USER MOD reduce.3.24.130724 H: found=0, std=0, add=1163, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1161 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 103 GLN : amide:sc= 0.499 K(o=-1.7,f=-5.6) USER MOD Set 1.2: A 105 ASN : amide:sc= -2.23! C(o=-1.7!,f=-5.2!) USER MOD Set 2.1: A 94 ASN : amide:sc= -0.637 K(o=-0.61,f=-1.4) USER MOD Set 2.2: A 111 GLN : amide:sc= 0.0311 K(o=-0.61,f=-1.6) USER MOD Set 3.1: A 5 HIS : no HD1:sc= -0.436 X(o=-0.44,f=-0.042) USER MOD Set 3.2: A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 0 ASN : amide:sc= -0.0524 K(o=-0.052,f=-0.93) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 CYS SG : rot 76:sc= -0.212 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 138:sc= -1.36 USER MOD Single : A -2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -4 GLY N :NH3+ 150:sc= 1.29 (180deg=1.21) USER MOD Single : A 12 TYR OH : rot 30:sc= -2.25 USER MOD Single : A 19 GLN : amide:sc= -0.0225 K(o=-0.022,f=-1.1) USER MOD Single : A 20 TYR OH : rot 180:sc= -0.0495 USER MOD Single : A 21 HIS : no HD1:sc= -6.34! C(o=-6.3!,f=-10!) USER MOD Single : A 22 ASN : amide:sc= -0.0539 X(o=-0.054,f=-0.44) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -2.03 K(o=-2,f=-3.1) USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot -20:sc= 1.12 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -164:sc= -0.053 (180deg=-0.312) USER MOD Single : A 59 GLN : amide:sc= -0.828 X(o=-0.83,f=-0.59) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 148:sc= -1.45! USER MOD Single : A 68 ASN : amide:sc= -1.68 X(o=-1.7,f=-1.2!) USER MOD Single : A 71 SER OG : rot -130:sc= 0.536 USER MOD Single : A 83 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-8.4!) USER MOD Single : A 87 THR OG1 : rot -34:sc= -2.18 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot -170:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.379) USER MOD Single : A 96 TYR OH : rot 31:sc= -3.95! USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 TYR OH : rot -151:sc= -0.863! USER MOD Single : A 119 GLN : amide:sc= -0.791 K(o=-0.79,f=-6.3!) USER MOD Single : A 121 HIS : no HD1:sc= -1.3 X(o=-1.3,f=-1.7!) USER MOD Single : A 127 SER OG : rot -150:sc= -0.0565 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 165:sc= -0.0193 (180deg=-0.25) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 14.964 -13.352 -14.189 1.00 11.02 N ATOM 2 CA GLY A -4 14.467 -14.092 -15.381 1.00 10.52 C ATOM 3 C GLY A -4 15.576 -14.443 -16.353 1.00 10.30 C ATOM 4 O GLY A -4 16.140 -13.565 -17.005 1.00 10.51 O ATOM 0 H1 GLY A -4 14.218 -12.717 -13.839 1.00 11.02 H new ATOM 0 H2 GLY A -4 15.222 -14.029 -13.443 1.00 11.02 H new ATOM 0 H3 GLY A -4 15.800 -12.792 -14.452 1.00 11.02 H new ATOM 0 HA2 GLY A -4 13.971 -15.006 -15.056 1.00 10.52 H new ATOM 0 HA3 GLY A -4 13.718 -13.488 -15.893 1.00 10.52 H new ATOM 10 N ALA A -3 15.890 -15.731 -16.448 1.00 10.11 N ATOM 11 CA ALA A -3 16.937 -16.197 -17.349 1.00 10.15 C ATOM 12 C ALA A -3 18.269 -15.517 -17.048 1.00 9.98 C ATOM 13 O ALA A -3 18.715 -14.649 -17.797 1.00 10.45 O ATOM 14 CB ALA A -3 16.534 -15.953 -18.797 1.00 10.85 C ATOM 0 H ALA A -3 15.434 -16.470 -15.912 1.00 10.11 H new ATOM 0 HA ALA A -3 17.064 -17.268 -17.192 1.00 10.15 H new ATOM 0 HB1 ALA A -3 17.325 -16.306 -19.459 1.00 10.85 H new ATOM 0 HB2 ALA A -3 15.612 -16.492 -19.014 1.00 10.85 H new ATOM 0 HB3 ALA A -3 16.376 -14.886 -18.956 1.00 10.85 H new ATOM 20 N MET A -2 18.900 -15.917 -15.948 1.00 9.54 N ATOM 21 CA MET A -2 20.182 -15.344 -15.553 1.00 9.62 C ATOM 22 C MET A -2 20.998 -16.345 -14.741 1.00 9.46 C ATOM 23 O MET A -2 20.870 -16.417 -13.518 1.00 9.56 O ATOM 24 CB MET A -2 19.965 -14.066 -14.742 1.00 9.74 C ATOM 25 CG MET A -2 19.245 -12.969 -15.514 1.00 10.00 C ATOM 26 SD MET A -2 18.895 -11.521 -14.498 1.00 10.44 S ATOM 27 CE MET A -2 18.006 -10.493 -15.665 1.00 10.72 C ATOM 0 H MET A -2 18.545 -16.634 -15.316 1.00 9.54 H new ATOM 0 HA MET A -2 20.738 -15.100 -16.459 1.00 9.62 H new ATOM 0 HB2 MET A -2 19.390 -14.306 -13.848 1.00 9.74 H new ATOM 0 HB3 MET A -2 20.932 -13.689 -14.408 1.00 9.74 H new ATOM 0 HG2 MET A -2 19.854 -12.671 -16.367 1.00 10.00 H new ATOM 0 HG3 MET A -2 18.310 -13.364 -15.912 1.00 10.00 H new ATOM 0 HE1 MET A -2 17.721 -9.558 -15.183 1.00 10.72 H new ATOM 0 HE2 MET A -2 18.645 -10.279 -16.522 1.00 10.72 H new ATOM 0 HE3 MET A -2 17.110 -11.015 -16.001 1.00 10.72 H new ATOM 37 N ALA A -1 21.837 -17.115 -15.428 1.00 9.48 N ATOM 38 CA ALA A -1 22.674 -18.112 -14.770 1.00 9.64 C ATOM 39 C ALA A -1 23.754 -17.447 -13.925 1.00 9.49 C ATOM 40 O ALA A -1 24.945 -17.573 -14.211 1.00 10.19 O ATOM 41 CB ALA A -1 23.304 -19.036 -15.801 1.00 10.62 C ATOM 0 H ALA A -1 21.955 -17.067 -16.440 1.00 9.48 H new ATOM 0 HA ALA A -1 22.041 -18.703 -14.108 1.00 9.64 H new ATOM 0 HB1 ALA A -1 23.926 -19.775 -15.296 1.00 10.62 H new ATOM 0 HB2 ALA A -1 22.520 -19.544 -16.362 1.00 10.62 H new ATOM 0 HB3 ALA A -1 23.919 -18.452 -16.486 1.00 10.62 H new ATOM 47 N ASN A 0 23.332 -16.737 -12.883 1.00 8.80 N ATOM 48 CA ASN A 0 24.267 -16.051 -11.998 1.00 8.90 C ATOM 49 C ASN A 0 23.529 -15.315 -10.884 1.00 8.17 C ATOM 50 O ASN A 0 23.522 -14.084 -10.837 1.00 8.36 O ATOM 51 CB ASN A 0 25.121 -15.064 -12.797 1.00 9.21 C ATOM 52 CG ASN A 0 24.283 -14.185 -13.708 1.00 9.30 C ATOM 53 OD1 ASN A 0 24.087 -14.500 -14.883 1.00 9.55 O ATOM 54 ND2 ASN A 0 23.777 -13.079 -13.171 1.00 9.37 N ATOM 0 H ASN A 0 22.350 -16.622 -12.631 1.00 8.80 H new ATOM 0 HA ASN A 0 24.914 -16.801 -11.543 1.00 8.90 H new ATOM 0 HB2 ASN A 0 25.686 -14.436 -12.109 1.00 9.21 H new ATOM 0 HB3 ASN A 0 25.847 -15.616 -13.395 1.00 9.21 H new ATOM 0 HD21 ASN A 0 23.202 -12.454 -13.736 1.00 9.37 H new ATOM 0 HD22 ASN A 0 23.964 -12.855 -12.194 1.00 9.37 H new ATOM 61 N SER A 1 22.907 -16.074 -9.987 1.00 7.57 N ATOM 62 CA SER A 1 22.169 -15.490 -8.873 1.00 7.04 C ATOM 63 C SER A 1 21.019 -14.624 -9.379 1.00 6.32 C ATOM 64 O SER A 1 21.139 -13.401 -9.461 1.00 6.00 O ATOM 65 CB SER A 1 23.105 -14.655 -7.996 1.00 7.04 C ATOM 66 OG SER A 1 24.127 -15.459 -7.431 1.00 7.69 O ATOM 0 H SER A 1 22.899 -17.094 -10.010 1.00 7.57 H new ATOM 0 HA SER A 1 21.754 -16.303 -8.277 1.00 7.04 H new ATOM 0 HB2 SER A 1 23.552 -13.858 -8.591 1.00 7.04 H new ATOM 0 HB3 SER A 1 22.533 -14.177 -7.201 1.00 7.04 H new ATOM 0 HG SER A 1 24.713 -14.902 -6.877 1.00 7.69 H new ATOM 72 N ASP A 2 19.906 -15.267 -9.719 1.00 6.42 N ATOM 73 CA ASP A 2 18.732 -14.557 -10.217 1.00 6.11 C ATOM 74 C ASP A 2 18.250 -13.512 -9.213 1.00 5.30 C ATOM 75 O ASP A 2 18.320 -12.311 -9.472 1.00 5.37 O ATOM 76 CB ASP A 2 17.604 -15.545 -10.524 1.00 6.52 C ATOM 77 CG ASP A 2 16.337 -14.851 -10.983 1.00 7.29 C ATOM 78 OD1 ASP A 2 15.532 -14.451 -10.116 1.00 7.71 O ATOM 79 OD2 ASP A 2 16.150 -14.707 -12.208 1.00 7.68 O ATOM 0 H ASP A 2 19.792 -16.279 -9.659 1.00 6.42 H new ATOM 0 HA ASP A 2 19.017 -14.042 -11.134 1.00 6.11 H new ATOM 0 HB2 ASP A 2 17.934 -16.241 -11.296 1.00 6.52 H new ATOM 0 HB3 ASP A 2 17.389 -16.135 -9.633 1.00 6.52 H new ATOM 84 N SER A 3 17.760 -13.977 -8.068 1.00 4.91 N ATOM 85 CA SER A 3 17.264 -13.082 -7.027 1.00 4.46 C ATOM 86 C SER A 3 18.420 -12.444 -6.260 1.00 3.40 C ATOM 87 O SER A 3 19.206 -13.139 -5.615 1.00 3.58 O ATOM 88 CB SER A 3 16.356 -13.845 -6.060 1.00 5.33 C ATOM 89 OG SER A 3 15.244 -14.402 -6.738 1.00 5.63 O ATOM 0 H SER A 3 17.696 -14.968 -7.837 1.00 4.91 H new ATOM 0 HA SER A 3 16.689 -12.290 -7.507 1.00 4.46 H new ATOM 0 HB2 SER A 3 16.923 -14.638 -5.572 1.00 5.33 H new ATOM 0 HB3 SER A 3 16.008 -13.173 -5.275 1.00 5.33 H new ATOM 0 HG SER A 3 14.680 -14.886 -6.099 1.00 5.63 H new ATOM 95 N CYS A 4 18.516 -11.118 -6.330 1.00 2.86 N ATOM 96 CA CYS A 4 19.577 -10.393 -5.641 1.00 2.40 C ATOM 97 C CYS A 4 19.033 -9.136 -4.968 1.00 1.90 C ATOM 98 O CYS A 4 19.701 -8.104 -4.930 1.00 2.51 O ATOM 99 CB CYS A 4 20.687 -10.016 -6.623 1.00 3.21 C ATOM 100 SG CYS A 4 21.472 -11.429 -7.430 1.00 3.99 S ATOM 0 H CYS A 4 17.873 -10.526 -6.856 1.00 2.86 H new ATOM 0 HA CYS A 4 19.986 -11.048 -4.871 1.00 2.40 H new ATOM 0 HB2 CYS A 4 20.273 -9.359 -7.388 1.00 3.21 H new ATOM 0 HB3 CYS A 4 21.449 -9.446 -6.092 1.00 3.21 H new ATOM 0 HG CYS A 4 20.685 -11.893 -8.354 1.00 3.99 H new ATOM 106 N HIS A 5 17.817 -9.231 -4.440 1.00 1.37 N ATOM 107 CA HIS A 5 17.187 -8.101 -3.768 1.00 1.06 C ATOM 108 C HIS A 5 15.874 -8.517 -3.118 1.00 0.81 C ATOM 109 O HIS A 5 14.901 -8.831 -3.803 1.00 0.79 O ATOM 110 CB HIS A 5 16.937 -6.960 -4.755 1.00 1.56 C ATOM 111 CG HIS A 5 16.244 -5.780 -4.145 1.00 1.02 C ATOM 112 ND1 HIS A 5 16.899 -4.618 -3.790 1.00 0.80 N ATOM 113 CD2 HIS A 5 14.941 -5.585 -3.831 1.00 0.83 C ATOM 114 CE1 HIS A 5 16.029 -3.761 -3.283 1.00 0.68 C ATOM 115 NE2 HIS A 5 14.834 -4.324 -3.298 1.00 0.64 N ATOM 0 H HIS A 5 17.249 -10.078 -4.465 1.00 1.37 H new ATOM 0 HA HIS A 5 17.867 -7.755 -2.989 1.00 1.06 H new ATOM 0 HB2 HIS A 5 17.891 -6.635 -5.171 1.00 1.56 H new ATOM 0 HB3 HIS A 5 16.338 -7.334 -5.585 1.00 1.56 H new ATOM 0 HD2 HIS A 5 14.136 -6.290 -3.973 1.00 0.83 H new ATOM 0 HE1 HIS A 5 16.256 -2.770 -2.919 1.00 0.68 H new ATOM 0 HE2 HIS A 5 13.971 -3.892 -2.967 1.00 0.64 H new ATOM 124 N LYS A 6 15.854 -8.519 -1.790 1.00 0.78 N ATOM 125 CA LYS A 6 14.661 -8.894 -1.047 1.00 0.64 C ATOM 126 C LYS A 6 13.537 -7.900 -1.298 1.00 0.60 C ATOM 127 O LYS A 6 13.722 -6.689 -1.174 1.00 0.96 O ATOM 128 CB LYS A 6 14.963 -8.974 0.451 1.00 0.77 C ATOM 129 CG LYS A 6 15.804 -10.179 0.851 1.00 1.44 C ATOM 130 CD LYS A 6 17.219 -10.099 0.296 1.00 1.86 C ATOM 131 CE LYS A 6 17.948 -8.862 0.797 1.00 2.27 C ATOM 132 NZ LYS A 6 19.344 -8.793 0.283 1.00 3.12 N ATOM 0 H LYS A 6 16.652 -8.265 -1.207 1.00 0.78 H new ATOM 0 HA LYS A 6 14.342 -9.877 -1.394 1.00 0.64 H new ATOM 0 HB2 LYS A 6 15.482 -8.065 0.755 1.00 0.77 H new ATOM 0 HB3 LYS A 6 14.022 -9.003 1.000 1.00 0.77 H new ATOM 0 HG2 LYS A 6 15.845 -10.247 1.938 1.00 1.44 H new ATOM 0 HG3 LYS A 6 15.325 -11.090 0.492 1.00 1.44 H new ATOM 0 HD2 LYS A 6 17.775 -10.991 0.585 1.00 1.86 H new ATOM 0 HD3 LYS A 6 17.183 -10.084 -0.793 1.00 1.86 H new ATOM 0 HE2 LYS A 6 17.403 -7.970 0.488 1.00 2.27 H new ATOM 0 HE3 LYS A 6 17.962 -8.866 1.887 1.00 2.27 H new ATOM 0 HZ1 LYS A 6 19.806 -7.936 0.648 1.00 3.12 H new ATOM 0 HZ2 LYS A 6 19.872 -9.632 0.598 1.00 3.12 H new ATOM 0 HZ3 LYS A 6 19.330 -8.763 -0.756 1.00 3.12 H new ATOM 146 N ILE A 7 12.371 -8.421 -1.654 1.00 0.35 N ATOM 147 CA ILE A 7 11.215 -7.587 -1.931 1.00 0.28 C ATOM 148 C ILE A 7 10.447 -7.262 -0.659 1.00 0.24 C ATOM 149 O ILE A 7 10.348 -8.084 0.252 1.00 0.31 O ATOM 150 CB ILE A 7 10.259 -8.265 -2.929 1.00 0.29 C ATOM 151 CG1 ILE A 7 10.998 -8.596 -4.223 1.00 0.36 C ATOM 152 CG2 ILE A 7 9.059 -7.375 -3.214 1.00 0.27 C ATOM 153 CD1 ILE A 7 10.096 -9.146 -5.305 1.00 0.43 C ATOM 0 H ILE A 7 12.203 -9.422 -1.757 1.00 0.35 H new ATOM 0 HA ILE A 7 11.595 -6.663 -2.368 1.00 0.28 H new ATOM 0 HB ILE A 7 9.896 -9.192 -2.486 1.00 0.29 H new ATOM 0 HG12 ILE A 7 11.490 -7.696 -4.593 1.00 0.36 H new ATOM 0 HG13 ILE A 7 11.782 -9.323 -4.010 1.00 0.36 H new ATOM 0 HG21 ILE A 7 8.396 -7.873 -3.922 1.00 0.27 H new ATOM 0 HG22 ILE A 7 8.520 -7.182 -2.286 1.00 0.27 H new ATOM 0 HG23 ILE A 7 9.399 -6.431 -3.639 1.00 0.27 H new ATOM 0 HD11 ILE A 7 10.686 -9.360 -6.197 1.00 0.43 H new ATOM 0 HD12 ILE A 7 9.624 -10.064 -4.954 1.00 0.43 H new ATOM 0 HD13 ILE A 7 9.327 -8.412 -5.546 1.00 0.43 H new ATOM 165 N ASP A 8 9.906 -6.056 -0.614 1.00 0.19 N ATOM 166 CA ASP A 8 9.131 -5.604 0.529 1.00 0.16 C ATOM 167 C ASP A 8 7.814 -5.003 0.060 1.00 0.14 C ATOM 168 O ASP A 8 7.784 -3.913 -0.512 1.00 0.14 O ATOM 169 CB ASP A 8 9.922 -4.576 1.334 1.00 0.19 C ATOM 170 CG ASP A 8 9.196 -4.146 2.594 1.00 1.13 C ATOM 171 OD1 ASP A 8 9.236 -4.899 3.588 1.00 1.06 O ATOM 172 OD2 ASP A 8 8.588 -3.055 2.585 1.00 2.04 O ATOM 0 H ASP A 8 9.990 -5.368 -1.362 1.00 0.19 H new ATOM 0 HA ASP A 8 8.921 -6.460 1.170 1.00 0.16 H new ATOM 0 HB2 ASP A 8 10.891 -4.996 1.602 1.00 0.19 H new ATOM 0 HB3 ASP A 8 10.114 -3.702 0.712 1.00 0.19 H new ATOM 177 N TYR A 9 6.728 -5.723 0.308 1.00 0.12 N ATOM 178 CA TYR A 9 5.403 -5.278 -0.096 1.00 0.12 C ATOM 179 C TYR A 9 5.152 -3.852 0.360 1.00 0.11 C ATOM 180 O TYR A 9 4.524 -3.065 -0.347 1.00 0.12 O ATOM 181 CB TYR A 9 4.339 -6.209 0.478 1.00 0.14 C ATOM 182 CG TYR A 9 4.664 -7.667 0.287 1.00 0.16 C ATOM 183 CD1 TYR A 9 5.145 -8.134 -0.929 1.00 0.15 C ATOM 184 CD2 TYR A 9 4.496 -8.573 1.321 1.00 0.24 C ATOM 185 CE1 TYR A 9 5.449 -9.468 -1.109 1.00 0.18 C ATOM 186 CE2 TYR A 9 4.798 -9.910 1.152 1.00 0.27 C ATOM 187 CZ TYR A 9 5.274 -10.353 -0.065 1.00 0.23 C ATOM 188 OH TYR A 9 5.576 -11.685 -0.237 1.00 0.27 O ATOM 0 H TYR A 9 6.740 -6.622 0.790 1.00 0.12 H new ATOM 0 HA TYR A 9 5.348 -5.305 -1.184 1.00 0.12 H new ATOM 0 HB2 TYR A 9 4.223 -6.005 1.542 1.00 0.14 H new ATOM 0 HB3 TYR A 9 3.381 -5.991 0.005 1.00 0.14 H new ATOM 0 HD1 TYR A 9 5.283 -7.442 -1.747 1.00 0.15 H new ATOM 0 HD2 TYR A 9 4.123 -8.229 2.274 1.00 0.24 H new ATOM 0 HE1 TYR A 9 5.821 -9.817 -2.061 1.00 0.18 H new ATOM 0 HE2 TYR A 9 4.662 -10.605 1.968 1.00 0.27 H new ATOM 0 HH TYR A 9 6.041 -12.020 0.558 1.00 0.27 H new ATOM 198 N GLY A 10 5.653 -3.515 1.539 1.00 0.10 N ATOM 199 CA GLY A 10 5.472 -2.177 2.044 1.00 0.11 C ATOM 200 C GLY A 10 6.169 -1.167 1.164 1.00 0.10 C ATOM 201 O GLY A 10 5.539 -0.271 0.609 1.00 0.12 O ATOM 0 H GLY A 10 6.178 -4.142 2.149 1.00 0.10 H new ATOM 0 HA2 GLY A 10 4.408 -1.945 2.097 1.00 0.11 H new ATOM 0 HA3 GLY A 10 5.864 -2.112 3.059 1.00 0.11 H new ATOM 205 N LEU A 11 7.470 -1.337 0.999 1.00 0.10 N ATOM 206 CA LEU A 11 8.244 -0.438 0.164 1.00 0.11 C ATOM 207 C LEU A 11 7.666 -0.418 -1.238 1.00 0.11 C ATOM 208 O LEU A 11 7.629 0.620 -1.898 1.00 0.16 O ATOM 209 CB LEU A 11 9.699 -0.881 0.119 1.00 0.13 C ATOM 210 CG LEU A 11 10.643 0.098 -0.569 1.00 0.16 C ATOM 211 CD1 LEU A 11 10.618 1.444 0.139 1.00 0.13 C ATOM 212 CD2 LEU A 11 12.050 -0.470 -0.600 1.00 0.23 C ATOM 0 H LEU A 11 8.010 -2.087 1.431 1.00 0.10 H new ATOM 0 HA LEU A 11 8.198 0.565 0.587 1.00 0.11 H new ATOM 0 HB2 LEU A 11 10.047 -1.043 1.139 1.00 0.13 H new ATOM 0 HB3 LEU A 11 9.756 -1.841 -0.394 1.00 0.13 H new ATOM 0 HG LEU A 11 10.309 0.249 -1.596 1.00 0.16 H new ATOM 0 HD11 LEU A 11 11.297 2.132 -0.364 1.00 0.13 H new ATOM 0 HD12 LEU A 11 9.606 1.849 0.114 1.00 0.13 H new ATOM 0 HD13 LEU A 11 10.932 1.316 1.175 1.00 0.13 H new ATOM 0 HD21 LEU A 11 12.717 0.237 -1.094 1.00 0.23 H new ATOM 0 HD22 LEU A 11 12.395 -0.643 0.419 1.00 0.23 H new ATOM 0 HD23 LEU A 11 12.050 -1.412 -1.148 1.00 0.23 H new ATOM 224 N TYR A 12 7.215 -1.583 -1.684 1.00 0.09 N ATOM 225 CA TYR A 12 6.622 -1.718 -3.002 1.00 0.09 C ATOM 226 C TYR A 12 5.333 -0.919 -3.069 1.00 0.09 C ATOM 227 O TYR A 12 5.149 -0.086 -3.955 1.00 0.12 O ATOM 228 CB TYR A 12 6.348 -3.186 -3.311 1.00 0.09 C ATOM 229 CG TYR A 12 5.773 -3.415 -4.687 1.00 0.10 C ATOM 230 CD1 TYR A 12 6.159 -2.621 -5.758 1.00 0.14 C ATOM 231 CD2 TYR A 12 4.848 -4.424 -4.915 1.00 0.10 C ATOM 232 CE1 TYR A 12 5.638 -2.825 -7.020 1.00 0.16 C ATOM 233 CE2 TYR A 12 4.322 -4.636 -6.174 1.00 0.12 C ATOM 234 CZ TYR A 12 4.711 -3.835 -7.219 1.00 0.15 C ATOM 235 OH TYR A 12 4.198 -4.042 -8.479 1.00 0.18 O ATOM 0 H TYR A 12 7.250 -2.450 -1.148 1.00 0.09 H new ATOM 0 HA TYR A 12 7.319 -1.332 -3.745 1.00 0.09 H new ATOM 0 HB2 TYR A 12 7.277 -3.748 -3.216 1.00 0.09 H new ATOM 0 HB3 TYR A 12 5.657 -3.583 -2.567 1.00 0.09 H new ATOM 0 HD1 TYR A 12 6.878 -1.831 -5.602 1.00 0.14 H new ATOM 0 HD2 TYR A 12 4.535 -5.053 -4.095 1.00 0.10 H new ATOM 0 HE1 TYR A 12 5.950 -2.202 -7.845 1.00 0.16 H new ATOM 0 HE2 TYR A 12 3.607 -5.429 -6.336 1.00 0.12 H new ATOM 0 HH TYR A 12 4.865 -3.785 -9.150 1.00 0.18 H new ATOM 245 N ALA A 13 4.441 -1.177 -2.119 1.00 0.10 N ATOM 246 CA ALA A 13 3.175 -0.470 -2.057 1.00 0.12 C ATOM 247 C ALA A 13 3.426 1.027 -2.035 1.00 0.12 C ATOM 248 O ALA A 13 2.663 1.809 -2.602 1.00 0.13 O ATOM 249 CB ALA A 13 2.383 -0.898 -0.834 1.00 0.13 C ATOM 0 H ALA A 13 4.575 -1.871 -1.383 1.00 0.10 H new ATOM 0 HA ALA A 13 2.588 -0.717 -2.941 1.00 0.12 H new ATOM 0 HB1 ALA A 13 1.437 -0.357 -0.805 1.00 0.13 H new ATOM 0 HB2 ALA A 13 2.187 -1.969 -0.884 1.00 0.13 H new ATOM 0 HB3 ALA A 13 2.956 -0.676 