USER MOD reduce.3.24.130724 H: found=0, std=0, add=930, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 766 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 25 HIS : no HD1:sc= -0.403 K(o=-25,f=-26) USER MOD Set 1.2: A 26 MET CE :methyl 177:sc= -6.02! (180deg=-6.29!) USER MOD Set 1.3: A 84 MET CE :methyl 173:sc= -4.28! (180deg=-4.92!) USER MOD Set 1.4: A 88 ASN : amide:sc= -14.5! C(o=-25!,f=-27!) USER MOD Single : A 24 SER OG : rot -29:sc= 0.00471 USER MOD Single : A 27 GLN : amide:sc= -0.144 K(o=-0.14,f=-0.8) USER MOD Single : A 29 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0749) USER MOD Single : A 33 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 145:sc= -5.36! (180deg=-8.72!) USER MOD Single : A 41 SER OG : rot 81:sc= 0.69 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= -0.443 K(o=-0.44,f=-2.6!) USER MOD Single : A 49 LYS NZ :NH3+ 154:sc= -1.49 (180deg=-1.97!) USER MOD Single : A 53 THR OG1 : rot 82:sc= 1.06 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 101:sc= -0.334 USER MOD Single : A 73 ASN : amide:sc= 0.466 K(o=0.47,f=-1) USER MOD Single : A 74 GLN : amide:sc= -8.88! C(o=-8.9!,f=-13!) USER MOD Single : A 78 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.0499) USER MOD Single : A 79 ASN : amide:sc= 0.0534 X(o=0.053,f=0) USER MOD Single : A 82 SER OG : rot -106:sc= -0.751 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl -117:sc= -1.67 (180deg=-3.29) USER MOD Single : A 86 GLN : amide:sc= -9.87! C(o=-9.9!,f=-13!) USER MOD Single : A 90 THR OG1 : rot 105:sc= 0.877 USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.0644 X(o=-0.064,f=0) USER MOD Single : A 102 MET CE :methyl -155:sc= -9.09! (180deg=-12.2!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -1.13 K(o=-1.1,f=-0.3) USER MOD Single : A 115 ASN : amide:sc= -3.29! K(o=-3.3!,f=-2.2) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= -0.389 K(o=-0.39,f=-3!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 24 -8.832 -7.083 -11.117 1.00 0.00 N ATOM 2 CA SER A 24 -8.903 -8.343 -11.836 1.00 0.00 C ATOM 3 C SER A 24 -7.915 -9.345 -11.237 1.00 0.00 C ATOM 4 O SER A 24 -7.300 -9.074 -10.205 1.00 0.00 O ATOM 5 CB SER A 24 -8.620 -8.144 -13.326 1.00 0.00 C ATOM 6 OG SER A 24 -7.285 -7.703 -13.562 1.00 0.00 O ATOM 0 HA SER A 24 -9.914 -8.737 -11.736 1.00 0.00 H new ATOM 0 HB2 SER A 24 -8.791 -9.081 -13.856 1.00 0.00 H new ATOM 0 HB3 SER A 24 -9.320 -7.415 -13.734 1.00 0.00 H new ATOM 0 HG SER A 24 -6.970 -7.186 -12.791 1.00 0.00 H new ATOM 11 N HIS A 25 -7.791 -10.480 -11.909 1.00 0.00 N ATOM 12 CA HIS A 25 -6.886 -11.523 -11.455 1.00 0.00 C ATOM 13 C HIS A 25 -7.559 -12.342 -10.351 1.00 0.00 C ATOM 14 O HIS A 25 -7.581 -13.570 -10.411 1.00 0.00 O ATOM 15 CB HIS A 25 -5.546 -10.928 -11.017 1.00 0.00 C ATOM 16 CG HIS A 25 -4.347 -11.558 -11.684 1.00 0.00 C ATOM 17 ND1 HIS A 25 -4.380 -12.045 -12.980 1.00 0.00 N ATOM 18 CD2 HIS A 25 -3.082 -11.776 -11.223 1.00 0.00 C ATOM 19 CE1 HIS A 25 -3.183 -12.532 -13.274 1.00 0.00 C ATOM 20 NE2 HIS A 25 -2.380 -12.364 -12.184 1.00 0.00 N ATOM 0 H HIS A 25 -8.302 -10.701 -12.764 1.00 0.00 H new ATOM 0 HA HIS A 25 -6.665 -12.201 -12.280 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -5.548 -9.859 -11.230 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -5.447 -11.037 -9.937 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -2.714 -11.514 -10.242 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -2.894 -12.983 -14.212 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -1.401 -12.644 -12.118 1.00 0.00 H new ATOM 27 N MET A 26 -8.093 -11.629 -9.371 1.00 0.00 N ATOM 28 CA MET A 26 -8.765 -12.274 -8.256 1.00 0.00 C ATOM 29 C MET A 26 -9.564 -11.260 -7.437 1.00 0.00 C ATOM 30 O MET A 26 -8.987 -10.417 -6.750 1.00 0.00 O ATOM 31 CB MET A 26 -7.728 -12.953 -7.359 1.00 0.00 C ATOM 32 CG MET A 26 -6.625 -11.972 -6.957 1.00 0.00 C ATOM 33 SD MET A 26 -5.112 -12.372 -7.815 1.00 0.00 S ATOM 34 CE MET A 26 -4.286 -10.792 -7.738 1.00 0.00 C ATOM 0 H MET A 26 -8.074 -10.610 -9.326 1.00 0.00 H new ATOM 0 HA MET A 26 -9.457 -13.017 -8.653 1.00 0.00 H new ATOM 0 HB2 MET A 26 -8.215 -13.344 -6.466 1.00 0.00 H new ATOM 0 HB3 MET A 26 -7.291 -13.803 -7.882 1.00 0.00 H new ATOM 0 HG2 MET A 26 -6.929 -10.953 -7.194 1.00 0.00 H new ATOM 0 HG3 MET A 26 -6.464 -12.014 -5.880 1.00 0.00 H new ATOM 0 HE1 MET A 26 -3.295 -10.877 -8.184 1.00 0.00 H new ATOM 0 HE2 MET A 26 -4.868 -10.050 -8.285 1.00 0.00 H new ATOM 0 HE3 MET A 26 -4.190 -10.482 -6.697 1.00 0.00 H new ATOM 42 N GLN A 27 -10.881 -11.372 -7.535 1.00 0.00 N ATOM 43 CA GLN A 27 -11.766 -10.475 -6.811 1.00 0.00 C ATOM 44 C GLN A 27 -11.959 -10.965 -5.374 1.00 0.00 C ATOM 45 O GLN A 27 -11.946 -12.168 -5.119 1.00 0.00 O ATOM 46 CB GLN A 27 -13.110 -10.334 -7.527 1.00 0.00 C ATOM 47 CG GLN A 27 -12.938 -9.649 -8.885 1.00 0.00 C ATOM 48 CD GLN A 27 -13.515 -8.232 -8.863 1.00 0.00 C ATOM 49 OE1 GLN A 27 -14.539 -7.962 -8.255 1.00 0.00 O ATOM 50 NE2 GLN A 27 -12.805 -7.347 -9.555 1.00 0.00 N ATOM 0 H GLN A 27 -11.357 -12.071 -8.105 1.00 0.00 H new ATOM 0 HA GLN A 27 -11.304 -9.488 -6.779 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -13.557 -11.318 -7.666 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -13.797 -9.756 -6.909 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -11.880 -9.610 -9.145 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -13.435 -10.236 -9.658 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -11.957 -7.641 -10.040 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -13.108 -6.374 -9.601 1.00 0.00 H new ATOM 57 N LEU A 28 -12.135 -10.008 -4.475 1.00 0.00 N ATOM 58 CA LEU A 28 -12.331 -10.329 -3.071 1.00 0.00 C ATOM 59 C LEU A 28 -12.932 -9.117 -2.356 1.00 0.00 C ATOM 60 O LEU A 28 -13.330 -8.147 -2.999 1.00 0.00 O ATOM 61 CB LEU A 28 -11.025 -10.825 -2.447 1.00 0.00 C ATOM 62 CG LEU A 28 -9.775 -10.000 -2.760 1.00 0.00 C ATOM 63 CD1 LEU A 28 -9.332 -10.205 -4.210 1.00 0.00 C ATOM 64 CD2 LEU A 28 -9.998 -8.521 -2.432 1.00 0.00 C ATOM 0 H LEU A 28 -12.146 -9.011 -4.691 1.00 0.00 H new ATOM 0 HA LEU A 28 -13.040 -11.149 -2.963 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -11.152 -10.858 -1.365 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.853 -11.849 -2.779 1.00 0.00 H new ATOM 0 HG LEU A 28 -8.964 -10.353 -2.123 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -8.442 -9.608 -4.406 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.106 -11.258 -4.376 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.132 -9.895 -4.882 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -9.095 -7.957 -2.664 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -10.828 -8.138 -3.026 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -10.231 -8.414 -1.373 1.00 0.00 H new ATOM 75 N LYS A 29 -12.980 -9.213 -1.036 1.00 0.00 N ATOM 76 CA LYS A 29 -13.526 -8.137 -0.226 1.00 0.00 C ATOM 77 C LYS A 29 -12.393 -7.202 0.204 1.00 0.00 C ATOM 78 O LYS A 29 -11.260 -7.640 0.392 1.00 0.00 O ATOM 79 CB LYS A 29 -14.333 -8.703 0.944 1.00 0.00 C ATOM 80 CG LYS A 29 -15.300 -7.656 1.501 1.00 0.00 C ATOM 81 CD LYS A 29 -14.859 -7.187 2.889 1.00 0.00 C ATOM 82 CE LYS A 29 -15.426 -5.802 3.205 1.00 0.00 C ATOM 83 NZ LYS A 29 -16.906 -5.830 3.185 1.00 0.00 N ATOM 0 H LYS A 29 -12.650 -10.020 -0.506 1.00 0.00 H new ATOM 0 HA LYS A 29 -14.228 -7.541 -0.809 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -14.891 -9.580 0.615 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -13.656 -9.033 1.732 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -15.349 -6.804 0.823 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -16.304 -8.076 1.557 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -15.193 -7.901 3.641 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -13.770 -7.158 2.938 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -15.076 -5.474 4.184 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -15.060 -5.078 2.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -17.275 -4.928 3.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -17.237 -5.972 2.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -17.247 -6.610 3.783 1.00 0.00 H new ATOM 93 N PHE A 30 -12.740 -5.932 0.347 1.00 0.00 N ATOM 94 CA PHE A 30 -11.767 -4.931 0.751 1.00 0.00 C ATOM 95 C PHE A 30 -11.993 -4.501 2.202 1.00 0.00 C ATOM 96 O PHE A 30 -12.554 -5.254 2.997 1.00 0.00 O ATOM 97 CB PHE A 30 -11.963 -3.720 -0.164 1.00 0.00 C ATOM 98 CG PHE A 30 -12.668 -4.046 -1.483 1.00 0.00 C ATOM 99 CD1 PHE A 30 -12.132 -4.961 -2.332 1.00 0.00 C ATOM 100 CD2 PHE A 30 -13.831 -3.418 -1.804 1.00 0.00 C ATOM 101 CE1 PHE A 30 -12.785 -5.263 -3.556 1.00 0.00 C ATOM 102 CE2 PHE A 30 -14.484 -3.719 -3.028 1.00 0.00 C ATOM 103 CZ PHE A 30 -13.948 -4.635 -3.879 1.00 0.00 C ATOM 0 H PHE A 30 -13.682 -5.573 0.190 1.00 0.00 H new ATOM 0 HA PHE A 30 -10.759 -5.340 0.674 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -12.541 -2.965 0.368 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -10.990 -3.281 -0.383 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -11.209 -5.459 -2.076 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -14.257 -2.691 -1.128 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -12.359 -5.991 -4.230 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -15.407 -3.220 -3.284 1.00 0.00 H new ATOM 0 HZ PHE A 30 -14.445 -4.864 -4.810 1.00 0.00 H new ATOM 112 N ALA A 31 -11.545 -3.291 2.504 1.00 0.00 N ATOM 113 CA ALA A 31 -11.692 -2.752 3.845 1.00 0.00 C ATOM 114 C ALA A 31 -12.752 -1.648 3.833 1.00 0.00 C ATOM 115 O ALA A 31 -13.497 -1.508 2.864 1.00 0.00 O ATOM 116 CB ALA A 31 -10.335 -2.251 4.345 1.00 0.00 C ATOM 0 H ALA A 31 -11.080 -2.669 1.843 1.00 0.00 H new ATOM 0 HA ALA A 31 -12.029 -3.526 4.535 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -10.445 -1.846 5.351 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -9.625 -3.078 4.362 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.967 -1.471 3.678 1.00 0.00 H new ATOM 122 N GLU A 32 -12.786 -0.893 4.921 1.00 0.00 N ATOM 123 CA GLU A 32 -13.743 0.194 5.049 1.00 0.00 C ATOM 124 C GLU A 32 -13.014 1.538 5.098 1.00 0.00 C ATOM 125 O GLU A 32 -13.643 2.592 5.002 1.00 0.00 O ATOM 126 CB GLU A 32 -14.627 0.003 6.283 1.00 0.00 C ATOM 127 CG GLU A 32 -15.458 -1.276 6.170 1.00 0.00 C ATOM 128 CD GLU A 32 -16.781 -1.139 6.927 1.00 0.00 C ATOM 129 OE1 GLU A 32 -17.677 -0.457 6.385 1.00 0.00 O ATOM 130 OE2 GLU A 32 -16.865 -1.721 8.030 1.00 0.00 O ATOM 0 H GLU A 32 -12.166 -1.012 5.722 1.00 0.00 H new ATOM 0 HA GLU A 32 -14.393 0.187 4.174 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -14.005 -0.041 7.177 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -15.289 0.862 6.397 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -15.656 -1.494 5.121 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -14.892 -2.118 6.569 1.00 0.00 H new ATOM 135 N CYS A 33 -11.701 1.458 5.247 1.00 0.00 N ATOM 136 CA CYS A 33 -10.880 2.657 5.310 1.00 0.00 C ATOM 137 C CYS A 33 -10.442 3.013 3.888 1.00 0.00 C ATOM 138 O CYS A 33 -9.962 4.118 3.642 1.00 0.00 O ATOM 139 CB CYS A 33 -9.685 2.475 6.248 1.00 0.00 C ATOM 140 SG CYS A 33 -10.173 2.871 7.966 1.00 0.00 S ATOM 0 H CYS A 33 -11.184 0.582 5.326 1.00 0.00 H new ATOM 0 HA CYS A 33 -11.462 3.479 5.726 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -9.321 1.449 6.192 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -8.865 3.122 5.936 1.00 0.00 H new ATOM 0 HG CYS A 33 -9.152 2.711 8.755 1.00 0.00 H new ATOM 145 N LEU A 34 -10.623 2.057 2.990 1.00 0.00 N ATOM 146 CA LEU A 34 -10.251 2.256 1.600 1.00 0.00 C ATOM 147 C LEU A 34 -11.210 3.263 0.959 1.00 0.00 C ATOM 148 O LEU A 34 -11.018 3.665 -0.187 1.00 0.00 O ATOM 149 CB LEU A 34 -10.187 0.916 0.864 1.00 0.00 C ATOM 150 CG LEU A 34 -9.588 -0.252 1.651 1.00 0.00 C ATOM 151 CD1 LEU A 34 -8.991 -1.299 0.708 1.00 0.00 C ATOM 152 CD2 LEU A 34 -8.568 0.243 2.677 1.00 0.00 C ATOM 0 H LEU A 34 -11.023 1.142 3.198 1.00 0.00 H new ATOM 0 HA LEU A 34 -9.249 2.679 1.532 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -11.197 0.643 0.559 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -9.604 1.052 -0.047 1.00 0.00 H new ATOM 0 HG LEU A 34 -10.391 -0.738 2.205 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -8.572 -2.118 1.292 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -9.771 -1.684 0.051 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -8.204 -0.842 0.108 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.158 -0.607 3.222 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.762 0.768 2.165 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -9.056 0.921 3.377 1.00 0.00 H new ATOM 163 N GLU A 35 -12.220 3.640 1.728 1.00 0.00 N ATOM 164 CA GLU A 35 -13.209 4.593 1.251 1.00 0.00 C ATOM 165 C GLU A 35 -12.653 6.016 1.323 1.00 0.00 C ATOM 166 O GLU A 35 -13.351 6.976 1.000 1.00 0.00 O ATOM 167 CB GLU A 35 -14.513 4.471 2.041 1.00 0.00 C ATOM 168 CG GLU A 35 -14.975 3.015 2.118 1.00 0.00 C ATOM 169 CD GLU A 35 -16.503 2.924 2.122 1.00 0.00 C ATOM 170 OE1 GLU A 35 -17.121 3.729 1.393 1.00 0.00 O ATOM 171 OE2 GLU A 35 -17.017 2.051 2.854 1.00 0.00 O ATOM 0 H GLU A 35 -12.376 3.303 2.678 1.00 0.00 H new ATOM 0 HA GLU A 35 -13.432 4.365 0.209 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -14.370 4.864 3.047 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -15.286 5.077 1.569 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -14.576 2.458 1.270 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -14.577 2.551 3.020 1.00 0.00 H new ATOM 176 N LYS A 36 -11.403 6.107 1.751 1.00 0.00 N ATOM 177 CA LYS A 36 -10.745 7.398 1.870 1.00 0.00 C ATOM 178 C LYS A 36 -9.811 7.602 0.676 1.00 0.00 C ATOM 179 O LYS A 36 -8.631 7.260 0.740 1.00 0.00 O ATOM 180 CB LYS A 36 -10.046 7.520 3.226 1.00 0.00 C ATOM 181 CG LYS A 36 -11.041 7.903 4.323 1.00 0.00 C ATOM 182 CD LYS A 36 -10.432 8.930 5.281 1.00 0.00 C ATOM 183 CE LYS A 36 -10.971 8.742 6.700 1.00 0.00 C ATOM 184 NZ LYS A 36 -10.116 9.453 7.678 1.00 0.00 N ATOM 0 H LYS A 36 -10.828 5.309 2.020 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.479 8.204 1.842 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -9.567 6.574 3.479 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -9.258 8.271 3.167 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.945 8.312 3.872 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.336 7.013 4.878 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -9.347 8.831 5.284 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.659 9.937 4.932 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -11.992 9.118 6.760 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -11.007 7.680 6.