USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1019 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 35 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 156 LYS NZ :NH3+ 177:sc= 0.0715 (180deg=0.0689) USER MOD Set 2.1: A 42 HIS : no HD1:sc= 0 X(o=0.37,f=0.14) USER MOD Set 2.2: A 143 GLN : amide:sc= 0.204 X(o=0.37,f=-0.025) USER MOD Set 2.3: A 144 ASN : amide:sc= 0.208 K(o=0.37,f=-0.14) USER MOD Set 2.4: A 146 GLN :FLIP amide:sc= -0.0422 F(o=-0.14,f=0.37) USER MOD Set 3.1: A 40 THR OG1 : rot -154:sc= -0.0428 USER MOD Set 3.2: A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -0.0327 X(o=-0.033,f=-0.033) USER MOD Single : A 15 LYS NZ :NH3+ 151:sc= 0 (180deg=-1.15) USER MOD Single : A 19 GLN : amide:sc= -0.147 X(o=-0.15,f=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 THR OG1 : rot -170:sc= -0.338 USER MOD Single : A 33 LYS NZ :NH3+ 173:sc= -0.484 (180deg=-0.706) USER MOD Single : A 37 HIS : no HD1:sc= -0.224 X(o=-0.22,f=-0.25) USER MOD Single : A 38 TYR OH : rot 30:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 124:sc= 1.79 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl -169:sc= -1.1 (180deg=-1.6) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 CYS SG : rot -24:sc= 0.0128 USER MOD Single : A 79 THR OG1 : rot -40:sc= 0.469 USER MOD Single : A 80 MET CE :methyl 169:sc= -0.534 (180deg=-0.834) USER MOD Single : A 87 GLN : amide:sc= -0.458 X(o=-0.46,f=-0.3) USER MOD Single : A 90 CYS SG : rot -131:sc= -2.16! USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 HIS : no HD1:sc= -0.523 X(o=-0.52,f=-0.83) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc=-0.00905 X(o=-0.0091,f=0) USER MOD Single : A 151 HIS : no HD1:sc= -0.563 X(o=-0.56,f=-0.078) USER MOD Single : A 152 MET CE :methyl -130:sc= -0.0415 (180deg=-0.234) USER MOD Single : A 154 MET CE :methyl 169:sc= -0.142 (180deg=-0.408) USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 162 THR OG1 : rot -22:sc= 0.219 USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 42 N ILE A 5 21.321 -4.942 -10.834 1.00 0.00 N ATOM 43 CA ILE A 5 22.040 -3.863 -10.079 1.00 0.00 C ATOM 44 C ILE A 5 22.922 -2.915 -10.966 1.00 0.00 C ATOM 45 O ILE A 5 22.888 -1.695 -10.775 1.00 0.00 O ATOM 46 CB ILE A 5 22.832 -4.551 -8.899 1.00 0.00 C ATOM 47 CG1 ILE A 5 21.922 -5.284 -7.861 1.00 0.00 C ATOM 48 CG2 ILE A 5 23.842 -3.635 -8.156 1.00 0.00 C ATOM 49 CD1 ILE A 5 21.018 -4.370 -7.028 1.00 0.00 C ATOM 0 HA ILE A 5 21.304 -3.169 -9.674 1.00 0.00 H new ATOM 0 HB ILE A 5 23.416 -5.301 -9.432 1.00 0.00 H new ATOM 0 HG12 ILE A 5 21.296 -6.001 -8.392 1.00 0.00 H new ATOM 0 HG13 ILE A 5 22.557 -5.855 -7.184 1.00 0.00 H new ATOM 0 HG21 ILE A 5 24.333 -4.201 -7.365 1.00 0.00 H new ATOM 0 HG22 ILE A 5 24.590 -3.272 -8.860 1.00 0.00 H new ATOM 0 HG23 ILE A 5 23.312 -2.788 -7.720 1.00 0.00 H new ATOM 0 HD11 ILE A 5 20.427 -4.973 -6.339 1.00 0.00 H new ATOM 0 HD12 ILE A 5 21.632 -3.669 -6.462 1.00 0.00 H new ATOM 0 HD13 ILE A 5 20.351 -3.817 -7.689 1.00 0.00 H new ATOM 61 N ALA A 6 23.672 -3.487 -11.924 1.00 0.00 N ATOM 62 CA ALA A 6 24.445 -2.713 -12.923 1.00 0.00 C ATOM 63 C ALA A 6 23.625 -1.945 -14.000 1.00 0.00 C ATOM 64 O ALA A 6 24.050 -0.849 -14.373 1.00 0.00 O ATOM 65 CB ALA A 6 25.459 -3.660 -13.574 1.00 0.00 C ATOM 0 H ALA A 6 23.762 -4.497 -12.031 1.00 0.00 H new ATOM 0 HA ALA A 6 24.928 -1.906 -12.371 1.00 0.00 H new ATOM 0 HB1 ALA A 6 26.043 -3.114 -14.315 1.00 0.00 H new ATOM 0 HB2 ALA A 6 26.126 -4.060 -12.810 1.00 0.00 H new ATOM 0 HB3 ALA A 6 24.931 -4.480 -14.060 1.00 0.00 H new ATOM 71 N ARG A 7 22.481 -2.478 -14.485 1.00 0.00 N ATOM 72 CA ARG A 7 21.557 -1.732 -15.387 1.00 0.00 C ATOM 73 C ARG A 7 20.641 -0.660 -14.698 1.00 0.00 C ATOM 74 O ARG A 7 20.288 0.314 -15.368 1.00 0.00 O ATOM 75 CB ARG A 7 20.815 -2.722 -16.331 1.00 0.00 C ATOM 76 CG ARG A 7 19.529 -3.419 -15.819 1.00 0.00 C ATOM 77 CD ARG A 7 19.287 -4.843 -16.359 1.00 0.00 C ATOM 78 NE ARG A 7 19.122 -4.926 -17.831 1.00 0.00 N ATOM 79 CZ ARG A 7 19.040 -6.086 -18.514 1.00 0.00 C ATOM 80 NH1 ARG A 7 19.024 -7.288 -17.937 1.00 0.00 N ATOM 81 NH2 ARG A 7 18.972 -6.029 -19.831 1.00 0.00 N ATOM 0 H ARG A 7 22.170 -3.425 -14.269 1.00 0.00 H new ATOM 0 HA ARG A 7 22.182 -1.089 -16.007 1.00 0.00 H new ATOM 0 HB2 ARG A 7 20.557 -2.180 -17.241 1.00 0.00 H new ATOM 0 HB3 ARG A 7 21.523 -3.501 -16.614 1.00 0.00 H new ATOM 0 HG2 ARG A 7 19.569 -3.464 -14.731 1.00 0.00 H new ATOM 0 HG3 ARG A 7 18.672 -2.799 -16.081 1.00 0.00 H new ATOM 0 HD2 ARG A 7 20.124 -5.476 -16.064 1.00 0.00 H new ATOM 0 HD3 ARG A 7 18.395 -5.251 -15.883 1.00 0.00 H new ATOM 0 HE ARG A 7 19.067 -4.054 -18.358 1.00 0.00 H new ATOM 0 HH11 ARG A 7 19.075 -7.367 -16.921 1.00 0.00 H new ATOM 0 HH12 ARG A 7 18.960 -8.129 -18.511 1.00 0.00 H new ATOM 0 HH21 ARG A 7 18.982 -5.125 -20.304 1.00 0.00 H new ATOM 0 HH22 ARG A 7 18.909 -6.889 -20.376 1.00 0.00 H new ATOM 95 N LEU A 8 20.270 -0.803 -13.402 1.00 0.00 N ATOM 96 CA LEU A 8 19.461 0.207 -12.663 1.00 0.00 C ATOM 97 C LEU A 8 20.243 1.488 -12.248 1.00 0.00 C ATOM 98 O LEU A 8 19.684 2.578 -12.371 1.00 0.00 O ATOM 99 CB LEU A 8 18.743 -0.391 -11.420 1.00 0.00 C ATOM 100 CG LEU A 8 17.782 -1.605 -11.589 1.00 0.00 C ATOM 101 CD1 LEU A 8 16.857 -1.721 -10.365 1.00 0.00 C ATOM 102 CD2 LEU A 8 16.954 -1.641 -12.889 1.00 0.00 C ATOM 0 H LEU A 8 20.520 -1.616 -12.839 1.00 0.00 H new ATOM 0 HA LEU A 8 18.713 0.514 -13.394 1.00 0.00 H new ATOM 0 HB2 LEU A 8 19.515 -0.684 -10.709 1.00 0.00 H new ATOM 0 HB3 LEU A 8 18.172 0.413 -10.957 1.00 0.00 H new ATOM 0 HG LEU A 8 18.443 -2.468 -11.666 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.189 -2.573 -10.493 1.00 0.00 H new ATOM 0 HD12 LEU A 8 17.458 -1.863 -9.467 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.268 -0.809 -10.267 1.00 0.00 H new ATOM 0 HD21 LEU A 8 16.323 -2.530 -12.894 1.00 0.00 H new ATOM 0 HD22 LEU A 8 16.327 -0.751 -12.946 1.00 0.00 H new ATOM 0 HD23 LEU A 8 17.625 -1.667 -13.747 1.00 0.00 H new ATOM 114 N ARG A 9 21.509 1.391 -11.784 1.00 0.00 N ATOM 115 CA ARG A 9 22.385 2.576 -11.552 1.00 0.00 C ATOM 116 C ARG A 9 22.588 3.530 -12.782 1.00 0.00 C ATOM 117 O ARG A 9 22.519 4.751 -12.614 1.00 0.00 O ATOM 118 CB ARG A 9 23.698 2.140 -10.846 1.00 0.00 C ATOM 119 CG ARG A 9 24.700 1.303 -11.677 1.00 0.00 C ATOM 120 CD ARG A 9 25.767 0.603 -10.818 1.00 0.00 C ATOM 121 NE ARG A 9 26.819 -0.012 -11.661 1.00 0.00 N ATOM 122 CZ ARG A 9 27.686 -0.952 -11.237 1.00 0.00 C ATOM 123 NH1 ARG A 9 27.700 -1.456 -10.003 1.00 0.00 N ATOM 124 NH2 ARG A 9 28.581 -1.400 -12.097 1.00 0.00 N ATOM 0 H ARG A 9 21.955 0.501 -11.560 1.00 0.00 H new ATOM 0 HA ARG A 9 21.841 3.232 -10.872 1.00 0.00 H new ATOM 0 HB2 ARG A 9 24.211 3.038 -10.501 1.00 0.00 H new ATOM 0 HB3 ARG A 9 23.431 1.565 -9.959 1.00 0.00 H new ATOM 0 HG2 ARG A 9 24.152 0.552 -12.246 1.00 0.00 H new ATOM 0 HG3 ARG A 9 25.194 1.953 -12.400 1.00 0.00 H new ATOM 0 HD2 ARG A 9 26.219 1.324 -10.137 1.00 0.00 H new ATOM 0 HD3 ARG A 9 25.296 -0.164 -10.203 1.00 0.00 H new ATOM 0 HE ARG A 9 26.892 0.298 -12.630 1.00 0.00 H new ATOM 0 HH11 ARG A 9 27.024 -1.131 -9.312 1.00 0.00 H new ATOM 0 HH12 ARG A 9 28.386 -2.167 -9.750 1.00 0.00 H new ATOM 0 HH21 ARG A 9 28.601 -1.035 -13.049 1.00 0.00 H new ATOM 0 HH22 ARG A 9 29.253 -2.112 -11.810 1.00 0.00 H new ATOM 138 N GLU A 10 22.764 2.973 -14.000 1.00 0.00 N ATOM 139 CA GLU A 10 22.677 3.734 -15.283 1.00 0.00 C ATOM 140 C GLU A 10 21.257 4.056 -15.863 1.00 0.00 C ATOM 141 O GLU A 10 21.189 4.732 -16.895 1.00 0.00 O ATOM 142 CB GLU A 10 23.570 3.032 -16.349 1.00 0.00 C ATOM 143 CG GLU A 10 23.165 1.589 -16.733 1.00 0.00 C ATOM 144 CD GLU A 10 23.929 1.033 -17.936 1.00 0.00 C ATOM 145 OE1 GLU A 10 23.472 1.228 -19.084 1.00 0.00 O ATOM 146 OE2 GLU A 10 24.988 0.397 -17.738 1.00 0.00 O ATOM 0 H GLU A 10 22.971 1.983 -14.130 1.00 0.00 H new ATOM 0 HA GLU A 10 23.039 4.729 -15.025 1.00 0.00 H new ATOM 0 HB2 GLU A 10 23.568 3.641 -17.253 1.00 0.00 H new ATOM 0 HB3 GLU A 10 24.595 3.014 -15.979 1.00 0.00 H new ATOM 0 HG2 GLU A 10 23.329 0.935 -15.876 1.00 0.00 H new ATOM 0 HG3 GLU A 10 22.097 1.567 -16.951 1.00 0.00 H new ATOM 153 N ASP A 11 20.140 3.633 -15.231 1.00 0.00 N ATOM 154 CA ASP A 11 18.764 4.039 -15.649 1.00 0.00 C ATOM 155 C ASP A 11 18.298 5.461 -15.196 1.00 0.00 C ATOM 156 O ASP A 11 17.196 5.864 -15.579 1.00 0.00 O ATOM 157 CB ASP A 11 17.816 2.863 -15.271 1.00 0.00 C ATOM 158 CG ASP A 11 16.371 2.942 -15.786 1.00 0.00 C ATOM 159 OD1 ASP A 11 16.167 2.968 -17.021 1.00 0.00 O ATOM 160 OD2 ASP A 11 15.435 2.978 -14.959 1.00 0.00 O ATOM 0 H ASP A 11 20.157 3.008 -14.425 1.00 0.00 H new ATOM 0 HA ASP A 11 18.745 4.195 -16.728 1.00 0.00 H new ATOM 0 HB2 ASP A 11 18.258 1.938 -15.642 1.00 0.00 H new ATOM 0 HB3 ASP A 11 17.785 2.788 -14.184 1.00 0.00 H new ATOM 165 N GLY A 12 19.106 6.232 -14.440 1.00 0.00 N ATOM 166 CA GLY A 12 18.618 7.443 -13.737 1.00 0.00 C ATOM 167 C GLY A 12 18.338 7.227 -12.230 1.00 0.00 C ATOM 168 O GLY A 12 18.737 8.041 -11.393 1.00 0.00 O ATOM 0 H GLY A 12 20.098 6.041 -14.299 1.00 0.00 H new ATOM 0 HA2 GLY A 12 19.356 8.237 -13.849 1.00 0.00 H new ATOM 0 HA3 GLY A 12 17.704 7.787 -14.220 1.00 0.00 H new ATOM 172 N ILE A 13 17.666 6.109 -11.907 1.00 0.00 N ATOM 173 CA ILE A 13 17.487 5.593 -10.521 1.00 0.00 C ATOM 174 C ILE A 13 18.839 5.081 -9.915 1.00 0.00 C ATOM 175 O ILE A 13 19.826 4.851 -10.625 1.00 0.00 O ATOM 176 CB ILE A 13 16.366 4.479 -10.531 1.00 0.00 C ATOM 177 CG1 ILE A 13 16.800 3.195 -11.307 1.00 0.00 C ATOM 178 CG2 ILE A 13 14.994 5.009 -11.016 1.00 0.00 C ATOM 179 CD1 ILE A 13 15.748 2.170 -11.725 1.00 0.00 C ATOM 0 H ILE A 13 17.219 5.520 -12.610 1.00 0.00 H new ATOM 0 HA ILE A 13 17.163 6.405 -9.869 1.00 0.00 H new ATOM 0 HB ILE A 13 16.235 4.187 -9.489 1.00 0.00 H new ATOM 0 HG12 ILE A 13 17.315 3.520 -12.211 1.00 0.00 H new ATOM 0 HG13 ILE A 13 17.534 2.675 -10.691 1.00 0.00 H new ATOM 0 HG21 ILE A 13 14.265 4.199 -11.001 1.00 0.00 H new ATOM 0 HG22 ILE A 13 14.660 5.810 -10.357 1.00 0.00 H new ATOM 0 HG23 ILE A 13 15.090 5.392 -12.032 1.00 0.00 H new ATOM 0 HD11 ILE A 13 16.231 1.347 -12.252 1.00 0.00 H new ATOM 0 HD12 ILE A 13 15.242 1.786 -10.839 1.00 0.00 H new ATOM 0 HD13 ILE A 13 15.019 2.644 -12.383 1.00 0.00 H new ATOM 191 N GLN A 14 18.843 4.858 -8.595 1.00 0.00 N ATOM 192 CA GLN A 14 19.891 4.055 -7.910 1.00 0.00 C ATOM 193 C GLN A 14 19.274 2.737 -7.352 1.00 0.00 C ATOM 194 O GLN A 14 18.077 2.466 -7.504 1.00 0.00 O ATOM 195 CB GLN A 14 20.567 4.942 -6.821 1.00 0.00 C ATOM 196 CG GLN A 14 21.394 6.151 -7.333 1.00 0.00 C ATOM 197 CD GLN A 14 22.526 5.825 -8.328 1.00 0.00 C ATOM 198 OE1 GLN A 14 22.489 6.219 -9.493 1.00 0.00 O ATOM 199 NE2 GLN A 14 23.537 5.094 -7.890 1.00 0.00 N ATOM 0 H GLN A 14 18.128 5.222 -7.965 1.00 0.00 H new ATOM 0 HA GLN A 14 20.671 3.747 -8.607 1.00 0.00 H new ATOM 0 HB2 GLN A 14 19.790 5.317 -6.155 1.00 0.00 H new ATOM 0 HB3 GLN A 14 21.222 4.309 -6.222 1.00 0.00 H new ATOM 0 HG2 GLN A 14 20.712 6.857 -7.808 1.00 0.00 H new ATOM 0 HG3 GLN A 14 21.829 6.658 -6.472 1.00 0.00 H new ATOM 0 HE21 GLN A 14 23.554 4.775 -6.921 1.00 0.00 H new ATOM 0 HE22 GLN A 14 24.300 4.849 -8.521 1.00 0.00 H new ATOM 208 N LYS A 15 20.107 1.888 -6.718 1.00 0.00 N ATOM 209 CA LYS A 15 19.637 0.709 -5.963 1.00 0.00 C ATOM 210 C LYS A 15 20.637 0.472 -4.794 1.00 0.00 C ATOM 211 O LYS A 15 21.835 0.270 -5.024 1.00 0.00 O ATOM 212 CB LYS A 15 19.554 -0.515 -6.924 1.00 0.00 C ATOM 213 CG LYS A 15 18.614 -1.668 -6.530 1.00 0.00 C ATOM 214 CD LYS A 15 18.832 -2.311 -5.145 1.00 0.00 C ATOM 215 CE LYS A 15 17.989 -3.579 -4.955 1.00 0.00 C ATOM 216 NZ LYS A 15 18.253 -4.217 -3.658 1.00 0.00 N ATOM 0 H LYS A 15 21.121 1.999 -6.715 1.00 0.00 H new ATOM 0 HA LYS A 15 18.640 0.862 -5.549 1.00 0.00 H new ATOM 0 HB2 LYS A 15 19.247 -0.152 -7.905 1.00 0.00 H new ATOM 0 HB3 LYS A 15 20.558 -0.924 -7.035 1.00 0.00 H new ATOM 0 HG2 LYS A 15 17.589 -1.299 -6.574 1.00 0.00 H new ATOM 0 HG3 LYS A 15 18.704 -2.450 -7.284 1.00 0.00 H new ATOM 0 HD2 LYS A 15 19.887 -2.556 -5.022 1.00 0.00 H new ATOM 0 HD3 LYS A 15 18.580 -1.590 -4.368 1.00 0.00 H new ATOM 0 HE2 LYS A 15 16.931 -3.327 -5.028 1.00 0.00 H new ATOM 0 HE3 LYS A 15 18.205 -4.284 -5.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 17.402 -4.723 -3.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 19.039 -4.890 -3.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 18.505 -3.490 -2.958 1.00 0.00 H new ATOM 230 N ARG A 16 20.129 0.483 -3.546 1.00 0.00 N ATOM 231 CA ARG A 16 20.956 0.305 -2.326 1.00 0.00 C ATOM 232 C ARG A 16 20.190 -0.613 -1.335 1.00 0.00 C ATOM 233 O ARG A 16 19.080 -0.288 -0.903 1.00 0.00 O ATOM 234 CB ARG A 16 21.249 1.710 -1.735 1.00 0.00 C ATOM 235 CG ARG A 16 22.207 1.734 -0.523 1.00 0.00 C ATOM 236 CD ARG A 16 22.391 3.133 0.099 1.00 0.00 C ATOM 237 NE ARG A 16 23.103 4.084 -0.795 1.00 0.00 N ATOM 238 CZ ARG A 16 23.107 5.421 -0.635 1.00 0.00 C ATOM 239 NH1 ARG A 16 22.495 6.053 0.365 1.00 0.00 N ATOM 240 NH2 ARG A 16 23.757 6.152 -1.523 1.00 0.00 N ATOM 0 H ARG A 16 19.137 0.615 -3.351 1.00 0.00 H new ATOM 0 HA ARG A 16 21.910 -0.175 -2.544 1.00 0.00 H new ATOM 0 HB2 ARG A 16 21.671 2.336 -2.522 1.00 0.00 H new ATOM 0 HB3 ARG A 16 20.304 2.165 -1.438 1.00 0.00 H new ATOM 0 HG2 ARG A 16 21.829 1.054 0.241 1.00 0.00 H new ATOM 0 HG3 ARG A 16 23.180 1.354 -0.834 1.00 0.00 H new ATOM 0 HD2 ARG A 16 21.413 3.543 0.349 1.00 0.00 H new ATOM 0 HD3 ARG A 16 22.945 3.038 1.033 1.00 0.00 H new ATOM 0 HE ARG A 16 23.623 3.698 -1.583 1.00 0.00 H new ATOM 0 HH11 ARG A 16 21.984 5.520 1.068 1.00 0.00 H new ATOM 0 HH12 ARG A 16 22.537 7.070 0.427 1.00 0.00 H new ATOM 0 HH21 ARG A 16 24.237 5.701 -2.302 1.00 0.00 H new ATOM 0 HH22 ARG A 16 23.779 7.167 -1.430 1.00 0.00 H new ATOM 254 N VAL A 17 20.821 -1.743 -0.962 1.00 0.00 N ATOM 255 CA VAL A 17 20.216 -2.767 -0.060 1.00 0.00 C ATOM 256 C VAL A 17 20.684 -2.581 1.411 1.00 0.00 C ATOM 257 O VAL A 17 21.870 -2.376 1.690 1.00 0.00 O ATOM 258 CB VAL A 17 20.439 -4.208 -0.639 1.00 0.00 C ATOM 259 CG1 VAL A 17 21.896 -4.712 -0.605 1.00 0.00 C ATOM 260 CG2 VAL A 17 19.531 -5.277 0.006 1.00 0.00 C ATOM 0 H VAL A 17 21.763 -1.980 -1.272 1.00 0.00 H new ATOM 0 HA VAL A 17 19.136 -2.623 -0.025 1.00 0.00 H new ATOM 0 HB VAL A 17 20.162 -4.078 -1.685 1.00 0.00 H new ATOM 0 HG11 VAL A 17 21.944 -5.716 -1.027 1.00 0.00 H new ATOM 0 HG12 VAL A 17 22.526 -4.042 -1.190 1.00 0.00 H new ATOM 0 HG13 VAL A 17 22.249 -4.735 0.426 1.00 0.00 H new ATOM 0 HG21 VAL A 17 19.739 -6.249 -0.442 1.00 0.00 H new ATOM 0 HG22 VAL A 17 19.726 -5.322 1.077 1.00 0.00 H new ATOM 0 HG23 VAL A 17 18.486 -5.016 -0.162 1.00 0.00 H new ATOM 270 N ILE A 18 19.723 -2.722 2.343 1.00 0.00 N ATOM 271 CA ILE A 18 19.993 -2.760 