0.066 1.00 0.13 H new ATOM 255 N LEU A 14 4.509 1.417 -1.371 1.00 0.11 N ATOM 256 CA LEU A 14 4.884 2.816 -1.292 1.00 0.11 C ATOM 257 C LEU A 14 5.202 3.324 -2.687 1.00 0.12 C ATOM 258 O LEU A 14 4.699 4.361 -3.118 1.00 0.14 O ATOM 259 CB LEU A 14 6.104 2.995 -0.388 1.00 0.12 C ATOM 260 CG LEU A 14 6.122 4.276 0.452 1.00 0.10 C ATOM 261 CD1 LEU A 14 7.535 4.581 0.921 1.00 0.11 C ATOM 262 CD2 LEU A 14 5.555 5.453 -0.330 1.00 0.10 C ATOM 0 H LEU A 14 5.139 0.781 -0.882 1.00 0.11 H new ATOM 0 HA LEU A 14 4.055 3.384 -0.869 1.00 0.11 H new ATOM 0 HB2 LEU A 14 6.164 2.140 0.285 1.00 0.12 H new ATOM 0 HB3 LEU A 14 7.000 2.976 -1.009 1.00 0.12 H new ATOM 0 HG LEU A 14 5.489 4.117 1.325 1.00 0.10 H new ATOM 0 HD11 LEU A 14 7.532 5.494 1.517 1.00 0.11 H new ATOM 0 HD12 LEU A 14 7.904 3.754 1.527 1.00 0.11 H new ATOM 0 HD13 LEU A 14 8.185 4.715 0.056 1.00 0.11 H new ATOM 0 HD21 LEU A 14 5.580 6.348 0.291 1.00 0.10 H new ATOM 0 HD22 LEU A 14 6.153 5.616 -1.227 1.00 0.10 H new ATOM 0 HD23 LEU A 14 4.525 5.238 -0.615 1.00 0.10 H new ATOM 274 N GLU A 15 6.052 2.579 -3.384 1.00 0.11 N ATOM 275 CA GLU A 15 6.433 2.921 -4.745 1.00 0.13 C ATOM 276 C GLU A 15 5.192 3.058 -5.607 1.00 0.13 C ATOM 277 O GLU A 15 4.984 4.073 -6.264 1.00 0.15 O ATOM 278 CB GLU A 15 7.331 1.834 -5.330 1.00 0.14 C ATOM 279 CG GLU A 15 8.680 1.713 -4.650 1.00 0.16 C ATOM 280 CD GLU A 15 9.428 0.463 -5.077 1.00 0.26 C ATOM 281 OE1 GLU A 15 10.115 0.509 -6.119 1.00 0.34 O ATOM 282 OE2 GLU A 15 9.326 -0.560 -4.368 1.00 0.35 O ATOM 0 H GLU A 15 6.491 1.731 -3.025 1.00 0.11 H new ATOM 0 HA GLU A 15 6.975 3.866 -4.728 1.00 0.13 H new ATOM 0 HB2 GLU A 15 6.815 0.876 -5.262 1.00 0.14 H new ATOM 0 HB3 GLU A 15 7.487 2.038 -6.389 1.00 0.14 H new ATOM 0 HG2 GLU A 15 9.282 2.592 -4.882 1.00 0.16 H new ATOM 0 HG3 GLU A 15 8.540 1.699 -3.569 1.00 0.16 H new ATOM 289 N ILE A 16 4.360 2.025 -5.578 1.00 0.11 N ATOM 290 CA ILE A 16 3.130 2.007 -6.350 1.00 0.12 C ATOM 291 C ILE A 16 2.317 3.259 -6.077 1.00 0.11 C ATOM 292 O ILE A 16 1.902 3.963 -6.998 1.00 0.14 O ATOM 293 CB ILE A 16 2.286 0.773 -5.996 1.00 0.12 C ATOM 294 CG1 ILE A 16 3.077 -0.504 -6.269 1.00 0.13 C ATOM 295 CG2 ILE A 16 0.981 0.774 -6.775 1.00 0.13 C ATOM 296 CD1 ILE A 16 2.406 -1.747 -5.741 1.00 0.25 C ATOM 0 H ILE A 16 4.519 1.184 -5.023 1.00 0.11 H new ATOM 0 HA ILE A 16 3.397 1.969 -7.406 1.00 0.12 H new ATOM 0 HB ILE A 16 2.045 0.811 -4.934 1.00 0.12 H new ATOM 0 HG12 ILE A 16 3.225 -0.608 -7.344 1.00 0.13 H new ATOM 0 HG13 ILE A 16 4.065 -0.414 -5.818 1.00 0.13 H new ATOM 0 HG21 ILE A 16 0.398 -0.108 -6.510 1.00 0.13 H new ATOM 0 HG22 ILE A 16 0.412 1.671 -6.531 1.00 0.13 H new ATOM 0 HG23 ILE A 16 1.195 0.759 -7.844 1.00 0.13 H new ATOM 0 HD11 ILE A 16 3.021 -2.617 -5.969 1.00 0.25 H new ATOM 0 HD12 ILE A 16 2.282 -1.663 -4.661 1.00 0.25 H new ATOM 0 HD13 ILE A 16 1.429 -1.860 -6.211 1.00 0.25 H new ATOM 308 N LEU A 17 2.094 3.527 -4.799 1.00 0.10 N ATOM 309 CA LEU A 17 1.341 4.696 -4.392 1.00 0.10 C ATOM 310 C LEU A 17 2.092 5.950 -4.798 1.00 0.11 C ATOM 311 O LEU A 17 1.500 6.928 -5.252 1.00 0.16 O ATOM 312 CB LEU A 17 1.117 4.669 -2.884 1.00 0.10 C ATOM 313 CG LEU A 17 0.291 3.484 -2.393 1.00 0.10 C ATOM 314 CD1 LEU A 17 0.447 3.311 -0.893 1.00 0.12 C ATOM 315 CD2 LEU A 17 -1.171 3.673 -2.770 1.00 0.12 C ATOM 0 H LEU A 17 2.426 2.948 -4.028 1.00 0.10 H new ATOM 0 HA LEU A 17 0.369 4.694 -4.885 1.00 0.10 H new ATOM 0 HB2 LEU A 17 2.086 4.653 -2.385 1.00 0.10 H new ATOM 0 HB3 LEU A 17 0.620 5.592 -2.586 1.00 0.10 H new ATOM 0 HG LEU A 17 0.656 2.577 -2.875 1.00 0.10 H new ATOM 0 HD11 LEU A 17 -0.149 2.461 -0.561 1.00 0.12 H new ATOM 0 HD12 LEU A 17 1.496 3.134 -0.654 1.00 0.12 H new ATOM 0 HD13 LEU A 17 0.107 4.214 -0.385 1.00 0.12 H new ATOM 0 HD21 LEU A 17 -1.751 2.821 -2.415 1.00 0.12 H new ATOM 0 HD22 LEU A 17 -1.550 4.587 -2.312 1.00 0.12 H new ATOM 0 HD23 LEU A 17 -1.261 3.746 -3.854 1.00 0.12 H new ATOM 327 N ALA A 18 3.408 5.903 -4.646 1.00 0.08 N ATOM 328 CA ALA A 18 4.252 7.023 -5.010 1.00 0.10 C ATOM 329 C ALA A 18 4.143 7.280 -6.501 1.00 0.12 C ATOM 330 O ALA A 18 4.122 8.421 -6.955 1.00 0.14 O ATOM 331 CB ALA A 18 5.696 6.757 -4.619 1.00 0.11 C ATOM 0 H ALA A 18 3.911 5.098 -4.272 1.00 0.08 H new ATOM 0 HA ALA A 18 3.915 7.908 -4.471 1.00 0.10 H new ATOM 0 HB1 ALA A 18 6.313 7.610 -4.901 1.00 0.11 H new ATOM 0 HB2 ALA A 18 5.759 6.604 -3.542 1.00 0.11 H new ATOM 0 HB3 ALA A 18 6.054 5.865 -5.133 1.00 0.11 H new ATOM 337 N GLN A 19 4.073 6.197 -7.259 1.00 0.14 N ATOM 338 CA GLN A 19 3.949 6.283 -8.702 1.00 0.16 C ATOM 339 C GLN A 19 2.529 6.665 -9.074 1.00 0.16 C ATOM 340 O GLN A 19 2.299 7.375 -10.054 1.00 0.18 O ATOM 341 CB GLN A 19 4.317 4.955 -9.348 1.00 0.20 C ATOM 342 CG GLN A 19 5.779 4.590 -9.191 1.00 0.23 C ATOM 343 CD GLN A 19 6.192 3.447 -10.097 1.00 0.32 C ATOM 344 OE1 GLN A 19 5.655 3.285 -11.193 1.00 0.80 O ATOM 345 NE2 GLN A 19 7.145 2.643 -9.640 1.00 0.40 N ATOM 0 H GLN A 19 4.100 5.245 -6.895 1.00 0.14 H new ATOM 0 HA GLN A 19 4.634 7.048 -9.067 1.00 0.16 H new ATOM 0 HB2 GLN A 19 3.705 4.166 -8.911 1.00 0.20 H new ATOM 0 HB3 GLN A 19 4.073 4.997 -10.410 1.00 0.20 H new ATOM 0 HG2 GLN A 19 6.394 5.463 -9.410 1.00 0.23 H new ATOM 0 HG3 GLN A 19 5.972 4.316 -8.154 1.00 0.23 H new ATOM 0 HE21 GLN A 19 7.562 2.815 -8.725 1.00 0.40 H new ATOM 0 HE22 GLN A 19 7.460 1.853 -10.204 1.00 0.40 H new ATOM 354 N TYR A 20 1.578 6.190 -8.280 1.00 0.16 N ATOM 355 CA TYR A 20 0.179 6.496 -8.511 1.00 0.17 C ATOM 356 C TYR A 20 -0.037 7.992 -8.372 1.00 0.16 C ATOM 357 O TYR A 20 -0.883 8.583 -9.042 1.00 0.17 O ATOM 358 CB TYR A 20 -0.702 5.750 -7.515 1.00 0.19 C ATOM 359 CG TYR A 20 -2.159 6.122 -7.613 1.00 0.22 C ATOM 360 CD1 TYR A 20 -2.986 5.507 -8.541 1.00 0.26 C ATOM 361 CD2 TYR A 20 -2.708 7.082 -6.775 1.00 0.23 C ATOM 362 CE1 TYR A 20 -4.321 5.839 -8.633 1.00 0.30 C ATOM 363 CE2 TYR A 20 -4.044 7.422 -6.861 1.00 0.27 C ATOM 364 CZ TYR A 20 -4.841 6.819 -7.796 1.00 0.30 C ATOM 365 OH TYR A 20 -6.179 7.130 -7.882 1.00 0.36 O ATOM 0 H TYR A 20 1.753 5.592 -7.472 1.00 0.16 H new ATOM 0 HA TYR A 20 -0.093 6.178 -9.518 1.00 0.17 H new ATOM 0 HB2 TYR A 20 -0.596 4.678 -7.679 1.00 0.19 H new ATOM 0 HB3 TYR A 20 -0.349 5.954 -6.504 1.00 0.19 H new ATOM 0 HD1 TYR A 20 -2.578 4.756 -9.202 1.00 0.26 H new ATOM 0 HD2 TYR A 20 -2.081 7.571 -6.044 1.00 0.23 H new ATOM 0 HE1 TYR A 20 -4.958 5.341 -9.350 1.00 0.30 H new ATOM 0 HE2 TYR A 20 -4.459 8.162 -6.192 1.00 0.27 H new ATOM 0 HH TYR A 20 -6.394 7.832 -7.233 1.00 0.36 H new ATOM 375 N HIS A 21 0.746 8.591 -7.486 1.00 0.14 N ATOM 376 CA HIS A 21 0.681 10.020 -7.242 1.00 0.15 C ATOM 377 C HIS A 21 1.702 10.770 -8.093 1.00 0.16 C ATOM 378 O HIS A 21 1.699 12.001 -8.135 1.00 0.20 O ATOM 379 CB HIS A 21 0.927 10.297 -5.763 1.00 0.18 C ATOM 380 CG HIS A 21 -0.265 10.018 -4.903 1.00 0.19 C ATOM 381 ND1 HIS A 21 -1.274 10.937 -4.758 1.00 0.20 N ATOM 382 CD2 HIS A 21 -0.565 8.911 -4.181 1.00 0.21 C ATOM 383 CE1 HIS A 21 -2.161 10.374 -3.957 1.00 0.21 C ATOM 384 NE2 HIS A 21 -1.775 9.145 -3.581 1.00 0.23 N ATOM 0 H HIS A 21 1.439 8.101 -6.920 1.00 0.14 H new ATOM 0 HA HIS A 21 -0.312 10.374 -7.519 1.00 0.15 H new ATOM 0 HB2 HIS A 21 1.764 9.688 -5.421 1.00 0.18 H new ATOM 0 HB3 HIS A 21 1.220 11.340 -5.639 1.00 0.18 H new ATOM 0 HD2 HIS A 21 0.034 8.017 -4.095 1.00 0.21 H new ATOM 0 HE1 HIS A 21 -3.082 10.844 -3.644 1.00 0.21 H new ATOM 0 HE2 HIS A 21 -2.284 8.508 -2.968 1.00 0.23 H new ATOM 392 N ASN A 22 2.580 10.024 -8.767 1.00 0.15 N ATOM 393 CA ASN A 22 3.601 10.619 -9.617 1.00 0.18 C ATOM 394 C ASN A 22 4.666 11.292 -8.770 1.00 0.19 C ATOM 395 O ASN A 22 5.292 12.265 -9.190 1.00 0.21 O ATOM 396 CB ASN A 22 2.980 11.623 -10.582 1.00 0.20 C ATOM 397 CG ASN A 22 1.806 11.040 -11.341 1.00 0.87 C ATOM 398 OD1 ASN A 22 0.651 11.216 -10.955 1.00 1.35 O ATOM 399 ND2 ASN A 22 2.101 10.329 -12.420 1.00 1.28 N ATOM 0 H ASN A 22 2.600 9.005 -8.737 1.00 0.15 H new ATOM 0 HA ASN A 22 4.067 9.825 -10.200 1.00 0.18 H new ATOM 0 HB2 ASN A 22 2.651 12.501 -10.027 1.00 0.20 H new ATOM 0 HB3 ASN A 22 3.737 11.959 -11.290 1.00 0.20 H new ATOM 0 HD21 ASN A 22 1.355 9.901 -12.968 1.00 1.28 H new ATOM 0 HD22 ASN A 22 3.074 10.210 -12.702 1.00 1.28 H new ATOM 406 N VAL A 23 4.865 10.758 -7.575 1.00 0.19 N ATOM 407 CA VAL A 23 5.848 11.290 -6.651 1.00 0.22 C ATOM 408 C VAL A 23 7.079 10.393 -6.606 1.00 0.25 C ATOM 409 O VAL A 23 6.972 9.176 -6.455 1.00 0.35 O ATOM 410 CB VAL A 23 5.256 11.438 -5.238 1.00 0.23 C ATOM 411 CG1 VAL A 23 4.635 10.134 -4.784 1.00 0.26 C ATOM 412 CG2 VAL A 23 6.310 11.899 -4.249 1.00 0.26 C ATOM 0 H VAL A 23 4.353 9.950 -7.222 1.00 0.19 H new ATOM 0 HA VAL A 23 6.141 12.278 -7.008 1.00 0.22 H new ATOM 0 HB VAL A 23 4.477 12.199 -5.277 1.00 0.23 H new ATOM 0 HG11 VAL A 23 4.221 10.257 -3.783 1.00 0.26 H new ATOM 0 HG12 VAL A 23 3.839 9.851 -5.473 1.00 0.26 H new ATOM 0 HG13 VAL A 23 5.397 9.354 -4.769 1.00 0.26 H new ATOM 0 HG21 VAL A 23 5.863 11.995 -3.259 1.00 0.26 H new ATOM 0 HG22 VAL A 23 7.119 11.169 -4.213 1.00 0.26 H new ATOM 0 HG23 VAL A 23 6.706 12.865 -4.563 1.00 0.26 H new ATOM 422 N SER A 24 8.245 11.008 -6.739 1.00 0.22 N ATOM 423 CA SER A 24 9.504 10.276 -6.727 1.00 0.25 C ATOM 424 C SER A 24 9.576 9.319 -5.547 1.00 0.27 C ATOM 425 O SER A 24 8.950 9.542 -4.512 1.00 0.49 O ATOM 426 CB SER A 24 10.680 11.250 -6.670 1.00 0.35 C ATOM 427 OG SER A 24 10.698 12.100 -7.804 1.00 0.82 O ATOM 0 H SER A 24 8.346 12.016 -6.857 1.00 0.22 H new ATOM 0 HA SER A 24 9.558 9.693 -7.646 1.00 0.25 H new ATOM 0 HB2 SER A 24 10.614 11.851 -5.763 1.00 0.35 H new ATOM 0 HB3 SER A 24 11.615 10.692 -6.616 1.00 0.35 H new ATOM 0 HG SER A 24 11.459 12.714 -7.741 1.00 0.82 H new ATOM 433 N VAL A 25 10.342 8.251 -5.721 1.00 0.20 N ATOM 434 CA VAL A 25 10.516 7.255 -4.679 1.00 0.17 C ATOM 435 C VAL A 25 11.738 6.396 -4.962 1.00 0.18 C ATOM 436 O VAL A 25 11.795 5.691 -5.970 1.00 0.25 O ATOM 437 CB VAL A 25 9.279 6.348 -4.537 1.00 0.13 C ATOM 438 CG1 VAL A 25 8.941 5.690 -5.865 1.00 0.13 C ATOM 439 CG2 VAL A 25 9.504 5.295 -3.459 1.00 0.15 C ATOM 0 H VAL A 25 10.855 8.054 -6.580 1.00 0.20 H new ATOM 0 HA VAL A 25 10.653 7.795 -3.742 1.00 0.17 H new ATOM 0 HB VAL A 25 8.434 6.969 -4.238 1.00 0.13 H new ATOM 0 HG11 VAL A 25 8.064 5.054 -5.743 1.00 0.13 H new ATOM 0 HG12 VAL A 25 8.731 6.459 -6.609 1.00 0.13 H new ATOM 0 HG13 VAL A 25 9.785 5.085 -6.197 1.00 0.13 H new ATOM 0 HG21 VAL A 25 8.618 4.665 -3.375 1.00 0.15 H new ATOM 0 HG22 VAL A 25 10.363 4.679 -3.725 1.00 0.15 H new ATOM 0 HG23 VAL A 25 9.692 5.786 -2.504 1.00 0.15 H new ATOM 449 N ASN A 26 12.718 6.475 -4.077 1.00 0.15 N ATOM 450 CA ASN A 26 13.933 5.696 -4.219 1.00 0.15 C ATOM 451 C ASN A 26 13.995 4.623 -3.142 1.00 0.16 C ATOM 452 O ASN A 26 14.565 4.833 -2.072 1.00 0.17 O ATOM 453 CB ASN A 26 15.156 6.602 -4.139 1.00 0.16 C ATOM 454 CG ASN A 26 16.452 5.843 -4.310 1.00 0.18 C ATOM 455 OD1 ASN A 26 16.475 4.731 -4.837 1.00 0.20 O ATOM 456 ND2 ASN A 26 17.545 6.454 -3.878 1.00 0.20 N ATOM 0 H ASN A 26 12.694 7.073 -3.251 1.00 0.15 H new ATOM 0 HA ASN A 26 13.927 5.211 -5.195 1.00 0.15 H new ATOM 0 HB2 ASN A 26 15.085 7.371 -4.908 1.00 0.16 H new ATOM 0 HB3 ASN A 26 15.163 7.113 -3.176 1.00 0.16 H new ATOM 0 HD21 ASN A 26 18.454 6.002 -3.976 1.00 0.20 H new ATOM 0 HD22 ASN A 26 17.477 7.376 -3.447 1.00 0.20 H new ATOM 463 N PRO A 27 13.398 3.454 -3.421 1.00 0.17 N ATOM 464 CA PRO A 27 13.374 2.334 -2.485 1.00 0.19 C ATOM 465 C PRO A 27 14.725 2.124 -1.826 1.00 0.20 C ATOM 466 O PRO A 27 14.811 1.794 -0.645 1.00 0.25 O ATOM 467 CB PRO A 27 13.019 1.156 -3.384 1.00 0.23 C ATOM 468 CG PRO A 27 12.154 1.757 -4.434 1.00 0.30 C ATOM 469 CD PRO A 27 12.703 3.133 -4.680 1.00 0.19 C ATOM 0 HA PRO A 27 12.677 2.483 -1.660 1.00 0.19 H new ATOM 0 HB2 PRO A 27 13.910 0.698 -3.814 1.00 0.23 H new ATOM 0 HB3 PRO A 27 12.495 0.376 -2.832 1.00 0.23 H new ATOM 0 HG2 PRO A 27 12.174 1.160 -5.346 1.00 0.30 H new ATOM 0 HG3 PRO A 27 11.116 1.803 -4.106 1.00 0.30 H new ATOM 0 HD2 PRO A 27 13.385 3.147 -5.530 1.00 0.19 H new ATOM 0 HD3 PRO A 27 11.910 3.849 -4.895 1.00 0.19 H new ATOM 477 N GLU A 28 15.777 2.327 -2.602 1.00 0.18 N ATOM 478 CA GLU A 28 17.130 2.177 -2.096 1.00 0.19 C ATOM 479 C GLU A 28 17.358 3.170 -0.972 1.00 0.19 C ATOM 480 O GLU A 28 17.935 2.841 0.063 1.00 0.21 O ATOM 481 CB GLU A 28 18.143 2.415 -3.214 1.00 0.21 C ATOM 482 CG GLU A 28 17.934 1.525 -4.426 1.00 0.23 C ATOM 483 CD GLU A 28 18.959 1.774 -5.516 1.00 0.72 C ATOM 484 OE1 GLU A 28 20.036 1.144 -5.473 1.00 0.70 O ATOM 485 OE2 GLU A 28 18.684 2.600 -6.411 1.00 1.24 O ATOM 0 H GLU A 28 15.719 2.596 -3.584 1.00 0.18 H new ATOM 0 HA GLU A 28 17.261 1.163 -1.719 1.00 0.19 H new ATOM 0 HB2 GLU A 28 18.088 3.458 -3.526 1.00 0.21 H new ATOM 0 HB3 GLU A 28 19.147 2.252 -2.823 1.00 0.21 H new ATOM 0 HG2 GLU A 28 17.983 0.481 -4.118 1.00 0.23 H new ATOM 0 HG3 GLU A 28 16.934 1.692 -4.827 1.00 0.23 H new ATOM 492 N GLU A 29 16.890 4.389 -1.194 1.00 0.18 N ATOM 493 CA GLU A 29 17.012 5.453 -0.213 1.00 0.18 C ATOM 494 C GLU A 29 16.034 5.229 0.923 1.00 0.16 C ATOM 495 O GLU A 29 16.386 5.343 2.097 1.00 0.20 O ATOM 496 CB GLU A 29 16.742 6.801 -0.866 1.00 0.20 C ATOM 497 CG GLU A 29 16.726 7.953 0.114 1.00 0.22 C ATOM 498 CD GLU A 29 16.322 9.266 -0.530 1.00 1.02 C ATOM 499 OE1 GLU A 29 15.106 9.540 -0.606 1.00 1.85 O ATOM 500 OE2 GLU A 29 17.222 10.018 -0.960 1.00 0.95 O ATOM 0 H GLU A 29 16.418 4.666 -2.055 1.00 0.18 H new ATOM 0 HA GLU A 29 18.027 5.447 0.184 1.00 0.18 H new ATOM 0 HB2 GLU A 29 17.504 6.988 -1.623 1.00 0.20 H new ATOM 0 HB3 GLU A 29 15.783 6.760 -1.382 1.00 0.20 H new ATOM 0 HG2 GLU A 29 16.036 7.724 0.926 1.00 0.22 H new ATOM 0 HG3 GLU A 29 17.716 8.060 0.558 1.00 0.22 H new ATOM 507 N ILE A 30 14.798 4.908 0.561 1.00 0.14 N ATOM 508 CA ILE A 30 13.760 4.658 1.547 1.00 0.14 C ATOM 509 C ILE A 30 14.241 3.636 2.563 1.00 0.14 C ATOM 510 O ILE A 30 14.187 3.864 3.770 1.00 0.21 O ATOM 511 CB ILE A 30 12.466 4.144 0.887 1.00 0.17 C ATOM 512 CG1 ILE A 30 11.938 5.171 -0.113 1.00 0.22 C ATOM 513 CG2 ILE A 30 11.416 3.835 1.941 1.00 0.17 C ATOM 514 CD1 ILE A 30 11.767 6.550 0.479 1.00 0.28 C ATOM 0 H ILE A 30 14.492 4.815 -0.408 1.00 0.14 H new ATOM 0 HA ILE A 30 13.543 5.604 2.044 1.00 0.14 H new ATOM 0 HB ILE A 30 12.692 3.223 0.350 1.00 0.17 H new ATOM 0 HG12 ILE A 30 12.623 5.229 -0.959 1.00 0.22 H new ATOM 0 HG13 ILE A 30 10.979 4.829 -0.502 1.00 0.22 H new ATOM 0 HG21 ILE A 30 10.509 3.473 1.456 1.00 0.17 H new ATOM 0 HG22 ILE A 30 11.795 3.070 2.619 1.00 0.17 H new ATOM 0 HG23 ILE A 30 11.190 4.740 2.505 1.00 0.17 H new ATOM 0 HD11 ILE A 30 11.389 7.230 -0.285 1.00 0.28 H new ATOM 0 HD12 ILE A 30 11.059 6.505 1.307 1.00 0.28 H new ATOM 0 HD13 ILE A 30 12.729 6.912 0.843 1.00 0.28 H new ATOM 526 N LYS A 31 14.725 2.512 2.065 1.00 0.15 N ATOM 527 CA LYS A 31 15.227 1.467 2.934 1.00 0.20 C ATOM 528 C LYS A 31 16.441 1.959 3.701 1.00 0.21 C ATOM 529 O LYS A 31 16.695 1.548 4.831 1.00 0.26 O ATOM 530 CB LYS A 31 15.597 0.232 2.123 1.00 0.26 C ATOM 531 CG LYS A 31 14.409 -0.421 1.448 1.00 0.80 C ATOM 532 CD LYS A 31 14.612 -1.916 1.291 1.00 0.82 C ATOM 533 CE LYS A 31 15.872 -2.227 0.498 1.00 0.65 C ATOM 534 NZ LYS A 31 16.060 -3.691 0.308 1.00 1.35 N ATOM 0 H LYS A 31 14.780 2.302 1.068 1.00 0.15 H new ATOM 0 HA LYS A 31 14.441 1.202 3.642 1.00 0.20 H new ATOM 0 HB2 LYS A 31 16.329 0.510 1.365 1.00 0.26 H new ATOM 0 HB3 LYS A 31 16.077 -0.494 2.779 1.00 0.26 H new ATOM 0 HG2 LYS A 31 13.509 -0.234 2.033 1.00 0.80 H new ATOM 0 HG3 LYS A 31 14.252 0.031 0.469 1.00 0.80 H new ATOM 0 HD2 LYS A 31 14.676 -2.381 2.275 1.00 0.82 H new ATOM 0 HD3 LYS A 31 13.748 -2.351 0.789 1.00 0.82 H new ATOM 0 HE2 LYS A 31 15.819 -1.738 -0.475 1.00 0.65 H new ATOM 0 HE3 LYS A 31 16.738 -1.814 1.015 1.00 0.65 H new ATOM 0 HZ1 LYS A 31 16.929 -3.862 -0.237 1.00 1.35 H new ATOM 0 HZ2 LYS A 31 16.136 -4.154 1.236 1.00 1.35 H new ATOM 0 HZ3 LYS A 31 15.246 -4.081 -0.208 1.00 1.35 H new ATOM 548 N HIS A 32 17.183 2.850 3.069 1.00 0.19 N ATOM 549 CA HIS A 32 18.377 3.418 3.665 1.00 0.23 C ATOM 550 C HIS A 32 18.013 4.335 4.824 1.00 0.23 C ATOM 551 O HIS A 32 18.788 4.509 5.765 1.00 0.29 O ATOM 552 CB HIS A 32 19.140 4.213 2.609 1.00 0.25 C ATOM 553 CG HIS