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -10.496 9.315 8.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -9.148 9.076 7.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -10.103 10.468 7.454 1.00 0.00 H new ATOM 194 N LYS A 37 -10.374 8.159 -0.387 1.00 0.00 N ATOM 195 CA LYS A 37 -9.606 8.413 -1.594 1.00 0.00 C ATOM 196 C LYS A 37 -8.258 9.031 -1.215 1.00 0.00 C ATOM 197 O LYS A 37 -8.039 9.392 -0.059 1.00 0.00 O ATOM 198 CB LYS A 37 -10.417 9.260 -2.576 1.00 0.00 C ATOM 199 CG LYS A 37 -11.467 8.411 -3.296 1.00 0.00 C ATOM 200 CD LYS A 37 -12.778 8.376 -2.508 1.00 0.00 C ATOM 201 CE LYS A 37 -13.965 8.732 -3.403 1.00 0.00 C ATOM 202 NZ LYS A 37 -14.199 7.665 -4.403 1.00 0.00 N ATOM 0 H LYS A 37 -11.353 8.441 -0.437 1.00 0.00 H new ATOM 0 HA LYS A 37 -9.394 7.479 -2.115 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.907 10.074 -2.041 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -9.749 9.715 -3.307 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.648 8.817 -4.291 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.091 7.397 -3.429 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.924 7.383 -2.082 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.724 9.076 -1.674 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -14.858 8.870 -2.794 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -13.775 9.678 -3.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -15.009 7.923 -5.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -13.352 7.552 -4.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -14.401 6.770 -3.914 1.00 0.00 H new ATOM 212 N VAL A 38 -7.390 9.134 -2.211 1.00 0.00 N ATOM 213 CA VAL A 38 -6.070 9.702 -1.996 1.00 0.00 C ATOM 214 C VAL A 38 -5.752 10.682 -3.127 1.00 0.00 C ATOM 215 O VAL A 38 -6.657 11.184 -3.793 1.00 0.00 O ATOM 216 CB VAL A 38 -5.034 8.584 -1.865 1.00 0.00 C ATOM 217 CG1 VAL A 38 -5.414 7.614 -0.745 1.00 0.00 C ATOM 218 CG2 VAL A 38 -4.854 7.846 -3.192 1.00 0.00 C ATOM 0 H VAL A 38 -7.575 8.834 -3.168 1.00 0.00 H new ATOM 0 HA VAL A 38 -6.043 10.263 -1.062 1.00 0.00 H new ATOM 0 HB VAL A 38 -4.079 9.040 -1.603 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -4.661 6.829 -0.673 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -5.468 8.153 0.201 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -6.384 7.168 -0.964 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -4.112 7.056 -3.072 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.804 7.408 -3.496 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -4.517 8.547 -3.955 1.00 0.00 H new ATOM 228 N ASP A 39 -4.462 10.928 -3.309 1.00 0.00 N ATOM 229 CA ASP A 39 -4.013 11.839 -4.348 1.00 0.00 C ATOM 230 C ASP A 39 -2.485 11.890 -4.351 1.00 0.00 C ATOM 231 O ASP A 39 -1.883 12.640 -3.584 1.00 0.00 O ATOM 232 CB ASP A 39 -4.533 13.256 -4.099 1.00 0.00 C ATOM 233 CG ASP A 39 -4.819 14.072 -5.362 1.00 0.00 C ATOM 234 OD1 ASP A 39 -4.342 13.643 -6.434 1.00 0.00 O ATOM 235 OD2 ASP A 39 -5.510 15.105 -5.227 1.00 0.00 O ATOM 0 H ASP A 39 -3.714 10.512 -2.754 1.00 0.00 H new ATOM 0 HA ASP A 39 -4.395 11.477 -5.302 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -5.448 13.193 -3.511 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -3.802 13.794 -3.495 1.00 0.00 H new ATOM 239 N MET A 40 -1.900 11.081 -5.222 1.00 0.00 N ATOM 240 CA MET A 40 -0.452 11.025 -5.334 1.00 0.00 C ATOM 241 C MET A 40 0.119 12.379 -5.762 1.00 0.00 C ATOM 242 O MET A 40 1.277 12.683 -5.485 1.00 0.00 O ATOM 243 CB MET A 40 -0.060 9.959 -6.361 1.00 0.00 C ATOM 244 CG MET A 40 -0.626 8.591 -5.973 1.00 0.00 C ATOM 245 SD MET A 40 0.410 7.832 -4.733 1.00 0.00 S ATOM 246 CE MET A 40 -0.206 8.651 -3.271 1.00 0.00 C ATOM 0 H MET A 40 -2.402 10.459 -5.856 1.00 0.00 H new ATOM 0 HA MET A 40 -0.041 10.771 -4.357 1.00 0.00 H new ATOM 0 HB2 MET A 40 -0.430 10.244 -7.346 1.00 0.00 H new ATOM 0 HB3 MET A 40 1.026 9.900 -6.433 1.00 0.00 H new ATOM 0 HG2 MET A 40 -1.641 8.703 -5.592 1.00 0.00 H new ATOM 0 HG3 MET A 40 -0.684 7.950 -6.852 1.00 0.00 H new ATOM 0 HE1 MET A 40 -0.183 7.959 -2.429 1.00 0.00 H new ATOM 0 HE2 MET A 40 0.420 9.515 -3.047 1.00 0.00 H new ATOM 0 HE3 MET A 40 -1.231 8.980 -3.443 1.00 0.00 H new ATOM 254 N SER A 41 -0.722 13.154 -6.431 1.00 0.00 N ATOM 255 CA SER A 41 -0.316 14.468 -6.900 1.00 0.00 C ATOM 256 C SER A 41 -0.164 15.422 -5.714 1.00 0.00 C ATOM 257 O SER A 41 0.298 16.551 -5.876 1.00 0.00 O ATOM 258 CB SER A 41 -1.321 15.028 -7.907 1.00 0.00 C ATOM 259 OG SER A 41 -2.486 14.214 -8.008 1.00 0.00 O ATOM 0 H SER A 41 -1.682 12.897 -6.659 1.00 0.00 H new ATOM 0 HA SER A 41 0.645 14.370 -7.404 1.00 0.00 H new ATOM 0 HB2 SER A 41 -1.608 16.037 -7.610 1.00 0.00 H new ATOM 0 HB3 SER A 41 -0.848 15.107 -8.886 1.00 0.00 H new ATOM 0 HG SER A 41 -3.095 14.421 -7.269 1.00 0.00 H new ATOM 264 N LYS A 42 -0.561 14.935 -4.548 1.00 0.00 N ATOM 265 CA LYS A 42 -0.475 15.730 -3.336 1.00 0.00 C ATOM 266 C LYS A 42 0.469 15.043 -2.346 1.00 0.00 C ATOM 267 O LYS A 42 1.234 15.708 -1.649 1.00 0.00 O ATOM 268 CB LYS A 42 -1.871 15.998 -2.769 1.00 0.00 C ATOM 269 CG LYS A 42 -2.889 16.196 -3.893 1.00 0.00 C ATOM 270 CD LYS A 42 -2.644 17.516 -4.629 1.00 0.00 C ATOM 271 CE LYS A 42 -3.959 18.257 -4.878 1.00 0.00 C ATOM 272 NZ LYS A 42 -3.792 19.259 -5.956 1.00 0.00 N ATOM 0 H LYS A 42 -0.943 13.999 -4.417 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.051 16.710 -3.554 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -2.178 15.164 -2.138 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.846 16.884 -2.135 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.825 15.366 -4.597 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.898 16.187 -3.480 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -1.974 18.144 -4.043 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.147 17.320 -5.579 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -4.738 17.546 -5.152 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -4.285 18.750 -3.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -4.693 19.753 -6.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -3.063 19.947 -5.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -3.502 18.781 -6.833 1.00 0.00 H new ATOM 282 N VAL A 43 0.382 13.722 -2.315 1.00 0.00 N ATOM 283 CA VAL A 43 1.219 12.938 -1.423 1.00 0.00 C ATOM 284 C VAL A 43 2.256 12.170 -2.245 1.00 0.00 C ATOM 285 O VAL A 43 2.009 11.830 -3.401 1.00 0.00 O ATOM 286 CB VAL A 43 0.348 12.025 -0.556 1.00 0.00 C ATOM 287 CG1 VAL A 43 -1.023 11.804 -1.199 1.00 0.00 C ATOM 288 CG2 VAL A 43 1.049 10.692 -0.287 1.00 0.00 C ATOM 0 H VAL A 43 -0.255 13.174 -2.893 1.00 0.00 H new ATOM 0 HA VAL A 43 1.764 13.590 -0.740 1.00 0.00 H new ATOM 0 HB VAL A 43 0.193 12.521 0.402 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.622 11.152 -0.563 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.529 12.762 -1.315 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.896 11.340 -2.177 1.00 0.00 H new ATOM 0 HG21 VAL A 43 0.409 10.062 0.331 1.00 0.00 H new ATOM 0 HG22 VAL A 43 1.249 10.189 -1.233 1.00 0.00 H new ATOM 0 HG23 VAL A 43 1.990 10.874 0.233 1.00 0.00 H new ATOM 298 N ASN A 44 3.394 11.918 -1.616 1.00 0.00 N ATOM 299 CA ASN A 44 4.470 11.198 -2.275 1.00 0.00 C ATOM 300 C ASN A 44 4.279 9.695 -2.057 1.00 0.00 C ATOM 301 O ASN A 44 3.977 9.259 -0.947 1.00 0.00 O ATOM 302 CB ASN A 44 5.831 11.590 -1.698 1.00 0.00 C ATOM 303 CG ASN A 44 6.647 12.392 -2.714 1.00 0.00 C ATOM 304 OD1 ASN A 44 6.369 12.404 -3.902 1.00 0.00 O ATOM 305 ND2 ASN A 44 7.669 13.057 -2.184 1.00 0.00 N ATOM 0 H ASN A 44 3.595 12.200 -0.656 1.00 0.00 H new ATOM 0 HA ASN A 44 4.443 11.449 -3.335 1.00 0.00 H new ATOM 0 HB2 ASN A 44 5.690 12.180 -0.793 1.00 0.00 H new ATOM 0 HB3 ASN A 44 6.380 10.693 -1.412 1.00 0.00 H new ATOM 0 HD21 ASN A 44 8.275 13.620 -2.780 1.00 0.00 H new ATOM 0 HD22 ASN A 44 7.847 13.004 -1.181 1.00 0.00 H new ATOM 311 N LEU A 45 4.463 8.945 -3.134 1.00 0.00 N ATOM 312 CA LEU A 45 4.315 7.501 -3.074 1.00 0.00 C ATOM 313 C LEU A 45 5.697 6.856 -2.942 1.00 0.00 C ATOM 314 O LEU A 45 5.820 5.741 -2.439 1.00 0.00 O ATOM 315 CB LEU A 45 3.512 6.995 -4.274 1.00 0.00 C ATOM 316 CG LEU A 45 4.315 6.292 -5.370 1.00 0.00 C ATOM 317 CD1 LEU A 45 5.384 7.221 -5.948 1.00 0.00 C ATOM 318 CD2 LEU A 45 4.912 4.979 -4.856 1.00 0.00 C ATOM 0 H LEU A 45 4.713 9.310 -4.053 1.00 0.00 H new ATOM 0 HA LEU A 45 3.743 7.213 -2.192 1.00 0.00 H new ATOM 0 HB2 LEU A 45 2.749 6.306 -3.911 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.990 7.842 -4.720 1.00 0.00 H new ATOM 0 HG LEU A 45 3.635 6.039 -6.183 1.00 0.00 H new ATOM 0 HD11 LEU A 45 5.940 6.697 -6.725 1.00 0.00 H new ATOM 0 HD12 LEU A 45 4.907 8.103 -6.376 1.00 0.00 H new ATOM 0 HD13 LEU A 45 6.068 7.526 -5.156 1.00 0.00 H new ATOM 0 HD21 LEU A 45 5.478 4.499 -5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.574 5.185 -4.015 1.00 0.00 H new ATOM 0 HD23 LEU A 45 4.109 4.317 -4.532 1.00 0.00 H new ATOM 329 N GLU A 46 6.702 7.586 -3.403 1.00 0.00 N ATOM 330 CA GLU A 46 8.069 7.100 -3.343 1.00 0.00 C ATOM 331 C GLU A 46 8.470 6.820 -1.894 1.00 0.00 C ATOM 332 O GLU A 46 9.172 5.849 -1.615 1.00 0.00 O ATOM 333 CB GLU A 46 9.033 8.092 -3.997 1.00 0.00 C ATOM 334 CG GLU A 46 9.650 7.502 -5.267 1.00 0.00 C ATOM 335 CD GLU A 46 10.318 8.589 -6.109 1.00 0.00 C ATOM 336 OE1 GLU A 46 11.426 9.012 -5.715 1.00 0.00 O ATOM 337 OE2 GLU A 46 9.706 8.974 -7.129 1.00 0.00 O ATOM 0 H GLU A 46 6.596 8.511 -3.820 1.00 0.00 H new ATOM 0 HA GLU A 46 8.126 6.166 -3.902 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.503 9.013 -4.240 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.823 8.355 -3.293 1.00 0.00 H new ATOM 0 HG2 GLU A 46 10.384 6.742 -4.999 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.877 7.006 -5.854 1.00 0.00 H new ATOM 342 N VAL A 47 8.008 7.690 -1.007 1.00 0.00 N ATOM 343 CA VAL A 47 8.309 7.549 0.407 1.00 0.00 C ATOM 344 C VAL A 47 7.557 6.339 0.967 1.00 0.00 C ATOM 345 O VAL A 47 7.756 5.959 2.120 1.00 0.00 O ATOM 346 CB VAL A 47 7.981 8.849 1.145 1.00 0.00 C ATOM 347 CG1 VAL A 47 8.919 9.977 0.709 1.00 0.00 C ATOM 348 CG2 VAL A 47 6.517 9.242 0.939 1.00 0.00 C ATOM 0 H VAL A 47 7.427 8.495 -1.241 1.00 0.00 H new ATOM 0 HA VAL A 47 9.374 7.367 0.553 1.00 0.00 H new ATOM 0 HB VAL A 47 8.134 8.678 2.211 1.00 0.00 H new ATOM 0 HG11 VAL A 47 8.665 10.890 1.248 1.00 0.00 H new ATOM 0 HG12 VAL A 47 9.950 9.699 0.931 1.00 0.00 H new ATOM 0 HG13 VAL A 47 8.811 10.146 -0.362 1.00 0.00 H new ATOM 0 HG21 VAL A 47 6.310 10.169 1.474 1.00 0.00 H new ATOM 0 HG22 VAL A 47 6.325 9.386 -0.124 1.00 0.00 H new ATOM 0 HG23 VAL A 47 5.871 8.451 1.320 1.00 0.00 H new ATOM 358 N ILE A 48 6.710 5.768 0.124 1.00 0.00 N ATOM 359 CA ILE A 48 5.927 4.609 0.519 1.00 0.00 C ATOM 360 C ILE A 48 6.452 3.371 -0.211 1.00 0.00 C ATOM 361 O ILE A 48 6.061 2.248 0.103 1.00 0.00 O ATOM 362 CB ILE A 48 4.436 4.868 0.297 1.00 0.00 C ATOM 363 CG1 ILE A 48 4.143 6.369 0.237 1.00 0.00 C ATOM 364 CG2 ILE A 48 3.592 4.161 1.359 1.00 0.00 C ATOM 365 CD1 ILE A 48 4.280 7.009 1.620 1.00 0.00 C ATOM 0 H ILE A 48 6.548 6.086 -0.832 1.00 0.00 H new ATOM 0 HA ILE A 48 6.038 4.421 1.587 1.00 0.00 H new ATOM 0 HB ILE A 48 4.156 4.447 -0.669 1.00 0.00 H new ATOM 0 HG12 ILE A 48 4.829 6.850 -0.460 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.135 6.532 -0.145 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.536 4.362 1.178 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.771 3.087 1.310 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.867 4.530 2.347 1.00 0.00 H new ATOM 0 HD11 ILE A 48 4.067 8.076 1.550 1.00 0.00 H new ATOM 0 HD12 ILE A 48 3.575 6.542 2.308 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.296 6.866 1.988 1.00 0.00 H new ATOM 376 N LYS A 49 7.331 3.618 -1.172 1.00 0.00 N ATOM 377 CA LYS A 49 7.913 2.538 -1.950 1.00 0.00 C ATOM 378 C LYS A 49 8.575 1.535 -1.004 1.00 0.00 C ATOM 379 O LYS A 49 8.378 0.328 -1.136 1.00 0.00 O ATOM 380 CB LYS A 49 8.859 3.095 -3.016 1.00 0.00 C ATOM 381 CG LYS A 49 8.408 2.680 -4.419 1.00 0.00 C ATOM 382 CD LYS A 49 6.899 2.864 -4.587 1.00 0.00 C ATOM 383 CE LYS A 49 6.180 1.513 -4.603 1.00 0.00 C ATOM 384 NZ LYS A 49 5.065 1.507 -3.631 1.00 0.00 N ATOM 0 H LYS A 49 7.654 4.551 -1.429 1.00 0.00 H new ATOM 0 HA LYS A 49 7.138 2.000 -2.495 1.00 0.00 H new ATOM 0 HB2 LYS A 49 8.891 4.182 -2.947 1.00 0.00 H new ATOM 0 HB3 LYS A 49 9.871 2.734 -2.834 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.936 3.274 -5.165 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.673 1.638 -4.596 1.00 0.00 H new ATOM 0 HD2 LYS A 49 6.511 3.477 -3.773 1.00 0.00 H new ATOM 0 HD3 LYS A 49 6.695 3.399 -5.514 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.799 1.309 -5.604 1.00 0.00 H new ATOM 0 HE3 LYS A 49 6.884 0.717 -4.