USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=26 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 16 GLN : amide:sc= 0.0197 X(o=-1,f=-1.3) USER MOD Set 1.2: E 31 ASN : amide:sc= -0.575 X(o=-1,f=-1.3) USER MOD Set 1.3: E 35 HIS :FLIP no HD1:sc= -0.449 F(o=-2.4,f=-1) USER MOD Set 2.1: D 31 ASN :FLIP amide:sc= -0.641 F(o=-2.8,f=-2) USER MOD Set 2.2: D 35 HIS :FLIP no HE2:sc= -1.38! C(o=-6.7!,f=-2!) USER MOD Single : D 3 GLN : amide:sc= 0 X(o=0,f=-0.074) USER MOD Single : D 6 THR OG1 : rot 180:sc= 0 USER MOD Single : D 8 LYS NZ :NH3+ -119:sc= -0.497 (180deg=-2.2!) USER MOD Single : D 10 TYR OH : rot 148:sc= 0.024 USER MOD Single : D 12 MET CE :methyl 170:sc= -0.0901 (180deg=-0.434) USER MOD Single : D 16 GLN : amide:sc= -0.336 K(o=-0.34,f=-3.7!) USER MOD Single : D 17 THR OG1 : rot 180:sc= 0.0436 USER MOD Single : D 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 19 THR OG1 : rot -44:sc= 1.26 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= -2.23! C(o=-2.2!,f=-2.1!) USER MOD Single : D 28 SER OG : rot 180:sc= 0 USER MOD Single : D 32 LYS NZ :NH3+ 146:sc= -0.182 (180deg=-1.05) USER MOD Single : D 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 43 THR OG1 : rot 160:sc= -0.355 USER MOD Single : D 45 ASN : amide:sc= -3.65! C(o=-3.6!,f=-9.5!) USER MOD Single : D 49 SER OG : rot 173:sc= -2.02! USER MOD Single : D 51 TYR OH : rot -163:sc= 1.2 USER MOD Single : D 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 3 GLN : amide:sc= -0.274 X(o=-0.27,f=-0.084) USER MOD Single : E 6 THR OG1 : rot 180:sc= 0 USER MOD Single : E 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 10 TYR OH : rot 180:sc= 0 USER MOD Single : E 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : E 17 THR OG1 : rot 180:sc= 0 USER MOD Single : E 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 19 THR OG1 : rot -78:sc= 0.326 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= -1.3 X(o=-1.3,f=-1.3) USER MOD Single : E 28 SER OG : rot 180:sc= 0 USER MOD Single : E 32 LYS NZ :NH3+ 151:sc= -0.303 (180deg=-2!) USER MOD Single : E 39 LYS NZ :NH3+ 149:sc= -0.0167 (180deg=-0.487) USER MOD Single : E 43 THR OG1 : rot 180:sc= 0 USER MOD Single : E 45 ASN : amide:sc= -0.375 K(o=-0.37,f=-2.5!) 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+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU D 2 -22.408 17.096 -10.953 1.00 0.00 N ATOM 21 CA GLU D 2 -21.918 15.882 -11.665 1.00 0.00 C ATOM 22 C GLU D 2 -21.978 14.677 -10.723 1.00 0.00 C ATOM 23 O GLU D 2 -21.643 14.769 -9.558 1.00 0.00 O ATOM 24 CB GLU D 2 -20.475 16.108 -12.120 1.00 0.00 C ATOM 25 CG GLU D 2 -20.387 17.421 -12.901 1.00 0.00 C ATOM 26 CD GLU D 2 -19.657 17.181 -14.224 1.00 0.00 C ATOM 27 OE1 GLU D 2 -18.960 16.184 -14.321 1.00 0.00 O ATOM 28 OE2 GLU D 2 -19.809 17.997 -15.118 1.00 0.00 O ATOM 0 HA GLU D 2 -22.547 15.691 -12.535 1.00 0.00 H new ATOM 0 HB2 GLU D 2 -19.811 16.141 -11.256 1.00 0.00 H new ATOM 0 HB3 GLU D 2 -20.145 15.278 -12.745 1.00 0.00 H new ATOM 0 HG2 GLU D 2 -21.387 17.811 -13.091 1.00 0.00 H new ATOM 0 HG3 GLU D 2 -19.859 18.171 -12.313 1.00 0.00 H new ATOM 35 N GLN D 3 -22.405 13.549 -11.218 1.00 0.00 N ATOM 36 CA GLN D 3 -22.490 12.338 -10.353 1.00 0.00 C ATOM 37 C GLN D 3 -21.121 11.661 -10.278 1.00 0.00 C ATOM 38 O GLN D 3 -20.588 11.204 -11.269 1.00 0.00 O ATOM 39 CB GLN D 3 -23.504 11.357 -10.946 1.00 0.00 C ATOM 40 CG GLN D 3 -24.917 11.766 -10.529 1.00 0.00 C ATOM 41 CD GLN D 3 -25.818 11.815 -11.765 1.00 0.00 C ATOM 42 OE1 GLN D 3 -25.835 10.892 -12.555 1.00 0.00 O ATOM 43 NE2 GLN D 3 -26.572 12.861 -11.969 1.00 0.00 N ATOM 0 H GLN D 3 -22.699 13.413 -12.185 1.00 0.00 H new ATOM 0 HA GLN D 3 -22.806 12.634 -9.352 1.00 0.00 H new ATOM 0 HB2 GLN D 3 -23.423 11.347 -12.033 1.00 0.00 H new ATOM 0 HB3 GLN D 3 -23.291 10.345 -10.601 1.00 0.00 H new ATOM 0 HG2 GLN D 3 -25.314 11.055 -9.804 1.00 0.00 H new ATOM 0 HG3 GLN D 3 -24.896 12.741 -10.042 1.00 0.00 H new ATOM 0 HE21 GLN D 3 -26.559 13.636 -11.306 1.00 0.00 H new ATOM 0 HE22 GLN D 3 -27.175 12.903 -12.791 1.00 0.00 H new ATOM 52 N ARG D 4 -20.549 11.584 -9.107 1.00 0.00 N ATOM 53 CA ARG D 4 -19.220 10.929 -8.968 1.00 0.00 C ATOM 54 C ARG D 4 -19.402 9.569 -8.289 1.00 0.00 C ATOM 55 O ARG D 4 -19.832 9.484 -7.156 1.00 0.00 O ATOM 56 CB ARG D 4 -18.301 11.808 -8.117 1.00 0.00 C ATOM 57 CG ARG D 4 -17.600 12.832 -9.013 1.00 0.00 C ATOM 58 CD ARG D 4 -16.546 12.126 -9.867 1.00 0.00 C ATOM 59 NE ARG D 4 -15.189 12.597 -9.473 1.00 0.00 N ATOM 60 CZ ARG D 4 -14.128 12.062 -10.016 1.00 0.00 C ATOM 61 NH1 ARG D 4 -13.794 10.834 -9.725 1.00 0.00 N ATOM 62 NH2 ARG D 4 -13.401 12.756 -10.849 1.00 0.00 N ATOM 0 H ARG D 4 -20.946 11.947 -8.241 1.00 0.00 H new ATOM 0 HA ARG D 4 -18.773 10.792 -9.953 1.00 0.00 H new ATOM 0 HB2 ARG D 4 -18.879 12.318 -7.347 1.00 0.00 H new ATOM 0 HB3 ARG D 4 -17.562 11.191 -7.605 1.00 0.00 H new ATOM 0 HG2 ARG D 4 -18.328 13.330 -9.653 1.00 0.00 H new ATOM 0 HG3 ARG D 4 -17.131 13.604 -8.403 1.00 0.00 H new ATOM 0 HD2 ARG D 4 -16.620 11.046 -9.736 1.00 0.00 H new ATOM 0 HD3 ARG D 4 -16.721 12.331 -10.923 1.00 0.00 H new ATOM 0 HE ARG D 4 -15.088 13.338 -8.779 1.00 0.00 H new ATOM 0 HH11 ARG D 4 -14.361 10.292 -9.074 1.00 0.00 H new ATOM 0 HH12 ARG D 4 -12.966 10.417 -10.149 1.00 0.00 H new ATOM 0 HH21 ARG D 4 -13.661 13.716 -11.076 1.00 0.00 H new ATOM 0 HH22 ARG D 4 -12.573 12.338 -11.273 1.00 0.00 H new ATOM 76 N ILE D 5 -19.085 8.503 -8.972 1.00 0.00 N ATOM 77 CA ILE D 5 -19.246 7.153 -8.366 1.00 0.00 C ATOM 78 C ILE D 5 -18.127 6.239 -8.868 1.00 0.00 C ATOM 79 O ILE D 5 -17.674 6.358 -9.988 1.00 0.00 O ATOM 80 CB ILE D 5 -20.600 6.571 -8.770 1.00 0.00 C ATOM 81 CG1 ILE D 5 -21.698 7.609 -8.523 1.00 0.00 C ATOM 82 CG2 ILE D 5 -20.889 5.319 -7.941 1.00 0.00 C ATOM 83 CD1 ILE D 5 -21.765 8.574 -9.709 1.00 0.00 C ATOM 0 H ILE D 5 -18.721 8.510 -9.925 1.00 0.00 H new ATOM 0 HA ILE D 5 -19.196 7.231 -7.280 1.00 0.00 H new ATOM 0 HB ILE D 5 -20.578 6.309 -9.828 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -22.659 7.112 -8.390 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -21.493 8.159 -7.604 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -21.855 4.906 -8.231 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -20.110 4.578 -8.118 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -20.909 5.580 -6.883 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -22.547 9.313 -9.533 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -20.806 9.080 -9.821 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -21.990 8.017 -10.619 1.00 0.00 H new ATOM 95 N THR D 6 -17.675 5.328 -8.050 1.00 0.00 N ATOM 96 CA THR D 6 -16.585 4.412 -8.487 1.00 0.00 C ATOM 97 C THR D 6 -17.152 3.359 -9.442 1.00 0.00 C ATOM 98 O THR D 6 -18.333 3.076 -9.442 1.00 0.00 O ATOM 99 CB THR D 6 -15.981 3.719 -7.264 1.00 0.00 C ATOM 100 OG1 THR D 6 -15.849 4.657 -6.205 1.00 0.00 O ATOM 101 CG2 THR D 6 -14.605 3.155 -7.623 1.00 0.00 C ATOM 0 H THR D 6 -18.013 5.179 -7.099 1.00 0.00 H new ATOM 0 HA THR D 6 -15.813 4.986 -8.999 1.00 0.00 H new ATOM 0 HB THR D 6 -16.634 2.905 -6.948 1.00 0.00 H new ATOM 0 HG1 THR D 6 -15.464 4.213 -5.421 1.00 0.00 H new ATOM 0 HG21 THR D 6 -14.175 2.661 -6.751 1.00 0.00 H new ATOM 0 HG22 THR D 6 -14.708 2.434 -8.434 1.00 0.00 H new ATOM 0 HG23 THR D 6 -13.950 3.967 -7.940 1.00 0.00 H new ATOM 109 N LEU D 7 -16.314 2.778 -10.257 1.00 0.00 N ATOM 110 CA LEU D 7 -16.793 1.742 -11.215 1.00 0.00 C ATOM 111 C LEU D 7 -17.390 0.565 -10.440 1.00 0.00 C ATOM 112 O LEU D 7 -18.085 -0.265 -10.992 1.00 0.00 O ATOM 113 CB LEU D 7 -15.612 1.256 -12.060 1.00 0.00 C ATOM 114 CG LEU D 7 -16.086 0.188 -13.048 1.00 0.00 C ATOM 115 CD1 LEU D 7 -16.903 0.846 -14.161 1.00 0.00 C ATOM 116 CD2 LEU D 7 -14.871 -0.516 -13.656 1.00 0.00 C ATOM 0 H LEU D 7 -15.315 2.977 -10.300 1.00 0.00 H new ATOM 0 HA LEU D 7 -17.557 2.168 -11.865 1.00 0.00 H new ATOM 0 HB2 LEU D 7 -15.170 2.094 -12.600 1.00 0.00 H new ATOM 0 HB3 LEU D 7 -14.835 0.848 -11.414 1.00 0.00 H new ATOM 0 HG LEU D 7 -16.707 -0.540 -12.526 1.00 0.00 H new ATOM 0 HD11 LEU D 7 -17.240 0.084 -14.864 1.00 0.00 H new ATOM 0 HD12 LEU D 7 -17.768 1.349 -13.729 1.00 0.00 H new ATOM 0 HD13 LEU D 7 -16.284 1.575 -14.685 1.00 0.00 H new ATOM 0 HD21 LEU D 7 -15.206 -1.277 -14.360 1.00 0.00 H new ATOM 0 HD22 LEU D 7 -14.251 0.213 -14.178 1.00 0.00 H new ATOM 0 HD23 LEU D 7 -14.289 -0.986 -12.864 1.00 0.00 H new ATOM 128 N LYS D 8 -17.123 0.484 -9.166 1.00 0.00 N ATOM 129 CA LYS D 8 -17.673 -0.642 -8.361 1.00 0.00 C ATOM 130 C LYS D 8 -19.044 -0.255 -7.801 1.00 0.00 C ATOM 131 O LYS D 8 -19.894 -1.095 -7.583 1.00 0.00 O ATOM 132 CB LYS D 8 -16.720 -0.956 -7.207 1.00 0.00 C ATOM 133 CG LYS D 8 -16.806 0.153 -6.155 1.00 0.00 C ATOM 134 CD LYS D 8 -15.904 -0.196 -4.970 1.00 0.00 C ATOM 135 CE LYS D 8 -14.442 0.039 -5.354 1.00 0.00 C ATOM 136 NZ LYS D 8 -13.859 -1.225 -5.886 1.00 0.00 N ATOM 0 H LYS D 8 -16.548 1.148 -8.648 1.00 0.00 H new ATOM 0 HA LYS D 8 -17.779 -1.522 -8.996 1.00 0.00 H new ATOM 0 HB2 LYS D 8 -16.978 -1.916 -6.760 1.00 0.00 H new ATOM 0 HB3 LYS D 8 -15.699 -1.041 -7.578 1.00 0.00 H new ATOM 0 HG2 LYS D 8 -16.501 1.105 -6.589 1.00 0.00 H new ATOM 0 HG3 LYS D 8 -17.836 0.271 -5.819 1.00 0.00 H new ATOM 0 HD2 LYS D 8 -16.167 0.415 -4.107 1.00 0.00 H new ATOM 0 HD3 LYS D 8 -16.052 -1.236 -4.681 1.00 0.00 H new ATOM 0 HE2 LYS D 8 -14.374 0.827 -6.104 1.00 0.00 H new ATOM 0 HE3 LYS D 8 -13.876 0.376 -4.485 1.00 0.00 H new ATOM 0 HZ1 LYS D 8 -13.064 -1.521 -5.285 1.00 0.00 H new ATOM 0 HZ2 LYS D 8 -14.586 -1.969 -5.889 1.00 0.00 H new ATOM 0 HZ3 LYS D 8 -13.520 -1.069 -6.857 1.00 0.00 H new ATOM 150 N ASP D 9 -19.265 1.008 -7.563 1.00 0.00 N ATOM 151 CA ASP D 9 -20.579 1.444 -7.013 1.00 0.00 C ATOM 152 C ASP D 9 -21.593 1.581 -8.149 1.00 0.00 C ATOM 153 O ASP D 9 -22.779 1.404 -7.958 1.00 0.00 O ATOM 154 CB ASP D 9 -20.417 2.795 -6.312 1.00 0.00 C ATOM 155 CG ASP D 9 -20.109 2.567 -4.832 1.00 0.00 C ATOM 156 OD1 ASP D 9 -18.949 2.364 -4.514 1.00 0.00 O ATOM 157 OD2 ASP D 9 -21.038 2.599 -4.042 1.00 0.00 O ATOM 0 H ASP D 9 -18.592 1.757 -7.726 1.00 0.00 H new ATOM 0 HA ASP D 9 -20.934 0.702 -6.298 1.00 0.00 H new ATOM 0 HB2 ASP D 9 -19.613 3.365 -6.778 1.00 0.00 H new ATOM 0 HB3 ASP D 9 -21.328 3.384 -6.418 1.00 0.00 H new ATOM 162 N TYR D 10 -21.138 1.894 -9.329 1.00 0.00 N ATOM 163 CA TYR D 10 -22.080 2.041 -10.473 1.00 0.00 C ATOM 164 C TYR D 10 -22.397 0.662 -11.050 1.00 0.00 C ATOM 165 O TYR D 10 -23.489 0.406 -11.513 1.00 0.00 O ATOM 166 CB TYR D 10 -21.438 2.913 -11.554 1.00 0.00 C ATOM 167 CG TYR D 10 -22.452 3.202 -12.637 1.00 0.00 C ATOM 168 CD1 TYR D 10 -23.759 3.566 -12.291 1.00 0.00 C ATOM 169 CD2 TYR D 10 -22.085 3.104 -13.984 1.00 0.00 C ATOM 170 CE1 TYR D 10 -24.698 3.834 -13.295 1.00 0.00 C ATOM 171 CE2 TYR D 10 -23.024 3.373 -14.986 1.00 0.00 C ATOM 172 CZ TYR D 10 -24.332 3.737 -14.642 1.00 0.00 C ATOM 173 OH TYR D 10 -25.258 4.001 -15.630 1.00 0.00 O ATOM 0 H TYR D 10 -20.155 2.054 -9.551 1.00 0.00 H new ATOM 0 HA TYR D 10 -23.001 2.511 -10.129 1.00 0.00 H new ATOM 0 HB2 TYR D 10 -21.080 3.846 -11.118 1.00 0.00 H new ATOM 0 HB3 TYR D 10 -20.572 2.406 -11.978 1.00 0.00 H new ATOM 0 HD1 TYR D 10 -24.043 3.640 -11.252 1.00 0.00 H new ATOM 0 HD2 TYR D 10 -21.077 2.821 -14.250 1.00 0.00 H new ATOM 0 HE1 TYR D 10 -25.706 4.116 -13.029 1.00 0.00 H new ATOM 0 HE2 TYR D 10 -22.740 3.300 -16.025 1.00 0.00 H new ATOM 0 HH TYR D 10 -24.805 4.387 -16.409 1.00 0.00 H new ATOM 183 N ALA D 11 -21.445 -0.227 -11.027 1.00 0.00 N ATOM 184 CA ALA D 11 -21.684 -1.590 -11.579 1.00 0.00 C ATOM 185 C ALA D 11 -22.391 -2.459 -10.535 1.00 0.00 C ATOM 186 O ALA D 11 -23.091 -3.395 -10.868 1.00 0.00 O ATOM 187 CB ALA D 11 -20.343 -2.228 -11.947 1.00 0.00 C ATOM 0 H ALA D 11 -20.511 -0.069 -10.650 1.00 0.00 H new ATOM 0 HA ALA D 11 -22.313 -1.514 -12.466 1.00 0.00 H new ATOM 0 HB1 ALA D 11 -20.514 -3.226 -12.351 1.00 0.00 H new ATOM 0 HB2 ALA D 11 -19.841 -1.614 -12.695 1.00 0.00 H new ATOM 0 HB3 ALA D 11 -19.718 -2.299 -11.057 1.00 0.00 H new ATOM 193 N MET D 12 -22.211 -2.167 -9.275 1.00 0.00 N ATOM 194 CA MET D 12 -22.872 -2.990 -8.221 1.00 0.00 C ATOM 195 C MET D 12 -24.241 -2.403 -7.874 1.00 0.00 C ATOM 196 O MET D 12 -25.205 -3.120 -7.690 1.00 0.00 O ATOM 197 CB MET D 12 -21.993 -3.018 -6.971 1.00 0.00 C ATOM 198 CG MET D 12 -20.847 -4.009 -7.179 1.00 0.00 C ATOM 199 SD MET D 12 -21.139 -5.488 -6.177 1.00 0.00 S ATOM 200 CE MET D 12 -21.967 -6.467 -7.455 1.00 0.00 C ATOM 0 H MET D 12 -21.637 -1.397 -8.931 1.00 0.00 H new ATOM 0 HA MET D 12 -23.008 -4.005 -8.595 1.00 0.00 H new ATOM 0 HB2 MET D 12 -21.596 -2.023 -6.770 1.00 0.00 H new ATOM 0 HB3 MET D 12 -22.585 -3.307 -6.103 1.00 0.00 H new ATOM 0 HG2 MET D 12 -20.772 -4.279 -8.232 1.00 0.00 H new ATOM 0 HG3 MET D 12 -19.899 -3.549 -6.900 1.00 0.00 H new ATOM 0 HE1 MET D 12 -22.082 -7.494 -7.109 1.00 0.00 H new ATOM 0 HE2 MET D 12 -22.949 -6.041 -7.660 1.00 0.00 H new ATOM 0 HE3 MET D 12 -21.369 -6.456 -8.366 1.00 0.00 H new ATOM 210 N ARG D 13 -24.334 -1.107 -7.775 1.00 0.00 N ATOM 211 CA ARG D 13 -25.643 -0.481 -7.430 1.00 0.00 C ATOM 212 C ARG D 13 -26.533 -0.415 -8.673 1.00 0.00 C ATOM 213 O ARG D 13 -27.744 -0.410 -8.578 1.00 0.00 O ATOM 214 CB ARG D 13 -25.409 0.934 -6.895 1.00 0.00 C ATOM 215 CG ARG D 13 -24.631 0.863 -5.578 1.00 0.00 C ATOM 216 CD ARG D 13 -25.300 1.766 -4.539 1.00 0.00 C ATOM 217 NE ARG D 13 -25.448 1.023 -3.255 1.00 0.00 N ATOM 218 CZ ARG D 13 -24.700 1.332 -2.232 1.00 0.00 C ATOM 219 NH1 ARG D 13 -23.497 1.801 -2.420 1.00 0.00 N ATOM 220 NH2 ARG D 13 -25.156 1.172 -1.019 1.00 0.00 N ATOM 0 H ARG D 13 -23.563 -0.454 -7.917 1.00 0.00 H new ATOM 0 HA ARG D 13 -26.136 -1.083 -6.667 1.00 0.00 H new ATOM 0 HB2 ARG D 13 -24.854 1.523 -7.626 1.00 0.00 H new ATOM 0 HB3 ARG D 13 -26.363 1.437 -6.739 1.00 0.00 H new ATOM 0 HG2 ARG D 13 -24.601 -0.165 -5.216 1.00 0.00 H new ATOM 0 HG3 ARG D 13 -23.599 1.176 -5.736 1.00 0.00 H new ATOM 0 HD2 ARG D 13 -24.703 2.665 -4.384 1.00 0.00 H new ATOM 0 HD3 ARG D 13 -26.277 2.090 -4.898 1.00 0.00 H new ATOM 0 HE ARG D 13 -26.134 0.273 -3.176 1.00 0.00 H new ATOM 0 HH11 ARG D 13 -23.141 1.926 -3.368 1.00 0.00 H new ATOM 0 HH12 ARG D 13 -22.913 2.042 -1.619 1.00 0.00 H new ATOM 0 HH21 ARG D 13 -26.096 0.806 -0.872 1.00 0.00 H new ATOM 0 HH22 ARG D 13 -24.572 1.413 -0.219 1.00 0.00 H new ATOM 234 N PHE D 14 -25.947 -0.361 -9.839 1.00 0.00 N ATOM 235 CA PHE D 14 -26.772 -0.292 -11.080 1.00 0.00 C ATOM 236 C PHE D 14 -26.546 -1.551 -11.919 1.00 0.00 C ATOM 237 O PHE D 14 -27.292 -1.838 -12.835 1.00 0.00 O ATOM 238 CB PHE D 14 -26.372 0.944 -11.888 1.00 0.00 C ATOM 239 CG PHE D 14 -26.371 2.155 -10.986 1.00 0.00 C ATOM 240 CD1 PHE D 14 -25.425 2.262 -9.960 1.00 0.00 C ATOM 241 CD2 PHE D 14 -27.317 3.171 -11.173 1.00 0.00 C ATOM 242 CE1 PHE D 14 -25.424 3.383 -9.120 1.00 0.00 C ATOM 243 CE2 PHE D 14 -27.316 4.291 -10.333 1.00 0.00 C ATOM 244 CZ PHE D 14 -26.369 4.398 -9.308 1.00 0.00 C ATOM 0 H PHE D 14 -24.938 -0.362 -9.986 1.00 0.00 H new ATOM 0 HA PHE D 14 -27.826 -0.225 -10.812 1.00 0.00 H new ATOM 0 HB2 PHE D 14 -25.384 0.802 -12.325 1.00 0.00 H new ATOM 0 HB3 PHE D 14 -27.068 1.093 -12.714 1.00 0.00 H new ATOM 0 HD1 PHE D 14 -24.695 1.479 -9.816 1.00 0.00 H new ATOM 0 HD2 PHE D 14 -28.047 3.090 -11.965 1.00 0.00 H new ATOM 0 HE1 PHE D 14 -24.694 3.464 -8.328 1.00 0.00 H new ATOM 0 HE2 PHE D 14 -28.047 5.073 -10.476 1.00 0.00 H new ATOM 0 HZ PHE D 14 -26.368 5.264 -8.662 1.00 0.00 H new ATOM 254 N GLY D 15 -25.529 -2.309 -11.614 1.00 0.00 N ATOM 255 CA GLY D 15 -25.265 -3.552 -12.394 1.00 0.00 C ATOM 256 C GLY D 15 -24.097 -3.321 -13.355 1.00 0.00 C ATOM 257 O GLY D 15 -23.919 -2.244 -13.887 1.00 0.00 O ATOM 0 H GLY D 15 -24.869 -2.122 -10.859 1.00 0.00 H new ATOM 0 HA2 GLY D 15 -25.034 -4.375 -11.718 1.00 0.00 H new ATOM 0 HA3 GLY D 15 -26.156 -3.839 -12.952 1.00 0.00 H new ATOM 261 N GLN D 16 -23.301 -4.331 -13.582 1.00 0.00 N ATOM 262 CA GLN D 16 -22.147 -4.178 -14.509 1.00 0.00 C ATOM 263 C GLN D 16 -22.658 -4.077 -15.948 1.00 0.00 C ATOM 264 O GLN D 16 -21.987 -3.564 -16.821 1.00 0.00 O ATOM 265 CB GLN D 16 -21.224 -5.391 -14.379 1.00 0.00 C ATOM 266 CG GLN D 16 -20.662 -5.455 -12.958 1.00 0.00 C ATOM 267 CD GLN D 16 -21.209 -6.692 -12.245 1.00 0.00 C ATOM 268 OE1 GLN D 16 -22.014 -7.418 -12.795 1.00 0.00 O ATOM 269 NE2 GLN D 16 -20.804 -6.964 -11.034 1.00 0.00 N ATOM 0 H GLN D 16 -23.402 -5.256 -13.164 1.00 0.00 H new ATOM 0 HA GLN D 16 -21.595 -3.273 -14.256 1.00 0.00 H new ATOM 0 HB2 GLN D 16 -21.773 -6.305 -14.606 1.00 0.00 H new ATOM 0 HB3 GLN D 16 -20.410 -5.321 -15.101 1.00 0.00 H new ATOM 0 HG2 GLN D 16 -19.573 -5.492 -12.988 1.00 0.00 H new ATOM 0 HG3 GLN D 16 -20.935 -4.555 -12.407 1.00 0.00 H new ATOM 0 HE21 GLN D 16 -20.128 -6.354 -10.573 1.00 0.00 H new ATOM 0 HE22 GLN D 16 -21.163 -7.786 -10.549 1.00 0.00 H new ATOM 278 N THR D 17 -23.844 -4.561 -16.202 1.00 0.00 N ATOM 279 CA THR D 17 -24.395 -4.489 -17.584 1.00 0.00 C ATOM 280 C THR D 17 -24.803 -3.047 -17.891 1.00 0.00 C ATOM 281 O THR D 17 -24.787 -2.615 -19.027 1.00 0.00 O ATOM 282 CB THR D 17 -25.617 -5.402 -17.700 1.00 0.00 C ATOM 283 OG1 THR D 17 -25.536 -6.424 -16.711 1.00 0.00 O ATOM 284 CG2 THR D 17 -25.654 -6.028 -19.096 1.00 0.00 C ATOM 0 H THR D 17 -24.453 -5.002 -15.513 1.00 0.00 H new ATOM 0 HA THR D 17 -23.635 -4.814 -18.295 1.00 0.00 H new ATOM 0 HB THR D 17 -26.527 -4.822 -17.545 1.00 0.00 H new ATOM 0 HG1 THR D 17 -26.318 -7.010 -16.781 1.00 0.00 H new ATOM 0 HG21 THR D 17 -26.524 -6.679 -19.180 1.00 0.00 H new ATOM 0 HG22 THR D 17 -25.716 -5.240 -19.847 1.00 0.00 H new ATOM 0 HG23 THR D 17 -24.748 -6.612 -19.257 1.00 0.00 H new ATOM 292 N LYS D 18 -25.167 -2.298 -16.886 1.00 0.00 N ATOM 293 CA LYS D 18 -25.571 -0.884 -17.120 1.00 0.00 C ATOM 294 C LYS D 18 -24.318 -0.016 -17.243 1.00 0.00 C ATOM 295 O LYS D 18 -24.261 0.903 -18.037 1.00 0.00 O ATOM 296 CB LYS D 18 -26.424 -0.394 -15.948 1.00 0.00 C ATOM 297 CG LYS D 18 -27.714 -1.214 -15.875 1.00 0.00 C ATOM 298 CD LYS D 18 -28.782 -0.423 -15.117 1.00 0.00 C ATOM 299 CE LYS D 18 -29.655 -1.384 -14.309 1.00 0.00 C ATOM 300 NZ LYS D 18 -31.088 -1.021 -14.492 1.00 0.00 N ATOM 0 H LYS D 18 -25.202 -2.605 -15.914 1.00 0.00 H new ATOM 0 HA LYS D 18 -26.153 -0.817 -18.039 1.00 0.00 H new ATOM 0 HB2 LYS D 18 -25.868 -0.489 -15.015 1.00 0.00 H new ATOM 0 HB3 LYS D 18 -26.659 0.663 -16.073 1.00 0.00 H new ATOM 0 HG2 LYS D 18 -28.065 -1.448 -16.880 1.00 0.00 H new ATOM 0 HG3 LYS D 18 -27.526 -2.163 -15.374 1.00 0.00 H new ATOM 0 HD2 LYS D 18 -28.310 0.301 -14.453 1.00 0.00 H new ATOM 0 HD3 LYS D 18 -29.397 0.141 -15.818 1.00 0.00 H new ATOM 0 HE2 LYS D 18 -29.484 -2.410 -14.635 1.00 0.00 H new ATOM 0 HE3 LYS D 18 -29.388 -1.336 -13.253 1.00 0.00 H new ATOM 0 HZ1 LYS D 18 -31.684 -1.673 -13.943 1.00 0.00 H new ATOM 0 HZ2 LYS D 18 -31.245 -0.048 -14.161 1.00 0.00 H new ATOM 0 HZ3 LYS D 18 -31.337 -1.089 -15.499 1.00 0.00 H new ATOM 314 N THR D 19 -23.311 -0.305 -16.466 1.00 0.00 N ATOM 315 CA THR D 19 -22.056 0.497 -16.539 1.00 0.00 C ATOM 316 C THR D 19 -21.352 0.208 -17.867 1.00 0.00 C ATOM 317 O THR D 19 -20.655 1.044 -18.407 1.00 0.00 O ATOM 318 CB THR D 19 -21.135 0.112 -15.378 1.00 0.00 C ATOM 319 OG1 THR D 19 -21.821 0.303 -14.149 1.00 0.00 O ATOM 320 CG2 THR D 19 -19.879 0.988 -15.402 1.00 0.00 C ATOM 0 H THR D 19 -23.302 -1.062 -15.783 1.00 0.00 H new ATOM 0 HA THR D 19 -22.295 1.559 -16.473 1.00 0.00 H new ATOM 0 HB THR D 19 -20.846 -0.934 -15.478 1.00 0.00 H new ATOM 0 HG1 THR D 19 -22.297 1.160 -14.170 1.00 0.00 H new ATOM 0 HG21 THR D 19 -19.226 0.711 -14.574 1.00 0.00 H new ATOM 0 HG22 THR D 19 -19.352 0.842 -16.345 1.00 0.00 H new ATOM 0 HG23 THR D 19 -20.164 2.036 -15.304 1.00 0.00 H new ATOM 328 N ALA D 20 -21.533 -0.970 -18.397 1.00 0.00 N ATOM 329 CA ALA D 20 -20.879 -1.317 -19.689 1.00 0.00 C ATOM 330 C ALA D 20 -21.750 -0.832 -20.849 1.00 0.00 C ATOM 331 O ALA D 20 -21.259 -0.496 -21.909 1.00 0.00 O ATOM 332 CB ALA D 20 -20.708 -2.835 -19.781 1.00 0.00 C ATOM 0 H ALA D 20 -22.107 -1.708 -17.990 1.00 0.00 H new ATOM 0 HA ALA D 20 -19.902 -0.836 -19.742 1.00 0.00 H new ATOM 0 HB1 ALA D 20 -20.229 -3.091 -20.726 1.00 0.00 H new ATOM 0 HB2 ALA D 20 -20.088 -3.182 -18.955 1.00 0.00 H new ATOM 0 HB3 ALA D 20 -21.685 -3.315 -19.728 1.00 0.00 H new ATOM 338 N LYS D 21 -23.040 -0.792 -20.659 1.00 0.00 N ATOM 339 CA LYS D 21 -23.940 -0.327 -21.750 1.00 0.00 C ATOM 340 C LYS D 21 -23.817 1.191 -21.891 1.00 0.00 C ATOM 341 O LYS D 21 -23.966 1.739 -22.965 1.00 0.00 O ATOM 342 CB LYS D 21 -25.388 -0.696 -21.415 1.00 0.00 C ATOM 343 CG LYS D 21 -26.297 -0.331 -22.590 1.00 0.00 C ATOM 344 CD LYS D 21 -27.634 -1.061 -22.448 1.00 0.00 C ATOM 345 CE LYS D 21 -27.719 -2.179 -23.489 1.00 0.00 C ATOM 346 NZ LYS D 21 -28.204 -3.430 -22.840 1.00 0.00 N ATOM 0 H LYS D 21 -23.509 -1.062 -19.794 1.00 0.00 H new ATOM 0 HA LYS D 21 -23.656 -0.806 -22.687 1.00 0.00 H new ATOM 0 HB2 LYS D 21 -25.462 -1.763 -21.203 1.00 0.00 H new ATOM 0 HB3 LYS D 21 -25.709 -0.169 -20.517 1.00 0.00 H new ATOM 0 HG2 LYS D 21 -26.460 0.746 -22.616 1.00 0.00 H new ATOM 0 HG3 LYS D 21 -25.820 -0.604 -23.531 1.00 0.00 H new ATOM 0 HD2 LYS D 21 -27.729 -1.476 -21.445 1.00 0.00 H new ATOM 0 HD3 LYS D 21 -28.459 -0.361 -22.583 1.00 0.00 H new ATOM 0 HE2 LYS D 21 -28.394 -1.890 -24.294 1.00 0.00 H new ATOM 0 HE3 LYS D 21 -26.740 -2.346 -23.939 1.00 0.00 H new ATOM 0 HZ1 LYS D 21 -28.261 -4.189 -23.549 1.00 0.00 H new ATOM 0 HZ2 LYS D 21 -27.543 -3.709 -22.087 1.00 0.00 H new ATOM 0 HZ3 LYS D 21 -29.146 -3.266 -22.431 1.00 0.00 H new ATOM 360 N ASP D 22 -23.539 1.872 -20.815 1.00 0.00 N ATOM 361 CA ASP D 22 -23.398 3.353 -20.888 1.00 0.00 C ATOM 362 C ASP D 22 -22.002 3.699 -21.399 1.00 0.00 C ATOM 363 O ASP D 22 -21.826 4.592 -22.204 1.00 0.00 O ATOM 364 CB ASP D 22 -23.596 3.958 -19.496 1.00 0.00 C ATOM 365 CG ASP D 22 -25.088 4.169 -19.235 1.00 0.00 C ATOM 366 OD1 ASP D 22 -25.875 3.389 -19.747 1.00 0.00 O ATOM 367 OD2 ASP D 22 -25.418 5.105 -18.525 1.00 0.00 O ATOM 0 H ASP D 22 -23.403 1.468 -19.888 1.00 0.00 H new ATOM 0 HA ASP D 22 -24.149 3.758 -21.566 1.00 0.00 H new ATOM 0 HB2 ASP D 22 -23.174 3.298 -18.738 1.00 0.00 H new ATOM 0 HB3 ASP D 22 -23.066 4.908 -19.423 1.00 0.00 H new ATOM 372 N LEU D 23 -21.007 2.996 -20.938 1.00 0.00 N ATOM 373 CA LEU D 23 -19.619 3.278 -21.395 1.00 0.00 C ATOM 374 C LEU D 23 -19.408 2.681 -22.787 1.00 0.00 C ATOM 375 O LEU D 23 -18.426 2.957 -23.448 1.00 0.00 O ATOM 376 CB LEU D 23 -18.622 2.657 -20.415 1.00 0.00 C ATOM 377 CG LEU D 23 -18.453 3.579 -19.206 1.00 0.00 C ATOM 378 CD1 LEU D 23 -18.448 2.746 -17.923 1.00 0.00 C ATOM 379 CD2 LEU D 23 -17.129 4.335 -19.326 1.00 0.00 C ATOM 0 H LEU D 23 -21.095 2.237 -20.263 1.00 0.00 H new ATOM 0 HA LEU D 23 -19.463 4.356 -21.436 1.00 0.00 H new ATOM 0 HB2 LEU D 23 -18.975 1.678 -20.092 1.00 0.00 H new ATOM 0 HB3 LEU D 23 -17.661 2.504 -20.906 1.00 0.00 H new ATOM 0 HG LEU D 23 -19.279 4.290 -19.173 1.00 0.00 H new ATOM 0 HD11 LEU D 23 -18.328 3.404 -17.062 1.00 0.00 H new ATOM 0 HD12 LEU D 23 -19.390 2.205 -17.837 1.00 0.00 H new ATOM 0 HD13 LEU D 23 -17.623 2.035 -17.954 1.00 0.00 H new ATOM 0 HD21 LEU D 23 -17.006 4.993 -18.466 1.00 0.00 H new ATOM 0 HD22 LEU D 23 -16.305 3.622 -19.358 1.00 0.00 H new ATOM 0 HD23 LEU D 23 -17.131 4.929 -20.240 1.00 0.00 H new ATOM 391 N GLY D 24 -20.320 1.863 -23.239 1.00 0.00 N ATOM 392 CA GLY D 24 -20.166 1.251 -24.589 1.00 0.00 C ATOM 393 C GLY D 24 -19.130 0.126 -24.526 1.00 0.00 C ATOM 394 O GLY D 24 -18.773 -0.458 -25.530 1.00 0.00 O ATOM 0 H GLY D 24 -21.163 1.593 -22.733 1.00 0.00 H new ATOM 0 HA2 GLY D 24 -21.123 0.859 -24.933 1.00 0.00 H new ATOM 0 HA3 GLY D 24 -19.854 2.007 -25.309 1.00 0.00 H new ATOM 398 N VAL D 25 -18.646 -0.185 -23.354 1.00 0.00 N ATOM 399 CA VAL D 25 -17.637 -1.277 -23.233 1.00 0.00 C ATOM 400 C VAL D 25 -18.355 -2.601 -22.967 1.00 0.00 C ATOM 401 O VAL D 25 -19.567 -2.675 -22.993 1.00 0.00 O ATOM 402 CB VAL D 25 -16.680 -0.971 -22.078 1.00 0.00 C ATOM 403 CG1 VAL D 25 -15.635 0.047 -22.538 1.00 0.00 C ATOM 404 CG2 VAL D 25 -17.465 -0.393 -20.898 1.00 0.00 C ATOM 0 H VAL D 25 -18.904 0.268 -22.477 1.00 0.00 H new ATOM 0 HA VAL D 25 -17.068 -1.349 -24.160 1.00 0.00 H new ATOM 0 HB VAL D 25 -16.184 -1.891 -21.768 1.00 0.00 H new ATOM 0 HG11 VAL D 25 -14.953 0.265 -21.716 1.00 0.00 H new ATOM 0 HG12 VAL D 25 -15.072 -0.363 -23.377 1.00 0.00 H new ATOM 0 HG13 VAL D 25 -16.134 0.965 -22.849 1.00 0.00 H new ATOM 0 HG21 VAL D 25 -16.781 -0.176 -20.077 1.00 0.00 H new ATOM 0 HG22 VAL D 25 -17.963 0.526 -21.208 1.00 0.00 H new ATOM 0 HG23 VAL D 25 -18.210 -1.116 -20.568 1.00 0.00 H new ATOM 414 N TYR D 26 -17.620 -3.649 -22.714 1.00 0.00 N ATOM 415 CA TYR D 26 -18.269 -4.968 -22.452 1.00 0.00 C ATOM 416 C TYR D 26 -18.326 -5.214 -20.943 1.00 0.00 C ATOM 417 O TYR D 26 -17.579 -4.632 -20.181 1.00 0.00 O ATOM 418 CB TYR D 26 -17.465 -6.096 -23.115 1.00 0.00 C ATOM 419 CG TYR D 26 -16.565 -5.535 -24.193 1.00 0.00 C ATOM 420 CD1 TYR D 26 -17.100 -4.723 -25.201 1.00 0.00 C ATOM 421 CD2 TYR D 26 -15.196 -5.829 -24.182 1.00 0.00 C ATOM 422 CE1 TYR D 26 -16.264 -4.204 -26.196 1.00 0.00 C ATOM 423 CE2 TYR D 26 -14.362 -5.309 -25.178 1.00 0.00 C ATOM 424 CZ TYR D 26 -14.896 -4.498 -26.185 1.00 0.00 C ATOM 425 OH TYR D 26 -14.073 -3.987 -27.168 1.00 0.00 O ATOM 0 H TYR D 26 -16.601 -3.651 -22.677 1.00 0.00 H new ATOM 0 HA TYR D 26 -19.277 -4.955 -22.867 1.00 0.00 H new ATOM 0 HB2 TYR D 26 -16.867 -6.614 -22.366 1.00 0.00 H new ATOM 0 HB3 TYR D 26 -18.144 -6.832 -23.545 1.00 0.00 H new ATOM 0 HD1 TYR D 26 -18.156 -4.498 -25.210 1.00 0.00 H new ATOM 0 HD2 TYR D 26 -14.784 -6.457 -23.405 1.00 0.00 H new ATOM 0 HE1 TYR D 26 -16.675 -3.576 -26.973 1.00 0.00 H new ATOM 0 HE2 TYR D 26 -13.306 -5.534 -25.169 1.00 0.00 H new ATOM 0 HH TYR D 26 -13.153 -4.286 -27.012 1.00 0.00 H new ATOM 435 N GLN D 27 -19.204 -6.075 -20.504 1.00 0.00 N ATOM 436 CA GLN D 27 -19.301 -6.359 -19.045 1.00 0.00 C ATOM 437 C GLN D 27 -18.057 -7.130 -18.598 1.00 0.00 C ATOM 438 O GLN D 27 -17.728 -7.176 -17.430 1.00 0.00 O ATOM 439 CB GLN D 27 -20.550 -7.198 -18.764 1.00 0.00 C ATOM 440 CG GLN D 27 -21.800 -6.346 -18.993 1.00 0.00 C ATOM 441 CD GLN D 27 -22.561 -6.870 -20.211 1.00 0.00 C ATOM 442 OE1 GLN D 27 -22.914 -6.113 -21.093 1.00 0.00 O ATOM 443 NE2 GLN D 27 -22.830 -8.144 -20.299 1.00 0.00 N ATOM 0 H GLN D 27 -19.857 -6.593 -21.092 1.00 0.00 H new ATOM 0 HA GLN D 27 -19.369 -5.420 -18.496 1.00 0.00 H new ATOM 0 HB2 GLN D 27 -20.568 -8.072 -19.416 1.00 0.00 H new ATOM 0 HB3 GLN D 27 -20.531 -7.566 -17.738 1.00 0.00 H new ATOM 0 HG2 GLN D 27 -22.440 -6.376 -18.111 1.00 0.00 H new ATOM 0 HG3 GLN D 27 -21.519 -5.304 -19.147 1.00 0.00 H new ATOM 0 HE21 GLN D 27 -22.534 -8.780 -19.559 1.00 0.00 H new ATOM 0 HE22 GLN D 27 -23.336 -8.504 -21.108 1.00 0.00 H new ATOM 452 N SER D 28 -17.362 -7.736 -19.522 1.00 0.00 N ATOM 453 CA SER D 28 -16.139 -8.502 -19.154 1.00 0.00 C ATOM 454 C SER D 28 -14.981 -7.529 -18.930 1.00 0.00 C ATOM 455 O SER D 28 -14.017 -7.836 -18.254 1.00 0.00 O ATOM 456 CB SER D 28 -15.783 -9.469 -20.284 1.00 0.00 C ATOM 457 OG SER D 28 -14.403 -9.802 -20.201 1.00 0.00 O ATOM 0 H SER D 28 -17.589 -7.733 -20.516 1.00 0.00 H new ATOM 0 HA SER D 28 -16.323 -9.066 -18.240 1.00 0.00 H new ATOM 0 HB2 SER D 28 -16.391 -10.371 -20.212 1.00 0.00 H new ATOM 0 HB3 SER D 28 -16.001 -9.014 -21.250 1.00 0.00 H new ATOM 0 HG SER D 28 -14.172 -10.423 -20.923 1.00 0.00 H new ATOM 463 N ALA D 29 -15.071 -6.349 -19.482 1.00 0.00 N ATOM 464 CA ALA D 29 -13.982 -5.352 -19.290 1.00 0.00 C ATOM 465 C ALA D 29 -14.214 -4.635 -17.965 1.00 0.00 C ATOM 466 O ALA D 29 -13.304 -4.418 -17.191 1.00 0.00 O ATOM 467 CB ALA D 29 -14.003 -4.339 -20.437 1.00 0.00 C ATOM 0 H ALA D 29 -15.852 -6.034 -20.057 1.00 0.00 H new ATOM 0 HA ALA D 29 -13.013 -5.851 -19.280 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -13.205 -3.611 -20.294 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -13.855 -4.858 -21.384 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -14.964 -3.826 -20.451 1.00 0.00 H new ATOM 473 N ILE D 30 -15.438 -4.285 -17.698 1.00 0.00 N ATOM 474 CA ILE D 30 -15.757 -3.600 -16.420 1.00 0.00 C ATOM 475 C ILE D 30 -15.630 -4.616 -15.281 1.00 0.00 C ATOM 476 O ILE D 30 -15.295 -4.277 -14.163 1.00 0.00 O ATOM 477 CB ILE D 30 -17.186 -3.056 -16.487 1.00 0.00 C ATOM 478 CG1 ILE D 30 -17.201 -1.769 -17.316 1.00 0.00 C ATOM 479 CG2 ILE D 30 -17.695 -2.757 -15.078 1.00 0.00 C ATOM 480 CD1 ILE D 30 -18.648 -1.374 -17.619 1.00 0.00 C ATOM 0 H ILE D 30 -16.235 -4.445 -18.314 1.00 0.00 H new ATOM 0 HA ILE D 30 -15.071 -2.771 -16.247 1.00 0.00 H new ATOM 0 HB ILE D 30 -17.832 -3.801 -16.951 1.00 0.00 H new ATOM 0 HG12 ILE D 30 -16.700 -0.968 -16.772 1.00 0.00 H new ATOM 0 HG13 ILE D 30 -16.651 -1.916 -18.245 1.00 0.00 H new ATOM 0 HG21 ILE D 30 -18.713 -2.370 -15.133 1.00 0.00 H new ATOM 0 HG22 ILE D 30 -17.686 -3.672 -14.486 1.00 0.00 H new ATOM 0 HG23 ILE D 30 -17.050 -2.015 -14.608 1.00 0.00 H new ATOM 0 HD11 ILE D 30 -18.659 -0.458 -18.209 1.00 0.00 H new ATOM 0 HD12 ILE D 30 -19.133 -2.173 -18.180 1.00 0.00 H new ATOM 0 HD13 ILE D 30 -19.184 -1.210 -16.684 1.00 0.00 H new ATOM 492 N ASN D 31 -15.886 -5.865 -15.565 1.00 0.00 N ATOM 493 CA ASN D 31 -15.773 -6.911 -14.512 1.00 0.00 C ATOM 494 C ASN D 31 -14.297 -7.125 -14.180 1.00 0.00 C ATOM 495 O ASN D 31 -13.924 -7.279 -13.035 1.00 0.00 O ATOM 496 CB ASN D 31 -16.373 -8.221 -15.028 1.00 0.00 C ATOM 497 CG ASN D 31 -16.195 -9.318 -13.976 1.00 0.00 C ATOM 498 OD1 ASN D 31 -16.832 -9.227 -12.841 1.00 0.00 O flip ATOM 499 ND2 ASN D 31 -15.468 -10.268 -14.189 1.00 0.00 N flip ATOM 0 H ASN D 31 -16.169 -6.205 -16.484 1.00 0.00 H new ATOM 0 HA ASN D 31 -16.311 -6.594 -13.618 1.00 0.00 H new ATOM 0 HB2 ASN D 31 -17.431 -8.085 -15.250 1.00 0.00 H new ATOM 0 HB3 ASN D 31 -15.887 -8.514 -15.959 1.00 0.00 H new ATOM 0 HD21 ASN D 31 -14.970 -10.340 -15.076 1.00 0.00 H new ATOM 0 HD22 ASN D 31 -15.356 -10.993 -13.481 1.00 0.00 H new ATOM 506 N LYS D 32 -13.451 -7.131 -15.175 1.00 0.00 N ATOM 507 CA LYS D 32 -11.997 -7.328 -14.921 1.00 0.00 C ATOM 508 C LYS D 32 -11.437 -6.090 -14.220 1.00 0.00 C ATOM 509 O LYS D 32 -10.543 -6.177 -13.401 1.00 0.00 O ATOM 510 CB LYS D 32 -11.269 -7.536 -16.251 1.00 0.00 C ATOM 511 CG LYS D 32 -11.533 -8.953 -16.764 1.00 0.00 C ATOM 512 CD LYS D 32 -11.174 -9.035 -18.250 1.00 0.00 C ATOM 513 CE LYS D 32 -9.769 -9.621 -18.402 1.00 0.00 C ATOM 514 NZ LYS D 32 -9.757 -11.020 -17.887 1.00 0.00 N ATOM 0 H LYS D 32 -13.706 -7.008 -16.155 1.00 0.00 H new ATOM 0 HA LYS D 32 -11.851 -8.204 -14.289 1.00 0.00 H new ATOM 0 HB2 LYS D 32 -11.611 -6.804 -16.983 1.00 0.00 H new ATOM 0 HB3 LYS D 32 -10.198 -7.379 -16.120 1.00 0.00 H new ATOM 0 HG2 LYS D 32 -10.943 -9.672 -16.196 1.00 0.00 H new ATOM 0 HG3 LYS D 32 -12.581 -9.215 -16.617 1.00 0.00 H new ATOM 0 HD2 LYS D 32 -11.898 -9.657 -18.777 1.00 0.00 H new ATOM 0 HD3 LYS D 32 -11.217 -8.044 -18.701 1.00 0.00 H new ATOM 0 HE2 LYS D 32 -9.468 -9.605 -19.449 1.00 0.00 H new ATOM 0 HE3 LYS D 32 -9.049 -9.014 -17.854 1.00 0.00 H new ATOM 0 HZ1 LYS D 32 -9.096 -11.592 -18.451 1.00 0.00 H new ATOM 0 HZ2 LYS D 32 -9.454 -11.021 -16.892 1.00 0.00 H new ATOM 0 HZ3 LYS D 32 -10.713 -11.424 -17.958 1.00 0.00 H new ATOM 528 N ALA D 33 -11.961 -4.935 -14.531 1.00 0.00 N ATOM 529 CA ALA D 33 -11.464 -3.690 -13.881 1.00 0.00 C ATOM 530 C ALA D 33 -11.799 -3.733 -12.391 1.00 0.00 C ATOM 531 O ALA D 33 -11.041 -3.275 -11.559 1.00 0.00 O ATOM 532 CB ALA D 33 -12.136 -2.473 -14.521 1.00 0.00 C ATOM 0 H ALA D 33 -12.712 -4.801 -15.208 1.00 0.00 H new ATOM 0 HA ALA D 33 -10.385 -3.615 -14.012 1.00 0.00 H new ATOM 0 HB1 ALA D 33 -11.771 -1.563 -14.044 1.00 0.00 H new ATOM 0 HB2 ALA D 33 -11.900 -2.445 -15.585 1.00 0.00 H new ATOM 0 HB3 ALA D 33 -13.216 -2.543 -14.390 1.00 0.00 H new ATOM 538 N ILE D 34 -12.929 -4.285 -12.049 1.00 0.00 N ATOM 539 CA ILE D 34 -13.316 -4.366 -10.614 1.00 0.00 C ATOM 540 C ILE D 34 -12.603 -5.557 -9.970 1.00 0.00 C ATOM 541 O ILE D 34 -12.337 -5.571 -8.785 1.00 0.00 O ATOM 542 CB ILE D 34 -14.830 -4.556 -10.501 1.00 0.00 C ATOM 543 CG1 ILE D 34 -15.542 -3.274 -10.946 1.00 0.00 C ATOM 544 CG2 ILE D 34 -15.198 -4.869 -9.050 1.00 0.00 C ATOM 545 CD1 ILE D 34 -15.088 -2.103 -10.072 1.00 0.00 C ATOM 0 H ILE D 34 -13.602 -4.684 -12.703 1.00 0.00 H new ATOM 0 HA ILE D 34 -13.030 -3.446 -10.105 1.00 0.00 H new ATOM 0 HB ILE D 34 -15.141 -5.383 -11.140 1.00 0.00 H new ATOM 0 HG12 ILE D 34 -15.319 -3.067 -11.993 1.00 0.00 H new ATOM 0 HG13 ILE D 34 -16.622 -3.401 -10.869 1.00 0.00 H new ATOM 0 HG21 ILE D 34 -16.277 -5.004 -8.969 1.00 0.00 H new ATOM 0 HG22 ILE D 34 -14.693 -5.782 -8.735 1.00 0.00 H new ATOM 0 HG23 ILE D 34 -14.887 -4.044 -8.410 1.00 0.00 H new ATOM 0 HD11 ILE D 34 -15.596 -1.193 -10.391 1.00 0.00 H new ATOM 0 HD12 ILE D 34 -15.334 -2.310 -9.030 1.00 0.00 H new ATOM 0 HD13 ILE D 34 -14.011 -1.971 -10.171 1.00 0.00 H new ATOM 557 N HIS D 35 -12.292 -6.558 -10.749 1.00 0.00 N ATOM 558 CA HIS D 35 -11.597 -7.751 -10.195 1.00 0.00 C ATOM 559 C HIS D 35 -10.153 -7.384 -9.849 1.00 0.00 C ATOM 560 O HIS D 35 -9.488 -8.074 -9.102 1.00 0.00 O ATOM 561 CB HIS D 35 -11.605 -8.868 -11.241 1.00 0.00 C ATOM 562 CG HIS D 35 -12.893 -9.634 -11.142 1.00 0.00 C ATOM 563 ND1 HIS D 35 -13.808 -9.761 -10.127 1.00 0.00 N flip ATOM 564 CD2 HIS D 35 -13.381 -10.399 -12.189 1.00 0.00 C flip ATOM 565 CE1 HIS D 35 -14.849 -10.591 -10.534 1.00 0.00 C flip ATOM 566 NE2 HIS D 35 -14.542 -10.947 -11.785 1.00 0.00 N flip ATOM 0 H HIS D 35 -12.491 -6.599 -11.749 1.00 0.00 H new ATOM 0 HA HIS D 35 -12.109 -8.090 -9.294 1.00 0.00 H new ATOM 0 HB2 HIS D 35 -11.496 -8.446 -12.240 1.00 0.00 H new ATOM 0 HB3 HIS D 35 -10.758 -9.536 -11.082 1.00 0.00 H new ATOM 0 HD1 HIS D 35 -13.736 -9.315 -9.213 1.00 0.00 H new ATOM 0 HD2 HIS D 35 -12.915 -10.532 -13.154 1.00 0.00 H new ATOM 0 HE1 HIS D 35 -15.717 -10.884 -9.962 1.00 0.00 H new ATOM 574 N ALA D 36 -9.663 -6.301 -10.386 1.00 0.00 N ATOM 575 CA ALA D 36 -8.263 -5.890 -10.087 1.00 0.00 C ATOM 576 C ALA D 36 -8.237 -5.060 -8.802 1.00 0.00 C ATOM 577 O ALA D 36 -7.202 -4.881 -8.189 1.00 0.00 O ATOM 578 CB ALA D 36 -7.718 -5.054 -11.246 1.00 0.00 C ATOM 0 H ALA D 36 -10.171 -5.683 -11.019 1.00 0.00 H new ATOM 0 HA ALA D 36 -7.644 -6.778 -9.957 1.00 0.00 H new ATOM 0 HB1 ALA D 36 -6.693 -4.753 -11.027 1.00 0.00 H new ATOM 0 HB2 ALA D 36 -7.735 -5.646 -12.161 1.00 0.00 H new ATOM 0 HB3 ALA D 36 -8.337 -4.166 -11.377 1.00 0.00 H new ATOM 584 N GLY D 37 -9.365 -4.551 -8.388 1.00 0.00 N ATOM 585 CA GLY D 37 -9.401 -3.733 -7.143 1.00 0.00 C ATOM 586 C GLY D 37 -8.564 -2.468 -7.339 1.00 0.00 C ATOM 587 O GLY D 37 -8.010 -1.926 -6.402 1.00 0.00 O ATOM 0 H GLY D 37 -10.263 -4.666 -8.858 1.00 0.00 H new ATOM 0 HA2 GLY D 37 -10.430 -3.467 -6.900 1.00 0.00 H new ATOM 0 HA3 GLY D 37 -9.014 -4.311 -6.304 1.00 0.00 H new ATOM 591 N ARG D 38 -8.467 -1.992 -8.551 1.00 0.00 N ATOM 592 CA ARG D 38 -7.666 -0.761 -8.808 1.00 0.00 C ATOM 593 C ARG D 38 -8.515 0.472 -8.497 1.00 0.00 C ATOM 594 O ARG D 38 -9.708 0.378 -8.284 1.00 0.00 O ATOM 595 CB ARG D 38 -7.243 -0.725 -10.278 1.00 0.00 C ATOM 596 CG ARG D 38 -6.016 -1.616 -10.481 1.00 0.00 C ATOM 597 CD ARG D 38 -4.765 -0.877 -10.001 1.00 0.00 C ATOM 598 NE ARG D 38 -3.754 -1.867 -9.533 1.00 0.00 N ATOM 599 CZ ARG D 38 -2.824 -2.285 -10.346 1.00 0.00 C ATOM 600 NH1 ARG D 38 -1.793 -1.529 -10.605 1.00 0.00 N ATOM 601 NH2 ARG D 38 -2.925 -3.462 -10.902 1.00 0.00 N ATOM 0 H ARG D 38 -8.908 -2.402 -9.374 1.00 0.00 H new ATOM 0 HA ARG D 38 -6.780 -0.766 -8.173 1.00 0.00 H new ATOM 0 HB2 ARG D 38 -8.062 -1.067 -10.911 1.00 0.00 H new ATOM 0 HB3 ARG D 38 -7.015 0.298 -10.576 1.00 0.00 H new ATOM 0 HG2 ARG D 38 -6.135 -2.548 -9.929 1.00 0.00 H new ATOM 0 HG3 ARG D 38 -5.915 -1.879 -11.534 1.00 0.00 H new ATOM 0 HD2 ARG D 38 -4.352 -0.274 -10.810 1.00 0.00 H new ATOM 0 HD3 ARG D 38 -5.021 -0.193 -9.192 1.00 0.00 H new ATOM 0 HE ARG D 38 -3.790 -2.218 -8.576 1.00 0.00 H new ATOM 0 HH11 ARG D 38 -1.713 -0.609 -10.171 1.00 0.00 H new ATOM 0 HH12 ARG D 38 -1.067 -1.858 -11.241 1.00 0.00 H new ATOM 0 HH21 ARG D 38 -3.731 -4.054 -10.700 1.00 0.00 H new ATOM 0 HH22 ARG D 38 -2.198 -3.790 -11.538 1.00 0.00 H new ATOM 615 N LYS D 39 -7.912 1.628 -8.474 1.00 0.00 N ATOM 616 CA LYS D 39 -8.687 2.867 -8.186 1.00 0.00 C ATOM 617 C LYS D 39 -9.339 3.358 -9.471 1.00 0.00 C ATOM 618 O LYS D 39 -8.948 4.356 -10.044 1.00 0.00 O ATOM 619 CB LYS D 39 -7.751 3.943 -7.630 1.00 0.00 C ATOM 620 CG LYS D 39 -7.916 4.031 -6.111 1.00 0.00 C ATOM 621 CD LYS D 39 -7.569 2.682 -5.478 1.00 0.00 C ATOM 622 CE LYS D 39 -8.393 2.488 -4.204 1.00 0.00 C ATOM 623 NZ LYS D 39 -9.719 1.902 -4.553 1.00 0.00 N ATOM 0 H LYS D 39 -6.916 1.768 -8.642 1.00 0.00 H new ATOM 0 HA LYS D 39 -9.459 2.655 -7.446 1.00 0.00 H new ATOM 0 HB2 LYS D 39 -6.717 3.705 -7.881 1.00 0.00 H new ATOM 0 HB3 LYS D 39 -7.976 4.907 -8.087 1.00 0.00 H new ATOM 0 HG2 LYS D 39 -7.268 4.810 -5.709 1.00 0.00 H new ATOM 0 HG3 LYS D 39 -8.940 4.308 -5.862 1.00 0.00 H new ATOM 0 HD2 LYS D 39 -7.773 1.875 -6.182 1.00 0.00 H new ATOM 0 HD3 LYS D 39 -6.505 2.641 -5.245 1.00 0.00 H new ATOM 0 HE2 LYS D 39 -7.864 1.832 -3.513 1.00 0.00 H new ATOM 0 HE3 LYS D 39 -8.528 3.443 -3.697 1.00 0.00 H new ATOM 0 HZ1 LYS D 39 -10.279 1.770 -3.687 1.00 0.00 H new ATOM 0 HZ2 LYS D 39 -10.224 2.544 -5.197 1.00 0.00 H new ATOM 0 HZ3 LYS D 39 -9.580 0.983 -5.019 1.00 0.00 H new ATOM 637 N ILE D 40 -10.342 2.662 -9.919 1.00 0.00 N ATOM 638 CA ILE D 40 -11.046 3.079 -11.161 1.00 0.00 C ATOM 639 C ILE D 40 -12.261 3.913 -10.769 1.00 0.00 C ATOM 640 O ILE D 40 -13.263 3.397 -10.314 1.00 0.00 O ATOM 641 CB ILE D 40 -11.497 1.845 -11.943 1.00 0.00 C ATOM 642 CG1 ILE D 40 -10.288 0.947 -12.219 1.00 0.00 C ATOM 643 CG2 ILE D 40 -12.118 2.282 -13.272 1.00 0.00 C ATOM 644 CD1 ILE D 40 -10.712 -0.225 -13.107 1.00 0.00 C ATOM 0 H ILE D 40 -10.707 1.818 -9.477 1.00 0.00 H new ATOM 0 HA ILE D 40 -10.376 3.665 -11.790 1.00 0.00 H new ATOM 0 HB ILE D 40 -12.235 1.295 -11.359 1.00 0.00 H new ATOM 0 HG12 ILE D 40 -9.500 1.520 -12.708 1.00 0.00 H new ATOM 0 HG13 ILE D 40 -9.876 0.575 -11.281 1.00 0.00 H new ATOM 0 HG21 ILE D 40 -12.440 1.403 -13.830 1.00 0.00 H new ATOM 0 HG22 ILE D 40 -12.978 2.923 -13.078 1.00 0.00 H new ATOM 0 HG23 ILE D 40 -11.379 2.832 -13.855 1.00 0.00 H new ATOM 0 HD11 ILE D 40 -9.851 -0.863 -13.303 1.00 0.00 H new ATOM 0 HD12 ILE D 40 -11.485 -0.804 -12.601 1.00 0.00 H new ATOM 0 HD13 ILE D 40 -11.103 0.156 -14.050 1.00 0.00 H new ATOM 656 N PHE D 41 -12.173 5.201 -10.923 1.00 0.00 N ATOM 657 CA PHE D 41 -13.313 6.074 -10.541 1.00 0.00 C ATOM 658 C PHE D 41 -14.207 6.319 -11.758 1.00 0.00 C ATOM 659 O PHE D 41 -13.799 6.135 -12.888 1.00 0.00 O ATOM 660 CB PHE D 41 -12.760 7.394 -10.010 1.00 0.00 C ATOM 661 CG PHE D 41 -11.602 7.104 -9.080 1.00 0.00 C ATOM 662 CD1 PHE D 41 -11.646 5.985 -8.234 1.00 0.00 C ATOM 663 CD2 PHE D 41 -10.485 7.949 -9.062 1.00 0.00 C ATOM 664 CE1 PHE D 41 -10.576 5.717 -7.373 1.00 0.00 C ATOM 665 CE2 PHE D 41 -9.416 7.677 -8.199 1.00 0.00 C ATOM 666 CZ PHE D 41 -9.462 6.563 -7.355 1.00 0.00 C ATOM 0 H PHE D 41 -11.359 5.688 -11.298 1.00 0.00 H new ATOM 0 HA PHE D 41 -13.912 5.594 -9.767 1.00 0.00 H new ATOM 0 HB2 PHE D 41 -12.431 8.024 -10.836 1.00 0.00 H new ATOM 0 HB3 PHE D 41 -13.539 7.943 -9.481 1.00 0.00 H new ATOM 0 HD1 PHE D 41 -12.505 5.331 -8.248 1.00 0.00 H new ATOM 0 HD2 PHE D 41 -10.448 8.810 -9.713 1.00 0.00 H new ATOM 0 HE1 PHE D 41 -10.610 4.856 -6.722 1.00 0.00 H new ATOM 0 HE2 PHE D 41 -8.555 