USER MOD reduce.3.24.130724 H: found=0, std=0, add=1218, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1215 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 89 TYR OH : rot 180:sc= 0.582 USER MOD Set 1.2: A 110 SER OG : rot -19:sc= 1.02 USER MOD Set 1.3: A 124 SER OG : rot -47:sc= 0.633 USER MOD Set 2.1: A 100 ASN : amide:sc= 0.76 K(o=2,f=-4.8!) USER MOD Set 2.2: A 102 LYS NZ :NH3+ 143:sc= 1.23 (180deg=0) USER MOD Set 3.1: A 99 ASN : amide:sc= 0.0848 K(o=0.92,f=-1.7) USER MOD Set 3.2: A 101 TYR OH : rot -92:sc= 0.84 USER MOD Single : A 3 SER OG : rot 65:sc= 0.98 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.0582 X(o=-0.058,f=0) USER MOD Single : A 13 THR OG1 : rot -5:sc= 1.34 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0277 USER MOD Single : A 21 ASN : amide:sc= -0.498 K(o=-0.5,f=-4.1!) USER MOD Single : A 24 ASN : amide:sc= 1.04 K(o=1,f=-3.9!) USER MOD Single : A 25 SER OG : rot 180:sc= 0.0117 USER MOD Single : A 26 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.251) USER MOD Single : A 28 GLN : amide:sc= -0.649 X(o=-0.65,f=-0.35) USER MOD Single : A 34 CYS SG : rot 180:sc= 0.0722 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -86:sc= 0.503 USER MOD Single : A 48 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 141:sc= 0.869 (180deg=-0.165) USER MOD Single : A 64 HIS : no HD1:sc= -0.0102 X(o=-0.01,f=0) USER MOD Single : A 67 HIS : no HE2:sc= -2.73 K(o=-2.7,f=-6.5!) USER MOD Single : A 72 ASN : amide:sc= -0.495 X(o=-0.5,f=-0.091) USER MOD Single : A 74 ASN : amide:sc= -0.038 K(o=-0.038,f=-1.4!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 167:sc= -0.243 (180deg=-0.723) USER MOD Single : A 84 GLN : amide:sc= -0.907 K(o=-0.91,f=-6.3!) USER MOD Single : A 91 SER OG : rot 71:sc= 0.719 USER MOD Single : A 94 LYS NZ :NH3+ -127:sc= 1.25 (180deg=-0.0711) USER MOD Single : A 97 ASN : amide:sc=-0.00591 K(o=-0.0059,f=-2.5!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot -151:sc= 0.473 USER MOD Single : A 117 ASN : amide:sc= 0.106 X(o=0.11,f=-0.029) USER MOD Single : A 118 LYS NZ :NH3+ -96:sc= 1.03 (180deg=-1.22!) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0.00967 USER MOD Single : A 123 GLN : amide:sc= 0.076 X(o=0.076,f=-0.11) USER MOD Single : A 126 ASN : amide:sc= 0.126 K(o=0.13,f=-3.6!) USER MOD Single : A 127 HIS : no HD1:sc= -0.0323 X(o=-0.032,f=-0.087) USER MOD Single : A 130 THR OG1 : rot 70:sc= 0.953 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot -14:sc= 0.166 USER MOD Single : A 142 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 CYS SG : rot 37:sc= -0.017 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0343) USER MOD Single : A 150 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 79:sc= 0.784 USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 25 N SER A 3 -14.039 -8.578 3.678 1.00 1.58 N ATOM 26 CA SER A 3 -14.292 -9.025 2.313 1.00 1.28 C ATOM 27 C SER A 3 -13.255 -8.389 1.384 1.00 1.06 C ATOM 28 O SER A 3 -12.555 -7.463 1.795 1.00 1.18 O ATOM 29 CB SER A 3 -15.730 -8.669 1.918 1.00 1.59 C ATOM 30 OG SER A 3 -16.159 -7.462 2.519 1.00 2.83 O ATOM 0 HA SER A 3 -14.193 -10.108 2.232 1.00 1.28 H new ATOM 0 HB2 SER A 3 -15.797 -8.578 0.834 1.00 1.59 H new ATOM 0 HB3 SER A 3 -16.398 -9.478 2.212 1.00 1.59 H new ATOM 0 HG SER A 3 -15.623 -6.717 2.176 1.00 2.83 H new ATOM 36 N TYR A 4 -13.133 -8.890 0.147 1.00 0.90 N ATOM 37 CA TYR A 4 -12.139 -8.428 -0.809 1.00 0.83 C ATOM 38 C TYR A 4 -12.867 -7.763 -1.967 1.00 0.76 C ATOM 39 O TYR A 4 -13.862 -8.306 -2.447 1.00 0.85 O ATOM 40 CB TYR A 4 -11.323 -9.611 -1.359 1.00 0.95 C ATOM 41 CG TYR A 4 -11.093 -10.779 -0.419 1.00 1.11 C ATOM 42 CD1 TYR A 4 -9.881 -10.898 0.284 1.00 2.30 C ATOM 43 CD2 TYR A 4 -12.077 -11.779 -0.291 1.00 2.43 C ATOM 44 CE1 TYR A 4 -9.658 -12.007 1.117 1.00 2.50 C ATOM 45 CE2 TYR A 4 -11.868 -12.883 0.552 1.00 2.65 C ATOM 46 CZ TYR A 4 -10.652 -13.000 1.265 1.00 1.81 C ATOM 47 OH TYR A 4 -10.425 -14.071 2.079 1.00 2.22 O ATOM 0 H TYR A 4 -13.731 -9.634 -0.213 1.00 0.90 H new ATOM 0 HA TYR A 4 -11.462 -7.732 -0.314 1.00 0.83 H new ATOM 0 HB2 TYR A 4 -11.827 -9.986 -2.250 1.00 0.95 H new ATOM 0 HB3 TYR A 4 -10.351 -9.234 -1.677 1.00 0.95 H new ATOM 0 HD1 TYR A 4 -9.122 -10.137 0.184 1.00 2.30 H new ATOM 0 HD2 TYR A 4 -13.000 -11.696 -0.846 1.00 2.43 H new ATOM 0 HE1 TYR A 4 -8.722 -12.101 1.647 1.00 2.50 H new ATOM 0 HE2 TYR A 4 -12.632 -13.639 0.655 1.00 2.65 H new ATOM 0 HH TYR A 4 -11.208 -14.660 2.071 1.00 2.22 H new ATOM 57 N HIS A 5 -12.347 -6.648 -2.475 1.00 0.81 N ATOM 58 CA HIS A 5 -12.874 -6.040 -3.686 1.00 0.86 C ATOM 59 C HIS A 5 -11.686 -5.482 -4.458 1.00 0.88 C ATOM 60 O HIS A 5 -10.841 -4.828 -3.860 1.00 1.03 O ATOM 61 CB HIS A 5 -13.873 -4.937 -3.299 1.00 0.93 C ATOM 62 CG HIS A 5 -14.905 -4.597 -4.350 1.00 1.04 C ATOM 63 ND1 HIS A 5 -16.198 -4.207 -4.082 1.00 1.35 N ATOM 64 CD2 HIS A 5 -14.764 -4.625 -5.713 1.00 1.04 C ATOM 65 CE1 HIS A 5 -16.820 -4.018 -5.258 1.00 1.38 C ATOM 66 NE2 HIS A 5 -15.990 -4.274 -6.284 1.00 1.17 N ATOM 0 H HIS A 5 -11.559 -6.149 -2.063 1.00 0.81 H new ATOM 0 HA HIS A 5 -13.406 -6.758 -4.309 1.00 0.86 H new ATOM 0 HB2 HIS A 5 -14.392 -5.243 -2.391 1.00 0.93 H new ATOM 0 HB3 HIS A 5 -13.314 -4.033 -3.057 1.00 0.93 H new ATOM 0 HD2 HIS A 5 -13.862 -4.875 -6.252 1.00 1.04 H new ATOM 0 HE1 HIS A 5 -17.848 -3.703 -5.364 1.00 1.38 H new ATOM 0 HE2 HIS A 5 -16.211 -4.222 -7.279 1.00 1.17 H new ATOM 74 N VAL A 6 -11.592 -5.719 -5.768 1.00 0.84 N ATOM 75 CA VAL A 6 -10.568 -5.065 -6.577 1.00 0.82 C ATOM 76 C VAL A 6 -11.228 -4.080 -7.526 1.00 0.83 C ATOM 77 O VAL A 6 -12.290 -4.378 -8.074 1.00 0.91 O ATOM 78 CB VAL A 6 -9.694 -6.089 -7.305 1.00 1.06 C ATOM 79 CG1 VAL A 6 -8.483 -5.400 -7.948 1.00 2.23 C ATOM 80 CG2 VAL A 6 -9.220 -7.122 -6.283 1.00 1.60 C ATOM 0 H VAL A 6 -12.205 -6.351 -6.284 1.00 0.84 H new ATOM 0 HA VAL A 6 -9.895 -4.507 -5.926 1.00 0.82 H new ATOM 0 HB VAL A 6 -10.270 -6.571 -8.095 1.00 1.06 H new ATOM 0 HG11 VAL A 6 -7.872 -6.143 -8.461 1.00 2.23 H new ATOM 0 HG12 VAL A 6 -8.827 -4.654 -8.665 1.00 2.23 H new ATOM 0 HG13 VAL A 6 -7.889 -4.913 -7.175 1.00 2.23 H new ATOM 0 HG21 VAL A 6 -8.594 -7.864 -6.779 1.00 1.60 H new ATOM 0 HG22 VAL A 6 -8.644 -6.624 -5.503 1.00 1.60 H new ATOM 0 HG23 VAL A 6 -10.084 -7.616 -5.837 1.00 1.60 H new ATOM 90 N VAL A 7 -10.605 -2.914 -7.709 1.00 0.78 N ATOM 91 CA VAL A 7 -11.174 -1.804 -8.446 1.00 0.77 C ATOM 92 C VAL A 7 -10.109 -1.295 -9.414 1.00 0.75 C ATOM 93 O VAL A 7 -8.954 -1.067 -9.052 1.00 0.84 O ATOM 94 CB VAL A 7 -11.650 -0.713 -7.470 1.00 0.87 C ATOM 95 CG1 VAL A 7 -12.381 0.405 -8.224 1.00 1.52 C ATOM 96 CG2 VAL A 7 -12.609 -1.285 -6.414 1.00 1.62 C ATOM 0 H VAL A 7 -9.674 -2.720 -7.339 1.00 0.78 H new ATOM 0 HA VAL A 7 -12.050 -2.114 -9.016 1.00 0.77 H new ATOM 0 HB VAL A 7 -10.762 -0.318 -6.978 1.00 0.87 H new ATOM 0 HG11 VAL A 7 -12.710 1.166 -7.517 1.00 1.52 H new ATOM 0 HG12 VAL A 7 -11.706 0.854 -8.953 1.00 1.52 H new ATOM 0 HG13 VAL A 7 -13.247 -0.010 -8.739 1.00 1.52 H new ATOM 0 HG21 VAL A 7 -12.926 -0.488 -5.741 1.00 1.62 H new ATOM 0 HG22 VAL A 7 -13.482 -1.711 -6.908 1.00 1.62 H new ATOM 0 HG23 VAL A 7 -12.100 -2.061 -5.843 1.00 1.62 H new ATOM 106 N ARG A 8 -10.495 -1.132 -10.676 1.00 0.72 N ATOM 107 CA ARG A 8 -9.605 -0.645 -11.715 1.00 0.73 C ATOM 108 C ARG A 8 -9.681 0.879 -11.723 1.00 0.70 C ATOM 109 O ARG A 8 -10.588 1.457 -12.314 1.00 0.80 O ATOM 110 CB ARG A 8 -9.997 -1.296 -13.054 1.00 0.83 C ATOM 111 CG ARG A 8 -11.393 -0.881 -13.556 1.00 1.70 C ATOM 112 CD ARG A 8 -12.069 -1.956 -14.410 1.00 2.08 C ATOM 113 NE ARG A 8 -13.403 -2.297 -13.900 1.00 3.20 N ATOM 114 CZ ARG A 8 -14.485 -1.514 -13.877 1.00 3.92 C ATOM 115 NH1 ARG A 8 -15.615 -1.964 -13.333 1.00 5.10 N ATOM 116 NH2 ARG A 8 -14.430 -0.284 -14.388 1.00 4.18 N ATOM 0 H ARG A 8 -11.439 -1.336 -11.004 1.00 0.72 H new ATOM 0 HA ARG A 8 -8.565 -0.918 -11.534 1.00 0.73 H new ATOM 0 HB2 ARG A 8 -9.256 -1.031 -13.808 1.00 0.83 H new ATOM 0 HB3 ARG A 8 -9.967 -2.380 -12.944 1.00 0.83 H new ATOM 0 HG2 ARG A 8 -12.028 -0.654 -12.699 1.00 1.70 H new ATOM 0 HG3 ARG A 8 -11.305 0.036 -14.139 1.00 1.70 H new ATOM 0 HD2 ARG A 8 -12.152 -1.605 -15.438 1.00 2.08 H new ATOM 0 HD3 ARG A 8 -11.447 -2.851 -14.428 1.00 2.08 H new ATOM 0 HE ARG A 8 -13.516 -3.237 -13.521 1.00 3.20 H new ATOM 0 HH11 ARG A 8 -15.651 -2.903 -12.936 1.00 5.10 H new ATOM 0 HH12 ARG A 8 -16.444 -1.369 -13.313 1.00 5.10 H new ATOM 0 HH21 ARG A 8 -13.561 0.060 -14.797 1.00 4.18 H new ATOM 0 HH22 ARG A 8 -15.257 0.313 -14.370 1.00 4.18 H new ATOM 130 N GLY A 9 -8.749 1.548 -11.051 1.00 0.68 N ATOM 131 CA GLY A 9 -8.697 2.991 -11.036 1.00 0.66 C ATOM 132 C GLY A 9 -7.278 3.421 -10.711 1.00 0.63 C ATOM 133 O GLY A 9 -6.335 2.642 -10.849 1.00 0.76 O ATOM 0 H GLY A 9 -8.014 1.099 -10.505 1.00 0.68 H new ATOM 0 HA2 GLY A 9 -9.001 3.391 -12.003 1.00 0.66 H new ATOM 0 HA3 GLY A 9 -9.391 3.387 -10.295 1.00 0.66 H new ATOM 137 N ASP A 10 -7.150 4.662 -10.262 1.00 0.62 N ATOM 138 CA ASP A 10 -5.899 5.310 -9.907 1.00 0.63 C ATOM 139 C ASP A 10 -5.918 5.603 -8.411 1.00 0.49 C ATOM 140 O ASP A 10 -6.977 5.772 -7.808 1.00 0.46 O ATOM 141 CB ASP A 10 -5.724 6.617 -10.697 1.00 0.79 C ATOM 142 CG ASP A 10 -5.158 6.365 -12.089 1.00 1.44 C ATOM 143 OD1 ASP A 10 -5.871 6.640 -13.081 1.00 2.72 O ATOM 144 OD2 ASP A 10 -4.014 5.864 -12.143 1.00 2.01 O ATOM 0 H ASP A 10 -7.956 5.272 -10.130 1.00 0.62 H new ATOM 0 HA ASP A 10 -5.064 4.654 -10.152 1.00 0.63 H new ATOM 0 HB2 ASP A 10 -6.686 7.122 -10.782 1.00 0.79 H new ATOM 0 HB3 ASP A 10 -5.060 7.286 -10.150 1.00 0.79 H new ATOM 149 N ILE A 11 -4.733 5.708 -7.817 1.00 0.47 N ATOM 150 CA ILE A 11 -4.535 6.010 -6.401 1.00 0.48 C ATOM 151 C ILE A 11 -5.103 7.388 -6.069 1.00 0.53 C ATOM 152 O ILE A 11 -5.770 7.565 -5.054 1.00 0.54 O ATOM 153 CB ILE A 11 -3.032 5.880 -6.099 1.00 0.59 C ATOM 154 CG1 ILE A 11 -2.673 4.380 -6.137 1.00 1.62 C ATOM 155 CG2 ILE A 11 -2.595 6.481 -4.756 1.00 1.64 C ATOM 156 CD1 ILE A 11 -1.366 4.144 -6.890 1.00 3.03 C ATOM 0 H ILE A 11 -3.856 5.582 -8.323 1.00 0.47 H new ATOM 0 HA ILE A 11 -5.074 5.309 -5.764 1.00 0.48 H new ATOM 0 HB ILE A 11 -2.500 6.455 -6.857 1.00 0.59 H new ATOM 0 HG12 ILE A 11 -2.584 3.999 -5.120 1.00 1.62 H new ATOM 0 HG13 ILE A 11 -3.478 3.823 -6.617 1.00 1.62 H new ATOM 0 HG21 ILE A 11 -1.521 6.343 -4.628 1.00 1.64 H new ATOM 0 HG22 ILE A 11 -2.829 7.545 -4.740 1.00 1.64 H new ATOM 0 HG23 ILE A 11 -3.124 5.981 -3.944 1.00 1.64 H new ATOM 0 HD11 ILE A 11 -1.139 3.078 -6.900 1.00 3.03 H new ATOM 0 HD12 ILE A 11 -1.466 4.503 -7.914 1.00 3.03 H new ATOM 0 HD13 ILE A 11 -0.558 4.682 -6.394 1.00 3.03 H new ATOM 168 N ALA A 12 -4.896 8.368 -6.948 1.00 0.66 N ATOM 169 CA ALA A 12 -5.442 9.710 -6.756 1.00 0.80 C ATOM 170 C ALA A 12 -6.948 9.768 -7.039 1.00 0.69 C ATOM 171 O ALA A 12 -7.547 10.836 -6.956 1.00 0.75 O ATOM 172 CB ALA A 12 -4.694 10.733 -7.614 1.00 1.13 C ATOM 0 H ALA A 12 -4.352 8.256 -7.803 1.00 0.66 H new ATOM 0 HA ALA A 12 -5.299 9.964 -5.706 1.00 0.80 H new ATOM 0 HB1 ALA A 12 -5.119 11.724 -7.453 1.00 1.13 H new ATOM 0 HB2 ALA A 12 -3.640 10.741 -7.335 1.00 1.13 H new ATOM 0 HB3 ALA A 12 -4.789 10.464 -8.666 1.00 1.13 H new ATOM 178 N THR A 13 -7.577 8.635 -7.354 1.00 0.60 N ATOM 179 CA THR A 13 -9.024 8.521 -7.459 1.00 0.61 C ATOM 180 C THR A 13 -9.541 7.417 -6.533 1.00 0.50 C ATOM 181 O THR A 13 -10.710 7.049 -6.606 1.00 0.53 O ATOM 182 CB THR A 13 -9.416 8.263 -8.920 1.00 0.74 C ATOM 183 OG1 THR A 13 -8.828 7.071 -9.402 1.00 0.69 O ATOM 184 CG2 THR A 13 -8.964 9.410 -9.828 1.00 0.91 C ATOM 0 H THR A 13 -7.085 7.762 -7.545 1.00 0.60 H new ATOM 0 HA THR A 13 -9.486 9.456 -7.142 1.00 0.61 H new ATOM 0 HB THR A 13 -10.503 8.180 -8.940 1.00 0.74 H new ATOM 0 HG1 THR A 13 -8.232 6.700 -8.718 1.00 0.69 H new ATOM 0 HG21 THR A 13 -9.257 9.197 -10.856 1.00 0.91 H new ATOM 0 HG22 THR A 13 -9.433 10.338 -9.502 1.00 0.91 H new ATOM 0 HG23 THR A 13 -7.880 9.512 -9.773 1.00 0.91 H new ATOM 192 N ALA A 14 -8.689 6.859 -5.670 1.00 0.43 N ATOM 193 CA ALA A 14 -9.057 5.782 -4.774 1.00 0.42 C ATOM 194 C ALA A 14 -9.643 6.395 -3.510 1.00 0.45 C ATOM 195 O ALA A 14 -9.115 6.224 -2.420 1.00 0.58 O ATOM 196 CB ALA A 14 -7.827 4.914 -4.481 1.00 0.45 C ATOM 0 H ALA A 14 -7.716 7.152 -5.580 1.00 0.43 H new ATOM 0 HA ALA A 14 -9.808 5.133 -5.225 1.00 0.42 H new ATOM 0 HB1 ALA A 14 -8.105 4.104 -3.807 1.00 0.45 H new ATOM 0 HB2 ALA A 14 -7.447 4.496 -5.413 1.00 0.45 H new ATOM 0 HB3 ALA A 14 -7.054 5.524 -4.015 1.00 0.45 H new ATOM 202 N THR A 15 -10.738 7.137 -3.647 1.00 0.45 N ATOM 203 CA THR A 15 -11.378 7.859 -2.559 1.00 0.53 C ATOM 204 C THR A 15 -12.229 6.921 -1.691 1.00 0.66 C ATOM 205 O THR A 15 -13.378 7.230 -1.388 1.00 0.86 O ATOM 206 CB THR A 15 -12.233 8.972 -3.181 1.00 0.58 C ATOM 207 OG1 THR A 15 -13.111 8.415 -4.133 1.00 1.10 O ATOM 208 CG2 THR A 15 -11.364 10.017 -3.885 1.00 0.79 C ATOM 0 H THR A 15 -11.214 7.254 -4.541 1.00 0.45 H new ATOM 0 HA THR A 15 -10.624 8.288 -1.899 1.00 0.53 H new ATOM 0 HB THR A 15 -12.787 9.455 -2.376 1.00 0.58 H new ATOM 0 HG1 THR A 15 -13.658 9.125 -4.529 1.00 1.10 H new ATOM 0 HG21 THR A 15 -12.001 10.790 -4.314 1.00 0.79 H new ATOM 0 HG22 THR A 15 -10.681 10.468 -3.165 1.00 0.79 H new ATOM 0 HG23 THR A 15 -10.790 9.538 -4.678 1.00 0.79 H new ATOM 216 N GLU A 16 -11.673 5.788 -1.262 1.00 0.67 N ATOM 217 CA GLU A 16 -12.352 4.722 -0.523 1.00 0.91 C ATOM 218 C GLU A 16 -12.270 4.990 0.975 1.00 1.08 C ATOM 219 O GLU A 16 -11.884 4.153 1.786 1.00 1.16 O ATOM 220 CB GLU A 16 -11.686 3.392 -0.901 1.00 1.00 C ATOM 221 CG GLU A 16 -12.635 2.500 -1.700 1.00 1.04 C ATOM 222 CD GLU A 16 -13.783 2.015 -0.815 1.00 2.40 C ATOM 223 OE1 GLU A 16 -14.767 2.780 -0.699 1.00 3.38 O ATOM 224 OE2 GLU A 16 -13.650 0.907 -0.249 1.00 3.78 O ATOM 0 H GLU A 16 -10.689 5.578 -1.428 1.00 0.67 H new ATOM 0 HA GLU A 16 -13.410 4.680 -0.781 1.00 0.91 H new ATOM 0 HB2 GLU A 16 -10.788 3.587 -1.487 1.00 1.00 H new ATOM 0 HB3 GLU A 16 -11.370 2.872 0.003 1.00 1.00 H new ATOM 0 HG2 GLU A 16 -13.032 3.052 -2.552 1.00 1.04 H new ATOM 0 HG3 GLU A 16 -12.090 1.645 -2.100 1.00 1.04 H new ATOM 231 N GLY A 17 -12.531 6.236 1.346 1.00 1.25 N ATOM 232 CA GLY A 17 -12.254 6.702 2.689 1.00 1.35 C ATOM 233 C GLY A 17 -10.768 7.011 2.852 1.00 1.17 C ATOM 234 O GLY A 17 -10.435 8.093 3.335 1.00 1.29 O ATOM 0 H GLY A 17 -12.936 6.941 0.730 1.00 1.25 H new ATOM 0 HA2 GLY A 17 -12.842 7.595 2.899 1.00 1.35 H new ATOM 0 HA3 GLY A 17 -12.555 5.945 3.412 1.00 1.35 H new ATOM 238 N VAL A 18 -9.889 6.082 2.463 1.00 0.95 N ATOM 239 CA VAL A 18 -8.492 6.027 2.851 1.00 0.85 C ATOM 240 C VAL A 18 -7.702 5.516 1.654 1.00 0.69 C ATOM 241 O VAL A 18 -8.194 4.666 0.914 1.00 0.68 O ATOM 242 CB VAL A 18 -8.340 5.048 4.029 1.00 0.92 C ATOM 243 CG1 VAL A 18 -6.902 5.001 4.560 1.00 0.77 C ATOM 244 CG2 VAL A 18 -9.257 5.422 5.193 1.00 1.54 C ATOM 0 H VAL A 18 -10.152 5.317 1.841 1.00 0.95 H new ATOM 0 HA VAL A 18 -8.129 7.009 3.154 1.00 0.85 H new ATOM 0 HB VAL A 18 -8.615 4.070 3.635 1.00 0.92 H new ATOM 0 HG11 VAL A 18 -6.844 4.297 5.390 1.00 0.77 H new ATOM 0 HG12 VAL A 18 -6.230 4.680 3.764 1.00 0.77 H new ATOM 0 HG13 VAL A 18 -6.609 5.993 4.904 1.00 0.77 H new ATOM 0 HG21 VAL A 18 -9.122 4.709 6.006 1.00 1.54 H new ATOM 0 HG22 VAL A 18 -9.009 6.424 5.544 1.00 1.54 H new ATOM 0 HG23 VAL A 18 -10.295 5.401 4.860 1.00 1.54 H new ATOM 254 N ILE A 19 -6.474 6.010 1.497 1.00 0.65 N ATOM 255 CA ILE A 19 -5.555 5.663 0.428 1.00 0.60 C ATOM 256 C ILE A 19 -4.251 5.240 1.089 1.00 0.60 C ATOM 257 O ILE A 19 -3.780 5.961 1.965 1.00 0.59 O ATOM 258 CB ILE A 19 -5.340 6.900 -0.470 1.00 0.60 C ATOM 259 CG1 ILE A 19 -6.632 7.219 -1.233 1.00 0.68 C ATOM 260 CG2 ILE A 19 -4.198 6.660 -1.470 1.00 0.76 C ATOM 261 CD1 ILE A 19 -6.649 8.588 -1.924 1.00 1.26 C ATOM 0 H ILE A 19 -6.081 6.693 2.144 1.00 0.65 H new ATOM 0 HA ILE A 19 -5.939 4.856 -0.195 1.00 0.60 H new ATOM 0 HB ILE A 19 -5.072 7.743 0.167 1.00 0.60 H new ATOM 0 HG12 ILE A 19 -6.794 6.446 -1.985 1.00 0.68 H new ATOM 0 HG13 ILE A 19 -7.470 7.168 -0.538 1.00 0.68 H new ATOM 0 HG21 ILE A 19 -4.066 7.546 -2.091 1.00 0.76 H new ATOM 0 HG22 ILE A 19 -3.275 6.457 -0.927 1.00 0.76 H new ATOM 0 HG23 ILE A 19 -4.442 5.806 -2.102 1.00 0.76 H new ATOM 0 HD11 ILE A 19 -7.601 8.725 -2.437 1.00 1.26 H new ATOM 0 HD12 ILE A 19 -6.522 9.373 -1.179 1.00 1.26 H new ATOM 0 HD13 ILE A 19 -5.836 8.640 -2.648 1.00 1.26 H new ATOM 273 N ILE A 20 -3.651 4.126 0.656 1.00 0.65 N ATOM 274 CA ILE A 20 -2.295 3.755 1.030 1.00 0.64 C ATOM 275 C ILE A 20 -1.473 3.783 -0.250 1.00 0.70 C ATOM 276 O ILE A 20 -1.906 3.260 -1.276 1.00 0.78 O ATOM 277 CB ILE A 20 -2.217 2.367 1.697 1.00 0.65 C ATOM 278 CG1 ILE A 20 -2.921 2.280 3.061 1.00 0.56 C ATOM 279 CG2 ILE A 20 -0.752 2.005 1.978 1.00 0.81 C ATOM 280 CD1 ILE A 20 -4.427 2.120 2.957 1.00 0.61 C ATOM 0 H ILE A 20 -4.101 3.456 0.032 1.00 0.65 H new ATOM 0 HA ILE A 20 -1.914 4.455 1.774 1.00 0.64 H new ATOM 0 HB ILE A 20 -2.709 1.696 0.993 1.00 0.65 H new ATOM 0 HG12 ILE A 20 -2.512 1.438 3.619 1.00 0.56 H new ATOM 0 HG13 ILE A 20 -2.698 3.180 3.634 1.00 0.56 H new ATOM 0 HG21 ILE A 20 -0.704 1.023 2.449 1.00 0.81 H new ATOM 0 HG22 ILE A 20 -0.196 1.985 1.041 1.00 0.81 H new ATOM 0 HG23 