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.344 0.822 -3.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.424 1.239 -2.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 4.642 2.456 -3.582 1.00 0.00 H new ATOM 394 N PRO A 50 9.368 2.084 -0.046 1.00 0.00 N ATOM 395 CA PRO A 50 10.061 1.251 0.922 1.00 0.00 C ATOM 396 C PRO A 50 9.092 0.718 1.980 1.00 0.00 C ATOM 397 O PRO A 50 9.312 -0.351 2.547 1.00 0.00 O ATOM 398 CB PRO A 50 11.146 2.142 1.504 1.00 0.00 C ATOM 399 CG PRO A 50 10.729 3.568 1.185 1.00 0.00 C ATOM 400 CD PRO A 50 9.625 3.509 0.141 1.00 0.00 C ATOM 0 HA PRO A 50 10.497 0.358 0.473 1.00 0.00 H new ATOM 0 HB2 PRO A 50 11.238 1.993 2.580 1.00 0.00 H new ATOM 0 HB3 PRO A 50 12.117 1.912 1.066 1.00 0.00 H new ATOM 0 HG2 PRO A 50 10.377 4.073 2.085 1.00 0.00 H new ATOM 0 HG3 PRO A 50 11.578 4.139 0.810 1.00 0.00 H new ATOM 0 HD2 PRO A 50 8.731 4.032 0.480 1.00 0.00 H new ATOM 0 HD3 PRO A 50 9.936 3.981 -0.791 1.00 0.00 H new ATOM 405 N TRP A 51 8.040 1.489 2.214 1.00 0.00 N ATOM 406 CA TRP A 51 7.037 1.109 3.194 1.00 0.00 C ATOM 407 C TRP A 51 6.194 -0.019 2.595 1.00 0.00 C ATOM 408 O TRP A 51 5.890 -0.998 3.274 1.00 0.00 O ATOM 409 CB TRP A 51 6.201 2.317 3.621 1.00 0.00 C ATOM 410 CG TRP A 51 5.234 2.030 4.771 1.00 0.00 C ATOM 411 CD1 TRP A 51 5.349 2.394 6.056 1.00 0.00 C ATOM 412 CD2 TRP A 51 3.992 1.300 4.688 1.00 0.00 C ATOM 413 NE1 TRP A 51 4.276 1.954 6.803 1.00 0.00 N ATOM 414 CE2 TRP A 51 3.425 1.268 5.945 1.00 0.00 C ATOM 415 CE3 TRP A 51 3.368 0.688 3.587 1.00 0.00 C ATOM 416 CZ2 TRP A 51 2.207 0.635 6.221 1.00 0.00 C ATOM 417 CZ3 TRP A 51 2.151 0.060 3.879 1.00 0.00 C ATOM 418 CH2 TRP A 51 1.568 0.018 5.139 1.00 0.00 C ATOM 0 H TRP A 51 7.861 2.375 1.742 1.00 0.00 H new ATOM 0 HA TRP A 51 7.509 0.745 4.107 1.00 0.00 H new ATOM 0 HB2 TRP A 51 6.872 3.124 3.917 1.00 0.00 H new ATOM 0 HB3 TRP A 51 5.632 2.674 2.762 1.00 0.00 H new ATOM 0 HD1 TRP A 51 6.177 2.960 6.456 1.00 0.00 H new ATOM 0 HE1 TRP A 51 4.133 2.105 7.802 1.00 0.00 H new ATOM 0 HE3 TRP A 51 3.794 0.701 2.594 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 1.784 0.623 7.214 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 1.629 -0.426 3.068 1.00 0.00 H new ATOM 0 HH2 TRP A 51 0.625 -0.489 5.283 1.00 0.00 H new ATOM 428 N ILE A 52 5.843 0.156 1.330 1.00 0.00 N ATOM 429 CA ILE A 52 5.041 -0.835 0.632 1.00 0.00 C ATOM 430 C ILE A 52 5.907 -2.060 0.326 1.00 0.00 C ATOM 431 O ILE A 52 5.530 -3.187 0.646 1.00 0.00 O ATOM 432 CB ILE A 52 4.387 -0.220 -0.606 1.00 0.00 C ATOM 433 CG1 ILE A 52 3.050 0.435 -0.252 1.00 0.00 C ATOM 434 CG2 ILE A 52 4.239 -1.257 -1.722 1.00 0.00 C ATOM 435 CD1 ILE A 52 3.008 1.887 -0.727 1.00 0.00 C ATOM 0 H ILE A 52 6.099 0.969 0.770 1.00 0.00 H new ATOM 0 HA ILE A 52 4.219 -1.173 1.263 1.00 0.00 H new ATOM 0 HB ILE A 52 5.042 0.566 -0.982 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.234 -0.125 -0.710 1.00 0.00 H new ATOM 0 HG13 ILE A 52 2.897 0.397 0.826 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.771 -0.793 -2.590 1.00 0.00 H new ATOM 0 HG22 ILE A 52 5.223 -1.636 -1.999 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.618 -2.081 -1.372 1.00 0.00 H new ATOM 0 HD11 ILE A 52 2.047 2.329 -0.463 1.00 0.00 H new ATOM 0 HD12 ILE A 52 3.810 2.450 -0.249 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.137 1.920 -1.809 1.00 0.00 H new ATOM 446 N THR A 53 7.049 -1.798 -0.290 1.00 0.00 N ATOM 447 CA THR A 53 7.971 -2.865 -0.643 1.00 0.00 C ATOM 448 C THR A 53 8.361 -3.666 0.601 1.00 0.00 C ATOM 449 O THR A 53 8.487 -4.888 0.542 1.00 0.00 O ATOM 450 CB THR A 53 9.167 -2.239 -1.362 1.00 0.00 C ATOM 451 OG1 THR A 53 8.594 -1.606 -2.504 1.00 0.00 O ATOM 452 CG2 THR A 53 10.112 -3.288 -1.952 1.00 0.00 C ATOM 0 H THR A 53 7.358 -0.862 -0.554 1.00 0.00 H new ATOM 0 HA THR A 53 7.506 -3.581 -1.320 1.00 0.00 H new ATOM 0 HB THR A 53 9.717 -1.606 -0.666 1.00 0.00 H new ATOM 0 HG1 THR A 53 8.238 -0.730 -2.248 1.00 0.00 H new ATOM 0 HG21 THR A 53 10.943 -2.789 -2.451 1.00 0.00 H new ATOM 0 HG22 THR A 53 10.496 -3.922 -1.153 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.571 -3.901 -2.673 1.00 0.00 H new ATOM 460 N LYS A 54 8.541 -2.945 1.698 1.00 0.00 N ATOM 461 CA LYS A 54 8.914 -3.573 2.953 1.00 0.00 C ATOM 462 C LYS A 54 7.702 -4.306 3.532 1.00 0.00 C ATOM 463 O LYS A 54 7.837 -5.398 4.082 1.00 0.00 O ATOM 464 CB LYS A 54 9.522 -2.544 3.908 1.00 0.00 C ATOM 465 CG LYS A 54 9.971 -3.204 5.213 1.00 0.00 C ATOM 466 CD LYS A 54 9.420 -2.450 6.426 1.00 0.00 C ATOM 467 CE LYS A 54 9.863 -3.115 7.731 1.00 0.00 C ATOM 468 NZ LYS A 54 9.800 -2.150 8.851 1.00 0.00 N ATOM 0 H LYS A 54 8.435 -1.931 1.743 1.00 0.00 H new ATOM 0 HA LYS A 54 9.691 -4.320 2.788 1.00 0.00 H new ATOM 0 HB2 LYS A 54 10.373 -2.058 3.431 1.00 0.00 H new ATOM 0 HB3 LYS A 54 8.790 -1.766 4.123 1.00 0.00 H new ATOM 0 HG2 LYS A 54 9.630 -4.239 5.238 1.00 0.00 H new ATOM 0 HG3 LYS A 54 11.060 -3.226 5.258 1.00 0.00 H new ATOM 0 HD2 LYS A 54 9.766 -1.417 6.404 1.00 0.00 H new ATOM 0 HD3 LYS A 54 8.331 -2.423 6.378 1.00 0.00 H new ATOM 0 HE2 LYS A 54 9.224 -3.972 7.945 1.00 0.00 H new ATOM 0 HE3 LYS A 54 10.880 -3.494 7.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 10.104 -2.617 9.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 10.428 -1.345 8.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 8.824 -1.808 8.960 1.00 0.00 H new ATOM 478 N ARG A 55 6.545 -3.678 3.386 1.00 0.00 N ATOM 479 CA ARG A 55 5.310 -4.257 3.888 1.00 0.00 C ATOM 480 C ARG A 55 4.971 -5.534 3.115 1.00 0.00 C ATOM 481 O ARG A 55 4.697 -6.571 3.716 1.00 0.00 O ATOM 482 CB ARG A 55 4.148 -3.269 3.762 1.00 0.00 C ATOM 483 CG ARG A 55 3.964 -2.472 5.055 1.00 0.00 C ATOM 484 CD ARG A 55 3.783 -3.405 6.254 1.00 0.00 C ATOM 485 NE ARG A 55 4.879 -3.197 7.226 1.00 0.00 N ATOM 486 CZ ARG A 55 4.947 -2.160 8.072 1.00 0.00 C ATOM 487 NH1 ARG A 55 3.984 -1.229 8.068 1.00 0.00 N ATOM 488 NH2 ARG A 55 5.979 -2.052 8.920 1.00 0.00 N ATOM 0 H ARG A 55 6.436 -2.774 2.927 1.00 0.00 H new ATOM 0 HA ARG A 55 5.458 -4.494 4.942 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.335 -2.586 2.933 1.00 0.00 H new ATOM 0 HB3 ARG A 55 3.230 -3.809 3.530 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.830 -1.830 5.217 1.00 0.00 H new ATOM 0 HG3 ARG A 55 3.096 -1.819 4.963 1.00 0.00 H new ATOM 0 HD2 ARG A 55 2.822 -3.215 6.731 1.00 0.00 H new ATOM 0 HD3 ARG A 55 3.774 -4.443 5.920 1.00 0.00 H new ATOM 0 HE ARG A 55 5.630 -3.886 7.254 1.00 0.00 H new ATOM 0 HH11 ARG A 55 3.199 -1.310 7.421 1.00 0.00 H new ATOM 0 HH12 ARG A 55 4.035 -0.439 8.712 1.00 0.00 H new ATOM 0 HH21 ARG A 55 6.714 -2.760 8.922 1.00 0.00 H new ATOM 0 HH22 ARG A 55 6.030 -1.262 9.564 1.00 0.00 H new ATOM 499 N VAL A 56 5.002 -5.414 1.796 1.00 0.00 N ATOM 500 CA VAL A 56 4.701 -6.546 0.936 1.00 0.00 C ATOM 501 C VAL A 56 5.750 -7.640 1.153 1.00 0.00 C ATOM 502 O VAL A 56 5.416 -8.822 1.208 1.00 0.00 O ATOM 503 CB VAL A 56 4.610 -6.087 -0.521 1.00 0.00 C ATOM 504 CG1 VAL A 56 3.408 -5.163 -0.730 1.00 0.00 C ATOM 505 CG2 VAL A 56 5.906 -5.407 -0.964 1.00 0.00 C ATOM 0 H VAL A 56 5.231 -4.551 1.302 1.00 0.00 H new ATOM 0 HA VAL A 56 3.730 -6.971 1.191 1.00 0.00 H new ATOM 0 HB VAL A 56 4.466 -6.971 -1.142 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.366 -4.851 -1.774 1.00 0.00 H new ATOM 0 HG12 VAL A 56 2.492 -5.694 -0.473 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.509 -4.285 -0.092 1.00 0.00 H new ATOM 0 HG21 VAL A 56 5.814 -5.091 -2.003 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.094 -4.537 -0.335 1.00 0.00 H new ATOM 0 HG23 VAL A 56 6.735 -6.108 -0.870 1.00 0.00 H new ATOM 515 N THR A 57 6.996 -7.204 1.271 1.00 0.00 N ATOM 516 CA THR A 57 8.096 -8.131 1.481 1.00 0.00 C ATOM 517 C THR A 57 7.964 -8.813 2.844 1.00 0.00 C ATOM 518 O THR A 57 8.188 -10.017 2.963 1.00 0.00 O ATOM 519 CB THR A 57 9.404 -7.358 1.311 1.00 0.00 C ATOM 520 OG1 THR A 57 9.419 -6.999 -0.068 1.00 0.00 O ATOM 521 CG2 THR A 57 10.636 -8.249 1.478 1.00 0.00 C ATOM 0 H THR A 57 7.268 -6.222 1.225 1.00 0.00 H new ATOM 0 HA THR A 57 8.081 -8.937 0.747 1.00 0.00 H new ATOM 0 HB THR A 57 9.442 -6.546 2.037 1.00 0.00 H new ATOM 0 HG1 THR A 57 9.151 -6.061 -0.165 1.00 0.00 H new ATOM 0 HG21 THR A 57 11.538 -7.651 1.348 1.00 0.00 H new ATOM 0 HG22 THR A 57 10.634 -8.690 2.475 1.00 0.00 H new ATOM 0 HG23 THR A 57 10.615 -9.042 0.731 1.00 0.00 H new ATOM 529 N GLU A 58 7.605 -8.014 3.837 1.00 0.00 N ATOM 530 CA GLU A 58 7.442 -8.526 5.187 1.00 0.00 C ATOM 531 C GLU A 58 6.171 -9.372 5.285 1.00 0.00 C ATOM 532 O GLU A 58 6.097 -10.296 6.094 1.00 0.00 O ATOM 533 CB GLU A 58 7.420 -7.385 6.207 1.00 0.00 C ATOM 534 CG GLU A 58 8.839 -6.986 6.614 1.00 0.00 C ATOM 535 CD GLU A 58 8.920 -6.700 8.115 1.00 0.00 C ATOM 536 OE1 GLU A 58 7.971 -6.063 8.622 1.00 0.00 O ATOM 537 OE2 GLU A 58 9.928 -7.122 8.721 1.00 0.00 O ATOM 0 H GLU A 58 7.422 -7.016 3.734 1.00 0.00 H new ATOM 0 HA GLU A 58 8.297 -9.161 5.419 1.00 0.00 H new ATOM 0 HB2 GLU A 58 6.904 -6.524 5.783 1.00 0.00 H new ATOM 0 HB3 GLU A 58 6.858 -7.692 7.089 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.534 -7.785 6.355 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.146 -6.102 6.055 1.00 0.00 H new ATOM 542 N ILE A 59 5.203 -9.028 4.448 1.00 0.00 N ATOM 543 CA ILE A 59 3.939 -9.745 4.430 1.00 0.00 C ATOM 544 C ILE A 59 4.205 -11.231 4.177 1.00 0.00 C ATOM 545 O ILE A 59 3.655 -12.089 4.866 1.00 0.00 O ATOM 546 CB ILE A 59 2.979 -9.112 3.421 1.00 0.00 C ATOM 547 CG1 ILE A 59 2.280 -7.891 4.022 1.00 0.00 C ATOM 548 CG2 ILE A 59 1.979 -10.143 2.894 1.00 0.00 C ATOM 549 CD1 ILE A 59 1.876 -6.897 2.930 1.00 0.00 C ATOM 0 H ILE A 59 5.269 -8.262 3.777 1.00 0.00 H new ATOM 0 HA ILE A 59 3.443 -9.669 5.398 1.00 0.00 H new ATOM 0 HB ILE A 59 3.561 -8.763 2.568 1.00 0.00 H new ATOM 0 HG12 ILE A 59 1.396 -8.209 4.574 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.943 -7.403 4.736 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.308 -9.667 2.179 1.00 0.00 H new ATOM 0 HG22 ILE A 59 2.517 -10.954 2.403 1.00 0.00 H new ATOM 0 HG23 ILE A 59 1.398 -10.544 3.725 1.00 0.00 H new ATOM 0 HD11 ILE A 59 1.381 -6.039 3.384 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.765 -6.562 2.396 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.194 -7.381 2.232 1.00 0.00 H new ATOM 560 N LEU A 60 5.047 -11.489 3.188 1.00 0.00 N ATOM 561 CA LEU A 60 5.392 -12.856 2.836 1.00 0.00 C ATOM 562 C LEU A 60 6.740 -13.215 3.465 1.00 0.00 C ATOM 563 O LEU A 60 6.890 -14.287 4.050 1.00 0.00 O ATOM 564 CB LEU A 60 5.352 -13.045 1.319 1.00 0.00 C ATOM 565 CG LEU A 60 5.060 -11.790 0.494 1.00 0.00 C ATOM 566 CD1 LEU A 60 6.346 -11.016 0.201 1.00 0.00 C ATOM 567 CD2 LEU A 60 4.297 -12.140 -0.785 1.00 0.00 C ATOM 0 H LEU A 60 5.501 -10.775 2.619 1.00 0.00 H new ATOM 0 HA LEU A 60 4.656 -13.551 3.240 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.311 -13.452 0.998 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.594 -13.793 1.086 1.00 0.00 H new ATOM 0 HG LEU A 60 4.417 -11.135 1.083 1.00 0.00 H new ATOM 0 HD11 LEU A 60 6.111 -10.129 -0.387 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.812 -10.717 1.140 1.00 0.00 H new ATOM 0 HD13 LEU A 60 7.033 -11.650 -0.359 1.00 0.00 H new ATOM 0 HD21 LEU A 60 4.102 -11.230 -1.353 1.00 0.00 H new ATOM 0 HD22 LEU A 60 4.893 -12.824 -1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.351 -12.615 -0.526 1.00 0.00 H new ATOM 578 N GLY A 61 7.686 -12.299 3.322 1.00 0.00 N ATOM 579 CA GLY A 61 9.017 -12.506 3.869 1.00 0.00 C ATOM 580 C GLY A 61 10.086 -12.332 2.788 1.00 0.00 C ATOM 581 O GLY A 61 11.279 -12.305 3.090 1.00 0.00 O ATOM 0 H GLY A 61 7.558 -11.412 2.835 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.195 -11.799 4.679 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.087 -13.506 4.297 1.00 0.00 H new ATOM 585 N PHE A 62 9.622 -12.220 1.553 1.00 0.00 N ATOM 586 CA PHE A 62 10.523 -12.050 0.427 1.00 0.00 C ATOM 587 C PHE A 62 10.081 -10.882 -0.458 1.00 0.00 C ATOM 588 O PHE A 62 8.905 -10.521 -0.473 1.00 0.00 O ATOM 589 CB PHE A 62 10.467 -13.343 -0.390 1.00 0.00 C ATOM 590 CG PHE A 62 9.056 -13.906 -0.567 1.00 0.00 C ATOM 591 CD1 PHE A 62 8.262 -13.449 -1.572 1.00 0.00 C ATOM 592 CD2 PHE A 62 8.595 -14.865 0.280 1.00 0.00 C ATOM 593 CE1 PHE A 62 6.952 -13.971 -1.736 1.00 0.00 C ATOM 594 CE2 PHE A 62 7.286 -15.389 0.116 1.00 0.00 C ATOM 595 CZ PHE A 62 6.492 -14.930 -0.889 1.00 0.00 C ATOM 0 H PHE A 62 8.632 -12.244 1.307 1.00 0.00 H new ATOM 0 HA PHE A 62 11.530 -11.838 0.785 1.00 0.00 H new ATOM 0 HB2 PHE A 62 10.900 -13.158 -1.373 1.00 0.00 H new ATOM 0 HB3 PHE A 62 11.089 -14.095 0.096 1.00 0.00 H new ATOM 0 HD1 PHE A 62 8.628 -12.689 -2.246 1.00 0.00 H new ATOM 0 HD2 PHE A 62 9.225 -15.228 1.078 1.00 0.00 H new ATOM 0 HE1 PHE A 62 6.321 -13.607 -2.533 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.921 -16.151 0.788 1.00 0.00 H new ATOM 0 HZ PHE A 62 5.496 -15.328 -1.014 1.00 0.00 H new ATOM 604 N GLU A 63 11.048 -10.324 -1.173 1.00 0.00 N ATOM 605 CA GLU A 63 10.773 -9.205 -2.057 1.00 0.00 C ATOM 606 C GLU A 63 9.880 -9.652 -3.218 1.00 0.00 C ATOM 607 O GLU A 63 10.341 -10.335 -4.132 1.00 0.00 O ATOM 608 CB GLU A 63 12.072 -8.583 -2.573 1.00 0.00 C ATOM 609 CG GLU A 63 11.836 -7.155 -3.071 1.00 0.00 C ATOM 610 CD