A 32 20.566 4.484 2.970 1.00 0.32 C ATOM 554 ND1 HIS A 32 21.003 5.694 3.464 1.00 0.37 N ATOM 555 CD2 HIS A 32 21.660 3.690 2.901 1.00 0.38 C ATOM 556 CE1 HIS A 32 22.305 5.635 3.681 1.00 0.44 C ATOM 557 NE2 HIS A 32 22.727 4.429 3.349 1.00 0.44 N ATOM 0 H HIS A 32 16.976 3.198 2.133 1.00 0.19 H new ATOM 0 HA HIS A 32 19.000 2.607 4.043 1.00 0.23 H new ATOM 0 HB2 HIS A 32 19.111 3.667 1.666 1.00 0.25 H new ATOM 0 HB3 HIS A 32 18.630 5.162 2.444 1.00 0.25 H new ATOM 0 HD2 HIS A 32 21.688 2.666 2.558 1.00 0.38 H new ATOM 0 HE1 HIS A 32 22.919 6.436 4.064 1.00 0.44 H new ATOM 0 HE2 HIS A 32 23.690 4.099 3.415 1.00 0.44 H new ATOM 566 N ARG A 33 16.827 4.919 4.741 1.00 0.19 N ATOM 567 CA ARG A 33 16.353 5.845 5.755 1.00 0.21 C ATOM 568 C ARG A 33 15.382 5.202 6.738 1.00 0.21 C ATOM 569 O ARG A 33 15.368 5.549 7.920 1.00 0.27 O ATOM 570 CB ARG A 33 15.655 7.016 5.078 1.00 0.24 C ATOM 571 CG ARG A 33 16.563 7.821 4.173 1.00 0.29 C ATOM 572 CD ARG A 33 15.813 8.965 3.513 1.00 0.36 C ATOM 573 NE ARG A 33 15.144 9.817 4.490 1.00 0.47 N ATOM 574 CZ ARG A 33 15.757 10.779 5.174 1.00 0.64 C ATOM 575 NH1 ARG A 33 17.051 11.004 4.992 1.00 1.13 N ATOM 576 NH2 ARG A 33 15.077 11.512 6.044 1.00 0.71 N ATOM 0 H ARG A 33 16.172 4.765 3.975 1.00 0.19 H new ATOM 0 HA ARG A 33 17.226 6.174 6.319 1.00 0.21 H new ATOM 0 HB2 ARG A 33 14.815 6.639 4.494 1.00 0.24 H new ATOM 0 HB3 ARG A 33 15.242 7.674 5.843 1.00 0.24 H new ATOM 0 HG2 ARG A 33 17.398 8.217 4.751 1.00 0.29 H new ATOM 0 HG3 ARG A 33 16.986 7.171 3.407 1.00 0.29 H new ATOM 0 HD2 ARG A 33 16.509 9.564 2.926 1.00 0.36 H new ATOM 0 HD3 ARG A 33 15.076 8.562 2.819 1.00 0.36 H new ATOM 0 HE ARG A 33 14.149 9.666 4.658 1.00 0.47 H new ATOM 0 HH11 ARG A 33 17.578 10.439 4.326 1.00 1.13 H new ATOM 0 HH12 ARG A 33 17.519 11.742 5.518 1.00 1.13 H new ATOM 0 HH21 ARG A 33 14.082 11.339 6.190 1.00 0.71 H new ATOM 0 HH22 ARG A 33 15.548 12.249 6.568 1.00 0.71 H new ATOM 590 N PHE A 34 14.573 4.269 6.255 1.00 0.17 N ATOM 591 CA PHE A 34 13.567 3.645 7.103 1.00 0.21 C ATOM 592 C PHE A 34 13.774 2.144 7.275 1.00 0.22 C ATOM 593 O PHE A 34 13.478 1.595 8.336 1.00 0.31 O ATOM 594 CB PHE A 34 12.187 3.943 6.524 1.00 0.23 C ATOM 595 CG PHE A 34 11.995 5.406 6.245 1.00 0.21 C ATOM 596 CD1 PHE A 34 11.525 6.257 7.232 1.00 0.29 C ATOM 597 CD2 PHE A 34 12.259 5.924 4.990 1.00 0.21 C ATOM 598 CE1 PHE A 34 11.325 7.598 6.972 1.00 0.29 C ATOM 599 CE2 PHE A 34 12.064 7.265 4.723 1.00 0.24 C ATOM 600 CZ PHE A 34 11.684 8.121 5.742 1.00 0.23 C ATOM 0 H PHE A 34 14.592 3.931 5.293 1.00 0.17 H new ATOM 0 HA PHE A 34 13.659 4.070 8.103 1.00 0.21 H new ATOM 0 HB2 PHE A 34 12.052 3.378 5.602 1.00 0.23 H new ATOM 0 HB3 PHE A 34 11.421 3.604 7.221 1.00 0.23 H new ATOM 0 HD1 PHE A 34 11.313 5.867 8.216 1.00 0.29 H new ATOM 0 HD2 PHE A 34 12.622 5.272 4.209 1.00 0.21 H new ATOM 0 HE1 PHE A 34 10.890 8.237 7.726 1.00 0.29 H new ATOM 0 HE2 PHE A 34 12.208 7.644 3.722 1.00 0.24 H new ATOM 0 HZ PHE A 34 11.668 9.188 5.579 1.00 0.23 H new ATOM 610 N ASP A 35 14.278 1.476 6.247 1.00 0.19 N ATOM 611 CA ASP A 35 14.510 0.038 6.338 1.00 0.22 C ATOM 612 C ASP A 35 15.967 -0.243 6.654 1.00 0.29 C ATOM 613 O ASP A 35 16.538 -1.232 6.196 1.00 0.34 O ATOM 614 CB ASP A 35 14.111 -0.673 5.050 1.00 0.23 C ATOM 615 CG ASP A 35 13.896 -2.155 5.260 1.00 0.28 C ATOM 616 OD1 ASP A 35 13.188 -2.524 6.221 1.00 1.10 O ATOM 617 OD2 ASP A 35 14.432 -2.947 4.460 1.00 0.94 O ATOM 0 H ASP A 35 14.531 1.897 5.353 1.00 0.19 H new ATOM 0 HA ASP A 35 13.887 -0.347 7.145 1.00 0.22 H new ATOM 0 HB2 ASP A 35 13.197 -0.227 4.659 1.00 0.23 H new ATOM 0 HB3 ASP A 35 14.886 -0.523 4.299 1.00 0.23 H new ATOM 622 N THR A 36 16.561 0.644 7.436 1.00 0.31 N ATOM 623 CA THR A 36 17.955 0.506 7.827 1.00 0.39 C ATOM 624 C THR A 36 18.233 -0.888 8.375 1.00 0.46 C ATOM 625 O THR A 36 19.368 -1.365 8.340 1.00 0.54 O ATOM 626 CB THR A 36 18.343 1.553 8.883 1.00 0.43 C ATOM 627 OG1 THR A 36 17.548 1.380 10.062 1.00 0.47 O ATOM 628 CG2 THR A 36 18.150 2.960 8.338 1.00 0.39 C ATOM 0 H THR A 36 16.098 1.470 7.814 1.00 0.31 H new ATOM 0 HA THR A 36 18.557 0.666 6.932 1.00 0.39 H new ATOM 0 HB THR A 36 19.395 1.415 9.133 1.00 0.43 H new ATOM 0 HG1 THR A 36 17.803 2.050 10.730 1.00 0.47 H new ATOM 0 HG21 THR A 36 18.430 3.687 9.100 1.00 0.39 H new ATOM 0 HG22 THR A 36 18.777 3.098 7.457 1.00 0.39 H new ATOM 0 HG23 THR A 36 17.105 3.104 8.065 1.00 0.39 H new ATOM 636 N ASP A 37 17.190 -1.536 8.882 1.00 0.45 N ATOM 637 CA ASP A 37 17.318 -2.879 9.427 1.00 0.51 C ATOM 638 C ASP A 37 17.293 -3.921 8.312 1.00 0.50 C ATOM 639 O ASP A 37 17.798 -5.031 8.473 1.00 0.58 O ATOM 640 CB ASP A 37 16.194 -3.155 10.426 1.00 0.51 C ATOM 641 CG ASP A 37 16.438 -2.493 11.769 1.00 1.04 C ATOM 642 OD1 ASP A 37 16.087 -1.304 11.917 1.00 1.71 O ATOM 643 OD2 ASP A 37 16.980 -3.165 12.672 1.00 0.98 O ATOM 0 H ASP A 37 16.246 -1.151 8.926 1.00 0.45 H new ATOM 0 HA ASP A 37 18.276 -2.947 9.942 1.00 0.51 H new ATOM 0 HB2 ASP A 37 15.250 -2.798 10.014 1.00 0.51 H new ATOM 0 HB3 ASP A 37 16.093 -4.231 10.567 1.00 0.51 H new ATOM 648 N GLY A 38 16.702 -3.551 7.178 1.00 0.43 N ATOM 649 CA GLY A 38 16.624 -4.459 6.052 1.00 0.46 C ATOM 650 C GLY A 38 15.626 -5.571 6.282 1.00 0.42 C ATOM 651 O GLY A 38 15.735 -6.648 5.697 1.00 0.46 O ATOM 0 H GLY A 38 16.276 -2.637 7.022 1.00 0.43 H new ATOM 0 HA2 GLY A 38 16.345 -3.902 5.157 1.00 0.46 H new ATOM 0 HA3 GLY A 38 17.608 -4.889 5.866 1.00 0.46 H new ATOM 655 N THR A 39 14.645 -5.304 7.135 1.00 0.35 N ATOM 656 CA THR A 39 13.620 -6.288 7.456 1.00 0.33 C ATOM 657 C THR A 39 12.237 -5.824 7.006 1.00 0.30 C ATOM 658 O THR A 39 11.220 -6.368 7.439 1.00 0.41 O ATOM 659 CB THR A 39 13.584 -6.582 8.966 1.00 0.35 C ATOM 660 OG1 THR A 39 12.524 -7.498 9.264 1.00 0.65 O ATOM 661 CG2 THR A 39 13.394 -5.300 9.763 1.00 0.64 C ATOM 0 H THR A 39 14.538 -4.412 7.618 1.00 0.35 H new ATOM 0 HA THR A 39 13.881 -7.199 6.917 1.00 0.33 H new ATOM 0 HB THR A 39 14.537 -7.029 9.249 1.00 0.35 H new ATOM 0 HG1 THR A 39 11.870 -7.490 8.534 1.00 0.65 H new ATOM 0 HG21 THR A 39 13.372 -5.533 10.828 1.00 0.64 H new ATOM 0 HG22 THR A 39 14.220 -4.618 9.558 1.00 0.64 H new ATOM 0 HG23 THR A 39 12.454 -4.829 9.475 1.00 0.64 H new ATOM 669 N GLY A 40 12.201 -4.811 6.143 1.00 0.22 N ATOM 670 CA GLY A 40 10.937 -4.298 5.657 1.00 0.21 C ATOM 671 C GLY A 40 10.545 -3.003 6.336 1.00 0.20 C ATOM 672 O GLY A 40 10.936 -2.747 7.475 1.00 0.32 O ATOM 0 H GLY A 40 13.026 -4.339 5.774 1.00 0.22 H new ATOM 0 HA2 GLY A 40 11.002 -4.137 4.581 1.00 0.21 H new ATOM 0 HA3 GLY A 40 10.158 -5.042 5.821 1.00 0.21 H new ATOM 676 N LEU A 41 9.772 -2.183 5.636 1.00 0.12 N ATOM 677 CA LEU A 41 9.329 -0.907 6.176 1.00 0.10 C ATOM 678 C LEU A 41 8.261 -1.100 7.239 1.00 0.10 C ATOM 679 O LEU A 41 7.250 -1.763 7.008 1.00 0.14 O ATOM 680 CB LEU A 41 8.779 -0.019 5.064 1.00 0.10 C ATOM 681 CG LEU A 41 9.826 0.535 4.107 1.00 0.11 C ATOM 682 CD1 LEU A 41 10.766 1.471 4.845 1.00 0.12 C ATOM 683 CD2 LEU A 41 10.596 -0.598 3.455 1.00 0.14 C ATOM 0 H LEU A 41 9.439 -2.380 4.692 1.00 0.12 H new ATOM 0 HA LEU A 41 10.194 -0.426 6.632 1.00 0.10 H new ATOM 0 HB2 LEU A 41 8.050 -0.591 4.490 1.00 0.10 H new ATOM 0 HB3 LEU A 41 8.244 0.816 5.517 1.00 0.10 H new ATOM 0 HG LEU A 41 9.323 1.101 3.323 1.00 0.11 H new ATOM 0 HD11 LEU A 41 11.510 1.861 4.151 1.00 0.12 H new ATOM 0 HD12 LEU A 41 10.197 2.298 5.269 1.00 0.12 H new ATOM 0 HD13 LEU A 41 11.267 0.927 5.646 1.00 0.12 H new ATOM 0 HD21 LEU A 41 11.341 -0.187 2.774 1.00 0.14 H new ATOM 0 HD22 LEU A 41 11.094 -1.189 4.224 1.00 0.14 H new ATOM 0 HD23 LEU A 41 9.907 -1.233 2.899 1.00 0.14 H new ATOM 695 N GLY A 42 8.494 -0.518 8.405 1.00 0.09 N ATOM 696 CA GLY A 42 7.531 -0.618 9.478 1.00 0.11 C ATOM 697 C GLY A 42 6.328 0.255 9.203 1.00 0.10 C ATOM 698 O GLY A 42 6.321 1.006 8.231 1.00 0.11 O ATOM 0 H GLY A 42 9.331 0.021 8.626 1.00 0.09 H new ATOM 0 HA2 GLY A 42 7.215 -1.655 9.593 1.00 0.11 H new ATOM 0 HA3 GLY A 42 7.995 -0.320 10.418 1.00 0.11 H new ATOM 702 N LEU A 43 5.312 0.170 10.042 1.00 0.12 N ATOM 703 CA LEU A 43 4.120 0.975 9.845 1.00 0.12 C ATOM 704 C LEU A 43 4.465 2.457 9.872 1.00 0.11 C ATOM 705 O LEU A 43 4.171 3.192 8.929 1.00 0.12 O ATOM 706 CB LEU A 43 3.068 0.657 10.910 1.00 0.14 C ATOM 707 CG LEU A 43 1.754 1.442 10.799 1.00 0.14 C ATOM 708 CD1 LEU A 43 1.860 2.767 11.535 1.00 0.14 C ATOM 709 CD2 LEU A 43 1.381 1.674 9.339 1.00 0.14 C ATOM 0 H LEU A 43 5.287 -0.441 10.858 1.00 0.12 H new ATOM 0 HA LEU A 43 3.705 0.731 8.867 1.00 0.12 H new ATOM 0 HB2 LEU A 43 2.839 -0.408 10.863 1.00 0.14 H new ATOM 0 HB3 LEU A 43 3.502 0.847 11.892 1.00 0.14 H new ATOM 0 HG LEU A 43 0.966 0.849 11.263 1.00 0.14 H new ATOM 0 HD11 LEU A 43 0.919 3.309 11.445 1.00 0.14 H new ATOM 0 HD12 LEU A 43 2.073 2.582 12.588 1.00 0.14 H new ATOM 0 HD13 LEU A 43 2.664 3.361 11.101 1.00 0.14 H new ATOM 0 HD21 LEU A 43 0.446 2.232 9.287 1.00 0.14 H new ATOM 0 HD22 LEU A 43 2.171 2.242 8.847 1.00 0.14 H new ATOM 0 HD23 LEU A 43 1.259 0.714 8.838 1.00 0.14 H new ATOM 721 N THR A 44 5.089 2.888 10.957 1.00 0.11 N ATOM 722 CA THR A 44 5.483 4.281 11.105 1.00 0.12 C ATOM 723 C THR A 44 6.635 4.614 10.168 1.00 0.12 C ATOM 724 O THR A 44 6.726 5.724 9.647 1.00 0.16 O ATOM 725 CB THR A 44 5.899 4.600 12.551 1.00 0.15 C ATOM 726 OG1 THR A 44 4.812 4.333 13.446 1.00 0.18 O ATOM 727 CG2 THR A 44 6.320 6.056 12.680 1.00 0.18 C ATOM 0 H THR A 44 5.334 2.293 11.749 1.00 0.11 H new ATOM 0 HA THR A 44 4.616 4.890 10.850 1.00 0.12 H new ATOM 0 HB THR A 44 6.746 3.965 12.811 1.00 0.15 H new ATOM 0 HG1 THR A 44 5.087 4.537 14.364 1.00 0.18 H new ATOM 0 HG21 THR A 44 6.610 6.261 13.710 1.00 0.18 H new ATOM 0 HG22 THR A 44 7.165 6.250 12.019 1.00 0.18 H new ATOM 0 HG23 THR A 44 5.487 6.702 12.403 1.00 0.18 H new ATOM 735 N SER A 45 7.510 3.640 9.954 1.00 0.11 N ATOM 736 CA SER A 45 8.656 3.820 9.078 1.00 0.13 C ATOM 737 C SER A 45 8.195 3.923 7.634 1.00 0.13 C ATOM 738 O SER A 45 8.794 4.629 6.822 1.00 0.19 O ATOM 739 CB SER A 45 9.633 2.656 9.241 1.00 0.17 C ATOM 740 OG SER A 45 10.435 2.819 10.398 1.00 0.31 O ATOM 0 H SER A 45 7.446 2.714 10.378 1.00 0.11 H new ATOM 0 HA SER A 45 9.167 4.743 9.350 1.00 0.13 H new ATOM 0 HB2 SER A 45 9.079 1.720 9.308 1.00 0.17 H new ATOM 0 HB3 SER A 45 10.271 2.587 8.360 1.00 0.17 H new ATOM 0 HG SER A 45 11.050 2.060 10.480 1.00 0.31 H new ATOM 746 N TRP A 46 7.122 3.210 7.325 1.00 0.10 N ATOM 747 CA TRP A 46 6.552 3.220 5.992 1.00 0.09 C ATOM 748 C TRP A 46 5.859 4.547 5.731 1.00 0.08 C ATOM 749 O TRP A 46 5.999 5.138 4.661 1.00 0.10 O ATOM 750 CB TRP A 46 5.555 2.077 5.840 1.00 0.09 C ATOM 751 CG TRP A 46 5.007 1.962 4.458 1.00 0.09 C ATOM 752 CD1 TRP A 46 5.331 1.019 3.533 1.00 0.11 C ATOM 753 CD2 TRP A 46 4.046 2.823 3.839 1.00 0.08 C ATOM 754 NE1 TRP A 46 4.629 1.237 2.377 1.00 0.12 N ATOM 755 CE2 TRP A 46 3.835 2.335 2.538 1.00 0.10 C ATOM 756 CE3 TRP A 46 3.343 3.954 4.255 1.00 0.08 C ATOM 757 CZ2 TRP A 46 2.953 2.937 1.649 1.00 0.10 C ATOM 758 CZ3 TRP A 46 2.466 4.554 3.370 1.00 0.08 C ATOM 759 CH2 TRP A 46 2.277 4.042 2.081 1.00 0.09 C ATOM 0 H TRP A 46 6.627 2.613 7.988 1.00 0.10 H new ATOM 0 HA TRP A 46 7.355 3.090 5.266 1.00 0.09 H new ATOM 0 HB2 TRP A 46 6.041 1.140 6.111 1.00 0.09 H new ATOM 0 HB3 TRP A 46 4.733 2.224 6.540 1.00 0.09 H new ATOM 0 HD1 TRP A 46 6.037 0.217 3.687 1.00 0.11 H new ATOM 0 HE1 TRP A 46 4.690 0.670 1.532 1.00 0.12 H new ATOM 0 HE3 TRP A 46 3.481 4.353 5.249 1.00 0.08 H new ATOM 0 HZ2 TRP A 46 2.807 2.545 0.653 1.00 0.10 H new ATOM 0 HZ3 TRP A 46 1.918 5.432 3.678 1.00 0.08 H new ATOM 0 HH2 TRP A 46 1.582 4.531 1.414 1.00 0.09 H new ATOM 770 N LEU A 47 5.106 5.007 6.721 1.00 0.08 N ATOM 771 CA LEU A 47 4.397 6.270 6.613 1.00 0.08 C ATOM 772 C LEU A 47 5.387 7.402 6.395 1.00 0.08 C ATOM 773 O LEU A 47 5.204 8.245 5.520 1.00 0.11 O ATOM 774 CB LEU A 47 3.575 6.522 7.877 1.00 0.09 C ATOM 775 CG LEU A 47 2.351 5.620 8.039 1.00 0.15 C ATOM 776 CD1 LEU A 47 1.751 5.783 9.426 1.00 0.60 C ATOM 777 CD2 LEU A 47 1.313 5.936 6.975 1.00 0.62 C ATOM 0 H LEU A 47 4.972 4.522 7.608 1.00 0.08 H new ATOM 0 HA LEU A 47 3.720 6.225 5.760 1.00 0.08 H new ATOM 0 HB2 LEU A 47 4.221 6.392 8.745 1.00 0.09 H new ATOM 0 HB3 LEU A 47 3.245 7.561 7.877 1.00 0.09 H new ATOM 0 HG LEU A 47 2.668 4.584 7.917 1.00 0.15 H new ATOM 0 HD11 LEU A 47 0.881 5.134 9.525 1.00 0.60 H new ATOM 0 HD12 LEU A 47 2.493 5.512 10.177 1.00 0.60 H new ATOM 0 HD13 LEU A 47 1.449 6.820 9.572 1.00 0.60 H new ATOM 0 HD21 LEU A 47 0.449 5.285 7.105 1.00 0.62 H new ATOM 0 HD22 LEU A 47 1.001 6.976 7.069 1.00 0.62 H new ATOM 0 HD23 LEU A 47 1.744 5.774 5.987 1.00 0.62 H new ATOM 789 N LEU A 48 6.442 7.402 7.196 1.00 0.08 N ATOM 790 CA LEU A 48 7.480 8.413 7.093 1.00 0.10 C ATOM 791 C LEU A 48 8.183 8.311 5.746 1.00 0.10 C ATOM 792 O LEU A 48 8.700 9.299 5.225 1.00 0.11 O ATOM 793 CB LEU A 48 8.486 8.243 8.226 1.00 0.12 C ATOM 794 CG LEU A 48 7.906 8.415 9.627 1.00 0.13 C ATOM 795 CD1 LEU A 48 8.845 7.838 10.673 1.00 0.17 C ATOM 796 CD2 LEU A 48 7.633 9.883 9.906 1.00 0.17 C ATOM 0 H LEU A 48 6.601 6.709 7.927 1.00 0.08 H new ATOM 0 HA LEU A 48 7.021 9.399 7.172 1.00 0.10 H new ATOM 0 HB2 LEU A 48 8.932 7.251 8.152 1.00 0.12 H new ATOM 0 HB3 LEU A 48 9.291 8.965 8.090 1.00 0.12 H new ATOM 0 HG LEU A 48 6.964 7.869 9.680 1.00 0.13 H new ATOM 0 HD11 LEU A 48 8.412 7.972 11.664 1.00 0.17 H new ATOM 0 HD12 LEU A 48 8.993 6.775 10.482 1.00 0.17 H new ATOM 0 HD13 LEU A 48 9.805 8.353 10.624 1.00 0.17 H new ATOM 0 HD21 LEU A 48 7.219 9.992 10.909 1.00 0.17 H new ATOM 0 HD22 LEU A 48 8.563 10.446 9.834 1.00 0.17 H new ATOM 0 HD23 LEU A 48 6.920 10.266 9.176 1.00 0.17 H new ATOM 808 N ALA A 49 8.196 7.104 5.189 1.00 0.10 N ATOM 809 CA ALA A 49 8.824 6.869 3.898 1.00 0.11 C ATOM 810 C ALA A 49 8.084 7.631 2.809 1.00 0.11 C ATOM 811 O ALA A 49 8.693 8.154 1.876 1.00 0.15 O ATOM 812 CB ALA A 49 8.861 5.381 3.583 1.00 0.11 C ATOM 0 H ALA A 49 7.779 6.275 5.613 1.00 0.10 H new ATOM 0 HA ALA A 49 9.851 7.232 3.939 1.00 0.11 H new ATOM 0 HB1 ALA A 49 9.334 5.226 2.613 1.00 0.11 H new ATOM 0 HB2 ALA A 49 9.431 4.860 4.352 1.00 0.11 H new ATOM 0 HB3 ALA A 49 7.844 4.989 3.557 1.00 0.11 H new ATOM 818 N ALA A 50 6.765 7.690 2.939 1.00 0.08 N ATOM 819 CA ALA A 50 5.931 8.397 1.981 1.00 0.08 C ATOM 820 C ALA A 50 6.053 9.898 2.183 1.00 0.10 C ATOM 821 O ALA A 50 6.119 10.665 1.223 1.00 0.13 O ATOM 822 CB ALA A 50 4.482 7.960 2.121 1.00 0.10 C ATOM 0 H ALA A 50 6.249 7.254 3.703 1.00 0.08 H new ATOM 0 HA ALA A 50 6.272 8.153 0.975 1.00 0.08 H new ATOM 0 HB1 ALA A 50 3.868 8.497 1.398 1.00 0.10 H new ATOM 0 HB2 ALA A 50 4.406 6.888 1.937 1.00 0.10 H new ATOM 0 HB3 ALA A 50 4.131 8.181 3.129 1.00 0.10 H new ATOM 828 N LYS A 51 6.085 10.310 3.445 1.00 0.09 N ATOM 829 CA LYS A 51 6.207 11.718 3.782 1.00 0.11 C ATOM 830 C LYS A 51 7.543 12.259 3.293 1.00 0.13 C ATOM 831 O LYS A 51 7.645 13.411 2.873 1.00 0.15 O ATOM 832 CB LYS A 51 6.079 11.917 5.292 1.00 0.14 C ATOM 833 CG LYS A 51 4.766 11.411 5.862 1.00 0.14 C ATOM 834 CD LYS A 51 4.680 11.646 7.364 1.00 0.21 C ATOM 835 CE LYS A 51 3.382 11.109 7.947 1.00 0.61 C ATOM 836 NZ LYS A 51 3.286 11.357 9.412 1.00 1.40 N ATOM 0 H LYS A 51 6.028 9.686 4.250 1.00 0.09 H new ATOM 0 HA LYS A 51 5.403 12.265 3.290 1.00 0.11 H new ATOM 0 HB2 LYS A 51 6.903 11.404 5.789 1.00 0.14 H new ATOM 0 HB3 LYS A 51 6.180 12.978 5.520 1.00 0.14 H new ATOM 0 HG2 LYS A 51 3.936 11.914 5.366 1.00 0.14 H new ATOM 0 HG3 LYS A 51 4.664 10.346 5.653 1.00 0.14 H new ATOM 0 HD2 LYS A 51 5.526 11.165 7.856 1.00 0.21 H new ATOM 0 HD3 LYS A 51 4.756 12.714 7.570 1.00 0.21 H new ATOM 0 HE2 LYS A 51 2.537 11.578 7.443 1.00 0.61 H new ATOM 0 HE3 LYS A 51 3.314 10.038 7.755 1.00 0.61 H new ATOM 0 HZ1 LYS A 51 2.387 10.976 9.770 1.00 1.40 H new ATOM 0 HZ2 LYS A 51 4.078 10.888 9.896 1.00 1.40 H new ATOM 0 HZ3 LYS A 51 3.325 12.380 9.594 1.00 1.40 H new ATOM 850 N SER A 52 8.566 11.413 3.354 1.00 0.12 N ATOM 851 CA SER A 52 9.898 11.796 2.904 1.00 0.15 C ATOM 852 C SER A 52 9.881 12.103 1.410 1.00 0.14 C ATOM 853 O SER A 52 10.719 12.852 0.907 1.00 0.16 O ATOM 854 CB SER A 52 10.907 10.686 3.199 1.00 0.17 C ATOM 855 OG SER A 52 12.206 11.047 2.762 1.00 1.23 O ATOM 0 H SER A 52 8.498 10.460 3.710 1.00 