8.329 -8.185 1.00 0.00 H new ATOM 0 HZ PHE D 41 -8.637 6.356 -6.689 1.00 0.00 H new ATOM 676 N LEU D 42 -15.431 6.720 -11.537 1.00 0.00 N ATOM 677 CA LEU D 42 -16.355 6.962 -12.680 1.00 0.00 C ATOM 678 C LEU D 42 -16.939 8.372 -12.578 1.00 0.00 C ATOM 679 O LEU D 42 -17.692 8.679 -11.677 1.00 0.00 O ATOM 680 CB LEU D 42 -17.492 5.938 -12.634 1.00 0.00 C ATOM 681 CG LEU D 42 -17.478 5.087 -13.906 1.00 0.00 C ATOM 682 CD1 LEU D 42 -16.122 4.393 -14.045 1.00 0.00 C ATOM 683 CD2 LEU D 42 -18.580 4.029 -13.817 1.00 0.00 C ATOM 0 H LEU D 42 -15.830 6.890 -10.614 1.00 0.00 H new ATOM 0 HA LEU D 42 -15.808 6.864 -13.618 1.00 0.00 H new ATOM 0 HB2 LEU D 42 -17.383 5.299 -11.757 1.00 0.00 H new ATOM 0 HB3 LEU D 42 -18.450 6.449 -12.538 1.00 0.00 H new ATOM 0 HG LEU D 42 -17.649 5.726 -14.772 1.00 0.00 H new ATOM 0 HD11 LEU D 42 -16.114 3.788 -14.951 1.00 0.00 H new ATOM 0 HD12 LEU D 42 -15.334 5.143 -14.103 1.00 0.00 H new ATOM 0 HD13 LEU D 42 -15.951 3.753 -13.180 1.00 0.00 H new ATOM 0 HD21 LEU D 42 -18.574 3.420 -14.721 1.00 0.00 H new ATOM 0 HD22 LEU D 42 -18.404 3.392 -12.950 1.00 0.00 H new ATOM 0 HD23 LEU D 42 -19.548 4.520 -13.717 1.00 0.00 H new ATOM 695 N THR D 43 -16.603 9.231 -13.497 1.00 0.00 N ATOM 696 CA THR D 43 -17.146 10.618 -13.454 1.00 0.00 C ATOM 697 C THR D 43 -18.338 10.717 -14.409 1.00 0.00 C ATOM 698 O THR D 43 -18.187 11.013 -15.578 1.00 0.00 O ATOM 699 CB THR D 43 -16.054 11.606 -13.881 1.00 0.00 C ATOM 700 OG1 THR D 43 -15.115 11.755 -12.825 1.00 0.00 O ATOM 701 CG2 THR D 43 -16.681 12.965 -14.201 1.00 0.00 C ATOM 0 H THR D 43 -15.976 9.034 -14.277 1.00 0.00 H new ATOM 0 HA THR D 43 -17.470 10.859 -12.442 1.00 0.00 H new ATOM 0 HB THR D 43 -15.550 11.225 -14.769 1.00 0.00 H new ATOM 0 HG1 THR D 43 -14.274 12.110 -13.182 1.00 0.00 H new ATOM 0 HG21 THR D 43 -15.901 13.663 -14.504 1.00 0.00 H new ATOM 0 HG22 THR D 43 -17.401 12.852 -15.011 1.00 0.00 H new ATOM 0 HG23 THR D 43 -17.188 13.349 -13.316 1.00 0.00 H new ATOM 709 N ILE D 44 -19.521 10.464 -13.920 1.00 0.00 N ATOM 710 CA ILE D 44 -20.722 10.536 -14.800 1.00 0.00 C ATOM 711 C ILE D 44 -21.183 11.991 -14.919 1.00 0.00 C ATOM 712 O ILE D 44 -21.701 12.568 -13.984 1.00 0.00 O ATOM 713 CB ILE D 44 -21.844 9.690 -14.195 1.00 0.00 C ATOM 714 CG1 ILE D 44 -21.248 8.404 -13.613 1.00 0.00 C ATOM 715 CG2 ILE D 44 -22.861 9.335 -15.282 1.00 0.00 C ATOM 716 CD1 ILE D 44 -22.369 7.414 -13.295 1.00 0.00 C ATOM 0 H ILE D 44 -19.708 10.211 -12.950 1.00 0.00 H new ATOM 0 HA ILE D 44 -20.472 10.155 -15.790 1.00 0.00 H new ATOM 0 HB ILE D 44 -22.342 10.253 -13.406 1.00 0.00 H new ATOM 0 HG12 ILE D 44 -20.550 7.961 -14.323 1.00 0.00 H new ATOM 0 HG13 ILE D 44 -20.683 8.630 -12.709 1.00 0.00 H new ATOM 0 HG21 ILE D 44 -23.660 8.732 -14.850 1.00 0.00 H new ATOM 0 HG22 ILE D 44 -23.282 10.250 -15.699 1.00 0.00 H new ATOM 0 HG23 ILE D 44 -22.367 8.770 -16.072 1.00 0.00 H new ATOM 0 HD11 ILE D 44 -21.941 6.501 -12.881 1.00 0.00 H new ATOM 0 HD12 ILE D 44 -23.050 7.857 -12.569 1.00 0.00 H new ATOM 0 HD13 ILE D 44 -22.915 7.178 -14.208 1.00 0.00 H new ATOM 728 N ASN D 45 -20.997 12.587 -16.065 1.00 0.00 N ATOM 729 CA ASN D 45 -21.421 14.001 -16.249 1.00 0.00 C ATOM 730 C ASN D 45 -22.945 14.096 -16.149 1.00 0.00 C ATOM 731 O ASN D 45 -23.665 13.240 -16.625 1.00 0.00 O ATOM 732 CB ASN D 45 -20.965 14.497 -17.621 1.00 0.00 C ATOM 733 CG ASN D 45 -19.493 14.134 -17.832 1.00 0.00 C ATOM 734 OD1 ASN D 45 -18.909 13.429 -17.033 1.00 0.00 O ATOM 735 ND2 ASN D 45 -18.864 14.589 -18.881 1.00 0.00 N ATOM 0 H ASN D 45 -20.569 12.153 -16.883 1.00 0.00 H new ATOM 0 HA ASN D 45 -20.969 14.619 -15.473 1.00 0.00 H new ATOM 0 HB2 ASN D 45 -21.577 14.048 -18.403 1.00 0.00 H new ATOM 0 HB3 ASN D 45 -21.098 15.577 -17.692 1.00 0.00 H new ATOM 0 HD21 ASN D 45 -17.883 14.353 -19.030 1.00 0.00 H new ATOM 0 HD22 ASN D 45 -19.353 15.181 -19.552 1.00 0.00 H new ATOM 742 N ALA D 46 -23.434 15.137 -15.531 1.00 0.00 N ATOM 743 CA ALA D 46 -24.908 15.314 -15.380 1.00 0.00 C ATOM 744 C ALA D 46 -25.621 15.034 -16.708 1.00 0.00 C ATOM 745 O ALA D 46 -26.798 14.737 -16.735 1.00 0.00 O ATOM 746 CB ALA D 46 -25.199 16.750 -14.943 1.00 0.00 C ATOM 0 H ALA D 46 -22.869 15.880 -15.120 1.00 0.00 H new ATOM 0 HA ALA D 46 -25.274 14.612 -14.630 1.00 0.00 H new ATOM 0 HB1 ALA D 46 -26.275 16.885 -14.831 1.00 0.00 H new ATOM 0 HB2 ALA D 46 -24.707 16.947 -13.990 1.00 0.00 H new ATOM 0 HB3 ALA D 46 -24.823 17.443 -15.696 1.00 0.00 H new ATOM 752 N ASP D 47 -24.925 15.126 -17.808 1.00 0.00 N ATOM 753 CA ASP D 47 -25.577 14.865 -19.123 1.00 0.00 C ATOM 754 C ASP D 47 -25.542 13.364 -19.428 1.00 0.00 C ATOM 755 O ASP D 47 -25.441 12.956 -20.569 1.00 0.00 O ATOM 756 CB ASP D 47 -24.828 15.625 -20.220 1.00 0.00 C ATOM 757 CG ASP D 47 -25.736 15.786 -21.441 1.00 0.00 C ATOM 758 OD1 ASP D 47 -26.385 14.820 -21.804 1.00 0.00 O ATOM 759 OD2 ASP D 47 -25.768 16.875 -21.990 1.00 0.00 O ATOM 0 H ASP D 47 -23.936 15.370 -17.853 1.00 0.00 H new ATOM 0 HA ASP D 47 -26.613 15.201 -19.086 1.00 0.00 H new ATOM 0 HB2 ASP D 47 -24.518 16.603 -19.853 1.00 0.00 H new ATOM 0 HB3 ASP D 47 -23.922 15.086 -20.496 1.00 0.00 H new ATOM 764 N GLY D 48 -25.623 12.537 -18.420 1.00 0.00 N ATOM 765 CA GLY D 48 -25.592 11.067 -18.659 1.00 0.00 C ATOM 766 C GLY D 48 -24.286 10.696 -19.359 1.00 0.00 C ATOM 767 O GLY D 48 -24.195 9.693 -20.038 1.00 0.00 O ATOM 0 H GLY D 48 -25.709 12.817 -17.443 1.00 0.00 H new ATOM 0 HA2 GLY D 48 -25.676 10.532 -17.713 1.00 0.00 H new ATOM 0 HA3 GLY D 48 -26.443 10.769 -19.271 1.00 0.00 H new ATOM 771 N SER D 49 -23.271 11.500 -19.198 1.00 0.00 N ATOM 772 CA SER D 49 -21.968 11.194 -19.855 1.00 0.00 C ATOM 773 C SER D 49 -21.115 10.345 -18.914 1.00 0.00 C ATOM 774 O SER D 49 -21.293 10.362 -17.713 1.00 0.00 O ATOM 775 CB SER D 49 -21.240 12.498 -20.176 1.00 0.00 C ATOM 776 OG SER D 49 -22.192 13.543 -20.323 1.00 0.00 O ATOM 0 H SER D 49 -23.287 12.354 -18.641 1.00 0.00 H new ATOM 0 HA SER D 49 -22.144 10.644 -20.780 1.00 0.00 H new ATOM 0 HB2 SER D 49 -20.536 12.741 -19.380 1.00 0.00 H new ATOM 0 HB3 SER D 49 -20.659 12.388 -21.092 1.00 0.00 H new ATOM 0 HG SER D 49 -21.725 14.400 -20.416 1.00 0.00 H new ATOM 782 N VAL D 50 -20.191 9.599 -19.450 1.00 0.00 N ATOM 783 CA VAL D 50 -19.330 8.750 -18.580 1.00 0.00 C ATOM 784 C VAL D 50 -17.860 9.134 -18.770 1.00 0.00 C ATOM 785 O VAL D 50 -17.370 9.227 -19.878 1.00 0.00 O ATOM 786 CB VAL D 50 -19.515 7.276 -18.944 1.00 0.00 C ATOM 787 CG1 VAL D 50 -19.065 6.403 -17.772 1.00 0.00 C ATOM 788 CG2 VAL D 50 -20.990 7.002 -19.244 1.00 0.00 C ATOM 0 H VAL D 50 -19.995 9.540 -20.449 1.00 0.00 H new ATOM 0 HA VAL D 50 -19.617 8.907 -17.540 1.00 0.00 H new ATOM 0 HB VAL D 50 -18.917 7.043 -19.825 1.00 0.00 H new ATOM 0 HG11 VAL D 50 -19.196 5.352 -18.030 1.00 0.00 H new ATOM 0 HG12 VAL D 50 -18.014 6.596 -17.557 1.00 0.00 H new ATOM 0 HG13 VAL D 50 -19.664 6.638 -16.892 1.00 0.00 H new ATOM 0 HG21 VAL D 50 -21.119 5.951 -19.503 1.00 0.00 H new ATOM 0 HG22 VAL D 50 -21.590 7.235 -18.364 1.00 0.00 H new ATOM 0 HG23 VAL D 50 -21.313 7.624 -20.079 1.00 0.00 H new ATOM 798 N TYR D 51 -17.155 9.347 -17.695 1.00 0.00 N ATOM 799 CA TYR D 51 -15.715 9.712 -17.801 1.00 0.00 C ATOM 800 C TYR D 51 -14.930 8.932 -16.746 1.00 0.00 C ATOM 801 O TYR D 51 -14.609 9.445 -15.693 1.00 0.00 O ATOM 802 CB TYR D 51 -15.547 11.215 -17.560 1.00 0.00 C ATOM 803 CG TYR D 51 -14.085 11.582 -17.658 1.00 0.00 C ATOM 804 CD1 TYR D 51 -13.431 11.527 -18.894 1.00 0.00 C ATOM 805 CD2 TYR D 51 -13.385 11.979 -16.512 1.00 0.00 C ATOM 806 CE1 TYR D 51 -12.076 11.868 -18.985 1.00 0.00 C ATOM 807 CE2 TYR D 51 -12.030 12.321 -16.603 1.00 0.00 C ATOM 808 CZ TYR D 51 -11.376 12.266 -17.840 1.00 0.00 C ATOM 809 OH TYR D 51 -10.041 12.602 -17.930 1.00 0.00 O ATOM 0 H TYR D 51 -17.516 9.284 -16.743 1.00 0.00 H new ATOM 0 HA TYR D 51 -15.343 9.467 -18.796 1.00 0.00 H new ATOM 0 HB2 TYR D 51 -16.124 11.778 -18.294 1.00 0.00 H new ATOM 0 HB3 TYR D 51 -15.934 11.482 -16.577 1.00 0.00 H new ATOM 0 HD1 TYR D 51 -13.971 11.222 -19.778 1.00 0.00 H new ATOM 0 HD2 TYR D 51 -13.890 12.021 -15.558 1.00 0.00 H new ATOM 0 HE1 TYR D 51 -11.571 11.824 -19.939 1.00 0.00 H new ATOM 0 HE2 TYR D 51 -11.490 12.627 -15.719 1.00 0.00 H new ATOM 0 HH TYR D 51 -9.640 12.590 -17.036 1.00 0.00 H new ATOM 819 N ALA D 52 -14.630 7.691 -17.017 1.00 0.00 N ATOM 820 CA ALA D 52 -13.881 6.870 -16.025 1.00 0.00 C ATOM 821 C ALA D 52 -12.395 7.216 -16.081 1.00 0.00 C ATOM 822 O ALA D 52 -11.835 7.441 -17.135 1.00 0.00 O ATOM 823 CB ALA D 52 -14.073 5.388 -16.349 1.00 0.00 C ATOM 0 H ALA D 52 -14.872 7.210 -17.884 1.00 0.00 H new ATOM 0 HA ALA D 52 -14.259 7.080 -15.024 1.00 0.00 H new ATOM 0 HB1 ALA D 52 -13.526 4.784 -15.625 1.00 0.00 H new ATOM 0 HB2 ALA D 52 -15.133 5.140 -16.302 1.00 0.00 H new ATOM 0 HB3 ALA D 52 -13.696 5.183 -17.351 1.00 0.00 H new ATOM 829 N GLU D 53 -11.753 7.259 -14.945 1.00 0.00 N ATOM 830 CA GLU D 53 -10.301 7.588 -14.916 1.00 0.00 C ATOM 831 C GLU D 53 -9.577 6.606 -13.999 1.00 0.00 C ATOM 832 O GLU D 53 -10.161 6.026 -13.104 1.00 0.00 O ATOM 833 CB GLU D 53 -10.111 9.009 -14.385 1.00 0.00 C ATOM 834 CG GLU D 53 -10.212 10.005 -15.541 1.00 0.00 C ATOM 835 CD GLU D 53 -8.815 10.505 -15.907 1.00 0.00 C ATOM 836 OE1 GLU D 53 -7.928 9.678 -16.047 1.00 0.00 O ATOM 837 OE2 GLU D 53 -8.654 11.707 -16.043 1.00 0.00 O ATOM 0 H GLU D 53 -12.174 7.080 -14.033 1.00 0.00 H new ATOM 0 HA GLU D 53 -9.892 7.517 -15.924 1.00 0.00 H new ATOM 0 HB2 GLU D 53 -10.868 9.231 -13.633 1.00 0.00 H new ATOM 0 HB3 GLU D 53 -9.140 9.099 -13.897 1.00 0.00 H new ATOM 0 HG2 GLU D 53 -10.678 9.530 -16.405 1.00 0.00 H new ATOM 0 HG3 GLU D 53 -10.847 10.844 -15.258 1.00 0.00 H new ATOM 844 N GLU D 54 -8.305 6.424 -14.210 1.00 0.00 N ATOM 845 CA GLU D 54 -7.535 5.489 -13.346 1.00 0.00 C ATOM 846 C GLU D 54 -6.572 6.295 -12.478 1.00 0.00 C ATOM 847 O GLU D 54 -5.784 7.079 -12.970 1.00 0.00 O ATOM 848 CB GLU D 54 -6.745 4.512 -14.218 1.00 0.00 C ATOM 849 CG GLU D 54 -6.062 3.473 -13.328 1.00 0.00 C ATOM 850 CD GLU D 54 -7.086 2.431 -12.877 1.00 0.00 C ATOM 851 OE1 GLU D 54 -7.796 2.701 -11.922 1.00 0.00 O ATOM 852 OE2 GLU D 54 -7.143 1.380 -13.493 1.00 0.00 O ATOM 0 H GLU D 54 -7.765 6.882 -14.944 1.00 0.00 H new ATOM 0 HA GLU D 54 -8.220 4.926 -12.712 1.00 0.00 H new ATOM 0 HB2 GLU D 54 -7.411 4.019 -14.926 1.00 0.00 H new ATOM 0 HB3 GLU D 54 -6.000 5.051 -14.804 1.00 0.00 H new ATOM 0 HG2 GLU D 54 -5.252 2.989 -13.873 1.00 0.00 H new ATOM 0 HG3 GLU D 54 -5.617 3.959 -12.460 1.00 0.00 H new ATOM 859 N VAL D 55 -6.634 6.111 -11.190 1.00 0.00 N ATOM 860 CA VAL D 55 -5.729 6.868 -10.281 1.00 0.00 C ATOM 861 C VAL D 55 -5.371 5.972 -9.100 1.00 0.00 C ATOM 862 O VAL D 55 -6.096 5.881 -8.129 1.00 0.00 O ATOM 863 CB VAL D 55 -6.425 8.142 -9.773 1.00 0.00 C ATOM 864 CG1 VAL D 55 -5.555 9.358 -10.095 1.00 0.00 C ATOM 865 CG2 VAL D 55 -7.791 8.311 -10.451 1.00 0.00 C ATOM 0 H VAL D 55 -7.274 5.467 -10.725 1.00 0.00 H new ATOM 0 HA VAL D 55 -4.828 7.160 -10.821 1.00 0.00 H new ATOM 0 HB VAL D 55 -6.569 8.058 -8.696 1.00 0.00 H new ATOM 0 HG11 VAL D 55 -6.046 10.262 -9.736 1.00 0.00 H new ATOM 0 HG12 VAL D 55 -4.587 9.252 -9.606 1.00 0.00 H new ATOM 0 HG13 VAL D 55 -5.411 9.427 -11.173 1.00 0.00 H new ATOM 0 HG21 VAL D 55 -8.271 9.217 -10.081 1.00 0.00 H new ATOM 0 HG22 VAL D 55 -7.655 8.387 -11.530 1.00 0.00 H new ATOM 0 HG23 VAL D 55 -8.419 7.449 -10.224 1.00 0.00 H new ATOM 875 N LYS D 56 -4.264 5.297 -9.186 1.00 0.00 N ATOM 876 CA LYS D 56 -3.857 4.387 -8.083 1.00 0.00 C ATOM 877 C LYS D 56 -2.361 4.579 -7.802 1.00 0.00 C ATOM 878 O LYS D 56 -1.557 4.536 -8.711 1.00 0.00 O ATOM 879 CB LYS D 56 -4.140 2.942 -8.516 1.00 0.00 C ATOM 880 CG LYS D 56 -3.403 1.946 -7.613 1.00 0.00 C ATOM 881 CD LYS D 56 -4.268 1.623 -6.394 1.00 0.00 C ATOM 882 CE LYS D 56 -3.427 0.875 -5.359 1.00 0.00 C ATOM 883 NZ LYS D 56 -4.043 -0.455 -5.084 1.00 0.00 N ATOM 0 H LYS D 56 -3.620 5.336 -9.976 1.00 0.00 H new ATOM 0 HA LYS D 56 -4.416 4.608 -7.174 1.00 0.00 H new ATOM 0 HB2 LYS D 56 -5.212 2.750 -8.477 1.00 0.00 H new ATOM 0 HB3 LYS D 56 -3.828 2.801 -9.551 1.00 0.00 H new ATOM 0 HG2 LYS D 56 -3.181 1.033 -8.166 1.00 0.00 H new ATOM 0 HG3 LYS D 56 -2.449 2.366 -7.294 1.00 0.00 H new ATOM 0 HD2 LYS D 56 -4.664 2.542 -5.962 1.00 0.00 H new ATOM 0 HD3 LYS D 56 -5.123 1.016 -6.691 1.00 0.00 H new ATOM 0 HE2 LYS D 56 -2.409 0.747 -5.726 1.00 0.00 H new ATOM 0 HE3 LYS D 56 -3.363 1.455 -4.439 1.00 0.00 H new ATOM 0 HZ1 LYS D 56 -3.471 -0.964 -4.380 1.00 0.00 H new ATOM 0 HZ2 LYS D 56 -5.007 -0.322 -4.716 1.00 0.00 H new ATOM 0 HZ3 LYS D 56 -4.082 -1.008 -5.964 1.00 0.00 H new ATOM 897 N PRO D 57 -2.030 4.786 -6.550 1.00 0.00 N ATOM 898 CA PRO D 57 -0.635 4.989 -6.124 1.00 0.00 C ATOM 899 C PRO D 57 0.103 3.648 -6.069 1.00 0.00 C ATOM 900 O PRO D 57 -0.503 2.596 -6.091 1.00 0.00 O ATOM 901 CB PRO D 57 -0.768 5.600 -4.727 1.00 0.00 C ATOM 902 CG PRO D 57 -2.167 5.193 -4.205 1.00 0.00 C ATOM 903 CD PRO D 57 -3.010 4.835 -5.444 1.00 0.00 C ATOM 0 HA PRO D 57 -0.065 5.622 -6.804 1.00 0.00 H new ATOM 0 HB2 PRO D 57 0.016 5.231 -4.065 1.00 0.00 H new ATOM 0 HB3 PRO D 57 -0.668 6.685 -4.766 1.00 0.00 H new ATOM 0 HG2 PRO D 57 -2.095 4.343 -3.526 1.00 0.00 