GLU A 63 13.017 -6.666 -3.913 1.00 0.00 C ATOM 611 OE1 GLU A 63 13.510 -7.478 -4.724 1.00 0.00 O ATOM 612 OE2 GLU A 63 13.398 -5.491 -3.725 1.00 0.00 O ATOM 0 H GLU A 63 12.022 -10.626 -1.158 1.00 0.00 H new ATOM 0 HA GLU A 63 10.242 -8.441 -1.490 1.00 0.00 H new ATOM 0 HB2 GLU A 63 12.817 -8.576 -1.778 1.00 0.00 H new ATOM 0 HB3 GLU A 63 12.475 -9.192 -3.382 1.00 0.00 H new ATOM 0 HG2 GLU A 63 10.922 -7.119 -3.664 1.00 0.00 H new ATOM 0 HG3 GLU A 63 11.690 -6.489 -2.221 1.00 0.00 H new ATOM 617 N ASP A 64 8.621 -9.248 -3.143 1.00 0.00 N ATOM 618 CA ASP A 64 7.660 -9.598 -4.176 1.00 0.00 C ATOM 619 C ASP A 64 8.026 -8.872 -5.473 1.00 0.00 C ATOM 620 O ASP A 64 9.191 -8.552 -5.702 1.00 0.00 O ATOM 621 CB ASP A 64 6.246 -9.173 -3.778 1.00 0.00 C ATOM 622 CG ASP A 64 5.149 -10.188 -4.108 1.00 0.00 C ATOM 623 OD1 ASP A 64 5.079 -10.585 -5.292 1.00 0.00 O ATOM 624 OD2 ASP A 64 4.405 -10.545 -3.169 1.00 0.00 O ATOM 0 H ASP A 64 8.243 -8.682 -2.383 1.00 0.00 H new ATOM 0 HA ASP A 64 7.687 -10.679 -4.311 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.230 -8.978 -2.706 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.012 -8.232 -4.276 1.00 0.00 H new ATOM 628 N ASP A 65 7.007 -8.636 -6.287 1.00 0.00 N ATOM 629 CA ASP A 65 7.206 -7.954 -7.554 1.00 0.00 C ATOM 630 C ASP A 65 5.846 -7.664 -8.192 1.00 0.00 C ATOM 631 O ASP A 65 5.570 -6.532 -8.588 1.00 0.00 O ATOM 632 CB ASP A 65 8.008 -8.822 -8.527 1.00 0.00 C ATOM 633 CG ASP A 65 9.451 -8.371 -8.757 1.00 0.00 C ATOM 634 OD1 ASP A 65 9.690 -7.149 -8.638 1.00 0.00 O ATOM 635 OD2 ASP A 65 10.284 -9.256 -9.046 1.00 0.00 O ATOM 0 H ASP A 65 6.042 -8.905 -6.094 1.00 0.00 H new ATOM 0 HA ASP A 65 7.753 -7.032 -7.358 1.00 0.00 H new ATOM 0 HB2 ASP A 65 8.018 -9.846 -8.153 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.491 -8.838 -9.486 1.00 0.00 H new ATOM 639 N VAL A 66 5.031 -8.707 -8.271 1.00 0.00 N ATOM 640 CA VAL A 66 3.706 -8.578 -8.854 1.00 0.00 C ATOM 641 C VAL A 66 2.863 -7.639 -7.989 1.00 0.00 C ATOM 642 O VAL A 66 2.171 -6.765 -8.508 1.00 0.00 O ATOM 643 CB VAL A 66 3.075 -9.960 -9.027 1.00 0.00 C ATOM 644 CG1 VAL A 66 2.118 -10.274 -7.875 1.00 0.00 C ATOM 645 CG2 VAL A 66 2.363 -10.072 -10.377 1.00 0.00 C ATOM 0 H VAL A 66 5.263 -9.644 -7.941 1.00 0.00 H new ATOM 0 HA VAL A 66 3.767 -8.136 -9.849 1.00 0.00 H new ATOM 0 HB VAL A 66 3.876 -10.699 -9.008 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.683 -11.262 -8.023 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.665 -10.255 -6.932 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.324 -9.528 -7.848 1.00 0.00 H new ATOM 0 HG21 VAL A 66 1.923 -11.064 -10.475 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.577 -9.319 -10.438 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.081 -9.913 -11.181 1.00 0.00 H new ATOM 655 N VAL A 67 2.947 -7.852 -6.684 1.00 0.00 N ATOM 656 CA VAL A 67 2.200 -7.037 -5.741 1.00 0.00 C ATOM 657 C VAL A 67 2.812 -5.635 -5.691 1.00 0.00 C ATOM 658 O VAL A 67 2.089 -4.641 -5.647 1.00 0.00 O ATOM 659 CB VAL A 67 2.161 -7.721 -4.374 1.00 0.00 C ATOM 660 CG1 VAL A 67 2.016 -9.237 -4.523 1.00 0.00 C ATOM 661 CG2 VAL A 67 3.398 -7.368 -3.546 1.00 0.00 C ATOM 0 H VAL A 67 3.522 -8.578 -6.257 1.00 0.00 H new ATOM 0 HA VAL A 67 1.165 -6.930 -6.065 1.00 0.00 H new ATOM 0 HB VAL A 67 1.285 -7.351 -3.841 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.991 -9.699 -3.536 1.00 0.00 H new ATOM 0 HG12 VAL A 67 1.091 -9.464 -5.053 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.863 -9.630 -5.086 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.343 -7.868 -2.579 1.00 0.00 H new ATOM 0 HG22 VAL A 67 4.294 -7.695 -4.073 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.439 -6.289 -3.395 1.00 0.00 H new ATOM 671 N ILE A 68 4.136 -5.601 -5.698 1.00 0.00 N ATOM 672 CA ILE A 68 4.852 -4.338 -5.653 1.00 0.00 C ATOM 673 C ILE A 68 4.493 -3.509 -6.887 1.00 0.00 C ATOM 674 O ILE A 68 4.133 -2.338 -6.770 1.00 0.00 O ATOM 675 CB ILE A 68 6.355 -4.579 -5.491 1.00 0.00 C ATOM 676 CG1 ILE A 68 6.641 -5.454 -4.269 1.00 0.00 C ATOM 677 CG2 ILE A 68 7.121 -3.255 -5.439 1.00 0.00 C ATOM 678 CD1 ILE A 68 8.035 -6.079 -4.356 1.00 0.00 C ATOM 0 H ILE A 68 4.732 -6.428 -5.734 1.00 0.00 H new ATOM 0 HA ILE A 68 4.549 -3.760 -4.780 1.00 0.00 H new ATOM 0 HB ILE A 68 6.710 -5.122 -6.367 1.00 0.00 H new ATOM 0 HG12 ILE A 68 6.563 -4.855 -3.362 1.00 0.00 H new ATOM 0 HG13 ILE A 68 5.890 -6.241 -4.197 1.00 0.00 H new ATOM 0 HG21 ILE A 68 8.186 -3.455 -5.324 1.00 0.00 H new ATOM 0 HG22 ILE A 68 6.954 -2.701 -6.363 1.00 0.00 H new ATOM 0 HG23 ILE A 68 6.769 -2.664 -4.593 1.00 0.00 H new ATOM 0 HD11 ILE A 68 8.213 -6.696 -3.475 1.00 0.00 H new ATOM 0 HD12 ILE A 68 8.101 -6.697 -5.251 1.00 0.00 H new ATOM 0 HD13 ILE A 68 8.785 -5.290 -4.404 1.00 0.00 H new ATOM 689 N GLU A 69 4.603 -4.148 -8.043 1.00 0.00 N ATOM 690 CA GLU A 69 4.293 -3.484 -9.298 1.00 0.00 C ATOM 691 C GLU A 69 2.869 -2.926 -9.267 1.00 0.00 C ATOM 692 O GLU A 69 2.628 -1.803 -9.708 1.00 0.00 O ATOM 693 CB GLU A 69 4.486 -4.433 -10.482 1.00 0.00 C ATOM 694 CG GLU A 69 5.777 -4.113 -11.237 1.00 0.00 C ATOM 695 CD GLU A 69 5.576 -4.249 -12.748 1.00 0.00 C ATOM 696 OE1 GLU A 69 4.447 -3.961 -13.199 1.00 0.00 O ATOM 697 OE2 GLU A 69 6.557 -4.640 -13.418 1.00 0.00 O ATOM 0 H GLU A 69 4.902 -5.119 -8.137 1.00 0.00 H new ATOM 0 HA GLU A 69 4.984 -2.651 -9.426 1.00 0.00 H new ATOM 0 HB2 GLU A 69 4.515 -5.463 -10.126 1.00 0.00 H new ATOM 0 HB3 GLU A 69 3.635 -4.353 -11.159 1.00 0.00 H new ATOM 0 HG2 GLU A 69 6.100 -3.099 -10.999 1.00 0.00 H new ATOM 0 HG3 GLU A 69 6.570 -4.785 -10.910 1.00 0.00 H new ATOM 702 N PHE A 70 1.962 -3.737 -8.741 1.00 0.00 N ATOM 703 CA PHE A 70 0.568 -3.339 -8.647 1.00 0.00 C ATOM 704 C PHE A 70 0.421 -2.041 -7.849 1.00 0.00 C ATOM 705 O PHE A 70 -0.290 -1.129 -8.267 1.00 0.00 O ATOM 706 CB PHE A 70 -0.168 -4.461 -7.912 1.00 0.00 C ATOM 707 CG PHE A 70 -0.767 -5.522 -8.837 1.00 0.00 C ATOM 708 CD1 PHE A 70 -1.566 -5.150 -9.873 1.00 0.00 C ATOM 709 CD2 PHE A 70 -0.500 -6.839 -8.625 1.00 0.00 C ATOM 710 CE1 PHE A 70 -2.122 -6.135 -10.732 1.00 0.00 C ATOM 711 CE2 PHE A 70 -1.055 -7.824 -9.483 1.00 0.00 C ATOM 712 CZ PHE A 70 -1.854 -7.451 -10.519 1.00 0.00 C ATOM 0 H PHE A 70 2.166 -4.667 -8.376 1.00 0.00 H new ATOM 0 HA PHE A 70 0.161 -3.169 -9.644 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.524 -4.944 -7.222 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -0.966 -4.025 -7.311 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -1.778 -4.105 -10.043 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.135 -7.135 -7.803 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.757 -5.839 -11.554 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -0.843 -8.869 -9.313 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.276 -8.200 -11.173 1.00 0.00 H new ATOM 721 N ILE A 71 1.105 -2.001 -6.715 1.00 0.00 N ATOM 722 CA ILE A 71 1.059 -0.830 -5.856 1.00 0.00 C ATOM 723 C ILE A 71 1.822 0.317 -6.522 1.00 0.00 C ATOM 724 O ILE A 71 1.349 1.451 -6.544 1.00 0.00 O ATOM 725 CB ILE A 71 1.566 -1.175 -4.453 1.00 0.00 C ATOM 726 CG1 ILE A 71 0.727 -2.289 -3.825 1.00 0.00 C ATOM 727 CG2 ILE A 71 1.620 0.072 -3.568 1.00 0.00 C ATOM 728 CD1 ILE A 71 1.607 -3.470 -3.409 1.00 0.00 C ATOM 0 H ILE A 71 1.694 -2.760 -6.371 1.00 0.00 H new ATOM 0 HA ILE A 71 0.031 -0.494 -5.724 1.00 0.00 H new ATOM 0 HB ILE A 71 2.585 -1.552 -4.541 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.196 -1.903 -2.955 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.028 -2.626 -4.536 1.00 0.00 H new ATOM 0 HG21 ILE A 71 1.983 -0.201 -2.577 1.00 0.00 H new ATOM 0 HG22 ILE A 71 2.293 0.805 -4.013 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.622 0.501 -3.483 1.00 0.00 H new ATOM 0 HD11 ILE A 71 0.986 -4.248 -2.965 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.118 -3.869 -4.285 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.345 -3.135 -2.680 1.00 0.00 H new ATOM 739 N PHE A 72 2.991 -0.020 -7.048 1.00 0.00 N ATOM 740 CA PHE A 72 3.824 0.967 -7.713 1.00 0.00 C ATOM 741 C PHE A 72 3.130 1.522 -8.958 1.00 0.00 C ATOM 742 O PHE A 72 3.073 2.735 -9.154 1.00 0.00 O ATOM 743 CB PHE A 72 5.111 0.255 -8.135 1.00 0.00 C ATOM 744 CG PHE A 72 6.384 1.062 -7.871 1.00 0.00 C ATOM 745 CD1 PHE A 72 6.395 2.405 -8.086 1.00 0.00 C ATOM 746 CD2 PHE A 72 7.505 0.436 -7.423 1.00 0.00 C ATOM 747 CE1 PHE A 72 7.577 3.153 -7.841 1.00 0.00 C ATOM 748 CE2 PHE A 72 8.687 1.184 -7.178 1.00 0.00 C ATOM 749 CZ PHE A 72 8.698 2.528 -7.392 1.00 0.00 C ATOM 0 H PHE A 72 3.380 -0.962 -7.027 1.00 0.00 H new ATOM 0 HA PHE A 72 4.022 1.801 -7.039 1.00 0.00 H new ATOM 0 HB2 PHE A 72 5.179 -0.695 -7.605 1.00 0.00 H new ATOM 0 HB3 PHE A 72 5.054 0.023 -9.199 1.00 0.00 H new ATOM 0 HD1 PHE A 72 5.505 2.902 -8.443 1.00 0.00 H new ATOM 0 HD2 PHE A 72 7.496 -0.631 -7.253 1.00 0.00 H new ATOM 0 HE1 PHE A 72 7.586 4.219 -8.011 1.00 0.00 H new ATOM 0 HE2 PHE A 72 9.577 0.686 -6.822 1.00 0.00 H new ATOM 0 HZ PHE A 72 9.596 3.098 -7.205 1.00 0.00 H new ATOM 758 N ASN A 73 2.620 0.606 -9.769 1.00 0.00 N ATOM 759 CA ASN A 73 1.933 0.988 -10.990 1.00 0.00 C ATOM 760 C ASN A 73 0.676 1.785 -10.635 1.00 0.00 C ATOM 761 O ASN A 73 0.342 2.758 -11.309 1.00 0.00 O ATOM 762 CB ASN A 73 1.502 -0.244 -11.788 1.00 0.00 C ATOM 763 CG ASN A 73 2.658 -0.781 -12.635 1.00 0.00 C ATOM 764 OD1 ASN A 73 2.663 -0.691 -13.852 1.00 0.00 O ATOM 765 ND2 ASN A 73 3.632 -1.343 -11.926 1.00 0.00 N ATOM 0 H ASN A 73 2.669 -0.399 -9.604 1.00 0.00 H new ATOM 0 HA ASN A 73 2.620 1.585 -11.591 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.155 -1.020 -11.106 1.00 0.00 H new ATOM 0 HB3 ASN A 73 0.662 0.012 -12.434 1.00 0.00 H new ATOM 0 HD21 ASN A 73 4.448 -1.732 -12.399 1.00 0.00 H new ATOM 0 HD22 ASN A 73 3.564 -1.385 -10.909 1.00 0.00 H new ATOM 771 N GLN A 74 0.013 1.342 -9.577 1.00 0.00 N ATOM 772 CA GLN A 74 -1.200 2.001 -9.124 1.00 0.00 C ATOM 773 C GLN A 74 -0.861 3.340 -8.465 1.00 0.00 C ATOM 774 O GLN A 74 -1.576 4.324 -8.649 1.00 0.00 O ATOM 775 CB GLN A 74 -1.988 1.103 -8.168 1.00 0.00 C ATOM 776 CG GLN A 74 -2.803 0.063 -8.939 1.00 0.00 C ATOM 777 CD GLN A 74 -2.026 -0.453 -10.153 1.00 0.00 C ATOM 778 OE1 GLN A 74 -1.667 0.288 -11.052 1.00 0.00 O ATOM 779 NE2 GLN A 74 -1.787 -1.761 -10.126 1.00 0.00 N ATOM 0 H GLN A 74 0.293 0.534 -9.020 1.00 0.00 H new ATOM 0 HA GLN A 74 -1.831 2.194 -9.991 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -1.302 0.600 -7.487 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -2.654 1.712 -7.557 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -3.052 -0.770 -8.281 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -3.745 0.503 -9.266 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -2.117 -2.324 -9.342 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -1.274 -2.202 -10.890 1.00 0.00 H new ATOM 786 N LEU A 75 0.228 3.334 -7.711 1.00 0.00 N ATOM 787 CA LEU A 75 0.669 4.535 -7.024 1.00 0.00 C ATOM 788 C LEU A 75 1.375 5.456 -8.020 1.00 0.00 C ATOM 789 O LEU A 75 1.742 6.580 -7.678 1.00 0.00 O ATOM 790 CB LEU A 75 1.524 4.173 -5.807 1.00 0.00 C ATOM 791 CG LEU A 75 0.774 3.582 -4.611 1.00 0.00 C ATOM 792 CD1 LEU A 75 1.660 3.562 -3.364 1.00 0.00 C ATOM 793 CD2 LEU A 75 -0.541 4.325 -4.368 1.00 0.00 C ATOM 0 H LEU A 75 0.818 2.516 -7.561 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.186 5.085 -6.631 1.00 0.00 H new ATOM 0 HB2 LEU A 75 2.285 3.459 -6.122 1.00 0.00 H new ATOM 0 HB3 LEU A 75 2.047 5.070 -5.475 1.00 0.00 H new ATOM 0 HG LEU A 75 0.521 2.547 -4.843 1.00 0.00 H new ATOM 0 HD11 LEU A 75 1.103 3.137 -2.529 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.545 2.955 -3.556 1.00 0.00 H new ATOM 0 HD13 LEU A 75 1.964 4.579 -3.118 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.055 3.886 -3.513 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.333 5.376 -4.166 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.173 4.244 -5.252 1.00 0.00 H new ATOM 804 N GLU A 76 1.545 4.947 -9.231 1.00 0.00 N ATOM 805 CA GLU A 76 2.201 5.710 -10.278 1.00 0.00 C ATOM 806 C GLU A 76 1.215 6.688 -10.919 1.00 0.00 C ATOM 807 O GLU A 76 1.593 7.484 -11.778 1.00 0.00 O ATOM 808 CB GLU A 76 2.815 4.783 -11.330 1.00 0.00 C ATOM 809 CG GLU A 76 4.249 4.402 -10.955 1.00 0.00 C ATOM 810 CD GLU A 76 5.236 4.854 -12.034 1.00 0.00 C ATOM 811 OE1 GLU A 76 4.889 4.692 -13.224 1.00 0.00 O ATOM 812 OE2 GLU A 76 6.315 5.352 -11.643 1.00 0.00 O ATOM 0 H GLU A 76 1.239 4.015 -9.510 1.00 0.00 H new ATOM 0 HA GLU A 76 3.012 6.283 -9.829 1.00 0.00 H new ATOM 0 HB2 GLU A 76 2.209 3.882 -11.425 1.00 0.00 H new ATOM 0 HB3 GLU A 76 2.808 5.276 -12.302 1.00 0.00 H new ATOM 0 HG2 GLU A 76 4.513 4.859 -10.001 1.00 0.00 H new ATOM 0 HG3 GLU A 76 4.319 3.322 -10.822 1.00 0.00 H new ATOM 817 N VAL A 77 -0.031 6.598 -10.477 1.00 0.00 N ATOM 818 CA VAL A 77 -1.074 7.466 -10.997 1.00 0.00 C ATOM 819 C VAL A 77 -1.376 8.562 -9.974 1.00 0.00 C ATOM 820 O VAL A 77 -0.724 8.643 -8.935 1.00 0.00 O ATOM 821 CB VAL A 77 -2.307 6.637 -11.366 1.00 0.00 C ATOM 822 CG1 VAL A 77 -1.910 5.386 -12.154 1.00 0.00 C ATOM 823 CG2 VAL A 77 -3.115 6.269 -10.121 1.00 0.00 C ATOM 0 H VAL A 77 -0.342 5.937 -9.765 1.00 0.00 H new ATOM 0 HA VAL A 77 -0.742 7.957 -11.912 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.942 7.249 -12.006 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -2.804 4.814 -12.404 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -1.399 5.680 -13.071 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -1.244 4.771 -11.549 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.985 5.680 -10.413 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -2.493 5.685 -9.443 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -3.444 7.179 -9.619 1.00 0.00 H new ATOM 833 N LYS A 78 -2.365 9.379 -10.304 1.00 0.00 N ATOM 834 CA LYS A 78 -2.762 10.468 -9.427 1.00 0.00 C ATOM 835 C LYS A 78 -3.921 10.008 -8.541 1.00 0.00 C ATOM 836 O LYS A 78 -4.182 10.600 -7.495 1.00 0.00 O ATOM 837 CB LYS A 78 -3.072 11.725 -10.241 1.00 0.00 C ATOM 838 CG LYS A 78 -2.174 11.815 -11.476 1.00 0.00 C ATOM 839 CD LYS A 78 -0.739 11.398 -11.143 1.00 0.00 C ATOM 840 CE LYS A 78 0.268 12.399 -11.711 1.00 0.00 C ATOM 841 NZ LYS A 78 0.864 13.210 -10.625 1.00 0.00 N ATOM 0 H LYS A 78 -2.904 9.309 -11.167 1.00 0.00 H new ATOM 0 HA LYS A 78 -1.942 10.740 -8.763 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -4.118 11.715 -10.548 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -2.931 12.609 -9.619 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -2.569 11.174 -12.265 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -2.180 12.835 -11.861 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -0.618 11.329 -10.062 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -0.541 10.406 -11.550 1.00 0.00 H new ATOM 0 HE2 LYS A 78 1.053 11.868 -12.249 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -0.226 13.052 -12.