ILE A 20 -0.315 2.749 2.644 1.00 0.81 H new ATOM 0 HD11 ILE A 20 -4.857 2.065 3.957 1.00 0.61 H new ATOM 0 HD12 ILE A 20 -4.848 2.975 2.427 1.00 0.61 H new ATOM 0 HD13 ILE A 20 -4.659 1.205 2.412 1.00 0.61 H new ATOM 292 N ASN A 21 -0.280 4.368 -0.181 1.00 0.70 N ATOM 293 CA ASN A 21 0.694 4.337 -1.260 1.00 0.76 C ATOM 294 C ASN A 21 2.072 4.005 -0.679 1.00 0.70 C ATOM 295 O ASN A 21 2.238 3.994 0.541 1.00 0.79 O ATOM 296 CB ASN A 21 0.672 5.695 -1.965 1.00 0.90 C ATOM 297 CG ASN A 21 1.160 5.627 -3.401 1.00 1.19 C ATOM 298 OD1 ASN A 21 1.645 4.603 -3.866 1.00 2.07 O ATOM 299 ND2 ASN A 21 1.029 6.722 -4.135 1.00 1.72 N ATOM 0 H ASN A 21 0.038 4.883 0.640 1.00 0.70 H new ATOM 0 HA ASN A 21 0.455 3.568 -1.994 1.00 0.76 H new ATOM 0 HB2 ASN A 21 -0.344 6.089 -1.951 1.00 0.90 H new ATOM 0 HB3 ASN A 21 1.294 6.397 -1.409 1.00 0.90 H new ATOM 0 HD21 ASN A 21 1.335 6.723 -5.108 1.00 1.72 H new ATOM 0 HD22 ASN A 21 0.622 7.564 -3.727 1.00 1.72 H new ATOM 306 N ALA A 22 3.067 3.724 -1.521 1.00 0.75 N ATOM 307 CA ALA A 22 4.432 3.522 -1.058 1.00 0.79 C ATOM 308 C ALA A 22 5.134 4.874 -0.861 1.00 0.96 C ATOM 309 O ALA A 22 4.614 5.916 -1.250 1.00 1.93 O ATOM 310 CB ALA A 22 5.179 2.641 -2.066 1.00 1.02 C ATOM 0 H ALA A 22 2.948 3.632 -2.530 1.00 0.75 H new ATOM 0 HA ALA A 22 4.425 3.016 -0.093 1.00 0.79 H new ATOM 0 HB1 ALA A 22 6.203 2.486 -1.725 1.00 1.02 H new ATOM 0 HB2 ALA A 22 4.675 1.678 -2.151 1.00 1.02 H new ATOM 0 HB3 ALA A 22 5.191 3.132 -3.039 1.00 1.02 H new ATOM 316 N ALA A 23 6.326 4.844 -0.269 1.00 0.63 N ATOM 317 CA ALA A 23 7.182 6.006 -0.048 1.00 0.79 C ATOM 318 C ALA A 23 8.640 5.562 0.026 1.00 0.89 C ATOM 319 O ALA A 23 9.518 6.062 -0.680 1.00 1.16 O ATOM 320 CB ALA A 23 6.790 6.659 1.271 1.00 1.02 C ATOM 0 H ALA A 23 6.736 3.979 0.082 1.00 0.63 H new ATOM 0 HA ALA A 23 7.062 6.713 -0.868 1.00 0.79 H new ATOM 0 HB1 ALA A 23 7.422 7.529 1.448 1.00 1.02 H new ATOM 0 HB2 ALA A 23 5.747 6.972 1.226 1.00 1.02 H new ATOM 0 HB3 ALA A 23 6.920 5.944 2.084 1.00 1.02 H new ATOM 326 N ASN A 24 8.891 4.592 0.907 1.00 0.75 N ATOM 327 CA ASN A 24 10.212 4.063 1.215 1.00 0.80 C ATOM 328 C ASN A 24 11.128 5.150 1.779 1.00 1.17 C ATOM 329 O ASN A 24 10.720 6.293 1.975 1.00 1.41 O ATOM 330 CB ASN A 24 10.793 3.368 -0.025 1.00 0.91 C ATOM 331 CG ASN A 24 9.806 2.353 -0.584 1.00 1.22 C ATOM 332 OD1 ASN A 24 9.239 1.557 0.152 1.00 1.43 O ATOM 333 ND2 ASN A 24 9.535 2.394 -1.879 1.00 1.96 N ATOM 0 H ASN A 24 8.150 4.140 1.443 1.00 0.75 H new ATOM 0 HA ASN A 24 10.127 3.312 2.001 1.00 0.80 H new ATOM 0 HB2 ASN A 24 11.030 4.111 -0.787 1.00 0.91 H new ATOM 0 HB3 ASN A 24 11.727 2.870 0.235 1.00 0.91 H new ATOM 0 HD21 ASN A 24 8.845 1.756 -2.276 1.00 1.96 H new ATOM 0 HD22 ASN A 24 10.016 3.063 -2.480 1.00 1.96 H new ATOM 340 N SER A 25 12.404 4.820 1.985 1.00 1.31 N ATOM 341 CA SER A 25 13.409 5.768 2.452 1.00 1.69 C ATOM 342 C SER A 25 13.546 6.997 1.558 1.00 1.86 C ATOM 343 O SER A 25 14.119 8.000 1.970 1.00 2.11 O ATOM 344 CB SER A 25 14.758 5.057 2.537 1.00 1.96 C ATOM 345 OG SER A 25 14.590 3.815 3.182 1.00 1.92 O ATOM 0 H SER A 25 12.769 3.880 1.831 1.00 1.31 H new ATOM 0 HA SER A 25 13.083 6.124 3.429 1.00 1.69 H new ATOM 0 HB2 SER A 25 15.167 4.908 1.538 1.00 1.96 H new ATOM 0 HB3 SER A 25 15.472 5.671 3.086 1.00 1.96 H new ATOM 0 HG SER A 25 15.454 3.355 3.237 1.00 1.92 H new ATOM 351 N LYS A 26 13.070 6.913 0.315 1.00 1.81 N ATOM 352 CA LYS A 26 13.202 7.993 -0.642 1.00 2.02 C ATOM 353 C LYS A 26 12.076 9.006 -0.458 1.00 1.90 C ATOM 354 O LYS A 26 12.279 10.172 -0.775 1.00 1.90 O ATOM 355 CB LYS A 26 13.256 7.417 -2.064 1.00 2.03 C ATOM 356 CG LYS A 26 14.543 6.591 -2.234 1.00 2.22 C ATOM 357 CD LYS A 26 14.889 6.221 -3.685 1.00 2.60 C ATOM 358 CE LYS A 26 14.141 4.990 -4.214 1.00 3.02 C ATOM 359 NZ LYS A 26 12.768 5.296 -4.676 1.00 3.73 N ATOM 0 H LYS A 26 12.584 6.093 -0.048 1.00 1.81 H new ATOM 0 HA LYS A 26 14.135 8.530 -0.471 1.00 2.02 H new ATOM 0 HB2 LYS A 26 12.383 6.791 -2.248 1.00 2.03 H new ATOM 0 HB3 LYS A 26 13.230 8.224 -2.796 1.00 2.03 H new ATOM 0 HG2 LYS A 26 15.376 7.152 -1.809 1.00 2.22 H new ATOM 0 HG3 LYS A 26 14.447 5.673 -1.654 1.00 2.22 H new ATOM 0 HD2 LYS A 26 14.666 7.072 -4.328 1.00 2.60 H new ATOM 0 HD3 LYS A 26 15.961 6.039 -3.756 1.00 2.60 H new ATOM 0 HE2 LYS A 26 14.707 4.556 -5.038 1.00 3.02 H new ATOM 0 HE3 LYS A 26 14.093 4.236 -3.428 1.00 3.02 H new ATOM 0 HZ1 LYS A 26 12.441 4.543 -5.315 1.00 3.73 H new ATOM 0 HZ2 LYS A 26 12.131 5.355 -3.856 1.00 3.73 H new ATOM 0 HZ3 LYS A 26 12.766 6.205 -5.182 1.00 3.73 H new ATOM 373 N GLY A 27 10.897 8.573 -0.004 1.00 1.88 N ATOM 374 CA GLY A 27 9.723 9.430 0.062 1.00 1.89 C ATOM 375 C GLY A 27 9.004 9.490 -1.285 1.00 1.85 C ATOM 376 O GLY A 27 8.303 10.451 -1.571 1.00 2.12 O ATOM 0 H GLY A 27 10.735 7.621 0.326 1.00 1.88 H new ATOM 0 HA2 GLY A 27 9.040 9.057 0.825 1.00 1.89 H new ATOM 0 HA3 GLY A 27 10.020 10.435 0.364 1.00 1.89 H new ATOM 380 N GLN A 28 9.167 8.487 -2.155 1.00 1.66 N ATOM 381 CA GLN A 28 8.437 8.455 -3.411 1.00 1.60 C ATOM 382 C GLN A 28 7.803 7.081 -3.606 1.00 1.35 C ATOM 383 O GLN A 28 8.491 6.064 -3.485 1.00 1.33 O ATOM 384 CB GLN A 28 9.370 8.766 -4.584 1.00 1.98 C ATOM 385 CG GLN A 28 9.517 10.265 -4.879 1.00 1.40 C ATOM 386 CD GLN A 28 10.249 11.088 -3.826 1.00 2.28 C ATOM 387 OE1 GLN A 28 9.856 12.205 -3.515 1.00 3.33 O ATOM 388 NE2 GLN A 28 11.359 10.581 -3.315 1.00 3.49 N ATOM 0 H GLN A 28 9.794 7.696 -2.007 1.00 1.66 H new ATOM 0 HA GLN A 28 7.655 9.214 -3.378 1.00 1.60 H new ATOM 0 HB2 GLN A 28 10.355 8.349 -4.373 1.00 1.98 H new ATOM 0 HB3 GLN A 28 8.996 8.265 -5.477 1.00 1.98 H new ATOM 0 HG2 GLN A 28 10.041 10.378 -5.828 1.00 1.40 H new ATOM 0 HG3 GLN A 28 8.521 10.687 -5.013 1.00 1.40 H new ATOM 0 HE21 GLN A 28 11.667 9.648 -3.589 1.00 3.49 H new ATOM 0 HE22 GLN A 28 11.907 11.123 -2.647 1.00 3.49 H new ATOM 397 N PRO A 29 6.515 7.035 -3.973 1.00 1.23 N ATOM 398 CA PRO A 29 5.827 5.795 -4.257 1.00 1.10 C ATOM 399 C PRO A 29 6.427 5.154 -5.503 1.00 1.32 C ATOM 400 O PRO A 29 6.410 5.746 -6.584 1.00 1.74 O ATOM 401 CB PRO A 29 4.358 6.174 -4.461 1.00 1.04 C ATOM 402 CG PRO A 29 4.428 7.622 -4.928 1.00 1.31 C ATOM 403 CD PRO A 29 5.636 8.171 -4.177 1.00 1.35 C ATOM 0 HA PRO A 29 5.923 5.065 -3.453 1.00 1.10 H new ATOM 0 HB2 PRO A 29 3.878 5.536 -5.202 1.00 1.04 H new ATOM 0 HB3 PRO A 29 3.786 6.077 -3.538 1.00 1.04 H new ATOM 0 HG2 PRO A 29 4.559 7.691 -6.008 1.00 1.31 H new ATOM 0 HG3 PRO A 29 3.518 8.169 -4.682 1.00 1.31 H new ATOM 0 HD2 PRO A 29 6.133 8.953 -4.751 1.00 1.35 H new ATOM 0 HD3 PRO A 29 5.339 8.613 -3.226 1.00 1.35 H new ATOM 411 N GLY A 30 6.951 3.935 -5.352 1.00 1.18 N ATOM 412 CA GLY A 30 7.448 3.147 -6.470 1.00 1.47 C ATOM 413 C GLY A 30 6.386 3.061 -7.560 1.00 1.93 C ATOM 414 O GLY A 30 5.318 2.501 -7.331 1.00 2.51 O ATOM 0 H GLY A 30 7.040 3.471 -4.448 1.00 1.18 H new ATOM 0 HA2 GLY A 30 8.355 3.600 -6.870 1.00 1.47 H new ATOM 0 HA3 GLY A 30 7.714 2.146 -6.130 1.00 1.47 H new ATOM 418 N GLY A 31 6.670 3.644 -8.727 1.00 1.94 N ATOM 419 CA GLY A 31 5.696 3.802 -9.797 1.00 2.46 C ATOM 420 C GLY A 31 5.727 5.224 -10.352 1.00 1.41 C ATOM 421 O GLY A 31 5.376 5.441 -11.506 1.00 2.61 O ATOM 0 H GLY A 31 7.591 4.021 -8.953 1.00 1.94 H new ATOM 0 HA2 GLY A 31 5.907 3.090 -10.595 1.00 2.46 H new ATOM 0 HA3 GLY A 31 4.698 3.574 -9.423 1.00 2.46 H new ATOM 425 N GLY A 32 6.131 6.203 -9.535 1.00 1.45 N ATOM 426 CA GLY A 32 6.147 7.606 -9.933 1.00 2.21 C ATOM 427 C GLY A 32 4.817 8.290 -9.622 1.00 1.93 C ATOM 428 O GLY A 32 4.556 9.398 -10.088 1.00 1.94 O ATOM 0 H GLY A 32 6.455 6.040 -8.582 1.00 1.45 H new ATOM 0 HA2 GLY A 32 6.954 8.124 -9.414 1.00 2.21 H new ATOM 0 HA3 GLY A 32 6.355 7.680 -11.000 1.00 2.21 H new ATOM 432 N VAL A 33 3.975 7.657 -8.801 1.00 1.74 N ATOM 433 CA VAL A 33 2.636 8.145 -8.504 1.00 1.49 C ATOM 434 C VAL A 33 2.671 9.470 -7.754 1.00 1.42 C ATOM 435 O VAL A 33 1.671 10.174 -7.765 1.00 1.29 O ATOM 436 CB VAL A 33 1.839 7.060 -7.759 1.00 1.41 C ATOM 437 CG1 VAL A 33 0.414 7.508 -7.412 1.00 2.99 C ATOM 438 CG2 VAL A 33 1.742 5.793 -8.619 1.00 1.95 C ATOM 0 H VAL A 33 4.210 6.787 -8.323 1.00 1.74 H new ATOM 0 HA VAL A 33 2.120 8.352 -9.442 1.00 1.49 H new ATOM 0 HB VAL A 33 2.377 6.866 -6.831 1.00 1.41 H new ATOM 0 HG11 VAL A 33 -0.103 6.704 -6.888 1.00 2.99 H new ATOM 0 HG12 VAL A 33 0.455 8.390 -6.773 1.00 2.99 H new ATOM 0 HG13 VAL A 33 -0.125 7.749 -8.328 1.00 2.99 H new ATOM 0 HG21 VAL A 33 1.176 5.031 -8.082 1.00 1.95 H new ATOM 0 HG22 VAL A 33 1.237 6.027 -9.556 1.00 1.95 H new ATOM 0 HG23 VAL A 33 2.744 5.419 -8.830 1.00 1.95 H new ATOM 448 N CYS A 34 3.806 9.875 -7.180 1.00 1.60 N ATOM 449 CA CYS A 34 4.014 11.212 -6.667 1.00 1.65 C ATOM 450 C CYS A 34 3.506 12.273 -7.637 1.00 1.60 C ATOM 451 O CYS A 34 2.903 13.255 -7.221 1.00 1.57 O ATOM 452 CB CYS A 34 5.507 11.403 -6.393 1.00 1.85 C ATOM 453 SG CYS A 34 6.601 10.615 -7.618 1.00 2.28 S ATOM 0 H CYS A 34 4.615 9.265 -7.061 1.00 1.60 H new ATOM 0 HA CYS A 34 3.446 11.329 -5.744 1.00 1.65 H new ATOM 0 HB2 CYS A 34 5.725 12.471 -6.362 1.00 1.85 H new ATOM 0 HB3 CYS A 34 5.738 11.002 -5.406 1.00 1.85 H new ATOM 0 HG CYS A 34 7.841 10.836 -7.298 1.00 2.28 H new ATOM 459 N GLY A 35 3.751 12.064 -8.928 1.00 1.63 N ATOM 460 CA GLY A 35 3.303 12.955 -9.988 1.00 1.56 C ATOM 461 C GLY A 35 1.781 13.097 -10.009 1.00 1.39 C ATOM 462 O GLY A 35 1.261 14.204 -9.915 1.00 1.44 O ATOM 0 H GLY A 35 4.274 11.258 -9.269 1.00 1.63 H new ATOM 0 HA2 GLY A 35 3.757 13.937 -9.853 1.00 1.56 H new ATOM 0 HA3 GLY A 35 3.645 12.575 -10.951 1.00 1.56 H new ATOM 466 N ALA A 36 1.047 11.992 -10.151 1.00 1.25 N ATOM 467 CA ALA A 36 -0.412 12.035 -10.225 1.00 1.09 C ATOM 468 C ALA A 36 -0.998 12.593 -8.934 1.00 1.00 C ATOM 469 O ALA A 36 -1.911 13.414 -8.959 1.00 0.91 O ATOM 470 CB ALA A 36 -0.966 10.634 -10.503 1.00 1.07 C ATOM 0 H ALA A 36 1.442 11.054 -10.217 1.00 1.25 H new ATOM 0 HA ALA A 36 -0.700 12.695 -11.043 1.00 1.09 H new ATOM 0 HB1 ALA A 36 -2.054 10.677 -10.556 1.00 1.07 H new ATOM 0 HB2 ALA A 36 -0.570 10.268 -11.450 1.00 1.07 H new ATOM 0 HB3 ALA A 36 -0.668 9.959 -9.700 1.00 1.07 H new ATOM 476 N LEU A 37 -0.459 12.148 -7.804 1.00 1.08 N ATOM 477 CA LEU A 37 -0.908 12.560 -6.493 1.00 1.02 C ATOM 478 C LEU A 37 -0.746 14.062 -6.330 1.00 1.11 C ATOM 479 O LEU A 37 -1.655 14.711 -5.848 1.00 1.10 O ATOM 480 CB LEU A 37 -0.158 11.765 -5.415 1.00 1.14 C ATOM 481 CG LEU A 37 -1.028 11.511 -4.179 1.00 0.76 C ATOM 482 CD1 LEU A 37 -2.217 10.608 -4.536 1.00 0.73 C ATOM 483 CD2 LEU A 37 -0.203 10.745 -3.144 1.00 0.85 C ATOM 0 H LEU A 37 0.313 11.482 -7.780 1.00 1.08 H new ATOM 0 HA LEU A 37 -1.970 12.342 -6.379 1.00 1.02 H new ATOM 0 HB2 LEU A 37 0.170 10.812 -5.830 1.00 1.14 H new ATOM 0 HB3 LEU A 37 0.739 12.310 -5.121 1.00 1.14 H new ATOM 0 HG LEU A 37 -1.375 12.473 -3.802 1.00 0.76 H new ATOM 0 HD11 LEU A 37 -2.824 10.438 -3.647 1.00 0.73 H new ATOM 0 HD12 LEU A 37 -2.823 11.091 -5.303 1.00 0.73 H new ATOM 0 HD13 LEU A 37 -1.849 9.653 -4.912 1.00 0.73 H new ATOM 0 HD21 LEU A 37 -0.812 10.558 -2.259 1.00 0.85 H new ATOM 0 HD22 LEU A 37 0.122 9.795 -3.568 1.00 0.85 H new ATOM 0 HD23 LEU A 37 0.670 11.335 -2.866 1.00 0.85 H new ATOM 495 N TYR A 38 0.362 14.632 -6.789 1.00 1.26 N ATOM 496 CA TYR A 38 0.572 16.073 -6.869 1.00 1.38 C ATOM 497 C TYR A 38 -0.411 16.730 -7.834 1.00 1.28 C ATOM 498 O TYR A 38 -0.848 17.855 -7.619 1.00 1.39 O ATOM 499 CB TYR A 38 2.020 16.301 -7.309 1.00 1.57 C ATOM 500 CG TYR A 38 2.383 17.678 -7.835 1.00 1.86 C ATOM 501 CD1 TYR A 38 3.032 18.611 -7.006 1.00 2.63 C ATOM 502 CD2 TYR A 38 2.124 17.999 -9.181 1.00 2.49 C ATOM 503 CE1 TYR A 38 3.399 19.874 -7.509 1.00 2.96 C ATOM 504 CE2 TYR A 38 2.482 19.259 -9.691 1.00 3.04 C ATOM 505 CZ TYR A 38 3.120 20.202 -8.857 1.00 2.89 C ATOM 506 OH TYR A 38 3.473 21.415 -9.368 1.00 3.49 O ATOM 0 H TYR A 38 1.159 14.091 -7.124 1.00 1.26 H new ATOM 0 HA TYR A 38 0.394 16.532 -5.897 1.00 1.38 H new ATOM 0 HB2 TYR A 38 2.668 16.083 -6.460 1.00 1.57 H new ATOM 0 HB3 TYR A 38 2.255 15.572 -8.084 1.00 1.57 H new ATOM 0 HD1 TYR A 38 3.250 18.357 -5.979 1.00 2.63 H new ATOM 0 HD2 TYR A 38 1.648 17.274 -9.825 1.00 2.49 H new ATOM 0 HE1 TYR A 38 3.892 20.590 -6.868 1.00 2.96 H new ATOM 0 HE2 TYR A 38 2.269 19.505 -10.721 1.00 3.04 H new ATOM 0 HH TYR A 38 3.204 21.464 -10.309 1.00 3.49 H new ATOM 516 N LYS A 39 -0.742 16.056 -8.933 1.00 1.13 N ATOM 517 CA LYS A 39 -1.538 16.630 -10.008 1.00 1.11 C ATOM 518 C LYS A 39 -2.995 16.747 -9.581 1.00 1.10 C ATOM 519 O LYS A 39 -3.751 17.529 -10.150 1.00 1.32 O ATOM 520 CB LYS A 39 -1.385 15.757 -11.259 1.00 1.04 C ATOM 521 CG LYS A 39 -1.687 16.540 -12.535 1.00 1.14 C ATOM 522 CD LYS A 39 -1.335 15.685 -13.758 1.00 1.30 C ATOM 523 CE LYS A 39 -1.281 16.562 -15.012 1.00 1.78 C ATOM 524 NZ LYS A 39 -0.773 15.812 -16.182 1.00 2.34 N ATOM 0 H LYS A 39 -0.462 15.090 -9.101 1.00 1.13 H new ATOM 0 HA LYS A 39 -1.186 17.636 -10.238 1.00 1.11 H new ATOM 0 HB2 LYS A 39 -0.370 15.363 -11.306 1.00 1.04 H new ATOM 0 HB3 LYS A 39 -2.056 14.901 -11.190 1.00 1.04 H new ATOM 0 HG2 LYS A 39 -2.741 16.817 -12.563 1.00 1.14 H new ATOM 0 HG3 LYS A 39 -1.114 17.467 -12.549 1.00 1.14 H new ATOM 0 HD2 LYS A 39 -0.373 15.195 -13.605 1.00 1.30 H new ATOM 0 HD3 LYS A 39 -2.077 14.897 -13.887 1.00 1.30 H new ATOM 0 HE2 LYS A 39 -2.277 16.946 -15.231 1.00 1.78 H new ATOM 0 HE3 LYS A 39 -0.640 17.424 -14.826 1.00 1.78 H new ATOM 0 HZ1 LYS A 39 -0.750 16.438 -17.012 1.00 2.34 H new ATOM 0 HZ2 LYS A 39 0.187 15.467 -15.983 1.00 2.34 H new ATOM 0 HZ3 LYS A 39 -1.399 15.004 -16.375 1.00 2.34 H new ATOM 538 N LYS A 40 -3.404 15.933 -8.608 1.00 0.97 N ATOM 539 CA LYS A 40 -4.764 15.909 -8.104 1.00 0.94 C ATOM 540 C LYS A 40 -4.849 16.608 -6.749 1.00 1.04 C ATOM 541 O LYS A 40 -5.861 17.238 -6.464 1.00 1.19 O ATOM 542 CB LYS A 40 -5.189 14.442 -8.012 1.00 0.80 C ATOM 543 CG LYS A 40 -6.707 14.242 -7.872 1.00 0.92 C ATOM 544 CD LYS A 40 -7.419 14.044 -9.213 1.00 0.92 C ATOM 545 CE LYS A 40 -7.354 15.307 -10.075 1.00 1.22 C ATOM 546 NZ LYS A 40 -8.162 15.169 -11.305 1.00 1.52 N ATOM 0 H LYS A 40 -2.787 15.265 -8.146 1.00 0.97 H new ATOM 0 HA LYS A 40 -5.436 16.448 -8.772 1.00 0.94 H new ATOM 0 HB2 LYS A 40 -4.844 13.917 -8.903 1.00 0.80 H new ATOM 0 HB3 LYS A 40 -4.691 13.982 -7.158 1.00 0.80 H new ATOM 0 HG2 LYS A 40 -6.895 13.376 -7.237 1.00 0.92 H new ATOM 0 HG3 LYS A 40 -7.135 15.107 -7.366 1.00 0.92 H new ATOM 0 HD2 LYS A 40 -6.962 13.212 -9.749 1.00 0.92 H new ATOM 0 HD3 LYS A 40 -8.461 13.776 -9.037 1.00 0.92 H new ATOM 0 HE2 LYS A 40 -7.711 16.160 -9.498 1.00 1.22 H new ATOM 0 HE3 LYS A 40 -6.317 15.513 -10.341 1.00 1.22 H new ATOM 0 HZ1 LYS A 40 -8.095 16.043 -11.865 1.00 1.52 H new ATOM 0 HZ2 LYS A 40 -7.805 14.370 -11.867 1.00 1.52 H new ATOM 0 HZ3 LYS A 40 -9.156 14.997 -11.050 1.00 1.52 H new ATOM 560 N PHE A 41 -3.825 16.449 -5.909 1.00 1.09 N ATOM 561 CA PHE A 41 -3.782 16.938 -4.543 1.00 1.32 C ATOM 562 C PHE A 41 -2.359 16.889 -3.964 1.00 1.17 C ATOM 563 O PHE A 41 -1.982 15.956 -3.246 1.00 1.31 O ATOM 564 CB PHE A 41 -4.780 16.181 -3.664 1.00 1.82 C ATOM 565 CG PHE A 41 -4.801 14.662 -3.692 1.00 0.84 C ATOM 566 CD1 PHE A 41 -5.671 13.991 -4.568 1.00 1.12 C ATOM 567 CD2 PHE A 41 -4.060 13.918 -2.755 1.00 1.51 C ATOM 568 CE1 PHE A 41 -5.818 12.596 -4.501 1.00 0.91 C ATOM 569 CE2 PHE A 41 -4.171 12.518 -2.721 1.00 2.45 C ATOM 570 CZ PHE A 41 -5.071 11.858 -3.573 1.00 1.98 C ATOM 0 H PHE A 41 -2.974 15.956 -6.178 1.00 1.09 H new ATOM 0 HA PHE A 41 -4.078 17.987 -4.555 1.00 1.32 H new ATOM 0 HB2 PHE A 41 -4.603 16.486 -2.633 1.00 1.82 H new ATOM 0 HB3 PHE A 41 -5.779 16.526 -3.932 1.00 1.82 H new ATOM 0 HD1 PHE A 41 -6.232 14.553 -5.300 1.00 1.12 H new ATOM 0 HD2 PHE A 41 -3.405 14.424 -2.061 1.00 1.51 H new ATOM 0 HE1 PHE A 41 -6.506 12.092 -5.164 1.00 0.91 H new ATOM 0 HE2 PHE A 41 -3.561 11.947 -2.037 1.00 2.45 H new ATOM 0 HZ PHE A 41 -5.187 10.786 -3.513 1.00 1.98 H new ATOM 580 N PRO A 42 -1.546 17.929 -4.192 1.00 1.08 N ATOM 581 CA PRO A 42 -0.199 17.996 -3.651 1.00 1.13 C ATOM 582 C PRO A 42 -0.197 18.204 -2.134 1.00 1.23 C ATOM 583 O PRO A 42 0.862 18.186 -1.517 1.00 1.37 O ATOM 584 CB PRO A 42 0.466 19.154 -4.395 1.00 1.22 C ATOM 585 CG PRO A 42 -0.695 20.092 -4.715 1.00 1.29 C ATOM 586 CD PRO A 42 -1.892 19.157 -4.892 1.00 1.19 C ATOM 0 HA PRO A 42 0.342 17.061 -3.796 1.00 1.13 H new ATOM 0 HB2 PRO A 42 1.220 19.645 -3.780 1.00 1.22 H new ATOM 0 HB3 PRO A 42 0.967 18.813 -5.301 1.00 1.22 H new ATOM 0 HG2 PRO A 42 -0.863 20.807 -3.910 1.00 1.29 H new ATOM 0 HG3 PRO A 42 -0.503 20.670 -5.619 1.00 1.29 H new ATOM 0 HD2 PRO A 42 -2.798 19.600 -4.479 1.00 1.19 H new ATOM 0 HD3 PRO A 42 -2.084 18.964 -5.947 1.00 1.19 H new ATOM 594 N GLU A 43 -1.364 18.311 -1.499 1.00 1.27 N ATOM 595 CA GLU A 43 -1.520 18.474 -0.068 1.00 1.49 C ATOM 596 C GLU A 43 -1.014 17.236 0.673 1.00 1.43 C ATOM 597 O GLU A 43 -0.864 17.266 1.890 1.00 1.71 O ATOM 598 CB GLU A 43 -3.002 18.708 0.253 1.00 1.64 C ATOM 599 CG GLU A 43 -3.565 20.038 -0.271 1.00 2.02 C ATOM 600 CD GLU A 43 -3.646 20.090 -1.797 1.00 2.73 C ATOM 601 OE1 GLU A 43 -3.993 19.035 -2.378 1.00 4.04 O ATOM 602 OE2 GLU A 43 -3.311 21.148 -2.366 1.00 3.21 O ATOM 0 H GLU A 43 -2.256 18.285 -1.993 1.00 1.27 H new ATOM 0 HA GLU A 43 -0.932 19.332 0.260 1.00 1.49 H new ATOM 0 HB2 GLU A 43 -3.586 17.890 -0.169 1.00 1.64 H new ATOM 0 HB3 GLU A 43 -3.137 18.672 1.334 1.00 1.64 H new ATOM 0 HG2 GLU A 43 -4.560 20.195 0.146 1.00 2.02 H new ATOM 0 HG3 GLU A 43 -2.938 20.857 0.083 1.00 2.02 H new ATOM 609 N SER A 44 -0.756 16.146 -0.051 1.00 1.17 N ATOM 610 CA SER A 44 -0.203 14.925 0.502 1.00 1.20 C ATOM 611 C SER A 44 1.297 15.074 0.790 1.00 1.83 C ATOM 612 O SER A 44 1.757 14.592 1.819 1.00 2.76 O ATOM 613 CB SER A 44 -0.460 13.794 -0.498 1.00 1.09 C ATOM 614 OG SER A 44 -0.114 14.195 -1.817 1.00 2.27 O ATOM 0 H SER A 44 -0.931 16.094 -1.054 1.00 1.17 H new ATOM 0 HA SER A 44 -0.684 14.700 1.454 1.00 1.20 H new ATOM 0 HB2 SER A 44 0.121 12.915 -0.217 1.00 1.09 H new ATOM 0 HB3 SER A 44 -1.511 13.506 -0.465 1.00 1.09 H new ATOM 0 HG SER A 44 -0.876 14.653 -2.230 1.00 2.27 H new ATOM 620 N PHE A 45 2.052 15.718 -0.111 1.00 1.54 N ATOM 621 CA PHE A 45 3.496 15.983 -0.012 1.00 2.12 C ATOM 622 C PHE A 45 4.302 14.886 0.725 1.00 1.66 C ATOM 623 O PHE A 45 5.117 15.148 1.607 1.00 2.89 O ATOM 624 CB PHE A 45 3.716 17.416 0.527 1.00 4.02 C ATOM 625 CG PHE A 45 4.103 18.479 -0.498 1.00 4.58 C ATOM 626 CD1 PHE A 45 3.745 18.377 -1.859 1.00 4.28 C ATOM 627 CD2 PHE A 45 4.827 19.607 -0.067 1.00 5.89 C ATOM 628 CE1 PHE A 45 4.112 19.381 -2.771 1.00 5.38 C ATOM 629 CE2 PHE A 45 5.193 20.614 -0.979 1.00 6.82 C ATOM 630 CZ PHE A 45 4.837 20.501 -2.333 1.00 6.59 C ATOM 0 H PHE A 45 1.652 16.088 -0.974 1.00 1.54 H new ATOM 0 HA PHE A 45 3.918 15.933 -1.016 1.00 2.12 H new ATOM 0 HB2 PHE A 45 2.800 17.738 1.023 1.00 4.02 H new ATOM 0 HB3 PHE A 45 4.494 17.378 1.289 1.00 4.02 H new ATOM 0 HD1 PHE A 45 3.184 17.520 -2.203 1.00 4.28 H new ATOM 0 HD2 PHE A 45 5.104 19.700 0.973 1.00 5.89 H new ATOM 0 HE1 PHE A 45 3.836 19.291 -3.811 1.00 5.38 H new ATOM 0 HE2 PHE A 45 5.748 21.475 -0.637 1.00 6.82 H new ATOM 0 HZ PHE A 45 5.120 21.272 -3.034 1.00 6.59 H new ATOM 640 N ASP A 46 4.163 13.643 0.259 1.00 1.48 N ATOM 641 CA ASP A 46 4.858 12.452 0.744 1.00 2.99 C ATOM 642 C ASP A 46 6.346 12.454 0.405 1.00 2.63 C ATOM 643 O ASP A 46 7.085 11.612 0.894 1.00 3.91 O ATOM 644 CB ASP A 46 4.202 11.213 0.133 1.00 4.45 C ATOM 645 CG ASP A 46 4.868 9.920 0.607 1.00 6.20 C ATOM 646 OD1 ASP A 46 5.293 9.133 -0.274 1.00 7.93 O ATOM 647 OD2 ASP A 46 4.841 9.685 1.835 1.00 6.17 O ATOM 0 H ASP A 46 3.527 13.430 -0.509 1.00 1.48 H new ATOM 0 HA ASP A 46 4.778 12.445 1.831 1.00 2.99 H new ATOM 0 HB2 ASP A 46 3.145 11.195 0.398 1.00 4.45 H new ATOM 0 HB3 ASP A 46 4.257 11.272 -0.954 1.00 4.45 H new ATOM 652 N LEU A 47 6.833 13.444 -0.348 1.00 1.43 N ATOM 653 CA LEU A 47 8.254 13.597 -0.661 1.00 1.51 C ATOM 654 C LEU A 47 9.142 13.835 0.573 1.00 1.37 C ATOM 655 O LEU A 47 10.335 14.097 0.429 1.00 1.36 O ATOM 656 CB LEU A 47 8.434 14.691 -1.718 1.00 1.78 C ATOM 657 CG LEU A 47 8.056 16.089 -1.195 1.00 1.99 C ATOM 658 CD1 LEU A 47 9.274 17.015 -1.182 1.00 2.21 C ATOM 659 CD2 LEU A 47 6.966 16.706 -2.074 1.00 3.12 C ATOM 0 H LEU A 47 6.245 14.168 -0.761 1.00 1.43 H new ATOM 0 HA LEU A 47 8.598 12.646 -1.067 1.00 1.51 H new ATOM 0 HB2 LEU A 47 9.471 14.701 -2.052 1.00 1.78 H new ATOM 0 HB3 LEU A 47 7.821 14.455 -2.588 1.00 1.78 H new ATOM 0 HG LEU A 47 7.686 15.976 -0.176 1.00 1.99 H new ATOM 0 HD11 LEU A 47 8.981 17.996 -0.809 1.00 2.21 H new ATOM 0 HD12 LEU A 47 10.043 16.595 -0.534 1.00 2.21 H new ATOM 0 HD13 LEU A 47 9.666 17.114 -2.194 1.00 2.21 H new ATOM 0 HD21 LEU A 47 6.708 17.694 -1.693 1.00 3.12 H new ATOM 0 HD22 LEU A 47 7.331 16.795 -3.097 1.00 3.12 H new ATOM 0 HD23 LEU A 47 6.082 16.069 -2.058 1.00 3.12 H new ATOM 671 N GLN A 48 8.599 13.742 1.790 1.00 1.36 N ATOM 672 CA GLN A 48 9.410 13.674 2.998 1.00 1.28 C ATOM 673 C GLN A 48 9.992 12.258 3.152 1.00 1.35 C ATOM 674 O GLN A 48 9.378 11.278 2.742 1.00 1.41 O ATOM 675 CB GLN A 48 8.535 14.016 4.212 1.00 1.32 C ATOM 676 CG GLN A 48 8.011 15.454 4.122 1.00 2.31 C ATOM 677 CD GLN A 48 7.259 15.882 5.381 1.00 2.75 C ATOM 678 OE1 GLN A 48 6.910 15.077 6.237 1.00 2.84 O ATOM 679 NE2 GLN A 48 7.009 17.178 5.529 1.00 3.64 N ATOM 0 H GLN A 48 7.594 13.712 1.960 1.00 1.36 H new ATOM 0 HA GLN A 48 10.231 14.388 2.930 1.00 1.28 H new ATOM 0 HB2 GLN A 48 7.696 13.322 4.268 1.00 1.32 H new ATOM 0 HB3 GLN A 48 9.113 13.892 5.128 1.00 1.32 H new ATOM 0 HG2 GLN A 48 8.848 16.132 3.954 1.00 2.31 H new ATOM 0 HG3 GLN A 48 7.350 15.543 3.260 1.00 2.31 H new ATOM 0 HE21 GLN A 48 7.304 17.840 4.811 1.00 3.64 H new ATOM 0 HE22 GLN A 48 6.522 17.512 6.361 1.00 3.64 H new ATOM 688 N PRO A 49 11.177 12.112 3.759 1.00 1.41 N ATOM 689 CA PRO A 49 11.780 10.806 3.979 1.00 1.59 C ATOM 690 C PRO A 49 10.985 10.030 5.034 1.00 1.56 C ATOM 691 O PRO A 49 10.476 10.624 5.985 1.00 1.62 O ATOM 692 CB PRO A 49 13.203 11.109 4.454 1.00 1.69 C ATOM 693 CG PRO A 49 13.063 12.467 5.144 1.00 1.52 C ATOM 694 CD PRO A 49 12.007 13.174 4.296 1.00 1.36 C ATOM 0 HA PRO A 49 11.784 10.184 3.084 1.00 1.59 H new ATOM 0 HB2 PRO A 49 13.569 10.345 5.140 1.00 1.69 H new ATOM 0 HB3 PRO A 49 13.905 11.152 3.621 1.00 1.69 H new ATOM 0 HG2 PRO A 49 12.744 12.362 6.181 1.00 1.52 H new ATOM 0 HG3 PRO A 49 14.006 13.014 5.154 1.00 1.52 H new ATOM 0 HD2 PRO A 49 11.419 13.868 4.897 1.00 1.36 H new ATOM 0 HD3 PRO A 49 12.468 13.756 3.498 1.00 1.36 H new ATOM 702 N ILE A 50 10.911 8.700 4.907 1.00 1.49 N ATOM 703 CA ILE A 50 10.223 7.832 5.845 1.00 1.47 C ATOM 704 C ILE A 50 11.205 6.741 6.279 1.00 1.48 C ATOM 705 O ILE A 50 12.165 6.441 5.571 1.00 1.54 O ATOM 706 CB ILE A 50 8.937 7.290 5.193 1.00 1.47 C ATOM 707 CG1 ILE A 50 8.085 8.478 4.700 1.00 1.57 C ATOM 708 CG2 ILE A 50 8.161 6.423 6.188 1.00 1.40 C ATOM 709 CD1 ILE A 50 6.621 8.136 4.420 1.00 1.72 C ATOM 0 H ILE A 50 11.339 8.196 4.131 1.00 1.49 H new ATOM 0 HA ILE A 50 9.903 8.364 6.741 1.00 1.47 H new ATOM 0 HB ILE A 50 9.191 6.661 4.340 1.00 1.47 H new ATOM 0 HG12 ILE A 50 8.123 9.271 5.447 1.00 1.57 H new ATOM 0 HG13 ILE A 50 8.532 8.876 3.789 1.00 1.57 H new ATOM 0 HG21 ILE A 50 7.255 6.047 5.713 1.00 1.40 H new ATOM 0 HG22 ILE A 50 8.782 5.584 6.501 1.00 1.40 H new ATOM 0 HG23 ILE A 50 7.893 7.020 7.059 1.00 1.40 H new ATOM 0 HD11 ILE A 50 6.098 9.029 4.078 1.00 1.72 H new ATOM 0 HD12 ILE A 50 6.568 7.367 3.649 1.00 1.72 H new ATOM 0 HD13 ILE A 50 6.152 7.768 5.333 1.00 1.72 H new ATOM 721 N GLU A 51 10.997 6.190 7.474 1.00 1.43 N ATOM 722 CA GLU A 51 11.851 5.171 8.056 1.00 1.39 C ATOM 723 C GLU A 51 11.522 3.806 7.438 1.00 1.17 C ATOM 724 O GLU A 51 10.652 3.701 6.578 1.00 1.25 O ATOM 725 CB GLU A 51 11.628 5.226 9.571 1.00 1.37 C ATOM 726 CG GLU A 51 12.716 4.527 10.390 1.00 1.69 C ATOM 727 CD GLU A 51 12.710 5.042 11.829 1.00 1.77 C ATOM 728 OE1 GLU A 51 11.632 4.950 12.460 1.00 2.18 O ATOM 729 OE2 GLU A 51 13.771 5.538 12.265 1.00 2.59 O ATOM 0 H GLU A 51 10.212 6.449 8.072 1.00 1.43 H new ATOM 0 HA GLU A 51 12.908 5.340 7.850 1.00 1.39 H new ATOM 0 HB2 GLU A 51 11.569 6.269 9.881 1.00 1.37 H new ATOM 0 HB3 GLU A 51 10.665 4.770 9.802 1.00 1.37 H new ATOM 0 HG2 GLU A 51 12.551 3.450 10.381 1.00 1.69 H new ATOM 0 HG3 GLU A 51 13.692 4.704 9.937 1.00 1.69 H new ATOM 736 N VAL A 52 12.206 2.743 7.853 1.00 1.07 N ATOM 737 CA VAL A 52 12.136 1.447 7.198 1.00 0.99 C ATOM 738 C VAL A 52 11.613 0.451 8.223 1.00 0.79 C ATOM 739 O VAL A 52 12.333 0.014 9.116 1.00 0.92 O ATOM 740 CB VAL A 52 13.513 1.079 6.629 1.00 1.23 C ATOM 741 CG1 VAL A 52 13.430 -0.103 5.658 1.00 1.44 C ATOM 742 CG2 VAL A 52 14.104 2.264 5.855 1.00 1.60 C ATOM 0 H VAL A 52 12.829 2.761 8.661 1.00 1.07 H new ATOM 0 HA VAL A 52 11.456 1.450 6.346 1.00 0.99 H new ATOM 0 HB VAL A 52 14.140 0.812 7.480 1.00 1.23 H new ATOM 0 HG11 VAL A 52 14.425 -0.332 5.278 1.00 1.44 H new ATOM 0 HG12 VAL A 52 13.031 -0.974 6.178 1.00 1.44 H new ATOM 0 HG13 VAL A 52 12.774 0.155 4.826 1.00 1.44 H new ATOM 0 HG21 VAL A 52 15.081 1.988 5.457 1.00 1.60 H new ATOM 0 HG22 VAL A 52 13.439 2.530 5.033 1.00 1.60 H new ATOM 0 HG23 VAL A 52 14.213 3.118 6.524 1.00 1.60 H new ATOM 752 N GLY A 53 10.321 0.149 8.130 1.00 0.63 N ATOM 753 CA GLY A 53 9.610 -0.676 9.098 1.00 0.62 C ATOM 754 C GLY A 53 8.471 0.099 9.743 1.00 0.69 C ATOM 755 O GLY A 53 7.772 -0.427 10.604 1.00 1.39 O ATOM 0 H GLY A 53 9.730 0.477 7.366 1.00 0.63 H new ATOM 0 HA2 GLY A 53 9.216 -1.564 8.604 1.00 0.62 H new ATOM 0 HA3 GLY A 53 10.302 -1.019 9.867 1.00 0.62 H new ATOM 759 N LYS A 54 8.255 1.354 9.342 1.00 0.57 N ATOM 760 CA LYS A 54 7.175 2.153 9.862 1.00 0.55 C ATOM 761 C LYS A 54 6.494 2.837 8.687 1.00 0.58 C ATOM 762 O LYS A 54 7.168 3.327 7.785 1.00 0.64 O ATOM 763 CB LYS A 54 7.767 3.129 10.884 1.00 0.62 C ATOM 764 CG LYS A 54 6.731 4.187 11.247 1.00 1.68 C ATOM 765 CD LYS A 54 6.875 4.725 12.677 1.00 2.05 C ATOM 766 CE LYS A 54 5.506 4.623 13.360 1.00 3.15 C ATOM 767 NZ LYS A 54 5.573 4.945 14.802 1.00 3.44 N ATOM 0 H LYS A 54 8.830 1.832 8.648 1.00 0.57 H new ATOM 0 HA LYS A 54 6.415 1.565 10.377 1.00 0.55 H new ATOM 0 HB2 LYS A 54 8.078 2.589 11.778 1.00 0.62 H new ATOM 0 HB3 LYS A 54 8.658 3.605 10.473 1.00 0.62 H new ATOM 0 HG2 LYS A 54 6.812 5.018 10.546 1.00 1.68 H new ATOM 0 HG3 LYS A 54 5.734 3.763 11.126 1.00 1.68 H new ATOM 0 HD2 LYS A 54 7.620 4.150 13.228 1.00 2.05 H new ATOM 0 HD3 LYS A 54 7.218 5.760 12.663 1.00 2.05 H new ATOM 0 HE2 LYS A 54 4.807 5.301 12.871 1.00 3.15 H new ATOM 0 HE3 LYS A 54 5.113 3.614 13.233 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 4.625 4.863 15.221 1.00 3.44 H new ATOM 0 HZ2 LYS A 54 6.219 4.282 15.276 1.00 3.44 H new ATOM 0 HZ3 LYS A 54 5.922 5.917 14.925 1.00 3.44 H new ATOM 781 N ALA A 55 5.163 2.892 8.714 1.00 0.58 N ATOM 782 CA ALA A 55 4.401 3.694 7.777 1.00 0.60 C ATOM 783 C ALA A 55 4.101 5.028 8.455 1.00 0.63 C ATOM 784 O ALA A 55 3.994 5.087 9.681 1.00 0.67 O ATOM 785 CB ALA A 55 3.101 2.959 7.426 1.00 0.55 C ATOM 0 H ALA A 55 4.591 2.381 9.386 1.00 0.58 H new ATOM 0 HA ALA A 55 4.956 3.863 6.854 1.00 0.60 H new ATOM 0 HB1 ALA A 55 2.523 3.557 6.721 1.00 0.55 H new ATOM 0 HB2 ALA A 55 3.338 1.996 6.975 1.00 0.55 H new ATOM 0 HB3 ALA A 55 2.516 2.801 8.332 1.00 0.55 H new ATOM 791 N ARG A 56 3.959 6.101 7.676 1.00 0.64 N ATOM 792 CA ARG A 56 3.617 7.410 8.207 1.00 0.66 C ATOM 793 C ARG A 56 2.491 7.960 7.347 1.00 0.60 C ATOM 794 O ARG A 56 2.619 8.047 6.129 1.00 0.61 O ATOM 795 CB ARG A 56 4.853 8.319 8.186 1.00 0.79 C ATOM 796 CG ARG A 56 4.640 9.586 9.017 1.00 1.29 C ATOM 797 CD ARG A 56 5.835 10.530 8.846 1.00 1.82 C ATOM 798 NE ARG A 56 5.698 11.726 9.692 1.00 2.45 N ATOM 799 CZ ARG A 56 6.073 11.831 10.974 1.00 2.62 C ATOM 800 NH1 ARG A 56 5.860 12.966 11.641 1.00 3.36 N ATOM 801 NH2 ARG A 56 6.654 10.802 11.594 1.00 3.31 N ATOM 0 H ARG A 56 4.078 6.082 6.663 1.00 0.64 H new ATOM 0 HA ARG A 56 3.288 7.351 9.244 1.00 0.66 H new ATOM 0 HB2 ARG A 56 5.713 7.772 8.571 1.00 0.79 H new ATOM 0 HB3 ARG A 56 5.085 8.594 7.157 1.00 0.79 H new ATOM 0 HG2 ARG A 56 3.723 10.086 8.705 1.00 1.29 H new ATOM 0 HG3 ARG A 56 4.519 9.325 10.068 1.00 1.29 H new ATOM 0 HD2 ARG A 56 6.755 10.005 9.102 1.00 1.82 H new ATOM 0 HD3 ARG A 56 5.918 10.829 7.801 1.00 1.82 H new ATOM 0 HE ARG A 56 5.279 12.551 9.263 1.00 2.45 H new ATOM 0 HH11 ARG A 56 5.411 13.755 11.175 1.00 3.36 H new ATOM 0 HH12 ARG A 56 6.146 13.045 12.617 1.00 3.36 H new ATOM 0 HH21 ARG A 56 6.815 9.929 11.092 1.00 3.31 H new ATOM 0 HH22 ARG A 56 6.937 10.889 12.570 1.00 3.31 H new ATOM 815 N LEU A 57 1.365 8.304 7.966 1.00 0.61 N ATOM 816 CA LEU A 57 0.307 8.973 7.237 1.00 0.63 C ATOM 817 C LEU A 57 0.690 10.423 6.987 1.00 0.59 C ATOM 818 O LEU A 57 1.424 11.018 7.777 1.00 0.66 O ATOM 819 CB LEU A 57 -1.043 8.858 7.956 1.00 0.75 C ATOM 820 CG LEU A 57 -1.063 9.379 9.402 1.00 0.94 C ATOM 821 CD1 LEU A 57 -2.323 10.218 9.636 1.00 1.56 C ATOM 822 CD2 LEU A 57 -1.063 8.206 10.389 1.00 1.55 C ATOM 0 H LEU A 57 1.169 8.132 8.952 1.00 0.61 H new ATOM 0 HA LEU A 57 0.185 8.476 6.274 1.00 0.63 H new ATOM 0 HB2 LEU A 57 -1.790 9.404 7.380 1.00 0.75 H new ATOM 0 HB3 LEU A 57 -1.346 7.811 7.960 1.00 0.75 H new ATOM 0 HG LEU A 57 -0.174 9.990 9.560 1.00 0.94 H new ATOM 0 HD11 LEU A 57 -2.331 10.584 10.663 1.00 1.56 H new ATOM 0 HD12 LEU A 57 -2.329 11.064 8.949 1.00 1.56 H new ATOM 0 HD13 LEU A 57 -3.207 9.604 9.463 1.00 1.56 H new ATOM 0 HD21 LEU A 57 -1.077 8.589 11.409 1.00 1.55 H new ATOM 0 HD22 LEU A 57 -1.946 7.589 10.221 1.00 1.55 H new ATOM 0 HD23 LEU A 57 -0.166 7.605 10.240 1.00 1.55 H new ATOM 834 N VAL A 58 0.165 10.999 5.908 1.00 0.59 N ATOM 835 CA VAL A 58 0.417 12.369 5.532 1.00 0.64 C ATOM 836 C VAL A 58 -0.947 13.055 5.494 1.00 0.63 C ATOM 837 O VAL A 58 -1.824 12.706 4.703 1.00 0.68 O ATOM 838 CB VAL A 58 1.226 12.418 4.222 1.00 0.78 C ATOM 839 CG1 VAL A 58 2.499 11.569 4.335 1.00 1.38 C ATOM 840 CG2 VAL A 58 0.475 11.918 2.986 1.00 0.99 C ATOM 0 H VAL A 58 -0.457 10.509 5.265 1.00 0.59 H new ATOM 0 HA VAL A 58 1.043 12.910 6.242 1.00 0.64 H new ATOM 0 HB VAL A 58 1.442 13.478 4.087 1.00 0.78 H new ATOM 0 HG11 VAL A 58 3.054 11.619 3.398 1.00 1.38 H new ATOM 0 HG12 VAL A 58 3.120 11.951 5.145 1.00 1.38 H new ATOM 0 HG13 VAL A 58 2.229 10.534 4.542 1.00 1.38 H new ATOM 0 HG21 VAL A 58 1.123 11.990 2.113 1.00 0.99 H new ATOM 0 HG22 VAL A 58 0.180 10.879 3.135 1.00 0.99 H new ATOM 0 HG23 VAL A 58 -0.414 12.528 2.829 1.00 0.99 H new ATOM 850 N LYS A 59 -1.189 13.976 6.428 1.00 0.86 N ATOM 851 CA LYS A 59 -2.436 14.722 6.409 1.00 0.92 C ATOM 852 C LYS A 59 -2.328 15.753 5.300 1.00 0.87 C ATOM 853 O LYS A 59 -1.325 16.457 5.234 1.00 1.41 O ATOM 854 CB LYS A 59 -2.683 15.436 7.741 1.00 1.30 C ATOM 855 CG LYS A 59 -3.071 14.463 8.861 1.00 2.63 C ATOM 856 CD LYS A 59 -3.456 15.256 10.120 1.00 3.12 C ATOM 857 CE LYS A 59 -2.378 15.150 11.202 1.00 4.18 C ATOM 858 NZ LYS A 59 -2.625 14.014 12.119 1.00 5.67 N ATOM 0 H LYS A 59 -0.552 14.216 7.188 1.00 0.86 H new ATOM 0 HA LYS A 59 -3.268 14.037 6.244 1.00 0.92 H new ATOM 0 HB2 LYS A 59 -1.784 15.980 8.031 1.00 1.30 H new ATOM 0 HB3 LYS A 59 -3.475 16.174 7.614 1.00 1.30 H new ATOM 0 HG2 LYS A 59 -3.906 13.839 8.542 1.00 2.63 H new ATOM 0 HG3 LYS A 59 -2.239 13.794 9.080 1.00 2.63 H new ATOM 0 HD2 LYS A 59 -3.609 16.303 9.859 1.00 3.12 H new ATOM 0 HD3 LYS A 59 -4.403 14.883 10.511 1.00 3.12 H new ATOM 0 HE2 LYS A 59 -1.402 15.031 10.731 1.00 4.18 H new ATOM 0 HE3 LYS A 59 -2.345 16.077 11.774 1.00 4.18 H new ATOM 0 HZ1 LYS A 59 -1.873 13.977 12.836 1.00 5.67 H new ATOM 0 HZ2 LYS A 59 -3.545 14.140 12.588 1.00 5.67 H new ATOM 0 HZ3 LYS A 59 -2.631 13.126 11.578 1.00 5.67 H new ATOM 872 N GLY A 60 -3.372 15.880 4.487 1.00 0.96 N ATOM 873 CA GLY A 60 -3.471 16.911 3.477 1.00 1.12 C ATOM 874 C GLY A 60 -4.862 17.512 3.573 1.00 1.06 C ATOM 875 O GLY A 60 -5.818 16.806 3.892 1.00 1.01 O ATOM 0 H GLY A 60 -4.180 15.258 4.517 1.00 0.96 H new ATOM 0 HA2 GLY A 60 -2.711 17.676 3.635 1.00 1.12 H new ATOM 0 HA3 GLY A 60 -3.302 16.493 2.485 1.00 1.12 H new ATOM 879 N ALA A 61 -4.984 18.814 3.306 1.00 1.19 N ATOM 880 CA ALA A 61 -6.260 19.514 3.392 1.00 1.28 C ATOM 881 C ALA A 61 -7.289 18.916 2.435 1.00 1.23 C ATOM 882 O ALA A 61 -8.480 18.918 2.730 1.00 1.27 O ATOM 883 CB ALA A 61 -6.056 21.006 3.121 1.00 1.48 C ATOM 0 H ALA A 61 -4.203 19.407 3.026 1.00 1.19 H new ATOM 0 HA ALA A 61 -6.652 19.393 4.402 1.00 1.28 H new ATOM 0 HB1 ALA A 61 -7.014 21.522 3.187 1.00 1.48 H new ATOM 0 HB2 ALA A 61 -5.369 21.419 3.860 1.00 1.48 H new ATOM 0 HB3 ALA A 61 -5.639 21.141 2.123 1.00 1.48 H new ATOM 889 N ALA A 62 -6.831 18.398 1.293 1.00 1.20 N ATOM 890 CA ALA A 62 -7.698 17.730 0.339 1.00 1.22 C ATOM 891 C ALA A 62 -8.288 16.463 0.965 1.00 1.19 C ATOM 892 O ALA A 62 -9.502 16.277 0.956 1.00 1.32 O ATOM 893 CB ALA A 62 -6.905 17.402 -0.930 1.00 1.24 C ATOM 0 H ALA A 62 -5.851 18.433 1.011 1.00 1.20 H new ATOM 0 HA ALA A 62 -8.524 18.388 0.070 1.00 1.22 H new ATOM 0 HB1 ALA A 62 -7.556 16.900 -1.646 1.00 1.24 H new ATOM 0 HB2 ALA A 62 -6.524 18.324 -1.369 1.00 1.24 H new ATOM 0 HB3 ALA A 62 -6.070 16.748 -0.678 1.00 1.24 H new ATOM 899 N LYS A 63 -7.438 15.572 1.486 1.00 1.06 N ATOM 900 CA LYS A 63 -7.879 14.370 2.182 1.00 1.03 C ATOM 901 C LYS A 63 -6.702 13.814 2.991 1.00 0.91 C ATOM 902 O LYS A 63 -5.547 14.091 2.676 1.00 0.86 O ATOM 903 CB LYS A 63 -8.411 13.353 1.151 1.00 1.12 C ATOM 904 CG LYS A 63 -9.057 12.096 1.753 1.00 1.92 C ATOM 905 CD LYS A 63 -10.221 12.415 2.701 1.00 2.97 C ATOM 906 CE LYS A 63 -10.717 11.130 3.369 1.00 3.82 C ATOM 907 NZ LYS A 63 -11.725 10.423 2.558 1.00 3.83 N ATOM 0 H LYS A 63 -6.424 15.669 1.434 1.00 1.06 H new ATOM 0 HA LYS A 63 -8.692 14.591 2.874 1.00 1.03 H new ATOM 0 HB2 LYS A 63 -9.144 13.851 0.516 1.00 1.12 H new ATOM 0 HB3 LYS A 63 -7.587 13.047 0.507 1.00 1.12 H new ATOM 0 HG2 LYS A 63 -9.417 11.458 0.946 1.00 1.92 H new ATOM 0 HG3 LYS A 63 -8.300 11.529 2.294 1.00 1.92 H new ATOM 0 HD2 LYS A 63 -9.898 13.128 3.460 1.00 2.97 H new ATOM 0 HD3 LYS A 63 -11.034 12.884 2.147 1.00 2.97 H new ATOM 0 HE2 LYS A 63 -9.870 10.468 3.548 1.00 3.82 H new ATOM 0 HE3 LYS A 63 -11.144 11.372 4.342 1.00 3.82 H new ATOM 0 HZ1 LYS A 63 -11.565 9.397 2.622 1.00 3.83 H new ATOM 0 HZ2 LYS A 63 -12.676 10.648 2.913 1.00 3.83 H new ATOM 0 HZ3 LYS A 63 -11.646 10.725 1.566 1.00 