USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1070 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 146 SER OG : rot -33:sc= 0.81 USER MOD Set 1.2: A 147 GLN : amide:sc= -0.333 K(o=0.48,f=1.1) USER MOD Set 2.1: A 8 GLN : amide:sc= -3.14! K(o=-3.6!,f=-1.1) USER MOD Set 2.2: A 76 MET CE :methyl 170:sc= -0.422 (180deg=-0.499) USER MOD Set 3.1: A 41 GLN : amide:sc= -0.424 K(o=-0.92,f=-1.8) USER MOD Set 3.2: A 72 MET CE :methyl -152:sc= -0.492 (180deg=-2.44) USER MOD Set 4.1: A 58 ASN : amide:sc= -0.0157 K(o=-1.3,f=0.69) USER MOD Set 4.2: A 59 ASN : amide:sc= -1.33! K(o=-1.3!,f=0.69) USER MOD Set 5.1: A 36 MET CE :methyl -109:sc= 0 (180deg=-1.31) USER MOD Set 5.2: A 75 GLN : amide:sc= -3.05 K(o=-3,f=-3.8!) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.53 USER MOD Single : A 13 LYS NZ :NH3+ -165:sc= -0.0516 (180deg=-0.324) USER MOD Single : A 18 GLN : amide:sc= -0.117 K(o=-0.12,f=-0.79) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.00233 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.368 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -22:sc= 0.359 USER MOD Single : A 42 ASN : amide:sc= -0.0955 K(o=-0.095,f=-0.65) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.864 USER MOD Single : A 49 GLN : amide:sc= -0.0491 K(o=-0.049,f=-0.7) USER MOD Single : A 57 ASN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 60 ASN : amide:sc= -0.894 K(o=-0.89,f=-0.0025) USER MOD Single : A 62 GLN : amide:sc= -11.8! K(o=-12!,f=-2.2) USER MOD Single : A 64 ASN : amide:sc= -2.11 K(o=-2.1,f=-11!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.0872 USER MOD Single : A 69 CYS SG : rot 180:sc= -1.9 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 32:sc= 0.222 USER MOD Single : A 85 MET CE :methyl 157:sc= -1.56 (180deg=-2.32) USER MOD Single : A 90 LYS NZ :NH3+ -148:sc= -1.26 (180deg=-3.25!) USER MOD Single : A 101 SER OG : rot -70:sc= 0.0166 USER MOD Single : A 109 MET CE :methyl 173:sc= -0.215 (180deg=-0.313) USER MOD Single : A 111 ASN : amide:sc= -0.385 X(o=-0.38,f=0.1!) USER MOD Single : A 115 LYS NZ :NH3+ -112:sc= -1.08 (180deg=-3.42!) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.0271 USER MOD Single : A 124 MET CE :methyl 167:sc= -0.532 (180deg=-0.786) USER MOD Single : A 135 MET CE :methyl -107:sc= -0.203 (180deg=-2.17) USER MOD Single : A 137 ASN : amide:sc= -4.11! C(o=-4.1!,f=-7.8!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 MET CE :methyl 147:sc= -3.49 (180deg=-4.06!) USER MOD Single : A 148 LYS NZ :NH3+ -152:sc= -0.153 (180deg=-0.936) USER MOD ----------------------------------------------------------------- ATOM 27 N LEU A 4 -1.032 7.951 3.301 1.00 0.73 N ATOM 28 CA LEU A 4 -2.330 8.413 3.779 1.00 0.45 C ATOM 29 C LEU A 4 -2.159 9.376 4.953 1.00 0.47 C ATOM 30 O LEU A 4 -2.101 8.959 6.110 1.00 0.58 O ATOM 31 CB LEU A 4 -3.204 7.221 4.185 1.00 0.41 C ATOM 32 CG LEU A 4 -3.301 6.101 3.143 1.00 0.50 C ATOM 33 CD1 LEU A 4 -4.215 4.994 3.636 1.00 1.27 C ATOM 34 CD2 LEU A 4 -3.799 6.642 1.810 1.00 1.19 C ATOM 0 HA LEU A 4 -2.826 8.947 2.968 1.00 0.45 H new ATOM 0 HB2 LEU A 4 -2.811 6.801 5.111 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -4.209 7.584 4.400 1.00 0.41 H new ATOM 0 HG LEU A 4 -2.303 5.690 2.994 1.00 0.50 H new ATOM 0 HD11 LEU A 4 -4.272 4.207 2.884 1.00 1.27 H new ATOM 0 HD12 LEU A 4 -3.819 4.581 4.564 1.00 1.27 H new ATOM 0 HD13 LEU A 4 -5.211 5.398 3.815 1.00 1.27 H new ATOM 0 HD21 LEU A 4 -3.859 5.829 1.087 1.00 1.19 H new ATOM 0 HD22 LEU A 4 -4.787 7.084 1.943 1.00 1.19 H new ATOM 0 HD23 LEU A 4 -3.108 7.402 1.445 1.00 1.19 H new ATOM 46 N THR A 5 -2.082 10.668 4.637 1.00 0.47 N ATOM 47 CA THR A 5 -1.910 11.705 5.652 1.00 0.54 C ATOM 48 C THR A 5 -3.133 11.813 6.560 1.00 0.51 C ATOM 49 O THR A 5 -3.937 10.887 6.647 1.00 0.55 O ATOM 50 CB THR A 5 -1.642 13.077 5.004 1.00 0.62 C ATOM 51 OG1 THR A 5 -2.736 13.440 4.156 1.00 1.12 O ATOM 52 CG2 THR A 5 -0.353 13.052 4.196 1.00 0.99 C ATOM 0 H THR A 5 -2.136 11.022 3.682 1.00 0.47 H new ATOM 0 HA THR A 5 -1.049 11.414 6.254 1.00 0.54 H new ATOM 0 HB THR A 5 -1.539 13.816 5.799 1.00 0.62 H new ATOM 0 HG1 THR A 5 -2.559 14.314 3.749 1.00 1.12 H new ATOM 0 HG21 THR A 5 -0.185 14.032 3.748 1.00 0.99 H new ATOM 0 HG22 THR A 5 0.482 12.805 4.851 1.00 0.99 H new ATOM 0 HG23 THR A 5 -0.431 12.302 3.409 1.00 0.99 H new ATOM 60 N GLU A 6 -3.272 12.954 7.230 1.00 0.60 N ATOM 61 CA GLU A 6 -4.390 13.178 8.137 1.00 0.62 C ATOM 62 C GLU A 6 -5.666 13.488 7.363 1.00 0.55 C ATOM 63 O GLU A 6 -6.732 12.948 7.659 1.00 0.53 O ATOM 64 CB GLU A 6 -4.072 14.328 9.093 1.00 0.75 C ATOM 65 CG GLU A 6 -2.820 14.099 9.925 1.00 1.46 C ATOM 66 CD GLU A 6 -2.455 15.303 10.769 1.00 1.74 C ATOM 67 OE1 GLU A 6 -2.959 15.406 11.908 1.00 2.00 O ATOM 68 OE2 GLU A 6 -1.663 16.143 10.295 1.00 2.20 O ATOM 0 H GLU A 6 -2.623 13.738 7.161 1.00 0.60 H new ATOM 0 HA GLU A 6 -4.547 12.265 8.712 1.00 0.62 H new ATOM 0 HB2 GLU A 6 -3.953 15.246 8.517 1.00 0.75 H new ATOM 0 HB3 GLU A 6 -4.920 14.479 9.761 1.00 0.75 H new ATOM 0 HG2 GLU A 6 -2.972 13.237 10.574 1.00 1.46 H new ATOM 0 HG3 GLU A 6 -1.988 13.857 9.264 1.00 1.46 H new ATOM 75 N GLU A 7 -5.546 14.360 6.368 1.00 0.58 N ATOM 76 CA GLU A 7 -6.686 14.750 5.550 1.00 0.58 C ATOM 77 C GLU A 7 -7.103 13.609 4.628 1.00 0.48 C ATOM 78 O GLU A 7 -8.292 13.371 4.414 1.00 0.46 O ATOM 79 CB GLU A 7 -6.347 15.996 4.729 1.00 0.69 C ATOM 80 CG GLU A 7 -5.197 15.797 3.757 1.00 0.69 C ATOM 81 CD GLU A 7 -5.632 15.907 2.309 1.00 1.02 C ATOM 82 OE1 GLU A 7 -6.056 14.881 1.736 1.00 1.19 O ATOM 83 OE2 GLU A 7 -5.552 17.020 1.748 1.00 1.35 O ATOM 0 H GLU A 7 -4.668 14.810 6.109 1.00 0.58 H new ATOM 0 HA GLU A 7 -7.521 14.980 6.212 1.00 0.58 H new ATOM 0 HB2 GLU A 7 -7.232 16.304 4.172 1.00 0.69 H new ATOM 0 HB3 GLU A 7 -6.099 16.811 5.409 1.00 0.69 H new ATOM 0 HG2 GLU A 7 -4.424 16.539 3.958 1.00 0.69 H new ATOM 0 HG3 GLU A 7 -4.750 14.817 3.925 1.00 0.69 H new ATOM 90 N GLN A 8 -6.113 12.906 4.088 1.00 0.44 N ATOM 91 CA GLN A 8 -6.371 11.785 3.194 1.00 0.37 C ATOM 92 C GLN A 8 -7.165 10.699 3.909 1.00 0.31 C ATOM 93 O GLN A 8 -8.158 10.191 3.382 1.00 0.29 O ATOM 94 CB GLN A 8 -5.052 11.214 2.673 1.00 0.40 C ATOM 95 CG GLN A 8 -4.304 12.162 1.748 1.00 0.48 C ATOM 96 CD GLN A 8 -2.984 11.591 1.264 1.00 1.35 C ATOM 97 OE1 GLN A 8 -2.032 12.330 1.014 1.00 2.22 O ATOM 98 NE2 GLN A 8 -2.920 10.272 1.125 1.00 1.68 N ATOM 0 H GLN A 8 -5.124 13.094 4.255 1.00 0.44 H new ATOM 0 HA GLN A 8 -6.960 12.145 2.351 1.00 0.37 H new ATOM 0 HB2 GLN A 8 -4.413 10.966 3.520 1.00 0.40 H new ATOM 0 HB3 GLN A 8 -5.253 10.284 2.142 1.00 0.40 H new ATOM 0 HG2 GLN A 8 -4.932 12.394 0.888 1.00 0.48 H new ATOM 0 HG3 GLN A 8 -4.119 13.101 2.270 1.00 0.48 H new ATOM 0 HE21 GLN A 8 -3.733 9.696 1.343 1.00 1.68 H new ATOM 0 HE22 GLN A 8 -2.058 9.835 0.800 1.00 1.68 H new ATOM 107 N ILE A 9 -6.726 10.352 5.116 1.00 0.33 N ATOM 108 CA ILE A 9 -7.401 9.330 5.906 1.00 0.33 C ATOM 109 C ILE A 9 -8.845 9.723 6.182 1.00 0.34 C ATOM 110 O ILE A 9 -9.766 8.970 5.881 1.00 0.36 O ATOM 111 CB ILE A 9 -6.675 9.066 7.244 1.00 0.42 C ATOM 112 CG1 ILE A 9 -5.358 8.323 6.997 1.00 0.44 C ATOM 113 CG2 ILE A 9 -7.566 8.269 8.191 1.00 0.51 C ATOM 114 CD1 ILE A 9 -4.511 8.153 8.241 1.00 0.54 C ATOM 0 H ILE A 9 -5.908 10.763 5.566 1.00 0.33 H new ATOM 0 HA ILE A 9 -7.383 8.412 5.318 1.00 0.33 H new ATOM 0 HB ILE A 9 -6.452 10.026 7.710 1.00 0.42 H new ATOM 0 HG12 ILE A 9 -5.578 7.340 6.581 1.00 0.44 H new ATOM 0 HG13 ILE A 9 -4.781 8.864 6.247 1.00 0.44 H new ATOM 0 HG21 ILE A 9 -7.036 8.093 9.127 1.00 0.51 H new ATOM 0 HG22 ILE A 9 -8.479 8.830 8.390 1.00 0.51 H new ATOM 0 HG23 ILE A 9 -7.820 7.313 7.733 1.00 0.51 H new ATOM 0 HD11 ILE A 9 -3.595 7.619 7.988 1.00 0.54 H new ATOM 0 HD12 ILE A 9 -4.259 9.133 8.646 1.00 0.54 H new ATOM 0 HD13 ILE A 9 -5.068 7.585 8.986 1.00 0.54 H new ATOM 126 N ALA A 10 -9.033 10.910 6.746 1.00 0.36 N ATOM 127 CA ALA A 10 -10.368 11.402 7.068 1.00 0.40 C ATOM 128 C ALA A 10 -11.242 11.518 5.822 1.00 0.35 C ATOM 129 O ALA A 10 -12.468 11.578 5.921 1.00 0.36 O ATOM 130 CB ALA A 10 -10.275 12.747 7.773 1.00 0.50 C ATOM 0 H ALA A 10 -8.278 11.550 6.990 1.00 0.36 H new ATOM 0 HA ALA A 10 -10.837 10.678 7.735 1.00 0.40 H new ATOM 0 HB1 ALA A 10 -11.277 13.104 8.008 1.00 0.50 H new ATOM 0 HB2 ALA A 10 -9.704 12.636 8.695 1.00 0.50 H new ATOM 0 HB3 ALA A 10 -9.777 13.466 7.122 1.00 0.50 H new ATOM 136 N GLU A 11 -10.612 11.547 4.651 1.00 0.33 N ATOM 137 CA GLU A 11 -11.350 11.667 3.398 1.00 0.33 C ATOM 138 C GLU A 11 -12.053 10.362 3.031 1.00 0.27 C ATOM 139 O GLU A 11 -13.275 10.332 2.864 1.00 0.28 O ATOM 140 CB GLU A 11 -10.407 12.089 2.268 1.00 0.37 C ATOM 141 CG GLU A 11 -11.114 12.334 0.944 1.00 0.41 C ATOM 142 CD GLU A 11 -12.116 13.469 1.020 1.00 1.27 C ATOM 143 OE1 GLU A 11 -13.282 13.208 1.386 1.00 2.27 O ATOM 144 OE2 GLU A 11 -11.737 14.619 0.713 1.00 1.19 O ATOM 0 H GLU A 11 -9.599 11.489 4.544 1.00 0.33 H new ATOM 0 HA GLU A 11 -12.115 12.431 3.536 1.00 0.33 H new ATOM 0 HB2 GLU A 11 -9.883 12.998 2.564 1.00 0.37 H new ATOM 0 HB3 GLU A 11 -9.651 11.316 2.129 1.00 0.37 H new ATOM 0 HG2 GLU A 11 -10.373 12.559 0.177 1.00 0.41 H new ATOM 0 HG3 GLU A 11 -11.626 11.422 0.635 1.00 0.41 H new ATOM 151 N PHE A 12 -11.289 9.276 2.921 1.00 0.23 N ATOM 152 CA PHE A 12 -11.876 7.988 2.572 1.00 0.22 C ATOM 153 C PHE A 12 -12.529 7.345 3.789 1.00 0.19 C ATOM 154 O PHE A 12 -13.383 6.469 3.654 1.00 0.20 O ATOM 155 CB PHE A 12 -10.838 7.049 1.945 1.00 0.26 C ATOM 156 CG PHE A 12 -9.667 6.724 2.831 1.00 0.25 C ATOM 157 CD1 PHE A 12 -9.823 5.918 3.947 1.00 0.31 C ATOM 158 CD2 PHE A 12 -8.407 7.219 2.536 1.00 0.27 C ATOM 159 CE1 PHE A 12 -8.747 5.614 4.754 1.00 0.37 C ATOM 160 CE2 PHE A 12 -7.326 6.917 3.340 1.00 0.30 C ATOM 161 CZ PHE A 12 -7.498 6.113 4.451 1.00 0.35 C ATOM 0 H PHE A 12 -10.279 9.263 3.066 1.00 0.23 H new ATOM 0 HA PHE A 12 -12.649 8.167 1.825 1.00 0.22 H new ATOM 0 HB2 PHE A 12 -11.332 6.119 1.664 1.00 0.26 H new ATOM 0 HB3 PHE A 12 -10.466 7.503 1.026 1.00 0.26 H new ATOM 0 HD1 PHE A 12 -10.799 5.523 4.188 1.00 0.31 H new ATOM 0 HD2 PHE A 12 -8.269 7.847 1.668 1.00 0.27 H new ATOM 0 HE1 PHE A 12 -8.882 4.986 5.622 1.00 0.37 H new ATOM 0 HE2 PHE A 12 -6.348 7.308 3.101 1.00 0.30 H new ATOM 0 HZ PHE A 12 -6.654 5.876 5.082 1.00 0.35 H new ATOM 171 N LYS A 13 -12.117 7.778 4.978 1.00 0.19 N ATOM 172 CA LYS A 13 -12.689 7.259 6.214 1.00 0.22 C ATOM 173 C LYS A 13 -14.118 7.762 6.354 1.00 0.21 C ATOM 174 O LYS A 13 -15.007 7.036 6.798 1.00 0.23 O ATOM 175 CB LYS A 13 -11.842 7.678 7.423 1.00 0.28 C ATOM 176 CG LYS A 13 -12.566 7.560 8.758 1.00 0.32 C ATOM 177 CD LYS A 13 -12.932 6.118 9.072 1.00 0.33 C ATOM 178 CE LYS A 13 -13.641 6.004 10.413 1.00 0.48 C ATOM 179 NZ LYS A 13 -12.811 6.540 11.528 1.00 1.23 N ATOM 0 H LYS A 13 -11.392 8.484 5.110 1.00 0.19 H new ATOM 0 HA LYS A 13 -12.695 6.170 6.178 1.00 0.22 H new ATOM 0 HB2 LYS A 13 -10.942 7.063 7.454 1.00 0.28 H new ATOM 0 HB3 LYS A 13 -11.519 8.710 7.287 1.00 0.28 H new ATOM 0 HG2 LYS A 13 -11.933 7.956 9.552 1.00 0.32 H new ATOM 0 HG3 LYS A 13 -13.470 8.169 8.737 1.00 0.32 H new ATOM 0 HD2 LYS A 13 -13.575 5.725 8.284 1.00 0.33 H new ATOM 0 HD3 LYS A 13 -12.030 5.506 9.083 1.00 0.33 H new ATOM 0 HE2 LYS A 13 -14.586 6.546 10.371 1.00 0.48 H new ATOM 0 HE3 LYS A 13 -13.881 4.959 10.609 1.00 0.48 H new ATOM 0 HZ1 LYS A 13 -13.203 6.222 12.437 1.00 1.23 H new ATOM 0 HZ2 LYS A 13 -11.835 6.194 11.432 1.00 1.23 H new ATOM 0 HZ3 LYS A 13 -12.814 7.579 11.495 1.00 1.23 H new ATOM 193 N ASP A 14 -14.327 9.020 5.978 1.00 0.23 N ATOM 194 CA ASP A 14 -15.651 9.615 6.016 1.00 0.25 C ATOM 195 C ASP A 14 -16.541 8.890 5.019 1.00 0.22 C ATOM 196 O ASP A 14 -17.668 8.501 5.334 1.00 0.23 O ATOM 197 CB ASP A 14 -15.581 11.105 5.675 1.00 0.31 C ATOM 198 CG ASP A 14 -16.920 11.799 5.835 1.00 0.37 C ATOM 199 OD1 ASP A 14 -17.205 12.293 6.946 1.00 0.44 O ATOM 200 OD2 ASP A 14 -17.684 11.850 4.847 1.00 0.41 O ATOM 0 H ASP A 14 -13.593 9.645 5.644 1.00 0.23 H new ATOM 0 HA ASP A 14 -16.064 9.518 7.020 1.00 0.25 H new ATOM 0 HB2 ASP A 14 -14.846 11.588 6.318 1.00 0.31 H new ATOM 0 HB3 ASP A 14 -15.234 11.224 4.649 1.00 0.31 H new ATOM 205 N ALA A 15 -16.015 8.709 3.809 1.00 0.22 N ATOM 206 CA ALA A 15 -16.738 8.004 2.760 1.00 0.24 C ATOM 207 C ALA A 15 -16.997 6.562 3.183 1.00 0.22 C ATOM 208 O ALA A 15 -17.978 5.945 2.771 1.00 0.29 O ATOM 209 CB ALA A 15 -15.950 8.046 1.459 1.00 0.27 C ATOM 0 H ALA A 15 -15.091 9.042 3.534 1.00 0.22 H new ATOM 0 HA ALA A 15 -17.697 8.497 2.598 1.00 0.24 H new ATOM 0 HB1 ALA A 15 -16.501 7.515 0.683 1.00 0.27 H new ATOM 0 HB2 ALA A 15 -15.803 9.083 1.156 1.00 0.27 H new ATOM 0 HB3 ALA A 15 -14.980 7.570 1.605 1.00 0.27 H new ATOM 215 N PHE A 16 -16.100 6.038 4.016 1.00 0.20 N ATOM 216 CA PHE A 16 -16.209 4.676 4.526 1.00 0.22 C ATOM 217 C PHE A 16 -17.413 4.555 5.454 1.00 0.22 C ATOM 218 O PHE A 16 -18.148 3.568 5.416 1.00 0.25 O ATOM 219 CB PHE A 16 -14.919 4.306 5.274 1.00 0.26 C ATOM 220 CG PHE A 16 -14.952 2.973 5.973 1.00 0.31 C ATOM 221 CD1 PHE A 16 -15.520 2.846 7.233 1.00 0.37 C ATOM 222 CD2 PHE A 16 -14.399 1.850 5.378 1.00 0.38 C ATOM 223 CE1 PHE A 16 -15.538 1.627 7.882 1.00 0.45 C ATOM 224 CE2 PHE A 16 -14.417 0.627 6.022 1.00 0.46 C ATOM 225 CZ PHE A 16 -14.986 0.516 7.276 1.00 0.48 C ATOM 0 H PHE A 16 -15.282 6.544 4.354 1.00 0.20 H new ATOM 0 HA PHE A 16 -16.349 3.989 3.691 1.00 0.22 H new ATOM 0 HB2 PHE A 16 -14.092 4.307 4.564 1.00 0.26 H new ATOM 0 HB3 PHE A 16 -14.708 5.081 6.011 1.00 0.26 H new ATOM 0 HD1 PHE A 16 -15.953 3.711 7.712 1.00 0.37 H new ATOM 0 HD2 PHE A 16 -13.949 1.931 4.400 1.00 0.38 H new ATOM 0 HE1 PHE A 16 -15.983 1.543 8.862 1.00 0.45 H new ATOM 0 HE2 PHE A 16 -13.987 -0.241 5.545 1.00 0.46 H new ATOM 0 HZ PHE A 16 -14.999 -0.438 7.781 1.00 0.48 H new ATOM 235 N VAL A 17 -17.607 5.574 6.282 1.00 0.22 N ATOM 236 CA VAL A 17 -18.700 5.608 7.224 1.00 0.23 C ATOM 237 C VAL A 17 -20.037 5.754 6.504 1.00 0.23 C ATOM 238 O VAL A 17 -21.074 5.309 6.995 1.00 0.26 O ATOM 239 CB VAL A 17 -18.486 6.769 8.202 1.00 0.30 C ATOM 240 CG1 VAL A 17 -19.525 7.863 8.027 1.00 1.11 C ATOM 241 CG2 VAL A 17 -18.443 6.261 9.625 1.00 0.91 C ATOM 0 H VAL A 17 -17.006 6.397 6.313 1.00 0.22 H new ATOM 0 HA VAL A 17 -18.723 4.668 7.775 1.00 0.23 H new ATOM 0 HB VAL A 17 -17.521 7.222 7.974 1.00 0.30 H new ATOM 0 HG11 VAL A 17 -19.333 8.664 8.741 1.00 1.11 H new ATOM 0 HG12 VAL A 17 -19.469 8.259 7.013 1.00 1.11 H new ATOM 0 HG13 VAL A 17 -20.519 7.452 8.201 1.00 1.11 H new ATOM 0 HG21 VAL A 17 -18.290 7.098 10.306 1.00 0.91 H new ATOM 0 HG22 VAL A 17 -19.385 5.766 9.863 1.00 0.91 H new ATOM 0 HG23 VAL A 17 -17.623 5.551 9.733 1.00 0.91 H new ATOM 251 N GLN A 18 -19.994 6.386 5.336 1.00 0.24 N ATOM 252 CA GLN A 18 -21.190 6.602 4.534 1.00 0.29 C ATOM 253 C GLN A 18 -21.825 5.278 4.116 1.00 0.32 C ATOM 254 O GLN A 18 -23.046 5.177 3.997 1.00 0.43 O ATOM 255 CB GLN A 18 -20.851 7.428 3.293 1.00 0.33 C ATOM 256 CG GLN A 18 -20.476 8.869 3.602 1.00 0.34 C ATOM 257 CD GLN A 18 -21.613 9.646 4.238 1.00 1.09 C ATOM 258 OE1 GLN A 18 -22.786 9.369 3.986 1.00 1.54 O ATOM 259 NE2 GLN A 18 -21.270 10.626 5.066 1.00 1.60 N ATOM 0 H GLN A 18 -19.139 6.759 4.923 1.00 0.24 H new ATOM 0 HA GLN A 18 -21.909 7.146 5.147 1.00 0.29 H new ATOM 0 HB2 GLN A 18 -20.025 6.952 2.765 1.00 0.33 H new ATOM 0 HB3 GLN A 18 -21.707 7.421 2.618 1.00 0.33 H new ATOM 0 HG2 GLN A 18 -19.615 8.881 4.270 1.00 0.34 H new ATOM 0 HG3 GLN A 18 -20.172 9.366 2.681 1.00 0.34 H new ATOM 0 HE21 GLN A 18 -20.285 10.821 5.246 1.00 1.60 H new ATOM 0 HE22 GLN A 18 -21.992 11.184 5.522 1.00 1.60 H new ATOM 268 N PHE A 19 -20.992 4.263 3.896 1.00 0.28 N ATOM 269 CA PHE A 19 -21.489 2.954 3.484 1.00 0.33 C ATOM 270 C PHE A 19 -21.703 2.036 4.683 1.00 0.35 C ATOM 271 O PHE A 19 -22.220 0.927 4.536 1.00 0.64 O ATOM 272 CB PHE