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 1.297 14.065 -11.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 0.123 13.483 -9.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 1.591 12.652 -10.134 1.00 0.00 H new ATOM 851 N ASN A 79 -4.586 8.953 -8.992 1.00 0.00 N ATOM 852 CA ASN A 79 -5.711 8.406 -8.253 1.00 0.00 C ATOM 853 C ASN A 79 -5.667 6.879 -8.322 1.00 0.00 C ATOM 854 O ASN A 79 -6.237 6.277 -9.232 1.00 0.00 O ATOM 855 CB ASN A 79 -7.040 8.868 -8.853 1.00 0.00 C ATOM 856 CG ASN A 79 -7.841 9.691 -7.842 1.00 0.00 C ATOM 857 OD1 ASN A 79 -8.913 9.309 -7.401 1.00 0.00 O ATOM 858 ND2 ASN A 79 -7.264 10.839 -7.501 1.00 0.00 N ATOM 0 H ASN A 79 -4.367 8.463 -9.860 1.00 0.00 H new ATOM 0 HA ASN A 79 -5.639 8.755 -7.223 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -6.852 9.465 -9.746 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -7.623 8.002 -9.165 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -7.720 11.460 -6.833 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -6.365 11.099 -7.908 1.00 0.00 H new ATOM 864 N PRO A 80 -4.966 6.278 -7.324 1.00 0.00 N ATOM 865 CA PRO A 80 -4.839 4.831 -7.264 1.00 0.00 C ATOM 866 C PRO A 80 -6.141 4.187 -6.784 1.00 0.00 C ATOM 867 O PRO A 80 -6.965 4.843 -6.148 1.00 0.00 O ATOM 868 CB PRO A 80 -3.670 4.577 -6.326 1.00 0.00 C ATOM 869 CG PRO A 80 -3.482 5.863 -5.536 1.00 0.00 C ATOM 870 CD PRO A 80 -4.276 6.957 -6.231 1.00 0.00 C ATOM 0 HA PRO A 80 -4.653 4.384 -8.241 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -3.877 3.738 -5.662 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -2.768 4.326 -6.885 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -3.826 5.734 -4.510 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -2.426 6.130 -5.487 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -4.983 7.427 -5.548 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -3.622 7.745 -6.605 1.00 0.00 H new ATOM 875 N ASP A 81 -6.286 2.910 -7.105 1.00 0.00 N ATOM 876 CA ASP A 81 -7.473 2.169 -6.714 1.00 0.00 C ATOM 877 C ASP A 81 -7.112 1.185 -5.600 1.00 0.00 C ATOM 878 O ASP A 81 -6.432 0.190 -5.843 1.00 0.00 O ATOM 879 CB ASP A 81 -8.034 1.367 -7.890 1.00 0.00 C ATOM 880 CG ASP A 81 -9.287 0.547 -7.576 1.00 0.00 C ATOM 881 OD1 ASP A 81 -9.892 0.821 -6.517 1.00 0.00 O ATOM 882 OD2 ASP A 81 -9.611 -0.333 -8.400 1.00 0.00 O ATOM 0 H ASP A 81 -5.600 2.369 -7.632 1.00 0.00 H new ATOM 0 HA ASP A 81 -8.221 2.886 -6.377 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -8.263 2.056 -8.703 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -7.258 0.692 -8.253 1.00 0.00 H new ATOM 886 N SER A 82 -7.584 1.498 -4.402 1.00 0.00 N ATOM 887 CA SER A 82 -7.319 0.654 -3.250 1.00 0.00 C ATOM 888 C SER A 82 -7.960 -0.722 -3.450 1.00 0.00 C ATOM 889 O SER A 82 -7.408 -1.736 -3.025 1.00 0.00 O ATOM 890 CB SER A 82 -7.839 1.298 -1.963 1.00 0.00 C ATOM 891 OG SER A 82 -9.170 1.786 -2.111 1.00 0.00 O ATOM 0 H SER A 82 -8.148 2.324 -4.205 1.00 0.00 H new ATOM 0 HA SER A 82 -6.240 0.536 -3.155 1.00 0.00 H new ATOM 0 HB2 SER A 82 -7.808 0.568 -1.154 1.00 0.00 H new ATOM 0 HB3 SER A 82 -7.181 2.119 -1.677 1.00 0.00 H new ATOM 0 HG SER A 82 -9.156 2.765 -2.160 1.00 0.00 H new ATOM 896 N LYS A 83 -9.115 -0.712 -4.100 1.00 0.00 N ATOM 897 CA LYS A 83 -9.836 -1.946 -4.362 1.00 0.00 C ATOM 898 C LYS A 83 -8.945 -2.890 -5.172 1.00 0.00 C ATOM 899 O LYS A 83 -8.816 -4.066 -4.838 1.00 0.00 O ATOM 900 CB LYS A 83 -11.182 -1.649 -5.026 1.00 0.00 C ATOM 901 CG LYS A 83 -12.227 -1.236 -3.988 1.00 0.00 C ATOM 902 CD LYS A 83 -12.708 0.195 -4.232 1.00 0.00 C ATOM 903 CE LYS A 83 -13.245 0.820 -2.943 1.00 0.00 C ATOM 904 NZ LYS A 83 -14.725 0.785 -2.927 1.00 0.00 N ATOM 0 H LYS A 83 -9.569 0.131 -4.453 1.00 0.00 H new ATOM 0 HA LYS A 83 -10.073 -2.455 -3.428 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.061 -0.854 -5.761 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -11.528 -2.531 -5.565 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -13.075 -1.920 -4.028 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.802 -1.315 -2.988 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -11.886 0.798 -4.618 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -13.488 0.195 -4.993 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -12.853 0.281 -2.080 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -12.899 1.850 -2.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -15.073 1.213 -2.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -15.094 1.319 -3.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -15.050 -0.201 -2.984 1.00 0.00 H new ATOM 914 N MET A 84 -8.355 -2.338 -6.222 1.00 0.00 N ATOM 915 CA MET A 84 -7.480 -3.117 -7.083 1.00 0.00 C ATOM 916 C MET A 84 -6.189 -3.495 -6.354 1.00 0.00 C ATOM 917 O MET A 84 -5.652 -4.582 -6.560 1.00 0.00 O ATOM 918 CB MET A 84 -7.140 -2.305 -8.335 1.00 0.00 C ATOM 919 CG MET A 84 -7.870 -2.856 -9.562 1.00 0.00 C ATOM 920 SD MET A 84 -6.827 -4.025 -10.417 1.00 0.00 S ATOM 921 CE MET A 84 -6.938 -5.414 -9.300 1.00 0.00 C ATOM 0 H MET A 84 -8.465 -1.362 -6.496 1.00 0.00 H new ATOM 0 HA MET A 84 -7.999 -4.034 -7.363 1.00 0.00 H new ATOM 0 HB2 MET A 84 -7.416 -1.262 -8.182 1.00 0.00 H new ATOM 0 HB3 MET A 84 -6.064 -2.329 -8.507 1.00 0.00 H new ATOM 0 HG2 MET A 84 -8.798 -3.339 -9.257 1.00 0.00 H new ATOM 0 HG3 MET A 84 -8.141 -2.040 -10.232 1.00 0.00 H new ATOM 0 HE1 MET A 84 -6.444 -6.278 -9.744 1.00 0.00 H new ATOM 0 HE2 MET A 84 -6.452 -5.163 -8.357 1.00 0.00 H new ATOM 0 HE3 MET A 84 -7.986 -5.650 -9.116 1.00 0.00 H new ATOM 929 N MET A 85 -5.728 -2.577 -5.518 1.00 0.00 N ATOM 930 CA MET A 85 -4.510 -2.801 -4.758 1.00 0.00 C ATOM 931 C MET A 85 -4.660 -4.006 -3.825 1.00 0.00 C ATOM 932 O MET A 85 -3.839 -4.921 -3.852 1.00 0.00 O ATOM 933 CB MET A 85 -4.187 -1.553 -3.932 1.00 0.00 C ATOM 934 CG MET A 85 -2.721 -1.148 -4.105 1.00 0.00 C ATOM 935 SD MET A 85 -2.453 0.478 -3.417 1.00 0.00 S ATOM 936 CE MET A 85 -2.929 1.487 -4.809 1.00 0.00 C ATOM 0 H MET A 85 -6.176 -1.676 -5.350 1.00 0.00 H new ATOM 0 HA MET A 85 -3.699 -3.005 -5.457 1.00 0.00 H new ATOM 0 HB2 MET A 85 -4.834 -0.731 -4.239 1.00 0.00 H new ATOM 0 HB3 MET A 85 -4.394 -1.745 -2.879 1.00 0.00 H new ATOM 0 HG2 MET A 85 -2.074 -1.873 -3.611 1.00 0.00 H new ATOM 0 HG3 MET A 85 -2.456 -1.153 -5.162 1.00 0.00 H new ATOM 0 HE1 MET A 85 -2.070 2.064 -5.151 1.00 0.00 H new ATOM 0 HE2 MET A 85 -3.282 0.848 -5.618 1.00 0.00 H new ATOM 0 HE3 MET A 85 -3.727 2.167 -4.510 1.00 0.00 H new ATOM 944 N GLN A 86 -5.713 -3.964 -3.023 1.00 0.00 N ATOM 945 CA GLN A 86 -5.981 -5.041 -2.083 1.00 0.00 C ATOM 946 C GLN A 86 -6.359 -6.319 -2.835 1.00 0.00 C ATOM 947 O GLN A 86 -6.028 -7.421 -2.399 1.00 0.00 O ATOM 948 CB GLN A 86 -7.076 -4.643 -1.091 1.00 0.00 C ATOM 949 CG GLN A 86 -6.633 -4.909 0.349 1.00 0.00 C ATOM 950 CD GLN A 86 -7.768 -5.531 1.166 1.00 0.00 C ATOM 951 OE1 GLN A 86 -7.786 -6.717 1.449 1.00 0.00 O ATOM 952 NE2 GLN A 86 -8.711 -4.665 1.526 1.00 0.00 N ATOM 0 H GLN A 86 -6.391 -3.202 -3.004 1.00 0.00 H new ATOM 0 HA GLN A 86 -5.073 -5.234 -1.512 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -7.315 -3.587 -1.212 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -7.986 -5.203 -1.305 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -5.771 -5.576 0.351 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -6.315 -3.976 0.814 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -8.633 -3.685 1.255 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -9.512 -4.981 2.073 1.00 0.00 H new ATOM 959 N ILE A 87 -7.048 -6.128 -3.951 1.00 0.00 N ATOM 960 CA ILE A 87 -7.475 -7.253 -4.766 1.00 0.00 C ATOM 961 C ILE A 87 -6.244 -7.984 -5.305 1.00 0.00 C ATOM 962 O ILE A 87 -6.209 -9.213 -5.329 1.00 0.00 O ATOM 963 CB ILE A 87 -8.438 -6.785 -5.860 1.00 0.00 C ATOM 964 CG1 ILE A 87 -9.877 -6.738 -5.340 1.00 0.00 C ATOM 965 CG2 ILE A 87 -8.310 -7.655 -7.112 1.00 0.00 C ATOM 966 CD1 ILE A 87 -10.688 -5.663 -6.067 1.00 0.00 C ATOM 0 H ILE A 87 -7.321 -5.213 -4.309 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.034 -7.969 -4.164 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.164 -5.769 -6.144 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -10.349 -7.711 -5.478 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -9.874 -6.534 -4.269 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.005 -7.301 -7.874 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.291 -7.595 -7.494 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.543 -8.690 -6.861 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -11.706 -5.651 -5.679 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -10.227 -4.689 -5.907 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -10.709 -5.883 -7.134 1.00 0.00 H new ATOM 977 N ASN A 88 -5.262 -7.198 -5.722 1.00 0.00 N ATOM 978 CA ASN A 88 -4.032 -7.755 -6.259 1.00 0.00 C ATOM 979 C ASN A 88 -3.204 -8.343 -5.114 1.00 0.00 C ATOM 980 O ASN A 88 -2.577 -9.389 -5.272 1.00 0.00 O ATOM 981 CB ASN A 88 -3.192 -6.676 -6.945 1.00 0.00 C ATOM 982 CG ASN A 88 -3.735 -6.365 -8.342 1.00 0.00 C ATOM 983 OD1 ASN A 88 -4.010 -7.245 -9.140 1.00 0.00 O ATOM 984 ND2 ASN A 88 -3.874 -5.065 -8.590 1.00 0.00 N ATOM 0 H ASN A 88 -5.293 -6.179 -5.699 1.00 0.00 H new ATOM 0 HA ASN A 88 -4.297 -8.521 -6.987 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.194 -5.769 -6.340 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -2.156 -7.008 -7.019 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.230 -4.753 -9.494 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.625 -4.380 -7.876 1.00 0.00 H new ATOM 990 N LEU A 89 -3.228 -7.645 -3.989 1.00 0.00 N ATOM 991 CA LEU A 89 -2.487 -8.085 -2.819 1.00 0.00 C ATOM 992 C LEU A 89 -2.999 -9.458 -2.382 1.00 0.00 C ATOM 993 O LEU A 89 -2.211 -10.352 -2.081 1.00 0.00 O ATOM 994 CB LEU A 89 -2.548 -7.026 -1.716 1.00 0.00 C ATOM 995 CG LEU A 89 -1.643 -5.807 -1.906 1.00 0.00 C ATOM 996 CD1 LEU A 89 -1.518 -5.010 -0.605 1.00 0.00 C ATOM 997 CD2 LEU A 89 -0.277 -6.219 -2.459 1.00 0.00 C ATOM 0 H LEU A 89 -3.749 -6.777 -3.862 1.00 0.00 H new ATOM 0 HA LEU A 89 -1.430 -8.201 -3.060 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -3.578 -6.679 -1.629 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.291 -7.501 -0.769 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.104 -5.150 -2.644 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.870 -4.149 -0.767 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.504 -4.668 -0.292 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -1.091 -5.645 0.171 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.347 -5.334 -2.585 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.205 -6.907 -1.764 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -0.408 -6.710 -3.423 1.00 0.00 H new ATOM 1008 N THR A 90 -4.319 -9.582 -2.362 1.00 0.00 N ATOM 1009 CA THR A 90 -4.946 -10.832 -1.967 1.00 0.00 C ATOM 1010 C THR A 90 -4.481 -11.973 -2.874 1.00 0.00 C ATOM 1011 O THR A 90 -4.557 -13.141 -2.496 1.00 0.00 O ATOM 1012 CB THR A 90 -6.462 -10.625 -1.981 1.00 0.00 C ATOM 1013 OG1 THR A 90 -6.654 -9.414 -1.254 1.00 0.00 O ATOM 1014 CG2 THR A 90 -7.205 -11.678 -1.156 1.00 0.00 C ATOM 0 H THR A 90 -4.970 -8.838 -2.613 1.00 0.00 H new ATOM 0 HA THR A 90 -4.651 -11.120 -0.958 1.00 0.00 H new ATOM 0 HB THR A 90 -6.822 -10.650 -3.009 1.00 0.00 H new ATOM 0 HG1 THR A 90 -6.855 -8.686 -1.878 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.277 -11.485 -1.200 1.00 0.00 H new ATOM 0 HG22 THR A 90 -6.998 -12.669 -1.560 1.00 0.00 H new ATOM 0 HG23 THR A 90 -6.870 -11.631 -0.120 1.00 0.00 H new ATOM 1022 N GLY A 91 -4.008 -11.594 -4.051 1.00 0.00 N ATOM 1023 CA GLY A 91 -3.529 -12.572 -5.016 1.00 0.00 C ATOM 1024 C GLY A 91 -2.212 -13.198 -4.553 1.00 0.00 C ATOM 1025 O GLY A 91 -1.869 -14.305 -4.966 1.00 0.00 O ATOM 0 H GLY A 91 -3.945 -10.624 -4.360 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -4.279 -13.352 -5.152 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -3.388 -12.093 -5.985 1.00 0.00 H new ATOM 1029 N PHE A 92 -1.512 -12.465 -3.701 1.00 0.00 N ATOM 1030 CA PHE A 92 -0.240 -12.935 -3.177 1.00 0.00 C ATOM 1031 C PHE A 92 -0.306 -13.115 -1.659 1.00 0.00 C ATOM 1032 O PHE A 92 0.154 -14.127 -1.130 1.00 0.00 O ATOM 