00 C ATOM 850 CD GLU D 54 -8.016 -0.663 -12.389 1.00 0.00 C ATOM 851 OE1 GLU D 54 -9.121 -0.172 -12.554 1.00 0.00 O ATOM 852 OE2 GLU D 54 -7.807 -1.665 -11.725 1.00 0.00 O ATOM 0 H GLU D 54 -7.611 3.653 -14.897 1.00 0.00 H new ATOM 0 HA GLU D 54 -8.486 2.063 -12.498 1.00 0.00 H new ATOM 0 HB2 GLU D 54 -8.170 0.728 -14.588 1.00 0.00 H new ATOM 0 HB3 GLU D 54 -6.539 1.350 -14.736 1.00 0.00 H new ATOM 0 HG2 GLU D 54 -6.224 -0.717 -13.597 1.00 0.00 H new ATOM 0 HG3 GLU D 54 -6.171 0.460 -12.300 1.00 0.00 H new ATOM 859 N VAL D 55 -6.320 2.600 -11.257 1.00 0.00 N ATOM 860 CA VAL D 55 -5.147 3.153 -10.527 1.00 0.00 C ATOM 861 C VAL D 55 -4.851 2.281 -9.306 1.00 0.00 C ATOM 862 O VAL D 55 -5.604 2.251 -8.354 1.00 0.00 O ATOM 863 CB VAL D 55 -5.441 4.594 -10.082 1.00 0.00 C ATOM 864 CG1 VAL D 55 -4.246 5.478 -10.431 1.00 0.00 C ATOM 865 CG2 VAL D 55 -6.681 5.135 -10.806 1.00 0.00 C ATOM 0 H VAL D 55 -6.930 1.991 -10.711 1.00 0.00 H new ATOM 0 HA VAL D 55 -4.279 3.157 -11.187 1.00 0.00 H new ATOM 0 HB VAL D 55 -5.621 4.601 -9.007 1.00 0.00 H new ATOM 0 HG11 VAL D 55 -4.448 6.502 -10.118 1.00 0.00 H new ATOM 0 HG12 VAL D 55 -3.358 5.109 -9.917 1.00 0.00 H new ATOM 0 HG13 VAL D 55 -4.078 5.454 -11.508 1.00 0.00 H new ATOM 0 HG21 VAL D 55 -6.876 6.157 -10.480 1.00 0.00 H new ATOM 0 HG22 VAL D 55 -6.508 5.124 -11.882 1.00 0.00 H new ATOM 0 HG23 VAL D 55 -7.542 4.509 -10.571 1.00 0.00 H new ATOM 875 N LYS D 56 -3.760 1.566 -9.329 1.00 0.00 N ATOM 876 CA LYS D 56 -3.423 0.686 -8.172 1.00 0.00 C ATOM 877 C LYS D 56 -1.895 0.597 -8.029 1.00 0.00 C ATOM 878 O LYS D 56 -1.204 0.347 -8.994 1.00 0.00 O ATOM 879 CB LYS D 56 -4.013 -0.705 -8.429 1.00 0.00 C ATOM 880 CG LYS D 56 -3.412 -1.732 -7.462 1.00 0.00 C ATOM 881 CD LYS D 56 -4.118 -1.631 -6.108 1.00 0.00 C ATOM 882 CE LYS D 56 -4.982 -2.873 -5.887 1.00 0.00 C ATOM 883 NZ LYS D 56 -4.176 -3.925 -5.206 1.00 0.00 N ATOM 0 H LYS D 56 -3.088 1.552 -10.096 1.00 0.00 H new ATOM 0 HA LYS D 56 -3.838 1.093 -7.250 1.00 0.00 H new ATOM 0 HB2 LYS D 56 -5.096 -0.675 -8.309 1.00 0.00 H new ATOM 0 HB3 LYS D 56 -3.814 -1.006 -9.458 1.00 0.00 H new ATOM 0 HG2 LYS D 56 -3.522 -2.738 -7.868 1.00 0.00 H new ATOM 0 HG3 LYS D 56 -2.344 -1.552 -7.342 1.00 0.00 H new ATOM 0 HD2 LYS D 56 -3.382 -1.540 -5.309 1.00 0.00 H new ATOM 0 HD3 LYS D 56 -4.737 -0.734 -6.075 1.00 0.00 H new ATOM 0 HE2 LYS D 56 -5.853 -2.620 -5.283 1.00 0.00 H new ATOM 0 HE3 LYS D 56 -5.353 -3.245 -6.842 1.00 0.00 H new ATOM 0 HZ1 LYS D 56 -4.764 -4.770 -5.056 1.00 0.00 H new ATOM 0 HZ2 LYS D 56 -3.358 -4.173 -5.798 1.00 0.00 H new ATOM 0 HZ3 LYS D 56 -3.843 -3.567 -4.288 1.00 0.00 H new ATOM 897 N PRO D 57 -1.411 0.811 -6.827 1.00 0.00 N ATOM 898 CA PRO D 57 0.036 0.778 -6.537 1.00 0.00 C ATOM 899 C PRO D 57 0.562 -0.659 -6.479 1.00 0.00 C ATOM 900 O PRO D 57 -0.138 -1.576 -6.095 1.00 0.00 O ATOM 901 CB PRO D 57 0.145 1.459 -5.170 1.00 0.00 C ATOM 902 CG PRO D 57 -1.248 1.339 -4.510 1.00 0.00 C ATOM 903 CD PRO D 57 -2.256 1.100 -5.650 1.00 0.00 C ATOM 0 HA PRO D 57 0.629 1.272 -7.307 1.00 0.00 H new ATOM 0 HB2 PRO D 57 0.908 0.979 -4.557 1.00 0.00 H new ATOM 0 HB3 PRO D 57 0.434 2.504 -5.279 1.00 0.00 H new ATOM 0 HG2 PRO D 57 -1.269 0.516 -3.796 1.00 0.00 H new ATOM 0 HG3 PRO D 57 -1.495 2.246 -3.958 1.00 0.00 H new ATOM 0 HD2 PRO D 57 -2.922 0.268 -5.424 1.00 0.00 H new ATOM 0 HD3 PRO D 57 -2.884 1.975 -5.816 1.00 0.00 H new ATOM 911 N PHE D 58 1.798 -0.857 -6.858 1.00 0.00 N ATOM 912 CA PHE D 58 2.381 -2.226 -6.825 1.00 0.00 C ATOM 913 C PHE D 58 3.710 -2.196 -6.057 1.00 0.00 C ATOM 914 O PHE D 58 4.414 -1.206 -6.081 1.00 0.00 O ATOM 915 CB PHE D 58 2.596 -2.723 -8.268 1.00 0.00 C ATOM 916 CG PHE D 58 3.966 -2.328 -8.781 1.00 0.00 C ATOM 917 CD1 PHE D 58 5.104 -3.021 -8.346 1.00 0.00 C ATOM 918 CD2 PHE D 58 4.095 -1.277 -9.696 1.00 0.00 C ATOM 919 CE1 PHE D 58 6.368 -2.661 -8.825 1.00 0.00 C ATOM 920 CE2 PHE D 58 5.360 -0.918 -10.176 1.00 0.00 C ATOM 921 CZ PHE D 58 6.498 -1.609 -9.740 1.00 0.00 C ATOM 0 H PHE D 58 2.428 -0.126 -7.189 1.00 0.00 H new ATOM 0 HA PHE D 58 1.701 -2.910 -6.317 1.00 0.00 H new ATOM 0 HB2 PHE D 58 2.490 -3.807 -8.302 1.00 0.00 H new ATOM 0 HB3 PHE D 58 1.827 -2.307 -8.918 1.00 0.00 H new ATOM 0 HD1 PHE D 58 5.005 -3.833 -7.641 1.00 0.00 H new ATOM 0 HD2 PHE D 58 3.218 -0.743 -10.032 1.00 0.00 H new ATOM 0 HE1 PHE D 58 7.244 -3.195 -8.489 1.00 0.00 H new ATOM 0 HE2 PHE D 58 5.459 -0.108 -10.883 1.00 0.00 H new ATOM 0 HZ PHE D 58 7.474 -1.331 -10.109 1.00 0.00 H new ATOM 931 N PRO D 59 4.010 -3.287 -5.399 1.00 0.00 N ATOM 932 CA PRO D 59 3.145 -4.480 -5.381 1.00 0.00 C ATOM 933 C PRO D 59 1.978 -4.273 -4.413 1.00 0.00 C ATOM 934 O PRO D 59 1.742 -3.181 -3.935 1.00 0.00 O ATOM 935 CB PRO D 59 4.075 -5.590 -4.884 1.00 0.00 C ATOM 936 CG PRO D 59 5.221 -4.886 -4.119 1.00 0.00 C ATOM 937 CD PRO D 59 5.251 -3.427 -4.613 1.00 0.00 C ATOM 0 HA PRO D 59 2.702 -4.706 -6.351 1.00 0.00 H new ATOM 0 HB2 PRO D 59 3.541 -6.282 -4.233 1.00 0.00 H new ATOM 0 HB3 PRO D 59 4.465 -6.173 -5.718 1.00 0.00 H new ATOM 0 HG2 PRO D 59 5.051 -4.927 -3.043 1.00 0.00 H new ATOM 0 HG3 PRO D 59 6.174 -5.379 -4.310 1.00 0.00 H new ATOM 0 HD2 PRO D 59 5.276 -2.725 -3.780 1.00 0.00 H new ATOM 0 HD3 PRO D 59 6.133 -3.231 -5.222 1.00 0.00 H new ATOM 1088 N GLN E 3 9.308 14.420 -9.014 1.00 0.00 N ATOM 1089 CA GLN E 3 10.204 13.444 -9.698 1.00 0.00 C ATOM 1090 C GLN E 3 9.364 12.298 -10.268 1.00 0.00 C ATOM 1091 O GLN E 3 9.026 11.358 -9.574 1.00 0.00 O ATOM 1092 CB GLN E 3 11.212 12.886 -8.691 1.00 0.00 C ATOM 1093 CG GLN E 3 12.335 13.904 -8.476 1.00 0.00 C ATOM 1094 CD GLN E 3 12.917 13.733 -7.071 1.00 0.00 C ATOM 1095 OE1 GLN E 3 12.960 12.638 -6.547 1.00 0.00 O ATOM 1096 NE2 GLN E 3 13.374 14.778 -6.435 1.00 0.00 N ATOM 0 HA GLN E 3 10.738 13.943 -10.507 1.00 0.00 H new ATOM 0 HB2 GLN E 3 10.716 12.671 -7.745 1.00 0.00 H new ATOM 0 HB3 GLN E 3 11.624 11.945 -9.056 1.00 0.00 H new ATOM 0 HG2 GLN E 3 13.115 13.764 -9.224 1.00 0.00 H new ATOM 0 HG3 GLN E 3 11.951 14.917 -8.601 1.00 0.00 H new ATOM 0 HE21 GLN E 3 13.338 15.698 -6.874 1.00 0.00 H new ATOM 0 HE22 GLN E 3 13.767 14.674 -5.499 1.00 0.00 H new ATOM 1105 N ARG E 4 9.021 12.370 -11.527 1.00 0.00 N ATOM 1106 CA ARG E 4 8.200 11.288 -12.139 1.00 0.00 C ATOM 1107 C ARG E 4 9.050 10.490 -13.131 1.00 0.00 C ATOM 1108 O ARG E 4 9.674 11.040 -14.018 1.00 0.00 O ATOM 1109 CB ARG E 4 7.007 11.907 -12.873 1.00 0.00 C ATOM 1110 CG ARG E 4 5.897 12.224 -11.868 1.00 0.00 C ATOM 1111 CD ARG E 4 5.211 10.924 -11.440 1.00 0.00 C ATOM 1112 NE ARG E 4 3.904 10.796 -12.144 1.00 0.00 N ATOM 1113 CZ ARG E 4 3.873 10.466 -13.406 1.00 0.00 C ATOM 1114 NH1 ARG E 4 4.027 9.220 -13.759 1.00 0.00 N ATOM 1115 NH2 ARG E 4 3.681 11.383 -14.315 1.00 0.00 N ATOM 0 H ARG E 4 9.274 13.131 -12.157 1.00 0.00 H new ATOM 0 HA ARG E 4 7.842 10.621 -11.355 1.00 0.00 H new ATOM 0 HB2 ARG E 4 7.316 12.816 -13.389 1.00 0.00 H new ATOM 0 HB3 ARG E 4 6.638 11.219 -13.634 1.00 0.00 H new ATOM 0 HG2 ARG E 4 6.313 12.732 -10.998 1.00 0.00 H new