H new ATOM 0 HG3 PRO D 57 -2.625 6.009 -3.647 1.00 0.00 H new ATOM 0 HD2 PRO D 57 -3.516 3.878 -5.318 1.00 0.00 H new ATOM 0 HD3 PRO D 57 -3.782 5.582 -5.629 1.00 0.00 H new ATOM 911 N PHE D 58 1.405 3.678 -5.999 1.00 0.00 N ATOM 912 CA PHE D 58 2.174 2.402 -5.945 1.00 0.00 C ATOM 913 C PHE D 58 3.455 2.608 -5.130 1.00 0.00 C ATOM 914 O PHE D 58 4.103 3.629 -5.249 1.00 0.00 O ATOM 915 CB PHE D 58 2.552 1.976 -7.364 1.00 0.00 C ATOM 916 CG PHE D 58 3.221 0.623 -7.332 1.00 0.00 C ATOM 917 CD1 PHE D 58 4.583 0.524 -7.024 1.00 0.00 C ATOM 918 CD2 PHE D 58 2.481 -0.533 -7.611 1.00 0.00 C ATOM 919 CE1 PHE D 58 5.205 -0.730 -6.996 1.00 0.00 C ATOM 920 CE2 PHE D 58 3.103 -1.787 -7.583 1.00 0.00 C ATOM 921 CZ PHE D 58 4.465 -1.886 -7.275 1.00 0.00 C ATOM 0 H PHE D 58 1.969 4.528 -5.977 1.00 0.00 H new ATOM 0 HA PHE D 58 1.560 1.632 -5.477 1.00 0.00 H new ATOM 0 HB2 PHE D 58 1.661 1.936 -7.991 1.00 0.00 H new ATOM 0 HB3 PHE D 58 3.222 2.712 -7.808 1.00 0.00 H new ATOM 0 HD1 PHE D 58 5.154 1.415 -6.808 1.00 0.00 H new ATOM 0 HD2 PHE D 58 1.430 -0.457 -7.848 1.00 0.00 H new ATOM 0 HE1 PHE D 58 6.256 -0.806 -6.759 1.00 0.00 H new ATOM 0 HE2 PHE D 58 2.532 -2.678 -7.799 1.00 0.00 H new ATOM 0 HZ PHE D 58 4.945 -2.853 -7.253 1.00 0.00 H new ATOM 931 N PRO D 59 3.792 1.624 -4.339 1.00 0.00 N ATOM 932 CA PRO D 59 3.001 0.388 -4.197 1.00 0.00 C ATOM 933 C PRO D 59 1.834 0.615 -3.232 1.00 0.00 C ATOM 934 O PRO D 59 1.588 1.721 -2.794 1.00 0.00 O ATOM 935 CB PRO D 59 4.004 -0.610 -3.615 1.00 0.00 C ATOM 936 CG PRO D 59 5.109 0.231 -2.935 1.00 0.00 C ATOM 937 CD PRO D 59 5.013 1.653 -3.516 1.00 0.00 C ATOM 0 HA PRO D 59 2.561 0.046 -5.133 1.00 0.00 H new ATOM 0 HB2 PRO D 59 3.521 -1.272 -2.896 1.00 0.00 H new ATOM 0 HB3 PRO D 59 4.423 -1.242 -4.398 1.00 0.00 H new ATOM 0 HG2 PRO D 59 4.972 0.246 -1.854 1.00 0.00 H new ATOM 0 HG3 PRO D 59 6.093 -0.198 -3.126 1.00 0.00 H new ATOM 0 HD2 PRO D 59 4.944 2.402 -2.727 1.00 0.00 H new ATOM 0 HD3 PRO D 59 5.891 1.899 -4.114 1.00 0.00 H new ATOM 1088 N GLN E 3 14.222 12.779 -10.079 1.00 0.00 N ATOM 1089 CA GLN E 3 14.342 11.755 -11.153 1.00 0.00 C ATOM 1090 C GLN E 3 12.951 11.267 -11.555 1.00 0.00 C ATOM 1091 O GLN E 3 12.273 10.600 -10.800 1.00 0.00 O ATOM 1092 CB GLN E 3 15.169 10.573 -10.644 1.00 0.00 C ATOM 1093 CG GLN E 3 16.400 10.389 -11.537 1.00 0.00 C ATOM 1094 CD GLN E 3 17.586 11.140 -10.931 1.00 0.00 C ATOM 1095 OE1 GLN E 3 18.222 11.934 -11.596 1.00 0.00 O ATOM 1096 NE2 GLN E 3 17.913 10.924 -9.686 1.00 0.00 N ATOM 0 HA GLN E 3 14.835 12.197 -12.019 1.00 0.00 H new ATOM 0 HB2 GLN E 3 15.477 10.748 -9.613 1.00 0.00 H new ATOM 0 HB3 GLN E 3 14.566 9.665 -10.647 1.00 0.00 H new ATOM 0 HG2 GLN E 3 16.638 9.330 -11.633 1.00 0.00 H new ATOM 0 HG3 GLN E 3 16.194 10.762 -12.540 1.00 0.00 H new ATOM 0 HE21 GLN E 3 17.380 10.258 -9.127 1.00 0.00 H new ATOM 0 HE22 GLN E 3 18.702 11.421 -9.272 1.00 0.00 H new ATOM 1105 N ARG E 4 12.524 11.588 -12.743 1.00 0.00 N ATOM 1106 CA ARG E 4 11.181 11.135 -13.201 1.00 0.00 C ATOM 1107 C ARG E 4 11.362 10.068 -14.281 1.00 0.00 C ATOM 1108 O ARG E 4 11.792 10.351 -15.382 1.00 0.00 O ATOM 1109 CB ARG E 4 10.409 12.324 -13.778 1.00 0.00 C ATOM 1110 CG ARG E 4 10.455 13.493 -12.791 1.00 0.00 C ATOM 1111 CD ARG E 4 9.537 13.196 -11.604 1.00 0.00 C ATOM 1112 NE ARG E 4 8.963 14.471 -11.089 1.00 0.00 N ATOM 1113 CZ ARG E 4 7.676 14.683 -11.155 1.00 0.00 C ATOM 1114 NH1 ARG E 4 7.160 15.233 -12.219 1.00 0.00 N ATOM 1115 NH2 ARG E 4 6.907 14.342 -10.157 1.00 0.00 N ATOM 0 H ARG E 4 13.047 12.145 -13.418 1.00 0.00 H new ATOM 0 HA ARG E 4 10.623 10.720 -12.361 1.00 0.00 H new ATOM 0 HB2 ARG E 4 10.842 12.623 -14.732 1.00 0.00 H new ATOM 0 HB3 ARG E 4 9.375 12.039 -13.973 1.00 0.00 H new ATOM 0 HG2 ARG E 4 11.476 13.650 -12.444 1.00 0.00 H new ATOM 0 HG3 ARG E 4 10.142 14.413 -13.285 1.00 0.00 H new ATOM 0 HD2 ARG E 4 8.737 12.522 -11.909 1.00 0.00 H new ATOM 0 HD3 ARG E 4 10.096 12.692 -10.816 1.00 0.00 H new ATOM 0 HE ARG E 4 9.576 15.179 -10.685 1.00 0.00 H new ATOM 0 HH11 ARG E 4 7.762 15.497 -12.999 1.00 0.00 H new ATOM 0 HH12 ARG E 4 6.155 15.399 -12.271 1.00 0.00 H new ATOM 0 HH21 ARG E 4 7.311 13.910 -9.326 1.00 0.00 H new ATOM 0 HH22 ARG E 4 5.902 14.507 -10.208 1.00 0.00 H new ATOM 1129 N ILE E 5 11.044 8.840 -13.976 1.00 0.00 N ATOM 1130 CA ILE E 5 11.206 7.757 -14.982 1.00 0.00 C ATOM 1131 C ILE E 5 10.019 6.800 -14.884 1.00 0.00 C ATOM 1132 O ILE E 5 9.411 6.660 -13.844 1.00 0.00 O ATOM 1133 CB ILE E 5 12.502 6.995 -14.706 1.00 0.00 C ATOM 1134 CG1 ILE E 5 13.597 7.985 -14.300 1.00 0.00 C ATOM 1135 CG2 ILE E 5 12.936 6.247 -15.967 1.00 0.00 C ATOM 1136 CD1 ILE E 5 13.573 8.180 -12.783 1.00 0.00 C ATOM 0 H ILE E 5 10.679 8.541 -13.072 1.00 0.00 H new ATOM 0 HA ILE E 5 11.247 8.188 -15.982 1.00 0.00 H new ATOM 0 HB ILE E 5 12.337 6.280 -13.900 1.00 0.00 H new ATOM 0 HG12 ILE E 5 14.572 7.613 -14.614 1.00 0.00 H new ATOM 0 HG13 ILE E 5 13.443 8.940 -14.802 1.00 0.00 H new ATOM 0 HG21 ILE E 5 13.860 5.704 -15.768 1.00 0.00 H new ATOM 0 HG22 ILE E 5 12.157 5.542 -16.258 1.00 0.00 H new ATOM 0 HG23 ILE E 5 13.101 6.960 -16.775 1.00 0.00 H new ATOM 0 HD11 ILE E 5 14.353 8.885 -12.494 1.00 0.00 H new ATOM 0 HD12 ILE E 5 12.601 8.571 -12.482 1.00 0.00 H new ATOM 0 HD13 ILE E 5 13.748 7.224 -12.290 1.00 0.00 H new ATOM 1148 N THR E 6 9.683 6.142 -15.957 1.00 0.00 N ATOM 1149 CA THR E 6 8.533 5.199 -15.919 1.00 0.00 C ATOM 1150 C THR E 6 8.959 3.896 -15.241 1.00 0.00 C ATOM 1151 O THR E 6 10.108 3.506 -15.290 1.00 0.00 O ATOM 1152 CB THR E 6 8.068 4.907 -17.347 1.00 0.00 C ATOM 1153 OG1 THR E 6 7.947 6.131 -18.061 1.00 0.00 O ATOM 1154 CG2 THR E 6 6.713 4.199 -17.308 1.00 0.00 C ATOM 0 H THR E 6 10.155 6.217 -16.858 1.00 0.00 H new ATOM 0 HA THR E 6 7.715 5.647 -15.355 1.00 0.00 H new ATOM 0 HB THR E 6 8.795 4.266 -17.845 1.00 0.00 H new ATOM 0 HG1 THR E 6 7.651 5.947 -18.977 1.00 0.00 H new ATOM 0 HG21 THR E 6 6.382 3.991 -18.325 1.00 0.00 H new ATOM 0 HG22 THR E 6 6.808 3.262 -16.759 1.00 0.00 H new ATOM 0 HG23 THR E 6 5.983 4.838 -16.812 1.00 0.00 H new ATOM 1162 N LEU E 7 8.039 3.220 -14.611 1.00 0.00 N ATOM 1163 CA LEU E 7 8.379 1.939 -13.928 1.00 0.00 C ATOM 1164 C LEU E 7 9.069 1.003 -14.920 1.00 0.00 C ATOM 1165 O LEU E 7 9.737 0.062 -14.541 1.00 0.00 O ATOM 1166 CB LEU E 7 7.095 1.280 -13.419 1.00 0.00 C ATOM 1167 CG LEU E 7 7.423 -0.092 -12.827 1.00 0.00 C ATOM 1168 CD1 LEU E 7 8.364 0.078 -11.634 1.00 0.00 C ATOM 1169 CD2 LEU E 7 6.131 -0.767 -12.364 1.00 0.00 C ATOM 0 H LEU E 7 7.061 3.501 -14.539 1.00 0.00 H new ATOM 0 HA LEU E 7 9.046 2.138 -13.089 1.00 0.00 H new ATOM 0 HB2 LEU E 7 6.625 1.910 -12.664 1.00 0.00 H new ATOM 0 HB3 LEU E 7 6.380 1.174 -14.235 1.00 0.00 H new ATOM 0 HG LEU E 7 7.906 -0.709 -13.585 1.00 0.00 H new ATOM 0 HD11 LEU E 7 8.597 -0.900 -11.212 1.00 0.00 H new ATOM 0 HD12 LEU E 7 9.284 0.561 -11.962 1.00 0.00 H new ATOM 0 HD13 LEU E 7 7.882 0.694 -10.875 1.00 0.00 H new ATOM 0 HD21 LEU E 7 6.362 -1.745 -11.942 1.00 0.00 H new ATOM 0 HD22 LEU E 7 5.649 -0.149 -11.606 1.00 0.00 H new ATOM 0 HD23 LEU E 7 5.459 -0.888 -13.214 1.00 0.00 H new ATOM 1181 N LYS E 8 8.903 1.247 -16.189 1.00 0.00 N ATOM 1182 CA LYS E 8 9.537 0.366 -17.208 1.00 0.00 C ATOM 1183 C LYS E 8 10.978 0.818 -17.464 1.00 0.00 C ATOM 1184 O LYS E 8 11.861 0.013 -17.683 1.00 0.00 O ATOM 1185 CB LYS E 8 8.728 0.439 -18.506 1.00 0.00 C ATOM 1186 CG LYS E 8 9.041 1.746 -19.241 1.00 0.00 C ATOM 1187 CD LYS E 8 8.129 1.878 -20.463 1.00 0.00 C ATOM 1188 CE LYS E 8 8.555 0.869 -21.530 1.00 0.00 C ATOM 1189 NZ LYS E 8 8.051 1.309 -22.861 1.00 0.00 N ATOM 0 H LYS E 8 8.354 2.020 -16.565 1.00 0.00 H new ATOM 0 HA LYS E 8 9.552 -0.662 -16.845 1.00 0.00 H new ATOM 0 HB2 LYS E 8 8.967 -0.413 -19.143 1.00 0.00 H new ATOM 0 HB3 LYS E 8 7.662 0.382 -18.285 1.00 0.00 H new ATOM 0 HG2 LYS E 8 8.896 2.595 -18.573 1.00 0.00 H new ATOM 0 HG3 LYS E 8 10.086 1.760 -19.551 1.00 0.00 H new ATOM 0 HD2 LYS E 8 7.092 1.704 -20.176 1.00 0.00 H new ATOM 0 HD3 LYS E 8 8.183 2.891 -20.863 1.00 0.00 H new ATOM 0 HE2 LYS E 8 9.641 0.783 -21.551 1.00 0.00 H new ATOM 0 HE3 LYS E 8 8.162 -0.119 -21.289 1.00 0.00 H new ATOM 0 HZ1 LYS E 8 8.341 0.622 -23.586 1.00 0.00 H new ATOM 0 HZ2 LYS E 8 7.013 1.369 -22.837 1.00 0.00 H new ATOM 0 HZ3 LYS E 8 8.447 2.243 -23.091 1.00 0.00 H new ATOM 1203 N ASP E 9 11.221 2.099 -17.440 1.00 0.00 N ATOM 1204 CA ASP E 9 12.604 2.600 -17.684 1.00 0.00 C ATOM 1205 C ASP E 9 13.463 2.358 -16.442 1.00 0.00 C ATOM 1206 O ASP E 9 14.670 2.244 -16.523 1.00 0.00 O ATOM 1207 CB ASP E 9 12.557 4.099 -17.984 1.00 0.00 C ATOM 1208 CG ASP E 9 12.401 4.315 -19.489 1.00 0.00 C ATOM 1209 OD1 ASP E 9 11.287 4.198 -19.972 1.00 0.00 O ATOM 1210 OD2 ASP E 9 13.398 4.594 -20.134 1.00 0.00 O ATOM 0 H ASP E 9 10.523 2.821 -17.262 1.00 0.00 H new ATOM 0 HA ASP E 9 13.036 2.071 -18.533 1.00 0.00 H new ATOM 0 HB2 ASP E 9 11.725 4.561 -17.452 1.00 0.00 H new ATOM 0 HB3 ASP E 9 13.469 4.580 -17.630 1.00 0.00 H new ATOM 1215 N TYR E 10 12.851 2.282 -15.294 1.00 0.00 N ATOM 1216 CA TYR E 10 13.632 2.052 -14.048 1.00 0.00 C ATOM 1217 C TYR E 10 13.890 0.554 -13.876 1.00 0.00 C ATOM 1218 O TYR E 10 14.911 0.145 -13.362 1.00 0.00 O ATOM 1219 CB TYR E 10 12.839 2.578 -12.849 1.00 0.00 C ATOM 1220 CG TYR E 10 13.699 2.513 -11.610 1.00 0.00 C ATOM 1221 CD1 TYR E 10 15.028 2.948 -11.658 1.00 0.00 C ATOM 1222 CD2 TYR E 10 13.166 2.016 -10.415 1.00 0.00 C ATOM 1223 CE1 TYR E 10 15.825 2.886 -10.510 1.00 0.00 C ATOM 1224 CE2 TYR E 10 13.964 1.954 -9.267 1.00 0.00 C ATOM 1225 CZ TYR E 10 15.294 2.388 -9.314 1.00 0.00 C ATOM 1226 OH TYR E 10 16.079 2.327 -8.182 1.00 0.00 O ATOM 0 H TYR E 10 11.843 2.369 -15.165 1.00 0.00 H new ATOM 0 HA TYR E 10 14.585 2.577 -14.112 1.00 0.00 H new ATOM 0 HB2 TYR E 10 12.522 3.605 -13.031 1.00 0.00 H new ATOM 0 HB3 TYR E 10 11.935 1.985 -12.709 1.00 0.00 H new ATOM 0 HD1 TYR E 10 15.438 3.331 -12.581 1.00 0.00 H new ATOM 0 HD2 TYR E 10 12.140 1.681 -10.379 1.00 0.00 H new ATOM 0 HE1 TYR E 10 16.851 3.222 -10.546 1.00 0.00 H new ATOM 0 HE2 TYR E 10 13.553 1.571 -8.344 1.00 0.00 H new ATOM 0 HH TYR E 10 15.556 1.958 -7.440 1.00 0.00 H new ATOM 1236 N ALA E 11 12.973 -0.267 -14.304 1.00 0.00 N ATOM 1237 CA ALA E 11 13.167 -1.739 -14.165 1.00 0.00 C ATOM 1238 C ALA E 11 13.984 -2.262 -15.348 1.00 0.00 C ATOM 1239 O ALA E 11 14.598 -3.309 -15.275 1.00 0.00 O ATOM 1240 CB ALA E 11 11.804 -2.434 -14.141 1.00 0.00 C ATOM 0 H ALA E 11 12.097 0.016 -14.744 1.00 0.00 H new ATOM 0 HA ALA E 11 13.698 -1.948 -13.236 1.00 0.00 H new ATOM 0 HB1 ALA E 11 11.946 -3.510 -14.039 1.00 0.00 H new ATOM 0 HB2 ALA E 11 11.222 -2.064 -13.297 1.00 0.00 H new ATOM 0 HB3 ALA E 11 11.272 -2.224 -15.069 1.00 0.00 H new ATOM 1246 N MET E 12 13.997 -1.544 -16.438 1.00 0.00 N ATOM 1247 CA MET E 12 14.771 -2.006 -17.624 1.00 0.00 C ATOM 1248 C MET E 12 16.196 -1.455 -17.552 1.00 0.00 C ATOM 1249 O MET E 12 17.152 -2.135 -17.871 1.00 0.00 O ATOM 1250 CB MET E 12 14.096 -1.502 -18.901 1.00 0.00 C ATOM 1251 CG MET E 12 12.863 -2.358 -19.199 1.00 0.00 C ATOM 1252 SD MET E 12 13.197 -3.422 -20.626 1.00 0.00 S ATOM 1253 CE MET E 12 11.993 -2.674 -21.750 1.00 0.00 C ATOM 0 H MET E 12 13.505 -0.658 -16.558 1.00 0.00 H new ATOM 0 HA MET E 12 14.803 -3.095 -17.633 1.00 0.00 H new ATOM 0 HB2 MET E 12 13.807 -0.457 -18.784 1.00 0.00 H new ATOM 0 HB3 MET E 12 14.794 -1.548 -19.737 1.00 0.00 H new ATOM 0 HG2 MET E 12 12.610 -2.966 -18.330 1.00 0.00 H new ATOM 0 HG3 MET E 12 12.004 -1.719 -19.402 1.00 0.00 H new ATOM 0 HE1 MET E 12 12.027 -3.185 -22.712 1.00 0.00 H new ATOM 0 HE2 MET E 12 10.993 -2.766 -21.326 1.00 0.00 H new ATOM 0 HE3 MET E 12 12.232 -1.620 -21.890 1.00 0.00 H new ATOM 1263 N ARG E 13 16.346 -0.230 -17.140 1.00 0.00 N ATOM 1264 CA ARG E 13 17.707 0.366 -17.053 1.00 0.00 C ATOM 1265 C ARG E 13 18.355 -0.014 -15.718 1.00 0.00 C ATOM 1266 O ARG E 13 19.562 0.006 -15.578 1.00 0.00 O ATOM 1267 CB ARG E 13 17.606 1.890 -17.154 1.00 0.00 C ATOM 1268 CG ARG E 13 17.378 2.291 -18.613 1.00 0.00 C ATOM 1269 CD ARG E 13 18.314 3.444 -18.979 1.00 0.00 C ATOM 1270 NE ARG E 13 17.683 4.275 -20.043 1.00 0.00 N ATOM 1271 CZ ARG E 13 17.801 5.574 -20.011 1.00 0.00 C ATOM 1272 NH1 ARG E 13 17.222 6.257 -19.062 1.00 0.00 N ATOM 1273 NH2 ARG E 13 18.496 6.190 -20.929 1.00 0.00 N ATOM 0 H ARG E 13 15.584 0.387 -16.859 1.00 0.00 H new ATOM 0 HA ARG E 13 18.318 -0.014 -17.872 1.00 0.00 H new ATOM 0 HB2 ARG E 13 16.786 2.253 -16.534 1.00 0.00 H new ATOM 0 HB3 ARG E 13 18.519 2.351 -16.777 1.00 0.00 H new ATOM 0 HG2 ARG E 13 17.560 1.439 -19.268 1.00 0.00 H new ATOM 0 HG3 ARG E 13 16.340 2.590 -18.761 1.00 0.00 H new ATOM 0 HD2 ARG E 13 18.519 4.054 -18.099 1.00 0.00 H new ATOM 0 HD3 ARG E 13 19.271 3.054 -19.326 1.00 0.00 H new ATOM 0 HE ARG E 13 17.159 3.829 -20.796 1.00 0.00 H new ATOM 0 HH11 ARG E 13 16.678 5.775 -18.346 1.00 0.00 H new ATOM 0 HH12 ARG E 13 17.314 7.273 -19.036 1.00 0.00 H new ATOM 0 HH21 ARG E 13 18.947 5.656 -21.672 1.00 0.00 H new ATOM 0 HH22 ARG E 13 18.588 7.206 -20.903 1.00 0.00 H new ATOM 1287 N PHE E 14 17.568 -0.358 -14.735 1.00 0.00 N ATOM 1288 CA PHE E 14 18.151 -0.732 -13.415 1.00 0.00 C ATOM 1289 C PHE E 14 17.741 -2.163 -13.056 1.00 0.00 C ATOM 