0.12 H new ATOM 0 HA SER A 52 10.200 12.692 3.447 1.00 0.15 H new ATOM 0 HB2 SER A 52 10.924 10.481 4.269 1.00 0.17 H new ATOM 0 HB3 SER A 52 10.596 9.766 2.703 1.00 0.17 H new ATOM 0 HG SER A 52 12.833 10.321 2.964 1.00 1.23 H new ATOM 861 N LEU A 53 8.915 11.518 0.706 1.00 0.12 N ATOM 862 CA LEU A 53 8.769 11.731 -0.728 1.00 0.12 C ATOM 863 C LEU A 53 7.857 12.919 -1.008 1.00 0.12 C ATOM 864 O LEU A 53 7.386 13.094 -2.129 1.00 0.15 O ATOM 865 CB LEU A 53 8.170 10.490 -1.386 1.00 0.13 C ATOM 866 CG LEU A 53 8.935 9.191 -1.157 1.00 0.12 C ATOM 867 CD1 LEU A 53 8.167 8.021 -1.748 1.00 0.13 C ATOM 868 CD2 LEU A 53 10.326 9.281 -1.759 1.00 0.14 C ATOM 0 H LEU A 53 8.220 10.890 1.109 1.00 0.12 H new ATOM 0 HA LEU A 53 9.759 11.930 -1.139 1.00 0.12 H new ATOM 0 HB2 LEU A 53 7.152 10.361 -1.019 1.00 0.13 H new ATOM 0 HB3 LEU A 53 8.102 10.667 -2.459 1.00 0.13 H new ATOM 0 HG LEU A 53 9.039 9.029 -0.084 1.00 0.12 H new ATOM 0 HD11 LEU A 53 8.722 7.099 -1.579 1.00 0.13 H new ATOM 0 HD12 LEU A 53 7.190 7.949 -1.271 1.00 0.13 H new ATOM 0 HD13 LEU A 53 8.037 8.175 -2.819 1.00 0.13 H new ATOM 0 HD21 LEU A 53 10.858 8.346 -1.587 1.00 0.14 H new ATOM 0 HD22 LEU A 53 10.247 9.462 -2.831 1.00 0.14 H new ATOM 0 HD23 LEU A 53 10.872 10.101 -1.292 1.00 0.14 H new ATOM 880 N GLU A 54 7.613 13.743 0.003 1.00 0.12 N ATOM 881 CA GLU A 54 6.723 14.878 -0.158 1.00 0.13 C ATOM 882 C GLU A 54 5.311 14.384 -0.461 1.00 0.11 C ATOM 883 O GLU A 54 4.477 15.125 -0.983 1.00 0.13 O ATOM 884 CB GLU A 54 7.220 15.787 -1.280 1.00 0.17 C ATOM 885 CG GLU A 54 8.667 16.209 -1.113 1.00 0.23 C ATOM 886 CD GLU A 54 9.145 17.118 -2.227 1.00 0.63 C ATOM 887 OE1 GLU A 54 8.999 18.351 -2.091 1.00 0.59 O ATOM 888 OE2 GLU A 54 9.664 16.597 -3.236 1.00 1.14 O ATOM 0 H GLU A 54 8.017 13.646 0.935 1.00 0.12 H new ATOM 0 HA GLU A 54 6.708 15.453 0.768 1.00 0.13 H new ATOM 0 HB2 GLU A 54 7.107 15.271 -2.233 1.00 0.17 H new ATOM 0 HB3 GLU A 54 6.592 16.677 -1.323 1.00 0.17 H new ATOM 0 HG2 GLU A 54 8.784 16.720 -0.157 1.00 0.23 H new ATOM 0 HG3 GLU A 54 9.298 15.321 -1.079 1.00 0.23 H new ATOM 895 N LEU A 55 5.055 13.118 -0.127 1.00 0.11 N ATOM 896 CA LEU A 55 3.761 12.499 -0.354 1.00 0.13 C ATOM 897 C LEU A 55 3.011 12.356 0.964 1.00 0.17 C ATOM 898 O LEU A 55 3.541 11.816 1.934 1.00 0.33 O ATOM 899 CB LEU A 55 3.956 11.127 -1.000 1.00 0.20 C ATOM 900 CG LEU A 55 2.712 10.244 -1.054 1.00 0.38 C ATOM 901 CD1 LEU A 55 1.765 10.722 -2.143 1.00 0.69 C ATOM 902 CD2 LEU A 55 3.107 8.791 -1.278 1.00 0.72 C ATOM 0 H LEU A 55 5.741 12.500 0.307 1.00 0.11 H new ATOM 0 HA LEU A 55 3.174 13.129 -1.022 1.00 0.13 H new ATOM 0 HB2 LEU A 55 4.322 11.272 -2.016 1.00 0.20 H new ATOM 0 HB3 LEU A 55 4.735 10.595 -0.454 1.00 0.20 H new ATOM 0 HG LEU A 55 2.191 10.315 -0.099 1.00 0.38 H new ATOM 0 HD11 LEU A 55 0.884 10.080 -2.166 1.00 0.69 H new ATOM 0 HD12 LEU A 55 1.461 11.748 -1.936 1.00 0.69 H new ATOM 0 HD13 LEU A 55 2.270 10.681 -3.108 1.00 0.69 H new ATOM 0 HD21 LEU A 55 2.211 8.172 -1.315 1.00 0.72 H new ATOM 0 HD22 LEU A 55 3.648 8.702 -2.220 1.00 0.72 H new ATOM 0 HD23 LEU A 55 3.745 8.457 -0.460 1.00 0.72 H new ATOM 914 N LYS A 56 1.777 12.841 0.996 1.00 0.15 N ATOM 915 CA LYS A 56 0.968 12.774 2.203 1.00 0.16 C ATOM 916 C LYS A 56 0.441 11.364 2.433 1.00 0.16 C ATOM 917 O LYS A 56 0.024 10.682 1.499 1.00 0.20 O ATOM 918 CB LYS A 56 -0.202 13.756 2.120 1.00 0.18 C ATOM 919 CG LYS A 56 -1.035 13.812 3.391 1.00 0.61 C ATOM 920 CD LYS A 56 -2.237 14.730 3.236 1.00 0.62 C ATOM 921 CE LYS A 56 -3.140 14.677 4.459 1.00 1.18 C ATOM 922 NZ LYS A 56 -4.383 15.475 4.268 1.00 1.86 N ATOM 0 H LYS A 56 1.316 13.284 0.201 1.00 0.15 H new ATOM 0 HA LYS A 56 1.605 13.047 3.044 1.00 0.16 H new ATOM 0 HB2 LYS A 56 0.184 14.752 1.903 1.00 0.18 H new ATOM 0 HB3 LYS A 56 -0.844 13.475 1.286 1.00 0.18 H new ATOM 0 HG2 LYS A 56 -1.374 12.809 3.648 1.00 0.61 H new ATOM 0 HG3 LYS A 56 -0.415 14.160 4.217 1.00 0.61 H new ATOM 0 HD2 LYS A 56 -1.897 15.753 3.078 1.00 0.62 H new ATOM 0 HD3 LYS A 56 -2.804 14.442 2.351 1.00 0.62 H new ATOM 0 HE2 LYS A 56 -3.403 13.641 4.671 1.00 1.18 H new ATOM 0 HE3 LYS A 56 -2.598 15.052 5.327 1.00 1.18 H new ATOM 0 HZ1 LYS A 56 -4.971 15.413 5.124 1.00 1.86 H new ATOM 0 HZ2 LYS A 56 -4.134 16.469 4.091 1.00 1.86 H new ATOM 0 HZ3 LYS A 56 -4.914 15.101 3.456 1.00 1.86 H new ATOM 936 N VAL A 57 0.478 10.933 3.684 1.00 0.14 N ATOM 937 CA VAL A 57 -0.008 9.614 4.058 1.00 0.14 C ATOM 938 C VAL A 57 -0.522 9.630 5.490 1.00 0.15 C ATOM 939 O VAL A 57 -0.073 10.437 6.305 1.00 0.15 O ATOM 940 CB VAL A 57 1.091 8.547 3.920 1.00 0.12 C ATOM 941 CG1 VAL A 57 1.597 8.487 2.487 1.00 0.12 C ATOM 942 CG2 VAL A 57 2.231 8.829 4.884 1.00 0.13 C ATOM 0 H VAL A 57 0.842 11.482 4.463 1.00 0.14 H new ATOM 0 HA VAL A 57 -0.821 9.358 3.378 1.00 0.14 H new ATOM 0 HB VAL A 57 0.665 7.576 4.172 1.00 0.12 H new ATOM 0 HG11 VAL A 57 2.374 7.727 2.407 1.00 0.12 H new ATOM 0 HG12 VAL A 57 0.773 8.234 1.820 1.00 0.12 H new ATOM 0 HG13 VAL A 57 2.007 9.457 2.205 1.00 0.12 H new ATOM 0 HG21 VAL A 57 2.999 8.064 4.772 1.00 0.13 H new ATOM 0 HG22 VAL A 57 2.659 9.808 4.665 1.00 0.13 H new ATOM 0 HG23 VAL A 57 1.854 8.818 5.907 1.00 0.13 H new ATOM 952 N LYS A 58 -1.454 8.736 5.801 1.00 0.17 N ATOM 953 CA LYS A 58 -2.023 8.685 7.143 1.00 0.20 C ATOM 954 C LYS A 58 -2.623 7.320 7.453 1.00 0.16 C ATOM 955 O LYS A 58 -3.561 6.877 6.790 1.00 0.18 O ATOM 956 CB LYS A 58 -3.104 9.756 7.297 1.00 0.26 C ATOM 957 CG LYS A 58 -2.574 11.177 7.230 1.00 0.63 C ATOM 958 CD LYS A 58 -1.604 11.465 8.364 1.00 1.21 C ATOM 959 CE LYS A 58 -2.304 11.438 9.714 1.00 1.69 C ATOM 960 NZ LYS A 58 -3.382 12.463 9.802 1.00 2.33 N ATOM 0 H LYS A 58 -1.828 8.044 5.151 1.00 0.17 H new ATOM 0 HA LYS A 58 -1.211 8.869 7.847 1.00 0.20 H new ATOM 0 HB2 LYS A 58 -3.851 9.620 6.515 1.00 0.26 H new ATOM 0 HB3 LYS A 58 -3.611 9.612 8.251 1.00 0.26 H new ATOM 0 HG2 LYS A 58 -2.075 11.335 6.274 1.00 0.63 H new ATOM 0 HG3 LYS A 58 -3.406 11.879 7.275 1.00 0.63 H new ATOM 0 HD2 LYS A 58 -0.801 10.728 8.354 1.00 1.21 H new ATOM 0 HD3 LYS A 58 -1.143 12.441 8.211 1.00 1.21 H new ATOM 0 HE2 LYS A 58 -2.729 10.449 9.883 1.00 1.69 H new ATOM 0 HE3 LYS A 58 -1.574 11.610 10.505 1.00 1.69 H new ATOM 0 HZ1 LYS A 58 -3.648 12.602 10.798 1.00 2.33 H new ATOM 0 HZ2 LYS A 58 -3.040 13.362 9.406 1.00 2.33 H new ATOM 0 HZ3 LYS A 58 -4.212 12.141 9.264 1.00 2.33 H new ATOM 974 N GLN A 59 -2.078 6.658 8.467 1.00 0.15 N ATOM 975 CA GLN A 59 -2.581 5.362 8.885 1.00 0.13 C ATOM 976 C GLN A 59 -3.614 5.540 9.986 1.00 0.13 C ATOM 977 O GLN A 59 -3.327 6.131 11.027 1.00 0.16 O ATOM 978 CB GLN A 59 -1.446 4.471 9.385 1.00 0.16 C ATOM 979 CG GLN A 59 -1.915 3.083 9.793 1.00 0.20 C ATOM 980 CD GLN A 59 -1.731 2.801 11.273 1.00 0.44 C ATOM 981 OE1 GLN A 59 -1.440 1.671 11.666 1.00 1.13 O ATOM 982 NE2 GLN A 59 -1.919 3.817 12.107 1.00 0.36 N ATOM 0 H GLN A 59 -1.287 7.001 9.013 1.00 0.15 H new ATOM 0 HA GLN A 59 -3.044 4.881 8.023 1.00 0.13 H new ATOM 0 HB2 GLN A 59 -0.693 4.378 8.603 1.00 0.16 H new ATOM 0 HB3 GLN A 59 -0.964 4.950 10.237 1.00 0.16 H new ATOM 0 HG2 GLN A 59 -2.969 2.973 9.537 1.00 0.20 H new ATOM 0 HG3 GLN A 59 -1.367 2.337 9.217 1.00 0.20 H new ATOM 0 HE21 GLN A 59 -2.159 4.739 11.742 1.00 0.36 H new ATOM 0 HE22 GLN A 59 -1.823 3.676 13.113 1.00 0.36 H new ATOM 991 N VAL A 60 -4.814 5.035 9.753 1.00 0.13 N ATOM 992 CA VAL A 60 -5.884 5.154 10.731 1.00 0.16 C ATOM 993 C VAL A 60 -6.774 3.920 10.726 1.00 0.15 C ATOM 994 O VAL A 60 -6.870 3.213 9.724 1.00 0.18 O ATOM 995 CB VAL A 60 -6.742 6.407 10.463 1.00 0.20 C ATOM 996 CG1 VAL A 60 -7.271 6.395 9.037 1.00 0.22 C ATOM 997 CG2 VAL A 60 -7.883 6.507 11.464 1.00 0.23 C ATOM 0 H VAL A 60 -5.072 4.541 8.899 1.00 0.13 H new ATOM 0 HA VAL A 60 -5.416 5.247 11.711 1.00 0.16 H new ATOM 0 HB VAL A 60 -6.111 7.287 10.586 1.00 0.20 H new ATOM 0 HG11 VAL A 60 -7.874 7.286 8.865 1.00 0.22 H new ATOM 0 HG12 VAL A 60 -6.434 6.383 8.339 1.00 0.22 H new ATOM 0 HG13 VAL A 60 -7.884 5.507 8.884 1.00 0.22 H new ATOM 0 HG21 VAL A 60 -8.474 7.399 11.254 1.00 0.23 H new ATOM 0 HG22 VAL A 60 -8.517 5.624 11.382 1.00 0.23 H new ATOM 0 HG23 VAL A 60 -7.477 6.570 12.474 1.00 0.23 H new ATOM 1007 N LYS A 61 -7.420 3.665 11.857 1.00 0.19 N ATOM 1008 CA LYS A 61 -8.307 2.522 11.983 1.00 0.20 C ATOM 1009 C LYS A 61 -9.660 2.843 11.372 1.00 0.21 C ATOM 1010 O LYS A 61 -10.437 3.618 11.928 1.00 0.23 O ATOM 1011 CB LYS A 61 -8.472 2.132 13.450 1.00 0.23 C ATOM 1012 CG LYS A 61 -9.236 0.835 13.648 1.00 0.28 C ATOM 1013 CD LYS A 61 -9.451 0.536 15.123 1.00 0.37 C ATOM 1014 CE LYS A 61 -10.192 -0.776 15.327 1.00 1.05 C ATOM 1015 NZ LYS A 61 -10.444 -1.052 16.768 1.00 2.03 N ATOM 0 H LYS A 61 -7.344 4.236 12.699 1.00 0.19 H new ATOM 0 HA LYS A 61 -7.867 1.680 11.448 1.00 0.20 H new ATOM 0 HB2 LYS A 61 -7.486 2.037 13.906 1.00 0.23 H new ATOM 0 HB3 LYS A 61 -8.991 2.934 13.975 1.00 0.23 H new ATOM 0 HG2 LYS A 61 -10.200 0.899 13.144 1.00 0.28 H new ATOM 0 HG3 LYS A 61 -8.688 0.014 13.185 1.00 0.28 H new ATOM 0 HD2 LYS A 61 -8.487 0.493 15.630 1.00 0.37 H new ATOM 0 HD3 LYS A 61 -10.016 1.348 15.581 1.00 0.37 H new ATOM 0 HE2 LYS A 61 -11.141 -0.744 14.792 1.00 1.05 H new ATOM 0 HE3 LYS A 61 -9.611 -1.592 14.897 1.00 1.05 H new ATOM 0 HZ1 LYS A 61 -10.951 -1.955 16.865 1.00 2.03 H new ATOM 0 HZ2 LYS A 61 -9.537 -1.108 17.275 1.00 2.03 H new ATOM 0 HZ3 LYS A 61 -11.020 -0.286 17.173 1.00 2.03 H new ATOM 1029 N LYS A 62 -9.934 2.242 10.225 1.00 0.20 N ATOM 1030 CA LYS A 62 -11.186 2.473 9.525 1.00 0.22 C ATOM 1031 C LYS A 62 -11.900 1.163 9.237 1.00 0.23 C ATOM 1032 O LYS A 62 -11.270 0.166 8.886 1.00 0.38 O ATOM 1033 CB LYS A 62 -10.918 3.213 8.217 1.00 0.23 C ATOM 1034 CG LYS A 62 -9.945 4.368 8.374 1.00 0.30 C ATOM 1035 CD LYS A 62 -10.534 5.475 9.232 1.00 0.50 C ATOM 1036 CE LYS A 62 -11.682 6.178 8.524 1.00 0.75 C ATOM 1037 NZ LYS A 62 -12.233 7.297 9.336 1.00 1.04 N ATOM 0 H LYS A 62 -9.304 1.589 9.759 1.00 0.20 H new ATOM 0 HA LYS A 62 -11.828 3.080 10.164 1.00 0.22 H new ATOM 0 HB2 LYS A 62 -10.523 2.510 7.483 1.00 0.23 H new ATOM 0 HB3 LYS A 62 -11.860 3.591 7.821 1.00 0.23 H new ATOM 0 HG2 LYS A 62 -9.020 4.008 8.826 1.00 0.30 H new ATOM 0 HG3 LYS A 62 -9.687 4.765 7.392 1.00 0.30 H new ATOM 0 HD2 LYS A 62 -10.888 5.057 10.174 1.00 0.50 H new ATOM 0 HD3 LYS A 62 -9.757 6.200 9.476 1.00 0.50 H new ATOM 0 HE2 LYS A 62 -11.336 6.562 7.564 1.00 0.75 H new ATOM 0 HE3 LYS A 62 -12.473 5.459 8.313 1.00 0.75 H new ATOM 0 HZ1 LYS A 62 -13.013 7.750 8.819 1.00 1.04 H new ATOM 0 HZ2 LYS A 62 -12.587 6.927 10.242 1.00 1.04 H new ATOM 0 HZ3 LYS A 62 -11.485 7.996 9.516 1.00 1.04 H new ATOM 1051 N THR A 63 -13.217 1.169 9.386 1.00 0.17 N ATOM 1052 CA THR A 63 -14.009 -0.020 9.127 1.00 0.15 C ATOM 1053 C THR A 63 -14.187 -0.221 7.631 1.00 0.13 C ATOM 1054 O THR A 63 -14.252 0.744 6.870 1.00 0.15 O ATOM 1055 CB THR A 63 -15.394 0.052 9.797 1.00 0.20 C ATOM 1056 OG1 THR A 63 -16.130 1.166 9.281 1.00 0.24 O ATOM 1057 CG2 THR A 63 -15.258 0.185 11.307 1.00 0.24 C ATOM 0 H THR A 63 -13.756 1.982 9.684 1.00 0.17 H new ATOM 0 HA THR A 63 -13.467 -0.864 9.554 1.00 0.15 H new ATOM 0 HB THR A 63 -15.929 -0.871 9.575 1.00 0.20 H new ATOM 0 HG1 THR A 63 -17.087 0.954 9.280 1.00 0.24 H new ATOM 0 HG21 THR A 63 -16.249 0.234 11.759 1.00 0.24 H new ATOM 0 HG22 THR A 63 -14.722 -0.678 11.701 1.00 0.24 H new ATOM 0 HG23 THR A 63 -14.706 1.094 11.544 1.00 0.24 H new ATOM 1065 N ILE A 64 -14.266 -1.474 7.210 1.00 0.12 N ATOM 1066 CA ILE A 64 -14.425 -1.803 5.799 1.00 0.13 C ATOM 1067 C ILE A 64 -15.460 -0.908 5.121 1.00 0.17 C ATOM 1068 O ILE A 64 -15.221 -0.373 4.038 1.00 0.21 O ATOM 1069 CB ILE A 64 -14.837 -3.273 5.625 1.00 0.15 C ATOM 1070 CG1 ILE A 64 -13.807 -4.189 6.282 1.00 0.16 C ATOM 1071 CG2 ILE A 64 -14.996 -3.612 4.155 1.00 0.20 C ATOM 1072 CD1 ILE A 64 -14.031 -5.654 5.992 1.00 0.20 C ATOM 0 H ILE A 64 -14.222 -2.284 7.828 1.00 0.12 H new ATOM 0 HA ILE A 64 -13.458 -1.636 5.324 1.00 0.13 H new ATOM 0 HB ILE A 64 -15.799 -3.426 6.114 1.00 0.15 H new ATOM 0 HG12 ILE A 64 -12.811 -3.907 5.940 1.00 0.16 H new ATOM 0 HG13 ILE A 64 -13.829 -4.033 7.361 1.00 0.16 H new ATOM 0 HG21 ILE A 64 -15.288 -4.657 4.052 1.00 0.20 H new ATOM 0 HG22 ILE A 64 -15.764 -2.976 3.716 1.00 0.20 H new ATOM 0 HG23 ILE A 64 -14.050 -3.447 3.639 1.00 0.20 H new ATOM 0 HD11 ILE A 64 -13.263 -6.245 6.490 1.00 0.20 H new ATOM 0 HD12 ILE A 64 -15.013 -5.952 6.359 1.00 0.20 H new ATOM 0 HD13 ILE A 64 -13.979 -5.824 4.917 1.00 0.20 H new ATOM 1084 N ASP A 65 -16.602 -0.744 5.772 1.00 0.21 N ATOM 1085 CA ASP A 65 -17.679 0.077 5.231 1.00 0.26 C ATOM 1086 C ASP A 65 -17.205 1.502 4.958 1.00 0.24 C ATOM 1087 O ASP A 65 -17.826 2.232 4.184 1.00 0.27 O ATOM 1088 CB ASP A 65 -18.866 0.095 6.195 1.00 0.33 C ATOM 1089 CG ASP A 65 -18.506 0.676 7.547 1.00 1.34 C ATOM 1090 OD1 ASP A 65 -18.551 1.916 7.693 1.00 2.08 O ATOM 1091 OD2 ASP A 65 -18.178 -0.109 8.462 1.00 1.99 O ATOM 0 H ASP A 65 -16.808 -1.168 6.676 1.00 0.21 H new ATOM 0 HA ASP A 65 -17.993 -0.363 4.284 1.00 0.26 H new ATOM 0 HB2 ASP A 65 -19.677 0.677 5.757 1.00 0.33 H new ATOM 0 HB3 ASP A 65 -19.238 -0.921 6.327 1.00 0.33 H new ATOM 1096 N ARG A 66 -16.106 1.895 5.595 1.00 0.20 N ATOM 1097 CA ARG A 66 -15.561 3.235 5.411 1.00 0.20 C ATOM 1098 C ARG A 66 -14.588 3.271 4.239 1.00 0.15 C ATOM 1099 O ARG A 66 -14.445 4.293 3.569 1.00 0.14 O ATOM 1100 CB ARG A 66 -14.855 3.702 6.685 1.00 0.24 C ATOM 1101 CG ARG A 66 -15.797 3.941 7.854 1.00 0.71 C ATOM 1102 CD ARG A 66 -16.878 4.947 7.505 1.00 0.66 C ATOM 1103 NE ARG A 66 -17.725 5.258 8.654 1.00 1.54 N ATOM 1104 CZ ARG A 66 -18.750 6.101 8.604 1.00 1.70 C ATOM 1105 NH1 ARG A 66 -19.055 6.712 7.467 1.00 0.95 N ATOM 1106 NH2 ARG A 66 -19.474 6.331 9.693 1.00 2.72 N ATOM 0 H ARG A 66 -15.578 1.307 6.240 1.00 0.20 H new ATOM 0 HA ARG A 66 -16.390 3.908 5.194 1.00 0.20 H new ATOM 0 HB2 ARG A 66 -14.114 2.956 6.973 1.00 0.24 H new ATOM 0 HB3 ARG A 66 -14.313 4.624 6.472 1.00 0.24 H new ATOM 0 HG2 ARG A 66 -16.258 2.998 8.149 1.00 0.71 H new ATOM 0 HG3 ARG A 66 -15.229 4.300 8.712 1.00 0.71 H new ATOM 0 HD2 ARG A 66 -16.416 5.863 7.136 1.00 0.66 H new ATOM 0 HD3 ARG A 66 -17.494 4.553 6.697 1.00 0.66 H new ATOM 0 HE ARG A 66 -17.518 4.803 9.543 1.00 1.54 H new ATOM 0 HH11 ARG A 66 -18.502 6.535 6.629 1.00 0.95 H new ATOM 0 HH12 ARG A 66 -19.843 7.359 7.431 1.00 0.95 H new ATOM 0 HH21 ARG A 66 -19.243 5.860 10.568 1.00 2.72 H new ATOM 0 HH22 ARG A 66 -20.261 6.978 9.655 1.00 2.72 H new ATOM 1120 N LEU A 67 -13.925 2.147 3.995 1.00 0.13 N ATOM 1121 CA LEU A 67 -12.963 2.046 2.906 1.00 0.11 C ATOM 1122 C LEU A 67 -13.569 2.498 1.587 1.00 0.13 C ATOM 1123 O LEU A 67 -12.854 2.887 0.663 1.00 0.14 O ATOM 1124 CB LEU A 67 -12.456 0.611 2.787 1.00 0.11 C ATOM 1125 CG LEU A 67 -11.203 0.295 3.608 1.00 0.12 C ATOM 1126 CD1 LEU A 67 -11.278 0.931 4.989 1.00 0.12 C ATOM 1127 CD2 LEU A 67 -11.021 -1.206 3.726 1.00 0.15 C ATOM 0 H LEU A 67 -14.037 1.291 4.538 1.00 0.13 H new ATOM 0 HA LEU A 67 -12.126 2.706 3.134 1.00 0.11 H new ATOM 0 HB2 LEU A 67 -13.253 -0.066 3.094 1.00 0.11 H new ATOM 0 HB3 LEU A 67 -12.247 0.402 1.738 1.00 0.11 H new ATOM 0 HG LEU A 67 -10.341 0.716 3.091 1.00 0.12 H new ATOM 0 HD11 LEU A 67 -10.375 0.690 5.550 1.00 0.12 H new ATOM 0 HD12 LEU A 67 -11.364 2.013 4.887 1.00 0.12 H new ATOM 0 HD13 LEU A 67 -12.149 0.546 5.520 1.00 0.12 H new ATOM 0 HD21 LEU A 67 -10.127 -1.419 4.312 1.00 0.15 H new ATOM 0 HD22 LEU A 67 -11.890 -1.640 4.220 1.00 0.15 H new ATOM 0 HD23 LEU A 67 -10.915 -1.639 2.731 1.00 0.15 H new ATOM 1139 N ASN A 68 -14.888 2.441 1.500 1.00 0.15 N ATOM 1140 CA ASN A 68 -15.581 2.855 0.293 1.00 0.19 C ATOM 1141 C ASN A 68 -15.581 4.381 0.159 1.00 0.19 C ATOM 1142 O ASN A 68 -15.874 4.916 -0.908 1.00 0.22 O ATOM 1143 CB ASN A 68 -17.017 2.328 0.312 1.00 0.25 C ATOM 1144 CG ASN A 68 -17.695 2.422 -1.041 1.00 0.88 C ATOM 1145 OD1 ASN A 68 -17.379 3.292 -1.852 1.00 1.69 O ATOM 1146 ND2 ASN A 68 -18.637 1.521 -1.291 1.00 0.83 N ATOM 0 H ASN A 68 -15.498 2.113 2.249 1.00 0.15 H new ATOM 0 HA ASN A 68 -15.056 2.438 -0.567 1.00 0.19 H new ATOM 0 HB2 ASN A 68 -17.013 1.289 0.640 1.00 0.25 H new ATOM 0 HB3 ASN A 68 -17.596 2.891 1.044 1.00 0.25 H new ATOM 0 HD21 ASN