USER MOD reduce.3.24.130724 H: found=0, std=0, add=1122, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1122 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 5 THR OG1 : rot 73:sc= 0.316 USER MOD Set 1.2: A 8 GLN : amide:sc= -6.07! C(o=-14!,f=-19!) USER MOD Set 1.3: A 41 GLN : amide:sc= -1.23 K(o=-14,f=-15) USER MOD Set 1.4: A 72 MET CE :methyl 168:sc= -6.93! (180deg=-7.49!) USER MOD Set 1.5: A 76 MET CE :methyl 141:sc= 0 (180deg=0) USER MOD Set 2.1: A 36 MET CE :methyl -138:sc= -2.51 (180deg=-4.22!) USER MOD Set 2.2: A 75 GLN : amide:sc= -2.8 K(o=-5.3,f=-7!) USER MOD Single : A 1 MET CE :methyl 152:sc= -0.182 (180deg=-0.901) USER MOD Single : A 1 MET N :NH3+ -120:sc= -1.4 (180deg=-1.82) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.105) USER MOD Single : A 18 GLN : amide:sc= -0.234 X(o=-0.23,f=-0.16) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -8:sc= 0.955! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -140:sc= -1.41 USER MOD Single : A 34 THR OG1 : rot 180:sc=0.000215 USER MOD Single : A 38 THR OG1 : rot 71:sc= 1.25 USER MOD Single : A 42 ASN : amide:sc= -4.41! K(o=-4.4!,f=-0.67) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -6.38! C(o=-6.4!,f=-3.2!) USER MOD Single : A 57 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 60 ASN : amide:sc= -0.212 K(o=-0.21,f=-2.9!) USER MOD Single : A 62 GLN : amide:sc= -7.6! K(o=-7.6!,f=-3.4) USER MOD Single : A 64 ASN : amide:sc= -1.13 K(o=-1.1,f=-4.4!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -46:sc= 0.622 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.0111 USER MOD Single : A 81 THR OG1 : rot 131:sc= -0.0914 USER MOD Single : A 85 MET CE :methyl -131:sc= -5.43! (180deg=-10.7!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= -1.43 USER MOD Single : A 109 MET CE :methyl 139:sc= -0.74 (180deg=-3.68!) USER MOD Single : A 111 ASN : amide:sc= -1.35! K(o=-1.4!,f=-0.15) USER MOD Single : A 115 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.54) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.0556 USER MOD Single : A 124 MET CE :methyl 151:sc= -0.27 (180deg=-1.55) USER MOD Single : A 135 MET CE :methyl -130:sc= -0.22 (180deg=-0.892) USER MOD Single : A 137 ASN : amide:sc= -2.56! C(o=-2.6!,f=-12!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.268 USER MOD Single : A 144 MET CE :methyl -163:sc= -1.8 (180deg=-2.66!) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 147 GLN : amide:sc= -2.7! K(o=-2.7!,f=-0.94) USER MOD Single : A 148 LYS NZ :NH3+ -171:sc= -0.0149 (180deg=-0.136) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.292 -6.131 7.429 1.00 1.05 N ATOM 2 CA MET A 1 11.672 -6.921 8.521 1.00 0.92 C ATOM 3 C MET A 1 11.662 -6.128 9.826 1.00 0.91 C ATOM 4 O MET A 1 12.694 -5.616 10.261 1.00 1.39 O ATOM 5 CB MET A 1 12.426 -8.241 8.707 1.00 1.18 C ATOM 6 CG MET A 1 13.889 -8.069 9.084 1.00 1.50 C ATOM 7 SD MET A 1 14.176 -8.243 10.857 1.00 1.72 S ATOM 8 CE MET A 1 13.730 -9.961 11.102 1.00 2.27 C ATOM 0 H1 MET A 1 11.602 -5.998 6.662 1.00 1.05 H new ATOM 0 H2 MET A 1 12.586 -5.203 7.796 1.00 1.05 H new ATOM 0 H3 MET A 1 13.123 -6.638 7.063 1.00 1.05 H new ATOM 0 HA MET A 1 10.640 -7.138 8.247 1.00 0.92 H new ATOM 0 HB2 MET A 1 11.928 -8.826 9.480 1.00 1.18 H new ATOM 0 HB3 MET A 1 12.365 -8.816 7.783 1.00 1.18 H new ATOM 0 HG2 MET A 1 14.487 -8.807 8.549 1.00 1.50 H new ATOM 0 HG3 MET A 1 14.231 -7.086 8.759 1.00 1.50 H new ATOM 0 HE1 MET A 1 14.285 -10.364 11.949 1.00 2.27 H new ATOM 0 HE2 MET A 1 12.661 -10.035 11.301 1.00 2.27 H new ATOM 0 HE3 MET A 1 13.972 -10.531 10.205 1.00 2.27 H new ATOM 20 N SER A 2 10.487 -6.026 10.441 1.00 0.85 N ATOM 21 CA SER A 2 10.338 -5.295 11.698 1.00 0.89 C ATOM 22 C SER A 2 8.943 -5.504 12.282 1.00 0.89 C ATOM 23 O SER A 2 8.797 -5.935 13.425 1.00 0.98 O ATOM 24 CB SER A 2 10.596 -3.803 11.482 1.00 0.92 C ATOM 25 OG SER A 2 10.380 -3.068 12.674 1.00 1.04 O ATOM 0 H SER A 2 9.623 -6.440 10.090 1.00 0.85 H new ATOM 0 HA SER A 2 11.072 -5.682 12.405 1.00 0.89 H new ATOM 0 HB2 SER A 2 11.620 -3.654 11.140 1.00 0.92 H new ATOM 0 HB3 SER A 2 9.940 -3.428 10.696 1.00 0.92 H new ATOM 0 HG SER A 2 10.553 -2.118 12.508 1.00 1.04 H new ATOM 31 N GLU A 3 7.924 -5.196 11.488 1.00 0.85 N ATOM 32 CA GLU A 3 6.540 -5.360 11.917 1.00 0.93 C ATOM 33 C GLU A 3 5.710 -5.952 10.789 1.00 0.95 C ATOM 34 O GLU A 3 4.479 -5.932 10.824 1.00 1.73 O ATOM 35 CB GLU A 3 5.949 -4.019 12.359 1.00 1.02 C ATOM 36 CG GLU A 3 6.678 -3.388 13.534 1.00 1.10 C ATOM 37 CD GLU A 3 6.057 -2.074 13.968 1.00 1.54 C ATOM 38 OE1 GLU A 3 5.112 -2.105 14.784 1.00 1.67 O ATOM 39 OE2 GLU A 3 6.517 -1.014 13.494 1.00 2.13 O ATOM 0 H GLU A 3 8.031 -4.831 10.542 1.00 0.85 H new ATOM 0 HA GLU A 3 6.521 -6.042 12.767 1.00 0.93 H new ATOM 0 HB2 GLU A 3 5.969 -3.328 11.517 1.00 1.02 H new ATOM 0 HB3 GLU A 3 4.903 -4.164 12.627 1.00 1.02 H new ATOM 0 HG2 GLU A 3 6.675 -4.082 14.374 1.00 1.10 H new ATOM 0 HG3 GLU A 3 7.720 -3.221 13.263 1.00 1.10 H new ATOM 46 N LEU A 4 6.404 -6.479 9.790 1.00 0.37 N ATOM 47 CA LEU A 4 5.758 -7.083 8.632 1.00 0.29 C ATOM 48 C LEU A 4 5.240 -8.478 8.963 1.00 0.32 C ATOM 49 O LEU A 4 5.148 -8.853 10.132 1.00 0.36 O ATOM 50 CB LEU A 4 6.741 -7.159 7.465 1.00 0.22 C ATOM 51 CG LEU A 4 7.281 -5.812 6.984 1.00 0.25 C ATOM 52 CD1 LEU A 4 8.518 -5.416 7.773 1.00 0.37 C ATOM 53 CD2 LEU A 4 7.595 -5.867 5.501 1.00 0.27 C ATOM 0 H LEU A 4 7.423 -6.500 9.758 1.00 0.37 H new ATOM 0 HA LEU A 4 4.910 -6.458 8.351 1.00 0.29 H new ATOM 0 HB2 LEU A 4 7.582 -7.786 7.759 1.00 0.22 H new ATOM 0 HB3 LEU A 4 6.250 -7.656 6.628 1.00 0.22 H new ATOM 0 HG LEU A 4 6.513 -5.057 7.149 1.00 0.25 H new ATOM 0 HD11 LEU A 4 8.886 -4.455 7.415 1.00 0.37 H new ATOM 0 HD12 LEU A 4 8.265 -5.336 8.830 1.00 0.37 H new ATOM 0 HD13 LEU A 4 9.291 -6.173 7.641 1.00 0.37 H new ATOM 0 HD21 LEU A 4 7.978 -4.900 5.174 1.00 0.27 H new ATOM 0 HD22 LEU A 4 8.345 -6.636 5.316 1.00 0.27 H new ATOM 0 HD23 LEU A 4 6.688 -6.104 4.946 1.00 0.27 H new ATOM 65 N THR A 5 4.900 -9.244 7.930 1.00 0.32 N ATOM 66 CA THR A 5 4.397 -10.595 8.125 1.00 0.37 C ATOM 67 C THR A 5 5.535 -11.605 8.051 1.00 0.37 C ATOM 68 O THR A 5 6.008 -12.101 9.075 1.00 0.39 O ATOM 69 CB THR A 5 3.332 -10.957 7.071 1.00 0.42 C ATOM 70 OG1 THR A 5 2.286 -9.979 7.076 1.00 0.91 O ATOM 71 CG2 THR A 5 2.743 -12.333 7.346 1.00 0.91 C ATOM 0 H THR A 5 4.964 -8.952 6.955 1.00 0.32 H new ATOM 0 HA THR A 5 3.939 -10.630 9.113 1.00 0.37 H new ATOM 0 HB THR A 5 3.813 -10.972 6.093 1.00 0.42 H new ATOM 0 HG1 THR A 5 2.613 -9.148 6.672 1.00 0.91 H new ATOM 0 HG21 THR A 5 1.994 -12.566 6.589 1.00 0.91 H new ATOM 0 HG22 THR A 5 3.535 -13.081 7.315 1.00 0.91 H new ATOM 0 HG23 THR A 5 2.277 -12.339 8.331 1.00 0.91 H new ATOM 79 N GLU A 6 5.977 -11.879 6.826 1.00 0.35 N ATOM 80 CA GLU A 6 7.063 -12.820 6.569 1.00 0.35 C ATOM 81 C GLU A 6 7.217 -13.018 5.070 1.00 0.34 C ATOM 82 O GLU A 6 8.332 -13.056 4.553 1.00 0.32 O ATOM 83 CB GLU A 6 6.802 -14.166 7.251 1.00 0.40 C ATOM 84 CG GLU A 6 8.055 -15.000 7.479 1.00 0.94 C ATOM 85 CD GLU A 6 8.700 -15.464 6.186 1.00 1.48 C ATOM 86 OE1 GLU A 6 8.150 -16.385 5.546 1.00 1.55 O ATOM 87 OE2 GLU A 6 9.754 -14.907 5.816 1.00 2.21 O ATOM 0 H GLU A 6 5.591 -11.454 5.983 1.00 0.35 H new ATOM 0 HA GLU A 6 7.983 -12.407 6.982 1.00 0.35 H new ATOM 0 HB2 GLU A 6 6.318 -13.987 8.211 1.00 0.40 H new ATOM 0 HB3 GLU A 6 6.102 -14.740 6.643 1.00 0.40 H new ATOM 0 HG2 GLU A 6 8.776 -14.414 8.049 1.00 0.94 H new ATOM 0 HG3 GLU A 6 7.801 -15.870 8.085 1.00 0.94 H new ATOM 94 N GLU A 7 6.091 -13.151 4.375 1.00 0.38 N ATOM 95 CA GLU A 7 6.118 -13.314 2.930 1.00 0.40 C ATOM 96 C GLU A 7 6.747 -12.078 2.304 1.00 0.35 C ATOM 97 O GLU A 7 7.654 -12.175 1.475 1.00 0.33 O ATOM 98 CB GLU A 7 4.704 -13.540 2.382 1.00 0.46 C ATOM 99 CG GLU A 7 3.703 -12.471 2.793 1.00 0.49 C ATOM 100 CD GLU A 7 2.306 -12.753 2.276 1.00 0.56 C ATOM 101 OE1 GLU A 7 1.537 -13.435 2.987 1.00 0.62 O ATOM 102 OE2 GLU A 7 1.981 -12.293 1.162 1.00 0.60 O ATOM 0 H GLU A 7 5.158 -13.149 4.787 1.00 0.38 H new ATOM 0 HA GLU A 7 6.713 -14.191 2.676 1.00 0.40 H new ATOM 0 HB2 GLU A 7 4.750 -13.581 1.294 1.00 0.46 H new ATOM 0 HB3 GLU A 7 4.344 -14.511 2.723 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.677 -12.401 3.880 1.00 0.49 H new ATOM 0 HG3 GLU A 7 4.036 -11.503 2.419 1.00 0.49 H new ATOM 109 N GLN A 8 6.260 -10.912 2.719 1.00 0.33 N ATOM 110 CA GLN A 8 6.787 -9.649 2.235 1.00 0.30 C ATOM 111 C GLN A 8 8.243 -9.518 2.639 1.00 0.24 C ATOM 112 O GLN A 8 9.061 -8.948 1.913 1.00 0.22 O ATOM 113 CB GLN A 8 5.983 -8.491 2.815 1.00 0.32 C ATOM 114 CG GLN A 8 5.719 -8.634 4.302 1.00 0.32 C ATOM 115 CD GLN A 8 4.750 -7.590 4.832 1.00 0.36 C ATOM 116 OE1 GLN A 8 3.978 -7.858 5.751 1.00 0.85 O ATOM 117 NE2 GLN A 8 4.786 -6.390 4.260 1.00 0.57 N ATOM 0 H GLN A 8 5.499 -10.820 3.392 1.00 0.33 H new ATOM 0 HA GLN A 8 6.710 -9.622 1.148 1.00 0.30 H new ATOM 0 HB2 GLN A 8 6.519 -7.559 2.635 1.00 0.32 H new ATOM 0 HB3 GLN A 8 5.031 -8.418 2.289 1.00 0.32 H new ATOM 0 HG2 GLN A 8 5.319 -9.628 4.501 1.00 0.32 H new ATOM 0 HG3 GLN A 8 6.662 -8.555 4.843 1.00 0.32 H new ATOM 0 HE21 GLN A 8 5.441 -6.207 3.500 1.00 0.57 H new ATOM 0 HE22 GLN A 8 4.159 -5.653 4.581 1.00 0.57 H new ATOM 126 N ILE A 9 8.558 -10.072 3.807 1.00 0.22 N ATOM 127 CA ILE A 9 9.909 -10.038 4.330 1.00 0.18 C ATOM 128 C ILE A 9 10.828 -10.793 3.396 1.00 0.17 C ATOM 129 O ILE A 9 11.917 -10.331 3.054 1.00 0.15 O ATOM 130 CB ILE A 9 9.987 -10.647 5.744 1.00 0.20 C ATOM 131 CG1 ILE A 9 9.123 -9.827 6.708 1.00 0.21 C ATOM 132 CG2 ILE A 9 11.434 -10.703 6.222 1.00 0.21 C ATOM 133 CD1 ILE A 9 9.145 -10.333 8.136 1.00 0.24 C ATOM 0 H ILE A 9 7.887 -10.551 4.408 1.00 0.22 H new ATOM 0 HA ILE A 9 10.220 -8.996 4.400 1.00 0.18 H new ATOM 0 HB ILE A 9 9.605 -11.667 5.715 1.00 0.20 H new ATOM 0 HG12 ILE A 9 9.464 -8.792 6.695 1.00 0.21 H new ATOM 0 HG13 ILE A 9 8.094 -9.828 6.348 1.00 0.21 H new ATOM 0 HG21 ILE A 9 11.470 -11.136 7.222 1.00 0.21 H new ATOM 0 HG22 ILE A 9 12.019 -11.318 5.539 1.00 0.21 H new ATOM 0 HG23 ILE A 9 11.848 -9.695 6.248 1.00 0.21 H new ATOM 0 HD11 ILE A 9 8.510 -9.700 8.756 1.00 0.24 H new ATOM 0 HD12 ILE A 9 8.775 -11.358 8.165 1.00 0.24 H new ATOM 0 HD13 ILE A 9 10.166 -10.305 8.516 1.00 0.24 H new ATOM 145 N ALA A 10 10.362 -11.958 2.979 1.00 0.20 N ATOM 146 CA ALA A 10 11.110 -12.803 2.064 1.00 0.21 C ATOM 147 C ALA A 10 11.208 -12.136 0.702 1.00 0.20 C ATOM 148 O ALA A 10 12.069 -12.470 -0.109 1.00 0.19 O ATOM 149 CB ALA A 10 10.435 -14.160 1.937 1.00 0.26 C ATOM 0 H ALA A 10 9.461 -12.343 3.263 1.00 0.20 H new ATOM 0 HA ALA A 10 12.116 -12.947 2.458 1.00 0.21 H new ATOM 0 HB1 ALA A 10 11.003 -14.786 1.249 1.00 0.26 H new ATOM 0 HB2 ALA A 10 10.395 -14.639 2.915 1.00 0.26 H new ATOM 0 HB3 ALA A 10 9.422 -14.028 1.556 1.00 0.26 H new ATOM 155 N GLU A 11 10.303 -11.191 0.462 1.00 0.20 N ATOM 156 CA GLU A 11 10.264 -10.470 -0.806 1.00 0.21 C ATOM 157 C GLU A 11 11.458 -9.543 -0.967 1.00 0.18 C ATOM 158 O GLU A 11 12.366 -9.840 -1.739 1.00 0.18 O ATOM 159 CB GLU A 11 8.984 -9.654 -0.930 1.00 0.25 C ATOM 160 CG GLU A 11 8.503 -9.487 -2.362 1.00 0.29 C ATOM 161 CD GLU A 11 8.240 -10.815 -3.048 1.00 0.94 C ATOM 162 OE1 GLU A 11 7.179 -11.419 -2.784 1.00 0.84 O ATOM 163 OE2 GLU A 11 9.096 -11.250 -3.846 1.00 1.78 O ATOM 0 H GLU A 11 9.586 -10.907 1.130 1.00 0.20 H new ATOM 0 HA GLU A 11 10.297 -11.223 -1.594 1.00 0.21 H new ATOM 0 HB2 GLU A 11 8.199 -10.135 -0.346 1.00 0.25 H new ATOM 0 HB3 GLU A 11 9.148 -8.669 -0.494 1.00 0.25 H new ATOM 0 HG2 GLU A 11 7.590 -8.892 -2.368 1.00 0.29 H new ATOM 0 HG3 GLU A 11 9.249 -8.931 -2.929 1.00 0.29 H new ATOM 170 N PHE A 12 11.470 -8.412 -0.249 1.00 0.17 N ATOM 171 CA PHE A 12 12.588 -7.485 -0.386 1.00 0.17 C ATOM 172 C PHE A 12 13.884 -8.195 -0.064 1.00 0.14 C ATOM 173 O PHE A 12 14.954 -7.798 -0.522 1.00 0.15 O ATOM 174 CB PHE A 12 12.421 -6.226 0.466 1.00 0.20 C ATOM 175 CG PHE A 12 11.919 -6.447 1.859 1.00 0.18 C ATOM 176 CD1 PHE A 12 10.563 -6.420 2.122 1.00 0.24 C ATOM 177 CD2 PHE A 12 12.799 -6.646 2.908 1.00 0.21 C ATOM 178 CE1 PHE A 12 10.089 -6.594 3.403 1.00 0.26 C ATOM 179 CE2 PHE A 12 12.331 -6.816 4.198 1.00 0.23 C ATOM 180 CZ PHE A 12 10.973 -6.789 4.445 1.00 0.21 C ATOM 0 H PHE A 12 10.744 -8.128 0.409 1.00 0.17 H new ATOM 0 HA PHE A 12 12.610 -7.147 -1.422 1.00 0.17 H new ATOM 0 HB2 PHE A 12 13.383 -5.718 0.523 1.00 0.20 H new ATOM 0 HB3 PHE A 12 11.734 -5.552 -0.045 1.00 0.20 H new ATOM 0 HD1 PHE A 12 9.866 -6.260 1.313 1.00 0.24 H new ATOM 0 HD2 PHE A 12 13.862 -6.669 2.717 1.00 0.21 H new ATOM 0 HE1 PHE A 12 9.026 -6.578 3.592 1.00 0.26 H new ATOM 0 HE2 PHE A 12 13.026 -6.970 5.010 1.00 0.23 H new ATOM 0 HZ PHE A 12 10.603 -6.920 5.451 1.00 0.21 H new ATOM 190 N LYS A 13 13.780 -9.243 0.739 1.00 0.12 N ATOM 191 CA LYS A 13 14.936 -10.049 1.071 1.00 0.12 C ATOM 192 C LYS A 13 15.471 -10.695 -0.198 1.00 0.13 C ATOM 193 O LYS A 13 16.647 -10.567 -0.527 1.00 0.16 O ATOM 194 CB LYS A 13 14.560 -11.131 2.085 1.00 0.14 C ATOM 195 CG LYS A 13 15.568 -12.267 2.160 1.00 0.24 C ATOM 196 CD LYS A 13 16.868 -11.825 2.815 1.00 1.07 C ATOM 197 CE LYS A 13 17.975 -12.846 2.603 1.00 1.30 C ATOM 198 NZ LYS A 13 17.568 -14.209 3.047 1.00 2.27 N ATOM 0 H LYS A 13 12.908 -9.551 1.170 1.00 0.12 H new ATOM 0 HA LYS A 13 15.702 -9.413 1.514 1.00 0.12 H new ATOM 0 HB2 LYS A 13 14.463 -10.676 3.071 1.00 0.14 H new ATOM 0 HB3 LYS A 13 13.583 -11.539 1.824 1.00 0.14 H new ATOM 0 HG2 LYS A 13 15.140 -13.096 2.724 1.00 0.24 H new ATOM 0 HG3 LYS A 13 15.774 -12.637 1.156 1.00 0.24 H new ATOM 0 HD2 LYS A 13 17.175 -10.863 2.404 1.00 1.07 H new ATOM 0 HD3 LYS A 13 16.707 -11.678 3.883 1.00 1.07 H new ATOM 0 HE2 LYS A 13 18.245 -12.874 1.547 1.00 1.30 H new ATOM 0 HE3 LYS A 13 18.864 -12.536 3.152 1.00 1.30 H new ATOM 0 HZ1 LYS A 13 18.403 -14.828 3.078 1.00 2.27 H new ATOM 0 HZ2 LYS A 13 17.143 -14.153 3.995 1.00 2.27 H new ATOM 0 HZ3 LYS A 13 16.873 -14.599 2.379 1.00 2.27 H new ATOM 212 N ASP A 14 14.578 -11.377 -0.914 1.00 0.14 N ATOM 213 CA ASP A 14 14.939 -12.051 -2.153 1.00 0.16 C ATOM 214 C ASP A 14 15.377 -11.040 -3.204 1.00 0.16 C ATOM 215 O ASP A 14 16.266 -11.318 -4.009 1.00 0.17 O ATOM 216 CB ASP A 14 13.761 -12.890 -2.674 1.00 0.19 C ATOM 217 CG ASP A 14 12.808 -12.107 -3.561 1.00 0.20 C ATOM 218 OD1 ASP A 14 13.204 -11.750 -4.688 1.00 0.22 O ATOM 219 OD2 ASP A 14 11.670 -11.838 -3.120 1.00 0.22 O ATOM 0 H ASP A 14 13.597 -11.475 -0.653 1.00 0.14 H new ATOM 0 HA ASP A 14 15.775 -12.720 -1.948 1.00 0.16 H new ATOM 0 HB2 ASP A 14 14.150 -13.741 -3.233 1.00 0.19 H new ATOM 0 HB3 ASP A 14 13.208 -13.292 -1.825 1.00 0.19 H new ATOM 224 N ALA A 15 14.751 -9.863 -3.190 1.00 0.16 N ATOM 225 CA ALA A 15 15.088 -8.816 -4.145 1.00 0.17 C ATOM 226 C ALA A 15 16.484 -8.276 -3.864 1.00 0.16 C ATOM 227 O ALA A 15 17.246 -7.965 -4.777 1.00 0.20 O ATOM 228 CB ALA A 15 14.063 -7.693 -4.080 1.00 0.20 C ATOM 0 H ALA A 15 14.013 -9.615 -2.531 1.00 0.16 H new ATOM 0 HA ALA A 15 15.075 -9.241 -5.149 1.00 0.17 H new ATOM 0 HB1 ALA A 15 14.327 -6.917 -4.799 1.00 0.20 H new ATOM 0 HB2 ALA A 15 13.075 -8.088 -4.318 1.00 0.20 H new ATOM 0 HB3 ALA A 15 14.051 -7.269 -3.076 1.00 0.20 H new ATOM 234 N PHE A 16 16.793 -8.155 -2.586 1.00 0.14 N ATOM 235 CA PHE A 16 18.084 -7.657 -2.141 1.00 0.14 C ATOM 236 C PHE A 16 19.245 -8.509 -2.657 1.00 0.14 C ATOM 237 O PHE A 16 20.168 -8.002 -3.294 1.00 0.15 O ATOM 238 CB PHE A 16 18.107 -7.646 -0.614 1.00 0.15 C ATOM 239 CG PHE A 16 19.235 -6.850 -0.038 1.00 0.25 C ATOM 240 CD1 PHE A 16 19.120 -5.481 0.114 1.00 0.35 C ATOM 241 CD2 PHE A 16 20.406 -7.471 0.355 1.00 0.45 C ATOM 242 CE1 PHE A 16 20.156 -4.741 0.650 1.00 0.50 C ATOM 243 CE2 PHE A 16 21.447 -6.739 0.890 1.00 0.59 C ATOM 244 CZ PHE A 16 21.322 -5.370 1.039 1.00 0.59 C ATOM 0 H PHE A 16 16.157 -8.399 -1.827 1.00 0.14 H new ATOM 0 HA PHE A 16 18.213 -6.652 -2.542 1.00 0.14 H new ATOM 0 HB2 PHE A 16 17.164 -7.241 -0.248 1.00 0.15 H new ATOM 0 HB3 PHE A 16 18.176 -8.672 -0.253 1.00 0.15 H new ATOM 0 HD1 PHE A 16 18.210 -4.984 -0.190 1.00 0.35 H new ATOM 0 HD2 PHE A 16 20.507 -8.540 0.242 1.00 0.45 H new ATOM 0 HE1 PHE A 16 20.054 -3.672 0.765 1.00 0.50 H new ATOM 0 HE2 PHE A 16 22.358 -7.235 1.192 1.00 0.59 H new ATOM 0 HZ PHE A 16 22.134 -4.794 1.458 1.00 0.59 H new ATOM 254 N VAL A 17 19.184 -9.809 -2.375 1.00 0.16 N ATOM 255 CA VAL A 17 20.242 -10.743 -2.764 1.00 0.18 C ATOM 256 C VAL A 17 20.436 -10.792 -4.268 1.00 0.16 C ATOM 257 O VAL A 17 21.561 -10.762 -4.765 1.00 0.15 O ATOM 258 CB VAL A 17 19.951 -12.179 -2.256 1.00 0.22 C ATOM 259 CG1 VAL A 17 19.031 -12.148 -1.055 1.00 0.31 C ATOM 260 CG2 VAL A 17 19.348 -13.060 -3.344 1.00 0.28 C ATOM 0 H VAL A 17 18.408 -10.243 -1.875 1.00 0.16 H new ATOM 0 HA VAL A 17 21.155 -10.369 -2.300 1.00 0.18 H new ATOM 0 HB VAL A 17 20.908 -12.611 -1.965 1.00 0.22 H new ATOM 0 HG11 VAL A 17 18.841 -13.166 -0.716 1.00 0.31 H new ATOM 0 HG12 VAL A 17 19.500 -11.580 -0.252 1.00 0.31 H new ATOM 0 HG13 VAL A 17 18.088 -11.675 -1.331 1.00 0.31 H new ATOM 0 HG21 VAL A 17 19.161 -14.056 -2.943 1.00 0.28 H new ATOM 0 HG22 VAL A 17 18.409 -12.624 -3.686 1.00 0.28 H new ATOM 0 HG23 VAL A 17 20.042 -13.130 -4.181 1.00 0.28 H new ATOM 270 N GLN A 18 19.328 -10.858 -4.983 1.00 0.17 N ATOM 271 CA GLN A 18 19.357 -10.952 -6.422 1.00 0.18 C ATOM 272 C GLN A 18 19.983 -9.704 -7.031 1.00 0.15 C ATOM 273 O GLN A 18 20.345 -9.687 -8.208 1.00 0.18 O ATOM 274 CB GLN A 18 17.950 -11.191 -6.943 1.00 0.23 C ATOM 275 CG GLN A 18 17.008 -10.036 -6.721 1.00 0.19 C ATOM 276 CD GLN A 18 15.807 -10.097 -7.634 1.00 0.39 C ATOM 277 OE1 GLN A 18 15.794 -9.498 -8.709 1.00 1.02 O ATOM 278 NE2 GLN A 18 14.793 -10.839 -7.214 1.00 0.42 N ATOM 0 H GLN A 18 18.391 -10.848 -4.581 1.00 0.17 H new ATOM 0 HA GLN A 18 19.979 -11.797 -6.718 1.00 0.18 H new ATOM 0 HB2 GLN A 18 18.001 -11.405 -8.011 1.00 0.23 H new ATOM 0 HB3 GLN A 18 17.541 -12.078 -6.460 1.00 0.23 H new ATOM 0 HG2 GLN A 18 16.674 -10.036 -5.683 1.00 0.19 H new ATOM 0 HG3 GLN A 18 17.540 -9.099 -6.885 1.00 0.19 H new ATOM 0 HE21 GLN A 18 14.849 -11.317 -6.315 1.00 0.42 H new ATOM 0 HE22 GLN A 18 13.956 -10.932 -7.790 1.00 0.42 H new ATOM 287 N PHE A 19 20.106 -8.661 -6.217 1.00 0.12 N ATOM 288 CA PHE A 19 20.716 -7.413 -6.652 1.00 0.15 C ATOM 289 C PHE A 19 22.176 -7.341 -6.212 1.00 0.18 C ATOM 290 O PHE A 19 22.995 -6.687 -6.858 1.00 0.26 O ATOM 291 CB PHE A 19 19.943 -6.214 -6.094 1.00 0.16 C ATOM 292 CG PHE A 19 18.858 -5.720 -7.010 1.00 0.18 C ATOM 293 CD1 PHE A 19 17.782 -6.526 -7.337 1.00 0.26 C ATOM 294 CD2 PHE A 19 18.924 -4.447 -7.551 1.00 0.23 C ATOM 295 CE1 PHE A 19 16.789 -6.074 -8.184 1.00 0.28 C ATOM 296 CE2 PHE A 19 17.937 -3.989 -8.400 1.00 0.25 C ATOM 297 CZ PHE A 19 16.868 -4.803 -8.718 1.00 0.24 C ATOM 0 H PHE A 19 19.789 -8.657 -5.248 1.00 0.12 H new ATOM 0 HA PHE A 19 20.679 -7.382 -7.741 1.00 0.15 H new ATOM 0 HB2 PHE A 19 19.501 -6.490 -5.137 1.00 0.16 H new ATOM 0 HB3 PHE A 19 20.642 -5.400 -5.899 1.00 0.16 H new ATOM 0 HD1 PHE A 19 17.718 -7.522 -6.924 1.00 0.26 H new ATOM 0 HD2 PHE A 19 19.757 -3.805 -7.306 1.00 0.23 H new ATOM 0 HE1 PHE A 19 15.953 -6.713 -8.428 1.00 0.28 H new ATOM 0 HE2 PHE A 19 18.001 -2.994 -8.816 1.00 0.25 H new ATOM 0 HZ PHE A 19 16.095 -4.446 -9.383 1.00 0.24 H new ATOM 307 N ASP A 20 22.498 -8.015 -5.107 1.00 0.15 N ATOM 308 CA ASP A 20 23.864 -8.015 -4.589 1.00 0.19 C ATOM 309 C ASP A 20 24.672 -9.200 -5.119 1.00 0.27 C ATOM 310 O ASP A 20 25.258 -9.127 -6.200 1.00 0.37 O ATOM 311 CB ASP A 20 23.854 -8.034 -3.059 1.00 0.20 C ATOM 312 CG ASP A 20 25.249 -8.149 -2.481 1.00 0.29 C ATOM 313 OD1 ASP A 20 26.151 -7.430 -2.962 1.00 0.34 O ATOM 314 OD2 ASP A 20 25.440 -8.958 -1.549 1.00 0.40 O ATOM 0 H ASP A 20 21.836 -8.564 -4.558 1.00 0.15 H new ATOM 0 HA ASP A 20 24.344 -7.100 -4.936 1.00 0.19 H new ATOM 0 HB2 ASP A 20 23.383 -7.124 -2.689 1.00 0.20 H new ATOM 0 HB3 ASP A 20 23.248 -8.871 -2.711 1.00 0.20 H new ATOM 319 N LYS A 21 24.684 -10.296 -4.359 1.00 0.35 N ATOM 320 CA LYS A 21 25.435 -11.495 -4.735 1.00 0.45 C ATOM 321 C LYS A 21 26.882 -11.157 -5.104 1.00 0.46 C ATOM 322 O LYS A 21 27.556 -11.937 -5.779 1.00 0.84 O ATOM 323 CB LYS A 21 24.747 -12.219 -5.894 1.00 0.53 C ATOM 324 CG LYS A 21 23.522 -13.016 -5.473 1.00 0.61 C ATOM 325 CD LYS A 21 23.910 -14.304 -4.763 1.00 0.69 C ATOM 326 CE LYS A 21 22.683 -15.087 -4.318 1.00 0.83 C ATOM 327 NZ LYS A 21 23.047 -16.411 -3.742 1.00 1.65 N ATOM 0 H LYS A 21 24.180 -10.378 -3.476 1.00 0.35 H new ATOM 0 HA LYS A 21 25.456 -12.157 -3.869 1.00 0.45 H new ATOM 0 HB2 LYS A 21 24.453 -11.486 -6.646 1.00 0.53 H new ATOM 0 HB3 LYS A 21 25.463 -12.891 -6.367 1.00 0.53 H new ATOM 0 HG2 LYS A 21 22.901 -12.409 -4.814 1.00 0.61 H new ATOM 0 HG3 LYS A 21 22.920 -13.251 -6.351 1.00 0.61 H new ATOM 0 HD2 LYS A 21 24.514 -14.920 -5.429 1.00 0.69 H new ATOM 0 HD3 LYS A 21 24.528 -14.071 -3.896 1.00 0.69 H new ATOM 0 HE2 LYS A 21 22.132 -14.508 -3.577 1.00 0.83 H new ATOM 0 HE3 LYS A 21 22.017 -15.232 -5.169 1.00 0.83 H new ATOM 0 HZ1 LYS A 21 22.183 -16.912 -3.451 1.00 1.65 H new ATOM 0 HZ2 LYS A 21 23.550 -16.974 -4.457 1.00 1.65 H new ATOM 0 HZ3 LYS A 21 23.662 -16.272 -2.915 1.00 1.65 H new ATOM 341 N GLU A 22 27.352 -9.993 -4.660 1.00 0.42 N ATOM 342 CA GLU A 22 28.721 -9.561 -4.936 1.00 0.47 C ATOM 343 C GLU A 22 29.675 -10.040 -3.848 1.00 0.45 C ATOM 344 O GLU A 22 30.878 -10.172 -4.073 1.00 0.53 O ATOM 345 CB GLU A 22 28.790 -8.035 -5.029 1.00 0.46 C ATOM 346 CG GLU A 22 27.808 -7.439 -6.024 1.00 0.66 C ATOM 347 CD GLU A 22 27.921 -5.931 -6.125 1.00 1.52 C ATOM 348 OE1 GLU A 22 28.715 -5.450 -6.961 1.00 1.49 O ATOM 349 OE2 GLU A 22 27.216 -5.231 -5.366 1.00 2.47 O ATOM 0 H GLU A 22 26.805 -9.332 -4.108 1.00 0.42 H new ATOM 0 HA GLU A 22 29.021 -9.999 -5.888 1.00 0.47 H new ATOM 0 HB2 GLU A 22 28.598 -7.611 -4.044 1.00 0.46 H new ATOM 0 HB3 GLU A 22 29.802 -7.742 -5.310 1.00 0.46 H new ATOM 0 HG2 GLU A 22 27.980 -7.879 -7.006 1.00 0.66 H new ATOM 0 HG3 GLU A 22 26.793 -7.704 -5.730 1.00 0.66 H new ATOM 356 N GLY A 23 29.124 -10.295 -2.666 1.00 0.48 N ATOM 357 CA GLY A 23 29.929 -10.739 -1.544 1.00 0.51 C ATOM 358 C GLY A 23 29.687 -9.885 -0.316 1.00 0.45 C ATOM 359 O GLY A 23 30.189 -10.177 0.769 1.00 0.72 O ATOM 0 H GLY A 23 28.128 -10.201 -2.465 1.00 0.48 H new ATOM 0 HA2 GLY A 23 29.696 -11.779 -1.317 1.00 0.51 H new ATOM 0 HA3 GLY A 23 30.984 -10.700 -1.814 1.00 0.51 H new ATOM 363 N THR A 24 28.907 -8.821 -0.501 1.00 0.33 N ATOM 364 CA THR A 24 28.574 -7.901 0.580 1.00 0.33 C ATOM 365 C THR A 24 27.115 -7.473 0.461 1.00 0.27 C ATOM 366 O THR A 24 26.731 -6.846 -0.521 1.00 0.25 O ATOM 367 CB THR A 24 29.471 -6.644 0.557 1.00 0.43 C ATOM 368 OG1 THR A 24 28.975 -5.701 -0.400 1.00 0.52 O ATOM 369 CG2 THR A 24 30.905 -7.005 0.205 1.00 0.44 C ATOM 0 H THR A 24 28.491 -8.575 -1.400 1.00 0.33 H new ATOM 0 HA THR A 24 28.740 -8.424 1.522 1.00 0.33 H new ATOM 0 HB THR A 24 29.453 -6.202 1.553 1.00 0.43 H new ATOM 0 HG1 THR A 24 28.249 -6.110 -0.916 1.00 0.52 H new ATOM 0 HG21 THR A 24 31.516 -6.102 0.196 1.00 0.44 H new ATOM 0 HG22 THR A 24 31.298 -7.701 0.946 1.00 0.44 H new ATOM 0 HG23 THR A 24 30.932 -7.471 -0.780 1.00 0.44 H new ATOM 377 N GLY A 25 26.308 -7.820 1.461 1.00 0.27 N ATOM 378 CA GLY A 25 24.896 -7.475 1.435 1.00 0.24 C ATOM 379 C GLY A 25 24.633 -5.987 1.531 1.00 0.20 C ATOM 380 O GLY A 25 24.148 -5.500 2.552 1.00 0.21 O ATOM 0 H GLY A 25 26.607 -8.334 2.290 1.00 0.27 H new ATOM 0 HA2 GLY A 25 24.455 -7.855 0.513 1.00 0.24 H new ATOM 0 HA3 GLY A 25 24.392 -7.978 2.260 1.00 0.24 H new ATOM 384 N LYS A 26 24.952 -5.266 0.465 1.00 0.16 N ATOM 385 CA LYS A 26 24.732 -3.829 0.413 1.00 0.14 C ATOM 386 C LYS A 26 24.505 -3.394 -1.027 1.00 0.14 C ATOM 387 O LYS A 26 25.402 -3.496 -1.864 1.00 0.17 O ATOM 388 CB LYS A 26 25.912 -3.045 0.999 1.00 0.17 C ATOM 389 CG LYS A 26 26.640 -3.745 2.135 1.00 0.37 C ATOM 390 CD LYS A 26 27.931 -3.027 2.490 1.00 0.50 C ATOM 391 CE LYS A 26 28.544 -3.576 3.768 1.00 0.56 C ATOM 392 NZ LYS A 26 29.831 -2.904 4.100 1.00 1.37 N ATOM 0 H LYS A 26 25.367 -5.657 -0.381 1.00 0.16 H new ATOM 0 HA LYS A 26 23.851 -3.611 1.017 1.00 0.14 H new ATOM 0 HB2 LYS A 26 26.625 -2.839 0.201 1.00 0.17 H new ATOM 0 HB3 LYS A 26 25.548 -2.082 1.358 1.00 0.17 H new ATOM 0 HG2 LYS A 26 25.993 -3.789 3.011 1.00 0.37 H new ATOM 0 HG3 LYS A 26 26.860 -4.774 1.849 1.00 0.37 H new ATOM 0 HD2 LYS A 26 28.643 -3.131 1.671 1.00 0.50 H new ATOM 0 HD3 LYS A 26 27.735 -1.961 2.609 1.00 0.50 H new ATOM 0 HE2 LYS A 26 27.843 -3.445 4.592 1.00 0.56 H new ATOM 0 HE3 LYS A 26 28.711 -4.648 3.659 1.00 0.56 H new ATOM 0 HZ1 LYS A 26 30.217 -3.307 4.978 1.00 1.37 H new ATOM 0 HZ2 LYS A 26 30.509 -3.050 3.325 1.00 1.37 H new ATOM 0 HZ3 LYS A 26 29.667 -1.885 4.229 1.00 1.37 H new ATOM 406 N ILE A 27 23.306 -2.910 -1.310 1.00 0.16 N ATOM 407 CA ILE A 27 22.968 -2.460 -2.657 1.00 0.19 C ATOM 408 C ILE A 27 23.116 -0.949 -2.780 1.00 0.19 C ATOM 409 O ILE A 27 22.883 -0.215 -1.825 1.00 0.22 O ATOM 410 CB ILE A 27 21.532 -2.852 -3.049 1.00 0.23 C ATOM 411 CG1 ILE A 27 20.538 -2.334 -2.011 1.00 0.28 C ATOM 412 CG2 ILE A 27 21.416 -4.362 -3.197 1.00 0.32 C ATOM 413 CD1 ILE A 27 19.153 -2.102 -2.569 1.00 0.34 C ATOM 0 H ILE A 27 22.551 -2.818 -0.630 1.00 0.16 H new ATOM 0 HA ILE A 27 23.665 -2.955 -3.334 1.00 0.19 H new ATOM 0 HB ILE A 27 21.296 -2.394 -4.010 1.00 0.23 H new ATOM 0 HG12 ILE A 27 20.476 -3.049 -1.190 1.00 0.28 H new ATOM 0 HG13 ILE A 27 20.914 -1.400 -1.593 1.00 0.28 H new ATOM 0 HG21 ILE A 27 20.395 -4.623 -3.474 1.00 0.32 H new ATOM 0 HG22 ILE A 27 22.101 -4.705 -3.972 1.00 0.32 H new ATOM 0 HG23 ILE A 27 21.669 -4.841 -2.251 1.00 0.32 H new ATOM 0 HD11 ILE A 27 18.499 -1.735 -1.778 1.00 0.34 H new ATOM 0 HD12 ILE A 27 19.202 -1.365 -3.370 1.00 0.34 H new ATOM 0 HD13 ILE A 27 18.757 -3.039 -2.961 1.00 0.34 H new ATOM 425 N ALA A 28 23.492 -0.490 -3.967 1.00 0.19 N ATOM 426 CA ALA A 28 23.675 0.936 -4.213 1.00 0.21 C ATOM 427 C ALA A 28 22.343 1.678 -4.157 1.00 0.20 C ATOM 428 O ALA A 28 21.349 1.240 -4.734 1.00 0.20 O ATOM 429 CB ALA A 28 24.352 1.158 -5.557 1.00 0.23 C ATOM 0 H ALA A 28 23.676 -1.084 -4.775 1.00 0.19 H new ATOM 0 HA ALA A 28 24.316 1.336 -3.427 1.00 0.21 H new ATOM 0 HB1 ALA A 28 24.482 2.227 -5.727 1.00 0.23 H new ATOM 0 HB2 ALA A 28 25.326 0.669 -5.559 1.00 0.23 H new ATOM 0 HB3 ALA A 28 23.734 0.737 -6.350 1.00 0.23 H new ATOM 435 N THR A 29 22.340 2.803 -3.444 1.00 0.21 N ATOM 436 CA THR A 29 21.145 3.627 -3.286 1.00 0.22 C ATOM 437 C THR A 29 20.567 4.050 -4.634 1.00 0.22 C ATOM 438 O THR A 29 19.354 4.206 -4.775 1.00 0.22 O ATOM 439 CB THR A 29 21.451 4.890 -2.457 1.00 0.26 C ATOM 440 OG1 THR A 29 22.335 5.750 -3.186 1.00 0.28 O ATOM 441 CG2 THR A 29 22.085 4.518 -1.127 1.00 0.28 C ATOM 0 H THR A 29 23.162 3.167 -2.962 1.00 0.21 H new ATOM 0 HA THR A 29 20.410 3.014 -2.764 1.00 0.22 H new ATOM 0 HB THR A 29 20.513 5.411 -2.265 1.00 0.26 H new ATOM 0 HG1 THR A 29 22.994 6.137 -2.573 1.00 0.28 H new ATOM 0 HG21 THR A 29 22.293 5.424 -0.557 1.00 0.28 H new ATOM 0 HG22 THR A 29 21.401 3.883 -0.563 1.00 0.28 H new ATOM 0 HG23 THR A 29 23.016 3.980 -1.306 1.00 0.28 H new ATOM 449 N ARG A 30 21.439 4.240 -5.620 1.00 0.23 N ATOM 450 CA ARG A 30 21.011 4.651 -6.954 1.00 0.25 C ATOM 451 C ARG A 30 20.188 3.565 -7.642 1.00 0.26 C ATOM 452 O ARG A 30 19.659 3.776 -8.735 1.00 0.43 O ATOM 453 CB ARG A 30 22.220 5.000 -7.813 1.00 0.29 C ATOM 454 CG ARG A 30 22.820 6.361 -7.505 1.00 1.36 C ATOM 455 CD ARG A 30 23.916 6.723 -8.495 1.00 1.46 C ATOM 456 NE ARG A 30 23.440 6.681 -9.877 1.00 1.85 N ATOM 457 CZ ARG A 30 24.088 7.233 -10.899 1.00 2.23 C ATOM 458 NH1 ARG A 30 25.235 7.867 -10.698 1.00 2.10 N ATOM 459 NH2 ARG A 30 23.588 7.147 -12.125 1.00 3.19 N ATOM 0 H ARG A 30 22.447 4.116 -5.521 1.00 0.23 H new ATOM 0 HA ARG A 30 20.380 5.532 -6.838 1.00 0.25 H new ATOM 0 HB2 ARG A 30 22.985 4.236 -7.674 1.00 0.29 H new ATOM 0 HB3 ARG A 30 21.928 4.971 -8.863 1.00 0.29 H new ATOM 0 HG2 ARG A 30 22.038 7.120 -7.533 1.00 1.36 H new ATOM 0 HG3 ARG A 30 23.227 6.360 -6.494 1.00 1.36 H new ATOM 0 HD2 ARG A 30 24.292 7.721 -8.271 1.00 1.46 H new ATOM 0 HD3 ARG A 30 24.752 6.034 -8.378 1.00 1.46 H new ATOM 0 HE ARG A 30 22.561 6.201 -10.068 1.00 1.85 H new ATOM 0 HH11 ARG A 30 25.623 7.933 -9.757 1.00 2.10 H new ATOM 0 HH12 ARG A 30 25.729 8.289 -11.484 1.00 2.10 H new ATOM 0 HH21 ARG A 30 22.707 6.658 -12.283 1.00 3.19 H new ATOM 0 HH22 ARG A 30 24.085 7.570 -12.909 1.00 3.19 H new ATOM 473 N GLU A 31 20.083 2.407 -7.001 1.00 0.17 N ATOM 474 CA GLU A 31 19.328 1.289 -7.559 1.00 0.18 C ATOM 475 C GLU A 31 18.325 0.751 -6.542 1.00 0.16 C ATOM 476 O GLU A 31 17.897 -0.400 -6.621 1.00 0.18 O ATOM 477 CB GLU A 31 20.287 0.178 -7.994 1.00 0.20 C ATOM 478 CG GLU A 31 19.681 -0.805 -8.982 1.00 0.26 C ATOM 479 CD GLU A 31 20.713 -1.746 -9.572 1.00 0.29 C ATOM 480 OE1 GLU A 31 21.037 -2.759 -8.918 1.00 0.28 O ATOM 481 OE2 GLU A 31 21.199 -1.468 -10.689 1.00 0.44 O ATOM 0 H GLU A 31 20.511 2.217 -6.095 1.00 0.17 H new ATOM 0 HA GLU A 31 18.775 1.644 -8.428 1.00 0.18 H new ATOM 0 HB2 GLU A 31 21.172 0.630 -8.442 1.00 0.20 H new ATOM 0 HB3 GLU A 31 20.620 -0.368 -7.111 1.00 0.20 H new ATOM 0 HG2 GLU A 31 18.907 -1.387 -8.482 1.00 0.26 H new ATOM 0 HG3 GLU A 31 19.195 -0.253 -9.787 1.00 0.26 H new ATOM 488 N LEU A 32 17.954 1.600 -5.588 1.00 0.17 N ATOM 489 CA LEU A 32 17.009 1.218 -4.542 1.00 0.19 C ATOM 490 C LEU A 32 15.565 1.301 -5.033 1.00 0.18 C ATOM 491 O LEU A 32 14.725 0.469 -4.675 1.00 0.17 O ATOM 492 CB LEU A 32 17.190 2.124 -3.324 1.00 0.24 C ATOM 493 CG LEU A 32 16.356 1.739 -2.106 1.00 0.29 C ATOM 494 CD1 LEU A 32 16.774 0.371 -1.594 1.00 0.39 C ATOM 495 CD2 LEU A 32 16.488 2.787 -1.012 1.00 0.38 C ATOM 0 H LEU A 32 18.294 2.559 -5.517 1.00 0.17 H new ATOM 0 HA LEU A 32 17.214 0.183 -4.268 1.00 0.19 H new ATOM 0 HB2 LEU A 32 18.243 2.121 -3.041 1.00 0.24 H new ATOM 0 HB3 LEU A 32 16.939 3.146 -3.609 1.00 0.24 H new ATOM 0 HG LEU A 32 15.308 1.692 -2.403 1.00 0.29 H new ATOM 0 HD11 LEU A 32 16.171 0.108 -0.725 1.00 0.39 H new ATOM 0 HD12 LEU A 32 16.624 -0.372 -2.377 1.00 0.39 H new ATOM 0 HD13 LEU A 32 17.827 0.394 -1.312 1.00 0.39 H new ATOM 0 HD21 LEU A 32 15.886 2.493 -0.152 1.00 0.38 H new ATOM 0 HD22 LEU A 32 17.533 2.870 -0.712 1.00 0.38 H new ATOM 0 HD23 LEU A 32 16.141 3.750 -1.387 1.00 0.38 H new ATOM 507 N GLY A 33 15.283 2.321 -5.839 1.00 0.22 N ATOM 508 CA GLY A 33 13.945 2.515 -6.369 1.00 0.23 C ATOM 509 C GLY A 33 13.341 1.241 -6.930 1.00 0.20 C ATOM 510 O GLY A 33 12.145 0.995 -6.775 1.00 0.19 O ATOM 0 H GLY A 33 15.963 3.021 -6.136 1.00 0.22 H new ATOM 0 HA2 GLY A 33 13.299 2.900 -5.580 1.00 0.23 H new ATOM 0 HA3 GLY A 33 13.976 3.272 -7.153 1.00 0.23 H new ATOM 514 N THR A 34 14.169 0.432 -7.581 1.00 0.19 N ATOM 515 CA THR A 34 13.707 -0.816 -8.177 1.00 0.18 C ATOM 516 C THR A 34 13.064 -1.740 -7.143 1.00 0.16 C ATOM 517 O THR A 34 11.987 -2.284 -7.378 1.00 0.17 O ATOM 518 CB THR A 34 14.858 -1.567 -8.871 1.00 0.21 C ATOM 519 OG1 THR A 34 15.640 -0.653 -9.650 1.00 0.26 O ATOM 520 CG2 THR A 34 14.316 -2.666 -9.772 1.00 0.23 C ATOM 0 H THR A 34 15.164 0.618 -7.710 1.00 0.19 H new ATOM 0 HA THR A 34 12.956 -0.540 -8.917 1.00 0.18 H new ATOM 0 HB THR A 34 15.484 -2.019 -8.102 1.00 0.21 H new ATOM 0 HG1 THR A 34 16.371 -1.138 -10.087 1.00 0.26 H new ATOM 0 HG21 THR A 34 15.146 -3.184 -10.253 1.00 0.23 H new ATOM 0 HG22 THR A 34 13.742 -3.375 -9.176 1.00 0.23 H new ATOM 0 HG23 THR A 34 13.672 -2.227 -10.534 1.00 0.23 H new ATOM 528 N LEU A 35 13.728 -1.917 -6.001 1.00 0.13 N ATOM 529 CA LEU A 35 13.208 -2.789 -4.948 1.00 0.12 C ATOM 530 C LEU A 35 11.895 -2.283 -4.377 1.00 0.14 C ATOM 531 O LEU A 35 10.898 -2.999 -4.396 1.00 0.15 O ATOM 532 CB LEU A 35 14.232 -2.952 -3.823 1.00 0.13 C ATOM 533 CG LEU A 35 15.177 -4.146 -3.975 1.00 0.14 C ATOM 534 CD1 LEU A 35 15.648 -4.282 -5.412 1.00 0.18 C ATOM 535 CD2 LEU A 35 16.360 -4.011 -3.034 1.00 0.20 C ATOM 0 H LEU A 35 14.620 -1.472 -5.782 1.00 0.13 H new ATOM 0 HA LEU A 35 13.019 -3.758 -5.409 1.00 0.12 H new ATOM 0 HB2 LEU A 35 14.828 -2.042 -3.761 1.00 0.13 H new ATOM 0 HB3 LEU A 35 13.698 -3.049 -2.878 1.00 0.13 H new ATOM 0 HG LEU A 35 14.629 -5.051 -3.712 1.00 0.14 H new ATOM 0 HD11 LEU A 35 16.319 -5.137 -5.496 1.00 0.18 H new ATOM 0 HD12 LEU A 35 14.788 -4.430 -6.064 1.00 0.18 H new ATOM 0 HD13 LEU A 35 16.177 -3.376 -5.709 1.00 0.18 H new ATOM 0 HD21 LEU A 35 17.021 -4.869 -3.156 1.00 0.20 H new ATOM 0 HD22 LEU A 35 16.906 -3.096 -3.265 1.00 0.20 H new ATOM 0 HD23 LEU A 35 16.003 -3.971 -2.005 1.00 0.20 H new ATOM 547 N MET A 36 11.885 -1.049 -3.882 1.00 0.17 N ATOM 548 CA MET A 36 10.665 -0.493 -3.303 1.00 0.21 C ATOM 549 C MET A 36 9.498 -0.650 -4.272 1.00 0.23 C ATOM 550 O MET A 36 8.373 -0.934 -3.859 1.00 0.26 O ATOM 551 CB MET A 36 10.857 0.971 -2.905 1.00 0.25 C ATOM 552 CG MET A 36 11.839 1.733 -3.777 1.00 0.21 C ATOM 553 SD MET A 36 13.017 2.704 -2.814 1.00 0.30 S ATOM 554 CE MET A 36 11.937 3.507 -1.629 1.00 0.73 C ATOM 0 H MET A 36 12.691 -0.424 -3.869 1.00 0.17 H new ATOM 0 HA