ATOM 0 HG3 ARG E 4 5.170 12.902 -12.315 1.00 0.00 H new ATOM 0 HD2 ARG E 4 5.847 10.071 -11.674 1.00 0.00 H new ATOM 0 HD3 ARG E 4 5.057 10.920 -10.361 1.00 0.00 H new ATOM 0 HE ARG E 4 3.034 10.966 -11.640 1.00 0.00 H new ATOM 0 HH11 ARG E 4 4.172 8.503 -13.048 1.00 0.00 H new ATOM 0 HH12 ARG E 4 4.003 8.963 -14.746 1.00 0.00 H new ATOM 0 HH21 ARG E 4 3.555 12.357 -14.039 1.00 0.00 H new ATOM 0 HH22 ARG E 4 3.657 11.126 -15.302 1.00 0.00 H new ATOM 1129 N ILE E 5 9.073 9.192 -12.989 1.00 0.00 N ATOM 1130 CA ILE E 5 9.875 8.345 -13.918 1.00 0.00 C ATOM 1131 C ILE E 5 9.175 6.995 -14.094 1.00 0.00 C ATOM 1132 O ILE E 5 8.789 6.360 -13.136 1.00 0.00 O ATOM 1133 CB ILE E 5 11.269 8.123 -13.333 1.00 0.00 C ATOM 1134 CG1 ILE E 5 12.016 9.456 -13.276 1.00 0.00 C ATOM 1135 CG2 ILE E 5 12.045 7.142 -14.215 1.00 0.00 C ATOM 1136 CD1 ILE E 5 11.811 10.092 -11.902 1.00 0.00 C ATOM 0 H ILE E 5 8.568 8.680 -12.266 1.00 0.00 H new ATOM 0 HA ILE E 5 9.965 8.843 -14.884 1.00 0.00 H new ATOM 0 HB ILE E 5 11.178 7.713 -12.327 1.00 0.00 H new ATOM 0 HG12 ILE E 5 13.078 9.299 -13.462 1.00 0.00 H new ATOM 0 HG13 ILE E 5 11.651 10.124 -14.057 1.00 0.00 H new ATOM 0 HG21 ILE E 5 13.039 6.985 -13.797 1.00 0.00 H new ATOM 0 HG22 ILE E 5 11.514 6.191 -14.256 1.00 0.00 H new ATOM 0 HG23 ILE E 5 12.135 7.551 -15.221 1.00 0.00 H new ATOM 0 HD11 ILE E 5 12.342 11.043 -11.858 1.00 0.00 H new ATOM 0 HD12 ILE E 5 10.747 10.263 -11.735 1.00 0.00 H new ATOM 0 HD13 ILE E 5 12.197 9.425 -11.131 1.00 0.00 H new ATOM 1148 N THR E 6 9.006 6.553 -15.310 1.00 0.00 N ATOM 1149 CA THR E 6 8.326 5.245 -15.538 1.00 0.00 C ATOM 1150 C THR E 6 9.177 4.111 -14.960 1.00 0.00 C ATOM 1151 O THR E 6 10.372 4.243 -14.789 1.00 0.00 O ATOM 1152 CB THR E 6 8.139 5.026 -17.040 1.00 0.00 C ATOM 1153 OG1 THR E 6 8.146 6.281 -17.706 1.00 0.00 O ATOM 1154 CG2 THR E 6 6.808 4.317 -17.295 1.00 0.00 C ATOM 0 H THR E 6 9.308 7.039 -16.154 1.00 0.00 H new ATOM 0 HA THR E 6 7.354 5.253 -15.044 1.00 0.00 H new ATOM 0 HB THR E 6 8.953 4.409 -17.420 1.00 0.00 H new ATOM 0 HG1 THR E 6 8.028 6.141 -18.669 1.00 0.00 H new ATOM 0 HG21 THR E 6 6.677 4.162 -18.366 1.00 0.00 H new ATOM 0 HG22 THR E 6 6.806 3.353 -16.786 1.00 0.00 H new ATOM 0 HG23 THR E 6 5.991 4.930 -16.915 1.00 0.00 H new ATOM 1162 N LEU E 7 8.567 2.995 -14.664 1.00 0.00 N ATOM 1163 CA LEU E 7 9.336 1.848 -14.102 1.00 0.00 C ATOM 1164 C LEU E 7 10.393 1.408 -15.117 1.00 0.00 C ATOM 1165 O LEU E 7 11.312 0.681 -14.797 1.00 0.00 O ATOM 1166 CB LEU E 7 8.381 0.683 -13.820 1.00 0.00 C ATOM 1167 CG LEU E 7 9.181 -0.603 -13.597 1.00 0.00 C ATOM 1168 CD1 LEU E 7 10.063 -0.449 -12.356 1.00 0.00 C ATOM 1169 CD2 LEU E 7 8.215 -1.773 -13.393 1.00 0.00 C ATOM 0 H LEU E 7 7.568 2.828 -14.787 1.00 0.00 H new ATOM 0 HA LEU E 7 9.822 2.150 -13.174 1.00 0.00 H new ATOM 0 HB2 LEU E 7 7.775 0.902 -12.941 1.00 0.00 H new ATOM 0 HB3 LEU E 7 7.694 0.554 -14.656 1.00 0.00 H new ATOM 0 HG LEU E 7 9.810 -0.795 -14.467 1.00 0.00 H new ATOM 0 HD11 LEU E 7 10.632 -1.365 -12.198 1.00 0.00 H new ATOM 0 HD12 LEU E 7 10.750 0.385 -12.499 1.00 0.00 H new ATOM 0 HD13 LEU E 7 9.436 -0.257 -11.485 1.00 0.00 H new ATOM 0 HD21 LEU E 7 8.783 -2.690 -13.234 1.00 0.00 H new ATOM 0 HD22 LEU E 7 7.587 -1.579 -12.523 1.00 0.00 H new ATOM 0 HD23 LEU E 7 7.586 -1.884 -14.276 1.00 0.00 H new ATOM 1181 N LYS E 8 10.265 1.841 -16.341 1.00 0.00 N ATOM 1182 CA LYS E 8 11.256 1.445 -17.379 1.00 0.00 C ATOM 1183 C LYS E 8 12.401 2.460 -17.414 1.00 0.00 C ATOM 1184 O LYS E 8 13.518 2.137 -17.766 1.00 0.00 O ATOM 1185 CB LYS E 8 10.565 1.397 -18.743 1.00 0.00 C ATOM 1186 CG LYS E 8 10.138 2.807 -19.153 1.00 0.00 C ATOM 1187 CD LYS E 8 9.957 2.862 -20.671 1.00 0.00 C ATOM 1188 CE LYS E 8 10.144 4.300 -21.153 1.00 0.00 C ATOM 1189 NZ LYS E 8 9.139 4.601 -22.212 1.00 0.00 N ATOM 0 H LYS E 8 9.516 2.452 -16.667 1.00 0.00 H new ATOM 0 HA LYS E 8 11.661 0.461 -17.141 1.00 0.00 H new ATOM 0 HB2 LYS E 8 11.241 0.980 -19.489 1.00 0.00 H new ATOM 0 HB3 LYS E 8 9.695 0.742 -18.698 1.00 0.00 H new ATOM 0 HG2 LYS E 8 9.207 3.076 -18.655 1.00 0.00 H new ATOM 0 HG3 LYS E 8 10.889 3.532 -18.839 1.00 0.00 H new ATOM 0 HD2 LYS E 8 10.679 2.207 -21.158 1.00 0.00 H new ATOM 0 HD3 LYS E 8 8.965 2.502 -20.943 1.00 0.00 H new ATOM 0 HE2 LYS E 8 10.029 4.993 -20.319 1.00 0.00 H new ATOM 0 HE3 LYS E 8 11.152 4.436 -21.544 1.00 0.00 H new ATOM 0 HZ1 LYS E 8 9.264 5.579 -22.542 1.00 0.00 H new ATOM 0 HZ2 LYS E 8 9.269 3.947 -23.010 1.00 0.00 H new ATOM 0 HZ3 LYS E 8 8.181 4.487 -21.824 1.00 0.00 H new ATOM 1203 N ASP E 9 12.134 3.686 -17.054 1.00 0.00 N ATOM 1204 CA ASP E 9 13.208 4.720 -17.071 1.00 0.00 C ATOM 1205 C ASP E 9 14.045 4.605 -15.794 1.00 0.00 C ATOM 1206 O ASP E 9 15.232 4.863 -15.792 1.00 0.00 O ATOM 1207 CB ASP E 9 12.576 6.111 -17.146 1.00 0.00 C ATOM 1208 CG ASP E 9 12.518 6.568 -18.605 1.00 0.00 C ATOM 1209 OD1 ASP E 9 12.160 5.758 -19.445 1.00 0.00 O ATOM 1210 OD2 ASP E 9 12.831 7.720 -18.857 1.00 0.00 O ATOM 0 H ASP E 9 11.219 4.016 -16.749 1.00 0.00 H new ATOM 0 HA ASP E 9 13.848 4.567 -17.940 1.00 0.00 H new ATOM 0 HB2 ASP E 9 11.573 6.089 -16.721 1.00 0.00 H new ATOM 0 HB3 ASP E 9 13.158 6.819 -16.555 1.00 0.00 H new ATOM 1215 N TYR E 10 13.434 4.217 -14.709 1.00 0.00 N ATOM 1216 CA TYR E 10 14.191 4.081 -13.433 1.00 0.00 C ATOM 1217 C TYR E 10 14.923 2.738 -13.421 1.00 0.00 C ATOM 1218 O TYR E 10 15.966 2.593 -12.813 1.00 0.00 O ATOM 1219 CB TYR E 10 13.212 4.143 -12.255 1.00 0.00 C ATOM 1220 CG TYR E 10 13.974 4.046 -10.953 1.00 0.00 C ATOM 1221 CD1 TYR E 10 15.043 4.913 -10.702 1.00 0.00 C ATOM 1222 CD2 TYR E 10 13.611 3.088 -9.998 1.00 0.00 C ATOM 1223 CE1 TYR E 10 15.749 4.825 -9.498 1.00 0.00 C ATOM 1224 CE2 TYR E 10 14.318 3.000 -8.791 1.00 0.00 C ATOM 1225 CZ TYR E 10 15.388 3.868 -8.542 1.00 0.00 C ATOM 1226 OH TYR E 10 16.084 3.782 -7.355 1.00 0.00 O ATOM 0 H TYR E 10 12.442 3.988 -14.651 1.00 0.00 H new ATOM 0 HA TYR E 10 14.916 4.890 -13.346 1.00 0.00 H new ATOM 0 HB2 TYR E 10 12.647 5.074 -12.288 1.00 0.00 H new ATOM 0 HB3 TYR E 10 12.490 3.329 -12.326 1.00 0.00 H new ATOM 0 HD1 TYR E 10 15.323 5.651 -11.439 1.00 0.00 H new ATOM 0 HD2 TYR E 10 12.787 2.417 -10.192 1.00 0.00 H new ATOM 0 HE1 TYR E 10 16.573 5.496 -9.306 1.00 0.00 H new ATOM 0 HE2 TYR E 10 14.038 2.263 -8.053 1.00 0.00 H new ATOM 0 HH TYR E 10 15.486 3.462 -6.648 1.00 0.00 H new ATOM 1236 N ALA E 11 14.385 1.754 -14.089 1.00 0.00 N ATOM 1237 CA ALA E 11 15.045 0.418 -14.116 1.00 0.00 C ATOM 1238 C ALA E 11 16.112 0.388 -15.213 1.00 0.00 C ATOM 1239 O ALA E 11 17.055 -0.376 -15.153 1.00 0.00 O ATOM 1240 CB ALA E 11 13.994 -0.658 -14.399 1.00 0.00 C ATOM 0 H ALA E 11 13.515 1.818 -14.618 1.00 0.00 H new ATOM 0 HA ALA E 11 15.517 0.228 -13.152 1.00 0.00 H new ATOM 0 HB1 ALA E 11 14.472 -1.637 -14.420 1.00 0.00 H new ATOM 0 HB2 ALA E 11 13.236 -0.641 -13.616 1.00 0.00 H new ATOM 0 HB3 ALA E 11 13.524 -0.463 -15.363 1.00 0.00 H new ATOM 1246 N MET E 12 15.970 1.210 -16.218 1.00 0.00 N ATOM 1247 CA MET E 12 16.977 1.221 -17.317 