3.803 1.00 0.00 C ATOM 272 C ILE A 18 20.327 -4.240 4.199 1.00 0.00 C ATOM 273 O ILE A 18 21.473 -4.516 4.564 1.00 0.00 O ATOM 274 CB ILE A 18 18.832 -2.103 4.631 1.00 0.00 C ATOM 275 CG1 ILE A 18 18.315 -0.715 4.125 1.00 0.00 C ATOM 276 CG2 ILE A 18 19.239 -1.943 6.120 1.00 0.00 C ATOM 277 CD1 ILE A 18 16.789 -0.650 4.013 1.00 0.00 C ATOM 0 H ILE A 18 18.734 -2.813 2.110 1.00 0.00 H new ATOM 0 HA ILE A 18 20.860 -2.148 4.052 1.00 0.00 H new ATOM 0 HB ILE A 18 18.008 -2.804 4.497 1.00 0.00 H new ATOM 0 HG12 ILE A 18 18.657 0.064 4.806 1.00 0.00 H new ATOM 0 HG13 ILE A 18 18.755 -0.503 3.150 1.00 0.00 H new ATOM 0 HG21 ILE A 18 18.419 -1.486 6.674 1.00 0.00 H new ATOM 0 HG22 ILE A 18 19.462 -2.922 6.544 1.00 0.00 H new ATOM 0 HG23 ILE A 18 20.122 -1.308 6.190 1.00 0.00 H new ATOM 0 HD11 ILE A 18 16.492 0.337 3.657 1.00 0.00 H new ATOM 0 HD12 ILE A 18 16.443 -1.408 3.310 1.00 0.00 H new ATOM 0 HD13 ILE A 18 16.344 -0.832 4.991 1.00 0.00 H new ATOM 289 N GLN A 19 19.343 -5.164 4.114 1.00 0.00 N ATOM 290 CA GLN A 19 19.523 -6.598 4.453 1.00 0.00 C ATOM 291 C GLN A 19 19.264 -7.433 3.174 1.00 0.00 C ATOM 292 O GLN A 19 18.115 -7.593 2.752 1.00 0.00 O ATOM 293 CB GLN A 19 18.555 -7.026 5.589 1.00 0.00 C ATOM 294 CG GLN A 19 18.813 -6.410 6.990 1.00 0.00 C ATOM 295 CD GLN A 19 17.666 -5.533 7.515 1.00 0.00 C ATOM 296 OE1 GLN A 19 17.082 -5.781 8.568 1.00 0.00 O ATOM 297 NE2 GLN A 19 17.330 -4.494 6.772 1.00 0.00 N ATOM 0 H GLN A 19 18.397 -4.937 3.807 1.00 0.00 H new ATOM 0 HA GLN A 19 20.538 -6.767 4.812 1.00 0.00 H new ATOM 0 HB2 GLN A 19 17.540 -6.770 5.286 1.00 0.00 H new ATOM 0 HB3 GLN A 19 18.596 -8.111 5.681 1.00 0.00 H new ATOM 0 HG2 GLN A 19 18.993 -7.216 7.701 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.723 -5.812 6.949 1.00 0.00 H new ATOM 0 HE21 GLN A 19 17.828 -4.307 5.902 1.00 0.00 H new ATOM 0 HE22 GLN A 19 16.572 -3.879 7.068 1.00 0.00 H new ATOM 306 N GLU A 20 20.334 -8.012 2.595 1.00 0.00 N ATOM 307 CA GLU A 20 20.234 -9.003 1.486 1.00 0.00 C ATOM 308 C GLU A 20 19.485 -10.291 1.943 1.00 0.00 C ATOM 309 O GLU A 20 19.906 -10.957 2.896 1.00 0.00 O ATOM 310 CB GLU A 20 21.650 -9.360 0.961 1.00 0.00 C ATOM 311 CG GLU A 20 22.334 -8.236 0.159 1.00 0.00 C ATOM 312 CD GLU A 20 23.726 -8.622 -0.343 1.00 0.00 C ATOM 313 OE1 GLU A 20 24.718 -8.394 0.385 1.00 0.00 O ATOM 314 OE2 GLU A 20 23.836 -9.155 -1.470 1.00 0.00 O ATOM 0 H GLU A 20 21.294 -7.812 2.876 1.00 0.00 H new ATOM 0 HA GLU A 20 19.658 -8.551 0.679 1.00 0.00 H new ATOM 0 HB2 GLU A 20 22.283 -9.622 1.809 1.00 0.00 H new ATOM 0 HB3 GLU A 20 21.578 -10.247 0.331 1.00 0.00 H new ATOM 0 HG2 GLU A 20 21.707 -7.972 -0.693 1.00 0.00 H new ATOM 0 HG3 GLU A 20 22.413 -7.347 0.785 1.00 0.00 H new ATOM 321 N GLY A 21 18.347 -10.587 1.290 1.00 0.00 N ATOM 322 CA GLY A 21 17.355 -11.540 1.827 1.00 0.00 C ATOM 323 C GLY A 21 17.644 -13.040 1.645 1.00 0.00 C ATOM 324 O GLY A 21 18.787 -13.495 1.753 1.00 0.00 O ATOM 0 H GLY A 21 18.090 -10.181 0.390 1.00 0.00 H new ATOM 0 HA2 GLY A 21 17.244 -11.345 2.894 1.00 0.00 H new ATOM 0 HA3 GLY A 21 16.393 -11.323 1.362 1.00 0.00 H new ATOM 328 N ARG A 22 16.554 -13.800 1.460 1.00 0.00 N ATOM 329 CA ARG A 22 16.560 -15.276 1.627 1.00 0.00 C ATOM 330 C ARG A 22 16.268 -15.960 0.267 1.00 0.00 C ATOM 331 O ARG A 22 15.302 -15.633 -0.434 1.00 0.00 O ATOM 332 CB ARG A 22 15.531 -15.731 2.702 1.00 0.00 C ATOM 333 CG ARG A 22 15.918 -15.480 4.179 1.00 0.00 C ATOM 334 CD ARG A 22 15.714 -14.036 4.680 1.00 0.00 C ATOM 335 NE ARG A 22 16.080 -13.906 6.110 1.00 0.00 N ATOM 336 CZ ARG A 22 16.349 -12.737 6.728 1.00 0.00 C ATOM 337 NH1 ARG A 22 16.286 -11.545 6.134 1.00 0.00 N ATOM 338 NH2 ARG A 22 16.699 -12.777 8.000 1.00 0.00 N ATOM 0 H ARG A 22 15.646 -13.420 1.192 1.00 0.00 H new ATOM 0 HA ARG A 22 17.549 -15.577 1.973 1.00 0.00 H new ATOM 0 HB2 ARG A 22 14.586 -15.224 2.506 1.00 0.00 H new ATOM 0 HB3 ARG A 22 15.352 -16.798 2.573 1.00 0.00 H new ATOM 0 HG2 ARG A 22 15.334 -16.151 4.809 1.00 0.00 H new ATOM 0 HG3 ARG A 22 16.966 -15.748 4.313 1.00 0.00 H new ATOM 0 HD2 ARG A 22 16.319 -13.353 4.084 1.00 0.00 H new ATOM 0 HD3 ARG A 22 14.673 -13.744 4.541 1.00 0.00 H new ATOM 0 HE ARG A 22 16.132 -14.760 6.666 1.00 0.00 H new ATOM 0 HH11 ARG A 22 16.021 -11.478 5.151 1.00 0.00 H new ATOM 0 HH12 ARG A 22 16.503 -10.700 6.662 1.00 0.00 H new ATOM 0 HH21 ARG A 22 16.759 -13.673 8.485 1.00 0.00 H new ATOM 0 HH22 ARG A 22 16.909 -11.912 8.498 1.00 0.00 H new ATOM 393 N PRO A 26 13.172 -14.561 -8.050 1.00 0.00 N ATOM 394 CA PRO A 26 12.280 -15.186 -9.071 1.00 0.00 C ATOM 395 C PRO A 26 12.201 -14.396 -10.423 1.00 0.00 C ATOM 396 O PRO A 26 13.147 -13.701 -10.808 1.00 0.00 O ATOM 397 CB PRO A 26 10.973 -15.334 -8.254 1.00 0.00 C ATOM 398 CG PRO A 26 10.959 -14.141 -7.305 1.00 0.00 C ATOM 399 CD PRO A 26 12.425 -13.997 -6.906 1.00 0.00 C ATOM 0 HA PRO A 26 12.622 -16.139 -9.474 1.00 0.00 H new ATOM 0 HB2 PRO A 26 10.099 -15.330 -8.905 1.00 0.00 H new ATOM 0 HB3 PRO A 26 10.956 -16.275 -7.704 1.00 0.00 H new ATOM 0 HG2 PRO A 26 10.584 -13.242 -7.794 1.00 0.00 H new ATOM 0 HG3 PRO A 26 10.322 -14.322 -6.439 1.00 0.00 H new ATOM 0 HD2 PRO A 26 12.690 -12.954 -6.734 1.00 0.00 H new ATOM 0 HD3 PRO A 26 12.641 -14.537 -5.984 1.00 0.00 H new ATOM 407 N ASP A 27 11.095 -14.556 -11.172 1.00 0.00 N ATOM 408 CA ASP A 27 10.937 -13.992 -12.542 1.00 0.00 C ATOM 409 C ASP A 27 10.879 -12.435 -12.595 1.00 0.00 C ATOM 410 O ASP A 27 11.710 -11.830 -13.277 1.00 0.00 O ATOM 411 CB ASP A 27 9.712 -14.623 -13.267 1.00 0.00 C ATOM 412 CG ASP A 27 9.840 -16.115 -13.608 1.00 0.00 C ATOM 413 OD1 ASP A 27 10.489 -16.448 -14.623 1.00 0.00 O ATOM 414 OD2 ASP A 27 9.292 -16.957 -12.862 1.00 0.00 O ATOM 0 H ASP A 27 10.280 -15.079 -10.852 1.00 0.00 H new ATOM 0 HA ASP A 27 11.848 -14.265 -13.075 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.831 -14.486 -12.640 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.535 -14.071 -14.190 1.00 0.00 H new ATOM 419 N PHE A 28 9.889 -11.799 -11.927 1.00 0.00 N ATOM 420 CA PHE A 28 9.551 -10.352 -12.108 1.00 0.00 C ATOM 421 C PHE A 28 9.227 -9.936 -13.579 1.00 0.00 C ATOM 422 O PHE A 28 9.800 -8.993 -14.133 1.00 0.00 O ATOM 423 CB PHE A 28 10.561 -9.414 -11.387 1.00 0.00 C ATOM 424 CG PHE A 28 10.510 -9.465 -9.853 1.00 0.00 C ATOM 425 CD1 PHE A 28 9.558 -8.708 -9.161 1.00 0.00 C ATOM 426 CD2 PHE A 28 11.416 -10.252 -9.136 1.00 0.00 C ATOM 427 CE1 PHE A 28 9.506 -8.750 -7.771 1.00 0.00 C ATOM 428 CE2 PHE A 28 11.361 -10.289 -7.746 1.00 0.00 C ATOM 429 CZ PHE A 28 10.400 -9.546 -7.066 1.00 0.00 C ATOM 0 H PHE A 28 9.295 -12.269 -11.243 1.00 0.00 H new ATOM 0 HA PHE A 28 8.598 -10.213 -11.598 1.00 0.00 H new ATOM 0 HB2 PHE A 28 11.569 -9.672 -11.711 1.00 0.00 H new ATOM 0 HB3 PHE A 28 10.376 -8.389 -11.708 1.00 0.00 H new ATOM 0 HD1 PHE A 28 8.862 -8.089 -9.707 1.00 0.00 H new ATOM 0 HD2 PHE A 28 12.160 -10.832 -9.662 1.00 0.00 H new ATOM 0 HE1 PHE A 28 8.771 -8.164 -7.240 1.00 0.00 H new ATOM 0 HE2 PHE A 28 12.065 -10.895 -7.194 1.00 0.00 H new ATOM 0 HZ PHE A 28 10.349 -9.589 -5.988 1.00 0.00 H new ATOM 439 N GLN A 29 8.273 -10.667 -14.181 1.00 0.00 N ATOM 440 CA GLN A 29 7.793 -10.449 -15.566 1.00 0.00 C ATOM 441 C GLN A 29 6.240 -10.278 -15.568 1.00 0.00 C ATOM 442 O GLN A 29 5.600 -10.251 -14.512 1.00 0.00 O ATOM 443 CB GLN A 29 8.302 -11.605 -16.480 1.00 0.00 C ATOM 444 CG GLN A 29 9.840 -11.733 -16.581 1.00 0.00 C ATOM 445 CD GLN A 29 10.314 -12.742 -17.635 1.00 0.00 C ATOM 446 OE1 GLN A 29 10.639 -12.388 -18.769 1.00 0.00 O ATOM 447 NE2 GLN A 29 10.367 -14.013 -17.273 1.00 0.00 N ATOM 0 H GLN A 29 7.802 -11.442 -13.714 1.00 0.00 H new ATOM 0 HA GLN A 29 8.200 -9.525 -15.977 1.00 0.00 H new ATOM 0 HB2 GLN A 29 7.898 -12.546 -16.107 1.00 0.00 H new ATOM 0 HB3 GLN A 29 7.899 -11.460 -17.482 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.261 -10.755 -16.814 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.235 -12.027 -15.608 1.00 0.00 H new ATOM 0 HE21 GLN A 29 10.094 -14.286 -16.329 1.00 0.00 H new ATOM 0 HE22 GLN A 29 10.681 -14.720 -17.938 1.00 0.00 H new ATOM 456 N ASP A 30 5.631 -10.118 -16.764 1.00 0.00 N ATOM 457 CA ASP A 30 4.202 -9.714 -16.919 1.00 0.00 C ATOM 458 C ASP A 30 3.210 -10.752 -16.301 1.00 0.00 C ATOM 459 O ASP A 30 2.973 -11.832 -16.853 1.00 0.00 O ATOM 460 CB ASP A 30 3.859 -9.446 -18.410 1.00 0.00 C ATOM 461 CG ASP A 30 4.592 -8.263 -19.065 1.00 0.00 C ATOM 462 OD1 ASP A 30 5.702 -8.464 -19.605 1.00 0.00 O ATOM 463 OD2 ASP A 30 4.061 -7.131 -19.043 1.00 0.00 O ATOM 0 H ASP A 30 6.110 -10.263 -17.653 1.00 0.00 H new ATOM 0 HA ASP A 30 4.078 -8.787 -16.359 1.00 0.00 H new ATOM 0 HB2 ASP A 30 4.081 -10.347 -18.982 1.00 0.00 H new ATOM 0 HB3 ASP A 30 2.786 -9.273 -18.491 1.00 0.00 H new ATOM 468 N GLY A 31 2.688 -10.389 -15.120 1.00 0.00 N ATOM 469 CA GLY A 31 1.856 -11.269 -14.271 1.00 0.00 C ATOM 470 C GLY A 31 2.537 -11.790 -12.983 1.00 0.00 C ATOM 471 O GLY A 31 2.227 -12.916 -12.589 1.00 0.00 O ATOM 0 H GLY A 31 2.831 -9.463 -14.718 1.00 0.00 H new ATOM 0 HA2 GLY A 31 0.954 -10.726 -13.990 1.00 0.00 H new ATOM 0 HA3 GLY A 31 1.540 -12.126 -14.866 1.00 0.00 H new ATOM 475 N THR A 32 3.413 -11.010 -12.304 1.00 0.00 N ATOM 476 CA THR A 32 4.049 -11.423 -11.034 1.00 0.00 C ATOM 477 C THR A 32 3.362 -10.577 -9.925 1.00 0.00 C ATOM 478 O THR A 32 3.361 -9.345 -9.940 1.00 0.00 O ATOM 479 CB THR A 32 5.594 -11.244 -11.132 1.00 0.00 C ATOM 480 OG1 THR A 32 6.158 -12.232 -11.985 1.00 0.00 O ATOM 481 CG2 THR A 32 6.343 -11.317 -9.795 1.00 0.00 C ATOM 0 H THR A 32 3.696 -10.083 -12.621 1.00 0.00 H new ATOM 0 HA THR A 32 3.914 -12.479 -10.800 1.00 0.00 H new ATOM 0 HB THR A 32 5.719 -10.235 -11.526 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.135 -12.207 -11.913 1.00 0.00 H new ATOM 0 HG21 THR A 32 7.411 -11.181 -9.968 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.980 -10.532 -9.131 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.171 -12.290 -9.334 1.00 0.00 H new ATOM 489 N LYS A 33 2.815 -11.276 -8.930 1.00 0.00 N ATOM 490 CA LYS A 33 2.236 -10.661 -7.716 1.00 0.00 C ATOM 491 C LYS A 33 3.336 -10.497 -6.639 1.00 0.00 C ATOM 492 O LYS A 33 3.604 -11.408 -5.851 1.00 0.00 O ATOM 493 CB LYS A 33 1.132 -11.645 -7.261 1.00 0.00 C ATOM 494 CG LYS A 33 0.304 -11.282 -6.012 1.00 0.00 C ATOM 495 CD LYS A 33 -0.994 -10.504 -6.291 1.00 0.00 C ATOM 496 CE LYS A 33 -0.861 -8.975 -6.261 1.00 0.00 C ATOM 497 NZ LYS A 33 -2.201 -8.369 -6.172 1.00 0.00 N ATOM 0 H LYS A 33 2.757 -12.294 -8.936 1.00 0.00 H new ATOM 0 HA LYS A 33 1.827 -9.666 -7.894 1.00 0.00 H new ATOM 0 HB2 LYS A 33 0.440 -11.777 -8.093 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.601 -12.612 -7.080 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.052 -12.201 -5.483 1.00 0.00 H new ATOM 0 HG3 LYS A 33 0.927 -10.690 -5.342 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.373 -10.800 -7.269 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -1.742 -10.802 -5.556 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.254 -8.668 -5.409 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.351 -8.626 -7.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.109 -7.343 -6.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.724 -8.553 -7.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -2.717 -8.783 -5.369 1.00 0.00 H new ATOM 511 N ALA A 34 3.939 -9.305 -6.607 1.00 0.00 N ATOM 512 CA ALA A 34 4.952 -8.950 -5.592 1.00 0.00 C ATOM 513 C ALA A 34 4.270 -8.251 -4.387 1.00 0.00 C ATOM 514 O ALA A 34 3.765 -7.129 -4.494 1.00 0.00 O ATOM 515 CB ALA A 34 6.031 -8.090 -6.267 1.00 0.00 C ATOM 0 H ALA A 34 3.745 -8.560 -7.276 1.00 0.00 H new ATOM 0 HA ALA A 34 5.439 -9.838 -5.189 1.00 0.00 H new ATOM 0 HB1 ALA A 34 6.790 -7.817 -5.534 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.494 -8.656 -7.075 1.00 0.00 H new ATOM 0 HB3 ALA A 34 5.575 -7.186 -6.672 1.00 0.00 H new ATOM 521 N THR A 35 4.267 -8.958 -3.246 1.00 0.00 N ATOM 522 CA THR A 35 3.707 -8.458 -1.959 1.00 0.00 C ATOM 523 C THR A 35 4.891 -7.945 -1.091 1.00 0.00 C ATOM 524 O THR A 35 5.862 -8.664 -0.825 1.00 0.00 O ATOM 525 CB THR A 35 2.915 -9.587 -1.235 1.00 0.00 C ATOM 526 OG1 THR A 35 1.885 -10.090 -2.079 1.00 0.00 O ATOM 527 CG2 THR A 35 2.252 -9.137 0.078 1.00 0.00 C ATOM 0 H THR A 35 4.653 -9.900 -3.179 1.00 0.00 H new ATOM 0 HA THR A 35 3.005 -7.643 -2.137 1.00 0.00 H new ATOM 0 HB THR A 35 3.657 -10.350 -1.000 1.00 0.00 H new ATOM 0 HG1 THR A 35 1.397 -10.800 -1.612 1.00 0.00 H new ATOM 0 HG21 THR A 35 1.720 -9.977 0.523 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.017 -8.784 0.770 1.00 0.00 H new ATOM 0 HG23 THR A 35 1.549 -8.330 -0.127 1.00 0.00 H new ATOM 535 N PHE A 36 4.779 -6.683 -0.656 1.00 0.00 N ATOM 536 CA PHE A 36 5.871 -5.975 0.067 1.00 0.00 C ATOM 537 C PHE A 36 5.308 -4.770 0.877 1.00 0.00 C ATOM 538 O PHE A 36 4.164 -4.349 0.710 1.00 0.00 O ATOM 539 CB PHE A 36 7.044 -5.587 -0.894 1.00 0.00 C ATOM 540 CG PHE A 36 6.742 -4.783 -2.164 1.00 0.00 C ATOM 541 CD1 PHE A 36 6.418 -5.458 -3.343 1.00 0.00 C ATOM 542 CD2 PHE A 36 6.819 -3.389 -2.172 1.00 0.00 C ATOM 543 CE1 PHE A 36 6.163 -4.748 -4.507 1.00 0.00 C ATOM 544 CE2 PHE A 36 6.555 -2.679 -3.336 1.00 0.00 C ATOM 545 CZ PHE A 36 6.236 -3.358 -4.503 1.00 0.00 C ATOM 0 H PHE A 36 3.940 -6.118 -0.788 1.00 0.00 H new ATOM 0 HA PHE A 36 6.305 -6.661 0.795 1.00 0.00 H new ATOM 0 HB2 PHE A 36 7.769 -5.019 -0.312 1.00 0.00 H new ATOM 0 HB3 PHE A 36 7.535 -6.511 -1.201 1.00 0.00 H new ATOM 0 HD1 PHE A 36 6.366 -6.537 -3.348 1.00 0.00 H new ATOM 0 HD2 PHE A 36 7.085 -2.860 -1.269 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.908 -5.273 -5.416 1.00 0.00 H new ATOM 0 HE2 PHE A 36 6.598 -1.600 -3.333 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.044 -2.806 -5.411 1.00 0.00 H new ATOM 555 N HIS A 37 6.144 -4.198 1.754 1.00 0.00 N ATOM 556 CA HIS A 37 5.900 -2.870 2.382 1.00 0.00 C ATOM 557 C HIS A 37 6.581 -1.719 1.593 1.00 0.00 C ATOM 558 O HIS A 37 7.493 -1.937 0.799 1.00 0.00 O ATOM 559 CB HIS A 37 6.451 -2.926 3.830 1.00 0.00 C ATOM 560 CG HIS A 37 5.514 -3.587 4.833 1.00 0.00 C ATOM 561 ND1 HIS A 37 4.377 -2.974 5.297 1.00 0.00 N ATOM 562 CD2 HIS A 37 5.723 -4.793 5.524 1.00 0.00 C ATOM 563 CE1 HIS A 37 4.013 -3.859 6.262 1.00 0.00 C ATOM 564 NE2 HIS A 37 4.739 -4.999 6.479 1.00 0.00 N ATOM 0 H HIS A 37 7.014 -4.636 2.056 1.00 0.00 H new ATOM 0 HA HIS A 37 4.830 -2.662 2.377 1.00 0.00 H new ATOM 0 HB2 HIS A 37 7.398 -3.466 3.825 1.00 0.00 H new ATOM 0 HB3 HIS A 37 6.664 -1.911 4.164 1.00 0.00 H new ATOM 0 HD2 HIS A 37 6.543 -5.471 5.336 1.00 0.00 H new ATOM 0 HE1 HIS A 37 3.140 -3.660 6.865 1.00 0.00 H new ATOM 0 HE2 HIS A 37 4.599 -5.764 7.139 1.00 0.00 H new ATOM 572 N TYR A 38 6.118 -0.481 