MET A 36 10.435 -1.050 -2.395 1.00 0.21 H new ATOM 0 HB2 MET A 36 9.891 1.475 -2.941 1.00 0.25 H new ATOM 0 HB3 MET A 36 11.200 1.012 -1.871 1.00 0.25 H new ATOM 0 HG2 MET A 36 12.383 1.028 -4.406 1.00 0.21 H new ATOM 0 HG3 MET A 36 11.288 2.396 -4.444 1.00 0.21 H new ATOM 0 HE1 MET A 36 12.239 4.547 -1.508 1.00 0.73 H new ATOM 0 HE2 MET A 36 10.909 3.467 -1.988 1.00 0.73 H new ATOM 0 HE3 MET A 36 12.006 2.996 -0.669 1.00 0.73 H new ATOM 564 N ARG A 37 9.772 -0.479 -5.564 1.00 0.23 N ATOM 565 CA ARG A 37 8.743 -0.635 -6.581 1.00 0.27 C ATOM 566 C ARG A 37 8.317 -2.095 -6.643 1.00 0.25 C ATOM 567 O ARG A 37 7.129 -2.407 -6.718 1.00 0.28 O ATOM 568 CB ARG A 37 9.254 -0.169 -7.946 1.00 0.31 C ATOM 569 CG ARG A 37 9.390 1.341 -8.055 1.00 0.37 C ATOM 570 CD ARG A 37 9.891 1.764 -9.426 1.00 0.43 C ATOM 571 NE ARG A 37 9.945 3.218 -9.560 1.00 0.53 N ATOM 572 CZ ARG A 37 10.869 3.862 -10.268 1.00 0.71 C ATOM 573 NH1 ARG A 37 11.815 3.185 -10.905 1.00 0.94 N ATOM 574 NH2 ARG A 37 10.845 5.186 -10.340 1.00 0.79 N ATOM 0 H ARG A 37 10.693 -0.234 -5.926 1.00 0.23 H new ATOM 0 HA ARG A 37 7.884 -0.018 -6.317 1.00 0.27 H new ATOM 0 HB2 ARG A 37 10.223 -0.629 -8.139 1.00 0.31 H new ATOM 0 HB3 ARG A 37 8.573 -0.522 -8.721 1.00 0.31 H new ATOM 0 HG2 ARG A 37 8.425 1.808 -7.861 1.00 0.37 H new ATOM 0 HG3 ARG A 37 10.078 1.700 -7.290 1.00 0.37 H new ATOM 0 HD2 ARG A 37 10.884 1.346 -9.595 1.00 0.43 H new ATOM 0 HD3 ARG A 37 9.237 1.352 -10.195 1.00 0.43 H new ATOM 0 HE ARG A 37 9.233 3.771 -9.083 1.00 0.53 H new ATOM 0 HH11 ARG A 37 11.836 2.167 -10.853 1.00 0.94 H new ATOM 0 HH12 ARG A 37 12.521 3.683 -11.447 1.00 0.94 H new ATOM 0 HH21 ARG A 37 10.118 5.710 -9.853 1.00 0.79 H new ATOM 0 HH22 ARG A 37 11.553 5.680 -10.883 1.00 0.79 H new ATOM 588 N THR A 38 9.308 -2.984 -6.636 1.00 0.24 N ATOM 589 CA THR A 38 9.058 -4.418 -6.641 1.00 0.29 C ATOM 590 C THR A 38 8.267 -4.802 -5.395 1.00 0.26 C ATOM 591 O THR A 38 7.581 -5.824 -5.360 1.00 0.32 O ATOM 592 CB THR A 38 10.382 -5.211 -6.667 1.00 0.38 C ATOM 593 OG1 THR A 38 11.157 -4.830 -7.810 1.00 1.07 O ATOM 594 CG2 THR A 38 10.127 -6.711 -6.704 1.00 0.67 C ATOM 0 H THR A 38 10.296 -2.731 -6.627 1.00 0.24 H new ATOM 0 HA THR A 38 8.488 -4.663 -7.537 1.00 0.29 H new ATOM 0 HB THR A 38 10.931 -4.978 -5.755 1.00 0.38 H new ATOM 0 HG1 THR A 38 11.504 -3.922 -7.682 1.00 1.07 H new ATOM 0 HG21 THR A 38 11.079 -7.242 -6.722 1.00 0.67 H new ATOM 0 HG22 THR A 38 9.563 -7.006 -5.819 1.00 0.67 H new ATOM 0 HG23 THR A 38 9.556 -6.961 -7.598 1.00 0.67 H new ATOM 602 N LEU A 39 8.372 -3.951 -4.376 1.00 0.21 N ATOM 603 CA LEU A 39 7.677 -4.156 -3.112 1.00 0.26 C ATOM 604 C LEU A 39 6.257 -3.606 -3.189 1.00 0.33 C ATOM 605 O LEU A 39 5.516 -3.620 -2.205 1.00 0.83 O ATOM 606 CB LEU A 39 8.448 -3.490 -1.967 1.00 0.24 C ATOM 607 CG LEU A 39 9.477 -4.379 -1.263 1.00 0.25 C ATOM 608 CD1 LEU A 39 10.538 -4.865 -2.240 1.00 0.29 C ATOM 609 CD2 LEU A 39 10.118 -3.624 -0.109 1.00 0.41 C ATOM 0 H LEU A 39 8.940 -3.104 -4.405 1.00 0.21 H new ATOM 0 HA LEU A 39 7.621 -5.227 -2.916 1.00 0.26 H new ATOM 0 HB2 LEU A 39 8.960 -2.611 -2.359 1.00 0.24 H new ATOM 0 HB3 LEU A 39 7.731 -3.137 -1.226 1.00 0.24 H new ATOM 0 HG LEU A 39 8.961 -5.254 -0.867 1.00 0.25 H new ATOM 0 HD11 LEU A 39 11.256 -5.494 -1.714 1.00 0.29 H new ATOM 0 HD12 LEU A 39 10.064 -5.441 -3.035 1.00 0.29 H new ATOM 0 HD13 LEU A 39 11.055 -4.008 -2.672 1.00 0.29 H new ATOM 0 HD21 LEU A 39 10.848 -4.265 0.385 1.00 0.41 H new ATOM 0 HD22 LEU A 39 10.617 -2.733 -0.490 1.00 0.41 H new ATOM 0 HD23 LEU A 39 9.349 -3.332 0.606 1.00 0.41 H new ATOM 621 N GLY A 40 5.889 -3.121 -4.371 1.00 0.48 N ATOM 622 CA GLY A 40 4.554 -2.586 -4.579 1.00 0.54 C ATOM 623 C GLY A 40 4.438 -1.101 -4.298 1.00 0.44 C ATOM 624 O GLY A 40 3.545 -0.436 -4.821 1.00 0.56 O ATOM 0 H GLY A 40 6.494 -3.089 -5.192 1.00 0.48 H new ATOM 0 HA2 GLY A 40 4.253 -2.776 -5.609 1.00 0.54 H new ATOM 0 HA3 GLY A 40 3.854 -3.123 -3.939 1.00 0.54 H new ATOM 628 N GLN A 41 5.338 -0.576 -3.475 1.00 0.41 N ATOM 629 CA GLN A 41 5.319 0.843 -3.135 1.00 0.37 C ATOM 630 C GLN A 41 6.262 1.634 -4.035 1.00 0.29 C ATOM 631 O GLN A 41 7.478 1.456 -3.985 1.00 0.35 O ATOM 632 CB GLN A 41 5.710 1.044 -1.669 1.00 0.47 C ATOM 633 CG GLN A 41 4.637 0.611 -0.682 1.00 0.66 C ATOM 634 CD GLN A 41 4.284 -0.859 -0.804 1.00 0.90 C ATOM 635 OE1 GLN A 41 3.386 -1.233 -1.558 1.00 1.79 O ATOM 636 NE2 GLN A 41 4.991 -1.700 -0.059 1.00 0.85 N ATOM 0 H GLN A 41 6.087 -1.108 -3.032 1.00 0.41 H new ATOM 0 HA GLN A 41 4.305 1.212 -3.289 1.00 0.37 H new ATOM 0 HB2 GLN A 41 6.624 0.485 -1.467 1.00 0.47 H new ATOM 0 HB3 GLN A 41 5.938 2.097 -1.505 1.00 0.47 H new ATOM 0 HG2 GLN A 41 4.980 0.815 0.333 1.00 0.66 H new ATOM 0 HG3 GLN A 41 3.740 1.210 -0.842 1.00 0.66 H new ATOM 0 HE21 GLN A 41 5.727 -1.345 0.552 1.00 0.85 H new ATOM 0 HE22 GLN A 41 4.799 -2.701 -0.098 1.00 0.85 H new ATOM 645 N ASN A 42 5.696 2.519 -4.850 1.00 0.34 N ATOM 646 CA ASN A 42 6.494 3.335 -5.755 1.00 0.29 C ATOM 647 C ASN A 42 6.797 4.692 -5.120 1.00 0.31 C ATOM 648 O ASN A 42 5.892 5.498 -4.906 1.00 0.36 O ATOM 649 CB ASN A 42 5.757 3.532 -7.082 1.00 0.34 C ATOM 650 CG ASN A 42 5.374 2.217 -7.736 1.00 0.43 C ATOM 651 OD1 ASN A 42 4.365 2.131 -8.436 1.00 1.03 O ATOM 652 ND2 ASN A 42 6.180 1.185 -7.513 1.00 0.96 N ATOM 0 H ASN A 42 4.691 2.688 -4.901 1.00 0.34 H new ATOM 0 HA ASN A 42 7.435 2.819 -5.947 1.00 0.29 H new ATOM 0 HB2 ASN A 42 4.858 4.124 -6.910 1.00 0.34 H new ATOM 0 HB3 ASN A 42 6.388 4.102 -7.763 1.00 0.34 H new ATOM 0 HD21 ASN A 42 5.973 0.277 -7.929 1.00 0.96 H new ATOM 0 HD22 ASN A 42 7.006 1.301 -6.926 1.00 0.96 H new ATOM 659 N PRO A 43 8.079 4.964 -4.810 1.00 0.30 N ATOM 660 CA PRO A 43 8.493 6.228 -4.195 1.00 0.35 C ATOM 661 C PRO A 43 8.693 7.343 -5.211 1.00 0.34 C ATOM 662 O PRO A 43 8.820 7.093 -6.410 1.00 0.52 O ATOM 663 CB PRO A 43 9.827 5.859 -3.557 1.00 0.40 C ATOM 664 CG PRO A 43 10.399 4.855 -4.493 1.00 0.35 C ATOM 665 CD PRO A 43 9.230 4.055 -5.004 1.00 0.27 C ATOM 0 HA PRO A 43 7.744 6.613 -3.503 1.00 0.35 H new ATOM 0 HB2 PRO A 43 10.477 6.728 -3.456 1.00 0.40 H new ATOM 0 HB3 PRO A 43 9.692 5.444 -2.558 1.00 0.40 H new ATOM 0 HG2 PRO A 43 10.928 5.342 -5.313 1.00 0.35 H new ATOM 0 HG3 PRO A 43 11.119 4.214 -3.985 1.00 0.35 H new ATOM 0 HD2 PRO A 43 9.356 3.785 -6.052 1.00 0.27 H new ATOM 0 HD3 PRO A 43 9.106 3.126 -4.448 1.00 0.27 H new ATOM 673 N THR A 44 8.720 8.576 -4.718 1.00 0.38 N ATOM 674 CA THR A 44 8.922 9.738 -5.571 1.00 0.38 C ATOM 675 C THR A 44 10.408 9.961 -5.824 1.00 0.34 C ATOM 676 O THR A 44 11.227 9.799 -4.920 1.00 0.33 O ATOM 677 CB THR A 44 8.321 11.008 -4.940 1.00 0.43 C ATOM 678 OG1 THR A 44 8.908 11.241 -3.654 1.00 0.43 O ATOM 679 CG2 THR A 44 6.812 10.878 -4.798 1.00 0.53 C ATOM 0 H THR A 44 8.604 8.796 -3.729 1.00 0.38 H new ATOM 0 HA THR A 44 8.414 9.542 -6.515 1.00 0.38 H new ATOM 0 HB THR A 44 8.538 11.851 -5.596 1.00 0.43 H new ATOM 0 HG1 THR A 44 8.522 12.051 -3.260 1.00 0.43 H new ATOM 0 HG21 THR A 44 6.409 11.786 -4.350 1.00 0.53 H new ATOM 0 HG22 THR A 44 6.366 10.729 -5.781 1.00 0.53 H new ATOM 0 HG23 THR A 44 6.579 10.025 -4.161 1.00 0.53 H new ATOM 687 N GLU A 45 10.749 10.327 -7.055 1.00 0.36 N ATOM 688 CA GLU A 45 12.140 10.567 -7.430 1.00 0.37 C ATOM 689 C GLU A 45 12.851 11.446 -6.402 1.00 0.33 C ATOM 690 O GLU A 45 14.050 11.296 -6.166 1.00 0.30 O ATOM 691 CB GLU A 45 12.206 11.225 -8.810 1.00 0.43 C ATOM 692 CG GLU A 45 13.622 11.391 -9.340 1.00 0.48 C ATOM 693 CD GLU A 45 13.666 12.128 -10.663 1.00 0.58 C ATOM 694 OE1 GLU A 45 13.553 11.466 -11.716 1.00 0.66 O ATOM 695 OE2 GLU A 45 13.812 13.368 -10.648 1.00 0.63 O ATOM 0 H GLU A 45 10.080 10.465 -7.813 1.00 0.36 H new ATOM 0 HA GLU A 45 12.649 9.604 -7.462 1.00 0.37 H new ATOM 0 HB2 GLU A 45 11.631 10.626 -9.516 1.00 0.43 H new ATOM 0 HB3 GLU A 45 11.729 12.204 -8.759 1.00 0.43 H new ATOM 0 HG2 GLU A 45 14.219 11.933 -8.607 1.00 0.48 H new ATOM 0 HG3 GLU A 45 14.079 10.409 -9.460 1.00 0.48 H new ATOM 702 N ALA A 46 12.101 12.355 -5.788 1.00 0.35 N ATOM 703 CA ALA A 46 12.652 13.267 -4.790 1.00 0.35 C ATOM 704 C ALA A 46 13.205 12.529 -3.571 1.00 0.32 C ATOM 705 O ALA A 46 14.306 12.824 -3.102 1.00 0.33 O ATOM 706 CB ALA A 46 11.589 14.265 -4.358 1.00 0.40 C ATOM 0 H ALA A 46 11.104 12.481 -5.965 1.00 0.35 H new ATOM 0 HA ALA A 46 13.486 13.794 -5.254 1.00 0.35 H new ATOM 0 HB1 ALA A 46 12.007 14.942 -3.613 1.00 0.40 H new ATOM 0 HB2 ALA A 46 11.255 14.838 -5.223 1.00 0.40 H new ATOM 0 HB3 ALA A 46 10.742 13.731 -3.928 1.00 0.40 H new ATOM 712 N GLU A 47 12.440 11.570 -3.055 1.00 0.30 N ATOM 713 CA GLU A 47 12.865 10.819 -1.879 1.00 0.30 C ATOM 714 C GLU A 47 14.065 9.926 -2.194 1.00 0.26 C ATOM 715 O GLU A 47 14.898 9.664 -1.328 1.00 0.26 O ATOM 716 CB GLU A 47 11.703 9.990 -1.320 1.00 0.33 C ATOM 717 CG GLU A 47 11.477 8.663 -2.028 1.00 0.37 C ATOM 718 CD GLU A 47 12.280 7.533 -1.415 1.00 0.88 C ATOM 719 OE1 GLU A 47 12.323 7.441 -0.171 1.00 1.43 O ATOM 720 OE2 GLU A 47 12.863 6.736 -2.180 1.00 1.15 O ATOM 0 H GLU A 47 11.531 11.297 -3.429 1.00 0.30 H new ATOM 0 HA GLU A 47 13.175 11.535 -1.118 1.00 0.30 H new ATOM 0 HB2 GLU A 47 11.887 9.797 -0.263 1.00 0.33 H new ATOM 0 HB3 GLU A 47 10.789 10.581 -1.382 1.00 0.33 H new ATOM 0 HG2 GLU A 47 10.417 8.412 -1.992 1.00 0.37 H new ATOM 0 HG3 GLU A 47 11.745 8.766 -3.080 1.00 0.37 H new ATOM 727 N LEU A 48 14.145 9.454 -3.433 1.00 0.24 N ATOM 728 CA LEU A 48 15.245 8.593 -3.849 1.00 0.22 C ATOM 729 C LEU A 48 16.576 9.336 -3.816 1.00 0.20 C ATOM 730 O LEU A 48 17.512 8.923 -3.135 1.00 0.19 O ATOM 731 CB LEU A 48 14.995 8.077 -5.267 1.00 0.25 C ATOM 732 CG LEU A 48 13.748 7.209 -5.438 1.00 0.27 C ATOM 733 CD1 LEU A 48 13.382 7.100 -6.910 1.00 0.31 C ATOM 734 CD2 LEU A 48 13.973 5.828 -4.837 1.00 0.29 C ATOM 0 H LEU A 48 13.463 9.653 -4.165 1.00 0.24 H new ATOM 0 HA LEU A 48 15.296 7.758 -3.150 1.00 0.22 H new ATOM 0 HB2 LEU A 48 14.917 8.932 -5.938 1.00 0.25 H new ATOM 0 HB3 LEU A 48 15.864 7.501 -5.585 1.00 0.25 H new ATOM 0 HG LEU A 48 12.920 7.680 -4.909 1.00 0.27 H new ATOM 0 HD11 LEU A 48 12.493 6.479 -7.019 1.00 0.31 H new ATOM 0 HD12 LEU A 48 13.182 8.094 -7.310 1.00 0.31 H new ATOM 0 HD13 LEU A 48 14.209 6.648 -7.458 1.00 0.31 H new ATOM 0 HD21 LEU A 48 13.075 5.224 -4.968 1.00 0.29 H new ATOM 0 HD22 LEU A 48 14.812 5.345 -5.339 1.00 0.29 H new ATOM 0 HD23 LEU A 48 14.193 5.925 -3.774 1.00 0.29 H new ATOM 746 N GLN A 49 16.649 10.442 -4.548 1.00 0.23 N ATOM 747 CA GLN A 49 17.869 11.236 -4.621 1.00 0.25 C ATOM 748 C GLN A 49 18.343 11.703 -3.247 1.00 0.25 C ATOM 749 O GLN A 49 19.546 11.752 -2.994 1.00 0.26 O ATOM 750 CB GLN A 49 17.652 12.433 -5.545 1.00 0.31 C ATOM 751 CG GLN A 49 16.586 13.399 -5.061 1.00 0.36 C ATOM 752 CD GLN A 49 15.758 13.968 -6.196 1.00 0.36 C ATOM 753 OE1 GLN A 49 15.282 15.102 -6.126 1.00 0.40 O ATOM 754 NE2 GLN A 49 15.578 13.178 -7.249 1.00 0.33 N ATOM 0 H GLN A 49 15.875 10.810 -5.101 1.00 0.23 H new ATOM 0 HA GLN A 49 18.654 10.597 -5.026 1.00 0.25 H new ATOM 0 HB2 GLN A 49 18.594 12.971 -5.653 1.00 0.31 H new ATOM 0 HB3 GLN A 49 17.377 12.070 -6.535 1.00 0.31 H new ATOM 0 HG2 GLN A 49 15.929 12.887 -4.358 1.00 0.36 H new ATOM 0 HG3 GLN A 49 17.061 14.216 -4.517 1.00 0.36 H new ATOM 0 HE21 GLN A 49 15.991 12.246 -7.264 1.00 0.33 H new ATOM 0 HE22 GLN A 49 15.027 13.504 -8.043 1.00 0.33 H new ATOM 763 N ASP A 50 17.413 12.049 -2.358 1.00 0.25 N ATOM 764 CA ASP A 50 17.800 12.514 -1.029 1.00 0.29 C ATOM 765 C ASP A 50 18.510 11.405 -0.254 1.00 0.27 C ATOM 766 O ASP A 50 19.602 11.616 0.271 1.00 0.30 O ATOM 767 CB ASP A 50 16.590 13.045 -0.242 1.00 0.33 C ATOM 768 CG ASP A 50 15.901 11.989 0.603 1.00 0.33 C ATOM 769 OD1 ASP A 50 16.484 11.573 1.627 1.00 0.35 O ATOM 770 OD2 ASP A 50 14.772 11.596 0.255 1.00 0.33 O ATOM 0 H ASP A 50 16.408 12.017 -2.529 1.00 0.25 H new ATOM 0 HA ASP A 50 18.496 13.343 -1.158 1.00 0.29 H new ATOM 0 HB2 ASP A 50 16.917 13.859 0.405 1.00 0.33 H new ATOM 0 HB3 ASP A 50 15.868 13.465 -0.942 1.00 0.33 H new ATOM 775 N LEU A 51 17.894 10.225 -0.186 1.00 0.25 N ATOM 776 CA LEU A 51 18.486 9.097 0.524 1.00 0.27 C ATOM 777 C LEU A 51 19.742 8.607 -0.186 1.00 0.24 C ATOM 778 O LEU A 51 20.598 7.964 0.421 1.00 0.27 O ATOM 779 CB LEU A 51 17.470 7.960 0.684 1.00 0.30 C ATOM 780 CG LEU A 51 16.846 7.439 -0.609 1.00 0.29 C ATOM 781 CD1 LEU A 51 17.785 6.464 -1.300 1.00 0.30 C ATOM 782 CD2 LEU A 51 15.507 6.778 -0.323 1.00 0.35 C ATOM 0 H LEU A 51 16.989 10.028 -0.613 1.00 0.25 H new ATOM 0 HA LEU A 51 18.773 9.437 1.519 1.00 0.27 H new ATOM 0 HB2 LEU A 51 17.961 7.128 1.189 1.00 0.30 H new ATOM 0 HB3 LEU A 51 16.669 8.303 1.339 1.00 0.30 H new ATOM 0 HG LEU A 51 16.678 8.285 -1.276 1.00 0.29 H new ATOM 0 HD11 LEU A 51 17.323 6.104 -2.219 1.00 0.30 H new ATOM 0 HD12 LEU A 51 18.722 6.968 -1.538 1.00 0.30 H new ATOM 0 HD13 LEU A 51 17.984 5.620 -0.639 1.00 0.30 H new ATOM 0 HD21 LEU A 51 15.075 6.412 -1.255 1.00 0.35 H new ATOM 0 HD22 LEU A 51 15.652 5.943 0.362 1.00 0.35 H new ATOM 0 HD23 LEU A 51 14.832 7.505 0.129 1.00 0.35 H new ATOM 794 N ILE A 52 19.847 8.913 -1.478 1.00 0.20 N ATOM 795 CA ILE A 52 21.011 8.512 -2.261 1.00 0.21 C ATOM 796 C ILE A 52 22.229 9.337 -1.857 1.00 0.25 C ATOM 797 O ILE A 52 23.240 8.792 -1.415 1.00 0.29 O ATOM 798 CB ILE A 52 20.759 8.659 -3.779 1.00 0.23 C ATOM 799 CG1 ILE A 52 19.837 7.538 -4.268 1.00 0.25 C ATOM 800 CG2 ILE A 52 22.074 8.644 -4.550 1.00 0.28 C ATOM 801 CD1 ILE A 52 19.360 7.720 -5.694 1.00 0.31 C ATOM 0 H ILE A 52 19.144 9.434 -2.001 1.00 0.20 H new ATOM 0 HA ILE A 52 21.199 7.459 -2.052 1.00 0.21 H new ATOM 0 HB ILE A 52 20.273 9.618 -3.959 1.00 0.23 H new ATOM 0 HG12 ILE A 52 20.363 6.587 -4.189 1.00 0.25 H new ATOM 0 HG13 ILE A 52 18.971 7.479 -3.609 1.00 0.25 H new ATOM 0 HG21 ILE A 52 21.872 8.749 -5.616 1.00 0.28 H new ATOM 0 HG22 ILE A 52 22.701 9.471 -4.216 1.00 0.28 H new ATOM 0 HG23 ILE A 52 22.591 7.701 -4.370 1.00 0.28 H new ATOM 0 HD11 ILE A 52 18.712 6.888 -5.970 1.00 0.31 H new ATOM 0 HD12 ILE A 52 18.805 8.655 -5.776 1.00 0.31 H new ATOM 0 HD13 ILE A 52 20.219 7.748 -6.364 1.00 0.31 H new ATOM 813 N ALA A 53 22.122 10.653 -2.009 1.00 0.29 N ATOM 814 CA ALA A 53 23.206 11.554 -1.644 1.00 0.36 C ATOM 815 C ALA A 53 23.507 11.399 -0.166 1.00 0.38 C ATOM 816 O ALA A 53 24.636 11.579 0.288 1.00 0.45 O ATOM 817 CB ALA A 53 22.825 12.993 -1.961 1.00 0.40 C ATOM 0 H ALA A 53 21.295 11.118 -2.383 1.00 0.29 H new ATOM 0 HA ALA A 53 24.096 11.303 -2.221 1.00 0.36 H new ATOM 0 HB1 ALA A 53 23.644 13.656 -1.683 1.00 0.40 H new ATOM 0 HB2 ALA A 53 22.626 13.090 -3.028 1.00 0.40 H new ATOM 0 HB3 ALA A 53 21.932 13.265 -1.399 1.00 0.40 H new ATOM 823 N GLU A 54 22.457 11.063 0.568 1.00 0.40 N ATOM 824 CA GLU A 54 22.531 10.849 2.001 1.00 0.47 C ATOM 825 C GLU A 54 23.542 9.759 2.350 1.00 0.40 C ATOM 826 O GLU A 54 24.466 9.984 3.132 1.00 0.45 O ATOM 827 CB GLU A 54 21.135 10.481 2.510 1.00 0.59 C ATOM 828 CG GLU A 54 21.135 9.531 3.687 1.00 0.69 C ATOM 829 CD GLU A 54 19.803 9.493 4.411 1.00 1.02 C ATOM 830 OE1 GLU A 54 19.582 10.351 5.290 1.00 1.27 O ATOM 831 OE2 GLU A 54 18.983 8.605 4.098 1.00 1.47 O ATOM 0 H GLU A 54 21.523 10.931 0.180 1.00 0.40 H new ATOM 0 HA GLU A 54 22.872 11.764 2.485 1.00 0.47 H new ATOM 0 HB2 GLU A 54 20.612 11.394 2.794 1.00 0.59 H new ATOM 0 HB3 GLU A 54 20.570 10.031 1.694 1.00 0.59 H new ATOM 0 HG2 GLU A 54 21.383 8.528 3.339 1.00 0.69 H new ATOM 0 HG3 GLU A 54 21.916 9.827 4.387 1.00 0.69 H new ATOM 838 N ALA A 55 23.362 8.579 1.765 1.00 0.33 N ATOM 839 CA ALA A 55 24.256 7.457 2.019 1.00 0.31 C ATOM 840 C ALA A 55 25.676 7.770 1.562 1.00 0.33 C ATOM 841 O ALA A 55 26.647 7.285 2.142 1.00 0.41 O ATOM 842 CB ALA A 55 23.739 6.203 1.333 1.00 0.37 C ATOM 0 H ALA A 55 22.605 8.376 1.112 1.00 0.33 H new ATOM 0 HA ALA A 55 24.282 7.282 3.095 1.00 0.31 H new ATOM 0 HB1 ALA A 55 24.417 5.373 1.532 1.00 0.37 H new ATOM 0 HB2 ALA A 55 22.748 5.961 1.716 1.00 0.37 H new ATOM 0 HB3 ALA A 55 23.681 6.374 0.258 1.00 0.37 H new ATOM 848 N GLU A 56 25.792 8.583 0.516 1.00 0.34 N ATOM 849 CA GLU A 56 27.097 8.963 -0.013 1.00 0.44 C ATOM 850 C GLU A 56 27.845 9.852 0.974 1.00 0.52 C ATOM 851 O GLU A 56 29.076 9.907 0.966 1.00 0.65 O ATOM 852 CB GLU A 56 26.940 9.685 -1.353 1.00 0.50 C ATOM 853 CG GLU A 56 26.295 8.829 -2.432 1.00 0.61 C ATOM 854 CD GLU A 56 26.223 9.538 -3.769 1.00 1.09 C ATOM 855 OE1 GLU A 56 27.183 9.414 -4.559 1.00 1.31 O ATOM 856 OE2 GLU A 56 25.208 10.217 -4.028 1.00 1.88 O ATOM 0 H GLU A 56 25.000 8.990 0.019 1.00 0.34 H new ATOM 0 