1.00 0.00 C ATOM 1248 C MET E 12 18.088 2.218 -16.988 1.00 0.00 C ATOM 1249 O MET E 12 19.254 1.961 -17.212 1.00 0.00 O ATOM 1250 CB MET E 12 16.299 1.632 -18.625 1.00 0.00 C ATOM 1251 CG MET E 12 15.411 0.490 -19.125 1.00 0.00 C ATOM 1252 SD MET E 12 14.621 0.979 -20.679 1.00 0.00 S ATOM 1253 CE MET E 12 13.577 -0.485 -20.876 1.00 0.00 C ATOM 0 H MET E 12 15.202 1.873 -16.325 1.00 0.00 H new ATOM 0 HA MET E 12 17.405 0.224 -17.423 1.00 0.00 H new ATOM 0 HB2 MET E 12 15.701 2.530 -18.470 1.00 0.00 H new ATOM 0 HB3 MET E 12 17.051 1.876 -19.375 1.00 0.00 H new ATOM 0 HG2 MET E 12 16.007 -0.410 -19.275 1.00 0.00 H new ATOM 0 HG3 MET E 12 14.654 0.250 -18.379 1.00 0.00 H new ATOM 0 HE1 MET E 12 12.991 -0.393 -21.790 1.00 0.00 H new ATOM 0 HE2 MET E 12 14.205 -1.374 -20.935 1.00 0.00 H new ATOM 0 HE3 MET E 12 12.906 -0.571 -20.022 1.00 0.00 H new ATOM 1263 N ARG E 13 17.735 3.355 -16.461 1.00 0.00 N ATOM 1264 CA ARG E 13 18.769 4.374 -16.122 1.00 0.00 C ATOM 1265 C ARG E 13 19.440 4.005 -14.797 1.00 0.00 C ATOM 1266 O ARG E 13 20.580 4.346 -14.554 1.00 0.00 O ATOM 1267 CB ARG E 13 18.110 5.749 -15.994 1.00 0.00 C ATOM 1268 CG ARG E 13 17.877 6.333 -17.389 1.00 0.00 C ATOM 1269 CD ARG E 13 16.603 7.178 -17.384 1.00 0.00 C ATOM 1270 NE ARG E 13 16.958 8.612 -17.575 1.00 0.00 N ATOM 1271 CZ ARG E 13 16.320 9.329 -18.459 1.00 0.00 C ATOM 1272 NH1 ARG E 13 16.184 8.890 -19.681 1.00 0.00 N ATOM 1273 NH2 ARG E 13 15.814 10.482 -18.118 1.00 0.00 N ATOM 0 H ARG E 13 16.774 3.625 -16.249 1.00 0.00 H new ATOM 0 HA ARG E 13 19.519 4.402 -16.912 1.00 0.00 H new ATOM 0 HB2 ARG E 13 17.163 5.662 -15.461 1.00 0.00 H new ATOM 0 HB3 ARG E 13 18.745 6.416 -15.410 1.00 0.00 H new ATOM 0 HG2 ARG E 13 18.730 6.944 -17.686 1.00 0.00 H new ATOM 0 HG3 ARG E 13 17.790 5.530 -18.121 1.00 0.00 H new ATOM 0 HD2 ARG E 13 15.933 6.849 -18.178 1.00 0.00 H new ATOM 0 HD3 ARG E 13 16.070 7.046 -16.442 1.00 0.00 H new ATOM 0 HE ARG E 13 17.699 9.033 -17.015 1.00 0.00 H new ATOM 0 HH11 ARG E 13 16.577 7.986 -19.945 1.00 0.00 H new ATOM 0 HH12 ARG E 13 15.685 9.451 -20.372 1.00 0.00 H new ATOM 0 HH21 ARG E 13 15.917 10.822 -17.162 1.00 0.00 H new ATOM 0 HH22 ARG E 13 15.315 11.044 -18.808 1.00 0.00 H new ATOM 1287 N PHE E 14 18.747 3.309 -13.937 1.00 0.00 N ATOM 1288 CA PHE E 14 19.355 2.924 -12.633 1.00 0.00 C ATOM 1289 C PHE E 14 19.526 1.403 -12.579 1.00 0.00 C ATOM 1290 O PHE E 14 20.144 0.871 -11.678 1.00 0.00 O ATOM 1291 CB PHE E 14 18.447 3.383 -11.490 1.00 0.00 C ATOM 1292 CG PHE E 14 18.065 4.829 -11.702 1.00 0.00 C ATOM 1293 CD1 PHE E 14 17.208 5.183 -12.754 1.00 0.00 C ATOM 1294 CD2 PHE E 14 18.571 5.817 -10.849 1.00 0.00 C ATOM 1295 CE1 PHE E 14 16.859 6.525 -12.950 1.00 0.00 C ATOM 1296 CE2 PHE E 14 18.220 7.159 -11.045 1.00 0.00 C ATOM 1297 CZ PHE E 14 17.366 7.512 -12.096 1.00 0.00 C ATOM 0 H PHE E 14 17.788 2.991 -14.081 1.00 0.00 H new ATOM 0 HA PHE E 14 20.330 3.400 -12.531 1.00 0.00 H new ATOM 0 HB2 PHE E 14 17.553 2.761 -11.449 1.00 0.00 H new ATOM 0 HB3 PHE E 14 18.959 3.267 -10.535 1.00 0.00 H new ATOM 0 HD1 PHE E 14 16.817 4.421 -13.413 1.00 0.00 H new ATOM 0 HD2 PHE E 14 19.232 5.545 -10.040 1.00 0.00 H new ATOM 0 HE1 PHE E 14 16.199 6.799 -13.760 1.00 0.00 H new ATOM 0 HE2 PHE E 14 18.608 7.921 -10.385 1.00 0.00 H new ATOM 0 HZ PHE E 14 17.098 8.547 -12.249 1.00 0.00 H new ATOM 1307 N GLY E 15 18.986 0.700 -13.539 1.00 0.00 N ATOM 1308 CA GLY E 15 19.121 -0.786 -13.545 1.00 0.00 C ATOM 1309 C GLY E 15 17.868 -1.422 -12.942 1.00 0.00 C ATOM 1310 O GLY E 15 17.248 -0.874 -12.052 1.00 0.00 O ATOM 0 H GLY E 15 18.457 1.090 -14.319 1.00 0.00 H new ATOM 0 HA2 GLY E 15 19.267 -1.143 -14.565 1.00 0.00 H new ATOM 0 HA3 GLY E 15 20.001 -1.083 -12.975 1.00 0.00 H new ATOM 1314 N GLN E 16 17.491 -2.578 -13.418 1.00 0.00 N ATOM 1315 CA GLN E 16 16.281 -3.253 -12.871 1.00 0.00 C ATOM 1316 C GLN E 16 16.569 -3.730 -11.449 1.00 0.00 C ATOM 1317 O GLN E 16 15.728 -3.662 -10.576 1.00 0.00 O ATOM 1318 CB GLN E 16 15.922 -4.451 -13.751 1.00 0.00 C ATOM 1319 CG GLN E 16 15.376 -3.954 -15.091 1.00 0.00 C ATOM 1320 CD GLN E 16 16.375 -4.278 -16.204 1.00 0.00 C ATOM 1321 OE1 GLN E 16 16.905 -3.388 -16.838 1.00 0.00 O ATOM 1322 NE2 GLN E 16 16.658 -5.524 -16.470 1.00 0.00 N ATOM 0 H GLN E 16 17.970 -3.084 -14.163 1.00 0.00 H new ATOM 0 HA GLN E 16 15.446 -2.553 -12.858 1.00 0.00 H new ATOM 0 HB2 GLN E 16 16.802 -5.073 -13.913 1.00 0.00 H new ATOM 0 HB3 GLN E 16 15.179 -5.073 -13.252 1.00 0.00 H new ATOM 0 HG2 GLN E 16 14.416 -4.426 -15.301 1.00 0.00 H new ATOM 0 HG3 GLN E 16 15.200 -2.879 -15.048 1.00 0.00 H new ATOM 0 HE21 GLN E 16 16.214 -6.273 -15.938 1.00 0.00 H new ATOM 0 HE22 GLN E 16 17.323 -5.749 -17.209 1.00 0.00 H new ATOM 1331 N THR E 17 17.757 -4.210 -11.211 1.00 0.00 N ATOM 1332 CA THR E 17 18.106 -4.688 -9.845 1.00 0.00 C ATOM 1333 C THR E 17 18.020 -3.516 -8.866 1.00 0.00 C ATOM 1334 O THR E 17 17.765 -3.692 -7.691 1.00 0.00 O ATOM 1335 CB THR E 17 19.528 -5.254 -9.848 1.00 0.00 C ATOM 1336 OG1 THR E 17 19.702 -6.084 -10.989 1.00 0.00 O ATOM 1337 CG2 THR E 17 19.757 -6.073 -8.578 1.00 0.00 C ATOM 0 H THR E 17 18.501 -4.292 -11.903 1.00 0.00 H new ATOM 0 HA THR E 17 17.410 -5.470 -9.540 1.00 0.00 H new ATOM 0 HB THR E 17 20.246 -4.434 -9.881 1.00 0.00 H new ATOM 0 HG1 THR E 17 20.613 -6.446 -10.994 1.00 0.00 H new ATOM 0 HG21 THR E 17 20.770 -6.475 -8.582 1.00 0.00 H new ATOM 0 HG22 THR E 17 19.623 -5.435 -7.704 1.00 0.00 H new ATOM 0 HG23 THR E 17 19.041 -6.894 -8.540 1.00 0.00 H new ATOM 1345 N LYS E 18 18.226 -2.318 -9.342 1.00 0.00 N ATOM 1346 CA LYS E 18 18.151 -1.135 -8.440 1.00 0.00 C ATOM 1347 C LYS E 18 16.684 -0.780 -8.201 1.00 0.00 C ATOM 1348 O LYS E 18 16.276 -0.488 -7.095 1.00 0.00 O ATOM 1349 CB LYS E 18 18.867 0.051 -9.087 1.00 0.00 C ATOM 1350 CG LYS E 18 20.311 0.113 -8.581 1.00 0.00 C ATOM 1351 CD LYS E 18 20.883 1.508 -8.836 1.00 0.00 C ATOM 1352 CE LYS E 18 22.251 1.383 -9.508 1.00 0.00 C ATOM 1353 NZ LYS E 18 23.216 2.302 -8.844 1.00 0.00 N ATOM 0 H LYS E 18 18.443 -2.108 -10.316 1.00 0.00 H new ATOM 0 HA LYS E 18 18.632 -1.368 -7.490 1.00 0.00 H new ATOM 0 HB2 LYS E 18 18.855 -0.051 -10.172 1.00 0.00 H new ATOM 0 HB3 LYS E 18 18.346 0.978 -8.848 1.00 0.00 H new ATOM 0 HG2 LYS E 18 20.344 -0.116 -7.516 1.00 0.00 H new ATOM 0 HG3 LYS E 18 20.917 -0.638 -9.087 1.00 0.00 H new ATOM 0 HD2 LYS E 18 20.206 2.080 -9.470 1.00 0.00 H new ATOM 0 HD3 LYS E 18 20.976 2.052 -7.896 1.00 0.00 H new ATOM 0 HE2 LYS E 18 22.608 0.355 -9.443 1.00 0.00 H new ATOM 0 HE3 LYS E 18 22.171 1.626 -10.568 1.00 0.00 H new ATOM 0 HZ1 LYS E 18 24.147 2.217 -9.301 1.00 0.00 H new ATOM 0 HZ2 LYS E 18 22.877 3.282 -8.928 1.00 0.00 H new ATOM 0 HZ3 LYS E 18 23.300 2.050 -7.838 1.00 0.00 H new ATOM 1367 N THR E 19 15.885 -0.809 -9.231 1.00 0.00 N ATOM 1368 CA THR E 19 14.442 -0.481 -9.065 1.00 0.00 C ATOM 1369 C THR E 19 13.818 -1.469 -8.079 1.00 0.00 C ATOM 1370 O THR E 19 12.906 -1.140 -7.347 1.00 0.00 O ATOM 1371 CB THR E 19 13.731 -0.586 -10.418 1.00 0.00 C ATOM 