USER MOD reduce.3.24.130724 H: found=0, std=0, add=1122, rem=0, adj=30 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 109 MET CE :methyl -139:sc= -0.396 (180deg=-3.18!) USER MOD Set 1.2: A 124 MET CE :methyl 161:sc= -0.212 (180deg=-0.925) USER MOD Set 2.1: A 79 THR OG1 : rot -85:sc= 0.914 USER MOD Set 2.2: A 81 THR OG1 : rot 180:sc= 0.983 USER MOD Set 3.1: A 58 ASN : amide:sc= -1.27 K(o=-2.3,f=-1.2) USER MOD Set 3.2: A 59 ASN : amide:sc= -1.03 K(o=-2.3,f=-4.3) USER MOD Set 4.1: A 36 MET CE :methyl -157:sc= -2.59 (180deg=-3.67!) USER MOD Set 4.2: A 75 GLN : amide:sc= -1.78 K(o=-4.4,f=-5.4!) USER MOD Set 5.1: A 5 THR OG1 : rot -76:sc= -0.499 USER MOD Set 5.2: A 8 GLN : amide:sc= -4.43! C(o=-11!,f=-15!) USER MOD Set 5.3: A 41 GLN : amide:sc= -1.55 K(o=-11,f=-13) USER MOD Set 5.4: A 72 MET CE :methyl 169:sc= -4.01! (180deg=-4.59!) USER MOD Set 5.5: A 76 MET CE :methyl 144:sc= -0.393 (180deg=0) USER MOD Single : A 1 MET CE :methyl 145:sc= -0.149 (180deg=-1.39) USER MOD Single : A 1 MET N :NH3+ 179:sc= -1.74 (180deg=-1.76) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0.0295 X(o=0.029,f=-0.007) USER MOD Single : A 21 LYS NZ :NH3+ 167:sc= -0.0173 (180deg=-0.199) USER MOD Single : A 24 THR OG1 : rot 60:sc= 1.1 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -140:sc= -0.488 USER MOD Single : A 34 THR OG1 : rot -170:sc= 0.00111 USER MOD Single : A 38 THR OG1 : rot 75:sc= 0.842 USER MOD Single : A 42 ASN : amide:sc= -3.1! K(o=-3.1!,f=-0.16) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -6.47! K(o=-6.5!,f=-3.1) USER MOD Single : A 57 ASN : amide:sc= -0.0734 K(o=-0.073,f=-1) USER MOD Single : A 60 ASN : amide:sc= -0.285 K(o=-0.28,f=-3.1!) USER MOD Single : A 62 GLN : amide:sc= -0.904 K(o=-0.9,f=-0.051) USER MOD Single : A 64 ASN : amide:sc= -2.52 K(o=-2.5,f=-8.5!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -30:sc= 0.246 USER MOD Single : A 74 LYS NZ :NH3+ 161:sc= 0.856 (180deg=0.609) USER MOD Single : A 85 MET CE :methyl -147:sc= -4.26! (180deg=-7.98!) USER MOD Single : A 90 LYS NZ :NH3+ -169:sc=-0.00899 (180deg=-0.138) USER MOD Single : A 101 SER OG : rot 180:sc= -1.42 USER MOD Single : A 111 ASN : amide:sc= -2.26 K(o=-2.3,f=-0.71) USER MOD Single : A 115 LYS NZ :NH3+ -159:sc= -0.122 (180deg=-0.678) USER MOD Single : A 117 THR OG1 : rot -170:sc= -0.474 USER MOD Single : A 135 MET CE :methyl -153:sc= -0.295 (180deg=-1.25) USER MOD Single : A 137 ASN : amide:sc= -3.47! C(o=-3.5!,f=-12!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.311 USER MOD Single : A 144 MET CE :methyl -153:sc= -0.532 (180deg=-1.66!) USER MOD Single : A 146 SER OG : rot -30:sc= 0.624 USER MOD Single : A 147 GLN : amide:sc= -2.36 K(o=-2.4,f=-0.68) USER MOD Single : A 148 LYS NZ :NH3+ -131:sc= 0 (180deg=-1.81!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.482 -6.417 8.289 1.00 1.05 N ATOM 2 CA MET A 1 10.877 -7.426 9.193 1.00 0.92 C ATOM 3 C MET A 1 10.518 -6.804 10.539 1.00 0.91 C ATOM 4 O MET A 1 10.457 -7.495 11.557 1.00 1.39 O ATOM 5 CB MET A 1 11.842 -8.595 9.402 1.00 1.18 C ATOM 6 CG MET A 1 13.177 -8.184 10.004 1.00 1.50 C ATOM 7 SD MET A 1 14.299 -9.578 10.223 1.00 1.72 S ATOM 8 CE MET A 1 14.540 -10.089 8.524 1.00 2.27 C ATOM 0 H1 MET A 1 11.734 -6.867 7.386 1.00 1.05 H new ATOM 0 H2 MET A 1 10.799 -5.652 8.116 1.00 1.05 H new ATOM 0 H3 MET A 1 12.338 -6.024 8.730 1.00 1.05 H new ATOM 0 HA MET A 1 9.963 -7.794 8.727 1.00 0.92 H new ATOM 0 HB2 MET A 1 11.371 -9.332 10.053 1.00 1.18 H new ATOM 0 HB3 MET A 1 12.020 -9.084 8.444 1.00 1.18 H new ATOM 0 HG2 MET A 1 13.648 -7.441 9.360 1.00 1.50 H new ATOM 0 HG3 MET A 1 13.005 -7.706 10.969 1.00 1.50 H new ATOM 0 HE1 MET A 1 15.562 -10.445 8.393 1.00 2.27 H new ATOM 0 HE2 MET A 1 13.842 -10.891 8.283 1.00 2.27 H new ATOM 0 HE3 MET A 1 14.363 -9.242 7.861 1.00 2.27 H new ATOM 20 N SER A 2 10.284 -5.497 10.535 1.00 0.85 N ATOM 21 CA SER A 2 9.931 -4.780 11.756 1.00 0.89 C ATOM 22 C SER A 2 8.609 -5.289 12.324 1.00 0.89 C ATOM 23 O SER A 2 8.539 -5.711 13.478 1.00 0.98 O ATOM 24 CB SER A 2 9.834 -3.279 11.478 1.00 0.92 C ATOM 25 OG SER A 2 9.463 -2.567 12.647 1.00 1.04 O ATOM 0 H SER A 2 10.332 -4.912 9.701 1.00 0.85 H new ATOM 0 HA SER A 2 10.715 -4.958 12.492 1.00 0.89 H new ATOM 0 HB2 SER A 2 10.793 -2.911 11.113 1.00 0.92 H new ATOM 0 HB3 SER A 2 9.102 -3.098 10.691 1.00 0.92 H new ATOM 0 HG SER A 2 9.409 -1.610 12.444 1.00 1.04 H new ATOM 31 N GLU A 3 7.567 -5.251 11.499 1.00 0.85 N ATOM 32 CA GLU A 3 6.242 -5.707 11.912 1.00 0.93 C ATOM 33 C GLU A 3 5.498 -6.329 10.736 1.00 0.95 C ATOM 34 O GLU A 3 4.269 -6.409 10.737 1.00 1.73 O ATOM 35 CB GLU A 3 5.432 -4.543 12.484 1.00 1.02 C ATOM 36 CG GLU A 3 5.924 -4.062 13.839 1.00 1.10 C ATOM 37 CD GLU A 3 5.644 -5.057 14.949 1.00 1.54 C ATOM 38 OE1 GLU A 3 6.475 -5.965 15.157 1.00 2.13 O ATOM 39 OE2 GLU A 3 4.591 -4.930 15.608 1.00 1.67 O ATOM 0 H GLU A 3 7.614 -4.909 10.539 1.00 0.85 H new ATOM 0 HA GLU A 3 6.368 -6.464 12.686 1.00 0.93 H new ATOM 0 HB2 GLU A 3 5.462 -3.711 11.780 1.00 1.02 H new ATOM 0 HB3 GLU A 3 4.389 -4.847 12.573 1.00 1.02 H new ATOM 0 HG2 GLU A 3 6.996 -3.875 13.786 1.00 1.10 H new ATOM 0 HG3 GLU A 3 5.446 -3.112 14.079 1.00 1.10 H new ATOM 46 N LEU A 4 6.253 -6.769 9.735 1.00 0.37 N ATOM 47 CA LEU A 4 5.672 -7.382 8.546 1.00 0.29 C ATOM 48 C LEU A 4 5.199 -8.803 8.838 1.00 0.32 C ATOM 49 O LEU A 4 5.148 -9.223 9.995 1.00 0.36 O ATOM 50 CB LEU A 4 6.691 -7.393 7.406 1.00 0.22 C ATOM 51 CG LEU A 4 7.159 -6.014 6.939 1.00 0.25 C ATOM 52 CD1 LEU A 4 8.328 -5.529 7.778 1.00 0.37 C ATOM 53 CD2 LEU A 4 7.545 -6.052 5.473 1.00 0.27 C ATOM 0 H LEU A 4 7.271 -6.712 9.724 1.00 0.37 H new ATOM 0 HA LEU A 4 4.808 -6.789 8.247 1.00 0.29 H new ATOM 0 HB2 LEU A 4 7.562 -7.966 7.724 1.00 0.22 H new ATOM 0 HB3 LEU A 4 6.256 -7.919 6.556 1.00 0.22 H new ATOM 0 HG LEU A 4 6.332 -5.315 7.064 1.00 0.25 H new ATOM 0 HD11 LEU A 4 8.644 -4.546 7.428 1.00 0.37 H new ATOM 0 HD12 LEU A 4 8.023 -5.461 8.822 1.00 0.37 H new ATOM 0 HD13 LEU A 4 9.157 -6.231 7.687 1.00 0.37 H new ATOM 0 HD21 LEU A 4 7.875 -5.062 5.158 1.00 0.27 H new ATOM 0 HD22 LEU A 4 8.354 -6.768 5.328 1.00 0.27 H new ATOM 0 HD23 LEU A 4 6.683 -6.353 4.878 1.00 0.27 H new ATOM 65 N THR A 5 4.850 -9.541 7.786 1.00 0.32 N ATOM 66 CA THR A 5 4.378 -10.911 7.946 1.00 0.37 C ATOM 67 C THR A 5 5.530 -11.903 7.852 1.00 0.37 C ATOM 68 O THR A 5 6.019 -12.404 8.864 1.00 0.39 O ATOM 69 CB THR A 5 3.321 -11.269 6.884 1.00 0.42 C ATOM 70 OG1 THR A 5 3.801 -10.933 5.576 1.00 0.91 O ATOM 71 CG2 THR A 5 2.014 -10.541 7.148 1.00 0.91 C ATOM 0 H THR A 5 4.885 -9.214 6.820 1.00 0.32 H new ATOM 0 HA THR A 5 3.925 -10.975 8.935 1.00 0.37 H new ATOM 0 HB THR A 5 3.139 -12.342 6.940 1.00 0.42 H new ATOM 0 HG1 THR A 5 3.739 -9.964 5.444 1.00 0.91 H new ATOM 0 HG21 THR A 5 1.286 -10.812 6.384 1.00 0.91 H new ATOM 0 HG22 THR A 5 1.632 -10.823 8.129 1.00 0.91 H new ATOM 0 HG23 THR A 5 2.185 -9.465 7.121 1.00 0.91 H new ATOM 79 N GLU A 6 5.961 -12.157 6.620 1.00 0.35 N ATOM 80 CA GLU A 6 7.049 -13.084 6.336 1.00 0.35 C ATOM 81 C GLU A 6 7.190 -13.232 4.833 1.00 0.34 C ATOM 82 O GLU A 6 8.299 -13.326 4.311 1.00 0.32 O ATOM 83 CB GLU A 6 6.793 -14.451 6.986 1.00 0.40 C ATOM 84 CG GLU A 6 7.994 -15.384 6.960 1.00 0.94 C ATOM 85 CD GLU A 6 8.251 -15.978 5.588 1.00 1.48 C ATOM 86 OE1 GLU A 6 7.401 -16.759 5.112 1.00 1.55 O ATOM 87 OE2 GLU A 6 9.303 -15.666 4.993 1.00 2.21 O ATOM 0 H GLU A 6 5.563 -11.723 5.787 1.00 0.35 H new ATOM 0 HA GLU A 6 7.973 -12.687 6.756 1.00 0.35 H new ATOM 0 HB2 GLU A 6 6.487 -14.298 8.021 1.00 0.40 H new ATOM 0 HB3 GLU A 6 5.960 -14.934 6.476 1.00 0.40 H new ATOM 0 HG2 GLU A 6 8.879 -14.838 7.285 1.00 0.94 H new ATOM 0 HG3 GLU A 6 7.836 -16.191 7.676 1.00 0.94 H new ATOM 94 N GLU A 7 6.057 -13.262 4.138 1.00 0.38 N ATOM 95 CA GLU A 7 6.067 -13.362 2.689 1.00 0.40 C ATOM 96 C GLU A 7 6.709 -12.108 2.109 1.00 0.35 C ATOM 97 O GLU A 7 7.632 -12.183 1.296 1.00 0.33 O ATOM 98 CB GLU A 7 4.645 -13.539 2.147 1.00 0.46 C ATOM 99 CG GLU A 7 3.640 -12.557 2.727 1.00 0.49 C ATOM 100 CD GLU A 7 2.226 -12.823 2.246 1.00 0.56 C ATOM 101 OE1 GLU A 7 1.510 -13.602 2.910 1.00 0.62 O ATOM 102 OE2 GLU A 7 1.836 -12.254 1.205 1.00 0.60 O ATOM 0 H GLU A 7 5.127 -13.219 4.555 1.00 0.38 H new ATOM 0 HA GLU A 7 6.646 -14.237 2.393 1.00 0.40 H new ATOM 0 HB2 GLU A 7 4.663 -13.428 1.063 1.00 0.46 H new ATOM 0 HB3 GLU A 7 4.310 -14.555 2.358 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.667 -12.614 3.815 1.00 0.49 H new ATOM 0 HG3 GLU A 7 3.929 -11.542 2.454 1.00 0.49 H new ATOM 109 N GLN A 8 6.213 -10.953 2.548 1.00 0.33 N ATOM 110 CA GLN A 8 6.748 -9.678 2.110 1.00 0.30 C ATOM 111 C GLN A 8 8.194 -9.553 2.555 1.00 0.24 C ATOM 112 O GLN A 8 9.030 -8.964 1.866 1.00 0.22 O ATOM 113 CB GLN A 8 5.923 -8.538 2.696 1.00 0.32 C ATOM 114 CG GLN A 8 5.647 -8.709 4.179 1.00 0.32 C ATOM 115 CD GLN A 8 4.655 -7.692 4.721 1.00 0.36 C ATOM 116 OE1 GLN A 8 3.912 -7.979 5.659 1.00 0.85 O ATOM 117 NE2 GLN A 8 4.634 -6.499 4.135 1.00 0.57 N ATOM 0 H GLN A 8 5.439 -10.880 3.209 1.00 0.33 H new ATOM 0 HA GLN A 8 6.701 -9.624 1.022 1.00 0.30 H new ATOM 0 HB2 GLN A 8 6.448 -7.597 2.536 1.00 0.32 H new ATOM 0 HB3 GLN A 8 4.976 -8.470 2.161 1.00 0.32 H new ATOM 0 HG2 GLN A 8 5.263 -9.713 4.358 1.00 0.32 H new ATOM 0 HG3 GLN A 8 6.584 -8.623 4.729 1.00 0.32 H new ATOM 0 HE21 GLN A 8 5.266 -6.300 3.360 1.00 0.57 H new ATOM 0 HE22 GLN A 8 3.985 -5.782 4.461 1.00 0.57 H new ATOM 126 N ILE A 9 8.478 -10.130 3.720 1.00 0.22 N ATOM 127 CA ILE A 9 9.815 -10.105 4.279 1.00 0.18 C ATOM 128 C ILE A 9 10.760 -10.846 3.358 1.00 0.17 C ATOM 129 O ILE A 9 11.852 -10.374 3.047 1.00 0.15 O ATOM 130 CB ILE A 9 9.857 -10.735 5.686 1.00 0.20 C ATOM 131 CG1 ILE A 9 8.984 -9.923 6.647 1.00 0.21 C ATOM 132 CG2 ILE A 9 11.294 -10.810 6.192 1.00 0.21 C ATOM 133 CD1 ILE A 9 8.941 -10.477 8.056 1.00 0.24 C ATOM 0 H ILE A 9 7.792 -10.621 4.293 1.00 0.22 H new ATOM 0 HA ILE A 9 10.123 -9.064 4.372 1.00 0.18 H new ATOM 0 HB ILE A 9 9.464 -11.750 5.632 1.00 0.20 H new ATOM 0 HG12 ILE A 9 9.355 -8.899 6.681 1.00 0.21 H new ATOM 0 HG13 ILE A 9 7.969 -9.881 6.253 1.00 0.21 H new ATOM 0 HG21 ILE A 9 11.307 -11.257 7.186 1.00 0.21 H new ATOM 0 HG22 ILE A 9 11.888 -11.421 5.512 1.00 0.21 H new ATOM 0 HG23 ILE A 9 11.716 -9.806 6.240 1.00 0.21 H new ATOM 0 HD11 ILE A 9 8.303 -9.847 8.675 1.00 0.24 H new ATOM 0 HD12 ILE A 9 8.541 -11.491 8.036 1.00 0.24 H new ATOM 0 HD13 ILE A 9 9.948 -10.493 8.472 1.00 0.24 H new ATOM 145 N ALA A 10 10.310 -12.010 2.920 1.00 0.20 N ATOM 146 CA ALA A 10 11.084 -12.841 2.015 1.00 0.21 C ATOM 147 C ALA A 10 11.205 -12.165 0.661 1.00 0.20 C ATOM 148 O ALA A 10 12.072 -12.500 -0.144 1.00 0.19 O ATOM 149 CB ALA A 10 10.427 -14.205 1.866 1.00 0.26 C ATOM 0 H ALA A 10 9.405 -12.403 3.180 1.00 0.20 H new ATOM 0 HA ALA A 10 12.083 -12.977 2.429 1.00 0.21 H new ATOM 0 HB1 ALA A 10 11.016 -14.820 1.185 1.00 0.26 H new ATOM 0 HB2 ALA A 10 10.373 -14.691 2.840 1.00 0.26 H new ATOM 0 HB3 ALA A 10 9.421 -14.082 1.466 1.00 0.26 H new ATOM 155 N GLU A 11 10.310 -11.210 0.420 1.00 0.20 N ATOM 156 CA GLU A 11 10.292 -10.474 -0.840 1.00 0.21 C ATOM 157 C GLU A 11 11.501 -9.560 -0.971 1.00 0.18 C ATOM 158 O GLU A 11 12.404 -9.846 -1.750 1.00 0.18 O ATOM 159 CB GLU A 11 9.021 -9.642 -0.968 1.00 0.25 C ATOM 160 CG GLU A 11 8.557 -9.454 -2.403 1.00 0.29 C ATOM 161 CD GLU A 11 8.292 -10.770 -3.109 1.00 0.94 C ATOM 162 OE1 GLU A 11 7.217 -11.361 -2.879 1.00 0.84 O ATOM 163 OE2 GLU A 11 9.161 -11.209 -3.891 1.00 1.78 O ATOM 0 H GLU A 11 9.587 -10.928 1.082 1.00 0.20 H new ATOM 0 HA GLU A 11 10.323 -11.214 -1.639 1.00 0.21 H new ATOM 0 HB2 GLU A 11 8.225 -10.121 -0.398 1.00 0.25 H new ATOM 0 HB3 GLU A 11 9.191 -8.663 -0.519 1.00 0.25 H new ATOM 0 HG2 GLU A 11 7.648 -8.853 -2.411 1.00 0.29 H new ATOM 0 HG3 GLU A 11 9.313 -8.896 -2.955 1.00 0.29 H new ATOM 170 N PHE A 12 11.527 -8.450 -0.219 1.00 0.17 N ATOM 171 CA PHE A 12 12.663 -7.542 -0.319 1.00 0.17 C ATOM 172 C PHE A 12 13.934 -8.283 0.025 1.00 0.14 C ATOM 173 O PHE A 12 15.027 -7.892 -0.380 1.00 0.15 O ATOM 174 CB PHE A 12 12.504 -6.294 0.551 1.00 0.20 C ATOM 175 CG PHE A 12 11.974 -6.527 1.932 1.00 0.18 C ATOM 176 CD1 PHE A 12 10.614 -6.488 2.170 1.00 0.24 C ATOM 177 CD2 PHE A 12 12.831 -6.751 2.995 1.00 0.21 C ATOM 178 CE1 PHE A 12 10.115 -6.672 3.440 1.00 0.26 C ATOM 179 CE2 PHE A 12 12.338 -6.932 4.273 1.00 0.23 C ATOM 180 CZ PHE A 12 10.977 -6.893 4.496 1.00 0.21 C ATOM 0 H PHE A 12 10.800 -8.172 0.440 1.00 0.17 H new ATOM 0 HA PHE A 12 12.713 -7.188 -1.349 1.00 0.17 H new ATOM 0 HB2 PHE A 12 13.474 -5.804 0.632 1.00 0.20 H new ATOM 0 HB3 PHE A 12 11.838 -5.599 0.039 1.00 0.20 H new ATOM 0 HD1 PHE A 12 9.934 -6.311 1.350 1.00 0.24 H new ATOM 0 HD2 PHE A 12 13.897 -6.785 2.824 1.00 0.21 H new ATOM 0 HE1 PHE A 12 9.049 -6.643 3.610 1.00 0.26 H new ATOM 0 HE2 PHE A 12 13.016 -7.104 5.096 1.00 0.23 H new ATOM 0 HZ PHE A 12 10.587 -7.035 5.493 1.00 0.21 H new ATOM 190 N LYS A 13 13.780 -9.352 0.789 1.00 0.12 N ATOM 191 CA LYS A 13 14.902 -10.192 1.144 1.00 0.12 C ATOM 192 C LYS A 13 15.467 -10.825 -0.121 1.00 0.13 C ATOM 193 O LYS A 13 16.659 -10.724 -0.401 1.00 0.16 O ATOM 194 CB LYS A 13 14.456 -11.276 2.124 1.00 0.14 C ATOM 195 CG LYS A 13 15.491 -12.362 2.355 1.00 0.24 C ATOM 196 CD LYS A 13 16.675 -11.836 3.147 1.00 1.07 C ATOM 197 CE LYS A 13 17.802 -12.852 3.210 1.00 1.30 C ATOM 198 NZ LYS A 13 18.970 -12.337 3.976 1.00 2.27 N ATOM 0 H LYS A 13 12.885 -9.655 1.174 1.00 0.12 H new ATOM 0 HA LYS A 13 15.673 -9.590 1.625 1.00 0.12 H new ATOM 0 HB2 LYS A 13 14.213 -10.810 3.079 1.00 0.14 H new ATOM 0 HB3 LYS A 13 13.540 -11.734 1.751 1.00 0.14 H new ATOM 0 HG2 LYS A 13 15.034 -13.195 2.890 1.00 0.24 H new ATOM 0 HG3 LYS A 13 15.835 -12.749 1.396 1.00 0.24 H new ATOM 0 HD2 LYS A 13 17.039 -10.916 2.690 1.00 1.07 H new ATOM 0 HD3 LYS A 13 16.354 -11.585 4.158 1.00 1.07 H new ATOM 0 HE2 LYS A 13 17.439 -13.769 3.674 1.00 1.30 H new ATOM 0 HE3 LYS A 13 18.116 -13.109 2.198 1.00 1.30 H new ATOM 0 HZ1 LYS A 13 19.718 -13.059 3.996 1.00 2.27 H new ATOM 0 HZ2 LYS A 13 19.333 -11.476 3.519 1.00 2.27 H new ATOM 0 HZ3 LYS A 13 18.677 -12.115 4.949 1.00 2.27 H new ATOM 212 N ASP A 14 14.582 -11.450 -0.893 1.00 0.14 N ATOM 213 CA ASP A 14 14.969 -12.103 -2.136 1.00 0.16 C ATOM 214 C ASP A 14 15.446 -11.077 -3.158 1.00 0.16 C ATOM 215 O ASP A 14 16.369 -11.340 -3.927 1.00 0.17 O ATOM 216 CB ASP A 14 13.796 -12.919 -2.703 1.00 0.19 C ATOM 217 CG ASP A 14 12.865 -12.104 -3.582 1.00 0.20 C ATOM 218 OD1 ASP A 14 13.274 -11.736 -4.705 1.00 0.22 O ATOM 219 OD2 ASP A 14 11.719 -11.852 -3.158 1.00 0.22 O ATOM 0 H ASP A 14 13.588 -11.517 -0.676 1.00 0.14 H new ATOM 0 HA ASP A 14 15.794 -12.783 -1.922 1.00 0.16 H new ATOM 0 HB2 ASP A 14 14.190 -13.755 -3.281 1.00 0.19 H new ATOM 0 HB3 ASP A 14 13.225 -13.343 -1.877 1.00 0.19 H new ATOM 224 N ALA A 15 14.811 -9.905 -3.160 1.00 0.16 N ATOM 225 CA ALA A 15 15.179 -8.844 -4.089 1.00 0.17 C ATOM 226 C ALA A 15 16.574 -8.314 -3.780 1.00 0.16 C ATOM 227 O ALA A 15 17.384 -8.091 -4.676 1.00 0.20 O ATOM 228 CB ALA A 15 14.161 -7.714 -4.034 1.00 0.20 C ATOM 0 H ALA A 15 14.043 -9.670 -2.531 1.00 0.16 H new ATOM 0 HA ALA A 15 15.186 -9.260 -5.096 1.00 0.17 H new ATOM 0 HB1 ALA A 15 14.450 -6.930 -4.733 1.00 0.20 H new ATOM 0 HB2 ALA A 15 13.177 -8.097 -4.305 1.00 0.20 H new ATOM 0 HB3 ALA A 15 14.126 -7.305 -3.024 1.00 0.20 H new ATOM 234 N PHE A 16 16.835 -8.105 -2.502 1.00 0.14 N ATOM 235 CA PHE A 16 18.121 -7.598 -2.044 1.00 0.14 C ATOM 236 C PHE A 16 19.290 -8.457 -2.531 1.00 0.14 C ATOM 237 O PHE A 16 20.231 -7.951 -3.144 1.00 0.15 O ATOM 238 CB PHE A 16 18.133 -7.548 -0.517 1.00 0.15 C ATOM 239 CG PHE A 16 19.025 -6.482 0.042 1.00 0.25 C ATOM 240 CD1 PHE A 16 20.364 -6.736 0.283 1.00 0.45 C ATOM 241 CD2 PHE A 16 18.520 -5.226 0.330 1.00 0.35 C ATOM 242 CE1 PHE A 16 21.186 -5.754 0.800 1.00 0.59 C ATOM 243 CE2 PHE A 16 19.336 -4.239 0.850 1.00 0.50 C ATOM 244 CZ PHE A 16 20.671 -4.504 1.085 1.00 0.59 C ATOM 0 H PHE A 16 16.166 -8.281 -1.753 1.00 0.14 H new ATOM 0 HA PHE A 16 18.248 -6.599 -2.462 1.00 0.14 H new ATOM 0 HB2 PHE A 16 17.117 -7.384 -0.159 1.00 0.15 H new ATOM 0 HB3 PHE A 16 18.453 -8.516 -0.133 1.00 0.15 H new ATOM 0 HD1 PHE A 16 20.770 -7.712 0.064 1.00 0.45 H new ATOM 0 HD2 PHE A 16 17.477 -5.015 0.146 1.00 0.35 H new ATOM 0 HE1 PHE A 16 22.230 -5.963 0.981 1.00 0.59 H new ATOM 0 HE2 PHE A 16 18.931 -3.263 1.072 1.00 0.50 H new ATOM 0 HZ PHE A 16 21.312 -3.735 1.491 1.00 0.59 H new ATOM 254 N VAL A 17 19.221 -9.757 -2.253 1.00 0.16 N ATOM 255 CA VAL A 17 20.295 -10.684 -2.621 1.00 0.18 C ATOM 256 C VAL A 17 20.488 -10.767 -4.123 1.00 0.16 C ATOM 257 O VAL A 17 21.609 -10.701 -4.626 1.00 0.15 O ATOM 258 CB VAL A 17 20.032 -12.113 -2.080 1.00 0.22 C ATOM 259 CG1 VAL A 17 19.148 -12.066 -0.854 1.00 0.31 C ATOM 260 CG2 VAL A 17 19.405 -13.018 -3.136 1.00 0.28 C ATOM 0 H VAL A 17 18.434 -10.195 -1.774 1.00 0.16 H new ATOM 0 HA VAL A 17 21.200 -10.282 -2.165 1.00 0.18 H new ATOM 0 HB VAL A 17 21.000 -12.534 -1.810 1.00 0.22 H new ATOM 0 HG11 VAL A 17 18.976 -13.079 -0.490 1.00 0.31 H new ATOM 0 HG12 VAL A 17 19.636 -11.479 -0.076 1.00 0.31 H new ATOM 0 HG13 VAL A 17 18.194 -11.606 -1.111 1.00 0.31 H new ATOM 0 HG21 VAL A 17 19.238 -14.009 -2.713 1.00 0.28 H new ATOM 0 HG22 VAL A 17 18.453 -12.596 -3.458 1.00 0.28 H new ATOM 0 HG23 VAL A 17 20.075 -13.097 -3.992 1.00 0.28 H new ATOM 270 N GLN A 18 19.380 -10.893 -4.831 1.00 0.17 N ATOM 271 CA GLN A 18 19.403 -11.033 -6.267 1.00 0.18 C ATOM 272 C GLN A 18 20.024 -9.803 -6.916 1.00 0.15 C ATOM 273 O GLN A 18 20.375 -9.817 -8.096 1.00 0.18 O ATOM 274 CB GLN A 18 17.997 -11.300 -6.775 1.00 0.23 C ATOM 275 CG GLN A 18 17.076 -10.110 -6.683 1.00 0.19 C ATOM 276 CD GLN A 18 15.927 -10.198 -7.659 1.00 0.39 C ATOM 277 OE1 GLN A 18 16.002 -9.689 -8.777 1.00 1.02 O ATOM 278 NE2 GLN A 18 14.857 -10.858 -7.243 1.00 0.42 N ATOM 0 H GLN A 18 18.445 -10.901 -4.424 1.00 0.17 H new ATOM 0 HA GLN A 18 20.027 -11.884 -6.541 1.00 0.18 H new ATOM 0 HB2 GLN A 18 18.053 -11.624 -7.814 1.00 0.23 H new ATOM 0 HB3 GLN A 18 17.567 -12.124 -6.207 1.00 0.23 H new ATOM 0 HG2 GLN A 18 16.683 -10.035 -5.669 1.00 0.19 H new ATOM 0 HG3 GLN A 18 17.643 -9.199 -6.874 1.00 0.19 H new ATOM 0 HE21 GLN A 18 14.840 -11.263 -6.307 1.00 0.42 H new ATOM 0 HE22 GLN A 18 14.050 -10.961 -7.858 1.00 0.42 H new ATOM 287 N PHE A 19 20.152 -8.740 -6.130 1.00 0.12 N ATOM 288 CA PHE A 19 20.759 -7.503 -6.600 1.00 0.15 C ATOM 289 C PHE A 19 22.237 -7.453 -6.215 1.00 0.18 C ATOM 290 O PHE A 19 23.056 -6.891 -6.942 1.00 0.26 O ATOM 291 CB PHE A 19 20.021 -6.291 -6.027 1.00 0.16 C ATOM 292 CG PHE A 19 18.903 -5.798 -6.905 1.00 0.18 C ATOM 293 CD1 PHE A 19 17.822 -6.615 -7.192 1.00 0.26 C ATOM 294 CD2 PHE A 19 18.927 -4.519 -7.437 1.00 0.23 C ATOM 295 CE1 PHE A 19 16.789 -6.166 -7.992 1.00 0.28 C ATOM 296 CE2 PHE A 19 17.897 -4.064 -8.234 1.00 0.25 C ATOM 297 CZ PHE A 19 16.850 -4.889 -8.542 1.00 0.24 C ATOM 0 H PHE A 19 19.841 -8.712 -5.159 1.00 0.12 H new ATOM 0 HA PHE A 19 20.681 -7.474 -7.687 1.00 0.15 H new ATOM 0 HB2 PHE A 19 19.616 -6.551 -5.049 1.00 0.16 H new ATOM 0 HB3 PHE A 19 20.734 -5.481 -5.872 1.00 0.16 H new ATOM 0 HD1 PHE A 19 17.786 -7.615 -6.786 1.00 0.26 H new ATOM 0 HD2 PHE A 19 19.763 -3.869 -7.225 1.00 0.23 H new ATOM 0 HE1 PHE A 19 15.939 -6.802 -8.189 1.00 0.28 H new ATOM 0 HE2 PHE A 19 17.917 -3.054 -8.616 1.00 0.25 H new ATOM 0 HZ PHE A 19 16.072 -4.550 -9.211 1.00 0.24 H new ATOM 307 N ASP A 20 22.572 -8.046 -5.067 1.00 0.15 N ATOM 308 CA ASP A 20 23.954 -8.063 -4.594 1.00 0.19 C ATOM 309 C ASP A 20 24.700 -9.318 -5.046 1.00 0.27 C ATOM 310 O ASP A 20 25.398 -9.302 -6.059 1.00 0.37 O ATOM 311 CB ASP A 20 24.004 -7.967 -3.068 1.00 0.20 C ATOM 312 CG ASP A 20 25.383 -8.282 -2.525 1.00 0.29 C ATOM 313 OD1 ASP A 20 26.353 -7.620 -2.949 1.00 0.34 O ATOM 314 OD2 ASP A 20 25.489 -9.183 -1.668 1.00 0.40 O ATOM 0 H ASP A 20 21.908 -8.517 -4.452 1.00 0.15 H new ATOM 0 HA ASP A 20 24.448 -7.196 -5.033 1.00 0.19 H new ATOM 0 HB2 ASP A 20 23.713 -6.963 -2.758 1.00 0.20 H new ATOM 0 HB3 ASP A 20 23.278 -8.657 -2.637 1.00 0.20 H new ATOM 319 N LYS A 21 24.523 -10.406 -4.295 1.00 0.35 N ATOM 320 CA LYS A 21 25.195 -11.673 -4.579 1.00 0.45 C ATOM 321 C LYS A 21 26.659 -11.456 -4.960 1.00 0.46 C ATOM 322 O LYS A 21 27.071 -11.737 -6.086 1.00 0.84 O ATOM 323 CB LYS A 21 24.468 -12.444 -5.683 1.00 0.53 C ATOM 324 CG LYS A 21 23.250 -13.215 -5.193 1.00 0.61 C ATOM 325 CD LYS A 21 23.638 -14.328 -4.232 1.00 0.69 C ATOM 326 CE LYS A 21 22.414 -15.071 -3.723 1.00 0.83 C ATOM 327 NZ LYS A 21 21.660 -15.724 -4.830 1.00 1.65 N ATOM 0 H LYS A 21 23.913 -10.433 -3.478 1.00 0.35 H new ATOM 0 HA LYS A 21 25.168 -12.267 -3.665 1.00 0.45 H new ATOM 0 HB2 LYS A 21 24.156 -11.744 -6.458 1.00 0.53 H new ATOM 0 HB3 LYS A 21 25.166 -13.141 -6.146 1.00 0.53 H new ATOM 0 HG2 LYS A 21 22.561 -12.531 -4.698 1.00 0.61 H new ATOM 0 HG3 LYS A 21 22.720 -13.639 -6.046 1.00 0.61 H new ATOM 0 HD2 LYS A 21 24.308 -15.027 -4.733 1.00 0.69 H new ATOM 0 HD3 LYS A 21 24.188 -13.908 -3.389 1.00 0.69 H new ATOM 0 HE2 LYS A 21 22.722 -15.826 -2.999 1.00 0.83 H new ATOM 0 HE3 LYS A 21 21.759 -14.375 -3.199 1.00 0.83 H new ATOM 0 HZ1 LYS A 21 20.971 -16.394 -4.433 1.00 1.65 H new ATOM 0 HZ2 LYS A 21 21.160 -15.000 -5.384 1.00 1.65 H new ATOM 0 HZ3 LYS A 21 22.323 -16.235 -5.447 1.00 1.65 H new ATOM 341 N GLU A 22 27.438 -10.955 -4.003 1.00 0.42 N ATOM 342 CA GLU A 22 28.865 -10.706 -4.212 1.00 0.47 C ATOM 343 C GLU A 22 29.644 -10.871 -2.909 1.00 0.45 C ATOM 344 O GLU A 22 30.870 -10.767 -2.893 1.00 0.53 O ATOM 345 CB GLU A 22 29.103 -9.300 -4.773 1.00 0.46 C ATOM 346 CG GLU A 22 28.570 -9.103 -6.183 1.00 0.66 C ATOM 347 CD GLU A 22 28.794 -7.695 -6.699 1.00 1.52 C ATOM 348 OE1 GLU A 22 27.947 -6.821 -6.423 1.00 2.47 O ATOM 349 OE2 GLU A 22 29.818 -7.467 -7.377 1.00 1.49 O ATOM 0 H GLU A 22 27.104 -10.712 -3.070 1.00 0.42 H new ATOM 0 HA GLU A 22 29.220 -11.440 -4.935 1.00 0.47 H new ATOM 0 HB2 GLU A 22 28.634 -8.571 -4.112 1.00 0.46 H new ATOM 0 HB3 GLU A 22 30.173 -9.093 -4.767 1.00 0.46 H new ATOM 0 HG2 GLU A 22 29.054 -9.813 -6.853 1.00 0.66 H new ATOM 0 HG3 GLU A 22 27.503 -9.327 -6.199 1.00 0.66 H new ATOM 356 N GLY A 23 28.927 -11.128 -1.819 1.00 0.48 N ATOM 357 CA GLY A 23 29.574 -11.299 -0.530 1.00 0.51 C ATOM 358 C GLY A 23 29.458 -10.062 0.337 1.00 0.45 C ATOM 359 O GLY A 23 30.088 -9.971 1.391 1.00 0.72 O ATOM 0 H GLY A 23 27.911 -11.221 -1.805 1.00 0.48 H new ATOM 0 HA2 GLY A 23 29.128 -12.147 -0.011 1.00 0.51 H new ATOM 0 HA3 GLY A 23 30.627 -11.536 -0.682 1.00 0.51 H new ATOM 363 N THR A 24 28.648 -9.108 -0.112 1.00 0.33 N ATOM 364 CA THR A 24 28.437 -7.864 0.619 1.00 0.33 C ATOM 365 C THR A 24 26.976 -7.437 0.525 1.00 0.27 C ATOM 366 O THR A 24 26.550 -6.899 -0.491 1.00 0.25 O ATOM 367 CB THR A 24 29.334 -6.728 0.078 1.00 0.43 C ATOM 368 OG1 THR A 24 28.866 -6.301 -1.207 1.00 0.52 O ATOM 369 CG2 THR A 24 30.778 -7.186 -0.041 1.00 0.44 C ATOM 0 H THR A 24 28.124 -9.174 -0.985 1.00 0.33 H new ATOM 0 HA THR A 24 28.702 -8.049 1.660 1.00 0.33 H new ATOM 0 HB THR A 24 29.285 -5.897 0.782 1.00 0.43 H new ATOM 0 HG1 THR A 24 27.944 -5.978 -1.129 1.00 0.52 H new ATOM 0 HG21 THR A 24 31.389 -6.368 -0.424 1.00 0.44 H new ATOM 0 HG22 THR A 24 31.147 -7.486 0.940 1.00 0.44 H new ATOM 0 HG23 THR A 24 30.836 -8.033 -0.725 1.00 0.44 H new ATOM 377 N GLY A 25 26.214 -7.690 1.587 1.00 0.27 N ATOM 378 CA GLY A 25 24.802 -7.339 1.596 1.00 0.24 C ATOM 379 C GLY A 25 24.543 -5.846 1.629 1.00 0.20 C ATOM 380 O GLY A 25 23.985 -5.332 2.597 1.00 0.21 O ATOM 0 H GLY A 25 26.549 -8.132 2.443 1.00 0.27 H new ATOM 0 HA2 GLY A 25 24.327 -7.761 0.711 1.00 0.24 H new ATOM 0 HA3 GLY A 25 24.328 -7.800 2.463 1.00 0.24 H new ATOM 384 N LYS A 26 24.942 -5.153 0.572 1.00 0.16 N ATOM 385 CA LYS A 26 24.732 -3.719 0.471 1.00 0.14 C ATOM 386 C LYS A 26 24.580 -3.312 -0.985 1.00 0.14 C ATOM 387 O LYS A 26 25.518 -3.421 -1.776 1.00 0.17 O ATOM 388 CB LYS A 26 25.877 -2.939 1.120 1.00 0.17 C ATOM 389 CG LYS A 26 25.972 -3.129 2.625 1.00 0.37 C ATOM 390 CD LYS A 26 27.139 -2.356 3.216 1.00 0.50 C ATOM 391 CE LYS A 26 28.472 -2.931 2.774 1.00 0.56 C ATOM 392 NZ LYS A 26 29.619 -2.236 3.421 1.00 1.37 N ATOM 0 H LYS A 26 25.416 -5.565 -0.232 1.00 0.16 H new ATOM 0 HA LYS A 26 23.815 -3.477 1.008 1.00 0.14 H new ATOM 0 HB2 LYS A 26 26.818 -3.246 0.664 1.00 0.17 H new ATOM 0 HB3 LYS A 26 25.750 -1.878 0.904 1.00 0.17 H new ATOM 0 HG2 LYS A 26 25.044 -2.801 3.093 1.00 0.37 H new ATOM 0 HG3 LYS A 26 26.085 -4.189 2.852 1.00 0.37 H new ATOM 0 HD2 LYS A 26 27.075 -1.311 2.913 1.00 0.50 H new ATOM 0 HD3 LYS A 26 27.076 -2.377 4.304 1.00 0.50 H new ATOM 0 HE2 LYS A 26 28.507 -3.993 3.017 1.00 0.56 H new ATOM 0 HE3 LYS A 26 28.562 -2.848 1.691 1.00 0.56 H new ATOM 0 HZ1 LYS A 26 30.511 -2.658 3.093 1.00 1.37 H new ATOM 0 HZ2 LYS A 26 29.600 -1.227 3.169 1.00 1.37 H new ATOM 0 HZ3 LYS A 26 29.548 -2.336 4.454 1.00 1.37 H new ATOM 406 N ILE A 27 23.388 -2.850 -1.332 1.00 0.16 N ATOM 407 CA ILE A 27 23.097 -2.427 -2.701 1.00 0.19 C ATOM 408 C ILE A 27 23.177 -0.913 -2.840 1.00 0.19 C ATOM 409 O ILE A 27 22.912 -0.181 -1.893 1.00 0.22 O ATOM 410 CB ILE A 27 21.703 -2.888 -3.154 1.00 0.23 C ATOM 411 CG1 ILE A 27 20.733 -2.874 -1.977 1.00 0.28 C ATOM 412 CG2 ILE A 27 21.776 -4.274 -3.776 1.00 0.32 C ATOM 413 CD1 ILE A 27 19.285 -2.723 -2.384 1.00 0.34 C ATOM 0 H ILE A 27 22.604 -2.757 -0.687 1.00 0.16 H new ATOM 0 HA ILE A 27 23.852 -2.893 -3.334 1.00 0.19 H new ATOM 0 HB ILE A 27 21.336 -2.195 -3.911 1.00 0.23 H new ATOM 0 HG12 ILE A 27 20.848 -3.799 -1.412 1.00 0.28 H new ATOM 0 HG13 ILE A 27 21.000 -2.056 -1.307 1.00 0.28 H new ATOM 0 HG21 ILE A 27 20.780 -4.584 -4.091 1.00 0.32 H new ATOM 0 HG22 ILE A 27 22.439 -4.250 -4.641 1.00 0.32 H new ATOM 0 HG23 ILE A 27 22.162 -4.982 -3.043 1.00 0.32 H new ATOM 0 HD11 ILE A 27 18.655 -2.721 -1.494 1.00 0.34 H new ATOM 0 HD12 ILE A 27 19.154 -1.784 -2.923 1.00 0.34 H new ATOM 0 HD13 ILE A 27 19.000 -3.554 -3.029 1.00 0.34 H new ATOM 425 N ALA A 28 23.512 -0.450 -4.039 1.00 0.19 N ATOM 426 CA ALA A 28 23.632 0.977 -4.302 1.00 0.21 C ATOM 427 C ALA A 28 22.276 1.666 -4.214 1.00 0.20 C ATOM 428 O ALA A 28 21.309 1.239 -4.843 1.00 0.20 O ATOM 429 CB ALA A 28 24.257 1.212 -5.669 1.00 0.23 C ATOM 0 H ALA A 28 23.705 -1.044 -4.845 1.00 0.19 H new ATOM 0 HA ALA A 28 24.281 1.408 -3.540 1.00 0.21 H new ATOM 0 HB1 ALA A 28 24.340 2.283 -5.852 1.00 0.23 H new ATOM 0 HB2 ALA A 28 25.249 0.761 -5.698 1.00 0.23 H new ATOM 0 HB3 ALA A 28 23.630 0.760 -6.438 1.00 0.23 H new ATOM 435 N THR A 29 22.216 2.727 -3.411 1.00 0.21 N ATOM 436 CA THR A 29 20.988 3.494 -3.229 1.00 0.22 C ATOM 437 C THR A 29 20.460 4.016 -4.560 1.00 0.22 C ATOM 438 O THR A 29 19.269 4.292 -4.701 1.00 0.22 O ATOM 439 CB THR A 29 21.213 4.685 -2.278 1.00 0.26 C ATOM 440 OG1 THR A 29 22.059 5.659 -2.902 1.00 0.28 O ATOM 441 CG2 THR A 29 21.843 4.222 -0.974 1.00 0.28 C ATOM 0 H THR A 29 23.010 3.076 -2.874 1.00 0.21 H new ATOM 0 HA THR A 29 20.253 2.818 -2.793 1.00 0.22 H new ATOM 0 HB THR A 29 20.244 5.134 -2.058 1.00 0.26 H new ATOM 0 HG1 THR A 29 22.686 6.019 -2.241 1.00 0.28 H new ATOM 0 HG21 THR A 29 21.993 5.079 -0.318 1.00 0.28 H new ATOM 0 HG22 THR A 29 21.184 3.503 -0.487 1.00 0.28 H new ATOM 0 HG23 THR A 29 22.804 3.751 -1.181 1.00 0.28 H new ATOM 449 N ARG A 30 21.357 4.157 -5.534 1.00 0.23 N ATOM 450 CA ARG A 30 20.980 4.635 -6.860 1.00 0.25 C ATOM 451 C ARG A 30 20.033 3.642 -7.523 1.00 0.26 C ATOM 452 O ARG A 30 19.400 3.941 -8.537 1.00 0.43 O ATOM 453 CB ARG A 30 22.228 4.834 -7.726 1.00 0.29 C ATOM 454 CG ARG A 30 21.948 5.508 -9.060 1.00 1.36 C ATOM 455 CD ARG A 30 23.202 5.593 -9.914 1.00 1.46 C ATOM 456 NE ARG A 30 24.281 6.304 -9.233 1.00 1.85 N ATOM 457 CZ ARG A 30 25.416 6.662 -9.825 1.00 2.23 C ATOM 458 NH1 ARG A 30 25.621 6.380 -11.104 1.00 2.10 N ATOM 459 NH2 ARG A 30 26.350 7.303 -9.137 1.00 3.19 N ATOM 0 H ARG A 30 22.350 3.947 -5.429 1.00 0.23 H new ATOM 0 HA ARG A 30 20.471 5.593 -6.757 1.00 0.25 H new ATOM 0 HB2 ARG A 30 22.952 5.432 -7.172 1.00 0.29 H new ATOM 0 HB3 ARG A 30 22.690 3.864 -7.909 1.00 0.29 H new ATOM 0 HG2 ARG A 30 21.179 4.952 -9.596 1.00 1.36 H new ATOM 0 HG3 ARG A 30 21.555 6.510 -8.887 1.00 1.36 H new ATOM 0 HD2 ARG A 30 23.535 4.587 -10.170 1.00 1.46 H new ATOM 0 HD3 ARG A 30 22.969 6.099 -10.851 1.00 1.46 H new ATOM 0 HE ARG A 30 24.157 6.539 -8.248 1.00 1.85 H new ATOM 0 HH11 ARG A 30 24.906 5.886 -11.638 1.00 2.10 H new ATOM 0 HH12 ARG A 30 26.494 6.657 -11.554 1.00 2.10 H new ATOM 0 HH21 ARG A 30 26.198 7.522 -8.152 1.00 3.19 H new ATOM 0 HH22 ARG A 30 27.221 7.577 -9.592 1.00 3.19 H new ATOM 473 N GLU A 31 19.945 2.457 -6.930 1.00 0.17 N ATOM 474 CA GLU A 31 19.084 1.397 -7.433 1.00 0.18 C ATOM 475 C GLU A 31 18.079 0.982 -6.358 1.00 0.16 C ATOM 476 O GLU A 31 17.675 -0.177 -6.274 1.00 0.18 O ATOM 477 CB GLU A 31 19.936 0.200 -7.864 1.00 0.20 C ATOM 478 CG GLU A 31 19.193 -0.801 -8.732 1.00 0.26 C ATOM 479 CD GLU A 31 20.128 -1.755 -9.450 1.00 0.29 C ATOM 480 OE1 GLU A 31 20.803 -2.551 -8.764 1.00 0.28 O ATOM 481 OE2 GLU A 31 20.180 -1.711 -10.696 1.00 0.44 O ATOM 0 H GLU A 31 20.467 2.206 -6.090 1.00 0.17 H new ATOM 0 HA GLU A 31 18.531 1.763 -8.298 1.00 0.18 H new ATOM 0 HB2 GLU A 31 20.807 0.564 -8.409 1.00 0.20 H new ATOM 0 HB3 GLU A 31 20.307 -0.309 -6.974 1.00 0.20 H new ATOM 0 HG2 GLU A 31 18.502 -1.372 -8.112 1.00 0.26 H new ATOM 0 HG3 GLU A 31 18.592 -0.265 -9.467 1.00 0.26 H new ATOM 488 N LEU A 32 17.684 1.953 -5.538 1.00 0.17 N ATOM 489 CA LEU A 32 16.735 1.720 -4.452 1.00 0.19 C ATOM 490 C LEU A 32 15.300 1.652 -4.970 1.00 0.18 C ATOM 491 O LEU A 32 14.558 0.713 -4.660 1.00 0.17 O ATOM 492 CB LEU A 32 16.846 2.839 -3.415 1.00 0.24 C ATOM 493 CG LEU A 32 15.921 2.698 -2.210 1.00 0.29 C ATOM 494 CD1 LEU A 32 16.431 1.615 -1.278 1.00 0.39 C ATOM 495 CD2 LEU A 32 15.793 4.021 -1.474 1.00 0.38 C ATOM 0 H LEU A 32 18.010 2.917 -5.606 1.00 0.17 H new ATOM 0 HA LEU A 32 16.981 0.762 -3.994 1.00 0.19 H new ATOM 0 HB2 LEU A 32 17.876 2.884 -3.060 1.00 0.24 H new ATOM 0 HB3 LEU A 32 16.636 3.790 -3.905 1.00 0.24 H new ATOM 0 HG LEU A 32 14.932 2.411 -2.566 1.00 0.29 H new ATOM 0 HD11 LEU A 32 15.761 1.526 -0.423 1.00 0.39 H new ATOM 0 HD12 LEU A 32 16.468 0.665 -1.810 1.00 0.39 H new ATOM 0 HD13 LEU A 32 17.431 1.875 -0.930 1.00 0.39 H new ATOM 0 HD21 LEU A 32 15.129 3.899 -0.618 1.00 0.38 H new ATOM 0 HD22 LEU A 32 16.776 4.341 -1.128 1.00 0.38 H new ATOM 0 HD23 LEU A 32 15.382 4.774 -2.147 1.00 0.38 H new ATOM 507 N GLY A 33 14.916 2.664 -5.743 1.00 0.22 N ATOM 508 CA GLY A 33 13.574 2.722 -6.297 1.00 0.23 C ATOM 509 C GLY A 33 13.126 1.398 -6.882 1.00 0.20 C ATOM 510 O GLY A 33 11.952 1.044 -6.803 1.00 0.19 O ATOM 0 H GLY A 33 15.515 3.450 -5.997 1.00 0.22 H new ATOM 0 HA2 GLY A 33 12.876 3.025 -5.517 1.00 0.23 H new ATOM 0 HA3 GLY A 33 13.538 3.488 -7.072 1.00 0.23 H new ATOM 514 N THR A 34 14.066 0.664 -7.466 1.00 0.19 N ATOM 515 CA THR A 34 13.762 -0.624 -8.075 1.00 0.18 C ATOM 516 C THR A 34 13.116 -1.585 -7.079 1.00 0.16 C ATOM 517 O THR A 34 12.045 -2.131 -7.343 1.00 0.17 O ATOM 518 CB THR A 34 15.027 -1.282 -8.654 1.00 0.21 C ATOM 519 OG1 THR A 34 15.784 -0.320 -9.399 1.00 0.26 O ATOM 520 CG2 THR A 34 14.658 -2.448 -9.559 1.00 0.23 C ATOM 0 H THR A 34 15.046 0.940 -7.530 1.00 0.19 H new ATOM 0 HA THR A 34 13.056 -0.424 -8.881 1.00 0.18 H new ATOM 0 HB THR A 34 15.629 -1.655 -7.825 1.00 0.21 H new ATOM 0 HG1 THR A 34 16.497 -0.776 -9.892 1.00 0.26 H new ATOM 0 HG21 THR A 34 15.566 -2.900 -9.959 1.00 0.23 H new ATOM 0 HG22 THR A 34 14.104 -3.192 -8.986 1.00 0.23 H new ATOM 0 HG23 THR A 34 14.039 -2.089 -10.381 1.00 0.23 H new ATOM 528 N LEU A 35 13.769 -1.791 -5.936 1.00 0.13 N ATOM 529 CA LEU A 35 13.246 -2.700 -4.918 1.00 0.12 C ATOM 530 C LEU A 35 11.914 -2.240 -4.352 1.00 0.14 C ATOM 531 O LEU A 35 10.937 -2.983 -4.408 1.00 0.15 O ATOM 532 CB LEU A 35 14.250 -2.889 -3.779 1.00 0.13 C ATOM 533 CG LEU A 35 15.192 -4.084 -3.942 1.00 0.14 C ATOM 534 CD1 LEU A 35 15.820 -4.093 -5.322 1.00 0.18 C ATOM 535 CD2 LEU A 35 16.263 -4.066 -2.865 1.00 0.20 C ATOM 0 H LEU A 35 14.654 -1.345 -5.693 1.00 0.13 H new ATOM 0 HA LEU A 35 13.083 -3.654 -5.419 1.00 0.12 H new ATOM 0 HB2 LEU A 35 14.849 -1.983 -3.688 1.00 0.13 H new ATOM 0 HB3 LEU A 35 13.700 -3.003 -2.845 1.00 0.13 H new ATOM 0 HG LEU A 35 14.607 -4.997 -3.832 1.00 0.14 H new ATOM 0 HD11 LEU A 35 16.485 -4.952 -5.413 1.00 0.18 H new ATOM 0 HD12 LEU A 35 15.037 -4.158 -6.078 1.00 0.18 H new ATOM 0 HD13 LEU A 35 16.390 -3.175 -5.468 1.00 0.18 H new ATOM 0 HD21 LEU A 35 16.924 -4.922 -2.995 1.00 0.20 H new ATOM 0 HD22 LEU A 35 16.842 -3.146 -2.943 1.00 0.20 H new ATOM 0 HD23 LEU A 35 15.792 -4.117 -1.883 1.00 0.20 H new ATOM 547 N MET A 36 11.858 -1.021 -3.819 1.00 0.17 N ATOM 548 CA MET A 36 10.609 -0.530 -3.243 1.00 0.21 C ATOM 549 C MET A 36 9.461 -0.704 -4.227 1.00 0.23 C ATOM 550 O MET A 36 8.334 -0.997 -3.826 1.00 0.26 O ATOM 551 CB MET A 36 10.724 0.926 -2.781 1.00 0.25 C ATOM 552 CG