1033 CB PHE A 92 0.803 -11.865 -3.507 1.00 0.00 C ATOM 1034 CG PHE A 92 1.886 -12.332 -4.482 1.00 0.00 C ATOM 1035 CD1 PHE A 92 1.593 -12.485 -5.802 1.00 0.00 C ATOM 1036 CD2 PHE A 92 3.141 -12.596 -4.028 1.00 0.00 C ATOM 1037 CE1 PHE A 92 2.598 -12.918 -6.706 1.00 0.00 C ATOM 1038 CE2 PHE A 92 4.146 -13.029 -4.933 1.00 0.00 C ATOM 1039 CZ PHE A 92 3.853 -13.181 -6.253 1.00 0.00 C ATOM 0 H PHE A 92 -1.801 -11.548 -3.360 1.00 0.00 H new ATOM 0 HA PHE A 92 0.012 -13.899 -3.620 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.297 -10.997 -3.930 1.00 0.00 H new ATOM 0 HB3 PHE A 92 1.278 -11.537 -2.582 1.00 0.00 H new ATOM 0 HD1 PHE A 92 0.596 -12.277 -6.162 1.00 0.00 H new ATOM 0 HD2 PHE A 92 3.373 -12.476 -2.980 1.00 0.00 H new ATOM 0 HE1 PHE A 92 2.366 -13.039 -7.754 1.00 0.00 H new ATOM 0 HE2 PHE A 92 5.143 -13.238 -4.574 1.00 0.00 H new ATOM 0 HZ PHE A 92 4.617 -13.511 -6.941 1.00 0.00 H new ATOM 1048 N LEU A 93 -0.882 -12.120 -1.001 1.00 0.00 N ATOM 1049 CA LEU A 93 -1.013 -12.156 0.446 1.00 0.00 C ATOM 1050 C LEU A 93 -1.938 -13.310 0.841 1.00 0.00 C ATOM 1051 O LEU A 93 -2.275 -14.152 0.010 1.00 0.00 O ATOM 1052 CB LEU A 93 -1.465 -10.795 0.977 1.00 0.00 C ATOM 1053 CG LEU A 93 -0.751 -9.575 0.391 1.00 0.00 C ATOM 1054 CD1 LEU A 93 -0.698 -8.432 1.406 1.00 0.00 C ATOM 1055 CD2 LEU A 93 0.640 -9.950 -0.124 1.00 0.00 C ATOM 0 H LEU A 93 -1.263 -11.284 -1.443 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.047 -12.348 0.912 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.534 -10.691 0.789 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -1.329 -10.786 2.058 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.326 -9.220 -0.464 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.186 -7.577 0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.712 -8.144 1.683 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.158 -8.759 2.295 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.126 -9.065 -0.535 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.238 -10.344 0.698 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.548 -10.708 -0.902 1.00 0.00 H new ATOM 1066 N ASN A 94 -2.323 -13.309 2.108 1.00 0.00 N ATOM 1067 CA ASN A 94 -3.202 -14.344 2.624 1.00 0.00 C ATOM 1068 C ASN A 94 -4.653 -13.867 2.533 1.00 0.00 C ATOM 1069 O ASN A 94 -5.580 -14.637 2.780 1.00 0.00 O ATOM 1070 CB ASN A 94 -2.895 -14.649 4.091 1.00 0.00 C ATOM 1071 CG ASN A 94 -1.622 -15.487 4.223 1.00 0.00 C ATOM 1072 OD1 ASN A 94 -1.651 -16.706 4.259 1.00 0.00 O ATOM 1073 ND2 ASN A 94 -0.505 -14.768 4.292 1.00 0.00 N ATOM 0 H ASN A 94 -2.042 -12.607 2.793 1.00 0.00 H new ATOM 0 HA ASN A 94 -3.046 -15.244 2.030 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -2.779 -13.716 4.643 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -3.734 -15.183 4.538 1.00 0.00 H new ATOM 0 HD21 ASN A 94 0.397 -15.235 4.381 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -0.551 -13.750 4.256 1.00 0.00 H new ATOM 1079 N GLY A 95 -4.804 -12.599 2.178 1.00 0.00 N ATOM 1080 CA GLY A 95 -6.126 -12.010 2.053 1.00 0.00 C ATOM 1081 C GLY A 95 -6.412 -11.052 3.211 1.00 0.00 C ATOM 1082 O GLY A 95 -6.871 -9.932 2.995 1.00 0.00 O ATOM 0 H GLY A 95 -4.033 -11.964 1.973 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -6.201 -11.475 1.107 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -6.879 -12.798 2.034 1.00 0.00 H new ATOM 1086 N LYS A 96 -6.127 -11.528 4.414 1.00 0.00 N ATOM 1087 CA LYS A 96 -6.348 -10.728 5.607 1.00 0.00 C ATOM 1088 C LYS A 96 -5.267 -9.650 5.700 1.00 0.00 C ATOM 1089 O LYS A 96 -5.531 -8.536 6.152 1.00 0.00 O ATOM 1090 CB LYS A 96 -6.433 -11.623 6.844 1.00 0.00 C ATOM 1091 CG LYS A 96 -7.880 -12.025 7.132 1.00 0.00 C ATOM 1092 CD LYS A 96 -8.122 -13.493 6.776 1.00 0.00 C ATOM 1093 CE LYS A 96 -9.578 -13.888 7.034 1.00 0.00 C ATOM 1094 NZ LYS A 96 -10.450 -13.394 5.946 1.00 0.00 N ATOM 0 H LYS A 96 -5.745 -12.458 4.588 1.00 0.00 H new ATOM 0 HA LYS A 96 -7.307 -10.213 5.549 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.827 -12.516 6.693 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -6.019 -11.099 7.705 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -8.104 -11.861 8.186 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -8.558 -11.392 6.560 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -7.876 -13.662 5.728 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -7.460 -14.128 7.365 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -9.659 -14.972 7.109 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -9.909 -13.477 7.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -11.434 -13.671 6.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -10.386 -12.357 5.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -10.144 -13.806 5.042 1.00 0.00 H new ATOM 1104 N ASN A 97 -4.070 -10.018 5.264 1.00 0.00 N ATOM 1105 CA ASN A 97 -2.947 -9.097 5.294 1.00 0.00 C ATOM 1106 C ASN A 97 -3.198 -7.962 4.299 1.00 0.00 C ATOM 1107 O ASN A 97 -2.756 -6.834 4.514 1.00 0.00 O ATOM 1108 CB ASN A 97 -1.648 -9.798 4.891 1.00 0.00 C ATOM 1109 CG ASN A 97 -0.833 -10.194 6.124 1.00 0.00 C ATOM 1110 OD1 ASN A 97 -0.637 -11.359 6.423 1.00 0.00 O ATOM 1111 ND2 ASN A 97 -0.372 -9.159 6.822 1.00 0.00 N ATOM 0 H ASN A 97 -3.854 -10.941 4.888 1.00 0.00 H new ATOM 0 HA ASN A 97 -2.851 -8.716 6.311 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -1.877 -10.686 4.302 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -1.056 -9.138 4.256 1.00 0.00 H new ATOM 0 HD21 ASN A 97 0.182 -9.318 7.663 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -0.573 -8.207 6.516 1.00 0.00 H new ATOM 1117 N ALA A 98 -3.908 -8.298 3.232 1.00 0.00 N ATOM 1118 CA ALA A 98 -4.224 -7.322 2.203 1.00 0.00 C ATOM 1119 C ALA A 98 -5.109 -6.226 2.801 1.00 0.00 C ATOM 1120 O ALA A 98 -4.932 -5.047 2.501 1.00 0.00 O ATOM 1121 CB ALA A 98 -4.887 -8.026 1.018 1.00 0.00 C ATOM 0 H ALA A 98 -4.274 -9.234 3.058 1.00 0.00 H new ATOM 0 HA ALA A 98 -3.316 -6.847 1.832 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -5.124 -7.294 0.246 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -4.206 -8.774 0.612 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -5.804 -8.513 1.350 1.00 0.00 H new ATOM 1127 N ARG A 99 -6.043 -6.656 3.637 1.00 0.00 N ATOM 1128 CA ARG A 99 -6.957 -5.726 4.280 1.00 0.00 C ATOM 1129 C ARG A 99 -6.205 -4.856 5.289 1.00 0.00 C ATOM 1130 O ARG A 99 -6.461 -3.657 5.391 1.00 0.00 O ATOM 1131 CB ARG A 99 -8.085 -6.469 4.998 1.00 0.00 C ATOM 1132 CG ARG A 99 -8.987 -7.195 3.998 1.00 0.00 C ATOM 1133 CD ARG A 99 -10.322 -7.578 4.640 1.00 0.00 C ATOM 1134 NE ARG A 99 -10.882 -6.419 5.370 1.00 0.00 N ATOM 1135 CZ ARG A 99 -11.816 -6.514 6.326 1.00 0.00 C ATOM 1136 NH1 ARG A 99 -12.299 -7.713 6.674 1.00 0.00 N ATOM 1137 NH2 ARG A 99 -12.265 -5.407 6.935 1.00 0.00 N ATOM 0 H ARG A 99 -6.187 -7.635 3.884 1.00 0.00 H new ATOM 0 HA ARG A 99 -7.390 -5.096 3.503 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -7.663 -7.188 5.700 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.677 -5.763 5.581 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -9.166 -6.556 3.133 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -8.484 -8.091 3.634 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -11.022 -7.908 3.873 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -10.180 -8.415 5.324 1.00 0.00 H new ATOM 0 HE ARG A 99 -10.535 -5.490 5.131 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -11.956 -8.555 6.211 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -13.010 -7.785 7.402 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -11.896 -4.494 6.670 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -12.976 -5.478 7.663 1.00 0.00 H new ATOM 1148 N GLU A 100 -5.294 -5.494 6.009 1.00 0.00 N ATOM 1149 CA GLU A 100 -4.504 -4.793 7.007 1.00 0.00 C ATOM 1150 C GLU A 100 -3.459 -3.904 6.328 1.00 0.00 C ATOM 1151 O GLU A 100 -3.172 -2.806 6.801 1.00 0.00 O ATOM 1152 CB GLU A 100 -3.842 -5.777 7.973 1.00 0.00 C ATOM 1153 CG GLU A 100 -4.885 -6.457 8.863 1.00 0.00 C ATOM 1154 CD GLU A 100 -4.216 -7.207 10.017 1.00 0.00 C ATOM 1155 OE1 GLU A 100 -3.044 -7.602 9.833 1.00 0.00 O ATOM 1156 OE2 GLU A 100 -4.891 -7.367 11.056 1.00 0.00 O ATOM 0 H GLU A 100 -5.085 -6.489 5.921 1.00 0.00 H new ATOM 0 HA GLU A 100 -5.171 -4.157 7.589 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -3.292 -6.531 7.410 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -3.117 -5.251 8.594 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -5.572 -5.710 9.260 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -5.478 -7.152 8.268 1.00 0.00 H new ATOM 1161 N PHE A 101 -2.919 -4.413 5.230 1.00 0.00 N ATOM 1162 CA PHE A 101 -1.913 -3.680 4.482 1.00 0.00 C ATOM 1163 C PHE A 101 -2.473 -2.354 3.963 1.00 0.00 C ATOM 1164 O PHE A 101 -1.861 -1.303 4.145 1.00 0.00 O ATOM 1165 CB PHE A 101 -1.516 -4.553 3.290 1.00 0.00 C ATOM 1166 CG PHE A 101 -0.627 -3.844 2.267 1.00 0.00 C ATOM 1167 CD1 PHE A 101 -1.190 -3.088 1.286 1.00 0.00 C ATOM 1168 CD2 PHE A 101 0.725 -3.969 2.338 1.00 0.00 C ATOM 1169 CE1 PHE A 101 -0.364 -2.430 0.336 1.00 0.00 C ATOM 1170 CE2 PHE A 101 1.550 -3.310 1.388 1.00 0.00 C ATOM 1171 CZ PHE A 101 0.987 -2.555 0.407 1.00 0.00 C ATOM 0 H PHE A 101 -3.160 -5.325 4.841 1.00 0.00 H new ATOM 0 HA PHE A 101 -1.061 -3.458 5.125 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.995 -5.437 3.658 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -2.420 -4.901 2.791 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -2.264 -2.988 1.230 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.172 -4.569 3.117 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -0.810 -1.830 -0.443 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.624 -3.408 1.445 1.00 0.00 H new ATOM 0 HZ PHE A 101 1.614 -2.055 -0.316 1.00 0.00 H new ATOM 1180 N MET A 102 -3.632 -2.447 3.327 1.00 0.00 N ATOM 1181 CA MET A 102 -4.281 -1.268 2.779 1.00 0.00 C ATOM 1182 C MET A 102 -4.842 -0.384 3.895 1.00 0.00 C ATOM 1183 O MET A 102 -5.189 0.772 3.661 1.00 0.00 O ATOM 1184 CB MET A 102 -5.417 -1.696 1.848 1.00 0.00 C ATOM 1185 CG MET A 102 -4.880 -2.073 0.466 1.00 0.00 C ATOM 1186 SD MET A 102 -4.022 -0.684 -0.256 1.00 0.00 S ATOM 1187 CE MET A 102 -5.412 0.246 -0.880 1.00 0.00 C ATOM 0 H MET A 102 -4.138 -3.320 3.179 1.00 0.00 H new ATOM 0 HA MET A 102 -3.540 -0.694 2.222 1.00 0.00 H new ATOM 0 HB2 MET A 102 -5.946 -2.545 2.281 1.00 0.00 H new ATOM 0 HB3 MET A 102 -6.139 -0.885 1.753 1.00 0.00 H new ATOM 0 HG2 MET A 102 -4.205 -2.925 0.549 1.00 0.00 H new ATOM 0 HG3 MET A 102 -5.702 -2.380 -0.181 1.00 0.00 H new ATOM 0 HE1 MET A 102 -5.087 0.873 -1.710 1.00 0.00 H new ATOM 0 HE2 MET A 102 -6.184 -0.441 -1.225 1.00 0.00 H new ATOM 0 HE3 MET A 102 -5.815 0.875 -0.086 1.00 0.00 H new ATOM 1195 N GLY A 103 -4.914 -0.962 5.086 1.00 0.00 N ATOM 1196 CA GLY A 103 -5.426 -0.241 6.238 1.00 0.00 C ATOM 1197 C GLY A 103 -4.312 0.539 6.938 1.00 0.00 C ATOM 1198 O GLY A 103 -4.545 1.176 7.964 1.00 0.00 O ATOM 0 H GLY A 103 -4.626 -1.922 5.277 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -6.212 0.445 5.922 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -5.879 -0.943 6.939 1.00 0.00 H new ATOM 1202 N GLU A 104 -3.124 0.462 6.355 1.00 0.00 N ATOM 1203 CA GLU A 104 -1.972 1.152 6.909 1.00 0.00 C ATOM 1204 C GLU A 104 -1.262 1.959 5.820 1.00 0.00 C ATOM 1205 O GLU A 104 -0.437 2.821 6.120 1.00 0.00 O ATOM 1206 CB GLU A 104 -1.011 0.167 7.577 1.00 0.00 C ATOM 1207 CG GLU A 104 -1.707 -0.601 8.702 1.00 0.00 C ATOM 1208 CD GLU A 104 -0.932 -0.474 10.015 1.00 0.00 C ATOM 1209 OE1 GLU A 104 -0.678 0.683 10.414 1.00 0.00 O ATOM 1210 OE2 GLU A 104 -0.612 -1.536 10.590 1.00 0.00 O ATOM 0 H GLU A 104 -2.935 -0.068 5.504 1.00 0.00 H new ATOM 0 HA GLU A 104 -2.322 1.843 7.676 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -0.630 -0.534 6.835 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -0.152 0.706 7.977 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -2.719 -0.220 8.835 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.796 -1.652 8.428 1.00 0.00 H new ATOM 1215 N LEU A 105 -1.609 1.651 4.579 1.00 0.00 N ATOM 1216 CA LEU A 105 -1.014 2.336 3.445 1.00 0.00 C ATOM 1217 C LEU A 105 -1.982 3.407 2.937 1.00 0.00 C ATOM 1218 O LEU A 105 -1.574 4.528 2.640 1.00 0.00 O ATOM 1219 CB LEU A 105 -0.592 1.330 2.372 1.00 0.00 C ATOM 1220 CG LEU A 105 0.326 1.867 1.272 1.00 0.00 C ATOM 1221 CD1 LEU A 105 0.090 1.131 -0.048 1.00 0.00 C ATOM 1222 CD2 LEU A 105 0.171 3.382 1.120 1.00 0.00 C ATOM 0 H LEU A 105 -2.294 0.936 4.334 1.00 0.00 H new ATOM 0 HA LEU A 105 -0.100 2.848 3.746 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -0.089 0.496 2.862 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.491 0.930 1.904 1.00 0.00 H new ATOM 0 HG LEU A 105 1.358 1.677 1.566 1.00 0.00 H new ATOM 0 HD11 LEU A 105 0.755 1.532 -0.812 1.00 0.00 H new ATOM 0 HD12 LEU A 105 0.292 0.068 0.087 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.945 1.267 -0.360 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.834 3.738 0.332 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.861 3.618 0.860 1.00 0.00 H new ATOM 0 HD23 LEU A 105 0.429 3.870 2.060 1.00 0.00 H new ATOM 1233 N TRP A 106 -3.248 3.023 2.853 1.00 0.00 N ATOM 1234 CA TRP A 106 -4.277 3.936 2.385 1.00 0.00 C ATOM 1235 C TRP A 106 -4.300 5.142 3.325 1.00 0.00 C ATOM 1236 O TRP A 106 -4.415 6.282 2.875 1.00 0.00 O ATOM 1237 CB TRP A 106 -5.632 3.231 2.286 1.00 0.00 C ATOM 1238 CG TRP A 106 -6.579 3.844 1.252 1.00 0.00 C ATOM 1239 CD1 TRP A 106 -7.760 4.439 1.467 1.00 0.00 C