USER MOD reduce.3.24.130724 H: found=0, std=0, add=1163, rem=0, adj=30 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 Single : A 0 ASN : amide:sc= -0.888 K(o=-0.89,f=-2!) 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 27:sc= 0.105 USER MOD Single : A 5 HIS : no HD1:sc= -0.189 X(o=-0.19,f=-4.9e-05) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 120:sc= -0.0552 USER MOD Single : A -2 MET CE :methyl -149:sc= -0.164 (180deg=-0.754) USER MOD Single : A -4 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot 30:sc= -1.44 USER MOD Single : A 19 GLN : amide:sc= -0.182 K(o=-0.18,f=-1.4!) USER MOD Single : A 20 TYR OH : rot 180:sc= -0.816 USER MOD Single : A 21 HIS : no HD1:sc= -5.52! C(o=-5.5!,f=-9.2!) USER MOD Single : A 22 ASN : amide:sc= -1.21 K(o=-1.2,f=-4.3!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -1.37 K(o=-1.4,f=-2) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 -25:sc= 1.21 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+ -122:sc= 0.564 (180deg=-0.704) USER MOD Single : A 52 SER OG : rot -21:sc= 0.648 USER MOD Single : A 56 LYS NZ :NH3+ 169:sc= -0.0224 (180deg=-0.223) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN :FLIP amide:sc= -0.0866 F(o=-0.71,f=-0.087) USER MOD Single : A 61 LYS NZ :NH3+ 141:sc= -0.0541 (180deg=-0.387) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot -122:sc= -1.63! USER MOD Single : A 68 ASN :FLIP amide:sc= -0.895! F(o=-1.7,f=-0.89!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc= -1.01 K(o=-1,f=-8.1!) USER MOD Single : A 87 THR OG1 : rot -34:sc= -2.54 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 150:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 167:sc=-0.00749 (180deg=-0.188) USER MOD Single : A 94 ASN : amide:sc= -0.519 K(o=-0.52,f=-1.4) USER MOD Single : A 96 TYR OH : rot 40:sc= -2.58! USER MOD Single : A 103 GLN : amide:sc= -7.63! C(o=-7.6!,f=-11!) USER MOD Single : A 105 ASN : amide:sc= -2.47! C(o=-2.5!,f=-4.1!) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 TYR OH : rot -146:sc= 0.95 USER MOD Single : A 119 GLN : amide:sc= -1.35 K(o=-1.4,f=-7.4!) USER MOD Single : A 121 HIS : no HD1:sc= -1.99 X(o=-2,f=-2.4!) USER MOD Single : A 127 SER OG : rot -160:sc= -0.32 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 4:sc= 0.393 USER MOD Single : A 134 LYS NZ :NH3+ 167:sc= -0.0597 (180deg=-0.296) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 28.199 -5.117 1.369 1.00 11.02 N ATOM 2 CA GLY A -4 26.733 -5.372 1.334 1.00 10.52 C ATOM 3 C GLY A -4 26.181 -5.401 -0.078 1.00 10.30 C ATOM 4 O GLY A -4 26.097 -4.367 -0.740 1.00 10.51 O ATOM 0 H1 GLY A -4 28.526 -5.107 2.356 1.00 11.02 H new ATOM 0 H2 GLY A -4 28.695 -5.868 0.848 1.00 11.02 H new ATOM 0 H3 GLY A -4 28.402 -4.197 0.928 1.00 11.02 H new ATOM 0 HA2 GLY A -4 26.521 -6.323 1.823 1.00 10.52 H new ATOM 0 HA3 GLY A -4 26.219 -4.599 1.905 1.00 10.52 H new ATOM 10 N ALA A -3 25.805 -6.590 -0.539 1.00 10.11 N ATOM 11 CA ALA A -3 25.259 -6.752 -1.881 1.00 10.15 C ATOM 12 C ALA A -3 26.284 -6.357 -2.939 1.00 9.98 C ATOM 13 O ALA A -3 26.025 -5.494 -3.777 1.00 10.45 O ATOM 14 CB ALA A -3 23.991 -5.927 -2.038 1.00 10.85 C ATOM 0 H ALA A -3 25.869 -7.455 -0.002 1.00 10.11 H new ATOM 0 HA ALA A -3 25.014 -7.804 -2.024 1.00 10.15 H new ATOM 0 HB1 ALA A -3 23.594 -6.058 -3.045 1.00 10.85 H new ATOM 0 HB2 ALA A -3 23.250 -6.257 -1.310 1.00 10.85 H new ATOM 0 HB3 ALA A -3 24.219 -4.874 -1.872 1.00 10.85 H new ATOM 20 N MET A -2 27.448 -6.998 -2.895 1.00 9.54 N ATOM 21 CA MET A -2 28.513 -6.714 -3.849 1.00 9.62 C ATOM 22 C MET A -2 29.752 -7.553 -3.541 1.00 9.46 C ATOM 23 O MET A -2 30.413 -7.349 -2.525 1.00 9.56 O ATOM 24 CB MET A -2 28.867 -5.223 -3.821 1.00 9.74 C ATOM 25 CG MET A -2 29.279 -4.713 -2.445 1.00 10.00 C ATOM 26 