3.83 H new ATOM 921 N HIS A 64 -6.983 13.018 4.026 1.00 0.94 N ATOM 922 CA HIS A 64 -5.960 12.267 4.744 1.00 0.84 C ATOM 923 C HIS A 64 -5.468 11.123 3.865 1.00 0.78 C ATOM 924 O HIS A 64 -6.283 10.345 3.373 1.00 0.93 O ATOM 925 CB HIS A 64 -6.553 11.667 6.022 1.00 0.87 C ATOM 926 CG HIS A 64 -6.858 12.658 7.116 1.00 1.13 C ATOM 927 ND1 HIS A 64 -7.300 12.329 8.378 1.00 1.53 N ATOM 928 CD2 HIS A 64 -6.744 14.024 7.057 1.00 1.15 C ATOM 929 CE1 HIS A 64 -7.451 13.475 9.064 1.00 1.77 C ATOM 930 NE2 HIS A 64 -7.113 14.531 8.306 1.00 1.53 N ATOM 0 H HIS A 64 -7.927 12.879 4.387 1.00 0.94 H new ATOM 0 HA HIS A 64 -5.139 12.939 4.995 1.00 0.84 H new ATOM 0 HB2 HIS A 64 -7.472 11.141 5.764 1.00 0.87 H new ATOM 0 HB3 HIS A 64 -5.858 10.923 6.411 1.00 0.87 H new ATOM 0 HD2 HIS A 64 -6.427 14.602 6.202 1.00 1.15 H new ATOM 0 HE1 HIS A 64 -7.797 13.538 10.085 1.00 1.77 H new ATOM 0 HE2 HIS A 64 -7.124 15.511 8.587 1.00 1.53 H new ATOM 938 N ILE A 65 -4.151 10.991 3.710 1.00 0.63 N ATOM 939 CA ILE A 65 -3.534 9.954 2.900 1.00 0.59 C ATOM 940 C ILE A 65 -2.600 9.162 3.811 1.00 0.47 C ATOM 941 O ILE A 65 -2.180 9.664 4.851 1.00 0.48 O ATOM 942 CB ILE A 65 -2.804 10.601 1.707 1.00 0.66 C ATOM 943 CG1 ILE A 65 -3.640 11.668 0.975 1.00 1.36 C ATOM 944 CG2 ILE A 65 -2.309 9.563 0.686 1.00 1.10 C ATOM 945 CD1 ILE A 65 -5.022 11.198 0.506 1.00 1.32 C ATOM 0 H ILE A 65 -3.476 11.614 4.153 1.00 0.63 H new ATOM 0 HA ILE A 65 -4.270 9.270 2.477 1.00 0.59 H new ATOM 0 HB ILE A 65 -1.945 11.098 2.158 1.00 0.66 H new ATOM 0 HG12 ILE A 65 -3.769 12.524 1.637 1.00 1.36 H new ATOM 0 HG13 ILE A 65 -3.078 12.017 0.109 1.00 1.36 H new ATOM 0 HG21 ILE A 65 -1.802 10.072 -0.134 1.00 1.10 H new ATOM 0 HG22 ILE A 65 -1.615 8.877 1.172 1.00 1.10 H new ATOM 0 HG23 ILE A 65 -3.159 9.003 0.295 1.00 1.10 H new ATOM 0 HD11 ILE A 65 -5.534 12.018 0.003 1.00 1.32 H new ATOM 0 HD12 ILE A 65 -4.907 10.363 -0.185 1.00 1.32 H new ATOM 0 HD13 ILE A 65 -5.609 10.878 1.367 1.00 1.32 H new ATOM 957 N ILE A 66 -2.271 7.926 3.446 1.00 0.49 N ATOM 958 CA ILE A 66 -1.424 7.047 4.229 1.00 0.50 C ATOM 959 C ILE A 66 -0.287 6.626 3.308 1.00 0.62 C ATOM 960 O ILE A 66 -0.526 6.317 2.141 1.00 0.73 O ATOM 961 CB ILE A 66 -2.203 5.815 4.716 1.00 0.58 C ATOM 962 CG1 ILE A 66 -3.622 6.098 5.241 1.00 0.59 C ATOM 963 CG2 ILE A 66 -1.388 5.042 5.765 1.00 0.64 C ATOM 964 CD1 ILE A 66 -3.655 6.944 6.512 1.00 0.48 C ATOM 0 H ILE A 66 -2.596 7.503 2.577 1.00 0.49 H new ATOM 0 HA ILE A 66 -1.054 7.555 5.120 1.00 0.50 H new ATOM 0 HB ILE A 66 -2.349 5.206 3.824 1.00 0.58 H new ATOM 0 HG12 ILE A 66 -4.192 6.606 4.463 1.00 0.59 H new ATOM 0 HG13 ILE A 66 -4.123 5.149 5.435 1.00 0.59 H new ATOM 0 HG21 ILE A 66 -1.955 4.173 6.098 1.00 0.64 H new ATOM 0 HG22 ILE A 66 -0.447 4.714 5.325 1.00 0.64 H new ATOM 0 HG23 ILE A 66 -1.183 5.690 6.617 1.00 0.64 H new ATOM 0 HD11 ILE A 66 -4.689 7.100 6.819 1.00 0.48 H new ATOM 0 HD12 ILE A 66 -3.115 6.429 7.306 1.00 0.48 H new ATOM 0 HD13 ILE A 66 -3.185 7.908 6.320 1.00 0.48 H new ATOM 976 N HIS A 67 0.946 6.614 3.806 1.00 0.64 N ATOM 977 CA HIS A 67 2.074 6.148 3.021 1.00 0.84 C ATOM 978 C HIS A 67 2.899 5.183 3.854 1.00 0.66 C ATOM 979 O HIS A 67 2.945 5.287 5.079 1.00 0.77 O ATOM 980 CB HIS A 67 2.899 7.325 2.499 1.00 1.22 C ATOM 981 CG HIS A 67 2.309 7.951 1.259 1.00 1.95 C ATOM 982 ND1 HIS A 67 2.867 7.938 0.003 1.00 3.25 N ATOM 983 CD2 HIS A 67 1.181 8.723 1.196 1.00 2.35 C ATOM 984 CE1 HIS A 67 2.112 8.723 -0.784 1.00 3.58 C ATOM 985 NE2 HIS A 67 1.049 9.194 -0.115 1.00 3.18 N ATOM 0 H HIS A 67 1.185 6.922 4.749 1.00 0.64 H new ATOM 0 HA HIS A 67 1.715 5.613 2.142 1.00 0.84 H new ATOM 0 HB2 HIS A 67 2.978 8.082 3.280 1.00 1.22 H new ATOM 0 HB3 HIS A 67 3.911 6.985 2.282 1.00 1.22 H new ATOM 0 HD1 HIS A 67 3.702 7.426 -0.280 1.00 3.25 H new ATOM 0 HD2 HIS A 67 0.509 8.932 2.016 1.00 2.35 H new ATOM 0 HE1 HIS A 67 2.332 8.945 -1.818 1.00 3.58 H new ATOM 993 N ALA A 68 3.525 4.217 3.189 1.00 0.52 N ATOM 994 CA ALA A 68 4.235 3.128 3.833 1.00 0.49 C ATOM 995 C ALA A 68 5.523 2.808 3.084 1.00 0.60 C ATOM 996 O ALA A 68 5.776 3.312 1.990 1.00 0.64 O ATOM 997 CB ALA A 68 3.315 1.905 3.905 1.00 0.43 C ATOM 0 H ALA A 68 3.551 4.172 2.170 1.00 0.52 H new ATOM 0 HA ALA A 68 4.514 3.421 4.845 1.00 0.49 H new ATOM 0 HB1 ALA A 68 3.841 1.082 4.388 1.00 0.43 H new ATOM 0 HB2 ALA A 68 2.424 2.154 4.481 1.00 0.43 H new ATOM 0 HB3 ALA A 68 3.024 1.608 2.897 1.00 0.43 H new ATOM 1003 N VAL A 69 6.344 1.945 3.672 1.00 0.83 N ATOM 1004 CA VAL A 69 7.593 1.506 3.121 1.00 1.01 C ATOM 1005 C VAL A 69 7.424 0.013 2.893 1.00 0.93 C ATOM 1006 O VAL A 69 7.055 -0.712 3.812 1.00 0.92 O ATOM 1007 CB VAL A 69 8.683 1.864 4.136 1.00 1.15 C ATOM 1008 CG1 VAL A 69 9.993 1.198 3.738 1.00 1.86 C ATOM 1009 CG2 VAL A 69 8.779 3.392 4.248 1.00 1.63 C ATOM 0 H VAL A 69 6.138 1.524 4.578 1.00 0.83 H new ATOM 0 HA VAL A 69 7.878 1.972 2.177 1.00 1.01 H new ATOM 0 HB VAL A 69 8.437 1.486 5.128 1.00 1.15 H new ATOM 0 HG11 VAL A 69 10.766 1.455 4.462 1.00 1.86 H new ATOM 0 HG12 VAL A 69 9.860 0.116 3.717 1.00 1.86 H new ATOM 0 HG13 VAL A 69 10.292 1.546 2.749 1.00 1.86 H new ATOM 0 HG21 VAL A 69 9.553 3.656 4.969 1.00 1.63 H new ATOM 0 HG22 VAL A 69 9.031 3.813 3.275 1.00 1.63 H new ATOM 0 HG23 VAL A 69 7.822 3.793 4.580 1.00 1.63 H new ATOM 1019 N GLY A 70 7.630 -0.427 1.656 1.00 1.11 N ATOM 1020 CA GLY A 70 7.541 -1.828 1.299 1.00 1.26 C ATOM 1021 C GLY A 70 8.924 -2.455 1.415 1.00 1.51 C ATOM 1022 O GLY A 70 9.930 -1.759 1.297 1.00 1.62 O ATOM 0 H GLY A 70 7.864 0.185 0.874 1.00 1.11 H new ATOM 0 HA2 GLY A 70 6.838 -2.341 1.956 1.00 1.26 H new ATOM 0 HA3 GLY A 70 7.163 -1.935 0.282 1.00 1.26 H new ATOM 1026 N PRO A 71 9.001 -3.771 1.623 1.00 2.13 N ATOM 1027 CA PRO A 71 10.264 -4.483 1.664 1.00 2.51 C ATOM 1028 C PRO A 71 10.849 -4.556 0.255 1.00 1.79 C ATOM 1029 O PRO A 71 10.171 -4.981 -0.683 1.00 1.82 O ATOM 1030 CB PRO A 71 9.908 -5.872 2.194 1.00 3.44 C ATOM 1031 CG PRO A 71 8.475 -6.069 1.709 1.00 3.44 C ATOM 1032 CD PRO A 71 7.880 -4.668 1.820 1.00 2.75 C ATOM 0 HA PRO A 71 11.013 -3.999 2.292 1.00 2.51 H new ATOM 0 HB2 PRO A 71 10.576 -6.638 1.800 1.00 3.44 H new ATOM 0 HB3 PRO A 71 9.976 -5.919 3.281 1.00 3.44 H new ATOM 0 HG2 PRO A 71 8.443 -6.441 0.685 1.00 3.44 H new ATOM 0 HG3 PRO A 71 7.935 -6.787 2.326 1.00 3.44 H new ATOM 0 HD2 PRO A 71 7.107 -4.506 1.068 1.00 2.75 H new ATOM 0 HD3 PRO A 71 7.415 -4.512 2.794 1.00 2.75 H new ATOM 1040 N ASN A 72 12.121 -4.189 0.086 1.00 1.43 N ATOM 1041 CA ASN A 72 12.774 -4.336 -1.191 1.00 1.08 C ATOM 1042 C ASN A 72 13.542 -5.637 -1.105 1.00 1.06 C ATOM 1043 O ASN A 72 14.719 -5.599 -0.781 1.00 1.16 O ATOM 1044 CB ASN A 72 13.733 -3.166 -1.473 1.00 1.44 C ATOM 1045 CG ASN A 72 13.014 -1.858 -1.776 1.00 1.69 C ATOM 1046 OD1 ASN A 72 12.366 -1.274 -0.922 1.00 2.72 O ATOM 1047 ND2 ASN A 72 13.131 -1.343 -2.992 1.00 2.06 N ATOM 0 H ASN A 72 12.706 -3.791 0.821 1.00 1.43 H new ATOM 0 HA ASN A 72 12.048 -4.339 -2.004 1.00 1.08 H new ATOM 0 HB2 ASN A 72 14.384 -3.023 -0.611 1.00 1.44 H new ATOM 0 HB3 ASN A 72 14.373 -3.425 -2.317 1.00 1.44 H new ATOM 0 HD21 ASN A 72 12.679 -0.457 -3.216 1.00 2.06 H new ATOM 0 HD22 ASN A 72 13.673 -1.833 -3.703 1.00 2.06 H new ATOM 1054 N PHE A 73 12.930 -6.785 -1.400 1.00 0.98 N ATOM 1055 CA PHE A 73 13.685 -8.038 -1.458 1.00 0.94 C ATOM 1056 C PHE A 73 14.868 -7.943 -2.431 1.00 0.91 C ATOM 1057 O PHE A 73 15.854 -8.655 -2.282 1.00 0.96 O ATOM 1058 CB PHE A 73 12.785 -9.236 -1.776 1.00 0.98 C ATOM 1059 CG PHE A 73 11.674 -9.470 -0.770 1.00 2.02 C ATOM 1060 CD1 PHE A 73 10.370 -9.000 -1.019 1.00 3.19 C ATOM 1061 CD2 PHE A 73 11.938 -10.194 0.409 1.00 3.23 C ATOM 1062 CE1 PHE A 73 9.338 -9.263 -0.104 1.00 4.68 C ATOM 1063 CE2 PHE A 73 10.900 -10.468 1.318 1.00 4.58 C ATOM 1064 CZ PHE A 73 9.601 -9.998 1.064 1.00 5.14 C ATOM 0 H PHE A 73 11.934 -6.874 -1.599 1.00 0.98 H new ATOM 0 HA PHE A 73 14.097 -8.206 -0.463 1.00 0.94 H new ATOM 0 HB2 PHE A 73 12.342 -9.090 -2.761 1.00 0.98 H new ATOM 0 HB3 PHE A 73 13.402 -10.133 -1.833 1.00 0.98 H new ATOM 0 HD1 PHE A 73 10.163 -8.436 -1.916 1.00 3.19 H new ATOM 0 HD2 PHE A 73 12.940 -10.540 0.616 1.00 3.23 H new ATOM 0 HE1 PHE A 73 8.340 -8.899 -0.299 1.00 4.68 H new ATOM 0 HE2 PHE A 73 11.102 -11.040 2.212 1.00 4.58 H new ATOM 0 HZ PHE A 73 8.806 -10.201 1.766 1.00 5.14 H new ATOM 1074 N ASN A 74 14.825 -7.019 -3.396 1.00 0.90 N ATOM 1075 CA ASN A 74 15.952 -6.788 -4.292 1.00 0.97 C ATOM 1076 C ASN A 74 17.214 -6.359 -3.538 1.00 1.08 C ATOM 1077 O ASN A 74 18.328 -6.604 -3.990 1.00 1.24 O ATOM 1078 CB ASN A 74 15.559 -5.734 -5.336 1.00 0.97 C ATOM 1079 CG ASN A 74 16.383 -5.825 -6.613 1.00 1.24 C ATOM 1080 OD1 ASN A 74 17.167 -6.739 -6.814 1.00 2.12 O ATOM 1081 ND2 ASN A 74 16.171 -4.897 -7.537 1.00 1.49 N ATOM 0 H ASN A 74 14.018 -6.420 -3.573 1.00 0.90 H new ATOM 0 HA ASN A 74 16.190 -7.729 -4.788 1.00 0.97 H new ATOM 0 HB2 ASN A 74 14.504 -5.850 -5.582 1.00 0.97 H new ATOM 0 HB3 ASN A 74 15.678 -4.740 -4.904 1.00 0.97 H new ATOM 0 HD21 ASN A 74 16.666 -4.942 -8.428 1.00 1.49 H new ATOM 0 HD22 ASN A 74 15.513 -4.139 -7.357 1.00 1.49 H new ATOM 1088 N LYS A 75 17.059 -5.683 -2.394 1.00 1.07 N ATOM 1089 CA LYS A 75 18.175 -5.229 -1.572 1.00 1.14 C ATOM 1090 C LYS A 75 17.950 -5.572 -0.102 1.00 1.08 C ATOM 1091 O LYS A 75 18.496 -4.914 0.780 1.00 1.15 O ATOM 1092 CB LYS A 75 18.350 -3.725 -1.777 1.00 1.27 C ATOM 1093 CG LYS A 75 19.017 -3.452 -3.127 1.00 1.39 C ATOM 1094 CD LYS A 75 19.097 -1.948 -3.360 1.00 2.26 C ATOM 1095 CE LYS A 75 20.012 -1.687 -4.561 1.00 2.40 C ATOM 1096 NZ LYS A 75 20.129 -0.246 -4.870 1.00 3.75 N ATOM 0 H LYS A 75 16.145 -5.436 -2.014 1.00 1.07 H new ATOM 0 HA LYS A 75 19.088 -5.742 -1.876 1.00 1.14 H new ATOM 0 HB2 LYS A 75 17.380 -3.229 -1.735 1.00 1.27 H new ATOM 0 HB3 LYS A 75 18.956 -3.309 -0.972 1.00 1.27 H new ATOM 0 HG2 LYS A 75 20.016 -3.887 -3.145 1.00 1.39 H new ATOM 0 HG3 LYS A 75 18.448 -3.925 -3.928 1.00 1.39 H new ATOM 0 HD2 LYS A 75 18.103 -1.541 -3.546 1.00 2.26 H new ATOM 0 HD3 LYS A 75 19.485 -1.448 -2.473 1.00 2.26 H new ATOM 0 HE2 LYS A 75 21.002 -2.095 -4.357 1.00 2.40 H new ATOM 0 HE3 LYS A 75 19.624 -2.214 -5.433 1.00 2.40 H new ATOM 0 HZ1 LYS A 75 20.757 -0.116 -5.689 1.00 3.75 H new ATOM 0 HZ2 LYS A 75 19.188 0.139 -5.091 1.00 3.75 H new ATOM 0 HZ3 LYS A 75 20.524 0.254 -4.048 1.00 3.75 H new ATOM 1110 N VAL A 76 17.170 -6.612 0.175 1.00 1.00 N ATOM 1111 CA VAL A 76 16.916 -7.044 1.543 1.00 1.00 C ATOM 1112 C VAL A 76 16.667 -8.552 1.533 1.00 0.95 C ATOM 1113 O VAL A 76 16.003 -9.061 0.635 1.00 1.07 O ATOM 1114 CB VAL A 76 15.768 -6.199 2.148 1.00 1.05 C ATOM 1115 CG1 VAL A 76 14.468 -6.957 2.442 1.00 0.83 C ATOM 1116 CG2 VAL A 76 16.259 -5.526 3.426 1.00 1.38 C ATOM 0 H VAL A 76 16.701 -7.174 -0.535 1.00 1.00 H new ATOM 0 HA VAL A 76 17.773 -6.874 2.195 1.00 1.00 H new ATOM 0 HB VAL A 76 15.508 -5.475 1.376 1.00 1.05 H new ATOM 0 HG11 VAL A 76 13.733 -6.270 2.862 1.00 0.83 H new ATOM 0 HG12 VAL A 76 14.079 -7.384 1.518 1.00 0.83 H new ATOM 0 HG13 VAL A 76 14.667 -7.757 3.155 1.00 0.83 H new ATOM 0 HG21 VAL A 76 15.454 -4.930 3.856 1.00 1.38 H new ATOM 0 HG22 VAL A 76 16.569 -6.287 4.142 1.00 1.38 H new ATOM 0 HG23 VAL A 76 17.106 -4.880 3.195 1.00 1.38 H new ATOM 1126 N SER A 77 17.223 -9.290 2.494 1.00 0.87 N ATOM 1127 CA SER A 77 17.094 -10.732 2.511 1.00 0.83 C ATOM 1128 C SER A 77 15.666 -11.085 2.890 1.00 0.82 C ATOM 1129 O SER A 77 15.000 -10.309 3.565 1.00 0.81 O ATOM 1130 CB SER A 77 18.078 -11.306 3.530 1.00 0.87 C ATOM 1131 OG SER A 77 19.367 -10.793 3.267 1.00 1.39 O ATOM 0 H SER A 77 17.765 -8.905 3.267 1.00 0.87 H new ATOM 0 HA SER A 77 17.319 -11.153 1.531 1.00 0.83 H new ATOM 0 HB2 SER A 77 17.768 -11.043 4.541 1.00 0.87 H new ATOM 0 HB3 SER A 77 18.087 -12.394 3.472 1.00 0.87 H new ATOM 0 HG SER A 77 20.003 -11.156 3.918 1.00 1.39 H new ATOM 1137 N GLU A 78 15.218 -12.288 2.542 1.00 0.84 N ATOM 1138 CA GLU A 78 13.868 -12.767 2.819 1.00 0.83 C ATOM 1139 C GLU A 78 13.518 -12.657 4.302 1.00 0.80 C ATOM 1140 O GLU A 78 12.359 -12.467 4.647 1.00 0.77 O ATOM 1141 CB GLU A 78 13.719 -14.210 2.306 1.00 0.88 C ATOM 1142 CG GLU A 78 12.699 -14.257 1.161 1.00 1.04 C ATOM 1143 CD GLU A 78 12.711 -15.601 0.422 1.00 1.72 C ATOM 1144 OE1 GLU A 78 13.065 -15.596 -0.779 1.00 2.80 O ATOM 1145 OE2 GLU A 78 12.362 -16.624 1.042 1.00 2.41 O ATOM 0 H GLU A 78 15.795 -12.970 2.050 1.00 0.84 H new ATOM 0 HA GLU A 78 13.159 -12.131 2.289 1.00 0.83 H new ATOM 0 HB2 GLU A 78 14.683 -14.583 1.961 1.00 0.88 H new ATOM 0 HB3 GLU A 78 13.397 -14.862 3.118 1.00 0.88 H new ATOM 0 HG2 GLU A 78 11.701 -14.073 1.559 1.00 1.04 H new ATOM 0 HG3 GLU A 78 12.913 -13.455 0.454 1.00 1.04 H new ATOM 1152 N VAL A 79 14.519 -12.738 5.179 1.00 0.81 N ATOM 1153 CA VAL A 79 14.321 -12.606 6.618 1.00 0.80 C ATOM 1154 C VAL A 79 13.879 -11.180 6.935 1.00 0.73 C ATOM 1155 O VAL A 79 12.893 -10.950 7.631 1.00 0.73 O ATOM 1156 CB VAL A 79 15.630 -12.962 7.343 1.00 0.84 C ATOM 1157 CG1 VAL A 79 15.554 -12.711 8.853 1.00 0.89 C ATOM 1158 CG2 VAL A 79 15.980 -14.437 7.114 1.00 0.92 C ATOM 0 H VAL A 79 15.490 -12.897 4.909 1.00 0.81 H new ATOM 0 HA VAL A 79 13.544 -13.289 6.961 1.00 0.80 H new ATOM 0 HB VAL A 79 16.400 -12.313 6.926 1.00 0.84 H new ATOM 0 HG11 VAL A 79 16.504 -12.979 9.315 1.00 0.89 H new ATOM 0 HG12 VAL A 79 15.346 -11.657 9.037 1.00 0.89 H new ATOM 0 HG13 VAL A 79 14.758 -13.318 9.283 1.00 0.89 H new ATOM 0 HG21 VAL A 79 16.909 -14.675 7.633 1.00 0.92 H new ATOM 0 HG22 VAL A 79 15.177 -15.066 7.500 1.00 0.92 H new ATOM 0 HG23 VAL A 79 16.103 -14.620 6.047 1.00 0.92 H new ATOM 1168 N GLU A 80 14.632 -10.206 6.433 1.00 0.74 N ATOM 1169 CA GLU A 80 14.375 -8.814 6.765 1.00 0.69 C ATOM 1170 C GLU A 80 13.114 -8.355 6.049 1.00 0.63 C ATOM 1171 O GLU A 80 12.382 -7.523 6.563 1.00 0.56 O ATOM 1172 CB GLU A 80 15.585 -7.964 6.360 1.00 0.72 C ATOM 1173 CG GLU A 80 15.567 -6.559 6.975 1.00 0.81 C ATOM 1174 CD GLU A 80 16.055 -6.575 8.424 1.00 1.61 C ATOM 1175 OE1 GLU A 80 15.344 -7.171 9.264 1.00 2.99 O ATOM 1176 OE2 GLU A 80 17.141 -6.003 8.668 1.00 2.16 O ATOM 0 H GLU A 80 15.418 -10.355 5.800 1.00 0.74 H new ATOM 0 HA GLU A 80 14.222 -8.701 7.838 1.00 0.69 H new ATOM 0 HB2 GLU A 80 16.498 -8.475 6.664 1.00 0.72 H new ATOM 0 HB3 GLU A 80 15.614 -7.878 5.274 1.00 0.72 H new ATOM 0 HG2 GLU A 80 16.198 -5.894 6.385 1.00 0.81 H new ATOM 0 HG3 GLU A 80 14.555 -6.156 6.935 1.00 0.81 H new ATOM 1183 N GLY A 81 12.835 -8.903 4.870 1.00 0.68 N ATOM 1184 CA GLY A 81 11.662 -8.541 4.107 1.00 0.63 C ATOM 1185 C GLY A 81 10.418 -9.212 4.652 1.00 0.60 C ATOM 1186 O GLY A 81 9.341 -8.666 4.474 1.00 0.56 O ATOM 0 H GLY A 81 13.420 -9.609 4.424 1.00 0.68 H new ATOM 0 HA2 GLY A 81 11.532 -7.459 4.128 1.00 0.63 H new ATOM 0 HA3 GLY A 81 11.803 -8.825 3.064 1.00 0.63 H new ATOM 1190 N ASP A 82 10.532 -10.360 5.321 1.00 0.64 N ATOM 1191 CA ASP A 82 9.407 -10.934 6.050 1.00 0.65 C ATOM 1192 C ASP A 82 9.014 -9.969 7.159 1.00 0.58 C ATOM 1193 O ASP A 82 7.865 -9.538 7.242 1.00 0.55 O ATOM 1194 CB ASP A 82 9.775 -12.303 6.630 1.00 0.75 C ATOM 1195 CG ASP A 82 8.654 -12.829 7.525 1.00 0.91 C ATOM 1196 OD1 ASP A 82 7.554 -13.061 6.980 1.00 1.73 O ATOM 1197 OD2 ASP A 82 8.917 -12.988 8.738 1.00 1.68 O ATOM 0 H ASP A 82 11.391 -10.908 5.371 1.00 0.64 H new ATOM 0 HA ASP A 82 8.567 -11.083 5.372 1.00 0.65 H new ATOM 0 HB2 ASP A 82 9.962 -13.008 5.820 1.00 0.75 H new ATOM 0 HB3 ASP A 82 10.699 -12.224 7.204 1.00 0.75 H new ATOM 1202 N LYS A 83 9.985 -9.564 7.984 1.00 0.58 N ATOM 1203 CA LYS A 83 9.678 -8.649 9.070 1.00 0.52 C ATOM 1204 C LYS A 83 9.139 -7.350 8.521 1.00 0.46 C ATOM 1205 O LYS A 83 8.104 -6.898 8.976 1.00 0.46 O ATOM 1206 CB LYS A 83 10.882 -8.358 9.963 1.00 0.55 C ATOM 1207 CG LYS A 83 11.146 -9.487 10.957 1.00 0.66 C ATOM 1208 CD LYS A 83 11.895 -8.964 12.191 1.00 1.62 C ATOM 1209 CE LYS A 83 11.018 -8.012 13.031 1.00 3.46 C ATOM 1210 NZ LYS A 83 11.364 -6.575 12.865 1.00 4.71 N ATOM 0 H LYS A 83 10.962 -9.850 7.919 1.00 0.58 H new ATOM 0 HA LYS A 83 8.926 -9.142 9.686 1.00 0.52 H new ATOM 0 HB2 LYS A 83 11.765 -8.208 9.342 1.00 0.55 H new ATOM 0 HB3 LYS A 83 10.713 -7.429 10.507 1.00 0.55 H new ATOM 0 HG2 LYS A 83 10.201 -9.936 11.263 1.00 0.66 H new ATOM 0 HG3 LYS A 83 11.731 -10.271 10.476 1.00 0.66 H new ATOM 0 HD2 LYS A 83 12.212 -9.805 12.807 1.00 1.62 H new ATOM 0 HD3 LYS A 83 12.798 -8.442 11.874 1.00 1.62 H new ATOM 0 HE2 LYS A 83 9.973 -8.159 12.757 1.00 3.46 H new ATOM 0 HE3 LYS A 83 11.112 -8.280 14.083 1.00 3.46 H new ATOM 0 HZ1 LYS A 83 10.610 -5.987 13.275 1.00 4.71 H new ATOM 0 HZ2 LYS A 83 12.261 -6.376 13.351 1.00 4.71 H new ATOM 0 HZ3 LYS A 83 11.462 -6.356 11.853 1.00 4.71 H new ATOM 1224 N GLN A 84 9.813 -6.754 7.549 1.00 0.46 N ATOM 1225 CA GLN A 84 9.444 -5.464 6.994 1.00 0.44 C ATOM 1226 C GLN A 84 8.072 -5.557 6.342 1.00 0.44 C ATOM 1227 O GLN A 84 7.294 -4.613 6.427 1.00 0.43 O ATOM 1228 CB GLN A 84 10.502 -5.007 5.991 1.00 0.51 C ATOM 1229 CG GLN A 84 11.754 -4.498 6.713 1.00 1.61 C ATOM 1230 CD GLN A 84 11.532 -3.121 7.325 1.00 2.40 C ATOM 1231 OE1 GLN A 84 11.076 -2.208 6.646 1.00 2.11 O ATOM 1232 NE2 GLN A 84 11.864 -2.938 8.597 1.00 3.64 N ATOM 0 H GLN A 84 10.644 -7.160 7.118 1.00 