ATOM 1240 CD2 TRP A 106 -6.374 3.902 -0.175 1.00 0.00 C ATOM 1241 NE1 TRP A 106 -8.330 4.872 0.287 1.00 0.00 N ATOM 1242 CE2 TRP A 106 -7.460 4.535 -0.743 1.00 0.00 C ATOM 1243 CE3 TRP A 106 -5.305 3.432 -0.961 1.00 0.00 C ATOM 1244 CZ2 TRP A 106 -7.583 4.758 -2.120 1.00 0.00 C ATOM 1245 CZ3 TRP A 106 -5.445 3.663 -2.334 1.00 0.00 C ATOM 1246 CH2 TRP A 106 -6.531 4.299 -2.922 1.00 0.00 C ATOM 0 H TRP A 106 -3.584 2.092 3.101 1.00 0.00 H new ATOM 0 HA TRP A 106 -4.055 4.283 1.376 1.00 0.00 H new ATOM 0 HB2 TRP A 106 -5.467 2.183 2.036 1.00 0.00 H new ATOM 0 HB3 TRP A 106 -6.114 3.254 3.263 1.00 0.00 H new ATOM 0 HD1 TRP A 106 -8.209 4.564 2.441 1.00 0.00 H new ATOM 0 HE1 TRP A 106 -9.225 5.351 0.189 1.00 0.00 H new ATOM 0 HE3 TRP A 106 -4.446 2.933 -0.538 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 -8.443 5.257 -2.541 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 -4.652 3.322 -2.983 1.00 0.00 H new ATOM 0 HH2 TRP A 106 -6.564 4.439 -3.992 1.00 0.00 H new ATOM 1256 N PRO A 107 -4.186 4.844 4.647 1.00 0.00 N ATOM 1257 CA PRO A 107 -4.193 5.892 5.654 1.00 0.00 C ATOM 1258 C PRO A 107 -2.859 6.642 5.673 1.00 0.00 C ATOM 1259 O PRO A 107 -2.810 7.817 6.032 1.00 0.00 O ATOM 1260 CB PRO A 107 -4.491 5.178 6.962 1.00 0.00 C ATOM 1261 CG PRO A 107 -4.181 3.711 6.716 1.00 0.00 C ATOM 1262 CD PRO A 107 -4.049 3.507 5.215 1.00 0.00 C ATOM 0 HA PRO A 107 -4.940 6.661 5.456 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -3.880 5.576 7.772 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.533 5.314 7.252 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.259 3.426 7.222 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -4.974 3.081 7.119 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -3.087 3.064 4.958 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -4.820 2.835 4.837 1.00 0.00 H new ATOM 1267 N LEU A 108 -1.812 5.932 5.283 1.00 0.00 N ATOM 1268 CA LEU A 108 -0.482 6.516 5.250 1.00 0.00 C ATOM 1269 C LEU A 108 -0.483 7.725 4.314 1.00 0.00 C ATOM 1270 O LEU A 108 0.075 8.771 4.643 1.00 0.00 O ATOM 1271 CB LEU A 108 0.561 5.456 4.886 1.00 0.00 C ATOM 1272 CG LEU A 108 1.780 5.371 5.805 1.00 0.00 C ATOM 1273 CD1 LEU A 108 1.701 4.138 6.707 1.00 0.00 C ATOM 1274 CD2 LEU A 108 3.080 5.408 4.998 1.00 0.00 C ATOM 0 H LEU A 108 -1.857 4.957 4.987 1.00 0.00 H new ATOM 0 HA LEU A 108 -0.201 6.879 6.239 1.00 0.00 H new ATOM 0 HB2 LEU A 108 0.071 4.482 4.874 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.909 5.650 3.871 1.00 0.00 H new ATOM 0 HG LEU A 108 1.779 6.246 6.454 1.00 0.00 H new ATOM 0 HD11 LEU A 108 2.580 4.101 7.351 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.803 4.194 7.322 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.664 3.239 6.092 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.931 5.346 5.676 1.00 0.00 H new ATOM 0 HD22 LEU A 108 3.104 4.565 4.308 1.00 0.00 H new ATOM 0 HD23 LEU A 108 3.132 6.340 4.435 1.00 0.00 H new ATOM 1285 N LEU A 109 -1.116 7.543 3.164 1.00 0.00 N ATOM 1286 CA LEU A 109 -1.197 8.607 2.177 1.00 0.00 C ATOM 1287 C LEU A 109 -2.178 9.675 2.665 1.00 0.00 C ATOM 1288 O LEU A 109 -2.003 10.858 2.380 1.00 0.00 O ATOM 1289 CB LEU A 109 -1.546 8.035 0.802 1.00 0.00 C ATOM 1290 CG LEU A 109 -0.813 6.752 0.403 1.00 0.00 C ATOM 1291 CD1 LEU A 109 -1.552 6.026 -0.724 1.00 0.00 C ATOM 1292 CD2 LEU A 109 0.644 7.044 0.039 1.00 0.00 C ATOM 0 H LEU A 109 -1.578 6.675 2.894 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.228 9.093 2.059 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -2.618 7.841 0.773 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -1.339 8.797 0.050 1.00 0.00 H new ATOM 0 HG LEU A 109 -0.802 6.083 1.263 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -1.010 5.118 -0.988 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -2.557 5.765 -0.391 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -1.616 6.677 -1.596 1.00 0.00 H new ATOM 0 HD21 LEU A 109 1.142 6.116 -0.241 1.00 0.00 H new ATOM 0 HD22 LEU A 109 0.677 7.740 -0.799 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.152 7.484 0.897 1.00 0.00 H new ATOM 1303 N LEU A 110 -3.186 9.219 3.393 1.00 0.00 N ATOM 1304 CA LEU A 110 -4.194 10.122 3.924 1.00 0.00 C ATOM 1305 C LEU A 110 -3.507 11.244 4.705 1.00 0.00 C ATOM 1306 O LEU A 110 -3.843 12.415 4.540 1.00 0.00 O ATOM 1307 CB LEU A 110 -5.230 9.347 4.741 1.00 0.00 C ATOM 1308 CG LEU A 110 -6.443 8.828 3.967 1.00 0.00 C ATOM 1309 CD1 LEU A 110 -6.141 8.738 2.470 1.00 0.00 C ATOM 1310 CD2 LEU A 110 -6.926 7.491 4.536 1.00 0.00 C ATOM 0 H LEU A 110 -3.327 8.236 3.628 1.00 0.00 H new ATOM 0 HA LEU A 110 -4.750 10.593 3.113 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -4.733 8.498 5.210 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -5.586 9.992 5.545 1.00 0.00 H new ATOM 0 HG LEU A 110 -7.257 9.543 4.089 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -7.020 8.366 1.943 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -5.882 9.727 2.091 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -5.306 8.057 2.308 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -7.789 7.144 3.968 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -6.125 6.755 4.465 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -7.208 7.621 5.581 1.00 0.00 H new ATOM 1321 N SER A 111 -2.559 10.845 5.540 1.00 0.00 N ATOM 1322 CA SER A 111 -1.822 11.802 6.347 1.00 0.00 C ATOM 1323 C SER A 111 -0.767 12.506 5.492 1.00 0.00 C ATOM 1324 O SER A 111 -0.462 13.676 5.715 1.00 0.00 O ATOM 1325 CB SER A 111 -1.163 11.119 7.547 1.00 0.00 C ATOM 1326 OG SER A 111 -1.788 11.477 8.776 1.00 0.00 O ATOM 0 H SER A 111 -2.284 9.872 5.675 1.00 0.00 H new ATOM 0 HA SER A 111 -2.526 12.543 6.726 1.00 0.00 H new ATOM 0 HB2 SER A 111 -1.209 10.038 7.419 1.00 0.00 H new ATOM 0 HB3 SER A 111 -0.108 11.391 7.584 1.00 0.00 H new ATOM 0 HG SER A 111 -1.339 11.019 9.517 1.00 0.00 H new ATOM 1331 N ALA A 112 -0.239 11.763 4.530 1.00 0.00 N ATOM 1332 CA ALA A 112 0.775 12.301 3.640 1.00 0.00 C ATOM 1333 C ALA A 112 0.172 13.440 2.816 1.00 0.00 C ATOM 1334 O ALA A 112 0.777 14.504 2.684 1.00 0.00 O ATOM 1335 CB ALA A 112 1.333 11.178 2.763 1.00 0.00 C ATOM 0 H ALA A 112 -0.495 10.793 4.348 1.00 0.00 H new ATOM 0 HA ALA A 112 1.607 12.712 4.211 1.00 0.00 H new ATOM 0 HB1 ALA A 112 2.094 11.582 2.095 1.00 0.00 H new ATOM 0 HB2 ALA A 112 1.776 10.409 3.395 1.00 0.00 H new ATOM 0 HB3 ALA A 112 0.527 10.742 2.173 1.00 0.00 H new ATOM 1341 N GLN A 113 -1.012 13.179 2.282 1.00 0.00 N ATOM 1342 CA GLN A 113 -1.704 14.169 1.474 1.00 0.00 C ATOM 1343 C GLN A 113 -2.043 15.399 2.318 1.00 0.00 C ATOM 1344 O GLN A 113 -2.356 16.459 1.778 1.00 0.00 O ATOM 1345 CB GLN A 113 -2.963 13.575 0.839 1.00 0.00 C ATOM 1346 CG GLN A 113 -3.987 13.190 1.909 1.00 0.00 C ATOM 1347 CD GLN A 113 -5.384 13.038 1.303 1.00 0.00 C ATOM 1348 OE1 GLN A 113 -6.278 13.838 1.530 1.00 0.00 O ATOM 1349 NE2 GLN A 113 -5.522 11.973 0.520 1.00 0.00 N ATOM 0 H GLN A 113 -1.510 12.296 2.393 1.00 0.00 H new ATOM 0 HA GLN A 113 -1.041 14.479 0.666 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -3.404 14.297 0.152 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -2.698 12.696 0.251 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -3.689 12.255 2.383 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -4.006 13.951 2.689 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -4.733 11.343 0.372 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -6.416 11.785 0.067 1.00 0.00 H new ATOM 1356 N GLU A 114 -1.969 15.218 3.627 1.00 0.00 N ATOM 1357 CA GLU A 114 -2.264 16.301 4.551 1.00 0.00 C ATOM 1358 C GLU A 114 -0.999 17.112 4.839 1.00 0.00 C ATOM 1359 O GLU A 114 -1.071 18.197 5.414 1.00 0.00 O ATOM 1360 CB GLU A 114 -2.878 15.765 5.845 1.00 0.00 C ATOM 1361 CG GLU A 114 -4.253 15.146 5.585 1.00 0.00 C ATOM 1362 CD GLU A 114 -5.346 15.896 6.350 1.00 0.00 C ATOM 1363 OE1 GLU A 114 -5.774 16.952 5.838 1.00 0.00 O ATOM 1364 OE2 GLU A 114 -5.728 15.395 7.429 1.00 0.00 O ATOM 0 H GLU A 114 -1.709 14.337 4.071 1.00 0.00 H new ATOM 0 HA GLU A 114 -2.997 16.960 4.086 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -2.216 15.018 6.283 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -2.971 16.574 6.570 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -4.470 15.169 4.517 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -4.247 14.098 5.886 1.00 0.00 H new ATOM 1369 N ASN A 115 0.130 16.555 4.427 1.00 0.00 N ATOM 1370 CA ASN A 115 1.408 17.213 4.633 1.00 0.00 C ATOM 1371 C ASN A 115 1.658 18.202 3.492 1.00 0.00 C ATOM 1372 O ASN A 115 0.739 18.545 2.751 1.00 0.00 O ATOM 1373 CB ASN A 115 2.555 16.199 4.641 1.00 0.00 C ATOM 1374 CG ASN A 115 3.296 16.219 5.979 1.00 0.00 C ATOM 1375 OD1 ASN A 115 4.404 16.712 6.098 1.00 0.00 O ATOM 1376 ND2 ASN A 115 2.621 15.656 6.978 1.00 0.00 N ATOM 0 H ASN A 115 0.186 15.655 3.951 1.00 0.00 H new ATOM 0 HA ASN A 115 1.373 17.725 5.595 1.00 0.00 H new ATOM 0 HB2 ASN A 115 2.163 15.199 4.454 1.00 0.00 H new ATOM 0 HB3 ASN A 115 3.251 16.425 3.833 1.00 0.00 H new ATOM 0 HD21 ASN A 115 3.029 15.619 7.912 1.00 0.00 H new ATOM 0 HD22 ASN A 115 1.696 15.261 6.810 1.00 0.00 H new ATOM 1382 N ILE A 116 2.908 18.631 3.387 1.00 0.00 N ATOM 1383 CA ILE A 116 3.289 19.573 2.349 1.00 0.00 C ATOM 1384 C ILE A 116 4.230 18.882 1.361 1.00 0.00 C ATOM 1385 O ILE A 116 4.137 19.100 0.153 1.00 0.00 O ATOM 1386 CB ILE A 116 3.875 20.843 2.969 1.00 0.00 C ATOM 1387 CG1 ILE A 116 3.591 22.063 2.089 1.00 0.00 C ATOM 1388 CG2 ILE A 116 5.370 20.678 3.252 1.00 0.00 C ATOM 1389 CD1 ILE A 116 4.532 22.100 0.882 1.00 0.00 C ATOM 0 H ILE A 116 3.668 18.344 4.003 1.00 0.00 H new ATOM 0 HA ILE A 116 2.413 19.895 1.785 1.00 0.00 H new ATOM 0 HB ILE A 116 3.383 21.013 3.927 1.00 0.00 H new ATOM 0 HG12 ILE A 116 2.556 22.036 1.747 1.00 0.00 H new ATOM 0 HG13 ILE A 116 3.710 22.974 2.675 1.00 0.00 H new ATOM 0 HG21 ILE A 116 5.760 21.596 3.692 1.00 0.00 H new ATOM 0 HG22 ILE A 116 5.520 19.850 3.945 1.00 0.00 H new ATOM 0 HG23 ILE A 116 5.896 20.470 2.320 1.00 0.00 H new ATOM 0 HD11 ILE A 116 4.309 22.976 0.273 1.00 0.00 H new ATOM 0 HD12 ILE A 116 5.565 22.151 1.227 1.00 0.00 H new ATOM 0 HD13 ILE A 116 4.393 21.199 0.285 1.00 0.00 H new ATOM 1400 N ALA A 117 5.114 18.061 1.909 1.00 0.00 N ATOM 1401 CA ALA A 117 6.070 17.336 1.089 1.00 0.00 C ATOM 1402 C ALA A 117 5.467 15.991 0.677 1.00 0.00 C ATOM 1403 O ALA A 117 6.137 15.172 0.050 1.00 0.00 O ATOM 1404 CB ALA A 117 7.383 17.174 1.858 1.00 0.00 C ATOM 0 H ALA A 117 5.188 17.882 2.910 1.00 0.00 H new ATOM 0 HA ALA A 117 6.291 17.891 0.177 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.100 16.630 1.243 1.00 0.00 H new ATOM 0 HB2 ALA A 117 7.786 18.157 2.101 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.200 16.619 2.778 1.00 0.00 H new ATOM 1410 N GLY A 118 4.208 15.806 1.048 1.00 0.00 N ATOM 1411 CA GLY A 118 3.507 14.575 0.725 1.00 0.00 C ATOM 1412 C GLY A 118 4.136 13.380 1.444 1.00 0.00 C ATOM 1413 O GLY A 118 4.270 12.303 0.866 1.00 0.00 O ATOM 0 H GLY A 118 3.656 16.488 1.569 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.459 14.664 1.009 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.532 14.410 -0.352 1.00 0.00 H new ATOM 1417 N ILE A 119 4.505 13.611 2.695 1.00 0.00 N ATOM 1418 CA ILE A 119 5.118 12.568 3.500 1.00 0.00 C ATOM 1419 C ILE A 119 4.258 12.316 4.741 1.00 0.00 C ATOM 1420 O ILE A 119 3.786 13.258 5.375 1.00 0.00 O ATOM 1421 CB ILE A 119 6.571 12.922 3.821 1.00 0.00 C ATOM 1422 CG1 ILE A 119 7.528 12.264 2.824 1.00 0.00 C ATOM 1423 CG2 ILE A 119 6.916 12.564 5.268 1.00 0.00 C ATOM 1424 CD1 ILE A 119 7.582 13.053 1.514 1.00 0.00 C ATOM 0 H ILE A 119 4.391 14.506 3.171 1.00 0.00 H new ATOM 0 HA ILE A 119 5.158 11.632 2.943 1.00 0.00 H new ATOM 0 HB ILE A 119 6.691 14.001 3.719 1.00 0.00 H new ATOM 0 HG12 ILE A 119 8.526 12.204 3.258 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.205 11.242 2.624 1.00 0.00 H new ATOM 0 HG21 ILE A 119 7.955 12.826 5.470 1.00 0.00 H new ATOM 0 HG22 ILE A 119 6.264 13.117 5.945 1.00 0.00 H new ATOM 0 HG23 ILE A 119 6.775 11.494 5.422 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.269 12.564 0.823 1.00 0.00 H new ATOM 0 HD12 ILE A 119 6.587 13.091 1.071 1.00 0.00 H new ATOM 0 HD13 ILE A 119 7.929 14.067 1.714 1.00 0.00 H new ATOM 1435 N PRO A 120 4.076 11.006 5.057 1.00 0.00 N ATOM 1436 CA PRO A 120 3.282 10.619 6.211 1.00 0.00 C ATOM 1437 C PRO A 120 4.048 10.862 7.512 1.00 0.00 C ATOM 1438 O PRO A 120 5.278 10.875 7.519 1.00 0.00 O ATOM 1439 CB PRO A 120 2.947 9.154 5.984 1.00 0.00 C ATOM 1440 CG PRO A 120 3.948 8.652 4.956 1.00 0.00 C ATOM 1441 CD PRO A 120 4.619 9.864 4.329 1.00 0.00 C ATOM 0 HA PRO A 120 2.373 11.211 6.313 1.00 0.00 H new ATOM 0 HB2 PRO A 120 3.023 8.588 6.912 1.00 0.00 H new ATOM 0 HB3 PRO A 120 1.925 9.038 5.623 1.00 0.00 H new ATOM 0 HG2 PRO A 120 4.689 8.007 5.428 1.00 0.00 H new ATOM 0 HG3 PRO A 120 3.446 8.056 4.194 1.00 0.00 H new ATOM 0 HD2 PRO A 120 5.703 9.811 4.427 1.00 0.00 H new ATOM 0 HD3 PRO A 120 4.398 9.932 3.264 1.00 0.00 H new ATOM 1446 N SER A 121 3.290 11.050 8.582 1.00 0.00 N ATOM 1447 CA SER A 121 3.884 11.294 9.886 1.00 0.00 C ATOM 1448 C SER A 121 4.705 10.078 10.322 1.00 0.00 C ATOM 1449 O SER A 121 5.525 10.174 11.233 1.00 0.00 O ATOM 1450 CB SER A 121 2.809 11.610 10.929 1.00 0.00 C ATOM 1451 OG SER A 121 2.085 10.447 11.320 1.00 0.00 O ATOM 0 H SER A 121 2.270 11.038 8.573 1.00 0.00 H new ATOM 0 HA SER A 121 4.542 12.160 9.807 1.00 0.00 H new ATOM 0 HB2 SER A 121 3.276 12.058 11.806 1.00 0.00 H new ATOM 0 HB3 SER A 121 2.117 12.348 10.524 