HA GLU A 56 27.677 8.053 -0.167 1.00 0.44 H new ATOM 0 HB2 GLU A 56 26.339 10.582 -1.205 1.00 0.50 H new ATOM 0 HB3 GLU A 56 27.921 10.012 -1.698 1.00 0.50 H new ATOM 0 HG2 GLU A 56 26.861 7.904 -2.545 1.00 0.61 H new ATOM 0 HG3 GLU A 56 25.289 8.550 -2.117 1.00 0.61 H new ATOM 863 N ASN A 57 27.095 10.549 1.823 1.00 0.54 N ATOM 864 CA ASN A 57 27.689 11.435 2.818 1.00 0.68 C ATOM 865 C ASN A 57 28.081 10.656 4.069 1.00 0.70 C ATOM 866 O ASN A 57 29.091 10.953 4.708 1.00 0.98 O ATOM 867 CB ASN A 57 26.712 12.554 3.185 1.00 0.79 C ATOM 868 CG ASN A 57 27.314 13.550 4.158 1.00 0.96 C ATOM 869 OD1 ASN A 57 28.525 13.770 4.168 1.00 1.37 O ATOM 870 ND2 ASN A 57 26.469 14.159 4.982 1.00 1.66 N ATOM 0 H ASN A 57 26.076 10.517 1.842 1.00 0.54 H new ATOM 0 HA ASN A 57 28.588 11.876 2.387 1.00 0.68 H new ATOM 0 HB2 ASN A 57 26.404 13.076 2.279 1.00 0.79 H new ATOM 0 HB3 ASN A 57 25.814 12.119 3.623 1.00 0.79 H new ATOM 0 HD21 ASN A 57 26.817 14.839 5.658 1.00 1.66 H new ATOM 0 HD22 ASN A 57 25.472 13.946 4.939 1.00 1.66 H new ATOM 877 N ASN A 58 27.274 9.656 4.412 1.00 0.64 N ATOM 878 CA ASN A 58 27.534 8.828 5.584 1.00 0.70 C ATOM 879 C ASN A 58 28.458 7.665 5.231 1.00 0.63 C ATOM 880 O ASN A 58 29.605 7.614 5.672 1.00 0.89 O ATOM 881 CB ASN A 58 26.220 8.294 6.158 1.00 0.79 C ATOM 882 CG ASN A 58 25.271 9.405 6.564 1.00 1.13 C ATOM 883 OD1 ASN A 58 25.700 10.489 6.962 1.00 2.14 O ATOM 884 ND2 ASN A 58 23.974 9.141 6.463 1.00 1.12 N ATOM 0 H ASN A 58 26.434 9.400 3.894 1.00 0.64 H new ATOM 0 HA ASN A 58 28.026 9.446 6.335 1.00 0.70 H new ATOM 0 HB2 ASN A 58 25.735 7.659 5.417 1.00 0.79 H new ATOM 0 HB3 ASN A 58 26.433 7.668 7.024 1.00 0.79 H new ATOM 0 HD21 ASN A 58 23.288 9.850 6.720 1.00 1.12 H new ATOM 0 HD22 ASN A 58 23.664 8.229 6.128 1.00 1.12 H new ATOM 891 N ASN A 59 27.945 6.732 4.434 1.00 0.54 N ATOM 892 CA ASN A 59 28.722 5.569 4.015 1.00 0.72 C ATOM 893 C ASN A 59 29.418 5.839 2.684 1.00 0.82 C ATOM 894 O ASN A 59 29.489 6.981 2.232 1.00 1.69 O ATOM 895 CB ASN A 59 27.816 4.342 3.888 1.00 0.81 C ATOM 896 CG ASN A 59 26.929 4.146 5.102 1.00 0.88 C ATOM 897 OD1 ASN A 59 27.304 4.491 6.223 1.00 1.09 O ATOM 898 ND2 ASN A 59 25.743 3.588 4.883 1.00 0.93 N ATOM 0 H ASN A 59 26.994 6.758 4.065 1.00 0.54 H new ATOM 0 HA ASN A 59 29.480 5.374 4.773 1.00 0.72 H new ATOM 0 HB2 ASN A 59 27.193 4.445 3.000 1.00 0.81 H new ATOM 0 HB3 ASN A 59 28.431 3.454 3.744 1.00 0.81 H new ATOM 0 HD21 ASN A 59 25.102 3.430 5.661 1.00 0.93 H new ATOM 0 HD22 ASN A 59 25.473 3.318 3.937 1.00 0.93 H new ATOM 905 N ASN A 60 29.927 4.781 2.060 1.00 0.78 N ATOM 906 CA ASN A 60 30.612 4.907 0.779 1.00 0.73 C ATOM 907 C ASN A 60 29.636 5.330 -0.314 1.00 0.61 C ATOM 908 O ASN A 60 29.946 6.185 -1.144 1.00 0.68 O ATOM 909 CB ASN A 60 31.279 3.583 0.401 1.00 0.76 C ATOM 910 CG ASN A 60 32.394 3.201 1.356 1.00 1.00 C ATOM 911 OD1 ASN A 60 32.360 3.544 2.537 1.00 1.32 O ATOM 912 ND2 ASN A 60 33.390 2.488 0.845 1.00 1.74 N ATOM 0 H ASN A 60 29.878 3.828 2.421 1.00 0.78 H new ATOM 0 HA ASN A 60 31.379 5.675 0.876 1.00 0.73 H new ATOM 0 HB2 ASN A 60 30.529 2.792 0.389 1.00 0.76 H new ATOM 0 HB3 ASN A 60 31.680 3.657 -0.610 1.00 0.76 H new ATOM 0 HD21 ASN A 60 34.169 2.202 1.438 1.00 1.74 H new ATOM 0 HD22 ASN A 60 33.376 2.226 -0.141 1.00 1.74 H new ATOM 919 N GLY A 61 28.453 4.724 -0.303 1.00 0.53 N ATOM 920 CA GLY A 61 27.440 5.044 -1.293 1.00 0.47 C ATOM 921 C GLY A 61 26.389 3.959 -1.409 1.00 0.41 C ATOM 922 O GLY A 61 25.377 4.133 -2.088 1.00 0.56 O ATOM 0 H GLY A 61 28.177 4.015 0.376 1.00 0.53 H new ATOM 0 HA2 GLY A 61 26.960 5.986 -1.027 1.00 0.47 H new ATOM 0 HA3 GLY A 61 27.916 5.191 -2.262 1.00 0.47 H new ATOM 926 N GLN A 62 26.630 2.837 -0.739 1.00 0.28 N ATOM 927 CA GLN A 62 25.706 1.712 -0.763 1.00 0.22 C ATOM 928 C GLN A 62 24.970 1.578 0.566 1.00 0.19 C ATOM 929 O GLN A 62 25.437 2.060 1.599 1.00 0.22 O ATOM 930 CB GLN A 62 26.440 0.412 -1.105 1.00 0.22 C ATOM 931 CG GLN A 62 27.869 0.335 -0.578 1.00 0.31 C ATOM 932 CD GLN A 62 27.969 0.412 0.936 1.00 1.15 C ATOM 933 OE1 GLN A 62 28.972 0.877 1.478 1.00 1.44 O ATOM 934 NE2 GLN A 62 26.930 -0.034 1.628 1.00 1.87 N ATOM 0 H GLN A 62 27.463 2.684 -0.170 1.00 0.28 H new ATOM 0 HA GLN A 62 24.967 1.904 -1.541 1.00 0.22 H new ATOM 0 HB2 GLN A 62 25.872 -0.427 -0.703 1.00 0.22 H new ATOM 0 HB3 GLN A 62 26.459 0.295 -2.188 1.00 0.22 H new ATOM 0 HG2 GLN A 62 28.321 -0.598 -0.916 1.00 0.31 H new ATOM 0 HG3 GLN A 62 28.451 1.147 -1.013 1.00 0.31 H new ATOM 0 HE21 GLN A 62 26.117 -0.412 1.141 1.00 1.87 H new ATOM 0 HE22 GLN A 62 26.943 0.001 2.647 1.00 1.87 H new ATOM 943 N LEU A 63 23.809 0.936 0.525 1.00 0.19 N ATOM 944 CA LEU A 63 22.994 0.740 1.719 1.00 0.19 C ATOM 945 C LEU A 63 22.919 -0.737 2.097 1.00 0.18 C ATOM 946 O LEU A 63 23.016 -1.615 1.239 1.00 0.19 O ATOM 947 CB LEU A 63 21.584 1.300 1.494 1.00 0.23 C ATOM 948 CG LEU A 63 20.774 0.629 0.381 1.00 0.25 C ATOM 949 CD1 LEU A 63 20.063 -0.612 0.900 1.00 0.28 C ATOM 950 CD2 LEU A 63 19.769 1.606 -0.208 1.00 0.39 C ATOM 0 H LEU A 63 23.409 0.540 -0.326 1.00 0.19 H new ATOM 0 HA LEU A 63 23.464 1.277 2.543 1.00 0.19 H new ATOM 0 HB2 LEU A 63 21.026 1.215 2.426 1.00 0.23 H new ATOM 0 HB3 LEU A 63 21.667 2.363 1.268 1.00 0.23 H new ATOM 0 HG LEU A 63 21.466 0.323 -0.404 1.00 0.25 H new ATOM 0 HD11 LEU A 63 19.495 -1.071 0.091 1.00 0.28 H new ATOM 0 HD12 LEU A 63 20.799 -1.323 1.275 1.00 0.28 H new ATOM 0 HD13 LEU A 63 19.385 -0.332 1.707 1.00 0.28 H new ATOM 0 HD21 LEU A 63 19.202 1.113 -0.998 1.00 0.39 H new ATOM 0 HD22 LEU A 63 19.087 1.942 0.573 1.00 0.39 H new ATOM 0 HD23 LEU A 63 20.297 2.465 -0.623 1.00 0.39 H new ATOM 962 N ASN A 64 22.729 -0.994 3.388 1.00 0.18 N ATOM 963 CA ASN A 64 22.631 -2.357 3.904 1.00 0.18 C ATOM 964 C ASN A 64 21.171 -2.779 4.028 1.00 0.17 C ATOM 965 O ASN A 64 20.280 -1.935 4.128 1.00 0.17 O ATOM 966 CB ASN A 64 23.324 -2.471 5.263 1.00 0.20 C ATOM 967 CG ASN A 64 24.755 -1.972 5.230 1.00 0.26 C ATOM 968 OD1 ASN A 64 25.686 -2.737 4.984 1.00 0.74 O ATOM 969 ND2 ASN A 64 24.935 -0.680 5.478 1.00 0.61 N ATOM 0 H ASN A 64 22.639 -0.270 4.101 1.00 0.18 H new ATOM 0 HA ASN A 64 23.131 -3.022 3.200 1.00 0.18 H new ATOM 0 HB2 ASN A 64 22.761 -1.902 6.003 1.00 0.20 H new ATOM 0 HB3 ASN A 64 23.313 -3.512 5.586 1.00 0.20 H new ATOM 0 HD21 ASN A 64 25.875 -0.285 5.469 1.00 0.61 H new ATOM 0 HD22 ASN A 64 24.133 -0.082 5.677 1.00 0.61 H new ATOM 976 N PHE A 65 20.927 -4.085 4.011 1.00 0.17 N ATOM 977 CA PHE A 65 19.569 -4.612 4.107 1.00 0.17 C ATOM 978 C PHE A 65 18.810 -4.029 5.301 1.00 0.19 C ATOM 979 O PHE A 65 17.592 -3.873 5.243 1.00 0.18 O ATOM 980 CB PHE A 65 19.587 -6.140 4.209 1.00 0.19 C ATOM 981 CG PHE A 65 18.210 -6.741 4.290 1.00 0.18 C ATOM 982 CD1 PHE A 65 17.501 -7.042 3.139 1.00 0.20 C ATOM 983 CD2 PHE A 65 17.619 -6.990 5.521 1.00 0.19 C ATOM 984 CE1 PHE A 65 16.232 -7.579 3.211 1.00 0.21 C ATOM 985 CE2 PHE A 65 16.348 -7.526 5.598 1.00 0.19 C ATOM 986 CZ PHE A 65 15.653 -7.821 4.442 1.00 0.19 C ATOM 0 H PHE A 65 21.651 -4.799 3.932 1.00 0.17 H new ATOM 0 HA PHE A 65 19.049 -4.314 3.197 1.00 0.17 H new ATOM 0 HB2 PHE A 65 20.106 -6.550 3.343 1.00 0.19 H new ATOM 0 HB3 PHE A 65 20.158 -6.433 5.090 1.00 0.19 H new ATOM 0 HD1 PHE A 65 17.947 -6.854 2.173 1.00 0.20 H new ATOM 0 HD2 PHE A 65 18.159 -6.762 6.428 1.00 0.19 H new ATOM 0 HE1 PHE A 65 15.691 -7.810 2.305 1.00 0.21 H new ATOM 0 HE2 PHE A 65 15.898 -7.714 6.562 1.00 0.19 H new ATOM 0 HZ PHE A 65 14.659 -8.240 4.500 1.00 0.19 H new ATOM 996 N THR A 66 19.521 -3.708 6.379 1.00 0.23 N ATOM 997 CA THR A 66 18.870 -3.163 7.569 1.00 0.25 C ATOM 998 C THR A 66 18.254 -1.798 7.305 1.00 0.24 C ATOM 999 O THR A 66 17.067 -1.592 7.547 1.00 0.24 O ATOM 1000 CB THR A 66 19.829 -3.037 8.763 1.00 0.30 C ATOM 1001 OG1 THR A 66 20.404 -4.313 9.072 1.00 0.33 O ATOM 1002 CG2 THR A 66 19.082 -2.499 9.980 1.00 0.32 C ATOM 0 H THR A 66 20.533 -3.813 6.454 1.00 0.23 H new ATOM 0 HA THR A 66 18.086 -3.879 7.817 1.00 0.25 H new ATOM 0 HB THR A 66 20.627 -2.343 8.499 1.00 0.30 H new ATOM 0 HG1 THR A 66 21.015 -4.221 9.833 1.00 0.33 H new ATOM 0 HG21 THR A 66 19.770 -2.413 10.821 1.00 0.32 H new ATOM 0 HG22 THR A 66 18.668 -1.518 9.748 1.00 0.32 H new ATOM 0 HG23 THR A 66 18.273 -3.181 10.241 1.00 0.32 H new ATOM 1010 N GLU A 67 19.057 -0.855 6.820 1.00 0.25 N ATOM 1011 CA GLU A 67 18.543 0.479 6.555 1.00 0.26 C ATOM 1012 C GLU A 67 17.409 0.421 5.538 1.00 0.23 C ATOM 1013 O GLU A 67 16.397 1.102 5.701 1.00 0.23 O ATOM 1014 CB GLU A 67 19.653 1.430 6.097 1.00 0.29 C ATOM 1015 CG GLU A 67 20.538 0.885 4.992 1.00 0.27 C ATOM 1016 CD GLU A 67 21.723 1.789 4.710 1.00 0.45 C ATOM 1017 OE1 GLU A 67 21.527 2.846 4.075 1.00 0.66 O ATOM 1018 OE2 GLU A 67 22.849 1.437 5.122 1.00 0.61 O ATOM 0 H GLU A 67 20.046 -0.988 6.607 1.00 0.25 H new ATOM 0 HA GLU A 67 18.145 0.877 7.488 1.00 0.26 H new ATOM 0 HB2 GLU A 67 19.198 2.360 5.755 1.00 0.29 H new ATOM 0 HB3 GLU A 67 20.278 1.678 6.955 1.00 0.29 H new ATOM 0 HG2 GLU A 67 20.897 -0.106 5.271 1.00 0.27 H new ATOM 0 HG3 GLU A 67 19.949 0.766 4.082 1.00 0.27 H new ATOM 1025 N PHE A 68 17.569 -0.390 4.490 1.00 0.22 N ATOM 1026 CA PHE A 68 16.516 -0.517 3.489 1.00 0.20 C ATOM 1027 C PHE A 68 15.240 -1.057 4.113 1.00 0.18 C ATOM 1028 O PHE A 68 14.182 -0.448 3.996 1.00 0.19 O ATOM 1029 CB PHE A 68 16.926 -1.441 2.341 1.00 0.19 C ATOM 1030 CG PHE A 68 15.789 -1.701 1.388 1.00 0.18 C ATOM 1031 CD1 PHE A 68 15.001 -0.665 0.910 1.00 0.25 C ATOM 1032 CD2 PHE A 68 15.525 -2.992 0.956 1.00 0.17 C ATOM 1033 CE1 PHE A 68 13.973 -0.917 0.019 1.00 0.27 C ATOM 1034 CE2 PHE A 68 14.499 -3.249 0.071 1.00 0.18 C ATOM 1035 CZ PHE A 68 13.658 -2.148 -0.338 1.00 0.23 C ATOM 0 H PHE A 68 18.400 -0.956 4.317 1.00 0.22 H new ATOM 0 HA PHE A 68 16.344 0.483 3.092 1.00 0.20 H new ATOM 0 HB2 PHE A 68 17.759 -0.995 1.797 1.00 0.19 H new ATOM 0 HB3 PHE A 68 17.281 -2.388 2.748 1.00 0.19 H new ATOM 0 HD1 PHE A 68 15.191 0.347 1.236 1.00 0.25 H new ATOM 0 HD2 PHE A 68 16.132 -3.809 1.318 1.00 0.17 H new ATOM 0 HE1 PHE A 68 13.416 -0.089 -0.393 1.00 0.27 H new ATOM 0 HE2 PHE A 68 14.329 -4.247 -0.306 1.00 0.18 H new ATOM 0 HZ PHE A 68 12.776 -2.331 -0.933 1.00 0.23 H new ATOM 1045 N CYS A 69 15.342 -2.220 4.753 1.00 0.18 N ATOM 1046 CA CYS A 69 14.187 -2.831 5.401 1.00 0.19 C ATOM 1047 C CYS A 69 13.497 -1.803 6.282 1.00 0.20 C ATOM 1048 O CYS A 69 12.269 -1.771 6.386 1.00 0.20 O ATOM 1049 CB CYS A 69 14.606 -4.051 6.230 1.00 0.21 C ATOM 1050 SG CYS A 69 15.174 -3.664 7.902 1.00 0.26 S ATOM 0 H CYS A 69 16.207 -2.754 4.836 1.00 0.18 H new ATOM 0 HA CYS A 69 13.493 -3.172 4.633 1.00 0.19 H new ATOM 0 HB2 CYS A 69 13.761 -4.736 6.297 1.00 0.21 H new ATOM 0 HB3 CYS A 69 15.402 -4.577 5.702 1.00 0.21 H new ATOM 0 HG CYS A 69 16.011 -2.670 7.857 1.00 0.26 H new ATOM 1056 N GLY A 70 14.306 -0.954 6.905 1.00 0.22 N ATOM 1057 CA GLY A 70 13.772 0.089 7.748 1.00 0.25 C ATOM 1058 C GLY A 70 13.032 1.123 6.923 1.00 0.25 C ATOM 1059 O GLY A 70 12.038 1.700 7.366 1.00 0.27 O ATOM 0 H GLY A 70 15.324 -0.973 6.839 1.00 0.22 H new ATOM 0 HA2 GLY A 70 13.097 -0.344 8.486 1.00 0.25 H new ATOM 0 HA3 GLY A 70 14.582 0.568 8.298 1.00 0.25 H new ATOM 1063 N ILE A 71 13.536 1.351 5.710 1.00 0.25 N ATOM 1064 CA ILE A 71 12.954 2.313 4.781 1.00 0.27 C ATOM 1065 C ILE A 71 11.650 1.819 4.175 1.00 0.26 C ATOM 1066 O ILE A 71 10.631 2.491 4.266 1.00 0.29 O ATOM 1067 CB ILE A 71 13.940 2.650 3.648 1.00 0.28 C ATOM 1068 CG1 ILE A 71 15.053 3.531 4.207 1.00 0.30 C ATOM 1069 CG2 ILE A 71 13.223 3.338 2.491 1.00 0.30 C ATOM 1070 CD1 ILE A 71 16.089 3.943 3.179 1.00 0.33 C ATOM 0 H ILE A 71 14.360 0.872 5.346 1.00 0.25 H new ATOM 0 HA ILE A 71 12.741 3.209 5.364 1.00 0.27 H new ATOM 0 HB ILE A 71 14.373 1.729 3.257 1.00 0.28 H new ATOM 0 HG12 ILE A 71 14.610 4.428 4.640 1.00 0.30 H new ATOM 0 HG13 ILE A 71 15.552 2.999 5.017 1.00 0.30 H new ATOM 0 HG21 ILE A 71 13.940 3.566 1.703 1.00 0.30 H new ATOM 0 HG22 ILE A 71 12.450 2.678 2.098 1.00 0.30 H new ATOM 0 HG23 ILE A 71 12.766 4.262 2.844 1.00 0.30 H new ATOM 0 HD11 ILE A 71 16.845 4.567 3.655 1.00 0.33 H new ATOM 0 HD12 ILE A 71 16.562 3.054 2.762 1.00 0.33 H new ATOM 0 HD13 ILE A 71 15.605 4.505 2.380 1.00 0.33 H new ATOM 1082 N MET A 72 11.679 0.656 3.536 1.00 0.24 N ATOM 1083 CA MET A 72 10.473 0.118 2.932 1.00 0.25 C ATOM 1084 C MET A 72 9.356 0.102 3.964 1.00 0.27 C ATOM 1085 O MET A 72 8.191 0.328 3.641 1.00 0.31 O ATOM 1086 CB MET A 72 10.724 -1.278 2.352 1.00 0.23 C ATOM 1087 CG MET A 72 11.363 -2.259 3.324 1.00 0.26 C ATOM 1088 SD MET A 72 10.212 -2.891 4.562 1.00 0.49 S ATOM 1089 CE MET A 72 8.840 -3.401 3.534 1.00 0.33 C ATOM 0 H MET A 72 12.512 0.077 3.425 1.00 0.24 H new ATOM 0 HA MET A 72 10.172 0.757 2.102 1.00 0.25 H new ATOM 0 HB2 MET A 72 9.775 -1.691 2.009 1.00 0.23 H new ATOM 0 HB3 MET A 72 11.366 -1.184 1.476 1.00 0.23 H new ATOM 0 HG2 MET A 72 11.778 -3.096 2.763 1.00 0.26 H new ATOM 0 HG3 MET A 72 12.196 -1.769 3.829 1.00 0.26 H new ATOM 0 HE1 MET A 72 8.147 -4.001 4.124 1.00 0.33 H new ATOM 0 HE2 MET A 72 8.324 -2.520 3.153 1.00 0.33 H new ATOM 0 HE3 MET A 72 9.212 -3.993 2.698 1.00 0.33 H new ATOM 1099 N ALA A 73 9.727 -0.170 5.212 1.00 0.26 N ATOM 1100 CA ALA A 73 8.770 -0.180 6.306 1.00 0.29 C ATOM 1101 C ALA A 73 8.149 1.202 6.497 1.00 0.31 C ATOM 1102 O ALA A 73 6.927 1.336 6.551 1.00 0.36 O ATOM 1103 CB ALA A 73 9.449 -0.643 7.586 1.00 0.29 C ATOM 0 H ALA A 73 10.685 -0.386 5.488 1.00 0.26 H new ATOM 0 HA ALA A 73 7.969 -0.877 6.061 1.00 0.29 H new ATOM 0 HB1 ALA A 73 8.725 -0.648 8.401 1.00 0.29 H new ATOM 0 HB2 ALA A 73 9.843 -1.649 7.445 1.00 0.29 H new ATOM 0 HB3 ALA A 73 10.266 0.036 7.831 1.00 0.29 H new ATOM 1109 N LYS A 74 8.996 2.234 6.601 1.00 0.31 N ATOM 1110 CA LYS A 74 8.507 3.599 6.785 1.00 0.35 C ATOM 1111 C LYS A 74 7.767 4.077 5.541 1.00 0.38 C ATOM 1112 O LYS A 74 6.938 4.983 5.612 1.00 0.44 O ATOM 1113 CB LYS A 74 9.663 4.555 7.111 1.00 0.38 C ATOM 1114 CG LYS A 74 10.568 4.864 5.929 1.00 0.43 C ATOM 1115 CD LYS A 74 11.667 5.835 6.305 1.00 0.48 C ATOM 1116 CE LYS A 74 12.510 6.216 5.099 1.00 1.38 C ATOM 1117 NZ LYS A 74 13.586 7.182 5.457 1.00 2.11 N ATOM 0 H LYS A 74 10.012 2.148 6.561 1.00 0.31 H new ATOM 0 HA LYS A 74 7.813 3.596 7.626 1.00 0.35 H new ATOM 0 HB2 LYS A 74 9.251 5.489 7.493 1.00 0.38 H new ATOM 0 HB3 LYS A 74 10.264 4.122 7.911 1.00 0.38 H new ATOM 0 HG2 LYS A 74 11.010 3.940 5.558 1.00 0.43 H new ATOM 0 HG3 LYS A 74 9.975 5.283 5.116 1.00 0.43 H new ATOM 0 HD2 LYS A 74 11.228 6.732 6.741 1.00 0.48 H new ATOM 0 HD3 LYS A 74 12.303 5.388 7.069 1.00 0.48 H new ATOM 0 HE2 LYS A 74 12.956 5.319 4.669 1.00 1.38 H new ATOM 0 HE3 LYS A 74 11.870 6.653 4.332 1.00 1.38 H new ATOM 0 HZ1 LYS A 74 14.138 7.417 4.608 1.00 2.11 H new ATOM 0 HZ2 LYS A 74 13.160 8.049 5.843 1.00 2.11 H new ATOM 0 HZ3 LYS A 74 14.212 6.756 6.170 1.00 2.11 H new ATOM 1131 N GLN A 75 8.076 3.461 4.403 1.00 0.36 N ATOM 1132 CA GLN A 75 7.438 3.816 3.143 1.00 0.42 C ATOM 1133 C GLN A 75 5.981 3.383 3.148 1.00 0.51 C ATOM 1134 O GLN A 75 5.164 3.904 2.386 1.00 0.63 O ATOM 1135 CB GLN A 75 8.177 3.182 1.963 1.00 0.43 C ATOM 1136 CG GLN A 75 9.499 3.858 1.634 1.00 0.69 C ATOM 1137 CD GLN A 75 9.319 5.231 1.012 1.00 0.90 C ATOM 1138 OE1 GLN A 75 8.343 5.931 1.286 1.00 1.48 O ATOM 1139 NE2 GLN A 75 10.264 5.625 0.166 1.00 0.80 N ATOM 0 H GLN A 75 8.765 2.713 4.330 1.00 0.36 H new ATOM 0 HA GLN A 75 7.481 4.899 3.031 1.00 0.42 H new ATOM 0 HB2 GLN A 75 8.362 2.131 2.184 1.00 0.43 H new ATOM 0 HB3 GLN A 75 7.534 3.214 1.083 1.00 0.43 H new ATOM 0 HG2 GLN A 75 10.091 3.952 2.545 1.00 0.69 H new ATOM 0 HG3 GLN A 75 10.065 3.226 0.950 1.00 0.69 H new ATOM 0 HE21 GLN A 75 11.056 5.015 -0.034 1.00 0.80 H new ATOM 0 HE22 GLN A 75 10.197 6.538 -0.284 1.00 0.80 H new ATOM 1148 N MET A 76 5.665 2.418 4.006 1.00 0.49 N ATOM 1149 CA MET A 76 4.298 1.931 4.143 1.00 0.59 C ATOM 1150 C MET A 76 3.482 2.933 4.954 1.00 0.75 C ATOM 1151 O MET A 76 2.570 2.565 5.695 1.00 1.15 O ATOM 1152 CB MET A 76 4.294 0.565 4.826 1.00 0.57 C ATOM 1153 CG MET A 76 5.059 -0.486 4.047 1.00 0.63 C ATOM 1154 SD MET A 76 4.528 -2.163 4.425 1.00 0.96 S ATOM 1155 CE MET A 76 5.063 -2.997 2.936 1.00 0.68 C ATOM 0 H MET A 76 6.339 1.957 4.618 1.00 0.49 H new ATOM 0 HA MET A 76 3.851 1.823 3.155 1.00 0.59 H new ATOM 0 HB2 MET A 76 4.729 0.661 5.821 1.00 0.57 H new ATOM 0 HB3 MET A 76 3.264 0.234 4.959 1.00 0.57 H new ATOM 0 HG2 MET A 76 4.934 -0.303 2.980 1.00 0.63 H new ATOM 0 HG3 MET A 76 6.123 -0.389 4.264 1.00 0.63 H new ATOM 0 HE1 MET A 76 5.465 -3.977 3.192 1.00 0.68 H new ATOM 0 HE2 MET A 76 4.215 -3.117 2.262 1.00 0.68 H new ATOM 0 HE3 MET A 76 5.836 -2.405 2.445 1.00 0.68 H new ATOM 1165 N ARG A 77 3.831 4.206 4.792 1.00 1.01 N ATOM 1166 CA ARG A 77 3.189 5.302 5.504 1.00 1.21 C ATOM 1167 C ARG A 77 3.745 6.641 5.008 1.00 1.56 C ATOM 1168 O ARG A 77 3.048 7.657 5.020 1.00 1.86 O ATOM 1169 CB ARG A 77 3.411 5.134 7.013 1.00 1.28 C ATOM 1170 CG ARG A 77 3.467 6.438 7.788 1.00 1.81 C ATOM 1171 CD ARG A 77 3.172 6.219 9.264 1.00 2.26 C ATOM 1172 NE ARG A 77 1.867 5.601 9.476 1.00 2.93 N ATOM 1173 CZ ARG A 77 1.432 5.178 10.660 1.00 3.56 C ATOM 1174 NH1 ARG A 77 2.198 5.304 11.735 1.00 3.66 N ATOM 1175 NH2 ARG A 77 0.230 4.629 10.769 1.00 4.44 N ATOM 0 H ARG A 77 4.572 4.506 4.159 1.00 1.01 H new ATOM 0 HA ARG A 77 2.116 5.289 5.311 1.00 1.21 H new ATOM 0 HB2 ARG A 77 2.609 4.518 7.419 1.00 1.28 H new ATOM 0 HB3 ARG A 77 4.342 4.590 7.173 1.00 1.28 H new ATOM 0 HG2 ARG A 77 4.453 6.888 7.675 1.00 1.81 H new ATOM 0 HG3 ARG A 77 2.746 7.142 7.372 1.00 1.81 H new ATOM 0 HD2 ARG A 77 3.947 5.587 9.699 1.00 2.26 H new ATOM 0 HD3 ARG A 77 3.210 7.175 9.787 1.00 2.26 H new ATOM 0 HE ARG A 77 1.253 5.487 8.670 1.00 2.93 H new ATOM 0 HH11 ARG A 77 3.123 5.726 11.655 1.00 3.66 H new ATOM 0 HH12 ARG A 77 1.862 4.979 12.642 1.00 3.66 H new ATOM 0 HH21 ARG A 77 -0.362 4.531 9.944 1.00 4.44 H new ATOM 0 HH22 ARG A 77 -0.102 4.305 11.677 1.00 4.44 H new ATOM 1189 N GLU A 78 5.010 6.623 4.580 1.00 1.79 N ATOM 1190 CA GLU A 78 5.685 7.806 4.047 1.00 2.41 C ATOM 1191 C GLU A 78 5.941 8.864 5.115 1.00 3.29 C ATOM 1192 O GLU A 78 5.011 9.504 5.610 1.00 3.87 O ATOM 1193 CB GLU A 78 4.880 8.411 2.895 1.00 2.38 C ATOM 1194 CG GLU A 78 4.787 7.498 1.684 1.00 2.16 C ATOM 1195 CD GLU A 78 4.124 8.171 0.498 1.00 2.80 C ATOM 1196 OE1 GLU A 78 2.877 8.158 0.429 1.00 3.22 O ATOM 1197 OE2 GLU A 78 4.852 8.710 -0.363 1.00 3.27 O ATOM 0 H GLU A 78 5.594 5.787 4.594 1.00 1.79 H new ATOM 0 HA GLU A 78 6.655 7.474 3.678 1.00 2.41 H new ATOM 0 HB2 GLU A 78 3.874 8.642 3.246 1.00 2.38 H new ATOM 0 HB3 GLU A 78 5.338 9.354 2.596 1.00 2.38 H new ATOM 0 HG2 GLU A 78 5.788 7.173 1.400 1.00 2.16 H new ATOM 0 HG3 GLU A 78 4.225 6.603 1.950 1.00 2.16 H new ATOM 1204 N THR A 79 7.223 9.037 5.448 1.00 3.77 N ATOM 1205 CA THR A 79 7.663 10.021 6.439 1.00 4.81 C ATOM 1206 C THR A 79 7.343 9.596 7.865 1.00 5.38 C ATOM 1207 O THR A 79 8.177 9.729 8.761 1.00 6.26 O ATOM 1208 CB THR A 79 7.057 11.398 6.190 1.00 5.61 C ATOM 1209 OG1 THR A 79 7.043 11.691 4.788 1.00 6.33 O ATOM 1210 CG2 THR A 79 7.834 12.474 6.934 1.00 6.12 C ATOM 0 H THR A 79 7.985 8.498 5.037 1.00 3.77 H new ATOM 0 HA THR A 79 8.745 10.079 6.324 1.00 4.81 H new ATOM 0 HB THR A 79 6.033 11.388 6.562 1.00 5.61 H new ATOM 0 HG1 THR A 79 6.650 12.577 4.643 1.00 6.33 H new ATOM 0 HG21 THR A 79 7.383 13.447 6.741 1.00 6.12 H new ATOM 0 HG22 THR A 79 7.808 12.268 8.004 1.00 6.12 H new ATOM 0 HG23 THR A 79 8.869 12.479 6.591 1.00 6.12 H new ATOM 1218 N ASP A 80 6.132 9.089 8.072 1.00 5.21 N ATOM 1219 CA ASP A 80 5.694 8.657 9.393 1.00 6.18 C ATOM 1220 C ASP A 80 5.759 9.815 10.396 1.00 7.07 C ATOM 1221 O ASP A 80 5.602 9.620 11.600 1.00 7.91 O ATOM 1222 CB ASP A 80 6.539 7.477 9.870 1.00 6.70 C ATOM 1223 CG ASP A 80 6.695 6.407 8.807 1.00 6.31 C ATOM 1224 OD1 ASP A 80 7.411 6.655 7.814 1.00 6.38 O ATOM 1225 OD2 ASP A 80 6.101 5.320 8.967 1.00 6.26 O ATOM 0 H ASP A 80 5.434 8.967 7.338 1.00 5.21 H new ATOM 0 HA ASP A 80 4.655 8.333 9.324 1.00 6.18 H new ATOM 0 HB2 ASP A 80 7.524 7.836 10.167 1.00 6.70 H new ATOM 0 HB3 ASP A 80 6.079 7.040 10.756 1.00 6.70 H new ATOM 1230 N THR A 81 5.981 11.018 9.869 1.00 7.15 N ATOM 1231 CA THR A 81 6.059 12.248 10.664 1.00 8.23 C ATOM 1232 C THR A 81 6.868 12.109 11.958 1.00 9.23 C ATOM 1233 O THR A 81 8.097 12.182 11.940 1.00 9.95 O ATOM 1234 CB THR A 81 4.657 12.789 10.999 1.00 8.38 C ATOM 1235 OG1 THR A 81 3.808 11.725 11.445 1.00 7.82 O ATOM 1236 CG2 THR A 81 4.039 13.467 9.786 1.00 8.29 C ATOM 0 H THR A 81 6.113 11.170 8.869 1.00 7.15 H new ATOM 0 HA THR A 81 6.592 12.955 10.028 1.00 8.23 H new ATOM 0 HB THR A 81 4.757 13.524 11.797 1.00 8.38 H new ATOM 0 HG1 THR A 81 3.361 11.990 12.276 1.00 7.82 H new ATOM 0 HG21 THR A 81 3.049 13.842 10.044 1.00 8.29 H new ATOM 0 HG22 THR A 81 4.671 14.298 9.472 1.00 8.29 H new ATOM 0 HG23 THR A 81 3.954 12.748 8.971 1.00 8.29 H new ATOM 1244 N GLU A 82 6.173 11.911 13.078 1.00 9.45 N ATOM 1245 CA GLU A 82 6.823 11.817 14.387 1.00 10.56 C ATOM 1246 C GLU A 82 7.693 10.574 14.524 1.00 10.71 C ATOM 1247 O GLU A 82 8.692 10.596 15.232 1.00 11.73 O ATOM 1248 CB GLU A 82 5.779 11.844 15.504 1.00 10.89 C ATOM 1249 CG GLU A 82 5.180 13.219 15.752 1.00 11.44 C ATOM 1250 CD GLU A 82 4.399 13.742 14.562 1.00 10.69 C ATOM 1251 OE1 GLU A 82 3.230 13.338 14.395 1.00 10.52 O ATOM 1252 OE2 GLU A 82 4.956 14.561 13.799 1.00 10.45 O ATOM 0 H GLU A 82 5.158 11.812 13.106 1.00 9.45 H new ATOM 0 HA GLU A 82 7.479 12.683 14.474 1.00 10.56 H new ATOM 0 HB2 GLU A 82 4.977 11.148 15.256 1.00 10.89 H new ATOM 0 HB3 GLU A 82 6.238 11.486 16.426 1.00 10.89 H new ATOM 0 HG2 GLU A 82 4.523 13.173 16.620 1.00 11.44 H new ATOM 0 HG3 GLU A 82 5.979 13.920 15.993 1.00 11.44 H new ATOM 1259 N GLU A 83 7.315 9.492 13.867 1.00 9.86 N ATOM 1260 CA GLU A 83 8.092 8.259 13.946 1.00 10.23 C ATOM 1261 C GLU A 83 9.529 8.495 13.484 1.00 10.94 C ATOM 1262 O GLU A 83 10.480 8.232 14.220 1.00 12.03 O ATOM 1263 CB GLU A 83 7.438 7.179 13.090 1.00 9.26 C ATOM 1264 CG GLU A 83 8.279 5.925 12.920 1.00 9.89 C ATOM 1265 CD GLU A 83 8.566 5.228 14.237 1.00 10.21 C ATOM 1266 OE1 GLU A 83 9.592 5.555 14.871 1.00 10.48 O ATOM 1267 OE2 GLU A 83 7.766 4.354 14.633 1.00 10.36 O ATOM 0 H GLU A 83 6.484 9.437 13.278 1.00 9.86 H new ATOM 0 HA GLU A 83 8.115 7.929 14.985 1.00 10.23 H new ATOM 0 HB2 GLU A 83 6.483 6.905 13.538 1.00 9.26 H new ATOM 0 HB3 GLU A 83 7.221 7.593 12.106 1.00 9.26 H new ATOM 0 HG2 GLU A 83 7.763 5.234 12.253 1.00 9.89 H new ATOM 0 HG3 GLU A 83 9.222 6.187 12.440 1.00 9.89 H new ATOM 1274 N GLU A 84 9.676 8.993 12.260 1.00 10.48 N ATOM 1275 CA GLU A 84 10.993 9.275 11.697 1.00 11.32 C ATOM 1276 C GLU A 84 11.718 10.351 12.499 1.00 12.38 C ATOM 1277 O GLU A 84 12.938 10.306 12.665 1.00 13.44 O ATOM 1278 CB GLU A 84 10.852 9.729 10.242 1.00 10.78 C ATOM 1279 CG GLU A 84 12.179 10.042 9.570 1.00 11.09 C ATOM 1280 CD GLU A 84 12.008 10.555 8.153 1.00 11.33 C ATOM 1281 OE1 GLU A 84 11.816 11.778 7.983 1.00 11.72 O ATOM 1282 OE2 GLU A 84 12.067 9.734 7.214 1.00 11.29 O ATOM 0 H GLU A 84 8.898 9.210 11.638 1.00 10.48 H new ATOM 0 HA GLU A 84 11.581 8.358 11.741 1.00 11.32 H new ATOM 0 HB2 GLU A 84 10.342 8.950 9.675 1.00 10.78 H new ATOM 0 HB3 GLU A 84 10.219 10.615 10.207 1.00 10.78 H new ATOM 0 HG2 GLU A 84 12.714 10.786 10.160 1.00 11.09 H new ATOM 0 HG3 GLU A 84 12.796 9.143 9.555 1.00 11.09 H new ATOM 1289 N MET A 85 10.953 11.314 13.003 1.00 12.20 N ATOM 1290 CA MET A 85 11.517 12.418 13.771 1.00 13.28 C ATOM 1291 C MET A 85 12.086 11.932 15.104 1.00 14.20 C ATOM 1292 O MET A 85 13.249 12.180 15.418 1.00 15.28 O ATOM 1293 CB MET A 85 10.458 13.500 14.006 1.00 13.04 C ATOM 1294 CG MET A 85 10.916 14.589 14.954 1.00 14.20 C ATOM 1295 SD MET A 85 12.509 15.280 14.482 1.00 15.12 S ATOM 1296 CE MET A 85 13.091 15.869 16.067 1.00 16.29 C ATOM 0 H MET A 85 9.940 11.352 12.893 1.00 12.20 H new ATOM 0 HA MET A 85 12.336 12.846 13.192 1.00 13.28 H new ATOM 0 HB2 MET A 85 10.189 13.949 13.050 1.00 13.04 H new ATOM 0 HB3 MET A 85 9.556 13.036 14.405 1.00 13.04 H new ATOM 0 HG2 MET A 85 10.170 15.384 14.978 1.00 14.20 H new ATOM 0 HG3 MET A 85 10.983 14.184 15.964 1.00 14.20 H new ATOM 0 HE1 MET A 85 13.439 16.897 15.968 1.00 16.29 H new ATOM 0 HE2 MET A 85 12.277 15.830 16.791 1.00 16.29 H new ATOM 0 HE3 MET A 85 13.912 15.240 16.410 1.00 16.29 H new ATOM 1306 N ARG A 86 11.258 11.244 15.881 1.00 13.88 N ATOM 1307 CA ARG A 86 11.672 10.722 17.175 1.00 14.84 C ATOM 1308 C ARG A 86 12.862 9.783 17.025 1.00 15.43 C ATOM 1309 O ARG A 86 13.682 9.655 17.931 1.00 16.55 O ATOM 1310 CB ARG A 86 10.510 9.984 17.839 1.00 14.45 C ATOM 1311 CG ARG A 86 9.314 10.871 18.139 1.00 14.20 C ATOM 1312 CD ARG A 86 8.153 10.068 18.699 1.00 14.13 C ATOM 1313 NE ARG A 86 8.485 9.445 19.978 1.00 14.82 N ATOM 1314 CZ ARG A 86 7.678 8.610 20.624 1.00 15.11 C ATOM 1315 NH1 ARG A 86 6.499 8.287 20.109 1.00 14.78 N ATOM 1316 NH2 ARG A 86 8.052 8.094 21.787 1.00 15.88 N ATOM 0 H ARG A 86 10.291 11.034 15.634 1.00 13.88 H new ATOM 0 HA ARG A 86 11.971 11.562 17.802 1.00 14.84 H new ATOM 0 HB2 ARG A 86 10.192 9.168 17.191 1.00 14.45 H new ATOM 0 HB3 ARG A 86 10.860 9.535 18.768 1.00 14.45 H new ATOM 0 HG2 ARG A 86 9.602 11.643 18.853 1.00 14.20 H new ATOM 0 HG3 ARG A 86 9.000 11.380 17.228 1.00 14.20 H new ATOM 0 HD2 ARG A 86 7.289 10.720 18.827 1.00 14.13 H new ATOM 0 HD3 ARG A 86 7.867 9.297 17.984 1.00 14.13 H new ATOM 0 HE ARG A 86 9.388 9.663 20.399 1.00 14.82 H new ATOM 0 HH11 ARG A 86 6.209 8.680 19.214 1.00 14.78 H new ATOM 0 HH12 ARG A 86 5.883 7.646 20.608 1.00 14.78 H new ATOM 0 HH21 ARG A 86 8.959 8.338 22.185 1.00 15.88 H new ATOM 0 HH22 ARG A 86 7.433 7.453 22.283 1.00 15.88 H new ATOM 1330 N GLU A 87 12.949 9.131 15.871 1.00 14.77 N ATOM 1331 CA GLU A 87 14.038 8.204 15.601 1.00 15.43 C ATOM 1332 C GLU A 87 15.358 8.956 15.490 1.00 16.43 C ATOM 1333 O GLU A 87 16.378 8.526 16.030 1.00 17.50 O ATOM 1334 CB GLU A 87 13.766 7.431 14.311 1.00 14.60 C ATOM 1335 CG GLU A 87 14.604 6.172 14.165 1.00 15.22 C ATOM 1336 CD GLU A 87 14.266 5.392 12.909 1.00 14.94 C ATOM 1337 OE1 GLU A 87 13.285 4.619 12.936 1.00 14.72 O ATOM 1338 OE2 GLU A 87 14.983 5.554 11.899 1.00 15.08 O ATOM 0 H GLU A 87 12.278 9.228 15.109 1.00 14.77 H new ATOM 0 HA GLU A 87 14.105 7.497 16.428 1.00 15.43 H new ATOM 0 HB2 GLU A 87 12.711 7.160 14.276 1.00 14.60 H new ATOM 0 HB3 GLU A 87 13.956 8.084 13.459 1.00 14.60 H new ATOM 0 HG2 GLU A 87 15.660 6.442 14.148 1.00 15.22 H new ATOM 0 HG3 GLU A 87 14.452 5.535 15.036 1.00 15.22 H new ATOM 1345 N ALA A 88 15.322 10.104 14.824 1.00 16.17 N ATOM 1346 CA ALA A 88 16.518 10.913 14.639 1.00 17.18 C ATOM 1347 C ALA A 88 16.941 11.544 15.957 1.00 18.20 C ATOM 1348 O ALA A 88 18.122 11.527 16.307 1.00 19.32 O ATOM 1349 CB ALA A 88 16.292 11.977 13.577 1.00 16.77 C ATOM 0 H ALA A 88 14.478 10.494 14.404 1.00 16.17 H new ATOM 0 HA ALA A 88 17.323 10.263 14.296 1.00 17.18 H new ATOM 0 HB1 ALA A 88 17.199 12.569 13.456 1.00 16.77 H new ATOM 0 HB2 ALA A 88 16.042 11.499 12.630 1.00 16.77 H new ATOM 0 HB3 ALA A 88 15.472 12.627 13.882 1.00 16.77 H new ATOM 1355 N PHE A 89 15.977 12.097 16.685 1.00 17.88 N ATOM 1356 CA PHE A 89 16.265 12.711 17.973 1.00 18.88 C ATOM 1357 C PHE A 89 17.042 11.736 18.853 1.00 19.75 C ATOM 1358 O PHE A 89 18.005 12.114 19.521 1.00 20.90 O ATOM 1359 CB PHE A 89 14.969 13.137 18.672 1.00 18.44 C ATOM 1360 CG PHE A 89 15.166 13.506 20.115 1.00 19.53 C ATOM 1361 CD1 PHE A 89 15.540 14.790 20.465 1.00 20.12 C ATOM 1362 CD2 PHE A 89 14.989 12.565 21.118 1.00 20.04 C ATOM 1363 CE1 PHE A 89 15.736 15.133 21.789 1.00 21.19 C ATOM 1364 CE2 PHE A 89 15.182 12.903 22.443 1.00 21.09 C ATOM 1365 CZ PHE A 89 15.557 14.189 22.777 1.00 21.66 C ATOM 0 H PHE A 89 14.996 12.132 16.407 1.00 17.88 H new ATOM 0 HA PHE A 89 16.872 13.601 17.805 1.00 18.88 H new ATOM 0 HB2 PHE A 89 14.541 13.988 18.142 1.00 18.44 H new ATOM 0 HB3 PHE A 89 14.245 12.324 18.607 1.00 18.44 H new ATOM 0 HD1 PHE A 89 15.681 15.534 19.695 1.00 20.12 H new ATOM 0 HD2 PHE A 89 14.697 11.558 20.860 1.00 20.04 H new ATOM 0 HE1 PHE A 89 16.029 16.139 22.049 1.00 21.19 H new ATOM 0 HE2 PHE A 89 15.040 12.163 23.216 1.00 21.09 H new ATOM 0 HZ PHE A 89 15.710 14.455 23.812 1.00 21.66 H new ATOM 1375 N LYS A 90 16.610 10.477 18.844 1.00 19.26 N ATOM 1376 CA LYS A 90 17.260 9.434 19.629 1.00 20.11 C ATOM 1377 C LYS A 90 18.699 9.223 19.173 1.00 20.94 C ATOM 1378 O LYS A 90 19.580 8.940 19.985 1.00 22.05 O ATOM 1379 CB LYS A 90 16.482 8.122 19.517 1.00 19.45 C ATOM 1380 CG LYS A 90 15.130 8.154 20.211 1.00 18.94 C ATOM 1381 CD LYS A 90 14.366 6.859 19.998 1.00 18.35 C ATOM 1382 CE LYS A 90 12.996 6.905 20.654 1.00 17.84 C ATOM 1383 NZ LYS A 90 12.262 5.617 20.500 1.00 18.07 N ATOM 0 H LYS A 90 15.810 10.155 18.299 1.00 19.26 H new ATOM 0 HA LYS A 90 17.272 9.755 20.670 1.00 20.11 H new ATOM 0 HB2 LYS A 90 16.334 7.886 18.463 1.00 19.45 H new ATOM 0 HB3 LYS A 90 17.081 7.317 19.943 1.00 19.45 H new ATOM 0 HG2 LYS A 90 15.271 8.323 21.278 1.00 18.94 H new ATOM 0 HG3 LYS A 90 14.544 8.991 19.831 1.00 18.94 H new ATOM 0 HD2 LYS A 90 14.253 6.674 18.930 1.00 18.35 H new ATOM 0 HD3 LYS A 90 14.938 6.026 20.407 1.00 18.35 H new ATOM 0 HE2 LYS A 90 13.109 7.134 21.714 1.00 17.84 H new ATOM 0 HE3 LYS A 90 12.410 7.712 20.214 1.00 17.84 H new ATOM 0 HZ1 LYS A 90 11.333 5.690 20.961 1.00 18.07 H new ATOM 0 HZ2 LYS A 90 12.132 5.410 19.489 1.00 18.07 H new ATOM 0 HZ3 LYS A 90 12.809 4.851 20.942 1.00 18.07 H new ATOM 1397 N ILE A 91 18.933 9.363 17.870 1.00 20.46 N ATOM 1398 CA ILE A 91 20.271 9.186 17.313 1.00 21.30 C ATOM 1399 C ILE A 91 21.256 10.199 17.896 1.00 22.45 C ATOM 1400 O ILE A 91 22.395 9.854 18.207 1.00 23.52 O ATOM 1401 CB ILE A 91 20.272 9.311 15.775 1.00 20.67 C ATOM 1402 CG1 ILE A 91 19.264 8.336 15.166 1.00 19.54 C ATOM 1403 CG2 ILE A 91 21.667 9.052 15.222 1.00 21.70 C ATOM 1404 CD1 ILE A 91 19.082 8.498 13.671 1.00 18.86 C ATOM 0 H ILE A 91 18.216 9.598 17.183 1.00 20.46 H new ATOM 0 HA ILE A 91 20.587 8.179 17.585 1.00 21.30 H new ATOM 0 HB ILE A 91 19.979 10.326 15.506 1.00 20.67 H new ATOM 0 HG12 ILE A 91 19.588 7.316 15.375 1.00 19.54 H new ATOM 0 HG13 ILE A 91 18.300 8.471 15.657 1.00 19.54 H new ATOM 0 HG21 ILE A 91 21.651 9.144 14.136 1.00 21.70 H new ATOM 0 HG22 ILE A 91 22.364 9.780 15.637 1.00 21.70 H new ATOM 0 HG23 ILE A 91 21.986 8.047 15.496 1.00 21.70 H new ATOM 0 HD11 ILE A 91 18.352 7.772 13.313 1.00 18.86 H new ATOM 0 HD12 ILE A 91 18.728 9.506 13.455 1.00 18.86 H new ATOM 0 HD13 ILE A 91 20.035 8.333 13.168 1.00 18.86 H new ATOM 1416 N PHE A 92 20.813 11.445 18.045 1.00 22.30 N ATOM 1417 CA PHE A 92 21.673 12.498 18.584 1.00 23.42 C ATOM 1418 C PHE A 92 21.839 12.377 20.093 1.00 24.20 C ATOM 1419 O PHE A 92 22.886 12.722 20.635 1.00 25.36 O ATOM 1420 CB PHE A 92 21.112 13.880 18.257 1.00 23.12 C ATOM 1421 CG PHE A 92 20.939 14.132 16.786 1.00 22.46 C ATOM 1422 CD1 PHE A 92 22.025 14.452 15.986 1.00 22.15 C ATOM 1423 CD2 PHE A 92 19.685 14.048 16.206 1.00 22.24 C ATOM 1424 CE1 PHE A 92 21.859 14.683 14.633 1.00 21.64 C ATOM 1425 CE2 PHE A 92 19.512 14.277 14.855 1.00 21.74 C ATOM 1426 CZ PHE A 92 20.635 14.604 14.064 1.00 21.45 C ATOM 0 H PHE A 92 19.870 11.750 17.802 1.00 22.30 H new ATOM 0 HA PHE A 92 22.649 12.376 18.114 1.00 23.42 H new ATOM 0 HB2 PHE A 92 20.148 13.997 18.752 1.00 23.12 H new ATOM 0 HB3 PHE A 92 21.777 14.639 18.670 1.00 23.12 H new ATOM 0 HD1 PHE A 92 23.010 14.521 16.424 1.00 22.15 H new ATOM 0 HD2 PHE A 92 18.830 13.800 16.818 1.00 22.24 H new ATOM 0 HE1 PHE A 92 22.716 14.929 14.024 1.00 21.64 H new ATOM 0 HE2 PHE A 92 18.531 14.207 14.409 1.00 21.74 H new ATOM 0 HZ PHE A 92 20.517 14.791 13.007 1.00 21.45 H new ATOM 1436 N ASP A 93 20.808 11.879 20.764 1.00 23.63 N ATOM 1437 CA ASP A 93 20.837 11.739 22.217 1.00 24.39 C ATOM 1438 C ASP A 93 21.863 10.703 22.652 1.00 25.20 C ATOM 1439 O ASP A 93 22.565 10.900 23.643 1.00 26.19 O ATOM 1440 CB ASP A 93 19.451 11.356 22.743 1.00 23.63 C ATOM 1441 CG ASP A 93 19.333 11.499 24.250 1.00 24.48 C ATOM 1442 OD1 ASP A 93 20.274 11.085 24.958 1.00 24.81 O ATOM 1443 OD2 ASP A 93 18.306 12.029 24.722 1.00 24.88 O ATOM 0 H ASP A 93 19.941 11.565 20.327 1.00 23.63 H new ATOM 0 HA ASP A 93 21.126 12.702 22.639 1.00 24.39 H new ATOM 0 HB2 ASP A 93 18.699 11.983 22.263 1.00 23.63 H new ATOM 0 HB3 ASP A 93 19.233 10.326 22.462 1.00 23.63 H new ATOM 1448 N ARG A 94 21.930 9.599 21.905 1.00 24.82 N ATOM 1449 CA ARG A 94 22.856 8.500 22.194 1.00 25.61 C ATOM 1450 C ARG A 94 22.341 7.639 23.332 1.00 25.96 C ATOM 1451 O ARG A 94 22.308 6.411 23.240 1.00 26.03 O ATOM 1452 CB ARG A 94 24.236 9.040 22.551 1.00 26.84 C ATOM 1453 CG ARG A 94 24.803 9.948 21.484 1.00 26.72 C ATOM 1454 CD ARG A 94 25.951 9.287 20.754 1.00 27.97 C ATOM 1455 NE ARG A 94 25.620 7.931 20.325 1.00 28.57 N ATOM 1456 CZ ARG A 94 26.088 7.371 19.212 1.00 29.55 C ATOM 1457 NH1 ARG A 94 26.906 8.048 18.416 1.00 30.03 N ATOM 1458 NH2 ARG A 94 25.737 6.132 18.894 1.00 30.10 N ATOM 0 H ARG A 94 21.345 9.441 21.084 