MET A 36 11.690 1.770 -3.588 1.00 0.21 C ATOM 553 SD MET A 36 12.467 3.069 -2.600 1.00 0.30 S ATOM 554 CE MET A 36 11.087 3.634 -1.602 1.00 0.73 C ATOM 0 H MET A 36 12.642 -0.370 -3.774 1.00 0.17 H new ATOM 0 HA MET A 36 10.398 -1.129 -2.357 1.00 0.21 H new ATOM 0 HB2 MET A 36 9.737 1.386 -2.824 1.00 0.25 H new ATOM 0 HB3 MET A 36 11.036 0.938 -1.737 1.00 0.25 H new ATOM 0 HG2 MET A 36 12.463 1.128 -4.010 1.00 0.21 H new ATOM 0 HG3 MET A 36 11.159 2.223 -4.425 1.00 0.21 H new ATOM 0 HE1 MET A 36 11.277 4.652 -1.261 1.00 0.73 H new ATOM 0 HE2 MET A 36 10.175 3.615 -2.199 1.00 0.73 H new ATOM 0 HE3 MET A 36 10.970 2.978 -0.739 1.00 0.73 H new ATOM 564 N ARG A 37 9.745 -0.539 -5.517 1.00 0.23 N ATOM 565 CA ARG A 37 8.719 -0.724 -6.535 1.00 0.27 C ATOM 566 C ARG A 37 8.295 -2.185 -6.537 1.00 0.25 C ATOM 567 O ARG A 37 7.107 -2.503 -6.545 1.00 0.28 O ATOM 568 CB ARG A 37 9.232 -0.316 -7.917 1.00 0.31 C ATOM 569 CG ARG A 37 9.294 1.189 -8.123 1.00 0.37 C ATOM 570 CD ARG A 37 9.838 1.541 -9.499 1.00 0.43 C ATOM 571 NE ARG A 37 9.818 2.980 -9.743 1.00 0.53 N ATOM 572 CZ ARG A 37 10.144 3.535 -10.907 1.00 0.71 C ATOM 573 NH1 ARG A 37 10.517 2.774 -11.927 1.00 0.94 N ATOM 574 NH2 ARG A 37 10.097 4.853 -11.051 1.00 0.79 N ATOM 0 H ARG A 37 10.664 -0.281 -5.877 1.00 0.23 H new ATOM 0 HA ARG A 37 7.865 -0.088 -6.303 1.00 0.27 H new ATOM 0 HB2 ARG A 37 10.227 -0.736 -8.065 1.00 0.31 H new ATOM 0 HB3 ARG A 37 8.586 -0.752 -8.679 1.00 0.31 H new ATOM 0 HG2 ARG A 37 8.298 1.615 -8.005 1.00 0.37 H new ATOM 0 HG3 ARG A 37 9.925 1.637 -7.355 1.00 0.37 H new ATOM 0 HD2 ARG A 37 10.860 1.172 -9.590 1.00 0.43 H new ATOM 0 HD3 ARG A 37 9.247 1.035 -10.263 1.00 0.43 H new ATOM 0 HE ARG A 37 9.538 3.594 -8.978 1.00 0.53 H new ATOM 0 HH11 ARG A 37 10.554 1.760 -11.820 1.00 0.94 H new ATOM 0 HH12 ARG A 37 10.766 3.202 -12.818 1.00 0.94 H new ATOM 0 HH21 ARG A 37 9.811 5.442 -10.269 1.00 0.79 H new ATOM 0 HH22 ARG A 37 10.347 5.278 -11.944 1.00 0.79 H new ATOM 588 N THR A 38 9.292 -3.068 -6.550 1.00 0.24 N ATOM 589 CA THR A 38 9.057 -4.504 -6.503 1.00 0.29 C ATOM 590 C THR A 38 8.335 -4.864 -5.207 1.00 0.26 C ATOM 591 O THR A 38 7.680 -5.903 -5.105 1.00 0.32 O ATOM 592 CB THR A 38 10.390 -5.278 -6.573 1.00 0.38 C ATOM 593 OG1 THR A 38 11.164 -4.816 -7.687 1.00 1.07 O ATOM 594 CG2 THR A 38 10.155 -6.776 -6.708 1.00 0.67 C ATOM 0 H THR A 38 10.277 -2.808 -6.593 1.00 0.24 H new ATOM 0 HA THR A 38 8.443 -4.781 -7.360 1.00 0.29 H new ATOM 0 HB THR A 38 10.931 -5.097 -5.644 1.00 0.38 H new ATOM 0 HG1 THR A 38 11.551 -3.941 -7.476 1.00 1.07 H new ATOM 0 HG21 THR A 38 11.114 -7.292 -6.755 1.00 0.67 H new ATOM 0 HG22 THR A 38 9.591 -7.135 -5.847 1.00 0.67 H new ATOM 0 HG23 THR A 38 9.591 -6.975 -7.619 1.00 0.67 H new ATOM 602 N LEU A 39 8.468 -3.979 -4.219 1.00 0.21 N ATOM 603 CA LEU A 39 7.845 -4.157 -2.913 1.00 0.26 C ATOM 604 C LEU A 39 6.427 -3.594 -2.903 1.00 0.33 C ATOM 605 O LEU A 39 5.748 -3.615 -1.877 1.00 0.83 O ATOM 606 CB LEU A 39 8.682 -3.469 -1.828 1.00 0.24 C ATOM 607 CG LEU A 39 9.761 -4.335 -1.174 1.00 0.25 C ATOM 608 CD1 LEU A 39 10.758 -4.841 -2.204 1.00 0.29 C ATOM 609 CD2 LEU A 39 10.473 -3.540 -0.091 1.00 0.41 C ATOM 0 H LEU A 39 9.011 -3.120 -4.304 1.00 0.21 H new ATOM 0 HA LEU A 39 7.795 -5.226 -2.706 1.00 0.26 H new ATOM 0 HB2 LEU A 39 9.161 -2.593 -2.265 1.00 0.24 H new ATOM 0 HB3 LEU A 39 8.009 -3.109 -1.049 1.00 0.24 H new ATOM 0 HG LEU A 39 9.280 -5.203 -0.723 1.00 0.25 H new ATOM 0 HD11 LEU A 39 11.513 -5.453 -1.710 1.00 0.29 H new ATOM 0 HD12 LEU A 39 10.237 -5.440 -2.951 1.00 0.29 H new ATOM 0 HD13 LEU A 39 11.240 -3.993 -2.691 1.00 0.29 H new ATOM 0 HD21 LEU A 39 11.240 -4.161 0.371 1.00 0.41 H new ATOM 0 HD22 LEU A 39 10.937 -2.658 -0.533 1.00 0.41 H new ATOM 0 HD23 LEU A 39 9.752 -3.230 0.666 1.00 0.41 H new ATOM 621 N GLY A 40 5.989 -3.092 -4.052 1.00 0.48 N ATOM 622 CA GLY A 40 4.654 -2.531 -4.159 1.00 0.54 C ATOM 623 C GLY A 40 4.595 -1.051 -3.827 1.00 0.44 C ATOM 624 O GLY A 40 3.647 -0.363 -4.208 1.00 0.56 O ATOM 0 H GLY A 40 6.535 -3.063 -4.913 1.00 0.48 H new ATOM 0 HA2 GLY A 40 4.284 -2.684 -5.173 1.00 0.54 H new ATOM 0 HA3 GLY A 40 3.985 -3.073 -3.490 1.00 0.54 H new ATOM 628 N GLN A 41 5.606 -0.558 -3.117 1.00 0.41 N ATOM 629 CA GLN A 41 5.657 0.852 -2.741 1.00 0.37 C ATOM 630 C GLN A 41 6.477 1.653 -3.748 1.00 0.29 C ATOM 631 O GLN A 41 7.685 1.461 -3.871 1.00 0.35 O ATOM 632 CB GLN A 41 6.255 1.012 -1.340 1.00 0.47 C ATOM 633 CG GLN A 41 5.339 0.532 -0.223 1.00 0.66 C ATOM 634 CD GLN A 41 5.038 -0.951 -0.307 1.00 0.90 C ATOM 635 OE1 GLN A 41 4.061 -1.363 -0.932 1.00 1.79 O ATOM 636 NE2 GLN A 41 5.879 -1.763 0.322 1.00 0.85 N ATOM 0 H GLN A 41 6.398 -1.111 -2.791 1.00 0.41 H new ATOM 0 HA GLN A 41 4.637 1.236 -2.738 1.00 0.37 H new ATOM 0 HB2 GLN A 41 7.193 0.460 -1.290 1.00 0.47 H new ATOM 0 HB3 GLN A 41 6.494 2.063 -1.175 1.00 0.47 H new ATOM 0 HG2 GLN A 41 5.802 0.750 0.739 1.00 0.66 H new ATOM 0 HG3 GLN A 41 4.404 1.091 -0.261 1.00 0.66 H new ATOM 0 HE21 GLN A 41 6.677 -1.378 0.828 1.00 0.85 H new ATOM 0 HE22 GLN A 41 5.728 -2.771 0.299 1.00 0.85 H new ATOM 645 N ASN A 42 5.815 2.560 -4.457 1.00 0.34 N ATOM 646 CA ASN A 42 6.487 3.380 -5.455 1.00 0.29 C ATOM 647 C ASN A 42 6.870 4.744 -4.876 1.00 0.31 C ATOM 648 O ASN A 42 6.000 5.555 -4.556 1.00 0.36 O ATOM 649 CB ASN A 42 5.582 3.573 -6.674 1.00 0.34 C ATOM 650 CG ASN A 42 5.458 2.317 -7.519 1.00 0.43 C ATOM 651 OD1 ASN A 42 5.283 2.391 -8.735 1.00 1.03 O ATOM 652 ND2 ASN A 42 5.547 1.155 -6.880 1.00 0.96 N ATOM 0 H ASN A 42 4.817 2.745 -4.359 1.00 0.34 H new ATOM 0 HA ASN A 42 7.398 2.864 -5.758 1.00 0.29 H new ATOM 0 HB2 ASN A 42 4.591 3.880 -6.340 1.00 0.34 H new ATOM 0 HB3 ASN A 42 5.976 4.382 -7.289 1.00 0.34 H new ATOM 0 HD21 ASN A 42 5.470 0.280 -7.399 1.00 0.96 H new ATOM 0 HD22 ASN A 42 5.692 1.138 -5.871 1.00 0.96 H new ATOM 659 N PRO A 43 8.181 5.013 -4.733 1.00 0.30 N ATOM 660 CA PRO A 43 8.677 6.290 -4.204 1.00 0.35 C ATOM 661 C PRO A 43 8.577 7.419 -5.226 1.00 0.34 C ATOM 662 O PRO A 43 7.724 7.391 -6.114 1.00 0.52 O ATOM 663 CB PRO A 43 10.142 5.986 -3.893 1.00 0.40 C ATOM 664 CG PRO A 43 10.514 4.924 -4.866 1.00 0.35 C ATOM 665 CD PRO A 43 9.286 4.080 -5.040 1.00 0.27 C ATOM 0 HA PRO A 43 8.100 6.632 -3.345 1.00 0.35 H new ATOM 0 HB2 PRO A 43 10.766 6.872 -4.014 1.00 0.40 H new ATOM 0 HB3 PRO A 43 10.268 5.645 -2.865 1.00 0.40 H new ATOM 0 HG2 PRO A 43 10.829 5.357 -5.816 1.00 0.35 H new ATOM 0 HG3 PRO A 43 11.348 4.329 -4.495 1.00 0.35 H new ATOM 0 HD2 PRO A 43 9.209 3.687 -6.054 1.00 0.27 H new ATOM 0 HD3 PRO A 43 9.288 3.224 -4.365 1.00 0.27 H new ATOM 673 N THR A 44 9.456 8.410 -5.096 1.00 0.38 N ATOM 674 CA THR A 44 9.476 9.545 -6.010 1.00 0.38 C ATOM 675 C THR A 44 10.907 10.016 -6.244 1.00 0.34 C ATOM 676 O THR A 44 11.730 9.991 -5.330 1.00 0.33 O ATOM 677 CB THR A 44 8.634 10.726 -5.489 1.00 0.43 C ATOM 678 OG1 THR A 44 9.091 11.118 -4.189 1.00 0.43 O ATOM 679 CG2 THR A 44 7.159 10.357 -5.424 1.00 0.53 C ATOM 0 H THR A 44 10.165 8.448 -4.364 1.00 0.38 H new ATOM 0 HA THR A 44 9.039 9.202 -6.948 1.00 0.38 H new ATOM 0 HB THR A 44 8.752 11.559 -6.182 1.00 0.43 H new ATOM 0 HG1 THR A 44 8.552 11.870 -3.866 1.00 0.43 H new ATOM 0 HG21 THR A 44 6.587 11.208 -5.053 1.00 0.53 H new ATOM 0 HG22 THR A 44 6.807 10.089 -6.420 1.00 0.53 H new ATOM 0 HG23 THR A 44 7.025 9.509 -4.752 1.00 0.53 H new ATOM 687 N GLU A 45 11.195 10.436 -7.469 1.00 0.36 N ATOM 688 CA GLU A 45 12.532 10.894 -7.835 1.00 0.37 C ATOM 689 C GLU A 45 13.143 11.787 -6.754 1.00 0.33 C ATOM 690 O GLU A 45 14.304 11.614 -6.379 1.00 0.30 O ATOM 691 CB GLU A 45 12.473 11.649 -9.163 1.00 0.43 C ATOM 692 CG GLU A 45 13.825 11.796 -9.837 1.00 0.48 C ATOM 693 CD GLU A 45 13.752 12.603 -11.119 1.00 0.58 C ATOM 694 OE1 GLU A 45 13.323 12.042 -12.149 1.00 0.66 O ATOM 695 OE2 GLU A 45 14.123 13.795 -11.091 1.00 0.63 O ATOM 0 H GLU A 45 10.518 10.470 -8.231 1.00 0.36 H new ATOM 0 HA GLU A 45 13.170 10.016 -7.937 1.00 0.37 H new ATOM 0 HB2 GLU A 45 11.794 11.128 -9.838 1.00 0.43 H new ATOM 0 HB3 GLU A 45 12.053 12.640 -8.990 1.00 0.43 H new ATOM 0 HG2 GLU A 45 14.520 12.277 -9.148 1.00 0.48 H new ATOM 0 HG3 GLU A 45 14.227 10.807 -10.057 1.00 0.48 H new ATOM 702 N ALA A 46 12.346 12.717 -6.240 1.00 0.35 N ATOM 703 CA ALA A 46 12.808 13.655 -5.219 1.00 0.35 C ATOM 704 C ALA A 46 13.336 12.948 -3.970 1.00 0.32 C ATOM 705 O ALA A 46 14.462 13.197 -3.538 1.00 0.33 O ATOM 706 CB ALA A 46 11.687 14.613 -4.845 1.00 0.40 C ATOM 0 H ALA A 46 11.372 12.843 -6.514 1.00 0.35 H new ATOM 0 HA ALA A 46 13.641 14.213 -5.647 1.00 0.35 H new ATOM 0 HB1 ALA A 46 12.041 15.308 -4.084 1.00 0.40 H new ATOM 0 HB2 ALA A 46 11.375 15.170 -5.728 1.00 0.40 H new ATOM 0 HB3 ALA A 46 10.840 14.048 -4.455 1.00 0.40 H new ATOM 712 N GLU A 47 12.526 12.070 -3.390 1.00 0.30 N ATOM 713 CA GLU A 47 12.929 11.359 -2.181 1.00 0.30 C ATOM 714 C GLU A 47 14.141 10.467 -2.443 1.00 0.26 C ATOM 715 O GLU A 47 14.989 10.282 -1.571 1.00 0.26 O ATOM 716 CB GLU A 47 11.763 10.529 -1.626 1.00 0.33 C ATOM 717 CG GLU A 47 11.482 9.250 -2.397 1.00 0.37 C ATOM 718 CD GLU A 47 10.444 8.381 -1.715 1.00 0.88 C ATOM 719 OE1 GLU A 47 9.238 8.588 -1.967 1.00 1.43 O ATOM 720 OE2 GLU A 47 10.836 7.491 -0.929 1.00 1.15 O ATOM 0 H GLU A 47 11.595 11.834 -3.733 1.00 0.30 H new ATOM 0 HA GLU A 47 13.212 12.103 -1.436 1.00 0.30 H new ATOM 0 HB2 GLU A 47 11.976 10.274 -0.588 1.00 0.33 H new ATOM 0 HB3 GLU A 47 10.863 11.144 -1.625 1.00 0.33 H new ATOM 0 HG2 GLU A 47 11.139 9.502 -3.400 1.00 0.37 H new ATOM 0 HG3 GLU A 47 12.408 8.686 -2.509 1.00 0.37 H new ATOM 727 N LEU A 48 14.219 9.919 -3.649 1.00 0.24 N ATOM 728 CA LEU A 48 15.323 9.042 -4.018 1.00 0.22 C ATOM 729 C LEU A 48 16.662 9.777 -4.016 1.00 0.20 C ATOM 730 O LEU A 48 17.589 9.388 -3.311 1.00 0.19 O ATOM 731 CB LEU A 48 15.080 8.454 -5.409 1.00 0.25 C ATOM 732 CG LEU A 48 13.795 7.640 -5.558 1.00 0.27 C ATOM 733 CD1 LEU A 48 13.471 7.429 -7.029 1.00 0.31 C ATOM 734 CD2 LEU A 48 13.924 6.304 -4.841 1.00 0.29 C ATOM 0 H LEU A 48 13.531 10.066 -4.388 1.00 0.24 H new ATOM 0 HA LEU A 48 15.368 8.248 -3.273 1.00 0.22 H new ATOM 0 HB2 LEU A 48 15.060 9.270 -6.132 1.00 0.25 H new ATOM 0 HB3 LEU A 48 15.926 7.818 -5.670 1.00 0.25 H new ATOM 0 HG LEU A 48 12.977 8.196 -5.100 1.00 0.27 H new ATOM 0 HD11 LEU A 48 12.553 6.848 -7.120 1.00 0.31 H new ATOM 0 HD12 LEU A 48 13.338 8.396 -7.515 1.00 0.31 H new ATOM 0 HD13 LEU A 48 14.289 6.892 -7.508 1.00 0.31 H new ATOM 0 HD21 LEU A 48 13.000 5.738 -4.958 1.00 0.29 H new ATOM 0 HD22 LEU A 48 14.752 5.739 -5.270 1.00 0.29 H new ATOM 0 HD23 LEU A 48 14.113 6.476 -3.781 1.00 0.29 H new ATOM 746 N GLN A 49 16.750 10.850 -4.798 1.00 0.23 N ATOM 747 CA GLN A 49 17.988 11.617 -4.910 1.00 0.25 C ATOM 748 C GLN A 49 18.486 12.138 -3.563 1.00 0.25 C ATOM 749 O GLN A 49 19.693 12.174 -3.324 1.00 0.26 O ATOM 750 CB GLN A 49 17.803 12.777 -5.887 1.00 0.31 C ATOM 751 CG GLN A 49 16.837 13.844 -5.405 1.00 0.36 C ATOM 752 CD GLN A 49 15.949 14.368 -6.517 1.00 0.36 C ATOM 753 OE1 GLN A 49 15.537 15.528 -6.505 1.00 0.40 O ATOM 754 NE2 GLN A 49 15.646 13.509 -7.485 1.00 0.33 N ATOM 0 H GLN A 49 15.980 11.208 -5.363 1.00 0.23 H new ATOM 0 HA GLN A 49 18.750 10.935 -5.288 1.00 0.25 H new ATOM 0 HB2 GLN A 49 18.773 13.238 -6.075 1.00 0.31 H new ATOM 0 HB3 GLN A 49 17.447 12.383 -6.839 1.00 0.31 H new ATOM 0 HG2 GLN A 49 16.214 13.434 -4.610 1.00 0.36 H new ATOM 0 HG3 GLN A 49 17.400 14.672 -4.974 1.00 0.36 H new ATOM 0 HE21 GLN A 49 16.010 12.557 -7.454 1.00 0.33 H new ATOM 0 HE22 GLN A 49 15.049 13.802 -8.259 1.00 0.33 H new ATOM 763 N ASP A 50 17.575 12.547 -2.682 1.00 0.25 N ATOM 764 CA ASP A 50 17.986 13.067 -1.380 1.00 0.29 C ATOM 765 C ASP A 50 18.668 11.982 -0.544 1.00 0.27 C ATOM 766 O ASP A 50 19.775 12.185 -0.049 1.00 0.30 O ATOM 767 CB ASP A 50 16.797 13.682 -0.625 1.00 0.33 C ATOM 768 CG ASP A 50 16.052 12.693 0.253 1.00 0.33 C ATOM 769 OD1 ASP A 50 16.600 12.305 1.304 1.00 0.35 O ATOM 770 OD2 ASP A 50 14.928 12.295 -0.118 1.00 0.33 O ATOM 0 H ASP A 50 16.568 12.530 -2.841 1.00 0.25 H new ATOM 0 HA ASP A 50 18.713 13.860 -1.555 1.00 0.29 H new ATOM 0 HB2 ASP A 50 17.157 14.504 -0.006 1.00 0.33 H new ATOM 0 HB3 ASP A 50 16.101 14.108 -1.347 1.00 0.33 H new ATOM 775 N LEU A 51 18.010 10.833 -0.392 1.00 0.25 N ATOM 776 CA LEU A 51 18.570 9.730 0.382 1.00 0.27 C ATOM 777 C LEU A 51 19.786 9.127 -0.315 1.00 0.24 C ATOM 778 O LEU A 51 20.653 8.538 0.330 1.00 0.27 O ATOM 779 CB LEU A 51 17.503 8.655 0.626 1.00 0.30 C ATOM 780 CG LEU A 51 16.879 8.046 -0.632 1.00 0.29 C ATOM 781 CD1 LEU A 51 17.755 6.931 -1.177 1.00 0.30 C ATOM 782 CD2 LEU A 51 15.479 7.530 -0.335 1.00 0.35 C ATOM 0 H LEU A 51 17.092 10.644 -0.794 1.00 0.25 H new ATOM 0 HA LEU A 51 18.898 10.125 1.344 1.00 0.27 H new ATOM 0 HB2 LEU A 51 17.949 7.853 1.214 1.00 0.30 H new ATOM 0 HB3 LEU A 51 16.707 9.089 1.231 1.00 0.30 H new ATOM 0 HG LEU A 51 16.805 8.825 -1.391 1.00 0.29 H new ATOM 0 HD11 LEU A 51 17.295 6.511 -2.071 1.00 0.30 H new ATOM 0 HD12 LEU A 51 18.738 7.330 -1.428 1.00 0.30 H new ATOM 0 HD13 LEU A 51 17.862 6.151 -0.423 1.00 0.30 H new ATOM 0 HD21 LEU A 51 15.050 7.100 -1.240 1.00 0.35 H new ATOM 0 HD22 LEU A 51 15.530 6.766 0.441 1.00 0.35 H new ATOM 0 HD23 LEU A 51 14.853 8.354 0.008 1.00 0.35 H new ATOM 794 N ILE A 52 19.845 9.278 -1.636 1.00 0.20 N ATOM 795 CA ILE A 52 20.955 8.744 -2.417 1.00 0.21 C ATOM 796 C ILE A 52 22.222 9.570 -2.209 1.00 0.25 C ATOM 797 O ILE A 52 23.259 9.040 -1.814 1.00 0.29 O ATOM 798 CB ILE A 52 20.611 8.686 -3.924 1.00 0.23 C ATOM 799 CG1 ILE A 52 19.633 7.540 -4.196 1.00 0.25 C ATOM 800 CG2 ILE A 52 21.872 8.522 -4.764 1.00 0.28 C ATOM 801 CD1 ILE A 52 19.082 7.530 -5.607 1.00 0.31 C ATOM 0 H ILE A 52 19.138 9.765 -2.186 1.00 0.20 H new ATOM 0 HA ILE A 52 21.134 7.729 -2.064 1.00 0.21 H new ATOM 0 HB ILE A 52 20.139 9.627 -4.206 1.00 0.23 H new ATOM 0 HG12 ILE A 52 20.136 6.592 -4.005 1.00 0.25 H new ATOM 0 HG13 ILE A 52 18.803 7.608 -3.492 1.00 0.25 H new ATOM 0 HG21 ILE A 52 21.604 8.484 -5.820 1.00 0.28 H new ATOM 0 HG22 ILE A 52 22.538 9.367 -4.589 1.00 0.28 H new ATOM 0 HG23 ILE A 52 22.378 7.598 -4.485 1.00 0.28 H new ATOM 0 HD11 ILE A 52 18.397 6.690 -5.724 1.00 0.31 H new ATOM 0 HD12 ILE A 52 18.549 8.462 -5.796 1.00 0.31 H new ATOM 0 HD13 ILE A 52 19.903 7.431 -6.317 1.00 0.31 H new ATOM 813 N ALA A 53 22.129 10.868 -2.474 1.00 0.29 N ATOM 814 CA ALA A 53 23.267 11.765 -2.313 1.00 0.36 C ATOM 815 C ALA A 53 23.757 11.721 -0.877 1.00 0.38 C ATOM 816 O ALA A 53 24.957 11.657 -0.608 1.00 0.45 O ATOM 817 CB ALA A 53 22.878 13.185 -2.696 1.00 0.40 C ATOM 0 H ALA A 53 21.277 11.323 -2.801 1.00 0.29 H new ATOM 0 HA ALA A 53 24.072 11.439 -2.972 1.00 0.36 H new ATOM 0 HB1 ALA A 53 23.737 13.844 -2.571 1.00 0.40 H new ATOM 0 HB2 ALA A 53 22.554 13.205 -3.736 1.00 0.40 H new ATOM 0 HB3 ALA A 53 22.064 13.525 -2.055 1.00 0.40 H new ATOM 823 N GLU A 54 22.797 11.756 0.034 1.00 0.40 N ATOM 824 CA GLU A 54 23.065 11.702 1.460 1.00 0.47 C ATOM 825 C GLU A 54 23.842 10.440 1.835 1.00 0.40 C ATOM 826 O GLU A 54 24.868 10.512 2.512 1.00 0.45 O ATOM 827 CB GLU A 54 21.732 11.772 2.213 1.00 0.59 C ATOM 828 CG GLU A 54 21.705 10.982 3.504 1.00 0.69 C ATOM 829 CD GLU A 54 20.572 11.398 4.422 1.00 1.02 C ATOM 830 OE1 GLU A 54 20.776 12.323 5.236 1.00 1.27 O ATOM 831 OE2 GLU A 54 19.480 10.798 4.327 1.00 1.47 O ATOM 0 H GLU A 54 21.806 11.823 -0.198 1.00 0.40 H new ATOM 0 HA GLU A 54 23.689 12.551 1.740 1.00 0.47 H new ATOM 0 HB2 GLU A 54 21.507 12.815 2.434 1.00 0.59 H new ATOM 0 HB3 GLU A 54 20.939 11.407 1.560 1.00 0.59 H new ATOM 0 HG2 GLU A 54 21.609 9.921 3.274 1.00 0.69 H new ATOM 0 HG3 GLU A 54 22.654 11.111 4.024 1.00 0.69 H new ATOM 838 N ALA A 55 23.348 9.287 1.394 1.00 0.33 N ATOM 839 CA ALA A 55 23.996 8.013 1.692 1.00 0.31 C ATOM 840 C ALA A 55 25.392 7.932 1.076 1.00 0.33 C ATOM 841 O ALA A 55 26.285 7.297 1.632 1.00 0.41 O ATOM 842 CB ALA A 55 23.133 6.857 1.203 1.00 0.37 C ATOM 0 H ALA A 55 22.502 9.208 0.830 1.00 0.33 H new ATOM 0 HA ALA A 55 24.109 7.942 2.774 1.00 0.31 H new ATOM 0 HB1 ALA A 55 23.627 5.912 1.431 1.00 0.37 H new ATOM 0 HB2 ALA A 55 22.164 6.890 1.702 1.00 0.37 H new ATOM 0 HB3 ALA A 55 22.989 6.941 0.126 1.00 0.37 H new ATOM 848 N GLU A 56 25.574 8.573 -0.074 1.00 0.34 N ATOM 849 CA GLU A 56 26.866 8.559 -0.757 1.00 0.44 C ATOM 850 C GLU A 56 27.921 9.343 0.020 1.00 0.52 C ATOM 851 O GLU A 56 29.117 9.219 -0.245 1.00 0.65 O ATOM 852 CB GLU A 56 26.728 9.141 -2.166 1.00 0.50 C ATOM 853 CG GLU A 56 25.965 8.245 -3.127 