SD MET A -2 29.555 -2.932 -2.424 1.00 10.44 S ATOM 27 CE MET A -2 30.792 -2.765 -3.709 1.00 10.72 C ATOM 0 H MET A -2 27.677 -7.717 -2.209 1.00 9.54 H new ATOM 0 HA MET A -2 28.158 -6.975 -4.846 1.00 9.62 H new ATOM 0 HB2 MET A -2 29.679 -5.039 -4.524 1.00 9.74 H new ATOM 0 HB3 MET A -2 28.008 -4.649 -4.169 1.00 9.74 H new ATOM 0 HG2 MET A -2 28.505 -4.966 -1.720 1.00 10.00 H new ATOM 0 HG3 MET A -2 30.190 -5.222 -2.130 1.00 10.00 H new ATOM 0 HE1 MET A -2 31.446 -1.924 -3.478 1.00 10.72 H new ATOM 0 HE2 MET A -2 31.383 -3.679 -3.766 1.00 10.72 H new ATOM 0 HE3 MET A -2 30.301 -2.590 -4.666 1.00 10.72 H new ATOM 37 N ALA A -1 30.055 -8.502 -4.423 1.00 9.48 N ATOM 38 CA ALA A -1 31.213 -9.370 -4.240 1.00 9.64 C ATOM 39 C ALA A -1 31.023 -10.289 -3.039 1.00 9.49 C ATOM 40 O ALA A -1 31.980 -10.622 -2.340 1.00 10.19 O ATOM 41 CB ALA A -1 32.477 -8.540 -4.075 1.00 10.62 C ATOM 0 H ALA A -1 29.516 -8.689 -5.269 1.00 9.48 H new ATOM 0 HA ALA A -1 31.314 -9.991 -5.130 1.00 9.64 H new ATOM 0 HB1 ALA A -1 33.332 -9.202 -3.939 1.00 10.62 H new ATOM 0 HB2 ALA A -1 32.629 -7.928 -4.964 1.00 10.62 H new ATOM 0 HB3 ALA A -1 32.377 -7.894 -3.203 1.00 10.62 H new ATOM 47 N ASN A 0 29.780 -10.696 -2.806 1.00 8.80 N ATOM 48 CA ASN A 0 29.458 -11.576 -1.689 1.00 8.90 C ATOM 49 C ASN A 0 28.452 -12.639 -2.114 1.00 8.17 C ATOM 50 O ASN A 0 27.262 -12.536 -1.814 1.00 8.36 O ATOM 51 CB ASN A 0 28.898 -10.766 -0.518 1.00 9.21 C ATOM 52 CG ASN A 0 29.889 -9.739 -0.001 1.00 9.30 C ATOM 53 OD1 ASN A 0 31.102 -9.940 -0.072 1.00 9.55 O ATOM 54 ND2 ASN A 0 29.379 -8.630 0.527 1.00 9.37 N ATOM 0 H ASN A 0 28.978 -10.430 -3.377 1.00 8.80 H new ATOM 0 HA ASN A 0 30.375 -12.072 -1.371 1.00 8.90 H new ATOM 0 HB2 ASN A 0 27.985 -10.260 -0.833 1.00 9.21 H new ATOM 0 HB3 ASN A 0 28.625 -11.443 0.291 1.00 9.21 H new ATOM 0 HD21 ASN A 0 29.999 -7.907 0.892 1.00 9.37 H new ATOM 0 HD22 ASN A 0 28.368 -8.502 0.567 1.00 9.37 H new ATOM 61 N SER A 1 28.938 -13.655 -2.821 1.00 7.57 N ATOM 62 CA SER A 1 28.084 -14.739 -3.294 1.00 7.04 C ATOM 63 C SER A 1 27.129 -14.244 -4.377 1.00 6.32 C ATOM 64 O SER A 1 27.229 -14.650 -5.535 1.00 6.00 O ATOM 65 CB SER A 1 27.297 -15.347 -2.132 1.00 7.04 C ATOM 66 OG SER A 1 28.167 -15.775 -1.098 1.00 7.69 O ATOM 0 H SER A 1 29.920 -13.750 -3.079 1.00 7.57 H new ATOM 0 HA SER A 1 28.723 -15.510 -3.725 1.00 7.04 H new ATOM 0 HB2 SER A 1 26.594 -14.612 -1.740 1.00 7.04 H new ATOM 0 HB3 SER A 1 26.708 -16.192 -2.489 1.00 7.04 H new ATOM 0 HG SER A 1 27.641 -16.158 -0.366 1.00 7.69 H new ATOM 72 N ASP A 2 26.208 -13.363 -3.995 1.00 6.42 N ATOM 73 CA ASP A 2 25.240 -12.812 -4.939 1.00 6.11 C ATOM 74 C ASP A 2 24.639 -11.513 -4.411 1.00 5.30 C ATOM 75 O ASP A 2 24.893 -11.118 -3.272 1.00 5.37 O ATOM 76 CB ASP A 2 24.121 -13.820 -5.214 1.00 6.52 C ATOM 77 CG ASP A 2 24.620 -15.072 -5.910 1.00 7.29 C ATOM 78 OD1 ASP A 2 24.639 -15.090 -7.158 1.00 7.68 O ATOM 79 OD2 ASP A 2 24.989 -16.035 -5.206 1.00 7.71 O ATOM 0 H ASP A 2 26.112 -13.016 -3.041 1.00 6.42 H new ATOM 0 HA ASP A 2 25.768 -12.601 -5.869 1.00 6.11 H new ATOM 0 HB2 ASP A 2 23.647 -14.097 -4.272 1.00 6.52 H new ATOM 0 HB3 ASP A 2 23.355 -13.348 -5.829 1.00 6.52 H new ATOM 84 N SER A 3 23.843 -10.853 -5.246 1.00 4.91 N ATOM 85 CA SER A 3 23.199 -9.601 -4.863 1.00 4.46 C ATOM 86 C SER A 3 21.684 -9.705 -5.003 1.00 3.40 C ATOM 87 O SER A 3 21.085 -9.062 -5.866 1.00 3.58 O ATOM 88 CB SER A 3 23.722 -8.448 -5.722 1.00 5.33 C ATOM 89 OG SER A 3 23.127 -7.219 -5.339 1.00 5.63 O ATOM 0 H SER A 3 23.628 -11.164 -6.193 1.00 4.91 H new ATOM 0 HA SER A 3 23.439 -9.404 -3.818 1.00 4.46 H new ATOM 0 HB2 SER A 3 24.805 -8.378 -5.623 1.00 5.33 H new ATOM 0 HB3 SER A 3 23.510 -8.647 -6.772 1.00 5.33 H new ATOM 0 HG SER A 3 23.478 -6.497 -5.901 1.00 5.63 H new