1.835 1.00 0.00 N ATOM 573 CA TYR A 38 6.606 0.738 1.132 1.00 0.00 C ATOM 574 C TYR A 38 6.600 1.943 2.118 1.00 0.00 C ATOM 575 O TYR A 38 5.739 2.049 2.998 1.00 0.00 O ATOM 576 CB TYR A 38 5.747 0.964 -0.161 1.00 0.00 C ATOM 577 CG TYR A 38 4.471 1.836 -0.084 1.00 0.00 C ATOM 578 CD1 TYR A 38 3.241 1.309 0.308 1.00 0.00 C ATOM 579 CD2 TYR A 38 4.541 3.178 -0.467 1.00 0.00 C ATOM 580 CE1 TYR A 38 2.081 2.076 0.224 1.00 0.00 C ATOM 581 CE2 TYR A 38 3.388 3.958 -0.523 1.00 0.00 C ATOM 582 CZ TYR A 38 2.155 3.400 -0.202 1.00 0.00 C ATOM 583 OH TYR A 38 1.005 4.130 -0.345 1.00 0.00 O ATOM 0 H TYR A 38 5.392 -0.287 2.525 1.00 0.00 H new ATOM 0 HA TYR A 38 7.638 0.621 0.802 1.00 0.00 H new ATOM 0 HB2 TYR A 38 6.400 1.406 -0.914 1.00 0.00 H new ATOM 0 HB3 TYR A 38 5.451 -0.017 -0.532 1.00 0.00 H new ATOM 0 HD1 TYR A 38 3.187 0.297 0.680 1.00 0.00 H new ATOM 0 HD2 TYR A 38 5.496 3.614 -0.721 1.00 0.00 H new ATOM 0 HE1 TYR A 38 1.127 1.645 0.489 1.00 0.00 H new ATOM 0 HE2 TYR A 38 3.452 4.996 -0.816 1.00 0.00 H new ATOM 0 HH TYR A 38 0.333 3.811 0.293 1.00 0.00 H new ATOM 593 N ARG A 39 7.535 2.887 1.922 1.00 0.00 N ATOM 594 CA ARG A 39 7.590 4.131 2.732 1.00 0.00 C ATOM 595 C ARG A 39 8.232 5.228 1.855 1.00 0.00 C ATOM 596 O ARG A 39 9.458 5.336 1.751 1.00 0.00 O ATOM 597 CB ARG A 39 8.341 3.884 4.066 1.00 0.00 C ATOM 598 CG ARG A 39 7.938 4.796 5.252 1.00 0.00 C ATOM 599 CD ARG A 39 8.963 5.878 5.635 1.00 0.00 C ATOM 600 NE ARG A 39 10.266 5.314 6.079 1.00 0.00 N ATOM 601 CZ ARG A 39 11.168 5.967 6.834 1.00 0.00 C ATOM 602 NH1 ARG A 39 10.982 7.188 7.331 1.00 0.00 N ATOM 603 NH2 ARG A 39 12.309 5.356 7.098 1.00 0.00 N ATOM 0 H ARG A 39 8.265 2.820 1.213 1.00 0.00 H new ATOM 0 HA ARG A 39 6.593 4.462 3.024 1.00 0.00 H new ATOM 0 HB2 ARG A 39 8.184 2.847 4.362 1.00 0.00 H new ATOM 0 HB3 ARG A 39 9.409 4.006 3.886 1.00 0.00 H new ATOM 0 HG2 ARG A 39 6.995 5.284 5.008 1.00 0.00 H new ATOM 0 HG3 ARG A 39 7.755 4.168 6.124 1.00 0.00 H new ATOM 0 HD2 ARG A 39 9.129 6.532 4.779 1.00 0.00 H new ATOM 0 HD3 ARG A 39 8.550 6.496 6.433 1.00 0.00 H new ATOM 0 HE ARG A 39 10.492 4.362 5.790 1.00 0.00 H new ATOM 0 HH11 ARG A 39 10.112 7.687 7.146 1.00 0.00 H new ATOM 0 HH12 ARG A 39 11.710 7.625 7.897 1.00 0.00 H new ATOM 0 HH21 ARG A 39 12.483 4.420 6.733 1.00 0.00 H new ATOM 0 HH22 ARG A 39 13.016 5.821 7.667 1.00 0.00 H new ATOM 617 N THR A 40 7.373 6.040 1.219 1.00 0.00 N ATOM 618 CA THR A 40 7.807 7.148 0.338 1.00 0.00 C ATOM 619 C THR A 40 8.062 8.397 1.219 1.00 0.00 C ATOM 620 O THR A 40 7.157 8.883 1.905 1.00 0.00 O ATOM 621 CB THR A 40 6.779 7.424 -0.794 1.00 0.00 C ATOM 622 OG1 THR A 40 5.539 7.884 -0.282 1.00 0.00 O ATOM 623 CG2 THR A 40 6.471 6.222 -1.703 1.00 0.00 C ATOM 0 H THR A 40 6.360 5.952 1.297 1.00 0.00 H new ATOM 0 HA THR A 40 8.731 6.873 -0.171 1.00 0.00 H new ATOM 0 HB THR A 40 7.276 8.187 -1.393 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.822 7.658 -0.910 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.744 6.515 -2.460 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.388 5.890 -2.190 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.063 5.408 -1.104 1.00 0.00 H new ATOM 631 N LEU A 41 9.307 8.889 1.206 1.00 0.00 N ATOM 632 CA LEU A 41 9.698 10.119 1.926 1.00 0.00 C ATOM 633 C LEU A 41 10.584 11.012 1.015 1.00 0.00 C ATOM 634 O LEU A 41 11.266 10.540 0.101 1.00 0.00 O ATOM 635 CB LEU A 41 10.302 9.765 3.316 1.00 0.00 C ATOM 636 CG LEU A 41 11.751 9.197 3.398 1.00 0.00 C ATOM 637 CD1 LEU A 41 12.436 9.639 4.706 1.00 0.00 C ATOM 638 CD2 LEU A 41 11.796 7.664 3.262 1.00 0.00 C ATOM 0 H LEU A 41 10.075 8.450 0.698 1.00 0.00 H new ATOM 0 HA LEU A 41 8.824 10.729 2.153 1.00 0.00 H new ATOM 0 HB2 LEU A 41 10.269 10.668 3.926 1.00 0.00 H new ATOM 0 HB3 LEU A 41 9.639 9.039 3.786 1.00 0.00 H new ATOM 0 HG LEU A 41 12.297 9.610 2.550 1.00 0.00 H new ATOM 0 HD11 LEU A 41 13.446 9.232 4.743 1.00 0.00 H new ATOM 0 HD12 LEU A 41 12.482 10.727 4.743 1.00 0.00 H new ATOM 0 HD13 LEU A 41 11.865 9.271 5.558 1.00 0.00 H new ATOM 0 HD21 LEU A 41 12.829 7.323 3.326 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.214 7.210 4.064 1.00 0.00 H new ATOM 0 HD23 LEU A 41 11.377 7.372 2.299 1.00 0.00 H new ATOM 650 N HIS A 42 10.589 12.323 1.295 1.00 0.00 N ATOM 651 CA HIS A 42 11.392 13.321 0.541 1.00 0.00 C ATOM 652 C HIS A 42 12.914 13.144 0.803 1.00 0.00 C ATOM 653 O HIS A 42 13.346 12.950 1.944 1.00 0.00 O ATOM 654 CB HIS A 42 10.887 14.744 0.920 1.00 0.00 C ATOM 655 CG HIS A 42 9.593 15.141 0.202 1.00 0.00 C ATOM 656 ND1 HIS A 42 8.313 14.868 0.650 1.00 0.00 N ATOM 657 CD2 HIS A 42 9.532 15.727 -1.071 1.00 0.00 C ATOM 658 CE1 HIS A 42 7.584 15.337 -0.408 1.00 0.00 C ATOM 659 NE2 HIS A 42 8.218 15.875 -1.499 1.00 0.00 N ATOM 0 H HIS A 42 10.038 12.731 2.050 1.00 0.00 H new ATOM 0 HA HIS A 42 11.259 13.171 -0.530 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.725 14.789 1.997 1.00 0.00 H new ATOM 0 HB3 HIS A 42 11.663 15.472 0.684 1.00 0.00 H new ATOM 0 HD2 HIS A 42 10.396 16.025 -1.646 1.00 0.00 H new ATOM 0 HE1 HIS A 42 6.506 15.284 -0.384 1.00 0.00 H new ATOM 0 HE2 HIS A 42 7.840 16.265 -2.362 1.00 0.00 H new ATOM 667 N SER A 43 13.710 13.174 -0.281 1.00 0.00 N ATOM 668 CA SER A 43 15.169 12.879 -0.225 1.00 0.00 C ATOM 669 C SER A 43 16.013 14.004 0.446 1.00 0.00 C ATOM 670 O SER A 43 16.713 13.727 1.424 1.00 0.00 O ATOM 671 CB SER A 43 15.670 12.501 -1.639 1.00 0.00 C ATOM 672 OG SER A 43 16.991 11.975 -1.590 1.00 0.00 O ATOM 0 H SER A 43 13.372 13.400 -1.216 1.00 0.00 H new ATOM 0 HA SER A 43 15.313 12.023 0.435 1.00 0.00 H new ATOM 0 HB2 SER A 43 14.998 11.765 -2.082 1.00 0.00 H new ATOM 0 HB3 SER A 43 15.649 13.380 -2.283 1.00 0.00 H new ATOM 0 HG SER A 43 17.284 11.742 -2.496 1.00 0.00 H new ATOM 678 N ASP A 44 15.946 15.245 -0.077 1.00 0.00 N ATOM 679 CA ASP A 44 16.674 16.422 0.486 1.00 0.00 C ATOM 680 C ASP A 44 15.864 17.767 0.498 1.00 0.00 C ATOM 681 O ASP A 44 16.340 18.730 1.108 1.00 0.00 O ATOM 682 CB ASP A 44 18.038 16.546 -0.255 1.00 0.00 C ATOM 683 CG ASP A 44 19.082 17.443 0.425 1.00 0.00 C ATOM 684 OD1 ASP A 44 19.689 17.010 1.429 1.00 0.00 O ATOM 685 OD2 ASP A 44 19.295 18.585 -0.040 1.00 0.00 O ATOM 0 H ASP A 44 15.389 15.469 -0.901 1.00 0.00 H new ATOM 0 HA ASP A 44 16.834 16.235 1.548 1.00 0.00 H new ATOM 0 HB2 ASP A 44 18.461 15.548 -0.369 1.00 0.00 H new ATOM 0 HB3 ASP A 44 17.853 16.930 -1.258 1.00 0.00 H new ATOM 690 N ASP A 45 14.654 17.850 -0.101 1.00 0.00 N ATOM 691 CA ASP A 45 13.732 19.016 0.037 1.00 0.00 C ATOM 692 C ASP A 45 13.324 19.347 1.505 1.00 0.00 C ATOM 693 O ASP A 45 13.458 20.499 1.926 1.00 0.00 O ATOM 694 CB ASP A 45 12.497 18.733 -0.856 1.00 0.00 C ATOM 695 CG ASP A 45 11.483 19.875 -1.021 1.00 0.00 C ATOM 696 OD1 ASP A 45 11.814 20.893 -1.666 1.00 0.00 O ATOM 697 OD2 ASP A 45 10.347 19.749 -0.514 1.00 0.00 O ATOM 0 H ASP A 45 14.282 17.111 -0.697 1.00 0.00 H new ATOM 0 HA ASP A 45 14.258 19.913 -0.289 1.00 0.00 H new ATOM 0 HB2 ASP A 45 12.852 18.449 -1.847 1.00 0.00 H new ATOM 0 HB3 ASP A 45 11.972 17.870 -0.446 1.00 0.00 H new ATOM 702 N GLU A 46 12.840 18.338 2.253 1.00 0.00 N ATOM 703 CA GLU A 46 12.583 18.447 3.710 1.00 0.00 C ATOM 704 C GLU A 46 13.189 17.244 4.501 1.00 0.00 C ATOM 705 O GLU A 46 13.653 17.439 5.628 1.00 0.00 O ATOM 706 CB GLU A 46 11.059 18.635 3.977 1.00 0.00 C ATOM 707 CG GLU A 46 10.663 19.433 5.244 1.00 0.00 C ATOM 708 CD GLU A 46 11.064 18.835 6.599 1.00 0.00 C ATOM 709 OE1 GLU A 46 10.657 17.695 6.914 1.00 0.00 O ATOM 710 OE2 GLU A 46 11.802 19.505 7.354 1.00 0.00 O ATOM 0 H GLU A 46 12.614 17.421 1.868 1.00 0.00 H new ATOM 0 HA GLU A 46 13.094 19.334 4.084 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.622 19.133 3.112 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.601 17.648 4.041 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.103 20.427 5.169 1.00 0.00 H new ATOM 0 HG3 GLU A 46 9.581 19.562 5.238 1.00 0.00 H new ATOM 717 N GLY A 47 13.125 16.010 3.963 1.00 0.00 N ATOM 718 CA GLY A 47 13.131 14.779 4.780 1.00 0.00 C ATOM 719 C GLY A 47 11.761 14.270 5.318 1.00 0.00 C ATOM 720 O GLY A 47 11.760 13.353 6.143 1.00 0.00 O ATOM 0 H GLY A 47 13.068 15.838 2.959 1.00 0.00 H new ATOM 0 HA2 GLY A 47 13.577 13.982 4.185 1.00 0.00 H new ATOM 0 HA3 GLY A 47 13.788 14.945 5.634 1.00 0.00 H new ATOM 724 N THR A 48 10.620 14.835 4.868 1.00 0.00 N ATOM 725 CA THR A 48 9.264 14.487 5.377 1.00 0.00 C ATOM 726 C THR A 48 8.711 13.202 4.706 1.00 0.00 C ATOM 727 O THR A 48 8.817 13.025 3.492 1.00 0.00 O ATOM 728 CB THR A 48 8.297 15.702 5.216 1.00 0.00 C ATOM 729 OG1 THR A 48 7.099 15.459 5.948 1.00 0.00 O ATOM 730 CG2 THR A 48 7.906 16.090 3.777 1.00 0.00 C ATOM 0 H THR A 48 10.607 15.548 4.139 1.00 0.00 H new ATOM 0 HA THR A 48 9.343 14.264 6.441 1.00 0.00 H new ATOM 0 HB THR A 48 8.872 16.545 5.599 1.00 0.00 H new ATOM 0 HG1 THR A 48 6.494 16.223 5.848 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.232 16.947 3.801 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.802 16.349 3.214 1.00 0.00 H new ATOM 0 HG23 THR A 48 7.406 15.249 3.296 1.00 0.00 H new ATOM 738 N VAL A 49 8.057 12.350 5.510 1.00 0.00 N ATOM 739 CA VAL A 49 7.367 11.134 5.007 1.00 0.00 C ATOM 740 C VAL A 49 5.951 11.540 4.522 1.00 0.00 C ATOM 741 O VAL A 49 5.082 11.934 5.306 1.00 0.00 O ATOM 742 CB VAL A 49 7.444 9.934 6.002 1.00 0.00 C ATOM 743 CG1 VAL A 49 6.974 10.243 7.440 1.00 0.00 C ATOM 744 CG2 VAL A 49 6.719 8.676 5.485 1.00 0.00 C ATOM 0 H VAL A 49 7.987 12.475 6.520 1.00 0.00 H new ATOM 0 HA VAL A 49 7.889 10.727 4.141 1.00 0.00 H new ATOM 0 HB VAL A 49 8.514 9.736 6.056 1.00 0.00 H new ATOM 0 HG11 VAL A 49 7.066 9.347 8.053 1.00 0.00 H new ATOM 0 HG12 VAL A 49 7.591 11.036 7.862 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.933 10.564 7.421 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.808 7.877 6.221 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.666 8.904 5.323 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.170 8.356 4.546 1.00 0.00 H new ATOM 754 N LEU A 50 5.767 11.417 3.200 1.00 0.00 N ATOM 755 CA LEU A 50 4.457 11.618 2.543 1.00 0.00 C ATOM 756 C LEU A 50 3.507 10.378 2.592 1.00 0.00 C ATOM 757 O LEU A 50 2.288 10.568 2.603 1.00 0.00 O ATOM 758 CB LEU A 50 4.701 12.132 1.094 1.00 0.00 C ATOM 759 CG LEU A 50 5.333 11.129 0.081 1.00 0.00 C ATOM 760 CD1 LEU A 50 4.356 10.773 -1.041 1.00 0.00 C ATOM 761 CD2 LEU A 50 6.671 11.608 -0.506 1.00 0.00 C ATOM 0 H LEU A 50 6.517 11.176 2.552 1.00 0.00 H new ATOM 0 HA LEU A 50 3.912 12.370 3.114 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.746 12.466 0.688 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.347 13.008 1.150 1.00 0.00 H new ATOM 0 HG LEU A 50 5.549 10.231 0.660 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.831 10.072 -1.728 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.463 10.315 -0.615 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.077 11.678 -1.581 1.00 0.00 H new ATOM 0 HD21 LEU A 50 7.051 10.860 -1.202 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.521 12.551 -1.032 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.391 11.753 0.300 1.00 0.00 H new ATOM 773 N ASP A 51 4.055 9.137 2.585 1.00 0.00 N ATOM 774 CA ASP A 51 3.258 7.889 2.581 1.00 0.00 C ATOM 775 C ASP A 51 4.043 6.769 3.334 1.00 0.00 C ATOM 776 O ASP A 51 5.273 6.693 3.255 1.00 0.00 O ATOM 777 CB ASP A 51 2.869 7.475 1.131 1.00 0.00 C ATOM 778 CG ASP A 51 1.419 7.008 0.955 1.00 0.00 C ATOM 779 OD1 ASP A 51 0.945 6.166 1.752 1.00 0.00 O ATOM 780 OD2 ASP A 51 0.749 7.471 0.006 1.00 0.00 O ATOM 0 H ASP A 51 5.062 8.976 2.582 1.00 0.00 H new ATOM 0 HA ASP A 51 2.320 8.056 3.110 1.00 0.00 H new ATOM 0 HB2 ASP A 51 3.044 8.322 0.468 1.00 0.00 H new ATOM 0 HB3 ASP A 51 3.534 6.674 0.807 1.00 0.00 H new ATOM 785 N ASP A 52 3.329 5.903 4.078 1.00 0.00 N ATOM 786 CA ASP A 52 3.943 4.933 5.021 1.00 0.00 C ATOM 787 C ASP A 52 2.989 3.725 5.241 1.00 0.00 C ATOM 788 O ASP A 52 1.837 3.886 5.657 1.00 0.00 O ATOM 789 CB ASP A 52 4.369 5.617 6.351 1.00 0.00 C ATOM 790 CG ASP A 52 3.315 6.423 7.138 1.00 0.00 C ATOM 791 OD1 ASP A 52 2.463 5.818 7.825 1.00 0.00 O ATOM 792 OD2 ASP A 52 3.337 7.672 7.059 1.00 0.00 O ATOM 0 H ASP A 52 2.311 5.852 4.046 1.00 0.00 H new ATOM 0 HA ASP A 52 4.862 4.547 4.579 1.00 0.00 H new ATOM 0 HB2 ASP A 52 4.755 4.842 7.013 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.199 6.287 6.127 1.00 0.00 H new ATOM 797 N SER A 53 3.510 2.518 4.968 1.00 0.00 N ATOM 798 CA SER A 53 2.776 1.232 5.162 1.00 0.00 C ATOM 799 C SER A 53 3.329 0.381 6.332 1.00 0.00 C ATOM 800 O SER A 53 2.544 -0.017 7.195 1.00 0.00 O ATOM 801 CB SER A 53 2.721 0.433 3.842 1.00 0.00 C ATOM 802 OG SER A 53 1.642 0.896 3.041 1.00 0.00 O ATOM 0 H SER A 53 4.455 2.393 4.605 1.00 0.00 H new ATOM 0 HA SER A 53 1.757 1.490 5.450 1.00 0.00 H new ATOM 0 HB2 SER A 53 3.661 0.543 3.301 1.00 0.00 H new ATOM 0 HB3 SER A 53 2.598 -0.629 4.054 1.00 0.00 H new ATOM 0 HG SER A 53 1.981 1.173 2.164 1.00 0.00 H new ATOM 808 N ARG A 54 4.647 0.106 6.380 1.00 0.00 N ATOM 809 CA ARG A 54 5.321 -0.525 7.549 1.00 0.00 C ATOM 810 C ARG A 54 5.326 0.271 8.886 1.00 0.00 C ATOM 811 O ARG A 54 5.446 -0.347 9.947 1.00 0.00 O ATOM 812 CB ARG A 54 6.769 -0.958 7.167 1.00 0.00 C ATOM 813 CG ARG A 54 7.671 0.018 6.359 1.00 0.00 C ATOM 814 CD ARG A 54 8.115 1.329 7.032 1.00 0.00 C ATOM 815 NE ARG A 54 8.852 1.132 8.305 1.00 0.00 N ATOM 816 CZ ARG A 54 9.161 2.123 9.163 1.00 0.00 C ATOM 817 NH1 ARG A 54 8.865 3.406 8.961 1.00 0.00 N ATOM 818 NH2 ARG A 54 9.797 1.802 10.275 1.00 0.00 N ATOM 0 H ARG A 54 5.283 0.313 5.610 1.00 0.00 H new ATOM 0 HA ARG A 54 4.692 -1.387 7.773 1.00 0.00 H new ATOM 0 HB2 ARG A 54 7.293 -1.198 8.092 1.00 0.00 H new ATOM 0 HB3 ARG A 54 6.693 -1.883 6.595 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.569 -0.526 6.065 1.00 0.00 H new ATOM 0 HG3 ARG A 54 7.142 0.278 5.442 1.00 0.00 H new ATOM 0 HD2 ARG A 54 8.747 1.885 6.340 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.235 1.943 7.224 1.00 0.00 H new ATOM 0 HE ARG A 54 9.143 0.185 8.546 1.00 0.00 H new ATOM 0 HH11 ARG A 54 8.374 3.689 8.113 1.00 0.00 H new ATOM 0 HH12 ARG A 54 9.130 4.106 9.654 1.00 0.00 H new ATOM 0 HH21 ARG A 54 10.039 0.829 10.462 1.00 0.00 H new ATOM 0 HH22 ARG A 54 10.047 2.527 10.947 1.00 0.00 H new ATOM 832 N ALA A 55 5.148 1.607 8.844 1.00 0.00 N ATOM 833 CA ALA A 55 4.801 2.415 10.035 1.00 0.00 C ATOM 834 C ALA A 55 3.485 1.998 10.772 1.00 0.00 C ATOM 835 O ALA A 55 3.457 1.952 12.005 1.00 0.00 O ATOM 836 CB ALA A 55 4.730 3.883 9.589 1.00 0.00 C ATOM 0 H ALA A 55 5.240 2.156 7.989 1.00 0.00 H new ATOM 0 HA ALA A 55 5.579 2.244 10.779 1.00 0.00 H new ATOM 0 HB1 ALA A 55 4.476 4.511 10.443 1.00 0.00 H new ATOM 