1.00 24.82 H new ATOM 0 HA ARG A 94 22.931 7.888 21.295 1.00 25.61 H new ATOM 0 HB2 ARG A 94 24.175 9.587 23.492 1.00 26.84 H new ATOM 0 HB3 ARG A 94 24.918 8.205 22.711 1.00 26.84 H new ATOM 0 HG2 ARG A 94 24.020 10.210 20.773 1.00 26.72 H new ATOM 0 HG3 ARG A 94 25.145 10.878 21.939 1.00 26.72 H new ATOM 0 HD2 ARG A 94 26.220 9.886 19.884 1.00 27.97 H new ATOM 0 HD3 ARG A 94 26.825 9.258 21.404 1.00 27.97 H new ATOM 0 HE ARG A 94 24.994 7.381 20.913 1.00 28.57 H new ATOM 0 HH11 ARG A 94 27.178 9.001 18.656 1.00 30.03 H new ATOM 0 HH12 ARG A 94 27.262 7.615 17.564 1.00 30.03 H new ATOM 0 HH21 ARG A 94 25.108 5.608 19.503 1.00 30.10 H new ATOM 0 HH22 ARG A 94 26.096 5.703 18.041 1.00 30.10 H new ATOM 1472 N ASP A 95 21.940 8.302 24.405 1.00 26.27 N ATOM 1473 CA ASP A 95 21.425 7.616 25.586 1.00 26.74 C ATOM 1474 C ASP A 95 19.943 7.303 25.429 1.00 25.70 C ATOM 1475 O ASP A 95 19.535 6.142 25.460 1.00 25.63 O ATOM 1476 CB ASP A 95 21.626 8.469 26.840 1.00 27.69 C ATOM 1477 CG ASP A 95 22.813 9.403 26.736 1.00 28.38 C ATOM 1478 OD1 ASP A 95 23.961 8.903 26.762 1.00 28.47 O ATOM 1479 OD2 ASP A 95 22.599 10.628 26.628 1.00 28.88 O ATOM 0 H ASP A 95 21.960 9.319 24.485 1.00 26.27 H new ATOM 0 HA ASP A 95 21.980 6.684 25.691 1.00 26.74 H new ATOM 0 HB2 ASP A 95 20.725 9.054 27.023 1.00 27.69 H new ATOM 0 HB3 ASP A 95 21.760 7.814 27.701 1.00 27.69 H new ATOM 1484 N GLY A 96 19.140 8.349 25.259 1.00 24.96 N ATOM 1485 CA GLY A 96 17.709 8.172 25.115 1.00 24.00 C ATOM 1486 C GLY A 96 16.962 8.561 26.375 1.00 24.47 C ATOM 1487 O GLY A 96 15.924 7.981 26.696 1.00 24.19 O ATOM 0 H GLY A 96 19.457 9.318 25.219 1.00 24.96 H new ATOM 0 HA2 GLY A 96 17.351 8.774 24.280 1.00 24.00 H new ATOM 0 HA3 GLY A 96 17.494 7.131 24.872 1.00 24.00 H new ATOM 1491 N ASP A 97 17.495 9.550 27.089 1.00 25.28 N ATOM 1492 CA ASP A 97 16.881 10.021 28.326 1.00 25.89 C ATOM 1493 C ASP A 97 15.752 10.996 28.018 1.00 25.11 C ATOM 1494 O ASP A 97 15.110 11.527 28.925 1.00 25.54 O ATOM 1495 CB ASP A 97 17.922 10.700 29.217 1.00 27.15 C ATOM 1496 CG ASP A 97 19.307 10.108 29.046 1.00 27.81 C ATOM 1497 OD1 ASP A 97 19.553 9.010 29.587 1.00 28.13 O ATOM 1498 OD2 ASP A 97 20.145 10.743 28.372 1.00 28.07 O ATOM 0 H ASP A 97 18.351 10.040 26.831 1.00 25.28 H new ATOM 0 HA ASP A 97 16.473 9.160 28.855 1.00 25.89 H new ATOM 0 HB2 ASP A 97 17.954 11.765 28.986 1.00 27.15 H new ATOM 0 HB3 ASP A 97 17.618 10.609 30.260 1.00 27.15 H new ATOM 1503 N GLY A 98 15.519 11.224 26.731 1.00 24.03 N ATOM 1504 CA GLY A 98 14.472 12.134 26.312 1.00 23.27 C ATOM 1505 C GLY A 98 15.010 13.510 25.976 1.00 23.53 C ATOM 1506 O GLY A 98 14.289 14.352 25.441 1.00 22.95 O ATOM 0 H GLY A 98 16.040 10.792 25.968 1.00 24.03 H new ATOM 0 HA2 GLY A 98 13.962 11.722 25.441 1.00 23.27 H new ATOM 0 HA3 GLY A 98 13.729 12.220 27.105 1.00 23.27 H new ATOM 1510 N PHE A 99 16.277 13.742 26.310 1.00 24.50 N ATOM 1511 CA PHE A 99 16.925 15.018 26.028 1.00 24.94 C ATOM 1512 C PHE A 99 18.380 14.835 25.591 1.00 25.47 C ATOM 1513 O PHE A 99 19.147 14.080 26.198 1.00 26.19 O ATOM 1514 CB PHE A 99 16.837 15.951 27.241 1.00 25.98 C ATOM 1515 CG PHE A 99 16.698 15.235 28.552 1.00 26.68 C ATOM 1516 CD1 PHE A 99 17.812 14.780 29.240 1.00 27.05 C ATOM 1517 CD2 PHE A 99 15.443 15.021 29.095 1.00 27.04 C ATOM 1518 CE1 PHE A 99 17.671 14.122 30.448 1.00 27.77 C ATOM 1519 CE2 PHE A 99 15.295 14.366 30.300 1.00 27.76 C ATOM 1520 CZ PHE A 99 16.411 13.915 30.979 1.00 28.11 C ATOM 0 H PHE A 99 16.876 13.061 26.777 1.00 24.50 H new ATOM 0 HA PHE A 99 16.391 15.477 25.196 1.00 24.94 H new ATOM 0 HB2 PHE A 99 17.730 16.575 27.272 1.00 25.98 H new ATOM 0 HB3 PHE A 99 15.986 16.619 27.112 1.00 25.98 H new ATOM 0 HD1 PHE A 99 18.798 14.941 28.829 1.00 27.05 H new ATOM 0 HD2 PHE A 99 14.568 15.372 28.568 1.00 27.04 H new ATOM 0 HE1 PHE A 99 18.545 13.770 30.977 1.00 27.77 H new ATOM 0 HE2 PHE A 99 14.309 14.206 30.712 1.00 27.76 H new ATOM 0 HZ PHE A 99 16.299 13.402 31.923 1.00 28.11 H new ATOM 1530 N ILE A 100 18.735 15.540 24.520 1.00 25.18 N ATOM 1531 CA ILE A 100 20.075 15.501 23.958 1.00 25.71 C ATOM 1532 C ILE A 100 20.970 16.544 24.613 1.00 26.98 C ATOM 1533 O ILE A 100 20.748 17.745 24.465 1.00 27.09 O ATOM 1534 CB ILE A 100 20.051 15.789 22.444 1.00 24.88 C ATOM 1535 CG1 ILE A 100 19.165 14.790 21.709 1.00 23.56 C ATOM 1536 CG2 ILE A 100 21.459 15.765 21.868 1.00 25.54 C ATOM 1537 CD1 ILE A 100 18.709 15.292 20.359 1.00 22.62 C ATOM 0 H ILE A 100 18.096 16.156 24.018 1.00 25.18 H new ATOM 0 HA ILE A 100 20.464 14.500 24.142 1.00 25.71 H new ATOM 0 HB ILE A 100 19.633 16.786 22.303 1.00 24.88 H new ATOM 0 HG12 ILE A 100 19.711 13.855 21.578 1.00 23.56 H new ATOM 0 HG13 ILE A 100 18.292 14.566 22.322 1.00 23.56 H new ATOM 0 HG21 ILE A 100 21.418 15.971 20.798 1.00 25.54 H new ATOM 0 HG22 ILE A 100 22.067 16.524 22.361 1.00 25.54 H new ATOM 0 HG23 ILE A 100 21.902 14.783 22.032 1.00 25.54 H new ATOM 0 HD11 ILE A 100 18.082 14.538 19.883 1.00 22.62 H new ATOM 0 HD12 ILE A 100 18.138 16.211 20.487 1.00 22.62 H new ATOM 0 HD13 ILE A 100 19.578 15.489 19.732 1.00 22.62 H new ATOM 1549 N SER A 101 21.979 16.082 25.330 1.00 27.98 N ATOM 1550 CA SER A 101 22.920 16.980 25.977 1.00 29.24 C ATOM 1551 C SER A 101 23.876 17.550 24.934 1.00 29.53 C ATOM 1552 O SER A 101 24.115 16.914 23.908 1.00 29.01 O ATOM 1553 CB SER A 101 23.693 16.233 27.063 1.00 30.23 C ATOM 1554 OG SER A 101 24.820 16.972 27.499 1.00 31.40 O ATOM 0 H SER A 101 22.168 15.091 25.479 1.00 27.98 H new ATOM 0 HA SER A 101 22.377 17.801 26.445 1.00 29.24 H new ATOM 0 HB2 SER A 101 23.035 16.037 27.910 1.00 30.23 H new ATOM 0 HB3 SER A 101 24.017 15.265 26.680 1.00 30.23 H new ATOM 0 HG SER A 101 25.292 16.468 28.195 1.00 31.40 H new ATOM 1560 N PRO A 102 24.417 18.762 25.163 1.00 30.40 N ATOM 1561 CA PRO A 102 25.344 19.405 24.233 1.00 30.84 C ATOM 1562 C PRO A 102 26.267 18.416 23.525 1.00 31.00 C ATOM 1563 O PRO A 102 26.266 18.331 22.300 1.00 30.80 O ATOM 1564 CB PRO A 102 26.140 20.326 25.151 1.00 32.14 C ATOM 1565 CG PRO A 102 25.169 20.736 26.208 1.00 32.10 C ATOM 1566 CD PRO A 102 24.163 19.615 26.341 1.00 31.10 C ATOM 0 HA PRO A 102 24.826 19.913 23.419 1.00 30.84 H new ATOM 0 HB2 PRO A 102 26.999 19.811 25.581 1.00 32.14 H new ATOM 0 HB3 PRO A 102 26.524 21.190 24.609 1.00 32.14 H new ATOM 0 HG2 PRO A 102 25.680 20.910 27.155 1.00 32.10 H new ATOM 0 HG3 PRO A 102 24.674 21.668 25.937 1.00 32.10 H new ATOM 0 HD2 PRO A 102 24.302 19.063 27.270 1.00 31.10 H new ATOM 0 HD3 PRO A 102 23.141 19.995 26.345 1.00 31.10 H new ATOM 1574 N ALA A 103 27.028 17.652 24.303 1.00 31.44 N ATOM 1575 CA ALA A 103 27.967 16.680 23.746 1.00 31.71 C ATOM 1576 C ALA A 103 27.280 15.682 22.812 1.00 30.52 C ATOM 1577 O ALA A 103 27.846 15.286 21.799 1.00 30.50 O ATOM 1578 CB ALA A 103 28.688 15.947 24.865 1.00 32.55 C ATOM 0 H ALA A 103 27.014 17.686 25.322 1.00 31.44 H new ATOM 0 HA ALA A 103 28.693 17.233 23.150 1.00 31.71 H new ATOM 0 HB1 ALA A 103 29.385 15.226 24.438 1.00 32.55 H new ATOM 0 HB2 ALA A 103 29.237 16.664 25.475 1.00 32.55 H new ATOM 0 HB3 ALA A 103 27.960 15.425 25.486 1.00 32.55 H new ATOM 1584 N GLU A 104 26.057 15.294 23.152 1.00 29.57 N ATOM 1585 CA GLU A 104 25.292 14.338 22.349 1.00 28.37 C ATOM 1586 C GLU A 104 24.897 14.938 21.001 1.00 27.59 C ATOM 1587 O GLU A 104 25.007 14.285 19.959 1.00 27.15 O ATOM 1588 CB GLU A 104 24.043 13.911 23.119 1.00 27.67 C ATOM 1589 CG GLU A 104 24.332 13.398 24.520 1.00 28.56 C ATOM 1590 CD GLU A 104 23.069 13.213 25.338 1.00 28.05 C ATOM 1591 OE1 GLU A 104 21.982 13.129 24.732 1.00 28.09 O ATOM 1592 OE2 GLU A 104 23.165 13.161 26.582 1.00 27.67 O ATOM 0 H GLU A 104 25.568 15.627 23.983 1.00 29.57 H new ATOM 0 HA GLU A 104 25.920 13.468 22.156 1.00 28.37 H new ATOM 0 HB2 GLU A 104 23.361 14.759 23.186 1.00 27.67 H new ATOM 0 HB3 GLU A 104 23.529 13.132 22.556 1.00 27.67 H new ATOM 0 HG2 GLU A 104 24.862 12.448 24.454 1.00 28.56 H new ATOM 0 HG3 GLU A 104 24.994 14.097 25.031 1.00 28.56 H new ATOM 1599 N LEU A 105 24.470 16.195 21.025 1.00 27.51 N ATOM 1600 CA LEU A 105 24.033 16.876 19.813 1.00 26.86 C ATOM 1601 C LEU A 105 25.170 17.050 18.805 1.00 27.51 C ATOM 1602 O LEU A 105 25.069 16.592 17.667 1.00 26.94 O ATOM 1603 CB LEU A 105 23.446 18.241 20.178 1.00 26.95 C ATOM 1604 CG LEU A 105 22.960 19.084 18.999 1.00 26.49 C ATOM 1605 CD1 LEU A 105 21.884 18.345 18.216 1.00 25.10 C ATOM 1606 CD2 LEU A 105 22.438 20.425 19.491 1.00 26.84 C ATOM 0 H LEU A 105 24.417 16.763 21.871 1.00 27.51 H new ATOM 0 HA LEU A 105 23.273 16.255 19.339 1.00 26.86 H new ATOM 0 HB2 LEU A 105 22.611 18.087 20.861 1.00 26.95 H new ATOM 0 HB3 LEU A 105 24.202 18.809 20.721 1.00 26.95 H new ATOM 0 HG LEU A 105 23.803 19.263 18.331 1.00 26.49 H new ATOM 0 HD11 LEU A 105 21.552 18.963 17.382 1.00 25.10 H new ATOM 0 HD12 LEU A 105 22.290 17.408 17.835 1.00 25.10 H new ATOM 0 HD13 LEU A 105 21.038 18.134 18.870 1.00 25.10 H new ATOM 0 HD21 LEU A 105 22.095 21.016 18.642 1.00 26.84 H new ATOM 0 HD22 LEU A 105 21.608 20.262 20.179 1.00 26.84 H new ATOM 0 HD23 LEU A 105 23.236 20.959 20.006 1.00 26.84 H new ATOM 1618 N ARG A 106 26.249 17.706 19.225 1.00 28.76 N ATOM 1619 CA ARG A 106 27.389 17.941 18.335 1.00 29.56 C ATOM 1620 C ARG A 106 28.070 16.641 17.917 1.00 29.58 C ATOM 1621 O ARG A 106 28.401 16.456 16.751 1.00 29.39 O ATOM 1622 CB ARG A 106 28.430 18.866 18.986 1.00 30.94 C ATOM 1623 CG ARG A 106 28.096 19.298 20.403 1.00 31.13 C ATOM 1624 CD ARG A 106 29.115 20.287 20.942 1.00 32.40 C ATOM 1625 NE ARG A 106 28.871 20.610 22.346 1.00 32.96 N ATOM 1626 CZ ARG A 106 29.833 20.922 23.209 1.00 33.97 C ATOM 1627 NH1 ARG A 106 31.099 20.957 22.814 1.00 34.53 N ATOM 1628 NH2 ARG A 106 29.529 21.200 24.469 1.00 34.47 N ATOM 0 H ARG A 106 26.360 18.082 20.167 1.00 28.76 H new ATOM 0 HA ARG A 106 26.983 18.423 17.446 1.00 29.56 H new ATOM 0 HB2 ARG A 106 29.394 18.357 18.993 1.00 30.94 H new ATOM 0 HB3 ARG A 106 28.544 19.756 18.367 1.00 30.94 H new ATOM 0 HG2 ARG A 106 27.104 19.750 20.422 1.00 31.13 H new ATOM 0 HG3 ARG A 106 28.060 18.423 21.052 1.00 31.13 H new ATOM 0 HD2 ARG A 106 30.117 19.871 20.834 1.00 32.40 H new ATOM 0 HD3 ARG A 106 29.083 21.201 20.348 1.00 32.40 H new ATOM 0 HE ARG A 106 27.908 20.595 22.683 1.00 32.96 H new ATOM 0 HH11 ARG A 106 31.337 20.744 21.845 1.00 34.53 H new ATOM 0 HH12 ARG A 106 31.834 21.197 23.479 1.00 34.53 H new ATOM 0 HH21 ARG A 106 28.557 21.175 24.777 1.00 34.47 H new ATOM 0 HH22 ARG A 106 30.267 21.439 25.131 1.00 34.47 H new ATOM 1642 N PHE A 107 28.272 15.744 18.871 1.00 29.92 N ATOM 1643 CA PHE A 107 28.952 14.477 18.604 1.00 30.13 C ATOM 1644 C PHE A 107 28.315 13.700 17.463 1.00 29.04 C ATOM 1645 O PHE A 107 29.020 13.094 16.661 1.00 29.31 O ATOM 1646 CB PHE A 107 28.977 13.602 19.858 1.00 30.44 C ATOM 1647 CG PHE A 107 29.646 12.271 19.651 1.00 30.81 C ATOM 1648 CD1 PHE A 107 31.001 12.197 19.365 1.00 30.89 C ATOM 1649 CD2 PHE A 107 28.919 11.094 19.739 1.00 31.17 C ATOM 1650 CE1 PHE A 107 31.617 10.975 19.172 1.00 31.32 C ATOM 1651 CE2 PHE A 107 29.531 9.869 19.548 1.00 31.59 C ATOM 1652 CZ PHE A 107 30.881 9.810 19.264 1.00 31.68 C ATOM 0 H PHE A 107 27.976 15.867 19.839 1.00 29.92 H new ATOM 0 HA PHE A 107 29.970 14.731 18.308 1.00 30.13 H new ATOM 0 HB2 PHE A 107 29.493 14.138 20.655 1.00 30.44 H new ATOM 0 HB3 PHE A 107 27.954 13.436 20.196 1.00 30.44 H new ATOM 0 HD1 PHE A 107 31.582 13.105 19.292 1.00 30.89 H new ATOM 0 HD2 PHE A 107 27.862 11.134 19.959 1.00 31.17 H new ATOM 0 HE1 PHE A 107 32.673 10.931 18.949 1.00 31.32 H new ATOM 0 HE2 PHE A 107 28.954 8.959 19.621 1.00 31.59 H new ATOM 0 HZ PHE A 107 31.361 8.854 19.114 1.00 31.68 H new ATOM 1662 N VAL A 108 26.991 13.719 17.379 1.00 27.85 N ATOM 1663 CA VAL A 108 26.306 12.974 16.334 1.00 26.77 C ATOM 1664 C VAL A 108 26.209 13.762 15.030 1.00 26.50 C ATOM 1665 O VAL A 108 26.452 13.212 13.956 1.00 26.41 O ATOM 1666 CB VAL A 108 24.905 12.534 16.788 1.00 25.58 C ATOM 1667 CG1 VAL A 108 24.177 11.826 15.660 1.00 24.43 C ATOM 1668 CG2 VAL A 108 25.009 11.635 18.011 1.00 25.89 C ATOM 0 H VAL A 108 26.379 14.234 18.012 1.00 27.85 H new ATOM 0 HA VAL A 108 26.909 12.086 16.143 1.00 26.77 H new ATOM 0 HB VAL A 108 24.330 13.420 17.058 1.00 25.58 H new ATOM 0 HG11 VAL A 108 23.187 11.522 16.000 1.00 24.43 H new ATOM 0 HG12 VAL A 108 24.077 12.502 14.811 1.00 24.43 H new ATOM 0 HG13 VAL A 108 24.743 10.945 15.358 1.00 24.43 H new ATOM 0 HG21 VAL A 108 24.011 11.329 18.324 1.00 25.89 H new ATOM 0 HG22 VAL A 108 25.598 10.752 17.764 1.00 25.89 H new ATOM 0 HG23 VAL A 108 25.493 12.179 18.822 1.00 25.89 H new ATOM 1678 N MET A 109 25.858 15.040 15.113 1.00 26.48 N ATOM 1679 CA MET A 109 25.742 15.864 13.913 1.00 26.33 C ATOM 1680 C MET A 109 27.100 16.041 13.241 1.00 27.50 C ATOM 1681 O MET A 109 27.182 16.244 12.030 1.00 27.46 O ATOM 1682 CB MET A 109 25.142 17.231 14.244 1.00 26.26 C ATOM 1683 CG MET A 109 26.046 18.109 15.090 1.00 27.48 C ATOM 1684 SD MET A 109 25.537 19.840 15.078 1.00 27.39 S ATOM 1685 CE MET A 109 23.827 19.703 15.595 1.00 26.90 C ATOM 0 H MET A 109 25.651 15.525 15.986 1.00 26.48 H new ATOM 0 HA MET A 109 25.075 15.349 13.222 1.00 26.33 H new ATOM 0 HB2 MET A 109 24.913 17.751 13.314 1.00 26.26 H new ATOM 0 HB3 MET A 109 24.198 17.085 14.769 1.00 26.26 H new ATOM 0 HG2 MET A 109 26.047 17.741 16.116 1.00 27.48 H new ATOM 0 HG3 MET A 109 27.069 18.032 14.722 1.00 27.48 H new ATOM 0 HE1 MET A 109 23.593 20.506 16.294 1.00 26.90 H new ATOM 0 HE2 MET A 109 23.176 19.780 14.724 1.00 26.90 H new ATOM 0 HE3 MET A 109 23.670 18.740 16.082 1.00 26.90 H new ATOM 1695 N ILE A 110 28.163 15.969 14.034 1.00 28.57 N ATOM 1696 CA ILE A 110 29.517 16.117 13.515 1.00 29.77 C ATOM 1697 C ILE A 110 30.057 14.782 13.018 1.00 29.90 C ATOM 1698 O ILE A 110 30.813 14.729 12.047 1.00 30.43 O ATOM 1699 CB ILE A 110 30.474 16.679 14.583 1.00 30.96 C ATOM 1700 CG1 ILE A 110 30.026 18.079 15.012 1.00 31.00 C ATOM 1701 CG2 ILE A 110 31.903 16.716 14.054 1.00 32.20 C ATOM 1702 CD1 ILE A 110 30.773 18.612 16.216 1.00 32.05 C ATOM 0 H ILE A 110 28.113 15.809 15.040 1.00 28.57 H new ATOM 0 HA ILE A 110 29.463 16.821 12.684 1.00 29.77 H new ATOM 0 HB ILE A 110 30.447 16.023 15.453 1.00 30.96 H new ATOM 0 HG12 ILE A 110 30.162 18.767 14.177 1.00 31.00 H new ATOM 0 HG13 ILE A 110 28.960 18.057 15.237 1.00 31.00 H new ATOM 0 HG21 ILE A 110 32.565 17.116 14.822 1.00 32.20 H new ATOM 0 HG22 ILE A 110 32.220 15.707 13.791 1.00 32.20 H new ATOM 0 HG23 ILE A 110 31.947 17.352 13.170 1.00 32.20 H new ATOM 0 HD11 ILE A 110 30.403 19.607 16.462 1.00 32.05 H new ATOM 0 HD12 ILE A 110 30.617 17.946 17.065 1.00 32.05 H new ATOM 0 HD13 ILE A 110 31.838 18.667 15.989 1.00 32.05 H new ATOM 1714 N ASN A 111 29.663 13.703 13.690 1.00 29.51 N ATOM 1715 CA ASN A 111 30.108 12.369 13.305 1.00 29.69 C ATOM 1716 C ASN A 111 29.641 12.056 11.889 1.00 28.92 C ATOM 1717 O ASN A 111 30.393 11.508 11.083 1.00 29.42 O ATOM 1718 CB ASN A 111 29.580 11.311 14.278 1.00 29.42 C ATOM 1719 CG ASN A 111 30.477 10.091 14.354 1.00 30.42 C ATOM 1720 OD1 ASN A 111 30.000 8.960 14.443 1.00 30.38 O ATOM 1721 ND2 ASN A 111 31.787 10.316 14.335 1.00 31.39 N ATOM 0 H ASN A 111 29.041 13.727 14.498 1.00 29.51 H new ATOM 0 HA ASN A 111 31.197 12.348 13.339 1.00 29.69 H new ATOM 0 HB2 ASN A 111 29.485 11.751 15.271 1.00 29.42 H new ATOM 0 HB3 ASN A 111 28.581 11.004 13.969 1.00 29.42 H new ATOM 0 HD21 ASN A 111 32.440 9.534 14.395 1.00 31.39 H new ATOM 0 HD22 ASN A 111 32.140 11.270 14.260 1.00 31.39 H new ATOM 1728 N LEU A 112 28.393 12.409 11.593 1.00 27.75 N ATOM 1729 CA LEU A 112 27.833 12.184 10.266 1.00 26.97 C ATOM 1730 C LEU A 112 28.553 13.054 9.240 1.00 27.67 C ATOM 1731 O LEU A 112 28.406 12.869 8.032 1.00 27.59 O ATOM 1732 CB LEU A 112 26.321 12.450 10.251 1.00 25.59 C ATOM 1733 CG LEU A 112 25.893 13.901 10.475 1.00 25.50 C ATOM 1734 CD1 LEU A 112 25.855 14.660 9.157 1.00 25.51 C ATOM 1735 CD2 LEU A 112 24.533 13.952 11.156 1.00 24.36 C ATOM 0 H LEU A 112 27.753 12.851 12.253 1.00 27.75 H new ATOM 0 HA LEU A 112 27.983 11.138 10.000 1.00 26.97 H new ATOM 0 HB2 LEU A 112 25.923 12.119 9.292 1.00 25.59 H new ATOM 0 HB3 LEU A 112 25.856 11.832 11.019 1.00 25.59 H new ATOM 0 HG LEU A 112 26.627 14.379 11.124 1.00 25.50 H new ATOM 0 HD11 LEU A 112 25.548 15.690 9.339 1.00 25.51 H new ATOM 0 HD12 LEU A 112 26.846 14.651 8.703 1.00 25.51 H new ATOM 0 HD13 LEU A 112 25.143 14.183 8.483 1.00 25.51 H new ATOM 0 HD21 LEU A 112 24.241 14.991 11.309 1.00 24.36 H new ATOM 0 HD22 LEU