A 68 -19.130 1.533 -2.184 1.00 0.83 H new ATOM 0 HD22 ASN A 68 -18.868 0.817 -0.590 1.00 0.83 H new ATOM 1153 N PHE A 69 -15.240 5.079 1.244 1.00 0.17 N ATOM 1154 CA PHE A 69 -15.223 6.539 1.230 1.00 0.18 C ATOM 1155 C PHE A 69 -13.841 7.108 1.559 1.00 0.15 C ATOM 1156 O PHE A 69 -13.636 8.320 1.482 1.00 0.18 O ATOM 1157 CB PHE A 69 -16.254 7.080 2.221 1.00 0.22 C ATOM 1158 CG PHE A 69 -17.601 6.431 2.090 1.00 0.25 C ATOM 1159 CD1 PHE A 69 -18.551 6.937 1.216 1.00 0.32 C ATOM 1160 CD2 PHE A 69 -17.915 5.310 2.840 1.00 0.27 C ATOM 1161 CE1 PHE A 69 -19.788 6.334 1.094 1.00 0.36 C ATOM 1162 CE2 PHE A 69 -19.150 4.704 2.722 1.00 0.31 C ATOM 1163 CZ PHE A 69 -20.088 5.216 1.848 1.00 0.34 C ATOM 0 H PHE A 69 -14.974 4.660 2.135 1.00 0.17 H new ATOM 0 HA PHE A 69 -15.475 6.857 0.218 1.00 0.18 H new ATOM 0 HB2 PHE A 69 -15.885 6.932 3.236 1.00 0.22 H new ATOM 0 HB3 PHE A 69 -16.360 8.155 2.074 1.00 0.22 H new ATOM 0 HD1 PHE A 69 -18.322 7.811 0.625 1.00 0.32 H new ATOM 0 HD2 PHE A 69 -17.185 4.905 3.525 1.00 0.27 H new ATOM 0 HE1 PHE A 69 -20.520 6.736 0.410 1.00 0.36 H new ATOM 0 HE2 PHE A 69 -19.382 3.830 3.313 1.00 0.31 H new ATOM 0 HZ PHE A 69 -21.055 4.743 1.754 1.00 0.34 H new ATOM 1173 N ILE A 70 -12.893 6.248 1.924 1.00 0.12 N ATOM 1174 CA ILE A 70 -11.550 6.713 2.262 1.00 0.11 C ATOM 1175 C ILE A 70 -10.771 7.103 1.014 1.00 0.12 C ATOM 1176 O ILE A 70 -11.227 6.895 -0.111 1.00 0.13 O ATOM 1177 CB ILE A 70 -10.743 5.659 3.043 1.00 0.11 C ATOM 1178 CG1 ILE A 70 -10.515 4.416 2.186 1.00 0.11 C ATOM 1179 CG2 ILE A 70 -11.448 5.298 4.342 1.00 0.13 C ATOM 1180 CD1 ILE A 70 -9.731 3.332 2.893 1.00 0.15 C ATOM 0 H ILE A 70 -13.026 5.239 1.993 1.00 0.12 H new ATOM 0 HA ILE A 70 -11.686 7.587 2.899 1.00 0.11 H new ATOM 0 HB ILE A 70 -9.771 6.085 3.292 1.00 0.11 H new ATOM 0 HG12 ILE A 70 -11.480 4.014 1.879 1.00 0.11 H new ATOM 0 HG13 ILE A 70 -9.986 4.703 1.277 1.00 0.11 H new ATOM 0 HG21 ILE A 70 -10.862 4.552 4.879 1.00 0.13 H new ATOM 0 HG22 ILE A 70 -11.553 6.190 4.959 1.00 0.13 H new ATOM 0 HG23 ILE A 70 -12.435 4.893 4.120 1.00 0.13 H new ATOM 0 HD11 ILE A 70 -9.606 2.479 2.226 1.00 0.15 H new ATOM 0 HD12 ILE A 70 -8.751 3.717 3.176 1.00 0.15 H new ATOM 0 HD13 ILE A 70 -10.270 3.018 3.787 1.00 0.15 H new ATOM 1192 N SER A 71 -9.590 7.667 1.226 1.00 0.12 N ATOM 1193 CA SER A 71 -8.738 8.104 0.128 1.00 0.14 C ATOM 1194 C SER A 71 -8.102 6.920 -0.588 1.00 0.13 C ATOM 1195 O SER A 71 -7.053 6.421 -0.179 1.00 0.15 O ATOM 1196 CB SER A 71 -7.650 9.040 0.650 1.00 0.17 C ATOM 1197 OG SER A 71 -6.830 9.511 -0.405 1.00 1.14 O ATOM 0 H SER A 71 -9.198 7.833 2.153 1.00 0.12 H new ATOM 0 HA SER A 71 -9.363 8.637 -0.589 1.00 0.14 H new ATOM 0 HB2 SER A 71 -8.109 9.885 1.163 1.00 0.17 H new ATOM 0 HB3 SER A 71 -7.038 8.516 1.384 1.00 0.17 H new ATOM 0 HG SER A 71 -5.888 9.378 -0.171 1.00 1.14 H new ATOM 1203 N LEU A 72 -8.745 6.478 -1.661 1.00 0.12 N ATOM 1204 CA LEU A 72 -8.241 5.366 -2.455 1.00 0.12 C ATOM 1205 C LEU A 72 -7.354 5.883 -3.588 1.00 0.13 C ATOM 1206 O LEU A 72 -7.552 6.996 -4.075 1.00 0.15 O ATOM 1207 CB LEU A 72 -9.406 4.552 -3.026 1.00 0.13 C ATOM 1208 CG LEU A 72 -9.547 3.131 -2.470 1.00 0.15 C ATOM 1209 CD1 LEU A 72 -9.542 3.144 -0.950 1.00 0.17 C ATOM 1210 CD2 LEU A 72 -10.821 2.484 -2.990 1.00 0.16 C ATOM 0 H LEU A 72 -9.620 6.875 -2.002 1.00 0.12 H new ATOM 0 HA LEU A 72 -7.644 4.720 -1.811 1.00 0.12 H new ATOM 0 HB2 LEU A 72 -10.333 5.093 -2.835 1.00 0.13 H new ATOM 0 HB3 LEU A 72 -9.289 4.491 -4.108 1.00 0.13 H new ATOM 0 HG LEU A 72 -8.693 2.544 -2.809 1.00 0.15 H new ATOM 0 HD11 LEU A 72 -9.643 2.125 -0.577 1.00 0.17 H new ATOM 0 HD12 LEU A 72 -8.604 3.570 -0.593 1.00 0.17 H new ATOM 0 HD13 LEU A 72 -10.375 3.747 -0.589 1.00 0.17 H new ATOM 0 HD21 LEU A 72 -10.908 1.475 -2.587 1.00 0.16 H new ATOM 0 HD22 LEU A 72 -11.682 3.075 -2.678 1.00 0.16 H new ATOM 0 HD23 LEU A 72 -10.788 2.438 -4.079 1.00 0.16 H new ATOM 1222 N PRO A 73 -6.361 5.087 -4.030 1.00 0.13 N ATOM 1223 CA PRO A 73 -6.087 3.754 -3.486 1.00 0.11 C ATOM 1224 C PRO A 73 -5.426 3.818 -2.116 1.00 0.10 C ATOM 1225 O PRO A 73 -4.454 4.546 -1.915 1.00 0.13 O ATOM 1226 CB PRO A 73 -5.137 3.145 -4.514 1.00 0.12 C ATOM 1227 CG PRO A 73 -4.425 4.312 -5.100 1.00 0.19 C ATOM 1228 CD PRO A 73 -5.414 5.447 -5.100 1.00 0.14 C ATOM 0 HA PRO A 73 -6.998 3.175 -3.334 1.00 0.11 H new ATOM 0 HB2 PRO A 73 -4.440 2.449 -4.047 1.00 0.12 H new ATOM 0 HB3 PRO A 73 -5.681 2.588 -5.277 1.00 0.12 H new ATOM 0 HG2 PRO A 73 -3.542 4.565 -4.513 1.00 0.19 H new ATOM 0 HG3 PRO A 73 -4.084 4.093 -6.112 1.00 0.19 H new ATOM 0 HD2 PRO A 73 -4.928 6.402 -4.899 1.00 0.14 H new ATOM 0 HD3 PRO A 73 -5.915 5.541 -6.063 1.00 0.14 H new ATOM 1236 N ALA A 74 -5.960 3.049 -1.177 1.00 0.09 N ATOM 1237 CA ALA A 74 -5.431 3.020 0.180 1.00 0.09 C ATOM 1238 C ALA A 74 -4.596 1.767 0.412 1.00 0.08 C ATOM 1239 O ALA A 74 -4.756 0.765 -0.284 1.00 0.14 O ATOM 1240 CB ALA A 74 -6.566 3.094 1.186 1.00 0.09 C ATOM 0 H ALA A 74 -6.761 2.436 -1.330 1.00 0.09 H new ATOM 0 HA ALA A 74 -4.784 3.887 0.314 1.00 0.09 H new ATOM 0 HB1 ALA A 74 -6.158 3.072 2.197 1.00 0.09 H new ATOM 0 HB2 ALA A 74 -7.122 4.020 1.040 1.00 0.09 H new ATOM 0 HB3 ALA A 74 -7.233 2.244 1.045 1.00 0.09 H new ATOM 1246 N LEU A 75 -3.702 1.829 1.393 1.00 0.07 N ATOM 1247 CA LEU A 75 -2.845 0.694 1.709 1.00 0.07 C ATOM 1248 C LEU A 75 -3.257 0.045 3.024 1.00 0.07 C ATOM 1249 O LEU A 75 -3.084 0.624 4.095 1.00 0.10 O ATOM 1250 CB LEU A 75 -1.385 1.136 1.789 1.00 0.08 C ATOM 1251 CG LEU A 75 -0.424 0.086 2.349 1.00 0.07 C ATOM 1252 CD1 LEU A 75 -0.237 -1.050 1.358 1.00 0.07 C ATOM 1253 CD2 LEU A 75 0.912 0.721 2.700 1.00 0.09 C ATOM 0 H LEU A 75 -3.553 2.650 1.980 1.00 0.07 H new ATOM 0 HA LEU A 75 -2.956 -0.040 0.911 1.00 0.07 H new ATOM 0 HB2 LEU A 75 -1.051 1.418 0.791 1.00 0.08 H new ATOM 0 HB3 LEU A 75 -1.325 2.030 2.409 1.00 0.08 H new ATOM 0 HG LEU A 75 -0.856 -0.326 3.261 1.00 0.07 H new ATOM 0 HD11 LEU A 75 0.450 -1.787 1.774 1.00 0.07 H new ATOM 0 HD12 LEU A 75 -1.199 -1.522 1.160 1.00 0.07 H new ATOM 0 HD13 LEU A 75 0.173 -0.657 0.427 1.00 0.07 H new ATOM 0 HD21 LEU A 75 1.584 -0.040 3.097 1.00 0.09 H new ATOM 0 HD22 LEU A 75 1.352 1.162 1.805 1.00 0.09 H new ATOM 0 HD23 LEU A 75 0.760 1.497 3.450 1.00 0.09 H new ATOM 1265 N VAL A 76 -3.794 -1.164 2.936 1.00 0.06 N ATOM 1266 CA VAL A 76 -4.220 -1.897 4.117 1.00 0.07 C ATOM 1267 C VAL A 76 -3.022 -2.530 4.810 1.00 0.07 C ATOM 1268 O VAL A 76 -2.558 -3.601 4.420 1.00 0.08 O ATOM 1269 CB VAL A 76 -5.238 -2.996 3.761 1.00 0.08 C ATOM 1270 CG1 VAL A 76 -4.672 -3.907 2.689 1.00 0.08 C ATOM 1271 CG2 VAL A 76 -5.631 -3.794 4.996 1.00 0.10 C ATOM 0 H VAL A 76 -3.945 -1.658 2.056 1.00 0.06 H new ATOM 0 HA VAL A 76 -4.698 -1.183 4.788 1.00 0.07 H new ATOM 0 HB VAL A 76 -6.138 -2.519 3.372 1.00 0.08 H new ATOM 0 HG11 VAL A 76 -5.401 -4.680 2.446 1.00 0.08 H new ATOM 0 HG12 VAL A 76 -4.450 -3.323 1.795 1.00 0.08 H new ATOM 0 HG13 VAL A 76 -3.757 -4.373 3.054 1.00 0.08 H new ATOM 0 HG21 VAL A 76 -6.351 -4.564 4.718 1.00 0.10 H new ATOM 0 HG22 VAL A 76 -4.745 -4.263 5.423 1.00 0.10 H new ATOM 0 HG23 VAL A 76 -6.079 -3.127 5.733 1.00 0.10 H new ATOM 1281 N TRP A 77 -2.523 -1.860 5.838 1.00 0.07 N ATOM 1282 CA TRP A 77 -1.373 -2.356 6.574 1.00 0.08 C ATOM 1283 C TRP A 77 -1.648 -3.741 7.142 1.00 0.09 C ATOM 1284 O TRP A 77 -2.686 -3.977 7.763 1.00 0.13 O ATOM 1285 CB TRP A 77 -1.006 -1.396 7.702 1.00 0.10 C ATOM 1286 CG TRP A 77 0.368 -1.629 8.237 1.00 0.09 C ATOM 1287 CD1 TRP A 77 0.700 -2.171 9.444 1.00 0.10 C ATOM 1288 CD2 TRP A 77 1.601 -1.332 7.577 1.00 0.09 C ATOM 1289 NE1 TRP A 77 2.064 -2.225 9.575 1.00 0.11 N ATOM 1290 CE2 TRP A 77 2.640 -1.714 8.442 1.00 0.10 C ATOM 1291 CE3 TRP A 77 1.925 -0.779 6.335 1.00 0.09 C ATOM 1292 CZ2 TRP A 77 3.983 -1.558 8.107 1.00 0.11 C ATOM 1293 CZ3 TRP A 77 3.257 -0.624 6.004 1.00 0.11 C ATOM 1294 CH2 TRP A 77 4.272 -1.014 6.886 1.00 0.12 C ATOM 0 H TRP A 77 -2.896 -0.974 6.180 1.00 0.07 H new ATOM 0 HA TRP A 77 -0.535 -2.425 5.880 1.00 0.08 H new ATOM 0 HB2 TRP A 77 -1.080 -0.371 7.339 1.00 0.10 H new ATOM 0 HB3 TRP A 77 -1.729 -1.501 8.511 1.00 0.10 H new ATOM 0 HD1 TRP A 77 -0.007 -2.508 10.187 1.00 0.10 H new ATOM 0 HE1 TRP A 77 2.568 -2.587 10.385 1.00 0.11 H new ATOM 0 HE3 TRP A 77 1.149 -0.479 5.647 1.00 0.09 H new ATOM 0 HZ2 TRP A 77 4.768 -1.856 8.787 1.00 0.11 H new ATOM 0 HZ3 TRP A 77 3.520 -0.195 5.049 1.00 0.11 H new ATOM 0 HH2 TRP A 77 5.304 -0.883 6.596 1.00 0.12 H new ATOM 1305 N ARG A 78 -0.711 -4.653 6.925 1.00 0.10 N ATOM 1306 CA ARG A 78 -0.844 -6.015 7.417 1.00 0.13 C ATOM 1307 C ARG A 78 0.345 -6.395 8.285 1.00 0.15 C ATOM 1308 O ARG A 78 1.480 -6.455 7.816 1.00 0.17 O ATOM 1309 CB ARG A 78 -0.977 -6.992 6.248 1.00 0.16 C ATOM 1310 CG ARG A 78 -2.349 -6.972 5.596 1.00 0.19 C ATOM 1311 CD ARG A 78 -3.361 -7.767 6.404 1.00 0.30 C ATOM 1312 NE ARG A 78 -3.018 -9.186 6.463 1.00 0.23 N ATOM 1313 CZ ARG A 78 -3.595 -10.048 7.291 1.00 0.33 C ATOM 1314 NH1 ARG A 78 -4.548 -9.642 8.119 1.00 0.79 N ATOM 1315 NH2 ARG A 78 -3.223 -11.322 7.289 1.00 0.38 N ATOM 0 H ARG A 78 0.151 -4.473 6.410 1.00 0.10 H new ATOM 0 HA ARG A 78 -1.746 -6.070 8.027 1.00 0.13 H new ATOM 0 HB2 ARG A 78 -0.223 -6.754 5.498 1.00 0.16 H new ATOM 0 HB3 ARG A 78 -0.766 -8.001 6.602 1.00 0.16 H new ATOM 0 HG2 ARG A 78 -2.690 -5.942 5.496 1.00 0.19 H new ATOM 0 HG3 ARG A 78 -2.281 -7.384 4.589 1.00 0.19 H new ATOM 0 HD2 ARG A 78 -3.415 -7.364 7.415 1.00 0.30 H new ATOM 0 HD3 ARG A 78 -4.350 -7.651 5.962 1.00 0.30 H new ATOM 0 HE ARG A 78 -2.295 -9.533 5.833 1.00 0.23 H new ATOM 0 HH11 ARG A 78 -4.840 -8.665 8.121 1.00 0.79 H new ATOM 0 HH12 ARG A 78 -4.989 -10.307 8.754 1.00 0.79 H new ATOM 0 HH21 ARG A 78 -2.493 -11.639 6.651 1.00 0.38 H new ATOM 0 HH22 ARG A 78 -3.667 -11.984 7.926 1.00 0.38 H new ATOM 1329 N GLU A 79 0.069 -6.651 9.554 1.00 0.17 N ATOM 1330 CA GLU A 79 1.106 -7.031 10.502 1.00 0.20 C ATOM 1331 C GLU A 79 1.725 -8.374 10.131 1.00 0.23 C ATOM 1332 O GLU A 79 2.797 -8.728 10.624 1.00 0.28 O ATOM 1333 CB GLU A 79 0.531 -7.097 11.914 1.00 0.21 C ATOM 1334 CG GLU A 79 -0.053 -5.780 12.393 1.00 0.28 C ATOM 1335 CD GLU A 79 -0.564 -5.853 13.818 1.00 0.86 C ATOM 1336 OE1 GLU A 79 0.244 -5.660 14.749 1.00 1.13 O ATOM 1337 OE2 GLU A 79 -1.774 -6.105 14.002 1.00 1.75 O ATOM 0 H GLU A 79 -0.868 -6.602 9.953 1.00 0.17 H new ATOM 0 HA GLU A 79 1.888 -6.272 10.467 1.00 0.20 H new ATOM 0 HB2 GLU A 79 -0.245 -7.862 11.946 1.00 0.21 H new ATOM 0 HB3 GLU A 79 1.316 -7.409 12.603 1.00 0.21 H new ATOM 0 HG2 GLU A 79 0.708 -5.003 12.323 1.00 0.28 H new ATOM 0 HG3 GLU A 79 -0.869 -5.487 11.733 1.00 0.28 H new ATOM 1344 N ASP A 80 1.050 -9.121 9.262 1.00 0.24 N ATOM 1345 CA ASP A 80 1.544 -10.422 8.836 1.00 0.32 C ATOM 1346 C ASP A 80 2.600 -10.287 7.739 1.00 0.35 C ATOM 1347 O ASP A 80 3.146 -11.285 7.271 1.00 0.45 O ATOM 1348 CB ASP A 80 0.388 -11.290 8.339 1.00 0.34 C ATOM 1349 CG ASP A 80 0.841 -12.671 7.909 1.00 1.29 C ATOM 1350 OD1 ASP A 80 0.896 -13.573 8.771 1.00 1.86 O ATOM 1351 OD2 ASP A 80 1.141 -12.851 6.710 1.00 2.00 O ATOM 0 H ASP A 80 0.162 -8.847 8.841 1.00 0.24 H new ATOM 0 HA ASP A 80 2.010 -10.899 9.699 1.00 0.32 H new ATOM 0 HB2 ASP A 80 -0.356 -11.385 9.130 1.00 0.34 H new ATOM 0 HB3 ASP A 80 -0.100 -10.794 7.500 1.00 0.34 H new ATOM 1356 N GLY A 81 2.890 -9.050 7.330 1.00 0.32 N ATOM 1357 CA GLY A 81 3.877 -8.835 6.290 1.00 0.40 C ATOM 1358 C GLY A 81 3.325 -9.149 4.917 1.00 0.45 C ATOM 1359 O GLY A 81 4.064 -9.528 4.009 1.00 0.82 O ATOM 0 H GLY A 81 2.461 -8.202 7.700 1.00 0.32 H new ATOM 0 HA2 GLY A 81 4.214 -7.799 6.318 1.00 0.40 H new ATOM 0 HA3 GLY A 81 4.749 -9.459 6.482 1.00 0.40 H new ATOM 1363 N ARG A 82 2.014 -8.999 4.776 1.00 0.18 N ATOM 1364 CA ARG A 82 1.335 -9.260 3.516 1.00 0.18 C ATOM 1365 C ARG A 82 0.301 -8.177 3.252 1.00 0.14 C ATOM 1366 O ARG A 82 -0.903 -8.437 3.255 1.00 0.17 O ATOM 1367 CB ARG A 82 0.657 -10.627 3.560 1.00 0.22 C ATOM 1368 CG ARG A 82 1.603 -11.755 3.926 1.00 0.29 C ATOM 1369 CD ARG A 82 2.389 -12.235 2.719 1.00 0.60 C ATOM 1370 NE ARG A 82 3.345 -13.285 3.064 1.00 0.96 N ATOM 1371 CZ ARG A 82 4.149 -13.866 2.179 1.00 1.46 C ATOM 1372 NH1 ARG A 82 4.118 -13.494 0.907 1.00 1.68 N ATOM 1373 NH2 ARG A 82 4.985 -14.820 2.566 1.00 1.85 N ATOM 0 H ARG A 82 1.396 -8.695 5.528 1.00 0.18 H new ATOM 0 HA ARG A 82 2.069 -9.256 2.711 1.00 0.18 H new ATOM 0 HB2 ARG A 82 -0.158 -10.597 4.283 1.00 0.22 H new ATOM 0 HB3 ARG A 82 0.213 -10.836 2.587 1.00 0.22 H new ATOM 0 HG2 ARG A 82 2.292 -11.417 4.700 1.00 0.29 H new ATOM 0 HG3 ARG A 82 1.036 -12.586 4.346 1.00 0.29 H new ATOM 0 HD2 ARG A 82 1.698 -12.609 1.963 1.00 0.60 H new ATOM 0 HD3 ARG A 82 2.921 -11.393 2.276 1.00 0.60 H new ATOM 0 HE ARG A 82 3.398 -13.588 4.036 1.00 0.96 H new ATOM 0 HH11 ARG A 82 3.476 -12.761 0.606 1.00 1.68 H new ATOM 0 HH12 ARG A 82 4.736 -13.941 0.230 1.00 1.68 H new ATOM 0 HH21 ARG A 82 5.012 -15.109 3.544 1.00 1.85 H new ATOM 0 HH22 ARG A 82 5.601 -15.265 1.886 1.00 1.85 H new ATOM 1387 N HIS A 83 0.779 -6.963 3.023 1.00 0.11 N ATOM 1388 CA HIS A 83 -0.106 -5.832 2.777 1.00 0.09 C ATOM 1389 C HIS A 83 -0.570 -5.810 1.328 1.00 0.08 C ATOM 1390 O HIS A 83 -0.071 -6.561 0.490 1.00 0.10 O ATOM 1391 CB HIS A 83 0.588 -4.499 3.101 1.00 0.12 C ATOM 1392 CG HIS A 83 1.770 -4.613 4.017 1.00 0.12 C ATOM 1393 ND1 HIS A 83 1.659 -5.157 5.272 1.00 0.22 N ATOM 1394 CD2 HIS A 83 3.054 -4.239 3.807 1.00 0.13 C ATOM 1395 CE1 HIS A 83 2.870 -5.103 5.798 1.00 0.23 C ATOM 1396 NE2 HIS A 83 3.750 -4.554 4.945 1.00 0.15 N ATOM 0 H HIS A 83 1.773 -6.735 3.002 1.00 0.11 H new ATOM 0 HA HIS A 83 -0.969 -5.952 3.432 1.00 0.09 H new ATOM 0 HB2 HIS A 83 0.912 -4.038 2.168 1.00 0.12 H new ATOM 0 HB3 HIS A 83 -0.141 -3.826 3.553 1.00 0.12 H new ATOM 0 HD2 HIS A 83 3.453 -3.781 2.914 1.00 0.13 H new ATOM 0 HE1 HIS A 83 3.120 -5.455 6.788 1.00 0.23 H new ATOM 0 HE2 HIS A 83 4.745 -4.401 5.112 1.00 0.15 H new ATOM 1404 N PHE A 84 -1.533 -4.943 1.045 1.00 0.09 N ATOM 1405 CA PHE A 84 -2.060 -4.792 -0.302 1.00 0.08 C ATOM 1406 C PHE A 84 -2.758 -3.444 -0.444 1.00 0.08 C ATOM 1407 O PHE A 84 -3.270 -2.894 0.529 1.00 0.08 O ATOM 1408 CB PHE A 84 -3.001 -5.945 -0.666 1.00 0.09 C ATOM 1409 CG PHE A 84 -4.134 -6.162 0.299 1.00 0.09 C ATOM 1410 CD1 PHE A 84 -3.993 -7.020 1.379 1.00 0.11 C ATOM 1411 CD2 PHE A 84 -5.347 -5.523 0.111 1.00 0.12 C ATOM 1412 CE1 PHE A 84 -5.043 -7.234 2.253 1.00 0.14 C ATOM 1413 CE2 PHE A 84 -6.397 -5.731 0.983 1.00 0.14 C ATOM 1414 CZ PHE A 84 -6.247 -6.588 2.054 1.00 0.15 C ATOM 0 H PHE A 84 -1.966 -4.331 1.736 1.00 0.09 H new ATOM 0 HA PHE A 84 -1.225 -4.825 -1.002 1.00 0.08 H new ATOM 0 HB2 PHE A 84 -3.416 -5.758 -1.656 1.00 0.09 H new ATOM 0 HB3 PHE A 84 -2.418 -6.864 -0.733 1.00 0.09 H new ATOM 0 HD1 PHE A 84 -3.053 -7.527 1.539 1.00 0.11 H new ATOM 0 HD2 PHE A 84 -5.474 -4.854 -0.727 1.00 0.12 H new ATOM 0 HE1 PHE A 84 -4.922 -7.905 3.090 1.00 0.14 H new ATOM 0 HE2 PHE A 84 -7.337 -5.222 0.827 1.00 0.14 H new ATOM 0 HZ PHE A 84 -7.069 -6.753 2.735 1.00 0.15 H new ATOM 1424 N ILE A 85 -2.774 -2.917 -1.659 1.00 0.09 N ATOM 1425 CA ILE A 85 -3.376 -1.615 -1.915 1.00 0.09 C ATOM 1426 C ILE A 85 -4.823 -1.734 -2.378 1.00 0.08 C ATOM 1427 O ILE A 85 -5.107 -2.331 -3.416 1.00 0.09 O ATOM 1428 CB ILE A 85 -2.569 -0.832 -2.972 1.00 0.11 C ATOM 1429 CG1 ILE A 85 -1.140 -0.598 -2.482 1.00 0.12 C ATOM 1430 CG2 ILE A 85 -3.242 0.493 -3.303 1.00 0.13 C ATOM 1431 CD1 ILE A 85 -0.323 0.281 -3.404 1.00 0.12 C ATOM 0 H ILE A 85 -2.378 -3.369 -2.483 1.00 0.09 H new ATOM 0 HA ILE A 85 -3.360 -1.075 -0.969 1.00 0.09 H new ATOM 0 HB ILE A 85 -2.534 -1.429 -3.883 1.00 0.11 H new ATOM 0 HG12 ILE A 85 -1.174 -0.141 -1.493 1.00 0.12 H new ATOM 0 HG13 ILE A 85 -0.640 -1.560 -2.372 1.00 0.12 H new ATOM 0 HG21 ILE A 85 -2.652 1.024 -4.050 1.00 0.13 H new ATOM 0 HG22 ILE A 85 -4.241 0.305 -3.696 1.00 0.13 H new ATOM 0 HG23 ILE A 85 -3.315 1.100 -2.400 1.00 0.13 H new ATOM 0 HD11 ILE A 85 0.680 0.405 -2.995 1.00 0.12 H new ATOM 0 HD12 ILE A 85 -0.259 -0.184 -4.388 1.00 0.12 H new ATOM 0 HD13 ILE A 85 -0.801 1.257 -3.495 1.00 0.12 H new ATOM 1443 N LEU A 86 -5.731 -1.149 -1.603 1.00 0.08 N ATOM 1444 CA LEU A 86 -7.146 -1.157 -1.941 1.00 0.08 C ATOM 1445 C LEU