0 HB2 ALA A 55 5.697 4.189 9.189 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.967 3.993 8.818 1.00 0.00 H new ATOM 842 N ARG A 56 2.434 1.666 10.000 1.00 0.00 N ATOM 843 CA ARG A 56 1.198 1.012 10.511 1.00 0.00 C ATOM 844 C ARG A 56 1.297 -0.539 10.723 1.00 0.00 C ATOM 845 O ARG A 56 0.516 -1.081 11.511 1.00 0.00 O ATOM 846 CB ARG A 56 0.025 1.316 9.531 1.00 0.00 C ATOM 847 CG ARG A 56 -0.270 2.795 9.162 1.00 0.00 C ATOM 848 CD ARG A 56 -0.576 3.760 10.327 1.00 0.00 C ATOM 849 NE ARG A 56 -1.810 3.398 11.068 1.00 0.00 N ATOM 850 CZ ARG A 56 -2.267 4.054 12.152 1.00 0.00 C ATOM 851 NH1 ARG A 56 -1.681 5.133 12.672 1.00 0.00 N ATOM 852 NH2 ARG A 56 -3.362 3.601 12.734 1.00 0.00 N ATOM 0 H ARG A 56 2.411 1.842 8.996 1.00 0.00 H new ATOM 0 HA ARG A 56 1.031 1.432 11.503 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.219 0.776 8.604 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.884 0.894 9.961 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.588 3.185 8.615 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -1.118 2.811 8.477 1.00 0.00 H new ATOM 0 HD2 ARG A 56 0.267 3.767 11.017 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -0.677 4.773 9.936 1.00 0.00 H new ATOM 0 HE ARG A 56 -2.348 2.599 10.734 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -0.834 5.509 12.246 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -2.080 5.583 13.496 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -3.835 2.778 12.361 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -3.735 4.074 13.557 1.00 0.00 H new ATOM 866 N GLY A 57 2.189 -1.249 9.999 1.00 0.00 N ATOM 867 CA GLY A 57 2.161 -2.728 9.881 1.00 0.00 C ATOM 868 C GLY A 57 1.183 -3.347 8.847 1.00 0.00 C ATOM 869 O GLY A 57 0.799 -4.506 9.023 1.00 0.00 O ATOM 0 H GLY A 57 2.951 -0.815 9.478 1.00 0.00 H new ATOM 0 HA2 GLY A 57 3.168 -3.065 9.635 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.918 -3.139 10.861 1.00 0.00 H new ATOM 873 N LYS A 58 0.807 -2.605 7.783 1.00 0.00 N ATOM 874 CA LYS A 58 -0.204 -3.038 6.785 1.00 0.00 C ATOM 875 C LYS A 58 0.478 -3.099 5.377 1.00 0.00 C ATOM 876 O LYS A 58 0.663 -2.035 4.777 1.00 0.00 O ATOM 877 CB LYS A 58 -1.438 -2.083 6.782 1.00 0.00 C ATOM 878 CG LYS A 58 -2.161 -1.793 8.120 1.00 0.00 C ATOM 879 CD LYS A 58 -2.563 -3.038 8.930 1.00 0.00 C ATOM 880 CE LYS A 58 -3.447 -2.701 10.144 1.00 0.00 C ATOM 881 NZ LYS A 58 -3.793 -3.909 10.912 1.00 0.00 N ATOM 0 H LYS A 58 1.197 -1.683 7.588 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.577 -4.028 7.047 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.115 -1.128 6.368 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -2.174 -2.497 6.092 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.513 -1.171 8.737 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.058 -1.210 7.911 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -3.096 -3.732 8.280 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.663 -3.549 9.272 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.926 -1.995 10.790 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.359 -2.210 9.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.389 -3.646 11.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.312 -4.572 10.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -2.923 -4.363 11.255 1.00 0.00 H new ATOM 895 N PRO A 59 0.867 -4.279 4.807 1.00 0.00 N ATOM 896 CA PRO A 59 1.620 -4.352 3.525 1.00 0.00 C ATOM 897 C PRO A 59 0.743 -4.166 2.257 1.00 0.00 C ATOM 898 O PRO A 59 -0.426 -4.565 2.204 1.00 0.00 O ATOM 899 CB PRO A 59 2.274 -5.749 3.593 1.00 0.00 C ATOM 900 CG PRO A 59 1.389 -6.575 4.526 1.00 0.00 C ATOM 901 CD PRO A 59 0.784 -5.578 5.501 1.00 0.00 C ATOM 0 HA PRO A 59 2.337 -3.537 3.427 1.00 0.00 H new ATOM 0 HB2 PRO A 59 2.331 -6.203 2.604 1.00 0.00 H new ATOM 0 HB3 PRO A 59 3.293 -5.686 3.974 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.613 -7.099 3.968 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.971 -7.333 5.050 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.248 -5.834 5.740 1.00 0.00 H new ATOM 0 HD3 PRO A 59 1.334 -5.560 6.442 1.00 0.00 H new ATOM 909 N MET A 60 1.368 -3.568 1.233 1.00 0.00 N ATOM 910 CA MET A 60 0.749 -3.352 -0.103 1.00 0.00 C ATOM 911 C MET A 60 0.903 -4.590 -1.051 1.00 0.00 C ATOM 912 O MET A 60 1.515 -5.608 -0.707 1.00 0.00 O ATOM 913 CB MET A 60 1.311 -2.018 -0.687 1.00 0.00 C ATOM 914 CG MET A 60 2.842 -1.903 -0.823 1.00 0.00 C ATOM 915 SD MET A 60 3.543 -3.252 -1.775 1.00 0.00 S ATOM 916 CE MET A 60 3.174 -2.706 -3.432 1.00 0.00 C ATOM 0 H MET A 60 2.323 -3.215 1.298 1.00 0.00 H new ATOM 0 HA MET A 60 -0.332 -3.252 -0.002 1.00 0.00 H new ATOM 0 HB2 MET A 60 0.871 -1.868 -1.673 1.00 0.00 H new ATOM 0 HB3 MET A 60 0.965 -1.200 -0.056 1.00 0.00 H new ATOM 0 HG2 MET A 60 3.092 -0.956 -1.301 1.00 0.00 H new ATOM 0 HG3 MET A 60 3.293 -1.889 0.169 1.00 0.00 H new ATOM 0 HE1 MET A 60 3.366 -3.518 -4.134 1.00 0.00 H new ATOM 0 HE2 MET A 60 2.126 -2.414 -3.494 1.00 0.00 H new ATOM 0 HE3 MET A 60 3.804 -1.853 -3.683 1.00 0.00 H new ATOM 926 N GLU A 61 0.329 -4.467 -2.263 1.00 0.00 N ATOM 927 CA GLU A 61 0.414 -5.504 -3.327 1.00 0.00 C ATOM 928 C GLU A 61 0.511 -4.799 -4.707 1.00 0.00 C ATOM 929 O GLU A 61 -0.415 -4.111 -5.151 1.00 0.00 O ATOM 930 CB GLU A 61 -0.800 -6.479 -3.261 1.00 0.00 C ATOM 931 CG GLU A 61 -0.494 -7.791 -2.514 1.00 0.00 C ATOM 932 CD GLU A 61 -1.735 -8.638 -2.225 1.00 0.00 C ATOM 933 OE1 GLU A 61 -2.437 -8.359 -1.228 1.00 0.00 O ATOM 934 OE2 GLU A 61 -2.012 -9.590 -2.989 1.00 0.00 O ATOM 0 H GLU A 61 -0.210 -3.646 -2.539 1.00 0.00 H new ATOM 0 HA GLU A 61 1.307 -6.110 -3.175 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.633 -5.976 -2.770 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -1.123 -6.714 -4.275 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.207 -8.380 -3.105 1.00 0.00 H new ATOM 0 HG3 GLU A 61 0.002 -7.555 -1.572 1.00 0.00 H new ATOM 941 N LEU A 62 1.655 -5.021 -5.378 1.00 0.00 N ATOM 942 CA LEU A 62 1.936 -4.524 -6.746 1.00 0.00 C ATOM 943 C LEU A 62 1.836 -5.731 -7.711 1.00 0.00 C ATOM 944 O LEU A 62 2.353 -6.827 -7.463 1.00 0.00 O ATOM 945 CB LEU A 62 3.337 -3.844 -6.771 1.00 0.00 C ATOM 946 CG LEU A 62 4.044 -3.602 -8.136 1.00 0.00 C ATOM 947 CD1 LEU A 62 3.585 -2.315 -8.819 1.00 0.00 C ATOM 948 CD2 LEU A 62 5.562 -3.704 -8.048 1.00 0.00 C ATOM 0 H LEU A 62 2.426 -5.559 -4.983 1.00 0.00 H new ATOM 0 HA LEU A 62 1.217 -3.768 -7.062 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.240 -2.877 -6.277 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.006 -4.450 -6.159 1.00 0.00 H new ATOM 0 HG LEU A 62 3.725 -4.421 -8.780 1.00 0.00 H new ATOM 0 HD11 LEU A 62 4.111 -2.198 -9.766 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.512 -2.364 -9.004 1.00 0.00 H new ATOM 0 HD13 LEU A 62 3.804 -1.463 -8.175 1.00 0.00 H new ATOM 0 HD21 LEU A 62 5.996 -3.525 -9.032 1.00 0.00 H new ATOM 0 HD22 LEU A 62 5.937 -2.960 -7.345 1.00 0.00 H new ATOM 0 HD23 LEU A 62 5.840 -4.700 -7.704 1.00 0.00 H new ATOM 960 N ILE A 63 1.222 -5.447 -8.863 1.00 0.00 N ATOM 961 CA ILE A 63 1.151 -6.385 -10.007 1.00 0.00 C ATOM 962 C ILE A 63 2.224 -5.880 -11.017 1.00 0.00 C ATOM 963 O ILE A 63 2.232 -4.718 -11.441 1.00 0.00 O ATOM 964 CB ILE A 63 -0.292 -6.465 -10.621 1.00 0.00 C ATOM 965 CG1 ILE A 63 -1.400 -7.012 -9.678 1.00 0.00 C ATOM 966 CG2 ILE A 63 -0.335 -7.348 -11.891 1.00 0.00 C ATOM 967 CD1 ILE A 63 -1.762 -6.115 -8.492 1.00 0.00 C ATOM 0 H ILE A 63 0.755 -4.557 -9.038 1.00 0.00 H new ATOM 0 HA ILE A 63 1.357 -7.412 -9.705 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.506 -5.418 -10.834 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -2.300 -7.185 -10.267 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.079 -7.980 -9.294 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.352 -7.375 -12.281 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.333 -6.932 -12.646 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.016 -8.360 -11.642 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -2.544 -6.592 -7.901 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -0.880 -5.960 -7.870 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -2.120 -5.153 -8.859 1.00 0.00 H new ATOM 979 N ILE A 64 3.087 -6.814 -11.440 1.00 0.00 N ATOM 980 CA ILE A 64 4.065 -6.574 -12.541 1.00 0.00 C ATOM 981 C ILE A 64 3.294 -6.639 -13.895 1.00 0.00 C ATOM 982 O ILE A 64 2.803 -7.705 -14.261 1.00 0.00 O ATOM 983 CB ILE A 64 5.297 -7.546 -12.525 1.00 0.00 C ATOM 984 CG1 ILE A 64 6.057 -7.699 -11.174 1.00 0.00 C ATOM 985 CG2 ILE A 64 6.319 -7.220 -13.647 1.00 0.00 C ATOM 986 CD1 ILE A 64 6.625 -6.436 -10.548 1.00 0.00 C ATOM 0 H ILE A 64 3.137 -7.752 -11.042 1.00 0.00 H new ATOM 0 HA ILE A 64 4.503 -5.587 -12.397 1.00 0.00 H new ATOM 0 HB ILE A 64 4.821 -8.510 -12.702 1.00 0.00 H new ATOM 0 HG12 ILE A 64 5.378 -8.156 -10.455 1.00 0.00 H new ATOM 0 HG13 ILE A 64 6.878 -8.399 -11.326 1.00 0.00 H new ATOM 0 HG21 ILE A 64 7.153 -7.920 -13.594 1.00 0.00 H new ATOM 0 HG22 ILE A 64 5.833 -7.308 -14.619 1.00 0.00 H new ATOM 0 HG23 ILE A 64 6.690 -6.203 -13.517 1.00 0.00 H new ATOM 0 HD11 ILE A 64 7.127 -6.687 -9.614 1.00 0.00 H new ATOM 0 HD12 ILE A 64 7.340 -5.980 -11.233 1.00 0.00 H new ATOM 0 HD13 ILE A 64 5.816 -5.734 -10.348 1.00 0.00 H new ATOM 998 N GLY A 65 3.209 -5.514 -14.625 1.00 0.00 N ATOM 999 CA GLY A 65 2.810 -5.495 -16.061 1.00 0.00 C ATOM 1000 C GLY A 65 1.527 -6.241 -16.506 1.00 0.00 C ATOM 1001 O GLY A 65 1.596 -7.135 -17.351 1.00 0.00 O ATOM 0 H GLY A 65 3.412 -4.589 -14.246 1.00 0.00 H new ATOM 0 HA2 GLY A 65 2.700 -4.451 -16.356 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.641 -5.903 -16.636 1.00 0.00 H new ATOM 1005 N LYS A 66 0.379 -5.887 -15.907 1.00 0.00 N ATOM 1006 CA LYS A 66 -0.904 -6.631 -16.066 1.00 0.00 C ATOM 1007 C LYS A 66 -2.054 -5.697 -15.581 1.00 0.00 C ATOM 1008 O LYS A 66 -2.875 -5.274 -16.401 1.00 0.00 O ATOM 1009 CB LYS A 66 -0.826 -8.065 -15.429 1.00 0.00 C ATOM 1010 CG LYS A 66 -2.116 -8.786 -14.975 1.00 0.00 C ATOM 1011 CD LYS A 66 -3.106 -9.161 -16.092 1.00 0.00 C ATOM 1012 CE LYS A 66 -4.374 -9.819 -15.518 1.00 0.00 C ATOM 1013 NZ LYS A 66 -5.300 -10.245 -16.582 1.00 0.00 N ATOM 0 H LYS A 66 0.303 -5.075 -15.294 1.00 0.00 H new ATOM 0 HA LYS A 66 -1.122 -6.865 -17.108 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -0.331 -8.713 -16.152 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -0.171 -7.998 -14.560 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.833 -9.696 -14.446 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -2.632 -8.148 -14.258 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -3.380 -8.268 -16.653 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.625 -9.843 -16.793 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -4.094 -10.682 -14.913 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -4.880 -9.116 -14.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -6.141 -10.683 -16.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -5.588 -9.418 -17.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -4.826 -10.935 -17.199 1.00 0.00 H new ATOM 1027 N LYS A 67 -2.109 -5.387 -14.270 1.00 0.00 N ATOM 1028 CA LYS A 67 -3.122 -4.491 -13.657 1.00 0.00 C ATOM 1029 C LYS A 67 -2.558 -3.074 -13.334 1.00 0.00 C ATOM 1030 O LYS A 67 -3.248 -2.084 -13.599 1.00 0.00 O ATOM 1031 CB LYS A 67 -3.736 -5.225 -12.428 1.00 0.00 C ATOM 1032 CG LYS A 67 -4.966 -4.575 -11.747 1.00 0.00 C ATOM 1033 CD LYS A 67 -4.633 -3.584 -10.610 1.00 0.00 C ATOM 1034 CE LYS A 67 -5.889 -3.019 -9.923 1.00 0.00 C ATOM 1035 NZ LYS A 67 -5.542 -2.047 -8.871 1.00 0.00 N ATOM 0 H LYS A 67 -1.442 -5.756 -13.593 1.00 0.00 H new ATOM 0 HA LYS A 67 -3.919 -4.288 -14.372 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -4.018 -6.230 -12.743 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -2.954 -5.334 -11.676 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.549 -4.052 -12.505 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -5.601 -5.365 -11.346 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -4.013 -4.086 -9.867 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -4.044 -2.760 -11.013 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.526 -2.540 -10.666 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.465 -3.836 -9.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -6.412 -1.687 -8.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -4.955 -2.511 -8.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -5.014 -1.255 -9.290 1.00 0.00 H new ATOM 1049 N PHE A 68 -1.359 -2.973 -12.719 1.00 0.00 N ATOM 1050 CA PHE A 68 -0.889 -1.739 -12.046 1.00 0.00 C ATOM 1051 C PHE A 68 -0.407 -0.641 -13.033 1.00 0.00 C ATOM 1052 O PHE A 68 0.212 -0.910 -14.068 1.00 0.00 O ATOM 1053 CB PHE A 68 0.239 -2.121 -11.046 1.00 0.00 C ATOM 1054 CG PHE A 68 0.252 -1.292 -9.755 1.00 0.00 C ATOM 1055 CD1 PHE A 68 -0.443 -1.769 -8.636 1.00 0.00 C ATOM 1056 CD2 PHE A 68 1.062 -0.156 -9.626 1.00 0.00 C ATOM 1057 CE1 PHE A 68 -0.309 -1.139 -7.407 1.00 0.00 C ATOM 1058 CE2 PHE A 68 1.194 0.473 -8.391 1.00 0.00 C ATOM 1059 CZ PHE A 68 0.518 -0.030 -7.283 1.00 0.00 C ATOM 0 H PHE A 68 -0.690 -3.742 -12.674 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.737 -1.301 -11.519 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.135 -3.174 -10.785 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.202 -2.010 -11.544 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.086 -2.631 -8.730 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.585 0.233 -10.487 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.847 -1.511 -6.548 1.00 0.00 H new ATOM 0 HE2 PHE A 68 1.819 1.348 -8.293 1.00 0.00 H new ATOM 0 HZ PHE A 68 0.637 0.445 -6.321 1.00 0.00 H new ATOM 1069 N LYS A 69 -0.704 0.604 -12.647 1.00 0.00 N ATOM 1070 CA LYS A 69 -0.448 1.810 -13.485 1.00 0.00 C ATOM 1071 C LYS A 69 0.953 2.484 -13.317 1.00 0.00 C ATOM 1072 O LYS A 69 1.383 3.154 -14.259 1.00 0.00 O ATOM 1073 CB LYS A 69 -1.582 2.850 -13.268 1.00 0.00 C ATOM 1074 CG LYS A 69 -3.062 2.393 -13.383 1.00 0.00 C ATOM 1075 CD LYS A 69 -3.478 1.623 -14.654 1.00 0.00 C ATOM 1076 CE LYS A 69 -3.392 2.441 -15.956 1.00 0.00 C ATOM 1077 NZ LYS A 69 -3.863 1.652 -17.108 1.00 0.00 N ATOM 0 H LYS A 69 -1.130 0.819 -11.745 1.00 0.00 H new ATOM 0 HA LYS A 69 -0.441 1.441 -14.511 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.448 3.280 -12.275 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -1.431 3.655 -13.987 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.287 1.764 -12.521 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.693 3.278 -13.305 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.845 0.741 -14.752 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.501 1.269 -14.530 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -3.992 3.346 -15.861 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.362 2.757 -16.