1372 OG1 THR E 19 14.407 0.224 -11.369 1.00 0.00 O ATOM 1373 CG2 THR E 19 12.282 -0.112 -10.277 1.00 0.00 C ATOM 0 H THR E 19 16.169 -1.046 -10.181 1.00 0.00 H new ATOM 0 HA THR E 19 14.337 0.535 -8.685 1.00 0.00 H new ATOM 0 HB THR E 19 13.738 -1.623 -10.752 1.00 0.00 H new ATOM 0 HG1 THR E 19 14.304 1.168 -11.127 1.00 0.00 H new ATOM 0 HG21 THR E 19 11.779 -0.188 -11.241 1.00 0.00 H new ATOM 0 HG22 THR E 19 11.765 -0.735 -9.548 1.00 0.00 H new ATOM 0 HG23 THR E 19 12.269 0.925 -9.942 1.00 0.00 H new ATOM 1381 N ALA E 20 14.309 -2.678 -8.050 1.00 0.00 N ATOM 1382 CA ALA E 20 13.752 -3.686 -7.107 1.00 0.00 C ATOM 1383 C ALA E 20 14.385 -3.488 -5.729 1.00 0.00 C ATOM 1384 O ALA E 20 13.858 -3.921 -4.725 1.00 0.00 O ATOM 1385 CB ALA E 20 14.066 -5.095 -7.617 1.00 0.00 C ATOM 0 H ALA E 20 15.072 -3.010 -8.639 1.00 0.00 H new ATOM 0 HA ALA E 20 12.671 -3.562 -7.036 1.00 0.00 H new ATOM 0 HB1 ALA E 20 13.657 -5.832 -6.925 1.00 0.00 H new ATOM 0 HB2 ALA E 20 13.618 -5.234 -8.601 1.00 0.00 H new ATOM 0 HB3 ALA E 20 15.146 -5.224 -7.688 1.00 0.00 H new ATOM 1391 N LYS E 21 15.512 -2.833 -5.673 1.00 0.00 N ATOM 1392 CA LYS E 21 16.176 -2.605 -4.359 1.00 0.00 C ATOM 1393 C LYS E 21 15.456 -1.476 -3.622 1.00 0.00 C ATOM 1394 O LYS E 21 15.287 -1.513 -2.419 1.00 0.00 O ATOM 1395 CB LYS E 21 17.639 -2.218 -4.585 1.00 0.00 C ATOM 1396 CG LYS E 21 18.480 -2.686 -3.394 1.00 0.00 C ATOM 1397 CD LYS E 21 19.023 -4.088 -3.670 1.00 0.00 C ATOM 1398 CE LYS E 21 20.553 -4.062 -3.630 1.00 0.00 C ATOM 1399 NZ LYS E 21 21.036 -4.953 -2.539 1.00 0.00 N ATOM 0 H LYS E 21 16.001 -2.446 -6.480 1.00 0.00 H new ATOM 0 HA LYS E 21 16.133 -3.517 -3.764 1.00 0.00 H new ATOM 0 HB2 LYS E 21 18.008 -2.671 -5.505 1.00 0.00 H new ATOM 0 HB3 LYS E 21 17.727 -1.138 -4.704 1.00 0.00 H new ATOM 0 HG2 LYS E 21 19.304 -1.993 -3.223 1.00 0.00 H new ATOM 0 HG3 LYS E 21 17.874 -2.691 -2.488 1.00 0.00 H new ATOM 0 HD2 LYS E 21 18.641 -4.789 -2.928 1.00 0.00 H new ATOM 0 HD3 LYS E 21 18.680 -4.437 -4.644 1.00 0.00 H new ATOM 0 HE2 LYS E 21 20.958 -4.389 -4.588 1.00 0.00 H new ATOM 0 HE3 LYS E 21 20.906 -3.044 -3.466 1.00 0.00 H new ATOM 0 HZ1 LYS E 21 22.075 -4.936 -2.511 1.00 0.00 H new ATOM 0 HZ2 LYS E 21 20.660 -4.621 -1.628 1.00 0.00 H new ATOM 0 HZ3 LYS E 21 20.710 -5.925 -2.715 1.00 0.00 H new ATOM 1413 N ASP E 22 15.027 -0.473 -4.336 1.00 0.00 N ATOM 1414 CA ASP E 22 14.313 0.658 -3.682 1.00 0.00 C ATOM 1415 C ASP E 22 12.858 0.258 -3.434 1.00 0.00 C ATOM 1416 O ASP E 22 12.268 0.607 -2.430 1.00 0.00 O ATOM 1417 CB ASP E 22 14.357 1.886 -4.593 1.00 0.00 C ATOM 1418 CG ASP E 22 14.644 3.133 -3.758 1.00 0.00 C ATOM 1419 OD1 ASP E 22 14.861 2.987 -2.566 1.00 0.00 O ATOM 1420 OD2 ASP E 22 14.645 4.214 -4.323 1.00 0.00 O ATOM 0 H ASP E 22 15.140 -0.388 -5.346 1.00 0.00 H new ATOM 0 HA ASP E 22 14.795 0.895 -2.733 1.00 0.00 H new ATOM 0 HB2 ASP E 22 15.128 1.760 -5.353 1.00 0.00 H new ATOM 0 HB3 ASP E 22 13.408 1.997 -5.117 1.00 0.00 H new ATOM 1425 N LEU E 23 12.279 -0.475 -4.342 1.00 0.00 N ATOM 1426 CA LEU E 23 10.866 -0.906 -4.164 1.00 0.00 C ATOM 1427 C LEU E 23 10.830 -2.196 -3.344 1.00 0.00 C ATOM 1428 O LEU E 23 9.791 -2.618 -2.875 1.00 0.00 O ATOM 1429 CB LEU E 23 10.231 -1.146 -5.537 1.00 0.00 C ATOM 1430 CG LEU E 23 9.814 0.195 -6.146 1.00 0.00 C ATOM 1431 CD1 LEU E 23 10.049 0.169 -7.658 1.00 0.00 C ATOM 1432 CD2 LEU E 23 8.332 0.443 -5.869 1.00 0.00 C ATOM 0 H LEU E 23 12.725 -0.795 -5.202 1.00 0.00 H new ATOM 0 HA LEU E 23 10.308 -0.130 -3.640 1.00 0.00 H new ATOM 0 HB2 LEU E 23 10.939 -1.652 -6.194 1.00 0.00 H new ATOM 0 HB3 LEU E 23 9.364 -1.799 -5.440 1.00 0.00 H new ATOM 0 HG LEU E 23 10.408 0.993 -5.700 1.00 0.00 H new ATOM 0 HD11 LEU E 23 9.751 1.125 -8.089 1.00 0.00 H new ATOM 0 HD12 LEU E 23 11.106 -0.006 -7.859 1.00 0.00 H new ATOM 0 HD13 LEU E 23 9.457 -0.630 -8.104 1.00 0.00 H new ATOM 0 HD21 LEU E 23 8.036 1.398 -6.303 1.00 0.00 H new ATOM 0 HD22 LEU E 23 7.740 -0.357 -6.314 1.00 0.00 H new ATOM 0 HD23 LEU E 23 8.162 0.465 -4.793 1.00 0.00 H new ATOM 1444 N GLY E 24 11.961 -2.825 -3.160 1.00 0.00 N ATOM 1445 CA GLY E 24 11.995 -4.086 -2.363 1.00 0.00 C ATOM 1446 C GLY E 24 11.178 -5.169 -3.071 1.00 0.00 C ATOM 1447 O GLY E 24 10.446 -5.912 -2.449 1.00 0.00 O ATOM 0 H GLY E 24 12.862 -2.520 -3.527 1.00 0.00 H new ATOM 0 HA2 GLY E 24 13.025 -4.419 -2.236 1.00 0.00 H new ATOM 0 HA3 GLY E 24 11.593 -3.908 -1.366 1.00 0.00 H new ATOM 1451 N VAL E 25 11.298 -5.267 -4.367 1.00 0.00 N ATOM 1452 CA VAL E 25 10.528 -6.305 -5.108 1.00 0.00 C ATOM 1453 C VAL E 25 11.498 -7.317 -5.720 1.00 0.00 C ATOM 1454 O VAL E 25 12.689 -7.270 -5.486 1.00 0.00 O ATOM 1455 CB VAL E 25 9.710 -5.642 -6.219 1.00 0.00 C ATOM 1456 CG1 VAL E 25 8.456 -6.474 -6.495 1.00 0.00 C ATOM 1457 CG2 VAL E 25 9.300 -4.234 -5.781 1.00 0.00 C ATOM 0 H VAL E 25 11.895 -4.674 -4.944 1.00 0.00 H new ATOM 0 HA VAL E 25 9.854 -6.817 -4.421 1.00 0.00 H new ATOM 0 HB VAL E 25 10.313 -5.580 -7.125 1.00 0.00 H new ATOM 0 HG11 VAL E 25 7.873 -6.002 -7.286 1.00 0.00 H new ATOM 0 HG12 VAL E 25 8.746 -7.477 -6.807 1.00 0.00 H new ATOM 0 HG13 VAL E 25 7.854 -6.536 -5.589 1.00 0.00 H new ATOM 0 HG21 VAL E 25 8.718 -3.762 -6.572 1.00 0.00 H new ATOM 0 HG22 VAL E 25 8.698 -4.296 -4.875 1.00 0.00 H new ATOM 0 HG23 VAL E 25 10.192 -3.640 -5.584 1.00 0.00 H new ATOM 1467 N TYR E 26 10.999 -8.235 -6.503 1.00 0.00 N ATOM 1468 CA TYR E 26 11.895 -9.251 -7.126 1.00 0.00 C ATOM 1469 C TYR E 26 12.357 -8.752 -8.498 1.00 0.00 C ATOM 1470 O TYR E 26 11.694 -7.958 -9.137 1.00 0.00 O ATOM 1471 CB TYR E 26 11.142 -10.577 -7.301 1.00 0.00 C ATOM 1472 CG TYR E 26 10.018 -10.671 -6.293 1.00 0.00 C ATOM 1473 CD1 TYR E 26 10.306 -10.860 -4.936 1.00 0.00 C ATOM 1474 CD2 TYR E 26 8.688 -10.573 -6.719 1.00 0.00 C ATOM 1475 CE1 TYR E 26 9.264 -10.949 -4.005 1.00 0.00 C ATOM 1476 CE2 TYR E 26 7.645 -10.663 -5.788 1.00 0.00 C ATOM 1477 CZ TYR E 26 7.934 -10.850 -4.431 1.00 0.00 C ATOM 1478 OH TYR E 26 6.908 -10.939 -3.513 1.00 0.00 O ATOM 0 H TYR E 26 10.011 -8.325 -6.738 1.00 0.00 H new ATOM 0 HA TYR E 26 12.758 -9.408 -6.479 1.00 0.00 H new ATOM 0 HB2 TYR E 26 10.741 -10.646 -8.312 1.00 0.00 H new ATOM 0 HB3 TYR E 26 11.828 -11.414 -7.172 1.00 0.00 H new ATOM 0 HD1 TYR E 26 11.332 -10.937 -4.607 1.00 0.00 H new ATOM 0 HD2 TYR E 26 8.466 -10.428 -7.766 1.00 0.00 H new ATOM 0 HE1 TYR E 26 9.486 -11.094 -2.958 1.00 0.00 H new ATOM 0 HE2 TYR E 26 6.619 -10.588 -6.117 1.00 0.00 H new ATOM 0 HH TYR E 26 6.048 -10.849 -3.974 1.00 0.00 H new ATOM 1488 N GLN E 27 13.487 -9.216 -8.957 1.00 0.00 N ATOM 1489 CA GLN E 27 13.987 -8.773 -10.288 1.00 0.00 C ATOM 1490 C GLN E 27 13.028 -9.262 -11.374 1.00 0.00 C ATOM 1491 O GLN E 27 12.880 -8.647 -12.411 1.00 0.00 O ATOM 1492 CB GLN E 27 15.377 -9.362 -10.535 1.00 0.00 C ATOM 1493 CG GLN E 27 16.400 -8.652 -9.647 1.00 0.00 C ATOM 1494 CD GLN E 27 17.355 -9.685 -9.044 1.00 0.00 C ATOM 1495 OE1 GLN E 27 16.965 -10.478 -8.210 1.00 0.00 O ATOM 1496 NE2 GLN E 27 18.601 -9.709 -9.433 1.00 0.00 N ATOM 0 H GLN E 27 