A 86 -7.428 -0.067 -2.964 1.00 0.08 C ATOM 1446 O LEU A 86 -7.058 1.089 -2.763 1.00 0.10 O ATOM 1447 CB LEU A 86 -7.999 -0.938 -0.688 1.00 0.09 C ATOM 1448 CG LEU A 86 -9.510 -0.976 -0.921 1.00 0.10 C ATOM 1449 CD1 LEU A 86 -9.897 -2.238 -1.671 1.00 0.11 C ATOM 1450 CD2 LEU A 86 -10.260 -0.890 0.402 1.00 0.14 C ATOM 0 H LEU A 86 -5.509 -0.663 -0.734 1.00 0.08 H new ATOM 0 HA LEU A 86 -7.404 -2.127 -2.365 1.00 0.08 H new ATOM 0 HB2 LEU A 86 -7.740 -1.700 0.047 1.00 0.09 H new ATOM 0 HB3 LEU A 86 -7.738 0.027 -0.253 1.00 0.09 H new ATOM 0 HG LEU A 86 -9.787 -0.113 -1.527 1.00 0.10 H new ATOM 0 HD11 LEU A 86 -10.975 -2.251 -1.829 1.00 0.11 H new ATOM 0 HD12 LEU A 86 -9.388 -2.259 -2.635 1.00 0.11 H new ATOM 0 HD13 LEU A 86 -9.605 -3.112 -1.088 1.00 0.11 H new ATOM 0 HD21 LEU A 86 -11.333 -0.919 0.214 1.00 0.14 H new ATOM 0 HD22 LEU A 86 -9.980 -1.732 1.035 1.00 0.14 H new ATOM 0 HD23 LEU A 86 -10.004 0.043 0.905 1.00 0.14 H new ATOM 1462 N THR A 87 -8.076 -0.432 -4.062 1.00 0.08 N ATOM 1463 CA THR A 87 -8.369 0.529 -5.118 1.00 0.09 C ATOM 1464 C THR A 87 -9.865 0.703 -5.346 1.00 0.09 C ATOM 1465 O THR A 87 -10.294 1.667 -5.981 1.00 0.11 O ATOM 1466 CB THR A 87 -7.713 0.106 -6.440 1.00 0.10 C ATOM 1467 OG1 THR A 87 -8.301 -1.112 -6.910 1.00 0.14 O ATOM 1468 CG2 THR A 87 -6.218 -0.086 -6.256 1.00 0.13 C ATOM 0 H THR A 87 -8.407 -1.379 -4.245 1.00 0.08 H new ATOM 0 HA THR A 87 -7.958 1.482 -4.785 1.00 0.09 H new ATOM 0 HB THR A 87 -7.878 0.894 -7.175 1.00 0.10 H new ATOM 0 HG1 THR A 87 -8.548 -1.672 -6.145 1.00 0.14 H new ATOM 0 HG21 THR A 87 -5.770 -0.386 -7.204 1.00 0.13 H new ATOM 0 HG22 THR A 87 -5.769 0.850 -5.922 1.00 0.13 H new ATOM 0 HG23 THR A 87 -6.040 -0.860 -5.510 1.00 0.13 H new ATOM 1476 N LYS A 88 -10.660 -0.230 -4.839 1.00 0.09 N ATOM 1477 CA LYS A 88 -12.103 -0.158 -5.006 1.00 0.10 C ATOM 1478 C LYS A 88 -12.800 -1.263 -4.227 1.00 0.11 C ATOM 1479 O LYS A 88 -12.207 -2.297 -3.923 1.00 0.11 O ATOM 1480 CB LYS A 88 -12.461 -0.250 -6.490 1.00 0.12 C ATOM 1481 CG LYS A 88 -13.949 -0.389 -6.756 1.00 0.16 C ATOM 1482 CD LYS A 88 -14.231 -0.526 -8.243 1.00 0.21 C ATOM 1483 CE LYS A 88 -15.703 -0.796 -8.512 1.00 0.55 C ATOM 1484 NZ LYS A 88 -15.972 -1.005 -9.962 1.00 1.43 N ATOM 0 H LYS A 88 -10.332 -1.040 -4.312 1.00 0.09 H new ATOM 0 HA LYS A 88 -12.446 0.799 -4.613 1.00 0.10 H new ATOM 0 HB2 LYS A 88 -12.093 0.641 -6.999 1.00 0.12 H new ATOM 0 HB3 LYS A 88 -11.942 -1.104 -6.927 1.00 0.12 H new ATOM 0 HG2 LYS A 88 -14.336 -1.261 -6.228 1.00 0.16 H new ATOM 0 HG3 LYS A 88 -14.474 0.481 -6.362 1.00 0.16 H new ATOM 0 HD2 LYS A 88 -13.928 0.386 -8.757 1.00 0.21 H new ATOM 0 HD3 LYS A 88 -13.631 -1.338 -8.654 1.00 0.21 H new ATOM 0 HE2 LYS A 88 -16.019 -1.677 -7.953 1.00 0.55 H new ATOM 0 HE3 LYS A 88 -16.298 0.042 -8.149 1.00 0.55 H new ATOM 0 HZ1 LYS A 88 -16.986 -1.186 -10.104 1.00 1.43 H new ATOM 0 HZ2 LYS A 88 -15.694 -0.155 -10.493 1.00 1.43 H new ATOM 0 HZ3 LYS A 88 -15.424 -1.820 -10.303 1.00 1.43 H new ATOM 1498 N VAL A 89 -14.066 -1.031 -3.903 1.00 0.13 N ATOM 1499 CA VAL A 89 -14.852 -2.001 -3.160 1.00 0.15 C ATOM 1500 C VAL A 89 -16.269 -2.104 -3.717 1.00 0.17 C ATOM 1501 O VAL A 89 -17.006 -1.118 -3.753 1.00 0.20 O ATOM 1502 CB VAL A 89 -14.910 -1.642 -1.660 1.00 0.18 C ATOM 1503 CG1 VAL A 89 -13.511 -1.392 -1.125 1.00 0.18 C ATOM 1504 CG2 VAL A 89 -15.797 -0.430 -1.414 1.00 0.21 C ATOM 0 H VAL A 89 -14.569 -0.177 -4.145 1.00 0.13 H new ATOM 0 HA VAL A 89 -14.359 -2.967 -3.271 1.00 0.15 H new ATOM 0 HB VAL A 89 -15.347 -2.488 -1.128 1.00 0.18 H new ATOM 0 HG11 VAL A 89 -13.566 -1.140 -0.066 1.00 0.18 H new ATOM 0 HG12 VAL A 89 -12.907 -2.290 -1.253 1.00 0.18 H new ATOM 0 HG13 VAL A 89 -13.055 -0.567 -1.671 1.00 0.18 H new ATOM 0 HG21 VAL A 89 -15.816 -0.204 -0.348 1.00 0.21 H new ATOM 0 HG22 VAL A 89 -15.402 0.427 -1.960 1.00 0.21 H new ATOM 0 HG23 VAL A 89 -16.809 -0.644 -1.758 1.00 0.21 H new ATOM 1514 N SER A 90 -16.643 -3.299 -4.156 1.00 0.20 N ATOM 1515 CA SER A 90 -17.974 -3.521 -4.703 1.00 0.24 C ATOM 1516 C SER A 90 -18.913 -4.044 -3.627 1.00 0.23 C ATOM 1517 O SER A 90 -19.322 -5.202 -3.659 1.00 0.22 O ATOM 1518 CB SER A 90 -17.919 -4.512 -5.865 1.00 0.27 C ATOM 1519 OG SER A 90 -19.187 -4.638 -6.488 1.00 1.15 O ATOM 0 H SER A 90 -16.046 -4.126 -4.144 1.00 0.20 H new ATOM 0 HA SER A 90 -18.352 -2.567 -5.070 1.00 0.24 H new ATOM 0 HB2 SER A 90 -17.182 -4.179 -6.596 1.00 0.27 H new ATOM 0 HB3 SER A 90 -17.590 -5.486 -5.502 1.00 0.27 H new ATOM 0 HG SER A 90 -19.168 -5.387 -7.120 1.00 1.15 H new ATOM 1525 N LYS A 91 -19.254 -3.183 -2.676 1.00 0.28 N ATOM 1526 CA LYS A 91 -20.147 -3.566 -1.591 1.00 0.31 C ATOM 1527 C LYS A 91 -21.425 -4.190 -2.138 1.00 0.33 C ATOM 1528 O LYS A 91 -22.091 -4.968 -1.455 1.00 0.35 O ATOM 1529 CB LYS A 91 -20.485 -2.354 -0.722 1.00 0.41 C ATOM 1530 CG LYS A 91 -19.303 -1.834 0.084 1.00 0.80 C ATOM 1531 CD LYS A 91 -19.756 -1.001 1.272 1.00 1.43 C ATOM 1532 CE LYS A 91 -20.258 -1.875 2.410 1.00 1.61 C ATOM 1533 NZ LYS A 91 -20.731 -1.065 3.565 1.00 1.86 N ATOM 0 H LYS A 91 -18.927 -2.218 -2.634 1.00 0.28 H new ATOM 0 HA LYS A 91 -19.635 -4.307 -0.977 1.00 0.31 H new ATOM 0 HB2 LYS A 91 -20.860 -1.553 -1.360 1.00 0.41 H new ATOM 0 HB3 LYS A 91 -21.291 -2.621 -0.038 1.00 0.41 H new ATOM 0 HG2 LYS A 91 -18.704 -2.674 0.436 1.00 0.80 H new ATOM 0 HG3 LYS A 91 -18.661 -1.232 -0.559 1.00 0.80 H new ATOM 0 HD2 LYS A 91 -18.927 -0.386 1.623 1.00 1.43 H new ATOM 0 HD3 LYS A 91 -20.548 -0.320 0.959 1.00 1.43 H new ATOM 0 HE2 LYS A 91 -21.072 -2.506 2.052 1.00 1.61 H new ATOM 0 HE3 LYS A 91 -19.459 -2.540 2.736 1.00 1.61 H new ATOM 0 HZ1 LYS A 91 -20.743 -1.655 4.421 1.00 1.86 H new ATOM 0 HZ2 LYS A 91 -20.090 -0.259 3.709 1.00 1.86 H new ATOM 0 HZ3 LYS A 91 -21.691 -0.714 3.373 1.00 1.86 H new ATOM 1547 N GLU A 92 -21.760 -3.844 -3.376 1.00 0.36 N ATOM 1548 CA GLU A 92 -22.950 -4.378 -4.021 1.00 0.41 C ATOM 1549 C GLU A 92 -22.816 -5.882 -4.210 1.00 0.35 C ATOM 1550 O GLU A 92 -23.785 -6.630 -4.081 1.00 0.39 O ATOM 1551 CB GLU A 92 -23.167 -3.697 -5.371 1.00 0.49 C ATOM 1552 CG GLU A 92 -23.363 -2.195 -5.264 1.00 0.57 C ATOM 1553 CD GLU A 92 -23.520 -1.527 -6.617 1.00 1.27 C ATOM 1554 OE1 GLU A 92 -22.488 -1.238 -7.259 1.00 2.09 O ATOM 1555 OE2 GLU A 92 -24.674 -1.291 -7.032 1.00 1.29 O ATOM 0 H GLU A 92 -21.223 -3.196 -3.952 1.00 0.36 H new ATOM 0 HA GLU A 92 -23.812 -4.180 -3.384 1.00 0.41 H new ATOM 0 HB2 GLU A 92 -22.310 -3.899 -6.014 1.00 0.49 H new ATOM 0 HB3 GLU A 92 -24.039 -4.136 -5.855 1.00 0.49 H new ATOM 0 HG2 GLU A 92 -24.245 -1.990 -4.658 1.00 0.57 H new ATOM 0 HG3 GLU A 92 -22.511 -1.758 -4.744 1.00 0.57 H new ATOM 1562 N ALA A 93 -21.600 -6.311 -4.516 1.00 0.30 N ATOM 1563 CA ALA A 93 -21.306 -7.722 -4.719 1.00 0.30 C ATOM 1564 C ALA A 93 -20.469 -8.287 -3.574 1.00 0.26 C ATOM 1565 O ALA A 93 -20.243 -9.495 -3.496 1.00 0.34 O ATOM 1566 CB ALA A 93 -20.583 -7.915 -6.042 1.00 0.36 C ATOM 0 H ALA A 93 -20.795 -5.696 -4.630 1.00 0.30 H new ATOM 0 HA ALA A 93 -22.251 -8.265 -4.741 1.00 0.30 H new ATOM 0 HB1 ALA A 93 -20.366 -8.973 -6.187 1.00 0.36 H new ATOM 0 HB2 ALA A 93 -21.214 -7.559 -6.857 1.00 0.36 H new ATOM 0 HB3 ALA A 93 -19.650 -7.352 -6.032 1.00 0.36 H new ATOM 1572 N ASN A 94 -20.010 -7.407 -2.684 1.00 0.18 N ATOM 1573 CA ASN A 94 -19.196 -7.812 -1.551 1.00 0.18 C ATOM 1574 C ASN A 94 -17.794 -8.180 -2.010 1.00 0.19 C ATOM 1575 O ASN A 94 -17.211 -9.149 -1.537 1.00 0.33 O ATOM 1576 CB ASN A 94 -19.835 -8.990 -0.818 1.00 0.24 C ATOM 1577 CG ASN A 94 -21.323 -8.794 -0.599 1.00 0.21 C ATOM 1578 OD1 ASN A 94 -22.142 -9.209 -1.419 1.00 0.53 O ATOM 1579 ND2 ASN A 94 -21.678 -8.155 0.508 1.00 0.44 N ATOM 0 H ASN A 94 -20.193 -6.405 -2.732 1.00 0.18 H new ATOM 0 HA ASN A 94 -19.131 -6.970 -0.861 1.00 0.18 H new ATOM 0 HB2 ASN A 94 -19.672 -9.903 -1.391 1.00 0.24 H new ATOM 0 HB3 ASN A 94 -19.343 -9.126 0.145 1.00 0.24 H new ATOM 0 HD21 ASN A 94 -22.665 -7.990 0.708 1.00 0.44 H new ATOM 0 HD22 ASN A 94 -20.964 -7.829 1.160 1.00 0.44 H new ATOM 1586 N ARG A 95 -17.264 -7.404 -2.949 1.00 0.15 N ATOM 1587 CA ARG A 95 -15.925 -7.643 -3.465 1.00 0.15 C ATOM 1588 C ARG A 95 -15.021 -6.451 -3.185 1.00 0.13 C ATOM 1589 O ARG A 95 -15.496 -5.360 -2.870 1.00 0.15 O ATOM 1590 CB ARG A 95 -15.970 -7.921 -4.965 1.00 0.18 C ATOM 1591 CG ARG A 95 -17.041 -8.918 -5.363 1.00 0.26 C ATOM 1592 CD ARG A 95 -17.139 -9.046 -6.871 1.00 0.30 C ATOM 1593 NE ARG A 95 -17.403 -7.760 -7.512 1.00 1.01 N ATOM 1594 CZ ARG A 95 -17.373 -7.573 -8.828 1.00 1.19 C ATOM 1595 NH1 ARG A 95 -17.093 -8.585 -9.639 1.00 0.65 N ATOM 1596 NH2 ARG A 95 -17.624 -6.373 -9.334 1.00 1.98 N ATOM 0 H ARG A 95 -17.742 -6.606 -3.367 1.00 0.15 H new ATOM 0 HA ARG A 95 -15.518 -8.518 -2.957 1.00 0.15 H new ATOM 0 HB2 ARG A 95 -16.142 -6.984 -5.495 1.00 0.18 H new ATOM 0 HB3 ARG A 95 -14.998 -8.296 -5.286 1.00 0.18 H new ATOM 0 HG2 ARG A 95 -16.816 -9.891 -4.927 1.00 0.26 H new ATOM 0 HG3 ARG A 95 -18.003 -8.603 -4.959 1.00 0.26 H new ATOM 0 HD2 ARG A 95 -16.210 -9.462 -7.261 1.00 0.30 H new ATOM 0 HD3 ARG A 95 -17.934 -9.748 -7.125 1.00 0.30 H new ATOM 0 HE ARG A 95 -17.623 -6.961 -6.917 1.00 1.01 H new ATOM 0 HH11 ARG A 95 -16.900 -9.509 -9.253 1.00 0.65 H new ATOM 0 HH12 ARG A 95 -17.071 -8.439 -10.648 1.00 0.65 H new ATOM 0 HH21 ARG A 95 -17.840 -5.593 -8.713 1.00 1.98 H new ATOM 0 HH22 ARG A 95 -17.601 -6.230 -10.344 1.00 1.98 H new ATOM 1610 N TYR A 96 -13.720 -6.666 -3.300 1.00 0.11 N ATOM 1611 CA TYR A 96 -12.750 -5.613 -3.049 1.00 0.10 C ATOM 1612 C TYR A 96 -11.595 -5.672 -4.037 1.00 0.08 C ATOM 1613 O TYR A 96 -10.924 -6.696 -4.164 1.00 0.09 O ATOM 1614 CB TYR A 96 -12.225 -5.735 -1.623 1.00 0.11 C ATOM 1615 CG TYR A 96 -13.301 -5.531 -0.587 1.00 0.11 C ATOM 1616 CD1 TYR A 96 -14.190 -6.548 -0.278 1.00 0.10 C ATOM 1617 CD2 TYR A 96 -13.412 -4.327 0.097 1.00 0.14 C ATOM 1618 CE1 TYR A 96 -15.166 -6.373 0.682 1.00 0.12 C ATOM 1619 CE2 TYR A 96 -14.383 -4.145 1.062 1.00 0.16 C ATOM 1620 CZ TYR A 96 -15.308 -5.143 1.293 1.00 0.13 C ATOM 1621 OH TYR A 96 -16.223 -4.992 2.314 1.00 0.17 O ATOM 0 H TYR A 96 -13.311 -7.562 -3.566 1.00 0.11 H new ATOM 0 HA TYR A 96 -13.247 -4.652 -3.178 1.00 0.10 H new ATOM 0 HB2 TYR A 96 -11.778 -6.720 -1.488 1.00 0.11 H new ATOM 0 HB3 TYR A 96 -11.433 -5.002 -1.468 1.00 0.11 H new ATOM 0 HD1 TYR A 96 -14.118 -7.493 -0.797 1.00 0.10 H new ATOM 0 HD2 TYR A 96 -12.729 -3.522 -0.129 1.00 0.14 H new ATOM 0 HE1 TYR A 96 -15.814 -7.193 0.954 1.00 0.12 H new ATOM 0 HE2 TYR A 96 -14.418 -3.228 1.632 1.00 0.16 H new ATOM 0 HH TYR A 96 -16.311 -5.837 2.802 1.00 0.17 H new ATOM 1631 N LEU A 97 -11.364 -4.564 -4.732 1.00 0.08 N ATOM 1632 CA LEU A 97 -10.285 -4.493 -5.704 1.00 0.07 C ATOM 1633 C LEU A 97 -8.998 -4.035 -5.036 1.00 0.07 C ATOM 1634 O LEU A 97 -8.876 -2.880 -4.632 1.00 0.08 O ATOM 1635 CB LEU A 97 -10.641 -3.533 -6.835 1.00 0.09 C ATOM 1636 CG LEU A 97 -9.590 -3.428 -7.941 1.00 0.10 C ATOM 1637 CD1 LEU A 97 -9.431 -4.760 -8.658 1.00 0.15 C ATOM 1638 CD2 LEU A 97 -9.961 -2.328 -8.924 1.00 0.13 C ATOM 0 H LEU A 97 -11.909 -3.707 -4.639 1.00 0.08 H new ATOM 0 HA LEU A 97 -10.139 -5.490 -6.119 1.00 0.07 H new ATOM 0 HB2 LEU A 97 -11.585 -3.850 -7.279 1.00 0.09 H new ATOM 0 HB3 LEU A 97 -10.805 -2.541 -6.413 1.00 0.09 H new ATOM 0 HG LEU A 97 -8.634 -3.172 -7.485 1.00 0.10 H new ATOM 0 HD11 LEU A 97 -8.679 -4.664 -9.441 1.00 0.15 H new ATOM 0 HD12 LEU A 97 -9.117 -5.522 -7.945 1.00 0.15 H new ATOM 0 HD13 LEU A 97 -10.383 -5.050 -9.103 1.00 0.15 H new ATOM 0 HD21 LEU A 97 -9.203 -2.267 -9.705 1.00 0.13 H new ATOM 0 HD22 LEU A 97 -10.928 -2.553 -9.374 1.00 0.13 H new ATOM 0 HD23 LEU A 97 -10.019 -1.375 -8.399 1.00 0.13 H new ATOM 1650 N ILE A 98 -8.037 -4.939 -4.936 1.00 0.08 N ATOM 1651 CA ILE A 98 -6.765 -4.623 -4.315 1.00 0.09 C ATOM 1652 C ILE A 98 -5.612 -4.903 -5.261 1.00 0.09 C ATOM 1653 O ILE A 98 -5.759 -5.647 -6.226 1.00 0.10 O ATOM 1654 CB ILE A 98 -6.553 -5.443 -3.033 1.00 0.09 C ATOM 1655 CG1 ILE A 98 -6.532 -6.938 -3.356 1.00 0.09 C ATOM 1656 CG2 ILE A 98 -7.638 -5.130 -2.015 1.00 0.09 C ATOM 1657 CD1 ILE A 98 -5.185 -7.446 -3.823 1.00 0.11 C ATOM 0 H ILE A 98 -8.115 -5.897 -5.277 1.00 0.08 H new ATOM 0 HA ILE A 98 -6.789 -3.561 -4.069 1.00 0.09 H new ATOM 0 HB ILE A 98 -5.590 -5.170 -2.601 1.00 0.09 H new ATOM 0 HG12 ILE A 98 -6.832 -7.496 -2.469 1.00 0.09 H new ATOM 0 HG13 ILE A 98 -7.274 -7.143 -4.127 1.00 0.09 H new ATOM 0 HG21 ILE A 98 -7.472 -5.720 -1.113 1.00 0.09 H new ATOM 0 HG22 ILE A 98 -7.608 -4.069 -1.766 1.00 0.09 H new ATOM 0 HG23 ILE A 98 -8.613 -5.376 -2.435 1.00 0.09 H new ATOM 0 HD11 ILE A 98 -5.251 -8.514 -4.032 1.00 0.11 H new ATOM 0 HD12 ILE A 98 -4.891 -6.916 -4.729 1.00 0.11 H new ATOM 0 HD13 ILE A 98 -4.442 -7.274 -3.045 1.00 0.11 H new ATOM 1669 N PHE A 99 -4.466 -4.301 -4.983 1.00 0.10 N ATOM 1670 CA PHE A 99 -3.291 -4.518 -5.808 1.00 0.11 C ATOM 1671 C PHE A 99 -2.327 -5.453 -5.097 1.00 0.12 C ATOM 1672 O PHE A 99 -1.797 -5.123 -4.039 1.00 0.14 O ATOM 1673 CB PHE A 99 -2.602 -3.197 -6.140 1.00 0.12 C ATOM 1674 CG PHE A 99 -1.542 -3.341 -7.191 1.00 0.12 C ATOM 1675 CD1 PHE A 99 -1.868 -3.276 -8.535 1.00 0.16 C ATOM 1676 CD2 PHE A 99 -0.216 -3.530 -6.833 1.00 0.12 C ATOM 1677 CE1 PHE A 99 -0.893 -3.400 -9.504 1.00 0.18 C ATOM 1678 CE2 PHE A 99 0.764 -3.653 -7.797 1.00 0.13 C ATOM 1679 CZ PHE A 99 0.419 -3.623 -9.137 1.00 0.15 C ATOM 0 H PHE A 99 -4.326 -3.664 -4.199 1.00 0.10 H new ATOM 0 HA PHE A 99 -3.608 -4.976 -6.745 1.00 0.11 H new ATOM 0 HB2 PHE A 99 -3.348 -2.479 -6.480 1.00 0.12 H new ATOM 0 HB3 PHE A 99 -2.155 -2.788 -5.234 1.00 0.12 H new ATOM 0 HD1 PHE A 99 -2.897 -3.127 -8.828 1.00 0.16 H new ATOM 0 HD2 PHE A 99 0.053 -3.582 -5.788 1.00 0.12 H new ATOM 0 HE1 PHE A 99 -1.156 -3.323 -10.549 1.00 0.18 H new ATOM 0 HE2 PHE A 99 1.797 -3.772 -7.506 1.00 0.13 H new ATOM 0 HZ PHE A 99 1.175 -3.774 -9.894 1.00 0.15 H new ATOM 1689 N ASP A 100 -2.114 -6.627 -5.676 1.00 0.17 N ATOM 1690 CA ASP A 100 -1.221 -7.618 -5.089 1.00 0.20 C ATOM 1691 C ASP A 100 0.237 -7.182 -5.191 1.00 0.15 C ATOM 1692 O ASP A 100 0.797 -7.087 -6.283 1.00 0.14 O ATOM 1693 CB ASP A 100 -1.416 -8.970 -5.770 1.00 0.28 C ATOM 1694 CG ASP A 100 -0.682 -10.089 -5.059 1.00 0.32 C ATOM 1695 OD1 ASP A 100 0.567 -10.066 -5.047 1.00 0.17 O ATOM 1696 OD2 ASP A 100 -1.355 -10.988 -4.515 1.00 0.58 O ATOM 0 H ASP A 100 -2.548 -6.917 -6.552 1.00 0.17 H new ATOM 0 HA ASP A 100 -1.470 -7.710 -4.032 1.00 0.20 H new ATOM 0 HB2 ASP A 100 -2.480 -9.204 -5.808 1.00 0.28 H new ATOM 0 HB3 ASP A 100 -1.067 -8.908 -6.801 1.00 0.28 H new ATOM 1701 N LEU A 101 0.840 -6.917 -4.038 1.00 0.14 N ATOM 1702 CA LEU A 101 2.232 -6.490 -3.970 1.00 0.12 C ATOM 1703 C LEU A 101 3.194 -7.651 -4.227 1.00 0.13 C ATOM 1704 O LEU A 101 4.398 -7.446 -4.375 1.00 0.16 O ATOM 1705 CB LEU A 101 2.513 -5.865 -2.599 1.00 0.14 C ATOM 1706 CG LEU A 101 1.897 -4.477 -2.363 1.00 0.11 C ATOM 1707 CD1 LEU A 101 0.551 -4.346 -3.057 1.00 0.10 C ATOM 1708 CD2 LEU A 101 1.741 -4.216 -0.874 1.00 0.11 C ATOM 0 H LEU A 101 0.381 -6.991 -3.130 1.00 0.14 H new ATOM 0 HA LEU A 101 2.396 -5.749 -4.752 1.00 0.12 H new ATOM 0 HB2 LEU A 101 2.144 -6.542 -1.829 1.00 0.14 H new ATOM 0 HB3 LEU A 101 3.593 -5.791 -2.468 1.00 0.14 H new ATOM 0 HG LEU A 101 2.573 -3.735 -2.788 1.00 0.11 H new ATOM 0 HD11 LEU A 101 0.141 -3.353 -2.871 1.00 0.10 H new ATOM 0 HD12 LEU A 101 0.679 -4.491 -4.130 1.00 0.10 H new ATOM 0 HD13 LEU A 101 -0.134 -5.100 -2.668 1.00 0.10 H new ATOM 0 HD21 LEU A 101 1.304 -3.229 -0.721 1.00 0.11 H new ATOM 0 HD22 LEU A 101 1.089 -4.973 -0.438 1.00 0.11 H new ATOM 0 HD23 LEU A 101 2.718 -4.258 -0.393 1.00 0.11 H new ATOM 1720 N GLU A 102 2.662 -8.872 -4.278 1.00 0.14 N ATOM 1721 CA GLU A 102 3.481 -10.054 -4.513 1.00 0.16 C ATOM 1722 C GLU A 102 3.583 -10.352 -6.003 1.00 0.16 C ATOM 1723 O GLU A 102 4.638 -10.740 -6.504 1.00 0.20 O ATOM 1724 CB GLU A 102 2.887 -11.264 -3.791 1.00 0.17 C ATOM 1725 CG GLU A 102 2.567 -11.006 -2.329 1.00 0.21 C ATOM 1726 CD GLU A 102 2.061 -12.245 -1.617 1.00 0.23 C ATOM 1727 OE1 GLU A 102 2.889 -13.110 -1.264 1.00 0.32 O ATOM 1728 OE2 GLU A 102 0.834 -12.350 -1.409 1.00 0.29 O ATOM 0 H GLU A 102 1.668 -9.065 -4.159 1.00 0.14 H new ATOM 0 HA GLU A 102 4.479 -9.855 -4.123 1.00 0.16 