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.795 2.226 -17.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -3.274 0.801 -17.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.853 1.372 -16.955 1.00 0.00 H new ATOM 1091 N LEU A 70 1.642 2.347 -12.160 1.00 0.00 N ATOM 1092 CA LEU A 70 2.926 3.025 -11.859 1.00 0.00 C ATOM 1093 C LEU A 70 4.111 2.019 -12.068 1.00 0.00 C ATOM 1094 O LEU A 70 4.309 1.164 -11.196 1.00 0.00 O ATOM 1095 CB LEU A 70 2.811 3.635 -10.430 1.00 0.00 C ATOM 1096 CG LEU A 70 3.865 4.624 -9.863 1.00 0.00 C ATOM 1097 CD1 LEU A 70 4.879 3.938 -8.946 1.00 0.00 C ATOM 1098 CD2 LEU A 70 4.531 5.531 -10.911 1.00 0.00 C ATOM 0 H LEU A 70 1.317 1.753 -11.397 1.00 0.00 H new ATOM 0 HA LEU A 70 3.141 3.851 -12.537 1.00 0.00 H new ATOM 0 HB2 LEU A 70 1.848 4.143 -10.383 1.00 0.00 H new ATOM 0 HB3 LEU A 70 2.763 2.797 -9.735 1.00 0.00 H new ATOM 0 HG LEU A 70 3.287 5.310 -9.244 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.593 4.675 -8.577 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.358 3.484 -8.103 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.410 3.166 -9.503 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.251 6.186 -10.420 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.044 4.916 -11.650 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.770 6.134 -11.406 1.00 0.00 H new ATOM 1110 N PRO A 71 4.904 2.064 -13.183 1.00 0.00 N ATOM 1111 CA PRO A 71 5.993 1.083 -13.465 1.00 0.00 C ATOM 1112 C PRO A 71 7.348 1.231 -12.702 1.00 0.00 C ATOM 1113 O PRO A 71 8.162 0.306 -12.757 1.00 0.00 O ATOM 1114 CB PRO A 71 6.188 1.263 -14.986 1.00 0.00 C ATOM 1115 CG PRO A 71 5.868 2.736 -15.254 1.00 0.00 C ATOM 1116 CD PRO A 71 4.733 3.037 -14.278 1.00 0.00 C ATOM 0 HA PRO A 71 5.693 0.095 -13.115 1.00 0.00 H new ATOM 0 HB2 PRO A 71 7.208 1.020 -15.285 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.525 0.606 -15.550 1.00 0.00 H new ATOM 0 HG2 PRO A 71 6.733 3.374 -15.073 1.00 0.00 H new ATOM 0 HG3 PRO A 71 5.563 2.899 -16.288 1.00 0.00 H new ATOM 0 HD2 PRO A 71 4.791 4.061 -13.909 1.00 0.00 H new ATOM 0 HD3 PRO A 71 3.760 2.925 -14.757 1.00 0.00 H new ATOM 1124 N VAL A 72 7.591 2.362 -12.008 1.00 0.00 N ATOM 1125 CA VAL A 72 8.796 2.547 -11.144 1.00 0.00 C ATOM 1126 C VAL A 72 8.815 1.634 -9.877 1.00 0.00 C ATOM 1127 O VAL A 72 9.884 1.109 -9.565 1.00 0.00 O ATOM 1128 CB VAL A 72 9.097 4.053 -10.868 1.00 0.00 C ATOM 1129 CG1 VAL A 72 8.084 4.781 -9.971 1.00 0.00 C ATOM 1130 CG2 VAL A 72 10.526 4.290 -10.330 1.00 0.00 C ATOM 0 H VAL A 72 6.970 3.171 -12.024 1.00 0.00 H new ATOM 0 HA VAL A 72 9.645 2.184 -11.723 1.00 0.00 H new ATOM 0 HB VAL A 72 9.002 4.497 -11.859 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.390 5.820 -9.845 1.00 0.00 H new ATOM 0 HG12 VAL A 72 7.098 4.747 -10.434 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.045 4.294 -8.997 1.00 0.00 H new ATOM 0 HG21 VAL A 72 10.678 5.355 -10.157 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.657 3.748 -9.393 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.253 3.934 -11.060 1.00 0.00 H new ATOM 1140 N TRP A 73 7.668 1.385 -9.203 1.00 0.00 N ATOM 1141 CA TRP A 73 7.521 0.277 -8.210 1.00 0.00 C ATOM 1142 C TRP A 73 7.982 -1.126 -8.707 1.00 0.00 C ATOM 1143 O TRP A 73 8.639 -1.832 -7.945 1.00 0.00 O ATOM 1144 CB TRP A 73 6.053 0.258 -7.672 1.00 0.00 C ATOM 1145 CG TRP A 73 5.708 1.286 -6.577 1.00 0.00 C ATOM 1146 CD1 TRP A 73 6.407 2.485 -6.310 1.00 0.00 C ATOM 1147 CD2 TRP A 73 4.672 1.266 -5.655 1.00 0.00 C ATOM 1148 NE1 TRP A 73 5.860 3.193 -5.233 1.00 0.00 N ATOM 1149 CE2 TRP A 73 4.780 2.429 -4.851 1.00 0.00 C ATOM 1150 CE3 TRP A 73 3.598 0.362 -5.455 1.00 0.00 C ATOM 1151 CZ2 TRP A 73 3.818 2.700 -3.857 1.00 0.00 C ATOM 1152 CZ3 TRP A 73 2.651 0.659 -4.468 1.00 0.00 C ATOM 1153 CH2 TRP A 73 2.755 1.814 -3.691 1.00 0.00 C ATOM 0 H TRP A 73 6.820 1.938 -9.326 1.00 0.00 H new ATOM 0 HA TRP A 73 8.214 0.495 -7.397 1.00 0.00 H new ATOM 0 HB2 TRP A 73 5.379 0.417 -8.514 1.00 0.00 H new ATOM 0 HB3 TRP A 73 5.846 -0.738 -7.282 1.00 0.00 H new ATOM 0 HD1 TRP A 73 7.266 2.818 -6.873 1.00 0.00 H new ATOM 0 HE1 TRP A 73 6.186 4.070 -4.826 1.00 0.00 H new ATOM 0 HE3 TRP A 73 3.513 -0.535 -6.050 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 3.903 3.579 -3.235 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 1.825 -0.018 -4.305 1.00 0.00 H new ATOM 0 HH2 TRP A 73 1.999 2.025 -2.949 1.00 0.00 H new ATOM 1164 N GLU A 74 7.685 -1.476 -9.972 1.00 0.00 N ATOM 1165 CA GLU A 74 8.123 -2.751 -10.623 1.00 0.00 C ATOM 1166 C GLU A 74 9.660 -2.881 -10.871 1.00 0.00 C ATOM 1167 O GLU A 74 10.219 -3.951 -10.628 1.00 0.00 O ATOM 1168 CB GLU A 74 7.354 -2.962 -11.963 1.00 0.00 C ATOM 1169 CG GLU A 74 5.810 -2.831 -11.954 1.00 0.00 C ATOM 1170 CD GLU A 74 5.130 -2.914 -13.326 1.00 0.00 C ATOM 1171 OE1 GLU A 74 5.682 -3.530 -14.266 1.00 0.00 O ATOM 1172 OE2 GLU A 74 4.013 -2.366 -13.464 1.00 0.00 O ATOM 0 H GLU A 74 7.129 -0.883 -10.588 1.00 0.00 H new ATOM 0 HA GLU A 74 7.879 -3.532 -9.903 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.744 -2.246 -12.686 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.601 -3.957 -12.335 1.00 0.00 H new ATOM 0 HG2 GLU A 74 5.400 -3.615 -11.317 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.547 -1.878 -11.495 1.00 0.00 H new ATOM 1179 N THR A 75 10.322 -1.809 -11.346 1.00 0.00 N ATOM 1180 CA THR A 75 11.802 -1.730 -11.527 1.00 0.00 C ATOM 1181 C THR A 75 12.598 -1.654 -10.181 1.00 0.00 C ATOM 1182 O THR A 75 13.624 -2.329 -10.064 1.00 0.00 O ATOM 1183 CB THR A 75 12.092 -0.534 -12.487 1.00 0.00 C ATOM 1184 OG1 THR A 75 11.353 -0.667 -13.700 1.00 0.00 O ATOM 1185 CG2 THR A 75 13.563 -0.390 -12.901 1.00 0.00 C ATOM 0 H THR A 75 9.843 -0.952 -11.623 1.00 0.00 H new ATOM 0 HA THR A 75 12.163 -2.657 -11.972 1.00 0.00 H new ATOM 0 HB THR A 75 11.801 0.343 -11.909 1.00 0.00 H new ATOM 0 HG1 THR A 75 11.548 0.093 -14.287 1.00 0.00 H new ATOM 0 HG21 THR A 75 13.671 0.466 -13.567 1.00 0.00 H new ATOM 0 HG22 THR A 75 14.178 -0.239 -12.014 1.00 0.00 H new ATOM 0 HG23 THR A 75 13.886 -1.294 -13.417 1.00 0.00 H new ATOM 1193 N ILE A 76 12.115 -0.895 -9.168 1.00 0.00 N ATOM 1194 CA ILE A 76 12.576 -0.988 -7.744 1.00 0.00 C ATOM 1195 C ILE A 76 12.615 -2.465 -7.222 1.00 0.00 C ATOM 1196 O ILE A 76 13.663 -2.912 -6.745 1.00 0.00 O ATOM 1197 CB ILE A 76 11.719 -0.019 -6.836 1.00 0.00 C ATOM 1198 CG1 ILE A 76 11.945 1.488 -7.176 1.00 0.00 C ATOM 1199 CG2 ILE A 76 11.892 -0.218 -5.301 1.00 0.00 C ATOM 1200 CD1 ILE A 76 10.849 2.426 -6.660 1.00 0.00 C ATOM 0 H ILE A 76 11.389 -0.193 -9.308 1.00 0.00 H new ATOM 0 HA ILE A 76 13.612 -0.652 -7.691 1.00 0.00 H new ATOM 0 HB ILE A 76 10.697 -0.306 -7.084 1.00 0.00 H new ATOM 0 HG12 ILE A 76 12.901 1.802 -6.758 1.00 0.00 H new ATOM 0 HG13 ILE A 76 12.019 1.596 -8.258 1.00 0.00 H new ATOM 0 HG21 ILE A 76 11.262 0.495 -4.768 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.601 -1.233 -5.031 1.00 0.00 H new ATOM 0 HG23 ILE A 76 12.935 -0.055 -5.028 1.00 0.00 H new ATOM 0 HD11 ILE A 76 11.086 3.452 -6.941 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.892 2.142 -7.097 1.00 0.00 H new ATOM 0 HD13 ILE A 76 10.788 2.352 -5.574 1.00 0.00 H new ATOM 1212 N VAL A 77 11.492 -3.201 -7.330 1.00 0.00 N ATOM 1213 CA VAL A 77 11.405 -4.609 -6.854 1.00 0.00 C ATOM 1214 C VAL A 77 11.938 -5.727 -7.802 1.00 0.00 C ATOM 1215 O VAL A 77 12.033 -6.868 -7.345 1.00 0.00 O ATOM 1216 CB VAL A 77 9.995 -4.951 -6.288 1.00 0.00 C ATOM 1217 CG1 VAL A 77 9.632 -4.069 -5.074 1.00 0.00 C ATOM 1218 CG2 VAL A 77 8.846 -5.087 -7.306 1.00 0.00 C ATOM 0 H VAL A 77 10.628 -2.850 -7.742 1.00 0.00 H new ATOM 0 HA VAL A 77 12.132 -4.622 -6.042 1.00 0.00 H new ATOM 0 HB VAL A 77 10.105 -5.978 -5.941 1.00 0.00 H new ATOM 0 HG11 VAL A 77 8.641 -4.340 -4.710 1.00 0.00 H new ATOM 0 HG12 VAL A 77 10.364 -4.222 -4.281 1.00 0.00 H new ATOM 0 HG13 VAL A 77 9.634 -3.021 -5.372 1.00 0.00 H new ATOM 0 HG21 VAL A 77 7.921 -5.326 -6.781 1.00 0.00 H new ATOM 0 HG22 VAL A 77 8.725 -4.148 -7.845 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.078 -5.884 -8.013 1.00 0.00 H new ATOM 1228 N CYS A 78 12.311 -5.448 -9.068 1.00 0.00 N ATOM 1229 CA CYS A 78 12.894 -6.474 -9.977 1.00 0.00 C ATOM 1230 C CYS A 78 14.222 -7.145 -9.487 1.00 0.00 C ATOM 1231 O CYS A 78 14.404 -8.347 -9.703 1.00 0.00 O ATOM 1232 CB CYS A 78 13.044 -5.877 -11.393 1.00 0.00 C ATOM 1233 SG CYS A 78 13.448 -7.175 -12.612 1.00 0.00 S ATOM 0 H CYS A 78 12.222 -4.524 -9.490 1.00 0.00 H new ATOM 0 HA CYS A 78 12.185 -7.302 -9.985 1.00 0.00 H new ATOM 0 HB2 CYS A 78 12.119 -5.378 -11.681 1.00 0.00 H new ATOM 0 HB3 CYS A 78 13.827 -5.119 -11.391 1.00 0.00 H new ATOM 0 HG CYS A 78 14.014 -8.177 -12.007 1.00 0.00 H new ATOM 1239 N THR A 79 15.098 -6.382 -8.799 1.00 0.00 N ATOM 1240 CA THR A 79 16.221 -6.930 -7.986 1.00 0.00 C ATOM 1241 C THR A 79 15.852 -6.847 -6.457 1.00 0.00 C ATOM 1242 O THR A 79 16.544 -6.195 -5.674 1.00 0.00 O ATOM 1243 CB THR A 79 17.609 -6.341 -8.415 1.00 0.00 C ATOM 1244 OG1 THR A 79 18.605 -6.608 -7.435 1.00 0.00 O ATOM 1245 CG2 THR A 79 17.665 -4.850 -8.790 1.00 0.00 C ATOM 0 H THR A 79 15.052 -5.363 -8.788 1.00 0.00 H new ATOM 0 HA THR A 79 16.357 -7.992 -8.188 1.00 0.00 H new ATOM 0 HB THR A 79 17.802 -6.868 -9.349 1.00 0.00 H new ATOM 0 HG1 THR A 79 18.220 -6.501 -6.540 1.00 0.00 H new ATOM 0 HG21 THR A 79 18.685 -4.582 -9.065 1.00 0.00 H new ATOM 0 HG22 THR A 79 17.000 -4.662 -9.633 1.00 0.00 H new ATOM 0 HG23 THR A 79 17.349 -4.248 -7.938 1.00 0.00 H new ATOM 1253 N MET A 80 14.778 -7.540 -6.026 1.00 0.00 N ATOM 1254 CA MET A 80 14.390 -7.679 -4.589 1.00 0.00 C ATOM 1255 C MET A 80 13.744 -9.081 -4.432 1.00 0.00 C ATOM 1256 O MET A 80 12.713 -9.368 -5.045 1.00 0.00 O ATOM 1257 CB MET A 80 13.386 -6.597 -4.108 1.00 0.00 C ATOM 1258 CG MET A 80 13.964 -5.213 -3.761 1.00 0.00 C ATOM 1259 SD MET A 80 14.435 -5.191 -2.022 1.00 0.00 S ATOM 1260 CE MET A 80 12.837 -4.796 -1.280 1.00 0.00 C ATOM 0 H MET A 80 14.145 -8.026 -6.662 1.00 0.00 H new ATOM 0 HA MET A 80 15.283 -7.553 -3.977 1.00 0.00 H new ATOM 0 HB2 MET A 80 12.633 -6.465 -4.885 1.00 0.00 H new ATOM 0 HB3 MET A 80 12.871 -6.980 -3.227 1.00 0.00 H new ATOM 0 HG2 MET A 80 14.830 -4.999 -4.388 1.00 0.00 H new ATOM 0 HG3 MET A 80 13.226 -4.436 -3.961 1.00 0.00 H new ATOM 0 HE1 MET A 80 12.894 -4.933 -0.200 1.00 0.00 H new ATOM 0 HE2 MET A 80 12.579 -3.760 -1.502 1.00 0.00 H new ATOM 0 HE3 MET A 80 12.072 -5.456 -1.690 1.00 0.00 H new ATOM 1270 N ARG A 81 14.345 -9.945 -3.600 1.00 0.00 N ATOM 1271 CA ARG A 81 13.889 -11.352 -3.400 1.00 0.00 C ATOM 1272 C ARG A 81 13.082 -11.510 -2.082 1.00 0.00 C ATOM 1273 O ARG A 81 13.061 -10.607 -1.244 1.00 0.00 O ATOM 1274 CB ARG A 81 15.128 -12.287 -3.482 1.00 0.00 C ATOM 1275 CG ARG A 81 16.235 -12.066 -2.428 1.00 0.00 C ATOM 1276 CD ARG A 81 17.441 -12.979 -2.658 1.00 0.00 C ATOM 1277 NE ARG A 81 18.513 -12.626 -1.703 1.00 0.00 N ATOM 1278 CZ ARG A 81 19.753 -13.152 -1.722 1.00 0.00 C ATOM 1279 NH1 ARG A 81 20.154 -14.082 -2.587 1.00 0.00 N ATOM 1280 NH2 ARG A 81 20.625 -12.719 -0.832 1.00 0.00 N ATOM 0 H ARG A 81 15.162 -9.699 -3.041 1.00 0.00 H new ATOM 0 HA ARG A 81 13.193 -11.638 -4.189 1.00 0.00 H new ATOM 0 HB2 ARG A 81 14.782 -13.318 -3.401 1.00 0.00 H new ATOM 0 HB3 ARG A 81 15.573 -12.176 -4.471 1.00 0.00 H new ATOM 0 HG2 ARG A 81 16.558 -11.025 -2.456 1.00 0.00 H new ATOM 0 HG3 ARG A 81 15.829 -12.247 -1.433 1.00 0.00 H new ATOM 0 HD2 ARG A 81 17.152 -14.022 -2.528 1.00 0.00 H new ATOM 0 HD3 ARG A 81 17.801 -12.873 -3.681 1.00 0.00 H new ATOM 0 HE ARG A 81 18.299 -11.938 -0.981 1.00 0.00 H new ATOM 0 HH11 ARG A 81 19.506 -14.438 -3.290 1.00 0.00 H new ATOM 0 HH12 ARG A 81 21.109 -14.438 -2.547 1.00 0.00 H new ATOM 0 HH21 ARG A 81 20.352 -12.006 -0.156 1.00 0.00 H new ATOM 0 HH22 ARG A 81 21.572 -13.097 -0.820 1.00 0.00 H new ATOM 1294 N GLU A 82 12.435 -12.677 -1.886 1.00 0.00 N ATOM 1295 CA GLU A 82 11.573 -12.965 -0.700 1.00 0.00 C ATOM 1296 C GLU A 82 12.353 -12.854 0.642 1.00 0.00 C ATOM 1297 O GLU A 82 13.224 -13.677 0.941 1.00 0.00 O ATOM 1298 CB GLU A 82 10.925 -14.371 -0.833 1.00 0.00 C ATOM 1299 CG GLU A 82 9.887 -14.501 -1.967 1.00 0.00 C ATOM 1300 CD GLU A 82 9.189 -15.860 -2.002 1.00 0.00 C ATOM 1301 OE1 GLU A 82 8.135 -16.014 -1.346 1.00 0.00 O ATOM 1302 OE2 GLU A 82 9.687 -16.778 -2.688 1.00 0.00 O ATOM 0 H GLU A 82 12.490 -13.455 -2.543 1.00 0.00 H new ATOM 0 HA GLU A 82 10.790 -12.207 -0.680 1.00 0.00 H new ATOM 0 HB2 GLU A 82 11.714 -15.105 -0.996 1.00 0.00 H new ATOM 0 HB3 GLU A 82 10.444 -14.625 0.112 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.136 -13.719 -1.853 1.00 0.00 H new ATOM 0 HG3 GLU A 82 10.382 -14.331 -2.923 1.00 0.00 H new ATOM 1309 N GLY A 83 12.046 -11.789 1.402 1.00 0.00 N ATOM 1310 CA GLY A 83 12.807 -11.434 2.627 1.00 0.00 C ATOM 1311 C GLY A 83 13.949 -10.382 2.518 1.00 0.00 C ATOM 1312 O GLY A 83 14.690 -10.233 3.494 1.00 0.00 O ATOM 0 H GLY A 83 11.276 -11.154 1.194 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.093 -11.071 3.366 1.00 0.00 H new ATOM 0 HA3 GLY A 83 13.240 -12.352 3.025 1.00 0.00 H new ATOM 1316 N GLU A 84 14.094 -9.658 1.388 1.00 0.00 N ATOM 1317 CA GLU A 84 15.140 -8.622 1.179 1.00 0.00 C ATOM 1318 C GLU A 84 14.550 -7.218 1.444 1.00 0.00 C ATOM 1319 O GLU A 84 13.407 -6.939 1.085 1.00 0.00 O ATOM 1320 CB GLU A 84 15.688 -8.757 -0.271 1.00 0.00 C ATOM 1321 CG GLU A 84 16.885 -7.839 -0.608 1.00 0.00 C ATOM 1322 CD GLU A 84 17.661 -8.240 -1.864 1.00 0.00 C ATOM 1323 OE1 GLU A 84 18.430 -9.226 -1.808 1.00 0.00 O ATOM 1324 OE2 GLU A 84 17.530 -7.559 -2.904 1.00 0.00 O ATOM 0 H GLU A 84 13.481 -9.775 0.581 1.00 0.00 H new ATOM 0 HA GLU A 84 15.965 -8.763 1.877 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.987 -9.792 -0.435 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.879 -8.544 -0.970 1.00 0.00 H new ATOM 0 HG2 GLU A 84 16.520 -6.819 -0.732 1.00 0.00 H new ATOM 0 HG3 GLU A 84 17.570 -7.831 0.240 1.00 0.00 H new ATOM 1331 N ILE A 85 15.354 -6.337 2.058 1.00 0.00 N ATOM 1332 CA ILE A 85 14.919 -4.969 2.437 1.00 0.00 C ATOM 1333 C ILE A 85 15.939 -4.006 1.775 1.00 0.00 C ATOM 1334 O ILE A 85 17.130 -4.060 2.089 1.00 0.00 O ATOM 1335 CB ILE A 85 14.807 -4.783 3.995 1.00 0.00 C ATOM 1336 CG1 ILE A 85 13.927 -5.844 4.738 1.00 0.00 C ATOM 1337 CG2 ILE A 85 14.251 -3.379 4.331 1.00 0.00 C ATOM 1338 CD1 ILE A 85 14.674 -7.102 5.215 1.00 0.00 C ATOM 0 H ILE A 85 16.321 -6.544 2.308 1.00 0.00 H new ATOM 0 HA ILE A 85 