0.46 H new ATOM 0 HA GLN A 84 9.393 -4.724 7.793 1.00 0.44 H new ATOM 0 HB2 GLN A 84 10.767 -5.835 5.333 1.00 0.51 H new ATOM 0 HB3 GLN A 84 10.094 -4.217 5.360 1.00 0.51 H new ATOM 0 HG2 GLN A 84 12.034 -5.203 7.496 1.00 1.61 H new ATOM 0 HG3 GLN A 84 12.586 -4.454 6.011 1.00 1.61 H new ATOM 0 HE21 GLN A 84 12.242 -3.713 9.142 1.00 3.64 H new ATOM 0 HE22 GLN A 84 11.741 -2.022 9.029 1.00 3.64 H new ATOM 1241 N LEU A 85 7.745 -6.689 5.714 1.00 0.48 N ATOM 1242 CA LEU A 85 6.414 -6.860 5.144 1.00 0.51 C ATOM 1243 C LEU A 85 5.380 -6.831 6.261 1.00 0.46 C ATOM 1244 O LEU A 85 4.341 -6.186 6.135 1.00 0.45 O ATOM 1245 CB LEU A 85 6.320 -8.172 4.347 1.00 0.64 C ATOM 1246 CG LEU A 85 5.014 -8.323 3.550 1.00 0.65 C ATOM 1247 CD1 LEU A 85 4.724 -7.096 2.677 1.00 0.83 C ATOM 1248 CD2 LEU A 85 5.123 -9.547 2.639 1.00 0.97 C ATOM 0 H LEU A 85 8.372 -7.484 5.590 1.00 0.48 H new ATOM 0 HA LEU A 85 6.217 -6.042 4.452 1.00 0.51 H new ATOM 0 HB2 LEU A 85 7.163 -8.229 3.659 1.00 0.64 H new ATOM 0 HB3 LEU A 85 6.413 -9.012 5.036 1.00 0.64 H new ATOM 0 HG LEU A 85 4.201 -8.432 4.268 1.00 0.65 H new ATOM 0 HD11 LEU A 85 3.792 -7.249 2.133 1.00 0.83 H new ATOM 0 HD12 LEU A 85 4.635 -6.213 3.309 1.00 0.83 H new ATOM 0 HD13 LEU A 85 5.539 -6.953 1.967 1.00 0.83 H new ATOM 0 HD21 LEU A 85 4.200 -9.661 2.070 1.00 0.97 H new ATOM 0 HD22 LEU A 85 5.959 -9.416 1.952 1.00 0.97 H new ATOM 0 HD23 LEU A 85 5.288 -10.438 3.245 1.00 0.97 H new ATOM 1260 N ALA A 86 5.663 -7.516 7.366 1.00 0.45 N ATOM 1261 CA ALA A 86 4.739 -7.578 8.484 1.00 0.44 C ATOM 1262 C ALA A 86 4.734 -6.269 9.261 1.00 0.38 C ATOM 1263 O ALA A 86 3.748 -5.967 9.908 1.00 0.36 O ATOM 1264 CB ALA A 86 5.131 -8.737 9.400 1.00 0.48 C ATOM 0 H ALA A 86 6.529 -8.036 7.507 1.00 0.45 H new ATOM 0 HA ALA A 86 3.732 -7.741 8.100 1.00 0.44 H new ATOM 0 HB1 ALA A 86 4.439 -8.786 10.241 1.00 0.48 H new ATOM 0 HB2 ALA A 86 5.091 -9.672 8.841 1.00 0.48 H new ATOM 0 HB3 ALA A 86 6.143 -8.580 9.772 1.00 0.48 H new ATOM 1270 N GLU A 87 5.803 -5.482 9.208 1.00 0.36 N ATOM 1271 CA GLU A 87 5.946 -4.213 9.902 1.00 0.33 C ATOM 1272 C GLU A 87 5.167 -3.149 9.129 1.00 0.31 C ATOM 1273 O GLU A 87 4.518 -2.288 9.726 1.00 0.31 O ATOM 1274 CB GLU A 87 7.446 -3.899 10.069 1.00 0.39 C ATOM 1275 CG GLU A 87 7.975 -4.689 11.277 1.00 0.57 C ATOM 1276 CD GLU A 87 9.481 -4.573 11.573 1.00 1.24 C ATOM 1277 OE1 GLU A 87 10.310 -4.935 10.706 1.00 2.43 O ATOM 1278 OE2 GLU A 87 9.831 -4.333 12.751 1.00 2.06 O ATOM 0 H GLU A 87 6.626 -5.723 8.657 1.00 0.36 H new ATOM 0 HA GLU A 87 5.526 -4.244 10.908 1.00 0.33 H new ATOM 0 HB2 GLU A 87 7.994 -4.173 9.167 1.00 0.39 H new ATOM 0 HB3 GLU A 87 7.595 -2.830 10.220 1.00 0.39 H new ATOM 0 HG2 GLU A 87 7.428 -4.364 12.162 1.00 0.57 H new ATOM 0 HG3 GLU A 87 7.738 -5.742 11.125 1.00 0.57 H new ATOM 1285 N ALA A 88 5.144 -3.254 7.798 1.00 0.35 N ATOM 1286 CA ALA A 88 4.278 -2.433 6.971 1.00 0.40 C ATOM 1287 C ALA A 88 2.832 -2.777 7.309 1.00 0.39 C ATOM 1288 O ALA A 88 2.054 -1.913 7.702 1.00 0.38 O ATOM 1289 CB ALA A 88 4.583 -2.671 5.488 1.00 0.47 C ATOM 0 H ALA A 88 5.724 -3.908 7.273 1.00 0.35 H new ATOM 0 HA ALA A 88 4.449 -1.375 7.168 1.00 0.40 H new ATOM 0 HB1 ALA A 88 3.927 -2.050 4.877 1.00 0.47 H new ATOM 0 HB2 ALA A 88 5.622 -2.412 5.284 1.00 0.47 H new ATOM 0 HB3 ALA A 88 4.417 -3.721 5.246 1.00 0.47 H new ATOM 1295 N TYR A 89 2.477 -4.054 7.190 1.00 0.39 N ATOM 1296 CA TYR A 89 1.148 -4.558 7.454 1.00 0.41 C ATOM 1297 C TYR A 89 0.723 -4.354 8.905 1.00 0.37 C ATOM 1298 O TYR A 89 -0.466 -4.210 9.155 1.00 0.38 O ATOM 1299 CB TYR A 89 1.090 -6.023 6.993 1.00 0.46 C ATOM 1300 CG TYR A 89 0.977 -6.224 5.482 1.00 0.52 C ATOM 1301 CD1 TYR A 89 1.604 -7.330 4.875 1.00 1.97 C ATOM 1302 CD2 TYR A 89 0.270 -5.311 4.669 1.00 1.98 C ATOM 1303 CE1 TYR A 89 1.554 -7.508 3.479 1.00 1.97 C ATOM 1304 CE2 TYR A 89 0.255 -5.461 3.274 1.00 2.01 C ATOM 1305 CZ TYR A 89 0.892 -6.561 2.667 1.00 0.62 C ATOM 1306 OH TYR A 89 0.859 -6.673 1.308 1.00 0.67 O ATOM 0 H TYR A 89 3.131 -4.781 6.898 1.00 0.39 H new ATOM 0 HA TYR A 89 0.415 -3.986 6.885 1.00 0.41 H new ATOM 0 HB2 TYR A 89 1.986 -6.534 7.346 1.00 0.46 H new ATOM 0 HB3 TYR A 89 0.238 -6.505 7.473 1.00 0.46 H new ATOM 0 HD1 TYR A 89 2.129 -8.049 5.487 1.00 1.97 H new ATOM 0 HD2 TYR A 89 -0.264 -4.490 5.125 1.00 1.98 H new ATOM 0 HE1 TYR A 89 2.023 -8.370 3.028 1.00 1.97 H new ATOM 0 HE2 TYR A 89 -0.249 -4.728 2.661 1.00 2.01 H new ATOM 0 HH TYR A 89 0.354 -5.923 0.930 1.00 0.67 H new ATOM 1316 N GLU A 90 1.642 -4.264 9.861 1.00 0.34 N ATOM 1317 CA GLU A 90 1.327 -3.933 11.237 1.00 0.37 C ATOM 1318 C GLU A 90 1.047 -2.454 11.366 1.00 0.34 C ATOM 1319 O GLU A 90 0.176 -2.065 12.135 1.00 0.37 O ATOM 1320 CB GLU A 90 2.482 -4.272 12.186 1.00 0.51 C ATOM 1321 CG GLU A 90 2.301 -5.660 12.799 1.00 1.24 C ATOM 1322 CD GLU A 90 3.041 -5.770 14.135 1.00 1.62 C ATOM 1323 OE1 GLU A 90 3.892 -6.673 14.271 1.00 2.76 O ATOM 1324 OE2 GLU A 90 2.752 -4.922 15.016 1.00 1.87 O ATOM 0 H GLU A 90 2.636 -4.421 9.695 1.00 0.34 H new ATOM 0 HA GLU A 90 0.452 -4.523 11.509 1.00 0.37 H new ATOM 0 HB2 GLU A 90 3.426 -4.231 11.643 1.00 0.51 H new ATOM 0 HB3 GLU A 90 2.537 -3.525 12.978 1.00 0.51 H new ATOM 0 HG2 GLU A 90 1.240 -5.860 12.949 1.00 1.24 H new ATOM 0 HG3 GLU A 90 2.673 -6.418 12.109 1.00 1.24 H new ATOM 1331 N SER A 91 1.796 -1.618 10.653 1.00 0.36 N ATOM 1332 CA SER A 91 1.511 -0.200 10.680 1.00 0.43 C ATOM 1333 C SER A 91 0.123 0.022 10.096 1.00 0.40 C ATOM 1334 O SER A 91 -0.656 0.793 10.642 1.00 0.44 O ATOM 1335 CB SER A 91 2.561 0.599 9.907 1.00 0.54 C ATOM 1336 OG SER A 91 3.860 0.453 10.449 1.00 0.94 O ATOM 0 H SER A 91 2.583 -1.894 10.066 1.00 0.36 H new ATOM 0 HA SER A 91 1.543 0.154 11.710 1.00 0.43 H new ATOM 0 HB2 SER A 91 2.566 0.275 8.866 1.00 0.54 H new ATOM 0 HB3 SER A 91 2.286 1.654 9.911 1.00 0.54 H new ATOM 0 HG SER A 91 4.191 -0.451 10.265 1.00 0.94 H new ATOM 1342 N ILE A 92 -0.213 -0.667 9.004 1.00 0.39 N ATOM 1343 CA ILE A 92 -1.481 -0.457 8.329 1.00 0.43 C ATOM 1344 C ILE A 92 -2.596 -1.008 9.215 1.00 0.36 C ATOM 1345 O ILE A 92 -3.605 -0.347 9.434 1.00 0.36 O ATOM 1346 CB ILE A 92 -1.423 -1.090 6.919 1.00 0.54 C ATOM 1347 CG1 ILE A 92 -0.998 -0.057 5.856 1.00 0.69 C ATOM 1348 CG2 ILE A 92 -2.756 -1.695 6.487 1.00 0.59 C ATOM 1349 CD1 ILE A 92 0.512 -0.054 5.634 1.00 0.90 C ATOM 0 H ILE A 92 0.381 -1.375 8.573 1.00 0.39 H new ATOM 0 HA ILE A 92 -1.690 0.602 8.174 1.00 0.43 H new ATOM 0 HB ILE A 92 -0.682 -1.886 6.990 1.00 0.54 H new ATOM 0 HG12 ILE A 92 -1.502 -0.277 4.915 1.00 0.69 H new ATOM 0 HG13 ILE A 92 -1.321 0.937 6.167 1.00 0.69 H new ATOM 0 HG21 ILE A 92 -2.655 -2.124 5.490 1.00 0.59 H new ATOM 0 HG22 ILE A 92 -3.046 -2.475 7.190 1.00 0.59 H new ATOM 0 HG23 ILE A 92 -3.520 -0.918 6.472 1.00 0.59 H new ATOM 0 HD11 ILE A 92 0.767 0.688 4.878 1.00 0.90 H new ATOM 0 HD12 ILE A 92 1.017 0.192 6.568 1.00 0.90 H new ATOM 0 HD13 ILE A 92 0.832 -1.040 5.297 1.00 0.90 H new ATOM 1361 N ALA A 93 -2.425 -2.222 9.729 1.00 0.37 N ATOM 1362 CA ALA A 93 -3.474 -2.943 10.433 1.00 0.41 C ATOM 1363 C ALA A 93 -3.774 -2.239 11.748 1.00 0.39 C ATOM 1364 O ALA A 93 -4.930 -2.030 12.110 1.00 0.42 O ATOM 1365 CB ALA A 93 -3.046 -4.396 10.658 1.00 0.49 C ATOM 0 H ALA A 93 -1.546 -2.735 9.667 1.00 0.37 H new ATOM 0 HA ALA A 93 -4.385 -2.954 9.835 1.00 0.41 H new ATOM 0 HB1 ALA A 93 -3.836 -4.930 11.186 1.00 0.49 H new ATOM 0 HB2 ALA A 93 -2.864 -4.875 9.696 1.00 0.49 H new ATOM 0 HB3 ALA A 93 -2.133 -4.418 11.253 1.00 0.49 H new ATOM 1371 N LYS A 94 -2.731 -1.828 12.468 1.00 0.40 N ATOM 1372 CA LYS A 94 -2.943 -1.032 13.658 1.00 0.45 C ATOM 1373 C LYS A 94 -3.593 0.287 13.275 1.00 0.45 C ATOM 1374 O LYS A 94 -4.545 0.654 13.942 1.00 0.49 O ATOM 1375 CB LYS A 94 -1.659 -0.869 14.474 1.00 0.49 C ATOM 1376 CG LYS A 94 -1.341 -2.221 15.130 1.00 1.05 C ATOM 1377 CD LYS A 94 -0.044 -2.204 15.941 1.00 1.55 C ATOM 1378 CE LYS A 94 1.149 -2.140 14.988 1.00 2.73 C ATOM 1379 NZ LYS A 94 2.420 -2.418 15.685 1.00 3.65 N ATOM 0 H LYS A 94 -1.756 -2.031 12.249 1.00 0.40 H new ATOM 0 HA LYS A 94 -3.630 -1.555 14.324 1.00 0.45 H new ATOM 0 HB2 LYS A 94 -0.836 -0.554 13.832 1.00 0.49 H new ATOM 0 HB3 LYS A 94 -1.785 -0.097 15.233 1.00 0.49 H new ATOM 0 HG2 LYS A 94 -2.167 -2.505 15.782 1.00 1.05 H new ATOM 0 HG3 LYS A 94 -1.269 -2.985 14.356 1.00 1.05 H new ATOM 0 HD2 LYS A 94 -0.033 -1.346 16.613 1.00 1.55 H new ATOM 0 HD3 LYS A 94 0.021 -3.097 16.563 1.00 1.55 H new ATOM 0 HE2 LYS A 94 1.010 -2.861 14.183 1.00 2.73 H new ATOM 0 HE3 LYS A 94 1.195 -1.153 14.528 1.00 2.73 H new ATOM 0 HZ1 LYS A 94 3.095 -1.649 15.496 1.00 3.65 H new ATOM 0 HZ2 LYS A 94 2.247 -2.484 16.708 1.00 3.65 H new ATOM 0 HZ3 LYS A 94 2.815 -3.317 15.342 1.00 3.65 H new ATOM 1393 N ILE A 95 -3.175 0.961 12.197 1.00 0.42 N ATOM 1394 CA ILE A 95 -3.792 2.231 11.791 1.00 0.44 C ATOM 1395 C ILE A 95 -5.284 2.041 11.510 1.00 0.38 C ATOM 1396 O ILE A 95 -6.091 2.923 11.794 1.00 0.39 O ATOM 1397 CB ILE A 95 -3.038 2.847 10.589 1.00 0.51 C ATOM 1398 CG1 ILE A 95 -1.779 3.561 11.115 1.00 0.72 C ATOM 1399 CG2 ILE A 95 -3.892 3.844 9.785 1.00 0.91 C ATOM 1400 CD1 ILE A 95 -0.790 3.939 10.007 1.00 0.76 C ATOM 0 H ILE A 95 -2.415 0.650 11.592 1.00 0.42 H new ATOM 0 HA ILE A 95 -3.711 2.941 12.614 1.00 0.44 H new ATOM 0 HB ILE A 95 -2.782 2.034 9.909 1.00 0.51 H new ATOM 0 HG12 ILE A 95 -2.078 4.463 11.649 1.00 0.72 H new ATOM 0 HG13 ILE A 95 -1.277 2.915 11.835 1.00 0.72 H new ATOM 0 HG21 ILE A 95 -3.305 4.240 8.956 1.00 0.91 H new ATOM 0 HG22 ILE A 95 -4.774 3.336 9.395 1.00 0.91 H new ATOM 0 HG23 ILE A 95 -4.202 4.663 10.434 1.00 0.91 H new ATOM 0 HD11 ILE A 95 0.074 4.438 10.445 1.00 0.76 H new ATOM 0 HD12 ILE A 95 -0.464 3.038 9.488 1.00 0.76 H new ATOM 0 HD13 ILE A 95 -1.276 4.610 9.299 1.00 0.76 H new ATOM 1412 N VAL A 96 -5.671 0.892 10.963 1.00 0.38 N ATOM 1413 CA VAL A 96 -7.050 0.585 10.627 1.00 0.43 C ATOM 1414 C VAL A 96 -7.883 0.573 11.900 1.00 0.53 C ATOM 1415 O VAL A 96 -9.024 1.022 11.899 1.00 0.55 O ATOM 1416 CB VAL A 96 -7.089 -0.744 9.849 1.00 0.55 C ATOM 1417 CG1 VAL A 96 -8.458 -1.434 9.855 1.00 0.75 C ATOM 1418 CG2 VAL A 96 -6.708 -0.478 8.393 1.00 0.59 C ATOM 0 H VAL A 96 -5.021 0.138 10.739 1.00 0.38 H new ATOM 0 HA VAL A 96 -7.484 1.345 9.978 1.00 0.43 H new ATOM 0 HB VAL A 96 -6.388 -1.409 10.352 1.00 0.55 H new ATOM 0 HG11 VAL A 96 -8.400 -2.362 9.286 1.00 0.75 H new ATOM 0 HG12 VAL A 96 -8.749 -1.655 10.882 1.00 0.75 H new ATOM 0 HG13 VAL A 96 -9.199 -0.776 9.402 1.00 0.75 H new ATOM 0 HG21 VAL A 96 -6.733 -1.413 7.834 1.00 0.59 H new ATOM 0 HG22 VAL A 96 -7.415 0.226 7.955 1.00 0.59 H new ATOM 0 HG23 VAL A 96 -5.704 -0.057 8.351 1.00 0.59 H new ATOM 1428 N ASN A 97 -7.325 0.092 13.003 1.00 0.66 N ATOM 1429 CA ASN A 97 -8.066 0.082 14.253 1.00 0.92 C ATOM 1430 C ASN A 97 -7.963 1.437 14.940 1.00 0.98 C ATOM 1431 O ASN A 97 -8.927 1.890 15.547 1.00 1.18 O ATOM 1432 CB ASN A 97 -7.558 -1.032 15.174 1.00 1.01 C ATOM 1433 CG ASN A 97 -7.930 -2.409 14.641 1.00 0.90 C ATOM 1434 OD1 ASN A 97 -8.971 -2.582 14.016 1.00 1.31 O ATOM 1435 ND2 ASN A 97 -7.099 -3.414 14.885 1.00 1.24 N ATOM 0 H ASN A 97 -6.380 -0.289 13.057 1.00 0.66 H new ATOM 0 HA ASN A 97 -9.115 -0.114 14.031 1.00 0.92 H new ATOM 0 HB2 ASN A 97 -6.475 -0.959 15.272 1.00 1.01 H new ATOM 0 HB3 ASN A 97 -7.978 -0.901 16.171 1.00 1.01 H new ATOM 0 HD21 ASN A 97 -7.321 -4.352 14.551 1.00 1.24 H new ATOM 0 HD22 ASN A 97 -6.238 -3.249 15.407 1.00 1.24 H new ATOM 1442 N ASP A 98 -6.809 2.094 14.821 1.00 0.89 N ATOM 1443 CA ASP A 98 -6.488 3.345 15.504 1.00 1.02 C ATOM 1444 C ASP A 98 -7.436 4.433 15.013 1.00 1.08 C ATOM 1445 O ASP A 98 -7.858 5.314 15.757 1.00 1.40 O ATOM 1446 CB ASP A 98 -5.026 3.732 15.215 1.00 0.97 C ATOM 1447 CG ASP A 98 -4.333 4.399 16.402 1.00 1.53 C ATOM 1448 OD1 ASP A 98 -4.578 3.942 17.539 1.00 1.82 O ATOM 1449 OD2 ASP A 98 -3.510 5.305 16.143 1.00 2.89 O ATOM 0 H ASP A 98 -6.049 1.759 14.228 1.00 0.89 H new ATOM 0 HA ASP A 98 -6.607 3.225 16.581 1.00 1.02 H new ATOM 0 HB2 ASP A 98 -4.469 2.838 14.933 1.00 0.97 H new ATOM 0 HB3 ASP A 98 -4.998 4.408 14.360 1.00 0.97 H new ATOM 1454 N ASN A 99 -7.784 4.345 13.729 1.00 0.81 N ATOM 1455 CA ASN A 99 -8.687 5.272 13.061 1.00 0.86 C ATOM 1456 C ASN A 99 -10.074 4.660 12.852 1.00 0.90 C ATOM 1457 O ASN A 99 -10.974 5.320 12.336 1.00 0.96 O ATOM 1458 CB ASN A 99 -8.067 5.644 11.717 1.00 0.83 C ATOM 1459 CG ASN A 99 -8.260 7.115 11.378 1.00 0.90 C ATOM 1460 OD1 ASN A 99 -7.318 7.796 10.982 1.00 1.21 O ATOM 1461 ND2 ASN A 99 -9.474 7.637 11.485 1.00 2.16 N ATOM 0 H ASN A 99 -7.436 3.609 13.114 1.00 0.81 H new ATOM 0 HA ASN A 99 -8.821 6.156 13.684 1.00 0.86 H new ATOM 0 HB2 ASN A 99 -7.002 5.415 11.735 1.00 0.83 H new ATOM 0 HB3 ASN A 99 -8.512 5.032 10.933 1.00 0.83 H new ATOM 0 HD21 ASN A 99 -9.633 8.614 11.237 1.00 2.16 H new ATOM 0 HD22 ASN A 99 -10.249 7.062 11.815 1.00 2.16 H new ATOM 1468 N ASN A 100 -10.235 3.395 13.240 1.00 0.91 N ATOM 1469 CA ASN A 100 -11.456 2.597 13.173 1.00 0.95 C ATOM 1470 C ASN A 100 -12.049 2.530 11.767 1.00 0.81 C ATOM 1471 O ASN A 100 -13.263 2.565 11.570 1.00 0.73 O ATOM 1472 CB ASN A 100 -12.468 3.113 14.195 1.00 1.07 C ATOM 1473 CG ASN A 100 -13.609 2.121 14.392 1.00 1.28 C ATOM 1474 OD1 ASN A 100 -13.450 0.916 14.202 1.00 1.38 O ATOM 1475 ND2 ASN A 100 -14.780 2.605 14.784 1.00 2.59 N ATOM 0 H ASN A 100 -9.460 2.865 13.637 1.00 0.91 H new ATOM 0 HA ASN A 100 -11.194 1.569 13.425 1.00 0.95 H new ATOM 0 HB2 ASN A 100 -11.968 3.290 15.147 1.00 1.07 H new ATOM 0 HB3 ASN A 100 -12.869 4.070 13.862 1.00 1.07 H new ATOM 0 HD21 ASN A 100 -15.568 1.975 14.933 1.00 2.59 H new ATOM 0 HD22 ASN A 100 -14.892 3.607 14.936 1.00 2.59 H new ATOM 1482 N TYR A 101 -11.188 2.391 10.769 1.00 0.79 N ATOM 1483 CA TYR A 101 -11.596 2.272 9.386 1.00 0.72 C ATOM 1484 C TYR A 101 -12.241 0.923 9.109 1.00 0.87 C ATOM 1485 O TYR A 101 -11.674 -0.117 9.433 1.00 1.16 O ATOM 1486 CB TYR A 101 -10.361 2.372 8.510 1.00 0.81 C ATOM 1487 CG TYR A 101 -9.616 3.694 8.553 1.00 0.69 C ATOM 1488 CD1 TYR A 101 -8.223 3.715 8.348 1.00 1.77 C ATOM 1489 CD2 TYR A 101 -10.313 4.907 8.725 1.00 1.69 C ATOM 1490 CE1 TYR A 101 -7.536 4.938 8.261 1.00 1.78 C ATOM 1491 CE2 TYR A 101 -9.638 6.132 8.599 1.00 1.87 C ATOM 1492 CZ TYR A 101 -8.248 6.155 8.348 1.00 1.07 C ATOM 1493 OH TYR A 101 -7.599 7.346 8.223 1.00 1.43 O ATOM 0 H TYR A 101 -10.177 2.358 10.903 1.00 0.79 H new ATOM 0 HA TYR A 101 -12.315 3.063 9.176 1.00 0.72 H new ATOM 0 HB2 TYR A 101 -9.670 1.580 8.799 1.00 0.81 H new ATOM 0 HB3 TYR A 101 -10.655 2.178 7.479 1.00 0.81 H new ATOM 0 HD1 TYR A 101 -7.680 2.786 8.257 1.00 1.77 H new ATOM 0 HD2 TYR A 101 -11.368 4.894 8.954 1.00 1.69 H new ATOM 0 HE1 TYR A 101 -6.464 4.947 8.128 1.00 1.78 H new ATOM 0 HE2 TYR A 101 -10.183 7.059 8.694 1.00 1.87 H new ATOM 0 HH TYR A 101 -7.324 7.663 9.108 1.00 1.43 H new ATOM 1503 N LYS A 102 -13.414 0.929 8.475 1.00 0.87 N ATOM 1504 CA LYS A 102 -14.141 -0.271 8.107 1.00 1.16 C ATOM 1505 C LYS A 102 -13.996 -0.618 6.626 1.00 0.92 C ATOM 1506 O LYS A 102 -14.262 -1.749 6.240 1.00 1.13 O ATOM 1507 CB LYS A 102 -15.604 -0.081 8.486 1.00 1.61 C ATOM 1508 CG LYS A 102 -15.841 0.180 9.986 1.00 2.23 C ATOM 1509 CD LYS A 102 -15.274 -0.872 10.956 1.00 3.56 C ATOM 1510 CE LYS A 102 -13.769 -0.702 11.223 1.00 3.89 C ATOM 1511 NZ LYS A 102 -13.357 -1.312 12.503 1.00 5.51 N ATOM 0 H LYS A 102 -13.889 1.789 8.201 1.00 0.87 H new ATOM 0 HA LYS A 102 -13.717 -1.115 8.650 1.00 1.16 H new ATOM 0 HB2 LYS A 102 -16.010 0.754 7.915 1.00 1.61 H new ATOM 0 HB3 LYS A 102 -16.162 -0.970 8.191 1.00 1.61 H new ATOM 0 HG2 LYS A 102 -15.407 1.148 10.238 1.00 2.23 H new ATOM 0 HG3 LYS A 102 -16.915 0.258 10.155 1.00 2.23 H new ATOM 0 HD2 LYS A 102 -15.813 -0.813 11.902 1.00 3.56 H new ATOM 0 HD3 LYS A 102 -15.454 -1.867 10.548 1.00 3.56 H new ATOM 0 HE2 LYS A 102 -13.204 -1.155 10.408 1.00 3.89 H new ATOM 0 HE3 LYS A 102 -13.521 0.359 11.232 1.00 3.89 H new ATOM 0 HZ1 LYS A 102 -12.415 -1.740 12.396 1.00 5.51 H new ATOM 0 HZ2 LYS A 102 -13.324 -0.580 13.241 1.00 5.51 H new ATOM 0 HZ3 LYS A 102 -14.042 -2.046 12.774 1.00 5.51 H new ATOM 1525 N SER A 103 -13.563 0.327 5.800 1.00 0.69 N ATOM 1526 CA SER A 103 -13.214 0.105 4.403 1.00 0.68 C ATOM 1527 C SER A 103 -11.958 0.923 4.107 1.00 0.55 C ATOM 1528 O SER A 103 -11.780 1.987 4.702 1.00 0.70 O ATOM 1529 CB SER A 103 -14.387 0.498 3.499 1.00 1.03 C ATOM 1530 OG SER A 103 -15.132 1.555 4.077 1.00 1.65 O ATOM 0 H SER A 103 -13.442 1.297 6.093 1.00 0.69 H new ATOM 0 HA SER A 103 -13.010 -0.948 4.208 1.00 0.68 H new ATOM 0 HB2 SER A 103 -14.013 0.802 2.521 1.00 1.03 H new ATOM 0 HB3 SER A 103 -15.034 -0.364 3.339 1.00 1.03 H new ATOM 0 HG SER A 103 -15.876 1.793 3.485 1.00 1.65 H new ATOM 1536 N VAL A 104 -11.056 0.397 3.269 1.00 0.48 N ATOM 1537 CA VAL A 104 -9.762 1.008 2.988 1.00 0.51 C ATOM 1538 C VAL A 104 -9.282 0.562 1.613 1.00 0.47 C ATOM 1539 O VAL A 104 -9.324 -0.633 1.316 1.00 0.50 O ATOM 1540 CB VAL A 104 -8.736 0.576 4.054 1.00 0.73 C ATOM 1541 CG1 VAL A 104 -7.311 1.017 3.709 1.00 1.67 C ATOM 1542 CG2 VAL A 104 -9.066 1.149 5.435 1.00 1.36 C ATOM 0 H VAL A 104 -11.211 -0.475 2.764 1.00 0.48 H new ATOM 0 HA VAL A 104 -9.864 2.093 3.008 1.00 0.51 H new