14.085 -9.882 -8.468 1.00 0.00 H new ATOM 0 HA GLN E 27 14.046 -7.685 -10.312 1.00 0.00 H new ATOM 0 HB2 GLN E 27 15.374 -10.431 -10.320 1.00 0.00 H new ATOM 0 HB3 GLN E 27 15.650 -9.248 -11.584 1.00 0.00 H new ATOM 0 HG2 GLN E 27 16.959 -7.921 -10.231 1.00 0.00 H new ATOM 0 HG3 GLN E 27 15.891 -8.104 -8.854 1.00 0.00 H new ATOM 0 HE21 GLN E 27 18.930 -9.044 -10.133 1.00 0.00 H new ATOM 0 HE22 GLN E 27 19.246 -10.393 -9.037 1.00 0.00 H new ATOM 1505 N SER E 28 12.375 -10.368 -11.142 1.00 0.00 N ATOM 1506 CA SER E 28 11.423 -10.901 -12.156 1.00 0.00 C ATOM 1507 C SER E 28 10.109 -10.121 -12.079 1.00 0.00 C ATOM 1508 O SER E 28 9.273 -10.206 -12.958 1.00 0.00 O ATOM 1509 CB SER E 28 11.156 -12.380 -11.874 1.00 0.00 C ATOM 1510 OG SER E 28 11.271 -13.116 -13.085 1.00 0.00 O ATOM 0 H SER E 28 12.460 -10.926 -10.292 1.00 0.00 H new ATOM 0 HA SER E 28 11.852 -10.793 -13.152 1.00 0.00 H new ATOM 0 HB2 SER E 28 11.866 -12.756 -11.137 1.00 0.00 H new ATOM 0 HB3 SER E 28 10.160 -12.508 -11.450 1.00 0.00 H new ATOM 0 HG SER E 28 11.102 -14.065 -12.908 1.00 0.00 H new ATOM 1516 N ALA E 29 9.923 -9.353 -11.041 1.00 0.00 N ATOM 1517 CA ALA E 29 8.667 -8.562 -10.915 1.00 0.00 C ATOM 1518 C ALA E 29 8.814 -7.277 -11.721 1.00 0.00 C ATOM 1519 O ALA E 29 7.896 -6.833 -12.382 1.00 0.00 O ATOM 1520 CB ALA E 29 8.418 -8.222 -9.444 1.00 0.00 C ATOM 0 H ALA E 29 10.587 -9.239 -10.275 1.00 0.00 H new ATOM 0 HA ALA E 29 7.824 -9.142 -11.292 1.00 0.00 H new ATOM 0 HB1 ALA E 29 7.499 -7.643 -9.355 1.00 0.00 H new ATOM 0 HB2 ALA E 29 8.324 -9.143 -8.869 1.00 0.00 H new ATOM 0 HB3 ALA E 29 9.253 -7.637 -9.059 1.00 0.00 H new ATOM 1526 N ILE E 30 9.971 -6.683 -11.681 1.00 0.00 N ATOM 1527 CA ILE E 30 10.195 -5.433 -12.452 1.00 0.00 C ATOM 1528 C ILE E 30 10.334 -5.790 -13.936 1.00 0.00 C ATOM 1529 O ILE E 30 9.908 -5.056 -14.805 1.00 0.00 O ATOM 1530 CB ILE E 30 11.472 -4.751 -11.938 1.00 0.00 C ATOM 1531 CG1 ILE E 30 11.125 -3.893 -10.719 1.00 0.00 C ATOM 1532 CG2 ILE E 30 12.073 -3.859 -13.028 1.00 0.00 C ATOM 1533 CD1 ILE E 30 11.981 -4.326 -9.529 1.00 0.00 C ATOM 0 H ILE E 30 10.774 -7.011 -11.145 1.00 0.00 H new ATOM 0 HA ILE E 30 9.357 -4.748 -12.327 1.00 0.00 H new ATOM 0 HB ILE E 30 12.200 -5.515 -11.665 1.00 0.00 H new ATOM 0 HG12 ILE E 30 11.299 -2.840 -10.941 1.00 0.00 H new ATOM 0 HG13 ILE E 30 10.067 -3.998 -10.477 1.00 0.00 H new ATOM 0 HG21 ILE E 30 12.977 -3.382 -12.650 1.00 0.00 H new ATOM 0 HG22 ILE E 30 12.320 -4.465 -13.899 1.00 0.00 H new ATOM 0 HG23 ILE E 30 11.350 -3.094 -13.311 1.00 0.00 H new ATOM 0 HD11 ILE E 30 11.734 -3.715 -8.661 1.00 0.00 H new ATOM 0 HD12 ILE E 30 11.785 -5.374 -9.302 1.00 0.00 H new ATOM 0 HD13 ILE E 30 13.035 -4.198 -9.774 1.00 0.00 H new ATOM 1545 N ASN E 31 10.920 -6.919 -14.226 1.00 0.00 N ATOM 1546 CA ASN E 31 11.079 -7.330 -15.649 1.00 0.00 C ATOM 1547 C ASN E 31 9.723 -7.778 -16.198 1.00 0.00 C ATOM 1548 O ASN E 31 9.441 -7.643 -17.371 1.00 0.00 O ATOM 1549 CB ASN E 31 12.076 -8.488 -15.738 1.00 0.00 C ATOM 1550 CG ASN E 31 13.013 -8.264 -16.926 1.00 0.00 C ATOM 1551 OD1 ASN E 31 13.490 -7.167 -17.139 1.00 0.00 O ATOM 1552 ND2 ASN E 31 13.300 -9.265 -17.713 1.00 0.00 N ATOM 0 H ASN E 31 11.295 -7.574 -13.540 1.00 0.00 H new ATOM 0 HA ASN E 31 11.451 -6.489 -16.234 1.00 0.00 H new ATOM 0 HB2 ASN E 31 12.652 -8.558 -14.815 1.00 0.00 H new ATOM 0 HB3 ASN E 31 11.544 -9.432 -15.854 1.00 0.00 H new ATOM 0 HD21 ASN E 31 13.925 -9.126 -18.507 1.00 0.00 H new ATOM 0 HD22 ASN E 31 12.899 -10.186 -17.534 1.00 0.00 H new ATOM 1559 N LYS E 32 8.878 -8.309 -15.353 1.00 0.00 N ATOM 1560 CA LYS E 32 7.539 -8.763 -15.823 1.00 0.00 C ATOM 1561 C LYS E 32 6.646 -7.545 -16.067 1.00 0.00 C ATOM 1562 O LYS E 32 5.913 -7.485 -17.034 1.00 0.00 O ATOM 1563 CB LYS E 32 6.904 -9.664 -14.762 1.00 0.00 C ATOM 1564 CG LYS E 32 7.527 -11.059 -14.842 1.00 0.00 C ATOM 1565 CD LYS E 32 7.043 -11.902 -13.660 1.00 0.00 C ATOM 1566 CE LYS E 32 5.844 -12.746 -14.094 1.00 0.00 C ATOM 1567 NZ LYS E 32 4.595 -11.947 -13.946 1.00 0.00 N ATOM 0 H LYS E 32 9.059 -8.447 -14.359 1.00 0.00 H new ATOM 0 HA LYS E 32 7.648 -9.323 -16.752 1.00 0.00 H new ATOM 0 HB2 LYS E 32 7.059 -9.241 -13.770 1.00 0.00 H new ATOM 0 HB3 LYS E 32 5.827 -9.725 -14.918 1.00 0.00 H new ATOM 0 HG2 LYS E 32 7.252 -11.539 -15.781 1.00 0.00 H new ATOM 0 HG3 LYS E 32 8.614 -10.985 -14.829 1.00 0.00 H new ATOM 0 HD2 LYS E 32 7.847 -12.548 -13.306 1.00 0.00 H new ATOM 0 HD3 LYS E 32 6.764 -11.255 -12.828 1.00 0.00 H new ATOM 0 HE2 LYS E 32 5.965 -13.063 -15.130 1.00 0.00 H new ATOM 0 HE3 LYS E 32 5.784 -13.650 -13.488 1.00 0.00 H new ATOM 0 HZ1 LYS E 32 3.790 -12.587 -13.788 1.00 0.00 H new ATOM 0 HZ2 LYS E 32 4.689 -11.303 -13.135 1.00 0.00 H new ATOM 0 HZ3 LYS E 32 4.433 -11.393 -14.811 1.00 0.00 H new ATOM 1581 N ALA E 33 6.709 -6.572 -15.203 1.00 0.00 N ATOM 1582 CA ALA E 33 5.871 -5.355 -15.394 1.00 0.00 C ATOM 1583 C ALA E 33 6.338 -4.628 -16.654 1.00 0.00 C ATOM 1584 O ALA E 33 5.560 -4.012 -17.356 1.00 0.00 O ATOM 1585 CB ALA E 33 6.015 -4.430 -14.183 1.00 0.00 C ATOM 0 H ALA E 33 7.303 -6.566 -14.374 1.00 0.00 H new ATOM 0 HA ALA E 33 4.824 -5.641 -15.497 1.00 0.00 H new ATOM 0 HB1 ALA E 33 5.400 -3.542 -14.328 1.00 0.00 H new ATOM 0 HB2 ALA E 33 5.689 -4.954 -13.284 1.00 0.00 H new ATOM 0 HB3 ALA E 33 7.058 -4.135 -14.073 1.00 0.00 H new ATOM 1591 N ILE E 34 7.605 -4.706 -16.952 1.00 0.00 N ATOM 1592 CA ILE E 34 8.128 -4.034 -18.172 1.00 0.00 C ATOM 1593 C ILE E 34 7.896 -4.944 -19.379 1.00 0.00 C ATOM 1594 O ILE E 34 7.815 -4.494 -20.505 1.00 0.00 O ATOM 1595 CB ILE E 34 9.627 -3.775 -18.012 1.00 0.00 C ATOM 1596 CG1 ILE E 34 9.847 -2.677 -16.967 1.00 0.00 C ATOM 1597 CG2 ILE E 34 10.216 -3.330 -19.351 1.00 0.00 C ATOM 1598 CD1 ILE E 34 9.435 -1.325 -17.551 1.00 0.00 C ATOM 0 H ILE E 34 8.302 -5.208 -16.401 1.00 0.00 H new ATOM 0 HA ILE E 34 7.612 -3.085 -18.318 1.00 0.00 H new ATOM 0 HB ILE E 34 10.120 -4.691 -17.686 1.00 0.00 H new ATOM 0 HG12 ILE E 34 9.264 -2.891 -16.071 1.00 0.00 H new ATOM 0 HG13 ILE E 34 10.894 -2.651 -16.667 1.00 0.00 H new ATOM 0 HG21 ILE E 34 11.284 -3.146 -19.235 1.00 0.00 H new ATOM 0 HG22 ILE E 34 10.061 -4.112 -20.095 1.00 0.00 H new ATOM 0 HG23 ILE E 34 9.723 -2.415 -19.679 1.00 0.00 H new ATOM 0 HD11 ILE E 34 9.592 -0.544 -16.807 1.00 0.00 H new ATOM 0 HD12 ILE E 34 10.038 -1.111 -18.434 1.00 0.00 H new ATOM 0 HD13 ILE E 34 8.382 -1.355 -17.829 1.00 0.00 H new ATOM 1610 N HIS E 35 7.787 -6.224 -19.151 1.00 0.00 N ATOM 1611 CA HIS E 35 7.560 -7.171 -20.278 1.00 0.00 C ATOM 1612 C HIS E 35 6.109 -7.061 -20.752 1.00 0.00 C ATOM 1613 O HIS E 35 5.792 -7.362 -21.886 1.00 0.00 O ATOM 1614 CB HIS E 35 7.832 -8.599 -19.802 1.00 0.00 C ATOM 1615 CG HIS E 35 9.313 -8.860 -19.816 1.00 0.00 C ATOM 1616 ND1 HIS E 35 10.146 -8.352 -20.800 1.00 0.00 N ATOM 1617 CD2 HIS E 35 10.124 -9.577 -18.972 1.00 0.00 C ATOM 1618 CE1 HIS E 35 11.397 -8.766 -20.526 1.00 0.00 C ATOM 1619 NE2 HIS E 35 11.439 -9.516 -19.421 1.00 0.00 N ATOM 0 H HIS E 35 7.846 -6.656 -18.229 