A 19 -20.536 2.302 2.477 1.00 0.36 C ATOM 273 CG PHE A 19 -20.511 3.008 1.151 1.00 0.37 C ATOM 274 CD1 PHE A 19 -21.392 2.653 0.143 1.00 0.48 C ATOM 275 CD2 PHE A 19 -19.600 4.025 0.912 1.00 0.41 C ATOM 276 CE1 PHE A 19 -21.365 3.299 -1.079 1.00 0.54 C ATOM 277 CE2 PHE A 19 -19.570 4.674 -0.307 1.00 0.44 C ATOM 278 CZ PHE A 19 -20.479 4.318 -1.300 1.00 0.47 C ATOM 0 H PHE A 19 -19.979 4.321 3.995 1.00 0.28 H new ATOM 0 HA PHE A 19 -22.454 3.107 3.001 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.529 2.288 2.894 1.00 0.36 H new ATOM 0 HB3 PHE A 19 -20.832 1.264 2.324 1.00 0.36 H new ATOM 0 HD1 PHE A 19 -22.108 1.863 0.314 1.00 0.48 H new ATOM 0 HD2 PHE A 19 -18.906 4.313 1.688 1.00 0.41 H new ATOM 0 HE1 PHE A 19 -22.046 2.998 -1.862 1.00 0.54 H new ATOM 0 HE2 PHE A 19 -18.845 5.454 -0.489 1.00 0.44 H new ATOM 0 HZ PHE A 19 -20.485 4.845 -2.243 1.00 0.47 H new ATOM 288 N ASP A 20 -21.307 2.493 5.868 1.00 0.29 N ATOM 289 CA ASP A 20 -21.483 1.695 7.076 1.00 0.28 C ATOM 290 C ASP A 20 -22.775 2.084 7.789 1.00 0.37 C ATOM 291 O ASP A 20 -22.755 2.814 8.781 1.00 0.44 O ATOM 292 CB ASP A 20 -20.291 1.861 8.018 1.00 0.25 C ATOM 293 CG ASP A 20 -20.359 0.907 9.194 1.00 0.27 C ATOM 294 OD1 ASP A 20 -20.531 -0.310 8.963 1.00 0.29 O ATOM 295 OD2 ASP A 20 -20.241 1.376 10.346 1.00 0.33 O ATOM 0 H ASP A 20 -20.867 3.401 6.016 1.00 0.29 H new ATOM 0 HA ASP A 20 -21.545 0.647 6.782 1.00 0.28 H new ATOM 0 HB2 ASP A 20 -19.367 1.691 7.466 1.00 0.25 H new ATOM 0 HB3 ASP A 20 -20.259 2.887 8.385 1.00 0.25 H new ATOM 300 N LYS A 21 -23.895 1.590 7.273 1.00 0.47 N ATOM 301 CA LYS A 21 -25.203 1.886 7.848 1.00 0.59 C ATOM 302 C LYS A 21 -25.594 0.846 8.893 1.00 0.64 C ATOM 303 O LYS A 21 -26.265 1.162 9.877 1.00 0.83 O ATOM 304 CB LYS A 21 -26.260 1.937 6.744 1.00 0.68 C ATOM 305 CG LYS A 21 -26.070 3.098 5.782 1.00 1.02 C ATOM 306 CD LYS A 21 -26.503 4.419 6.401 1.00 1.14 C ATOM 307 CE LYS A 21 -28.013 4.485 6.579 1.00 1.67 C ATOM 308 NZ LYS A 21 -28.448 5.785 7.162 1.00 2.10 N ATOM 0 H LYS A 21 -23.924 0.981 6.455 1.00 0.47 H new ATOM 0 HA LYS A 21 -25.145 2.857 8.339 1.00 0.59 H new ATOM 0 HB2 LYS A 21 -26.235 1.002 6.184 1.00 0.68 H new ATOM 0 HB3 LYS A 21 -27.248 2.010 7.199 1.00 0.68 H new ATOM 0 HG2 LYS A 21 -25.022 3.160 5.489 1.00 1.02 H new ATOM 0 HG3 LYS A 21 -26.645 2.916 4.874 1.00 1.02 H new ATOM 0 HD2 LYS A 21 -26.016 4.545 7.368 1.00 1.14 H new ATOM 0 HD3 LYS A 21 -26.174 5.243 5.768 1.00 1.14 H new ATOM 0 HE2 LYS A 21 -28.499 4.339 5.614 1.00 1.67 H new ATOM 0 HE3 LYS A 21 -28.338 3.670 7.226 1.00 1.67 H new ATOM 0 HZ1 LYS A 21 -29.483 5.789 7.267 1.00 2.10 H new ATOM 0 HZ2 LYS A 21 -28.005 5.913 8.094 1.00 2.10 H new ATOM 0 HZ3 LYS A 21 -28.161 6.561 6.532 1.00 2.10 H new ATOM 322 N GLU A 22 -25.171 -0.394 8.674 1.00 0.58 N ATOM 323 CA GLU A 22 -25.478 -1.485 9.591 1.00 0.63 C ATOM 324 C GLU A 22 -24.872 -1.234 10.969 1.00 0.60 C ATOM 325 O GLU A 22 -25.348 -1.766 11.972 1.00 0.80 O ATOM 326 CB GLU A 22 -24.966 -2.809 9.025 1.00 0.62 C ATOM 327 CG GLU A 22 -25.532 -3.141 7.654 1.00 0.71 C ATOM 328 CD GLU A 22 -24.955 -4.417 7.077 1.00 0.98 C ATOM 329 OE1 GLU A 22 -25.521 -5.498 7.342 1.00 0.96 O ATOM 330 OE2 GLU A 22 -23.936 -4.336 6.359 1.00 1.80 O ATOM 0 H GLU A 22 -24.612 -0.669 7.866 1.00 0.58 H new ATOM 0 HA GLU A 22 -26.561 -1.538 9.702 1.00 0.63 H new ATOM 0 HB2 GLU A 22 -23.879 -2.772 8.961 1.00 0.62 H new ATOM 0 HB3 GLU A 22 -25.217 -3.612 9.717 1.00 0.62 H new ATOM 0 HG2 GLU A 22 -26.615 -3.237 7.726 1.00 0.71 H new ATOM 0 HG3 GLU A 22 -25.330 -2.315 6.972 1.00 0.71 H new ATOM 337 N GLY A 23 -23.820 -0.422 11.009 1.00 0.45 N ATOM 338 CA GLY A 23 -23.169 -0.111 12.270 1.00 0.46 C ATOM 339 C GLY A 23 -22.102 -1.123 12.641 1.00 0.39 C ATOM 340 O GLY A 23 -21.605 -1.124 13.767 1.00 0.45 O ATOM 0 H GLY A 23 -23.406 0.026 10.191 1.00 0.45 H new ATOM 0 HA2 GLY A 23 -22.719 0.880 12.207 1.00 0.46 H new ATOM 0 HA3 GLY A 23 -23.918 -0.072 13.061 1.00 0.46 H new ATOM 344 N THR A 24 -21.749 -1.985 11.693 1.00 0.34 N ATOM 345 CA THR A 24 -20.734 -3.005 11.925 1.00 0.30 C ATOM 346 C THR A 24 -19.335 -2.459 11.660 1.00 0.28 C ATOM 347 O THR A 24 -18.363 -3.215 11.604 1.00 0.29 O ATOM 348 CB THR A 24 -20.967 -4.245 11.039 1.00 0.32 C ATOM 349 OG1 THR A 24 -21.123 -3.848 9.673 1.00 0.33 O ATOM 350 CG2 THR A 24 -22.202 -5.010 11.495 1.00 0.40 C ATOM 0 H THR A 24 -22.152 -1.997 10.756 1.00 0.34 H new ATOM 0 HA THR A 24 -20.815 -3.297 12.972 1.00 0.30 H new ATOM 0 HB THR A 24 -20.099 -4.899 11.130 1.00 0.32 H new ATOM 0 HG1 THR A 24 -21.269 -4.641 9.116 1.00 0.33 H new ATOM 0 HG21 THR A 24 -22.347 -5.881 10.856 1.00 0.40 H new ATOM 0 HG22 THR A 24 -22.068 -5.335 12.527 1.00 0.40 H new ATOM 0 HG23 THR A 24 -23.076 -4.362 11.429 1.00 0.40 H new ATOM 358 N GLY A 25 -19.239 -1.140 11.502 1.00 0.30 N ATOM 359 CA GLY A 25 -17.954 -0.513 11.241 1.00 0.32 C ATOM 360 C GLY A 25 -17.263 -1.105 10.030 1.00 0.28 C ATOM 361 O GLY A 25 -16.037 -1.054 9.917 1.00 0.33 O ATOM 0 H GLY A 25 -20.028 -0.495 11.550 1.00 0.30 H new ATOM 0 HA2 GLY A 25 -18.098 0.557 11.088 1.00 0.32 H new ATOM 0 HA3 GLY A 25 -17.312 -0.626 12.115 1.00 0.32 H new ATOM 365 N LYS A 26 -18.054 -1.667 9.124 1.00 0.22 N ATOM 366 CA LYS A 26 -17.526 -2.282 7.917 1.00 0.19 C ATOM 367 C LYS A 26 -18.326 -1.850 6.685 1.00 0.20 C ATOM 368 O LYS A 26 -19.489 -1.464 6.793 1.00 0.23 O ATOM 369 CB LYS A 26 -17.527 -3.805 8.076 1.00 0.20 C ATOM 370 CG LYS A 26 -16.367 -4.305 8.929 1.00 0.25 C ATOM 371 CD LYS A 26 -16.641 -5.669 9.544 1.00 0.62 C ATOM 372 CE LYS A 26 -16.669 -6.766 8.493 1.00 0.62 C ATOM 373 NZ LYS A 26 -16.501 -8.118 9.092 1.00 1.10 N ATOM 0 H LYS A 26 -19.070 -1.708 9.205 1.00 0.22 H new ATOM 0 HA LYS A 26 -16.500 -1.947 7.767 1.00 0.19 H new ATOM 0 HB2 LYS A 26 -18.468 -4.119 8.528 1.00 0.20 H new ATOM 0 HB3 LYS A 26 -17.476 -4.270 7.091 1.00 0.20 H new ATOM 0 HG2 LYS A 26 -15.467 -4.361 8.316 1.00 0.25 H new ATOM 0 HG3 LYS A 26 -16.168 -3.585 9.723 1.00 0.25 H new ATOM 0 HD2 LYS A 26 -15.874 -5.895 10.285 1.00 0.62 H new ATOM 0 HD3 LYS A 26 -17.595 -5.645 10.070 1.00 0.62 H new ATOM 0 HE2 LYS A 26 -17.614 -6.725 7.951 1.00 0.62 H new ATOM 0 HE3 LYS A 26 -15.876 -6.591 7.765 1.00 0.62 H new ATOM 0 HZ1 LYS A 26 -16.526 -8.836 8.340 1.00 1.10 H new ATOM 0 HZ2 LYS A 26 -15.588 -8.167 9.587 1.00 1.10 H new ATOM 0 HZ3 LYS A 26 -17.271 -8.297 9.767 1.00 1.10 H new ATOM 387 N ILE A 27 -17.689 -1.915 5.516 1.00 0.22 N ATOM 388 CA ILE A 27 -18.327 -1.508 4.261 1.00 0.26 C ATOM 389 C ILE A 27 -18.512 -2.680 3.299 1.00 0.24 C ATOM 390 O ILE A 27 -17.606 -3.487 3.110 1.00 0.25 O ATOM 391 CB ILE A 27 -17.499 -0.425 3.547 1.00 0.34 C ATOM 392 CG1 ILE A 27 -16.055 -0.900 3.367 1.00 0.40 C ATOM 393 CG2 ILE A 27 -17.545 0.877 4.330 1.00 0.33 C ATOM 394 CD1 ILE A 27 -15.222 0.006 2.490 1.00 0.50 C ATOM 0 H ILE A 27 -16.730 -2.246 5.410 1.00 0.22 H new ATOM 0 HA ILE A 27 -19.307 -1.116 4.534 1.00 0.26 H new ATOM 0 HB ILE A 27 -17.928 -0.245 2.561 1.00 0.34 H new ATOM 0 HG12 ILE A 27 -15.583 -0.978 4.346 1.00 0.40 H new ATOM 0 HG13 ILE A 27 -16.062 -1.901 2.936 1.00 0.40 H new ATOM 0 HG21 ILE A 27 -16.955 1.634 3.813 1.00 0.33 H new ATOM 0 HG22 ILE A 27 -18.578 1.216 4.412 1.00 0.33 H new ATOM 0 HG23 ILE A 27 -17.135 0.716 5.327 1.00 0.33 H new ATOM 0 HD11 ILE A 27 -14.212 -0.395 2.409 1.00 0.50 H new ATOM 0 HD12 ILE A 27 -15.670 0.065 1.498 1.00 0.50 H new ATOM 0 HD13 ILE A 27 -15.183 1.003 2.930 1.00 0.50 H new ATOM 406 N ALA A 28 -19.688 -2.755 2.682 1.00 0.26 N ATOM 407 CA ALA A 28 -19.990 -3.823 1.734 1.00 0.26 C ATOM 408 C ALA A 28 -19.003 -3.828 0.570 1.00 0.23 C ATOM 409 O ALA A 28 -18.682 -2.779 0.010 1.00 0.25 O ATOM 410 CB ALA A 28 -21.414 -3.680 1.218 1.00 0.30 C ATOM 0 H ALA A 28 -20.448 -2.089 2.822 1.00 0.26 H new ATOM 0 HA ALA A 28 -19.895 -4.774 2.257 1.00 0.26 H new ATOM 0 HB1 ALA A 28 -21.627 -4.482 0.512 1.00 0.30 H new ATOM 0 HB2 ALA A 28 -22.111 -3.737 2.054 1.00 0.30 H new ATOM 0 HB3 ALA A 28 -21.525 -2.718 0.718 1.00 0.30 H new ATOM 416 N THR A 29 -18.528 -5.019 0.213 1.00 0.27 N ATOM 417 CA THR A 29 -17.575 -5.172 -0.882 1.00 0.30 C ATOM 418 C THR A 29 -18.205 -4.794 -2.217 1.00 0.29 C ATOM 419 O THR A 29 -17.505 -4.448 -3.169 1.00 0.39 O ATOM 420 CB THR A 29 -17.041 -6.614 -0.964 1.00 0.37 C ATOM 421 OG1 THR A 29 -16.079 -6.724 -2.021 1.00 1.03 O ATOM 422 CG2 THR A 29 -18.174 -7.602 -1.202 1.00 0.96 C ATOM 0 H THR A 29 -18.789 -5.894 0.668 1.00 0.27 H new ATOM 0 HA THR A 29 -16.744 -4.498 -0.675 1.00 0.30 H new ATOM 0 HB THR A 29 -16.565 -6.852 -0.013 1.00 0.37 H new ATOM 0 HG1 THR A 29 -15.744 -7.644 -2.064 1.00 1.03 H new ATOM 0 HG21 THR A 29 -17.770 -8.613 -1.256 1.00 0.96 H new ATOM 0 HG22 THR A 29 -18.889 -7.540 -0.382 1.00 0.96 H new ATOM 0 HG23 THR A 29 -18.676 -7.361 -2.139 1.00 0.96 H new ATOM 430 N ARG A 30 -19.528 -4.868 -2.279 1.00 0.25 N ATOM 431 CA ARG A 30 -20.259 -4.526 -3.491 1.00 0.29 C ATOM 432 C ARG A 30 -20.359 -3.013 -3.641 1.00 0.28 C ATOM 433 O ARG A 30 -20.901 -2.508 -4.624 1.00 0.44 O ATOM 434 CB ARG A 30 -21.658 -5.141 -3.448 1.00 0.35 C ATOM 435 CG ARG A 30 -21.655 -6.643 -3.219 1.00 0.43 C ATOM 436 CD ARG A 30 -22.926 -7.100 -2.524 1.00 0.83 C ATOM 437 NE ARG A 30 -24.126 -6.695 -3.251 1.00 1.56 N ATOM 438 CZ ARG A 30 -25.348 -7.138 -2.966 1.00 2.17 C ATOM 439 NH1 ARG A 30 -25.529 -8.005 -1.980 1.00 2.25 N ATOM 440 NH2 ARG A 30 -26.389 -6.714 -3.670 1.00 3.08 N ATOM 0 H ARG A 30 -20.118 -5.163 -1.501 1.00 0.25 H new ATOM 0 HA ARG A 30 -19.720 -4.927 -4.349 1.00 0.29 H new ATOM 0 HB2 ARG A 30 -22.232 -4.662 -2.655 1.00 0.35 H new ATOM 0 HB3 ARG A 30 -22.169 -4.926 -4.386 1.00 0.35 H new ATOM 0 HG2 ARG A 30 -21.556 -7.158 -4.174 1.00 0.43 H new ATOM 0 HG3 ARG A 30 -20.790 -6.919 -2.617 1.00 0.43 H new ATOM 0 HD2 ARG A 30 -22.913 -8.185 -2.423 1.00 0.83 H new ATOM 0 HD3 ARG A 30 -22.956 -6.686 -1.516 1.00 0.83 H new ATOM 0 HE ARG A 30 -24.021 -6.035 -4.021 1.00 1.56 H new ATOM 0 HH11 ARG A 30 -24.731 -8.334 -1.437 1.00 2.25 H new ATOM 0 HH12 ARG A 30 -26.467 -8.343 -1.764 1.00 2.25 H new ATOM 0 HH21 ARG A 30 -26.253 -6.048 -4.430 1.00 3.08 H new ATOM 0 HH22 ARG A 30 -27.325 -7.054 -3.451 1.00 3.08 H new ATOM 454 N GLU A 31 -19.832 -2.299 -2.653 1.00 0.22 N ATOM 455 CA GLU A 31 -19.852 -0.843 -2.657 1.00 0.23 C ATOM 456 C GLU A 31 -18.445 -0.281 -2.824 1.00 0.21 C ATOM 457 O GLU A 31 -18.261 0.928 -2.960 1.00 0.21 O ATOM 458 CB GLU A 31 -20.474 -0.322 -1.364 1.00 0.30 C ATOM 459 CG GLU A 31 -21.956 -0.634 -1.244 1.00 0.32 C ATOM 460 CD GLU A 31 -22.805 0.185 -2.197 1.00 1.30 C ATOM 461 OE1 GLU A 31 -22.806 -0.124 -3.407 1.00 2.26 O ATOM 462 OE2 GLU A 31 -23.468 1.137 -1.733 1.00 1.40 O ATOM 0 H GLU A 31 -19.383 -2.709 -1.834 1.00 0.22 H new ATOM 0 HA GLU A 31 -20.456 -0.512 -3.502 1.00 0.23 H new ATOM 0 HB2 GLU A 31 -19.948 -0.757 -0.514 1.00 0.30 H new ATOM 0 HB3 GLU A 31 -20.331 0.757 -1.309 1.00 0.30 H new ATOM 0 HG2 GLU A 31 -22.117 -1.694 -1.440 1.00 0.32 H new ATOM 0 HG3 GLU A 31 -22.281 -0.446 -0.221 1.00 0.32 H new ATOM 469 N LEU A 32 -17.456 -1.172 -2.806 1.00 0.21 N ATOM 470 CA LEU A 32 -16.060 -0.774 -2.962 1.00 0.24 C ATOM 471 C LEU A 32 -15.889 0.094 -4.203 1.00 0.23 C ATOM 472 O LEU A 32 -15.305 1.177 -4.140 1.00 0.25 O ATOM 473 CB LEU A 32 -15.164 -2.016 -3.047 1.00 0.29 C ATOM 474 CG LEU A 32 -13.667 -1.788 -2.787 1.00 0.44 C ATOM 475 CD1 LEU A 32 -13.024 -1.009 -3.926 1.00 1.04 C ATOM 476 CD2 LEU A 32 -13.454 -1.068 -1.464 1.00 1.37 C ATOM 0 H LEU A 32 -17.596 -2.175 -2.685 1.00 0.21 H new ATOM 0 HA LEU A 32 -15.764 -0.189 -2.092 1.00 0.24 H new ATOM 0 HB2 LEU A 32 -15.529 -2.752 -2.330 1.00 0.29 H new ATOM 0 HB3 LEU A 32 -15.277 -2.454 -4.039 1.00 0.29 H new ATOM 0 HG LEU A 32 -13.186 -2.765 -2.731 1.00 0.44 H new ATOM 0 HD11 LEU A 32 -11.965 -0.863 -3.714 1.00 1.04 H new ATOM 0 HD12 LEU A 32 -13.135 -1.567 -4.856 1.00 1.04 H new ATOM 0 HD13 LEU A 32 -13.512 -0.039 -4.024 1.00 1.04 H new ATOM 0 HD21 LEU A 32 -12.387 -0.917 -1.300 1.00 1.37 H new ATOM 0 HD22 LEU A 32 -13.958 -0.102 -1.490 1.00 1.37 H new ATOM 0 HD23 LEU A 32 -13.864 -1.669 -0.653 1.00 1.37 H new ATOM 488 N GLY A 33 -16.399 -0.387 -5.333 1.00 0.25 N ATOM 489 CA GLY A 33 -16.299 0.366 -6.568 1.00 0.28 C ATOM 490 C GLY A 33 -16.953 1.728 -6.452 1.00 0.27 C ATOM 491 O GLY A 33 -16.407 2.732 -6.913 1.00 0.32 O ATOM 0 H GLY A 33 -16.879 -1.283 -5.414 1.00 0.25 H new ATOM 0 HA2 GLY A 33 -15.249 0.489 -6.835 1.00 0.28 H new ATOM 0 HA3 GLY A 33 -16.770 -0.196 -7.375 1.00 0.28 H new ATOM 495 N THR A 34 -18.128 1.758 -5.830 1.00 0.23 N ATOM 496 CA THR A 34 -18.860 3.002 -5.638 1.00 0.24 C ATOM 497 C THR A 34 -18.025 3.995 -4.840 1.00 0.22 C ATOM 498 O THR A 34 -18.121 5.206 -5.037 1.00 0.23 O ATOM 499 CB THR A 34 -20.191 2.761 -4.902 1.00 0.26 C ATOM 500 OG1 THR A 34 -20.946 1.745 -5.575 1.00 0.31 O ATOM 501 CG2 THR A 34 -21.010 4.041 -4.829 1.00 0.29 C ATOM 0 H THR A 34 -18.593 0.933 -5.451 1.00 0.23 H new ATOM 0 HA THR A 34 -19.072 3.410 -6.626 1.00 0.24 H new ATOM 0 HB THR A 34 -19.965 2.435 -3.887 1.00 0.26 H new ATOM 0 HG1 THR A 34 -21.790 1.596 -5.100 1.00 0.31 H new ATOM 0 HG21 THR A 34 -21.945 3.845 -4.305 1.00 0.29 H new ATOM 0 HG22 THR A 34 -20.446 4.804 -4.292 1.00 0.29 H new ATOM 0 HG23 THR A 34 -21.226 4.393 -5.838 1.00 0.29 H new ATOM 509 N LEU A 35 -17.203 3.468 -3.938 1.00 0.22 N ATOM 510 CA LEU A 35 -16.344 4.293 -3.109 1.00 0.24 C ATOM 511 C LEU A 35 -15.272 4.971 -3.954 1.00 0.25 C ATOM 512 O LEU A 35 -14.958 6.144 -3.757 1.00 0.29 O ATOM 513 CB LEU A 35 -15.692 3.440 -2.025 1.00 0.29 C ATOM 514 CG LEU A 35 -16.348 3.521 -0.653 1.00 0.42 C ATOM 515 CD1 LEU A 35 -15.801 2.444 0.268 1.00 1.24 C ATOM 516 CD2 LEU A 35 -16.147 4.900 -0.045 1.00 1.16 C ATOM 0 H LEU A 35 -17.117 2.466 -3.765 1.00 0.22 H new ATOM 0 HA LEU A 35 -16.953 5.065 -2.639 1.00 0.24 H new ATOM 0 HB2 LEU A 35 -15.697 2.400 -2.352 1.00 0.29 H new ATOM 0 HB3 LEU A 35 -14.648 3.739 -1.929 1.00 0.29 H new ATOM 0 HG LEU A 35 -17.418 3.353 -0.775 1.00 0.42 H new ATOM 0 HD11 LEU A 35 -16.283 2.520 1.243 1.00 1.24 H new ATOM 0 HD12 LEU A 35 -16.002 1.462 -0.161 1.00 1.24 H new ATOM 0 HD13 LEU A 35 -14.725 2.576 0.384 1.00 1.24 H new ATOM 0 HD21 LEU A 35 -16.623 4.938 0.935 1.00 1.16 H new ATOM 0 HD22 LEU A 35 -15.081 5.099 0.061 1.00 1.16 H new ATOM 0 HD23 LEU A 35 -16.593 5.653 -0.695 1.00 1.16 H new ATOM 528 N MET A 36 -14.714 4.222 -4.897 1.00 0.28 N ATOM 529 CA MET A 36 -13.679 4.746 -5.776 1.00 0.32 C ATOM 530 C MET A 36 -14.244 5.820 -6.693 1.00 0.30 C ATOM 531 O MET A 36 -13.519 6.692 -7.168 1.00 0.40 O ATOM 532 CB MET A 36 -13.073 3.618 -6.603 1.00 0.45 C ATOM 533 CG MET A 36 -12.426 2.539 -5.756 1.00 0.51 C ATOM 534 SD MET A 36 -11.303 3.218 -4.521 1.00 1.10 S ATOM 535 CE MET A 36 -10.482 1.736 -3.956 1.00 0.69 C ATOM 0 H MET A 36 -14.962 3.248 -5.072 1.00 0.28 H new ATOM 0 HA MET A 36 -12.900 5.194 -5.160 1.00 0.32 H new ATOM 0 HB2 MET A 36 -13.852 3.169 -7.220 1.00 0.45 H new ATOM 0 HB3 MET A 36 -12.328 4.033 -7.282 1.00 0.45 H new ATOM 0 HG2 MET A 36 -13.202 1.958 -5.258 1.00 0.51 H new ATOM 0 HG3 MET A 36 -11.879 1.852 -6.402 1.00 0.51 H new ATOM 0 HE1 MET A 36 -10.813 1.500 -2.945 1.00 0.69 H new ATOM 0 HE2 MET A 36 -10.727 0.908 -4.621 1.00 0.69 H new ATOM 0 HE3 MET A 36 -9.404 1.895 -3.957 1.00 0.69 H new ATOM 545 N ARG A 37 -15.544 5.741 -6.944 1.00 0.30 N ATOM 546 CA ARG A 37 -16.218 6.715 -7.799 1.00 0.34 C ATOM 547 C ARG A 37 -16.407 8.043 -7.070 1.00 0.33 C ATOM 548 O ARG A 37 -16.106 9.108 -7.612 1.00 0.43 O ATOM 549 CB ARG A 37 -17.571 6.174 -8.264 1.00 0.44 C ATOM 550 CG ARG A 37 -17.459 5.023 -9.250 1.00 0.64 C ATOM 551 CD ARG A 37 -18.829 4.553 -9.714 1.00 0.70 C ATOM 552 NE ARG A 37 -18.737 3.475 -10.695 1.00 1.40 N ATOM 553 CZ ARG A 37 -19.793 2.878 -11.238 1.00 1.73 C ATOM 554 NH1 ARG A 37 -21.020 3.252 -10.896 1.00 1.52 N ATOM 555 NH2 ARG A 37 -19.626 1.907 -12.127 