1.00 0.61 C ATOM 854 CD GLU A 56 25.857 8.844 -4.517 1.00 1.09 C ATOM 855 OE1 GLU A 56 24.889 9.589 -4.769 1.00 1.88 O ATOM 856 OE2 GLU A 56 26.743 8.566 -5.353 1.00 1.31 O ATOM 0 H GLU A 56 24.848 9.107 -0.552 1.00 0.34 H new ATOM 0 HA GLU A 56 27.192 7.521 -0.821 1.00 0.44 H new ATOM 0 HB2 GLU A 56 26.222 10.105 -2.103 1.00 0.50 H new ATOM 0 HB3 GLU A 56 27.723 9.329 -2.571 1.00 0.50 H new ATOM 0 HG2 GLU A 56 26.463 7.277 -3.189 1.00 0.61 H new ATOM 0 HG3 GLU A 56 24.965 8.064 -2.734 1.00 0.61 H new ATOM 863 N ASN A 57 27.476 10.146 0.981 1.00 0.54 N ATOM 864 CA ASN A 57 28.388 10.957 1.783 1.00 0.68 C ATOM 865 C ASN A 57 28.953 10.175 2.966 1.00 0.70 C ATOM 866 O ASN A 57 29.980 10.549 3.531 1.00 0.98 O ATOM 867 CB ASN A 57 27.672 12.212 2.287 1.00 0.79 C ATOM 868 CG ASN A 57 28.597 13.137 3.056 1.00 0.96 C ATOM 869 OD1 ASN A 57 29.797 13.198 2.788 1.00 1.37 O ATOM 870 ND2 ASN A 57 28.042 13.862 4.019 1.00 1.66 N ATOM 0 H ASN A 57 26.491 10.253 1.224 1.00 0.54 H new ATOM 0 HA ASN A 57 29.222 11.243 1.142 1.00 0.68 H new ATOM 0 HB2 ASN A 57 27.248 12.750 1.439 1.00 0.79 H new ATOM 0 HB3 ASN A 57 26.840 11.920 2.928 1.00 0.79 H new ATOM 0 HD21 ASN A 57 28.614 14.501 4.571 1.00 1.66 H new ATOM 0 HD22 ASN A 57 27.043 13.780 4.208 1.00 1.66 H new ATOM 877 N ASN A 58 28.280 9.090 3.342 1.00 0.64 N ATOM 878 CA ASN A 58 28.726 8.272 4.467 1.00 0.70 C ATOM 879 C ASN A 58 28.684 6.784 4.128 1.00 0.63 C ATOM 880 O ASN A 58 29.688 6.082 4.256 1.00 0.89 O ATOM 881 CB ASN A 58 27.864 8.559 5.699 1.00 0.79 C ATOM 882 CG ASN A 58 26.382 8.597 5.376 1.00 1.13 C ATOM 883 OD1 ASN A 58 25.692 7.582 5.454 1.00 2.14 O ATOM 884 ND2 ASN A 58 25.887 9.773 5.009 1.00 1.12 N ATOM 0 H ASN A 58 27.429 8.758 2.888 1.00 0.64 H new ATOM 0 HA ASN A 58 29.762 8.535 4.684 1.00 0.70 H new ATOM 0 HB2 ASN A 58 28.048 7.794 6.453 1.00 0.79 H new ATOM 0 HB3 ASN A 58 28.162 9.513 6.133 1.00 0.79 H new ATOM 0 HD21 ASN A 58 24.897 9.860 4.778 1.00 1.12 H new ATOM 0 HD22 ASN A 58 26.496 10.589 4.958 1.00 1.12 H new ATOM 891 N ASN A 59 27.521 6.309 3.695 1.00 0.54 N ATOM 892 CA ASN A 59 27.351 4.903 3.338 1.00 0.72 C ATOM 893 C ASN A 59 28.085 4.564 2.042 1.00 0.82 C ATOM 894 O ASN A 59 28.004 3.434 1.559 1.00 1.69 O ATOM 895 CB ASN A 59 25.865 4.569 3.198 1.00 0.81 C ATOM 896 CG ASN A 59 25.177 4.427 4.542 1.00 0.88 C ATOM 897 OD1 ASN A 59 25.614 4.997 5.541 1.00 1.09 O ATOM 898 ND2 ASN A 59 24.091 3.665 4.572 1.00 0.93 N ATOM 0 H ASN A 59 26.681 6.876 3.582 1.00 0.54 H new ATOM 0 HA ASN A 59 27.782 4.302 4.138 1.00 0.72 H new ATOM 0 HB2 ASN A 59 25.372 5.351 2.621 1.00 0.81 H new ATOM 0 HB3 ASN A 59 25.755 3.641 2.636 1.00 0.81 H new ATOM 0 HD21 ASN A 59 23.584 3.534 5.447 1.00 0.93 H new ATOM 0 HD22 ASN A 59 23.763 3.211 3.720 1.00 0.93 H new ATOM 905 N ASN A 60 28.777 5.560 1.479 1.00 0.78 N ATOM 906 CA ASN A 60 29.548 5.396 0.241 1.00 0.73 C ATOM 907 C ASN A 60 28.647 5.427 -0.991 1.00 0.61 C ATOM 908 O ASN A 60 29.046 5.921 -2.046 1.00 0.68 O ATOM 909 CB ASN A 60 30.363 4.098 0.258 1.00 0.76 C ATOM 910 CG ASN A 60 31.386 4.068 1.377 1.00 1.00 C ATOM 911 OD1 ASN A 60 31.187 4.671 2.433 1.00 1.32 O ATOM 912 ND2 ASN A 60 32.490 3.366 1.151 1.00 1.74 N ATOM 0 H ASN A 60 28.819 6.502 1.868 1.00 0.78 H new ATOM 0 HA ASN A 60 30.237 6.239 0.185 1.00 0.73 H new ATOM 0 HB2 ASN A 60 29.687 3.250 0.366 1.00 0.76 H new ATOM 0 HB3 ASN A 60 30.872 3.980 -0.698 1.00 0.76 H new ATOM 0 HD21 ASN A 60 33.215 3.311 1.867 1.00 1.74 H new ATOM 0 HD22 ASN A 60 32.613 2.882 0.262 1.00 1.74 H new ATOM 919 N GLY A 61 27.437 4.897 -0.854 1.00 0.53 N ATOM 920 CA GLY A 61 26.508 4.878 -1.969 1.00 0.47 C ATOM 921 C GLY A 61 25.660 3.623 -1.992 1.00 0.41 C ATOM 922 O GLY A 61 24.900 3.399 -2.931 1.00 0.56 O ATOM 0 H GLY A 61 27.083 4.481 0.007 1.00 0.53 H new ATOM 0 HA2 GLY A 61 25.858 5.751 -1.912 1.00 0.47 H new ATOM 0 HA3 GLY A 61 27.064 4.955 -2.903 1.00 0.47 H new ATOM 926 N GLN A 62 25.801 2.805 -0.955 1.00 0.28 N ATOM 927 CA GLN A 62 25.045 1.562 -0.840 1.00 0.22 C ATOM 928 C GLN A 62 24.482 1.405 0.569 1.00 0.19 C ATOM 929 O GLN A 62 25.014 1.972 1.523 1.00 0.22 O ATOM 930 CB GLN A 62 25.928 0.363 -1.192 1.00 0.22 C ATOM 931 CG GLN A 62 27.351 0.497 -0.709 1.00 0.31 C ATOM 932 CD GLN A 62 28.251 -0.634 -1.175 1.00 1.15 C ATOM 933 OE1 GLN A 62 29.443 -0.436 -1.403 1.00 1.44 O ATOM 934 NE2 GLN A 62 27.688 -1.831 -1.311 1.00 1.87 N ATOM 0 H GLN A 62 26.436 2.982 -0.177 1.00 0.28 H new ATOM 0 HA GLN A 62 24.214 1.602 -1.544 1.00 0.22 H new ATOM 0 HB2 GLN A 62 25.491 -0.538 -0.762 1.00 0.22 H new ATOM 0 HB3 GLN A 62 25.932 0.230 -2.274 1.00 0.22 H new ATOM 0 HG2 GLN A 62 27.759 1.445 -1.060 1.00 0.31 H new ATOM 0 HG3 GLN A 62 27.356 0.531 0.380 1.00 0.31 H new ATOM 0 HE21 GLN A 62 26.695 -1.953 -1.112 1.00 1.87 H new ATOM 0 HE22 GLN A 62 28.249 -2.627 -1.615 1.00 1.87 H new ATOM 943 N LEU A 63 23.408 0.631 0.697 1.00 0.19 N ATOM 944 CA LEU A 63 22.774 0.420 1.992 1.00 0.19 C ATOM 945 C LEU A 63 22.683 -1.062 2.339 1.00 0.18 C ATOM 946 O LEU A 63 22.641 -1.920 1.456 1.00 0.19 O ATOM 947 CB LEU A 63 21.380 1.057 2.017 1.00 0.23 C ATOM 948 CG LEU A 63 20.596 0.999 0.704 1.00 0.25 C ATOM 949 CD1 LEU A 63 20.214 -0.432 0.362 1.00 0.28 C ATOM 950 CD2 LEU A 63 19.355 1.871 0.796 1.00 0.39 C ATOM 0 H LEU A 63 22.961 0.142 -0.078 1.00 0.19 H new ATOM 0 HA LEU A 63 23.398 0.901 2.745 1.00 0.19 H new ATOM 0 HB2 LEU A 63 20.791 0.566 2.792 1.00 0.23 H new ATOM 0 HB3 LEU A 63 21.484 2.102 2.310 1.00 0.23 H new ATOM 0 HG LEU A 63 21.235 1.378 -0.094 1.00 0.25 H new ATOM 0 HD11 LEU A 63 19.658 -0.446 -0.575 1.00 0.28 H new ATOM 0 HD12 LEU A 63 21.116 -1.034 0.257 1.00 0.28 H new ATOM 0 HD13 LEU A 63 19.594 -0.843 1.158 1.00 0.28 H new ATOM 0 HD21 LEU A 63 18.805 1.822 -0.144 1.00 0.39 H new ATOM 0 HD22 LEU A 63 18.720 1.515 1.607 1.00 0.39 H new ATOM 0 HD23 LEU A 63 19.649 2.902 0.991 1.00 0.39 H new ATOM 962 N ASN A 64 22.633 -1.344 3.639 1.00 0.18 N ATOM 963 CA ASN A 64 22.551 -2.710 4.144 1.00 0.18 C ATOM 964 C ASN A 64 21.094 -3.145 4.258 1.00 0.17 C ATOM 965 O ASN A 64 20.197 -2.308 4.361 1.00 0.17 O ATOM 966 CB ASN A 64 23.229 -2.832 5.514 1.00 0.20 C ATOM 967 CG ASN A 64 24.341 -1.820 5.722 1.00 0.26 C ATOM 968 OD1 ASN A 64 24.932 -1.318 4.769 1.00 0.74 O ATOM 969 ND2 ASN A 64 24.634 -1.516 6.982 1.00 0.61 N ATOM 0 H ASN A 64 22.648 -0.633 4.370 1.00 0.18 H new ATOM 0 HA ASN A 64 23.070 -3.359 3.438 1.00 0.18 H new ATOM 0 HB2 ASN A 64 22.480 -2.705 6.296 1.00 0.20 H new ATOM 0 HB3 ASN A 64 23.636 -3.837 5.623 1.00 0.20 H new ATOM 0 HD21 ASN A 64 25.373 -0.844 7.186 1.00 0.61 H new ATOM 0 HD22 ASN A 64 24.119 -1.955 7.745 1.00 0.61 H new ATOM 976 N PHE A 65 20.861 -4.452 4.232 1.00 0.17 N ATOM 977 CA PHE A 65 19.507 -4.990 4.316 1.00 0.17 C ATOM 978 C PHE A 65 18.730 -4.421 5.504 1.00 0.19 C ATOM 979 O PHE A 65 17.519 -4.224 5.416 1.00 0.18 O ATOM 980 CB PHE A 65 19.530 -6.516 4.406 1.00 0.19 C ATOM 981 CG PHE A 65 18.155 -7.117 4.436 1.00 0.18 C ATOM 982 CD1 PHE A 65 17.427 -7.279 3.268 1.00 0.20 C ATOM 983 CD2 PHE A 65 17.599 -7.538 5.632 1.00 0.19 C ATOM 984 CE1 PHE A 65 16.168 -7.848 3.294 1.00 0.21 C ATOM 985 CE2 PHE A 65 16.344 -8.110 5.663 1.00 0.19 C ATOM 986 CZ PHE A 65 15.594 -8.192 4.487 1.00 0.19 C ATOM 0 H PHE A 65 21.592 -5.159 4.153 1.00 0.17 H new ATOM 0 HA PHE A 65 18.996 -4.688 3.402 1.00 0.17 H new ATOM 0 HB2 PHE A 65 20.079 -6.918 3.554 1.00 0.19 H new ATOM 0 HB3 PHE A 65 20.072 -6.814 5.303 1.00 0.19 H new ATOM 0 HD1 PHE A 65 17.848 -6.957 2.327 1.00 0.20 H new ATOM 0 HD2 PHE A 65 18.154 -7.417 6.551 1.00 0.19 H new ATOM 0 HE1 PHE A 65 15.636 -8.021 2.370 1.00 0.21 H new ATOM 0 HE2 PHE A 65 15.944 -8.492 6.590 1.00 0.19 H new ATOM 0 HZ PHE A 65 14.567 -8.525 4.520 1.00 0.19 H new ATOM 996 N THR A 66 19.416 -4.160 6.614 1.00 0.23 N ATOM 997 CA THR A 66 18.745 -3.632 7.799 1.00 0.25 C ATOM 998 C THR A 66 18.176 -2.242 7.552 1.00 0.24 C ATOM 999 O THR A 66 16.988 -2.006 7.766 1.00 0.24 O ATOM 1000 CB THR A 66 19.677 -3.564 9.020 1.00 0.30 C ATOM 1001 OG1 THR A 66 20.215 -4.862 9.304 1.00 0.33 O ATOM 1002 CG2 THR A 66 18.916 -3.045 10.236 1.00 0.32 C ATOM 0 H THR A 66 20.421 -4.303 6.718 1.00 0.23 H new ATOM 0 HA THR A 66 17.935 -4.330 8.009 1.00 0.25 H new ATOM 0 HB THR A 66 20.495 -2.880 8.794 1.00 0.30 H new ATOM 0 HG1 THR A 66 20.808 -4.807 10.082 1.00 0.33 H new ATOM 0 HG21 THR A 66 19.587 -3.002 11.094 1.00 0.32 H new ATOM 0 HG22 THR A 66 18.531 -2.047 10.026 1.00 0.32 H new ATOM 0 HG23 THR A 66 18.085 -3.715 10.459 1.00 0.32 H new ATOM 1010 N GLU A 67 19.022 -1.315 7.118 1.00 0.25 N ATOM 1011 CA GLU A 67 18.563 0.041 6.863 1.00 0.26 C ATOM 1012 C GLU A 67 17.498 0.053 5.772 1.00 0.23 C ATOM 1013 O GLU A 67 16.495 0.756 5.893 1.00 0.23 O ATOM 1014 CB GLU A 67 19.731 0.966 6.507 1.00 0.29 C ATOM 1015 CG GLU A 67 20.631 0.448 5.400 1.00 0.27 C ATOM 1016 CD GLU A 67 21.841 1.334 5.189 1.00 0.45 C ATOM 1017 OE1 GLU A 67 21.672 2.452 4.658 1.00 0.66 O ATOM 1018 OE2 GLU A 67 22.958 0.915 5.560 1.00 0.61 O ATOM 0 H GLU A 67 20.013 -1.475 6.938 1.00 0.25 H new ATOM 0 HA GLU A 67 18.113 0.422 7.780 1.00 0.26 H new ATOM 0 HB2 GLU A 67 19.332 1.936 6.209 1.00 0.29 H new ATOM 0 HB3 GLU A 67 20.333 1.130 7.401 1.00 0.29 H new ATOM 0 HG2 GLU A 67 20.960 -0.562 5.643 1.00 0.27 H new ATOM 0 HG3 GLU A 67 20.063 0.383 4.472 1.00 0.27 H new ATOM 1025 N PHE A 68 17.710 -0.719 4.707 1.00 0.22 N ATOM 1026 CA PHE A 68 16.731 -0.782 3.628 1.00 0.20 C ATOM 1027 C PHE A 68 15.395 -1.307 4.137 1.00 0.18 C ATOM 1028 O PHE A 68 14.363 -0.658 3.975 1.00 0.19 O ATOM 1029 CB PHE A 68 17.206 -1.678 2.484 1.00 0.19 C ATOM 1030 CG PHE A 68 16.133 -1.888 1.452 1.00 0.18 C ATOM 1031 CD1 PHE A 68 15.588 -0.819 0.756 1.00 0.25 C ATOM 1032 CD2 PHE A 68 15.693 -3.167 1.157 1.00 0.17 C ATOM 1033 CE1 PHE A 68 14.624 -1.029 -0.212 1.00 0.27 C ATOM 1034 CE2 PHE A 68 14.729 -3.381 0.195 1.00 0.18 C ATOM 1035 CZ PHE A 68 14.107 -2.238 -0.415 1.00 0.23 C ATOM 0 H PHE A 68 18.537 -1.300 4.571 1.00 0.22 H new ATOM 0 HA PHE A 68 16.611 0.235 3.255 1.00 0.20 H new ATOM 0 HB2 PHE A 68 18.081 -1.231 2.012 1.00 0.19 H new ATOM 0 HB3 PHE A 68 17.518 -2.643 2.884 1.00 0.19 H new ATOM 0 HD1 PHE A 68 15.920 0.186 0.972 1.00 0.25 H new ATOM 0 HD2 PHE A 68 16.111 -4.009 1.688 1.00 0.17 H new ATOM 0 HE1 PHE A 68 14.285 -0.198 -0.813 1.00 0.27 H new ATOM 0 HE2 PHE A 68 14.448 -4.383 -0.093 1.00 0.18 H new ATOM 0 HZ PHE A 68 13.229 -2.359 -1.032 1.00 0.23 H new ATOM 1045 N CYS A 69 15.417 -2.501 4.726 1.00 0.18 N ATOM 1046 CA CYS A 69 14.203 -3.102 5.268 1.00 0.19 C ATOM 1047 C CYS A 69 13.523 -2.116 6.202 1.00 0.20 C ATOM 1048 O CYS A 69 12.296 -2.070 6.298 1.00 0.20 O ATOM 1049 CB CYS A 69 14.519 -4.406 6.009 1.00 0.21 C ATOM 1050 SG CYS A 69 15.205 -4.182 7.666 1.00 0.26 S ATOM 0 H CYS A 69 16.258 -3.068 4.839 1.00 0.18 H new ATOM 0 HA CYS A 69 13.532 -3.341 4.443 1.00 0.19 H new ATOM 0 HB2 CYS A 69 13.606 -4.996 6.085 1.00 0.21 H new ATOM 0 HB3 CYS A 69 15.224 -4.985 5.413 1.00 0.21 H new ATOM 0 HG CYS A 69 15.886 -3.075 7.708 1.00 0.26 H new ATOM 1056 N GLY A 70 14.340 -1.325 6.890 1.00 0.22 N ATOM 1057 CA GLY A 70 13.817 -0.320 7.787 1.00 0.25 C ATOM 1058 C GLY A 70 13.123 0.782 7.013 1.00 0.25 C ATOM 1059 O GLY A 70 12.154 1.378 7.485 1.00 0.27 O ATOM 0 H GLY A 70 15.358 -1.365 6.840 1.00 0.22 H new ATOM 0 HA2 GLY A 70 13.116 -0.778 8.485 1.00 0.25 H new ATOM 0 HA3 GLY A 70 14.628 0.102 8.381 1.00 0.25 H new ATOM 1063 N ILE A 71 13.638 1.042 5.811 1.00 0.25 N ATOM 1064 CA ILE A 71 13.092 2.068 4.930 1.00 0.27 C ATOM 1065 C ILE A 71 11.758 1.657 4.330 1.00 0.26 C ATOM 1066 O ILE A 71 10.785 2.398 4.415 1.00 0.29 O ATOM 1067 CB ILE A 71 14.078 2.404 3.795 1.00 0.28 C ATOM 1068 CG1 ILE A 71 15.209 3.256 4.365 1.00 0.30 C ATOM 1069 CG2 ILE A 71 13.367 3.123 2.651 1.00 0.30 C ATOM 1070 CD1 ILE A 71 16.201 3.743 3.328 1.00 0.33 C ATOM 0 H ILE A 71 14.442 0.548 5.424 1.00 0.25 H new ATOM 0 HA ILE A 71 12.932 2.952 5.547 1.00 0.27 H new ATOM 0 HB ILE A 71 14.492 1.483 3.385 1.00 0.28 H new ATOM 0 HG12 ILE A 71 14.779 4.119 4.873 1.00 0.30 H new ATOM 0 HG13 ILE A 71 15.742 2.676 5.118 1.00 0.30 H new ATOM 0 HG21 ILE A 71 14.084 3.350 1.862 1.00 0.30 H new ATOM 0 HG22 ILE A 71 12.579 2.483 2.253 1.00 0.30 H new ATOM 0 HG23 ILE A 71 12.929 4.050 3.020 1.00 0.30 H new ATOM 0 HD11 ILE A 71 16.972 4.340 3.814 1.00 0.33 H new ATOM 0 HD12 ILE A 71 16.662 2.887 2.835 1.00 0.33 H new ATOM 0 HD13 ILE A 71 15.683 4.352 2.587 1.00 0.33 H new ATOM 1082 N MET A 72 11.714 0.489 3.703 1.00 0.24 N ATOM 1083 CA MET A 72 10.476 0.021 3.107 1.00 0.25 C ATOM 1084 C MET A 72 9.382 0.008 4.163 1.00 0.27 C ATOM 1085 O MET A 72 8.219 0.294 3.878 1.00 0.31 O ATOM 1086 CB MET A 72 10.658 -1.367 2.484 1.00 0.23 C ATOM 1087 CG MET A 72 11.065 -2.449 3.474 1.00 0.26 C ATOM 1088 SD MET A 72 9.672 -3.103 4.418 1.00 0.49 S ATOM 1089 CE MET A 72 8.579 -3.627 3.100 1.00 0.33 C ATOM 0 H MET A 72 12.509 -0.141 3.596 1.00 0.24 H new ATOM 0 HA MET A 72 10.187 0.700 2.305 1.00 0.25 H new ATOM 0 HB2 MET A 72 9.725 -1.662 2.004 1.00 0.23 H new ATOM 0 HB3 MET A 72 11.413 -1.305 1.701 1.00 0.23 H new ATOM 0 HG2 MET A 72 11.546 -3.265 2.934 1.00 0.26 H new ATOM 0 HG3 MET A 72 11.805 -2.043 4.163 1.00 0.26 H new ATOM 0 HE1 MET A 72 7.768 -4.225 3.516 1.00 0.33 H new ATOM 0 HE2 MET A 72 8.165 -2.751 2.601 1.00 0.33 H new ATOM 0 HE3 MET A 72 9.138 -4.224 2.380 1.00 0.33 H new ATOM 1099 N ALA A 73 9.773 -0.329 5.388 1.00 0.26 N ATOM 1100 CA ALA A 73 8.845 -0.358 6.506 1.00 0.29 C ATOM 1101 C ALA A 73 8.239 1.021 6.750 1.00 0.31 C ATOM 1102 O ALA A 73 7.018 1.162 6.810 1.00 0.36 O ATOM 1103 CB ALA A 73 9.550 -0.863 7.756 1.00 0.29 C ATOM 0 H ALA A 73 10.730 -0.586 5.629 1.00 0.26 H new ATOM 0 HA ALA A 73 8.032 -1.041 6.261 1.00 0.29 H new ATOM 0 HB1 ALA A 73 8.846 -0.881 8.588 1.00 0.29 H new ATOM 0 HB2 ALA A 73 9.928 -1.870 7.579 1.00 0.29 H new ATOM 0 HB3 ALA A 73 10.381 -0.200 7.998 1.00 0.29 H new ATOM 1109 N LYS A 74 9.091 2.043 6.893 1.00 0.31 N ATOM 1110 CA LYS A 74 8.598 3.399 7.124 1.00 0.35 C ATOM 1111 C LYS A 74 7.875 3.920 5.891 1.00 0.38 C ATOM 1112 O LYS A 74 7.026 4.808 5.981 1.00 0.44 O ATOM 1113 CB LYS A 74 9.740 4.349 7.491 1.00 0.38 C ATOM 1114 CG LYS A 74 10.921 4.294 6.538 1.00 0.43 C ATOM 1115 CD LYS A 74 11.962 5.352 6.873 1.00 0.48 C ATOM 1116 CE LYS A 74 12.647 5.066 8.201 1.00 1.38 C ATOM 1117 NZ LYS A 74 13.681 6.087 8.523 1.00 2.11 N ATOM 0 H LYS A 74 10.107 1.957 6.853 1.00 0.31 H new ATOM 0 HA LYS A 74 7.900 3.358 7.960 1.00 0.35 H new ATOM 0 HB2 LYS A 74 9.356 5.369 7.518 1.00 0.38 H new ATOM 0 HB3 LYS A 74 10.087 4.112 8.497 1.00 0.38 H new ATOM 0 HG2 LYS A 74 11.379 3.306 6.582 1.00 0.43 H new ATOM 0 HG3 LYS A 74 10.571 4.438 5.516 1.00 0.43 H new ATOM 0 HD2 LYS A 74 12.708 5.392 6.080 1.00 0.48 H new ATOM 0 HD3 LYS A 74 11.486 6.332 6.913 1.00 0.48 H new ATOM 0 HE2 LYS A 74 11.902 5.041 8.996 1.00 1.38 H new ATOM 0 HE3 LYS A 74 13.109 4.080 8.166 1.00 1.38 H new ATOM 0 HZ1 LYS A 74 13.893 6.057 9.541 1.00 2.11 H new ATOM 0 HZ2 LYS A 74 14.547 5.887 7.983 1.00 2.11 H new ATOM 0 HZ3 LYS A 74 13.326 7.032 8.271 1.00 2.11 H new ATOM 1131 N GLN A 75 8.221 3.357 4.740 1.00 0.36 N ATOM 1132 CA GLN A 75 7.617 3.755 3.479 1.00 0.42 C ATOM 1133 C GLN A 75 6.158 3.319 3.427 1.00 0.51 C ATOM 1134 O GLN A 75 5.384 3.788 2.592 1.00 0.63 O ATOM 1135 CB GLN A 75 8.394 3.149 2.308 1.00 0.43 C ATOM 1136 CG GLN A 75 7.895 3.592 0.942 1.00 0.69 C ATOM 1137 CD GLN A 75 8.006 5.092 0.738 1.00 0.90 C ATOM 1138 OE1 GLN A 75 7.078 5.840 1.039 1.00 1.48 O ATOM 1139 NE2 GLN A 75 9.147 5.536 0.227 1.00 0.80 N ATOM 0 H GLN A 75 8.921 2.620 4.656 1.00 0.36 H new ATOM 0 HA GLN A 75 7.656 4.842 3.402 1.00 0.42 H new ATOM 0 HB2 GLN A 75 9.446 3.418 2.405 1.00 0.43 H new ATOM 0 HB3 GLN A 75 8.336 2.062 2.370 1.00 0.43 H new ATOM 0 HG2 GLN A 75 8.466 3.081 0.167 1.00 0.69 H new ATOM 0 HG3 GLN A 75 6.855 3.289 0.824 1.00 0.69 H new ATOM 0 HE21 GLN A 75 9.891 4.879 -0.008 1.00 0.80 H new ATOM 0 HE22 GLN A 75 9.281 6.535 0.069 1.00 0.80 H new ATOM 1148 N MET A 76 5.794 2.402 4.315 1.00 0.49 N ATOM 1149 CA MET A 76 4.428 1.907 4.386 1.00 0.59 C ATOM 1150 C MET A 76 3.527 2.908 5.103 1.00 0.75 C ATOM 1151 O MET A 76 2.599 3.461 4.513 1.00 1.15 O ATOM 1152 CB MET A 76 4.396 0.559 5.106 1.00 0.57 C ATOM 1153 CG MET A 76 5.094 -0.539 4.327 1.00 0.63 C ATOM 1154 SD MET A 76 4.547 -2.188 4.796 1.00 0.96 S ATOM 1155 CE MET A 76 4.977 -3.092 3.313 1.00 0.68 C ATOM 0 H MET A 76 6.429 1.986 4.997 1.00 0.49 H new ATOM 0 HA MET A 76 4.055 1.777 3.370 1.00 0.59 H new ATOM 0 HB2 