ATOM 95 N CYS A 4 21.068 -10.518 -4.150 1.00 2.86 N ATOM 96 CA CYS A 4 19.622 -10.706 -4.183 1.00 2.40 C ATOM 97 C CYS A 4 18.902 -9.500 -3.586 1.00 1.90 C ATOM 98 O CYS A 4 19.273 -9.011 -2.519 1.00 2.51 O ATOM 99 CB CYS A 4 19.230 -11.974 -3.421 1.00 3.21 C ATOM 100 SG CYS A 4 19.698 -11.959 -1.674 1.00 3.99 S ATOM 0 H CYS A 4 21.547 -11.056 -3.428 1.00 2.86 H new ATOM 0 HA CYS A 4 19.321 -10.810 -5.225 1.00 2.40 H new ATOM 0 HB2 CYS A 4 18.151 -12.111 -3.496 1.00 3.21 H new ATOM 0 HB3 CYS A 4 19.695 -12.834 -3.903 1.00 3.21 H new ATOM 0 HG CYS A 4 19.754 -10.731 -1.250 1.00 3.99 H new ATOM 106 N HIS A 5 17.874 -9.025 -4.281 1.00 1.37 N ATOM 107 CA HIS A 5 17.103 -7.878 -3.815 1.00 1.06 C ATOM 108 C HIS A 5 15.835 -8.330 -3.100 1.00 0.81 C ATOM 109 O HIS A 5 14.854 -8.715 -3.736 1.00 0.79 O ATOM 110 CB HIS A 5 16.739 -6.962 -4.985 1.00 1.56 C ATOM 111 CG HIS A 5 15.926 -5.773 -4.580 1.00 1.02 C ATOM 112 ND1 HIS A 5 16.472 -4.527 -4.353 1.00 0.80 N ATOM 113 CD2 HIS A 5 14.596 -5.644 -4.362 1.00 0.83 C ATOM 114 CE1 HIS A 5 15.512 -3.683 -4.012 1.00 0.68 C ATOM 115 NE2 HIS A 5 14.365 -4.335 -4.011 1.00 0.64 N ATOM 0 H HIS A 5 17.556 -9.416 -5.168 1.00 1.37 H new ATOM 0 HA HIS A 5 17.723 -7.323 -3.110 1.00 1.06 H new ATOM 0 HB2 HIS A 5 17.655 -6.619 -5.467 1.00 1.56 H new ATOM 0 HB3 HIS A 5 16.184 -7.536 -5.727 1.00 1.56 H new ATOM 0 HD2 HIS A 5 13.854 -6.424 -4.448 1.00 0.83 H new ATOM 0 HE1 HIS A 5 15.645 -2.638 -3.775 1.00 0.68 H new ATOM 0 HE2 HIS A 5 13.455 -3.933 -3.786 1.00 0.64 H new ATOM 124 N LYS A 6 15.864 -8.283 -1.773 1.00 0.78 N ATOM 125 CA LYS A 6 14.717 -8.683 -0.972 1.00 0.64 C ATOM 126 C LYS A 6 13.523 -7.784 -1.256 1.00 0.60 C ATOM 127 O LYS A 6 13.621 -6.559 -1.183 1.00 0.96 O ATOM 128 CB LYS A 6 15.062 -8.638 0.515 1.00 0.77 C ATOM 129 CG LYS A 6 13.904 -9.023 1.420 1.00 1.44 C ATOM 130 CD LYS A 6 14.327 -9.062 2.880 1.00 1.86 C ATOM 131 CE LYS A 6 15.361 -10.149 3.131 1.00 2.27 C ATOM 132 NZ LYS A 6 15.738 -10.236 4.568 1.00 3.12 N ATOM 0 H LYS A 6 16.670 -7.972 -1.231 1.00 0.78 H new ATOM 0 HA LYS A 6 14.455 -9.706 -1.242 1.00 0.64 H new ATOM 0 HB2 LYS A 6 15.900 -9.309 0.706 1.00 0.77 H new ATOM 0 HB3 LYS A 6 15.394 -7.632 0.772 1.00 0.77 H new ATOM 0 HG2 LYS A 6 13.090 -8.309 1.295 1.00 1.44 H new ATOM 0 HG3 LYS A 6 13.520 -9.999 1.125 1.00 1.44 H new ATOM 0 HD2 LYS A 6 14.738 -8.094 3.167 1.00 1.86 H new ATOM 0 HD3 LYS A 6 13.454 -9.237 3.509 1.00 1.86 H new ATOM 0 HE2 LYS A 6 14.965 -11.109 2.801 1.00 2.27 H new ATOM 0 HE3 LYS A 6 16.251 -9.949 2.534 1.00 2.27 H new ATOM 0 HZ1 LYS A 6 16.444 -10.988 4.697 1.00 3.12 H new ATOM 0 HZ2 LYS A 6 16.139 -9.328 4.877 1.00 3.12 H new ATOM 0 HZ3 LYS A 6 14.894 -10.453 5.136 1.00 3.12 H new ATOM 146 N ILE A 7 12.398 -8.403 -1.585 1.00 0.35 N ATOM 147 CA ILE A 7 11.185 -7.664 -1.887 1.00 0.28 C ATOM 148 C ILE A 7 10.414 -7.326 -0.623 1.00 0.24 C ATOM 149 O ILE A 7 10.329 -8.129 0.306 1.00 0.31 O ATOM 150 CB ILE A 7 10.268 -8.456 -2.834 1.00 0.29 C ATOM 151 CG1 ILE A 7 11.018 -8.807 -4.116 1.00 0.36 C ATOM 152 CG2 ILE A 7 9.009 -7.661 -3.150 1.00 0.27 C ATOM 153 CD1 ILE A 7 10.186 -9.591 -5.104 1.00 0.43 C ATOM 0 H ILE A 7 12.302 -9.416 -1.649 1.00 0.35 H new ATOM 0 HA ILE A 7 11.495 -6.740 -2.376 1.00 0.28 H new ATOM 0 HB ILE A 7 9.970 -9.380 -2.340 1.00 0.29 H new ATOM 0 HG12 ILE A 7 11.361 -7.888 -4.590 1.00 0.36 H new ATOM 0 HG13 ILE A 7 11.906 -9.385 -3.861 1.00 0.36 H new ATOM 0 HG21 ILE A 7 8.373 -8.238 -3.821 1.00 0.27 H new ATOM 0 HG22 ILE A 7 8.468 -7.454 -2.227 1.00 0.27 H new ATOM 0 HG23 ILE A 7 9.283 -6.721 -3.629 1.00 0.27 H new ATOM 0 HD11 ILE A 7 10.782 -9.806 -5.991 1.00 0.43 H new ATOM 0 HD12 ILE A 7 9.865 -10.527 -4.647 1.00 0.43 H new ATOM 0 HD13 ILE A 7 9.311 -9.006 -5.387 1.00 0.43 H new ATOM 165 N