A 112 23.793 13.456 10.528 1.00 24.36 H new ATOM 0 HD23 LEU A 112 24.589 13.445 12.119 1.00 24.36 H new ATOM 1747 N GLY A 113 29.336 14.008 9.745 1.00 28.44 N ATOM 1748 CA GLY A 113 30.086 14.906 8.883 1.00 29.23 C ATOM 1749 C GLY A 113 29.384 16.227 8.624 1.00 29.21 C ATOM 1750 O GLY A 113 28.548 16.334 7.728 1.00 29.01 O ATOM 0 H GLY A 113 29.464 14.174 10.743 1.00 28.44 H new ATOM 0 HA2 GLY A 113 31.058 15.103 9.335 1.00 29.23 H new ATOM 0 HA3 GLY A 113 30.273 14.410 7.930 1.00 29.23 H new ATOM 1754 N GLU A 114 29.739 17.233 9.422 1.00 29.51 N ATOM 1755 CA GLU A 114 29.168 18.573 9.290 1.00 29.65 C ATOM 1756 C GLU A 114 30.181 19.648 9.662 1.00 30.86 C ATOM 1757 O GLU A 114 30.215 20.721 9.058 1.00 31.02 O ATOM 1758 CB GLU A 114 27.912 18.716 10.149 1.00 28.56 C ATOM 1759 CG GLU A 114 26.715 17.961 9.599 1.00 27.33 C ATOM 1760 CD GLU A 114 25.433 18.270 10.348 1.00 26.52 C ATOM 1761 OE1 GLU A 114 24.916 19.397 10.201 1.00 26.19 O ATOM 1762 OE2 GLU A 114 24.950 17.386 11.086 1.00 26.29 O ATOM 0 H GLU A 114 30.424 17.144 10.172 1.00 29.51 H new ATOM 0 HA GLU A 114 28.895 18.709 8.244 1.00 29.65 H new ATOM 0 HB2 GLU A 114 28.127 18.358 11.156 1.00 28.56 H new ATOM 0 HB3 GLU A 114 27.658 19.772 10.234 1.00 28.56 H new ATOM 0 HG2 GLU A 114 26.585 18.212 8.546 1.00 27.33 H new ATOM 0 HG3 GLU A 114 26.912 16.890 9.650 1.00 27.33 H new ATOM 1769 N LYS A 115 30.990 19.353 10.660 1.00 31.76 N ATOM 1770 CA LYS A 115 32.020 20.276 11.126 1.00 32.97 C ATOM 1771 C LYS A 115 31.396 21.572 11.615 1.00 32.97 C ATOM 1772 O LYS A 115 31.556 22.629 11.001 1.00 33.55 O ATOM 1773 CB LYS A 115 33.036 20.559 10.014 1.00 34.07 C ATOM 1774 CG LYS A 115 33.995 19.408 9.747 1.00 34.37 C ATOM 1775 CD LYS A 115 33.284 18.211 9.132 1.00 34.03 C ATOM 1776 CE LYS A 115 34.256 17.086 8.813 1.00 34.21 C ATOM 1777 NZ LYS A 115 33.562 15.894 8.253 1.00 34.46 N ATOM 0 H LYS A 115 30.957 18.472 11.173 1.00 31.76 H new ATOM 0 HA LYS A 115 32.543 19.808 11.960 1.00 32.97 H new ATOM 0 HB2 LYS A 115 32.498 20.792 9.095 1.00 34.07 H new ATOM 0 HB3 LYS A 115 33.613 21.445 10.279 1.00 34.07 H new ATOM 0 HG2 LYS A 115 34.788 19.743 9.078 1.00 34.37 H new ATOM 0 HG3 LYS A 115 34.471 19.108 10.680 1.00 34.37 H new ATOM 0 HD2 LYS A 115 32.520 17.848 9.819 1.00 34.03 H new ATOM 0 HD3 LYS A 115 32.772 18.520 8.221 1.00 34.03 H new ATOM 0 HE2 LYS A 115 35.000 17.441 8.100 1.00 34.21 H new ATOM 0 HE3 LYS A 115 34.792 16.802 9.719 1.00 34.21 H new ATOM 0 HZ1 LYS A 115 34.237 15.327 7.701 1.00 34.46 H new ATOM 0 HZ2 LYS A 115 33.180 15.318 9.030 1.00 34.46 H new ATOM 0 HZ3 LYS A 115 32.784 16.203 7.636 1.00 34.46 H new ATOM 1791 N VAL A 116 30.679 21.475 12.725 1.00 32.39 N ATOM 1792 CA VAL A 116 30.021 22.627 13.314 1.00 32.39 C ATOM 1793 C VAL A 116 30.858 23.218 14.440 1.00 33.53 C ATOM 1794 O VAL A 116 31.614 22.510 15.107 1.00 33.96 O ATOM 1795 CB VAL A 116 28.631 22.252 13.866 1.00 31.13 C ATOM 1796 CG1 VAL A 116 27.874 21.387 12.873 1.00 29.96 C ATOM 1797 CG2 VAL A 116 28.752 21.545 15.207 1.00 31.21 C ATOM 0 H VAL A 116 30.539 20.604 13.237 1.00 32.39 H new ATOM 0 HA VAL A 116 29.905 23.368 12.523 1.00 32.39 H new ATOM 0 HB VAL A 116 28.069 23.173 14.017 1.00 31.13 H new ATOM 0 HG11 VAL A 116 26.896 21.134 13.282 1.00 29.96 H new ATOM 0 HG12 VAL A 116 27.746 21.933 11.938 1.00 29.96 H new ATOM 0 HG13 VAL A 116 28.436 20.472 12.685 1.00 29.96 H new ATOM 0 HG21 VAL A 116 27.758 21.291 15.575 1.00 31.21 H new ATOM 0 HG22 VAL A 116 29.338 20.634 15.086 1.00 31.21 H new ATOM 0 HG23 VAL A 116 29.247 22.203 15.922 1.00 31.21 H new ATOM 1807 N THR A 117 30.720 24.520 14.641 1.00 34.07 N ATOM 1808 CA THR A 117 31.445 25.211 15.698 1.00 35.18 C ATOM 1809 C THR A 117 30.661 25.154 17.004 1.00 34.78 C ATOM 1810 O THR A 117 29.437 25.276 17.002 1.00 33.80 O ATOM 1811 CB THR A 117 31.709 26.682 15.328 1.00 36.10 C ATOM 1812 OG1 THR A 117 30.472 27.337 15.019 1.00 35.42 O ATOM 1813 CG2 THR A 117 32.649 26.781 14.137 1.00 36.81 C ATOM 0 H THR A 117 30.111 25.121 14.085 1.00 34.07 H new ATOM 0 HA THR A 117 32.403 24.706 15.823 1.00 35.18 H new ATOM 0 HB THR A 117 32.178 27.170 16.182 1.00 36.10 H new ATOM 0 HG1 THR A 117 30.647 28.273 14.786 1.00 35.42 H new ATOM 0 HG21 THR A 117 32.820 27.830 13.895 1.00 36.81 H new ATOM 0 HG22 THR A 117 33.599 26.306 14.383 1.00 36.81 H new ATOM 0 HG23 THR A 117 32.203 26.279 13.279 1.00 36.81 H new ATOM 1821 N ASP A 118 31.364 24.967 18.115 1.00 35.59 N ATOM 1822 CA ASP A 118 30.722 24.889 19.422 1.00 35.40 C ATOM 1823 C ASP A 118 29.747 26.044 19.619 1.00 35.21 C ATOM 1824 O ASP A 118 28.670 25.869 20.187 1.00 34.50 O ATOM 1825 CB ASP A 118 31.774 24.900 20.532 1.00 36.59 C ATOM 1826 CG ASP A 118 32.755 23.751 20.410 1.00 36.85 C ATOM 1827 OD1 ASP A 118 33.788 23.921 19.729 1.00 36.95 O ATOM 1828 OD2 ASP A 118 32.490 22.680 20.996 1.00 37.02 O ATOM 0 H ASP A 118 32.379 24.867 18.137 1.00 35.59 H new ATOM 0 HA ASP A 118 30.164 23.954 19.469 1.00 35.40 H new ATOM 0 HB2 ASP A 118 32.319 25.844 20.503 1.00 36.59 H new ATOM 0 HB3 ASP A 118 31.277 24.848 21.501 1.00 36.59 H new ATOM 1833 N GLU A 119 30.134 27.224 19.149 1.00 35.91 N ATOM 1834 CA GLU A 119 29.295 28.409 19.272 1.00 35.91 C ATOM 1835 C GLU A 119 27.933 28.206 18.614 1.00 34.60 C ATOM 1836 O GLU A 119 26.907 28.617 19.159 1.00 34.24 O ATOM 1837 CB GLU A 119 29.998 29.623 18.662 1.00 36.90 C ATOM 1838 CG GLU A 119 30.474 29.402 17.236 1.00 36.71 C ATOM 1839 CD GLU A 119 31.199 30.606 16.668 1.00 37.77 C ATOM 1840 OE1 GLU A 119 32.414 30.743 16.924 1.00 38.19 O ATOM 1841 OE2 GLU A 119 30.553 31.411 15.965 1.00 38.22 O ATOM 0 H GLU A 119 31.025 27.385 18.679 1.00 35.91 H new ATOM 0 HA GLU A 119 29.129 28.586 20.335 1.00 35.91 H new ATOM 0 HB2 GLU A 119 29.316 30.473 18.680 1.00 36.90 H new ATOM 0 HB3 GLU A 119 30.853 29.887 19.284 1.00 36.90 H new ATOM 0 HG2 GLU A 119 31.137 28.537 17.209 1.00 36.71 H new ATOM 0 HG3 GLU A 119 29.618 29.167 16.604 1.00 36.71 H new ATOM 1848 N GLU A 120 27.915 27.574 17.443 1.00 33.92 N ATOM 1849 CA GLU A 120 26.657 27.331 16.747 1.00 32.68 C ATOM 1850 C GLU A 120 25.823 26.336 17.541 1.00 31.73 C ATOM 1851 O GLU A 120 24.596 26.422 17.580 1.00 30.88 O ATOM 1852 CB GLU A 120 26.906 26.828 15.317 1.00 32.23 C ATOM 1853 CG GLU A 120 27.101 25.322 15.201 1.00 31.98 C ATOM 1854 CD GLU A 120 25.801 24.583 14.951 1.00 31.39 C ATOM 1855 OE1 GLU A 120 25.356 24.543 13.785 1.00 31.34 O ATOM 1856 OE2 GLU A 120 25.228 24.044 15.921 1.00 31.03 O ATOM 0 H GLU A 120 28.745 27.226 16.963 1.00 33.92 H new ATOM 0 HA GLU A 120 26.108 28.269 16.668 1.00 32.68 H new ATOM 0 HB2 GLU A 120 26.064 27.122 14.691 1.00 32.23 H new ATOM 0 HB3 GLU A 120 27.789 27.328 14.919 1.00 32.23 H new ATOM 0 HG2 GLU A 120 27.797 25.111 14.389 1.00 31.98 H new ATOM 0 HG3 GLU A 120 27.557 24.947 16.117 1.00 31.98 H new ATOM 1863 N ILE A 121 26.509 25.389 18.171 1.00 31.93 N ATOM 1864 CA ILE A 121 25.858 24.384 18.994 1.00 31.19 C ATOM 1865 C ILE A 121 25.115 25.034 20.162 1.00 31.38 C ATOM 1866 O ILE A 121 23.931 24.775 20.371 1.00 30.48 O ATOM 1867 CB ILE A 121 26.884 23.365 19.539 1.00 31.66 C ATOM 1868 CG1 ILE A 121 27.449 22.508 18.399 1.00 31.30 C ATOM 1869 CG2 ILE A 121 26.263 22.486 20.614 1.00 31.21 C ATOM 1870 CD1 ILE A 121 26.415 21.639 17.712 1.00 29.89 C ATOM 0 H ILE A 121 27.524 25.299 18.125 1.00 31.93 H new ATOM 0 HA ILE A 121 25.140 23.860 18.363 1.00 31.19 H new ATOM 0 HB ILE A 121 27.704 23.921 19.993 1.00 31.66 H new ATOM 0 HG12 ILE A 121 27.908 23.163 17.659 1.00 31.30 H new ATOM 0 HG13 ILE A 121 28.240 21.871 18.795 1.00 31.30 H new ATOM 0 HG21 ILE A 121 27.007 21.778 20.980 1.00 31.21 H new ATOM 0 HG22 ILE A 121 25.918 23.109 21.439 1.00 31.21 H new ATOM 0 HG23 ILE A 121 25.418 21.940 20.194 1.00 31.21 H new ATOM 0 HD11 ILE A 121 26.892 21.064 16.918 1.00 29.89 H new ATOM 0 HD12 ILE A 121 25.972 20.957 18.438 1.00 29.89 H new ATOM 0 HD13 ILE A 121 25.636 22.270 17.285 1.00 29.89 H new ATOM 1882 N ASP A 122 25.813 25.871 20.930 1.00 32.59 N ATOM 1883 CA ASP A 122 25.196 26.541 22.072 1.00 32.95 C ATOM 1884 C ASP A 122 24.025 27.409 21.630 1.00 32.41 C ATOM 1885 O ASP A 122 23.068 27.608 22.379 1.00 32.19 O ATOM 1886 CB ASP A 122 26.221 27.403 22.821 1.00 34.41 C ATOM 1887 CG ASP A 122 26.404 28.781 22.209 1.00 35.02 C ATOM 1888 OD1 ASP A 122 25.476 29.607 22.324 1.00 35.33 O ATOM 1889 OD2 ASP A 122 27.466 29.028 21.601 1.00 35.24 O ATOM 0 H ASP A 122 26.796 26.099 20.783 1.00 32.59 H new ATOM 0 HA ASP A 122 24.826 25.767 22.744 1.00 32.95 H new ATOM 0 HB2 ASP A 122 25.905 27.512 23.859 1.00 34.41 H new ATOM 0 HB3 ASP A 122 27.181 26.887 22.832 1.00 34.41 H new ATOM 1894 N GLU A 123 24.109 27.925 20.408 1.00 32.28 N ATOM 1895 CA GLU A 123 23.066 28.788 19.870 1.00 31.88 C ATOM 1896 C GLU A 123 21.734 28.053 19.761 1.00 30.51 C ATOM 1897 O GLU A 123 20.722 28.506 20.293 1.00 30.32 O ATOM 1898 CB GLU A 123 23.479 29.327 18.500 1.00 32.05 C ATOM 1899 CG GLU A 123 22.380 30.106 17.800 1.00 31.72 C ATOM 1900 CD GLU A 123 22.892 30.913 16.624 1.00 32.49 C ATOM 1901 OE1 GLU A 123 22.912 30.374 15.497 1.00 32.69 O ATOM 1902 OE2 GLU A 123 23.273 32.084 16.829 1.00 32.95 O ATOM 0 H GLU A 123 24.889 27.760 19.772 1.00 32.28 H new ATOM 0 HA GLU A 123 22.936 29.621 20.560 1.00 31.88 H new ATOM 0 HB2 GLU A 123 24.351 29.971 18.619 1.00 32.05 H new ATOM 0 HB3 GLU A 123 23.783 28.493 17.867 1.00 32.05 H new ATOM 0 HG2 GLU A 123 21.614 29.413 17.453 1.00 31.72 H new ATOM 0 HG3 GLU A 123 21.904 30.776 18.515 1.00 31.72 H new ATOM 1909 N MET A 124 21.734 26.926 19.062 1.00 29.62 N ATOM 1910 CA MET A 124 20.513 26.148 18.891 1.00 28.28 C ATOM 1911 C MET A 124 19.952 25.686 20.234 1.00 28.13 C ATOM 1912 O MET A 124 18.742 25.736 20.454 1.00 27.52 O ATOM 1913 CB MET A 124 20.754 24.946 17.970 1.00 27.46 C ATOM 1914 CG MET A 124 22.044 24.197 18.252 1.00 28.01 C ATOM 1915 SD MET A 124 22.323 22.836 17.102 1.00 27.29 S ATOM 1916 CE MET A 124 22.210 23.680 15.526 1.00 26.32 C ATOM 0 H MET A 124 22.558 26.532 18.607 1.00 29.62 H new ATOM 0 HA MET A 124 19.774 26.799 18.424 1.00 28.28 H new ATOM 0 HB2 MET A 124 19.917 24.255 18.066 1.00 27.46 H new ATOM 0 HB3 MET A 124 20.765 25.291 16.936 1.00 27.46 H new ATOM 0 HG2 MET A 124 22.882 24.892 18.197 1.00 28.01 H new ATOM 0 HG3 MET A 124 22.019 23.808 19.270 1.00 28.01 H new ATOM 0 HE1 MET A 124 22.830 23.165 14.792 1.00 26.32 H new ATOM 0 HE2 MET A 124 21.174 23.682 15.188 1.00 26.32 H new ATOM 0 HE3 MET A 124 22.557 24.707 15.638 1.00 26.32 H new ATOM 1926 N ILE A 125 20.829 25.233 21.132 1.00 28.78 N ATOM 1927 CA ILE A 125 20.384 24.762 22.444 1.00 28.80 C ATOM 1928 C ILE A 125 19.664 25.855 23.221 1.00 29.32 C ATOM 1929 O ILE A 125 18.510 25.694 23.599 1.00 28.74 O ATOM 1930 CB ILE A 125 21.560 24.277 23.320 1.00 29.69 C ATOM 1931 CG1 ILE A 125 22.372 23.198 22.599 1.00 29.31 C ATOM 1932 CG2 ILE A 125 21.030 23.755 24.654 1.00 29.77 C ATOM 1933 CD1 ILE A 125 23.675 22.855 23.287 1.00 30.29 C ATOM 0 H ILE A 125 21.836 25.183 20.978 1.00 28.78 H new ATOM 0 HA ILE A 125 19.707 23.933 22.237 1.00 28.80 H new ATOM 0 HB ILE A 125 22.225 25.120 23.510 1.00 29.69 H new ATOM 0 HG12 ILE A 125 21.767 22.295 22.516 1.00 29.31 H new ATOM 0 HG13 ILE A 125 22.585 23.534 21.584 1.00 29.31 H new ATOM 0 HG21 ILE A 125 21.863 23.414 25.268 1.00 29.77 H new ATOM 0 HG22 ILE A 125 20.500 24.554 25.173 1.00 29.77 H new ATOM 0 HG23 ILE A 125 20.348 22.924 24.474 1.00 29.77 H new ATOM 0 HD11 ILE A 125 24.195 22.084 22.718 1.00 30.29 H new ATOM 0 HD12 ILE A 125 24.301 23.746 23.346 1.00 30.29 H new ATOM 0 HD13 ILE A 125 23.470 22.488 24.293 1.00 30.29 H new ATOM 1945 N ARG A 126 20.357 26.967 23.448 1.00 30.48 N ATOM 1946 CA ARG A 126 19.804 28.086 24.207 1.00 31.17 C ATOM 1947 C ARG A 126 18.457 28.558 23.653 1.00 30.45 C ATOM 1948 O ARG A 126 17.525 28.820 24.413 1.00 30.52 O ATOM 1949 CB ARG A 126 20.802 29.252 24.228 1.00 32.45 C ATOM 1950 CG ARG A 126 20.998 29.927 22.882 1.00 32.40 C ATOM 1951 CD ARG A 126 21.886 31.155 22.996 1.00 33.74 C ATOM 1952 NE ARG A 126 22.045 31.834 21.713 1.00 34.27 N ATOM 1953 CZ ARG A 126 22.734 32.960 21.553 1.00 35.37 C ATOM 1954 NH1 ARG A 126 23.325 33.535 22.592 1.00 36.06 N ATOM 1955 NH2 ARG A 126 22.833 33.511 20.351 1.00 35.85 N ATOM 0 H ARG A 126 21.309 27.118 23.115 1.00 30.48 H new ATOM 0 HA ARG A 126 19.630 27.732 25.223 1.00 31.17 H new ATOM 0 HB2 ARG A 126 20.460 29.995 24.948 1.00 32.45 H new ATOM 0 HB3 ARG A 126 21.765 28.885 24.582 1.00 32.45 H new ATOM 0 HG2 ARG A 126 21.442 29.220 22.181 1.00 32.40 H new ATOM 0 HG3 ARG A 126 20.029 30.215 22.474 1.00 32.40 H new ATOM 0 HD2 ARG A 126 21.458 31.846 23.722 1.00 33.74 H new ATOM 0 HD3 ARG A 126 22.865 30.861 23.375 1.00 33.74 H new ATOM 0 HE ARG A 126 21.602 31.421 20.892 1.00 34.27 H new ATOM 0 HH11 ARG A 126 23.252 33.113 23.518 1.00 36.06 H new ATOM 0 HH12 ARG A 126 23.853 34.399 22.465 1.00 36.06 H new ATOM 0 HH21 ARG A 126 22.381 33.071 19.550 1.00 35.85 H new ATOM 0 HH22 ARG A 126 23.361 34.375 20.228 1.00 35.85 H new ATOM 1969 N GLU A 127 18.362 28.664 22.332 1.00 29.84 N ATOM 1970 CA GLU A 127 17.137 29.128 21.685 1.00 29.22 C ATOM 1971 C GLU A 127 15.955 28.199 21.942 1.00 28.15 C ATOM 1972 O GLU A 127 14.846 28.660 22.217 1.00 28.09 O ATOM 1973 CB GLU A 127 17.355 29.262 20.178 1.00 28.76 C ATOM 1974 CG GLU A 127 16.435 30.283 19.523 1.00 28.80 C ATOM 1975 CD GLU A 127 16.852 30.620 18.104 1.00 28.73 C ATOM 1976 OE1 GLU A 127 17.931 31.225 17.931 1.00 28.70 O ATOM 1977 OE2 GLU A 127 16.104 30.272 17.166 1.00 28.78 O ATOM 0 H GLU A 127 19.118 28.435 21.687 1.00 29.84 H new ATOM 0 HA GLU A 127 16.898 30.099 22.119 1.00 29.22 H new ATOM 0 HB2 GLU A 127 18.391 29.545 19.992 1.00 28.76 H new ATOM 0 HB3 GLU A 127 17.201 28.291 19.708 1.00 28.76 H new ATOM 0 HG2 GLU A 127 15.416 29.896 19.516 1.00 28.80 H new ATOM 0 HG3 GLU A 127 16.426 31.194 20.121 1.00 28.80 H new ATOM 1984 N ALA A 128 16.190 26.893 21.859 1.00 27.36 N ATOM 1985 CA ALA A 128 15.122 25.921 22.060 1.00 26.33 C ATOM 1986 C ALA A 128 15.011 25.473 23.512 1.00 26.81 C ATOM 1987 O ALA A 128 14.001 24.898 23.906 1.00 26.28 O ATOM 1988 CB ALA A 128 15.332 24.718 21.153 1.00 25.22 C ATOM 0 H ALA A 128 17.103 26.486 21.656 1.00 27.36 H new ATOM 0 HA ALA A 128 14.184 26.413 21.803 1.00 26.33 H new ATOM 0 HB1 ALA A 128 14.529 23.998 21.311 1.00 25.22 H new ATOM 0 HB2 ALA A 128 15.329 25.042 20.112 1.00 25.22 H new ATOM 0 HB3 ALA A 128 16.289 24.250 21.385 1.00 25.22 H new ATOM 1994 N ASP A 129 16.041 25.740 24.308 1.00 27.88 N ATOM 1995 CA ASP A 129 16.037 25.339 25.714 1.00 28.48 C ATOM 1996 C ASP A 129 15.018 26.145 26.511 1.00 29.02 C ATOM 1997 O ASP A 129 15.373 27.042 27.276 1.00 30.17 O ATOM 1998 CB ASP A 129 17.426 25.502 26.326 1.00 29.57 C ATOM 1999 CG ASP A 129 17.530 24.830 27.677 1.00 30.10 C ATOM 2000 OD1 ASP A 129 17.035 23.692 27.812 1.00 30.56 O ATOM 2001 OD2 ASP A 129 18.105 25.446 28.605 1.00 30.12 O ATOM 0 H ASP A 129 16.885 26.229 24.008 1.00 27.88 H new ATOM 0 HA ASP A 129 15.755 24.287 25.758 1.00 28.48 H new ATOM 0 HB2 ASP A 129 18.171 25.080 25.652 1.00 29.57 H new ATOM 0 HB3 ASP A 129 17.655 26.563 26.430 1.00 29.57 H new ATOM 2006 N PHE A 130 13.751 25.809 26.321 1.00 28.23 N ATOM 2007 CA PHE A 130 12.658 26.491 27.006 1.00 28.72 C ATOM 2008 C PHE A 130 12.610 26.119 28.484 1.00 29.48 C ATOM 2009 O PHE A 130 12.342 26.964 29.338 1.00 30.47 O ATOM 2010 CB PHE A 130 11.322 26.143 26.343 1.00 27.68 C ATOM 2011 CG PHE A 130 11.274 26.473 24.877 1.00 26.94 C ATOM 2012 CD1 PHE A 130 11.461 27.775 24.436 1.00 26.44 C ATOM 2013 CD2 PHE A 130 11.039 25.481 23.940 1.00 26.82 C ATOM 2014 CE1 PHE A 130 11.416 28.079 23.090 1.00 25.82 C ATOM 2015 CE2 PHE A 130 10.991 25.779 22.591 1.00 26.23 C ATOM 2016 CZ PHE A 130 11.180 27.080 22.165 1.00 25.72 C ATOM 0 H PHE A 130 13.451 25.063 25.694 1.00 28.23 H new ATOM 0 HA PHE A 130 12.835 27.564 26.930 1.00 28.72 H new ATOM 0 HB2 PHE A 130 11.127 25.079 26.474 1.00 27.68 H new ATOM 0 HB3 PHE A 130 10.522 26.679 26.854 1.00 27.68 H new ATOM 0 HD1 PHE A 130 11.644 28.560 25.154 1.00 26.44 H new ATOM 0 HD2 PHE A 130 10.891 24.462 24.267 1.00 26.82 H new ATOM 0 HE1 PHE A 130 11.565 29.097 22.760 1.00 25.82 H new ATOM 0 HE2 PHE A 130 10.806 24.996 21.871 1.00 26.23 H new ATOM 0 HZ PHE A 130 11.143 27.315 21.112 1.00 25.72 H new ATOM 2026 N ASP A 131 12.870 24.848 28.781 1.00 29.07 N ATOM 2027 CA ASP A 131 12.844 24.364 30.159 1.00 29.81 C ATOM 2028 C ASP A 131 14.058 24.872 30.923 1.00 31.01 C ATOM 2029 O ASP A 131 14.178 24.670 32.132 1.00 31.82 