H new ATOM 0 HB2 GLU A 102 1.976 -11.571 -4.304 1.00 0.17 H new ATOM 0 HB3 GLU A 102 3.587 -12.096 -3.859 1.00 0.17 H new ATOM 0 HG2 GLU A 102 3.461 -10.641 -1.824 1.00 0.21 H new ATOM 0 HG3 GLU A 102 1.817 -10.219 -2.258 1.00 0.21 H new ATOM 1735 N GLN A 103 2.470 -10.169 -6.704 1.00 0.15 N ATOM 1736 CA GLN A 103 2.413 -10.420 -8.137 1.00 0.16 C ATOM 1737 C GLN A 103 2.494 -9.121 -8.931 1.00 0.15 C ATOM 1738 O GLN A 103 2.747 -9.139 -10.137 1.00 0.17 O ATOM 1739 CB GLN A 103 1.126 -11.161 -8.486 1.00 0.17 C ATOM 1740 CG GLN A 103 0.776 -12.245 -7.489 1.00 0.23 C ATOM 1741 CD GLN A 103 -0.504 -12.975 -7.837 1.00 0.56 C ATOM 1742 OE1 GLN A 103 -0.860 -13.108 -9.008 1.00 1.11 O ATOM 1743 NE2 GLN A 103 -1.203 -13.453 -6.816 1.00 0.45 N ATOM 0 H GLN A 103 1.591 -9.846 -6.299 1.00 0.15 H new ATOM 0 HA GLN A 103 3.272 -11.036 -8.405 1.00 0.16 H new ATOM 0 HB2 GLN A 103 0.305 -10.446 -8.539 1.00 0.17 H new ATOM 0 HB3 GLN A 103 1.227 -11.605 -9.476 1.00 0.17 H new ATOM 0 HG2 GLN A 103 1.595 -12.962 -7.438 1.00 0.23 H new ATOM 0 HG3 GLN A 103 0.678 -11.802 -6.498 1.00 0.23 H new ATOM 0 HE21 GLN A 103 -0.869 -13.319 -5.862 1.00 0.45 H new ATOM 0 HE22 GLN A 103 -2.075 -13.955 -6.985 1.00 0.45 H new ATOM 1752 N ARG A 104 2.269 -7.997 -8.253 1.00 0.15 N ATOM 1753 CA ARG A 104 2.319 -6.692 -8.898 1.00 0.15 C ATOM 1754 C ARG A 104 1.138 -6.519 -9.841 1.00 0.16 C ATOM 1755 O ARG A 104 1.237 -5.838 -10.861 1.00 0.20 O ATOM 1756 CB ARG A 104 3.631 -6.527 -9.663 1.00 0.16 C ATOM 1757 CG ARG A 104 4.860 -6.830 -8.823 1.00 0.17 C ATOM 1758 CD ARG A 104 6.139 -6.608 -9.608 1.00 0.21 C ATOM 1759 NE ARG A 104 7.329 -6.967 -8.837 1.00 0.79 N ATOM 1760 CZ ARG A 104 8.568 -6.850 -9.302 1.00 0.98 C ATOM 1761 NH1 ARG A 104 8.779 -6.386 -10.526 1.00 0.64 N ATOM 1762 NH2 ARG A 104 9.599 -7.196 -8.543 1.00 1.67 N ATOM 0 H ARG A 104 2.050 -7.967 -7.257 1.00 0.15 H new ATOM 0 HA ARG A 104 2.264 -5.924 -8.126 1.00 0.15 H new ATOM 0 HB2 ARG A 104 3.622 -7.185 -10.532 1.00 0.16 H new ATOM 0 HB3 ARG A 104 3.699 -5.506 -10.038 1.00 0.16 H new ATOM 0 HG2 ARG A 104 4.861 -6.196 -7.936 1.00 0.17 H new ATOM 0 HG3 ARG A 104 4.819 -7.863 -8.476 1.00 0.17 H new ATOM 0 HD2 ARG A 104 6.109 -7.199 -10.523 1.00 0.21 H new ATOM 0 HD3 ARG A 104 6.203 -5.562 -9.906 1.00 0.21 H new ATOM 0 HE ARG A 104 7.201 -7.327 -7.891 1.00 0.79 H new ATOM 0 HH11 ARG A 104 7.989 -6.118 -11.113 1.00 0.64 H new ATOM 0 HH12 ARG A 104 9.731 -6.297 -10.881 1.00 0.64 H new ATOM 0 HH21 ARG A 104 9.441 -7.553 -7.600 1.00 1.67 H new ATOM 0 HH22 ARG A 104 10.550 -7.105 -8.902 1.00 1.67 H new ATOM 1776 N ASN A 105 0.017 -7.137 -9.485 1.00 0.14 N ATOM 1777 CA ASN A 105 -1.185 -7.064 -10.299 1.00 0.16 C ATOM 1778 C ASN A 105 -2.421 -6.841 -9.434 1.00 0.13 C ATOM 1779 O ASN A 105 -2.440 -7.213 -8.261 1.00 0.15 O ATOM 1780 CB ASN A 105 -1.352 -8.353 -11.100 1.00 0.22 C ATOM 1781 CG ASN A 105 -1.500 -9.568 -10.204 1.00 0.42 C ATOM 1782 OD1 ASN A 105 -2.015 -9.470 -9.089 1.00 1.23 O ATOM 1783 ND2 ASN A 105 -1.050 -10.721 -10.684 1.00 0.45 N ATOM 0 H ASN A 105 -0.082 -7.694 -8.636 1.00 0.14 H new ATOM 0 HA ASN A 105 -1.080 -6.219 -10.979 1.00 0.16 H new ATOM 0 HB2 ASN A 105 -2.228 -8.269 -11.743 1.00 0.22 H new ATOM 0 HB3 ASN A 105 -0.490 -8.488 -11.753 1.00 0.22 H new ATOM 0 HD21 ASN A 105 -1.124 -11.570 -10.124 1.00 0.45 H new ATOM 0 HD22 ASN A 105 -0.630 -10.758 -11.613 1.00 0.45 H new ATOM 1790 N PRO A 106 -3.472 -6.228 -10.006 1.00 0.14 N ATOM 1791 CA PRO A 106 -4.719 -5.969 -9.290 1.00 0.13 C ATOM 1792 C PRO A 106 -5.511 -7.247 -9.063 1.00 0.15 C ATOM 1793 O PRO A 106 -5.336 -8.235 -9.777 1.00 0.21 O ATOM 1794 CB PRO A 106 -5.493 -5.019 -10.213 1.00 0.15 C ATOM 1795 CG PRO A 106 -4.528 -4.615 -11.277 1.00 0.20 C ATOM 1796 CD PRO A 106 -3.533 -5.730 -11.385 1.00 0.22 C ATOM 0 HA PRO A 106 -4.538 -5.550 -8.300 1.00 0.13 H new ATOM 0 HB2 PRO A 106 -6.364 -5.514 -10.642 1.00 0.15 H new ATOM 0 HB3 PRO A 106 -5.857 -4.150 -9.664 1.00 0.15 H new ATOM 0 HG2 PRO A 106 -5.039 -4.457 -12.226 1.00 0.20 H new ATOM 0 HG3 PRO A 106 -4.035 -3.677 -11.020 1.00 0.20 H new ATOM 0 HD2 PRO A 106 -3.860 -6.501 -12.082 1.00 0.22 H new ATOM 0 HD3 PRO A 106 -2.562 -5.377 -11.733 1.00 0.22 H new ATOM 1804 N ARG A 107 -6.386 -7.220 -8.069 1.00 0.11 N ATOM 1805 CA ARG A 107 -7.202 -8.378 -7.743 1.00 0.13 C ATOM 1806 C ARG A 107 -8.499 -7.965 -7.067 1.00 0.11 C ATOM 1807 O ARG A 107 -8.560 -6.949 -6.380 1.00 0.11 O ATOM 1808 CB ARG A 107 -6.429 -9.328 -6.832 1.00 0.16 C ATOM 1809 CG ARG A 107 -5.370 -10.138 -7.558 1.00 0.18 C ATOM 1810 CD ARG A 107 -4.756 -11.198 -6.655 1.00 0.27 C ATOM 1811 NE ARG A 107 -5.749 -12.150 -6.161 1.00 0.35 N ATOM 1812 CZ ARG A 107 -5.439 -13.338 -5.653 1.00 0.98 C ATOM 1813 NH1 ARG A 107 -4.171 -13.724 -5.585 1.00 1.70 N ATOM 1814 NH2 ARG A 107 -6.396 -14.143 -5.213 1.00 1.02 N ATOM 0 H ARG A 107 -6.549 -6.408 -7.474 1.00 0.11 H new ATOM 0 HA ARG A 107 -7.447 -8.887 -8.675 1.00 0.13 H new ATOM 0 HB2 ARG A 107 -5.953 -8.751 -6.039 1.00 0.16 H new ATOM 0 HB3 ARG A 107 -7.131 -10.010 -6.353 1.00 0.16 H new ATOM 0 HG2 ARG A 107 -5.813 -10.616 -8.432 1.00 0.18 H new ATOM 0 HG3 ARG A 107 -4.588 -9.472 -7.921 1.00 0.18 H new ATOM 0 HD2 ARG A 107 -3.982 -11.735 -7.204 1.00 0.27 H new ATOM 0 HD3 ARG A 107 -4.269 -10.713 -5.809 1.00 0.27 H new ATOM 0 HE ARG A 107 -6.734 -11.888 -6.209 1.00 0.35 H new ATOM 0 HH11 ARG A 107 -3.432 -13.108 -5.923 1.00 1.70 H new ATOM 0 HH12 ARG A 107 -3.936 -14.637 -5.195 1.00 1.70 H new ATOM 0 HH21 ARG A 107 -7.372 -13.851 -5.264 1.00 1.02 H new ATOM 0 HH22 ARG A 107 -6.156 -15.055 -4.823 1.00 1.02 H new ATOM 1828 N VAL A 108 -9.534 -8.766 -7.270 1.00 0.13 N ATOM 1829 CA VAL A 108 -10.834 -8.502 -6.676 1.00 0.12 C ATOM 1830 C VAL A 108 -11.181 -9.586 -5.666 1.00 0.12 C ATOM 1831 O VAL A 108 -11.577 -10.690 -6.036 1.00 0.15 O ATOM 1832 CB VAL A 108 -11.941 -8.432 -7.744 1.00 0.14 C ATOM 1833 CG1 VAL A 108 -13.295 -8.179 -7.096 1.00 0.66 C ATOM 1834 CG2 VAL A 108 -11.624 -7.355 -8.768 1.00 0.61 C ATOM 0 H VAL A 108 -9.497 -9.608 -7.845 1.00 0.13 H new ATOM 0 HA VAL A 108 -10.774 -7.535 -6.176 1.00 0.12 H new ATOM 0 HB VAL A 108 -11.985 -9.392 -8.259 1.00 0.14 H new ATOM 0 HG11 VAL A 108 -14.064 -8.133 -7.867 1.00 0.66 H new ATOM 0 HG12 VAL A 108 -13.524 -8.989 -6.403 1.00 0.66 H new ATOM 0 HG13 VAL A 108 -13.268 -7.234 -6.553 1.00 0.66 H new ATOM 0 HG21 VAL A 108 -12.417 -7.319 -9.515 1.00 0.61 H new ATOM 0 HG22 VAL A 108 -11.552 -6.389 -8.269 1.00 0.61 H new ATOM 0 HG23 VAL A 108 -10.676 -7.584 -9.255 1.00 0.61 H new ATOM 1844 N LEU A 109 -11.029 -9.263 -4.389 1.00 0.12 N ATOM 1845 CA LEU A 109 -11.315 -10.216 -3.327 1.00 0.12 C ATOM 1846 C LEU A 109 -12.768 -10.142 -2.906 1.00 0.12 C ATOM 1847 O LEU A 109 -13.460 -9.166 -3.184 1.00 0.17 O ATOM 1848 CB LEU A 109 -10.436 -9.945 -2.108 1.00 0.11 C ATOM 1849 CG LEU A 109 -8.948 -10.225 -2.294 1.00 0.12 C ATOM 1850 CD1 LEU A 109 -8.334 -9.223 -3.256 1.00 0.12 C ATOM 1851 CD2 LEU A 109 -8.237 -10.188 -0.950 1.00 0.14 C ATOM 0 H LEU A 109 -10.710 -8.350 -4.064 1.00 0.12 H new ATOM 0 HA LEU A 109 -11.104 -11.211 -3.718 1.00 0.12 H new ATOM 0 HB2 LEU A 109 -10.558 -8.901 -1.819 1.00 0.11 H new ATOM 0 HB3 LEU A 109 -10.800 -10.550 -1.278 1.00 0.11 H new ATOM 0 HG LEU A 109 -8.829 -11.221 -2.721 1.00 0.12 H new ATOM 0 HD11 LEU A 109 -7.272 -9.438 -3.377 1.00 0.12 H new ATOM 0 HD12 LEU A 109 -8.831 -9.296 -4.223 1.00 0.12 H new ATOM 0 HD13 LEU A 109 -8.457 -8.215 -2.859 1.00 0.12 H new ATOM 0 HD21 LEU A 109 -7.175 -10.389 -1.094 1.00 0.14 H new ATOM 0 HD22 LEU A 109 -8.362 -9.203 -0.499 1.00 0.14 H new ATOM 0 HD23 LEU A 109 -8.664 -10.945 -0.292 1.00 0.14 H new ATOM 1863 N GLU A 110 -13.224 -11.188 -2.239 1.00 0.13 N ATOM 1864 CA GLU A 110 -14.584 -11.235 -1.746 1.00 0.13 C ATOM 1865 C GLU A 110 -14.592 -10.757 -0.306 1.00 0.12 C ATOM 1866 O GLU A 110 -13.593 -10.895 0.396 1.00 0.12 O ATOM 1867 CB GLU A 110 -15.151 -12.653 -1.833 1.00 0.15 C ATOM 1868 CG GLU A 110 -14.615 -13.452 -3.009 1.00 0.19 C ATOM 1869 CD GLU A 110 -15.334 -14.774 -3.193 1.00 0.26 C ATOM 1870 OE1 GLU A 110 -16.371 -14.793 -3.889 1.00 0.33 O ATOM 1871 OE2 GLU A 110 -14.862 -15.790 -2.640 1.00 0.34 O ATOM 0 H GLU A 110 -12.668 -12.017 -2.027 1.00 0.13 H new ATOM 0 HA GLU A 110 -15.212 -10.590 -2.360 1.00 0.13 H new ATOM 0 HB2 GLU A 110 -14.922 -13.184 -0.909 1.00 0.15 H new ATOM 0 HB3 GLU A 110 -16.237 -12.597 -1.907 1.00 0.15 H new ATOM 0 HG2 GLU A 110 -14.712 -12.860 -3.919 1.00 0.19 H new ATOM 0 HG3 GLU A 110 -13.551 -13.639 -2.862 1.00 0.19 H new ATOM 1878 N GLN A 111 -15.707 -10.207 0.146 1.00 0.13 N ATOM 1879 CA GLN A 111 -15.791 -9.702 1.509 1.00 0.13 C ATOM 1880 C GLN A 111 -15.235 -10.710 2.503 1.00 0.12 C ATOM 1881 O GLN A 111 -14.474 -10.358 3.401 1.00 0.13 O ATOM 1882 CB GLN A 111 -17.230 -9.363 1.866 1.00 0.14 C ATOM 1883 CG GLN A 111 -17.383 -8.894 3.295 1.00 0.16 C ATOM 1884 CD GLN A 111 -18.717 -8.234 3.560 1.00 0.17 C ATOM 1885 OE1 GLN A 111 -19.732 -8.585 2.957 1.00 0.36 O ATOM 1886 NE2 GLN A 111 -18.718 -7.262 4.461 1.00 0.31 N ATOM 0 H GLN A 111 -16.559 -10.099 -0.404 1.00 0.13 H new ATOM 0 HA GLN A 111 -15.188 -8.795 1.564 1.00 0.13 H new ATOM 0 HB2 GLN A 111 -17.594 -8.587 1.193 1.00 0.14 H new ATOM 0 HB3 GLN A 111 -17.856 -10.241 1.707 1.00 0.14 H new ATOM 0 HG2 GLN A 111 -17.265 -9.745 3.966 1.00 0.16 H new ATOM 0 HG3 GLN A 111 -16.583 -8.191 3.529 1.00 0.16 H new ATOM 0 HE21 GLN A 111 -17.852 -7.006 4.936 1.00 0.31 H new ATOM 0 HE22 GLN A 111 -19.585 -6.770 4.680 1.00 0.31 H new ATOM 1895 N SER A 112 -15.615 -11.963 2.332 1.00 0.13 N ATOM 1896 CA SER A 112 -15.130 -13.014 3.208 1.00 0.14 C ATOM 1897 C SER A 112 -13.612 -13.081 3.137 1.00 0.14 C ATOM 1898 O SER A 112 -12.941 -13.328 4.138 1.00 0.16 O ATOM 1899 CB SER A 112 -15.739 -14.361 2.820 1.00 0.16 C ATOM 1900 OG SER A 112 -17.136 -14.377 3.055 1.00 0.95 O ATOM 0 H SER A 112 -16.253 -12.276 1.601 1.00 0.13 H new ATOM 0 HA SER A 112 -15.430 -12.786 4.231 1.00 0.14 H new ATOM 0 HB2 SER A 112 -15.542 -14.563 1.767 1.00 0.16 H new ATOM 0 HB3 SER A 112 -15.262 -15.157 3.392 1.00 0.16 H new ATOM 0 HG SER A 112 -17.501 -15.249 2.797 1.00 0.95 H new ATOM 1906 N GLU A 113 -13.078 -12.856 1.941 1.00 0.13 N ATOM 1907 CA GLU A 113 -11.641 -12.874 1.731 1.00 0.13 C ATOM 1908 C GLU A 113 -11.007 -11.606 2.284 1.00 0.14 C ATOM 1909 O GLU A 113 -10.046 -11.662 3.050 1.00 0.17 O ATOM 1910 CB GLU A 113 -11.325 -13.013 0.246 1.00 0.14 C ATOM 1911 CG GLU A 113 -11.860 -14.293 -0.366 1.00 0.18 C ATOM 1912 CD GLU A 113 -11.293 -15.537 0.289 1.00 0.25 C ATOM 1913 OE1 GLU A 113 -10.231 -16.014 -0.165 1.00 0.31 O ATOM 1914 OE2 GLU A 113 -11.908 -16.035 1.255 1.00 0.30 O ATOM 0 H GLU A 113 -13.624 -12.659 1.102 1.00 0.13 H new ATOM 0 HA GLU A 113 -11.226 -13.731 2.261 1.00 0.13 H new ATOM 0 HB2 GLU A 113 -11.744 -12.161 -0.288 1.00 0.14 H new ATOM 0 HB3 GLU A 113 -10.245 -12.976 0.107 1.00 0.14 H new ATOM 0 HG2 GLU A 113 -12.947 -14.305 -0.280 1.00 0.18 H new ATOM 0 HG3 GLU A 113 -11.624 -14.308 -1.430 1.00 0.18 H new ATOM 1921 N PHE A 114 -11.556 -10.462 1.891 1.00 0.11 N ATOM 1922 CA PHE A 114 -11.049 -9.182 2.350 1.00 0.12 C ATOM 1923 C PHE A 114 -11.171 -9.083 3.864 1.00 0.13 C ATOM 1924 O PHE A 114 -10.208 -8.760 4.555 1.00 0.19 O ATOM 1925 CB PHE A 114 -11.806 -8.035 1.680 1.00 0.12 C ATOM 1926 CG PHE A 114 -11.280 -6.686 2.062 1.00 0.12 C ATOM 1927 CD1 PHE A 114 -11.767 -6.035 3.182 1.00 0.14 C ATOM 1928 CD2 PHE A 114 -10.293 -6.074 1.308 1.00 0.12 C ATOM 1929 CE1 PHE A 114 -11.278 -4.796 3.543 1.00 0.15 C ATOM 1930 CE2 PHE A 114 -9.800 -4.836 1.667 1.00 0.13 C ATOM 1931 CZ PHE A 114 -10.292 -4.197 2.785 1.00 0.14 C ATOM 0 H PHE A 114 -12.352 -10.399 1.256 1.00 0.11 H new ATOM 0 HA PHE A 114 -9.997 -9.106 2.077 1.00 0.12 H new ATOM 0 HB2 PHE A 114 -11.745 -8.150 0.598 1.00 0.12 H new ATOM 0 HB3 PHE A 114 -12.861 -8.097 1.948 1.00 0.12 H new ATOM 0 HD1 PHE A 114 -12.537 -6.501 3.779 1.00 0.14 H new ATOM 0 HD2 PHE A 114 -9.905 -6.570 0.431 1.00 0.12 H new ATOM 0 HE1 PHE A 114 -11.666 -4.296 4.418 1.00 0.15 H new ATOM 0 HE2 PHE A 114 -9.029 -4.368 1.072 1.00 0.13 H new ATOM 0 HZ PHE A 114 -9.906 -3.229 3.068 1.00 0.14 H new ATOM 1941 N GLU A 115 -12.366 -9.366 4.370 1.00 0.12 N ATOM 1942 CA GLU A 115 -12.615 -9.338 5.805 1.00 0.14 C ATOM 1943 C GLU A 115 -11.612 -10.226 6.517 1.00 0.15 C ATOM 1944 O GLU A 115 -11.152 -9.924 7.619 1.00 0.18 O ATOM 1945 CB GLU A 115 -14.027 -9.831 6.107 1.00 0.14 C ATOM 1946 CG GLU A 115 -15.116 -8.841 5.745 1.00 0.14 C ATOM 1947 CD GLU A 115 -16.486 -9.284 6.218 1.00 0.41 C ATOM 1948 OE1 GLU A 115 -16.856 -10.449 5.962 1.00 0.60 O ATOM 1949 OE2 GLU A 115 -17.191 -8.463 6.845 1.00 0.66 O ATOM 0 H GLU A 115 -13.178 -9.618 3.806 1.00 0.12 H new ATOM 0 HA GLU A 115 -12.512 -8.311 6.157 1.00 0.14 H new ATOM 0 HB2 GLU A 115 -14.200 -10.760 5.564 1.00 0.14 H new ATOM 0 HB3 GLU A 115 -14.100 -10.064 7.169 1.00 0.14 H new ATOM 0 HG2 GLU A 115 -14.880 -7.871 6.183 1.00 0.14 H new ATOM 0 HG3 GLU A 115 -15.135 -8.706 4.664 1.00 0.14 H new ATOM 1956 N ALA A 116 -11.284 -11.325 5.861 1.00 0.13 N ATOM 1957 CA ALA A 116 -10.345 -12.295 6.394 1.00 0.15 C ATOM 1958 C ALA A 116 -8.904 -11.793 6.307 1.00 0.16 C ATOM 1959 O ALA A 116 -7.987 -12.433 6.819 1.00 0.21 O ATOM 1960 CB ALA A 116 -10.497 -13.606 5.642 1.00 0.17 C ATOM 0 H ALA A 116 -11.661 -11.570 4.945 1.00 0.13 H new ATOM 0 HA ALA A 116 -10.570 -12.448 7.449 1.00 0.15 H new ATOM 0 HB1 ALA A 116 -9.793 -14.337 6.040 1.00 0.17 H new ATOM 0 HB2 ALA A 116 -11.514 -13.979 5.762 1.00 0.17 H new ATOM 0 HB3 ALA A 116 -10.293 -13.444 4.584 1.00 0.17 H new ATOM 1966 N LEU A 117 -8.707 -10.648 5.654 1.00 0.16 N ATOM 1967 CA LEU A 117 -7.374 -10.079 5.508 1.00 0.18 C ATOM 1968 C LEU A 117 -7.280 -8.716 6.186 1.00 0.19 C ATOM 1969 O LEU A 117 -6.241 -8.357 6.740 1.00 0.28 O ATOM 1970 CB LEU A 117 -7.026 -9.948 4.026 1.00 0.19 C ATOM 1971 CG LEU A 117 -7.067 -11.255 3.239 1.00 0.19 C ATOM 1972 CD1 LEU A 117 -7.191 -10.979 1.750 1.00 0.22 C ATOM 1973 CD2 LEU A 117 -5.826 -12.088 3.524 1.00 0.23 C ATOM 0 H LEU A 117 -9.451 -10.101 5.221 1.00 0.16 H new ATOM 0 HA LEU A 117 -6.663 -10.748 5.991 1.00 0.18 H new ATOM 0 HB2 LEU A 117 -7.718 -9.242 3.566 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -6.028 -9.519 3.939 1.00 0.19 H new ATOM 0 HG LEU A 117 -7.943 -11.820 3.558 1.00 0.19 H new ATOM 0 HD11 LEU A 117 -7.219 -11.923 1.206 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -8.109 -10.423 1.558 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -6.335 -10.393 1.416 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -5.872 -13.016 2.955 1.00 0.23 H new ATOM 0 HD22 LEU A 117 -4.937 -11.528 3.233 1.00 0.23 H new ATOM 0 HD23 LEU A 117 -5.778 -12.317 4.589 1.00 0.23 H new ATOM 1985 N TYR A 118 -8.374 -7.963 6.144 1.00 0.14 N ATOM 1986 CA TYR A 118 -8.410 -6.635 6.741 1.00 0.14 C ATOM 1987 C TYR A 118 -8.180 -6.702 8.246 1.00 0.20 C ATOM 1988 O TYR A 118 -8.690 -7.594 8.924 1.00 0.28 O ATOM 1989 CB TYR A 118 -9.747 -5.953 6.449 1.00 0.14 C ATOM 1990 CG TYR A 118 -9.714 -4.457 6.654 1.00 0.17 C ATOM 1991 CD1 TYR A 118 -8.737 -3.671 6.059 1.00 0.22 C ATOM 1992 CD2 TYR A 118 -10.668 -3.834 7.446 1.00 0.19 C ATOM 1993 CE1 TYR A 118 -8.712 -2.303 6.248 1.00 0.27 C ATOM 1994 CE2 TYR A 118 -10.651 -2.467 7.640 1.00 0.23 C ATOM 1995 CZ TYR A 118 -9.637 -1.705 7.025 1.00 0.27 C ATOM 1996 OH TYR A 118 -9.651 -0.344 7.231 1.00 0.33 O ATOM 0 H TYR A 118 -9.247 -8.251 5.702 1.00 0.14 H new ATOM 0 HA TYR A 118 -7.606 -6.049 6.296 1.00 0.14 H new ATOM 0 HB2 TYR A 118 -10.038 -6.165 5.420 1.00 0.14 H new ATOM 0 HB3 TYR A 118 -10.514 -6.384 7.092 1.00 0.14 H new ATOM 0 HD1 TYR A 118 -7.985 -4.136 5.439 1.00 0.22 H new ATOM 0 HD2 TYR A 118 -11.436 -4.428 7.918 1.00 0.19 H new ATOM 0 HE1 TYR A 118 -7.947 -1.709 5.770 1.00 0.27 H new ATOM 0 HE2 TYR A 118 -11.402 -1.990 8.252 1.00 0.23 H new ATOM 0 HH TYR A 118 -10.039 -0.150 8.110 1.00 0.33 H new ATOM 2006 N GLN A 119 -7.409 -5.751 8.762 1.00 0.22 N ATOM 2007 CA GLN A 119 -7.112 -5.702 10.189 1.00 0.29 C ATOM 2008 C GLN A 119 -7.723 -4.466 10.851 1.00 0.26 C ATOM 2009 O GLN A 119 -7.446 -4.182 12.017 1.00 0.40 O ATOM 2010 CB GLN A 119 -5.599 -5.715 10.419 1.00 0.36 C ATOM 2011 CG GLN A 