ASP A 8 9.852 -6.128 -0.602 1.00 0.19 N ATOM 166 CA ASP A 8 9.074 -5.667 0.534 1.00 0.16 C ATOM 167 C ASP A 8 7.775 -5.038 0.053 1.00 0.14 C ATOM 168 O ASP A 8 7.771 -3.932 -0.485 1.00 0.14 O ATOM 169 CB ASP A 8 9.876 -4.657 1.353 1.00 0.19 C ATOM 170 CG ASP A 8 9.175 -4.274 2.642 1.00 1.13 C ATOM 171 OD1 ASP A 8 9.197 -5.083 3.593 1.00 1.06 O ATOM 172 OD2 ASP A 8 8.602 -3.166 2.698 1.00 2.04 O ATOM 0 H ASP A 8 9.922 -5.454 -1.365 1.00 0.19 H new ATOM 0 HA ASP A 8 8.840 -6.522 1.169 1.00 0.16 H new ATOM 0 HB2 ASP A 8 10.855 -5.077 1.585 1.00 0.19 H new ATOM 0 HB3 ASP A 8 10.047 -3.762 0.755 1.00 0.19 H new ATOM 177 N TYR A 9 6.674 -5.752 0.251 1.00 0.12 N ATOM 178 CA TYR A 9 5.365 -5.274 -0.171 1.00 0.12 C ATOM 179 C TYR A 9 5.126 -3.858 0.329 1.00 0.11 C ATOM 180 O TYR A 9 4.501 -3.046 -0.352 1.00 0.12 O ATOM 181 CB TYR A 9 4.275 -6.212 0.345 1.00 0.14 C ATOM 182 CG TYR A 9 4.615 -7.668 0.158 1.00 0.16 C ATOM 183 CD1 TYR A 9 5.246 -8.109 -0.993 1.00 0.15 C ATOM 184 CD2 TYR A 9 4.294 -8.601 1.134 1.00 0.24 C ATOM 185 CE1 TYR A 9 5.551 -9.444 -1.172 1.00 0.18 C ATOM 186 CE2 TYR A 9 4.595 -9.937 0.967 1.00 0.27 C ATOM 187 CZ TYR A 9 5.259 -10.347 -0.184 1.00 0.23 C ATOM 188 OH TYR A 9 5.522 -11.688 -0.357 1.00 0.27 O ATOM 0 H TYR A 9 6.663 -6.667 0.702 1.00 0.12 H new ATOM 0 HA TYR A 9 5.333 -5.261 -1.260 1.00 0.12 H new ATOM 0 HB2 TYR A 9 4.107 -6.017 1.404 1.00 0.14 H new ATOM 0 HB3 TYR A 9 3.341 -5.993 -0.172 1.00 0.14 H new ATOM 0 HD1 TYR A 9 5.504 -7.397 -1.763 1.00 0.15 H new ATOM 0 HD2 TYR A 9 3.801 -8.276 2.038 1.00 0.24 H new ATOM 0 HE1 TYR A 9 6.018 -9.775 -2.088 1.00 0.18 H new ATOM 0 HE2 TYR A 9 4.318 -10.657 1.723 1.00 0.27 H new ATOM 0 HH TYR A 9 6.148 -11.990 0.333 1.00 0.27 H new ATOM 198 N GLY A 10 5.635 -3.563 1.516 1.00 0.10 N ATOM 199 CA GLY A 10 5.471 -2.239 2.067 1.00 0.11 C ATOM 200 C GLY A 10 6.147 -1.204 1.200 1.00 0.10 C ATOM 201 O GLY A 10 5.504 -0.283 0.701 1.00 0.12 O ATOM 0 H GLY A 10 6.156 -4.215 2.103 1.00 0.10 H new ATOM 0 HA2 GLY A 10 4.410 -2.007 2.156 1.00 0.11 H new ATOM 0 HA3 GLY A 10 5.890 -2.205 3.073 1.00 0.11 H new ATOM 205 N LEU A 11 7.443 -1.376 0.988 1.00 0.10 N ATOM 206 CA LEU A 11 8.199 -0.454 0.161 1.00 0.11 C ATOM 207 C LEU A 11 7.599 -0.402 -1.232 1.00 0.11 C ATOM 208 O LEU A 11 7.505 0.662 -1.846 1.00 0.16 O ATOM 209 CB LEU A 11 9.657 -0.887 0.077 1.00 0.13 C ATOM 210 CG LEU A 11 10.564 0.072 -0.685 1.00 0.16 C ATOM 211 CD1 LEU A 11 10.672 1.398 0.052 1.00 0.13 C ATOM 212 CD2 LEU A 11 11.934 -0.552 -0.883 1.00 0.23 C ATOM 0 H LEU A 11 7.990 -2.144 1.377 1.00 0.10 H new ATOM 0 HA LEU A 11 8.153 0.537 0.612 1.00 0.11 H new ATOM 0 HB2 LEU A 11 10.045 -1.006 1.089 1.00 0.13 H new ATOM 0 HB3 LEU A 11 9.704 -1.866 -0.400 1.00 0.13 H new ATOM 0 HG LEU A 11 10.130 0.265 -1.666 1.00 0.16 H new ATOM 0 HD11 LEU A 11 11.323 2.072 -0.505 1.00 0.13 H new ATOM 0 HD12 LEU A 11 9.682 1.844 0.145 1.00 0.13 H new ATOM 0 HD13 LEU A 11 11.089 1.229 1.045 1.00 0.13 H new ATOM 0 HD21 LEU A 11 12.574 0.141 -1.428 1.00 0.23 H new ATOM 0 HD22 LEU A 11 12.379 -0.769 0.088 1.00 0.23 H new ATOM 0 HD23 LEU A 11 11.834 -1.477 -1.451 1.00 0.23 H new ATOM 224 N TYR A 12 7.196 -1.565 -1.723 1.00 0.09 N ATOM 225 CA TYR A 12 6.590 -1.667 -3.037 1.00 0.09 C ATOM 226 C TYR A 12 5.303 -0.864 -3.068 1.00 0.09 C ATOM 227 O TYR A 12 5.123 0.013 -3.913 1.00 0.12 O ATOM 228 CB TYR A 12 6.309 -3.127 -3.383 1.00 0.09 C ATOM 229 CG TYR A 12 5.738 -3.320 -4.767 1.00 0.10 C ATOM 230 CD1 TYR A 12 6.071 -2.456 -5.801 1.00 0.14 C ATOM 231 CD2 TYR A 12 4.864 -4.362 -5.036 1.00 0.10 C ATOM 232 CE1 TYR A 12 5.547 -2.625 -7.066 1.00 0.16 C ATOM 233 CE2 TYR A 12 4.336 -4.541 -6.299 1.00 0.12 C ATOM 234 CZ TYR A 12 4.681 -3.667 -7.311 1.00 0.15 C ATOM 235 OH TYR A 12 4.155 -3.837 -8.570 