ATOM 0 HB VAL A 104 -8.793 -0.512 4.071 1.00 0.73 H new ATOM 0 HG11 VAL A 104 -6.628 0.687 4.492 1.00 1.67 H new ATOM 0 HG12 VAL A 104 -7.013 0.575 2.758 1.00 1.67 H new ATOM 0 HG13 VAL A 104 -7.275 2.104 3.630 1.00 1.67 H new ATOM 0 HG21 VAL A 104 -8.317 0.819 6.154 1.00 1.36 H new ATOM 0 HG22 VAL A 104 -9.067 2.238 5.386 1.00 1.36 H new ATOM 0 HG23 VAL A 104 -10.049 0.799 5.749 1.00 1.36 H new ATOM 1552 N ALA A 105 -8.752 1.493 0.809 1.00 0.49 N ATOM 1553 CA ALA A 105 -8.070 1.128 -0.421 1.00 0.51 C ATOM 1554 C ALA A 105 -6.588 0.886 -0.152 1.00 0.51 C ATOM 1555 O ALA A 105 -5.839 1.821 0.138 1.00 0.55 O ATOM 1556 CB ALA A 105 -8.274 2.170 -1.519 1.00 0.56 C ATOM 0 H ALA A 105 -8.786 2.496 0.994 1.00 0.49 H new ATOM 0 HA ALA A 105 -8.511 0.200 -0.785 1.00 0.51 H new ATOM 0 HB1 ALA A 105 -7.747 1.857 -2.420 1.00 0.56 H new ATOM 0 HB2 ALA A 105 -9.338 2.267 -1.736 1.00 0.56 H new ATOM 0 HB3 ALA A 105 -7.883 3.131 -1.186 1.00 0.56 H new ATOM 1562 N ILE A 106 -6.167 -0.374 -0.276 1.00 0.53 N ATOM 1563 CA ILE A 106 -4.809 -0.829 -0.043 1.00 0.60 C ATOM 1564 C ILE A 106 -4.358 -1.600 -1.291 1.00 0.71 C ATOM 1565 O ILE A 106 -4.815 -2.717 -1.525 1.00 1.08 O ATOM 1566 CB ILE A 106 -4.757 -1.642 1.271 1.00 0.83 C ATOM 1567 CG1 ILE A 106 -3.396 -2.306 1.510 1.00 1.87 C ATOM 1568 CG2 ILE A 106 -5.827 -2.738 1.391 1.00 1.19 C ATOM 1569 CD1 ILE A 106 -2.230 -1.319 1.539 1.00 3.10 C ATOM 0 H ILE A 106 -6.793 -1.130 -0.553 1.00 0.53 H new ATOM 0 HA ILE A 106 -4.109 -0.006 0.100 1.00 0.60 H new ATOM 0 HB ILE A 106 -4.950 -0.881 2.027 1.00 0.83 H new ATOM 0 HG12 ILE A 106 -3.426 -2.847 2.456 1.00 1.87 H new ATOM 0 HG13 ILE A 106 -3.218 -3.043 0.727 1.00 1.87 H new ATOM 0 HG21 ILE A 106 -5.713 -3.255 2.344 1.00 1.19 H new ATOM 0 HG22 ILE A 106 -6.818 -2.286 1.339 1.00 1.19 H new ATOM 0 HG23 ILE A 106 -5.710 -3.451 0.575 1.00 1.19 H new ATOM 0 HD11 ILE A 106 -1.300 -1.860 1.712 1.00 3.10 H new ATOM 0 HD12 ILE A 106 -2.173 -0.795 0.585 1.00 3.10 H new ATOM 0 HD13 ILE A 106 -2.384 -0.597 2.341 1.00 3.10 H new ATOM 1581 N PRO A 107 -3.509 -1.008 -2.144 1.00 0.61 N ATOM 1582 CA PRO A 107 -3.039 -1.669 -3.349 1.00 0.77 C ATOM 1583 C PRO A 107 -2.034 -2.772 -3.002 1.00 0.76 C ATOM 1584 O PRO A 107 -1.598 -2.901 -1.858 1.00 0.83 O ATOM 1585 CB PRO A 107 -2.421 -0.554 -4.196 1.00 0.91 C ATOM 1586 CG PRO A 107 -1.912 0.432 -3.148 1.00 0.87 C ATOM 1587 CD PRO A 107 -2.975 0.342 -2.055 1.00 0.74 C ATOM 0 HA PRO A 107 -3.838 -2.172 -3.894 1.00 0.77 H new ATOM 0 HB2 PRO A 107 -1.613 -0.926 -4.826 1.00 0.91 H new ATOM 0 HB3 PRO A 107 -3.156 -0.096 -4.858 1.00 0.91 H new ATOM 0 HG2 PRO A 107 -0.925 0.154 -2.777 1.00 0.87 H new ATOM 0 HG3 PRO A 107 -1.829 1.442 -3.549 1.00 0.87 H new ATOM 0 HD2 PRO A 107 -2.544 0.530 -1.072 1.00 0.74 H new ATOM 0 HD3 PRO A 107 -3.758 1.085 -2.207 1.00 0.74 H new ATOM 1595 N LEU A 108 -1.643 -3.568 -4.002 1.00 1.02 N ATOM 1596 CA LEU A 108 -0.682 -4.643 -3.835 1.00 1.02 C ATOM 1597 C LEU A 108 0.648 -4.158 -4.383 1.00 1.04 C ATOM 1598 O LEU A 108 0.714 -3.601 -5.477 1.00 1.32 O ATOM 1599 CB LEU A 108 -1.149 -5.908 -4.568 1.00 1.39 C ATOM 1600 CG LEU A 108 -2.350 -6.560 -3.868 1.00 1.65 C ATOM 1601 CD1 LEU A 108 -2.978 -7.625 -4.767 1.00 2.33 C ATOM 1602 CD2 LEU A 108 -1.939 -7.226 -2.552 1.00 2.06 C ATOM 0 H LEU A 108 -1.993 -3.477 -4.956 1.00 1.02 H new ATOM 0 HA LEU A 108 -0.582 -4.904 -2.781 1.00 1.02 H new ATOM 0 HB2 LEU A 108 -1.419 -5.656 -5.594 1.00 1.39 H new ATOM 0 HB3 LEU A 108 -0.327 -6.622 -4.621 1.00 1.39 H new ATOM 0 HG LEU A 108 -3.068 -5.767 -3.661 1.00 1.65 H new ATOM 0 HD11 LEU A 108 -3.828 -8.077 -4.256 1.00 2.33 H new ATOM 0 HD12 LEU A 108 -3.316 -7.164 -5.695 1.00 2.33 H new ATOM 0 HD13 LEU A 108 -2.239 -8.394 -4.992 1.00 2.33 H new ATOM 0 HD21 LEU A 108 -2.814 -7.677 -2.084 1.00 2.06 H new ATOM 0 HD22 LEU A 108 -1.196 -7.998 -2.751 1.00 2.06 H new ATOM 0 HD23 LEU A 108 -1.514 -6.478 -1.883 1.00 2.06 H new ATOM 1614 N LEU A 109 1.695 -4.360 -3.592 1.00 1.00 N ATOM 1615 CA LEU A 109 3.050 -3.917 -3.860 1.00 1.16 C ATOM 1616 C LEU A 109 4.024 -5.006 -3.400 1.00 0.83 C ATOM 1617 O LEU A 109 3.595 -6.116 -3.089 1.00 0.98 O ATOM 1618 CB LEU A 109 3.272 -2.530 -3.215 1.00 1.79 C ATOM 1619 CG LEU A 109 2.818 -2.377 -1.749 1.00 1.15 C ATOM 1620 CD1 LEU A 109 3.603 -3.263 -0.778 1.00 2.29 C ATOM 1621 CD2 LEU A 109 3.000 -0.918 -1.321 1.00 1.33 C ATOM 0 H LEU A 109 1.614 -4.860 -2.707 1.00 1.00 H new ATOM 0 HA LEU A 109 3.233 -3.776 -4.925 1.00 1.16 H new ATOM 0 HB2 LEU A 109 4.335 -2.293 -3.270 1.00 1.79 H new ATOM 0 HB3 LEU A 109 2.748 -1.786 -3.815 1.00 1.79 H new ATOM 0 HG LEU A 109 1.774 -2.687 -1.707 1.00 1.15 H new ATOM 0 HD11 LEU A 109 3.234 -3.107 0.236 1.00 2.29 H new ATOM 0 HD12 LEU A 109 3.474 -4.309 -1.055 1.00 2.29 H new ATOM 0 HD13 LEU A 109 4.661 -3.004 -0.823 1.00 2.29 H new ATOM 0 HD21 LEU A 109 2.681 -0.800 -0.285 1.00 1.33 H new ATOM 0 HD22 LEU A 109 4.050 -0.641 -1.411 1.00 1.33 H new ATOM 0 HD23 LEU A 109 2.398 -0.273 -1.961 1.00 1.33 H new ATOM 1633 N SER A 110 5.321 -4.679 -3.381 1.00 0.86 N ATOM 1634 CA SER A 110 6.435 -5.573 -3.089 1.00 1.08 C ATOM 1635 C SER A 110 6.506 -6.762 -4.046 1.00 1.40 C ATOM 1636 O SER A 110 6.659 -7.895 -3.601 1.00 1.94 O ATOM 1637 CB SER A 110 6.473 -5.977 -1.604 1.00 1.54 C ATOM 1638 OG SER A 110 5.450 -6.882 -1.245 1.00 1.78 O ATOM 0 H SER A 110 5.633 -3.729 -3.581 1.00 0.86 H new ATOM 0 HA SER A 110 7.350 -5.009 -3.271 1.00 1.08 H new ATOM 0 HB2 SER A 110 7.441 -6.427 -1.382 1.00 1.54 H new ATOM 0 HB3 SER A 110 6.389 -5.081 -0.989 1.00 1.54 H new ATOM 0 HG SER A 110 4.739 -6.857 -1.919 1.00 1.78 H new ATOM 1644 N THR A 111 6.469 -6.498 -5.356 1.00 1.48 N ATOM 1645 CA THR A 111 6.365 -7.535 -6.381 1.00 1.99 C ATOM 1646 C THR A 111 7.435 -7.458 -7.470 1.00 2.62 C ATOM 1647 O THR A 111 7.531 -8.351 -8.307 1.00 3.67 O ATOM 1648 CB THR A 111 4.982 -7.420 -7.023 1.00 1.95 C ATOM 1649 OG1 THR A 111 4.653 -6.047 -7.171 1.00 2.30 O ATOM 1650 CG2 THR A 111 3.936 -8.098 -6.149 1.00 1.67 C ATOM 0 H THR A 111 6.511 -5.552 -5.735 1.00 1.48 H new ATOM 0 HA THR A 111 6.518 -8.494 -5.886 1.00 1.99 H new ATOM 0 HB THR A 111 4.998 -7.909 -7.997 1.00 1.95 H new ATOM 0 HG1 THR A 111 3.768 -5.965 -7.584 1.00 2.30 H new ATOM 0 HG21 THR A 111 2.956 -8.008 -6.618 1.00 1.67 H new ATOM 0 HG22 THR A 111 4.187 -9.152 -6.032 1.00 1.67 H new ATOM 0 HG23 THR A 111 3.914 -7.620 -5.170 1.00 1.67 H new ATOM 1658 N GLY A 112 8.235 -6.394 -7.495 1.00 2.61 N ATOM 1659 CA GLY A 112 9.228 -6.200 -8.543 1.00 3.15 C ATOM 1660 C GLY A 112 9.890 -4.845 -8.361 1.00 2.42 C ATOM 1661 O GLY A 112 11.097 -4.758 -8.171 1.00 3.42 O ATOM 0 H GLY A 112 8.212 -5.651 -6.797 1.00 2.61 H new ATOM 0 HA2 GLY A 112 9.976 -6.992 -8.502 1.00 3.15 H new ATOM 0 HA3 GLY A 112 8.755 -6.258 -9.523 1.00 3.15 H new ATOM 1665 N ILE A 113 9.079 -3.788 -8.308 1.00 1.31 N ATOM 1666 CA ILE A 113 9.545 -2.441 -7.996 1.00 0.95 C ATOM 1667 C ILE A 113 10.382 -2.399 -6.709 1.00 0.88 C ATOM 1668 O ILE A 113 11.311 -1.602 -6.601 1.00 1.21 O ATOM 1669 CB ILE A 113 8.372 -1.441 -7.972 1.00 1.77 C ATOM 1670 CG1 ILE A 113 7.329 -1.649 -6.852 1.00 2.89 C ATOM 1671 CG2 ILE A 113 7.693 -1.388 -9.348 1.00 2.67 C ATOM 1672 CD1 ILE A 113 6.528 -2.957 -6.863 1.00 5.40 C ATOM 0 H ILE A 113 8.075 -3.845 -8.482 1.00 1.31 H new ATOM 0 HA ILE A 113 10.216 -2.131 -8.798 1.00 0.95 H new ATOM 0 HB ILE A 113 8.829 -0.481 -7.733 1.00 1.77 H new ATOM 0 HG12 ILE A 113 7.845 -1.579 -5.895 1.00 2.89 H new ATOM 0 HG13 ILE A 113 6.621 -0.821 -6.894 1.00 2.89 H new ATOM 0 HG21 ILE A 113 6.866 -0.678 -9.319 1.00 2.67 H new ATOM 0 HG22 ILE A 113 8.417 -1.071 -10.099 1.00 2.67 H new ATOM 0 HG23 ILE A 113 7.313 -2.377 -9.605 1.00 2.67 H new ATOM 0 HD11 ILE A 113 5.835 -2.967 -6.021 1.00 5.40 H new ATOM 0 HD12 ILE A 113 5.968 -3.033 -7.795 1.00 5.40 H new ATOM 0 HD13 ILE A 113 7.211 -3.803 -6.780 1.00 5.40 H new ATOM 1684 N PHE A 114 10.068 -3.263 -5.738 1.00 0.78 N ATOM 1685 CA PHE A 114 10.815 -3.408 -4.497 1.00 0.77 C ATOM 1686 C PHE A 114 11.460 -4.795 -4.445 1.00 0.76 C ATOM 1687 O PHE A 114 12.650 -4.925 -4.165 1.00 0.78 O ATOM 1688 CB PHE A 114 9.915 -3.110 -3.285 1.00 0.98 C ATOM 1689 CG PHE A 114 9.097 -1.838 -3.389 1.00 0.82 C ATOM 1690 CD1 PHE A 114 9.638 -0.698 -4.011 1.00 1.81 C ATOM 1691 CD2 PHE A 114 7.782 -1.796 -2.889 1.00 1.82 C ATOM 1692 CE1 PHE A 114 8.848 0.440 -4.218 1.00 1.85 C ATOM 1693 CE2 PHE A 114 6.998 -0.644 -3.069 1.00 1.99 C ATOM 1694 CZ PHE A 114 7.521 0.466 -3.756 1.00 1.21 C ATOM 0 H PHE A 114 9.268 -3.893 -5.800 1.00 0.78 H new ATOM 0 HA PHE A 114 11.622 -2.677 -4.460 1.00 0.77 H new ATOM 0 HB2 PHE A 114 9.235 -3.950 -3.142 1.00 0.98 H new ATOM 0 HB3 PHE A 114 10.540 -3.050 -2.394 1.00 0.98 H new ATOM 0 HD1 PHE A 114 10.669 -0.700 -4.331 1.00 1.81 H new ATOM 0 HD2 PHE A 114 7.375 -2.650 -2.367 1.00 1.82 H new ATOM 0 HE1 PHE A 114 9.258 1.297 -4.732 1.00 1.85 H new ATOM 0 HE2 PHE A 114 5.991 -0.611 -2.679 1.00 1.99 H new ATOM 0 HZ PHE A 114 6.905 1.336 -3.928 1.00 1.21 H new ATOM 1704 N SER A 115 10.677 -5.843 -4.710 1.00 0.79 N ATOM 1705 CA SER A 115 11.121 -7.226 -4.596 1.00 0.88 C ATOM 1706 C SER A 115 12.221 -7.602 -5.597 1.00 0.83 C ATOM 1707 O SER A 115 12.938 -8.583 -5.414 1.00 0.91 O ATOM 1708 CB SER A 115 9.909 -8.139 -4.767 1.00 1.05 C ATOM 1709 OG SER A 115 10.193 -9.411 -4.252 1.00 2.11 O ATOM 0 H SER A 115 9.707 -5.750 -5.013 1.00 0.79 H new ATOM 0 HA SER A 115 11.567 -7.350 -3.609 1.00 0.88 H new ATOM 0 HB2 SER A 115 9.047 -7.713 -4.253 1.00 1.05 H new ATOM 0 HB3 SER A 115 9.646 -8.215 -5.822 1.00 1.05 H new ATOM 0 HG SER A 115 9.671 -10.084 -4.736 1.00 2.11 H new ATOM 1715 N GLY A 116 12.362 -6.847 -6.683 1.00 0.93 N ATOM 1716 CA GLY A 116 13.298 -7.175 -7.739 1.00 0.99 C ATOM 1717 C GLY A 116 12.669 -8.213 -8.651 1.00 1.05 C ATOM 1718 O GLY A 116 12.080 -7.861 -9.668 1.00 1.85 O ATOM 0 H GLY A 116 11.829 -5.994 -6.850 1.00 0.93 H new ATOM 0 HA2 GLY A 116 13.554 -6.280 -8.307 1.00 0.99 H new ATOM 0 HA3 GLY A 116 14.225 -7.559 -7.314 1.00 0.99 H new ATOM 1722 N ASN A 117 12.793 -9.494 -8.297 1.00 1.25 N ATOM 1723 CA ASN A 117 12.364 -10.579 -9.174 1.00 1.50 C ATOM 1724 C ASN A 117 11.942 -11.802 -8.351 1.00 1.54 C ATOM 1725 O ASN A 117 12.409 -12.913 -8.592 1.00 2.16 O ATOM 1726 CB ASN A 117 13.511 -10.899 -10.151 1.00 2.26 C ATOM 1727 CG ASN A 117 13.045 -11.694 -11.368 1.00 2.74 C ATOM 1728 OD1 ASN A 117 12.745 -11.124 -12.408 1.00 3.51 O ATOM 1729 ND2 ASN A 117 12.988 -13.013 -11.277 1.00 3.68 N ATOM 0 H ASN A 117 13.187 -9.803 -7.408 1.00 1.25 H new ATOM 0 HA ASN A 117 11.489 -10.279 -9.751 1.00 1.50 H new ATOM 0 HB2 ASN A 117 13.969 -9.968 -10.484 1.00 2.26 H new ATOM 0 HB3 ASN A 117 14.282 -11.464 -9.627 1.00 2.26 H new ATOM 0 HD21 ASN A 117 12.691 -13.567 -12.080 1.00 3.68 H new ATOM 0 HD22 ASN A 117 13.241 -13.475 -10.404 1.00 3.68 H new ATOM 1736 N LYS A 118 11.067 -11.610 -7.359 1.00 1.93 N ATOM 1737 CA LYS A 118 10.419 -12.688 -6.608 1.00 2.20 C ATOM 1738 C LYS A 118 9.227 -12.085 -5.857 1.00 2.12 C ATOM 1739 O LYS A 118 8.901 -10.931 -6.118 1.00 2.95 O ATOM 1740 CB LYS A 118 11.436 -13.386 -5.677 1.00 2.81 C ATOM 1741 CG LYS A 118 11.573 -14.864 -6.080 1.00 3.25 C ATOM 1742 CD LYS A 118 12.603 -15.622 -5.232 1.00 4.05 C ATOM 1743 CE LYS A 118 11.984 -16.070 -3.902 1.00 5.62 C ATOM 1744 NZ LYS A 118 12.957 -16.759 -3.030 1.00 6.62 N ATOM 0 H LYS A 118 10.784 -10.680 -7.050 1.00 1.93 H new ATOM 0 HA LYS A 118 10.048 -13.467 -7.274 1.00 2.20 H new ATOM 0 HB2 LYS A 118 12.404 -12.890 -5.742 1.00 2.81 H new ATOM 0 HB3 LYS A 118 11.107 -13.310 -4.640 1.00 2.81 H new ATOM 0 HG2 LYS A 118 10.603 -15.352 -5.986 1.00 3.25 H new ATOM 0 HG3 LYS A 118 11.860 -14.924 -7.130 1.00 3.25 H new ATOM 0 HD2 LYS A 118 12.965 -16.491 -5.781 1.00 4.05 H new ATOM 0 HD3 LYS A 118 13.465 -14.983 -5.041 1.00 4.05 H new ATOM 0 HE2 LYS A 118 11.584 -15.201 -3.380 1.00 5.62 H new ATOM 0 HE3 LYS A 118 11.144 -16.736 -4.102 1.00 5.62 H new ATOM 0 HZ1 LYS A 118 12.868 -17.788 -3.156 1.00 6.62 H new ATOM 0 HZ2 LYS A 118 13.921 -16.461 -3.282 1.00 6.62 H new ATOM 0 HZ3 LYS A 118 12.768 -16.514 -2.037 1.00 6.62 H new ATOM 1758 N ASP A 119 8.609 -12.834 -4.936 1.00 2.10 N ATOM 1759 CA ASP A 119 7.426 -12.460 -4.145 1.00 1.96 C ATOM 1760 C ASP A 119 6.302 -11.896 -5.021 1.00 1.45 C ATOM 1761 O ASP A 119 6.265 -10.709 -5.332 1.00 2.23 O ATOM 1762 CB ASP A 119 7.796 -11.516 -2.988 1.00 2.50 C ATOM 1763 CG ASP A 119 6.683 -11.453 -1.941 1.00 3.22 C ATOM 1764 OD1 ASP A 119 5.516 -11.688 -2.312 1.00 3.84 O ATOM 1765 OD2 ASP A 119 7.008 -11.269 -0.748 1.00 3.90 O ATOM 0 H ASP A 119 8.939 -13.772 -4.708 1.00 2.10 H new ATOM 0 HA ASP A 119 7.035 -13.373 -3.697 1.00 1.96 H new ATOM 0 HB2 ASP A 119 8.719 -11.857 -2.520 1.00 2.50 H new ATOM 0 HB3 ASP A 119 7.987 -10.517 -3.379 1.00 2.50 H new ATOM 1770 N ARG A 120 5.388 -12.750 -5.489 1.00 1.07 N ATOM 1771 CA ARG A 120 4.336 -12.250 -6.365 1.00 1.07 C ATOM 1772 C ARG A 120 3.238 -11.568 -5.555 1.00 0.92 C ATOM 1773 O ARG A 120 3.177 -11.625 -4.332 1.00 0.90 O ATOM 1774 CB ARG A 120 3.736 -13.343 -7.251 1.00 1.69 C ATOM 1775 CG ARG A 120 4.772 -14.111 -8.079 1.00 1.98 C ATOM 1776 CD ARG A 120 4.061 -14.684 -9.311 1.00 2.74 C ATOM 1777 NE ARG A 120 4.848 -15.730 -9.982 1.00 3.22 N ATOM 1778 CZ ARG A 120 4.631 -16.174 -11.228 1.00 3.97 C ATOM 1779 NH1 ARG A 120 5.318 -17.219 -11.693 1.00 4.57 N ATOM 1780 NH2 ARG A 120 3.725 -15.582 -12.008 1.00 4.51 N ATOM 0 H ARG A 120 5.356 -13.749 -5.285 1.00 1.07 H new ATOM 0 HA ARG A 120 4.803 -11.520 -7.026 1.00 1.07 H new ATOM 0 HB2 ARG A 120 3.193 -14.049 -6.623 1.00 1.69 H new ATOM 0 HB3 ARG A 120 3.009 -12.891 -7.926 1.00 1.69 H new ATOM 0 HG2 ARG A 120 5.585 -13.450 -8.381 1.00 1.98 H new ATOM 0 HG3 ARG A 120 5.215 -14.912 -7.487 1.00 1.98 H new ATOM 0 HD2 ARG A 120 3.097 -15.096 -9.011 1.00 2.74 H new ATOM 0 HD3 ARG A 120 3.858 -13.878 -10.016 1.00 2.74 H new ATOM 0 HE ARG A 120 5.617 -16.149 -9.460 1.00 3.22 H new ATOM 0 HH11 ARG A 120 6.008 -17.680 -11.100 1.00 4.57 H new ATOM 0 HH12 ARG A 120 5.153 -17.557 -12.641 1.00 4.57 H new ATOM 0 HH21 ARG A 120 3.192 -14.786 -11.657 1.00 4.51 H new ATOM 0 HH22 ARG A 120 3.565 -15.925 -12.955 1.00 4.51 H new ATOM 1794 N LEU A 121 2.281 -10.980 -6.263 1.00 0.87 N ATOM 1795 CA LEU A 121 1.185 -10.270 -5.633 1.00 0.80 C ATOM 1796 C LEU A 121 0.277 -11.237 -4.908 1.00 0.75 C ATOM 1797 O LEU A 121 -0.330 -10.855 -3.926 1.00 0.72 O ATOM 1798 CB LEU A 121 0.370 -9.440 -6.627 1.00 0.86 C ATOM 1799 CG LEU A 121 -0.057 -10.202 -7.895 1.00 1.02 C ATOM 1800 CD1 LEU A 121 -1.564 -10.090 -8.102 1.00 1.52 C ATOM 1801 CD2 LEU A 121 0.675 -9.650 -9.119 1.00 1.68 C ATOM 0 H LEU A 121 2.246 -10.984 -7.282 1.00 0.87 H new ATOM 0 HA LEU A 121 1.631 -9.577 -4.919 1.00 0.80 H new ATOM 0 HB2 LEU A 121 -0.523 -9.068 -6.124 1.00 0.86 H new ATOM 0 HB3 LEU A 121 0.957 -8.570 -6.921 1.00 0.86 H new ATOM 0 HG LEU A 121 0.205 -11.252 -7.768 1.00 1.02 H new ATOM 0 HD11 LEU A 121 -1.849 -10.634 -9.002 1.00 1.52 H new ATOM 0 HD12 LEU A 121 -2.082 -10.515 -7.242 1.00 1.52 H new ATOM 0 HD13 LEU A 121 -1.840 -9.041 -8.210 1.00 1.52 H new ATOM 0 HD21 LEU A 121 0.363 -10.199 -10.008 1.00 1.68 H new ATOM 0 HD22 LEU A 121 0.434 -8.594 -9.241 1.00 1.68 H new ATOM 0 HD23 LEU A 121 1.750 -9.763 -8.982 1.00 1.68 H new ATOM 1813 N THR A 122 0.199 -12.485 -5.353 1.00 0.79 N ATOM 1814 CA THR A 122 -0.487 -13.564 -4.679 1.00 0.78 C ATOM 1815 C THR A 122 0.060 -13.799 -3.275 1.00 0.76 C ATOM 1816 O THR A 122 -0.678 -14.238 -2.392 1.00 0.78 O ATOM 1817 CB THR A 122 -0.256 -14.780 -5.577 1.00 0.84 C ATOM 1818 OG1 THR A 122 -0.769 -14.493 -6.860 1.00 0.93 O ATOM 1819 CG2 THR A 122 -0.869 -16.070 -5.037 1.00 0.94 C ATOM 0 H THR A 122 0.632 -12.778 -6.229 1.00 0.79 H new ATOM 0 HA THR A 122 -1.545 -13.346 -4.536 1.00 0.78 H new ATOM 0 HB THR A 122 0.818 -14.960 -5.614 1.00 0.84 H new ATOM 0 HG1 THR A 122 -0.627 -15.263 -7.449 1.00 0.93 H new ATOM 0 HG21 THR A 122 -0.664 -16.888 -5.728 1.00 0.94 H new ATOM 0 HG22 THR A 122 -0.435 -16.300 -4.064 1.00 0.94 H new ATOM 0 HG23 THR A 122 -1.947 -15.945 -4.933 1.00 0.94 H new ATOM 1827 N GLN A 123 1.349 -13.539 -3.061 1.00 0.77 N ATOM 1828 CA GLN A 123 1.950 -13.731 -1.764 1.00 0.78 C ATOM 1829 C GLN A 123 1.715 -12.471 -0.937 1.00 0.71 C ATOM 1830 O GLN A 123 1.247 -12.570 0.195 1.00 0.68 O ATOM 1831 CB GLN A 123 3.423 -14.109 -1.950 1.00 0.94 C ATOM 1832 CG GLN A 123 4.171 -14.005 -0.624 1.00 2.22 C ATOM 1833 CD GLN A 123 5.523 -14.715 -0.660 1.00 2.02 C ATOM 1834 OE1 GLN A 123 5.605 -15.884 -1.023 1.00 2.13 O ATOM 1835 NE2 GLN A 123 6.604 -14.047 -0.279 1.00 2.98 N ATOM 0 H GLN A 123 1.989 -13.195 -3.777 1.00 0.77 H new ATOM 0 HA GLN A 123 1.498 -14.555 -1.211 1.00 0.78 H new ATOM 0 HB2 GLN A 123 3.498 -15.125 -2.338 1.00 0.94 H new ATOM 0 HB3 GLN A 123 3.883 -13.451 -2.687 1.00 0.94 H new ATOM 0 HG2 GLN A 123 4.322 -12.954 -0.377 1.00 2.22 H new ATOM 0 HG3 GLN A 123 3.559 -14.434 0.170 1.00 2.22 H new ATOM 0 HE21 GLN A 123 6.524 -13.075 0.021 1.00 2.98 H new ATOM 0 HE22 GLN A 123 7.515 -14.505 -0.286 1.00 2.98 H new ATOM 1844 N SER A 124 1.960 -11.284 -1.497 1.00 0.71 N ATOM 1845 CA SER A 124 1.787 -10.054 -0.735 1.00 0.69 C ATOM 1846 C SER A 124 0.331 -9.919 -0.278 1.00 0.65 