MET A 76 4.869 0.662 6.083 1.00 0.57 H new ATOM 0 HB3 MET A 76 3.360 0.271 5.282 1.00 0.57 H new ATOM 0 HG2 MET A 76 4.915 -0.392 3.262 1.00 0.63 H new ATOM 0 HG3 MET A 76 6.170 -0.461 4.483 1.00 0.63 H new ATOM 0 HE1 MET A 76 5.319 -4.091 3.582 1.00 0.68 H new ATOM 0 HE2 MET A 76 4.102 -3.170 2.668 1.00 0.68 H new ATOM 0 HE3 MET A 76 5.772 -2.567 2.784 1.00 0.68 H new ATOM 1165 N ARG A 77 3.811 3.135 6.384 1.00 1.01 N ATOM 1166 CA ARG A 77 3.032 4.069 7.194 1.00 1.21 C ATOM 1167 C ARG A 77 3.125 5.501 6.662 1.00 1.56 C ATOM 1168 O ARG A 77 2.102 6.153 6.452 1.00 1.86 O ATOM 1169 CB ARG A 77 3.492 4.026 8.658 1.00 1.28 C ATOM 1170 CG ARG A 77 4.987 3.800 8.841 1.00 1.81 C ATOM 1171 CD ARG A 77 5.290 2.363 9.234 1.00 2.26 C ATOM 1172 NE ARG A 77 4.733 2.026 10.543 1.00 2.93 N ATOM 1173 CZ ARG A 77 4.822 0.821 11.096 1.00 3.56 C ATOM 1174 NH1 ARG A 77 5.445 -0.162 10.458 1.00 3.66 N ATOM 1175 NH2 ARG A 77 4.290 0.597 12.290 1.00 4.44 N ATOM 0 H ARG A 77 4.577 2.684 6.884 1.00 1.01 H new ATOM 0 HA ARG A 77 1.990 3.756 7.134 1.00 1.21 H new ATOM 0 HB2 ARG A 77 3.217 4.964 9.140 1.00 1.28 H new ATOM 0 HB3 ARG A 77 2.951 3.232 9.173 1.00 1.28 H new ATOM 0 HG2 ARG A 77 5.509 4.043 7.915 1.00 1.81 H new ATOM 0 HG3 ARG A 77 5.367 4.476 9.607 1.00 1.81 H new ATOM 0 HD2 ARG A 77 4.883 1.687 8.482 1.00 2.26 H new ATOM 0 HD3 ARG A 77 6.369 2.211 9.249 1.00 2.26 H new ATOM 0 HE ARG A 77 4.248 2.758 11.062 1.00 2.93 H new ATOM 0 HH11 ARG A 77 5.857 0.006 9.540 1.00 3.66 H new ATOM 0 HH12 ARG A 77 5.512 -1.086 10.885 1.00 3.66 H new ATOM 0 HH21 ARG A 77 3.812 1.350 12.785 1.00 4.44 H new ATOM 0 HH22 ARG A 77 4.359 -0.328 12.714 1.00 4.44 H new ATOM 1189 N GLU A 78 4.347 5.983 6.440 1.00 1.79 N ATOM 1190 CA GLU A 78 4.563 7.342 5.946 1.00 2.41 C ATOM 1191 C GLU A 78 3.748 8.354 6.751 1.00 3.29 C ATOM 1192 O GLU A 78 3.055 9.199 6.182 1.00 3.87 O ATOM 1193 CB GLU A 78 4.191 7.445 4.465 1.00 2.38 C ATOM 1194 CG GLU A 78 4.999 6.532 3.557 1.00 2.16 C ATOM 1195 CD GLU A 78 4.520 6.579 2.119 1.00 2.80 C ATOM 1196 OE1 GLU A 78 4.942 7.493 1.381 1.00 3.27 O ATOM 1197 OE2 GLU A 78 3.720 5.701 1.731 1.00 3.22 O ATOM 0 H GLU A 78 5.204 5.452 6.595 1.00 1.79 H new ATOM 0 HA GLU A 78 5.622 7.571 6.064 1.00 2.41 H new ATOM 0 HB2 GLU A 78 3.133 7.210 4.350 1.00 2.38 H new ATOM 0 HB3 GLU A 78 4.326 8.476 4.138 1.00 2.38 H new ATOM 0 HG2 GLU A 78 6.049 6.821 3.597 1.00 2.16 H new ATOM 0 HG3 GLU A 78 4.935 5.508 3.925 1.00 2.16 H new ATOM 1204 N THR A 79 3.831 8.263 8.077 1.00 3.77 N ATOM 1205 CA THR A 79 3.098 9.175 8.949 1.00 4.81 C ATOM 1206 C THR A 79 3.796 10.529 9.031 1.00 5.38 C ATOM 1207 O THR A 79 3.141 11.566 9.149 1.00 6.26 O ATOM 1208 CB THR A 79 2.933 8.597 10.368 1.00 5.61 C ATOM 1209 OG1 THR A 79 2.111 9.467 11.157 1.00 6.33 O ATOM 1210 CG2 THR A 79 4.282 8.415 11.050 1.00 6.12 C ATOM 0 H THR A 79 4.396 7.570 8.568 1.00 3.77 H new ATOM 0 HA THR A 79 2.108 9.306 8.511 1.00 4.81 H new ATOM 0 HB THR A 79 2.458 7.620 10.280 1.00 5.61 H new ATOM 0 HG1 THR A 79 2.665 10.175 11.547 1.00 6.33 H new ATOM 0 HG21 THR A 79 4.132 8.006 12.049 1.00 6.12 H new ATOM 0 HG22 THR A 79 4.896 7.730 10.465 1.00 6.12 H new ATOM 0 HG23 THR A 79 4.785 9.379 11.124 1.00 6.12 H new ATOM 1218 N ASP A 80 5.130 10.499 8.968 1.00 5.21 N ATOM 1219 CA ASP A 80 5.957 11.709 9.021 1.00 6.18 C ATOM 1220 C ASP A 80 5.965 12.361 10.407 1.00 7.07 C ATOM 1221 O ASP A 80 6.980 12.921 10.822 1.00 7.91 O ATOM 1222 CB ASP A 80 5.489 12.711 7.985 1.00 6.70 C ATOM 1223 CG ASP A 80 5.684 12.218 6.565 1.00 6.31 C ATOM 1224 OD1 ASP A 80 4.806 11.482 6.066 1.00 6.38 O ATOM 1225 OD2 ASP A 80 6.715 12.566 5.952 1.00 6.26 O ATOM 0 H ASP A 80 5.667 9.637 8.879 1.00 5.21 H new ATOM 0 HA ASP A 80 6.979 11.400 8.803 1.00 6.18 H new ATOM 0 HB2 ASP A 80 4.434 12.930 8.148 1.00 6.70 H new ATOM 0 HB3 ASP A 80 6.033 13.646 8.118 1.00 6.70 H new ATOM 1230 N THR A 81 4.843 12.294 11.123 1.00 7.15 N ATOM 1231 CA THR A 81 4.762 12.889 12.454 1.00 8.23 C ATOM 1232 C THR A 81 5.662 12.136 13.417 1.00 9.23 C ATOM 1233 O THR A 81 6.783 12.564 13.694 1.00 9.95 O ATOM 1234 CB THR A 81 3.323 12.899 13.000 1.00 8.38 C ATOM 1235 OG1 THR A 81 2.656 11.678 12.660 1.00 7.82 O ATOM 1236 CG2 THR A 81 2.547 14.084 12.451 1.00 8.29 C ATOM 0 H THR A 81 3.987 11.839 10.807 1.00 7.15 H new ATOM 0 HA THR A 81 5.093 13.924 12.364 1.00 8.23 H new ATOM 0 HB THR A 81 3.370 12.989 14.085 1.00 8.38 H new ATOM 0 HG1 THR A 81 1.742 11.695 13.014 1.00 7.82 H new ATOM 0 HG21 THR A 81 1.533 14.071 12.850 1.00 8.29 H new ATOM 0 HG22 THR A 81 3.041 15.010 12.745 1.00 8.29 H new ATOM 0 HG23 THR A 81 2.510 14.022 11.363 1.00 8.29 H new ATOM 1244 N GLU A 82 5.172 11.014 13.929 1.00 9.45 N ATOM 1245 CA GLU A 82 5.964 10.198 14.832 1.00 10.56 C ATOM 1246 C GLU A 82 7.100 9.556 14.052 1.00 10.71 C ATOM 1247 O GLU A 82 8.038 9.011 14.627 1.00 11.73 O ATOM 1248 CB GLU A 82 5.102 9.126 15.503 1.00 10.89 C ATOM 1249 CG GLU A 82 4.242 9.661 16.639 1.00 11.44 C ATOM 1250 CD GLU A 82 3.240 10.700 16.174 1.00 10.69 C ATOM 1251 OE1 GLU A 82 2.114 10.313 15.797 1.00 10.52 O ATOM 1252 OE2 GLU A 82 3.582 11.901 16.188 1.00 10.45 O ATOM 0 H GLU A 82 4.238 10.653 13.735 1.00 9.45 H new ATOM 0 HA GLU A 82 6.372 10.832 15.619 1.00 10.56 H new ATOM 0 HB2 GLU A 82 4.456 8.669 14.753 1.00 10.89 H new ATOM 0 HB3 GLU A 82 5.750 8.339 15.888 1.00 10.89 H new ATOM 0 HG2 GLU A 82 3.710 8.833 17.108 1.00 11.44 H new ATOM 0 HG3 GLU A 82 4.886 10.099 17.402 1.00 11.44 H new ATOM 1259 N GLU A 83 6.995 9.616 12.725 1.00 9.86 N ATOM 1260 CA GLU A 83 8.022 9.069 11.854 1.00 10.23 C ATOM 1261 C GLU A 83 9.335 9.808 12.069 1.00 10.94 C ATOM 1262 O GLU A 83 10.354 9.209 12.415 1.00 12.03 O ATOM 1263 CB GLU A 83 7.583 9.204 10.391 1.00 9.26 C ATOM 1264 CG GLU A 83 8.626 8.731 9.391 1.00 9.89 C ATOM 1265 CD GLU A 83 8.987 7.270 9.574 1.00 10.21 C ATOM 1266 OE1 GLU A 83 8.176 6.405 9.178 1.00 10.36 O ATOM 1267 OE2 GLU A 83 10.078 6.991 10.112 1.00 10.48 O ATOM 0 H GLU A 83 6.207 10.039 12.234 1.00 9.86 H new ATOM 0 HA GLU A 83 8.166 8.015 12.091 1.00 10.23 H new ATOM 0 HB2 GLU A 83 6.666 8.634 10.243 1.00 9.26 H new ATOM 0 HB3 GLU A 83 7.345 10.248 10.188 1.00 9.26 H new ATOM 0 HG2 GLU A 83 8.250 8.885 8.379 1.00 9.89 H new ATOM 0 HG3 GLU A 83 9.525 9.339 9.493 1.00 9.89 H new ATOM 1274 N GLU A 84 9.294 11.118 11.862 1.00 10.48 N ATOM 1275 CA GLU A 84 10.460 11.971 12.048 1.00 11.32 C ATOM 1276 C GLU A 84 10.837 12.070 13.520 1.00 12.38 C ATOM 1277 O GLU A 84 12.011 12.202 13.866 1.00 13.44 O ATOM 1278 CB GLU A 84 10.167 13.371 11.507 1.00 10.78 C ATOM 1279 CG GLU A 84 9.918 13.405 10.008 1.00 11.09 C ATOM 1280 CD GLU A 84 11.128 12.968 9.205 1.00 11.33 C ATOM 1281 OE1 GLU A 84 11.273 11.752 8.965 1.00 11.72 O ATOM 1282 OE2 GLU A 84 11.930 13.843 8.816 1.00 11.29 O ATOM 0 H GLU A 84 8.456 11.617 11.562 1.00 10.48 H new ATOM 0 HA GLU A 84 11.294 11.528 11.504 1.00 11.32 H new ATOM 0 HB2 GLU A 84 9.295 13.775 12.021 1.00 10.78 H new ATOM 0 HB3 GLU A 84 11.006 14.025 11.742 1.00 10.78 H new ATOM 0 HG2 GLU A 84 9.075 12.757 9.769 1.00 11.09 H new ATOM 0 HG3 GLU A 84 9.637 14.416 9.713 1.00 11.09 H new ATOM 1289 N MET A 85 9.826 12.005 14.383 1.00 12.20 N ATOM 1290 CA MET A 85 10.039 12.115 15.822 1.00 13.28 C ATOM 1291 C MET A 85 10.767 10.898 16.392 1.00 14.20 C ATOM 1292 O MET A 85 11.820 11.034 17.015 1.00 15.28 O ATOM 1293 CB MET A 85 8.697 12.300 16.537 1.00 13.04 C ATOM 1294 CG MET A 85 8.836 12.452 18.036 1.00 14.20 C ATOM 1295 SD MET A 85 9.871 13.854 18.482 1.00 15.12 S ATOM 1296 CE MET A 85 10.896 13.126 19.754 1.00 16.29 C ATOM 0 H MET A 85 8.852 11.877 14.110 1.00 12.20 H new ATOM 0 HA MET A 85 10.672 12.986 15.992 1.00 13.28 H new ATOM 0 HB2 MET A 85 8.196 13.180 16.134 1.00 13.04 H new ATOM 0 HB3 MET A 85 8.058 11.444 16.323 1.00 13.04 H new ATOM 0 HG2 MET A 85 7.848 12.575 18.480 1.00 14.20 H new ATOM 0 HG3 MET A 85 9.262 11.540 18.454 1.00 14.20 H new ATOM 0 HE1 MET A 85 11.141 13.881 20.501 1.00 16.29 H new ATOM 0 HE2 MET A 85 10.358 12.306 20.230 1.00 16.29 H new ATOM 0 HE3 MET A 85 11.815 12.746 19.308 1.00 16.29 H new ATOM 1306 N ARG A 86 10.204 9.714 16.180 1.00 13.88 N ATOM 1307 CA ARG A 86 10.798 8.480 16.680 1.00 14.84 C ATOM 1308 C ARG A 86 12.162 8.221 16.052 1.00 15.43 C ATOM 1309 O ARG A 86 13.058 7.681 16.700 1.00 16.55 O ATOM 1310 CB ARG A 86 9.869 7.299 16.404 1.00 14.45 C ATOM 1311 CG ARG A 86 8.550 7.372 17.155 1.00 14.20 C ATOM 1312 CD ARG A 86 7.824 6.037 17.134 1.00 14.13 C ATOM 1313 NE ARG A 86 8.532 5.020 17.907 1.00 14.82 N ATOM 1314 CZ ARG A 86 8.090 3.777 18.070 1.00 15.11 C ATOM 1315 NH1 ARG A 86 6.945 3.399 17.516 1.00 14.78 N ATOM 1316 NH2 ARG A 86 8.791 2.910 18.789 1.00 15.88 N ATOM 0 H ARG A 86 9.334 9.583 15.664 1.00 13.88 H new ATOM 0 HA ARG A 86 10.936 8.591 17.755 1.00 14.84 H new ATOM 0 HB2 ARG A 86 9.666 7.250 15.334 1.00 14.45 H new ATOM 0 HB3 ARG A 86 10.380 6.375 16.674 1.00 14.45 H new ATOM 0 HG2 ARG A 86 8.733 7.672 18.187 1.00 14.20 H new ATOM 0 HG3 ARG A 86 7.917 8.139 16.708 1.00 14.20 H new ATOM 0 HD2 ARG A 86 6.819 6.164 17.536 1.00 14.13 H new ATOM 0 HD3 ARG A 86 7.715 5.699 16.103 1.00 14.13 H new ATOM 0 HE ARG A 86 9.415 5.278 18.347 1.00 14.82 H new ATOM 0 HH11 ARG A 86 6.402 4.063 16.964 1.00 14.78 H new ATOM 0 HH12 ARG A 86 6.608 2.445 17.642 1.00 14.78 H new ATOM 0 HH21 ARG A 86 9.671 3.197 19.218 1.00 15.88 H new ATOM 0 HH22 ARG A 86 8.450 1.957 18.913 1.00 15.88 H new ATOM 1330 N GLU A 87 12.315 8.610 14.792 1.00 14.77 N ATOM 1331 CA GLU A 87 13.565 8.409 14.083 1.00 15.43 C ATOM 1332 C GLU A 87 14.668 9.281 14.669 1.00 16.43 C ATOM 1333 O GLU A 87 15.802 8.835 14.825 1.00 17.50 O ATOM 1334 CB GLU A 87 13.381 8.726 12.601 1.00 14.60 C ATOM 1335 CG GLU A 87 14.603 8.420 11.760 1.00 15.22 C ATOM 1336 CD GLU A 87 15.038 6.972 11.865 1.00 14.94 C ATOM 1337 OE1 GLU A 87 14.293 6.091 11.387 1.00 14.72 O ATOM 1338 OE2 GLU A 87 16.124 6.718 12.429 1.00 15.08 O ATOM 0 H GLU A 87 11.586 9.066 14.243 1.00 14.77 H new ATOM 0 HA GLU A 87 13.858 7.365 14.194 1.00 15.43 H new ATOM 0 HB2 GLU A 87 12.535 8.156 12.218 1.00 14.60 H new ATOM 0 HB3 GLU A 87 13.130 9.781 12.492 1.00 14.60 H new ATOM 0 HG2 GLU A 87 14.390 8.656 10.717 1.00 15.22 H new ATOM 0 HG3 GLU A 87 15.424 9.065 12.072 1.00 15.22 H new ATOM 1345 N ALA A 88 14.315 10.508 15.035 1.00 16.17 N ATOM 1346 CA ALA A 88 15.279 11.446 15.593 1.00 17.18 C ATOM 1347 C ALA A 88 15.695 11.019 16.992 1.00 18.20 C ATOM 1348 O ALA A 88 16.879 11.055 17.330 1.00 19.32 O ATOM 1349 CB ALA A 88 14.714 12.859 15.598 1.00 16.77 C ATOM 0 H ALA A 88 13.367 10.876 14.955 1.00 16.17 H new ATOM 0 HA ALA A 88 16.167 11.442 14.961 1.00 17.18 H new ATOM 0 HB1 ALA A 88 15.450 13.544 16.019 1.00 16.77 H new ATOM 0 HB2 ALA A 88 14.480 13.161 14.577 1.00 16.77 H new ATOM 0 HB3 ALA A 88 13.807 12.886 16.202 1.00 16.77 H new ATOM 1355 N PHE A 89 14.723 10.623 17.809 1.00 17.88 N ATOM 1356 CA PHE A 89 15.018 10.171 19.161 1.00 18.88 C ATOM 1357 C PHE A 89 16.076 9.073 19.119 1.00 19.75 C ATOM 1358 O PHE A 89 17.028 9.078 19.901 1.00 20.90 O ATOM 1359 CB PHE A 89 13.751 9.655 19.850 1.00 18.44 C ATOM 1360 CG PHE A 89 14.029 8.971 21.157 1.00 19.53 C ATOM 1361 CD1 PHE A 89 14.169 9.708 22.318 1.00 20.12 C ATOM 1362 CD2 PHE A 89 14.163 7.592 21.223 1.00 20.04 C ATOM 1363 CE1 PHE A 89 14.439 9.088 23.522 1.00 21.19 C ATOM 1364 CE2 PHE A 89 14.430 6.965 22.424 1.00 21.09 C ATOM 1365 CZ PHE A 89 14.570 7.716 23.575 1.00 21.66 C ATOM 0 H PHE A 89 13.734 10.606 17.560 1.00 17.88 H new ATOM 0 HA PHE A 89 15.399 11.016 19.735 1.00 18.88 H new ATOM 0 HB2 PHE A 89 13.072 10.490 20.021 1.00 18.44 H new ATOM 0 HB3 PHE A 89 13.240 8.960 19.184 1.00 18.44 H new ATOM 0 HD1 PHE A 89 14.066 10.782 22.283 1.00 20.12 H new ATOM 0 HD2 PHE A 89 14.057 7.002 20.325 1.00 20.04 H new ATOM 0 HE1 PHE A 89 14.547 9.677 24.421 1.00 21.19 H new ATOM 0 HE2 PHE A 89 14.529 5.890 22.463 1.00 21.09 H new ATOM 0 HZ PHE A 89 14.782 7.229 24.516 1.00 21.66 H new ATOM 1375 N LYS A 90 15.895 8.134 18.194 1.00 19.26 N ATOM 1376 CA LYS A 90 16.826 7.024 18.026 1.00 20.11 C ATOM 1377 C LYS A 90 18.206 7.520 17.605 1.00 20.94 C ATOM 1378 O LYS A 90 19.223 6.925 17.964 1.00 22.05 O ATOM 1379 CB LYS A 90 16.290 6.038 16.985 1.00 19.45 C ATOM 1380 CG LYS A 90 15.010 5.336 17.410 1.00 18.94 C ATOM 1381 CD LYS A 90 14.476 4.435 16.309 1.00 18.35 C ATOM 1382 CE LYS A 90 13.184 3.749 16.725 1.00 17.84 C ATOM 1383 NZ LYS A 90 13.387 2.829 17.879 1.00 18.07 N ATOM 0 H LYS A 90 15.107 8.121 17.546 1.00 19.26 H new ATOM 0 HA LYS A 90 16.922 6.519 18.987 1.00 20.11 H new ATOM 0 HB2 LYS A 90 16.109 6.571 16.052 1.00 19.45 H new ATOM 0 HB3 LYS A 90 17.054 5.288 16.780 1.00 19.45 H new ATOM 0 HG2 LYS A 90 15.199 4.745 18.306 1.00 18.94 H new ATOM 0 HG3 LYS A 90 14.256 6.079 17.671 1.00 18.94 H new ATOM 0 HD2 LYS A 90 14.302 5.024 15.408 1.00 18.35 H new ATOM 0 HD3 LYS A 90 15.224 3.683 16.059 1.00 18.35 H new ATOM 0 HE2 LYS A 90 12.442 4.503 16.988 1.00 17.84 H new ATOM 0 HE3 LYS A 90 12.783 3.188 15.881 1.00 17.84 H new ATOM 0 HZ1 LYS A 90 12.536 2.246 18.012 1.00 18.07 H new ATOM 0 HZ2 LYS A 90 14.203 2.212 17.692 1.00 18.07 H new ATOM 0 HZ3 LYS A 90 13.564 3.385 18.740 1.00 18.07 H new ATOM 1397 N ILE A 91 18.239 8.611 16.841 1.00 20.46 N ATOM 1398 CA ILE A 91 19.504 9.176 16.376 1.00 21.30 C ATOM 1399 C ILE A 91 20.368 9.634 17.547 1.00 22.45 C ATOM 1400 O ILE A 91 21.580 9.417 17.553 1.00 23.52 O ATOM 1401 CB ILE A 91 19.282 10.362 15.412 1.00 20.67 C ATOM 1402 CG1 ILE A 91 18.504 9.903 14.178 1.00 19.54 C ATOM 1403 CG2 ILE A 91 20.617 10.975 15.005 1.00 21.70 C ATOM 1404 CD1 ILE A 91 18.067 11.032 13.270 1.00 18.86 C ATOM 0 H ILE A 91 17.410 9.118 16.533 1.00 20.46 H new ATOM 0 HA ILE A 91 20.021 8.381 15.838 1.00 21.30 H new ATOM 0 HB ILE A 91 18.697 11.124 15.927 1.00 20.67 H new ATOM 0 HG12 ILE A 91 19.123 9.211 13.608 1.00 19.54 H new ATOM 0 HG13 ILE A 91 17.623 9.349 14.502 1.00 19.54 H new ATOM 0 HG21 ILE A 91 20.442 11.809 14.326 1.00 21.70 H new ATOM 0 HG22 ILE A 91 21.139 11.333 15.893 1.00 21.70 H new ATOM 0 HG23 ILE A 91 21.226 10.222 14.505 1.00 21.70 H new ATOM 0 HD11 ILE A 91 17.522 10.624 12.419 1.00 18.86 H new ATOM 0 HD12 ILE A 91 17.420 11.714 13.822 1.00 18.86 H new ATOM 0 HD13 ILE A 91 18.944 11.573 12.914 1.00 18.86 H new ATOM 1416 N PHE A 92 19.745 10.264 18.540 1.00 22.30 N ATOM 1417 CA PHE A 92 20.478 10.746 19.708 1.00 23.42 C ATOM 1418 C PHE A 92 20.832 9.606 20.652 1.00 24.20 C ATOM 1419 O PHE A 92 21.885 9.625 21.283 1.00 25.36 O ATOM 1420 CB PHE A 92 19.663 11.781 20.481 1.00 23.12 C ATOM 1421 CG PHE A 92 19.300 13.001 19.687 1.00 22.46 C ATOM 1422 CD1 PHE A 92 20.244 13.986 19.445 1.00 22.15 C ATOM 1423 CD2 PHE A 92 18.016 13.172 19.191 1.00 22.24 C ATOM 1424 CE1 PHE A 92 19.920 15.115 18.722 1.00 21.64 C ATOM 1425 CE2 PHE A 92 17.685 14.303 18.468 1.00 21.74 C ATOM 1426 CZ PHE A 92 18.638 15.276 18.233 1.00 21.45 C ATOM 0 H PHE A 92 18.743 10.452 18.560 1.00 22.30 H new ATOM 0 HA PHE A 92 21.394 11.204 19.335 1.00 23.42 H new ATOM 0 HB2 PHE A 92 18.748 11.311 20.840 1.00 23.12 H new ATOM 0 HB3 PHE A 92 20.229 12.089 21.360 1.00 23.12 H new ATOM 0 HD1 PHE A 92 21.247 13.868 19.828 1.00 22.15 H new ATOM 0 HD2 PHE A 92 17.268 12.414 19.371 1.00 22.24 H new ATOM 0 HE1 PHE A 92 20.668 15.872 18.538 1.00 21.64 H new ATOM 0 HE2 PHE A 92 16.682 14.426 18.087 1.00 21.74 H new ATOM 0 HZ PHE A 92 18.381 16.160 17.668 1.00 21.45 H new ATOM 1436 N ASP A 93 19.957 8.609 20.731 1.00 23.63 N ATOM 1437 CA ASP A 93 20.169 7.476 21.626 1.00 24.39 C ATOM 1438 C ASP A 93 21.404 6.681 21.225 1.00 25.20 C ATOM 1439 O ASP A 93 22.240 6.362 22.071 1.00 26.19 O ATOM 1440 CB ASP A 93 18.938 6.567 21.636 1.00 23.63 C ATOM 1441 CG ASP A 93 18.950 5.579 22.788 1.00 24.48 C ATOM 1442 OD1 ASP A 93 19.981 4.904 22.984 1.00 24.88 O ATOM 1443 OD2 ASP A 93 17.923 5.479 23.493 1.00 24.81 O ATOM 0 H ASP A 93 19.095 8.562 20.187 1.00 23.63 H new ATOM 0 HA ASP A 93 20.329 7.868 22.630 1.00 24.39 H new ATOM 0 HB2 ASP A 93 18.039 7.180 21.698 1.00 23.63 H new ATOM 0 HB3 ASP A 93 18.887 6.020 20.694 1.00 23.63 H new ATOM 1448 N ARG A 94 21.487 6.344 19.939 1.00 24.82 N ATOM 1449 CA ARG A 94 22.612 5.585 19.380 1.00 25.61 C ATOM 1450 C ARG A 94 22.420 4.087 19.576 1.00 25.96 C ATOM 1451 O ARG A 94 22.655 3.294 18.664 1.00 26.03 O ATOM 1452 CB ARG A 94 23.942 6.006 20.013 1.00 26.84 C ATOM 1453 CG ARG A 94 24.246 7.485 19.866 1.00 26.72 C ATOM 1454 CD ARG A 94 25.542 7.855 20.568 1.00 27.97 C ATOM 1455 NE ARG A 94 26.680 7.098 20.051 1.00 