1.00 0.00 H new ATOM 0 HG SER A 121 1.410 10.691 11.987 1.00 0.00 H new ATOM 1456 N ALA A 122 4.455 8.964 9.651 1.00 0.00 N ATOM 1457 CA ALA A 122 5.162 7.732 9.957 1.00 0.00 C ATOM 1458 C ALA A 122 6.663 7.949 9.765 1.00 0.00 C ATOM 1459 O ALA A 122 7.476 7.320 10.441 1.00 0.00 O ATOM 1460 CB ALA A 122 4.619 6.601 9.082 1.00 0.00 C ATOM 0 H ALA A 122 3.773 8.888 8.897 1.00 0.00 H new ATOM 0 HA ALA A 122 5.001 7.445 10.996 1.00 0.00 H new ATOM 0 HB1 ALA A 122 5.149 5.677 9.311 1.00 0.00 H new ATOM 0 HB2 ALA A 122 3.555 6.467 9.279 1.00 0.00 H new ATOM 0 HB3 ALA A 122 4.765 6.852 8.031 1.00 0.00 H new ATOM 1466 N PHE A 123 6.986 8.840 8.839 1.00 0.00 N ATOM 1467 CA PHE A 123 8.377 9.147 8.549 1.00 0.00 C ATOM 1468 C PHE A 123 8.810 10.439 9.246 1.00 0.00 C ATOM 1469 O PHE A 123 9.934 10.538 9.734 1.00 0.00 O ATOM 1470 CB PHE A 123 8.487 9.337 7.035 1.00 0.00 C ATOM 1471 CG PHE A 123 7.858 8.206 6.219 1.00 0.00 C ATOM 1472 CD1 PHE A 123 7.652 6.989 6.790 1.00 0.00 C ATOM 1473 CD2 PHE A 123 7.506 8.417 4.923 1.00 0.00 C ATOM 1474 CE1 PHE A 123 7.068 5.939 6.032 1.00 0.00 C ATOM 1475 CE2 PHE A 123 6.922 7.368 4.165 1.00 0.00 C ATOM 1476 CZ PHE A 123 6.716 6.150 4.736 1.00 0.00 C ATOM 0 H PHE A 123 6.309 9.359 8.280 1.00 0.00 H new ATOM 0 HA PHE A 123 9.018 8.341 8.905 1.00 0.00 H new ATOM 0 HB2 PHE A 123 8.009 10.278 6.761 1.00 0.00 H new ATOM 0 HB3 PHE A 123 9.540 9.424 6.765 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.932 6.821 7.819 1.00 0.00 H new ATOM 0 HD2 PHE A 123 7.671 9.383 4.470 1.00 0.00 H new ATOM 0 HE1 PHE A 123 6.904 4.973 6.486 1.00 0.00 H new ATOM 0 HE2 PHE A 123 6.641 7.537 3.136 1.00 0.00 H new ATOM 0 HZ PHE A 123 6.273 5.351 4.160 1.00 0.00 H new ATOM 1485 N LEU A 124 7.894 11.396 9.270 1.00 0.00 N ATOM 1486 CA LEU A 124 8.166 12.677 9.899 1.00 0.00 C ATOM 1487 C LEU A 124 8.693 12.443 11.317 1.00 0.00 C ATOM 1488 O LEU A 124 9.857 12.713 11.603 1.00 0.00 O ATOM 1489 CB LEU A 124 6.929 13.576 9.842 1.00 0.00 C ATOM 1490 CG LEU A 124 6.353 13.836 8.449 1.00 0.00 C ATOM 1491 CD1 LEU A 124 5.053 14.638 8.535 1.00 0.00 C ATOM 1492 CD2 LEU A 124 7.385 14.515 7.547 1.00 0.00 C ATOM 0 H LEU A 124 6.962 11.310 8.864 1.00 0.00 H new ATOM 0 HA LEU A 124 8.944 13.211 9.354 1.00 0.00 H new ATOM 0 HB2 LEU A 124 6.150 13.127 10.458 1.00 0.00 H new ATOM 0 HB3 LEU A 124 7.180 14.535 10.295 1.00 0.00 H new ATOM 0 HG LEU A 124 6.110 12.875 7.995 1.00 0.00 H new ATOM 0 HD11 LEU A 124 4.664 14.809 7.531 1.00 0.00 H new ATOM 0 HD12 LEU A 124 4.320 14.081 9.118 1.00 0.00 H new ATOM 0 HD13 LEU A 124 5.248 15.596 9.017 1.00 0.00 H new ATOM 0 HD21 LEU A 124 6.950 14.688 6.563 1.00 0.00 H new ATOM 0 HD22 LEU A 124 7.681 15.468 7.986 1.00 0.00 H new ATOM 0 HD23 LEU A 124 8.261 13.873 7.449 1.00 0.00 H new ATOM 1503 N GLU A 125 7.808 11.942 12.166 1.00 0.00 N ATOM 1504 CA GLU A 125 8.168 11.668 13.547 1.00 0.00 C ATOM 1505 C GLU A 125 9.384 10.742 13.604 1.00 0.00 C ATOM 1506 O GLU A 125 10.506 11.196 13.825 1.00 0.00 O ATOM 1507 CB GLU A 125 6.987 11.071 14.314 1.00 0.00 C ATOM 1508 CG GLU A 125 7.363 10.792 15.771 1.00 0.00 C ATOM 1509 CD GLU A 125 7.622 12.096 16.529 1.00 0.00 C ATOM 1510 OE1 GLU A 125 8.745 12.624 16.383 1.00 0.00 O ATOM 1511 OE2 GLU A 125 6.690 12.535 17.237 1.00 0.00 O ATOM 0 H GLU A 125 6.843 11.719 11.924 1.00 0.00 H new ATOM 0 HA GLU A 125 8.431 12.610 14.028 1.00 0.00 H new ATOM 0 HB2 GLU A 125 6.141 11.758 14.278 1.00 0.00 H new ATOM 0 HB3 GLU A 125 6.667 10.146 13.834 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.561 10.237 16.258 1.00 0.00 H new ATOM 0 HG3 GLU A 125 8.253 10.163 15.807 1.00 0.00 H new ATOM 1516 N LEU A 126 9.120 9.459 13.401 1.00 0.00 N ATOM 1517 CA LEU A 126 10.179 8.465 13.428 1.00 0.00 C ATOM 1518 C LEU A 126 11.213 8.797 12.350 1.00 0.00 C ATOM 1519 O LEU A 126 11.127 9.840 11.704 1.00 0.00 O ATOM 1520 CB LEU A 126 9.594 7.056 13.304 1.00 0.00 C ATOM 1521 CG LEU A 126 8.868 6.521 14.540 1.00 0.00 C ATOM 1522 CD1 LEU A 126 7.416 6.167 14.213 1.00 0.00 C ATOM 1523 CD2 LEU A 126 9.622 5.337 15.149 1.00 0.00 C ATOM 0 H LEU A 126 8.189 9.086 13.217 1.00 0.00 H new ATOM 0 HA LEU A 126 10.698 8.488 14.386 1.00 0.00 H new ATOM 0 HB2 LEU A 126 8.898 7.045 12.465 1.00 0.00 H new ATOM 0 HB3 LEU A 126 10.403 6.369 13.056 1.00 0.00 H new ATOM 0 HG LEU A 126 8.846 7.311 15.291 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.923 5.789 15.109 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.895 7.057 13.860 1.00 0.00 H new ATOM 0 HD13 LEU A 126 7.394 5.402 13.437 1.00 0.00 H new ATOM 0 HD21 LEU A 126 9.085 4.976 16.026 1.00 0.00 H new ATOM 0 HD22 LEU A 126 9.696 4.536 14.414 1.00 0.00 H new ATOM 0 HD23 LEU A 126 10.623 5.655 15.442 1.00 0.00 H new ATOM 1534 N LYS A 127 12.166 7.891 12.189 1.00 0.00 N ATOM 1535 CA LYS A 127 13.215 8.076 11.201 1.00 0.00 C ATOM 1536 C LYS A 127 12.851 7.310 9.928 1.00 0.00 C ATOM 1537 O LYS A 127 11.751 6.768 9.818 1.00 0.00 O ATOM 1538 CB LYS A 127 14.575 7.687 11.784 1.00 0.00 C ATOM 1539 CG LYS A 127 14.722 6.167 11.868 1.00 0.00 C ATOM 1540 CD LYS A 127 14.925 5.715 13.315 1.00 0.00 C ATOM 1541 CE LYS A 127 15.580 4.333 13.371 1.00 0.00 C ATOM 1542 NZ LYS A 127 17.005 4.451 13.754 1.00 0.00 N ATOM 0 H LYS A 127 12.234 7.027 12.726 1.00 0.00 H new ATOM 0 HA LYS A 127 13.300 9.128 10.928 1.00 0.00 H new ATOM 0 HB2 LYS A 127 15.371 8.099 11.164 1.00 0.00 H new ATOM 0 HB3 LYS A 127 14.687 8.122 12.777 1.00 0.00 H new ATOM 0 HG2 LYS A 127 13.834 5.689 11.455 1.00 0.00 H new ATOM 0 HG3 LYS A 127 15.568 5.846 11.261 1.00 0.00 H new ATOM 0 HD2 LYS A 127 15.548 6.438 13.842 1.00 0.00 H new ATOM 0 HD3 LYS A 127 13.964 5.687 13.829 1.00 0.00 H new ATOM 0 HE2 LYS A 127 15.055 3.704 14.090 1.00 0.00 H new ATOM 0 HE3 LYS A 127 15.497 3.845 12.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 17.435 3.505 13.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 17.506 5.034 13.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.077 4.897 14.691 1.00 0.00 H new ATOM 1552 N LYS A 128 13.794 7.290 8.998 1.00 0.00 N ATOM 1553 CA LYS A 128 13.586 6.598 7.736 1.00 0.00 C ATOM 1554 C LYS A 128 14.932 6.417 7.031 1.00 0.00 C ATOM 1555 O LYS A 128 15.631 7.392 6.760 1.00 0.00 O ATOM 1556 CB LYS A 128 12.542 7.330 6.890 1.00 0.00 C ATOM 1557 CG LYS A 128 13.165 8.519 6.159 1.00 0.00 C ATOM 1558 CD LYS A 128 12.091 9.513 5.710 1.00 0.00 C ATOM 1559 CE LYS A 128 12.588 10.369 4.544 1.00 0.00 C ATOM 1560 NZ LYS A 128 11.454 10.798 3.696 1.00 0.00 N ATOM 0 H LYS A 128 14.704 7.741 9.092 1.00 0.00 H new ATOM 0 HA LYS A 128 13.180 5.601 7.910 1.00 0.00 H new ATOM 0 HB2 LYS A 128 12.107 6.641 6.166 1.00 0.00 H new ATOM 0 HB3 LYS A 128 11.729 7.676 7.528 1.00 0.00 H new ATOM 0 HG2 LYS A 128 13.878 9.020 6.814 1.00 0.00 H new ATOM 0 HG3 LYS A 128 13.723 8.165 5.292 1.00 0.00 H new ATOM 0 HD2 LYS A 128 11.193 8.973 5.412 1.00 0.00 H new ATOM 0 HD3 LYS A 128 11.814 10.156 6.545 1.00 0.00 H new ATOM 0 HE2 LYS A 128 13.115 11.243 4.926 1.00 0.00 H new ATOM 0 HE3 LYS A 128 13.302 9.802 3.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 11.809 11.378 2.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 10.968 9.960 3.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 10.787 11.357 4.265 1.00 0.00 H new ATOM 1570 N GLU A 129 15.255 5.162 6.754 1.00 0.00 N ATOM 1571 CA GLU A 129 16.504 4.841 6.086 1.00 0.00 C ATOM 1572 C GLU A 129 16.475 5.338 4.639 1.00 0.00 C ATOM 1573 O GLU A 129 15.406 5.471 4.046 1.00 0.00 O ATOM 1574 CB GLU A 129 16.786 3.339 6.144 1.00 0.00 C ATOM 1575 CG GLU A 129 18.290 3.066 6.213 1.00 0.00 C ATOM 1576 CD GLU A 129 18.573 1.722 6.889 1.00 0.00 C ATOM 1577 OE1 GLU A 129 17.796 0.780 6.624 1.00 0.00 O ATOM 1578 OE2 GLU A 129 19.560 1.667 7.653 1.00 0.00 O ATOM 0 H GLU A 129 14.673 4.356 6.980 1.00 0.00 H new ATOM 0 HA GLU A 129 17.314 5.350 6.608 1.00 0.00 H new ATOM 0 HB2 GLU A 129 16.294 2.906 7.015 1.00 0.00 H new ATOM 0 HB3 GLU A 129 16.364 2.852 5.265 1.00 0.00 H new ATOM 0 HG2 GLU A 129 18.710 3.067 5.207 1.00 0.00 H new ATOM 0 HG3 GLU A 129 18.784 3.866 6.765 1.00 0.00 H new ATOM 1583 N GLU A 130 17.662 5.599 4.112 1.00 0.00 N ATOM 1584 CA GLU A 130 17.786 6.077 2.746 1.00 0.00 C ATOM 1585 C GLU A 130 18.290 4.957 1.835 1.00 0.00 C ATOM 1586 O GLU A 130 19.473 4.909 1.498 1.00 0.00 O ATOM 1587 CB GLU A 130 18.707 7.298 2.674 1.00 0.00 C ATOM 1588 CG GLU A 130 18.406 8.139 1.433 1.00 0.00 C ATOM 1589 CD GLU A 130 18.058 9.579 1.817 1.00 0.00 C ATOM 1590 OE1 GLU A 130 17.337 9.738 2.825 1.00 0.00 O ATOM 1591 OE2 GLU A 130 18.522 10.487 1.093 1.00 0.00 O ATOM 0 H GLU A 130 18.547 5.488 4.607 1.00 0.00 H new ATOM 0 HA GLU A 130 16.800 6.385 2.399 1.00 0.00 H new ATOM 0 HB2 GLU A 130 18.581 7.907 3.569 1.00 0.00 H new ATOM 0 HB3 GLU A 130 19.747 6.973 2.654 1.00 0.00 H new ATOM 0 HG2 GLU A 130 19.270 8.135 0.768 1.00 0.00 H new ATOM 0 HG3 GLU A 130 17.577 7.696 0.881 1.00 0.00 H new ATOM 1596 N ILE A 131 17.368 4.083 1.460 1.00 0.00 N ATOM 1597 CA ILE A 131 17.703 2.966 0.593 1.00 0.00 C ATOM 1598 C ILE A 131 18.107 3.497 -0.784 1.00 0.00 C ATOM 1599 O ILE A 131 17.329 4.187 -1.440 1.00 0.00 O ATOM 1600 CB ILE A 131 16.553 1.957 0.549 1.00 0.00 C ATOM 1601 CG1 ILE A 131 16.322 1.330 1.926 1.00 0.00 C ATOM 1602 CG2 ILE A 131 16.792 0.900 -0.530 1.00 0.00 C ATOM 1603 CD1 ILE A 131 17.505 0.451 2.334 1.00 0.00 C ATOM 0 H ILE A 131 16.388 4.126 1.741 1.00 0.00 H new ATOM 0 HA ILE A 131 18.560 2.421 0.989 1.00 0.00 H new ATOM 0 HB ILE A 131 15.641 2.489 0.280 1.00 0.00 H new ATOM 0 HG12 ILE A 131 16.176 2.116 2.667 1.00 0.00 H new ATOM 0 HG13 ILE A 131 15.410 0.733 1.909 1.00 0.00 H new ATOM 0 HG21 ILE A 131 15.960 0.196 -0.540 1.00 0.00 H new ATOM 0 HG22 ILE A 131 16.869 1.385 -1.503 1.00 0.00 H new ATOM 0 HG23 ILE A 131 17.718 0.365 -0.317 1.00 0.00 H new ATOM 0 HD11 ILE A 131 17.315 0.018 3.316 1.00 0.00 H new ATOM 0 HD12 ILE A 131 17.634 -0.348 1.604 1.00 0.00 H new ATOM 0 HD13 ILE A 131 18.411 1.056 2.373 1.00 0.00 H new ATOM 1614 N LYS A 132 19.325 3.155 -1.180 1.00 0.00 N ATOM 1615 CA LYS A 132 19.842 3.590 -2.466 1.00 0.00 C ATOM 1616 C LYS A 132 19.713 2.447 -3.475 1.00 0.00 C ATOM 1617 O LYS A 132 20.615 1.621 -3.603 1.00 0.00 O ATOM 1618 CB LYS A 132 21.269 4.120 -2.319 1.00 0.00 C ATOM 1619 CG LYS A 132 21.701 4.890 -3.569 1.00 0.00 C ATOM 1620 CD LYS A 132 21.627 6.400 -3.337 1.00 0.00 C ATOM 1621 CE LYS A 132 23.011 6.976 -3.034 1.00 0.00 C ATOM 1622 NZ LYS A 132 23.109 7.367 -1.610 1.00 0.00 N ATOM 0 H LYS A 132 19.968 2.582 -0.633 1.00 0.00 H new ATOM 0 HA LYS A 132 19.255 4.424 -2.850 1.00 0.00 H new ATOM 0 HB2 LYS A 132 21.331 4.771 -1.447 1.00 0.00 H new ATOM 0 HB3 LYS A 132 21.953 3.289 -2.145 1.00 0.00 H new ATOM 0 HG2 LYS A 132 22.719 4.610 -3.839 1.00 0.00 H new ATOM 0 HG3 LYS A 132 21.062 4.616 -4.408 1.00 0.00 H new ATOM 0 HD2 LYS A 132 21.211 6.887 -4.219 1.00 0.00 H new ATOM 0 HD3 LYS A 132 20.952 6.612 -2.508 1.00 0.00 H new ATOM 0 HE2 LYS A 132 23.778 6.238 -3.268 1.00 0.00 H new ATOM 0 HE3 LYS A 132 23.198 7.842 -3.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 24.055 7.756 -1.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 22.390 8.087 -1.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 22.952 6.533 -1.009 1.00 0.00 H new ATOM 1632 N GLN A 133 18.582 2.435 -4.167 1.00 0.00 N ATOM 1633 CA GLN A 133 18.323 1.408 -5.160 1.00 0.00 C ATOM 1634 C GLN A 133 19.089 1.710 -6.450 1.00 0.00 C ATOM 1635 O GLN A 133 19.155 2.860 -6.881 1.00 0.00 O ATOM 1636 CB GLN A 133 16.823 1.274 -5.432 1.00 0.00 C ATOM 1637 CG GLN A 133 16.230 0.088 -4.668 1.00 0.00 C ATOM 1638 CD GLN A 133 15.545 -0.892 -5.622 1.00 0.00 C ATOM 1639 OE1 GLN A 133 15.643 -0.790 -6.833 1.00 0.00 O ATOM 1640 NE2 GLN A 133 14.846 -1.843 -5.010 1.00 0.00 N ATOM 0 H GLN A 133 17.835 3.121 -4.059 1.00 0.00 H new ATOM 0 HA GLN A 133 18.675 0.454 -4.767 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.313 2.192 -5.138 1.00 0.00 H new ATOM 0 HB3 GLN A 133 16.654 1.144 -6.501 1.00 0.00 H new ATOM 0 HG2 GLN A 133 17.019 -0.426 -4.118 1.00 0.00 H new ATOM 0 HG3 GLN A 133 15.511 0.448 -3.932 1.00 0.00 H new ATOM 0 HE21 GLN A 133 14.806 -1.871 -3.991 1.00 0.00 H new ATOM 0 HE22 GLN A 133 14.350 -2.545 -5.559 1.00 0.00 H new ATOM 1647 N ARG A 134 19.648 0.657 -7.028 1.00 0.00 N ATOM 1648 CA ARG A 134 20.408 0.796 -8.260 1.00 0.00 C ATOM 1649 C ARG A 134 19.718 1.789 -9.199 1.00 0.00 C ATOM 1650 O ARG A 134 20.091 2.960 -9.251 1.00 0.00 O ATOM 1651 CB ARG A 134 20.554 -0.550 -8.970 1.00 0.00 C ATOM 1652 CG ARG A 134 21.369 -0.405 -10.258 1.00 0.00 C ATOM 1653 CD ARG A 134 20.465 -0.481 -11.489 1.00 0.00 C ATOM 1654 NE ARG A 134 20.414 -1.870 -11.996 1.00 0.00 N ATOM 1655 CZ ARG A 134 19.631 -2.274 -13.005 1.00 0.00 C ATOM 1656 NH1 ARG A 134 18.827 -1.397 -13.622 1.00 0.00 N ATOM 1657 NH2 ARG A 134 19.649 -3.555 -13.397 1.00 0.00 N ATOM 0 H ARG A 134 19.590 -0.295 -6.667 1.00 0.00 H new ATOM 0 HA ARG A 134 21.400 1.166 -8.000 1.00 0.00 H new ATOM 0 HB2 ARG A 134 21.040 -1.265 -8.306 1.00 0.00 H new ATOM 0 HB3 ARG A 134 19.568 -0.951 -9.203 1.00 0.00 H new ATOM 0 HG2 ARG A 134 21.901 0.546 -10.251 1.00 0.00 H new ATOM 0 HG3 ARG A 134 22.122 -1.191 -10.306 1.00 0.00 H new ATOM 0 HD2 ARG A 134 19.461 -0.141 -11.234 1.00 0.00 H new ATOM 0 HD3 ARG A 134 20.839 0.185 -12.267 1.00 0.00 H new ATOM 0 HE ARG A 134 21.013 -2.564 -11.549 1.00 0.00 H new ATOM 0 HH11 ARG A 134 18.811 -0.422 -13.323 1.00 0.00 H new ATOM 0 HH12 ARG A 134 18.231 -1.705 -14.390 1.00 0.00 H new ATOM 0 HH21 ARG A 134 20.259 -4.224 -12.927 1.00 0.00 H new ATOM 0 HH22 ARG A 134 19.052 -3.862 -14.165 1.00 0.00 H new TER 1668 ARG A 134