1.00 0.00 H new ATOM 0 HA HIS E 35 8.231 -6.926 -21.101 1.00 0.00 H new ATOM 0 HB2 HIS E 35 7.437 -8.740 -18.796 1.00 0.00 H new ATOM 0 HB3 HIS E 35 7.320 -9.312 -20.448 1.00 0.00 H new ATOM 0 HD1 HIS E 35 9.863 -7.770 -21.588 1.00 0.00 H new ATOM 0 HD2 HIS E 35 9.791 -10.108 -18.092 1.00 0.00 H new ATOM 0 HE1 HIS E 35 12.261 -8.522 -21.126 1.00 0.00 H new ATOM 1627 N ALA E 36 5.225 -6.636 -19.890 1.00 0.00 N ATOM 1628 CA ALA E 36 3.795 -6.510 -20.291 1.00 0.00 C ATOM 1629 C ALA E 36 3.572 -5.159 -20.974 1.00 0.00 C ATOM 1630 O ALA E 36 2.536 -4.911 -21.557 1.00 0.00 O ATOM 1631 CB ALA E 36 2.907 -6.605 -19.048 1.00 0.00 C ATOM 0 H ALA E 36 5.431 -6.371 -18.927 1.00 0.00 H new ATOM 0 HA ALA E 36 3.540 -7.313 -20.983 1.00 0.00 H new ATOM 0 HB1 ALA E 36 1.861 -6.513 -19.340 1.00 0.00 H new ATOM 0 HB2 ALA E 36 3.064 -7.567 -18.561 1.00 0.00 H new ATOM 0 HB3 ALA E 36 3.162 -5.802 -18.356 1.00 0.00 H new ATOM 1637 N GLY E 37 4.537 -4.283 -20.908 1.00 0.00 N ATOM 1638 CA GLY E 37 4.379 -2.950 -21.556 1.00 0.00 C ATOM 1639 C GLY E 37 3.102 -2.282 -21.045 1.00 0.00 C ATOM 1640 O GLY E 37 2.503 -1.468 -21.721 1.00 0.00 O ATOM 0 H GLY E 37 5.428 -4.432 -20.434 1.00 0.00 H new ATOM 0 HA2 GLY E 37 5.243 -2.323 -21.337 1.00 0.00 H new ATOM 0 HA3 GLY E 37 4.334 -3.063 -22.639 1.00 0.00 H new ATOM 1644 N ARG E 38 2.681 -2.617 -19.857 1.00 0.00 N ATOM 1645 CA ARG E 38 1.443 -2.000 -19.304 1.00 0.00 C ATOM 1646 C ARG E 38 1.751 -0.579 -18.829 1.00 0.00 C ATOM 1647 O ARG E 38 2.840 -0.075 -19.012 1.00 0.00 O ATOM 1648 CB ARG E 38 0.939 -2.835 -18.125 1.00 0.00 C ATOM 1649 CG ARG E 38 -0.328 -3.588 -18.538 1.00 0.00 C ATOM 1650 CD ARG E 38 -0.071 -4.345 -19.842 1.00 0.00 C ATOM 1651 NE ARG E 38 -0.779 -5.656 -19.804 1.00 0.00 N ATOM 1652 CZ ARG E 38 -2.030 -5.710 -19.437 1.00 0.00 C ATOM 1653 NH1 ARG E 38 -2.969 -5.369 -20.276 1.00 0.00 N ATOM 1654 NH2 ARG E 38 -2.341 -6.109 -18.235 1.00 0.00 N ATOM 0 H ARG E 38 3.141 -3.291 -19.245 1.00 0.00 H new ATOM 0 HA ARG E 38 0.676 -1.966 -20.078 1.00 0.00 H new ATOM 0 HB2 ARG E 38 1.708 -3.541 -17.810 1.00 0.00 H new ATOM 0 HB3 ARG E 38 0.730 -2.190 -17.272 1.00 0.00 H new ATOM 0 HG2 ARG E 38 -0.622 -4.285 -17.753 1.00 0.00 H new ATOM 0 HG3 ARG E 38 -1.153 -2.888 -18.668 1.00 0.00 H new ATOM 0 HD2 ARG E 38 -0.419 -3.756 -20.691 1.00 0.00 H new ATOM 0 HD3 ARG E 38 0.999 -4.501 -19.979 1.00 0.00 H new ATOM 0 HE ARG E 38 -0.286 -6.510 -20.065 1.00 0.00 H new ATOM 0 HH11 ARG E 38 -2.725 -5.061 -21.217 1.00 0.00 H new ATOM 0 HH12 ARG E 38 -3.947 -5.411 -19.991 1.00 0.00 H new ATOM 0 HH21 ARG E 38 -1.606 -6.379 -17.581 1.00 0.00 H new ATOM 0 HH22 ARG E 38 -3.319 -6.151 -17.949 1.00 0.00 H new ATOM 1668 N LYS E 39 0.797 0.071 -18.219 1.00 0.00 N ATOM 1669 CA LYS E 39 1.033 1.459 -17.733 1.00 0.00 C ATOM 1670 C LYS E 39 1.598 1.418 -16.316 1.00 0.00 C ATOM 1671 O LYS E 39 0.889 1.592 -15.345 1.00 0.00 O ATOM 1672 CB LYS E 39 -0.288 2.233 -17.737 1.00 0.00 C ATOM 1673 CG LYS E 39 -0.868 2.244 -19.153 1.00 0.00 C ATOM 1674 CD LYS E 39 -0.427 3.518 -19.876 1.00 0.00 C ATOM 1675 CE LYS E 39 -0.163 3.204 -21.351 1.00 0.00 C ATOM 1676 NZ LYS E 39 -0.077 4.477 -22.121 1.00 0.00 N ATOM 0 H LYS E 39 -0.135 -0.300 -18.037 1.00 0.00 H new ATOM 0 HA LYS E 39 1.747 1.956 -18.390 1.00 0.00 H new ATOM 0 HB2 LYS E 39 -0.994 1.772 -17.047 1.00 0.00 H new ATOM 0 HB3 LYS E 39 -0.125 3.254 -17.391 1.00 0.00 H new ATOM 0 HG2 LYS E 39 -0.530 1.366 -19.703 1.00 0.00 H new ATOM 0 HG3 LYS E 39 -1.956 2.195 -19.112 1.00 0.00 H new ATOM 0 HD2 LYS E 39 -1.198 4.284 -19.789 1.00 0.00 H new ATOM 0 HD3 LYS E 39 0.474 3.919 -19.412 1.00 0.00 H new ATOM 0 HE2 LYS E 39 0.764 2.641 -21.454 1.00 0.00 H new ATOM 0 HE3 LYS E 39 -0.962 2.578 -21.750 1.00 0.00 H new ATOM 0 HZ1 LYS E 39 0.102 4.265 -23.123 1.00 0.00 H new ATOM 0 HZ2 LYS E 39 -0.973 4.998 -22.032 1.00 0.00 H new ATOM 0 HZ3 LYS E 39 0.700 5.058 -21.746 1.00 0.00 H new ATOM 1690 N ILE E 40 2.876 1.201 -16.195 1.00 0.00 N ATOM 1691 CA ILE E 40 3.497 1.162 -14.844 1.00 0.00 C ATOM 1692 C ILE E 40 4.371 2.401 -14.672 1.00 0.00 C ATOM 1693 O ILE E 40 5.453 2.494 -15.217 1.00 0.00 O ATOM 1694 CB ILE E 40 4.355 -0.098 -14.703 1.00 0.00 C ATOM 1695 CG1 ILE E 40 3.516 -1.330 -15.056 1.00 0.00 C ATOM 1696 CG2 ILE E 40 4.858 -0.214 -13.262 1.00 0.00 C ATOM 1697 CD1 ILE E 40 2.534 -1.627 -13.922 1.00 0.00 C ATOM 0 H ILE E 40 3.518 1.049 -16.973 1.00 0.00 H new ATOM 0 HA ILE E 40 2.720 1.146 -14.080 1.00 0.00 H new ATOM 0 HB ILE E 40 5.207 -0.036 -15.380 1.00 0.00 H new ATOM 0 HG12 ILE E 40 2.972 -1.158 -15.985 1.00 0.00 H new ATOM 0 HG13 ILE E 40 4.166 -2.189 -15.222 1.00 0.00 H new ATOM 0 HG21 ILE E 40 5.469 -1.111 -13.161 1.00 0.00 H new ATOM 0 HG22 ILE E 40 5.456 0.663 -13.014 1.00 0.00 H new ATOM 0 HG23 ILE E 40 4.007 -0.276 -12.584 1.00 0.00 H new ATOM 0 HD11 ILE E 40 1.939 -2.504 -14.176 1.00 0.00 H new ATOM 0 HD12 ILE E 40 3.087 -1.818 -13.002 1.00 0.00 H new ATOM 0 HD13 ILE E 40 1.875 -0.771 -13.778 1.00 0.00 H new ATOM 1709 N PHE E 41 3.904 3.358 -13.926 1.00 0.00 N ATOM 1710 CA PHE E 41 4.697 4.598 -13.724 1.00 0.00 C ATOM 1711 C PHE E 41 5.428 4.517 -12.384 1.00 0.00 C ATOM 1712 O PHE E 41 5.058 3.756 -11.512 1.00 0.00 O ATOM 1713 CB PHE E 41 3.746 5.796 -13.740 1.00 0.00 C ATOM 1714 CG PHE E 41 2.775 5.642 -14.891 1.00 0.00 C ATOM 1715 CD1 PHE E 41 3.191 5.025 -16.080 1.00 0.00 C ATOM 1716 CD2 PHE E 41 1.463 6.117 -14.775 1.00 0.00 C ATOM 1717 CE1 PHE E 41 2.296 4.887 -17.147 1.00 0.00 C ATOM 1718 CE2 PHE E 41 0.569 5.979 -15.844 1.00 0.00 C ATOM 1719 CZ PHE E 41 0.986 5.363 -17.030 1.00 0.00 C ATOM 0 H PHE E 41 3.004 3.335 -13.446 1.00 0.00 H new ATOM 0 HA PHE E 41 5.434 4.712 -14.519 1.00 0.00 H new ATOM 0 HB2 PHE E 41 3.204 5.858 -12.796 1.00 0.00 H new ATOM 0 HB3 PHE E 41 4.310 6.723 -13.845 1.00 0.00 H new ATOM 0 HD1 PHE E 41 4.202 4.656 -16.172 1.00 0.00 H new ATOM 0 HD2 PHE E 41 1.140 6.591 -13.860 1.00 0.00 H new ATOM 0 HE1 PHE E 41 2.617 4.412 -18.062 1.00 0.00 H new ATOM 0 HE2 PHE E 41 -0.442 6.348 -15.754 1.00 0.00 H new ATOM 0 HZ PHE E 41 0.296 5.255 -17.854 1.00 0.00 H new ATOM 1729 N LEU E 42 6.468 5.284 -12.212 1.00 0.00 N ATOM 1730 CA LEU E 42 7.220 5.230 -10.927 1.00 0.00 C ATOM 1731 C LEU E 42 7.303 6.627 -10.313 1.00 0.00 C ATOM 1732 O LEU E 42 8.097 7.450 -10.720 1.00 0.00 O ATOM 1733 CB LEU E 42 8.630 4.699 -11.186 1.00 0.00 C ATOM 1734 CG LEU E 42 8.866 3.442 -10.349 1.00 0.00 C ATOM 1735 CD1 LEU E 42 7.784 2.408 -10.662 1.00 0.00 C ATOM 1736 CD2 LEU E 42 10.239 2.855 -10.687 1.00 0.00 C ATOM 0 H LEU E 42 6.829 5.943 -12.902 1.00 0.00 H new ATOM 0 HA LEU E 42 6.701 4.567 -10.234 1.00 0.00 H new ATOM 0 HB2 LEU E 42 8.755 4.472 -12.245 1.00 0.00 H new ATOM 0 HB3 LEU E 42 9.368 5.460 -10.934 1.00 0.00 H new ATOM 0 HG LEU E 42 8.828 3.700 -9.291 1.00 0.00 H new ATOM 0 HD11 LEU E 42 7.953 1.512 -10.065 1.00 0.00 H new ATOM 0 HD12 LEU E 42 6.805 2.823 -10.424 1.00 0.00 H new ATOM 0 HD13 LEU E 42 7.822 2.151 -11.721 1.00 0.00 H new ATOM 0 HD21 LEU E 42 10.408 1.959 -10.091 