1.00 0.18 O ATOM 0 H TYR A 12 7.279 -2.452 -1.227 1.00 0.09 H new ATOM 0 HA TYR A 12 7.281 -1.266 -3.778 1.00 0.09 H new ATOM 0 HB2 TYR A 12 7.234 -3.697 -3.298 1.00 0.09 H new ATOM 0 HB3 TYR A 12 5.613 -3.538 -2.651 1.00 0.09 H new ATOM 0 HD1 TYR A 12 6.751 -1.638 -5.612 1.00 0.14 H new ATOM 0 HD2 TYR A 12 4.592 -5.045 -4.245 1.00 0.10 H new ATOM 0 HE1 TYR A 12 5.815 -1.944 -7.860 1.00 0.16 H new ATOM 0 HE2 TYR A 12 3.658 -5.359 -6.494 1.00 0.12 H new ATOM 0 HH TYR A 12 4.791 -3.506 -9.238 1.00 0.18 H new ATOM 245 N ALA A 13 4.412 -1.164 -2.131 1.00 0.10 N ATOM 246 CA ALA A 13 3.146 -0.456 -2.034 1.00 0.12 C ATOM 247 C ALA A 13 3.395 1.041 -1.981 1.00 0.12 C ATOM 248 O ALA A 13 2.668 1.828 -2.585 1.00 0.13 O ATOM 249 CB ALA A 13 2.376 -0.912 -0.808 1.00 0.13 C ATOM 0 H ALA A 13 4.544 -1.892 -1.429 1.00 0.10 H new ATOM 0 HA ALA A 13 2.546 -0.682 -2.916 1.00 0.12 H new ATOM 0 HB1 ALA A 13 1.431 -0.372 -0.750 1.00 0.13 H new ATOM 0 HB2 ALA A 13 2.179 -1.982 -0.879 1.00 0.13 H new ATOM 0 HB3 ALA A 13 2.964 -0.710 0.087 1.00 0.13 H new ATOM 255 N LEU A 14 4.439 1.425 -1.254 1.00 0.11 N ATOM 256 CA LEU A 14 4.809 2.823 -1.143 1.00 0.11 C ATOM 257 C LEU A 14 5.155 3.348 -2.524 1.00 0.12 C ATOM 258 O LEU A 14 4.682 4.401 -2.946 1.00 0.14 O ATOM 259 CB LEU A 14 6.010 2.990 -0.211 1.00 0.12 C ATOM 260 CG LEU A 14 6.011 4.261 0.643 1.00 0.10 C ATOM 261 CD1 LEU A 14 7.418 4.571 1.124 1.00 0.11 C ATOM 262 CD2 LEU A 14 5.441 5.445 -0.127 1.00 0.10 C ATOM 0 H LEU A 14 5.040 0.785 -0.735 1.00 0.11 H new ATOM 0 HA LEU A 14 3.972 3.384 -0.727 1.00 0.11 H new ATOM 0 HB2 LEU A 14 6.055 2.127 0.453 1.00 0.12 H new ATOM 0 HB3 LEU A 14 6.919 2.977 -0.812 1.00 0.12 H new ATOM 0 HG LEU A 14 5.372 4.085 1.508 1.00 0.10 H new ATOM 0 HD11 LEU A 14 7.404 5.477 1.730 1.00 0.11 H new ATOM 0 HD12 LEU A 14 7.789 3.739 1.723 1.00 0.11 H new ATOM 0 HD13 LEU A 14 8.072 4.719 0.265 1.00 0.11 H new ATOM 0 HD21 LEU A 14 5.455 6.332 0.506 1.00 0.10 H new ATOM 0 HD22 LEU A 14 6.044 5.625 -1.017 1.00 0.10 H new ATOM 0 HD23 LEU A 14 4.415 5.227 -0.422 1.00 0.10 H new ATOM 274 N GLU A 15 5.996 2.589 -3.217 1.00 0.11 N ATOM 275 CA GLU A 15 6.406 2.935 -4.566 1.00 0.13 C ATOM 276 C GLU A 15 5.184 3.078 -5.457 1.00 0.13 C ATOM 277 O GLU A 15 5.005 4.092 -6.122 1.00 0.15 O ATOM 278 CB GLU A 15 7.320 1.850 -5.129 1.00 0.14 C ATOM 279 CG GLU A 15 8.684 1.794 -4.469 1.00 0.16 C ATOM 280 CD GLU A 15 9.440 0.524 -4.807 1.00 0.26 C ATOM 281 OE1 GLU A 15 9.752 0.318 -5.999 1.00 0.34 O ATOM 282 OE2 GLU A 15 9.720 -0.265 -3.880 1.00 0.35 O ATOM 0 H GLU A 15 6.407 1.726 -2.861 1.00 0.11 H new ATOM 0 HA GLU A 15 6.946 3.881 -4.537 1.00 0.13 H new ATOM 0 HB2 GLU A 15 6.832 0.882 -5.015 1.00 0.14 H new ATOM 0 HB3 GLU A 15 7.451 2.017 -6.198 1.00 0.14 H new ATOM 0 HG2 GLU A 15 9.271 2.657 -4.782 1.00 0.16 H new ATOM 0 HG3 GLU A 15 8.564 1.865 -3.388 1.00 0.16 H new ATOM 289 N ILE A 16 4.341 2.053 -5.450 1.00 0.11 N ATOM 290 CA ILE A 16 3.127 2.054 -6.248 1.00 0.12 C ATOM 291 C ILE A 16 2.314 3.305 -5.968 1.00 0.11 C ATOM 292 O ILE A 16 1.893 4.010 -6.885 1.00 0.14 O ATOM 293 CB ILE A 16 2.269 0.817 -5.940 1.00 0.12 C ATOM 294 CG1 ILE A 16 3.060 -0.457 -6.221 1.00 0.13 C ATOM 295 CG2 ILE A 16 0.982 0.841 -6.750 1.00 0.13 C ATOM 296 CD1 ILE A 16 2.375 -1.704 -5.718 1.00 0.25 C ATOM 0 H ILE A 16 4.479 1.207 -4.897 1.00 0.11 H new ATOM 0 HA ILE A 16 3.417 2.033 -7.298 1.00 0.12 H new ATOM 0 HB ILE A 16 2.003 0.833 -4.883 1.00 0.12 H new ATOM 0 HG12 ILE A 16 3.222 -0.547 -7.295 1.00 0.13 H new ATOM 0 HG13 ILE A 16 4.043 -0.377 -5.756 1.00 0.13 H new ATOM 0 HG21 ILE A 16 0.389 -0.043 -6.517 1.00 0.13 H new ATOM 0 HG22 ILE A 16 0.412 1.736 -6.501 1.00 0.13 H new ATOM 0 HG23 ILE A 16 1.221 0.848 -7.813 1.00 0.13 H new ATOM 0 HD11 ILE A 16 2.989 -2.575 -5.949 1.00 0.25 H new ATOM 0 HD12 ILE A 16 2.237 -1.633 -4.639 1.00 0.25 H new ATOM 0 HD13 ILE A 16 1.404 -1.806 -6.202 1.00 0.25 H new ATOM 308 N LEU A 17 2.096 3.569 -4.689 1.00 0.10 N ATOM 309 CA LEU A 17 1.347 4.738 -4.274 1.00 0.10 C ATOM 310 C LEU A 17 2.111 5.988 -4.659 1.00 0.11 C ATOM 311 O LEU A 17 1.529 6.992 -5.065 1.00 0.16 O ATOM 312 CB LEU A 17 1.110 4.696 -2.768 1.00 0.10 C ATOM 313 CG LEU A 17 0.323 3.482 -2.288 1.00 0.10 C ATOM 314 CD1 LEU A 17 0.575 3.239 -0.811 1.00 0.12 C ATOM 315 CD2 LEU A 17 -1.158 3.675 -2.562 1.00 0.12 C ATOM 0 H LEU A 17 2.429 2.986 -3.921 1.00 0.10 H new ATOM 0 HA LEU A 17 0.378 4.748 -4.774 1.00 0.10 H new ATOM 0 HB2 LEU A 17 2.074 4.713 -2.260 1.00 0.10 H new ATOM 0 HB3 LEU A 17 0.578 5.600 -2.471 1.00 0.10 H new ATOM 0 HG LEU A 17 0.660 2.603 -2.838 1.00 0.10 H new ATOM 0 HD11 LEU A 17 0.006 2.369 -0.483 1.00 0.12 H new ATOM 0 HD12 LEU A 17 1.638 3.060 -0.648 1.00 0.12 H new ATOM 0 HD13 LEU A 17 0.262 4.113 -0.240 1.00 0.12 H new ATOM 0 HD21 LEU A 17 -1.709 2.801 -2.215 1.00 0.12 H new ATOM 0 HD22 LEU A 17 -1.513 4.561 -2.035 1.00 0.12 H new ATOM 0 HD23 LEU A 17 -1.316 3.802 -3.633 1.00 0.12 H new ATOM 327 N ALA A 18 3.430 5.911 -4.540 1.00 0.08 N ATOM 328 CA ALA A 18 4.286 7.026 -4.894 1.00 0.10 C ATOM 329 C ALA A 18 4.180 7.295 -6.384 1.00 0.12 C ATOM 330 O ALA A 18 4.111 8.439 -6.822 1.00 0.14 O ATOM 331 CB ALA A 18 5.726 6.741 -4.503 1.00 0.11 C ATOM 0 H ALA A 18 3.926 5.087 -4.201 1.00 0.08 H new ATOM 0 HA ALA A 18 3.959 7.911 -4.349 1.00 0.10 H new ATOM 0 HB1 ALA A 18 6.352 7.590 -4.777 1.00 0.11 H new ATOM 0 HB2 ALA A 18 5.785 6.579 -3.427 1.00 0.11 H new ATOM 0 HB3 ALA A 18 6.075 5.849 -5.024 1.00 0.11 H new ATOM 337 N GLN A 19 4.162 6.223 -7.160 1.00 0.14 N ATOM 338 CA GLN A 19 4.047 6.331 -8.602 1.00 0.16 C ATOM 339 C GLN A 19 2.615 6.663 -8.978 1.00 0.16 C ATOM 340 O GLN A 19 2.359 7.315 -9.991 1.00 0.18 O ATOM 341 CB GLN A 19 4.477 5.030 -9.271 1.00 0.20 C ATOM 342 CG GLN A 19 5.919 4.656 -8.995 1.00 0.23 C ATOM 343 CD GLN A 19 6.518 3.789 -10.086 1.00 0.32 C ATOM 344 OE1 GLN A 19 6.163 3.911 -11.258 1.00 0.80 O ATOM 345 NE2 GLN A 19 7.429 2.901 -9.702 1.00 0.40 N ATOM 0 H GLN A 19 4.226 5.266 -6.812 1.00 0.14 H new ATOM 0 HA GLN A 19 4.703 7.129 -8.948 1.00 0.16 H new ATOM 0 HB2 GLN A 19 3.829 4.223 -8.929 1.00 0.20 H new ATOM 0 HB3 GLN A 19 4.333 5.120 -10.348 1.00 0.20 H new ATOM 0 HG2 GLN A 19 6.512 5.565 -8.892 1.00 0.23 H new ATOM 0 HG3 GLN A 19 5.977 4.127 -8.044 1.00 0.23 H new ATOM 0 HE21 GLN A 19 7.693 2.834 -8.719 1.00 0.40 H new ATOM 0 HE22 GLN A 19 7.864 2.286 -10.390 1.00 0.40 H new ATOM 354 N TYR A 20 1.682 6.209 -8.151 1.00 0.16 N ATOM 355 CA TYR A 20 0.273 6.474 -8.377 1.00 0.17 C ATOM 356 C TYR A 20 0.028 7.969 -8.294 1.00 0.16 C ATOM 357 O TYR A 20 -0.818 8.519 -8.999 1.00 0.17 O ATOM 358 CB TYR A 20 -0.576 5.745 -7.339 1.00 0.19 C ATOM 359 CG TYR A 20 -2.054 6.005 -7.484 1.00 0.22 C ATOM 360 CD1 TYR A 20 -2.823 5.250 -8.355 1.00 0.26 C ATOM 361 CD2 TYR A 20 -2.678 7.003 -6.749 1.00 0.23 C ATOM 362 CE1 TYR A 20 -4.176 5.481 -8.492 1.00 0.30 C ATOM 363 CE2 TYR A 20 -4.031 7.240 -6.879 1.00 0.27 C ATOM 364 CZ TYR A 20 -4.774 6.491 -7.750 1.00 0.30 C ATOM 365 OH TYR A 20 -6.126 6.711 -7.885 1.00 0.36 O ATOM 0 H TYR A 20 1.879 5.655 -7.318 1.00 0.16 H new ATOM 0 HA TYR A 20 -0.008 6.113 -9.366 1.00 0.17 H new ATOM 0 HB2 TYR A 20 -0.394 4.673 -7.419 1.00 0.19 H new ATOM 0 HB3 TYR A 20 -0.257 6.049 -6.342 1.00 0.19 H new ATOM 0 HD1 TYR A 20 -2.356 4.468 -8.936 1.00 0.26 H new ATOM 0 HD2 TYR A 20 -2.096 7.603 -6.065 1.00 0.23 H new ATOM 0 HE1 TYR A 20 -4.765 4.882 -9.170 1.00 0.30 H new ATOM 0 HE2 TYR A 20 -4.503 8.016 -6.294 1.00 0.27 H new ATOM 0 HH TYR A 20 -6.397 7.449 -7.301 1.00 0.36 H new ATOM 375 N HIS