119 -4.906 -6.932 9.832 1.00 0.56 C ATOM 2012 CD GLN A 119 -3.474 -7.066 10.306 1.00 0.70 C ATOM 2013 OE1 GLN A 119 -2.807 -6.071 10.593 1.00 1.49 O ATOM 2014 NE2 GLN A 119 -2.991 -8.299 10.387 1.00 0.36 N ATOM 0 H GLN A 119 -6.979 -5.005 8.215 1.00 0.22 H new ATOM 0 HA GLN A 119 -7.557 -6.586 10.645 1.00 0.29 H new ATOM 0 HB2 GLN A 119 -5.166 -4.815 9.983 1.00 0.36 H new ATOM 0 HB3 GLN A 119 -5.402 -5.677 11.490 1.00 0.36 H new ATOM 0 HG2 GLN A 119 -5.461 -7.829 10.104 1.00 0.56 H new ATOM 0 HG3 GLN A 119 -4.921 -6.866 8.744 1.00 0.56 H new ATOM 0 HE21 GLN A 119 -3.579 -9.095 10.139 1.00 0.36 H new ATOM 0 HE22 GLN A 119 -2.031 -8.451 10.697 1.00 0.36 H new ATOM 2023 N GLY A 120 -8.552 -3.729 10.111 1.00 0.26 N ATOM 2024 CA GLY A 120 -9.173 -2.538 10.664 1.00 0.25 C ATOM 2025 C GLY A 120 -8.324 -1.294 10.479 1.00 0.22 C ATOM 2026 O GLY A 120 -8.824 -0.175 10.588 1.00 0.35 O ATOM 0 H GLY A 120 -8.802 -3.935 9.144 1.00 0.26 H new ATOM 0 HA2 GLY A 120 -10.142 -2.385 10.189 1.00 0.25 H new ATOM 0 HA3 GLY A 120 -9.359 -2.691 11.727 1.00 0.25 H new ATOM 2030 N HIS A 121 -7.039 -1.487 10.199 1.00 0.20 N ATOM 2031 CA HIS A 121 -6.126 -0.371 10.003 1.00 0.18 C ATOM 2032 C HIS A 121 -5.745 -0.235 8.537 1.00 0.17 C ATOM 2033 O HIS A 121 -5.348 -1.207 7.895 1.00 0.26 O ATOM 2034 CB HIS A 121 -4.868 -0.549 10.853 1.00 0.21 C ATOM 2035 CG HIS A 121 -5.066 -0.196 12.293 1.00 0.23 C ATOM 2036 ND1 HIS A 121 -4.956 -1.111 13.319 1.00 0.29 N ATOM 2037 CD2 HIS A 121 -5.361 0.987 12.875 1.00 0.24 C ATOM 2038 CE1 HIS A 121 -5.177 -0.504 14.471 1.00 0.32 C ATOM 2039 NE2 HIS A 121 -5.425 0.770 14.229 1.00 0.29 N ATOM 0 H HIS A 121 -6.608 -2.407 10.103 1.00 0.20 H new ATOM 0 HA HIS A 121 -6.637 0.539 10.316 1.00 0.18 H new ATOM 0 HB2 HIS A 121 -4.536 -1.585 10.783 1.00 0.21 H new ATOM 0 HB3 HIS A 121 -4.071 0.070 10.442 1.00 0.21 H new ATOM 0 HD2 HIS A 121 -5.517 1.928 12.369 1.00 0.24 H new ATOM 0 HE1 HIS A 121 -5.158 -0.970 15.445 1.00 0.32 H new ATOM 0 HE2 HIS A 121 -5.631 1.478 14.934 1.00 0.29 H new ATOM 2048 N ILE A 122 -5.866 0.977 8.014 1.00 0.09 N ATOM 2049 CA ILE A 122 -5.534 1.236 6.624 1.00 0.08 C ATOM 2050 C ILE A 122 -4.771 2.546 6.484 1.00 0.08 C ATOM 2051 O ILE A 122 -4.974 3.480 7.261 1.00 0.12 O ATOM 2052 CB ILE A 122 -6.799 1.268 5.744 1.00 0.08 C ATOM 2053 CG1 ILE A 122 -6.418 1.215 4.269 1.00 0.09 C ATOM 2054 CG2 ILE A 122 -7.633 2.507 6.038 1.00 0.10 C ATOM 2055 CD1 ILE A 122 -7.539 0.728 3.378 1.00 0.12 C ATOM 0 H ILE A 122 -6.191 1.794 8.532 1.00 0.09 H new ATOM 0 HA ILE A 122 -4.897 0.420 6.282 1.00 0.08 H new ATOM 0 HB ILE A 122 -7.403 0.392 5.979 1.00 0.08 H new ATOM 0 HG12 ILE A 122 -6.111 2.209 3.944 1.00 0.09 H new ATOM 0 HG13 ILE A 122 -5.556 0.560 4.147 1.00 0.09 H new ATOM 0 HG21 ILE A 122 -8.520 2.507 5.405 1.00 0.10 H new ATOM 0 HG22 ILE A 122 -7.935 2.502 7.085 1.00 0.10 H new ATOM 0 HG23 ILE A 122 -7.042 3.400 5.835 1.00 0.10 H new ATOM 0 HD11 ILE A 122 -7.201 0.715 2.342 1.00 0.12 H new ATOM 0 HD12 ILE A 122 -7.831 -0.279 3.678 1.00 0.12 H new ATOM 0 HD13 ILE A 122 -8.395 1.397 3.472 1.00 0.12 H new ATOM 2067 N ILE A 123 -3.897 2.611 5.490 1.00 0.08 N ATOM 2068 CA ILE A 123 -3.097 3.802 5.262 1.00 0.08 C ATOM 2069 C ILE A 123 -3.608 4.603 4.075 1.00 0.08 C ATOM 2070 O ILE A 123 -3.627 4.120 2.942 1.00 0.09 O ATOM 2071 CB ILE A 123 -1.621 3.439 5.035 1.00 0.09 C ATOM 2072 CG1 ILE A 123 -1.105 2.651 6.235 1.00 0.10 C ATOM 2073 CG2 ILE A 123 -0.790 4.695 4.812 1.00 0.09 C ATOM 2074 CD1 ILE A 123 0.341 2.233 6.123 1.00 0.10 C ATOM 0 H ILE A 123 -3.725 1.853 4.830 1.00 0.08 H new ATOM 0 HA ILE A 123 -3.183 4.417 6.158 1.00 0.08 H new ATOM 0 HB ILE A 123 -1.534 2.821 4.141 1.00 0.09 H new ATOM 0 HG12 ILE A 123 -1.229 3.256 7.133 1.00 0.10 H new ATOM 0 HG13 ILE A 123 -1.720 1.761 6.363 1.00 0.10 H new ATOM 0 HG21 ILE A 123 0.252 4.418 4.653 1.00 0.09 H new ATOM 0 HG22 ILE A 123 -1.162 5.227 3.936 1.00 0.09 H new ATOM 0 HG23 ILE A 123 -0.865 5.341 5.687 1.00 0.09 H new ATOM 0 HD11 ILE A 123 0.630 1.678 7.016 1.00 0.10 H new ATOM 0 HD12 ILE A 123 0.470 1.600 5.245 1.00 0.10 H new ATOM 0 HD13 ILE A 123 0.969 3.119 6.027 1.00 0.10 H new ATOM 2086 N LEU A 124 -4.023 5.830 4.350 1.00 0.08 N ATOM 2087 CA LEU A 124 -4.528 6.715 3.314 1.00 0.09 C ATOM 2088 C LEU A 124 -3.404 7.595 2.783 1.00 0.09 C ATOM 2089 O LEU A 124 -2.666 8.203 3.557 1.00 0.09 O ATOM 2090 CB LEU A 124 -5.660 7.579 3.870 1.00 0.10 C ATOM 2091 CG LEU A 124 -6.765 6.804 4.590 1.00 0.11 C ATOM 2092 CD1 LEU A 124 -7.810 7.758 5.147 1.00 0.16 C ATOM 2093 CD2 LEU A 124 -7.406 5.794 3.651 1.00 0.13 C ATOM 0 H LEU A 124 -4.019 6.236 5.286 1.00 0.08 H new ATOM 0 HA LEU A 124 -4.917 6.113 2.493 1.00 0.09 H new ATOM 0 HB2 LEU A 124 -5.236 8.307 4.562 1.00 0.10 H new ATOM 0 HB3 LEU A 124 -6.106 8.141 3.049 1.00 0.10 H new ATOM 0 HG LEU A 124 -6.319 6.261 5.424 1.00 0.11 H new ATOM 0 HD11 LEU A 124 -8.588 7.189 5.656 1.00 0.16 H new ATOM 0 HD12 LEU A 124 -7.339 8.441 5.854 1.00 0.16 H new ATOM 0 HD13 LEU A 124 -8.253 8.329 4.331 1.00 0.16 H new ATOM 0 HD21 LEU A 124 -8.190 5.252 4.180 1.00 0.13 H new ATOM 0 HD22 LEU A 124 -7.838 6.315 2.797 1.00 0.13 H new ATOM 0 HD23 LEU A 124 -6.650 5.090 3.302 1.00 0.13 H new ATOM 2105 N ILE A 125 -3.276 7.660 1.463 1.00 0.10 N ATOM 2106 CA ILE A 125 -2.230 8.459 0.845 1.00 0.11 C ATOM 2107 C ILE A 125 -2.811 9.627 0.057 1.00 0.12 C ATOM 2108 O ILE A 125 -3.920 9.555 -0.472 1.00 0.17 O ATOM 2109 CB ILE A 125 -1.337 7.606 -0.084 1.00 0.12 C ATOM 2110 CG1 ILE A 125 -0.644 6.504 0.714 1.00 0.11 C ATOM 2111 CG2 ILE A 125 -0.301 8.471 -0.792 1.00 0.13 C ATOM 2112 CD1 ILE A 125 -1.519 5.296 0.968 1.00 0.11 C ATOM 0 H ILE A 125 -3.882 7.171 0.804 1.00 0.10 H new ATOM 0 HA ILE A 125 -1.618 8.851 1.657 1.00 0.11 H new ATOM 0 HB ILE A 125 -1.975 7.149 -0.841 1.00 0.12 H new ATOM 0 HG12 ILE A 125 0.251 6.187 0.178 1.00 0.11 H new ATOM 0 HG13 ILE A 125 -0.316 6.911 1.670 1.00 0.11 H new ATOM 0 HG21 ILE A 125 0.314 7.846 -1.439 1.00 0.13 H new ATOM 0 HG22 ILE A 125 -0.807 9.227 -1.392 1.00 0.13 H new ATOM 0 HG23 ILE A 125 0.332 8.960 -0.052 1.00 0.13 H new ATOM 0 HD11 ILE A 125 -0.960 4.555 1.540 1.00 0.11 H new ATOM 0 HD12 ILE A 125 -2.402 5.598 1.531 1.00 0.11 H new ATOM 0 HD13 ILE A 125 -1.827 4.863 0.016 1.00 0.11 H new ATOM 2124 N ALA A 126 -2.038 10.702 -0.006 1.00 0.12 N ATOM 2125 CA ALA A 126 -2.428 11.906 -0.718 1.00 0.14 C ATOM 2126 C ALA A 126 -1.194 12.619 -1.250 1.00 0.13 C ATOM 2127 O ALA A 126 -0.154 12.638 -0.598 1.00 0.21 O ATOM 2128 CB ALA A 126 -3.214 12.826 0.201 1.00 0.17 C ATOM 0 H ALA A 126 -1.121 10.762 0.437 1.00 0.12 H new ATOM 0 HA ALA A 126 -3.063 11.629 -1.560 1.00 0.14 H new ATOM 0 HB1 ALA A 126 -3.501 13.726 -0.344 1.00 0.17 H new ATOM 0 HB2 ALA A 126 -4.109 12.312 0.551 1.00 0.17 H new ATOM 0 HB3 ALA A 126 -2.596 13.101 1.056 1.00 0.17 H new ATOM 2134 N SER A 127 -1.305 13.201 -2.435 1.00 0.19 N ATOM 2135 CA SER A 127 -0.177 13.902 -3.030 1.00 0.19 C ATOM 2136 C SER A 127 -0.561 15.299 -3.491 1.00 0.26 C ATOM 2137 O SER A 127 -1.735 15.598 -3.705 1.00 0.28 O ATOM 2138 CB SER A 127 0.387 13.106 -4.206 1.00 0.23 C ATOM 2139 OG SER A 127 1.533 13.740 -4.747 1.00 0.27 O ATOM 0 H SER A 127 -2.155 13.202 -2.999 1.00 0.19 H new ATOM 0 HA SER A 127 0.588 13.999 -2.259 1.00 0.19 H new ATOM 0 HB2 SER A 127 0.645 12.099 -3.877 1.00 0.23 H new ATOM 0 HB3 SER A 127 -0.375 13.003 -4.979 1.00 0.23 H new ATOM 0 HG SER A 127 1.597 13.539 -5.704 1.00 0.27 H new ATOM 2145 N ARG A 128 0.446 16.149 -3.644 1.00 0.40 N ATOM 2146 CA ARG A 128 0.235 17.525 -4.079 1.00 0.53 C ATOM 2147 C ARG A 128 -0.672 17.582 -5.304 1.00 0.55 C ATOM 2148 O ARG A 128 -1.634 18.350 -5.342 1.00 0.83 O ATOM 2149 CB ARG A 128 1.577 18.184 -4.395 1.00 0.80 C ATOM 2150 CG ARG A 128 2.550 18.166 -3.230 1.00 0.95 C ATOM 2151 CD ARG A 128 3.870 18.825 -3.596 1.00 1.25 C ATOM 2152 NE ARG A 128 3.697 20.228 -3.964 1.00 1.65 N ATOM 2153 CZ ARG A 128 4.708 21.072 -4.147 1.00 1.99 C ATOM 2154 NH1 ARG A 128 5.958 20.651 -4.008 1.00 1.94 N ATOM 2155 NH2 ARG A 128 4.470 22.335 -4.472 1.00 2.54 N ATOM 0 H ARG A 128 1.422 15.909 -3.472 1.00 0.40 H new ATOM 0 HA ARG A 128 -0.253 18.066 -3.268 1.00 0.53 H new ATOM 0 HB2 ARG A 128 2.031 17.675 -5.245 1.00 0.80 H new ATOM 0 HB3 ARG A 128 1.403 19.217 -4.697 1.00 0.80 H new ATOM 0 HG2 ARG A 128 2.108 18.682 -2.378 1.00 0.95 H new ATOM 0 HG3 ARG A 128 2.730 17.136 -2.921 1.00 0.95 H new ATOM 0 HD2 ARG A 128 4.557 18.753 -2.753 1.00 1.25 H new ATOM 0 HD3 ARG A 128 4.327 18.286 -4.426 1.00 1.25 H new ATOM 0 HE ARG A 128 2.748 20.580 -4.087 1.00 1.65 H new ATOM 0 HH11 ARG A 128 6.144 19.679 -3.761 1.00 1.94 H new ATOM 0 HH12 ARG A 128 6.733 21.299 -4.149 1.00 1.94 H new ATOM 0 HH21 ARG A 128 3.510 22.661 -4.582 1.00 2.54 H new ATOM 0 HH22 ARG A 128 5.247 22.981 -4.612 1.00 2.54 H new ATOM 2169 N SER A 129 -0.362 16.761 -6.301 1.00 0.60 N ATOM 2170 CA SER A 129 -1.144 16.724 -7.531 1.00 0.69 C ATOM 2171 C SER A 129 -2.461 15.983 -7.325 1.00 0.72 C ATOM 2172 O SER A 129 -3.419 16.184 -8.073 1.00 1.08 O ATOM 2173 CB SER A 129 -0.341 16.059 -8.651 1.00 0.89 C ATOM 2174 OG SER A 129 -1.086 16.014 -9.856 1.00 1.55 O ATOM 0 H SER A 129 0.425 16.112 -6.282 1.00 0.60 H new ATOM 0 HA SER A 129 -1.371 17.752 -7.814 1.00 0.69 H new ATOM 0 HB2 SER A 129 0.586 16.609 -8.813 1.00 0.89 H new ATOM 0 HB3 SER A 129 -0.064 15.048 -8.353 1.00 0.89 H new ATOM 0 HG SER A 129 -0.550 15.586 -10.556 1.00 1.55 H new ATOM 2180 N SER A 130 -2.506 15.127 -6.310 1.00 0.58 N ATOM 2181 CA SER A 130 -3.710 14.359 -6.017 1.00 0.74 C ATOM 2182 C SER A 130 -3.852 14.111 -4.520 1.00 0.97 C ATOM 2183 O SER A 130 -3.380 13.099 -4.001 1.00 1.60 O ATOM 2184 CB SER A 130 -3.685 13.027 -6.761 1.00 1.13 C ATOM 2185 OG SER A 130 -3.633 13.225 -8.163 1.00 1.78 O ATOM 0 H SER A 130 -1.725 14.948 -5.678 1.00 0.58 H new ATOM 0 HA SER A 130 -4.568 14.942 -6.353 1.00 0.74 H new ATOM 0 HB2 SER A 130 -2.821 12.445 -6.441 1.00 1.13 H new ATOM 0 HB3 SER A 130 -4.572 12.448 -6.505 1.00 1.13 H new ATOM 0 HG SER A 130 -3.616 12.356 -8.616 1.00 1.78 H new ATOM 2191 N VAL A 131 -4.507 15.038 -3.834 1.00 1.26 N ATOM 2192 CA VAL A 131 -4.714 14.921 -2.398 1.00 1.73 C ATOM 2193 C VAL A 131 -6.075 14.309 -2.085 1.00 1.69 C ATOM 2194 O VAL A 131 -6.281 13.748 -1.008 1.00 2.16 O ATOM 2195 CB VAL A 131 -4.618 16.291 -1.704 1.00 2.26 C ATOM 2196 CG1 VAL A 131 -3.259 16.924 -1.952 1.00 2.59 C ATOM 2197 CG2 VAL A 131 -5.736 17.208 -2.178 1.00 2.28 C ATOM 0 H VAL A 131 -4.904 15.880 -4.250 1.00 1.26 H new ATOM 0 HA VAL A 131 -3.926 14.269 -2.020 1.00 1.73 H new ATOM 0 HB VAL A 131 -4.731 16.142 -0.630 1.00 2.26 H new ATOM 0 HG11 VAL A 131 -3.212 17.892 -1.453 1.00 2.59 H new ATOM 0 HG12 VAL A 131 -2.478 16.274 -1.558 1.00 2.59 H new ATOM 0 HG13 VAL A 131 -3.111 17.061 -3.023 1.00 2.59 H new ATOM 0 HG21 VAL A 131 -5.653 18.172 -1.677 1.00 2.28 H new ATOM 0 HG22 VAL A 131 -5.657 17.351 -3.256 1.00 2.28 H new ATOM 0 HG23 VAL A 131 -6.700 16.758 -1.941 1.00 2.28 H new ATOM 2207 N ALA A 132 -7.001 14.421 -3.030 1.00 1.45 N ATOM 2208 CA ALA A 132 -8.343 13.889 -2.848 1.00 1.75 C ATOM 2209 C ALA A 132 -8.699 12.896 -3.948 1.00 2.08 C ATOM 2210 O ALA A 132 -9.874 12.670 -4.237 1.00 2.50 O ATOM 2211 CB ALA A 132 -9.349 15.026 -2.816 1.00 1.89 C ATOM 0 H ALA A 132 -6.846 14.876 -3.930 1.00 1.45 H new ATOM 0 HA ALA A 132 -8.373 13.356 -1.898 1.00 1.75 H new ATOM 0 HB1 ALA A 132 -10.352 14.621 -2.680 1.00 1.89 H new ATOM 0 HB2 ALA A 132 -9.113 15.697 -1.990 1.00 1.89 H new ATOM 0 HB3 ALA A 132 -9.305 15.577 -3.755 1.00 1.89 H new ATOM 2217 N GLY A 133 -7.678 12.306 -4.557 1.00 2.20 N ATOM 2218 CA GLY A 133 -7.904 11.347 -5.621 1.00 2.72 C ATOM 2219 C GLY A 133 -8.509 11.986 -6.855 1.00 2.49 C ATOM 2220 O GLY A 133 -9.672 11.751 -7.179 1.00 2.56 O ATOM 0 H GLY A 133 -6.697 12.475 -4.333 1.00 2.20 H new ATOM 0 HA2 GLY A 133 -6.959 10.873 -5.887 1.00 2.72 H new ATOM 0 HA3 GLY A 133 -8.566 10.559 -5.262 1.00 2.72 H new ATOM 2224 N LYS A 134 -7.715 12.798 -7.546 1.00 2.56 N ATOM 2225 CA LYS A 134 -8.177 13.477 -8.751 1.00 2.53 C ATOM 2226 C LYS A 134 -7.885 12.642 -9.992 1.00 2.33 C ATOM 2227 O LYS A 134 -8.656 12.648 -10.952 1.00 2.66 O ATOM 2228 CB LYS A 134 -7.509 14.845 -8.875 1.00 3.01 C ATOM 2229 CG LYS A 134 -7.966 15.642 -10.086 1.00 3.36 C ATOM 2230 CD LYS A 134 -7.232 16.970 -10.186 1.00 4.13 C ATOM 2231 CE LYS A 134 -7.384 17.789 -8.915 1.00 4.97 C ATOM 2232 NZ LYS A 134 -6.689 19.102 -9.013 1.00 5.84 N ATOM 0 H LYS A 134 -6.748 13.002 -7.292 1.00 2.56 H new ATOM 0 HA LYS A 134 -9.256 13.611 -8.672 1.00 2.53 H new ATOM 0 HB2 LYS A 134 -7.714 15.422 -7.973 1.00 3.01 H new ATOM 0 HB3 LYS A 134 -6.429 14.708 -8.928 1.00 3.01 H new ATOM 0 HG2 LYS A 134 -7.794 15.061 -10.992 1.00 3.36 H new ATOM 0 HG3 LYS A 134 -9.039 15.822 -10.021 1.00 3.36 H new ATOM 0 HD2 LYS A 134 -6.175 16.789 -10.379 1.00 4.13 H new ATOM 0 HD3 LYS A 134 -7.618 17.537 -11.033 1.00 4.13 H new ATOM 0 HE2 LYS A 134 -8.443 17.953 -8.713 1.00 4.97 H new ATOM 0 HE3 LYS A 134 -6.982 17.228 -8.071 1.00 4.97 H new ATOM 0 HZ1 LYS A 134 -6.817 19.630 -8.126 1.00 5.84 H new ATOM 0 HZ2 LYS A 134 -5.674 18.946 -9.180 1.00 5.84 H new ATOM 0 HZ3 LYS A 134 -7.090 19.649 -9.802 1.00 5.84 H new ATOM 2246 N LEU A 135 -6.766 11.928 -9.968 1.00 2.03 N ATOM 2247 CA LEU A 135 -6.371 11.091 -11.092 1.00 2.01 C ATOM 2248 C LEU A 135 -7.355 9.943 -11.286 1.00 2.30 C ATOM 2249 O LEU A 135 -7.063 8.795 -10.953 1.00 2.68 O ATOM 2250 CB LEU A 135 -4.962 10.539 -10.877 1.00 1.88 C ATOM 2251 CG LEU A 135 -4.471 9.578 -11.960 1.00 2.28 C ATOM 2252 CD1 LEU A 135 -4.339 10.296 -13.294 1.00 2.66 C ATOM 2253 CD2 LEU A 135 -3.144 8.951 -11.558 1.00 2.33 C ATOM 0 H LEU A 135 -6.116 11.913 -9.182 1.00 2.03 H new ATOM 0 HA LEU A 135 -6.377 11.708 -11.990 1.00 2.01 H new ATOM 0 HB2 LEU A 135 -4.266 11.376 -10.813 1.00 1.88 H new ATOM 0 HB3 LEU A 135 -4.932 10.025 -9.916 1.00 1.88 H new ATOM 0 HG LEU A 135 -5.208 8.782 -12.070 1.00 2.28 H new ATOM 0 HD11 LEU A 135 -3.988 9.595 -14.051 1.00 2.66 H new ATOM 0 HD12 LEU A 135 -5.309 10.695 -13.590 1.00 2.66 H new ATOM 0 HD13 LEU A 135 -3.625 11.114 -13.198 1.00 2.66 H new ATOM 0 HD21 LEU A 135 -2.811 8.270 -12.341 1.00 2.33 H new ATOM 0 HD22 LEU A 135 -2.399 9.734 -11.417 1.00 2.33 H new ATOM 0 HD23 LEU A 135 -3.270 8.399 -10.627 1.00 2.33 H new ATOM 2265 N ALA A 136 -8.526 10.267 -11.823 1.00 2.40 N ATOM 2266 CA ALA A 136 -9.559 9.268 -12.067 1.00 2.83 C ATOM 2267 C ALA A 136 -9.362 8.594 -13.420 1.00 2.82 C ATOM 2268 O ALA A 136 -9.731 9.144 -14.457 1.00 3.32 O ATOM 2269 CB ALA A 136 -10.937 9.906 -11.989 1.00 3.52 C ATOM 0 H ALA A 136 -8.783 11.215 -12.098 1.00 2.40 H new ATOM 0 HA ALA A 136 -9.480 8.503 -11.295 1.00 2.83 H new ATOM 0 HB1 ALA A 136 -11.699 9.149 -12.173 1.00 3.52 H new ATOM 0 HB2 ALA A 136 -11.084 10.335 -10.998 1.00 3.52 H new ATOM 0 HB3 ALA A 136 -11.017 10.692 -12.740 1.00 3.52 H new ATOM 2275 N LYS A 137 -8.778 7.401 -13.402 1.00 2.71 N ATOM 2276 CA LYS A 137 -8.533 6.652 -14.629 1.00 3.21 C ATOM 2277 C LYS A 137 -9.844 6.301 -15.323 1.00 3.74 C ATOM 2278 O LYS A 137 -10.321 7.123 -16.135 1.00 4.08 O ATOM 2279 CB LYS A 137 -7.746 5.373 -14.326 1.00 3.53 C ATOM 2280 CG LYS A 137 -7.391 4.571 -15.567 1.00 4.27 C ATOM 2281 CD LYS A 137 -6.617 3.311 -15.215 1.00 4.96 C ATOM 2282 CE LYS A 137 -7.459 2.352 -14.388 1.00 5.65 C ATOM 2283 NZ LYS A 137 -8.668 1.895 -15.128 1.00 6.33 N ATOM 2284 OXT LYS A 137 -10.383 5.207 -15.053 1.00 4.29 O ATOM 0 H LYS A 137 -8.466 6.932 -12.552 1.00 2.71 H new ATOM 0 HA LYS A 137 -7.945 7.282 -15.296 1.00 3.21 H new ATOM 0 HB2 LYS A 137 -6.829 5.636 -13.799 1.00 3.53 H new ATOM 0 HB3 LYS A 137 -8.332 4.746 -13.653 1.00 3.53 H new ATOM 0 HG2 LYS A 137 -8.303 4.302 -16.100 1.00 4.27 H new ATOM 0 HG3 LYS A 137 -6.797 5.187 -16.242 1.00 4.27 H new ATOM 0 HD2 LYS A 137 -6.292 2.815 -16.130 1.00 4.96 H new ATOM 0 HD3 LYS A 137 -5.718 3.578 -14.660 1.00 4.96 H new ATOM 0 HE2 LYS A 137 -6.856 1.488 -14.109 1.00 5.65 H new ATOM 0 HE3 LYS A 137 -7.763 2.841 -13.463 1.00 5.65 H new ATOM 0 HZ1 LYS A 137 -9.075 1.066 -14.650 1.00 6.33 H new ATOM 0 HZ2 LYS A 137 -9.371 2.661 -15.151 1.00 6.33 H new ATOM 0 HZ3 LYS A 137 -8.403 1.639 -16.101 1.00 6.33 H new TER 2298 LYS A 137