28.57 N ATOM 1456 CZ ARG A 94 27.211 7.293 18.847 1.00 29.55 C ATOM 1457 NH1 ARG A 94 26.707 8.213 18.036 1.00 30.03 N ATOM 1458 NH2 ARG A 94 28.248 6.567 18.454 1.00 30.10 N ATOM 0 H ARG A 94 20.775 6.589 19.251 1.00 24.82 H new ATOM 0 HA ARG A 94 22.640 5.807 18.313 1.00 25.61 H new ATOM 0 HB2 ARG A 94 23.927 5.751 21.073 1.00 26.84 H new ATOM 0 HB3 ARG A 94 24.749 5.431 19.558 1.00 26.84 H new ATOM 0 HG2 ARG A 94 24.317 7.740 18.809 1.00 26.72 H new ATOM 0 HG3 ARG A 94 23.425 8.070 20.281 1.00 26.72 H new ATOM 0 HD2 ARG A 94 25.730 8.922 20.444 1.00 27.97 H new ATOM 0 HD3 ARG A 94 25.440 7.671 21.638 1.00 27.97 H new ATOM 0 HE ARG A 94 27.090 6.379 20.647 1.00 28.57 H new ATOM 0 HH11 ARG A 94 25.909 8.774 18.335 1.00 30.03 H new ATOM 0 HH12 ARG A 94 27.117 8.360 17.114 1.00 30.03 H new ATOM 0 HH21 ARG A 94 28.639 5.858 19.075 1.00 30.10 H new ATOM 0 HH22 ARG A 94 28.655 6.717 17.531 1.00 30.10 H new ATOM 1472 N ASP A 95 21.991 3.711 20.776 1.00 26.27 N ATOM 1473 CA ASP A 95 21.778 2.307 21.109 1.00 26.74 C ATOM 1474 C ASP A 95 20.373 1.860 20.723 1.00 25.70 C ATOM 1475 O ASP A 95 20.198 0.918 19.949 1.00 25.63 O ATOM 1476 CB ASP A 95 21.980 2.075 22.607 1.00 27.69 C ATOM 1477 CG ASP A 95 22.940 3.066 23.232 1.00 28.38 C ATOM 1478 OD1 ASP A 95 24.157 2.959 22.978 1.00 28.88 O ATOM 1479 OD2 ASP A 95 22.468 3.951 23.980 1.00 28.47 O ATOM 0 H ASP A 95 21.784 4.360 21.535 1.00 26.27 H new ATOM 0 HA ASP A 95 22.505 1.722 20.546 1.00 26.74 H new ATOM 0 HB2 ASP A 95 21.017 2.141 23.113 1.00 27.69 H new ATOM 0 HB3 ASP A 95 22.355 1.064 22.766 1.00 27.69 H new ATOM 1484 N GLY A 96 19.377 2.546 21.272 1.00 24.96 N ATOM 1485 CA GLY A 96 17.995 2.203 20.994 1.00 24.00 C ATOM 1486 C GLY A 96 17.341 1.489 22.162 1.00 24.47 C ATOM 1487 O GLY A 96 16.472 0.638 21.970 1.00 24.19 O ATOM 0 H GLY A 96 19.502 3.335 21.906 1.00 24.96 H new ATOM 0 HA2 GLY A 96 17.436 3.110 20.764 1.00 24.00 H new ATOM 0 HA3 GLY A 96 17.950 1.568 20.109 1.00 24.00 H new ATOM 1491 N ASP A 97 17.761 1.839 23.375 1.00 25.28 N ATOM 1492 CA ASP A 97 17.217 1.227 24.582 1.00 25.89 C ATOM 1493 C ASP A 97 15.911 1.899 24.982 1.00 25.11 C ATOM 1494 O ASP A 97 15.253 1.486 25.937 1.00 25.54 O ATOM 1495 CB ASP A 97 18.219 1.333 25.735 1.00 27.15 C ATOM 1496 CG ASP A 97 19.657 1.214 25.272 1.00 27.81 C ATOM 1497 OD1 ASP A 97 20.091 0.080 24.975 1.00 28.13 O ATOM 1498 OD2 ASP A 97 20.348 2.252 25.205 1.00 28.07 O ATOM 0 H ASP A 97 18.477 2.544 23.547 1.00 25.28 H new ATOM 0 HA ASP A 97 17.025 0.175 24.369 1.00 25.89 H new ATOM 0 HB2 ASP A 97 18.083 2.288 26.243 1.00 27.15 H new ATOM 0 HB3 ASP A 97 18.011 0.551 26.465 1.00 27.15 H new ATOM 1503 N GLY A 98 15.541 2.938 24.241 1.00 24.03 N ATOM 1504 CA GLY A 98 14.320 3.661 24.532 1.00 23.27 C ATOM 1505 C GLY A 98 14.583 4.922 25.329 1.00 23.53 C ATOM 1506 O GLY A 98 13.667 5.702 25.590 1.00 22.95 O ATOM 0 H GLY A 98 16.067 3.292 23.442 1.00 24.03 H new ATOM 0 HA2 GLY A 98 13.821 3.920 23.598 1.00 23.27 H new ATOM 0 HA3 GLY A 98 13.640 3.016 25.089 1.00 23.27 H new ATOM 1510 N PHE A 99 15.837 5.112 25.734 1.00 24.50 N ATOM 1511 CA PHE A 99 16.224 6.292 26.496 1.00 24.94 C ATOM 1512 C PHE A 99 17.619 6.791 26.112 1.00 25.47 C ATOM 1513 O PHE A 99 18.581 6.020 26.037 1.00 26.19 O ATOM 1514 CB PHE A 99 16.141 6.014 28.002 1.00 25.98 C ATOM 1515 CG PHE A 99 16.291 4.566 28.369 1.00 26.68 C ATOM 1516 CD1 PHE A 99 17.543 3.997 28.541 1.00 27.05 C ATOM 1517 CD2 PHE A 99 15.169 3.776 28.546 1.00 27.04 C ATOM 1518 CE1 PHE A 99 17.668 2.663 28.883 1.00 27.77 C ATOM 1519 CE2 PHE A 99 15.285 2.444 28.886 1.00 27.76 C ATOM 1520 CZ PHE A 99 16.538 1.885 29.056 1.00 28.11 C ATOM 0 H PHE A 99 16.601 4.463 25.546 1.00 24.50 H new ATOM 0 HA PHE A 99 15.519 7.085 26.248 1.00 24.94 H new ATOM 0 HB2 PHE A 99 16.916 6.588 28.509 1.00 25.98 H new ATOM 0 HB3 PHE A 99 15.182 6.374 28.374 1.00 25.98 H new ATOM 0 HD1 PHE A 99 18.428 4.601 28.407 1.00 27.05 H new ATOM 0 HD2 PHE A 99 14.188 4.208 28.416 1.00 27.04 H new ATOM 0 HE1 PHE A 99 18.648 2.229 29.015 1.00 27.77 H new ATOM 0 HE2 PHE A 99 14.400 1.840 29.019 1.00 27.76 H new ATOM 0 HZ PHE A 99 16.634 0.843 29.323 1.00 28.11 H new ATOM 1530 N ILE A 100 17.700 8.098 25.863 1.00 25.18 N ATOM 1531 CA ILE A 100 18.945 8.751 25.487 1.00 25.71 C ATOM 1532 C ILE A 100 19.699 9.244 26.716 1.00 26.98 C ATOM 1533 O ILE A 100 19.240 10.147 27.415 1.00 27.09 O ATOM 1534 CB ILE A 100 18.681 9.969 24.580 1.00 24.88 C ATOM 1535 CG1 ILE A 100 17.882 9.574 23.344 1.00 23.56 C ATOM 1536 CG2 ILE A 100 19.989 10.622 24.170 1.00 25.54 C ATOM 1537 CD1 ILE A 100 17.184 10.749 22.697 1.00 22.62 C ATOM 0 H ILE A 100 16.902 8.730 25.917 1.00 25.18 H new ATOM 0 HA ILE A 100 19.539 8.008 24.955 1.00 25.71 H new ATOM 0 HB ILE A 100 18.092 10.687 25.151 1.00 24.88 H new ATOM 0 HG12 ILE A 100 18.550 9.110 22.618 1.00 23.56 H new ATOM 0 HG13 ILE A 100 17.141 8.824 23.621 1.00 23.56 H new ATOM 0 HG21 ILE A 100 19.782 11.480 23.530 1.00 25.54 H new ATOM 0 HG22 ILE A 100 20.525 10.953 25.060 1.00 25.54 H new ATOM 0 HG23 ILE A 100 20.600 9.902 23.626 1.00 25.54 H new ATOM 0 HD11 ILE A 100 16.631 10.407 21.822 1.00 22.62 H new ATOM 0 HD12 ILE A 100 16.493 11.199 23.410 1.00 22.62 H new ATOM 0 HD13 ILE A 100 17.924 11.489 22.392 1.00 22.62 H new ATOM 1549 N SER A 101 20.854 8.653 26.971 1.00 27.98 N ATOM 1550 CA SER A 101 21.682 9.056 28.097 1.00 29.24 C ATOM 1551 C SER A 101 22.487 10.301 27.727 1.00 29.53 C ATOM 1552 O SER A 101 22.741 10.537 26.550 1.00 29.01 O ATOM 1553 CB SER A 101 22.616 7.911 28.487 1.00 30.23 C ATOM 1554 OG SER A 101 23.683 8.366 29.301 1.00 31.40 O ATOM 0 H SER A 101 21.241 7.892 26.413 1.00 27.98 H new ATOM 0 HA SER A 101 21.045 9.293 28.949 1.00 29.24 H new ATOM 0 HB2 SER A 101 22.052 7.145 29.019 1.00 30.23 H new ATOM 0 HB3 SER A 101 23.017 7.444 27.587 1.00 30.23 H new ATOM 0 HG SER A 101 24.261 7.610 29.535 1.00 31.40 H new ATOM 1560 N PRO A 102 22.879 11.126 28.719 1.00 30.40 N ATOM 1561 CA PRO A 102 23.659 12.340 28.479 1.00 30.84 C ATOM 1562 C PRO A 102 24.679 12.191 27.349 1.00 31.00 C ATOM 1563 O PRO A 102 24.709 12.999 26.426 1.00 30.80 O ATOM 1564 CB PRO A 102 24.359 12.544 29.817 1.00 32.14 C ATOM 1565 CG PRO A 102 23.379 12.049 30.827 1.00 32.10 C ATOM 1566 CD PRO A 102 22.575 10.958 30.155 1.00 31.10 C ATOM 0 HA PRO A 102 23.035 13.175 28.160 1.00 30.84 H new ATOM 0 HB2 PRO A 102 25.295 11.987 29.865 1.00 32.14 H new ATOM 0 HB3 PRO A 102 24.604 13.593 29.982 1.00 32.14 H new ATOM 0 HG2 PRO A 102 23.892 11.664 31.708 1.00 32.10 H new ATOM 0 HG3 PRO A 102 22.729 12.857 31.164 1.00 32.10 H new ATOM 0 HD2 PRO A 102 22.866 9.970 30.512 1.00 31.10 H new ATOM 0 HD3 PRO A 102 21.509 11.068 30.353 1.00 31.10 H new ATOM 1574 N ALA A 103 25.503 11.150 27.418 1.00 31.44 N ATOM 1575 CA ALA A 103 26.522 10.915 26.395 1.00 31.71 C ATOM 1576 C ALA A 103 25.899 10.790 25.005 1.00 30.52 C ATOM 1577 O ALA A 103 26.451 11.273 24.022 1.00 30.50 O ATOM 1578 CB ALA A 103 27.325 9.667 26.730 1.00 32.55 C ATOM 0 H ALA A 103 25.487 10.458 28.167 1.00 31.44 H new ATOM 0 HA ALA A 103 27.191 11.776 26.383 1.00 31.71 H new ATOM 0 HB1 ALA A 103 28.080 9.503 25.961 1.00 32.55 H new ATOM 0 HB2 ALA A 103 27.813 9.797 27.696 1.00 32.55 H new ATOM 0 HB3 ALA A 103 26.658 8.806 26.773 1.00 32.55 H new ATOM 1584 N GLU A 104 24.743 10.143 24.942 1.00 29.57 N ATOM 1585 CA GLU A 104 24.025 9.935 23.684 1.00 28.37 C ATOM 1586 C GLU A 104 23.416 11.239 23.164 1.00 27.59 C ATOM 1587 O GLU A 104 23.576 11.589 21.991 1.00 27.15 O ATOM 1588 CB GLU A 104 22.931 8.890 23.903 1.00 27.67 C ATOM 1589 CG GLU A 104 23.426 7.628 24.594 1.00 28.56 C ATOM 1590 CD GLU A 104 22.296 6.690 24.968 1.00 28.05 C ATOM 1591 OE1 GLU A 104 21.199 6.830 24.392 1.00 28.09 O ATOM 1592 OE2 GLU A 104 22.504 5.820 25.839 1.00 27.67 O ATOM 0 H GLU A 104 24.275 9.747 25.757 1.00 29.57 H new ATOM 0 HA GLU A 104 24.731 9.583 22.932 1.00 28.37 H new ATOM 0 HB2 GLU A 104 22.132 9.331 24.499 1.00 27.67 H new ATOM 0 HB3 GLU A 104 22.498 8.621 22.939 1.00 27.67 H new ATOM 0 HG2 GLU A 104 24.123 7.108 23.937 1.00 28.56 H new ATOM 0 HG3 GLU A 104 23.979 7.903 25.493 1.00 28.56 H new ATOM 1599 N LEU A 105 22.746 11.966 24.050 1.00 27.51 N ATOM 1600 CA LEU A 105 22.090 13.218 23.684 1.00 26.86 C ATOM 1601 C LEU A 105 23.090 14.274 23.223 1.00 27.51 C ATOM 1602 O LEU A 105 22.985 14.793 22.115 1.00 26.94 O ATOM 1603 CB LEU A 105 21.291 13.745 24.881 1.00 26.95 C ATOM 1604 CG LEU A 105 20.836 15.204 24.784 1.00 26.49 C ATOM 1605 CD1 LEU A 105 19.871 15.395 23.625 1.00 25.10 C ATOM 1606 CD2 LEU A 105 20.195 15.641 26.091 1.00 26.84 C ATOM 0 H LEU A 105 22.642 11.710 25.032 1.00 27.51 H new ATOM 0 HA LEU A 105 21.421 13.013 22.848 1.00 26.86 H new ATOM 0 HB2 LEU A 105 20.410 13.117 25.012 1.00 26.95 H new ATOM 0 HB3 LEU A 105 21.899 13.632 25.779 1.00 26.95 H new ATOM 0 HG LEU A 105 21.712 15.826 24.599 1.00 26.49 H new ATOM 0 HD11 LEU A 105 19.562 16.439 23.577 1.00 25.10 H new ATOM 0 HD12 LEU A 105 20.363 15.119 22.692 1.00 25.10 H new ATOM 0 HD13 LEU A 105 18.995 14.764 23.773 1.00 25.10 H new ATOM 0 HD21 LEU A 105 19.876 16.680 26.010 1.00 26.84 H new ATOM 0 HD22 LEU A 105 19.331 15.011 26.301 1.00 26.84 H new ATOM 0 HD23 LEU A 105 20.918 15.546 26.901 1.00 26.84 H new ATOM 1618 N ARG A 106 24.061 14.575 24.075 1.00 28.76 N ATOM 1619 CA ARG A 106 25.071 15.587 23.777 1.00 29.56 C ATOM 1620 C ARG A 106 25.889 15.243 22.540 1.00 29.58 C ATOM 1621 O ARG A 106 25.970 16.020 21.597 1.00 29.39 O ATOM 1622 CB ARG A 106 26.021 15.731 24.963 1.00 30.94 C ATOM 1623 CG ARG A 106 25.315 15.852 26.298 1.00 31.13 C ATOM 1624 CD ARG A 106 26.282 15.657 27.453 1.00 32.40 C ATOM 1625 NE ARG A 106 27.455 16.518 27.338 1.00 32.96 N ATOM 1626 CZ ARG A 106 28.707 16.072 27.412 1.00 33.97 C ATOM 1627 NH1 ARG A 106 28.945 14.778 27.587 1.00 34.53 N ATOM 1628 NH2 ARG A 106 29.720 16.919 27.306 1.00 34.47 N ATOM 0 H ARG A 106 24.172 14.130 24.986 1.00 28.76 H new ATOM 0 HA ARG A 106 24.541 16.520 23.586 1.00 29.56 H new ATOM 0 HB2 ARG A 106 26.686 14.868 24.991 1.00 30.94 H new ATOM 0 HB3 ARG A 106 26.646 16.611 24.812 1.00 30.94 H new ATOM 0 HG2 ARG A 106 24.845 16.832 26.376 1.00 31.13 H new ATOM 0 HG3 ARG A 106 24.518 15.111 26.359 1.00 31.13 H new ATOM 0 HD2 ARG A 106 25.770 15.865 28.393 1.00 32.40 H new ATOM 0 HD3 ARG A 106 26.600 14.615 27.487 1.00 32.40 H new ATOM 0 HE ARG A 106 27.307 17.517 27.193 1.00 32.96 H new ATOM 0 HH11 ARG A 106 28.167 14.122 27.665 1.00 34.53 H new ATOM 0 HH12 ARG A 106 29.905 14.439 27.643 1.00 34.53 H new ATOM 0 HH21 ARG A 106 29.541 17.914 27.168 1.00 34.47 H new ATOM 0 HH22 ARG A 106 30.679 16.577 27.363 1.00 34.47 H new ATOM 1642 N PHE A 107 26.489 14.068 22.564 1.00 29.92 N ATOM 1643 CA PHE A 107 27.350 13.609 21.473 1.00 30.13 C ATOM 1644 C PHE A 107 26.684 13.731 20.109 1.00 29.04 C ATOM 1645 O PHE A 107 27.342 14.058 19.125 1.00 29.31 O ATOM 1646 CB PHE A 107 27.783 12.161 21.705 1.00 30.44 C ATOM 1647 CG PHE A 107 28.690 11.621 20.635 1.00 30.81 C ATOM 1648 CD1 PHE A 107 30.027 11.986 20.593 1.00 30.89 C ATOM 1649 CD2 PHE A 107 28.207 10.749 19.672 1.00 31.17 C ATOM 1650 CE1 PHE A 107 30.864 11.492 19.611 1.00 31.32 C ATOM 1651 CE2 PHE A 107 29.041 10.251 18.688 1.00 31.59 C ATOM 1652 CZ PHE A 107 30.366 10.620 18.655 1.00 31.68 C ATOM 0 H PHE A 107 26.399 13.403 23.332 1.00 29.92 H new ATOM 0 HA PHE A 107 28.224 14.260 21.471 1.00 30.13 H new ATOM 0 HB2 PHE A 107 28.291 12.093 22.667 1.00 30.44 H new ATOM 0 HB3 PHE A 107 26.895 11.532 21.768 1.00 30.44 H new ATOM 0 HD1 PHE A 107 30.419 12.664 21.337 1.00 30.89 H new ATOM 0 HD2 PHE A 107 27.168 10.455 19.690 1.00 31.17 H new ATOM 0 HE1 PHE A 107 31.903 11.784 19.588 1.00 31.32 H new ATOM 0 HE2 PHE A 107 28.652 9.571 17.944 1.00 31.59 H new ATOM 0 HZ PHE A 107 31.017 10.231 17.886 1.00 31.68 H new ATOM 1662 N VAL A 108 25.383 13.483 20.042 1.00 27.85 N ATOM 1663 CA VAL A 108 24.682 13.550 18.768 1.00 26.77 C ATOM 1664 C VAL A 108 24.230 14.970 18.431 1.00 26.50 C ATOM 1665 O VAL A 108 24.442 15.445 17.315 1.00 26.41 O ATOM 1666 CB VAL A 108 23.469 12.606 18.747 1.00 25.58 C ATOM 1667 CG1 VAL A 108 22.668 12.799 17.472 1.00 24.43 C ATOM 1668 CG2 VAL A 108 23.919 11.159 18.885 1.00 25.89 C ATOM 0 H VAL A 108 24.799 13.237 20.842 1.00 27.85 H new ATOM 0 HA VAL A 108 25.396 13.231 18.009 1.00 26.77 H new ATOM 0 HB VAL A 108 22.827 12.848 19.594 1.00 25.58 H new ATOM 0 HG11 VAL A 108 21.813 12.123 17.474 1.00 24.43 H new ATOM 0 HG12 VAL A 108 22.316 13.829 17.416 1.00 24.43 H new ATOM 0 HG13 VAL A 108 23.299 12.584 16.610 1.00 24.43 H new ATOM 0 HG21 VAL A 108 23.048 10.504 18.868 1.00 25.89 H new ATOM 0 HG22 VAL A 108 24.581 10.903 18.058 1.00 25.89 H new ATOM 0 HG23 VAL A 108 24.451 11.032 19.828 1.00 25.89 H new ATOM 1678 N MET A 109 23.610 15.646 19.390 1.00 26.48 N ATOM 1679 CA MET A 109 23.124 17.003 19.167 1.00 26.33 C ATOM 1680 C MET A 109 24.271 17.982 18.927 1.00 27.50 C ATOM 1681 O MET A 109 24.093 19.006 18.267 1.00 27.46 O ATOM 1682 CB MET A 109 22.281 17.465 20.351 1.00 26.26 C ATOM 1683 CG MET A 109 23.074 17.673 21.630 1.00 27.48 C ATOM 1684 SD MET A 109 22.008 17.986 23.049 1.00 27.39 S ATOM 1685 CE MET A 109 21.111 19.436 22.496 1.00 26.90 C ATOM 0 H MET A 109 23.432 15.280 20.325 1.00 26.48 H new ATOM 0 HA MET A 109 22.506 16.987 18.269 1.00 26.33 H new ATOM 0 HB2 MET A 109 21.784 18.399 20.088 1.00 26.26 H new ATOM 0 HB3 MET A 109 21.499 16.729 20.536 1.00 26.26 H new ATOM 0 HG2 MET A 109 23.685 16.791 21.824 1.00 27.48 H new ATOM 0 HG3 MET A 109 23.758 18.512 21.499 1.00 27.48 H new ATOM 0 HE1 MET A 109 21.012 20.140 23.322 1.00 26.90 H new ATOM 0 HE2 MET A 109 21.654 19.910 21.678 1.00 26.90 H new ATOM 0 HE3 MET A 109 20.120 19.141 22.151 1.00 26.90 H new ATOM 1695 N ILE A 110 25.443 17.666 19.465 1.00 28.57 N ATOM 1696 CA ILE A 110 26.611 18.525 19.309 1.00 29.77 C ATOM 1697 C ILE A 110 27.382 18.193 18.039 1.00 29.90 C ATOM 1698 O ILE A 110 27.867 19.088 17.346 1.00 30.43 O ATOM 1699 CB ILE A 110 27.562 18.413 20.519 1.00 30.96 C ATOM 1700 CG1 ILE A 110 26.830 18.789 21.809 1.00 31.00 C ATOM 1701 CG2 ILE A 110 28.780 19.304 20.322 1.00 32.20 C ATOM 1702 CD1 ILE A 110 27.575 18.392 23.066 1.00 32.05 C ATOM 0 H ILE A 110 25.610 16.822 20.013 1.00 28.57 H new ATOM 0 HA ILE A 110 26.237 19.547 19.243 1.00 29.77 H new ATOM 0 HB ILE A 110 27.899 17.379 20.600 1.00 30.96 H new ATOM 0 HG12 ILE A 110 26.662 19.866 21.821 1.00 31.00 H new ATOM 0 HG13 ILE A 110 25.849 18.313 21.812 1.00 31.00 H new ATOM 0 HG21 ILE A 110 29.440 19.213 21.184 1.00 32.20 H new ATOM 0 HG22 ILE A 110 29.314 18.997 19.422 1.00 32.20 H new ATOM 0 HG23 ILE A 110 28.459 20.341 20.218 1.00 32.20 H new ATOM 0 HD11 ILE A 110 26.997 18.690 23.941 1.00 32.05 H new ATOM 0 HD12 ILE A 110 27.720 17.312 23.077 1.00 32.05 H new ATOM 0 HD13 ILE A 110 28.545 18.888 23.086 1.00 32.05 H new ATOM 1714 N ASN A 111 27.494 16.904 17.732 1.00 29.51 N ATOM 1715 CA ASN A 111 28.214 16.473 16.542 1.00 29.69 C ATOM 1716 C ASN A 111 27.510 16.940 15.275 1.00 28.92 C ATOM 1717 O ASN A 111 28.159 17.229 14.271 1.00 29.42 O ATOM 1718 CB ASN A 111 28.374 14.950 16.525 1.00 29.42 C ATOM 1719 CG ASN A 111 29.526 14.474 17.391 1.00 30.42 C ATOM 1720 OD1 ASN A 111 30.132 13.438 17.121 1.00 30.38 O ATOM 1721 ND2 ASN A 111 29.833 15.229 18.441 1.00 31.39 N ATOM 0 H ASN A 111 27.098 16.146 18.287 1.00 29.51 H new ATOM 0 HA ASN A 111 29.204 16.928 16.572 1.00 29.69 H new ATOM 0 HB2 ASN A 111 27.449 14.487 16.871 1.00 29.42 H new ATOM 0 HB3 ASN A 111 28.533 14.617 15.500 1.00 29.42 H new ATOM 0 HD21 ASN A 111 30.597 14.956 19.059 1.00 31.39 H new ATOM 0 HD22 ASN A 111 29.304 16.081 18.629 1.00 31.39 H new ATOM 1728 N LEU A 112 26.181 17.016 15.319 1.00 27.75 N ATOM 1729 CA LEU A 112 25.423 17.454 14.154 1.00 26.97 C ATOM 1730 C LEU A 112 25.709 18.921 13.833 1.00 27.67 C ATOM 1731 O LEU A 112 26.017 19.257 12.689 1.00 27.59 O ATOM 1732 CB LEU A 112 23.914 17.201 14.337 1.00 25.59 C ATOM 1733 CG LEU A 112 23.184 18.061 15.374 1.00 25.50 C ATOM 1734 CD1 LEU A 112 22.705 19.369 14.757 1.00 25.51 C ATOM 1735 CD2 LEU A 112 22.004 17.294 15.948 1.00 24.36 C ATOM 0 H LEU A 112 25.616 16.784 16.136 1.00 27.75 H new ATOM 0 HA LEU A 112 25.750 16.858 13.302 1.00 26.97 H new ATOM 0 HB2 LEU A 112 23.427 17.347 13.373 1.00 25.59 H new ATOM 0 HB3 LEU A 112 23.777 16.154 14.608 1.00 25.59 H new ATOM 0 HG LEU A 112 23.884 18.297 16.176 1.00 25.50 H new ATOM 0 HD11 LEU A 112 22.190 19.961 15.514 1.00 25.51 H new ATOM 0 HD12 LEU A 112 23.561 19.928 14.379 1.00 