13.910 -4.760 2.083 1.00 0.00 H new ATOM 0 HB ILE A 85 15.828 -4.917 4.354 1.00 0.00 H new ATOM 0 HG12 ILE A 85 13.465 -5.367 5.602 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.120 -6.151 4.073 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.179 -3.265 5.413 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.919 -2.617 3.930 1.00 0.00 H new ATOM 0 HG23 ILE A 85 13.262 -3.264 3.888 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.975 -7.772 5.716 1.00 0.00 H new ATOM 0 HD12 ILE A 85 15.113 -7.612 4.357 1.00 0.00 H new ATOM 0 HD13 ILE A 85 15.463 -6.815 5.910 1.00 0.00 H new ATOM 1350 N ALA A 86 15.453 -3.120 0.887 1.00 0.00 N ATOM 1351 CA ALA A 86 16.297 -2.116 0.198 1.00 0.00 C ATOM 1352 C ALA A 86 15.590 -0.740 0.133 1.00 0.00 C ATOM 1353 O ALA A 86 14.424 -0.646 -0.267 1.00 0.00 O ATOM 1354 CB ALA A 86 16.631 -2.635 -1.211 1.00 0.00 C ATOM 0 H ALA A 86 14.468 -3.076 0.625 1.00 0.00 H new ATOM 0 HA ALA A 86 17.220 -1.972 0.760 1.00 0.00 H new ATOM 0 HB1 ALA A 86 17.252 -1.905 -1.730 1.00 0.00 H new ATOM 0 HB2 ALA A 86 17.169 -3.580 -1.133 1.00 0.00 H new ATOM 0 HB3 ALA A 86 15.708 -2.789 -1.770 1.00 0.00 H new ATOM 1360 N GLN A 87 16.333 0.322 0.507 1.00 0.00 N ATOM 1361 CA GLN A 87 15.848 1.726 0.438 1.00 0.00 C ATOM 1362 C GLN A 87 16.723 2.562 -0.510 1.00 0.00 C ATOM 1363 O GLN A 87 17.955 2.473 -0.464 1.00 0.00 O ATOM 1364 CB GLN A 87 15.658 2.369 1.826 1.00 0.00 C ATOM 1365 CG GLN A 87 16.893 2.805 2.640 1.00 0.00 C ATOM 1366 CD GLN A 87 17.692 4.053 2.202 1.00 0.00 C ATOM 1367 OE1 GLN A 87 18.920 4.023 2.143 1.00 0.00 O ATOM 1368 NE2 GLN A 87 17.040 5.158 1.866 1.00 0.00 N ATOM 0 H GLN A 87 17.284 0.236 0.865 1.00 0.00 H new ATOM 0 HA GLN A 87 14.846 1.704 0.010 1.00 0.00 H new ATOM 0 HB2 GLN A 87 15.027 3.248 1.694 1.00 0.00 H new ATOM 0 HB3 GLN A 87 15.097 1.663 2.438 1.00 0.00 H new ATOM 0 HG2 GLN A 87 16.566 2.971 3.666 1.00 0.00 H new ATOM 0 HG3 GLN A 87 17.586 1.964 2.658 1.00 0.00 H new ATOM 0 HE21 GLN A 87 16.021 5.184 1.915 1.00 0.00 H new ATOM 0 HE22 GLN A 87 17.557 5.982 1.559 1.00 0.00 H new ATOM 1377 N PHE A 88 16.080 3.372 -1.374 1.00 0.00 N ATOM 1378 CA PHE A 88 16.791 4.050 -2.483 1.00 0.00 C ATOM 1379 C PHE A 88 15.902 5.071 -3.241 1.00 0.00 C ATOM 1380 O PHE A 88 14.670 4.980 -3.279 1.00 0.00 O ATOM 1381 CB PHE A 88 17.451 3.040 -3.462 1.00 0.00 C ATOM 1382 CG PHE A 88 16.578 1.956 -4.106 1.00 0.00 C ATOM 1383 CD1 PHE A 88 16.013 2.178 -5.364 1.00 0.00 C ATOM 1384 CD2 PHE A 88 16.521 0.677 -3.540 1.00 0.00 C ATOM 1385 CE1 PHE A 88 15.504 1.112 -6.097 1.00 0.00 C ATOM 1386 CE2 PHE A 88 15.968 -0.378 -4.256 1.00 0.00 C ATOM 1387 CZ PHE A 88 15.504 -0.165 -5.549 1.00 0.00 C ATOM 0 H PHE A 88 15.081 3.573 -1.329 1.00 0.00 H new ATOM 0 HA PHE A 88 17.590 4.622 -2.012 1.00 0.00 H new ATOM 0 HB2 PHE A 88 17.912 3.613 -4.266 1.00 0.00 H new ATOM 0 HB3 PHE A 88 18.257 2.539 -2.925 1.00 0.00 H new ATOM 0 HD1 PHE A 88 15.972 3.179 -5.768 1.00 0.00 H new ATOM 0 HD2 PHE A 88 16.907 0.510 -2.545 1.00 0.00 H new ATOM 0 HE1 PHE A 88 15.110 1.276 -7.089 1.00 0.00 H new ATOM 0 HE2 PHE A 88 15.899 -1.359 -3.810 1.00 0.00 H new ATOM 0 HZ PHE A 88 15.141 -0.998 -6.132 1.00 0.00 H new ATOM 1397 N LEU A 89 16.598 6.022 -3.888 1.00 0.00 N ATOM 1398 CA LEU A 89 15.963 7.117 -4.669 1.00 0.00 C ATOM 1399 C LEU A 89 15.620 6.714 -6.131 1.00 0.00 C ATOM 1400 O LEU A 89 16.244 5.824 -6.720 1.00 0.00 O ATOM 1401 CB LEU A 89 16.747 8.462 -4.562 1.00 0.00 C ATOM 1402 CG LEU A 89 18.239 8.550 -5.003 1.00 0.00 C ATOM 1403 CD1 LEU A 89 18.437 8.494 -6.532 1.00 0.00 C ATOM 1404 CD2 LEU A 89 18.874 9.844 -4.450 1.00 0.00 C ATOM 0 H LEU A 89 17.617 6.060 -3.889 1.00 0.00 H new ATOM 0 HA LEU A 89 14.998 7.299 -4.197 1.00 0.00 H new ATOM 0 HB2 LEU A 89 16.196 9.201 -5.144 1.00 0.00 H new ATOM 0 HB3 LEU A 89 16.701 8.778 -3.520 1.00 0.00 H new ATOM 0 HG LEU A 89 18.732 7.670 -4.590 1.00 0.00 H new ATOM 0 HD11 LEU A 89 19.500 8.561 -6.764 1.00 0.00 H new ATOM 0 HD12 LEU A 89 18.040 7.554 -6.916 1.00 0.00 H new ATOM 0 HD13 LEU A 89 17.911 9.328 -6.998 1.00 0.00 H new ATOM 0 HD21 LEU A 89 19.917 9.900 -4.762 1.00 0.00 H new ATOM 0 HD22 LEU A 89 18.333 10.708 -4.836 1.00 0.00 H new ATOM 0 HD23 LEU A 89 18.821 9.839 -3.361 1.00 0.00 H new ATOM 1416 N CYS A 90 14.626 7.419 -6.706 1.00 0.00 N ATOM 1417 CA CYS A 90 14.292 7.321 -8.145 1.00 0.00 C ATOM 1418 C CYS A 90 14.189 8.737 -8.757 1.00 0.00 C ATOM 1419 O CYS A 90 13.567 9.632 -8.172 1.00 0.00 O ATOM 1420 CB CYS A 90 12.965 6.565 -8.351 1.00 0.00 C ATOM 1421 SG CYS A 90 12.993 4.959 -7.489 1.00 0.00 S ATOM 0 H CYS A 90 14.033 8.070 -6.191 1.00 0.00 H new ATOM 0 HA CYS A 90 15.085 6.766 -8.645 1.00 0.00 H new ATOM 0 HB2 CYS A 90 12.137 7.168 -7.979 1.00 0.00 H new ATOM 0 HB3 CYS A 90 12.792 6.408 -9.416 1.00 0.00 H new ATOM 0 HG CYS A 90 12.598 4.024 -8.301 1.00 0.00 H new ATOM 1427 N ASP A 91 14.745 8.914 -9.973 1.00 0.00 N ATOM 1428 CA ASP A 91 14.660 10.192 -10.730 1.00 0.00 C ATOM 1429 C ASP A 91 13.190 10.537 -11.115 1.00 0.00 C ATOM 1430 O ASP A 91 12.382 9.649 -11.399 1.00 0.00 O ATOM 1431 CB ASP A 91 15.612 10.093 -11.954 1.00 0.00 C ATOM 1432 CG ASP A 91 15.914 11.426 -12.657 1.00 0.00 C ATOM 1433 OD1 ASP A 91 15.162 11.812 -13.578 1.00 0.00 O ATOM 1434 OD2 ASP A 91 16.904 12.092 -12.284 1.00 0.00 O ATOM 0 H ASP A 91 15.264 8.183 -10.460 1.00 0.00 H new ATOM 0 HA ASP A 91 14.985 11.024 -10.106 1.00 0.00 H new ATOM 0 HB2 ASP A 91 16.553 9.651 -11.627 1.00 0.00 H new ATOM 0 HB3 ASP A 91 15.174 9.408 -12.680 1.00 0.00 H new ATOM 1439 N ILE A 92 12.862 11.841 -11.103 1.00 0.00 N ATOM 1440 CA ILE A 92 11.505 12.365 -11.434 1.00 0.00 C ATOM 1441 C ILE A 92 10.887 12.009 -12.812 1.00 0.00 C ATOM 1442 O ILE A 92 9.663 11.933 -12.882 1.00 0.00 O ATOM 1443 CB ILE A 92 11.346 13.901 -11.145 1.00 0.00 C ATOM 1444 CG1 ILE A 92 12.626 14.777 -11.304 1.00 0.00 C ATOM 1445 CG2 ILE A 92 10.642 14.098 -9.790 1.00 0.00 C ATOM 1446 CD1 ILE A 92 12.393 16.291 -11.395 1.00 0.00 C ATOM 0 H ILE A 92 13.529 12.574 -10.863 1.00 0.00 H new ATOM 0 HA ILE A 92 10.907 11.786 -10.731 1.00 0.00 H new ATOM 0 HB ILE A 92 10.718 14.290 -11.947 1.00 0.00 H new ATOM 0 HG12 ILE A 92 13.285 14.580 -10.458 1.00 0.00 H new ATOM 0 HG13 ILE A 92 13.154 14.455 -12.202 1.00 0.00 H new ATOM 0 HG21 ILE A 92 10.531 15.164 -9.589 1.00 0.00 H new ATOM 0 HG22 ILE A 92 9.658 13.630 -9.820 1.00 0.00 H new ATOM 0 HG23 ILE A 92 11.238 13.640 -9.000 1.00 0.00 H new ATOM 0 HD11 ILE A 92 13.350 16.801 -11.503 1.00 0.00 H new ATOM 0 HD12 ILE A 92 11.765 16.511 -12.258 1.00 0.00 H new ATOM 0 HD13 ILE A 92 11.898 16.638 -10.488 1.00 0.00 H new ATOM 1458 N LYS A 93 11.672 11.730 -13.863 1.00 0.00 N ATOM 1459 CA LYS A 93 11.164 11.007 -15.076 1.00 0.00 C ATOM 1460 C LYS A 93 10.372 9.664 -14.852 1.00 0.00 C ATOM 1461 O LYS A 93 9.538 9.304 -15.687 1.00 0.00 O ATOM 1462 CB LYS A 93 12.333 10.819 -16.086 1.00 0.00 C ATOM 1463 CG LYS A 93 13.405 9.770 -15.698 1.00 0.00 C ATOM 1464 CD LYS A 93 14.692 9.772 -16.545 1.00 0.00 C ATOM 1465 CE LYS A 93 14.519 9.158 -17.948 1.00 0.00 C ATOM 1466 NZ LYS A 93 15.792 9.145 -18.689 1.00 0.00 N ATOM 0 H LYS A 93 12.658 11.985 -13.914 1.00 0.00 H new ATOM 0 HA LYS A 93 10.387 11.658 -15.475 1.00 0.00 H new ATOM 0 HB2 LYS A 93 11.911 10.538 -17.051 1.00 0.00 H new ATOM 0 HB3 LYS A 93 12.827 11.781 -16.222 1.00 0.00 H new ATOM 0 HG2 LYS A 93 13.680 9.930 -14.655 1.00 0.00 H new ATOM 0 HG3 LYS A 93 12.954 8.779 -15.761 1.00 0.00 H new ATOM 0 HD2 LYS A 93 15.045 10.798 -16.649 1.00 0.00 H new ATOM 0 HD3 LYS A 93 15.467 9.221 -16.012 1.00 0.00 H new ATOM 0 HE2 LYS A 93 14.139 8.141 -17.857 1.00 0.00 H new ATOM 0 HE3 LYS A 93 13.776 9.727 -18.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 15.642 8.726 -19.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 16.142 10.119 -18.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 16.492 8.581 -18.166 1.00 0.00 H new ATOM 1480 N HIS A 94 10.651 8.946 -13.746 1.00 0.00 N ATOM 1481 CA HIS A 94 10.005 7.663 -13.375 1.00 0.00 C ATOM 1482 C HIS A 94 8.875 7.885 -12.313 1.00 0.00 C ATOM 1483 O HIS A 94 7.785 7.331 -12.488 1.00 0.00 O ATOM 1484 CB HIS A 94 11.066 6.642 -12.880 1.00 0.00 C ATOM 1485 CG HIS A 94 12.305 6.394 -13.755 1.00 0.00 C ATOM 1486 ND1 HIS A 94 12.356 5.616 -14.901 1.00 0.00 N ATOM 1487 CD2 HIS A 94 13.574 6.933 -13.490 1.00 0.00 C ATOM 1488 CE1 HIS A 94 13.684 5.763 -15.221 1.00 0.00 C ATOM 1489 NE2 HIS A 94 14.501 6.537 -14.438 1.00 0.00 N ATOM 0 H HIS A 94 11.349 9.247 -13.066 1.00 0.00 H new ATOM 0 HA HIS A 94 9.532 7.247 -14.264 1.00 0.00 H new ATOM 0 HB2 HIS A 94 11.412 6.971 -11.900 1.00 0.00 H new ATOM 0 HB3 HIS A 94 10.564 5.685 -12.736 1.00 0.00 H new ATOM 0 HD2 HIS A 94 13.798 7.576 -12.652 1.00 0.00 H new ATOM 0 HE1 HIS A 94 14.086 5.267 -16.092 1.00 0.00 H new ATOM 0 HE2 HIS A 94 15.493 6.755 -14.527 1.00 0.00 H new ATOM 1497 N VAL A 95 9.109 8.687 -11.240 1.00 0.00 N ATOM 1498 CA VAL A 95 8.046 9.097 -10.261 1.00 0.00 C ATOM 1499 C VAL A 95 7.190 10.355 -10.679 1.00 0.00 C ATOM 1500 O VAL A 95 6.556 10.980 -9.822 1.00 0.00 O ATOM 1501 CB VAL A 95 8.638 9.243 -8.811 1.00 0.00 C ATOM 1502 CG1 VAL A 95 9.219 7.932 -8.249 1.00 0.00 C ATOM 1503 CG2 VAL A 95 9.670 10.377 -8.624 1.00 0.00 C ATOM 0 H VAL A 95 10.030 9.069 -11.024 1.00 0.00 H new ATOM 0 HA VAL A 95 7.327 8.278 -10.268 1.00 0.00 H new ATOM 0 HB VAL A 95 7.755 9.520 -8.236 1.00 0.00 H new ATOM 0 HG11 VAL A 95 9.609 8.107 -7.246 1.00 0.00 H new ATOM 0 HG12 VAL A 95 8.435 7.176 -8.206 1.00 0.00 H new ATOM 0 HG13 VAL A 95 10.024 7.584 -8.896 1.00 0.00 H new ATOM 0 HG21 VAL A 95 10.014 10.389 -7.590 1.00 0.00 H new ATOM 0 HG22 VAL A 95 10.519 10.209 -9.286 1.00 0.00 H new ATOM 0 HG23 VAL A 95 9.206 11.334 -8.864 1.00 0.00 H new ATOM 1513 N VAL A 96 7.114 10.695 -11.984 1.00 0.00 N ATOM 1514 CA VAL A 96 6.262 11.801 -12.522 1.00 0.00 C ATOM 1515 C VAL A 96 4.725 11.542 -12.346 1.00 0.00 C ATOM 1516 O VAL A 96 3.989 12.452 -11.954 1.00 0.00 O ATOM 1517 CB VAL A 96 6.732 12.186 -13.985 1.00 0.00 C ATOM 1518 CG1 VAL A 96 5.733 12.001 -15.154 1.00 0.00 C ATOM 1519 CG2 VAL A 96 7.289 13.626 -14.052 1.00 0.00 C ATOM 0 H VAL A 96 7.644 10.210 -12.708 1.00 0.00 H new ATOM 0 HA VAL A 96 6.415 12.692 -11.913 1.00 0.00 H new ATOM 0 HB VAL A 96 7.502 11.432 -14.151 1.00 0.00 H new ATOM 0 HG11 VAL A 96 6.204 12.308 -16.088 1.00 0.00 H new ATOM 0 HG12 VAL A 96 5.443 10.953 -15.222 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.848 12.612 -14.976 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.600 13.849 -15.073 1.00 0.00 H new ATOM 0 HG22 VAL A 96 6.515 14.330 -13.746 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.146 13.716 -13.384 1.00 0.00 H new ATOM 1529 N LEU A 97 4.282 10.306 -12.652 1.00 0.00 N ATOM 1530 CA LEU A 97 2.898 9.823 -12.405 1.00 0.00 C ATOM 1531 C LEU A 97 2.666 9.025 -11.076 1.00 0.00 C ATOM 1532 O LEU A 97 1.603 8.422 -10.919 1.00 0.00 O ATOM 1533 CB LEU A 97 2.420 9.035 -13.664 1.00 0.00 C ATOM 1534 CG LEU A 97 3.195 7.722 -14.016 1.00 0.00 C ATOM 1535 CD1 LEU A 97 2.251 6.530 -14.252 1.00 0.00 C ATOM 1536 CD2 LEU A 97 4.153 7.888 -15.211 1.00 0.00 C ATOM 0 H LEU A 97 4.880 9.601 -13.084 1.00 0.00 H new ATOM 0 HA LEU A 97 2.285 10.710 -12.244 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.369 8.781 -13.526 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.477 9.703 -14.524 1.00 0.00 H new ATOM 0 HG LEU A 97 3.803 7.507 -13.137 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.838 5.643 -14.493 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.667 6.345 -13.351 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.579 6.756 -15.080 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.660 6.943 -15.405 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.586 8.183 -16.094 1.00 0.00 H new ATOM 0 HD23 LEU A 97 4.892 8.656 -14.981 1.00 0.00 H new ATOM 1548 N TYR A 98 3.583 9.084 -10.087 1.00 0.00 N ATOM 1549 CA TYR A 98 3.282 8.710 -8.679 1.00 0.00 C ATOM 1550 C TYR A 98 2.138 9.549 -7.998 1.00 0.00 C ATOM 1551 O TYR A 98 1.287 8.881 -7.409 1.00 0.00 O ATOM 1552 CB TYR A 98 4.598 8.720 -7.846 1.00 0.00 C ATOM 1553 CG TYR A 98 4.420 8.240 -6.389 1.00 0.00 C ATOM 1554 CD1 TYR A 98 4.322 6.877 -6.094 1.00 0.00 C ATOM 1555 CD2 TYR A 98 4.155 9.182 -5.385 1.00 0.00 C ATOM 1556 CE1 TYR A 98 3.938 6.463 -4.822 1.00 0.00 C ATOM 1557 CE2 TYR A 98 3.744 8.763 -4.124 1.00 0.00 C ATOM 1558 CZ TYR A 98 3.641 7.404 -3.839 1.00 0.00 C ATOM 1559 OH TYR A 98 3.223 6.993 -2.600 1.00 0.00 O ATOM 0 H TYR A 98 4.545 9.388 -10.234 1.00 0.00 H new ATOM 0 HA TYR A 98 2.873 7.700 -8.706 1.00 0.00 H new ATOM 0 HB2 TYR A 98 5.334 8.085 -8.340 1.00 0.00 H new ATOM 0 HB3 TYR A 98 5.004 9.732 -7.838 1.00 0.00 H new ATOM 0 HD1 TYR A 98 4.545 6.144 -6.855 1.00 0.00 H new ATOM 0 HD2 TYR A 98 4.270 10.236 -5.591 1.00 0.00 H new ATOM 0 HE1 TYR A 98 3.870 5.409 -4.596 1.00 0.00 H new ATOM 0 HE2 TYR A 98 3.504 9.493 -3.365 1.00 0.00 H new ATOM 0 HH TYR A 98 3.060 7.776 -2.034 1.00 0.00 H new ATOM 1569 N PRO A 99 2.034 10.915 -7.996 1.00 0.00 N ATOM 1570 CA PRO A 99 0.824 11.623 -7.482 1.00 0.00 C ATOM 1571 C PRO A 99 -0.526 11.388 -8.240 1.00 0.00 C ATOM 1572 O PRO A 99 -1.581 11.730 -7.698 1.00 0.00 O ATOM 1573 CB PRO A 99 1.271 13.093 -7.518 1.00 0.00 C ATOM 1574 CG PRO A 99 2.284 13.178 -8.661 1.00 0.00 C ATOM 1575 CD PRO A 99 2.959 11.818 -8.705 1.00 0.00 C ATOM 0 HA PRO A 99 0.548 11.240 -6.500 1.00 0.00 H new ATOM 0 HB2 PRO A 99 0.425 13.757 -7.692 1.00 0.00 H new ATOM 0 HB3 PRO A 99 1.721 13.391 -6.571 1.00 0.00 H new ATOM 0 HG2 PRO A 99 1.791 13.402 -9.607 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.010 13.971 -8.484 1.00 0.00 H new ATOM 0 HD2 PRO A 99 3.122 11.490 -9.732 1.00 0.00 H new ATOM 0 HD3 PRO A 99 3.935 11.845 -8.220 1.00 0.00 H new ATOM 1583 N LEU A 100 -0.498 10.797 -9.452 1.00 0.00 N ATOM 1584 CA LEU A 100 -1.713 10.339 -10.175 1.00 0.00 C ATOM 1585 C LEU A 100 -2.166 8.911 -9.719 1.00 0.00 C ATOM 1586 O LEU A 100 -3.363 8.684 -9.527 1.00 0.00 O ATOM 1587 CB LEU A 100 -1.502 10.403 -11.721 1.00 0.00 C ATOM 1588 CG LEU A 100 -0.790 11.642 -12.349 1.00 0.00 C ATOM 1589 CD1 LEU A 100 -0.773 11.543 -13.887 1.00 0.00 C ATOM 1590 CD2 LEU A 100 -1.350 13.005 -11.903 1.00 0.00 C ATOM 0 H LEU A 100 0.368 10.621 -9.962 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.521 11.024 -9.917 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.934 9.519 -12.010 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -2.483 10.318 -12.188 1.00 0.00 H new ATOM 0 HG LEU A 100 0.229 11.608 -11.964 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.272 12.417 -14.302 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -0.239 10.642 -14.188 