1.00 2.69 N ATOM 0 H ARG A 37 -16.154 5.014 -6.569 1.00 0.30 H new ATOM 0 HA ARG A 37 -15.589 6.888 -8.672 1.00 0.34 H new ATOM 0 HB2 ARG A 37 -18.139 5.843 -7.395 1.00 0.44 H new ATOM 0 HB3 ARG A 37 -18.137 6.983 -8.725 1.00 0.44 H new ATOM 0 HG2 ARG A 37 -16.869 5.336 -10.112 1.00 0.64 H new ATOM 0 HG3 ARG A 37 -16.927 4.194 -8.784 1.00 0.64 H new ATOM 0 HD2 ARG A 37 -19.405 4.212 -8.854 1.00 0.70 H new ATOM 0 HD3 ARG A 37 -19.372 5.392 -10.148 1.00 0.70 H new ATOM 0 HE ARG A 37 -17.809 3.162 -10.980 1.00 1.40 H new ATOM 0 HH11 ARG A 37 -21.154 3.999 -10.215 1.00 1.52 H new ATOM 0 HH12 ARG A 37 -21.829 2.792 -11.314 1.00 1.52 H new ATOM 0 HH21 ARG A 37 -18.685 1.617 -12.395 1.00 2.69 H new ATOM 0 HH22 ARG A 37 -20.438 1.450 -12.542 1.00 2.69 H new ATOM 569 N THR A 38 -16.906 7.975 -5.837 1.00 0.31 N ATOM 570 CA THR A 38 -17.130 9.171 -5.032 1.00 0.39 C ATOM 571 C THR A 38 -15.806 9.788 -4.587 1.00 0.36 C ATOM 572 O THR A 38 -15.763 10.925 -4.117 1.00 0.43 O ATOM 573 CB THR A 38 -17.990 8.867 -3.789 1.00 0.50 C ATOM 574 OG1 THR A 38 -18.206 10.068 -3.037 1.00 1.06 O ATOM 575 CG2 THR A 38 -17.324 7.824 -2.906 1.00 0.61 C ATOM 0 H THR A 38 -17.163 7.103 -5.375 1.00 0.31 H new ATOM 0 HA THR A 38 -17.665 9.880 -5.664 1.00 0.39 H new ATOM 0 HB THR A 38 -18.948 8.472 -4.128 1.00 0.50 H new ATOM 0 HG1 THR A 38 -17.509 10.721 -3.257 1.00 1.06 H new ATOM 0 HG21 THR A 38 -17.952 7.629 -2.037 1.00 0.61 H new ATOM 0 HG22 THR A 38 -17.189 6.902 -3.471 1.00 0.61 H new ATOM 0 HG23 THR A 38 -16.353 8.193 -2.576 1.00 0.61 H new ATOM 583 N LEU A 39 -14.728 9.024 -4.740 1.00 0.30 N ATOM 584 CA LEU A 39 -13.396 9.479 -4.355 1.00 0.33 C ATOM 585 C LEU A 39 -12.504 9.634 -5.585 1.00 0.33 C ATOM 586 O LEU A 39 -12.755 9.025 -6.624 1.00 0.31 O ATOM 587 CB LEU A 39 -12.760 8.490 -3.374 1.00 0.38 C ATOM 588 CG LEU A 39 -13.573 8.210 -2.106 1.00 0.64 C ATOM 589 CD1 LEU A 39 -12.953 7.068 -1.317 1.00 1.26 C ATOM 590 CD2 LEU A 39 -13.672 9.458 -1.240 1.00 1.07 C ATOM 0 H LEU A 39 -14.752 8.082 -5.130 1.00 0.30 H new ATOM 0 HA LEU A 39 -13.494 10.450 -3.869 1.00 0.33 H new ATOM 0 HB2 LEU A 39 -12.591 7.547 -3.893 1.00 0.38 H new ATOM 0 HB3 LEU A 39 -11.782 8.872 -3.082 1.00 0.38 H new ATOM 0 HG LEU A 39 -14.580 7.920 -2.406 1.00 0.64 H new ATOM 0 HD11 LEU A 39 -13.544 6.883 -0.420 1.00 1.26 H new ATOM 0 HD12 LEU A 39 -12.936 6.168 -1.932 1.00 1.26 H new ATOM 0 HD13 LEU A 39 -11.935 7.333 -1.033 1.00 1.26 H new ATOM 0 HD21 LEU A 39 -14.254 9.235 -0.346 1.00 1.07 H new ATOM 0 HD22 LEU A 39 -12.672 9.781 -0.951 1.00 1.07 H new ATOM 0 HD23 LEU A 39 -14.162 10.253 -1.802 1.00 1.07 H new ATOM 602 N GLY A 40 -11.472 10.467 -5.463 1.00 0.42 N ATOM 603 CA GLY A 40 -10.556 10.699 -6.570 1.00 0.47 C ATOM 604 C GLY A 40 -9.981 9.417 -7.153 1.00 0.43 C ATOM 605 O GLY A 40 -9.359 9.440 -8.215 1.00 0.69 O ATOM 0 H GLY A 40 -11.253 10.988 -4.614 1.00 0.42 H new ATOM 0 HA2 GLY A 40 -11.078 11.246 -7.356 1.00 0.47 H new ATOM 0 HA3 GLY A 40 -9.738 11.334 -6.229 1.00 0.47 H new ATOM 609 N GLN A 41 -10.185 8.302 -6.456 1.00 0.44 N ATOM 610 CA GLN A 41 -9.690 7.006 -6.912 1.00 0.40 C ATOM 611 C GLN A 41 -10.253 6.653 -8.287 1.00 0.51 C ATOM 612 O GLN A 41 -11.207 7.272 -8.758 1.00 1.45 O ATOM 613 CB GLN A 41 -10.068 5.918 -5.906 1.00 0.48 C ATOM 614 CG GLN A 41 -9.081 5.759 -4.756 1.00 0.74 C ATOM 615 CD GLN A 41 -8.405 7.061 -4.368 1.00 1.06 C ATOM 616 OE1 GLN A 41 -7.331 7.389 -4.869 1.00 1.97 O ATOM 617 NE2 GLN A 41 -9.037 7.813 -3.475 1.00 1.30 N ATOM 0 H GLN A 41 -10.691 8.270 -5.571 1.00 0.44 H new ATOM 0 HA GLN A 41 -8.605 7.069 -6.991 1.00 0.40 H new ATOM 0 HB2 GLN A 41 -11.052 6.144 -5.496 1.00 0.48 H new ATOM 0 HB3 GLN A 41 -10.152 4.967 -6.431 1.00 0.48 H new ATOM 0 HG2 GLN A 41 -9.604 5.356 -3.889 1.00 0.74 H new ATOM 0 HG3 GLN A 41 -8.320 5.031 -5.036 1.00 0.74 H new ATOM 0 HE21 GLN A 41 -9.927 7.502 -3.085 1.00 1.30 H new ATOM 0 HE22 GLN A 41 -8.633 8.702 -3.179 1.00 1.30 H new ATOM 626 N ASN A 42 -9.654 5.648 -8.919 1.00 0.74 N ATOM 627 CA ASN A 42 -10.087 5.196 -10.240 1.00 0.68 C ATOM 628 C ASN A 42 -9.346 3.919 -10.639 1.00 0.53 C ATOM 629 O ASN A 42 -8.454 3.949 -11.488 1.00 0.62 O ATOM 630 CB ASN A 42 -9.847 6.288 -11.286 1.00 0.85 C ATOM 631 CG ASN A 42 -10.306 5.874 -12.671 1.00 1.87 C ATOM 632 OD1 ASN A 42 -11.250 5.098 -12.819 1.00 2.57 O ATOM 633 ND2 ASN A 42 -9.637 6.391 -13.695 1.00 2.66 N ATOM 0 H ASN A 42 -8.864 5.128 -8.537 1.00 0.74 H new ATOM 0 HA ASN A 42 -11.155 4.982 -10.194 1.00 0.68 H new ATOM 0 HB2 ASN A 42 -10.373 7.195 -10.988 1.00 0.85 H new ATOM 0 HB3 ASN A 42 -8.785 6.531 -11.316 1.00 0.85 H new ATOM 0 HD21 ASN A 42 -9.900 6.149 -14.650 1.00 2.66 H new ATOM 0 HD22 ASN A 42 -8.861 7.031 -13.526 1.00 2.66 H new ATOM 640 N PRO A 43 -9.703 2.776 -10.025 1.00 0.41 N ATOM 641 CA PRO A 43 -9.067 1.489 -10.315 1.00 0.40 C ATOM 642 C PRO A 43 -9.606 0.839 -11.583 1.00 0.39 C ATOM 643 O PRO A 43 -10.711 1.147 -12.031 1.00 0.51 O ATOM 644 CB PRO A 43 -9.435 0.650 -9.096 1.00 0.44 C ATOM 645 CG PRO A 43 -10.765 1.172 -8.679 1.00 0.45 C ATOM 646 CD PRO A 43 -10.754 2.646 -8.994 1.00 0.44 C ATOM 0 HA PRO A 43 -7.995 1.591 -10.487 1.00 0.40 H new ATOM 0 HB2 PRO A 43 -9.483 -0.411 -9.343 1.00 0.44 H new ATOM 0 HB3 PRO A 43 -8.698 0.759 -8.301 1.00 0.44 H new ATOM 0 HG2 PRO A 43 -11.568 0.665 -9.215 1.00 0.45 H new ATOM 0 HG3 PRO A 43 -10.934 1.002 -7.616 1.00 0.45 H new ATOM 0 HD2 PRO A 43 -11.722 2.984 -9.364 1.00 0.44 H new ATOM 0 HD3 PRO A 43 -10.525 3.243 -8.111 1.00 0.44 H new ATOM 654 N THR A 44 -8.816 -0.062 -12.156 1.00 0.35 N ATOM 655 CA THR A 44 -9.210 -0.768 -13.368 1.00 0.36 C ATOM 656 C THR A 44 -10.373 -1.712 -13.094 1.00 0.32 C ATOM 657 O THR A 44 -10.475 -2.279 -12.005 1.00 0.33 O ATOM 658 CB THR A 44 -8.038 -1.574 -13.956 1.00 0.43 C ATOM 659 OG1 THR A 44 -7.263 -2.153 -12.900 1.00 0.73 O ATOM 660 CG2 THR A 44 -7.150 -0.691 -14.819 1.00 0.69 C ATOM 0 H THR A 44 -7.896 -0.321 -11.799 1.00 0.35 H new ATOM 0 HA THR A 44 -9.518 -0.012 -14.090 1.00 0.36 H new ATOM 0 HB THR A 44 -8.450 -2.367 -14.581 1.00 0.43 H new ATOM 0 HG1 THR A 44 -6.520 -2.666 -13.282 1.00 0.73 H new ATOM 0 HG21 THR A 44 -6.329 -1.284 -15.223 1.00 0.69 H new ATOM 0 HG22 THR A 44 -7.736 -0.277 -15.639 1.00 0.69 H new ATOM 0 HG23 THR A 44 -6.747 0.122 -14.214 1.00 0.69 H new ATOM 668 N GLU A 45 -11.250 -1.876 -14.080 1.00 0.32 N ATOM 669 CA GLU A 45 -12.405 -2.755 -13.936 1.00 0.33 C ATOM 670 C GLU A 45 -11.987 -4.111 -13.376 1.00 0.32 C ATOM 671 O GLU A 45 -12.580 -4.609 -12.418 1.00 0.34 O ATOM 672 CB GLU A 45 -13.104 -2.940 -15.285 1.00 0.40 C ATOM 673 CG GLU A 45 -14.312 -3.864 -15.225 1.00 1.14 C ATOM 674 CD GLU A 45 -14.984 -4.034 -16.573 1.00 1.84 C ATOM 675 OE1 GLU A 45 -14.474 -4.827 -17.394 1.00 2.70 O ATOM 676 OE2 GLU A 45 -16.019 -3.377 -16.807 1.00 2.04 O ATOM 0 H GLU A 45 -11.183 -1.412 -14.986 1.00 0.32 H new ATOM 0 HA GLU A 45 -13.100 -2.290 -13.237 1.00 0.33 H new ATOM 0 HB2 GLU A 45 -13.421 -1.966 -15.657 1.00 0.40 H new ATOM 0 HB3 GLU A 45 -12.388 -3.338 -16.004 1.00 0.40 H new ATOM 0 HG2 GLU A 45 -14.000 -4.840 -14.853 1.00 1.14 H new ATOM 0 HG3 GLU A 45 -15.034 -3.467 -14.511 1.00 1.14 H new ATOM 683 N ALA A 46 -10.956 -4.697 -13.977 1.00 0.33 N ATOM 684 CA ALA A 46 -10.452 -5.995 -13.542 1.00 0.37 C ATOM 685 C ALA A 46 -10.027 -5.957 -12.079 1.00 0.33 C ATOM 686 O ALA A 46 -10.345 -6.864 -11.310 1.00 0.34 O ATOM 687 CB ALA A 46 -9.289 -6.429 -14.419 1.00 0.46 C ATOM 0 H ALA A 46 -10.453 -4.293 -14.767 1.00 0.33 H new ATOM 0 HA ALA A 46 -11.259 -6.722 -13.640 1.00 0.37 H new ATOM 0 HB1 ALA A 46 -8.922 -7.399 -14.083 1.00 0.46 H new ATOM 0 HB2 ALA A 46 -9.622 -6.505 -15.454 1.00 0.46 H new ATOM 0 HB3 ALA A 46 -8.487 -5.694 -14.349 1.00 0.46 H new ATOM 693 N GLU A 47 -9.308 -4.902 -11.702 1.00 0.32 N ATOM 694 CA GLU A 47 -8.838 -4.748 -10.327 1.00 0.32 C ATOM 695 C GLU A 47 -9.996 -4.844 -9.342 1.00 0.28 C ATOM 696 O GLU A 47 -9.907 -5.544 -8.335 1.00 0.28 O ATOM 697 CB GLU A 47 -8.114 -3.411 -10.158 1.00 0.37 C ATOM 698 CG GLU A 47 -7.394 -3.275 -8.827 1.00 0.43 C ATOM 699 CD GLU A 47 -6.565 -2.009 -8.737 1.00 1.24 C ATOM 700 OE1 GLU A 47 -5.436 -2.001 -9.267 1.00 1.27 O ATOM 701 OE2 GLU A 47 -7.049 -1.025 -8.138 1.00 2.23 O ATOM 0 H GLU A 47 -9.039 -4.143 -12.328 1.00 0.32 H new ATOM 0 HA GLU A 47 -8.140 -5.558 -10.116 1.00 0.32 H new ATOM 0 HB2 GLU A 47 -7.392 -3.293 -10.966 1.00 0.37 H new ATOM 0 HB3 GLU A 47 -8.837 -2.601 -10.256 1.00 0.37 H new ATOM 0 HG2 GLU A 47 -8.127 -3.283 -8.020 1.00 0.43 H new ATOM 0 HG3 GLU A 47 -6.747 -4.139 -8.679 1.00 0.43 H new ATOM 708 N LEU A 48 -11.083 -4.141 -9.640 1.00 0.29 N ATOM 709 CA LEU A 48 -12.257 -4.158 -8.778 1.00 0.31 C ATOM 710 C LEU A 48 -12.822 -5.568 -8.660 1.00 0.30 C ATOM 711 O LEU A 48 -13.147 -6.025 -7.567 1.00 0.35 O ATOM 712 CB LEU A 48 -13.333 -3.209 -9.312 1.00 0.35 C ATOM 713 CG LEU A 48 -13.094 -1.724 -9.030 1.00 0.65 C ATOM 714 CD1 LEU A 48 -14.149 -0.874 -9.721 1.00 1.34 C ATOM 715 CD2 LEU A 48 -13.097 -1.459 -7.531 1.00 1.36 C ATOM 0 H LEU A 48 -11.175 -3.554 -10.469 1.00 0.29 H new ATOM 0 HA LEU A 48 -11.950 -3.821 -7.788 1.00 0.31 H new ATOM 0 HB2 LEU A 48 -13.415 -3.349 -10.390 1.00 0.35 H new ATOM 0 HB3 LEU A 48 -14.292 -3.494 -8.880 1.00 0.35 H new ATOM 0 HG LEU A 48 -12.116 -1.451 -9.427 1.00 0.65 H new ATOM 0 HD11 LEU A 48 -13.964 0.179 -9.510 1.00 1.34 H new ATOM 0 HD12 LEU A 48 -14.104 -1.042 -10.797 1.00 1.34 H new ATOM 0 HD13 LEU A 48 -15.137 -1.150 -9.352 1.00 1.34 H new ATOM 0 HD21 LEU A 48 -12.926 -0.398 -7.349 1.00 1.36 H new ATOM 0 HD22 LEU A 48 -14.061 -1.748 -7.112 1.00 1.36 H new ATOM 0 HD23 LEU A 48 -12.306 -2.041 -7.057 1.00 1.36 H new ATOM 727 N GLN A 49 -12.930 -6.259 -9.790 1.00 0.30 N ATOM 728 CA GLN A 49 -13.463 -7.616 -9.806 1.00 0.35 C ATOM 729 C GLN A 49 -12.556 -8.574 -9.035 1.00 0.35 C ATOM 730 O GLN A 49 -13.019 -9.581 -8.499 1.00 0.38 O ATOM 731 CB GLN A 49 -13.633 -8.104 -11.247 1.00 0.41 C ATOM 732 CG GLN A 49 -14.532 -7.213 -12.091 1.00 0.48 C ATOM 733 CD GLN A 49 -15.935 -7.096 -11.527 1.00 0.78 C ATOM 734 OE1 GLN A 49 -16.441 -8.022 -10.893 1.00 1.22 O ATOM 735 NE2 GLN A 49 -16.572 -5.954 -11.757 1.00 1.19 N ATOM 0 H GLN A 49 -12.656 -5.902 -10.705 1.00 0.30 H new ATOM 0 HA GLN A 49 -14.437 -7.599 -9.317 1.00 0.35 H new ATOM 0 HB2 GLN A 49 -12.652 -8.167 -11.718 1.00 0.41 H new ATOM 0 HB3 GLN A 49 -14.045 -9.113 -11.234 1.00 0.41 H new ATOM 0 HG2 GLN A 49 -14.089 -6.220 -12.162 1.00 0.48 H new ATOM 0 HG3 GLN A 49 -14.584 -7.612 -13.104 1.00 0.48 H new ATOM 0 HE21 GLN A 49 -16.114 -5.213 -12.288 1.00 1.19 H new ATOM 0 HE22 GLN A 49 -17.519 -5.818 -11.403 1.00 1.19 H new ATOM 744 N ASP A 50 -11.266 -8.253 -8.978 1.00 0.34 N ATOM 745 CA ASP A 50 -10.299 -9.093 -8.277 1.00 0.38 C ATOM 746 C ASP A 50 -10.424 -8.951 -6.762 1.00 0.35 C ATOM 747 O ASP A 50 -10.598 -9.941 -6.051 1.00 0.39 O ATOM 748 CB ASP A 50 -8.874 -8.746 -8.715 1.00 0.43 C ATOM 749 CG ASP A 50 -8.571 -9.215 -10.125 1.00 0.49 C ATOM 750 OD1 ASP A 50 -8.681 -10.431 -10.384 1.00 0.62 O ATOM 751 OD2 ASP A 50 -8.224 -8.364 -10.971 1.00 0.53 O ATOM 0 H ASP A 50 -10.867 -7.419 -9.408 1.00 0.34 H new ATOM 0 HA ASP A 50 -10.515 -10.129 -8.539 1.00 0.38 H new ATOM 0 HB2 ASP A 50 -8.731 -7.667 -8.656 1.00 0.43 H new ATOM 0 HB3 ASP A 50 -8.164 -9.200 -8.024 1.00 0.43 H new ATOM 756 N LEU A 51 -10.334 -7.718 -6.273 1.00 0.32 N ATOM 757 CA LEU A 51 -10.423 -7.454 -4.840 1.00 0.33 C ATOM 758 C LEU A 51 -11.820 -7.749 -4.297 1.00 0.32 C ATOM 759 O LEU A 51 -11.961 -8.310 -3.211 1.00 0.35 O ATOM 760 CB LEU A 51 -10.039 -6.005 -4.547 1.00 0.36 C ATOM 761 CG LEU A 51 -10.886 -4.956 -5.264 1.00 0.30 C ATOM 762 CD1 LEU A 51 -11.941 -4.390 -4.329 1.00 0.39 C ATOM 763 CD2 LEU A 51 -10.002 -3.849 -5.814 1.00 0.31 C ATOM 0 H LEU A 51 -10.200 -6.886 -6.847 1.00 0.32 H new ATOM 0 HA LEU A 51 -9.724 -8.121 -4.336 1.00 0.33 H new ATOM 0 HB2 LEU A 51 -10.111 -5.836 -3.473 1.00 0.36 H new ATOM 0 HB3 LEU A 51 -8.995 -5.858 -4.824 1.00 0.36 H new ATOM 0 HG LEU A 51 -11.397 -5.435 -6.100 1.00 0.30 H new ATOM 0 HD11 LEU A 51 -12.534 -3.644 -4.858 1.00 0.39 H new ATOM 0 HD12 LEU A 51 -12.592 -5.194 -3.985 1.00 0.39 H new ATOM 0 HD13 LEU A 51 -11.455 -3.925 -3.471 1.00 0.39 H new ATOM 0 HD21 LEU A 51 -10.620 -3.109 -6.322 1.00 0.31 H new ATOM 0 HD22 LEU A 51 -9.464 -3.372 -4.995 1.00 0.31 H new ATOM 0 HD23 LEU A 51 -9.287 -4.271 -6.520 1.00 0.31 H new ATOM 775 N ILE A 52 -12.849 -7.371 -5.052 1.00 0.31 N ATOM 776 CA ILE A 52 -14.227 -7.603 -4.628 1.00 0.34 C ATOM 777 C ILE A 52 -14.512 -9.095 -4.502 1.00 0.37 C ATOM 778 O ILE A 52 -15.102 -9.539 -3.520 1.00 0.41 O ATOM 779 CB ILE A 52 -15.246 -6.964 -5.599 1.00 0.38 C ATOM 780 CG1 ILE A 52 -15.167 -5.436 -5.517 1.00 0.42 C ATOM 781 CG2 ILE A 52 -16.658 -7.445 -5.286 1.00 0.50 C ATOM 782 CD1 ILE A 52 -16.056 -4.725 -6.515 1.00 0.50 C ATOM 0 H ILE A 52 -12.756 -6.906 -5.955 1.00 0.31 H new ATOM 0 HA ILE A 52 -14.341 -7.129 -3.653 1.00 0.34 H new ATOM 0 HB ILE A 52 -14.999 -7.271 -6.615 1.00 0.38 H new ATOM 0 HG12 ILE A 52 -15.441 -5.121 -4.510 1.00 0.42 H new ATOM 0 HG13 ILE A 52 -14.135 -5.125 -5.678 1.00 0.42 H new ATOM 0 HG21 ILE A 52 -17.361 -6.985 -5.980 1.00 0.50 H new ATOM 0 HG22 ILE A 52 -16.704 -8.529 -5.389 1.00 0.50 H new ATOM 0 HG23 ILE A 52 -16.920 -7.166 -4.265 1.00 0.50 H new ATOM 0 HD11 ILE A 52 -15.946 -3.647 -6.397 1.00 0.50 H new ATOM 0 HD12 ILE A 52 -15.768 -5.010 -7.527 1.00 0.50 H new ATOM 0 HD13 ILE A 52 -17.095 -5.005 -6.341 1.00 0.50 H new ATOM 794 N ALA A 53 -14.093 -9.866 -5.502 1.00 0.41 N ATOM 795 CA ALA A 53 -14.302 -11.307 -5.483 1.00 0.50 C ATOM 796 C ALA A 53 -13.463 -11.953 -4.391 1.00 0.49 C ATOM 797 O ALA A 53 -13.872 -12.942 -3.781 1.00 0.58 O ATOM 798 CB ALA A 53 -13.972 -11.915 -6.838 1.00 0.59 C ATOM 0 H ALA A 53 -13.610 -9.518 -6.330 1.00 0.41 H new ATOM 0 HA ALA A 53 -15.354 -11.498 -5.269 1.00 0.50 H new ATOM 0 HB1 ALA A 53 -14.135 -12.992 -6.803 1.00 0.59 H new ATOM 0 HB2 ALA A 53 -14.615 -11.476 -7.600 1.00 0.59 H new ATOM 0 HB3 ALA A 53 -12.929 -11.713 -7.083 1.00 0.59 H new ATOM 804 N GLU A 54 -12.286 -11.386 -4.149 1.00 0.45 N ATOM 805 CA GLU A 54 -11.393 -11.896 -3.120 1.00 0.51 C ATOM 806 C GLU A 54 -12.044 -11.760 -1.752 1.00 0.50 C ATOM 807 O GLU A 54 -12.001 -12.681 -0.935 1.00 0.59 O ATOM 808 CB GLU A 54 -10.063 -11.142 -3.149 1.00 0.57 C ATOM 809 CG GLU A 54 -9.056 -11.641 -2.126 1.00 1.07 C ATOM 810 CD GLU A 54 -7.740 -10.891 -2.191 1.00 1.77 C ATOM 811 OE1 GLU A 54 -7.614 -9.853 -1.508 1.00 2.54 O ATOM 812 OE2 GLU A 54 -6.835 -11.343 -2.924 1.00 1.99 O ATOM 0 H GLU A 54 -11.930 -10.573 -4.652 1.00 0.45 H new ATOM 0 HA GLU A 54 -11.199 -12.951 -3.316 1.00 0.51 H new ATOM 0 HB2 GLU A 54 -9.629 -11.227 -4.145 1.00 0.57 H new ATOM 0 HB3 GLU A 54 -10.252 -10.083 -2.973 1.00 0.57 H new ATOM 0 HG2 GLU A 54 -9.479 -11.540 -1.126 1.00 1.07 H new ATOM 0 HG3 GLU A 54 -8.873 -12.703 -2.289 1.00 1.07 H new ATOM 819 N ALA A 55 -12.648 -10.602 -1.509 1.00 0.43 N ATOM 820 CA ALA A 55 -13.325 -10.343 -0.247 1.00 0.47 C ATOM 821 C ALA A 55 -14.707 -10.989 -0.229 1.00 0.46 C ATOM 822 O ALA A 55 -15.311 -11.158 0.830 1.00 0.53 O ATOM 823 CB ALA A 55 -13.436 -8.845 -0.008 1.00 0.50 C ATOM 0 H ALA A 55 -12.682 -9.827 -2.172 1.00 0.43 H new ATOM 0 HA ALA A 55 -12.734 -10.784 0.556 1.00 0.47 H new ATOM 0 HB1 ALA A 55 -13.944 -8.664 0.939 1.00 0.50 H new ATOM 0 HB2 ALA A 55 -12.438 -8.407 0.026 1.00 0.50 H new ATOM 0 HB3 ALA A 55 -14.005 -8.389 -0.818 1.00 0.50 H new ATOM 829 N GLU A 56 -15.201 -11.350 -1.412 1.00 0.41 N ATOM 830 CA GLU A 56 -16.514 -11.977 -1.535 1.00 0.44 C ATOM 831 C GLU A 56 -16.479 -13.421 -1.046 1.00 0.49 C ATOM 832 O GLU A 56 -17.384 -13.872 -0.344 1.00 0.63 O ATOM 833 CB GLU A 56 -16.988 -11.930 -2.990 1.00 0.47 C ATOM 834 CG GLU A 56 -18.362 -12.545 -3.205 1.00 0.52 C ATOM 835 CD GLU A 56 -18.788 -12.528 -4.660 1.00 1.26 