O ATOM 2030 CB ASP A 131 12.859 22.839 30.196 1.00 29.11 C ATOM 2031 CG ASP A 131 12.309 22.202 28.939 1.00 27.70 C ATOM 2032 OD1 ASP A 131 11.092 22.322 28.691 1.00 27.01 O ATOM 2033 OD2 ASP A 131 13.108 21.581 28.199 1.00 27.31 O ATOM 0 H ASP A 131 13.101 24.136 28.088 1.00 29.07 H new ATOM 0 HA ASP A 131 11.929 24.735 30.621 1.00 29.81 H new ATOM 0 HB2 ASP A 131 13.882 22.497 30.350 1.00 29.11 H new ATOM 0 HB3 ASP A 131 12.277 22.498 31.052 1.00 29.11 H new ATOM 2038 N GLY A 132 14.954 25.535 30.201 1.00 31.16 N ATOM 2039 CA GLY A 132 16.168 26.047 30.802 1.00 32.30 C ATOM 2040 C GLY A 132 17.018 24.964 31.419 1.00 32.54 C ATOM 2041 O GLY A 132 17.470 25.087 32.557 1.00 33.59 O ATOM 0 H GLY A 132 14.859 25.727 29.204 1.00 31.16 H new ATOM 0 HA2 GLY A 132 16.750 26.571 30.044 1.00 32.30 H new ATOM 0 HA3 GLY A 132 15.908 26.779 31.567 1.00 32.30 H new ATOM 2045 N ASP A 133 17.240 23.899 30.657 1.00 31.60 N ATOM 2046 CA ASP A 133 18.063 22.799 31.106 1.00 31.81 C ATOM 2047 C ASP A 133 19.317 22.757 30.264 1.00 31.80 C ATOM 2048 O ASP A 133 19.346 23.253 29.139 1.00 31.29 O ATOM 2049 CB ASP A 133 17.352 21.452 30.958 1.00 30.84 C ATOM 2050 CG ASP A 133 15.848 21.550 30.998 1.00 30.25 C ATOM 2051 OD1 ASP A 133 15.307 22.070 31.997 1.00 30.65 O ATOM 2052 OD2 ASP A 133 15.210 21.098 30.022 1.00 29.45 O ATOM 0 H ASP A 133 16.855 23.781 29.720 1.00 31.60 H new ATOM 0 HA ASP A 133 18.286 22.960 32.161 1.00 31.81 H new ATOM 0 HB2 ASP A 133 17.652 20.995 30.015 1.00 30.84 H new ATOM 0 HB3 ASP A 133 17.685 20.787 31.755 1.00 30.84 H new ATOM 2057 N GLY A 134 20.345 22.161 30.809 1.00 32.44 N ATOM 2058 CA GLY A 134 21.587 22.028 30.080 1.00 32.56 C ATOM 2059 C GLY A 134 21.471 20.985 28.990 1.00 31.38 C ATOM 2060 O GLY A 134 22.474 20.433 28.542 1.00 31.48 O ATOM 0 H GLY A 134 20.352 21.762 31.748 1.00 32.44 H new ATOM 0 HA2 GLY A 134 21.859 22.988 29.641 1.00 32.56 H new ATOM 0 HA3 GLY A 134 22.388 21.753 30.767 1.00 32.56 H new ATOM 2064 N MET A 135 20.235 20.711 28.570 1.00 30.31 N ATOM 2065 CA MET A 135 19.977 19.719 27.537 1.00 29.12 C ATOM 2066 C MET A 135 18.750 20.088 26.704 1.00 28.02 C ATOM 2067 O MET A 135 17.852 20.808 27.164 1.00 28.13 O ATOM 2068 CB MET A 135 19.782 18.339 28.168 1.00 28.97 C ATOM 2069 CG MET A 135 18.761 18.318 29.294 1.00 29.26 C ATOM 2070 SD MET A 135 19.457 18.835 30.874 1.00 30.55 S ATOM 2071 CE MET A 135 20.609 17.499 31.189 1.00 31.50 C ATOM 0 H MET A 135 19.398 21.166 28.933 1.00 30.31 H new ATOM 0 HA MET A 135 20.842 19.695 26.874 1.00 29.12 H new ATOM 0 HB2 MET A 135 19.471 17.637 27.395 1.00 28.97 H new ATOM 0 HB3 MET A 135 20.739 17.987 28.552 1.00 28.97 H new ATOM 0 HG2 MET A 135 17.929 18.973 29.037 1.00 29.26 H new ATOM 0 HG3 MET A 135 18.355 17.311 29.392 1.00 29.26 H new ATOM 0 HE1 MET A 135 20.457 17.118 32.199 1.00 31.50 H new ATOM 0 HE2 MET A 135 20.442 16.697 30.470 1.00 31.50 H new ATOM 0 HE3 MET A 135 21.630 17.868 31.091 1.00 31.50 H new ATOM 2081 N ILE A 136 18.712 19.573 25.477 1.00 27.01 N ATOM 2082 CA ILE A 136 17.604 19.844 24.569 1.00 25.91 C ATOM 2083 C ILE A 136 16.600 18.699 24.583 1.00 24.90 C ATOM 2084 O ILE A 136 16.962 17.549 24.386 1.00 24.54 O ATOM 2085 CB ILE A 136 18.075 20.049 23.116 1.00 25.40 C ATOM 2086 CG1 ILE A 136 19.143 21.139 23.032 1.00 26.49 C ATOM 2087 CG2 ILE A 136 16.891 20.400 22.231 1.00 24.33 C ATOM 2088 CD1 ILE A 136 19.648 21.376 21.623 1.00 26.17 C ATOM 0 H ILE A 136 19.436 18.967 25.091 1.00 27.01 H new ATOM 0 HA ILE A 136 17.140 20.764 24.924 1.00 25.91 H new ATOM 0 HB ILE A 136 18.519 19.117 22.765 1.00 25.40 H new ATOM 0 HG12 ILE A 136 18.734 22.070 23.425 1.00 26.49 H new ATOM 0 HG13 ILE A 136 19.983 20.865 23.670 1.00 26.49 H new ATOM 0 HG21 ILE A 136 17.233 20.543 21.206 1.00 24.33 H new ATOM 0 HG22 ILE A 136 16.162 19.590 22.261 1.00 24.33 H new ATOM 0 HG23 ILE A 136 16.428 21.319 22.591 1.00 24.33 H new ATOM 0 HD11 ILE A 136 20.404 22.162 21.635 1.00 26.17 H new ATOM 0 HD12 ILE A 136 20.086 20.457 21.234 1.00 26.17 H new ATOM 0 HD13 ILE A 136 18.818 21.680 20.985 1.00 26.17 H new ATOM 2100 N ASN A 137 15.334 19.018 24.798 1.00 24.49 N ATOM 2101 CA ASN A 137 14.298 18.001 24.828 1.00 23.59 C ATOM 2102 C ASN A 137 13.719 17.818 23.434 1.00 22.27 C ATOM 2103 O ASN A 137 13.714 18.755 22.638 1.00 22.13 O ATOM 2104 CB ASN A 137 13.200 18.389 25.821 1.00 23.94 C ATOM 2105 CG ASN A 137 12.173 17.292 26.033 1.00 23.25 C ATOM 2106 OD1 ASN A 137 11.907 16.483 25.147 1.00 22.19 O ATOM 2107 ND2 ASN A 137 11.582 17.261 27.215 1.00 23.92 N ATOM 0 H ASN A 137 15.001 19.969 24.954 1.00 24.49 H new ATOM 0 HA ASN A 137 14.734 17.057 25.155 1.00 23.59 H new ATOM 0 HB2 ASN A 137 13.657 18.641 26.778 1.00 23.94 H new ATOM 0 HB3 ASN A 137 12.695 19.286 25.463 1.00 23.94 H new ATOM 0 HD21 ASN A 137 10.880 16.549 27.416 1.00 23.92 H new ATOM 0 HD22 ASN A 137 11.828 17.949 27.927 1.00 23.92 H new ATOM 2114 N TYR A 138 13.259 16.609 23.136 1.00 21.38 N ATOM 2115 CA TYR A 138 12.680 16.303 21.834 1.00 20.08 C ATOM 2116 C TYR A 138 11.846 17.462 21.303 1.00 19.79 C ATOM 2117 O TYR A 138 11.933 17.805 20.127 1.00 19.22 O ATOM 2118 CB TYR A 138 11.825 15.042 21.924 1.00 19.28 C ATOM 2119 CG TYR A 138 11.054 14.743 20.660 1.00 17.91 C ATOM 2120 CD1 TYR A 138 11.692 14.212 19.545 1.00 17.42 C ATOM 2121 CD2 TYR A 138 9.689 14.988 20.582 1.00 17.16 C ATOM 2122 CE1 TYR A 138 10.991 13.934 18.388 1.00 16.17 C ATOM 2123 CE2 TYR A 138 8.983 14.713 19.429 1.00 15.93 C ATOM 2124 CZ TYR A 138 9.634 14.202 18.334 1.00 15.40 C ATOM 2125 OH TYR A 138 8.938 13.910 17.183 1.00 14.17 O ATOM 0 H TYR A 138 13.276 15.820 23.783 1.00 21.38 H new ATOM 0 HA TYR A 138 13.501 16.136 21.136 1.00 20.08 H new ATOM 0 HB2 TYR A 138 12.468 14.193 22.157 1.00 19.28 H new ATOM 0 HB3 TYR A 138 11.123 15.147 22.751 1.00 19.28 H new ATOM 0 HD1 TYR A 138 12.753 14.014 19.584 1.00 17.42 H new ATOM 0 HD2 TYR A 138 9.173 15.400 21.437 1.00 17.16 H new ATOM 0 HE1 TYR A 138 11.497 13.511 17.533 1.00 16.17 H new ATOM 0 HE2 TYR A 138 7.920 14.899 19.388 1.00 15.93 H new ATOM 0 HH TYR A 138 7.996 14.154 17.300 1.00 14.17 H new ATOM 2135 N GLU A 139 11.055 18.070 22.180 1.00 20.30 N ATOM 2136 CA GLU A 139 10.194 19.185 21.792 1.00 20.23 C ATOM 2137 C GLU A 139 10.997 20.396 21.318 1.00 20.87 C ATOM 2138 O GLU A 139 10.669 21.020 20.305 1.00 20.48 O ATOM 2139 CB GLU A 139 9.311 19.590 22.970 1.00 20.94 C ATOM 2140 CG GLU A 139 10.089 19.899 24.240 1.00 22.25 C ATOM 2141 CD GLU A 139 9.186 20.271 25.400 1.00 22.99 C ATOM 2142 OE1 GLU A 139 8.817 21.461 25.509 1.00 23.36 O ATOM 2143 OE2 GLU A 139 8.847 19.374 26.200 1.00 23.27 O ATOM 0 H GLU A 139 10.991 17.811 23.164 1.00 20.30 H new ATOM 0 HA GLU A 139 9.579 18.847 20.958 1.00 20.23 H new ATOM 0 HB2 GLU A 139 8.727 20.467 22.690 1.00 20.94 H new ATOM 0 HB3 GLU A 139 8.603 18.787 23.175 1.00 20.94 H new ATOM 0 HG2 GLU A 139 10.689 19.031 24.515 1.00 22.25 H new ATOM 0 HG3 GLU A 139 10.782 20.717 24.047 1.00 22.25 H new ATOM 2150 N GLU A 140 12.062 20.705 22.041 1.00 21.93 N ATOM 2151 CA GLU A 140 12.899 21.854 21.724 1.00 22.74 C ATOM 2152 C GLU A 140 13.698 21.615 20.453 1.00 22.24 C ATOM 2153 O GLU A 140 13.743 22.460 19.559 1.00 22.29 O ATOM 2154 CB GLU A 140 13.869 22.126 22.869 1.00 24.01 C ATOM 2155 CG GLU A 140 13.249 22.038 24.255 1.00 24.56 C ATOM 2156 CD GLU A 140 14.257 22.320 25.353 1.00 25.83 C ATOM 2157 OE1 GLU A 140 15.413 21.862 25.237 1.00 26.40 O ATOM 2158 OE2 GLU A 140 13.889 22.992 26.335 1.00 26.30 O ATOM 0 H GLU A 140 12.369 20.174 22.856 1.00 21.93 H new ATOM 0 HA GLU A 140 12.243 22.712 21.576 1.00 22.74 H new ATOM 0 HB2 GLU A 140 14.693 21.415 22.807 1.00 24.01 H new ATOM 0 HB3 GLU A 140 14.296 23.120 22.738 1.00 24.01 H new ATOM 0 HG2 GLU A 140 12.426 22.749 24.329 1.00 24.56 H new ATOM 0 HG3 GLU A 140 12.826 21.044 24.399 1.00 24.56 H new ATOM 2165 N PHE A 141 14.326 20.453 20.389 1.00 21.88 N ATOM 2166 CA PHE A 141 15.150 20.081 19.251 1.00 21.51 C ATOM 2167 C PHE A 141 14.336 20.044 17.959 1.00 20.36 C ATOM 2168 O PHE A 141 14.711 20.664 16.963 1.00 20.46 O ATOM 2169 CB PHE A 141 15.796 18.719 19.519 1.00 21.36 C ATOM 2170 CG PHE A 141 16.473 18.114 18.328 1.00 20.89 C ATOM 2171 CD1 PHE A 141 17.747 18.509 17.961 1.00 20.72 C ATOM 2172 CD2 PHE A 141 15.833 17.143 17.583 1.00 20.72 C ATOM 2173 CE1 PHE A 141 18.371 17.945 16.865 1.00 20.40 C ATOM 2174 CE2 PHE A 141 16.449 16.574 16.487 1.00 20.40 C ATOM 2175 CZ PHE A 141 17.720 16.975 16.127 1.00 20.24 C ATOM 0 H PHE A 141 14.280 19.744 21.121 1.00 21.88 H new ATOM 0 HA PHE A 141 15.927 20.835 19.122 1.00 21.51 H new ATOM 0 HB2 PHE A 141 16.526 18.828 20.321 1.00 21.36 H new ATOM 0 HB3 PHE A 141 15.030 18.030 19.876 1.00 21.36 H new ATOM 0 HD1 PHE A 141 18.259 19.266 18.537 1.00 20.72 H new ATOM 0 HD2 PHE A 141 14.839 16.825 17.861 1.00 20.72 H new ATOM 0 HE1 PHE A 141 19.365 18.261 16.586 1.00 20.40 H new ATOM 0 HE2 PHE A 141 15.938 15.816 15.912 1.00 20.40 H new ATOM 0 HZ PHE A 141 18.205 16.531 15.270 1.00 20.24 H new ATOM 2185 N VAL A 142 13.226 19.311 17.979 1.00 19.36 N ATOM 2186 CA VAL A 142 12.370 19.193 16.796 1.00 18.22 C ATOM 2187 C VAL A 142 11.923 20.556 16.302 1.00 18.56 C ATOM 2188 O VAL A 142 11.790 20.779 15.098 1.00 18.08 O ATOM 2189 CB VAL A 142 11.121 18.325 17.049 1.00 17.23 C ATOM 2190 CG1 VAL A 142 10.231 18.927 18.118 1.00 17.77 C ATOM 2191 CG2 VAL A 142 10.348 18.145 15.754 1.00 16.07 C ATOM 0 H VAL A 142 12.898 18.792 18.794 1.00 19.36 H new ATOM 0 HA VAL A 142 12.981 18.704 16.037 1.00 18.22 H new ATOM 0 HB VAL A 142 11.452 17.351 17.409 1.00 17.23 H new ATOM 0 HG11 VAL A 142 9.361 18.288 18.269 1.00 17.77 H new ATOM 0 HG12 VAL A 142 10.788 19.009 19.051 1.00 17.77 H new ATOM 0 HG13 VAL A 142 9.903 19.918 17.803 1.00 17.77 H new ATOM 0 HG21 VAL A 142 9.467 17.531 15.939 1.00 16.07 H new ATOM 0 HG22 VAL A 142 10.039 19.120 15.376 1.00 16.07 H new ATOM 0 HG23 VAL A 142 10.983 17.655 15.016 1.00 16.07 H new ATOM 2201 N TRP A 143 11.693 21.464 17.236 1.00 19.50 N ATOM 2202 CA TRP A 143 11.276 22.811 16.894 1.00 20.05 C ATOM 2203 C TRP A 143 12.339 23.476 16.035 1.00 20.61 C ATOM 2204 O TRP A 143 12.058 24.025 14.969 1.00 20.44 O ATOM 2205 CB TRP A 143 11.059 23.630 18.169 1.00 21.15 C ATOM 2206 CG TRP A 143 11.185 25.102 17.944 1.00 22.13 C ATOM 2207 CD1 TRP A 143 10.207 25.930 17.515 1.00 22.20 C ATOM 2208 CD2 TRP A 143 12.354 25.911 18.108 1.00 23.25 C ATOM 2209 NE1 TRP A 143 10.681 27.215 17.410 1.00 23.30 N ATOM 2210 CE2 TRP A 143 11.998 27.226 17.765 1.00 23.94 C ATOM 2211 CE3 TRP A 143 13.663 25.653 18.511 1.00 23.82 C ATOM 2212 CZ2 TRP A 143 12.903 28.278 17.812 1.00 25.11 C ATOM 2213 CZ3 TRP A 143 14.562 26.699 18.554 1.00 24.98 C ATOM 2214 CH2 TRP A 143 14.177 27.996 18.206 1.00 25.59 C ATOM 0 H TRP A 143 11.788 21.291 18.237 1.00 19.50 H new ATOM 0 HA TRP A 143 10.341 22.762 16.337 1.00 20.05 H new ATOM 0 HB2 TRP A 143 10.069 23.412 18.570 1.00 21.15 H new ATOM 0 HB3 TRP A 143 11.783 23.319 18.922 1.00 21.15 H new ATOM 0 HD1 TRP A 143 9.196 25.625 17.287 1.00 22.20 H new ATOM 0 HE1 TRP A 143 10.138 28.027 17.115 1.00 23.30 H new ATOM 0 HE3 TRP A 143 13.968 24.654 18.784 1.00 23.82 H new ATOM 0 HZ2 TRP A 143 12.608 29.282 17.546 1.00 25.11 H new ATOM 0 HZ3 TRP A 143 15.580 26.512 18.862 1.00 24.98 H new ATOM 0 HH2 TRP A 143 14.905 28.793 18.250 1.00 25.59 H new ATOM 2225 N MET A 144 13.556 23.415 16.530 1.00 21.37 N ATOM 2226 CA MET A 144 14.705 24.012 15.878 1.00 22.12 C ATOM 2227 C MET A 144 14.897 23.526 14.440 1.00 21.40 C ATOM 2228 O MET A 144 14.965 24.331 13.514 1.00 21.75 O ATOM 2229 CB MET A 144 15.927 23.700 16.728 1.00 22.89 C ATOM 2230 CG MET A 144 17.247 24.111 16.099 1.00 23.65 C ATOM 2231 SD MET A 144 18.034 22.766 15.192 1.00 23.25 S ATOM 2232 CE MET A 144 18.185 21.537 16.485 1.00 22.97 C ATOM 0 H MET A 144 13.780 22.944 17.407 1.00 21.37 H new ATOM 0 HA MET A 144 14.548 25.088 15.799 1.00 22.12 H new ATOM 0 HB2 MET A 144 15.824 24.203 17.690 1.00 22.89 H new ATOM 0 HB3 MET A 144 15.952 22.629 16.929 1.00 22.89 H new ATOM 0 HG2 MET A 144 17.077 24.949 15.423 1.00 23.65 H new ATOM 0 HG3 MET A 144 17.923 24.462 16.879 1.00 23.65 H new ATOM 0 HE1 MET A 144 18.907 20.778 16.183 1.00 22.97 H new ATOM 0 HE2 MET A 144 18.524 22.015 17.404 1.00 22.97 H new ATOM 0 HE3 MET A 144 17.216 21.068 16.656 1.00 22.97 H new ATOM 2242 N ILE A 145 14.987 22.213 14.258 1.00 20.47 N ATOM 2243 CA ILE A 145 15.183 21.637 12.929 1.00 19.79 C ATOM 2244 C ILE A 145 13.954 21.824 12.044 1.00 18.96 C ATOM 2245 O ILE A 145 14.022 21.635 10.829 1.00 18.60 O ATOM 2246 CB ILE A 145 15.516 20.137 13.005 1.00 19.06 C ATOM 2247 CG1 ILE A 145 14.334 19.365 13.590 1.00 18.09 C ATOM 2248 CG2 ILE A 145 16.772 19.915 13.834 1.00 20.01 C ATOM 2249 CD1 ILE A 145 14.559 17.871 13.651 1.00 17.41 C ATOM 0 H ILE A 145 14.928 21.527 15.011 1.00 20.47 H new ATOM 0 HA ILE A 145 16.025 22.171 12.488 1.00 19.79 H new ATOM 0 HB ILE A 145 15.704 19.766 11.998 1.00 19.06 H new ATOM 0 HG12 ILE A 145 14.130 19.735 14.595 1.00 18.09 H new ATOM 0 HG13 ILE A 145 13.446 19.566 12.990 1.00 18.09 H new ATOM 0 HG21 ILE A 145 16.995 18.849 13.879 1.00 20.01 H new ATOM 0 HG22 ILE A 145 17.609 20.442 13.375 1.00 20.01 H new ATOM 0 HG23 ILE A 145 16.614 20.295 14.843 1.00 20.01 H new ATOM 0 HD11 ILE A 145 13.680 17.388 14.077 1.00 17.41 H new ATOM 0 HD12 ILE A 145 14.733 17.488 12.645 1.00 17.41 H new ATOM 0 HD13 ILE A 145 15.427 17.659 14.275 1.00 17.41 H new ATOM 2261 N SER A 146 12.834 22.194 12.654 1.00 18.76 N ATOM 2262 CA SER A 146 11.593 22.391 11.913 1.00 18.09 C ATOM 2263 C SER A 146 11.640 23.686 11.111 1.00 18.99 C ATOM 2264 O SER A 146 11.196 23.735 9.964 1.00 18.73 O ATOM 2265 CB SER A 146 10.397 22.415 12.866 1.00 17.78 C ATOM 2266 OG SER A 146 9.179 22.526 12.153 1.00 17.22 O ATOM 0 H SER A 146 12.759 22.363 13.657 1.00 18.76 H new ATOM 0 HA SER A 146 11.479 21.556 11.222 1.00 18.09 H new ATOM 0 HB2 SER A 146 10.389 21.506 13.467 1.00 17.78 H new ATOM 0 HB3 SER A 146 10.495 23.252 13.557 1.00 17.78 H new ATOM 0 HG SER A 146 8.430 22.538 12.785 1.00 17.22 H new ATOM 2272 N GLN A 147 12.182 24.731 11.723 1.00 20.13 N ATOM 2273 CA GLN A 147 12.284 26.030 11.072 1.00 21.14 C ATOM 2274 C GLN A 147 13.652 26.212 10.425 1.00 21.86 C ATOM 2275 O GLN A 147 13.756 26.638 9.276 1.00 22.11 O ATOM 2276 CB GLN A 147 12.043 27.140 12.090 1.00 22.13 C ATOM 2277 CG GLN A 147 11.121 26.726 13.221 1.00 21.65 C ATOM 2278 CD GLN A 147 10.631 27.903 14.026 1.00 22.67 C ATOM 2279 OE1 GLN A 147 9.582 28.479 13.738 1.00 22.79 O ATOM 2280 NE2 GLN A 147 11.397 28.268 15.039 1.00 23.48 N ATOM 0 H GLN A 147 12.558 24.704 12.671 1.00 20.13 H new ATOM 0 HA GLN A 147 11.526 26.081 10.291 1.00 21.14 H new ATOM 0 HB2 GLN A 147 12.999 27.455 12.507 1.00 22.13 H new ATOM 0 HB3 GLN A 147 11.617 28.004 11.581 1.00 22.13 H new ATOM 0 HG2 GLN A 147 10.266 26.189 12.810 1.00 21.65 H new ATOM 0 HG3 GLN A 147 11.646 26.033 13.879 1.00 21.65 H new ATOM 0 HE21 GLN A 147 12.258 27.758 15.237 1.00 23.48 H new ATOM 0 HE22 GLN A 147 11.127 29.060 15.623 1.00 23.48 H new ATOM 2289 N LYS A 148 14.697 25.881 11.176 1.00 22.30 N ATOM 2290 CA LYS A 148 16.063 26.011 10.686 1.00 23.11 C ATOM 2291 C LYS A 148 16.468 24.793 9.861 1.00 22.36 C ATOM 2292 O LYS A 148 16.960 23.812 10.458 1.00 22.12 O ATOM 2293 CB LYS A 148 17.029 26.193 11.860 1.00 24.04 C ATOM 2294 CG LYS A 148 16.662 27.354 12.770 1.00 24.96 C ATOM 2295 CD LYS A 148 17.583 27.431 13.975 1.00 25.58 C ATOM 2296 CE LYS A 148 17.155 28.532 14.931 1.00 25.71 C ATOM 2297 NZ LYS A 148 17.223 29.876 14.296 1.00 26.17 N ATOM 2298 OXT LYS A 148 16.287 24.829 8.627 1.00 22.11 O ATOM 0 H LYS A 148 14.623 25.520 12.127 1.00 22.30 H new ATOM 0 HA LYS A 148 16.110 26.890 10.043 1.00 23.11 H new ATOM 0 HB2 LYS A 148 17.053 25.275 12.447 1.00 24.04 H new ATOM 0 HB3 LYS A 148 18.035 26.350 11.472 1.00 24.04 H new ATOM 0 HG2 LYS A 148 16.716 28.287 12.210 1.00 24.96 H new ATOM 0 HG3 LYS A 148 15.631 27.242 13.106 1.00 24.96 H new ATOM 0 HD2 LYS A 148 17.583 26.474 14.497 1.00 25.58 H new ATOM 0 HD3 LYS A 148 18.605 27.613 13.643 1.00 25.58 H new ATOM 0 HE2 LYS A 148 16.137 28.342 15.271 1.00 25.71 H new ATOM 0 HE3 LYS A 148 17.794 28.515 15.814 1.00 25.71 H new ATOM 0 HZ1 LYS A 148 17.072 30.609 15.018 1.00 26.17 H new ATOM 0 HZ2 LYS A 148 18.158 30.007 13.860 1.00 26.17 H new ATOM 0 HZ3 LYS A 148 16.486 29.953 13.566 1.00 26.17 H new TER 2312 LYS A 148 HETATM 2313 CA CA A 149 20.781 12.406 26.777 1.00 27.20 CA HETATM 2314 CA CA A 150 15.649 21.782 27.731 1.00 27.86 CA