25.51 H new ATOM 0 HD13 LEU A 112 22.021 19.155 13.936 1.00 25.51 H new ATOM 0 HD21 LEU A 112 21.491 17.913 16.684 1.00 24.36 H new ATOM 0 HD22 LEU A 112 21.313 17.036 15.146 1.00 24.36 H new ATOM 0 HD23 LEU A 112 22.361 16.382 16.426 1.00 24.36 H new ATOM 1747 N GLY A 113 25.607 19.796 14.835 1.00 28.44 N ATOM 1748 CA GLY A 113 25.870 21.207 14.599 1.00 29.23 C ATOM 1749 C GLY A 113 25.392 22.129 15.709 1.00 29.21 C ATOM 1750 O GLY A 113 24.788 23.166 15.427 1.00 29.01 O ATOM 0 H GLY A 113 25.351 19.557 15.793 1.00 28.44 H new ATOM 0 HA2 GLY A 113 26.943 21.347 14.464 1.00 29.23 H new ATOM 0 HA3 GLY A 113 25.390 21.502 13.666 1.00 29.23 H new ATOM 1754 N GLU A 114 25.658 21.778 16.967 1.00 29.51 N ATOM 1755 CA GLU A 114 25.236 22.613 18.088 1.00 29.65 C ATOM 1756 C GLU A 114 26.231 22.535 19.240 1.00 30.86 C ATOM 1757 O GLU A 114 26.350 21.508 19.905 1.00 31.02 O ATOM 1758 CB GLU A 114 23.846 22.201 18.579 1.00 28.56 C ATOM 1759 CG GLU A 114 22.766 22.277 17.511 1.00 27.33 C ATOM 1760 CD GLU A 114 21.381 22.002 18.062 1.00 26.52 C ATOM 1761 OE1 GLU A 114 21.004 20.814 18.155 1.00 26.29 O ATOM 1762 OE2 GLU A 114 20.674 22.973 18.401 1.00 26.19 O ATOM 0 H GLU A 114 26.159 20.930 17.233 1.00 29.51 H new ATOM 0 HA GLU A 114 25.197 23.642 17.732 1.00 29.65 H new ATOM 0 HB2 GLU A 114 23.894 21.181 18.961 1.00 28.56 H new ATOM 0 HB3 GLU A 114 23.562 22.841 19.414 1.00 28.56 H new ATOM 0 HG2 GLU A 114 22.781 23.266 17.054 1.00 27.33 H new ATOM 0 HG3 GLU A 114 22.989 21.558 16.723 1.00 27.33 H new ATOM 1769 N LYS A 115 26.937 23.635 19.480 1.00 31.76 N ATOM 1770 CA LYS A 115 27.916 23.690 20.560 1.00 32.97 C ATOM 1771 C LYS A 115 27.215 23.969 21.879 1.00 32.97 C ATOM 1772 O LYS A 115 27.179 25.106 22.354 1.00 33.55 O ATOM 1773 CB LYS A 115 28.969 24.764 20.277 1.00 34.07 C ATOM 1774 CG LYS A 115 29.477 24.758 18.842 1.00 34.37 C ATOM 1775 CD LYS A 115 30.156 23.443 18.490 1.00 34.03 C ATOM 1776 CE LYS A 115 30.415 23.338 16.996 1.00 34.21 C ATOM 1777 NZ LYS A 115 29.153 23.424 16.210 1.00 34.46 N ATOM 0 H LYS A 115 26.850 24.498 18.943 1.00 31.76 H new ATOM 0 HA LYS A 115 28.421 22.726 20.625 1.00 32.97 H new ATOM 0 HB2 LYS A 115 28.545 25.743 20.499 1.00 34.07 H new ATOM 0 HB3 LYS A 115 29.812 24.621 20.953 1.00 34.07 H new ATOM 0 HG2 LYS A 115 28.644 24.931 18.161 1.00 34.37 H new ATOM 0 HG3 LYS A 115 30.180 25.579 18.701 1.00 34.37 H new ATOM 0 HD2 LYS A 115 31.099 23.362 19.031 1.00 34.03 H new ATOM 0 HD3 LYS A 115 29.530 22.611 18.812 1.00 34.03 H new ATOM 0 HE2 LYS A 115 31.091 24.135 16.687 1.00 34.21 H new ATOM 0 HE3 LYS A 115 30.915 22.394 16.779 1.00 34.21 H new ATOM 0 HZ1 LYS A 115 29.301 23.006 15.269 1.00 34.46 H new ATOM 0 HZ2 LYS A 115 28.400 22.905 16.705 1.00 34.46 H new ATOM 0 HZ3 LYS A 115 28.876 24.421 16.106 1.00 34.46 H new ATOM 1791 N VAL A 116 26.655 22.918 22.465 1.00 32.39 N ATOM 1792 CA VAL A 116 25.933 23.037 23.720 1.00 32.39 C ATOM 1793 C VAL A 116 26.836 22.758 24.916 1.00 33.53 C ATOM 1794 O VAL A 116 27.775 21.965 24.834 1.00 33.96 O ATOM 1795 CB VAL A 116 24.729 22.071 23.762 1.00 31.13 C ATOM 1796 CG1 VAL A 116 24.090 21.941 22.388 1.00 29.96 C ATOM 1797 CG2 VAL A 116 25.141 20.708 24.297 1.00 31.21 C ATOM 0 H VAL A 116 26.689 21.971 22.087 1.00 32.39 H new ATOM 0 HA VAL A 116 25.576 24.065 23.780 1.00 32.39 H new ATOM 0 HB VAL A 116 23.988 22.490 24.443 1.00 31.13 H new ATOM 0 HG11 VAL A 116 23.244 21.255 22.443 1.00 29.96 H new ATOM 0 HG12 VAL A 116 23.743 22.919 22.054 1.00 29.96 H new ATOM 0 HG13 VAL A 116 24.824 21.555 21.680 1.00 29.96 H new ATOM 0 HG21 VAL A 116 24.274 20.047 24.316 1.00 31.21 H new ATOM 0 HG22 VAL A 116 25.909 20.281 23.652 1.00 31.21 H new ATOM 0 HG23 VAL A 116 25.536 20.818 25.307 1.00 31.21 H new ATOM 1807 N THR A 117 26.546 23.428 26.021 1.00 34.07 N ATOM 1808 CA THR A 117 27.303 23.246 27.251 1.00 35.18 C ATOM 1809 C THR A 117 26.673 22.154 28.110 1.00 34.78 C ATOM 1810 O THR A 117 25.478 21.882 27.998 1.00 33.80 O ATOM 1811 CB THR A 117 27.374 24.551 28.065 1.00 36.10 C ATOM 1812 OG1 THR A 117 26.059 25.089 28.244 1.00 35.42 O ATOM 1813 CG2 THR A 117 28.256 25.575 27.368 1.00 36.81 C ATOM 0 H THR A 117 25.788 24.106 26.091 1.00 34.07 H new ATOM 0 HA THR A 117 28.314 22.953 26.970 1.00 35.18 H new ATOM 0 HB THR A 117 27.808 24.323 29.039 1.00 36.10 H new ATOM 0 HG1 THR A 117 26.123 25.991 28.621 1.00 35.42 H new ATOM 0 HG21 THR A 117 28.291 26.489 27.961 1.00 36.81 H new ATOM 0 HG22 THR A 117 29.264 25.174 27.260 1.00 36.81 H new ATOM 0 HG23 THR A 117 27.846 25.798 26.383 1.00 36.81 H new ATOM 1821 N ASP A 118 27.474 21.522 28.955 1.00 35.59 N ATOM 1822 CA ASP A 118 26.978 20.461 29.824 1.00 35.40 C ATOM 1823 C ASP A 118 25.802 20.942 30.672 1.00 35.21 C ATOM 1824 O ASP A 118 24.852 20.197 30.913 1.00 34.50 O ATOM 1825 CB ASP A 118 28.098 19.963 30.739 1.00 36.59 C ATOM 1826 CG ASP A 118 29.201 19.259 29.973 1.00 36.85 C ATOM 1827 OD1 ASP A 118 30.148 19.944 29.533 1.00 36.95 O ATOM 1828 OD2 ASP A 118 29.116 18.024 29.810 1.00 37.02 O ATOM 0 H ASP A 118 28.468 21.724 29.059 1.00 35.59 H new ATOM 0 HA ASP A 118 26.634 19.645 29.189 1.00 35.40 H new ATOM 0 HB2 ASP A 118 28.520 20.807 31.284 1.00 36.59 H new ATOM 0 HB3 ASP A 118 27.682 19.281 31.480 1.00 36.59 H new ATOM 1833 N GLU A 119 25.875 22.190 31.120 1.00 35.91 N ATOM 1834 CA GLU A 119 24.833 22.772 31.959 1.00 35.91 C ATOM 1835 C GLU A 119 23.456 22.762 31.294 1.00 34.60 C ATOM 1836 O GLU A 119 22.476 22.335 31.907 1.00 34.24 O ATOM 1837 CB GLU A 119 25.210 24.201 32.355 1.00 36.90 C ATOM 1838 CG GLU A 119 25.494 25.109 31.170 1.00 36.71 C ATOM 1839 CD GLU A 119 25.856 26.519 31.588 1.00 37.77 C ATOM 1840 OE1 GLU A 119 27.058 26.787 31.797 1.00 38.19 O ATOM 1841 OE2 GLU A 119 24.938 27.358 31.705 1.00 38.22 O ATOM 0 H GLU A 119 26.649 22.822 30.915 1.00 35.91 H new ATOM 0 HA GLU A 119 24.762 22.146 32.849 1.00 35.91 H new ATOM 0 HB2 GLU A 119 24.400 24.631 32.945 1.00 36.90 H new ATOM 0 HB3 GLU A 119 26.090 24.170 32.997 1.00 36.90 H new ATOM 0 HG2 GLU A 119 26.310 24.688 30.582 1.00 36.71 H new ATOM 0 HG3 GLU A 119 24.617 25.140 30.523 1.00 36.71 H new ATOM 1848 N GLU A 120 23.363 23.226 30.049 1.00 33.92 N ATOM 1849 CA GLU A 120 22.073 23.251 29.370 1.00 32.68 C ATOM 1850 C GLU A 120 21.577 21.829 29.162 1.00 31.73 C ATOM 1851 O GLU A 120 20.375 21.567 29.179 1.00 30.88 O ATOM 1852 CB GLU A 120 22.148 24.010 28.043 1.00 32.23 C ATOM 1853 CG GLU A 120 23.220 23.505 27.097 1.00 31.98 C ATOM 1854 CD GLU A 120 23.276 24.302 25.809 1.00 31.39 C ATOM 1855 OE1 GLU A 120 22.443 24.044 24.914 1.00 31.03 O ATOM 1856 OE2 GLU A 120 24.154 25.183 25.694 1.00 31.34 O ATOM 0 H GLU A 120 24.147 23.582 29.502 1.00 33.92 H new ATOM 0 HA GLU A 120 21.362 23.785 30.000 1.00 32.68 H new ATOM 0 HB2 GLU A 120 21.180 23.945 27.545 1.00 32.23 H new ATOM 0 HB3 GLU A 120 22.330 25.065 28.250 1.00 32.23 H new ATOM 0 HG2 GLU A 120 24.190 23.552 27.593 1.00 31.98 H new ATOM 0 HG3 GLU A 120 23.031 22.457 26.865 1.00 31.98 H new ATOM 1863 N ILE A 121 22.518 20.914 28.963 1.00 31.93 N ATOM 1864 CA ILE A 121 22.189 19.507 28.793 1.00 31.19 C ATOM 1865 C ILE A 121 21.480 18.962 30.034 1.00 31.38 C ATOM 1866 O ILE A 121 20.406 18.372 29.931 1.00 30.48 O ATOM 1867 CB ILE A 121 23.454 18.665 28.510 1.00 31.66 C ATOM 1868 CG1 ILE A 121 23.992 18.960 27.104 1.00 31.30 C ATOM 1869 CG2 ILE A 121 23.165 17.178 28.669 1.00 31.21 C ATOM 1870 CD1 ILE A 121 22.970 18.753 26.009 1.00 29.89 C ATOM 0 H ILE A 121 23.515 21.123 28.916 1.00 31.93 H new ATOM 0 HA ILE A 121 21.520 19.431 27.936 1.00 31.19 H new ATOM 0 HB ILE A 121 24.216 18.942 29.239 1.00 31.66 H new ATOM 0 HG12 ILE A 121 24.347 19.990 27.069 1.00 31.30 H new ATOM 0 HG13 ILE A 121 24.853 18.320 26.912 1.00 31.30 H new ATOM 0 HG21 ILE A 121 24.071 16.607 28.464 1.00 31.21 H new ATOM 0 HG22 ILE A 121 22.833 16.979 29.688 1.00 31.21 H new ATOM 0 HG23 ILE A 121 22.384 16.882 27.969 1.00 31.21 H new ATOM 0 HD11 ILE A 121 23.421 18.980 25.043 1.00 29.89 H new ATOM 0 HD12 ILE A 121 22.633 17.717 26.017 1.00 29.89 H new ATOM 0 HD13 ILE A 121 22.119 19.413 26.176 1.00 29.89 H new ATOM 1882 N ASP A 122 22.086 19.152 31.206 1.00 32.59 N ATOM 1883 CA ASP A 122 21.489 18.665 32.449 1.00 32.95 C ATOM 1884 C ASP A 122 20.109 19.273 32.672 1.00 32.41 C ATOM 1885 O ASP A 122 19.241 18.653 33.286 1.00 32.19 O ATOM 1886 CB ASP A 122 22.393 18.976 33.649 1.00 34.41 C ATOM 1887 CG ASP A 122 22.263 20.404 34.147 1.00 35.02 C ATOM 1888 OD1 ASP A 122 21.187 20.752 34.672 1.00 35.33 O ATOM 1889 OD2 ASP A 122 23.231 21.180 33.995 1.00 35.24 O ATOM 0 H ASP A 122 22.978 19.633 31.321 1.00 32.59 H new ATOM 0 HA ASP A 122 21.382 17.584 32.358 1.00 32.95 H new ATOM 0 HB2 ASP A 122 22.152 18.292 34.463 1.00 34.41 H new ATOM 0 HB3 ASP A 122 23.430 18.789 33.371 1.00 34.41 H new ATOM 1894 N GLU A 123 19.915 20.488 32.169 1.00 32.28 N ATOM 1895 CA GLU A 123 18.648 21.192 32.329 1.00 31.88 C ATOM 1896 C GLU A 123 17.499 20.461 31.638 1.00 30.51 C ATOM 1897 O GLU A 123 16.486 20.153 32.264 1.00 30.32 O ATOM 1898 CB GLU A 123 18.768 22.616 31.783 1.00 32.05 C ATOM 1899 CG GLU A 123 17.447 23.366 31.745 1.00 31.72 C ATOM 1900 CD GLU A 123 17.633 24.865 31.613 1.00 32.49 C ATOM 1901 OE1 GLU A 123 17.748 25.351 30.468 1.00 32.69 O ATOM 1902 OE2 GLU A 123 17.663 25.553 32.655 1.00 32.95 O ATOM 0 H GLU A 123 20.621 21.006 31.646 1.00 32.28 H new ATOM 0 HA GLU A 123 18.422 21.227 33.395 1.00 31.88 H new ATOM 0 HB2 GLU A 123 19.475 23.173 32.397 1.00 32.05 H new ATOM 0 HB3 GLU A 123 19.183 22.576 30.776 1.00 32.05 H new ATOM 0 HG2 GLU A 123 16.851 23.002 30.908 1.00 31.72 H new ATOM 0 HG3 GLU A 123 16.885 23.152 32.654 1.00 31.72 H new ATOM 1909 N MET A 124 17.651 20.198 30.346 1.00 29.62 N ATOM 1910 CA MET A 124 16.606 19.514 29.591 1.00 28.28 C ATOM 1911 C MET A 124 16.315 18.126 30.159 1.00 28.13 C ATOM 1912 O MET A 124 15.154 17.740 30.297 1.00 27.52 O ATOM 1913 CB MET A 124 16.989 19.408 28.111 1.00 27.46 C ATOM 1914 CG MET A 124 18.424 18.974 27.872 1.00 28.01 C ATOM 1915 SD MET A 124 18.828 18.850 26.118 1.00 27.29 S ATOM 1916 CE MET A 124 18.402 20.493 25.547 1.00 26.32 C ATOM 0 H MET A 124 18.478 20.444 29.803 1.00 29.62 H new ATOM 0 HA MET A 124 15.698 20.110 29.681 1.00 28.28 H new ATOM 0 HB2 MET A 124 16.320 18.699 27.624 1.00 27.46 H new ATOM 0 HB3 MET A 124 16.829 20.376 27.635 1.00 27.46 H new ATOM 0 HG2 MET A 124 19.099 19.686 28.347 1.00 28.01 H new ATOM 0 HG3 MET A 124 18.592 18.008 28.349 1.00 28.01 H new ATOM 0 HE1 MET A 124 18.894 20.686 24.594 1.00 26.32 H new ATOM 0 HE2 MET A 124 17.322 20.565 25.419 1.00 26.32 H new ATOM 0 HE3 MET A 124 18.730 21.230 26.281 1.00 26.32 H new ATOM 1926 N ILE A 125 17.367 17.377 30.485 1.00 28.78 N ATOM 1927 CA ILE A 125 17.198 16.029 31.023 1.00 28.80 C ATOM 1928 C ILE A 125 16.393 16.018 32.317 1.00 29.32 C ATOM 1929 O ILE A 125 15.367 15.355 32.405 1.00 28.74 O ATOM 1930 CB ILE A 125 18.552 15.346 31.307 1.00 29.69 C ATOM 1931 CG1 ILE A 125 19.418 15.319 30.044 1.00 29.31 C ATOM 1932 CG2 ILE A 125 18.319 13.933 31.836 1.00 29.77 C ATOM 1933 CD1 ILE A 125 20.828 14.823 30.276 1.00 30.29 C ATOM 0 H ILE A 125 18.337 17.677 30.387 1.00 28.78 H new ATOM 0 HA ILE A 125 16.658 15.480 30.251 1.00 28.80 H new ATOM 0 HB ILE A 125 19.085 15.919 32.066 1.00 29.69 H new ATOM 0 HG12 ILE A 125 18.938 14.683 29.300 1.00 29.31 H new ATOM 0 HG13 ILE A 125 19.462 16.324 29.624 1.00 29.31 H new ATOM 0 HG21 ILE A 125 19.279 13.456 32.035 1.00 29.77 H new ATOM 0 HG22 ILE A 125 17.740 13.981 32.758 1.00 29.77 H new ATOM 0 HG23 ILE A 125 17.772 13.352 31.093 1.00 29.77 H new ATOM 0 HD11 ILE A 125 21.377 14.834 29.334 1.00 30.29 H new ATOM 0 HD12 ILE A 125 21.328 15.472 30.995 1.00 30.29 H new ATOM 0 HD13 ILE A 125 20.796 13.806 30.666 1.00 30.29 H new ATOM 1945 N ARG A 126 16.868 16.755 33.315 1.00 30.48 N ATOM 1946 CA ARG A 126 16.209 16.811 34.619 1.00 31.17 C ATOM 1947 C ARG A 126 14.719 17.148 34.513 1.00 30.45 C ATOM 1948 O ARG A 126 13.886 16.510 35.158 1.00 30.52 O ATOM 1949 CB ARG A 126 16.913 17.831 35.521 1.00 32.45 C ATOM 1950 CG ARG A 126 16.799 19.266 35.037 1.00 32.40 C ATOM 1951 CD ARG A 126 17.421 20.241 36.023 1.00 33.74 C ATOM 1952 NE ARG A 126 17.315 21.623 35.562 1.00 34.27 N ATOM 1953 CZ ARG A 126 17.947 22.643 36.135 1.00 35.37 C ATOM 1954 NH1 ARG A 126 18.734 22.437 37.183 1.00 36.06 N ATOM 1955 NH2 ARG A 126 17.795 23.871 35.657 1.00 35.85 N ATOM 0 H ARG A 126 17.711 17.325 33.247 1.00 30.48 H new ATOM 0 HA ARG A 126 16.283 15.816 35.057 1.00 31.17 H new ATOM 0 HB2 ARG A 126 16.494 17.763 36.525 1.00 32.45 H new ATOM 0 HB3 ARG A 126 17.968 17.567 35.597 1.00 32.45 H new ATOM 0 HG2 ARG A 126 17.290 19.364 34.069 1.00 32.40 H new ATOM 0 HG3 ARG A 126 15.749 19.518 34.889 1.00 32.40 H new ATOM 0 HD2 ARG A 126 16.929 20.142 36.991 1.00 33.74 H new ATOM 0 HD3 ARG A 126 18.471 19.987 36.172 1.00 33.74 H new ATOM 0 HE ARG A 126 16.722 21.817 34.755 1.00 34.27 H new ATOM 0 HH11 ARG A 126 18.856 21.494 37.552 1.00 36.06 H new ATOM 0 HH12 ARG A 126 19.217 23.222 37.620 1.00 36.06 H new ATOM 0 HH21 ARG A 126 17.193 24.033 34.850 1.00 35.85 H new ATOM 0 HH22 ARG A 126 18.280 24.653 36.097 1.00 35.85 H new ATOM 1969 N GLU A 127 14.388 18.148 33.702 1.00 29.84 N ATOM 1970 CA GLU A 127 13.002 18.584 33.545 1.00 29.22 C ATOM 1971 C GLU A 127 12.102 17.499 32.955 1.00 28.15 C ATOM 1972 O GLU A 127 10.976 17.309 33.414 1.00 28.09 O ATOM 1973 CB GLU A 127 12.937 19.830 32.663 1.00 28.76 C ATOM 1974 CG GLU A 127 11.731 20.712 32.956 1.00 28.80 C ATOM 1975 CD GLU A 127 11.840 22.082 32.317 1.00 28.73 C ATOM 1976 OE1 GLU A 127 12.696 22.877 32.759 1.00 28.70 O ATOM 1977 OE2 GLU A 127 11.069 22.361 31.375 1.00 28.78 O ATOM 0 H GLU A 127 15.060 18.673 33.142 1.00 29.84 H new ATOM 0 HA GLU A 127 12.632 18.809 34.545 1.00 29.22 H new ATOM 0 HB2 GLU A 127 13.847 20.413 32.802 1.00 28.76 H new ATOM 0 HB3 GLU A 127 12.910 19.525 31.617 1.00 28.76 H new ATOM 0 HG2 GLU A 127 10.829 20.218 32.596 1.00 28.80 H new ATOM 0 HG3 GLU A 127 11.623 20.826 34.035 1.00 28.80 H new ATOM 1984 N ALA A 128 12.592 16.787 31.945 1.00 27.36 N ATOM 1985 CA ALA A 128 11.794 15.751 31.302 1.00 26.33 C ATOM 1986 C ALA A 128 11.979 14.392 31.967 1.00 26.81 C ATOM 1987 O ALA A 128 11.141 13.508 31.812 1.00 26.28 O ATOM 1988 CB ALA A 128 12.129 15.669 29.819 1.00 25.22 C ATOM 0 H ALA A 128 13.528 16.907 31.558 1.00 27.36 H new ATOM 0 HA ALA A 128 10.746 16.028 31.416 1.00 26.33 H new ATOM 0 HB1 ALA A 128 11.525 14.891 29.352 1.00 25.22 H new ATOM 0 HB2 ALA A 128 11.916 16.627 29.344 1.00 25.22 H new ATOM 0 HB3 ALA A 128 13.186 15.430 29.697 1.00 25.22 H new ATOM 1994 N ASP A 129 13.065 14.234 32.716 1.00 27.88 N ATOM 1995 CA ASP A 129 13.349 12.970 33.390 1.00 28.48 C ATOM 1996 C ASP A 129 12.350 12.708 34.508 1.00 29.02 C ATOM 1997 O ASP A 129 12.666 12.850 35.691 1.00 30.17 O ATOM 1998 CB ASP A 129 14.768 12.962 33.949 1.00 29.57 C ATOM 1999 CG ASP A 129 15.160 11.599 34.476 1.00 30.10 C ATOM 2000 OD1 ASP A 129 14.972 10.606 33.743 1.00 30.56 O ATOM 2001 OD2 ASP A 129 15.654 11.527 35.625 1.00 30.12 O ATOM 0 H ASP A 129 13.762 14.962 32.872 1.00 27.88 H new ATOM 0 HA ASP A 129 13.257 12.174 32.651 1.00 28.48 H new ATOM 0 HB2 ASP A 129 15.467 13.264 33.169 1.00 29.57 H new ATOM 0 HB3 ASP A 129 14.847 13.697 34.750 1.00 29.57 H new ATOM 2006 N PHE A 130 11.145 12.326 34.120 1.00 28.23 N ATOM 2007 CA PHE A 130 10.079 12.041 35.073 1.00 28.72 C ATOM 2008 C PHE A 130 10.329 10.731 35.813 1.00 29.48 C ATOM 2009 O PHE A 130 10.068 10.626 37.012 1.00 30.47 O ATOM 2010 CB PHE A 130 8.732 11.971 34.352 1.00 27.68 C ATOM 2011 CG PHE A 130 8.363 13.239 33.632 1.00 26.94 C ATOM 2012 CD1 PHE A 130 8.214 14.428 34.327 1.00 26.82 C ATOM 2013 CD2 PHE A 130 8.174 13.242 32.259 1.00 26.44 C ATOM 2014 CE1 PHE A 130 7.878 15.596 33.667 1.00 26.23 C ATOM 2015 CE2 PHE A 130 7.839 14.406 31.594 1.00 25.82 C ATOM 2016 CZ PHE A 130 7.672 15.579 32.301 1.00 25.72 C ATOM 0 H PHE A 130 10.876 12.205 33.144 1.00 28.23 H new ATOM 0 HA PHE A 130 10.063 12.850 35.803 1.00 28.72 H new ATOM 0 HB2 PHE A 130 8.756 11.151 33.635 1.00 27.68 H new ATOM 0 HB3 PHE A 130 7.953 11.737 35.078 1.00 27.68 H new ATOM 0 HD1 PHE A 130 8.362 14.443 35.397 1.00 26.82 H new ATOM 0 HD2 PHE A 130 8.290 12.324 31.702 1.00 26.44 H new ATOM 0 HE1 PHE A 130 7.777 16.519 34.218 1.00 26.23 H new ATOM 0 HE2 PHE A 130 7.708 14.398 30.522 1.00 25.82 H new ATOM 0 HZ PHE A 130 7.381 16.483 31.787 1.00 25.72 H new ATOM 2026 N ASP A 131 10.837 9.735 35.093 1.00 29.07 N ATOM 