C ATOM 836 OE1 GLU A 56 -18.465 -13.491 -5.386 1.00 1.95 O ATOM 837 OE2 GLU A 56 -19.444 -11.548 -5.074 1.00 1.66 O ATOM 0 H GLU A 56 -14.712 -11.219 -2.297 1.00 0.41 H new ATOM 0 HA GLU A 56 -17.214 -11.421 -0.912 1.00 0.44 H new ATOM 0 HB2 GLU A 56 -17.008 -10.892 -3.323 1.00 0.47 H new ATOM 0 HB3 GLU A 56 -16.264 -12.452 -3.616 1.00 0.47 H new ATOM 0 HG2 GLU A 56 -18.356 -13.574 -2.844 1.00 0.52 H new ATOM 0 HG3 GLU A 56 -19.096 -12.002 -2.609 1.00 0.52 H new ATOM 844 N ASN A 57 -15.427 -14.142 -1.423 1.00 0.53 N ATOM 845 CA ASN A 57 -15.273 -15.538 -1.027 1.00 0.68 C ATOM 846 C ASN A 57 -14.258 -15.680 0.105 1.00 0.79 C ATOM 847 O ASN A 57 -13.366 -16.528 0.049 1.00 1.19 O ATOM 848 CB ASN A 57 -14.843 -16.384 -2.227 1.00 0.87 C ATOM 849 CG ASN A 57 -15.861 -16.359 -3.350 1.00 1.67 C ATOM 850 OD1 ASN A 57 -17.062 -16.228 -3.113 1.00 2.38 O ATOM 851 ND2 ASN A 57 -15.384 -16.482 -4.584 1.00 2.48 N ATOM 0 H ASN A 57 -14.668 -13.782 -2.002 1.00 0.53 H new ATOM 0 HA ASN A 57 -16.238 -15.895 -0.666 1.00 0.68 H new ATOM 0 HB2 ASN A 57 -13.886 -16.019 -2.600 1.00 0.87 H new ATOM 0 HB3 ASN A 57 -14.688 -17.414 -1.905 1.00 0.87 H new ATOM 0 HD21 ASN A 57 -16.021 -16.470 -5.381 1.00 2.48 H new ATOM 0 HD22 ASN A 57 -14.381 -16.588 -4.735 1.00 2.48 H new ATOM 858 N ASN A 58 -14.401 -14.846 1.129 1.00 0.84 N ATOM 859 CA ASN A 58 -13.500 -14.878 2.277 1.00 1.03 C ATOM 860 C ASN A 58 -14.055 -14.047 3.428 1.00 1.09 C ATOM 861 O ASN A 58 -14.215 -14.541 4.544 1.00 1.84 O ATOM 862 CB ASN A 58 -12.113 -14.364 1.883 1.00 1.12 C ATOM 863 CG ASN A 58 -11.146 -14.360 3.050 1.00 1.81 C ATOM 864 OD1 ASN A 58 -11.044 -13.377 3.782 1.00 2.48 O ATOM 865 ND2 ASN A 58 -10.428 -15.464 3.229 1.00 2.14 N ATOM 0 H ASN A 58 -15.133 -14.138 1.188 1.00 0.84 H new ATOM 0 HA ASN A 58 -13.414 -15.913 2.608 1.00 1.03 H new ATOM 0 HB2 ASN A 58 -11.711 -14.987 1.084 1.00 1.12 H new ATOM 0 HB3 ASN A 58 -12.202 -13.353 1.485 1.00 1.12 H new ATOM 0 HD21 ASN A 58 -9.760 -15.519 3.998 1.00 2.14 H new ATOM 0 HD22 ASN A 58 -10.545 -16.256 2.597 1.00 2.14 H new ATOM 872 N ASN A 59 -14.347 -12.779 3.149 1.00 1.04 N ATOM 873 CA ASN A 59 -14.888 -11.879 4.162 1.00 1.01 C ATOM 874 C ASN A 59 -16.405 -11.792 4.052 1.00 0.88 C ATOM 875 O ASN A 59 -17.010 -10.803 4.464 1.00 0.91 O ATOM 876 CB ASN A 59 -14.271 -10.485 4.021 1.00 1.08 C ATOM 877 CG ASN A 59 -12.773 -10.490 4.258 1.00 1.31 C ATOM 878 OD1 ASN A 59 -12.310 -10.309 5.383 1.00 2.05 O ATOM 879 ND2 ASN A 59 -12.007 -10.699 3.193 1.00 1.51 N ATOM 0 H ASN A 59 -14.218 -12.353 2.231 1.00 1.04 H new ATOM 0 HA ASN A 59 -14.634 -12.280 5.143 1.00 1.01 H new ATOM 0 HB2 ASN A 59 -14.477 -10.099 3.023 1.00 1.08 H new ATOM 0 HB3 ASN A 59 -14.746 -9.807 4.730 1.00 1.08 H new ATOM 0 HD21 ASN A 59 -10.992 -10.714 3.290 1.00 1.51 H new ATOM 0 HD22 ASN A 59 -12.434 -10.845 2.278 1.00 1.51 H new ATOM 886 N ASN A 60 -17.009 -12.840 3.492 1.00 0.80 N ATOM 887 CA ASN A 60 -18.459 -12.904 3.319 1.00 0.76 C ATOM 888 C ASN A 60 -18.949 -11.828 2.351 1.00 0.74 C ATOM 889 O ASN A 60 -19.198 -12.104 1.178 1.00 1.42 O ATOM 890 CB ASN A 60 -19.171 -12.766 4.668 1.00 0.86 C ATOM 891 CG ASN A 60 -18.642 -13.738 5.707 1.00 0.95 C ATOM 892 OD1 ASN A 60 -18.673 -13.458 6.905 1.00 1.47 O ATOM 893 ND2 ASN A 60 -18.151 -14.885 5.254 1.00 1.19 N ATOM 0 H ASN A 60 -16.512 -13.662 3.148 1.00 0.80 H new ATOM 0 HA ASN A 60 -18.699 -13.879 2.894 1.00 0.76 H new ATOM 0 HB2 ASN A 60 -19.052 -11.747 5.035 1.00 0.86 H new ATOM 0 HB3 ASN A 60 -20.239 -12.933 4.530 1.00 0.86 H new ATOM 0 HD21 ASN A 60 -17.780 -15.575 5.908 1.00 1.19 H new ATOM 0 HD22 ASN A 60 -18.145 -15.077 4.252 1.00 1.19 H new ATOM 900 N GLY A 61 -19.085 -10.603 2.851 1.00 0.43 N ATOM 901 CA GLY A 61 -19.543 -9.506 2.017 1.00 0.40 C ATOM 902 C GLY A 61 -19.308 -8.154 2.660 1.00 0.32 C ATOM 903 O GLY A 61 -19.925 -7.159 2.278 1.00 0.38 O ATOM 0 H GLY A 61 -18.886 -10.351 3.819 1.00 0.43 H new ATOM 0 HA2 GLY A 61 -19.028 -9.543 1.057 1.00 0.40 H new ATOM 0 HA3 GLY A 61 -20.607 -9.628 1.813 1.00 0.40 H new ATOM 907 N GLN A 62 -18.410 -8.117 3.641 1.00 0.36 N ATOM 908 CA GLN A 62 -18.092 -6.883 4.345 1.00 0.29 C ATOM 909 C GLN A 62 -16.585 -6.629 4.371 1.00 0.31 C ATOM 910 O GLN A 62 -15.784 -7.558 4.262 1.00 0.38 O ATOM 911 CB GLN A 62 -18.640 -6.931 5.772 1.00 0.27 C ATOM 912 CG GLN A 62 -20.089 -6.489 5.894 1.00 0.27 C ATOM 913 CD GLN A 62 -20.219 -4.989 6.047 1.00 0.23 C ATOM 914 OE1 GLN A 62 -21.143 -4.490 6.693 1.00 0.25 O ATOM 915 NE2 GLN A 62 -19.289 -4.262 5.450 1.00 0.21 N ATOM 0 H GLN A 62 -17.889 -8.932 3.966 1.00 0.36 H new ATOM 0 HA GLN A 62 -18.564 -6.061 3.807 1.00 0.29 H new ATOM 0 HB2 GLN A 62 -18.548 -7.949 6.151 1.00 0.27 H new ATOM 0 HB3 GLN A 62 -18.023 -6.297 6.409 1.00 0.27 H new ATOM 0 HG2 GLN A 62 -20.641 -6.811 5.011 1.00 0.27 H new ATOM 0 HG3 GLN A 62 -20.546 -6.981 6.753 1.00 0.27 H new ATOM 0 HE21 GLN A 62 -18.543 -4.719 4.926 1.00 0.21 H new ATOM 0 HE22 GLN A 62 -19.318 -3.244 5.514 1.00 0.21 H new ATOM 924 N LEU A 63 -16.213 -5.358 4.513 1.00 0.30 N ATOM 925 CA LEU A 63 -14.809 -4.954 4.548 1.00 0.36 C ATOM 926 C LEU A 63 -14.516 -4.136 5.796 1.00 0.31 C ATOM 927 O LEU A 63 -15.399 -3.482 6.331 1.00 0.27 O ATOM 928 CB LEU A 63 -14.465 -4.116 3.319 1.00 0.45 C ATOM 929 CG LEU A 63 -15.011 -4.640 1.997 1.00 0.79 C ATOM 930 CD1 LEU A 63 -14.816 -3.602 0.902 1.00 1.41 C ATOM 931 CD2 LEU A 63 -14.336 -5.953 1.633 1.00 1.43 C ATOM 0 H LEU A 63 -16.871 -4.584 4.606 1.00 0.30 H new ATOM 0 HA LEU A 63 -14.202 -5.860 4.557 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -14.842 -3.105 3.473 1.00 0.45 H new ATOM 0 HB3 LEU A 63 -13.380 -4.044 3.242 1.00 0.45 H new ATOM 0 HG LEU A 63 -16.080 -4.827 2.102 1.00 0.79 H new ATOM 0 HD11 LEU A 63 -15.210 -3.987 -0.039 1.00 1.41 H new ATOM 0 HD12 LEU A 63 -15.345 -2.687 1.169 1.00 1.41 H new ATOM 0 HD13 LEU A 63 -13.753 -3.387 0.790 1.00 1.41 H new ATOM 0 HD21 LEU A 63 -14.735 -6.317 0.686 1.00 1.43 H new ATOM 0 HD22 LEU A 63 -13.262 -5.796 1.537 1.00 1.43 H new ATOM 0 HD23 LEU A 63 -14.527 -6.689 2.414 1.00 1.43 H new ATOM 943 N ASN A 64 -13.261 -4.129 6.221 1.00 0.33 N ATOM 944 CA ASN A 64 -12.864 -3.388 7.410 1.00 0.31 C ATOM 945 C ASN A 64 -11.974 -2.211 7.034 1.00 0.31 C ATOM 946 O ASN A 64 -11.347 -2.218 5.976 1.00 0.33 O ATOM 947 CB ASN A 64 -12.113 -4.292 8.388 1.00 0.34 C ATOM 948 CG ASN A 64 -12.866 -5.564 8.723 1.00 0.53 C ATOM 949 OD1 ASN A 64 -13.742 -6.002 7.977 1.00 1.19 O ATOM 950 ND2 ASN A 64 -12.512 -6.175 9.847 1.00 0.99 N ATOM 0 H ASN A 64 -12.500 -4.628 5.760 1.00 0.33 H new ATOM 0 HA ASN A 64 -13.771 -3.018 7.889 1.00 0.31 H new ATOM 0 HB2 ASN A 64 -11.144 -4.552 7.962 1.00 0.34 H new ATOM 0 HB3 ASN A 64 -11.918 -3.740 9.307 1.00 0.34 H new ATOM 0 HD21 ASN A 64 -12.971 -7.043 10.122 1.00 0.99 H new ATOM 0 HD22 ASN A 64 -11.781 -5.776 10.436 1.00 0.99 H new ATOM 957 N PHE A 65 -11.933 -1.201 7.897 1.00 0.30 N ATOM 958 CA PHE A 65 -11.126 -0.009 7.649 1.00 0.30 C ATOM 959 C PHE A 65 -9.741 -0.374 7.121 1.00 0.29 C ATOM 960 O PHE A 65 -9.215 0.290 6.230 1.00 0.31 O ATOM 961 CB PHE A 65 -10.993 0.823 8.926 1.00 0.32 C ATOM 962 CG PHE A 65 -10.187 2.079 8.743 1.00 0.33 C ATOM 963 CD1 PHE A 65 -10.740 3.189 8.124 1.00 0.37 C ATOM 964 CD2 PHE A 65 -8.878 2.151 9.195 1.00 0.35 C ATOM 965 CE1 PHE A 65 -10.003 4.346 7.958 1.00 0.40 C ATOM 966 CE2 PHE A 65 -8.137 3.305 9.031 1.00 0.38 C ATOM 967 CZ PHE A 65 -8.696 4.400 8.397 1.00 0.39 C ATOM 0 H PHE A 65 -12.450 -1.183 8.776 1.00 0.30 H new ATOM 0 HA PHE A 65 -11.636 0.582 6.888 1.00 0.30 H new ATOM 0 HB2 PHE A 65 -11.988 1.088 9.282 1.00 0.32 H new ATOM 0 HB3 PHE A 65 -10.529 0.213 9.701 1.00 0.32 H new ATOM 0 HD1 PHE A 65 -11.759 3.149 7.767 1.00 0.37 H new ATOM 0 HD2 PHE A 65 -8.433 1.295 9.681 1.00 0.35 H new ATOM 0 HE1 PHE A 65 -10.450 5.208 7.485 1.00 0.40 H new ATOM 0 HE2 PHE A 65 -7.122 3.352 9.397 1.00 0.38 H new ATOM 0 HZ PHE A 65 -8.111 5.295 8.246 1.00 0.39 H new ATOM 977 N THR A 66 -9.158 -1.436 7.668 1.00 0.31 N ATOM 978 CA THR A 66 -7.833 -1.880 7.247 1.00 0.32 C ATOM 979 C THR A 66 -7.859 -2.478 5.848 1.00 0.31 C ATOM 980 O THR A 66 -6.934 -2.278 5.065 1.00 0.30 O ATOM 981 CB THR A 66 -7.246 -2.919 8.214 1.00 0.40 C ATOM 982 OG1 THR A 66 -8.300 -3.626 8.877 1.00 0.56 O ATOM 983 CG2 THR A 66 -6.344 -2.253 9.238 1.00 0.81 C ATOM 0 H THR A 66 -9.581 -2.004 8.402 1.00 0.31 H new ATOM 0 HA THR A 66 -7.202 -0.991 7.249 1.00 0.32 H new ATOM 0 HB THR A 66 -6.650 -3.626 7.637 1.00 0.40 H new ATOM 0 HG1 THR A 66 -7.915 -4.287 9.490 1.00 0.56 H new ATOM 0 HG21 THR A 66 -5.940 -3.008 9.912 1.00 0.81 H new ATOM 0 HG22 THR A 66 -5.525 -1.747 8.727 1.00 0.81 H new ATOM 0 HG23 THR A 66 -6.919 -1.526 9.811 1.00 0.81 H new ATOM 991 N GLU A 67 -8.910 -3.230 5.542 1.00 0.34 N ATOM 992 CA GLU A 67 -9.040 -3.842 4.227 1.00 0.37 C ATOM 993 C GLU A 67 -9.114 -2.760 3.164 1.00 0.32 C ATOM 994 O GLU A 67 -8.346 -2.753 2.199 1.00 0.35 O ATOM 995 CB GLU A 67 -10.293 -4.718 4.169 1.00 0.42 C ATOM 996 CG GLU A 67 -10.428 -5.644 5.363 1.00 0.49 C ATOM 997 CD GLU A 67 -11.350 -6.818 5.096 1.00 0.88 C ATOM 998 OE1 GLU A 67 -10.916 -7.769 4.412 1.00 1.21 O ATOM 999 OE2 GLU A 67 -12.502 -6.788 5.574 1.00 1.36 O ATOM 0 H GLU A 67 -9.679 -3.429 6.182 1.00 0.34 H new ATOM 0 HA GLU A 67 -8.168 -4.469 4.042 1.00 0.37 H new ATOM 0 HB2 GLU A 67 -11.174 -4.078 4.112 1.00 0.42 H new ATOM 0 HB3 GLU A 67 -10.271 -5.313 3.256 1.00 0.42 H new ATOM 0 HG2 GLU A 67 -9.442 -6.018 5.640 1.00 0.49 H new ATOM 0 HG3 GLU A 67 -10.805 -5.078 6.215 1.00 0.49 H new ATOM 1006 N PHE A 68 -10.049 -1.844 3.364 1.00 0.29 N ATOM 1007 CA PHE A 68 -10.248 -0.728 2.451 1.00 0.27 C ATOM 1008 C PHE A 68 -8.981 0.115 2.354 1.00 0.26 C ATOM 1009 O PHE A 68 -8.458 0.339 1.265 1.00 0.32 O ATOM 1010 CB PHE A 68 -11.422 0.126 2.931 1.00 0.26 C ATOM 1011 CG PHE A 68 -11.737 1.297 2.044 1.00 0.30 C ATOM 1012 CD1 PHE A 68 -11.951 1.125 0.685 1.00 0.38 C ATOM 1013 CD2 PHE A 68 -11.829 2.573 2.576 1.00 0.35 C ATOM 1014 CE1 PHE A 68 -12.251 2.204 -0.125 1.00 0.48 C ATOM 1015 CE2 PHE A 68 -12.127 3.655 1.771 1.00 0.45 C ATOM 1016 CZ PHE A 68 -12.339 3.470 0.419 1.00 0.51 C ATOM 0 H PHE A 68 -10.688 -1.852 4.159 1.00 0.29 H new ATOM 0 HA PHE A 68 -10.474 -1.118 1.458 1.00 0.27 H new ATOM 0 HB2 PHE A 68 -12.307 -0.505 3.009 1.00 0.26 H new ATOM 0 HB3 PHE A 68 -11.203 0.493 3.934 1.00 0.26 H new ATOM 0 HD1 PHE A 68 -11.883 0.137 0.255 1.00 0.38 H new ATOM 0 HD2 PHE A 68 -11.666 2.723 3.633 1.00 0.35 H new ATOM 0 HE1 PHE A 68 -12.416 2.057 -1.182 1.00 0.48 H new ATOM 0 HE2 PHE A 68 -12.194 4.645 2.198 1.00 0.45 H new ATOM 0 HZ PHE A 68 -12.573 4.315 -0.212 1.00 0.51 H new ATOM 1026 N CYS A 69 -8.491 0.574 3.505 1.00 0.23 N ATOM 1027 CA CYS A 69 -7.276 1.386 3.560 1.00 0.23 C ATOM 1028 C CYS A 69 -6.151 0.710 2.797 1.00 0.27 C ATOM 1029 O CYS A 69 -5.533 1.309 1.921 1.00 0.31 O ATOM 1030 CB CYS A 69 -6.841 1.590 5.010 1.00 0.23 C ATOM 1031 SG CYS A 69 -5.259 2.438 5.203 1.00 0.75 S ATOM 0 H CYS A 69 -8.918 0.397 4.414 1.00 0.23 H new ATOM 0 HA CYS A 69 -7.493 2.352 3.104 1.00 0.23 H new ATOM 0 HB2 CYS A 69 -7.611 2.160 5.530 1.00 0.23 H new ATOM 0 HB3 CYS A 69 -6.780 0.617 5.498 1.00 0.23 H new ATOM 0 HG CYS A 69 -4.984 2.562 6.468 1.00 0.75 H new ATOM 1037 N GLY A 70 -5.890 -0.540 3.161 1.00 0.30 N ATOM 1038 CA GLY A 70 -4.845 -1.312 2.514 1.00 0.35 C ATOM 1039 C GLY A 70 -4.829 -1.119 1.009 1.00 0.37 C ATOM 1040 O GLY A 70 -3.803 -0.749 0.430 1.00 0.41 O ATOM 0 H GLY A 70 -6.388 -1.037 3.900 1.00 0.30 H new ATOM 0 HA2 GLY A 70 -3.877 -1.024 2.925 1.00 0.35 H new ATOM 0 HA3 GLY A 70 -4.985 -2.369 2.740 1.00 0.35 H new ATOM 1044 N ILE A 71 -5.973 -1.359 0.373 1.00 0.37 N ATOM 1045 CA ILE A 71 -6.080 -1.201 -1.071 1.00 0.41 C ATOM 1046 C ILE A 71 -5.887 0.250 -1.474 1.00 0.40 C ATOM 1047 O ILE A 71 -5.124 0.558 -2.387 1.00 0.44 O ATOM 1048 CB ILE A 71 -7.434 -1.686 -1.605 1.00 0.42 C ATOM 1049 CG1 ILE A 71 -7.586 -3.182 -1.349 1.00 0.47 C ATOM 1050 CG2 ILE A 71 -7.541 -1.376 -3.091 1.00 0.46 C ATOM 1051 CD1 ILE A 71 -9.014 -3.606 -1.078 1.00 0.51 C ATOM 0 H ILE A 71 -6.832 -1.661 0.833 1.00 0.37 H new ATOM 0 HA ILE A 71 -5.292 -1.815 -1.508 1.00 0.41 H new ATOM 0 HB ILE A 71 -8.238 -1.166 -1.085 1.00 0.42 H new ATOM 0 HG12 ILE A 71 -7.210 -3.730 -2.213 1.00 0.47 H new ATOM 0 HG13 ILE A 71 -6.964 -3.462 -0.498 1.00 0.47 H new ATOM 0 HG21 ILE A 71 -8.504 -1.722 -3.466 1.00 0.46 H new ATOM 0 HG22 ILE A 71 -7.457 -0.300 -3.245 1.00 0.46 H new ATOM 0 HG23 ILE A 71 -6.739 -1.883 -3.627 1.00 0.46 H new ATOM 0 HD11 ILE A 71 -9.048 -4.682 -0.905 1.00 0.51 H new ATOM 0 HD12 ILE A 71 -9.387 -3.085 -0.197 1.00 0.51 H new ATOM 0 HD13 ILE A 71 -9.637 -3.357 -1.937 1.00 0.51 H new ATOM 1063 N MET A 72 -6.596 1.135 -0.796 1.00 0.38 N ATOM 1064 CA MET A 72 -6.494 2.562 -1.071 1.00 0.41 C ATOM 1065 C MET A 72 -5.039 2.973 -1.147 1.00 0.45 C ATOM 1066 O MET A 72 -4.662 3.824 -1.938 1.00 0.52 O ATOM 1067 CB MET A 72 -7.185 3.371 0.017 1.00 0.39 C ATOM 1068 CG MET A 72 -8.675 3.128 0.097 1.00 0.41 C ATOM 1069 SD MET A 72 -9.579 3.905 -1.256 1.00 1.01 S ATOM 1070 CE MET A 72 -9.245 5.636 -0.944 1.00 0.58 C ATOM 0 H MET A 72 -7.249 0.893 -0.051 1.00 0.38 H new ATOM 0 HA MET A 72 -6.983 2.759 -2.025 1.00 0.41 H new ATOM 0 HB2 MET A 72 -6.734 3.130 0.979 1.00 0.39 H new ATOM 0 HB3 MET A 72 -7.007 4.431 -0.162 1.00 0.39 H new ATOM 0 HG2 MET A 72 -8.865 2.055 0.087 1.00 0.41 H new ATOM 0 HG3 MET A 72 -9.051 3.509 1.046 1.00 0.41 H new ATOM 0 HE1 MET A 72 -10.067 6.240 -1.327 1.00 0.58 H new ATOM 0 HE2 MET A 72 -9.144 5.799 0.129 1.00 0.58 H new ATOM 0 HE3 MET A 72 -8.320 5.924 -1.443 1.00 0.58 H new ATOM 1080 N ALA A 73 -4.232 2.361 -0.299 1.00 0.46 N ATOM 1081 CA ALA A 73 -2.808 2.645 -0.267 1.00 0.53 C ATOM 1082 C ALA A 73 -2.142 2.247 -1.581 1.00 0.59 C ATOM 1083 O ALA A 73 -1.507 3.074 -2.238 1.00 0.70 O ATOM 1084 CB ALA A 73 -2.155 1.924 0.903 1.00 0.54 C ATOM 0 H ALA A 73 -4.539 1.663 0.378 1.00 0.46 H new ATOM 0 HA ALA A 73 -2.675 3.719 -0.135 1.00 0.53 H new ATOM 0 HB1 ALA A 73 -1.088 2.145 0.916 1.00 0.54 H new ATOM 0 HB2 ALA A 73 -2.607 2.261 1.836 1.00 0.54 H new ATOM 0 HB3 ALA A 73 -2.302 0.849 0.796 1.00 0.54 H new ATOM 1090 N LYS A 74 -2.311 0.982 -1.975 1.00 0.55 N ATOM 1091 CA LYS A 74 -1.706 0.479 -3.209 1.00 0.62 C ATOM 1092 C LYS A 74 -2.191 1.246 -4.439 1.00 0.63 C ATOM 1093 O LYS A 74 -1.440 1.428 -5.397 1.00 0.70 O ATOM 1094 CB LYS A 74 -1.973 -1.023 -3.381 1.00 0.63 C ATOM 1095 CG LYS A 74 -3.420 -1.383 -3.671 1.00 0.65 C ATOM 1096 CD LYS A 74 -3.553 -2.856 -4.029 1.00 0.74 C ATOM 1097 CE LYS A 74 -4.968 -3.207 -4.458 1.00 0.73 C ATOM 1098 NZ LYS A 74 -5.075 -4.617 -4.925 1.00 1.38 N ATOM 0 H LYS A 74 -2.858 0.292 -1.460 1.00 0.55 H new ATOM 0 HA LYS A 74 -0.631 0.637 -3.122 1.00 0.62 H new ATOM 0 HB2 LYS A 74 -1.350 -1.398 -4.193 1.00 0.63 H new ATOM 0 HB3 LYS A 74 -1.659 -1.540 -2.474 1.00 0.63 H new ATOM 0 HG2 LYS A 74 -4.036 -1.160 -2.800 1.00 0.65 H new ATOM 0 HG3 LYS A 74 -3.794 -0.770 -4.491 1.00 0.65 H new ATOM 0 HD2 LYS A 74 -2.859 -3.099 -4.833 1.00 0.74 H new ATOM 0 HD3 LYS A 74 -3.272 -3.466 -3.170 1.00 0.74 H new ATOM 0 HE2 LYS A 74 -5.650 -3.049 -3.623 1.00 0.73 H new ATOM 0 HE3 LYS A 74 -5.282 -2.535 -5.257 1.00 0.73 H new ATOM 0 HZ1 LYS A 74 -6.056 -4.815 -5.208 1.00 1.38 H new ATOM 0 HZ2 LYS A 74 -4.444 -4.762 -5.739 1.00 1.38 H new ATOM 0 HZ3 LYS A 74 -4.800 -5.260 -4.155 1.00 1.38 H new ATOM 1112 N GLN A 75 -3.443 1.695 -4.414 1.00 0.59 N ATOM 1113 CA GLN A 75 -4.008 2.438 -5.539 1.00 0.63 C ATOM 1114 C GLN A 75 -3.550 3.894 -5.543 1.00 0.67 C ATOM 1115 O GLN A 75 -3.056 4.394 -6.554 1.00 0.79 O ATOM 1116 CB GLN A 75 -5.529 2.382 -5.513 1.00 0.63 C ATOM 1117 CG GLN A 75 -6.100 1.000 -5.783 1.00 1.04 C ATOM 1118 CD GLN A 75 -7.590 1.037 -6.062 1.00 1.23 C ATOM 1119 OE1 GLN A 75 -8.121 2.046 -6.527 1.00 1.98 O ATOM 1120 NE2 GLN A 75 -8.271 -0.069 -5.792 1.00 1.54 N ATOM 0 H GLN A 75 -4.084 1.559 -3.632 1.00 0.59 H new ATOM 0 HA GLN A 75 -3.645 1.963 -6.450 1.00 0.63 H new ATOM 0 HB2 GLN A 75 -5.879 2.725 -4.539 1.00 0.63 H new ATOM 0 HB3 GLN A 75 -5.921 3.077 -6.255 1.00 0.63 H new ATOM 0 HG2 GLN A 75 -5.584 0.556 -6.635 1.00 1.04 H new ATOM 0 HG3 GLN A 75 -5.909 0.356 -4.924 1.00 1.04 H new ATOM 0 HE21 GLN A 75 -7.791 -0.882 -5.407 1.00 1.54 H new ATOM 0 HE22 GLN A 75 -9.275 -0.106 -5.969 1.00 1.54 H new ATOM 1129 N MET A 76 -3.720 4.569 -4.410 1.00 0.65 N ATOM 1130 CA MET A 76 -3.341 5.962 -4.278 1.00 0.73 C ATOM 1131 C MET A 76 -1.866 6.179 -4.608 1.00 0.89 C ATOM 1132 O MET A 76 -1.450 7.306 -4.881 1.00 1.06 O ATOM 1133 CB MET A 76 -3.645 6.441 -2.864 1.00 0.76 C ATOM 1134 CG MET A 76 -5.132 6.612 -2.590 1.00 0.80 C ATOM 1135 SD MET A 76 -5.603 8.331 -2.321 1.00 1.20 S ATOM 1136 CE MET A 76 -4.888 8.627 -0.705 1.00 0.75 C ATOM 0 H MET A 76 -4.123 4.164 -3.565 1.00 0.65 H new ATOM 0 HA MET A 76 -3.923 6.543 -4.993 1.00 0.73 H new ATOM 0 HB2 MET A 76 -3.231 5.729 -2.150 1.00 0.76 H new ATOM 0 HB3 MET A 76 -3.140 7.392 -2.694 1.00 0.76 H new ATOM 0 HG2 MET A 76 -5.699 6.212 -3.431 1.00 0.80 H new ATOM 0 HG3 MET A 76 -5.405 6.024 -1.713 1.00 0.80 H new ATOM 0 HE1 MET A 76 -4.937 9.691 -0.475 1.00 0.75 H new ATOM 0 HE2 MET A 76 -5.444 8.067 0.047 1.00 0.75 H new ATOM 0 HE3 MET A 76 -3.847 8.303 -0.703 1.00 0.75 H new ATOM 1211 N THR A 81 5.390 11.578 -9.518 1.00 5.18 N ATOM 1212 CA THR A 81 5.991 11.555 -10.843 1.00 6.15 C ATOM 1213 C THR A 81 7.364 12.221 -10.824 1.00 6.80 C ATOM 1214 O THR A 81 7.514 13.367 -11.245 1.00 7.13 O ATOM 1215 CB THR A 81 5.098 12.260 -11.872 1.00 6.60 C ATOM 1216 OG1 THR A 81 3.746 11.799 -11.748 1.00 7.29 O ATOM 1217 CG2 THR A 81 5.603 11.987 -13.273 1.00 6.89 C ATOM 0 HA THR A 81 6.100 10.510 -11.132 1.00 6.15 H new ATOM 0 HB THR A 81 5.128 13.333 -11.684 1.00 6.60 H new ATOM 0 HG1 THR A 81 3.562 11.574 -10.812 1.00 7.29 H new ATOM 0 HG21 THR A 81 4.962 12.492 -13.996 1.00 6.89 H new ATOM 0 HG22 THR A 81 6.623 12.358 -13.371 1.00 6.89 H new ATOM 0 HG23 THR A 81 5.588 10.914 -13.462 1.00 6.89 H new ATOM 1225 N GLU A 82 8.361 11.464 -10.359 1.00 7.25 N ATOM 1226 CA GLU A 82 9.744 11.939 -10.236 1.00 8.05 C ATOM 1227 C GLU A 82 10.181 12.815 -11.411 1.00 8.92 C ATOM 1228 O GLU A 82 10.731 13.898 -11.209 1.00 9.53 O ATOM 1229 CB GLU A 82 10.700 10.751 -10.102 1.00 8.64 C ATOM 1230 CG GLU A 82 10.594 10.024 -8.770 1.00 8.69 C ATOM 1231 CD GLU A 82 9.272 9.304 -8.598 1.00 9.34 C ATOM 1232 OE1 GLU A 82 9.161 8.148 -9.060 1.00 9.63 O ATOM 1233 OE2 GLU A 82 8.346 9.895 -8.003 1.00 9.74 O ATOM 0 H GLU A 82 8.232 10.499 -10.055 1.00 7.25 H new ATOM 0 HA GLU A 82 9.782 12.557 -9.339 1.00 8.05 H new ATOM 0 HB2 GLU A 82 10.501 10.044 -10.908 1.00 8.64 H new ATOM 0 HB3 GLU A 82 11.723 11.104 -10.232 1.00 8.64 H new ATOM 0 HG2 GLU A 82 11.408 9.304 -8.689 1.00 8.69 H new ATOM 0 HG3 GLU A 82 10.720 10.741 -7.959 1.00 8.69 H new ATOM 1240 N GLU A 83 9.949 12.344 -12.631 1.00 9.15 N ATOM 1241 CA GLU A 83 10.337 13.095 -13.822 1.00 10.17 C ATOM 1242 C GLU A 83 9.709 14.487 -13.826 1.00 10.27 C ATOM 1243 O GLU A 83 10.373 15.480 -14.135 1.00 11.05 O ATOM 1244 CB GLU A 83 9.930 12.332 -15.084 1.00 10.55 C ATOM 1245 CG GLU A 83 10.540 10.942 -15.174 1.00 10.83 C ATOM 1246 CD GLU A 83 10.130 10.205 -16.433 1.00 11.60 C ATOM 1247 OE1 GLU A 83 9.099 9.502 -16.399 1.00 11.85 O ATOM 1248 OE2 GLU A 83 10.840 10.331 -17.452 1.00 12.11 O ATOM 0 H GLU A 83 9.496 11.450 -12.822 1.00 9.15 H new ATOM 0 HA GLU A 83 11.421 13.212 -13.808 1.00 10.17 H new ATOM 0 HB2 GLU A 83 8.844 12.246 -15.113 1.00 10.55 H new ATOM 0 HB3 GLU A 83 10.228 12.909 -15.960 1.00 10.55 H new ATOM 0 HG2 GLU A 83 11.626 11.024 -15.143 1.00 10.83 H new ATOM 0 HG3 GLU A 83 10.239 10.360 -14.303 1.00 10.83 H new ATOM 1255 N GLU A 84 8.432 14.551 -13.474 1.00 9.63 N ATOM 1256 CA GLU A 84 7.704 15.813 -13.442 1.00 9.95 C ATOM 1257 C GLU A 84 8.097 16.648 -12.225 1.00 9.87 C ATOM 1258 O GLU A 84 7.801 17.840 -12.161 1.00 10.51 O ATOM 1259 CB GLU A 84 6.196 15.554 -13.434 1.00 9.47 C ATOM 1260 CG GLU A 84 5.357 16.818 -13.545 1.00 9.88 C ATOM 1261 CD GLU A 84 5.636 17.594 -14.816 1.00 10.40 C ATOM 1262 OE1 GLU A 84 4.978 17.314 -15.840 1.00 10.49 O ATOM 1263 OE2 GLU A 84 6.514 18.482 -14.789 1.00 10.87 O ATOM 0 H GLU A 84 7.876 13.739 -13.205 1.00 9.63 H new ATOM 0 HA GLU A 84 7.967 16.374 -14.339 1.00 9.95 H new ATOM 0 HB2 GLU A 84 5.946 14.889 -14.261 1.00 9.47 H new ATOM 0 HB3 GLU A 84 5.931 15.032 -12.514 1.00 9.47 H new ATOM 0 HG2 GLU A 84 4.300 16.552 -13.511 1.00 9.88 H new ATOM 0 HG3 GLU A 84 5.553 17.456 -12.684 1.00 9.88 H new ATOM 1270 N MET A 85 8.766 16.021 -11.260 1.00 9.31 N ATOM 1271 CA MET A 85 9.188 16.721 -10.054 1.00 9.45 C ATOM 1272 C MET A 85 10.456 17.507 -10.325 1.00 10.49 C ATOM 1273 O MET A 85 10.697 18.555 -9.725 1.00 11.09 O ATOM 1274 CB MET A 85 9.433 15.733 -8.914 1.00 8.75 C ATOM 1275 CG MET A 85 8.350 14.683 -8.775 1.00 7.71 C ATOM 1276 SD MET A 85 8.509 13.716 -7.266 1.00 7.19 S ATOM 1277 CE MET A 85 6.851 13.848 -6.608 1.00 6.73 C ATOM 0 H MET A 85 9.025 15.035 -11.291 1.00 9.31 H new ATOM 0 HA MET A 85 8.392 17.406 -9.761 1.00 9.45 H new ATOM 0 HB2 MET A 85 10.390 15.236 -9.075 1.00 8.75 H new ATOM 0 HB3 MET A 85 9.514 16.285 -7.978 1.00 8.75 H new ATOM 0 HG2 MET A 85 7.375 15.169 -8.789 1.00 7.71 H new ATOM 0 HG3 MET A 85 8.385 14.015 -9.635 1.00 7.71 H new ATOM 0 HE1 MET A 85 6.660 13.013 -5.934 1.00 6.73 H new ATOM 0 HE2 MET A 85 6.750 14.786 -6.062 1.00 6.73 H new ATOM 0 HE3 MET A 85 6.132 13.825 -7.427 1.00 6.73 H new ATOM 1287 N ARG A 86 11.263 16.986 -11.237 1.00 10.82 N ATOM 1288 CA ARG A 86 12.516 17.620 -11.599 1.00 11.88 C ATOM 1289 C ARG A 86 12.272 18.786 -12.549 1.00 12.66 C ATOM 1290 O ARG A 86 12.832 19.868 -12.376 1.00 13.43 O ATOM 1291 CB ARG A 86 13.446 16.596 -12.245 1.00 12.21 C ATOM 1292 CG ARG A 86 14.913 16.868 -11.986 1.00 13.16 C ATOM 1293 CD ARG A 86 15.793 15.768 -12.559 1.00 13.63 C ATOM 1294 NE ARG A 86 17.212 16.027 -12.331 1.00 14.25 N ATOM 1295 CZ ARG A 86 18.123 15.068 -12.184 1.00 14.86 C ATOM 1296 NH1 ARG A 86 17.761 13.793 -12.216 1.00 14.96 N ATOM 1297 NH2 ARG A 86 19.398 15.386 -12.001 1.00 15.52 N ATOM 0 H ARG A 86 11.068 16.121 -11.741 1.00 10.82 H new ATOM 0 HA ARG A 86 12.986 18.008 -10.696 1.00 11.88 H new ATOM 0 HB2 ARG A 86 13.197 15.603 -11.871 1.00 12.21 H new ATOM 0 HB3 ARG A 86 13.271 16.585 -13.321 1.00 12.21 H new ATOM 0 HG2 ARG A 86 15.190 17.825 -12.428 1.00 13.16 H new ATOM 0 HG3 ARG A 86 15.085 16.951 -10.913 1.00 13.16 H new ATOM 0 HD2 ARG A 86 15.521 14.814 -12.107 1.00 13.63 H new ATOM 0 HD3 ARG A 86 15.609 15.677 -13.629 1.00 13.63 H new ATOM 0 HE ARG A 86 17.522 16.997 -12.282 1.00 14.25 H new ATOM 0 HH11 ARG A 86 16.781 13.544 -12.354 1.00 14.96 H new ATOM 0 HH12 ARG A 86 18.462 13.061 -12.103 1.00 14.96 H new ATOM 0 HH21 ARG A 86 19.680 16.366 -11.973 1.00 15.52 H new ATOM 0 HH22 ARG A 86 20.096 14.651 -11.888 1.00 15.52 H new ATOM 1311 N GLU A 87 11.429 18.558 -13.551 1.00 12.58 N ATOM 1312 CA GLU A 87 11.105 19.594 -14.524 1.00 13.44 C ATOM 1313 C GLU A 87 10.340 20.739 -13.865 1.00 13.54 C ATOM 1314 O GLU A 87 10.611 21.910 -14.128 1.00 14.45 O ATOM 1315 CB GLU A 87 10.283 19.006 -15.674 1.00 13.42 C ATOM 1316 CG GLU A 87 11.013 17.921 -16.451 1.00 14.12 C ATOM 1317 CD GLU A 87 12.300 18.418 -17.079 1.00 14.57 C ATOM 1318 OE1 GLU A 87 13.348 18.373 -16.400 1.00 14.77 O ATOM 1319 OE2 GLU A 87 12.261 18.853 -18.249 1.00 14.85 O ATOM 0 H GLU A 87 10.959 17.667 -13.710 1.00 12.58 H new ATOM 0 HA GLU A 87 12.039 19.989 -14.923 1.00 13.44 H new ATOM 0 HB2 GLU A 87 9.357 18.594 -15.274 1.00 13.42 H new ATOM 0 HB3 GLU A 87 10.006 19.808 -16.359 1.00 13.42 H new ATOM 0 HG2 GLU A 87 11.237 17.089 -15.783 1.00 14.12 H new ATOM 0 HG3 GLU A 87 10.358 17.535 -17.232 1.00 14.12 H new ATOM 1326 N ALA A 88 9.388 20.391 -13.002 1.00 12.70 N ATOM 1327 CA ALA A 88 8.585 21.389 -12.305 1.00 12.92 C ATOM 1328 C ALA A 88 9.431 22.193 -11.326 1.00 13.38 C ATOM 1329 O ALA A 88 9.251 23.403 -11.185 1.00 14.11 O ATOM 1330 CB ALA A 88 7.425 20.726 -11.578 1.00 12.02 C ATOM 0 H ALA A 88 9.155 19.426 -12.770 1.00 12.70 H new ATOM 0 HA ALA A 88 8.186 22.077 -13.051 1.00 12.92 H new ATOM 0 HB1 ALA A 88 6.836 21.485 -11.063 1.00 12.02 H new ATOM 0 HB2 ALA A 88 6.795 20.205 -12.298 1.00 12.02 H new ATOM 0 HB3 ALA A 88 7.812 20.012 -10.851 1.00 12.02 H new ATOM 1336 N PHE A 89 10.352 21.515 -10.646 1.00 13.10 N ATOM 1337 CA PHE A 89 11.227 22.172 -9.681 1.00 13.68 C ATOM 1338 C PHE A 89 12.040 23.270 -10.355 1.00 14.81 C ATOM 1339 O PHE A 89 12.212 24.359 -9.808 1.00 15.53 O ATOM 1340 CB PHE A 89 12.165 21.149 -9.037 1.00 13.32 C ATOM 1341 CG PHE A 89 13.145 21.752 -8.071 1.00 14.09 C ATOM 1342 CD1 PHE A 89 12.709 22.298 -6.875 1.00 14.41 C ATOM 1343 CD2 PHE A 89 14.499 21.775 -8.360 1.00 14.63 C ATOM 1344 CE1 PHE A 89 13.607 22.855 -5.984 1.00 15.22 C ATOM 1345 CE2 PHE A 89 15.402 22.330 -7.474 1.00 15.44 C ATOM 1346 CZ PHE A 89 14.960 22.863 -6.286 1.00 15.73 C ATOM 0 H PHE A 89 10.511 20.512 -10.746 1.00 13.10 H new ATOM 0 HA PHE A 89 10.607 22.623 -8.907 1.00 13.68 H new ATOM 0 HB2 PHE A 89 11.569 20.400 -8.516 1.00 13.32 H new ATOM 0 HB3 PHE A 89 12.715 20.629 -9.822 1.00 13.32 H new ATOM 0 HD1 PHE A 89 11.656 22.288 -6.636 1.00 14.41 H new ATOM 0 HD2 PHE A 89 14.853 21.354 -9.289 1.00 14.63 H new ATOM 0 HE1 PHE A 89 13.256 23.282 -5.056 1.00 15.22 H new ATOM 0 HE2 PHE A 89 16.455 22.345 -7.714 1.00 15.44 H new ATOM 0 HZ PHE A 89 15.667 23.288 -5.588 1.00 15.73 H new ATOM 1356 N LYS A 90 12.538 22.968 -11.547 1.00 15.06 N ATOM 1357 CA LYS A 90 13.333 23.918 -12.315 1.00 16.18 C ATOM 1358 C LYS A 90 12.513 25.148 -12.693 1.00 16.76 C ATOM 1359 O LYS A 90 12.991 26.279 -12.599 1.00 17.66 O ATOM 1360 CB LYS A 90 13.867 23.245 -13.576 1.00 16.38 C ATOM 1361 CG LYS A 90 14.810 22.092 -13.281 1.00 16.21 C ATOM 1362 CD LYS A 90 14.901 21.121 -14.449 1.00 16.55 C ATOM 1363 CE LYS A 90 15.817 21.639 -15.550 1.00 16.86 C ATOM 1364 NZ LYS A 90 15.300 22.890 -16.171 1.00 17.18 N ATOM 0 H LYS A 90 12.404 22.067 -12.005 1.00 15.06 H new ATOM 0 HA LYS A 90 14.166 24.244 -11.693 1.00 16.18 H new ATOM 0 HB2 LYS A 90 13.028 22.879 -14.168 1.00 16.38 H new ATOM 0 HB3 LYS A 90 14.387 23.986 -14.184 1.00 16.38 H new ATOM 0 HG2 LYS A 90 15.802 22.483 -13.056 1.00 16.21 H new ATOM 0 HG3 LYS A 90 14.467 21.561 -12.393 1.00 16.21 H new ATOM 0 HD2 LYS A 90 15.270 20.159 -14.093 1.00 16.55 H new ATOM 0 HD3 LYS A 90 13.905 20.950 -14.857 1.00 16.55 H new ATOM 0 HE2 LYS A 90 16.809 21.823 -15.138 1.00 16.86 H new ATOM 0 HE3 LYS A 90 15.928 20.873 -16.318 1.00 16.86 H new ATOM 0 HZ1 LYS A 90 15.576 22.920 -17.173 1.00 17.18 H new ATOM 0 HZ2 LYS A 90 14.263 22.911 -16.097 1.00 17.18 H new ATOM 0 HZ3 LYS A 90 15.699 23.714 -15.677 1.00 17.18 H new ATOM 1378 N ILE A 91 11.275 24.919 -13.122 1.00 16.32 N ATOM 1379 CA ILE A 91 10.388 26.004 -13.525 1.00 16.96 C ATOM 1380 C ILE A 91 10.087 26.946 -12.362 1.00 17.21 C ATOM 1381 O ILE A 91 10.224 28.164 -12.488 1.00 18.15 O ATOM 1382 CB ILE A 91 9.059 25.463 -14.091 1.00 16.50 C ATOM 1383 CG1 ILE A 91 9.327 24.572 -15.306 1.00 16.43 C ATOM 1384 CG2 ILE A 91 8.131 26.612 -14.463 1.00 17.34 C ATOM 1385 CD1 ILE A 91 8.105 23.821 -15.791 1.00 16.26 C ATOM 0 H ILE A 91 10.863 23.989 -13.199 1.00 16.32 H new ATOM 0 HA ILE A 91 10.911 26.559 -14.304 1.00 16.96 H new ATOM 0 HB ILE A 91 8.570 24.864 -13.323 1.00 16.50 H new ATOM 0 HG12 ILE A 91 9.711 25.188 -16.119 1.00 16.43 H new ATOM 0 HG13 ILE A 91 10.108 23.854 -15.054 1.00 16.43 H new ATOM 0 HG21 ILE A 91 7.198 26.212 -14.861 1.00 17.34 H new ATOM 0 HG22 ILE A 91 7.921 27.211 -13.577 1.00 17.34 H new ATOM 0 HG23 ILE A 91 8.609 27.236 -15.218 1.00 17.34 H new ATOM 0 HD11 ILE A 91 8.372 23.211 -16.654 1.00 16.26 H new ATOM 0 HD12 ILE A 91 7.733 23.178 -14.993 1.00 16.26 H new ATOM 0 HD13 ILE A 91 7.330 24.533 -16.075 1.00 16.26 H new ATOM 1397 N PHE A 92 9.676 26.381 -11.230 1.00 16.44 N ATOM 1398 CA PHE A 92 9.349 27.184 -10.056 1.00 16.75 C ATOM 1399 C PHE A 92 10.579 27.908 -9.519 1.00 17.52 C ATOM 1400 O PHE A 92 10.489 29.056 -9.087 1.00 18.34 O ATOM 1401 CB PHE A 92 8.726 26.315 -8.960 1.00 15.83 C ATOM 1402 CG PHE A 92 7.226 26.234 -9.042 1.00 15.63 C ATOM 1403 CD1 PHE A 92 6.458 27.388 -9.068 1.00 15.79 C ATOM 1404 CD2 PHE A 92 6.585 25.006 -9.098 1.00 15.41 C ATOM 1405 CE1 PHE A 92 5.080 27.319 -9.147 1.00 15.74 C ATOM 1406 CE2 PHE A 92 5.207 24.931 -9.178 1.00 15.39 C ATOM 1407 CZ PHE A 92 4.454 26.089 -9.202 1.00 15.56 C ATOM 0 H PHE A 92 9.562 25.376 -11.101 1.00 16.44 H new ATOM 0 HA PHE A 92 8.621 27.935 -10.364 1.00 16.75 H new ATOM 0 HB2 PHE A 92 9.141 25.309 -9.025 1.00 15.83 H new ATOM 0 HB3 PHE A 92 9.008 26.714 -7.986 1.00 15.83 H new ATOM 0 HD1 PHE A 92 6.942 28.352 -9.026 1.00 15.79 H new ATOM 0 HD2 PHE A 92 7.169 24.098 -9.079 1.00 15.41 H new ATOM 0 HE1 PHE A 92 4.493 28.226 -9.166 1.00 15.74 H new ATOM 0 HE2 PHE A 92 4.720 23.968 -9.222 1.00 15.39 H new ATOM 0 HZ PHE A 92 3.377 26.033 -9.264 1.00 15.56 H new ATOM 1417 N ASP A 93 11.725 27.234 -9.543 1.00 17.35 N ATOM 1418 CA ASP A 93 12.963 27.837 -9.061 1.00 18.13 C ATOM 1419 C ASP A 93 13.371 28.998 -9.962 1.00 19.15 C ATOM 1420 O ASP A 93 14.069 28.813 -10.959 1.00 19.29 O ATOM 1421 CB ASP A 93 14.082 26.795 -8.997 1.00 17.78 C ATOM 1422 CG ASP A 93 15.394 27.381 -8.509 1.00 18.61 C ATOM 1423 OD1 ASP A 93 15.353 28.376 -7.756 1.00 18.94 O ATOM 1424 OD2 ASP A 93 16.463 26.849 -8.883 1.00 18.99 O ATOM 0 H ASP A 93 11.822 26.279 -9.888 1.00 17.35 H new ATOM 0 HA ASP A 93 12.791 28.218 -8.054 1.00 18.13 H new ATOM 0 HB2 ASP A 93 13.781 25.984 -8.334 1.00 17.78 H new ATOM 0 HB3 ASP A 93 14.227 26.361 -9.986 1.00 17.78 H new ATOM 1429 N ARG A 94 12.926 30.195 -9.596 1.00 19.94 N ATOM 1430 CA ARG A 94 13.218 31.403 -10.362 1.00 20.98 C ATOM 1431 C ARG A 94 14.716 31.698 -10.424 1.00 21.56 C ATOM 1432 O ARG A 94 15.137 32.658 -11.068 1.00 22.25 O ATOM 1433 CB ARG A 94 12.471 32.588 -9.750 1.00 21.74 C ATOM 1434 CG ARG A 94 10.962 32.489 -9.894 1.00 21.43 C ATOM 1435 CD ARG A 94 10.429 33.503 -10.890 1.00 21.19 C ATOM 1436 NE ARG A 94 11.150 33.459 -12.158 1.00 21.42 N ATOM 1437 CZ ARG A 94 11.511 34.544 -12.837 1.00 21.61 C ATOM 1438 NH1 ARG A 94 11.224 35.752 -12.369 1.00 21.58 N ATOM 1439 NH2 ARG A 94 12.164 34.423 -13.986 1.00 21.94 N ATOM 0 H ARG A 94 12.356 30.356 -8.765 1.00 19.94 H new ATOM 0 HA ARG A 94 12.880 31.240 -11.386 1.00 20.98 H new ATOM 0 HB2 ARG A 94 12.724 32.660 -8.692 1.00 21.74 H new ATOM 0 HB3 ARG A 94 12.814 33.508 -10.223 1.00 21.74 H new ATOM 0 HG2 ARG A 94 10.692 31.484 -10.217 1.00 21.43 H new ATOM 0 HG3 ARG A 94 10.492 32.649 -8.924 1.00 21.43 H new ATOM 0 HD2 ARG A 94 9.371 33.313 -11.069 1.00 21.19 H new ATOM 0 HD3 ARG A 94 10.506 34.503 -10.464 1.00 21.19 H new ATOM 0 HE ARG A 94 11.390 32.546 -12.545 1.00 21.42 H new ATOM 0 HH11 ARG A 94 10.725 35.851 -11.485 1.00 21.58 H new ATOM 0 HH12 ARG A 94 11.503 36.581 -12.893 1.00 21.58 H new ATOM 0 HH21 ARG A 94 12.390 33.497 -14.349 1.00 21.94 H new ATOM 0 HH22 ARG A 94 12.440 35.256 -14.506 1.00 21.94 H new ATOM 1453 N ASP A 95 15.521 30.874 -9.756 1.00 21.37 N ATOM 1454 CA ASP A 95 16.969 31.061 -9.755 1.00 21.99 C ATOM 1455 C ASP A 95 17.682 29.799 -10.224 1.00 21.37 C ATOM 1456 O ASP A 95 17.048 28.785 -10.515 1.00 20.39 O ATOM 1457 CB ASP A 95 17.465 31.430 -8.358 1.00 22.48 C ATOM 1458 CG ASP A 95 16.731 32.615 -7.768 1.00 22.92 C ATOM 1459 OD1 ASP A 95 16.464 33.577 -8.518 1.00 23.34 O ATOM 1460 OD2 ASP A 95 16.421 32.581 -6.557 1.00 22.92 O ATOM 0 H ASP A 95 15.197 30.075 -9.211 1.00 21.37 H new ATOM 0 HA ASP A 95 17.195 31.874 -10.444 1.00 21.99 H new ATOM 0 HB2 ASP A 95 17.348 30.571 -7.697 1.00 22.48 H new ATOM 0 