1290 O PHE E 14 18.013 -2.643 -11.973 1.00 0.00 O ATOM 1291 CB PHE E 14 17.640 0.232 -12.342 1.00 0.00 C ATOM 1292 CG PHE E 14 17.767 1.651 -12.842 1.00 0.00 C ATOM 1293 CD1 PHE E 14 16.964 2.095 -13.898 1.00 0.00 C ATOM 1294 CD2 PHE E 14 18.692 2.521 -12.250 1.00 0.00 C ATOM 1295 CE1 PHE E 14 17.083 3.410 -14.363 1.00 0.00 C ATOM 1296 CE2 PHE E 14 18.812 3.836 -12.717 1.00 0.00 C ATOM 1297 CZ PHE E 14 18.008 4.281 -13.773 1.00 0.00 C ATOM 0 H PHE E 14 16.550 -0.396 -14.788 1.00 0.00 H new ATOM 0 HA PHE E 14 19.238 -0.673 -13.470 1.00 0.00 H new ATOM 0 HB2 PHE E 14 16.600 0.010 -12.104 1.00 0.00 H new ATOM 0 HB3 PHE E 14 18.211 0.106 -11.422 1.00 0.00 H new ATOM 0 HD1 PHE E 14 16.252 1.423 -14.355 1.00 0.00 H new ATOM 0 HD2 PHE E 14 19.312 2.178 -11.435 1.00 0.00 H new ATOM 0 HE1 PHE E 14 16.461 3.753 -15.177 1.00 0.00 H new ATOM 0 HE2 PHE E 14 19.525 4.507 -12.262 1.00 0.00 H new ATOM 0 HZ PHE E 14 18.101 5.295 -14.133 1.00 0.00 H new ATOM 1307 N GLY E 15 17.090 -2.850 -13.954 1.00 0.00 N ATOM 1308 CA GLY E 15 16.668 -4.248 -13.660 1.00 0.00 C ATOM 1309 C GLY E 15 15.429 -4.232 -12.763 1.00 0.00 C ATOM 1310 O GLY E 15 15.223 -3.319 -11.987 1.00 0.00 O ATOM 0 H GLY E 15 16.832 -2.504 -14.878 1.00 0.00 H new ATOM 0 HA2 GLY E 15 16.450 -4.776 -14.589 1.00 0.00 H new ATOM 0 HA3 GLY E 15 17.478 -4.787 -13.169 1.00 0.00 H new ATOM 1314 N GLN E 16 14.600 -5.235 -12.865 1.00 0.00 N ATOM 1315 CA GLN E 16 13.374 -5.279 -12.020 1.00 0.00 C ATOM 1316 C GLN E 16 13.763 -5.611 -10.578 1.00 0.00 C ATOM 1317 O GLN E 16 13.091 -5.232 -9.640 1.00 0.00 O ATOM 1318 CB GLN E 16 12.425 -6.354 -12.555 1.00 0.00 C ATOM 1319 CG GLN E 16 12.512 -6.399 -14.083 1.00 0.00 C ATOM 1320 CD GLN E 16 11.316 -7.173 -14.640 1.00 0.00 C ATOM 1321 OE1 GLN E 16 10.537 -6.642 -15.406 1.00 0.00 O ATOM 1322 NE2 GLN E 16 11.138 -8.417 -14.287 1.00 0.00 N ATOM 0 H GLN E 16 14.719 -6.026 -13.498 1.00 0.00 H new ATOM 0 HA GLN E 16 12.876 -4.310 -12.048 1.00 0.00 H new ATOM 0 HB2 GLN E 16 12.687 -7.326 -12.137 1.00 0.00 H new ATOM 0 HB3 GLN E 16 11.403 -6.138 -12.245 1.00 0.00 H new ATOM 0 HG2 GLN E 16 12.524 -5.387 -14.487 1.00 0.00 H new ATOM 0 HG3 GLN E 16 13.443 -6.876 -14.391 1.00 0.00 H new ATOM 0 HE21 GLN E 16 11.792 -8.863 -13.644 1.00 0.00 H new ATOM 0 HE22 GLN E 16 10.345 -8.943 -14.654 1.00 0.00 H new ATOM 1331 N THR E 17 14.844 -6.318 -10.396 1.00 0.00 N ATOM 1332 CA THR E 17 15.278 -6.676 -9.015 1.00 0.00 C ATOM 1333 C THR E 17 15.586 -5.401 -8.229 1.00 0.00 C ATOM 1334 O THR E 17 15.239 -5.274 -7.072 1.00 0.00 O ATOM 1335 CB THR E 17 16.535 -7.546 -9.085 1.00 0.00 C ATOM 1336 OG1 THR E 17 16.216 -8.789 -9.696 1.00 0.00 O ATOM 1337 CG2 THR E 17 17.068 -7.790 -7.673 1.00 0.00 C ATOM 0 H THR E 17 15.446 -6.664 -11.143 1.00 0.00 H new ATOM 0 HA THR E 17 14.481 -7.227 -8.516 1.00 0.00 H new ATOM 0 HB THR E 17 17.297 -7.037 -9.675 1.00 0.00 H new ATOM 0 HG1 THR E 17 17.021 -9.346 -9.743 1.00 0.00 H new ATOM 0 HG21 THR E 17 17.963 -8.410 -7.724 1.00 0.00 H new ATOM 0 HG22 THR E 17 17.313 -6.836 -7.207 1.00 0.00 H new ATOM 0 HG23 THR E 17 16.308 -8.299 -7.080 1.00 0.00 H new ATOM 1345 N LYS E 18 16.239 -4.455 -8.847 1.00 0.00 N ATOM 1346 CA LYS E 18 16.571 -3.192 -8.133 1.00 0.00 C ATOM 1347 C LYS E 18 15.295 -2.373 -7.925 1.00 0.00 C ATOM 1348 O LYS E 18 15.050 -1.848 -6.858 1.00 0.00 O ATOM 1349 CB LYS E 18 17.571 -2.388 -8.963 1.00 0.00 C ATOM 1350 CG LYS E 18 18.967 -2.994 -8.805 1.00 0.00 C ATOM 1351 CD LYS E 18 19.985 -2.133 -9.552 1.00 0.00 C ATOM 1352 CE LYS E 18 20.774 -3.007 -10.529 1.00 0.00 C ATOM 1353 NZ LYS E 18 22.233 -2.769 -10.346 1.00 0.00 N ATOM 0 H LYS E 18 16.556 -4.503 -9.815 1.00 0.00 H new ATOM 0 HA LYS E 18 17.011 -3.425 -7.163 1.00 0.00 H new ATOM 0 HB2 LYS E 18 17.277 -2.394 -10.013 1.00 0.00 H new ATOM 0 HB3 LYS E 18 17.576 -1.347 -8.639 1.00 0.00 H new ATOM 0 HG2 LYS E 18 19.231 -3.054 -7.749 1.00 0.00 H new ATOM 0 HG3 LYS E 18 18.979 -4.012 -9.195 1.00 0.00 H new ATOM 0 HD2 LYS E 18 19.476 -1.335 -10.092 1.00 0.00 H new ATOM 0 HD3 LYS E 18 20.663 -1.657 -8.844 1.00 0.00 H new ATOM 0 HE2 LYS E 18 20.543 -4.059 -10.360 1.00 0.00 H new ATOM 0 HE3 LYS E 18 20.484 -2.777 -11.554 1.00 0.00 H new ATOM 0 HZ1 LYS E 18 22.768 -3.364 -11.011 1.00 0.00 H new ATOM 0 HZ2 LYS E 18 22.447 -1.768 -10.528 1.00 0.00 H new ATOM 0 HZ3 LYS E 18 22.504 -3.009 -9.371 1.00 0.00 H new ATOM 1367 N THR E 19 14.481 -2.265 -8.936 1.00 0.00 N ATOM 1368 CA THR E 19 13.219 -1.483 -8.796 1.00 0.00 C ATOM 1369 C THR E 19 12.338 -2.133 -7.725 1.00 0.00 C ATOM 1370 O THR E 19 11.507 -1.489 -7.114 1.00 0.00 O ATOM 1371 CB THR E 19 12.472 -1.469 -10.132 1.00 0.00 C ATOM 1372 OG1 THR E 19 13.354 -1.045 -11.162 1.00 0.00 O ATOM 1373 CG2 THR E 19 11.283 -0.509 -10.046 1.00 0.00 C ATOM 0 H THR E 19 14.633 -2.684 -9.854 1.00 0.00 H new ATOM 0 HA THR E 19 13.455 -0.460 -8.505 1.00 0.00 H new ATOM 0 HB THR E 19 12.109 -2.472 -10.355 1.00 0.00 H new ATOM 0 HG1 THR E 19 13.454 -0.071 -11.126 1.00 0.00 H new ATOM 0 HG21 THR E 19 10.753 -0.501 -10.998 1.00 0.00 H new ATOM 0 HG22 THR E 19 10.607 -0.837 -9.257 1.00 0.00 H new ATOM 0 HG23 THR E 19 11.642 0.495 -9.822 1.00 0.00 H new ATOM 1381 N ALA E 20 12.513 -3.406 -7.495 1.00 0.00 N ATOM 1382 CA ALA E 20 11.687 -4.099 -6.466 1.00 0.00 C ATOM 1383 C ALA E 20 12.342 -3.946 -5.093 1.00 0.00 C ATOM 1384 O ALA E 20 11.682 -3.977 -4.074 1.00 0.00 O ATOM 1385 CB ALA E 20 11.581 -5.584 -6.815 1.00 0.00 C ATOM 0 H ALA E 20 13.192 -3.996 -7.975 1.00 0.00 H new ATOM 0 HA ALA E 20 10.691 -3.656 -6.444 1.00 0.00 H new ATOM 0 HB1 ALA E 20 10.977 -6.092 -6.063 1.00 0.00 H new ATOM 0 HB2 ALA E 20 11.112 -5.695 -7.793 1.00 0.00 H new ATOM 0 HB3 ALA E 20 12.578 -6.024 -6.838 1.00 0.00 H new ATOM 1391 N LYS E 21 13.636 -3.783 -5.056 1.00 0.00 N ATOM 1392 CA LYS E 21 14.327 -3.629 -3.745 1.00 0.00 C ATOM 1393 C LYS E 21 14.034 -2.239 -3.183 1.00 0.00 C ATOM 1394 O LYS E 21 13.872 -2.061 -1.992 1.00 0.00 O ATOM 1395 CB LYS E 21 15.836 -3.793 -3.940 1.00 0.00 C ATOM 1396 CG LYS E 21 16.412 -4.626 -2.793 1.00 0.00 C ATOM 1397 CD LYS E 21 16.183 -3.900 -1.466 1.00 0.00 C ATOM 1398 CE LYS E 21 17.056 -4.534 -0.382 1.00 0.00 C ATOM 1399 NZ LYS E 21 18.372 -3.838 -0.334 1.00 0.00 N ATOM 0 H LYS E 21 14.243 -3.750 -5.875 1.00 0.00 H new ATOM 0 HA LYS E 21 13.968 -4.389 -3.051 1.00 0.00 H new ATOM 0 HB2 LYS E 21 16.039 -4.279 -4.894 1.00 0.00 H new ATOM 0 HB3 LYS E 21 16.318 -2.816 -3.971 1.00 0.00 H new ATOM 0 HG2 LYS E 21 15.938 -5.607 -2.769 1.00 0.00 H new ATOM 0 HG3 LYS E 21 17.478 -4.791 -2.950 1.00 0.00 H new ATOM 0 HD2 LYS E 21 16.425 -2.842 -1.571 1.00 0.00 H new ATOM 0 HD3 LYS E 21 15.132 -3.960 -1.183 1.00 0.00 H new ATOM 0 HE2 LYS E 21 16.560 -4.464 0.586 1.00 0.00 H new ATOM 0 HE3 LYS E 21 17.201 -5.594 -0.590 1.00 0.00 H new ATOM 0 HZ1 LYS E 21 18.966 -4.269 0.403 1.00 0.00 H new ATOM 0 HZ2 LYS E 21 18.845 -3.927 -1.256 1.00 0.00 H new ATOM 0 HZ3 LYS E 21 18.225 -2.832 -0.116 1.00 0.00 H new ATOM 1413 N ASP E 22 13.962 -1.254 -4.032 1.00 0.00 N ATOM 1414 CA ASP E 22 13.674 0.124 -3.551 1.00 0.00 C ATOM 1415 C ASP E 22 12.182 0.247 -3.252 1.00 0.00 C ATOM 1416 O ASP E 22 11.782 0.762 -2.227 1.00 0.00 O ATOM 1417 CB ASP E 22 14.064 1.135 -4.632 1.00 0.00 C ATOM 1418 CG ASP E 22 13.060 1.075 -5.783 1.00 0.00 C ATOM 1419 OD1 ASP E 22 13.094 0.105 -6.521 1.00 0.00 O ATOM 1420 OD2 ASP E 22 12.275 2.000 -5.909 1.00 0.00 O ATOM 0 H ASP E 22 14.090 -1.344 -5.040 1.00 0.00 H new ATOM 0 HA ASP E 22 14.248 0.325 -2.646 1.00 0.00 H new ATOM 0 HB2 ASP E 22 14.089 2.140 -4.211 1.00 0.00 H new ATOM 0 HB3 ASP E 22 15.067 0.919 -5.000 1.00 0.00 H new ATOM 1425 N LEU E 23 11.361 -0.227 -4.143 1.00 0.00 N ATOM 1426 CA LEU E 23 9.892 -0.148 -3.919 1.00 0.00 C ATOM 1427 C LEU E 23 9.466 -1.267 -2.965 1.00 0.00 C ATOM 1428 O LEU E 23 8.364 -1.277 -2.453 1.00 0.00 O ATOM 1429 CB LEU E 23 9.165 -0.298 -5.257 1.00 0.00 C ATOM 1430 CG LEU E 23 9.281 1.011 -6.044 1.00 0.00 C ATOM 1431 CD1 LEU E 23 9.681 0.709 -7.488 1.00 0.00 C ATOM 1432 CD2 LEU E 23 7.933 1.735 -6.030 1.00 0.00 C ATOM 0 H LEU E 23 11.643 -0.667 -5.019 1.00 0.00 H new ATOM 0 HA LEU E 23 9.636 0.816 -3.480 1.00 0.00 H new ATOM 0 HB2 LEU E 23 9.597 -1.119 -5.829 1.00 0.00 H new ATOM 0 HB3 LEU E 23 8.116 -0.543 -5.089 1.00 0.00 H new ATOM 0 HG LEU E 23 10.040 1.643 -5.583 1.00 0.00 H new ATOM 0 HD11 LEU E 23 9.763 1.642 -8.046 1.00 0.00 H new ATOM 0 HD12 LEU E 23 10.642 0.194 -7.499 1.00 0.00 H new ATOM 0 HD13 LEU E 23 8.924 0.075 -7.950 1.00 0.00 H new ATOM 0 HD21 LEU E 23 8.015 2.667 -6.590 1.00 0.00 H new ATOM 0 HD22 LEU E 23 7.175 1.101 -6.489 1.00 0.00 H new ATOM 0 HD23 LEU E 23 7.648 1.954 -5.001 1.00 0.00 H new ATOM 1444 N GLY E 24 10.340 -2.204 -2.711 1.00 0.00 N ATOM 1445 CA GLY E 24 9.997 -3.316 -1.780 1.00 0.00 C ATOM 1446 C GLY E 24 8.806 -4.112 -2.321 1.00 0.00 C ATOM 1447 O GLY E 24 7.955 -4.552 -1.575 1.00 0.00 O ATOM 0 H GLY E 24 11.278 -2.247 -3.109 1.00 0.00 H new ATOM 0 HA2 GLY E 24 10.857 -3.974 -1.656 1.00 0.00 H new ATOM 0 HA3 GLY E 24 9.758 -2.915 -0.795 1.00 0.00 H new ATOM 1451 N VAL E 25 8.740 -4.310 -3.609 1.00 0.00 N ATOM 1452 CA VAL E 25 7.604 -5.089 -4.181 1.00 0.00 C ATOM 1453 C VAL E 25 8.121 -6.431 -4.698 1.00 0.00 C ATOM 1454 O VAL E 25 9.254 -6.803 -4.466 1.00 0.00 O ATOM 1455 CB VAL E 25 6.955 -4.311 -5.331 1.00 0.00 C ATOM 1456 CG1 VAL E 25 5.800 -3.467 -4.792 1.00 0.00 C ATOM 1457 CG2 VAL E 25 7.990 -3.395 -5.987 1.00 0.00 C ATOM 0 H VAL E 25 9.420 -3.968 -4.288 1.00 0.00 H new ATOM 0 HA VAL E 25 6.858 -5.256 -3.404 1.00 0.00 H new ATOM 0 HB VAL E 25 6.577 -5.017 -6.071 1.00 0.00 H new ATOM 0 HG11 VAL E 25 5.340 -2.915 -5.611 1.00 0.00 H new ATOM 0 HG12 VAL E 25 5.057 -4.118 -4.331 1.00 0.00 H new ATOM 0 HG13 VAL E 25 6.178 -2.765 -4.049 1.00 0.00 H new ATOM 0 HG21 VAL E 25 7.523 -2.845 -6.804 1.00 0.00 H new ATOM 0 HG22 VAL E 25 8.374 -2.692 -5.248 1.00 0.00 H new ATOM 0 HG23 VAL E 25 8.812 -3.995 -6.377 1.00 0.00 H new ATOM 1467 N TYR E 26 7.299 -7.163 -5.395 1.00 0.00 N ATOM 1468 CA TYR E 26 7.740 -8.487 -5.925 1.00 0.00 C ATOM 1469 C TYR E 26 8.102 -8.345 -7.405 1.00 0.00 C ATOM 1470 O TYR E 26 7.582 -7.497 -8.102 1.00 0.00 O ATOM 1471 CB TYR E 26 6.613 -9.522 -5.775 1.00 0.00 C ATOM 1472 CG TYR E 26 5.544 -9.000 -4.840 1.00 0.00 C ATOM 1473 CD1 TYR E 26 5.836 -8.793 -3.487 1.00 0.00 C ATOM 1474 CD2 TYR E 26 4.263 -8.720 -5.331 1.00 0.00 C ATOM 1475 CE1 TYR E 26 4.848 -8.305 -2.625 1.00 0.00 C ATOM 1476 CE2 TYR E 26 3.275 -8.232 -4.469 1.00 0.00 C ATOM 1477 CZ TYR E 26 3.567 -8.025 -3.115 1.00 0.00 C ATOM 1478 OH TYR E 26 2.592 -7.544 -2.266 1.00 0.00 O ATOM 0 H TYR E 26 6.339 -6.903 -5.622 1.00 0.00 H new ATOM 0 HA TYR E 26 8.609 -8.824 -5.360 1.00 0.00 H new ATOM 0 HB2 TYR E 26 6.178 -9.740 -6.750 1.00 0.00 H new ATOM 0 HB3 TYR E 26 7.018 -10.458 -5.390 1.00 0.00 H new ATOM 0 HD1 TYR E 26 6.824 -9.010 -3.108 1.00 0.00 H new ATOM 0 HD2 TYR E 26 4.038 -8.881 -6.375 1.00 0.00 H new ATOM 0 HE1 TYR E 26 5.074 -8.144 -1.581 1.00 0.00 H new ATOM 0 HE2 TYR E 26 2.287 -8.015 -4.848 1.00 0.00 H new ATOM 0 HH TYR E 26 1.762 -7.402 -2.768 1.00 0.00 H new ATOM 1488 N GLN E 27 8.989 -9.169 -7.891 1.00 0.00 N ATOM 1489 CA GLN E 27 9.380 -9.081 -9.326 1.00 0.00 C ATOM 1490 C GLN E 27 8.179 -9.441 -10.204 1.00 0.00 C ATOM 1491 O GLN E 27 8.146 -9.140 -11.380 1.00 0.00 O ATOM 1492 CB GLN E 27 10.526 -10.055 -9.606 1.00 0.00 C ATOM 1493 CG GLN E 27 11.646 -9.830 -8.590 1.00 0.00 C ATOM 1494 CD GLN E 27 11.550 -10.883 -7.484 1.00 0.00 C ATOM 1495 OE1 GLN E 27 11.583 -12.067 -7.753 1.00 0.00 O ATOM 1496 NE2 GLN E 27 11.431 -10.499 -6.243 1.00 0.00 N ATOM 0 H GLN E 27 9.460 -9.899 -7.357 1.00 0.00 H new ATOM 0 HA GLN E 27 9.705 -8.065 -9.551 1.00 0.00 H new ATOM 0 HB2 GLN E 27 10.167 -11.082 -9.546 1.00 0.00 H new ATOM 0 HB3 GLN E 27 10.903 -9.908 -10.618 1.00 0.00 H new ATOM 0 HG2 GLN E 27 12.616 -9.892 -9.083 1.00 0.00 H new ATOM 0 HG3 GLN E 27 11.569 -8.830 -8.163 1.00 0.00 H new ATOM 0 HE21 GLN E 27 11.403 -9.505 -6.017 1.00 0.00 H new ATOM 0 HE22 GLN E 27 11.366 -11.193 -5.498 1.00 0.00 H new ATOM 1505 N SER E 28 7.192 -10.083 -9.641 1.00 0.00 N ATOM 1506 CA SER E 28 5.994 -10.461 -10.444 1.00 0.00 C ATOM 1507 C SER E 28 5.055 -9.259 -10.555 1.00 0.00 C ATOM 1508 O SER E 28 4.231 -9.181 -11.444 1.00 0.00 O ATOM 1509 CB SER E 28 5.264 -11.615 -9.757 1.00 0.00 C ATOM 1510 OG SER E 28 5.219 -12.733 -10.634 1.00 0.00 O ATOM 0 H SER E 28 7.163 -10.362 -8.660 1.00 0.00 H new ATOM 0 HA SER E 28 6.308 -10.771 -11.441 1.00 0.00 H new ATOM 0 HB2 SER E 28 5.775 -11.884 -8.832 1.00 0.00 H new ATOM 0 HB3 SER E 28 4.253 -11.311 -9.486 1.00 0.00 H new ATOM 0 HG SER E 28 4.753 -13.475 -10.195 1.00 0.00 H new ATOM 1516 N ALA E 29 5.178 -8.314 -9.662 1.00 0.00 N ATOM 1517 CA ALA E 29 4.299 -7.114 -9.721 1.00 0.00 C ATOM 1518 C ALA E 29 4.934 -6.093 -10.657 1.00 0.00 C ATOM 1519 O ALA E 29 4.261 -5.321 -11.311 1.00 0.00 O ATOM 1520 CB ALA E 29 4.162 -6.510 -8.321 1.00 0.00 C ATOM 0 H ALA E 29 5.850 -8.323 -8.895 1.00 0.00 H new ATOM 0 HA ALA E 29 3.311 -7.392 -10.087 1.00 0.00 H new ATOM 0 HB1 ALA E 29 3.518 -5.631 -8.365 1.00 0.00 H new ATOM 0 HB2 ALA E 29 3.724 -7.247 -7.648 1.00 0.00 H new ATOM 0 HB3 ALA E 29 5.146 -6.221 -7.952 1.00 