1.00 0.00 H new ATOM 0 HD22 LEU E 42 10.274 2.598 -11.746 1.00 0.00 H new ATOM 0 HD23 LEU E 42 11.013 3.590 -10.466 1.00 0.00 H new ATOM 1748 N THR E 43 6.494 6.893 -9.328 1.00 0.00 N ATOM 1749 CA THR E 43 6.523 8.230 -8.673 1.00 0.00 C ATOM 1750 C THR E 43 7.461 8.177 -7.466 1.00 0.00 C ATOM 1751 O THR E 43 7.195 7.502 -6.493 1.00 0.00 O ATOM 1752 CB THR E 43 5.112 8.602 -8.209 1.00 0.00 C ATOM 1753 OG1 THR E 43 4.308 8.903 -9.341 1.00 0.00 O ATOM 1754 CG2 THR E 43 5.178 9.822 -7.288 1.00 0.00 C ATOM 0 H THR E 43 5.810 6.239 -8.946 1.00 0.00 H new ATOM 0 HA THR E 43 6.879 8.978 -9.381 1.00 0.00 H new ATOM 0 HB THR E 43 4.676 7.764 -7.665 1.00 0.00 H new ATOM 0 HG1 THR E 43 3.404 9.140 -9.046 1.00 0.00 H new ATOM 0 HG21 THR E 43 4.172 10.085 -6.959 1.00 0.00 H new ATOM 0 HG22 THR E 43 5.794 9.589 -6.420 1.00 0.00 H new ATOM 0 HG23 THR E 43 5.614 10.662 -7.828 1.00 0.00 H new ATOM 1762 N ILE E 44 8.562 8.878 -7.523 1.00 0.00 N ATOM 1763 CA ILE E 44 9.514 8.855 -6.376 1.00 0.00 C ATOM 1764 C ILE E 44 9.338 10.120 -5.532 1.00 0.00 C ATOM 1765 O ILE E 44 9.642 11.214 -5.965 1.00 0.00 O ATOM 1766 CB ILE E 44 10.948 8.790 -6.907 1.00 0.00 C ATOM 1767 CG1 ILE E 44 10.999 7.858 -8.120 1.00 0.00 C ATOM 1768 CG2 ILE E 44 11.874 8.252 -5.815 1.00 0.00 C ATOM 1769 CD1 ILE E 44 10.892 8.684 -9.402 1.00 0.00 C ATOM 0 H ILE E 44 8.842 9.463 -8.310 1.00 0.00 H new ATOM 0 HA ILE E 44 9.313 7.980 -5.758 1.00 0.00 H new ATOM 0 HB ILE E 44 11.272 9.789 -7.199 1.00 0.00 H new ATOM 0 HG12 ILE E 44 11.930 7.290 -8.117 1.00 0.00 H new ATOM 0 HG13 ILE E 44 10.185 7.135 -8.071 1.00 0.00 H new ATOM 0 HG21 ILE E 44 12.895 8.206 -6.194 1.00 0.00 H new ATOM 0 HG22 ILE E 44 11.838 8.913 -4.949 1.00 0.00 H new ATOM 0 HG23 ILE E 44 11.550 7.253 -5.523 1.00 0.00 H new ATOM 0 HD11 ILE E 44 10.928 8.021 -10.266 1.00 0.00 H new ATOM 0 HD12 ILE E 44 9.950 9.232 -9.404 1.00 0.00 H new ATOM 0 HD13 ILE E 44 11.722 9.389 -9.451 1.00 0.00 H new ATOM 1781 N ASN E 45 8.851 9.978 -4.330 1.00 0.00 N ATOM 1782 CA ASN E 45 8.657 11.169 -3.458 1.00 0.00 C ATOM 1783 C ASN E 45 9.986 11.908 -3.296 1.00 0.00 C ATOM 1784 O ASN E 45 11.032 11.303 -3.141 1.00 0.00 O ATOM 1785 CB ASN E 45 8.149 10.723 -2.086 1.00 0.00 C ATOM 1786 CG ASN E 45 6.989 9.743 -2.264 1.00 0.00 C ATOM 1787 OD1 ASN E 45 6.388 9.679 -3.318 1.00 0.00 O ATOM 1788 ND2 ASN E 45 6.642 8.972 -1.270 1.00 0.00 N ATOM 0 H ASN E 45 8.579 9.087 -3.914 1.00 0.00 H new ATOM 0 HA ASN E 45 7.926 11.836 -3.915 1.00 0.00 H new ATOM 0 HB2 ASN E 45 8.955 10.251 -1.524 1.00 0.00 H new ATOM 0 HB3 ASN E 45 7.823 11.588 -1.509 1.00 0.00 H new ATOM 0 HD21 ASN E 45 5.868 8.317 -1.379 1.00 0.00 H new ATOM 0 HD22 ASN E 45 7.145 9.024 -0.384 1.00 0.00 H new ATOM 1795 N ALA E 46 9.946 13.213 -3.329 1.00 0.00 N ATOM 1796 CA ALA E 46 11.195 14.021 -3.180 1.00 0.00 C ATOM 1797 C ALA E 46 12.058 13.476 -2.038 1.00 0.00 C ATOM 1798 O ALA E 46 13.246 13.722 -1.981 1.00 0.00 O ATOM 1799 CB ALA E 46 10.825 15.477 -2.885 1.00 0.00 C ATOM 0 H ALA E 46 9.094 13.760 -3.454 1.00 0.00 H new ATOM 0 HA ALA E 46 11.763 13.960 -4.108 1.00 0.00 H new ATOM 0 HB1 ALA E 46 11.734 16.068 -2.776 1.00 0.00 H new ATOM 0 HB2 ALA E 46 10.230 15.875 -3.707 1.00 0.00 H new ATOM 0 HB3 ALA E 46 10.247 15.526 -1.962 1.00 0.00 H new ATOM 1805 N ASP E 47 11.480 12.742 -1.124 1.00 0.00 N ATOM 1806 CA ASP E 47 12.284 12.193 0.005 1.00 0.00 C ATOM 1807 C ASP E 47 12.984 10.898 -0.428 1.00 0.00 C ATOM 1808 O ASP E 47 13.225 10.018 0.374 1.00 0.00 O ATOM 1809 CB ASP E 47 11.358 11.897 1.187 1.00 0.00 C ATOM 1810 CG ASP E 47 12.183 11.813 2.472 1.00 0.00 C ATOM 1811 OD1 ASP E 47 12.651 12.846 2.921 1.00 0.00 O ATOM 1812 OD2 ASP E 47 12.332 10.717 2.985 1.00 0.00 O ATOM 0 H ASP E 47 10.489 12.500 -1.111 1.00 0.00 H new ATOM 0 HA ASP E 47 13.037 12.925 0.297 1.00 0.00 H new ATOM 0 HB2 ASP E 47 10.604 12.679 1.277 1.00 0.00 H new ATOM 0 HB3 ASP E 47 10.827 10.960 1.021 1.00 0.00 H new ATOM 1817 N GLY E 48 13.315 10.772 -1.686 1.00 0.00 N ATOM 1818 CA GLY E 48 13.999 9.535 -2.156 1.00 0.00 C ATOM 1819 C GLY E 48 13.080 8.335 -1.940 1.00 0.00 C ATOM 1820 O GLY E 48 13.519 7.202 -1.908 1.00 0.00 O ATOM 0 H GLY E 48 13.141 11.472 -2.407 1.00 0.00 H new ATOM 0 HA2 GLY E 48 14.255 9.626 -3.212 1.00 0.00 H new ATOM 0 HA3 GLY E 48 14.933 9.394 -1.613 1.00 0.00 H new ATOM 1824 N SER E 49 11.806 8.571 -1.792 1.00 0.00 N ATOM 1825 CA SER E 49 10.864 7.438 -1.578 1.00 0.00 C ATOM 1826 C SER E 49 10.341 6.951 -2.931 1.00 0.00 C ATOM 1827 O SER E 49 10.194 7.718 -3.861 1.00 0.00 O ATOM 1828 CB SER E 49 9.695 7.901 -0.710 1.00 0.00 C ATOM 1829 OG SER E 49 9.714 7.191 0.520 1.00 0.00 O ATOM 0 H SER E 49 11.378 9.497 -1.810 1.00 0.00 H new ATOM 0 HA SER E 49 11.383 6.622 -1.075 1.00 0.00 H new ATOM 0 HB2 SER E 49 9.766 8.973 -0.526 1.00 0.00 H new ATOM 0 HB3 SER E 49 8.752 7.729 -1.228 1.00 0.00 H new ATOM 0 HG SER E 49 8.966 7.487 1.080 1.00 0.00 H new ATOM 1835 N VAL E 50 10.059 5.682 -3.050 1.00 0.00 N ATOM 1836 CA VAL E 50 9.542 5.158 -4.345 1.00 0.00 C ATOM 1837 C VAL E 50 8.036 4.925 -4.235 1.00 0.00 C ATOM 1838 O VAL E 50 7.530 4.530 -3.203 1.00 0.00 O ATOM 1839 CB VAL E 50 10.233 3.836 -4.685 1.00 0.00 C ATOM 1840 CG1 VAL E 50 9.801 3.384 -6.081 1.00 0.00 C ATOM 1841 CG2 VAL E 50 11.750 4.026 -4.663 1.00 0.00 C ATOM 0 H VAL E 50 10.164 4.988 -2.309 1.00 0.00 H new ATOM 0 HA VAL E 50 9.746 5.885 -5.131 1.00 0.00 H new ATOM 0 HB VAL E 50 9.952 3.082 -3.949 1.00 0.00 H new ATOM 0 HG11 VAL E 50 10.292 2.442 -6.327 1.00 0.00 H new ATOM 0 HG12 VAL E 50 8.720 3.246 -6.100 1.00 0.00 H new ATOM 0 HG13 VAL E 50 10.083 4.141 -6.812 1.00 0.00 H new ATOM 0 HG21 VAL E 50 12.238 3.082 -4.906 1.00 0.00 H new ATOM 0 HG22 VAL E 50 12.033 4.780 -5.397 1.00 0.00 H new ATOM 0 HG23 VAL E 50 12.062 4.351 -3.670 1.00 0.00 H new ATOM 1851 N TYR E 51 7.315 5.165 -5.293 1.00 0.00 N ATOM 1852 CA TYR E 51 5.841 4.957 -5.260 1.00 0.00 C ATOM 1853 C TYR E 51 5.376 4.521 -6.648 1.00 0.00 C ATOM 1854 O TYR E 51 4.904 5.318 -7.430 1.00 0.00 O ATOM 1855 CB TYR E 51 5.154 6.269 -4.874 1.00 0.00 C ATOM 1856 CG TYR E 51 3.781 5.982 -4.312 1.00 0.00 C ATOM 1857 CD1 TYR E 51 2.733 5.630 -5.171 1.00 0.00 C ATOM 1858 CD2 TYR E 51 3.557 6.072 -2.933 1.00 0.00 C ATOM 1859 CE1 TYR E 51 1.460 5.368 -4.649 1.00 0.00 C ATOM 1860 CE2 TYR E 51 2.284 5.810 -2.412 1.00 0.00 C ATOM 1861 CZ TYR E 51 1.235 5.458 -3.270 1.00 0.00 C ATOM 1862 OH TYR E 51 -0.019 5.202 -2.758 1.00 0.00 O ATOM 0 H TYR E 51 7.685 5.498 -6.184 1.00 0.00 H new ATOM 0 HA TYR E 51 5.586 4.190 -4.529 1.00 0.00 H new ATOM 0 HB2 TYR E 51 5.755 6.801 -4.137 1.00 0.00 H new ATOM 0 HB3 TYR E 51 5.072 6.917 -5.746 1.00 0.00 H new ATOM 0 HD1 TYR E 51 2.906 5.561 -6.235 1.00 0.00 H new ATOM 0 HD2 TYR E 51 4.366 6.343 -2.271 1.00 0.00 H new ATOM 0 HE1 TYR E 51 0.651 5.096 -5.311 1.00 0.00 H new ATOM 0 HE2 TYR E 51 2.111 5.879 -1.348 1.00 0.00 H new ATOM 0 HH TYR E 51 -0.002 5.308 -1.784 1.00 0.00 H new ATOM 1872 N ALA E 52 5.513 3.263 -6.964 1.00 0.00 N ATOM 1873 CA ALA E 52 5.091 2.788 -8.310 1.00 0.00 C ATOM 1874 C ALA E 52 3.574 2.642 -8.346 1.00 0.00 C ATOM 1875 O ALA E 52 2.957 2.215 -7.389 1.00 0.00 O ATOM 1876 CB ALA E 52 5.728 1.428 -8.601 1.00 0.00 C ATOM 0 H ALA E 52 5.898 2.546 -6.350 1.00 0.00 H new ATOM 0 HA ALA E 52 5.412 3.511 -9.060 1.00 0.00 H new ATOM 0 HB1 ALA E 52 5.416 1.084 -9.587 1.00 0.00 H new ATOM 0 HB2 ALA E 52 6.814 1.522 -8.576 1.00 0.00 H new ATOM 0 HB3 ALA E 52 5.408 0.708 -7.848 1.00 0.00 H new ATOM 1882 N GLU E 53 2.967 2.994 -9.442 1.00 0.00 N ATOM 1883 CA GLU E 53 1.491 2.880 -9.537 1.00 0.00 C ATOM 1884 C GLU E 53 1.097 2.383 -10.923 1.00 0.00 C ATOM 1885 O GLU E 53 1.854 2.462 -11.871 1.00 0.00 O ATOM 1886 CB GLU E 53 0.856 4.249 -9.289 1.00 0.00 C ATOM 1887 CG GLU E 53 0.174 4.254 -7.919 1.00 0.00 C ATOM 1888 CD GLU E 53 -1.311 4.579 -8.090 1.00 0.00 C ATOM 1889 OE1 GLU E 53 -1.639 5.752 -8.137 1.00 0.00 O ATOM 1890 OE2 GLU E 53 -2.096 3.647 -8.170 1.00 0.00 O ATOM 0 H GLU E 53 3.431 3.356 -10.275 1.00 0.00 H new ATOM 0 HA GLU E 53 1.139 2.171 -8.788 1.00 0.00 H new ATOM 0 HB2 GLU E 53 1.617 5.028 -9.331 1.00 0.00 H new ATOM 0 HB3 GLU E 53 0.129 4.471 -10.070 1.00 0.00 H new ATOM 0 HG2 GLU E 53 0.292 3.283 -7.439 1.00 0.00 H new ATOM 0 HG3 GLU E 53 0.646 4.990 -7.269 1.00 0.00 H new ATOM 1897 N GLU E 54 -0.098 1.892 -11.041 1.00 0.00 N ATOM 1898 CA GLU E 54 -0.592 1.404 -12.351 1.00 0.00 C ATOM 1899 C GLU E 54 -1.705 2.346 -12.783 1.00 0.00 C ATOM 1900 O GLU E 54 -2.387 2.915 -11.954 1.00 0.00 O ATOM 1901 CB GLU E 54 -1.139 -0.017 -12.204 1.00 0.00 C ATOM 1902 CG GLU E 54 -1.634 -0.518 -13.562 1.00 0.00 C ATOM 1903 CD GLU E 54 -2.747 -1.548 -13.353 1.00 0.00 C ATOM 1904 OE1 GLU E 54 -3.288 -1.593 -12.260 1.00 0.00 O ATOM 1905 OE2 GLU E 54 -3.037 -2.274 -14.289 1.00 0.00 O ATOM 0 H GLU E 54 -0.764 1.807 -10.273 1.00 0.00 H new ATOM 0 HA GLU E 54 0.210 1.383 -13.089 1.00 0.00 H new ATOM 0 HB2 GLU E 54 -0.362 -0.679 -11.822 1.00 0.00 H new ATOM 0 HB3 GLU E 54 -1.954 -0.031 -11.480 1.00 0.00 H new ATOM 0 HG2 GLU E 54 -2.004 0.317 -14.156 1.00 0.00 H new ATOM 0 HG3 GLU E 54 -0.810 -0.965 -14.119 1.00 0.00 H new ATOM 1912 N VAL E 55 -1.896 2.541 -14.053 1.00 0.00 N ATOM 1913 CA VAL E 55 -2.965 3.479 -14.481 1.00 0.00 C ATOM 1914 C VAL E 55 -3.451 3.106 -15.877 1.00 0.00 C ATOM 1915 O VAL E 55 -2.717 3.174 -16.844 1.00 0.00 O ATOM 1916 CB VAL E 55 -2.430 4.920 -14.480 1.00 0.00 C ATOM 1917 CG1 VAL E 55 -3.408 5.816 -13.720 1.00 0.00 C ATOM 1918 CG2 VAL E 55 -1.062 4.982 -13.791 1.00 0.00 C ATOM 0 H VAL E 55 -1.367 2.099 -14.805 1.00 0.00 H new ATOM 0 HA VAL E 55 -3.799 3.411 -13.783 1.00 0.00 H new ATOM 0 HB VAL E 55 -2.326 5.259 -15.511 1.00 0.00 H new ATOM 0 HG11 VAL E 55 -3.035 6.840 -13.715 1.00 0.00 H new ATOM 0 HG12 VAL E 55 -4.382 5.787 -14.208 1.00 0.00 H new ATOM 0 HG13 VAL E 55 -3.505 5.461 -12.694 1.00 0.00 H new ATOM 0 HG21 VAL E 55 -0.697 6.009 -13.799 1.00 0.00 H new ATOM 0 HG22 VAL E 55 -1.157 4.638 -12.761 1.00 0.00 H new ATOM 0 HG23 VAL E 55 -0.357 4.343 -14.323 1.00 0.00 H new ATOM 1928 N LYS E 56 -4.687 2.710 -15.986 1.00 0.00 N ATOM 1929 CA LYS E 56 -5.231 2.328 -17.313 1.00 0.00 C ATOM 1930 C LYS E 56 -6.741 2.626 -17.339 1.00 0.00 C ATOM 1931 O LYS E 56 -7.447 2.300 -16.407 1.00 0.00 O ATOM 1932 CB LYS E 56 -4.974 0.834 -17.532 1.00 0.00 C ATOM 1933 CG LYS E 56 -5.939 0.280 -18.583 1.00 0.00 C ATOM 1934 CD LYS E 56 -7.270 -0.071 -17.916 1.00 0.00 C ATOM 1935 CE LYS E 56 -7.682 -1.490 -18.310 1.00 0.00 C ATOM 1936 NZ LYS E 56 -9.107 -1.715 -17.938 1.00 0.00 N ATOM 0 H LYS E 56 -5.344 2.635 -15.210 1.00 0.00 H new ATOM 0 HA LYS E 56 -4.747 2.896 -18.108 1.00 0.00 H new ATOM 0 HB2 LYS E 56 -3.945 0.678 -17.855 1.00 0.00 H new ATOM 0 HB3 LYS E 56 -5.099 0.295 -16.593 1.00 0.00 H new ATOM 0 HG2 LYS E 56 -6.098 1.016 -19.371 1.00 0.00 H new ATOM 0 HG3 LYS E 56 -5.512 -0.605 -19.055 1.00 0.00 H new ATOM 0 HD2 LYS E 56 -7.176 0.004 -16.833 1.00 0.00 H new ATOM 0 HD3 LYS E 56 -8.039 0.639 -18.219 1.00 0.00 H new ATOM 0 HE2 LYS E 56 -7.548 -1.635 -19.382 1.00 0.00 H new ATOM 0 HE3 LYS E 56 -7.045 -2.218 -17.808 1.00 0.00 H new ATOM 0 HZ1 LYS E 56 -9.261 -2.726 -17.751 1.00 0.00 H new ATOM 0 HZ2 LYS E 56 -9.334 -1.166 -17.084 1.00 0.00 H new ATOM 0 HZ3 LYS E 56 -9.722 -1.410 -18.719 1.00 0.00 H new ATOM 1950 N PRO E 57 -7.184 3.251 -18.404 1.00 0.00 N ATOM 1951 CA PRO E 57 -8.601 3.629 -18.575 1.00 0.00 C ATOM 1952 C PRO E 57 -9.447 2.424 -18.995 1.00 0.00 C ATOM 1953 O PRO E 57 -9.024 1.599 -19.780 1.00 0.00 O ATOM 1954 CB PRO E 57 -8.561 4.669 -19.695 1.00 0.00 C ATOM 1955 CG PRO E 57 -7.252 4.414 -20.478 1.00 0.00 C ATOM 1956 CD PRO E 57 -6.318 3.638 -19.535 1.00 0.00 C ATOM 0 HA PRO E 57 -9.049 4.004 -17.655 1.00 0.00 H new ATOM 0 HB2 PRO E 57 -9.429 4.572 -20.347 1.00 0.00 H new ATOM 0 HB3 PRO E 57 -8.580 5.680 -19.288 1.00 0.00 H new ATOM 0 HG2 PRO E 57 -7.449 3.842 -21.385 1.00 0.00 H new ATOM 0 HG3 PRO E 57 -6.796 5.355 -20.787 1.00 0.00 H new ATOM 0 HD2 PRO E 57 -5.892 2.764 -20.027 1.00 0.00 H new ATOM 0 HD3 PRO E 57 -5.483 4.256 -19.204 1.00 0.00 H new ATOM 1964 N PHE E 58 -10.644 2.328 -18.487 1.00 0.00 N ATOM 1965 CA PHE E 58 -11.527 1.189 -18.860 1.00 0.00 C ATOM 1966 C PHE E 58 -12.440 1.615 -20.013 1.00 0.00 C ATOM 1967 O PHE E 58 -12.960 2.714 -20.009 1.00 0.00 O ATOM 1968 CB PHE E 58 -12.389 0.800 -17.659 1.00 0.00 C ATOM 1969 CG PHE E 58 -13.138 -0.479 -17.949 1.00 0.00 C ATOM 1970 CD1 PHE E 58 -14.236 -0.468 -18.820 1.00 0.00 C ATOM 1971 CD2 PHE E 58 -12.741 -1.676 -17.342 1.00 0.00 C ATOM 1972 CE1 PHE E 58 -14.934 -1.653 -19.081 1.00 0.00 C ATOM 1973 CE2 PHE E 58 -13.437 -2.861 -17.604 1.00 0.00 C ATOM 1974 CZ PHE E 58 -14.534 -2.850 -18.474 1.00 0.00 C ATOM 0 H PHE E 58 -11.050 2.992 -17.827 1.00 0.00 H new ATOM 0 HA PHE E 58 -10.916 0.339 -19.165 1.00 0.00 H new ATOM 0 HB2 PHE E 58 -11.761 0.671 -16.778 1.00 0.00 H new ATOM 0 HB3 PHE E 58 -13.094 1.600 -17.433 1.00 0.00 H new ATOM 0 HD1 PHE E 58 -14.544 0.455 -19.290 1.00 0.00 H new ATOM 0 HD2 PHE E 58 -11.896 -1.685 -16.670 1.00 0.00 H new ATOM 0 HE1 PHE E 58 -15.781 -1.644 -19.751 1.00 0.00 H new ATOM 0 HE2 PHE E 58 -13.128 -3.784 -17.135 1.00 0.00 H new ATOM 0 HZ PHE E 58 -15.072 -3.764 -18.677 1.00 0.00 H new ATOM 1984 N PRO E 59 -12.622 0.730 -20.956 1.00 0.00 N ATOM 1985 CA PRO E 59 -11.990 -0.601 -20.956 1.00 0.00 C ATOM 1986 C PRO E 59 -10.557 -0.510 -21.489 1.00 0.00 C ATOM 1987 O PRO E 59 -10.000 0.562 -21.620 1.00 0.00 O ATOM 1988 CB PRO E 59 -12.868 -1.411 -21.910 1.00 0.00 C ATOM 1989 CG PRO E 59 -13.579 -0.383 -22.823 1.00 0.00 C ATOM 1990 CD PRO E 59 -13.498 0.979 -22.112 1.00 0.00 C ATOM 0 HA PRO E 59 -11.921 -1.044 -19.962 1.00 0.00 H new ATOM 0 HB2 PRO E 59 -12.267 -2.104 -22.499 1.00 0.00 H new ATOM 0 HB3 PRO E 59 -13.594 -2.009 -21.358 1.00 0.00 H new ATOM 0 HG2 PRO E 59 -13.098 -0.337 -23.800 1.00 0.00 H new ATOM 0 HG3 PRO E 59 -14.617 -0.669 -22.991 1.00 0.00 H new ATOM 0 HD2 PRO E 59 -13.085 1.746 -22.767 1.00 0.00 H new ATOM 0 HD3 PRO E 59 -14.483 1.324 -21.798 1.00 0.00 H new