HB3 ASP A 95 18.531 31.655 -8.404 1.00 22.48 H new ATOM 1465 N GLY A 96 19.006 29.876 -10.301 1.00 22.00 N ATOM 1466 CA GLY A 96 19.796 28.735 -10.720 1.00 21.64 C ATOM 1467 C GLY A 96 20.420 28.015 -9.542 1.00 21.55 C ATOM 1468 O GLY A 96 21.062 26.977 -9.706 1.00 21.40 O ATOM 0 H GLY A 96 19.547 30.712 -10.080 1.00 22.00 H new ATOM 0 HA2 GLY A 96 19.165 28.042 -11.276 1.00 21.64 H new ATOM 0 HA3 GLY A 96 20.581 29.067 -11.399 1.00 21.64 H new ATOM 1472 N ASP A 97 20.232 28.575 -8.349 1.00 21.75 N ATOM 1473 CA ASP A 97 20.778 27.990 -7.130 1.00 21.82 C ATOM 1474 C ASP A 97 20.114 26.654 -6.810 1.00 20.80 C ATOM 1475 O ASP A 97 20.774 25.712 -6.371 1.00 20.85 O ATOM 1476 CB ASP A 97 20.607 28.954 -5.952 1.00 22.28 C ATOM 1477 CG ASP A 97 19.331 29.771 -6.043 1.00 21.72 C ATOM 1478 OD1 ASP A 97 18.233 29.174 -6.025 1.00 21.34 O ATOM 1479 OD2 ASP A 97 19.432 31.013 -6.128 1.00 21.74 O ATOM 0 H ASP A 97 19.704 29.435 -8.202 1.00 21.75 H new ATOM 0 HA ASP A 97 21.841 27.811 -7.295 1.00 21.82 H new ATOM 0 HB2 ASP A 97 20.605 28.387 -5.021 1.00 22.28 H new ATOM 0 HB3 ASP A 97 21.463 29.628 -5.912 1.00 22.28 H new ATOM 1484 N GLY A 98 18.806 26.580 -7.033 1.00 19.93 N ATOM 1485 CA GLY A 98 18.075 25.355 -6.762 1.00 18.92 C ATOM 1486 C GLY A 98 17.254 25.444 -5.491 1.00 18.54 C ATOM 1487 O GLY A 98 17.197 24.492 -4.715 1.00 17.94 O ATOM 0 H GLY A 98 18.239 27.346 -7.396 1.00 19.93 H new ATOM 0 HA2 GLY A 98 17.417 25.134 -7.602 1.00 18.92 H new ATOM 0 HA3 GLY A 98 18.778 24.526 -6.681 1.00 18.92 H new ATOM 1491 N PHE A 99 16.622 26.595 -5.278 1.00 19.01 N ATOM 1492 CA PHE A 99 15.800 26.809 -4.092 1.00 18.88 C ATOM 1493 C PHE A 99 14.576 27.658 -4.425 1.00 18.97 C ATOM 1494 O PHE A 99 14.660 28.599 -5.216 1.00 19.56 O ATOM 1495 CB PHE A 99 16.616 27.489 -2.992 1.00 19.81 C ATOM 1496 CG PHE A 99 17.802 26.687 -2.534 1.00 19.89 C ATOM 1497 CD1 PHE A 99 17.661 25.711 -1.560 1.00 19.90 C ATOM 1498 CD2 PHE A 99 19.057 26.908 -3.078 1.00 20.07 C ATOM 1499 CE1 PHE A 99 18.749 24.972 -1.137 1.00 20.10 C ATOM 1500 CE2 PHE A 99 20.149 26.172 -2.659 1.00 20.28 C ATOM 1501 CZ PHE A 99 19.995 25.205 -1.685 1.00 20.30 C ATOM 0 H PHE A 99 16.664 27.393 -5.911 1.00 19.01 H new ATOM 0 HA PHE A 99 15.463 25.835 -3.737 1.00 18.88 H new ATOM 0 HB2 PHE A 99 16.962 28.457 -3.354 1.00 19.81 H new ATOM 0 HB3 PHE A 99 15.967 27.682 -2.137 1.00 19.81 H new ATOM 0 HD1 PHE A 99 16.689 25.526 -1.127 1.00 19.90 H new ATOM 0 HD2 PHE A 99 19.183 27.664 -3.838 1.00 20.07 H new ATOM 0 HE1 PHE A 99 18.625 24.213 -0.379 1.00 20.10 H new ATOM 0 HE2 PHE A 99 21.121 26.353 -3.093 1.00 20.28 H new ATOM 0 HZ PHE A 99 20.848 24.632 -1.352 1.00 20.30 H new ATOM 1511 N ILE A 100 13.441 27.328 -3.812 1.00 18.48 N ATOM 1512 CA ILE A 100 12.205 28.064 -4.050 1.00 18.67 C ATOM 1513 C ILE A 100 11.751 28.797 -2.791 1.00 19.37 C ATOM 1514 O ILE A 100 11.512 28.184 -1.750 1.00 19.21 O ATOM 1515 CB ILE A 100 11.078 27.126 -4.524 1.00 17.64 C ATOM 1516 CG1 ILE A 100 11.547 26.307 -5.730 1.00 16.97 C ATOM 1517 CG2 ILE A 100 9.829 27.925 -4.873 1.00 18.04 C ATOM 1518 CD1 ILE A 100 10.571 25.231 -6.150 1.00 15.92 C ATOM 0 H ILE A 100 13.353 26.558 -3.149 1.00 18.48 H new ATOM 0 HA ILE A 100 12.414 28.793 -4.833 1.00 18.67 H new ATOM 0 HB ILE A 100 10.829 26.442 -3.713 1.00 17.64 H new ATOM 0 HG12 ILE A 100 11.717 26.979 -6.571 1.00 16.97 H new ATOM 0 HG13 ILE A 100 12.505 25.844 -5.493 1.00 16.97 H new ATOM 0 HG21 ILE A 100 9.044 27.246 -5.206 1.00 18.04 H new ATOM 0 HG22 ILE A 100 9.488 28.470 -3.993 1.00 18.04 H new ATOM 0 HG23 ILE A 100 10.060 28.631 -5.671 1.00 18.04 H new ATOM 0 HD11 ILE A 100 10.971 24.693 -7.009 1.00 15.92 H new ATOM 0 HD12 ILE A 100 10.419 24.535 -5.325 1.00 15.92 H new ATOM 0 HD13 ILE A 100 9.619 25.688 -6.419 1.00 15.92 H new ATOM 1530 N SER A 101 11.635 30.117 -2.900 1.00 20.25 N ATOM 1531 CA SER A 101 11.211 30.952 -1.782 1.00 21.07 C ATOM 1532 C SER A 101 9.861 31.599 -2.078 1.00 21.23 C ATOM 1533 O SER A 101 9.494 31.746 -3.240 1.00 20.98 O ATOM 1534 CB SER A 101 12.255 32.033 -1.501 1.00 22.16 C ATOM 1535 OG SER A 101 12.570 32.757 -2.678 1.00 22.49 O ATOM 0 H SER A 101 11.830 30.634 -3.757 1.00 20.25 H new ATOM 0 HA SER A 101 11.110 30.318 -0.901 1.00 21.07 H new ATOM 0 HB2 SER A 101 11.879 32.717 -0.740 1.00 22.16 H new ATOM 0 HB3 SER A 101 13.159 31.574 -1.100 1.00 22.16 H new ATOM 0 HG SER A 101 13.077 32.183 -3.289 1.00 22.49 H new ATOM 1541 N PRO A 102 9.098 31.984 -1.034 1.00 21.74 N ATOM 1542 CA PRO A 102 7.782 32.607 -1.205 1.00 22.05 C ATOM 1543 C PRO A 102 7.752 33.613 -2.354 1.00 22.55 C ATOM 1544 O PRO A 102 6.754 33.724 -3.069 1.00 22.43 O ATOM 1545 CB PRO A 102 7.565 33.308 0.132 1.00 23.00 C ATOM 1546 CG PRO A 102 8.281 32.453 1.120 1.00 22.78 C ATOM 1547 CD PRO A 102 9.461 31.857 0.392 1.00 22.19 C ATOM 0 HA PRO A 102 7.010 31.880 -1.458 1.00 22.05 H new ATOM 0 HB2 PRO A 102 7.966 34.321 0.119 1.00 23.00 H new ATOM 0 HB3 PRO A 102 6.505 33.388 0.371 1.00 23.00 H new ATOM 0 HG2 PRO A 102 8.610 33.042 1.976 1.00 22.78 H new ATOM 0 HG3 PRO A 102 7.626 31.671 1.503 1.00 22.78 H new ATOM 0 HD2 PRO A 102 10.383 32.393 0.619 1.00 22.19 H new ATOM 0 HD3 PRO A 102 9.620 30.816 0.673 1.00 22.19 H new ATOM 1555 N ALA A 103 8.854 34.333 -2.534 1.00 23.17 N ATOM 1556 CA ALA A 103 8.956 35.329 -3.596 1.00 23.77 C ATOM 1557 C ALA A 103 8.967 34.669 -4.971 1.00 23.02 C ATOM 1558 O ALA A 103 8.150 34.987 -5.835 1.00 23.22 O ATOM 1559 CB ALA A 103 10.211 36.165 -3.408 1.00 24.56 C ATOM 0 H ALA A 103 9.691 34.246 -1.957 1.00 23.17 H new ATOM 0 HA ALA A 103 8.081 35.977 -3.539 1.00 23.77 H new ATOM 0 HB1 ALA A 103 10.278 36.905 -4.205 1.00 24.56 H new ATOM 0 HB2 ALA A 103 10.169 36.673 -2.444 1.00 24.56 H new ATOM 0 HB3 ALA A 103 11.087 35.518 -3.439 1.00 24.56 H new ATOM 1565 N GLU A 104 9.903 33.747 -5.165 1.00 22.23 N ATOM 1566 CA GLU A 104 10.033 33.035 -6.429 1.00 21.53 C ATOM 1567 C GLU A 104 8.783 32.216 -6.724 1.00 20.75 C ATOM 1568 O GLU A 104 8.411 32.018 -7.883 1.00 20.59 O ATOM 1569 CB GLU A 104 11.243 32.101 -6.382 1.00 20.94 C ATOM 1570 CG GLU A 104 12.570 32.811 -6.183 1.00 21.74 C ATOM 1571 CD GLU A 104 13.746 31.855 -6.241 1.00 21.28 C ATOM 1572 OE1 GLU A 104 14.129 31.447 -7.358 1.00 20.84 O ATOM 1573 OE2 GLU A 104 14.289 31.518 -5.168 1.00 21.43 O ATOM 0 H GLU A 104 10.586 33.475 -4.458 1.00 22.23 H new ATOM 0 HA GLU A 104 10.166 33.774 -7.219 1.00 21.53 H new ATOM 0 HB2 GLU A 104 11.103 31.384 -5.573 1.00 20.94 H new ATOM 0 HB3 GLU A 104 11.284 31.531 -7.310 1.00 20.94 H new ATOM 0 HG2 GLU A 104 12.689 33.577 -6.949 1.00 21.74 H new ATOM 0 HG3 GLU A 104 12.566 33.321 -5.220 1.00 21.74 H new ATOM 1580 N LEU A 105 8.138 31.750 -5.665 1.00 20.36 N ATOM 1581 CA LEU A 105 6.947 30.924 -5.791 1.00 19.67 C ATOM 1582 C LEU A 105 5.761 31.711 -6.341 1.00 20.33 C ATOM 1583 O LEU A 105 5.170 31.323 -7.345 1.00 19.95 O ATOM 1584 CB LEU A 105 6.586 30.317 -4.433 1.00 19.42 C ATOM 1585 CG LEU A 105 5.445 29.299 -4.455 1.00 18.62 C ATOM 1586 CD1 LEU A 105 5.846 28.060 -5.241 1.00 17.90 C ATOM 1587 CD2 LEU A 105 5.045 28.924 -3.037 1.00 18.59 C ATOM 0 H LEU A 105 8.422 31.932 -4.702 1.00 20.36 H new ATOM 0 HA LEU A 105 7.172 30.128 -6.501 1.00 19.67 H new ATOM 0 HB2 LEU A 105 7.473 29.835 -4.022 1.00 19.42 H new ATOM 0 HB3 LEU A 105 6.317 31.125 -3.752 1.00 19.42 H new ATOM 0 HG LEU A 105 4.587 29.754 -4.950 1.00 18.62 H new ATOM 0 HD11 LEU A 105 5.020 27.348 -5.244 1.00 17.90 H new ATOM 0 HD12 LEU A 105 6.087 28.342 -6.266 1.00 17.90 H new ATOM 0 HD13 LEU A 105 6.719 27.601 -4.776 1.00 17.90 H new ATOM 0 HD21 LEU A 105 4.232 28.199 -3.068 1.00 18.59 H new ATOM 0 HD22 LEU A 105 5.900 28.488 -2.521 1.00 18.59 H new ATOM 0 HD23 LEU A 105 4.715 29.816 -2.504 1.00 18.59 H new ATOM 1599 N ARG A 106 5.417 32.816 -5.683 1.00 21.40 N ATOM 1600 CA ARG A 106 4.283 33.635 -6.109 1.00 22.20 C ATOM 1601 C ARG A 106 4.442 34.102 -7.554 1.00 22.44 C ATOM 1602 O ARG A 106 3.477 34.125 -8.318 1.00 22.57 O ATOM 1603 CB ARG A 106 4.106 34.841 -5.181 1.00 23.35 C ATOM 1604 CG ARG A 106 5.244 35.846 -5.244 1.00 24.22 C ATOM 1605 CD ARG A 106 4.807 37.136 -5.920 1.00 25.21 C ATOM 1606 NE ARG A 106 5.817 38.184 -5.804 1.00 25.76 N ATOM 1607 CZ ARG A 106 5.541 39.441 -5.468 1.00 26.69 C ATOM 1608 NH1 ARG A 106 4.290 39.803 -5.210 1.00 27.16 N ATOM 1609 NH2 ARG A 106 6.514 40.337 -5.384 1.00 27.19 N ATOM 0 H ARG A 106 5.904 33.164 -4.857 1.00 21.40 H new ATOM 0 HA ARG A 106 3.390 33.012 -6.051 1.00 22.20 H new ATOM 0 HB2 ARG A 106 3.174 35.347 -5.435 1.00 23.35 H new ATOM 0 HB3 ARG A 106 4.007 34.485 -4.156 1.00 23.35 H new ATOM 0 HG2 ARG A 106 5.596 36.063 -4.236 1.00 24.22 H new ATOM 0 HG3 ARG A 106 6.083 35.414 -5.789 1.00 24.22 H new ATOM 0 HD2 ARG A 106 4.605 36.943 -6.973 1.00 25.21 H new ATOM 0 HD3 ARG A 106 3.874 37.481 -5.474 1.00 25.21 H new ATOM 0 HE ARG A 106 6.789 37.938 -5.991 1.00 25.76 H new ATOM 0 HH11 ARG A 106 3.538 39.117 -5.269 1.00 27.16 H new ATOM 0 HH12 ARG A 106 4.081 40.768 -4.953 1.00 27.16 H new ATOM 0 HH21 ARG A 106 7.477 40.063 -5.577 1.00 27.19 H new ATOM 0 HH22 ARG A 106 6.299 41.300 -5.126 1.00 27.19 H new ATOM 1623 N PHE A 107 5.662 34.476 -7.922 1.00 22.61 N ATOM 1624 CA PHE A 107 5.944 34.942 -9.276 1.00 22.97 C ATOM 1625 C PHE A 107 5.572 33.884 -10.315 1.00 22.14 C ATOM 1626 O PHE A 107 4.815 34.162 -11.245 1.00 22.53 O ATOM 1627 CB PHE A 107 7.419 35.315 -9.414 1.00 23.24 C ATOM 1628 CG PHE A 107 7.707 36.192 -10.600 1.00 23.93 C ATOM 1629 CD1 PHE A 107 7.920 35.635 -11.851 1.00 24.11 C ATOM 1630 CD2 PHE A 107 7.767 37.570 -10.465 1.00 24.48 C ATOM 1631 CE1 PHE A 107 8.187 36.436 -12.946 1.00 24.82 C ATOM 1632 CE2 PHE A 107 8.034 38.375 -11.557 1.00 25.19 C ATOM 1633 CZ PHE A 107 8.234 37.818 -12.793 1.00 25.36 C ATOM 0 H PHE A 107 6.472 34.466 -7.302 1.00 22.61 H new ATOM 0 HA PHE A 107 5.334 35.827 -9.458 1.00 22.97 H new ATOM 0 HB2 PHE A 107 7.743 35.826 -8.507 1.00 23.24 H new ATOM 0 HB3 PHE A 107 8.010 34.403 -9.494 1.00 23.24 H new ATOM 0 HD1 PHE A 107 7.877 34.563 -11.972 1.00 24.11 H new ATOM 0 HD2 PHE A 107 7.604 38.020 -9.497 1.00 24.48 H new ATOM 0 HE1 PHE A 107 8.358 35.991 -13.915 1.00 24.82 H new ATOM 0 HE2 PHE A 107 8.085 39.447 -11.435 1.00 25.19 H new ATOM 0 HZ PHE A 107 8.428 38.451 -13.647 1.00 25.36 H new ATOM 1643 N VAL A 108 6.105 32.674 -10.155 1.00 21.06 N ATOM 1644 CA VAL A 108 5.820 31.589 -11.094 1.00 20.23 C ATOM 1645 C VAL A 108 4.365 31.146 -11.004 1.00 20.08 C ATOM 1646 O VAL A 108 3.736 30.874 -12.020 1.00 20.21 O ATOM 1647 CB VAL A 108 6.726 30.367 -10.858 1.00 19.12 C ATOM 1648 CG1 VAL A 108 6.447 29.288 -11.896 1.00 18.33 C ATOM 1649 CG2 VAL A 108 8.190 30.776 -10.884 1.00 19.13 C ATOM 0 H VAL A 108 6.731 32.421 -9.391 1.00 21.06 H new ATOM 0 HA VAL A 108 6.020 31.988 -12.088 1.00 20.23 H new ATOM 0 HB VAL A 108 6.505 29.957 -9.873 1.00 19.12 H new ATOM 0 HG11 VAL A 108 7.096 28.432 -11.714 1.00 18.33 H new ATOM 0 HG12 VAL A 108 5.405 28.975 -11.825 1.00 18.33 H new ATOM 0 HG13 VAL A 108 6.640 29.684 -12.893 1.00 18.33 H new ATOM 0 HG21 VAL A 108 8.816 29.900 -10.715 1.00 19.13 H new ATOM 0 HG22 VAL A 108 8.429 31.211 -11.854 1.00 19.13 H new ATOM 0 HG23 VAL A 108 8.376 31.511 -10.101 1.00 19.13 H new ATOM 1659 N MET A 109 3.841 31.068 -9.785 1.00 19.93 N ATOM 1660 CA MET A 109 2.457 30.656 -9.572 1.00 19.90 C ATOM 1661 C MET A 109 1.513 31.460 -10.452 1.00 20.93 C ATOM 1662 O MET A 109 0.540 30.927 -10.986 1.00 20.91 O ATOM 1663 CB MET A 109 2.068 30.826 -8.103 1.00 20.00 C ATOM 1664 CG MET A 109 2.639 29.751 -7.191 1.00 18.99 C ATOM 1665 SD MET A 109 1.412 28.517 -6.711 1.00 18.30 S ATOM 1666 CE MET A 109 0.908 27.891 -8.311 1.00 17.64 C ATOM 0 H MET A 109 4.353 31.284 -8.930 1.00 19.93 H new ATOM 0 HA MET A 109 2.374 29.603 -9.841 1.00 19.90 H new ATOM 0 HB2 MET A 109 2.408 31.802 -7.757 1.00 20.00 H new ATOM 0 HB3 MET A 109 0.981 30.820 -8.021 1.00 20.00 H new ATOM 0 HG2 MET A 109 3.468 29.255 -7.696 1.00 18.99 H new ATOM 0 HG3 MET A 109 3.046 30.220 -6.295 1.00 18.99 H new ATOM 0 HE1 MET A 109 0.245 27.036 -8.175 1.00 17.64 H new ATOM 0 HE2 MET A 109 0.383 28.674 -8.859 1.00 17.64 H new ATOM 0 HE3 MET A 109 1.788 27.582 -8.874 1.00 17.64 H new ATOM 1676 N ILE A 110 1.808 32.745 -10.601 1.00 21.91 N ATOM 1677 CA ILE A 110 0.990 33.619 -11.422 1.00 22.98 C ATOM 1678 C ILE A 110 1.084 33.240 -12.896 1.00 22.97 C ATOM 1679 O ILE A 110 0.175 33.518 -13.680 1.00 23.58 O ATOM 1680 CB ILE A 110 1.367 35.096 -11.212 1.00 24.01 C ATOM 1681 CG1 ILE A 110 0.953 35.519 -9.799 1.00 24.18 C ATOM 1682 CG2 ILE A 110 0.697 35.974 -12.260 1.00 25.13 C ATOM 1683 CD1 ILE A 110 1.431 36.895 -9.399 1.00 25.10 C ATOM 0 H ILE A 110 2.608 33.202 -10.163 1.00 21.91 H new ATOM 0 HA ILE A 110 -0.045 33.489 -11.107 1.00 22.98 H new ATOM 0 HB ILE A 110 2.445 35.217 -11.322 1.00 24.01 H new ATOM 0 HG12 ILE A 110 -0.134 35.489 -9.727 1.00 24.18 H new ATOM 0 HG13 ILE A 110 1.340 34.791 -9.086 1.00 24.18 H new ATOM 0 HG21 ILE A 110 0.976 37.015 -12.095 1.00 25.13 H new ATOM 0 HG22 ILE A 110 1.020 35.665 -13.254 1.00 25.13 H new ATOM 0 HG23 ILE A 110 -0.385 35.872 -12.182 1.00 25.13 H new ATOM 0 HD11 ILE A 110 1.095 37.117 -8.386 1.00 25.10 H new ATOM 0 HD12 ILE A 110 2.520 36.927 -9.436 1.00 25.10 H new ATOM 0 HD13 ILE A 110 1.023 37.636 -10.086 1.00 25.10 H new ATOM 1695 N ASN A 111 2.178 32.592 -13.261 1.00 22.36 N ATOM 1696 CA ASN A 111 2.382 32.158 -14.634 1.00 22.40 C ATOM 1697 C ASN A 111 1.467 30.977 -14.960 1.00 21.78 C ATOM 1698 O ASN A 111 1.178 30.705 -16.125 1.00 22.21 O ATOM 1699 CB ASN A 111 3.844 31.762 -14.851 1.00 21.96 C ATOM 1700 CG ASN A 111 4.242 31.777 -16.314 1.00 22.60 C ATOM 1701 OD1 ASN A 111 3.443 31.453 -17.192 1.00 23.32 O ATOM 1702 ND2 ASN A 111 5.481 32.166 -16.582 1.00 22.44 N ATOM 0 H ASN A 111 2.939 32.355 -12.625 1.00 22.36 H new ATOM 0 HA ASN A 111 2.137 32.986 -15.299 1.00 22.40 H new ATOM 0 HB2 ASN A 111 4.488 32.445 -14.296 1.00 21.96 H new ATOM 0 HB3 ASN A 111 4.011 30.765 -14.443 1.00 21.96 H new ATOM 0 HD21 ASN A 111 5.805 32.206 -17.548 1.00 22.44 H new ATOM 0 HD22 ASN A 111 6.110 32.426 -15.822 1.00 22.44 H new ATOM 1709 N LEU A 112 1.009 30.283 -13.918 1.00 20.83 N ATOM 1710 CA LEU A 112 0.126 29.130 -14.091 1.00 20.19 C ATOM 1711 C LEU A 112 -1.346 29.534 -13.992 1.00 20.95 C ATOM 1712 O LEU A 112 -1.997 29.782 -15.007 1.00 21.07 O ATOM 1713 CB LEU A 112 0.441 28.046 -13.053 1.00 19.00 C ATOM 1714 CG LEU A 112 1.806 27.367 -13.203 1.00 18.25 C ATOM 1715 CD1 LEU A 112 2.902 28.221 -12.593 1.00 17.58 C ATOM 1716 CD2 LEU A 112 1.789 25.987 -12.565 1.00 17.84 C ATOM 0 H LEU A 112 1.234 30.499 -12.947 1.00 20.83 H new ATOM 0 HA LEU A 112 0.304 28.729 -15.089 1.00 20.19 H new ATOM 0 HB2 LEU A 112 0.383 28.491 -12.060 1.00 19.00 H new ATOM 0 HB3 LEU A 112 -0.334 27.281 -13.105 1.00 19.00 H new ATOM 0 HG LEU A 112 2.014 27.253 -14.267 1.00 18.25 H new ATOM 0 HD11 LEU A 112 3.862 27.719 -12.711 1.00 17.58 H new ATOM 0 HD12 LEU A 112 2.933 29.187 -13.096 1.00 17.58 H new ATOM 0 HD13 LEU A 112 2.699 28.371 -11.533 1.00 17.58 H new ATOM 0 HD21 LEU A 112 2.767 25.520 -12.682 1.00 17.84 H new ATOM 0 HD22 LEU A 112 1.555 26.079 -11.504 1.00 17.84 H new ATOM 0 HD23 LEU A 112 1.033 25.371 -13.051 1.00 17.84 H new ATOM 1728 N GLY A 113 -1.865 29.599 -12.765 1.00 21.57 N ATOM 1729 CA GLY A 113 -3.258 29.972 -12.566 1.00 22.41 C ATOM 1730 C GLY A 113 -3.412 31.249 -11.774 1.00 22.40 C ATOM 1731 O GLY A 113 -4.528 31.715 -11.545 1.00 23.05 O ATOM 0 H GLY A 113 -1.348 29.401 -11.909 1.00 21.57 H new ATOM 0 HA2 GLY A 113 -3.740 30.091 -13.536 1.00 22.41 H new ATOM 0 HA3 GLY A 113 -3.776 29.164 -12.049 1.00 22.41 H new ATOM 1735 N GLU A 114 -2.280 31.802 -11.362 1.00 21.76 N ATOM 1736 CA GLU A 114 -2.228 33.042 -10.603 1.00 21.80 C ATOM 1737 C GLU A 114 -3.280 33.149 -9.503 1.00 22.59 C ATOM 1738 O GLU A 114 -3.953 32.178 -9.154 1.00 22.48 O ATOM 1739 CB GLU A 114 -2.337 34.215 -11.564 1.00 20.80 C ATOM 1740 CG GLU A 114 -3.749 34.500 -12.033 1.00 20.26 C ATOM 1741 CD GLU A 114 -3.805 35.565 -13.112 1.00 20.12 C ATOM 1742 OE1 GLU A 114 -3.699 35.208 -14.303 1.00 19.96 O ATOM 1743 OE2 GLU A 114 -3.955 36.754 -12.763 1.00 20.27 O ATOM 0 H GLU A 114 -1.362 31.397 -11.548 1.00 21.76 H new ATOM 0 HA GLU A 114 -1.270 33.055 -10.083 1.00 21.80 H new ATOM 0 HB2 GLU A 114 -1.940 35.107 -11.079 1.00 20.80 H new ATOM 0 HB3 GLU A 114 -1.709 34.018 -12.433 1.00 20.80 H new ATOM 0 HG2 GLU A 114 -4.194 33.580 -12.413 1.00 20.26 H new ATOM 0 HG3 GLU A 114 -4.352 34.818 -11.183 1.00 20.26 H new ATOM 1750 N LYS A 115 -3.375 34.354 -8.944 1.00 23.45 N ATOM 1751 CA LYS A 115 -4.316 34.658 -7.874 1.00 24.32 C ATOM 1752 C LYS A 115 -3.978 33.896 -6.598 1.00 23.94 C ATOM 1753 O LYS A 115 -4.818 33.184 -6.045 1.00 23.86 O ATOM 1754 CB LYS A 115 -5.754 34.355 -8.308 1.00 25.48 C ATOM 1755 CG LYS A 115 -6.302 35.330 -9.339 1.00 26.26 C ATOM 1756 CD LYS A 115 -6.552 36.709 -8.742 1.00 26.75 C ATOM 1757 CE LYS A 115 -7.775 36.721 -7.836 1.00 27.55 C ATOM 1758 NZ LYS A 115 -7.460 36.245 -6.460 1.00 27.96 N ATOM 0 H LYS A 115 -2.798 35.148 -9.223 1.00 23.45 H new ATOM 0 HA LYS A 115 -4.233 35.724 -7.662 1.00 24.32 H new ATOM 0 HB2 LYS A 115 -5.795 33.346 -8.718 1.00 25.48 H new ATOM 0 HB3 LYS A 115 -6.399 34.369 -7.430 1.00 25.48 H new ATOM 0 HG2 LYS A 115 -5.599 35.415 -10.167 1.00 26.26 H new ATOM 0 HG3 LYS A 115 -7.233 34.938 -9.750 1.00 26.26 H new ATOM 0 HD2 LYS A 115 -5.676 37.023 -8.174 1.00 26.75 H new ATOM 0 HD3 LYS A 115 -6.688 37.433 -9.545 1.00 26.75 H new ATOM 0 HE2 LYS A 115 -8.178 37.733 -7.785 1.00 27.55 H new ATOM 0 HE3 LYS A 115 -8.552 36.090 -8.268 1.00 27.55 H new ATOM 0 HZ1 LYS A 115 -7.931 35.333 -6.292 1.00 27.96 H new ATOM 0 HZ2 LYS A 115 -6.431 36.127 -6.360 1.00 27.96 H new ATOM 0 HZ3 LYS A 115 -7.798 36.942 -5.766 1.00 27.96 H new ATOM 1772 N VAL A 116 -2.741 34.050 -6.138 1.00 23.78 N ATOM 1773 CA VAL A 116 -2.297 33.398 -4.915 1.00 23.53 C ATOM 1774 C VAL A 116 -1.624 34.393 -3.980 1.00 24.38 C ATOM 1775 O VAL A 116 -0.575 34.951 -4.301 1.00 24.75 O ATOM 1776 CB VAL A 116 -1.319 32.245 -5.193 1.00 22.24 C ATOM 1777 CG1 VAL A 116 -2.069 30.978 -5.565 1.00 21.40 C ATOM 1778 CG2 VAL A 116 -0.326 32.628 -6.279 1.00 21.91 C ATOM 0 H VAL A 116 -2.030 34.621 -6.595 1.00 23.78 H new ATOM 0 HA VAL A 116 -3.192 32.991 -4.444 1.00 23.53 H new ATOM 0 HB VAL A 116 -0.759 32.048 -4.279 1.00 22.24 H new ATOM 0 HG11 VAL A 116 -1.356 30.176 -5.757 1.00 21.40 H new ATOM 0 HG12 VAL A 116 -2.726 30.690 -4.745 1.00 21.40 H new ATOM 0 HG13 VAL A 116 -2.664 31.157 -6.461 1.00 21.40 H new ATOM 0 HG21 VAL A 116 0.356 31.797 -6.458 1.00 21.91 H new ATOM 0 HG22 VAL A 116 -0.864 32.861 -7.198 1.00 21.91 H new ATOM 0 HG23 VAL A 116 0.243 33.501 -5.960 1.00 21.91 H new ATOM 1788 N THR A 117 -2.235 34.615 -2.823 1.00 24.76 N ATOM 1789 CA THR A 117 -1.690 35.538 -1.842 1.00 25.62 C ATOM 1790 C THR A 117 -0.414 34.971 -1.237 1.00 25.03 C ATOM 1791 O THR A 117 -0.279 33.757 -1.081 1.00 24.12 O ATOM 1792 CB THR A 117 -2.699 35.825 -0.714 1.00 26.54 C ATOM 1793 OG1 THR A 117 -2.978 34.621 0.011 1.00 25.98 O ATOM 1794 CG2 THR A 117 -3.992 36.391 -1.278 1.00 27.24 C ATOM 0 H THR A 117 -3.108 34.167 -2.543 1.00 24.76 H new ATOM 0 HA THR A 117 -1.472 36.472 -2.359 1.00 25.62 H new ATOM 0 HB THR A 117 -2.259 36.562 -0.041 1.00 26.54 H new ATOM 0 HG1 THR A 117 -3.619 34.812 0.728 1.00 25.98 H new ATOM 0 HG21 THR A 117 -4.690 36.586 -0.464 1.00 27.24 H new ATOM 0 HG22 THR A 117 -3.782 37.321 -1.806 1.00 27.24 H new ATOM 0 HG23 THR A 117 -4.433 35.672 -1.969 1.00 27.24 H new ATOM 1802 N ASP A 118 0.520 35.854 -0.902 1.00 25.62 N ATOM 1803 CA ASP A 118 1.787 35.439 -0.316 1.00 25.26 C ATOM 1804 C ASP A 118 1.563 34.561 0.912 1.00 25.12 C ATOM 1805 O ASP A 118 2.466 33.850 1.349 1.00 24.60 O ATOM 1806 CB ASP A 118 2.620 36.664 0.068 1.00 26.22 C ATOM 1807 CG ASP A 118 2.886 37.577 -1.113 1.00 26.44 C ATOM 1808 OD1 ASP A 118 2.064 38.486 -1.357 1.00 26.51 O ATOM 1809 OD2 ASP A 118 3.914 37.383 -1.795 1.00 26.63 O ATOM 0 H ASP A 118 0.423 36.862 -1.027 1.00 25.62 H new ATOM 0 HA ASP A 118 2.327 34.856 -1.062 1.00 25.26 H new ATOM 0 HB2 ASP A 118 2.101 37.223 0.846 1.00 26.22 H new ATOM 0 HB3 ASP A 118 3.570 36.336 0.491 1.00 26.22 H new ATOM 1814 N GLU A 119 0.350 34.608 1.457 1.00 25.66 N ATOM 1815 CA GLU A 119 0.011 33.824 2.639 1.00 25.70 C ATOM 1816 C GLU A 119 -0.295 32.371 2.287 1.00 24.54 C ATOM 1817 O GLU A 119 0.321 31.455 2.830 1.00 24.02 O ATOM 1818 CB GLU A 119 -1.187 34.444 3.361 1.00 26.79 C ATOM 1819 CG GLU A 119 -0.925 35.847 3.880 1.00 27.99 C ATOM 1820 CD GLU A 119 -2.114 36.423 4.625 1.00 28.61 C ATOM 1821 OE1 GLU A 119 -3.003 37.002 3.965 1.00 28.61 O ATOM 1822 OE2 GLU A 119 -2.155 36.298 5.867 1.00 29.14 O ATOM 0 H GLU A 119 -0.414 35.181 1.098 1.00 25.66 H new ATOM 0 HA GLU A 119 0.880 33.835 3.297 1.00 25.70 H new ATOM 0 HB2 GLU A 119 -2.037 34.471 2.679 1.00 26.79 H new ATOM 0 HB3 GLU A 119 -1.468 33.803 4.197 1.00 26.79 H new ATOM 0 HG2 GLU A 119 -0.059 35.830 4.542 1.00 27.99 H new ATOM 0 HG3 GLU A 119 -0.674 36.499 3.044 1.00 27.99 H new ATOM 1829 N GLU A 120 -1.245 32.159 1.379 1.00 24.19 N ATOM 1830 CA GLU A 120 -1.625 30.807 0.982 1.00 23.13 C ATOM 1831 C GLU A 120 -0.431 30.032 0.432 1.00 21.97 C ATOM 1832 O GLU A 120 -0.231 28.863 0.773 1.00 21.17 O ATOM 1833 CB GLU A 120 -2.765 30.845 -0.039 1.00 23.10 C ATOM 1834 CG GLU A 120 -2.419 31.547 -1.339 1.00 22.97 C ATOM 1835 CD GLU A 120 -3.573 31.532 -2.323 1.00 23.00 C ATOM 1836 OE1 GLU A 120 -3.797 30.482 -2.961 1.00 22.54 O ATOM 1837 OE2 GLU A 120 -4.248 32.573 -2.462 1.00 23.55 O ATOM 0 H GLU A 120 -1.762 32.901 0.908 1.00 24.19 H new ATOM 0 HA GLU A 120 -1.976 30.285 1.872 1.00 23.13 H new ATOM 0 HB2 GLU A 120 -3.071 29.823 -0.262 1.00 23.10 H new ATOM 0 HB3 GLU A 120 -3.623 31.343 0.411 1.00 23.10 H new ATOM 0 HG2 GLU A 120 -2.136 32.579 -1.129 1.00 22.97 H new ATOM 0 HG3 GLU A 120 -1.552 31.065 -1.791 1.00 22.97 H new ATOM 1844 N ILE A 121 0.369 30.680 -0.409 1.00 21.93 N ATOM 1845 CA ILE A 121 1.537 30.030 -0.985 1.00 20.94 C ATOM 1846 C ILE A 121 2.600 29.768 0.077 1.00 20.97 C ATOM 1847 O ILE A 121 3.237 28.714 0.078 1.00 20.10 O ATOM 1848 CB ILE A 121 2.153 30.857 -2.128 1.00 21.05 C ATOM 1849 CG1 ILE A 121 2.349 32.309 -1.698 1.00 22.23 C ATOM 1850 CG2 ILE A 121 1.275 30.778 -3.365 1.00 20.98 C ATOM 1851 CD1 ILE A 121 3.652 32.908 -2.180 1.00 22.33 C ATOM 0 H ILE A 121 0.230 31.647 -0.704 1.00 21.93 H new ATOM 0 HA ILE A 121 1.192 29.080 -1.394 1.00 20.94 H new ATOM 0 HB ILE A 121 3.131 30.441 -2.369 1.00 21.05 H new ATOM 0 HG12 ILE A 121 1.521 32.907 -2.077 1.00 22.23 H new ATOM 0 HG13 ILE A 121 2.312 32.366 -0.610 1.00 22.23 H new ATOM 0 HG21 ILE A 121 1.721 31.367 -4.166 1.00 20.98 H new ATOM 0 HG22 ILE A 121 1.188 29.739 -3.684 1.00 20.98 H new ATOM 0 HG23 ILE A 121 0.285 31.171 -3.134 1.00 20.98 H new ATOM 0 HD11 ILE A 121 3.726 33.941 -1.839 1.00 22.33 H new ATOM 0 HD12 ILE A 121 4.487 32.333 -1.780 1.00 22.33 H new ATOM 0 HD13 ILE A 121 3.683 32.883 -3.269 1.00 22.33 H new ATOM 1863 N ASP A 122 2.792 30.727 0.982 1.00 22.05 N ATOM 1864 CA ASP A 122 3.778 30.575 2.047 1.00 22.30 C ATOM 1865 C ASP A 122 3.430 29.384 2.930 1.00 21.86 C ATOM 1866 O ASP A 122 4.307 28.613 3.322 1.00 21.46 O ATOM 1867 CB ASP A 122 3.860 31.846 2.895 1.00 23.63 C ATOM 1868 CG ASP A 122 4.831 31.706 4.052 1.00 24.02 C ATOM 1869 OD1 ASP A 122 6.032 31.986 3.855 1.00 24.14 O ATOM 1870 OD2 ASP A 122 4.389 31.318 5.154 1.00 24.29 O ATOM 0 H ASP A 122 2.282 31.610 0.998 1.00 22.05 H new ATOM 0 HA ASP A 122 4.750 30.400 1.585 1.00 22.30 H new ATOM 0 HB2 ASP A 122 4.167 32.681 2.265 1.00 23.63 H new ATOM 0 HB3 ASP A 122 2.870 32.086 3.282 1.00 23.63 H new ATOM 1875 N GLU A 123 2.145 29.240 3.244 1.00 22.03 N ATOM 1876 CA GLU A 123 1.681 28.134 4.072 1.00 21.74 C ATOM 1877 C GLU A 123 2.062 26.804 3.437 1.00 20.39 C ATOM 1878 O GLU A 123 2.544 25.897 4.115 1.00 20.02 O ATOM 1879 CB GLU A 123 0.166 28.210 4.269 1.00 22.27 C ATOM 1880 CG GLU A 123 -0.279 29.389 5.118 1.00 23.66 C ATOM 1881 CD GLU A 123 0.260 29.325 6.533 1.00 24.40 C ATOM 1882 OE1 GLU A 123 -0.384 28.678 7.386 1.00 24.74 O ATOM 1883 OE2 GLU A 123 1.327 29.923 6.789 1.00 24.71 O ATOM 0 H GLU A 123 1.408 29.875 2.937 1.00 22.03 H new ATOM 0 HA GLU A 123 2.161 28.208 5.048 1.00 21.74 H new ATOM 0 HB2 GLU A 123 -0.316 28.273 3.293 1.00 22.27 H new ATOM 0 HB3 GLU A 123 -0.178 27.287 4.735 1.00 22.27 H new ATOM 0 HG2 GLU A 123 0.052 30.315 4.649 1.00 23.66 H new ATOM 0 HG3 GLU A 123 -1.368 29.419 5.149 1.00 23.66 H new ATOM 1890 N MET A 124 1.839 26.695 2.129 1.00 19.71 N ATOM 1891 CA MET A 124 2.178 25.480 1.399 1.00 18.41 C ATOM 1892 C MET A 124 3.661 25.164 1.558 1.00 17.96 C ATOM 1893 O MET A 124 4.053 24.002 1.664 1.00 17.13 O ATOM 1894 CB MET A 124 1.827 25.632 -0.084 1.00 17.97 C ATOM 1895 CG MET A 124 2.323 24.487 -0.952 1.00 16.63 C ATOM 1896 SD MET A 124 1.765 24.615 -2.662 1.00 16.29 S ATOM 1897 CE MET A 124 2.627 26.093 -3.191 1.00 17.07 C ATOM 0 H MET A 124 1.426 27.432 1.556 1.00 19.71 H new ATOM 0 HA MET A 124 1.597 24.655 1.812 1.00 18.41 H new ATOM 0 HB2 MET A 124 0.745 25.710 -0.185 1.00 17.97 H new ATOM 0 HB3 MET A 124 2.250 26.566 -0.454 1.00 17.97 H new ATOM 0 HG2 MET A 124 3.413 24.466 -0.931 1.00 16.63 H new ATOM 0 HG3 MET A 124 1.978 23.542 -0.532 1.00 16.63 H new ATOM 0 HE1 MET A 124 2.573 26.177 -4.276 1.00 17.07 H new ATOM 0 HE2 MET A 124 2.163 26.968 -2.736 1.00 17.07 H new ATOM 0 HE3 MET A 124 3.671 26.035 -2.883 1.00 17.07 H new ATOM 1907 N ILE A 125 4.479 26.213 1.577 1.00 18.60 N ATOM 1908 CA ILE A 125 5.918 26.060 1.736 1.00 18.41 C ATOM 1909 C ILE A 125 6.245 25.525 3.123 1.00 18.72 C ATOM 1910 O ILE A 125 7.099 24.655 3.279 1.00 18.18 O ATOM 1911 CB ILE A 125 6.647 27.401 1.525 1.00 19.25 C ATOM 1912 CG1 ILE A 125 6.412 27.908 0.099 1.00 19.04 C ATOM 1913 CG2 ILE A 125 8.137 27.255 1.809 1.00 19.27 C ATOM 1914 CD1 ILE A 125 7.097 29.225 -0.204 1.00 19.95 C ATOM 0 H ILE A 125 4.167 27.179 1.484 1.00 18.60 H new ATOM 0 HA ILE A 125 6.259 25.352 0.981 1.00 18.41 H new ATOM 0 HB ILE A 125 6.243 28.132 2.225 1.00 19.25 H new ATOM 0 HG12 ILE A 125 6.764 27.156 -0.607 1.00 19.04 H new ATOM 0 HG13 ILE A 125 5.340 28.021 -0.064 1.00 19.04 H new ATOM 0 HG21 ILE A 125 8.633 28.213 1.654 1.00 19.27 H new ATOM 0 HG22 ILE A 125 8.281 26.935 2.841 1.00 19.27 H new ATOM 0 HG23 ILE A 125 8.565 26.512 1.136 1.00 19.27 H new ATOM 0 HD11 ILE A 125 6.884 29.518 -1.232 1.00 19.95 H new ATOM 0 HD12 ILE A 125 6.727 29.992 0.476 1.00 19.95 H new ATOM 0 HD13 ILE A 125 8.174 29.113 -0.075 1.00 19.95 H new ATOM 1926 N ARG A 126 5.556 26.059 4.126 1.00 19.67 N ATOM 1927 CA ARG A 126 5.754 25.645 5.509 1.00 20.18 C ATOM 1928 C ARG A 126 5.466 24.155 5.679 1.00 19.36 C ATOM 1929 O ARG A 126 6.142 23.465 6.441 1.00 19.42 O ATOM 1930 CB ARG A 126 4.850 26.462 6.434 1.00 21.37 C ATOM 1931 CG ARG A 126 4.901 26.023 7.889 1.00 22.05 C ATOM 1932 CD ARG A 126 3.879 26.772 8.729 1.00 22.88 C ATOM 1933 NE ARG A 126 3.814 26.264 10.097 1.00 23.53 N ATOM 1934 CZ ARG A 126 3.228 26.916 11.097 1.00 24.32 C ATOM 1935 NH1 ARG A 126 2.673 28.102 10.887 1.00 24.55 N ATOM 1936 NH2 ARG A 126 3.199 26.381 12.310 1.00 24.95 N ATOM 0 H ARG A 126 4.850 26.785 4.004 1.00 19.67 H new ATOM 0 HA ARG A 126 6.796 25.824 5.774 1.00 20.18 H new ATOM 0 HB2 ARG A 126 5.136 27.512 6.371 1.00 21.37 H new ATOM 0 HB3 ARG A 126 3.822 26.390 6.078 1.00 21.37 H new ATOM 0 HG2 ARG A 126 4.713 24.951 7.954 1.00 22.05 H new ATOM 0 HG3 ARG A 126 5.900 26.196 8.288 1.00 22.05 H new ATOM 0 HD2 ARG A 126 4.133 27.832 8.748 1.00 22.88 H new ATOM 0 HD3 ARG A 126 2.897 26.688 8.264 1.00 22.88 H new ATOM 0 HE ARG A 126 4.242 25.360 10.296 1.00 23.53 H new ATOM 0 HH11 ARG A 126 2.695 28.517 9.956 1.00 24.55 H new ATOM 0 HH12 ARG A 126 2.225 28.599 11.657 1.00 24.55 H new ATOM 0 HH21 ARG A 126 3.626 25.470 12.476 1.00 24.95 H new ATOM 0 HH22 ARG A 126 2.750 26.881 13.077 1.00 24.95 H new ATOM 1950 N GLU A 127 4.456 23.670 4.963 1.00 18.69 N ATOM 1951 CA GLU A 127 4.069 22.265 5.033 1.00 17.91 C ATOM 1952 C GLU A 127 5.182 21.356 4.519 1.00 16.85 C ATOM 1953 O GLU A 127 5.356 20.238 5.006 1.00 16.48 O ATOM 1954 CB GLU A 127 2.789 22.030 4.228 1.00 17.50 C ATOM 1955 CG GLU A 127 1.554 22.658 4.852 1.00 18.61 C ATOM 1956 CD GLU A 127 0.300 22.411 4.038 1.00 18.51 C ATOM 1957 OE1 GLU A 127 -0.303 21.327 4.190 1.00 18.51 O ATOM 1958 OE2 GLU A 127 -0.080 23.299 3.248 1.00 18.54 O ATOM 0 H GLU A 127 3.890 24.231 4.326 1.00 18.69 H new ATOM 0 HA GLU A 127 3.887 22.019 6.079 1.00 17.91 H new ATOM 0 HB2 GLU A 127 2.923 22.432 3.224 1.00 17.50 H new ATOM 0 HB3 GLU A 127 2.627 20.957 4.123 1.00 17.50 H new ATOM 0 HG2 GLU A 127 1.415 22.258 5.856 1.00 18.61 H new ATOM 0 HG3 GLU A 127 1.710 23.732 4.956 1.00 18.61 H new ATOM 1965 N ALA A 128 5.935 21.839 3.536 1.00 16.47 N ATOM 1966 CA ALA A 128 7.027 21.063 2.959 1.00 15.57 C ATOM 1967 C ALA A 128 8.362 21.424 3.600 1.00 16.23 C ATOM 1968 O ALA A 128 9.334 20.677 3.493 1.00 15.78 O ATOM 1969 CB ALA A 128 7.088 21.277 1.456 1.00 14.84 C ATOM 0 H ALA A 128 5.809 22.763 3.123 1.00 16.47 H new ATOM 0 HA ALA A 128 6.833 20.009 3.160 1.00 15.57 H new ATOM 0 HB1 ALA A 128 7.907 20.692 1.038 1.00 14.84 H new ATOM 0 HB2 ALA A 128 6.148 20.959 1.005 1.00 14.84 H new ATOM 0 HB3 ALA A 128 7.252 22.334 1.245 1.00 14.84 H new ATOM 1975 N ASP A 129 8.401 22.571 4.267 1.00 17.37 N ATOM 1976 CA ASP A 129 9.617 23.033 4.923 1.00 18.16 C ATOM 1977 C ASP A 129 9.633 22.614 6.388 1.00 18.88 C ATOM 1978 O ASP A 129 8.993 23.240 7.233 1.00 19.74 O ATOM 1979 CB ASP A 129 9.739 24.552 4.800 1.00 19.04 C ATOM 1980 CG ASP A 129 10.923 25.107 5.567 1.00 19.91 C ATOM 1981 OD1 ASP A 129 11.995 24.467 5.546 1.00 20.17 O ATOM 1982 OD2 ASP A 129 10.777 26.178 6.192 1.00 20.40 O ATOM 0 H ASP A 129 7.603 23.199 4.368 1.00 17.37 H new ATOM 0 HA ASP A 129 10.472 22.572 4.428 1.00 18.16 H new ATOM 0 HB2 ASP A 129 9.834 24.821 3.748 1.00 19.04 H new ATOM 0 HB3 ASP A 129 8.824 25.017 5.166 1.00 19.04 H new ATOM 1987 N PHE A 130 10.372 21.548 6.679 1.00 18.61 N ATOM 1988 CA PHE A 130 10.470 21.028 8.038 1.00 19.35 C ATOM 1989 C PHE A 130 11.552 21.751 8.836 1.00 20.46 C ATOM 1990 O PHE A 130 11.348 22.095 10.000 1.00 21.43 O ATOM 1991 CB PHE A 130 10.767 19.527 8.009 1.00 18.69 C ATOM 1992 CG PHE A 130 9.647 18.704 7.438 1.00 17.66 C ATOM 1993 CD1 PHE A 130 9.519 18.547 6.068 1.00 17.07 C ATOM 1994 CD2 PHE A 130 8.725 18.090 8.270 1.00 17.35 C ATOM 1995 CE1 PHE A 130 8.491 17.791 5.537 1.00 16.17 C ATOM 1996 CE2 PHE A 130 7.695 17.333 7.745 1.00 16.46 C ATOM 1997 CZ PHE A 130 7.575 17.180 6.387 1.00 15.86 C ATOM 0 H PHE A 130 10.913 21.026 5.989 1.00 18.61 H new ATOM 0 HA PHE A 130 9.512 21.201 8.529 1.00 19.35 H new ATOM 0 HB2 PHE A 130 11.669 19.355 7.422 1.00 18.69 H new ATOM 0 HB3 PHE A 130 10.977 19.187 9.023 1.00 18.69 H new ATOM 0 HD1 PHE A 130 10.230 19.020 5.407 1.00 17.07 H new ATOM 0 HD2 PHE A 130 8.812 18.204 9.340 1.00 17.35 H new ATOM 0 HE1 PHE A 130 8.399 17.675 4.467 1.00 16.17 H new ATOM 0 HE2 PHE A 130 6.983 16.861 8.405 1.00 16.46 H new ATOM 0 HZ PHE A 130 6.771 16.586 5.979 1.00 15.86 H new ATOM 2007 N ASP A 131 12.700 21.980 8.204 1.00 20.37 N ATOM 2008 CA ASP A 131 13.812 22.657 8.862 1.00 21.43 C ATOM 2009 C ASP A 131 13.405 24.057 9.310 1.00 22.32 C ATOM 2010 O ASP A 131 13.993 24.620 10.234 1.00 23.37 O ATOM 2011 CB ASP A 131 15.020 22.734 7.927 1.00 21.16 C ATOM 2012 CG ASP A 131 14.753 23.590 6.705 1.00 20.32 C ATOM 2013 OD1 ASP A 131 14.967 24.816 6.784 1.00 20.09 O ATOM 2014 OD2 ASP A 131 14.332 23.034 5.669 1.00 19.96 O ATOM 0 H ASP A 131 12.884 21.707 7.239 1.00 20.37 H new ATOM 0 HA ASP A 