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -1.796 11.500 -14.260 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.793 13.805 -12.391 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -2.402 13.074 -12.180 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.252 13.102 -10.822 1.00 0.00 H new ATOM 1602 N VAL A 101 -1.211 7.968 -9.556 1.00 0.00 N ATOM 1603 CA VAL A 101 -1.482 6.548 -9.183 1.00 0.00 C ATOM 1604 C VAL A 101 -1.614 6.307 -7.653 1.00 0.00 C ATOM 1605 O VAL A 101 -2.371 5.418 -7.271 1.00 0.00 O ATOM 1606 CB VAL A 101 -0.434 5.575 -9.816 1.00 0.00 C ATOM 1607 CG1 VAL A 101 -0.700 4.082 -9.474 1.00 0.00 C ATOM 1608 CG2 VAL A 101 -0.355 5.737 -11.348 1.00 0.00 C ATOM 0 H VAL A 101 -0.218 8.166 -9.679 1.00 0.00 H new ATOM 0 HA VAL A 101 -2.462 6.326 -9.604 1.00 0.00 H new ATOM 0 HB VAL A 101 0.520 5.857 -9.371 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.062 3.460 -9.943 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.666 3.945 -8.393 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -1.683 3.793 -9.845 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.384 5.044 -11.750 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -1.329 5.523 -11.787 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -0.064 6.759 -11.591 1.00 0.00 H new ATOM 1618 N ALA A 102 -0.918 7.050 -6.781 1.00 0.00 N ATOM 1619 CA ALA A 102 -1.299 7.157 -5.344 1.00 0.00 C ATOM 1620 C ALA A 102 -2.761 7.613 -5.042 1.00 0.00 C ATOM 1621 O ALA A 102 -3.344 7.145 -4.060 1.00 0.00 O ATOM 1622 CB ALA A 102 -0.329 8.109 -4.640 1.00 0.00 C ATOM 0 H ALA A 102 -0.089 7.588 -7.033 1.00 0.00 H new ATOM 0 HA ALA A 102 -1.242 6.136 -4.967 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -0.601 8.193 -3.588 1.00 0.00 H new ATOM 0 HB2 ALA A 102 0.686 7.721 -4.723 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.381 9.092 -5.108 1.00 0.00 H new ATOM 1628 N LYS A 103 -3.358 8.459 -5.913 1.00 0.00 N ATOM 1629 CA LYS A 103 -4.829 8.672 -5.951 1.00 0.00 C ATOM 1630 C LYS A 103 -5.662 7.555 -6.697 1.00 0.00 C ATOM 1631 O LYS A 103 -6.786 7.810 -7.143 1.00 0.00 O ATOM 1632 CB LYS A 103 -5.068 10.084 -6.570 1.00 0.00 C ATOM 1633 CG LYS A 103 -5.062 11.288 -5.604 1.00 0.00 C ATOM 1634 CD LYS A 103 -3.733 11.612 -4.886 1.00 0.00 C ATOM 1635 CE LYS A 103 -3.530 13.095 -4.504 1.00 0.00 C ATOM 1636 NZ LYS A 103 -4.514 13.607 -3.531 1.00 0.00 N ATOM 0 H LYS A 103 -2.844 9.008 -6.602 1.00 0.00 H new ATOM 0 HA LYS A 103 -5.203 8.605 -4.930 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.303 10.255 -7.327 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -6.029 10.069 -7.085 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -5.367 12.172 -6.164 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -5.823 11.114 -4.843 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.673 11.010 -3.980 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -2.908 11.304 -5.528 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -2.529 13.219 -4.091 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -3.579 13.702 -5.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -4.312 14.606 -3.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -5.471 13.522 -3.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.453 13.054 -2.652 1.00 0.00 H new ATOM 1650 N SER A 104 -5.153 6.311 -6.779 1.00 0.00 N ATOM 1651 CA SER A 104 -5.850 5.144 -7.382 1.00 0.00 C ATOM 1652 C SER A 104 -5.518 3.820 -6.627 1.00 0.00 C ATOM 1653 O SER A 104 -6.445 3.069 -6.328 1.00 0.00 O ATOM 1654 CB SER A 104 -5.539 5.010 -8.893 1.00 0.00 C ATOM 1655 OG SER A 104 -6.054 6.115 -9.628 1.00 0.00 O ATOM 0 H SER A 104 -4.226 6.078 -6.422 1.00 0.00 H new ATOM 0 HA SER A 104 -6.920 5.326 -7.277 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.461 4.944 -9.040 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.970 4.084 -9.274 1.00 0.00 H new ATOM 0 HG SER A 104 -5.841 6.004 -10.578 1.00 0.00 H new ATOM 1661 N LEU A 105 -4.248 3.514 -6.270 1.00 0.00 N ATOM 1662 CA LEU A 105 -3.896 2.408 -5.329 1.00 0.00 C ATOM 1663 C LEU A 105 -4.583 2.440 -3.918 1.00 0.00 C ATOM 1664 O LEU A 105 -4.774 1.382 -3.314 1.00 0.00 O ATOM 1665 CB LEU A 105 -2.345 2.242 -5.309 1.00 0.00 C ATOM 1666 CG LEU A 105 -1.484 3.173 -4.403 1.00 0.00 C ATOM 1667 CD1 LEU A 105 -1.308 2.631 -2.968 1.00 0.00 C ATOM 1668 CD2 LEU A 105 -0.106 3.456 -5.032 1.00 0.00 C ATOM 0 H LEU A 105 -3.436 4.022 -6.622 1.00 0.00 H new ATOM 0 HA LEU A 105 -4.344 1.495 -5.722 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.131 1.214 -5.018 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.990 2.364 -6.333 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.041 4.107 -4.330 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -0.699 3.325 -2.389 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.285 2.525 -2.497 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.815 1.659 -3.004 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.468 4.108 -4.373 1.00 0.00 H new ATOM 0 HD22 LEU A 105 0.431 2.517 -5.170 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.240 3.943 -5.998 1.00 0.00 H new ATOM 2135 N ASP A 137 1.021 16.501 0.910 1.00 0.00 N ATOM 2136 CA ASP A 137 2.431 16.019 0.803 1.00 0.00 C ATOM 2137 C ASP A 137 2.764 15.403 -0.590 1.00 0.00 C ATOM 2138 O ASP A 137 3.785 15.763 -1.181 1.00 0.00 O ATOM 2139 CB ASP A 137 2.744 15.007 1.933 1.00 0.00 C ATOM 2140 CG ASP A 137 2.745 15.562 3.365 1.00 0.00 C ATOM 2141 OD1 ASP A 137 3.804 16.044 3.826 1.00 0.00 O ATOM 2142 OD2 ASP A 137 1.688 15.518 4.032 1.00 0.00 O ATOM 0 HA ASP A 137 3.069 16.896 0.914 1.00 0.00 H new ATOM 0 HB2 ASP A 137 2.014 14.199 1.880 1.00 0.00 H new ATOM 0 HB3 ASP A 137 3.722 14.567 1.736 1.00 0.00 H new ATOM 2147 N LEU A 138 1.915 14.496 -1.116 1.00 0.00 N ATOM 2148 CA LEU A 138 1.949 14.074 -2.542 1.00 0.00 C ATOM 2149 C LEU A 138 1.349 15.124 -3.541 1.00 0.00 C ATOM 2150 O LEU A 138 1.762 15.113 -4.705 1.00 0.00 O ATOM 2151 CB LEU A 138 1.358 12.646 -2.745 1.00 0.00 C ATOM 2152 CG LEU A 138 0.036 12.251 -2.019 1.00 0.00 C ATOM 2153 CD1 LEU A 138 -0.707 11.163 -2.807 1.00 0.00 C ATOM 2154 CD2 LEU A 138 0.263 11.729 -0.579 1.00 0.00 C ATOM 0 H LEU A 138 1.187 14.034 -0.571 1.00 0.00 H new ATOM 0 HA LEU A 138 3.007 14.024 -2.800 1.00 0.00 H new ATOM 0 HB2 LEU A 138 1.197 12.508 -3.814 1.00 0.00 H new ATOM 0 HB3 LEU A 138 2.123 11.930 -2.443 1.00 0.00 H new ATOM 0 HG LEU A 138 -0.554 13.166 -1.962 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -1.627 10.900 -2.285 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -0.948 11.535 -3.803 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -0.074 10.280 -2.894 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -0.696 11.472 -0.130 1.00 0.00 H new ATOM 0 HD22 LEU A 138 0.899 10.844 -0.609 1.00 0.00 H new ATOM 0 HD23 LEU A 138 0.746 12.503 0.017 1.00 0.00 H new ATOM 2166 N ASP A 139 0.447 16.049 -3.121 1.00 0.00 N ATOM 2167 CA ASP A 139 0.098 17.250 -3.944 1.00 0.00 C ATOM 2168 C ASP A 139 1.172 18.395 -3.961 1.00 0.00 C ATOM 2169 O ASP A 139 1.131 19.229 -4.871 1.00 0.00 O ATOM 2170 CB ASP A 139 -1.304 17.766 -3.534 1.00 0.00 C ATOM 2171 CG ASP A 139 -1.983 18.719 -4.530 1.00 0.00 C ATOM 2172 OD1 ASP A 139 -2.611 18.236 -5.498 1.00 0.00 O ATOM 2173 OD2 ASP A 139 -1.890 19.954 -4.346 1.00 0.00 O ATOM 0 H ASP A 139 -0.049 15.993 -2.231 1.00 0.00 H new ATOM 0 HA ASP A 139 0.082 16.914 -4.981 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -1.956 16.906 -3.380 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -1.217 18.275 -2.574 1.00 0.00 H new ATOM 2178 N ALA A 140 2.160 18.421 -3.037 1.00 0.00 N ATOM 2179 CA ALA A 140 3.422 19.188 -3.220 1.00 0.00 C ATOM 2180 C ALA A 140 4.266 18.860 -4.492 1.00 0.00 C ATOM 2181 O ALA A 140 4.943 19.755 -4.993 1.00 0.00 O ATOM 2182 CB ALA A 140 4.297 19.019 -1.968 1.00 0.00 C ATOM 0 H ALA A 140 2.110 17.918 -2.151 1.00 0.00 H new ATOM 0 HA ALA A 140 3.099 20.218 -3.372 1.00 0.00 H new ATOM 0 HB1 ALA A 140 5.224 19.578 -2.094 1.00 0.00 H new ATOM 0 HB2 ALA A 140 3.762 19.396 -1.096 1.00 0.00 H new ATOM 0 HB3 ALA A 140 4.527 17.963 -1.824 1.00 0.00 H new ATOM 2188 N LEU A 141 4.212 17.621 -5.023 1.00 0.00 N ATOM 2189 CA LEU A 141 4.801 17.251 -6.346 1.00 0.00 C ATOM 2190 C LEU A 141 4.123 17.903 -7.587 1.00 0.00 C ATOM 2191 O LEU A 141 4.811 18.271 -8.541 1.00 0.00 O ATOM 2192 CB LEU A 141 4.800 15.706 -6.556 1.00 0.00 C ATOM 2193 CG LEU A 141 5.193 14.794 -5.367 1.00 0.00 C ATOM 2194 CD1 LEU A 141 4.941 13.314 -5.704 1.00 0.00 C ATOM 2195 CD2 LEU A 141 6.637 15.011 -4.879 1.00 0.00 C ATOM 0 H LEU A 141 3.758 16.839 -4.551 1.00 0.00 H new ATOM 0 HA LEU A 141 5.815 17.647 -6.289 1.00 0.00 H new ATOM 0 HB2 LEU A 141 3.800 15.417 -6.878 1.00 0.00 H new ATOM 0 HB3 LEU A 141 5.477 15.484 -7.381 1.00 0.00 H new ATOM 0 HG LEU A 141 4.548 15.082 -4.537 1.00 0.00 H new ATOM 0 HD11 LEU A 141 5.225 12.694 -4.854 1.00 0.00 H new ATOM 0 HD12 LEU A 141 3.884 13.166 -5.924 1.00 0.00 H new ATOM 0 HD13 LEU A 141 5.536 13.032 -6.573 1.00 0.00 H new ATOM 0 HD21 LEU A 141 6.844 14.340 -4.045 1.00 0.00 H new ATOM 0 HD22 LEU A 141 7.331 14.803 -5.693 1.00 0.00 H new ATOM 0 HD23 LEU A 141 6.759 16.044 -4.553 1.00 0.00 H new ATOM 2207 N GLN A 142 2.786 18.043 -7.566 1.00 0.00 N ATOM 2208 CA GLN A 142 2.007 18.809 -8.582 1.00 0.00 C ATOM 2209 C GLN A 142 2.436 20.299 -8.806 1.00 0.00 C ATOM 2210 O GLN A 142 2.431 20.768 -9.946 1.00 0.00 O ATOM 2211 CB GLN A 142 0.498 18.740 -8.212 1.00 0.00 C ATOM 2212 CG GLN A 142 -0.141 17.337 -8.102 1.00 0.00 C ATOM 2213 CD GLN A 142 -0.344 16.621 -9.448 1.00 0.00 C ATOM 2214 OE1 GLN A 142 -1.356 16.798 -10.124 1.00 0.00 O ATOM 2215 NE2 GLN A 142 0.611 15.804 -9.861 1.00 0.00 N ATOM 0 H GLN A 142 2.201 17.628 -6.841 1.00 0.00 H new ATOM 0 HA GLN A 142 2.221 18.326 -9.535 1.00 0.00 H new ATOM 0 HB2 GLN A 142 0.361 19.249 -7.258 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -0.059 19.307 -8.958 1.00 0.00 H new ATOM 0 HG2 GLN A 142 0.487 16.715 -7.465 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -1.107 17.429 -7.605 1.00 0.00 H new ATOM 0 HE21 GLN A 142 1.446 15.666 -9.291 1.00 0.00 H new ATOM 0 HE22 GLN A 142 0.513 15.312 -10.749 1.00 0.00 H new ATOM 2224 N GLN A 143 2.820 21.005 -7.726 1.00 0.00 N ATOM 2225 CA GLN A 143 3.487 22.332 -7.792 1.00 0.00 C ATOM 2226 C GLN A 143 5.043 22.273 -7.924 1.00 0.00 C ATOM 2227 O GLN A 143 5.607 23.187 -8.534 1.00 0.00 O ATOM 2228 CB GLN A 143 3.041 23.224 -6.596 1.00 0.00 C ATOM 2229 CG GLN A 143 3.227 22.653 -5.167 1.00 0.00 C ATOM 2230 CD GLN A 143 2.888 23.652 -4.053 1.00 0.00 C ATOM 2231 OE1 GLN A 143 1.723 23.870 -3.720 1.00 0.00 O ATOM 2232 NE2 GLN A 143 3.892 24.271 -3.452 1.00 0.00 N ATOM 0 H GLN A 143 2.678 20.673 -6.772 1.00 0.00 H new ATOM 0 HA GLN A 143 3.153 22.789 -8.723 1.00 0.00 H new ATOM 0 HB2 GLN A 143 3.588 24.165 -6.656 1.00 0.00 H new ATOM 0 HB3 GLN A 143 1.985 23.461 -6.729 1.00 0.00 H new ATOM 0 HG2 GLN A 143 2.598 21.770 -5.054 1.00 0.00 H new ATOM 0 HG3 GLN A 143 4.260 22.327 -5.048 1.00 0.00 H new ATOM 0 HE21 GLN A 143 4.853 24.081 -3.738 1.00 0.00 H new ATOM 0 HE22 GLN A 143 3.705 24.938 -2.703 1.00 0.00 H new ATOM 2241 N ASN A 144 5.738 21.263 -7.351 1.00 0.00 N ATOM 2242 CA ASN A 144 7.223 21.198 -7.347 1.00 0.00 C ATOM 2243 C ASN A 144 7.647 19.703 -7.270 1.00 0.00 C ATOM 2244 O ASN A 144 7.740 19.186 -6.155 1.00 0.00 O ATOM 2245 CB ASN A 144 7.935 22.085 -6.278 1.00 0.00 C ATOM 2246 CG ASN A 144 7.295 22.264 -4.884 1.00 0.00 C ATOM 2247 OD1 ASN A 144 6.653 23.275 -4.612 1.00 0.00 O ATOM 2248 ND2 ASN A 144 7.442 21.305 -3.987 1.00 0.00 N ATOM 0 H ASN A 144 5.292 20.475 -6.881 1.00 0.00 H new ATOM 0 HA ASN A 144 7.568 21.643 -8.280 1.00 0.00 H new ATOM 0 HB2 ASN A 144 8.934 21.675 -6.128 1.00 0.00 H new ATOM 0 HB3 ASN A 144 8.059 23.078 -6.709 1.00 0.00 H new ATOM 0 HD21 ASN A 144 7.021 21.402 -3.063 1.00 0.00 H new ATOM 0 HD22 ASN A 144 7.976 20.468 -4.219 1.00 0.00 H new ATOM 2255 N PRO A 145 7.927 18.968 -8.384 1.00 0.00 N ATOM 2256 CA PRO A 145 8.378 17.555 -8.323 1.00 0.00 C ATOM 2257 C PRO A 145 9.907 17.442 -8.049 1.00 0.00 C ATOM 2258 O PRO A 145 10.713 18.184 -8.622 1.00 0.00 O ATOM 2259 CB PRO A 145 7.937 17.027 -9.703 1.00 0.00 C ATOM 2260 CG PRO A 145 7.987 18.234 -10.645 1.00 0.00 C ATOM 2261 CD PRO A 145 7.644 19.433 -9.756 1.00 0.00 C ATOM 0 HA PRO A 145 7.955 16.975 -7.502 1.00 0.00 H new ATOM 0 HB2 PRO A 145 8.600 16.233 -10.048 1.00 0.00 H new ATOM 0 HB3 PRO A 145 6.932 16.607 -9.658 1.00 0.00 H new ATOM 0 HG2 PRO A 145 8.973 18.344 -11.096 1.00 0.00 H new ATOM 0 HG3 PRO A 145 7.273 18.129 -11.462 1.00 0.00 H new ATOM 0 HD2 PRO A 145 8.248 20.303 -10.013 1.00 0.00 H new ATOM 0 HD3 PRO A 145 6.600 19.725 -9.869 1.00 0.00 H new ATOM 2269 N GLN A 146 10.287 16.506 -7.161 1.00 0.00 N ATOM 2270 CA GLN A 146 11.710 16.251 -6.803 1.00 0.00 C ATOM 2271 C GLN A 146 11.935 14.734 -6.469 1.00 0.00 C ATOM 2272 O GLN A 146 11.005 14.097 -5.958 1.00 0.00 O ATOM 2273 CB GLN A 146 12.228 17.201 -5.685 1.00 0.00 C ATOM 2274 CG GLN A 146 11.450 17.235 -4.346 1.00 0.00 C ATOM 2275 CD GLN A 146 10.457 18.405 -4.209 1.00 0.00 C ATOM 2276 OE1 GLN A 146 9.212 18.123 -3.874 1.00 0.00 O flip ATOM 2277 NE2 GLN A 146 10.802 19.575 -4.378 1.00 0.00 N flip ATOM 0 H GLN A 146 9.627 15.904 -6.669 1.00 0.00 H new ATOM 0 HA GLN A 146 12.317 16.485 -7.678 1.00 0.00 H new ATOM 0 HB2 GLN A 146 13.260 16.928 -5.465 1.00 0.00 H new ATOM 0 HB3 GLN A 146 12.245 18.214 -6.088 1.00 0.00 H new ATOM 0 HG2 GLN A 146 10.904 16.298 -4.234 1.00 0.00 H new ATOM 0 HG3 GLN A 146 12.166 17.286 -3.526 1.00 0.00 H new ATOM 0 HE21 GLN A 146 11.765 19.790 -4.637 1.00 0.00 H new ATOM 0 HE22 GLN A 146 10.125 20.329 -4.259 1.00 0.00 H new ATOM 2286 N PRO A 147 13.120 14.101 -6.737 1.00 0.00 N ATOM 2287 CA PRO A 147 13.286 12.622 -6.670 1.00 0.00 C ATOM 2288 C PRO A 147 13.212 12.035 -5.229 1.00 0.00 C ATOM 2289 O PRO A 147 13.903 12.501 -4.319 1.00 0.00 O ATOM 2290 CB PRO A 147 14.661 12.415 -7.334 1.00 0.00 C ATOM 2291 CG PRO A 147 15.417 13.730 -7.173 1.00 0.00 C ATOM 2292 CD PRO A 147 14.318 14.783 -7.274 1.00 0.00 C ATOM 0 HA PRO A 147 12.475 12.089 -7.167 1.00 0.00 H new ATOM 0 HB2 PRO A 147 15.202 11.595 -6.861 1.00 0.00 H new ATOM 0 HB3 PRO A 147 14.549 12.157 -8.387 1.00 0.00 H new ATOM 0 HG2 PRO A 147 15.936 13.781 -6.216 1.00 0.00 H new ATOM 0 HG3 PRO A 147 16.170 13.859 -7.951 1.00 0.00 H new ATOM 0 HD2 PRO A 147 14.564 15.673 -6.695 1.00 0.00 H new ATOM 0 HD3 PRO A 147 14.166 15.104 -8.304 1.00 0.00 H new ATOM 2300 N LEU A 148 12.330 11.039 -5.050 1.00 0.00 N ATOM 2301 CA LEU A 148 11.886 10.575 -3.703 1.00 0.00 C ATOM 2302 C LEU A 148 12.566 9.237 -3.276 1.00 0.00 C ATOM 2303 O LEU A 148 12.914 8.398 -4.110 1.00 0.00 O ATOM 2304 CB LEU