C ATOM 1847 O SER A 124 0.060 -9.556 0.863 1.00 0.70 O ATOM 1848 CB SER A 124 2.291 -8.865 -1.566 1.00 0.76 C ATOM 1849 OG SER A 124 2.555 -7.744 -0.749 1.00 1.70 O ATOM 0 H SER A 124 2.273 -11.153 -2.459 1.00 0.71 H new ATOM 0 HA SER A 124 2.386 -10.076 0.176 1.00 0.69 H new ATOM 0 HB2 SER A 124 3.197 -9.150 -2.100 1.00 0.76 H new ATOM 0 HB3 SER A 124 1.547 -8.603 -2.318 1.00 0.76 H new ATOM 0 HG SER A 124 1.804 -7.603 -0.135 1.00 1.70 H new ATOM 1855 N LEU A 125 -0.600 -10.306 -1.150 1.00 0.62 N ATOM 1856 CA LEU A 125 -2.029 -10.440 -0.914 1.00 0.65 C ATOM 1857 C LEU A 125 -2.290 -11.383 0.231 1.00 0.64 C ATOM 1858 O LEU A 125 -3.056 -11.082 1.133 1.00 0.66 O ATOM 1859 CB LEU A 125 -2.677 -10.956 -2.212 1.00 0.78 C ATOM 1860 CG LEU A 125 -4.121 -11.480 -2.200 1.00 0.93 C ATOM 1861 CD1 LEU A 125 -4.229 -12.970 -1.849 1.00 0.87 C ATOM 1862 CD2 LEU A 125 -5.060 -10.666 -1.318 1.00 2.18 C ATOM 0 H LEU A 125 -0.352 -10.551 -2.109 1.00 0.62 H new ATOM 0 HA LEU A 125 -2.460 -9.476 -0.642 1.00 0.65 H new ATOM 0 HB2 LEU A 125 -2.634 -10.145 -2.939 1.00 0.78 H new ATOM 0 HB3 LEU A 125 -2.045 -11.759 -2.592 1.00 0.78 H new ATOM 0 HG LEU A 125 -4.448 -11.356 -3.232 1.00 0.93 H new ATOM 0 HD11 LEU A 125 -5.276 -13.271 -1.859 1.00 0.87 H new ATOM 0 HD12 LEU A 125 -3.675 -13.557 -2.581 1.00 0.87 H new ATOM 0 HD13 LEU A 125 -3.812 -13.141 -0.857 1.00 0.87 H new ATOM 0 HD21 LEU A 125 -6.061 -11.095 -1.359 1.00 2.18 H new ATOM 0 HD22 LEU A 125 -4.700 -10.684 -0.289 1.00 2.18 H new ATOM 0 HD23 LEU A 125 -5.092 -9.636 -1.673 1.00 2.18 H new ATOM 1874 N ASN A 126 -1.660 -12.542 0.204 1.00 0.65 N ATOM 1875 CA ASN A 126 -1.880 -13.538 1.232 1.00 0.68 C ATOM 1876 C ASN A 126 -1.536 -12.946 2.594 1.00 0.68 C ATOM 1877 O ASN A 126 -2.267 -13.135 3.563 1.00 0.75 O ATOM 1878 CB ASN A 126 -1.064 -14.791 0.908 1.00 0.69 C ATOM 1879 CG ASN A 126 -1.959 -15.986 0.606 1.00 1.08 C ATOM 1880 OD1 ASN A 126 -2.824 -16.368 1.391 1.00 1.11 O ATOM 1881 ND2 ASN A 126 -1.786 -16.585 -0.565 1.00 2.44 N ATOM 0 H ASN A 126 -0.993 -12.816 -0.518 1.00 0.65 H new ATOM 0 HA ASN A 126 -2.929 -13.834 1.264 1.00 0.68 H new ATOM 0 HB2 ASN A 126 -0.420 -14.594 0.051 1.00 0.69 H new ATOM 0 HB3 ASN A 126 -0.412 -15.028 1.749 1.00 0.69 H new ATOM 0 HD21 ASN A 126 -2.376 -17.375 -0.826 1.00 2.44 H new ATOM 0 HD22 ASN A 126 -1.063 -16.255 -1.205 1.00 2.44 H new ATOM 1888 N HIS A 127 -0.454 -12.175 2.664 1.00 0.64 N ATOM 1889 CA HIS A 127 -0.036 -11.556 3.914 1.00 0.63 C ATOM 1890 C HIS A 127 -0.956 -10.390 4.269 1.00 0.62 C ATOM 1891 O HIS A 127 -1.218 -10.151 5.442 1.00 0.65 O ATOM 1892 CB HIS A 127 1.424 -11.113 3.805 1.00 0.66 C ATOM 1893 CG HIS A 127 2.375 -12.272 3.655 1.00 0.75 C ATOM 1894 ND1 HIS A 127 2.606 -13.261 4.586 1.00 0.98 N ATOM 1895 CD2 HIS A 127 3.163 -12.533 2.567 1.00 0.73 C ATOM 1896 CE1 HIS A 127 3.516 -14.101 4.061 1.00 1.07 C ATOM 1897 NE2 HIS A 127 3.877 -13.704 2.830 1.00 0.90 N ATOM 0 H HIS A 127 0.148 -11.965 1.868 1.00 0.64 H new ATOM 0 HA HIS A 127 -0.111 -12.284 4.722 1.00 0.63 H new ATOM 0 HB2 HIS A 127 1.534 -10.446 2.950 1.00 0.66 H new ATOM 0 HB3 HIS A 127 1.693 -10.541 4.693 1.00 0.66 H new ATOM 0 HD2 HIS A 127 3.222 -11.940 1.666 1.00 0.73 H new ATOM 0 HE1 HIS A 127 3.904 -14.976 4.562 1.00 1.07 H new ATOM 0 HE2 HIS A 127 4.542 -14.166 2.210 1.00 0.90 H new ATOM 1905 N LEU A 128 -1.494 -9.698 3.266 1.00 0.62 N ATOM 1906 CA LEU A 128 -2.382 -8.554 3.443 1.00 0.64 C ATOM 1907 C LEU A 128 -3.676 -9.012 4.096 1.00 0.68 C ATOM 1908 O LEU A 128 -4.147 -8.407 5.051 1.00 0.71 O ATOM 1909 CB LEU A 128 -2.629 -7.907 2.068 1.00 0.67 C ATOM 1910 CG LEU A 128 -3.652 -6.763 2.024 1.00 0.79 C ATOM 1911 CD1 LEU A 128 -3.207 -5.558 2.839 1.00 1.63 C ATOM 1912 CD2 LEU A 128 -3.841 -6.347 0.563 1.00 1.07 C ATOM 0 H LEU A 128 -1.320 -9.923 2.287 1.00 0.62 H new ATOM 0 HA LEU A 128 -1.931 -7.809 4.098 1.00 0.64 H new ATOM 0 HB2 LEU A 128 -1.678 -7.529 1.693 1.00 0.67 H new ATOM 0 HB3 LEU A 128 -2.957 -8.685 1.379 1.00 0.67 H new ATOM 0 HG LEU A 128 -4.585 -7.119 2.460 1.00 0.79 H new ATOM 0 HD11 LEU A 128 -3.964 -4.776 2.776 1.00 1.63 H new ATOM 0 HD12 LEU A 128 -3.075 -5.852 3.880 1.00 1.63 H new ATOM 0 HD13 LEU A 128 -2.263 -5.181 2.446 1.00 1.63 H new ATOM 0 HD21 LEU A 128 -4.565 -5.534 0.507 1.00 1.07 H new ATOM 0 HD22 LEU A 128 -2.888 -6.013 0.154 1.00 1.07 H new ATOM 0 HD23 LEU A 128 -4.205 -7.197 -0.013 1.00 1.07 H new ATOM 1924 N LEU A 129 -4.224 -10.112 3.594 1.00 0.73 N ATOM 1925 CA LEU A 129 -5.367 -10.826 4.124 1.00 0.87 C ATOM 1926 C LEU A 129 -5.022 -11.379 5.489 1.00 0.86 C ATOM 1927 O LEU A 129 -5.876 -11.391 6.358 1.00 0.94 O ATOM 1928 CB LEU A 129 -5.739 -11.919 3.109 1.00 0.97 C ATOM 1929 CG LEU A 129 -6.750 -13.003 3.520 1.00 2.42 C ATOM 1930 CD1 LEU A 129 -6.116 -14.150 4.318 1.00 3.63 C ATOM 1931 CD2 LEU A 129 -7.991 -12.462 4.237 1.00 3.33 C ATOM 0 H LEU A 129 -3.854 -10.553 2.752 1.00 0.73 H new ATOM 0 HA LEU A 129 -6.231 -10.176 4.262 1.00 0.87 H new ATOM 0 HB2 LEU A 129 -6.130 -11.424 2.220 1.00 0.97 H new ATOM 0 HB3 LEU A 129 -4.818 -12.422 2.814 1.00 0.97 H new ATOM 0 HG LEU A 129 -7.093 -13.412 2.570 1.00 2.42 H new ATOM 0 HD11 LEU A 129 -6.883 -14.880 4.577 1.00 3.63 H new ATOM 0 HD12 LEU A 129 -5.346 -14.631 3.715 1.00 3.63 H new ATOM 0 HD13 LEU A 129 -5.669 -13.755 5.230 1.00 3.63 H new ATOM 0 HD21 LEU A 129 -8.653 -13.289 4.493 1.00 3.33 H new ATOM 0 HD22 LEU A 129 -7.689 -11.944 5.147 1.00 3.33 H new ATOM 0 HD23 LEU A 129 -8.516 -11.767 3.582 1.00 3.33 H new ATOM 1943 N THR A 130 -3.791 -11.821 5.735 1.00 0.81 N ATOM 1944 CA THR A 130 -3.498 -12.358 7.057 1.00 0.86 C ATOM 1945 C THR A 130 -3.584 -11.236 8.081 1.00 0.85 C ATOM 1946 O THR A 130 -4.172 -11.404 9.146 1.00 0.92 O ATOM 1947 CB THR A 130 -2.143 -13.076 7.077 1.00 0.88 C ATOM 1948 OG1 THR A 130 -2.192 -14.179 6.201 1.00 0.91 O ATOM 1949 CG2 THR A 130 -1.800 -13.626 8.462 1.00 0.93 C ATOM 0 H THR A 130 -3.016 -11.820 5.072 1.00 0.81 H new ATOM 0 HA THR A 130 -4.239 -13.113 7.319 1.00 0.86 H new ATOM 0 HB THR A 130 -1.390 -12.345 6.783 1.00 0.88 H new ATOM 0 HG1 THR A 130 -2.221 -13.860 5.275 1.00 0.91 H new ATOM 0 HG21 THR A 130 -0.832 -14.126 8.426 1.00 0.93 H new ATOM 0 HG22 THR A 130 -1.759 -12.806 9.179 1.00 0.93 H new ATOM 0 HG23 THR A 130 -2.565 -14.339 8.770 1.00 0.93 H new ATOM 1957 N ALA A 131 -3.028 -10.072 7.757 1.00 0.80 N ATOM 1958 CA ALA A 131 -3.062 -8.974 8.708 1.00 0.84 C ATOM 1959 C ALA A 131 -4.471 -8.412 8.835 1.00 0.86 C ATOM 1960 O ALA A 131 -4.902 -8.047 9.926 1.00 0.90 O ATOM 1961 CB ALA A 131 -2.067 -7.897 8.277 1.00 0.89 C ATOM 0 H ALA A 131 -2.563 -9.871 6.872 1.00 0.80 H new ATOM 0 HA ALA A 131 -2.772 -9.341 9.693 1.00 0.84 H new ATOM 0 HB1 ALA A 131 -2.092 -7.073 8.990 1.00 0.89 H new ATOM 0 HB2 ALA A 131 -1.063 -8.320 8.246 1.00 0.89 H new ATOM 0 HB3 ALA A 131 -2.336 -7.529 7.287 1.00 0.89 H new ATOM 1967 N LEU A 132 -5.193 -8.334 7.720 1.00 0.84 N ATOM 1968 CA LEU A 132 -6.513 -7.729 7.713 1.00 0.86 C ATOM 1969 C LEU A 132 -7.577 -8.730 8.115 1.00 0.84 C ATOM 1970 O LEU A 132 -8.696 -8.314 8.354 1.00 0.83 O ATOM 1971 CB LEU A 132 -6.844 -7.101 6.353 1.00 0.89 C ATOM 1972 CG LEU A 132 -6.109 -5.771 6.135 1.00 1.47 C ATOM 1973 CD1 LEU A 132 -6.292 -5.328 4.686 1.00 1.87 C ATOM 1974 CD2 LEU A 132 -6.665 -4.655 7.029 1.00 2.11 C ATOM 0 H LEU A 132 -4.883 -8.683 6.813 1.00 0.84 H new ATOM 0 HA LEU A 132 -6.502 -6.928 8.452 1.00 0.86 H new ATOM 0 HB2 LEU A 132 -6.576 -7.797 5.558 1.00 0.89 H new ATOM 0 HB3 LEU A 132 -7.919 -6.936 6.283 1.00 0.89 H new ATOM 0 HG LEU A 132 -5.060 -5.936 6.380 1.00 1.47 H new ATOM 0 HD11 LEU A 132 -5.772 -4.384 4.526 1.00 1.87 H new ATOM 0 HD12 LEU A 132 -5.881 -6.086 4.019 1.00 1.87 H new ATOM 0 HD13 LEU A 132 -7.354 -5.197 4.477 1.00 1.87 H new ATOM 0 HD21 LEU A 132 -6.116 -3.732 6.842 1.00 2.11 H new ATOM 0 HD22 LEU A 132 -7.721 -4.501 6.805 1.00 2.11 H new ATOM 0 HD23 LEU A 132 -6.554 -4.938 8.076 1.00 2.11 H new ATOM 1986 N ASP A 133 -7.273 -10.023 8.248 1.00 0.84 N ATOM 1987 CA ASP A 133 -8.256 -10.968 8.781 1.00 0.80 C ATOM 1988 C ASP A 133 -8.619 -10.567 10.207 1.00 0.74 C ATOM 1989 O ASP A 133 -9.777 -10.623 10.627 1.00 0.75 O ATOM 1990 CB ASP A 133 -7.740 -12.407 8.770 1.00 0.95 C ATOM 1991 CG ASP A 133 -8.847 -13.327 9.275 1.00 1.77 C ATOM 1992 OD1 ASP A 133 -8.552 -14.177 10.142 1.00 3.25 O ATOM 1993 OD2 ASP A 133 -9.984 -13.148 8.783 1.00 2.33 O ATOM 0 H ASP A 133 -6.373 -10.433 8.000 1.00 0.84 H new ATOM 0 HA ASP A 133 -9.135 -10.930 8.138 1.00 0.80 H new ATOM 0 HB2 ASP A 133 -7.441 -12.694 7.762 1.00 0.95 H new ATOM 0 HB3 ASP A 133 -6.856 -12.497 9.402 1.00 0.95 H new ATOM 1998 N THR A 134 -7.596 -10.087 10.917 1.00 0.83 N ATOM 1999 CA THR A 134 -7.660 -9.551 12.263 1.00 0.84 C ATOM 2000 C THR A 134 -8.640 -8.366 12.374 1.00 0.76 C ATOM 2001 O THR A 134 -8.956 -7.943 13.484 1.00 0.84 O ATOM 2002 CB THR A 134 -6.213 -9.286 12.736 1.00 0.99 C ATOM 2003 OG1 THR A 134 -5.958 -10.045 13.899 1.00 1.35 O ATOM 2004 CG2 THR A 134 -5.890 -7.829 13.028 1.00 1.35 C ATOM 0 H THR A 134 -6.649 -10.064 10.539 1.00 0.83 H new ATOM 0 HA THR A 134 -8.095 -10.271 12.957 1.00 0.84 H new ATOM 0 HB THR A 134 -5.575 -9.579 11.902 1.00 0.99 H new ATOM 0 HG1 THR A 134 -5.040 -9.881 14.202 1.00 1.35 H new ATOM 0 HG21 THR A 134 -4.853 -7.744 13.353 1.00 1.35 H new ATOM 0 HG22 THR A 134 -6.037 -7.236 12.125 1.00 1.35 H new ATOM 0 HG23 THR A 134 -6.548 -7.461 13.815 1.00 1.35 H new ATOM 2012 N THR A 135 -9.180 -7.846 11.264 1.00 0.69 N ATOM 2013 CA THR A 135 -10.229 -6.847 11.285 1.00 0.70 C ATOM 2014 C THR A 135 -11.394 -7.291 10.389 1.00 0.82 C ATOM 2015 O THR A 135 -11.253 -7.918 9.345 1.00 1.68 O ATOM 2016 CB THR A 135 -9.655 -5.471 10.909 1.00 0.96 C ATOM 2017 OG1 THR A 135 -9.147 -5.454 9.594 1.00 1.30 O ATOM 2018 CG2 THR A 135 -8.508 -5.077 11.844 1.00 1.33 C ATOM 0 H THR A 135 -8.891 -8.116 10.324 1.00 0.69 H new ATOM 0 HA THR A 135 -10.634 -6.747 12.292 1.00 0.70 H new ATOM 0 HB THR A 135 -10.483 -4.767 10.996 1.00 0.96 H new ATOM 0 HG1 THR A 135 -9.062 -6.373 9.264 1.00 1.30 H new ATOM 0 HG21 THR A 135 -8.122 -4.100 11.554 1.00 1.33 H new ATOM 0 HG22 THR A 135 -8.874 -5.033 12.870 1.00 1.33 H new ATOM 0 HG23 THR A 135 -7.711 -5.817 11.774 1.00 1.33 H new ATOM 2026 N ASP A 136 -12.613 -7.018 10.825 1.00 0.88 N ATOM 2027 CA ASP A 136 -13.840 -7.039 10.044 1.00 1.01 C ATOM 2028 C ASP A 136 -14.010 -5.692 9.344 1.00 1.26 C ATOM 2029 O ASP A 136 -15.025 -5.015 9.484 1.00 1.71 O ATOM 2030 CB ASP A 136 -15.033 -7.363 10.961 1.00 1.32 C ATOM 2031 CG ASP A 136 -15.293 -6.313 12.055 1.00 2.26 C ATOM 2032 OD1 ASP A 136 -14.309 -5.666 12.495 1.00 3.00 O ATOM 2033 OD2 ASP A 136 -16.461 -6.219 12.488 1.00 3.12 O ATOM 0 H ASP A 136 -12.783 -6.759 11.797 1.00 0.88 H new ATOM 0 HA ASP A 136 -13.791 -7.815 9.280 1.00 1.01 H new ATOM 0 HB2 ASP A 136 -15.930 -7.463 10.349 1.00 1.32 H new ATOM 0 HB3 ASP A 136 -14.860 -8.329 11.435 1.00 1.32 H new ATOM 2038 N ALA A 137 -13.001 -5.303 8.564 1.00 1.26 N ATOM 2039 CA ALA A 137 -13.084 -4.151 7.695 1.00 1.63 C ATOM 2040 C ALA A 137 -13.323 -4.675 6.276 1.00 1.47 C ATOM 2041 O ALA A 137 -14.232 -5.468 6.038 1.00 1.50 O ATOM 2042 CB ALA A 137 -11.803 -3.316 7.868 1.00 1.97 C ATOM 0 H ALA A 137 -12.104 -5.787 8.524 1.00 1.26 H new ATOM 0 HA ALA A 137 -13.909 -3.480 7.934 1.00 1.63 H new ATOM 0 HB1 ALA A 137 -11.848 -2.442 7.219 1.00 1.97 H new ATOM 0 HB2 ALA A 137 -11.716 -2.994 8.906 1.00 1.97 H new ATOM 0 HB3 ALA A 137 -10.936 -3.921 7.602 1.00 1.97 H new ATOM 2048 N ASP A 138 -12.472 -4.278 5.340 1.00 1.44 N ATOM 2049 CA ASP A 138 -12.508 -4.662 3.938 1.00 1.37 C ATOM 2050 C ASP A 138 -11.067 -4.581 3.437 1.00 1.39 C ATOM 2051 O ASP A 138 -10.207 -4.020 4.122 1.00 1.59 O ATOM 2052 CB ASP A 138 -13.435 -3.742 3.134 1.00 1.57 C ATOM 2053 CG ASP A 138 -13.755 -4.377 1.781 1.00 1.65 C ATOM 2054 OD1 ASP A 138 -14.736 -5.153 1.725 1.00 1.75 O ATOM 2055 OD2 ASP A 138 -12.979 -4.134 0.833 1.00 3.02 O ATOM 0 H ASP A 138 -11.699 -3.647 5.550 1.00 1.44 H new ATOM 0 HA ASP A 138 -12.907 -5.669 3.815 1.00 1.37 H new ATOM 0 HB2 ASP A 138 -14.356 -3.565 3.689 1.00 1.57 H new ATOM 0 HB3 ASP A 138 -12.960 -2.772 2.987 1.00 1.57 H new ATOM 2060 N VAL A 139 -10.786 -5.120 2.258 1.00 1.26 N ATOM 2061 CA VAL A 139 -9.517 -4.926 1.584 1.00 1.31 C ATOM 2062 C VAL A 139 -9.820 -4.537 0.140 1.00 1.24 C ATOM 2063 O VAL A 139 -10.146 -5.386 -0.695 1.00 1.49 O ATOM 2064 CB VAL A 139 -8.628 -6.166 1.781 1.00 1.28 C ATOM 2065 CG1 VAL A 139 -9.153 -7.455 1.160 1.00 1.37 C ATOM 2066 CG2 VAL A 139 -7.217 -5.935 1.249 1.00 1.69 C ATOM 0 H VAL A 139 -11.440 -5.708 1.742 1.00 1.26 H new ATOM 0 HA VAL A 139 -8.927 -4.111 2.004 1.00 1.31 H new ATOM 0 HB VAL A 139 -8.631 -6.303 2.862 1.00 1.28 H new ATOM 0 HG11 VAL A 139 -8.452 -8.266 1.357 1.00 1.37 H new ATOM 0 HG12 VAL A 139 -10.122 -7.700 1.595 1.00 1.37 H new ATOM 0 HG13 VAL A 139 -9.261 -7.323 0.083 1.00 1.37 H new ATOM 0 HG21 VAL A 139 -6.618 -6.832 1.405 1.00 1.69 H new ATOM 0 HG22 VAL A 139 -7.262 -5.710 0.183 1.00 1.69 H new ATOM 0 HG23 VAL A 139 -6.761 -5.098 1.778 1.00 1.69 H new ATOM 2076 N ALA A 140 -9.718 -3.242 -0.162 1.00 0.93 N ATOM 2077 CA ALA A 140 -10.081 -2.749 -1.480 1.00 0.78 C ATOM 2078 C ALA A 140 -8.797 -2.513 -2.271 1.00 0.80 C ATOM 2079 O ALA A 140 -8.108 -1.516 -2.087 1.00 1.07 O ATOM 2080 CB ALA A 140 -10.979 -1.511 -1.381 1.00 0.71 C ATOM 0 H ALA A 140 -9.390 -2.526 0.485 1.00 0.93 H new ATOM 0 HA ALA A 140 -10.678 -3.486 -2.016 1.00 0.78 H new ATOM 0 HB1 ALA A 140 -11.234 -1.165 -2.383 1.00 0.71 H new ATOM 0 HB2 ALA A 140 -11.892 -1.766 -0.842 1.00 0.71 H new ATOM 0 HB3 ALA A 140 -10.451 -0.720 -0.848 1.00 0.71 H new ATOM 2086 N ILE A 141 -8.432 -3.436 -3.150 1.00 0.81 N ATOM 2087 CA ILE A 141 -7.191 -3.323 -3.894 1.00 0.82 C ATOM 2088 C ILE A 141 -7.509 -2.486 -5.123 1.00 0.80 C ATOM 2089 O ILE A 141 -8.535 -2.676 -5.758 1.00 0.87 O ATOM 2090 CB ILE A 141 -6.693 -4.732 -4.244 1.00 0.89 C ATOM 2091 CG1 ILE A 141 -6.304 -5.478 -2.953 1.00 1.39 C ATOM 2092 CG2 ILE A 141 -5.499 -4.725 -5.209 1.00 1.33 C ATOM 2093 CD1 ILE A 141 -6.683 -6.955 -3.044 1.00 1.25 C ATOM 0 H ILE A 141 -8.979 -4.270 -3.363 1.00 0.81 H new ATOM 0 HA ILE A 141 -6.393 -2.842 -3.329 1.00 0.82 H new ATOM 0 HB ILE A 141 -7.512 -5.241 -4.752 1.00 0.89 H new ATOM 0 HG12 ILE A 141 -5.232 -5.383 -2.782 1.00 1.39 H new ATOM 0 HG13 ILE A 141 -6.805 -5.022 -2.099 1.00 1.39 H new ATOM 0 HG21 ILE A 141 -5.194 -5.750 -5.418 1.00 1.33 H new ATOM 0 HG22 ILE A 141 -5.786 -4.235 -6.140 1.00 1.33 H new ATOM 0 HG23 ILE A 141 -4.668 -4.184 -4.756 1.00 1.33 H new ATOM 0 HD11 ILE A 141 -6.399 -7.461 -2.121 1.00 1.25 H new ATOM 0 HD12 ILE A 141 -7.759 -7.046 -3.191 1.00 1.25 H new ATOM 0 HD13 ILE A 141 -6.162 -7.413 -3.885 1.00 1.25 H new ATOM 2105 N TYR A 142 -6.636 -1.545 -5.455 1.00 0.79 N ATOM 2106 CA TYR A 142 -6.789 -0.621 -6.565 1.00 0.86 C ATOM 2107 C TYR A 142 -5.578 -0.806 -7.460 1.00 0.81 C ATOM 2108 O TYR A 142 -4.449 -0.633 -7.001 1.00 0.95 O ATOM 2109 CB TYR A 142 -6.880 0.826 -6.058 1.00 1.08 C ATOM 2110 CG TYR A 142 -8.296 1.292 -5.780 1.00 1.48 C ATOM 2111 CD1 TYR A 142 -9.050 0.686 -4.759 1.00 2.41 C ATOM 2112 CD2 TYR A 142 -8.865 2.318 -6.559 1.00 2.65 C ATOM 2113 CE1 TYR A 142 -10.375 1.092 -4.525 1.00 3.89 C ATOM 2114 CE2 TYR A 142 -10.187 2.737 -6.324 1.00 4.13 C ATOM 2115 CZ TYR A 142 -10.948 2.122 -5.303 1.00 4.64 C ATOM 2116 OH TYR A 142 -12.235 2.501 -5.075 1.00 6.25 O ATOM 0 H TYR A 142 -5.769 -1.401 -4.937 1.00 0.79 H new ATOM 0 HA TYR A 142 -7.709 -0.821 -7.115 1.00 0.86 H new ATOM 0 HB2 TYR A 142 -6.292 0.918 -5.145 1.00 1.08 H new ATOM 0 HB3 TYR A 142 -6.428 1.488 -6.796 1.00 1.08 H new ATOM 0 HD1 TYR A 142 -8.610 -0.093 -4.154 1.00 2.41 H new ATOM 0 HD2 TYR A 142 -8.284 2.785 -7.340 1.00 2.65 H new ATOM 0 HE1 TYR A 142 -10.956 0.616 -3.749 1.00 3.89 H new ATOM 0 HE2 TYR A 142 -10.620 3.526 -6.921 1.00 4.13 H new ATOM 0 HH TYR A 142 -12.478 3.222 -5.693 1.00 6.25 H new ATOM 2126 N CYS A 143 -5.789 -1.165 -8.725 1.00 0.71 N ATOM 2127 CA CYS A 143 -4.685 -1.258 -9.664 1.00 0.74 C ATOM 2128 C CYS A 143 -5.181 -1.139 -11.097 1.00 0.76 C ATOM 2129 O CYS A 143 -6.171 -1.753 -11.495 1.00 0.77 O ATOM 2130 CB CYS A 143 -3.909 -2.561 -9.481 1.00 0.81 C ATOM 2131 SG CYS A 143 -5.039 -3.977 -9.348 1.00 3.37 S ATOM 0 H CYS A 143 -6.704 -1.393 -9.115 1.00 0.71 H new ATOM 0 HA CYS A 143 -4.009 -0.428 -9.459 1.00 0.74 H new ATOM 0 HB2 CYS A 143 -3.234 -2.708 -10.324 1.00 0.81 H new ATOM 0 HB3 CYS A 143 -3.292 -2.498 -8.585 1.00 0.81 H new ATOM 0 HG CYS A 143 -6.056 -3.796 -10.137 1.00 3.37 H new ATOM 2137 N ARG A 144 -4.482 -0.313 -11.866 1.00 0.92 N ATOM 2138 CA ARG A 144 -4.781 -0.010 -13.248 1.00 1.02 C ATOM 2139 C ARG A 144 -4.052 -0.984 -14.161 1.00 1.09 C ATOM 2140 O ARG A 144 -2.839 -0.893 -14.306 1.00 1.33 O ATOM 2141 CB ARG A 144 -4.345 1.439 -13.462 1.00 1.30 C ATOM 2142 CG ARG A 144 -5.316 2.264 -14.296 1.00 2.03 C ATOM 2143 CD ARG A 144 -4.971 3.700 -13.908 1.00 2.75 C ATOM 2144 NE ARG A 144 -5.280 4.684 -14.946 1.00 3.22 N ATOM 2145 CZ ARG A 144 -4.570 4.864 -16.062 1.00 3.32 C ATOM 2146 NH1 ARG A 144 -4.864 5.870 -16.885 1.00 4.05 N ATOM 2147 NH2 ARG A 144 -3.564 4.037 -16.354 1.00 3.35 N ATOM 0 H ARG A 144 -3.658 0.181 -11.523 1.00 0.92 H new ATOM 0 HA ARG A 144 -5.840 -0.117 -13.483 1.00 1.02 H new ATOM 0 HB2 ARG A 144 -4.221 1.917 -12.490 1.00 1.30 H new ATOM 0 HB3 ARG A 144 -3.369 1.446 -13.948 1.00 1.30 H new ATOM 0 HG2 ARG A 144 -5.179 2.091 -15.363 1.00 2.03 H new ATOM 0 HG3 ARG A 144 -6.353 2.022 -14.064 1.00 2.03 H new ATOM 0 HD2 ARG A 144 -5.514 3.961 -13.000 1.00 2.75 H new ATOM 0 HD3 ARG A 144 -3.909 3.757 -13.671 1.00 2.75 H new ATOM 0 HE ARG A 144 -6.099 5.276 -14.806 1.00 3.22 H new ATOM 0 HH11 ARG A 144 -5.632 6.503 -16.662 1.00 4.05 H new ATOM 0 HH12 ARG A 144 -4.321 6.007 -17.738 1.00 4.05 H new ATOM 0 HH21 ARG A 144 -3.338 3.267 -15.724 1.00 3.35 H new ATOM 0 HH22 ARG A 144 -3.022 4.175 -17.207 1.00 3.35 H new ATOM 2161 N ASP A 145 -4.791 -1.908 -14.769 1.00 1.04 N ATOM 2162 CA ASP A 145 -4.242 -2.915 -15.675 1.00 1.13 C ATOM 2163 C ASP A 145 -5.403 -3.660 -16.328 1.00 1.21 C ATOM 2164 O ASP A 145 -5.436 -3.835 -17.543 1.00 1.65 O ATOM 2165 CB ASP A 145 -3.354 -3.895 -14.894 1.00 1.10 C ATOM 2166 CG ASP A 145 -2.897 -5.066 -15.760 1.00 1.44 C ATOM 2167 OD1 ASP A 145 -3.779 -5.895 -16.072 1.00 2.47 O ATOM 2168 OD2 ASP A 145 -1.679 -5.197 -16.008 1.00 2.27 O ATOM 0 H ASP A 145 -5.801 -1.980 -14.645 1.00 1.04 H new ATOM 0 HA ASP A 145 -3.632 -2.437 -16.441 1.00 1.13 H new ATOM 0 HB2 ASP A 145 -2.482 -3.366 -14.509 1.00 1.10 H new ATOM 0 HB3 ASP A 145 -3.903 -4.274 -14.032 1.00 1.10 H new ATOM 2173 N LYS A 146 -6.355 -4.089 -15.486 1.00 0.98 N ATOM 2174 CA LYS A 146 -7.575 -4.837 -15.791 1.00 1.04 C ATOM 2175 C LYS A 146 -7.362 -6.322 -15.530 1.00 1.02 C ATOM 2176 O LYS A 146 -8.117 -6.912 -14.761 1.00 1.09 O ATOM 2177 CB LYS A 146 -8.090 -4.571 -17.212 1.00 1.08 C ATOM 2178 CG LYS A 146 -9.594 -4.853 -17.340 1.00 1.33 C ATOM 2179 CD LYS A 146 -10.409 -3.631 -16.896 1.00 2.17 C ATOM 2180 CE LYS A 146 -10.433 -2.543 -17.979 1.00 3.06 C ATOM 2181 NZ LYS A 146 -11.410 -2.839 -19.050 1.00 3.48 N ATOM 0 H LYS A 146 -6.280 -3.902 -14.486 1.00 0.98 H new ATOM 0 HA LYS A 146 -8.358 -4.480 -15.121 1.00 1.04 H new ATOM 0 HB2 LYS A 146 -7.891 -3.534 -17.482 1.00 1.08 H new ATOM 0 HB3 LYS A 146 -7.543 -5.195 -17.919 1.00 1.08 H new ATOM 0 HG2 LYS A 146 -9.836 -5.104 -18.373 1.00 1.33 H new ATOM 0 HG3 LYS A 146 -9.861 -5.717 -16.731 1.00 1.33 H new ATOM 0 HD2 LYS A 146 -11.429 -3.938 -16.665 1.00 2.17 H new ATOM 0 HD3 LYS A 146 -9.984 -3.223 -15.979 1.00 2.17 H new ATOM 0 HE2 LYS A 146 -10.677 -1.584 -17.522 1.00 3.06 H new ATOM 0 HE3 LYS A 146 -9.439 -2.445 -18.414 1.00 3.06 H new ATOM 0 HZ1 LYS A 146 -11.391 -2.077 -19.758 1.00 3.48 H new ATOM 0 HZ2 LYS A 146 -11.163 -3.741 -19.505 1.00 3.48 H new ATOM 0 HZ3 LYS A 146 -12.364 -2.907 -18.641 1.00 3.48 H new ATOM 2195 N LYS A 147 -6.316 -6.938 -16.085 1.00 1.01 N ATOM 2196 CA LYS A 147 -6.035 -8.343 -15.798 1.00 1.04 C ATOM 2197 C LYS A 147 -5.858 -8.563 -14.304 1.00 0.96 C ATOM 2198 O LYS A 147 -6.093 -9.667 -13.829 1.00 0.95 O ATOM 2199 CB LYS A 147 -4.774 -8.870 -16.506 1.00 1.09 C ATOM 2200 CG LYS A 147 -4.860 -9.007 -18.030 1.00 1.44 C ATOM 2201 CD LYS A 147 -5.020 -7.676 -18.772 1.00 3.01 C ATOM 2202 CE LYS A 147 -4.743 -7.865 -20.268 1.00 3.82 C ATOM 2203 NZ LYS A 147 -3.294 -7.959 -20.552 1.00 3.82 N ATOM 0 H LYS A 147 -5.659 -6.493 -16.726 1.00 1.01 H new ATOM 0 HA LYS A 147 -6.897 -8.893 -16.176 1.00 1.04 H new ATOM 0 HB2 LYS A 147 -3.944 -8.204 -16.268 1.00 1.09 H new ATOM 0 HB3 LYS A 147 -4.529 -9.846 -16.088 1.00 1.09 H new ATOM 0 HG2 LYS A 147 -3.960 -9.505 -18.390 1.00 1.44 H new ATOM 0 HG3 LYS A 147 -5.702 -9.652 -18.279 1.00 1.44 H new ATOM 0 HD2 LYS A 147 -6.029 -7.290 -18.628 1.00 3.01 H new ATOM 0 HD3 LYS A 147 -4.334 -6.937 -18.359 1.00 3.01 H new ATOM 0 HE2 LYS A 147 -5.241 -8.769 -20.618 1.00 3.82 H new ATOM 0 HE3 LYS A 147 -5.169 -7.030 -20.825 1.00 3.82 H new ATOM 0 HZ1 LYS A 147 -3.138 -7.916 -21.579 1.00 3.82 H new ATOM 0 HZ2 LYS A 147 -2.798 -7.168 -20.093 1.00 3.82 H new ATOM 0 HZ3 LYS A 147 -2.926 -8.859 -20.184 1.00 3.82 H new ATOM 2217 N TRP A 148 -5.437 -7.551 -13.551 1.00 0.91 N ATOM 2218 CA TRP A 148 -5.180 -7.746 -12.131 1.00 0.86 C ATOM 2219 C TRP A 148 -6.499 -7.863 -11.406 1.00 0.85 C ATOM 2220 O TRP A 148 -6.626 -8.671 -10.494 1.00 0.79 O ATOM 2221 CB TRP A 148 -4.368 -6.591 -11.541 1.00 0.90 C ATOM 2222 CG TRP A 148 -2.958 -6.442 -12.015 1.00 1.88 C ATOM 2223 CD1 TRP A 148 -2.527 -6.703 -13.264 1.00 2.97 C ATOM 2224 CD2 TRP A 148 -1.787 -5.949 -11.290 1.00 2.67 C ATOM 2225 NE1 TRP A 148 -1.215 -6.310 -13.402 1.00 4.38 N ATOM 2226 CE2 TRP A 148 -0.688 -5.887 -12.200 1.00 4.27 C ATOM 2227 CE3 TRP A 148 -1.545 -5.535 -9.963 1.00 2.37 C ATOM 2228 CZ2 TRP A 148 0.583 -5.439 -11.810 1.00 5.40 C ATOM 2229 CZ3 TRP A 148 -0.271 -5.094 -9.557 1.00 3.43 C ATOM 2230 CH2 TRP A 148 0.792 -5.047 -10.477 1.00 4.93 C ATOM 0 H TRP A 148 -5.270 -6.605 -13.893 1.00 0.91 H new ATOM 0 HA TRP A 148 -4.596 -8.658 -12.008 1.00 0.86 H new ATOM 0 HB2 TRP A 148 -4.897 -5.662 -11.753 1.00 0.90 H new ATOM 0 HB3 TRP A 148 -4.351 -6.708 -10.457 1.00 0.90 H new ATOM 0 HD1 TRP A 148 -3.123 -7.154 -14.043 1.00 2.97 H new ATOM 0 HE1 TRP A 148 -0.698 -6.329 -14.281 1.00 4.38 H new ATOM 0 HE3 TRP A 148 -2.352 -5.557 -9.245 1.00 2.37 H new ATOM 0 HZ2 TRP A 148 1.391 -5.396 -12.526 1.00 5.40 H new ATOM 0 HZ3 TRP A 148 -0.109 -4.790 -8.533 1.00 3.43 H new ATOM 0 HH2 TRP A 148 1.768 -4.710 -10.159 1.00 4.93 H new ATOM 2241 N GLU A 149 -7.496 -7.081 -11.812 1.00 0.96 N ATOM 2242 CA GLU A 149 -8.786 -7.214 -11.153 1.00 1.00 C ATOM 2243 C GLU A 149 -9.380 -8.570 -11.508 1.00 1.00 C ATOM 2244 O GLU A 149 -10.000 -9.212 -10.668 1.00 0.99 O ATOM 2245 CB GLU A 149 -9.728 -6.032 -11.415 1.00 1.21 C ATOM 2246 CG GLU A 149 -10.357 -5.957 -12.814 1.00 1.70 C ATOM 2247 CD GLU A 149 -11.856 -5.661 -12.704 1.00 2.36 C ATOM 2248 OE1 GLU A 149 -12.641 -6.627 -12.588 1.00 3.65 O ATOM 2249 OE2 GLU A 149 -12.212 -4.462 -12.708 1.00 2.53 O ATOM 0 H GLU A 149 -7.442 -6.384 -12.555 1.00 0.96 H new ATOM 0 HA GLU A 149 -8.638 -7.178 -10.074 1.00 1.00 H new ATOM 0 HB2 GLU A 149 -10.532 -6.067 -10.680 1.00 1.21 H new ATOM 0 HB3 GLU A 149 -9.175 -5.109 -11.239 1.00 1.21 H new ATOM 0 HG2 GLU A 149 -9.867 -5.179 -13.400 1.00 1.70 H new ATOM 0 HG3 GLU A 149 -10.202 -6.898 -13.341 1.00 1.70 H new ATOM 2256 N MET A 150 -9.130 -9.034 -12.735 1.00 1.05 N ATOM 2257 CA MET A 150 -9.648 -10.296 -13.225 1.00 1.16 C ATOM 2258 C MET A 150 -9.090 -11.424 -12.367 1.00 1.05 C ATOM 2259 O MET A 150 -9.840 -12.203 -11.794 1.00 1.05 O ATOM 2260 CB MET A 150 -9.288 -10.476 -14.707 1.00 1.31 C ATOM 2261 CG MET A 150 -10.527 -10.878 -15.507 1.00 1.25 C ATOM 2262 SD MET A 150 -10.190 -11.188 -17.260 1.00 1.78 S ATOM 2263 CE MET A 150 -11.855 -11.656 -17.797 1.00 2.51 C ATOM 0 H MET A 150 -8.557 -8.534 -13.415 1.00 1.05 H new ATOM 0 HA MET A 150 -10.736 -10.311 -13.153 1.00 1.16 H new ATOM 0 HB2 MET A 150 -8.875 -9.548 -15.104 1.00 1.31 H new ATOM 0 HB3 MET A 150 -8.516 -11.238 -14.811 1.00 1.31 H new ATOM 0 HG2 MET A 150 -10.959 -11.775 -15.065 1.00 1.25 H new ATOM 0 HG3 MET A 150 -11.275 -10.089 -15.423 1.00 1.25 H new ATOM 0 HE1 MET A 150 -11.843 -11.885 -18.863 1.00 2.51 H new ATOM 0 HE2 MET A 150 -12.183 -12.534 -17.241 1.00 2.51 H new ATOM 0 HE3 MET A 150 -12.543 -10.831 -17.611 1.00 2.51 H new ATOM 2273 N THR A 151 -7.766 -11.500 -12.258 1.00 1.00 N ATOM 2274 CA THR A 151 -7.093 -12.572 -11.564 1.00 1.00 C ATOM 2275 C THR A 151 -7.426 -12.543 -10.087 1.00 0.86 C ATOM 2276 O THR A 151 -7.704 -13.584 -9.500 1.00 0.90 O ATOM 2277 CB THR A 151 -5.584 -12.447 -11.786 1.00 1.05 C ATOM 2278 OG1 THR A 151 -5.289 -12.348 -13.163 1.00 1.13 O ATOM 2279 CG2 THR A 151 -4.865 -13.682 -11.273 1.00 1.17 C ATOM 0 H THR A 151 -7.132 -10.807 -12.656 1.00 1.00 H new ATOM 0 HA THR A 151 -7.433 -13.529 -11.960 1.00 1.00 H new ATOM 0 HB THR A 151 -5.256 -11.555 -11.253 1.00 1.05 H new ATOM 0 HG1 THR A 151 -5.459 -11.433 -13.469 1.00 1.13 H new ATOM 0 HG21 THR A 151 -3.793 -13.575 -11.440 1.00 1.17 H new ATOM 0 HG22 THR A 151 -5.057 -13.798 -10.206 1.00 1.17 H new ATOM 0 HG23 THR A 151 -5.228 -14.562 -11.804 1.00 1.17 H new ATOM 2287 N LEU A 152 -7.423 -11.365 -9.470 1.00 0.75 N ATOM 2288 CA LEU A 152 -7.788 -11.292 -8.066 1.00 0.67 C ATOM 2289 C LEU A 152 -9.236 -11.723 -7.888 1.00 0.66 C ATOM 2290 O LEU A 152 -9.552 -12.346 -6.885 1.00 0.65 O ATOM 2291 CB LEU A 152 -7.589 -9.886 -7.495 1.00 0.69 C ATOM 2292 CG LEU A 152 -6.204 -9.609 -6.889 1.00 0.98 C ATOM 2293 CD1 LEU A 152 -6.021 -10.353 -5.563 1.00 2.68 C ATOM 2294 CD2 LEU A 152 -5.045 -9.966 -7.815 1.00 2.40 C ATOM 0 H LEU A 152 -7.180 -10.476 -9.906 1.00 0.75 H new ATOM 0 HA LEU A 152 -7.131 -11.966 -7.517 1.00 0.67 H new ATOM 0 HB2 LEU A 152 -7.771 -9.161 -8.289 1.00 0.69 H new ATOM 0 HB3 LEU A 152 -8.343 -9.714 -6.727 1.00 0.69 H new ATOM 0 HG LEU A 152 -6.178 -8.531 -6.727 1.00 0.98 H new ATOM 0 HD11 LEU A 152 -5.032 -10.138 -5.158 1.00 2.68 H new ATOM 0 HD12 LEU A 152 -6.782 -10.026 -4.854 1.00 2.68 H new ATOM 0 HD13 LEU A 152 -6.119 -11.426 -5.731 1.00 2.68 H new ATOM 0 HD21 LEU A 152 -4.101 -9.743 -7.319 1.00 2.40 H new ATOM 0 HD22 LEU A 152 -5.086 -11.028 -8.056 1.00 2.40 H new ATOM 0 HD23 LEU A 152 -5.119 -9.382 -8.733 1.00 2.40 H new ATOM 2306 N LYS A 153 -10.122 -11.417 -8.836 1.00 0.74 N ATOM 2307 CA LYS A 153 -11.510 -11.848 -8.728 1.00 0.84 C ATOM 2308 C LYS A 153 -11.596 -13.357 -8.918 1.00 0.93 C ATOM 2309 O LYS A 153 -12.449 -13.994 -8.316 1.00 0.98 O ATOM 2310 CB LYS A 153 -12.394 -11.099 -9.734 1.00 1.03 C ATOM 2311 CG LYS A 153 -12.734 -9.690 -9.222 1.00 1.33 C ATOM 2312 CD LYS A 153 -13.227 -8.807 -10.374 1.00 2.62 C ATOM 2313 CE LYS A 153 -13.705 -7.435 -9.886 1.00 3.65 C ATOM 2314 NZ LYS A 153 -15.074 -7.490 -9.328 1.00 4.31 N ATOM 0 H LYS A 153 -9.905 -10.880 -9.675 1.00 0.74 H new ATOM 0 HA LYS A 153 -11.883 -11.607 -7.732 1.00 0.84 H new ATOM 0 HB2 LYS A 153 -11.881 -11.028 -10.693 1.00 1.03 H new ATOM 0 HB3 LYS A 153 -13.313 -11.660 -9.905 1.00 1.03 H new ATOM 0 HG2 LYS A 153 -13.500 -9.752 -8.449 1.00 1.33 H new ATOM 0 HG3 LYS A 153 -11.854 -9.241 -8.762 1.00 1.33 H new ATOM 0 HD2 LYS A 153 -12.423 -8.674 -11.098 1.00 2.62 H new ATOM 0 HD3 LYS A 153 -14.042 -9.311 -10.893 1.00 2.62 H new ATOM 0 HE2 LYS A 153 -13.019 -7.062 -9.126 1.00 3.65 H new ATOM 0 HE3 LYS A 153 -13.679 -6.727 -10.714 1.00 3.65 H new ATOM 0 HZ1 LYS A 153 -15.358 -6.541 -9.010 1.00 4.31 H new ATOM 0 HZ2 LYS A 153 -15.734 -7.822 -10.060 1.00 4.31 H new ATOM 0 HZ3 LYS A 153 -15.094 -8.146 -8.521 1.00 4.31 H new ATOM 2328 N GLU A 154 -10.712 -13.943 -9.724 1.00 0.99 N ATOM 2329 CA GLU A 154 -10.706 -15.375 -10.000 1.00 1.12 C ATOM 2330 C GLU A 154 -10.325 -16.101 -8.718 1.00 1.08 C ATOM 2331 O GLU A 154 -10.977 -17.043 -8.297 1.00 1.19 O ATOM 2332 CB GLU A 154 -9.714 -15.685 -11.135 1.00 1.21 C ATOM 2333 CG GLU A 154 -10.150 -16.871 -12.007 1.00 1.39 C ATOM 2334 CD GLU A 154 -10.084 -18.229 -11.292 1.00 2.16 C ATOM 2335 OE1 GLU A 154 -11.140 -18.893 -11.223 1.00 3.45 O ATOM 2336 OE2 GLU A 154 -8.976 -18.611 -10.851 1.00 2.83 O ATOM 0 H GLU A 154 -9.974 -13.431 -10.207 1.00 0.99 H new ATOM 0 HA GLU A 154 -11.691 -15.710 -10.325 1.00 1.12 H new ATOM 0 HB2 GLU A 154 -9.602 -14.801 -11.763 1.00 1.21 H new ATOM 0 HB3 GLU A 154 -8.735 -15.897 -10.706 1.00 1.21 H new ATOM 0 HG2 GLU A 154 -11.171 -16.701 -12.349 1.00 1.39 H new ATOM 0 HG3 GLU A 154 -9.518 -16.908 -12.894 1.00 1.39 H new ATOM 2343 N ALA A 155 -9.280 -15.619 -8.055 1.00 0.97 N ATOM 2344 CA ALA A 155 -8.764 -16.221 -6.842 1.00 1.00 C ATOM 2345 C ALA A 155 -9.710 -15.981 -5.677 1.00 0.91 C ATOM 2346 O ALA A 155 -9.901 -16.865 -4.851 1.00 1.01 O ATOM 2347 CB ALA A 155 -7.369 -15.663 -6.546 1.00 1.00 C ATOM 0 H ALA A 155 -8.765 -14.790 -8.352 1.00 0.97 H new ATOM 0 HA ALA A 155 -8.686 -17.299 -6.983 1.00 1.00 H new ATOM 0 HB1 ALA A 155 -6.982 -16.116 -5.634 1.00 1.00 H new ATOM 0 HB2 ALA A 155 -6.702 -15.892 -7.377 1.00 1.00 H new ATOM 0 HB3 ALA A 155 -7.429 -14.582 -6.417 1.00 1.00 H new ATOM 2353 N VAL A 156 -10.322 -14.800 -5.606 1.00 0.79 N ATOM 2354 CA VAL A 156 -11.338 -14.510 -4.611 1.00 0.76 C ATOM 2355 C VAL A 156 -12.568 -15.374 -4.895 1.00 0.89 C ATOM 2356 O VAL A 156 -13.290 -15.727 -3.969 1.00 0.99 O ATOM 2357 CB VAL A 156 -11.629 -12.997 -4.611 1.00 0.66 C ATOM 2358 CG1 VAL A 156 -12.901 -12.635 -3.853 1.00 0.71 C ATOM 2359 CG2 VAL A 156 -10.473 -12.236 -3.946 1.00 0.66 C ATOM 0 H VAL A 156 -10.124 -14.023 -6.237 1.00 0.79 H new ATOM 0 HA VAL A 156 -11.000 -14.761 -3.606 1.00 0.76 H new ATOM 0 HB VAL A 156 -11.750 -12.717 -5.657 1.00 0.66 H new ATOM 0 HG11 VAL A 156 -13.051 -11.556 -3.889 1.00 0.71 H new ATOM 0 HG12 VAL A 156 -13.753 -13.136 -4.312 1.00 0.71 H new ATOM 0 HG13 VAL A 156 -12.809 -12.954 -2.815 1.00 0.71 H new ATOM 0 HG21 VAL A 156 -10.690 -11.168 -3.952 1.00 0.66 H new ATOM 0 HG22 VAL A 156 -10.357 -12.577 -2.917 1.00 0.66 H new ATOM 0 HG23 VAL A 156 -9.551 -12.422 -4.496 1.00 0.66 H new ATOM 2369 N ALA A 157 -12.807 -15.757 -6.152 1.00 0.97 N ATOM 2370 CA ALA A 157 -13.962 -16.588 -6.465 1.00 1.14 C ATOM 2371 C ALA A 157 -13.683 -18.011 -5.994 1.00 1.25 C ATOM 2372 O ALA A 157 -14.488 -18.616 -5.294 1.00 1.33 O ATOM 2373 CB ALA A 157 -14.282 -16.543 -7.963 1.00 1.27 C ATOM 0 H ALA A 157 -12.226 -15.509 -6.953 1.00 0.97 H new ATOM 0 HA ALA A 157 -14.841 -16.206 -5.945 1.00 1.14 H new ATOM 0 HB1 ALA A 157 -15.148 -17.172 -8.169 1.00 1.27 H new ATOM 0 HB2 ALA A 157 -14.500 -15.517 -8.258 1.00 1.27 H new ATOM 0 HB3 ALA A 157 -13.425 -16.909 -8.529 1.00 1.27 H new ATOM 2379 N ARG A 158 -12.520 -18.547 -6.364 1.00 1.31 N ATOM 2380 CA ARG A 158 -12.117 -19.897 -6.014 1.00 1.50 C ATOM 2381 C ARG A 158 -11.805 -20.035 -4.526 1.00 1.49 C ATOM 2382 O ARG A 158 -11.771 -21.152 -4.021 1.00 1.69 O ATOM 2383 CB ARG A 158 -10.921 -20.331 -6.867 1.00 1.61 C ATOM 2384 CG ARG A 158 -11.329 -20.491 -8.339 1.00 2.65 C ATOM 2385 CD ARG A 158 -10.226 -21.191 -9.135 1.00 2.62 C ATOM 2386 NE ARG A 158 -10.018 -22.559 -8.627 1.00 2.32 N ATOM 2387 CZ ARG A 158 -8.907 -23.287 -8.770 1.00 2.74 C ATOM 2388 NH1 ARG A 158 -8.803 -24.467 -8.153 1.00 3.27 N ATOM 2389 NH2 ARG A 158 -7.905 -22.832 -9.522 1.00 3.50 N ATOM 0 H ARG A 158 -11.828 -18.046 -6.921 1.00 1.31 H new ATOM 0 HA ARG A 158 -12.958 -20.558 -6.224 1.00 1.50 H new ATOM 0 HB2 ARG A 158 -10.123 -19.593 -6.784 1.00 1.61 H new ATOM 0 HB3 ARG A 158 -10.523 -21.274 -6.491 1.00 1.61 H new ATOM 0 HG2 ARG A 158 -12.252 -21.067 -8.405 1.00 2.65 H new ATOM 0 HG3 ARG A 158 -11.532 -19.512 -8.773 1.00 2.65 H new ATOM 0 HD2 ARG A 158 -10.496 -21.225 -10.191 1.00 2.62 H new ATOM 0 HD3 ARG A 158 -9.298 -20.623 -9.061 1.00 2.62 H new ATOM 0 HE ARG A 158 -10.792 -22.989 -8.121 1.00 2.32 H new ATOM 0 HH11 ARG A 158 -9.570 -24.810 -7.575 1.00 3.27 H new ATOM 0 HH12 ARG A 158 -7.956 -25.026 -8.260 1.00 3.27 H new ATOM 0 HH21 ARG A 158 -7.987 -21.928 -9.988 1.00 3.50 H new ATOM 0 HH22 ARG A 158 -7.057 -23.387 -9.631 1.00 3.50 H new ATOM 2403 N ARG A 159 -11.556 -18.926 -3.825 1.00 1.30 N ATOM 2404 CA ARG A 159 -11.450 -18.935 -2.369 1.00 1.33 C ATOM 2405 C ARG A 159 -12.767 -19.348 -1.718 1.00 1.48 C ATOM 2406 O ARG A 159 -12.711 -19.940 -0.643 1.00 1.89 O ATOM 2407 CB ARG A 159 -11.028 -17.552 -1.854 1.00 1.31 C ATOM 2408 CG ARG A 159 -9.505 -17.372 -1.859 1.00 1.83 C ATOM 2409 CD ARG A 159 -8.937 -17.620 -0.456 1.00 2.12 C ATOM 2410 NE ARG A 159 -7.473 -17.472 -0.432 1.00 2.72 N ATOM 2411 CZ ARG A 159 -6.718 -17.349 0.670 1.00 3.18 C ATOM 2412 NH1 ARG A 159 -5.401 -17.167 0.551 1.00 4.11 N ATOM 2413 NH2 ARG A 159 -7.281 -17.405 1.878 1.00 3.29 N ATOM 0 H ARG A 159 -11.424 -18.007 -4.248 1.00 1.30 H new ATOM 0 HA ARG A 159 -10.690 -19.668 -2.098 1.00 1.33 H new ATOM 0 HB2 ARG A 159 -11.485 -16.780 -2.473 1.00 1.31 H new ATOM 0 HB3 ARG A 159 -11.405 -17.413 -0.841 1.00 1.31 H new ATOM 0 HG2 ARG A 159 -9.052 -18.063 -2.570 1.00 1.83 H new ATOM 0 HG3 ARG A 159 -9.252 -16.364 -2.189 1.00 1.83 H new ATOM 0 HD2 ARG A 159 -9.386 -16.920 0.248 1.00 2.12 H new ATOM 0 HD3 ARG A 159 -9.208 -18.623 -0.125 1.00 2.12 H new ATOM 0 HE ARG A 159 -6.991 -17.462 -1.331 1.00 2.72 H new ATOM 0 HH11 ARG A 159 -4.974 -17.122 -0.374 1.00 4.11 H new ATOM 0 HH12 ARG A 159 -4.822 -17.073 1.385 1.00 4.11 H new ATOM 0 HH21 ARG A 159 -8.288 -17.542 1.965 1.00 3.29 H new ATOM 0 HH22 ARG A 159 -6.704 -17.311 2.714 1.00 3.29 H new ATOM 2427 N GLU A 160 -13.899 -19.028 -2.358 1.00 1.35 N ATOM 2428 CA GLU A 160 -15.237 -19.055 -1.771 1.00 1.46 C ATOM 2429 C GLU A 160 -15.242 -18.461 -0.357 1.00 2.17 C ATOM 2430 O GLU A 160 -16.082 -18.892 0.463 1.00 2.70 O ATOM 2431 CB GLU A 160 -15.905 -20.439 -1.936 1.00 2.37 C ATOM 2432 CG GLU A 160 -15.184 -21.632 -1.287 1.00 4.00 C ATOM 2433 CD GLU A 160 -15.958 -22.944 -1.480 1.00 5.57 C ATOM 2434 OE1 GLU A 160 -16.177 -23.323 -2.653 1.00 6.18 O ATOM 2435 OE2 GLU A 160 -16.307 -23.577 -0.457 1.00 6.64 O ATOM 0 H GLU A 160 -13.904 -18.733 -3.334 1.00 1.35 H new ATOM 0 HA GLU A 160 -15.891 -18.389 -2.334 1.00 1.46 H new ATOM 0 HB2 GLU A 160 -16.912 -20.383 -1.522 1.00 2.37 H new ATOM 0 HB3 GLU A 160 -16.009 -20.642 -3.002 1.00 2.37 H new ATOM 0 HG2 GLU A 160 -14.188 -21.732 -1.718 1.00 4.00 H new ATOM 0 HG3 GLU A 160 -15.053 -21.441 -0.222 1.00 4.00 H new