131 14.087 22.079 9.744 1.00 21.43 H new ATOM 0 HB2 ASP A 131 15.872 23.140 8.472 1.00 21.16 H new ATOM 0 HB3 ASP A 131 15.295 21.728 7.609 1.00 21.16 H new ATOM 2019 N GLY A 132 12.397 24.613 8.648 1.00 21.94 N ATOM 2020 CA GLY A 132 11.920 25.939 8.993 1.00 22.81 C ATOM 2021 C GLY A 132 12.942 27.024 8.713 1.00 23.39 C ATOM 2022 O GLY A 132 13.606 27.510 9.629 1.00 24.32 O ATOM 0 H GLY A 132 11.900 24.168 7.876 1.00 21.94 H new ATOM 0 HA2 GLY A 132 11.010 26.150 8.431 1.00 22.81 H new ATOM 0 HA3 GLY A 132 11.654 25.961 10.050 1.00 22.81 H new ATOM 2026 N ASP A 133 13.071 27.403 7.444 1.00 22.90 N ATOM 2027 CA ASP A 133 14.016 28.442 7.048 1.00 23.47 C ATOM 2028 C ASP A 133 13.372 29.421 6.071 1.00 23.33 C ATOM 2029 O ASP A 133 13.765 30.585 5.995 1.00 23.88 O ATOM 2030 CB ASP A 133 15.261 27.817 6.414 1.00 23.07 C ATOM 2031 CG ASP A 133 14.978 27.211 5.053 1.00 21.88 C ATOM 2032 OD1 ASP A 133 14.000 26.443 4.935 1.00 21.33 O ATOM 2033 OD2 ASP A 133 15.737 27.503 4.106 1.00 21.56 O ATOM 0 H ASP A 133 12.533 27.006 6.673 1.00 22.90 H new ATOM 0 HA ASP A 133 14.309 28.989 7.944 1.00 23.47 H new ATOM 0 HB2 ASP A 133 16.035 28.578 6.315 1.00 23.07 H new ATOM 0 HB3 ASP A 133 15.654 27.046 7.077 1.00 23.07 H new ATOM 2038 N GLY A 134 12.380 28.942 5.326 1.00 22.67 N ATOM 2039 CA GLY A 134 11.695 29.789 4.365 1.00 22.60 C ATOM 2040 C GLY A 134 12.133 29.526 2.937 1.00 21.81 C ATOM 2041 O GLY A 134 11.839 30.313 2.037 1.00 21.94 O ATOM 0 H GLY A 134 12.038 27.982 5.371 1.00 22.67 H new ATOM 0 HA2 GLY A 134 10.620 29.628 4.446 1.00 22.60 H new ATOM 0 HA3 GLY A 134 11.881 30.835 4.611 1.00 22.60 H new ATOM 2045 N MET A 135 12.836 28.417 2.728 1.00 21.09 N ATOM 2046 CA MET A 135 13.311 28.051 1.399 1.00 20.37 C ATOM 2047 C MET A 135 13.012 26.586 1.108 1.00 19.18 C ATOM 2048 O MET A 135 12.906 25.772 2.026 1.00 19.03 O ATOM 2049 CB MET A 135 14.814 28.313 1.276 1.00 20.92 C ATOM 2050 CG MET A 135 15.212 29.741 1.615 1.00 22.12 C ATOM 2051 SD MET A 135 16.952 30.076 1.282 1.00 22.91 S ATOM 2052 CE MET A 135 16.997 29.893 -0.498 1.00 22.22 C ATOM 0 H MET A 135 13.089 27.756 3.463 1.00 21.09 H new ATOM 0 HA MET A 135 12.786 28.667 0.669 1.00 20.37 H new ATOM 0 HB2 MET A 135 15.349 27.629 1.935 1.00 20.92 H new ATOM 0 HB3 MET A 135 15.132 28.088 0.258 1.00 20.92 H new ATOM 0 HG2 MET A 135 14.596 30.432 1.039 1.00 22.12 H new ATOM 0 HG3 MET A 135 15.005 29.931 2.668 1.00 22.12 H new ATOM 0 HE1 MET A 135 17.504 28.963 -0.755 1.00 22.22 H new ATOM 0 HE2 MET A 135 15.979 29.872 -0.887 1.00 22.22 H new ATOM 0 HE3 MET A 135 17.536 30.733 -0.937 1.00 22.22 H new ATOM 2062 N ILE A 136 12.878 26.255 -0.172 1.00 18.41 N ATOM 2063 CA ILE A 136 12.582 24.885 -0.573 1.00 17.25 C ATOM 2064 C ILE A 136 13.722 24.265 -1.367 1.00 16.93 C ATOM 2065 O ILE A 136 14.412 24.941 -2.127 1.00 17.36 O ATOM 2066 CB ILE A 136 11.295 24.805 -1.422 1.00 16.55 C ATOM 2067 CG1 ILE A 136 10.082 25.256 -0.601 1.00 16.94 C ATOM 2068 CG2 ILE A 136 11.088 23.388 -1.958 1.00 15.33 C ATOM 2069 CD1 ILE A 136 9.788 24.372 0.595 1.00 16.79 C ATOM 0 H ILE A 136 12.969 26.913 -0.946 1.00 18.41 H new ATOM 0 HA ILE A 136 12.444 24.327 0.353 1.00 17.25 H new ATOM 0 HB ILE A 136 11.403 25.477 -2.273 1.00 16.55 H new ATOM 0 HG12 ILE A 136 10.249 26.276 -0.255 1.00 16.94 H new ATOM 0 HG13 ILE A 136 9.205 25.279 -1.248 1.00 16.94 H new ATOM 0 HG21 ILE A 136 10.176 23.354 -2.553 1.00 15.33 H new ATOM 0 HG22 ILE A 136 11.938 23.106 -2.580 1.00 15.33 H new ATOM 0 HG23 ILE A 136 11.003 22.692 -1.123 1.00 15.33 H new ATOM 0 HD11 ILE A 136 8.916 24.755 1.125 1.00 16.79 H new ATOM 0 HD12 ILE A 136 9.588 23.356 0.256 1.00 16.79 H new ATOM 0 HD13 ILE A 136 10.648 24.368 1.265 1.00 16.79 H new ATOM 2081 N ASN A 137 13.904 22.967 -1.172 1.00 16.28 N ATOM 2082 CA ASN A 137 14.921 22.207 -1.878 1.00 16.03 C ATOM 2083 C ASN A 137 14.246 21.102 -2.679 1.00 14.85 C ATOM 2084 O ASN A 137 13.119 20.722 -2.365 1.00 14.21 O ATOM 2085 CB ASN A 137 15.945 21.618 -0.904 1.00 16.50 C ATOM 2086 CG ASN A 137 15.310 21.129 0.382 1.00 16.54 C ATOM 2087 OD1 ASN A 137 14.866 19.986 0.474 1.00 16.44 O ATOM 2088 ND2 ASN A 137 15.271 21.996 1.386 1.00 16.82 N ATOM 0 H ASN A 137 13.350 22.412 -0.519 1.00 16.28 H new ATOM 0 HA ASN A 137 15.459 22.872 -2.553 1.00 16.03 H new ATOM 0 HB2 ASN A 137 16.465 20.790 -1.386 1.00 16.50 H new ATOM 0 HB3 ASN A 137 16.695 22.373 -0.670 1.00 16.50 H new ATOM 0 HD21 ASN A 137 14.860 21.724 2.279 1.00 16.82 H new ATOM 0 HD22 ASN A 137 15.652 22.934 1.264 1.00 16.82 H new ATOM 2095 N TYR A 138 14.910 20.611 -3.721 1.00 14.65 N ATOM 2096 CA TYR A 138 14.350 19.553 -4.564 1.00 13.62 C ATOM 2097 C TYR A 138 13.611 18.490 -3.740 1.00 12.81 C ATOM 2098 O TYR A 138 12.716 17.815 -4.249 1.00 11.86 O ATOM 2099 CB TYR A 138 15.460 18.896 -5.388 1.00 13.81 C ATOM 2100 CG TYR A 138 14.998 17.704 -6.196 1.00 12.91 C ATOM 2101 CD1 TYR A 138 14.205 17.869 -7.325 1.00 12.17 C ATOM 2102 CD2 TYR A 138 15.356 16.413 -5.830 1.00 12.92 C ATOM 2103 CE1 TYR A 138 13.780 16.781 -8.064 1.00 11.46 C ATOM 2104 CE2 TYR A 138 14.936 15.320 -6.563 1.00 12.20 C ATOM 2105 CZ TYR A 138 14.149 15.509 -7.679 1.00 11.46 C ATOM 2106 OH TYR A 138 13.729 14.423 -8.413 1.00 10.87 O ATOM 0 H TYR A 138 15.837 20.927 -4.004 1.00 14.65 H new ATOM 0 HA TYR A 138 13.623 20.017 -5.231 1.00 13.62 H new ATOM 0 HB2 TYR A 138 15.885 19.638 -6.064 1.00 13.81 H new ATOM 0 HB3 TYR A 138 16.259 18.580 -4.717 1.00 13.81 H new ATOM 0 HD1 TYR A 138 13.916 18.864 -7.630 1.00 12.17 H new ATOM 0 HD2 TYR A 138 15.974 16.261 -4.957 1.00 12.92 H new ATOM 0 HE1 TYR A 138 13.162 16.926 -8.938 1.00 11.46 H new ATOM 0 HE2 TYR A 138 15.223 14.323 -6.263 1.00 12.20 H new ATOM 0 HH TYR A 138 14.076 13.601 -8.009 1.00 10.87 H new ATOM 2116 N GLU A 139 13.967 18.364 -2.464 1.00 13.28 N ATOM 2117 CA GLU A 139 13.340 17.372 -1.594 1.00 12.75 C ATOM 2118 C GLU A 139 11.992 17.868 -1.073 1.00 12.57 C ATOM 2119 O GLU A 139 10.964 17.212 -1.261 1.00 11.70 O ATOM 2120 CB GLU A 139 14.261 17.035 -0.420 1.00 13.59 C ATOM 2121 CG GLU A 139 15.629 16.528 -0.846 1.00 13.94 C ATOM 2122 CD GLU A 139 16.569 16.327 0.326 1.00 14.48 C ATOM 2123 OE1 GLU A 139 17.221 17.308 0.739 1.00 14.82 O ATOM 2124 OE2 GLU A 139 16.653 15.187 0.832 1.00 14.68 O ATOM 0 H GLU A 139 14.682 18.933 -2.011 1.00 13.28 H new ATOM 0 HA GLU A 139 13.169 16.471 -2.184 1.00 12.75 H new ATOM 0 HB2 GLU A 139 14.388 17.924 0.198 1.00 13.59 H new ATOM 0 HB3 GLU A 139 13.781 16.280 0.203 1.00 13.59 H new ATOM 0 HG2 GLU A 139 15.512 15.584 -1.379 1.00 13.94 H new ATOM 0 HG3 GLU A 139 16.073 17.236 -1.545 1.00 13.94 H new ATOM 2131 N GLU A 140 12.001 19.030 -0.424 1.00 13.49 N ATOM 2132 CA GLU A 140 10.776 19.607 0.122 1.00 13.65 C ATOM 2133 C GLU A 140 9.768 19.866 -0.994 1.00 13.01 C ATOM 2134 O GLU A 140 8.561 19.728 -0.799 1.00 12.80 O ATOM 2135 CB GLU A 140 11.083 20.903 0.880 1.00 14.90 C ATOM 2136 CG GLU A 140 12.065 20.719 2.027 1.00 15.69 C ATOM 2137 CD GLU A 140 12.502 22.037 2.638 1.00 16.90 C ATOM 2138 OE1 GLU A 140 12.846 22.958 1.872 1.00 17.35 O ATOM 2139 OE2 GLU A 140 12.499 22.146 3.881 1.00 17.46 O ATOM 0 H GLU A 140 12.840 19.588 -0.264 1.00 13.49 H new ATOM 0 HA GLU A 140 10.341 18.895 0.823 1.00 13.65 H new ATOM 0 HB2 GLU A 140 11.486 21.636 0.181 1.00 14.90 H new ATOM 0 HB3 GLU A 140 10.153 21.314 1.272 1.00 14.90 H new ATOM 0 HG2 GLU A 140 11.606 20.100 2.798 1.00 15.69 H new ATOM 0 HG3 GLU A 140 12.942 20.181 1.667 1.00 15.69 H new ATOM 2146 N PHE A 141 10.277 20.239 -2.164 1.00 12.87 N ATOM 2147 CA PHE A 141 9.430 20.502 -3.322 1.00 12.46 C ATOM 2148 C PHE A 141 8.713 19.226 -3.748 1.00 11.27 C ATOM 2149 O PHE A 141 7.488 19.192 -3.855 1.00 11.00 O ATOM 2150 CB PHE A 141 10.274 21.045 -4.479 1.00 12.80 C ATOM 2151 CG PHE A 141 9.506 21.222 -5.758 1.00 12.57 C ATOM 2152 CD1 PHE A 141 8.704 22.333 -5.951 1.00 12.93 C ATOM 2153 CD2 PHE A 141 9.592 20.279 -6.767 1.00 12.17 C ATOM 2154 CE1 PHE A 141 8.003 22.502 -7.128 1.00 12.93 C ATOM 2155 CE2 PHE A 141 8.891 20.440 -7.946 1.00 12.17 C ATOM 2156 CZ PHE A 141 8.080 21.544 -8.119 1.00 12.56 C ATOM 0 H PHE A 141 11.274 20.366 -2.335 1.00 12.87 H new ATOM 0 HA PHE A 141 8.684 21.249 -3.050 1.00 12.46 H new ATOM 0 HB2 PHE A 141 10.701 22.004 -4.186 1.00 12.80 H new ATOM 0 HB3 PHE A 141 11.108 20.367 -4.658 1.00 12.80 H new ATOM 0 HD1 PHE A 141 8.626 23.077 -5.172 1.00 12.93 H new ATOM 0 HD2 PHE A 141 10.215 19.407 -6.631 1.00 12.17 H new ATOM 0 HE1 PHE A 141 7.395 23.383 -7.273 1.00 12.93 H new ATOM 0 HE2 PHE A 141 8.977 19.704 -8.731 1.00 12.17 H new ATOM 0 HZ PHE A 141 7.507 21.658 -9.027 1.00 12.56 H new ATOM 2166 N VAL A 142 9.500 18.183 -3.994 1.00 10.70 N ATOM 2167 CA VAL A 142 8.973 16.884 -4.397 1.00 9.58 C ATOM 2168 C VAL A 142 7.817 16.437 -3.500 1.00 9.23 C ATOM 2169 O VAL A 142 6.849 15.831 -3.969 1.00 8.50 O ATOM 2170 CB VAL A 142 10.091 15.815 -4.366 1.00 9.36 C ATOM 2171 CG1 VAL A 142 9.523 14.419 -4.139 1.00 8.32 C ATOM 2172 CG2 VAL A 142 10.901 15.860 -5.650 1.00 9.69 C ATOM 0 H VAL A 142 10.517 18.214 -3.920 1.00 10.70 H new ATOM 0 HA VAL A 142 8.595 16.991 -5.414 1.00 9.58 H new ATOM 0 HB VAL A 142 10.749 16.044 -3.527 1.00 9.36 H new ATOM 0 HG11 VAL A 142 10.336 13.693 -4.123 1.00 8.32 H new ATOM 0 HG12 VAL A 142 8.994 14.392 -3.186 1.00 8.32 H new ATOM 0 HG13 VAL A 142 8.832 14.172 -4.945 1.00 8.32 H new ATOM 0 HG21 VAL A 142 11.684 15.102 -5.613 1.00 9.69 H new ATOM 0 HG22 VAL A 142 10.247 15.665 -6.500 1.00 9.69 H new ATOM 0 HG23 VAL A 142 11.355 16.845 -5.760 1.00 9.69 H new ATOM 2182 N TRP A 143 7.916 16.743 -2.213 1.00 9.94 N ATOM 2183 CA TRP A 143 6.886 16.343 -1.261 1.00 9.97 C ATOM 2184 C TRP A 143 5.572 17.103 -1.454 1.00 10.29 C ATOM 2185 O TRP A 143 4.528 16.490 -1.649 1.00 9.82 O ATOM 2186 CB TRP A 143 7.377 16.538 0.174 1.00 10.95 C ATOM 2187 CG TRP A 143 6.374 16.101 1.194 1.00 11.20 C ATOM 2188 CD1 TRP A 143 6.193 14.843 1.694 1.00 10.93 C ATOM 2189 CD2 TRP A 143 5.403 16.928 1.826 1.00 11.97 C ATOM 2190 NE1 TRP A 143 5.160 14.844 2.602 1.00 11.51 N ATOM 2191 CE2 TRP A 143 4.660 16.117 2.700 1.00 12.15 C ATOM 2192 CE3 TRP A 143 5.097 18.281 1.731 1.00 12.67 C ATOM 2193 CZ2 TRP A 143 3.621 16.621 3.477 1.00 13.01 C ATOM 2194 CZ3 TRP A 143 4.066 18.785 2.501 1.00 13.49 C ATOM 2195 CH2 TRP A 143 3.339 17.956 3.364 1.00 13.66 C ATOM 0 H TRP A 143 8.693 17.263 -1.805 1.00 9.94 H new ATOM 0 HA TRP A 143 6.688 15.288 -1.448 1.00 9.97 H new ATOM 0 HB2 TRP A 143 8.301 15.978 0.316 1.00 10.95 H new ATOM 0 HB3 TRP A 143 7.615 17.590 0.332 1.00 10.95 H new ATOM 0 HD1 TRP A 143 6.775 13.976 1.417 1.00 10.93 H new ATOM 0 HE1 TRP A 143 4.822 14.032 3.118 1.00 11.51 H new ATOM 0 HE3 TRP A 143 5.655 18.926 1.068 1.00 12.67 H new ATOM 0 HZ2 TRP A 143 3.059 15.984 4.143 1.00 13.01 H new ATOM 0 HZ3 TRP A 143 3.817 19.834 2.436 1.00 13.49 H new ATOM 0 HH2 TRP A 143 2.539 18.379 3.953 1.00 13.66 H new ATOM 2206 N MET A 144 5.627 18.432 -1.411 1.00 11.22 N ATOM 2207 CA MET A 144 4.416 19.249 -1.531 1.00 11.83 C ATOM 2208 C MET A 144 3.726 19.106 -2.887 1.00 11.29 C ATOM 2209 O MET A 144 2.524 19.352 -2.996 1.00 11.65 O ATOM 2210 CB MET A 144 4.727 20.723 -1.258 1.00 13.01 C ATOM 2211 CG MET A 144 5.741 21.331 -2.209 1.00 13.05 C ATOM 2212 SD MET A 144 5.859 23.124 -2.033 1.00 14.50 S ATOM 2213 CE MET A 144 7.294 23.484 -3.044 1.00 14.50 C ATOM 0 H MET A 144 6.489 18.965 -1.295 1.00 11.22 H new ATOM 0 HA MET A 144 3.722 18.875 -0.778 1.00 11.83 H new ATOM 0 HB2 MET A 144 3.801 21.295 -1.317 1.00 13.01 H new ATOM 0 HB3 MET A 144 5.098 20.822 -0.238 1.00 13.01 H new ATOM 0 HG2 MET A 144 6.719 20.885 -2.027 1.00 13.05 H new ATOM 0 HG3 MET A 144 5.465 21.086 -3.235 1.00 13.05 H new ATOM 0 HE1 MET A 144 7.173 24.461 -3.512 1.00 14.50 H new ATOM 0 HE2 MET A 144 8.187 23.489 -2.419 1.00 14.50 H new ATOM 0 HE3 MET A 144 7.396 22.721 -3.816 1.00 14.50 H new ATOM 2223 N ILE A 145 4.467 18.708 -3.912 1.00 10.61 N ATOM 2224 CA ILE A 145 3.891 18.560 -5.247 1.00 10.28 C ATOM 2225 C ILE A 145 3.136 17.244 -5.412 1.00 9.33 C ATOM 2226 O ILE A 145 2.070 17.210 -6.028 1.00 9.45 O ATOM 2227 CB ILE A 145 4.969 18.654 -6.334 1.00 10.17 C ATOM 2228 CG1 ILE A 145 5.987 17.531 -6.157 1.00 9.32 C ATOM 2229 CG2 ILE A 145 5.645 20.014 -6.284 1.00 11.25 C ATOM 2230 CD1 ILE A 145 6.992 17.441 -7.282 1.00 9.30 C ATOM 0 H ILE A 145 5.460 18.483 -3.849 1.00 10.61 H new ATOM 0 HA ILE A 145 3.184 19.382 -5.360 1.00 10.28 H new ATOM 0 HB ILE A 145 4.502 18.542 -7.313 1.00 10.17 H new ATOM 0 HG12 ILE A 145 6.519 17.679 -5.217 1.00 9.32 H new ATOM 0 HG13 ILE A 145 5.458 16.582 -6.077 1.00 9.32 H new ATOM 0 HG21 ILE A 145 6.408 20.070 -7.060 1.00 11.25 H new ATOM 0 HG22 ILE A 145 4.903 20.795 -6.448 1.00 11.25 H new ATOM 0 HG23 ILE A 145 6.109 20.154 -5.308 1.00 11.25 H new ATOM 0 HD11 ILE A 145 7.683 16.621 -7.088 1.00 9.30 H new ATOM 0 HD12 ILE A 145 6.471 17.261 -8.222 1.00 9.30 H new ATOM 0 HD13 ILE A 145 7.548 18.376 -7.349 1.00 9.30 H new ATOM 2242 N SER A 146 3.688 16.161 -4.871 1.00 8.54 N ATOM 2243 CA SER A 146 3.052 14.851 -4.976 1.00 7.66 C ATOM 2244 C SER A 146 1.684 14.866 -4.308 1.00 8.22 C ATOM 2245 O SER A 146 0.873 13.958 -4.495 1.00 7.89 O ATOM 2246 CB SER A 146 3.933 13.775 -4.338 1.00 6.98 C ATOM 2247 OG SER A 146 4.169 14.055 -2.969 1.00 6.80 O ATOM 0 H SER A 146 4.570 16.164 -4.358 1.00 8.54 H new ATOM 0 HA SER A 146 2.923 14.619 -6.033 1.00 7.66 H new ATOM 0 HB2 SER A 146 3.452 12.802 -4.436 1.00 6.98 H new ATOM 0 HB3 SER A 146 4.883 13.716 -4.869 1.00 6.98 H new ATOM 0 HG SER A 146 4.202 15.025 -2.834 1.00 6.80 H new ATOM 2253 N GLN A 147 1.443 15.911 -3.532 1.00 9.26 N ATOM 2254 CA GLN A 147 0.191 16.065 -2.809 1.00 10.11 C ATOM 2255 C GLN A 147 -0.767 16.994 -3.551 1.00 11.05 C ATOM 2256 O GLN A 147 -1.971 16.984 -3.301 1.00 11.87 O ATOM 2257 CB GLN A 147 0.490 16.613 -1.418 1.00 10.77 C ATOM 2258 CG GLN A 147 1.776 16.056 -0.832 1.00 10.15 C ATOM 2259 CD GLN A 147 1.614 14.647 -0.297 1.00 9.47 C ATOM 2260 OE1 GLN A 147 1.259 14.448 0.864 1.00 10.00 O ATOM 2261 NE2 GLN A 147 1.880 13.656 -1.146 1.00 8.44 N ATOM 0 H GLN A 147 2.106 16.672 -3.386 1.00 9.26 H new ATOM 0 HA GLN A 147 -0.294 15.092 -2.729 1.00 10.11 H new ATOM 0 HB2 GLN A 147 0.559 17.700 -1.467 1.00 10.77 H new ATOM 0 HB3 GLN A 147 -0.340 16.376 -0.753 1.00 10.77 H new ATOM 0 HG2 GLN A 147 2.552 16.062 -1.598 1.00 10.15 H new ATOM 0 HG3 GLN A 147 2.116 16.708 -0.028 1.00 10.15 H new ATOM 0 HE21 GLN A 147 2.172 13.867 -2.100 1.00 8.44 H new ATOM 0 HE22 GLN A 147 1.792 12.686 -0.842 1.00 8.44 H new ATOM 2270 N LYS A 148 -0.221 17.798 -4.461 1.00 11.08 N ATOM 2271 CA LYS A 148 -1.029 18.730 -5.243 1.00 12.08 C ATOM 2272 C LYS A 148 -2.084 17.987 -6.058 1.00 12.24 C ATOM 2273 O LYS A 148 -1.762 17.550 -7.183 1.00 12.44 O ATOM 2274 CB LYS A 148 -0.138 19.557 -6.175 1.00 12.12 C ATOM 2275 CG LYS A 148 0.788 20.516 -5.444 1.00 12.94 C ATOM 2276 CD LYS A 148 1.692 21.269 -6.410 1.00 13.10 C ATOM 2277 CE LYS A 148 2.601 22.242 -5.678 1.00 13.06 C ATOM 2278 NZ LYS A 148 3.500 22.971 -6.615 1.00 13.68 N ATOM 2279 OXT LYS A 148 -3.224 17.850 -5.564 1.00 12.34 O ATOM 0 H LYS A 148 0.776 17.823 -4.675 1.00 11.08 H new ATOM 0 HA LYS A 148 -1.537 19.399 -4.549 1.00 12.08 H new ATOM 0 HB2 LYS A 148 0.462 18.881 -6.784 1.00 12.12 H new ATOM 0 HB3 LYS A 148 -0.770 20.125 -6.857 1.00 12.12 H new ATOM 0 HG2 LYS A 148 0.195 21.228 -4.870 1.00 12.94 H new ATOM 0 HG3 LYS A 148 1.398 19.961 -4.731 1.00 12.94 H new ATOM 0 HD2 LYS A 148 2.297 20.558 -6.973 1.00 13.10 H new ATOM 0 HD3 LYS A 148 1.082 21.812 -7.132 1.00 13.10 H new ATOM 0 HE2 LYS A 148 1.995 22.959 -5.124 1.00 13.06 H new ATOM 0 HE3 LYS A 148 3.201 21.700 -4.947 1.00 13.06 H new ATOM 0 HZ1 LYS A 148 4.375 23.238 -6.120 1.00 13.68 H new ATOM 0 HZ2 LYS A 148 3.732 22.357 -7.422 1.00 13.68 H new ATOM 0 HZ3 LYS A 148 3.022 23.828 -6.959 1.00 13.68 H new