0.00 H new ATOM 1526 N ILE E 30 6.236 -6.093 -10.727 1.00 0.00 N ATOM 1527 CA ILE E 30 6.938 -5.136 -11.619 1.00 0.00 C ATOM 1528 C ILE E 30 6.887 -5.664 -13.053 1.00 0.00 C ATOM 1529 O ILE E 30 6.764 -4.913 -14.002 1.00 0.00 O ATOM 1530 CB ILE E 30 8.392 -5.009 -11.168 1.00 0.00 C ATOM 1531 CG1 ILE E 30 8.452 -4.208 -9.865 1.00 0.00 C ATOM 1532 CG2 ILE E 30 9.200 -4.289 -12.245 1.00 0.00 C ATOM 1533 CD1 ILE E 30 9.812 -4.421 -9.196 1.00 0.00 C ATOM 0 H ILE E 30 6.845 -6.719 -10.201 1.00 0.00 H new ATOM 0 HA ILE E 30 6.458 -4.159 -11.574 1.00 0.00 H new ATOM 0 HB ILE E 30 8.810 -6.003 -11.005 1.00 0.00 H new ATOM 0 HG12 ILE E 30 8.298 -3.149 -10.070 1.00 0.00 H new ATOM 0 HG13 ILE E 30 7.652 -4.523 -9.195 1.00 0.00 H new ATOM 0 HG21 ILE E 30 10.237 -4.199 -11.922 1.00 0.00 H new ATOM 0 HG22 ILE E 30 9.157 -4.858 -13.174 1.00 0.00 H new ATOM 0 HG23 ILE E 30 8.783 -3.295 -12.409 1.00 0.00 H new ATOM 0 HD11 ILE E 30 9.854 -3.850 -8.268 1.00 0.00 H new ATOM 0 HD12 ILE E 30 9.948 -5.480 -8.977 1.00 0.00 H new ATOM 0 HD13 ILE E 30 10.604 -4.084 -9.865 1.00 0.00 H new ATOM 1545 N ASN E 31 6.971 -6.955 -13.214 1.00 0.00 N ATOM 1546 CA ASN E 31 6.921 -7.541 -14.582 1.00 0.00 C ATOM 1547 C ASN E 31 5.479 -7.507 -15.090 1.00 0.00 C ATOM 1548 O ASN E 31 5.229 -7.316 -16.263 1.00 0.00 O ATOM 1549 CB ASN E 31 7.414 -8.989 -14.536 1.00 0.00 C ATOM 1550 CG ASN E 31 7.713 -9.473 -15.955 1.00 0.00 C ATOM 1551 OD1 ASN E 31 7.273 -10.533 -16.353 1.00 0.00 O ATOM 1552 ND2 ASN E 31 8.447 -8.735 -16.741 1.00 0.00 N ATOM 0 H ASN E 31 7.072 -7.630 -12.456 1.00 0.00 H new ATOM 0 HA ASN E 31 7.559 -6.965 -15.252 1.00 0.00 H new ATOM 0 HB2 ASN E 31 8.311 -9.059 -13.920 1.00 0.00 H new ATOM 0 HB3 ASN E 31 6.660 -9.626 -14.075 1.00 0.00 H new ATOM 0 HD21 ASN E 31 8.652 -9.048 -17.690 1.00 0.00 H new ATOM 0 HD22 ASN E 31 8.816 -7.845 -16.407 1.00 0.00 H new ATOM 1559 N LYS E 32 4.528 -7.685 -14.214 1.00 0.00 N ATOM 1560 CA LYS E 32 3.104 -7.656 -14.650 1.00 0.00 C ATOM 1561 C LYS E 32 2.687 -6.206 -14.900 1.00 0.00 C ATOM 1562 O LYS E 32 1.909 -5.917 -15.787 1.00 0.00 O ATOM 1563 CB LYS E 32 2.221 -8.261 -13.558 1.00 0.00 C ATOM 1564 CG LYS E 32 2.254 -9.787 -13.667 1.00 0.00 C ATOM 1565 CD LYS E 32 1.862 -10.403 -12.323 1.00 0.00 C ATOM 1566 CE LYS E 32 0.886 -11.558 -12.559 1.00 0.00 C ATOM 1567 NZ LYS E 32 1.321 -12.336 -13.754 1.00 0.00 N ATOM 0 H LYS E 32 4.675 -7.849 -13.218 1.00 0.00 H new ATOM 0 HA LYS E 32 2.989 -8.235 -15.566 1.00 0.00 H new ATOM 0 HB2 LYS E 32 2.573 -7.948 -12.575 1.00 0.00 H new ATOM 0 HB3 LYS E 32 1.198 -7.900 -13.660 1.00 0.00 H new ATOM 0 HG2 LYS E 32 1.569 -10.121 -14.446 1.00 0.00 H new ATOM 0 HG3 LYS E 32 3.251 -10.120 -13.955 1.00 0.00 H new ATOM 0 HD2 LYS E 32 2.750 -10.763 -11.803 1.00 0.00 H new ATOM 0 HD3 LYS E 32 1.402 -9.648 -11.685 1.00 0.00 H new ATOM 0 HE2 LYS E 32 0.852 -12.205 -11.682 1.00 0.00 H new ATOM 0 HE3 LYS E 32 -0.122 -11.172 -12.710 1.00 0.00 H new ATOM 0 HZ1 LYS E 32 1.019 -13.326 -13.652 1.00 0.00 H new ATOM 0 HZ2 LYS E 32 0.891 -11.929 -14.609 1.00 0.00 H new ATOM 0 HZ3 LYS E 32 2.357 -12.297 -13.836 1.00 0.00 H new ATOM 1581 N ALA E 33 3.206 -5.291 -14.128 1.00 0.00 N ATOM 1582 CA ALA E 33 2.847 -3.860 -14.326 1.00 0.00 C ATOM 1583 C ALA E 33 3.340 -3.408 -15.700 1.00 0.00 C ATOM 1584 O ALA E 33 2.657 -2.705 -16.417 1.00 0.00 O ATOM 1585 CB ALA E 33 3.510 -3.009 -13.239 1.00 0.00 C ATOM 0 H ALA E 33 3.863 -5.473 -13.369 1.00 0.00 H new ATOM 0 HA ALA E 33 1.765 -3.741 -14.265 1.00 0.00 H new ATOM 0 HB1 ALA E 33 3.246 -1.962 -13.385 1.00 0.00 H new ATOM 0 HB2 ALA E 33 3.164 -3.337 -12.259 1.00 0.00 H new ATOM 0 HB3 ALA E 33 4.593 -3.122 -13.298 1.00 0.00 H new ATOM 1591 N ILE E 34 4.520 -3.816 -16.072 1.00 0.00 N ATOM 1592 CA ILE E 34 5.061 -3.422 -17.403 1.00 0.00 C ATOM 1593 C ILE E 34 4.367 -4.247 -18.488 1.00 0.00 C ATOM 1594 O ILE E 34 4.163 -3.791 -19.596 1.00 0.00 O ATOM 1595 CB ILE E 34 6.568 -3.690 -17.441 1.00 0.00 C ATOM 1596 CG1 ILE E 34 7.295 -2.634 -16.604 1.00 0.00 C ATOM 1597 CG2 ILE E 34 7.066 -3.623 -18.886 1.00 0.00 C ATOM 1598 CD1 ILE E 34 8.422 -3.298 -15.812 1.00 0.00 C ATOM 0 H ILE E 34 5.135 -4.406 -15.511 1.00 0.00 H new ATOM 0 HA ILE E 34 4.880 -2.361 -17.576 1.00 0.00 H new ATOM 0 HB ILE E 34 6.769 -4.681 -17.034 1.00 0.00 H new ATOM 0 HG12 ILE E 34 7.700 -1.857 -17.252 1.00 0.00 H new ATOM 0 HG13 ILE E 34 6.595 -2.149 -15.924 1.00 0.00 H new ATOM 0 HG21 ILE E 34 8.139 -3.814 -18.910 1.00 0.00 H new ATOM 0 HG22 ILE E 34 6.550 -4.374 -19.484 1.00 0.00 H new ATOM 0 HG23 ILE E 34 6.864 -2.633 -19.295 1.00 0.00 H new ATOM 0 HD11 ILE E 34 8.940 -2.546 -15.216 1.00 0.00 H new ATOM 0 HD12 ILE E 34 8.004 -4.059 -15.153 1.00 0.00 H new ATOM 0 HD13 ILE E 34 9.127 -3.763 -16.502 1.00 0.00 H new ATOM 1610 N HIS E 35 4.001 -5.459 -18.176 1.00 0.00 N ATOM 1611 CA HIS E 35 3.318 -6.316 -19.185 1.00 0.00 C ATOM 1612 C HIS E 35 1.971 -5.691 -19.548 1.00 0.00 C ATOM 1613 O HIS E 35 1.497 -5.816 -20.661 1.00 0.00 O ATOM 1614 CB HIS E 35 3.095 -7.712 -18.600 1.00 0.00 C ATOM 1615 CG HIS E 35 4.330 -8.545 -18.803 1.00 0.00 C ATOM 1616 ND1 HIS E 35 5.524 -8.279 -19.429 1.00 0.00 N flip ATOM 1617 CD2 HIS E 35 4.433 -9.843 -18.327 1.00 0.00 C flip ATOM 1618 CE1 HIS E 35 6.355 -9.393 -19.343 1.00 0.00 C flip ATOM 1619 NE2 HIS E 35 5.649 -10.306 -18.670 1.00 0.00 N flip ATOM 0 H HIS E 35 4.146 -5.894 -17.265 1.00 0.00 H new ATOM 0 HA HIS E 35 3.936 -6.394 -20.079 1.00 0.00 H new ATOM 0 HB2 HIS E 35 2.863 -7.640 -17.537 1.00 0.00 H new ATOM 0 HB3 HIS E 35 2.240 -8.187 -19.081 1.00 0.00 H new ATOM 0 HD2 HIS E 35 3.675 -10.384 -17.780 1.00 0.00 H new ATOM 0 HE1 HIS E 35 7.356 -9.497 -19.736 1.00 0.00 H new ATOM 0 HE2 HIS E 35 5.990 -11.240 -18.444 1.00 0.00 H new ATOM 1627 N ALA E 36 1.351 -5.016 -18.619 1.00 0.00 N ATOM 1628 CA ALA E 36 0.036 -4.381 -18.909 1.00 0.00 C ATOM 1629 C ALA E 36 0.250 -3.173 -19.824 1.00 0.00 C ATOM 1630 O ALA E 36 -0.637 -2.762 -20.546 1.00 0.00 O ATOM 1631 CB ALA E 36 -0.610 -3.920 -17.600 1.00 0.00 C ATOM 0 H ALA E 36 1.700 -4.877 -17.671 1.00 0.00 H new ATOM 0 HA ALA E 36 -0.617 -5.102 -19.400 1.00 0.00 H new ATOM 0 HB1 ALA E 36 -1.573 -3.455 -17.813 1.00 0.00 H new ATOM 0 HB2 ALA E 36 -0.759 -4.779 -16.945 1.00 0.00 H new ATOM 0 HB3 ALA E 36 0.041 -3.197 -17.108 1.00 0.00 H new ATOM 1637 N GLY E 37 1.424 -2.601 -19.797 1.00 0.00 N ATOM 1638 CA GLY E 37 1.700 -1.421 -20.664 1.00 0.00 C ATOM 1639 C GLY E 37 0.810 -0.251 -20.239 1.00 0.00 C ATOM 1640 O GLY E 37 0.533 0.644 -21.013 1.00 0.00 O ATOM 0 H GLY E 37 2.204 -2.901 -19.211 1.00 0.00 H new ATOM 0 HA2 GLY E 37 2.750 -1.139 -20.587 1.00 0.00 H new ATOM 0 HA3 GLY E 37 1.513 -1.673 -21.708 1.00 0.00 H new ATOM 1644 N ARG E 38 0.360 -0.248 -19.013 1.00 0.00 N ATOM 1645 CA ARG E 38 -0.512 0.864 -18.543 1.00 0.00 C ATOM 1646 C ARG E 38 0.330 2.127 -18.350 1.00 0.00 C ATOM 1647 O ARG E 38 1.383 2.278 -18.937 1.00 0.00 O ATOM 1648 CB ARG E 38 -1.160 0.476 -17.212 1.00 0.00 C ATOM 1649 CG ARG E 38 -2.638 0.872 -17.229 1.00 0.00 C ATOM 1650 CD ARG E 38 -3.478 -0.311 -17.712 1.00 0.00 C ATOM 1651 NE ARG E 38 -3.356 -1.435 -16.740 1.00 0.00 N ATOM 1652 CZ ARG E 38 -4.092 -1.449 -15.662 1.00 0.00 C ATOM 1653 NH1 ARG E 38 -4.823 -0.412 -15.353 1.00 0.00 N ATOM 1654 NH2 ARG E 38 -4.100 -2.502 -14.891 1.00 0.00 N ATOM 0 H ARG E 38 0.559 -0.967 -18.318 1.00 0.00 H new ATOM 0 HA ARG E 38 -1.288 1.054 -19.284 1.00 0.00 H new ATOM 0 HB2 ARG E 38 -1.062 -0.597 -17.047 1.00 0.00 H new ATOM 0 HB3 ARG E 38 -0.649 0.973 -16.388 1.00 0.00 H new ATOM 0 HG2 ARG E 38 -2.956 1.174 -16.231 1.00 0.00 H new ATOM 0 HG3 ARG E 38 -2.788 1.730 -17.885 1.00 0.00 H new ATOM 0 HD2 ARG E 38 -4.522 -0.013 -17.811 1.00 0.00 H new ATOM 0 HD3 ARG E 38 -3.142 -0.631 -18.699 1.00 0.00 H new ATOM 0 HE ARG E 38 -2.697 -2.193 -16.917 1.00 0.00 H new ATOM 0 HH11 ARG E 38 -4.820 0.412 -15.955 1.00 0.00 H new ATOM 0 HH12 ARG E 38 -5.397 -0.426 -14.510 1.00 0.00 H new ATOM 0 HH21 ARG E 38 -3.531 -3.314 -15.131 1.00 0.00 H new ATOM 0 HH22 ARG E 38 -4.675 -2.513 -14.049 1.00 0.00 H new ATOM 1668 N LYS E 39 -0.126 3.037 -17.532 1.00 0.00 N ATOM 1669 CA LYS E 39 0.650 4.289 -17.301 1.00 0.00 C ATOM 1670 C LYS E 39 1.180 4.303 -15.873 1.00 0.00 C ATOM 1671 O LYS E 39 0.726 5.051 -15.031 1.00 0.00 O ATOM 1672 CB LYS E 39 -0.251 5.504 -17.528 1.00 0.00 C ATOM 1673 CG LYS E 39 0.122 6.180 -18.850 1.00 0.00 C ATOM 1674 CD LYS E 39 -0.011 5.176 -19.997 1.00 0.00 C ATOM 1675 CE LYS E 39 -0.961 5.733 -21.059 1.00 0.00 C ATOM 1676 NZ LYS E 39 -0.418 7.014 -21.593 1.00 0.00 N ATOM 0 H LYS E 39 -1.002 2.967 -17.014 1.00 0.00 H new ATOM 0 HA LYS E 39 1.487 4.329 -17.998 1.00 0.00 H new ATOM 0 HB2 LYS E 39 -1.296 5.196 -17.548 1.00 0.00 H new ATOM 0 HB3 LYS E 39 -0.142 6.209 -16.704 1.00 0.00 H new ATOM 0 HG2 LYS E 39 -0.527 7.037 -19.027 1.00 0.00 H new ATOM 0 HG3 LYS E 39 1.143 6.558 -18.801 1.00 0.00 H new ATOM 0 HD2 LYS E 39 0.967 4.979 -20.437 1.00 0.00 H new ATOM 0 HD3 LYS E 39 -0.388 4.225 -19.620 1.00 0.00 H new ATOM 0 HE2 LYS E 39 -1.081 5.012 -21.868 1.00 0.00 H new ATOM 0 HE3 LYS E 39 -1.949 5.897 -20.628 1.00 0.00 H new ATOM 0 HZ1 LYS E 39 -0.705 7.125 -22.587 1.00 0.00 H new ATOM 0 HZ2 LYS E 39 -0.790 7.808 -21.034 1.00 0.00 H new ATOM 0 HZ3 LYS E 39 0.620 7.004 -21.531 1.00 0.00 H new ATOM 1690 N ILE E 40 2.155 3.486 -15.605 1.00 0.00 N ATOM 1691 CA ILE E 40 2.745 3.450 -14.239 1.00 0.00 C ATOM 1692 C ILE E 40 3.998 4.317 -14.236 1.00 0.00 C ATOM 1693 O ILE E 40 5.051 3.912 -14.687 1.00 0.00 O ATOM 1694 CB ILE E 40 3.107 2.011 -13.866 1.00 0.00 C ATOM 1695 CG1 ILE E 40 1.828 1.180 -13.742 1.00 0.00 C ATOM 1696 CG2 ILE E 40 3.852 2.003 -12.530 1.00 0.00 C ATOM 1697 CD1 ILE E 40 2.170 -0.213 -13.207 1.00 0.00 C ATOM 0 H ILE E 40 2.571 2.839 -16.274 1.00 0.00 H new ATOM 0 HA ILE E 40 2.027 3.826 -13.511 1.00 0.00 H new ATOM 0 HB ILE E 40 3.745 1.584 -14.640 1.00 0.00 H new ATOM 0 HG12 ILE E 40 1.124 1.675 -13.073 1.00 0.00 H new ATOM 0 HG13 ILE E 40 1.340 1.098 -14.713 1.00 0.00 H new ATOM 0 HG21 ILE E 40 4.110 0.978 -12.264 1.00 0.00 H new ATOM 0 HG22 ILE E 40 4.763 2.596 -12.618 1.00 0.00 H new ATOM 0 HG23 ILE E 40 3.215 2.430 -11.755 1.00 0.00 H new ATOM 0 HD11 ILE E 40 1.258 -0.803 -13.119 1.00 0.00 H new ATOM 0 HD12 ILE E 40 2.858 -0.708 -13.893 1.00 0.00 H new ATOM 0 HD13 ILE E 40 2.638 -0.121 -12.227 1.00 0.00 H new ATOM 1709 N PHE E 41 3.885 5.518 -13.749 1.00 0.00 N ATOM 1710 CA PHE E 41 5.057 6.430 -13.733 1.00 0.00 C ATOM 1711 C PHE E 41 5.877 6.202 -12.461 1.00 0.00 C ATOM 1712 O PHE E 41 5.412 5.607 -11.510 1.00 0.00 O ATOM 1713 CB PHE E 41 4.550 7.871 -13.795 1.00 0.00 C ATOM 1714 CG PHE E 41 3.458 7.960 -14.842 1.00 0.00 C ATOM 1715 CD1 PHE E 41 3.797 8.084 -16.195 1.00 0.00 C ATOM 1716 CD2 PHE E 41 2.108 7.918 -14.463 1.00 0.00 C ATOM 1717 CE1 PHE E 41 2.794 8.168 -17.167 1.00 0.00 C ATOM 1718 CE2 PHE E 41 1.104 8.002 -15.438 1.00 0.00 C ATOM 1719 CZ PHE E 41 1.448 8.127 -16.788 1.00 0.00 C ATOM 0 H PHE E 41 3.027 5.909 -13.360 1.00 0.00 H new ATOM 0 HA PHE E 41 5.700 6.233 -14.590 1.00 0.00 H new ATOM 0 HB2 PHE E 41 4.166 8.178 -12.822 1.00 0.00 H new ATOM 0 HB3 PHE E 41 5.367 8.548 -14.043 1.00 0.00 H new ATOM 0 HD1 PHE E 41 4.836 8.115 -16.489 1.00 0.00 H new ATOM 0 HD2 PHE E 41 1.842 7.821 -13.421 1.00 0.00 H new ATOM 0 HE1 PHE E 41 3.059 8.264 -18.210 1.00 0.00 H new ATOM 0 HE2 PHE E 41 0.065 7.970 -15.147 1.00 0.00 H new ATOM 0 HZ PHE E 41 0.674 8.192 -17.538 1.00 0.00 H new ATOM 1729 N LEU E 42 7.103 6.652 -12.445 1.00 0.00 N ATOM 1730 CA LEU E 42 7.960 6.442 -11.244 1.00 0.00 C ATOM 1731 C LEU E 42 8.586 7.771 -10.812 1.00 0.00 C ATOM 1732 O LEU E 42 9.316 8.393 -11.554 1.00 0.00 O ATOM 1733 CB LEU E 42 9.073 5.452 -11.597 1.00 0.00 C ATOM 1734 CG LEU E 42 9.085 4.295 -10.596 1.00 0.00 C ATOM 1735 CD1 LEU E 42 7.817 3.459 -10.763 1.00 0.00 C ATOM 1736 CD2 LEU E 42 10.306 3.414 -10.865 1.00 0.00 C ATOM 0 H LEU E 42 7.548 7.156 -13.212 1.00 0.00 H new ATOM 0 HA LEU E 42 7.353 6.050 -10.428 1.00 0.00 H new ATOM 0 HB2 LEU E 42 8.922 5.068 -12.606 1.00 0.00 H new ATOM 0 HB3 LEU E 42 10.038 5.960 -11.590 1.00 0.00 H new ATOM 0 HG LEU E 42 9.128 4.691 -9.581 1.00 0.00 H new ATOM 0 HD11 LEU E 42 7.828 2.635 -10.049 1.00 0.00 H new ATOM 0 HD12 LEU E 42 6.943 4.084 -10.583 1.00 0.00 H new ATOM 0 HD13 LEU E 42 7.775 3.060 -11.777 1.00 0.00 H new ATOM 0 HD21 LEU E 42 10.321 2.587 -10.155 1.00 0.00 H new ATOM 0 HD22 LEU E 42 10.254 3.020 -11.880 1.00 0.00 H new ATOM 0 HD23 LEU E 42 11.214 4.006 -10.752 1.00 0.00 H new ATOM 1748 N THR E 43 8.315 8.204 -9.613 1.00 0.00 N ATOM 1749 CA THR E 43 8.907 9.484 -9.132 1.00 0.00 C ATOM 1750 C THR E 43 10.079 9.164 -8.203 1.00 0.00 C ATOM 1751 O THR E 43 10.008 8.261 -7.395 1.00 0.00 O ATOM 1752 CB THR E 43 7.850 10.284 -8.367 1.00 0.00 C ATOM 1753 OG1 THR E 43 6.894 10.797 -9.283 1.00 0.00 O ATOM 1754 CG2 THR E 43 8.521 11.440 -7.623 1.00 0.00 C ATOM 0 H THR E 43 7.709 7.727 -8.945 1.00 0.00 H new ATOM 0 HA THR E 43 9.255 10.074 -9.980 1.00 0.00 H new ATOM 0 HB THR E 43 7.352 9.635 -7.647 1.00 0.00 H new ATOM 0 HG1 THR E 43 6.215 11.308 -8.795 1.00 0.00 H new ATOM 0 HG21 THR E 43 7.767 12.009 -7.079 1.00 0.00 H new ATOM 0 HG22 THR E 43 9.254 11.044 -6.920 1.00 