A 148 10.344 10.376 -3.716 1.00 0.00 C ATOM 2305 CG LEU A 148 9.432 11.556 -4.161 1.00 0.00 C ATOM 2306 CD1 LEU A 148 7.996 11.077 -4.455 1.00 0.00 C ATOM 2307 CD2 LEU A 148 9.451 12.713 -3.145 1.00 0.00 C ATOM 0 H LEU A 148 11.901 10.528 -5.822 1.00 0.00 H new ATOM 0 HA LEU A 148 12.178 11.338 -2.982 1.00 0.00 H new ATOM 0 HB2 LEU A 148 10.127 9.530 -4.368 1.00 0.00 H new ATOM 0 HB3 LEU A 148 10.041 10.089 -2.709 1.00 0.00 H new ATOM 0 HG LEU A 148 9.842 11.947 -5.092 1.00 0.00 H new ATOM 0 HD11 LEU A 148 7.385 11.926 -4.763 1.00 0.00 H new ATOM 0 HD12 LEU A 148 8.016 10.335 -5.254 1.00 0.00 H new ATOM 0 HD13 LEU A 148 7.570 10.631 -3.556 1.00 0.00 H new ATOM 0 HD21 LEU A 148 8.801 13.515 -3.495 1.00 0.00 H new ATOM 0 HD22 LEU A 148 9.097 12.354 -2.179 1.00 0.00 H new ATOM 0 HD23 LEU A 148 10.469 13.090 -3.041 1.00 0.00 H new ATOM 2319 N ILE A 149 12.664 9.038 -1.948 1.00 0.00 N ATOM 2320 CA ILE A 149 13.227 7.802 -1.317 1.00 0.00 C ATOM 2321 C ILE A 149 12.050 6.825 -1.082 1.00 0.00 C ATOM 2322 O ILE A 149 11.171 7.086 -0.259 1.00 0.00 O ATOM 2323 CB ILE A 149 14.036 8.107 -0.003 1.00 0.00 C ATOM 2324 CG1 ILE A 149 15.335 8.936 -0.248 1.00 0.00 C ATOM 2325 CG2 ILE A 149 14.380 6.839 0.824 1.00 0.00 C ATOM 2326 CD1 ILE A 149 16.550 8.185 -0.815 1.00 0.00 C ATOM 0 H ILE A 149 12.355 9.730 -1.266 1.00 0.00 H new ATOM 0 HA ILE A 149 13.959 7.345 -1.983 1.00 0.00 H new ATOM 0 HB ILE A 149 13.349 8.718 0.582 1.00 0.00 H new ATOM 0 HG12 ILE A 149 15.092 9.750 -0.931 1.00 0.00 H new ATOM 0 HG13 ILE A 149 15.630 9.390 0.698 1.00 0.00 H new ATOM 0 HG21 ILE A 149 14.938 7.126 1.715 1.00 0.00 H new ATOM 0 HG22 ILE A 149 13.459 6.336 1.119 1.00 0.00 H new ATOM 0 HG23 ILE A 149 14.985 6.163 0.219 1.00 0.00 H new ATOM 0 HD11 ILE A 149 17.382 8.878 -0.936 1.00 0.00 H new ATOM 0 HD12 ILE A 149 16.838 7.389 -0.129 1.00 0.00 H new ATOM 0 HD13 ILE A 149 16.293 7.755 -1.783 1.00 0.00 H new ATOM 2338 N PHE A 150 12.082 5.684 -1.783 1.00 0.00 N ATOM 2339 CA PHE A 150 11.046 4.633 -1.678 1.00 0.00 C ATOM 2340 C PHE A 150 11.696 3.439 -0.923 1.00 0.00 C ATOM 2341 O PHE A 150 12.429 2.631 -1.506 1.00 0.00 O ATOM 2342 CB PHE A 150 10.532 4.294 -3.107 1.00 0.00 C ATOM 2343 CG PHE A 150 9.578 5.279 -3.845 1.00 0.00 C ATOM 2344 CD1 PHE A 150 9.343 6.599 -3.429 1.00 0.00 C ATOM 2345 CD2 PHE A 150 8.923 4.819 -4.994 1.00 0.00 C ATOM 2346 CE1 PHE A 150 8.473 7.421 -4.134 1.00 0.00 C ATOM 2347 CE2 PHE A 150 8.086 5.661 -5.723 1.00 0.00 C ATOM 2348 CZ PHE A 150 7.862 6.961 -5.287 1.00 0.00 C ATOM 0 H PHE A 150 12.827 5.458 -2.442 1.00 0.00 H new ATOM 0 HA PHE A 150 10.165 4.941 -1.115 1.00 0.00 H new ATOM 0 HB2 PHE A 150 11.407 4.154 -3.741 1.00 0.00 H new ATOM 0 HB3 PHE A 150 10.023 3.332 -3.049 1.00 0.00 H new ATOM 0 HD1 PHE A 150 9.844 6.980 -2.551 1.00 0.00 H new ATOM 0 HD2 PHE A 150 9.068 3.799 -5.319 1.00 0.00 H new ATOM 0 HE1 PHE A 150 8.273 8.422 -3.781 1.00 0.00 H new ATOM 0 HE2 PHE A 150 7.612 5.304 -6.625 1.00 0.00 H new ATOM 0 HZ PHE A 150 7.210 7.613 -5.849 1.00 0.00 H new ATOM 2358 N HIS A 151 11.421 3.363 0.395 1.00 0.00 N ATOM 2359 CA HIS A 151 11.944 2.305 1.294 1.00 0.00 C ATOM 2360 C HIS A 151 10.974 1.107 1.247 1.00 0.00 C ATOM 2361 O HIS A 151 9.897 1.138 1.847 1.00 0.00 O ATOM 2362 CB HIS A 151 12.136 2.878 2.728 1.00 0.00 C ATOM 2363 CG HIS A 151 12.687 1.955 3.836 1.00 0.00 C ATOM 2364 ND1 HIS A 151 13.576 2.388 4.804 1.00 0.00 N ATOM 2365 CD2 HIS A 151 12.321 0.614 4.106 1.00 0.00 C ATOM 2366 CE1 HIS A 151 13.687 1.251 5.559 1.00 0.00 C ATOM 2367 NE2 HIS A 151 12.976 0.125 5.227 1.00 0.00 N ATOM 0 H HIS A 151 10.825 4.039 0.873 1.00 0.00 H new ATOM 0 HA HIS A 151 12.924 1.957 0.968 1.00 0.00 H new ATOM 0 HB2 HIS A 151 12.804 3.736 2.653 1.00 0.00 H new ATOM 0 HB3 HIS A 151 11.170 3.254 3.064 1.00 0.00 H new ATOM 0 HD2 HIS A 151 11.620 0.044 3.514 1.00 0.00 H new ATOM 0 HE1 HIS A 151 14.338 1.240 6.421 1.00 0.00 H new ATOM 0 HE2 HIS A 151 12.940 -0.793 5.670 1.00 0.00 H new ATOM 2375 N MET A 152 11.425 0.032 0.594 1.00 0.00 N ATOM 2376 CA MET A 152 10.609 -1.186 0.390 1.00 0.00 C ATOM 2377 C MET A 152 11.179 -2.398 1.158 1.00 0.00 C ATOM 2378 O MET A 152 12.393 -2.535 1.349 1.00 0.00 O ATOM 2379 CB MET A 152 10.480 -1.463 -1.122 1.00 0.00 C ATOM 2380 CG MET A 152 9.603 -0.397 -1.786 1.00 0.00 C ATOM 2381 SD MET A 152 9.225 -0.794 -3.482 1.00 0.00 S ATOM 2382 CE MET A 152 8.127 0.607 -3.698 1.00 0.00 C ATOM 0 H MET A 152 12.360 -0.027 0.191 1.00 0.00 H new ATOM 0 HA MET A 152 9.613 -1.017 0.800 1.00 0.00 H new ATOM 0 HB2 MET A 152 11.468 -1.469 -1.583 1.00 0.00 H new ATOM 0 HB3 MET A 152 10.047 -2.451 -1.282 1.00 0.00 H new ATOM 0 HG2 MET A 152 8.675 -0.291 -1.224 1.00 0.00 H new ATOM 0 HG3 MET A 152 10.112 0.566 -1.745 1.00 0.00 H new ATOM 0 HE1 MET A 152 7.184 0.268 -4.128 1.00 0.00 H new ATOM 0 HE2 MET A 152 7.938 1.074 -2.731 1.00 0.00 H new ATOM 0 HE3 MET A 152 8.590 1.333 -4.367 1.00 0.00 H new ATOM 2392 N GLU A 153 10.261 -3.281 1.590 1.00 0.00 N ATOM 2393 CA GLU A 153 10.596 -4.466 2.406 1.00 0.00 C ATOM 2394 C GLU A 153 9.855 -5.655 1.736 1.00 0.00 C ATOM 2395 O GLU A 153 8.650 -5.824 1.932 1.00 0.00 O ATOM 2396 CB GLU A 153 10.273 -4.136 3.904 1.00 0.00 C ATOM 2397 CG GLU A 153 9.616 -5.240 4.750 1.00 0.00 C ATOM 2398 CD GLU A 153 9.709 -5.000 6.257 1.00 0.00 C ATOM 2399 OE1 GLU A 153 8.827 -4.310 6.817 1.00 0.00 O ATOM 2400 OE2 GLU A 153 10.668 -5.497 6.890 1.00 0.00 O ATOM 0 H GLU A 153 9.266 -3.195 1.384 1.00 0.00 H new ATOM 0 HA GLU A 153 11.647 -4.751 2.439 1.00 0.00 H new ATOM 0 HB2 GLU A 153 11.203 -3.847 4.393 1.00 0.00 H new ATOM 0 HB3 GLU A 153 9.619 -3.264 3.923 1.00 0.00 H new ATOM 0 HG2 GLU A 153 8.566 -5.324 4.469 1.00 0.00 H new ATOM 0 HG3 GLU A 153 10.087 -6.194 4.514 1.00 0.00 H new ATOM 2407 N MET A 154 10.579 -6.499 0.973 1.00 0.00 N ATOM 2408 CA MET A 154 10.018 -7.737 0.381 1.00 0.00 C ATOM 2409 C MET A 154 9.775 -8.826 1.456 1.00 0.00 C ATOM 2410 O MET A 154 10.642 -9.142 2.275 1.00 0.00 O ATOM 2411 CB MET A 154 10.916 -8.246 -0.771 1.00 0.00 C ATOM 2412 CG MET A 154 10.250 -9.261 -1.721 1.00 0.00 C ATOM 2413 SD MET A 154 8.786 -8.577 -2.530 1.00 0.00 S ATOM 2414 CE MET A 154 9.515 -7.339 -3.623 1.00 0.00 C ATOM 0 H MET A 154 11.562 -6.346 0.749 1.00 0.00 H new ATOM 0 HA MET A 154 9.043 -7.498 -0.043 1.00 0.00 H new ATOM 0 HB2 MET A 154 11.250 -7.389 -1.356 1.00 0.00 H new ATOM 0 HB3 MET A 154 11.806 -8.705 -0.341 1.00 0.00 H new ATOM 0 HG2 MET A 154 10.969 -9.574 -2.478 1.00 0.00 H new ATOM 0 HG3 MET A 154 9.970 -10.152 -1.160 1.00 0.00 H new ATOM 0 HE1 MET A 154 8.758 -6.978 -4.319 1.00 0.00 H new ATOM 0 HE2 MET A 154 9.890 -6.505 -3.029 1.00 0.00 H new ATOM 0 HE3 MET A 154 10.338 -7.786 -4.181 1.00 0.00 H new ATOM 2424 N LEU A 155 8.557 -9.372 1.397 1.00 0.00 N ATOM 2425 CA LEU A 155 8.106 -10.524 2.223 1.00 0.00 C ATOM 2426 C LEU A 155 7.837 -11.774 1.331 1.00 0.00 C ATOM 2427 O LEU A 155 8.425 -12.830 1.583 1.00 0.00 O ATOM 2428 CB LEU A 155 6.935 -10.201 3.215 1.00 0.00 C ATOM 2429 CG LEU A 155 5.983 -8.998 2.915 1.00 0.00 C ATOM 2430 CD1 LEU A 155 4.526 -9.276 3.308 1.00 0.00 C ATOM 2431 CD2 LEU A 155 6.472 -7.703 3.591 1.00 0.00 C ATOM 0 H LEU A 155 7.834 -9.028 0.765 1.00 0.00 H new ATOM 0 HA LEU A 155 8.935 -10.764 2.889 1.00 0.00 H new ATOM 0 HB2 LEU A 155 6.317 -11.095 3.293 1.00 0.00 H new ATOM 0 HB3 LEU A 155 7.376 -10.032 4.197 1.00 0.00 H new ATOM 0 HG LEU A 155 6.011 -8.864 1.834 1.00 0.00 H new ATOM 0 HD11 LEU A 155 3.914 -8.405 3.076 1.00 0.00 H new ATOM 0 HD12 LEU A 155 4.157 -10.137 2.751 1.00 0.00 H new ATOM 0 HD13 LEU A 155 4.471 -9.484 4.377 1.00 0.00 H new ATOM 0 HD21 LEU A 155 5.784 -6.890 3.359 1.00 0.00 H new ATOM 0 HD22 LEU A 155 6.511 -7.849 4.671 1.00 0.00 H new ATOM 0 HD23 LEU A 155 7.467 -7.453 3.222 1.00 0.00 H new ATOM 2443 N LYS A 156 6.940 -11.669 0.329 1.00 0.00 N ATOM 2444 CA LYS A 156 6.528 -12.802 -0.541 1.00 0.00 C ATOM 2445 C LYS A 156 6.317 -12.267 -1.978 1.00 0.00 C ATOM 2446 O LYS A 156 5.895 -11.131 -2.206 1.00 0.00 O ATOM 2447 CB LYS A 156 5.260 -13.476 0.060 1.00 0.00 C ATOM 2448 CG LYS A 156 4.631 -14.687 -0.683 1.00 0.00 C ATOM 2449 CD LYS A 156 3.203 -14.474 -1.239 1.00 0.00 C ATOM 2450 CE LYS A 156 3.087 -13.426 -2.361 1.00 0.00 C ATOM 2451 NZ LYS A 156 1.714 -13.324 -2.886 1.00 0.00 N ATOM 0 H LYS A 156 6.475 -10.792 0.095 1.00 0.00 H new ATOM 0 HA LYS A 156 7.297 -13.573 -0.590 1.00 0.00 H new ATOM 0 HB2 LYS A 156 5.507 -13.801 1.071 1.00 0.00 H new ATOM 0 HB3 LYS A 156 4.491 -12.709 0.151 1.00 0.00 H new ATOM 0 HG2 LYS A 156 5.285 -14.959 -1.511 1.00 0.00 H new ATOM 0 HG3 LYS A 156 4.611 -15.536 -0.000 1.00 0.00 H new ATOM 0 HD2 LYS A 156 2.830 -15.427 -1.614 1.00 0.00 H new ATOM 0 HD3 LYS A 156 2.551 -14.177 -0.418 1.00 0.00 H new ATOM 0 HE2 LYS A 156 3.403 -12.454 -1.982 1.00 0.00 H new ATOM 0 HE3 LYS A 156 3.766 -13.688 -3.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 1.672 -12.572 -3.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 1.439 -14.230 -3.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 1.061 -13.098 -2.109 1.00 0.00 H new ATOM 2465 N VAL A 157 6.593 -13.135 -2.958 1.00 0.00 N ATOM 2466 CA VAL A 157 6.383 -12.835 -4.399 1.00 0.00 C ATOM 2467 C VAL A 157 6.042 -14.170 -5.137 1.00 0.00 C ATOM 2468 O VAL A 157 6.735 -15.182 -4.989 1.00 0.00 O ATOM 2469 CB VAL A 157 7.525 -11.954 -5.021 1.00 0.00 C ATOM 2470 CG1 VAL A 157 8.965 -12.328 -4.622 1.00 0.00 C ATOM 2471 CG2 VAL A 157 7.411 -11.824 -6.551 1.00 0.00 C ATOM 0 H VAL A 157 6.968 -14.068 -2.786 1.00 0.00 H new ATOM 0 HA VAL A 157 5.522 -12.180 -4.533 1.00 0.00 H new ATOM 0 HB VAL A 157 7.344 -10.982 -4.563 1.00 0.00 H new ATOM 0 HG11 VAL A 157 9.666 -11.652 -5.112 1.00 0.00 H new ATOM 0 HG12 VAL A 157 9.076 -12.245 -3.541 1.00 0.00 H new ATOM 0 HG13 VAL A 157 9.174 -13.352 -4.931 1.00 0.00 H new ATOM 0 HG21 VAL A 157 8.226 -11.205 -6.925 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.469 -12.813 -7.005 1.00 0.00 H new ATOM 0 HG23 VAL A 157 6.457 -11.362 -6.807 1.00 0.00 H new ATOM 2481 N GLU A 158 4.966 -14.120 -5.951 1.00 0.00 N ATOM 2482 CA GLU A 158 4.482 -15.274 -6.763 1.00 0.00 C ATOM 2483 C GLU A 158 4.540 -14.899 -8.269 1.00 0.00 C ATOM 2484 O GLU A 158 4.188 -13.788 -8.664 1.00 0.00 O ATOM 2485 CB GLU A 158 3.030 -15.662 -6.376 1.00 0.00 C ATOM 2486 CG GLU A 158 2.900 -16.413 -5.036 1.00 0.00 C ATOM 2487 CD GLU A 158 1.468 -16.877 -4.759 1.00 0.00 C ATOM 2488 OE1 GLU A 158 0.620 -16.041 -4.377 1.00 0.00 O ATOM 2489 OE2 GLU A 158 1.182 -18.084 -4.930 1.00 0.00 O ATOM 0 H GLU A 158 4.402 -13.279 -6.069 1.00 0.00 H new ATOM 0 HA GLU A 158 5.125 -16.132 -6.566 1.00 0.00 H new ATOM 0 HB2 GLU A 158 2.426 -14.756 -6.329 1.00 0.00 H new ATOM 0 HB3 GLU A 158 2.611 -16.283 -7.167 1.00 0.00 H new ATOM 0 HG2 GLU A 158 3.564 -17.278 -5.042 1.00 0.00 H new ATOM 0 HG3 GLU A 158 3.231 -15.763 -4.226 1.00 0.00 H new ATOM 2496 N SER A 159 4.966 -15.853 -9.107 1.00 0.00 N ATOM 2497 CA SER A 159 5.220 -15.629 -10.560 1.00 0.00 C ATOM 2498 C SER A 159 4.009 -16.038 -11.478 1.00 0.00 C ATOM 2499 O SER A 159 3.080 -16.678 -10.973 1.00 0.00 O ATOM 2500 CB SER A 159 6.511 -16.429 -10.877 1.00 0.00 C ATOM 2501 OG SER A 159 7.650 -15.823 -10.272 1.00 0.00 O ATOM 0 H SER A 159 5.149 -16.811 -8.807 1.00 0.00 H new ATOM 0 HA SER A 159 5.344 -14.567 -10.774 1.00 0.00 H new ATOM 0 HB2 SER A 159 6.406 -17.453 -10.518 1.00 0.00 H new ATOM 0 HB3 SER A 159 6.654 -16.483 -11.956 1.00 0.00 H new ATOM 0 HG SER A 159 8.451 -16.346 -10.485 1.00 0.00 H new ATOM 2507 N PRO A 160 3.956 -15.720 -12.816 1.00 0.00 N ATOM 2508 CA PRO A 160 2.804 -16.061 -13.698 1.00 0.00 C ATOM 2509 C PRO A 160 2.599 -17.586 -13.917 1.00 0.00 C ATOM 2510 O PRO A 160 3.424 -18.256 -14.548 1.00 0.00 O ATOM 2511 CB PRO A 160 3.076 -15.274 -14.996 1.00 0.00 C ATOM 2512 CG PRO A 160 4.564 -14.929 -14.971 1.00 0.00 C ATOM 2513 CD PRO A 160 4.895 -14.801 -13.487 1.00 0.00 C ATOM 0 HA PRO A 160 1.854 -15.780 -13.244 1.00 0.00 H new ATOM 0 HB2 PRO A 160 2.828 -15.870 -15.874 1.00 0.00 H new ATOM 0 HB3 PRO A 160 2.466 -14.372 -15.041 1.00 0.00 H new ATOM 0 HG2 PRO A 160 5.161 -15.707 -15.446 1.00 0.00 H new ATOM 0 HG3 PRO A 160 4.766 -14.001 -15.505 1.00 0.00 H new ATOM 0 HD2 PRO A 160 5.930 -15.076 -13.287 1.00 0.00 H new ATOM 0 HD3 PRO A 160 4.764 -13.777 -13.139 1.00 0.00 H new ATOM 2521 N GLY A 161 1.505 -18.107 -13.336 1.00 0.00 N ATOM 2522 CA GLY A 161 1.313 -19.562 -13.155 1.00 0.00 C ATOM 2523 C GLY A 161 0.743 -19.882 -11.759 1.00 0.00 C ATOM 2524 O GLY A 161 -0.337 -20.469 -11.648 1.00 0.00 O ATOM 0 H GLY A 161 0.734 -17.541 -12.981 1.00 0.00 H new ATOM 0 HA2 GLY A 161 0.637 -19.940 -13.922 1.00 0.00 H new ATOM 0 HA3 GLY A 161 2.265 -20.076 -13.288 1.00 0.00 H new ATOM 2528 N THR A 162 1.499 -19.507 -10.714 1.00 0.00 N ATOM 2529 CA THR A 162 1.137 -19.745 -9.289 1.00 0.00 C ATOM 2530 C THR A 162 0.356 -18.600 -8.559 1.00 0.00 C ATOM 2531 O THR A 162 -0.226 -18.868 -7.503 1.00 0.00 O ATOM 2532 CB THR A 162 2.426 -20.199 -8.534 1.00 0.00 C ATOM 2533 OG1 THR A 162 2.099 -20.618 -7.213 1.00 0.00 O ATOM 2534 CG2 THR A 162 3.576 -19.173 -8.444 1.00 0.00 C ATOM 0 H THR A 162 2.390 -19.024 -10.826 1.00 0.00 H new ATOM 0 HA THR A 162 0.386 -20.535 -9.280 1.00 0.00 H new ATOM 0 HB THR A 162 2.808 -21.012 -9.152 1.00 0.00 H new ATOM 0 HG1 THR A 162 1.245 -20.219 -6.945 1.00 0.00 H new ATOM 0 HG21 THR A 162 4.411 -19.610 -7.897 1.00 0.00 H new ATOM 0 HG22 THR A 162 3.902 -18.903 -9.448 1.00 0.00 H new ATOM 0 HG23 THR A 162 3.228 -18.281 -7.923 1.00 0.00 H new ATOM 2542 N TYR A 163 0.336 -17.355 -9.079 1.00 0.00 N ATOM 2543 CA TYR A 163 -0.224 -16.176 -8.367 1.00 0.00 C ATOM 2544 C TYR A 163 -1.785 -16.142 -8.257 1.00 0.00 C ATOM 2545 O TYR A 163 -2.486 -16.962 -8.862 1.00 0.00 O ATOM 2546 CB TYR A 163 0.415 -14.894 -8.987 1.00 0.00 C ATOM 2547 CG TYR A 163 -0.201 -14.295 -10.272 1.00 0.00 C ATOM 2548 CD1 TYR A 163 -0.078 -14.941 -11.502 1.00 0.00 C ATOM 2549 CD2 TYR A 163 -0.901 -13.086 -10.206 1.00 0.00 C ATOM 2550 CE1 TYR A 163 -0.638 -14.381 -12.649 1.00 0.00 C ATOM 2551 CE2 TYR A 163 -1.454 -12.520 -11.348 1.00 0.00 C ATOM 2552 CZ TYR A 163 -1.322 -13.167 -12.573 1.00 0.00 C ATOM 2553 OH TYR A 163 -1.872 -12.615 -13.701 1.00 0.00 O ATOM 0 H TYR A 163 0.706 -17.134 -10.003 1.00 0.00 H new ATOM 0 HA TYR A 163 0.052 -16.241 -7.315 1.00 0.00 H new ATOM 0 HB2 TYR A 163 0.401 -14.117 -8.223 1.00 0.00 H new ATOM 0 HB3 TYR A 163 1.461 -15.116 -9.197 1.00 0.00 H new ATOM 0 HD1 TYR A 163 0.453 -15.879 -11.566 1.00 0.00 H new ATOM 0 HD2 TYR A 163 -1.013 -12.586 -9.255 1.00 0.00 H new ATOM 0 HE1 TYR A 163 -0.542 -14.887 -13.598 1.00 0.00 H new ATOM 0 HE2 TYR A 163 -1.984 -11.581 -11.285 1.00 0.00 H new ATOM 0 HH TYR A 163 -2.313 -11.771 -13.471 1.00 0.00 H new