2027 CA ASP A 131 11.105 8.425 35.684 1.00 29.81 C ATOM 2028 C ASP A 131 12.298 8.493 36.631 1.00 31.01 C ATOM 2029 O ASP A 131 12.644 7.508 37.284 1.00 31.82 O ATOM 2030 CB ASP A 131 11.412 7.395 34.600 1.00 29.11 C ATOM 2031 CG ASP A 131 10.806 7.737 33.256 1.00 27.70 C ATOM 2032 OD1 ASP A 131 9.562 7.722 33.139 1.00 27.01 O ATOM 2033 OD2 ASP A 131 11.584 8.024 32.318 1.00 27.31 O ATOM 0 H ASP A 131 11.071 9.808 34.103 1.00 29.07 H new ATOM 0 HA ASP A 131 10.212 8.128 36.234 1.00 29.81 H new ATOM 0 HB2 ASP A 131 12.493 7.305 34.490 1.00 29.11 H new ATOM 0 HB3 ASP A 131 11.042 6.421 34.920 1.00 29.11 H new ATOM 2038 N GLY A 132 12.919 9.665 36.699 1.00 31.16 N ATOM 2039 CA GLY A 132 14.080 9.849 37.548 1.00 32.30 C ATOM 2040 C GLY A 132 15.215 8.915 37.203 1.00 32.54 C ATOM 2041 O GLY A 132 15.783 8.262 38.076 1.00 33.59 O ATOM 0 H GLY A 132 12.637 10.495 36.178 1.00 31.16 H new ATOM 0 HA2 GLY A 132 14.426 10.879 37.464 1.00 32.30 H new ATOM 0 HA3 GLY A 132 13.792 9.694 38.588 1.00 32.30 H new ATOM 2045 N ASP A 133 15.545 8.859 35.918 1.00 31.60 N ATOM 2046 CA ASP A 133 16.635 8.035 35.446 1.00 31.81 C ATOM 2047 C ASP A 133 17.726 8.934 34.907 1.00 31.80 C ATOM 2048 O ASP A 133 17.478 10.078 34.533 1.00 31.29 O ATOM 2049 CB ASP A 133 16.196 7.100 34.317 1.00 30.84 C ATOM 2050 CG ASP A 133 14.725 6.764 34.344 1.00 30.25 C ATOM 2051 OD1 ASP A 133 14.253 6.219 35.363 1.00 30.65 O ATOM 2052 OD2 ASP A 133 14.046 7.050 33.334 1.00 29.45 O ATOM 0 H ASP A 133 15.065 9.381 35.185 1.00 31.60 H new ATOM 0 HA ASP A 133 16.984 7.431 36.284 1.00 31.81 H new ATOM 0 HB2 ASP A 133 16.436 7.563 33.360 1.00 30.84 H new ATOM 0 HB3 ASP A 133 16.772 6.176 34.378 1.00 30.84 H new ATOM 2057 N GLY A 134 18.925 8.416 34.867 1.00 32.44 N ATOM 2058 CA GLY A 134 20.033 9.176 34.332 1.00 32.56 C ATOM 2059 C GLY A 134 19.946 9.286 32.823 1.00 31.38 C ATOM 2060 O GLY A 134 20.948 9.527 32.152 1.00 31.48 O ATOM 0 H GLY A 134 19.163 7.480 35.194 1.00 32.44 H new ATOM 0 HA2 GLY A 134 20.039 10.173 34.772 1.00 32.56 H new ATOM 0 HA3 GLY A 134 20.973 8.699 34.611 1.00 32.56 H new ATOM 2064 N MET A 135 18.737 9.100 32.289 1.00 30.31 N ATOM 2065 CA MET A 135 18.513 9.156 30.850 1.00 29.12 C ATOM 2066 C MET A 135 17.109 9.661 30.512 1.00 28.02 C ATOM 2067 O MET A 135 16.170 9.549 31.314 1.00 28.13 O ATOM 2068 CB MET A 135 18.730 7.774 30.230 1.00 28.97 C ATOM 2069 CG MET A 135 18.033 6.647 30.977 1.00 29.26 C ATOM 2070 SD MET A 135 18.902 6.161 32.482 1.00 30.55 S ATOM 2071 CE MET A 135 20.479 5.633 31.813 1.00 31.50 C ATOM 0 H MET A 135 17.898 8.909 32.837 1.00 30.31 H new ATOM 0 HA MET A 135 19.231 9.862 30.433 1.00 29.12 H new ATOM 0 HB2 MET A 135 18.374 7.789 29.200 1.00 28.97 H new ATOM 0 HB3 MET A 135 19.799 7.566 30.195 1.00 28.97 H new ATOM 0 HG2 MET A 135 17.020 6.959 31.233 1.00 29.26 H new ATOM 0 HG3 MET A 135 17.944 5.782 30.319 1.00 29.26 H new ATOM 0 HE1 MET A 135 20.926 4.893 32.477 1.00 31.50 H new ATOM 0 HE2 MET A 135 20.327 5.192 30.828 1.00 31.50 H new ATOM 0 HE3 MET A 135 21.144 6.492 31.727 1.00 31.50 H new ATOM 2081 N ILE A 136 16.977 10.208 29.304 1.00 27.01 N ATOM 2082 CA ILE A 136 15.702 10.743 28.831 1.00 25.91 C ATOM 2083 C ILE A 136 14.958 9.715 27.985 1.00 24.90 C ATOM 2084 O ILE A 136 15.524 9.129 27.075 1.00 24.54 O ATOM 2085 CB ILE A 136 15.890 12.015 27.980 1.00 25.40 C ATOM 2086 CG1 ILE A 136 16.656 13.087 28.754 1.00 26.49 C ATOM 2087 CG2 ILE A 136 14.541 12.553 27.532 1.00 24.33 C ATOM 2088 CD1 ILE A 136 16.939 14.328 27.930 1.00 26.17 C ATOM 0 H ILE A 136 17.741 10.292 28.633 1.00 27.01 H new ATOM 0 HA ILE A 136 15.125 10.988 29.723 1.00 25.91 H new ATOM 0 HB ILE A 136 16.476 11.749 27.100 1.00 25.40 H new ATOM 0 HG12 ILE A 136 16.083 13.368 29.638 1.00 26.49 H new ATOM 0 HG13 ILE A 136 17.599 12.669 29.105 1.00 26.49 H new ATOM 0 HG21 ILE A 136 14.688 13.451 26.932 1.00 24.33 H new ATOM 0 HG22 ILE A 136 14.028 11.798 26.936 1.00 24.33 H new ATOM 0 HG23 ILE A 136 13.938 12.796 28.407 1.00 24.33 H new ATOM 0 HD11 ILE A 136 17.485 15.051 28.536 1.00 26.17 H new ATOM 0 HD12 ILE A 136 17.538 14.058 27.060 1.00 26.17 H new ATOM 0 HD13 ILE A 136 15.998 14.768 27.600 1.00 26.17 H new ATOM 2100 N ASN A 137 13.681 9.514 28.277 1.00 24.49 N ATOM 2101 CA ASN A 137 12.874 8.561 27.529 1.00 23.59 C ATOM 2102 C ASN A 137 12.172 9.268 26.381 1.00 22.27 C ATOM 2103 O ASN A 137 11.894 10.461 26.467 1.00 22.13 O ATOM 2104 CB ASN A 137 11.853 7.894 28.458 1.00 23.94 C ATOM 2105 CG ASN A 137 11.023 6.827 27.766 1.00 23.25 C ATOM 2106 OD1 ASN A 137 10.585 6.991 26.629 1.00 22.19 O ATOM 2107 ND2 ASN A 137 10.800 5.720 28.456 1.00 23.92 N ATOM 0 H ASN A 137 13.182 9.997 29.025 1.00 24.49 H new ATOM 0 HA ASN A 137 13.522 7.787 27.117 1.00 23.59 H new ATOM 0 HB2 ASN A 137 12.377 7.447 29.302 1.00 23.94 H new ATOM 0 HB3 ASN A 137 11.188 8.656 28.864 1.00 23.94 H new ATOM 0 HD21 ASN A 137 10.248 4.966 28.047 1.00 23.92 H new ATOM 0 HD22 ASN A 137 11.180 5.620 29.397 1.00 23.92 H new ATOM 2114 N TYR A 138 11.910 8.538 25.303 1.00 21.38 N ATOM 2115 CA TYR A 138 11.241 9.103 24.136 1.00 20.08 C ATOM 2116 C TYR A 138 10.133 10.065 24.538 1.00 19.79 C ATOM 2117 O TYR A 138 10.022 11.154 23.985 1.00 19.22 O ATOM 2118 CB TYR A 138 10.668 7.986 23.267 1.00 19.28 C ATOM 2119 CG TYR A 138 9.842 8.490 22.106 1.00 17.91 C ATOM 2120 CD1 TYR A 138 10.447 9.116 21.023 1.00 17.42 C ATOM 2121 CD2 TYR A 138 8.461 8.334 22.086 1.00 17.16 C ATOM 2122 CE1 TYR A 138 9.702 9.575 19.956 1.00 16.17 C ATOM 2123 CE2 TYR A 138 7.709 8.791 21.023 1.00 15.93 C ATOM 2124 CZ TYR A 138 8.314 9.424 19.979 1.00 15.40 C ATOM 2125 OH TYR A 138 7.588 9.867 18.898 1.00 14.17 O ATOM 0 H TYR A 138 12.151 7.551 25.212 1.00 21.38 H new ATOM 0 HA TYR A 138 11.983 9.663 23.567 1.00 20.08 H new ATOM 0 HB2 TYR A 138 11.487 7.378 22.883 1.00 19.28 H new ATOM 0 HB3 TYR A 138 10.051 7.335 23.886 1.00 19.28 H new ATOM 0 HD1 TYR A 138 11.519 9.246 21.016 1.00 17.42 H new ATOM 0 HD2 TYR A 138 7.969 7.848 22.915 1.00 17.16 H new ATOM 0 HE1 TYR A 138 10.187 10.045 19.113 1.00 16.17 H new ATOM 0 HE2 TYR A 138 6.639 8.647 21.019 1.00 15.93 H new ATOM 0 HH TYR A 138 6.635 9.696 19.052 1.00 14.17 H new ATOM 2135 N GLU A 139 9.333 9.661 25.516 1.00 20.30 N ATOM 2136 CA GLU A 139 8.221 10.481 25.991 1.00 20.23 C ATOM 2137 C GLU A 139 8.705 11.794 26.597 1.00 20.87 C ATOM 2138 O GLU A 139 8.129 12.858 26.353 1.00 20.48 O ATOM 2139 CB GLU A 139 7.417 9.705 27.032 1.00 20.94 C ATOM 2140 CG GLU A 139 8.259 9.182 28.185 1.00 22.25 C ATOM 2141 CD GLU A 139 7.473 8.282 29.118 1.00 22.99 C ATOM 2142 OE1 GLU A 139 7.424 7.060 28.863 1.00 23.27 O ATOM 2143 OE2 GLU A 139 6.907 8.799 30.105 1.00 23.36 O ATOM 0 H GLU A 139 9.432 8.768 25.999 1.00 20.30 H new ATOM 0 HA GLU A 139 7.592 10.718 25.133 1.00 20.23 H new ATOM 0 HB2 GLU A 139 6.633 10.350 27.429 1.00 20.94 H new ATOM 0 HB3 GLU A 139 6.922 8.865 26.544 1.00 20.94 H new ATOM 0 HG2 GLU A 139 9.111 8.631 27.787 1.00 22.25 H new ATOM 0 HG3 GLU A 139 8.659 10.024 28.750 1.00 22.25 H new ATOM 2150 N GLU A 140 9.777 11.714 27.369 1.00 21.93 N ATOM 2151 CA GLU A 140 10.333 12.882 28.036 1.00 22.74 C ATOM 2152 C GLU A 140 10.979 13.822 27.028 1.00 22.24 C ATOM 2153 O GLU A 140 10.748 15.030 27.043 1.00 22.29 O ATOM 2154 CB GLU A 140 11.383 12.450 29.053 1.00 24.01 C ATOM 2155 CG GLU A 140 10.986 11.247 29.895 1.00 24.56 C ATOM 2156 CD GLU A 140 12.044 10.898 30.928 1.00 25.83 C ATOM 2157 OE1 GLU A 140 13.246 11.048 30.628 1.00 26.40 O ATOM 2158 OE2 GLU A 140 11.670 10.464 32.035 1.00 26.30 O ATOM 0 H GLU A 140 10.283 10.847 27.550 1.00 21.93 H new ATOM 0 HA GLU A 140 9.519 13.403 28.540 1.00 22.74 H new ATOM 0 HB2 GLU A 140 12.309 12.219 28.526 1.00 24.01 H new ATOM 0 HB3 GLU A 140 11.595 13.288 29.717 1.00 24.01 H new ATOM 0 HG2 GLU A 140 10.042 11.454 30.399 1.00 24.56 H new ATOM 0 HG3 GLU A 140 10.819 10.389 29.244 1.00 24.56 H new ATOM 2165 N PHE A 141 11.789 13.246 26.157 1.00 21.88 N ATOM 2166 CA PHE A 141 12.500 14.001 25.138 1.00 21.51 C ATOM 2167 C PHE A 141 11.530 14.707 24.191 1.00 20.36 C ATOM 2168 O PHE A 141 11.613 15.920 24.000 1.00 20.46 O ATOM 2169 CB PHE A 141 13.417 13.049 24.364 1.00 21.36 C ATOM 2170 CG PHE A 141 14.026 13.641 23.131 1.00 20.89 C ATOM 2171 CD1 PHE A 141 15.183 14.398 23.205 1.00 20.72 C ATOM 2172 CD2 PHE A 141 13.445 13.429 21.896 1.00 20.72 C ATOM 2173 CE1 PHE A 141 15.747 14.937 22.065 1.00 20.40 C ATOM 2174 CE2 PHE A 141 14.003 13.963 20.751 1.00 20.40 C ATOM 2175 CZ PHE A 141 15.155 14.718 20.835 1.00 20.24 C ATOM 0 H PHE A 141 11.973 12.243 26.135 1.00 21.88 H new ATOM 0 HA PHE A 141 13.098 14.774 25.621 1.00 21.51 H new ATOM 0 HB2 PHE A 141 14.217 12.717 25.026 1.00 21.36 H new ATOM 0 HB3 PHE A 141 12.847 12.163 24.083 1.00 21.36 H new ATOM 0 HD1 PHE A 141 15.649 14.569 24.164 1.00 20.72 H new ATOM 0 HD2 PHE A 141 12.544 12.839 21.825 1.00 20.72 H new ATOM 0 HE1 PHE A 141 16.648 15.528 22.134 1.00 20.40 H new ATOM 0 HE2 PHE A 141 13.538 13.790 19.791 1.00 20.40 H new ATOM 0 HZ PHE A 141 15.593 15.137 19.941 1.00 20.24 H new ATOM 2185 N VAL A 142 10.618 13.942 23.598 1.00 19.36 N ATOM 2186 CA VAL A 142 9.640 14.506 22.665 1.00 18.22 C ATOM 2187 C VAL A 142 8.846 15.626 23.314 1.00 18.56 C ATOM 2188 O VAL A 142 8.454 16.589 22.655 1.00 18.08 O ATOM 2189 CB VAL A 142 8.654 13.449 22.125 1.00 17.23 C ATOM 2190 CG1 VAL A 142 7.837 12.829 23.240 1.00 17.77 C ATOM 2191 CG2 VAL A 142 7.742 14.078 21.088 1.00 16.07 C ATOM 0 H VAL A 142 10.533 12.936 23.744 1.00 19.36 H new ATOM 0 HA VAL A 142 10.219 14.896 21.828 1.00 18.22 H new ATOM 0 HB VAL A 142 9.233 12.651 21.660 1.00 17.23 H new ATOM 0 HG11 VAL A 142 7.154 12.089 22.822 1.00 17.77 H new ATOM 0 HG12 VAL A 142 8.504 12.345 23.954 1.00 17.77 H new ATOM 0 HG13 VAL A 142 7.265 13.606 23.747 1.00 17.77 H new ATOM 0 HG21 VAL A 142 7.048 13.327 20.710 1.00 16.07 H new ATOM 0 HG22 VAL A 142 7.181 14.894 21.544 1.00 16.07 H new ATOM 0 HG23 VAL A 142 8.341 14.466 20.264 1.00 16.07 H new ATOM 2201 N TRP A 143 8.615 15.492 24.611 1.00 19.50 N ATOM 2202 CA TRP A 143 7.883 16.498 25.358 1.00 20.05 C ATOM 2203 C TRP A 143 8.639 17.813 25.321 1.00 20.61 C ATOM 2204 O TRP A 143 8.089 18.870 25.008 1.00 20.44 O ATOM 2205 CB TRP A 143 7.715 16.056 26.814 1.00 21.15 C ATOM 2206 CG TRP A 143 7.528 17.210 27.747 1.00 22.13 C ATOM 2207 CD1 TRP A 143 6.361 17.832 28.015 1.00 22.20 C ATOM 2208 CD2 TRP A 143 8.533 17.898 28.502 1.00 23.25 C ATOM 2209 NE1 TRP A 143 6.558 18.863 28.901 1.00 23.30 N ATOM 2210 CE2 TRP A 143 7.886 18.924 29.213 1.00 23.94 C ATOM 2211 CE3 TRP A 143 9.911 17.746 28.650 1.00 23.82 C ATOM 2212 CZ2 TRP A 143 8.570 19.794 30.054 1.00 25.11 C ATOM 2213 CZ3 TRP A 143 10.590 18.613 29.484 1.00 24.98 C ATOM 2214 CH2 TRP A 143 9.918 19.624 30.175 1.00 25.59 C ATOM 0 H TRP A 143 8.925 14.695 25.167 1.00 19.50 H new ATOM 0 HA TRP A 143 6.900 16.625 24.904 1.00 20.05 H new ATOM 0 HB2 TRP A 143 6.857 15.389 26.891 1.00 21.15 H new ATOM 0 HB3 TRP A 143 8.591 15.484 27.120 1.00 21.15 H new ATOM 0 HD1 TRP A 143 5.406 17.558 27.592 1.00 22.20 H new ATOM 0 HE1 TRP A 143 5.833 19.481 29.265 1.00 23.30 H new ATOM 0 HE3 TRP A 143 10.438 16.965 28.122 1.00 23.82 H new ATOM 0 HZ2 TRP A 143 8.053 20.575 30.592 1.00 25.11 H new ATOM 0 HZ3 TRP A 143 11.658 18.507 29.604 1.00 24.98 H new ATOM 0 HH2 TRP A 143 10.478 20.286 30.819 1.00 25.59 H new ATOM 2225 N MET A 144 9.908 17.714 25.654 1.00 21.37 N ATOM 2226 CA MET A 144 10.801 18.853 25.711 1.00 22.12 C ATOM 2227 C MET A 144 10.794 19.675 24.425 1.00 21.40 C ATOM 2228 O MET A 144 10.564 20.882 24.459 1.00 21.75 O ATOM 2229 CB MET A 144 12.194 18.334 26.021 1.00 22.89 C ATOM 2230 CG MET A 144 13.293 19.377 25.903 1.00 23.65 C ATOM 2231 SD MET A 144 14.206 19.248 24.355 1.00 23.25 S ATOM 2232 CE MET A 144 14.816 17.568 24.470 1.00 22.97 C ATOM 0 H MET A 144 10.355 16.830 25.896 1.00 21.37 H new ATOM 0 HA MET A 144 10.460 19.532 26.492 1.00 22.12 H new ATOM 0 HB2 MET A 144 12.201 17.929 27.033 1.00 22.89 H new ATOM 0 HB3 MET A 144 12.419 17.508 25.346 1.00 22.89 H new ATOM 0 HG2 MET A 144 12.855 20.372 25.980 1.00 23.65 H new ATOM 0 HG3 MET A 144 13.984 19.267 26.739 1.00 23.65 H new ATOM 0 HE1 MET A 144 15.738 17.476 23.896 1.00 22.97 H new ATOM 0 HE2 MET A 144 15.012 17.323 25.514 1.00 22.97 H new ATOM 0 HE3 MET A 144 14.070 16.882 24.070 1.00 22.97 H new ATOM 2242 N ILE A 145 11.049 19.024 23.298 1.00 20.47 N ATOM 2243 CA ILE A 145 11.079 19.714 22.013 1.00 19.79 C ATOM 2244 C ILE A 145 9.687 20.190 21.601 1.00 18.96 C ATOM 2245 O ILE A 145 9.547 21.018 20.701 1.00 18.60 O ATOM 2246 CB ILE A 145 11.644 18.809 20.904 1.00 19.06 C ATOM 2247 CG1 ILE A 145 10.665 17.676 20.596 1.00 18.09 C ATOM 2248 CG2 ILE A 145 13.000 18.254 21.318 1.00 20.01 C ATOM 2249 CD1 ILE A 145 11.095 16.798 19.442 1.00 17.41 C ATOM 0 H ILE A 145 11.238 18.023 23.246 1.00 20.47 H new ATOM 0 HA ILE A 145 11.730 20.579 22.139 1.00 19.79 H new ATOM 0 HB ILE A 145 11.778 19.401 19.999 1.00 19.06 H new ATOM 0 HG12 ILE A 145 10.546 17.058 21.486 1.00 18.09 H new ATOM 0 HG13 ILE A 145 9.688 18.103 20.372 1.00 18.09 H new ATOM 0 HG21 ILE A 145 13.389 17.615 20.525 1.00 20.01 H new ATOM 0 HG22 ILE A 145 13.692 19.078 21.493 1.00 20.01 H new ATOM 0 HG23 ILE A 145 12.891 17.671 22.233 1.00 20.01 H new ATOM 0 HD11 ILE A 145 10.352 16.017 19.282 1.00 17.41 H new ATOM 0 HD12 ILE A 145 11.186 17.402 18.539 1.00 17.41 H new ATOM 0 HD13 ILE A 145 12.058 16.341 19.671 1.00 17.41 H new ATOM 2261 N SER A 146 8.663 19.663 22.266 1.00 18.76 N ATOM 2262 CA SER A 146 7.285 20.032 21.958 1.00 18.09 C ATOM 2263 C SER A 146 6.927 21.383 22.569 1.00 18.99 C ATOM 2264 O SER A 146 5.800 21.857 22.427 1.00 18.73 O ATOM 2265 CB SER A 146 6.322 18.957 22.465 1.00 17.78 C ATOM 2266 OG SER A 146 4.983 19.269 22.123 1.00 17.22 O ATOM 0 H SER A 146 8.761 18.982 23.019 1.00 18.76 H new ATOM 0 HA SER A 146 7.193 20.112 20.875 1.00 18.09 H new ATOM 0 HB2 SER A 146 6.594 17.991 22.039 1.00 17.78 H new ATOM 0 HB3 SER A 146 6.412 18.865 23.547 1.00 17.78 H new ATOM 0 HG SER A 146 4.875 20.242 22.079 1.00 17.22 H new ATOM 2272 N GLN A 147 7.891 21.999 23.250 1.00 20.13 N ATOM 2273 CA GLN A 147 7.671 23.298 23.876 1.00 21.14 C ATOM 2274 C GLN A 147 8.901 24.183 23.724 1.00 21.86 C ATOM 2275 O GLN A 147 8.797 25.354 23.356 1.00 22.11 O ATOM 2276 CB GLN A 147 7.344 23.131 25.358 1.00 22.13 C ATOM 2277 CG GLN A 147 6.662 21.819 25.690 1.00 21.65 C ATOM 2278 CD GLN A 147 6.057 21.823 27.071 1.00 22.67 C ATOM 2279 OE1 GLN A 147 4.883 22.144 27.251 1.00 22.79 O ATOM 2280 NE2 GLN A 147 6.865 21.476 28.059 1.00 23.48 N ATOM 0 H GLN A 147 8.829 21.620 23.381 1.00 20.13 H new ATOM 0 HA GLN A 147 6.827 23.773 23.375 1.00 21.14 H new ATOM 0 HB2 GLN A 147 8.266 23.207 25.935 1.00 22.13 H new ATOM 0 HB3 GLN A 147 6.702 23.953 25.674 1.00 22.13 H new ATOM 0 HG2 GLN A 147 5.882 21.621 24.955 1.00 21.65 H new ATOM 0 HG3 GLN A 147 7.385 21.007 25.615 1.00 21.65 H new ATOM 0 HE21 GLN A 147 7.832 21.217 27.860 1.00 23.48 H new ATOM 0 HE22 GLN A 147 6.522 21.467 29.019 1.00 23.48 H new ATOM 2289 N LYS A 148 10.065 23.612 24.010 1.00 22.30 N ATOM 2290 CA LYS A 148 11.322 24.343 23.915 1.00 23.11 C ATOM 2291 C LYS A 148 11.848 24.336 22.483 1.00 22.36 C ATOM 2292 O LYS A 148 12.563 23.378 22.119 1.00 22.12 O ATOM 2293 CB LYS A 148 12.361 23.733 24.858 1.00 24.04 C ATOM 2294 CG LYS A 148 11.884 23.625 26.298 1.00 24.96 C ATOM 2295 CD LYS A 148 12.939 22.987 27.188 1.00 25.58 C ATOM 2296 CE LYS A 148 12.419 22.767 28.599 1.00 25.71 C ATOM 2297 NZ LYS A 148 13.474 22.222 29.498 1.00 26.17 N ATOM 2298 OXT LYS A 148 11.540 25.288 21.736 1.00 22.11 O ATOM 0 H LYS A 148 10.164 22.642 24.310 1.00 22.30 H new ATOM 0 HA LYS A 148 11.138 25.376 24.209 1.00 23.11 H new ATOM 0 HB2 LYS A 148 12.629 22.740 24.497 1.00 24.04 H new ATOM 0 HB3 LYS A 148 13.267 24.338 24.828 1.00 24.04 H new ATOM 0 HG2 LYS A 148 11.639 24.617 26.677 1.00 24.96 H new ATOM 0 HG3 LYS A 148 10.969 23.034 26.336 1.00 24.96 H new ATOM 0 HD2 LYS A 148 13.249 22.033 26.761 1.00 25.58 H new ATOM 0 HD3 LYS A 148 13.823 23.624 27.220 1.00 25.58 H new ATOM 0 HE2 LYS A 148 12.050 23.710 29.002 1.00 25.71 H new ATOM 0 HE3 LYS A 148 11.574 22.079 28.572 1.00 25.71 H new ATOM 0 HZ1 LYS A 148 13.100 21.400 30.014 1.00 26.17 H new ATOM 0 HZ2 LYS A 148 14.296 21.930 28.932 1.00 26.17 H new ATOM 0 HZ3 LYS A 148 13.764 22.954 30.177 1.00 26.17 H new TER 2312 LYS A 148 HETATM 2313 CA CA A 149 20.384 4.644 25.236 1.00 27.20 CA HETATM 2314 CA CA A 150 13.885 9.195 32.208 1.00 27.86 CA