0.00 H new ATOM 0 HG23 THR E 43 9.021 12.092 -8.339 1.00 0.00 H new ATOM 1762 N ILE E 44 11.162 9.884 -8.314 1.00 0.00 N ATOM 1763 CA ILE E 44 12.329 9.594 -7.436 1.00 0.00 C ATOM 1764 C ILE E 44 12.875 10.895 -6.846 1.00 0.00 C ATOM 1765 O ILE E 44 13.254 11.802 -7.561 1.00 0.00 O ATOM 1766 CB ILE E 44 13.422 8.907 -8.258 1.00 0.00 C ATOM 1767 CG1 ILE E 44 12.781 8.081 -9.377 1.00 0.00 C ATOM 1768 CG2 ILE E 44 14.235 7.982 -7.352 1.00 0.00 C ATOM 1769 CD1 ILE E 44 12.016 6.906 -8.767 1.00 0.00 C ATOM 0 H ILE E 44 11.288 10.655 -8.970 1.00 0.00 H new ATOM 0 HA ILE E 44 12.014 8.940 -6.623 1.00 0.00 H new ATOM 0 HB ILE E 44 14.076 9.664 -8.692 1.00 0.00 H new ATOM 0 HG12 ILE E 44 12.105 8.704 -9.963 1.00 0.00 H new ATOM 0 HG13 ILE E 44 13.548 7.715 -10.059 1.00 0.00 H new ATOM 0 HG21 ILE E 44 15.014 7.492 -7.937 1.00 0.00 H new ATOM 0 HG22 ILE E 44 14.694 8.566 -6.554 1.00 0.00 H new ATOM 0 HG23 ILE E 44 13.578 7.228 -6.919 1.00 0.00 H new ATOM 0 HD11 ILE E 44 11.559 6.317 -9.562 1.00 0.00 H new ATOM 0 HD12 ILE E 44 12.704 6.279 -8.200 1.00 0.00 H new ATOM 0 HD13 ILE E 44 11.239 7.284 -8.103 1.00 0.00 H new ATOM 1781 N ASN E 45 12.919 10.992 -5.544 1.00 0.00 N ATOM 1782 CA ASN E 45 13.442 12.232 -4.905 1.00 0.00 C ATOM 1783 C ASN E 45 14.951 12.099 -4.682 1.00 0.00 C ATOM 1784 O ASN E 45 15.460 11.024 -4.421 1.00 0.00 O ATOM 1785 CB ASN E 45 12.745 12.451 -3.560 1.00 0.00 C ATOM 1786 CG ASN E 45 11.231 12.350 -3.748 1.00 0.00 C ATOM 1787 OD1 ASN E 45 10.710 11.286 -4.018 1.00 0.00 O ATOM 1788 ND2 ASN E 45 10.497 13.421 -3.612 1.00 0.00 N ATOM 0 H ASN E 45 12.615 10.265 -4.896 1.00 0.00 H new ATOM 0 HA ASN E 45 13.246 13.083 -5.558 1.00 0.00 H new ATOM 0 HB2 ASN E 45 13.083 11.708 -2.838 1.00 0.00 H new ATOM 0 HB3 ASN E 45 13.008 13.429 -3.157 1.00 0.00 H new ATOM 0 HD21 ASN E 45 9.486 13.365 -3.732 1.00 0.00 H new ATOM 0 HD22 ASN E 45 10.935 14.314 -3.385 1.00 0.00 H new ATOM 1795 N ALA E 46 15.663 13.192 -4.784 1.00 0.00 N ATOM 1796 CA ALA E 46 17.145 13.163 -4.587 1.00 0.00 C ATOM 1797 C ALA E 46 17.512 12.301 -3.375 1.00 0.00 C ATOM 1798 O ALA E 46 18.621 11.814 -3.269 1.00 0.00 O ATOM 1799 CB ALA E 46 17.650 14.589 -4.360 1.00 0.00 C ATOM 0 H ALA E 46 15.278 14.112 -4.997 1.00 0.00 H new ATOM 0 HA ALA E 46 17.609 12.735 -5.476 1.00 0.00 H new ATOM 0 HB1 ALA E 46 18.730 14.574 -4.216 1.00 0.00 H new ATOM 0 HB2 ALA E 46 17.408 15.203 -5.228 1.00 0.00 H new ATOM 0 HB3 ALA E 46 17.172 15.008 -3.475 1.00 0.00 H new ATOM 1805 N ASP E 47 16.602 12.102 -2.461 1.00 0.00 N ATOM 1806 CA ASP E 47 16.916 11.271 -1.265 1.00 0.00 C ATOM 1807 C ASP E 47 16.701 9.790 -1.594 1.00 0.00 C ATOM 1808 O ASP E 47 16.295 9.012 -0.753 1.00 0.00 O ATOM 1809 CB ASP E 47 15.998 11.677 -0.110 1.00 0.00 C ATOM 1810 CG ASP E 47 16.647 12.813 0.681 1.00 0.00 C ATOM 1811 OD1 ASP E 47 16.943 13.833 0.080 1.00 0.00 O ATOM 1812 OD2 ASP E 47 16.838 12.645 1.874 1.00 0.00 O ATOM 0 H ASP E 47 15.655 12.479 -2.491 1.00 0.00 H new ATOM 0 HA ASP E 47 17.956 11.428 -0.978 1.00 0.00 H new ATOM 0 HB2 ASP E 47 15.029 11.995 -0.496 1.00 0.00 H new ATOM 0 HB3 ASP E 47 15.817 10.823 0.542 1.00 0.00 H new ATOM 1817 N GLY E 48 16.967 9.393 -2.809 1.00 0.00 N ATOM 1818 CA GLY E 48 16.777 7.966 -3.186 1.00 0.00 C ATOM 1819 C GLY E 48 15.368 7.527 -2.794 1.00 0.00 C ATOM 1820 O GLY E 48 15.126 6.375 -2.492 1.00 0.00 O ATOM 0 H GLY E 48 17.308 9.997 -3.557 1.00 0.00 H new ATOM 0 HA2 GLY E 48 16.926 7.838 -4.258 1.00 0.00 H new ATOM 0 HA3 GLY E 48 17.518 7.343 -2.685 1.00 0.00 H new ATOM 1824 N SER E 49 14.436 8.438 -2.796 1.00 0.00 N ATOM 1825 CA SER E 49 13.043 8.070 -2.421 1.00 0.00 C ATOM 1826 C SER E 49 12.273 7.656 -3.676 1.00 0.00 C ATOM 1827 O SER E 49 12.500 8.174 -4.749 1.00 0.00 O ATOM 1828 CB SER E 49 12.357 9.273 -1.772 1.00 0.00 C ATOM 1829 OG SER E 49 12.112 8.994 -0.399 1.00 0.00 O ATOM 0 H SER E 49 14.578 9.418 -3.040 1.00 0.00 H new ATOM 0 HA SER E 49 13.061 7.239 -1.716 1.00 0.00 H new ATOM 0 HB2 SER E 49 12.985 10.159 -1.868 1.00 0.00 H new ATOM 0 HB3 SER E 49 11.419 9.490 -2.283 1.00 0.00 H new ATOM 0 HG SER E 49 11.674 9.765 0.018 1.00 0.00 H new ATOM 1835 N VAL E 50 11.364 6.729 -3.555 1.00 0.00 N ATOM 1836 CA VAL E 50 10.588 6.300 -4.754 1.00 0.00 C ATOM 1837 C VAL E 50 9.098 6.538 -4.515 1.00 0.00 C ATOM 1838 O VAL E 50 8.615 6.475 -3.402 1.00 0.00 O ATOM 1839 CB VAL E 50 10.823 4.813 -5.031 1.00 0.00 C ATOM 1840 CG1 VAL E 50 10.208 4.452 -6.383 1.00 0.00 C ATOM 1841 CG2 VAL E 50 12.322 4.526 -5.069 1.00 0.00 C ATOM 0 H VAL E 50 11.125 6.252 -2.685 1.00 0.00 H new ATOM 0 HA VAL E 50 10.920 6.882 -5.614 1.00 0.00 H new ATOM 0 HB VAL E 50 10.361 4.220 -4.242 1.00 0.00 H new ATOM 0 HG11 VAL E 50 10.372 3.394 -6.586 1.00 0.00 H new ATOM 0 HG12 VAL E 50 9.137 4.656 -6.362 1.00 0.00 H new ATOM 0 HG13 VAL E 50 10.675 5.049 -7.166 1.00 0.00 H new ATOM 0 HG21 VAL E 50 12.485 3.466 -5.266 1.00 0.00 H new ATOM 0 HG22 VAL E 50 12.786 5.118 -5.858 1.00 0.00 H new ATOM 0 HG23 VAL E 50 12.767 4.789 -4.109 1.00 0.00 H new ATOM 1851 N TYR E 51 8.369 6.806 -5.560 1.00 0.00 N ATOM 1852 CA TYR E 51 6.908 7.045 -5.420 1.00 0.00 C ATOM 1853 C TYR E 51 6.249 6.826 -6.782 1.00 0.00 C ATOM 1854 O TYR E 51 5.988 7.759 -7.515 1.00 0.00 O ATOM 1855 CB TYR E 51 6.662 8.483 -4.954 1.00 0.00 C ATOM 1856 CG TYR E 51 5.297 8.583 -4.315 1.00 0.00 C ATOM 1857 CD1 TYR E 51 5.024 7.884 -3.132 1.00 0.00 C ATOM 1858 CD2 TYR E 51 4.306 9.378 -4.903 1.00 0.00 C ATOM 1859 CE1 TYR E 51 3.760 7.980 -2.539 1.00 0.00 C ATOM 1860 CE2 TYR E 51 3.040 9.473 -4.309 1.00 0.00 C ATOM 1861 CZ TYR E 51 2.768 8.774 -3.127 1.00 0.00 C ATOM 1862 OH TYR E 51 1.522 8.869 -2.542 1.00 0.00 O ATOM 0 H TYR E 51 8.726 6.870 -6.513 1.00 0.00 H new ATOM 0 HA TYR E 51 6.486 6.359 -4.685 1.00 0.00 H new ATOM 0 HB2 TYR E 51 7.431 8.781 -4.241 1.00 0.00 H new ATOM 0 HB3 TYR E 51 6.729 9.167 -5.800 1.00 0.00 H new ATOM 0 HD1 TYR E 51 5.789 7.271 -2.678 1.00 0.00 H new ATOM 0 HD2 TYR E 51 4.517 9.918 -5.814 1.00 0.00 H new ATOM 0 HE1 TYR E 51 3.550 7.441 -1.627 1.00 0.00 H new ATOM 0 HE2 TYR E 51 2.275 10.085 -4.763 1.00 0.00 H new ATOM 0 HH TYR E 51 0.953 9.461 -3.078 1.00 0.00 H new ATOM 1872 N ALA E 52 5.992 5.596 -7.130 1.00 0.00 N ATOM 1873 CA ALA E 52 5.364 5.314 -8.450 1.00 0.00 C ATOM 1874 C ALA E 52 3.861 5.576 -8.369 1.00 0.00 C ATOM 1875 O ALA E 52 3.243 5.391 -7.340 1.00 0.00 O ATOM 1876 CB ALA E 52 5.614 3.852 -8.824 1.00 0.00 C ATOM 0 H ALA E 52 6.190 4.775 -6.558 1.00 0.00 H new ATOM 0 HA ALA E 52 5.799 5.964 -9.209 1.00 0.00 H new ATOM 0 HB1 ALA E 52 5.156 3.640 -9.790 1.00 0.00 H new ATOM 0 HB2 ALA E 52 6.687 3.670 -8.883 1.00 0.00 H new ATOM 0 HB3 ALA E 52 5.177 3.203 -8.065 1.00 0.00 H new ATOM 1882 N GLU E 53 3.270 6.015 -9.446 1.00 0.00 N ATOM 1883 CA GLU E 53 1.809 6.298 -9.431 1.00 0.00 C ATOM 1884 C GLU E 53 1.151 5.703 -10.670 1.00 0.00 C ATOM 1885 O GLU E 53 1.807 5.302 -11.613 1.00 0.00 O ATOM 1886 CB GLU E 53 1.584 7.811 -9.409 1.00 0.00 C ATOM 1887 CG GLU E 53 1.812 8.339 -7.991 1.00 0.00 C ATOM 1888 CD GLU E 53 1.273 9.767 -7.883 1.00 0.00 C ATOM 1889 OE1 GLU E 53 0.305 10.067 -8.561 1.00 0.00 O ATOM 1890 OE2 GLU E 53 1.838 10.535 -7.121 1.00 0.00 O ATOM 0 H GLU E 53 3.737 6.190 -10.336 1.00 0.00 H new ATOM 0 HA GLU E 53 1.366 5.849 -8.542 1.00 0.00 H new ATOM 0 HB2 GLU E 53 2.265 8.301 -10.105 1.00 0.00 H new ATOM 0 HB3 GLU E 53 0.571 8.044 -9.737 1.00 0.00 H new ATOM 0 HG2 GLU E 53 1.312 7.695 -7.267 1.00 0.00 H new ATOM 0 HG3 GLU E 53 2.875 8.322 -7.752 1.00 0.00 H new ATOM 1897 N GLU E 54 -0.147 5.656 -10.671 1.00 0.00 N ATOM 1898 CA GLU E 54 -0.883 5.102 -11.838 1.00 0.00 C ATOM 1899 C GLU E 54 -1.851 6.167 -12.337 1.00 0.00 C ATOM 1900 O GLU E 54 -2.635 6.705 -11.581 1.00 0.00 O ATOM 1901 CB GLU E 54 -1.661 3.854 -11.412 1.00 0.00 C ATOM 1902 CG GLU E 54 -1.898 2.960 -12.632 1.00 0.00 C ATOM 1903 CD GLU E 54 -1.514 1.520 -12.291 1.00 0.00 C ATOM 1904 OE1 GLU E 54 -1.380 1.226 -11.115 1.00 0.00 O ATOM 1905 OE2 GLU E 54 -1.361 0.735 -13.212 1.00 0.00 O ATOM 0 H GLU E 54 -0.737 5.981 -9.905 1.00 0.00 H new ATOM 0 HA GLU E 54 -0.186 4.826 -12.629 1.00 0.00 H new ATOM 0 HB2 GLU E 54 -1.105 3.308 -10.650 1.00 0.00 H new ATOM 0 HB3 GLU E 54 -2.614 4.141 -10.967 1.00 0.00 H new ATOM 0 HG2 GLU E 54 -2.945 3.007 -12.933 1.00 0.00 H new ATOM 0 HG3 GLU E 54 -1.307 3.315 -13.477 1.00 0.00 H new ATOM 1912 N VAL E 55 -1.791 6.495 -13.594 1.00 0.00 N ATOM 1913 CA VAL E 55 -2.697 7.549 -14.117 1.00 0.00 C ATOM 1914 C VAL E 55 -3.067 7.230 -15.565 1.00 0.00 C ATOM 1915 O VAL E 55 -2.300 7.454 -16.480 1.00 0.00 O ATOM 1916 CB VAL E 55 -1.990 8.910 -14.038 1.00 0.00 C ATOM 1917 CG1 VAL E 55 -2.995 9.971 -13.595 1.00 0.00 C ATOM 1918 CG2 VAL E 55 -0.852 8.855 -13.012 1.00 0.00 C ATOM 0 H VAL E 55 -1.158 6.082 -14.278 1.00 0.00 H new ATOM 0 HA VAL E 55 -3.608 7.584 -13.519 1.00 0.00 H new ATOM 0 HB VAL E 55 -1.583 9.156 -15.019 1.00 0.00 H new ATOM 0 HG11 VAL E 55 -2.499 10.940 -13.537 1.00 0.00 H new ATOM 0 HG12 VAL E 55 -3.811 10.023 -14.316 1.00 0.00 H new ATOM 0 HG13 VAL E 55 -3.394 9.708 -12.615 1.00 0.00 H new ATOM 0 HG21 VAL E 55 -0.358 9.825 -12.964 1.00 0.00 H new ATOM 0 HG22 VAL E 55 -1.258 8.606 -12.031 1.00 0.00 H new ATOM 0 HG23 VAL E 55 -0.130 8.094 -13.310 1.00 0.00 H new ATOM 1928 N LYS E 56 -4.241 6.700 -15.774 1.00 0.00 N ATOM 1929 CA LYS E 56 -4.671 6.352 -17.158 1.00 0.00 C ATOM 1930 C LYS E 56 -6.201 6.465 -17.253 1.00 0.00 C ATOM 1931 O LYS E 56 -6.910 5.861 -16.473 1.00 0.00 O ATOM 1932 CB LYS E 56 -4.232 4.916 -17.459 1.00 0.00 C ATOM 1933 CG LYS E 56 -4.883 4.422 -18.758 1.00 0.00 C ATOM 1934 CD LYS E 56 -3.903 4.593 -19.919 1.00 0.00 C ATOM 1935 CE LYS E 56 -4.388 3.778 -21.120 1.00 0.00 C ATOM 1936 NZ LYS E 56 -3.353 2.770 -21.487 1.00 0.00 N ATOM 0 H LYS E 56 -4.923 6.492 -15.044 1.00 0.00 H new ATOM 0 HA LYS E 56 -4.218 7.031 -17.880 1.00 0.00 H new ATOM 0 HB2 LYS E 56 -3.147 4.871 -17.548 1.00 0.00 H new ATOM 0 HB3 LYS E 56 -4.511 4.262 -16.633 1.00 0.00 H new ATOM 0 HG2 LYS E 56 -5.166 3.374 -18.659 1.00 0.00 H new ATOM 0 HG3 LYS E 56 -5.797 4.982 -18.955 1.00 0.00 H new ATOM 0 HD2 LYS E 56 -3.823 5.646 -20.189 1.00 0.00 H new ATOM 0 HD3 LYS E 56 -2.908 4.264 -19.620 1.00 0.00 H new ATOM 0 HE2 LYS E 56 -5.327 3.280 -20.880 1.00 0.00 H new ATOM 0 HE3 LYS E 56 -4.584 4.438 -21.965 1.00 0.00 H new ATOM 0 HZ1 LYS E 56 -3.682 2.216 -22.303 1.00 0.00 H new ATOM 0 HZ2 LYS E 56 -2.467 3.256 -21.733 1.00 0.00 H new ATOM 0 HZ3 LYS E 56 -3.187 2.134 -20.681 1.00 0.00 H new ATOM 1950 N PRO E 57 -6.667 7.237 -18.205 1.00 0.00 N ATOM 1951 CA PRO E 57 -8.112 7.450 -18.418 1.00 0.00 C ATOM 1952 C PRO E 57 -8.742 6.256 -19.144 1.00 0.00 C ATOM 1953 O PRO E 57 -8.058 5.396 -19.664 1.00 0.00 O ATOM 1954 CB PRO E 57 -8.164 8.704 -19.296 1.00 0.00 C ATOM 1955 CG PRO E 57 -6.788 8.804 -19.996 1.00 0.00 C ATOM 1956 CD PRO E 57 -5.804 7.969 -19.155 1.00 0.00 C ATOM 0 HA PRO E 57 -8.664 7.558 -17.485 1.00 0.00 H new ATOM 0 HB2 PRO E 57 -8.968 8.632 -20.028 1.00 0.00 H new ATOM 0 HB3 PRO E 57 -8.359 9.592 -18.694 1.00 0.00 H new ATOM 0 HG2 PRO E 57 -6.844 8.425 -21.016 1.00 0.00 H new ATOM 0 HG3 PRO E 57 -6.460 9.842 -20.059 1.00 0.00 H new ATOM 0 HD2 PRO E 57 -5.229 7.285 -19.779 1.00 0.00 H new ATOM 0 HD3 PRO E 57 -5.088 8.604 -18.634 1.00 0.00 H new ATOM 1964 N PHE E 58 -10.047 6.204 -19.184 1.00 0.00 N ATOM 1965 CA PHE E 58 -10.737 5.078 -19.873 1.00 0.00 C ATOM 1966 C PHE E 58 -10.941 5.444 -21.348 1.00 0.00 C ATOM 1967 O PHE E 58 -10.690 6.565 -21.742 1.00 0.00 O ATOM 1968 CB PHE E 58 -12.094 4.840 -19.206 1.00 0.00 C ATOM 1969 CG PHE E 58 -12.054 3.540 -18.439 1.00 0.00 C ATOM 1970 CD1 PHE E 58 -10.893 3.166 -17.752 1.00 0.00 C ATOM 1971 CD2 PHE E 58 -13.181 2.709 -18.414 1.00 0.00 C ATOM 1972 CE1 PHE E 58 -10.858 1.961 -17.041 1.00 0.00 C ATOM 1973 CE2 PHE E 58 -13.145 1.502 -17.704 1.00 0.00 C ATOM 1974 CZ PHE E 58 -11.983 1.129 -17.016 1.00 0.00 C ATOM 0 H PHE E 58 -10.667 6.898 -18.766 1.00 0.00 H new ATOM 0 HA PHE E 58 -10.136 4.171 -19.804 1.00 0.00 H new ATOM 0 HB2 PHE E 58 -12.331 5.665 -18.534 1.00 0.00 H new ATOM 0 HB3 PHE E 58 -12.881 4.807 -19.959 1.00 0.00 H new ATOM 0 HD1 PHE E 58 -10.024 3.807 -17.771 1.00 0.00 H new ATOM 0 HD2 PHE E 58 -14.078 2.999 -18.942 1.00 0.00 H new ATOM 0 HE1 PHE E 58 -9.962 1.673 -16.511 1.00 0.00 H new ATOM 0 HE2 PHE E 58 -14.013 0.859 -17.687 1.00 0.00 H new ATOM 0 HZ PHE E 58 -11.955 0.200 -16.466 1.00 0.00 H new ATOM 1984 N PRO E 59 -11.386 4.486 -22.126 1.00 0.00 N ATOM 1985 CA PRO E 59 -11.693 3.123 -21.649 1.00 0.00 C ATOM 1986 C PRO E 59 -10.407 2.317 -21.441 1.00 0.00 C ATOM 1987 O PRO E 59 -9.314 2.808 -21.643 1.00 0.00 O ATOM 1988 CB PRO E 59 -12.536 2.530 -22.783 1.00 0.00 C ATOM 1989 CG PRO E 59 -12.198 3.346 -24.052 1.00 0.00 C ATOM 1990 CD PRO E 59 -11.620 4.688 -23.569 1.00 0.00 C ATOM 0 HA PRO E 59 -12.208 3.113 -20.688 1.00 0.00 H new ATOM 0 HB2 PRO E 59 -12.305 1.475 -22.927 1.00 0.00 H new ATOM 0 HB3 PRO E 59 -13.599 2.595 -22.551 1.00 0.00 H new ATOM 0 HG2 PRO E 59 -11.477 2.815 -24.674 1.00 0.00 H new ATOM 0 HG3 PRO E 59 -13.089 3.504 -24.660 1.00 0.00 H new ATOM 0 HD2 PRO E 59 -10.695 4.934 -24.091 1.00 0.00 H new ATOM 0 HD3 PRO E 59 -12.315 5.508 -23.748 1.00 0.00 H new