A 21 0.790 8.616 -7.421 1.00 0.14 N ATOM 376 CA HIS A 21 0.696 10.052 -7.227 1.00 0.15 C ATOM 377 C HIS A 21 1.723 10.794 -8.082 1.00 0.16 C ATOM 378 O HIS A 21 1.737 12.024 -8.115 1.00 0.20 O ATOM 379 CB HIS A 21 0.903 10.389 -5.755 1.00 0.18 C ATOM 380 CG HIS A 21 -0.306 10.126 -4.913 1.00 0.19 C ATOM 381 ND1 HIS A 21 -1.297 11.066 -4.776 1.00 0.20 N ATOM 382 CD2 HIS A 21 -0.639 9.022 -4.202 1.00 0.21 C ATOM 383 CE1 HIS A 21 -2.208 10.518 -3.993 1.00 0.21 C ATOM 384 NE2 HIS A 21 -1.853 9.281 -3.619 1.00 0.23 N ATOM 0 H HIS A 21 1.486 8.160 -6.832 1.00 0.14 H new ATOM 0 HA HIS A 21 -0.298 10.374 -7.538 1.00 0.15 H new ATOM 0 HB2 HIS A 21 1.740 9.806 -5.370 1.00 0.18 H new ATOM 0 HB3 HIS A 21 1.179 11.440 -5.665 1.00 0.18 H new ATOM 0 HD2 HIS A 21 -0.061 8.114 -4.112 1.00 0.21 H new ATOM 0 HE1 HIS A 21 -3.124 11.005 -3.692 1.00 0.21 H new ATOM 0 HE2 HIS A 21 -2.384 8.653 -3.016 1.00 0.23 H new ATOM 392 N ASN A 22 2.585 10.041 -8.770 1.00 0.15 N ATOM 393 CA ASN A 22 3.608 10.628 -9.625 1.00 0.18 C ATOM 394 C ASN A 22 4.702 11.266 -8.784 1.00 0.19 C ATOM 395 O ASN A 22 5.331 12.243 -9.191 1.00 0.21 O ATOM 396 CB ASN A 22 2.995 11.664 -10.564 1.00 0.20 C ATOM 397 CG ASN A 22 1.775 11.136 -11.293 1.00 0.87 C ATOM 398 OD1 ASN A 22 0.828 11.877 -11.558 1.00 1.35 O ATOM 399 ND2 ASN A 22 1.793 9.853 -11.631 1.00 1.28 N ATOM 0 H ASN A 22 2.591 9.021 -8.748 1.00 0.15 H new ATOM 0 HA ASN A 22 4.048 9.832 -10.226 1.00 0.18 H new ATOM 0 HB2 ASN A 22 2.718 12.549 -9.992 1.00 0.20 H new ATOM 0 HB3 ASN A 22 3.743 11.977 -11.293 1.00 0.20 H new ATOM 0 HD21 ASN A 22 1.002 9.446 -12.130 1.00 1.28 H new ATOM 0 HD22 ASN A 22 2.598 9.274 -11.392 1.00 1.28 H new ATOM 406 N VAL A 23 4.919 10.697 -7.607 1.00 0.19 N ATOM 407 CA VAL A 23 5.932 11.186 -6.690 1.00 0.22 C ATOM 408 C VAL A 23 7.113 10.221 -6.637 1.00 0.25 C ATOM 409 O VAL A 23 6.939 9.012 -6.491 1.00 0.35 O ATOM 410 CB VAL A 23 5.345 11.385 -5.278 1.00 0.23 C ATOM 411 CG1 VAL A 23 4.593 10.149 -4.837 1.00 0.26 C ATOM 412 CG2 VAL A 23 6.431 11.736 -4.274 1.00 0.26 C ATOM 0 H VAL A 23 4.400 9.888 -7.265 1.00 0.19 H new ATOM 0 HA VAL A 23 6.282 12.151 -7.056 1.00 0.22 H new ATOM 0 HB VAL A 23 4.646 12.221 -5.321 1.00 0.23 H new ATOM 0 HG11 VAL A 23 4.186 10.308 -3.838 1.00 0.26 H new ATOM 0 HG12 VAL A 23 3.779 9.951 -5.534 1.00 0.26 H new ATOM 0 HG13 VAL A 23 5.272 9.296 -4.821 1.00 0.26 H new ATOM 0 HG21 VAL A 23 5.986 11.870 -3.288 1.00 0.26 H new ATOM 0 HG22 VAL A 23 7.164 10.930 -4.234 1.00 0.26 H new ATOM 0 HG23 VAL A 23 6.923 12.660 -4.578 1.00 0.26 H new ATOM 422 N SER A 24 8.312 10.772 -6.757 1.00 0.22 N ATOM 423 CA SER A 24 9.530 9.975 -6.737 1.00 0.25 C ATOM 424 C SER A 24 9.557 9.031 -5.544 1.00 0.27 C ATOM 425 O SER A 24 8.884 9.259 -4.539 1.00 0.49 O ATOM 426 CB SER A 24 10.756 10.884 -6.701 1.00 0.35 C ATOM 427 OG SER A 24 10.819 11.704 -7.854 1.00 0.82 O ATOM 0 H SER A 24 8.468 11.774 -6.870 1.00 0.22 H new ATOM 0 HA SER A 24 9.548 9.376 -7.647 1.00 0.25 H new ATOM 0 HB2 SER A 24 10.723 11.509 -5.808 1.00 0.35 H new ATOM 0 HB3 SER A 24 11.659 10.278 -6.632 1.00 0.35 H new ATOM 0 HG SER A 24 11.612 12.277 -7.805 1.00 0.82 H new ATOM 433 N VAL A 25 10.342 7.970 -5.670 1.00 0.20 N ATOM 434 CA VAL A 25 10.479 6.982 -4.613 1.00 0.17 C ATOM 435 C VAL A 25 11.643 6.045 -4.900 1.00 0.18 C ATOM 436 O VAL A 25 11.556 5.178 -5.768 1.00 0.25 O ATOM 437 CB VAL A 25 9.195 6.150 -4.445 1.00 0.13 C ATOM 438 CG1 VAL A 25 8.823 5.476 -5.755 1.00 0.13 C ATOM 439 CG2 VAL A 25 9.365 5.120 -3.338 1.00 0.15 C ATOM 0 H VAL A 25 10.898 7.772 -6.502 1.00 0.20 H new ATOM 0 HA VAL A 25 10.666 7.528 -3.688 1.00 0.17 H new ATOM 0 HB VAL A 25 8.384 6.821 -4.163 1.00 0.13 H new ATOM 0 HG11 VAL A 25 7.913 4.892 -5.618 1.00 0.13 H new ATOM 0 HG12 VAL A 25 8.656 6.234 -6.520 1.00 0.13 H new ATOM 0 HG13 VAL A 25 9.633 4.817 -6.068 1.00 0.13 H new ATOM 0 HG21 VAL A 25 8.447 4.542 -3.235 1.00 0.15 H new ATOM 0 HG22 VAL A 25 10.189 4.451 -3.587 1.00 0.15 H new ATOM 0 HG23 VAL A 25 9.581 5.628 -2.398 1.00 0.15 H new ATOM 449 N ASN A 26 12.734 6.232 -4.173 1.00 0.15 N ATOM 450 CA ASN A 26 13.909 5.398 -4.342 1.00 0.15 C ATOM 451 C ASN A 26 13.911 4.287 -3.301 1.00 0.16 C ATOM 452 O ASN A 26 14.496 4.434 -2.228 1.00 0.17 O ATOM 453 CB ASN A 26 15.174 6.237 -4.225 1.00 0.16 C ATOM 454 CG ASN A 26 16.426 5.430 -4.487 1.00 0.18 C ATOM 455 OD1 ASN A 26 16.377 4.361 -5.095 1.00 0.20 O ATOM 456 ND2 ASN A 26 17.560 5.953 -4.044 1.00 0.20 N ATOM 0 H ASN A 26 12.828 6.955 -3.460 1.00 0.15 H new ATOM 0 HA ASN A 26 13.884 4.949 -5.335 1.00 0.15 H new ATOM 0 HB2 ASN A 26 15.124 7.065 -4.932 1.00 0.16 H new ATOM 0 HB3 ASN A 26 15.227 6.672 -3.227 1.00 0.16 H new ATOM 0 HD21 ASN A 26 18.442 5.466 -4.202 1.00 0.20 H new ATOM 0 HD22 ASN A 26 17.551 6.842 -3.545 1.00 0.20 H new ATOM 463 N PRO A 27 13.254 3.154 -3.606 1.00 0.17 N ATOM 464 CA PRO A 27 13.166 2.026 -2.688 1.00 0.19 C ATOM 465 C PRO A 27 14.500 1.734 -2.024 1.00 0.20 C ATOM 466 O PRO A 27 14.554 1.260 -0.892 1.00 0.25 O ATOM 467 CB PRO A 27 12.737 0.850 -3.576 1.00 0.23 C ATOM 468 CG PRO A 27 12.634 1.385 -4.968 1.00 0.30 C ATOM 469 CD PRO A 27 12.558 2.877 -4.864 1.00 0.19 C ATOM 0 HA PRO A 27 12.469 2.221 -1.873 1.00 0.19 H new ATOM 0 HB2 PRO A 27 13.464 0.040 -3.525 1.00 0.23 H new ATOM 0 HB3 PRO A 27 11.782 0.442 -3.245 1.00 0.23 H new ATOM 0 HG2 PRO A 27 13.498 1.084 -5.561 1.00 0.30 H new ATOM 0 HG3 PRO A 27 11.750 0.989 -5.468 1.00 0.30 H new ATOM 0 HD2 PRO A 27 13.042 3.366 -5.709 1.00 0.19 H new ATOM 0 HD3 PRO A 27 11.526 3.228 -4.841 1.00 0.19 H new ATOM 477 N GLU A 28 15.573 2.033 -2.734 1.00 0.18 N ATOM 478 CA GLU A 28 16.910 1.812 -2.211 1.00 0.19 C ATOM 479 C GLU A 28 17.178 2.780 -1.072 1.00 0.19 C ATOM 480 O GLU A 28 17.695 2.398 -0.023 1.00 0.21 O ATOM 481 CB GLU A 28 17.948 2.000 -3.315 1.00 0.21 C ATOM 482 CG GLU A 28 17.686 1.148 -4.543 1.00 0.23 C ATOM 483 CD GLU A 28 18.763 1.298 -5.598 1.00 0.72 C ATOM 484 OE1 GLU A 28 19.759 0.545 -5.542 1.00 0.70 O ATOM 485 OE2 GLU A 28 18.613 2.170 -6.480 1.00 1.24 O ATOM 0 H GLU A 28 15.545 2.429 -3.674 1.00 0.18 H new ATOM 0 HA GLU A 28 16.982 0.790 -1.838 1.00 0.19 H new ATOM 0 HB2 GLU A 28 17.969 3.050 -3.608 1.00 0.21 H new ATOM 0 HB3 GLU A 28 18.935 1.760 -2.920 1.00 0.21 H new ATOM 0 HG2 GLU A 28 17.617 0.101 -4.246 1.00 0.23 H new ATOM 0 HG3 GLU A 28 16.722 1.422 -4.972 1.00 0.23 H new ATOM 492 N GLU A 29 16.814 4.035 -1.293 1.00 0.18 N ATOM 493 CA GLU A 29 16.996 5.075 -0.295 1.00 0.18 C ATOM 494 C GLU A 29 15.979 4.918 0.820 1.00 0.16 C ATOM 495 O GLU A 29 16.298 5.082 1.998 1.00 0.20 O ATOM 496 CB GLU A 29 16.857 6.450 -0.935 1.00 0.20 C ATOM 497 CG GLU A 29 16.966 7.593 0.053 1.00 0.22 C ATOM 498 CD GLU A 29 18.353 7.719 0.654 1.00 1.02 C ATOM 499 OE1 GLU A 29 19.190 8.440 0.072 1.00 0.95 O ATOM 500 OE2 GLU A 29 18.600 7.095 1.708 1.00 1.85 O ATOM 0 H GLU A 29 16.388 4.358 -2.162 1.00 0.18 H new ATOM 0 HA GLU A 29 17.997 4.981 0.125 1.00 0.18 H new ATOM 0 HB2 GLU A 29 17.627 6.566 -1.698 1.00 0.20 H new ATOM 0 HB3 GLU A 29 15.894 6.510 -1.442 1.00 0.20 H new ATOM 0 HG2 GLU A 29 16.705 8.526 -0.447 1.00 0.22 H new ATOM 0 HG3 GLU A 29 16.240 7.447 0.853 1.00 0.22 H new ATOM 507 N ILE A 30 14.745 4.598 0.440 1.00 0.14 N ATOM 508 CA ILE A 30 13.682 4.409 1.412 1.00 0.14 C ATOM 509 C ILE A 30 14.116 3.403 2.460 1.00 0.14 C ATOM 510 O ILE A 30 14.046 3.661 3.660 1.00 0.21 O ATOM 511 CB ILE A 30 12.387 3.912 0.746 1.00 0.17 C ATOM 512 CG1 ILE A 30 11.938 4.892 -0.334 1.00 0.22 C ATOM 513 CG2 ILE A 30 11.297 3.727 1.790 1.00 0.17 C ATOM 514 CD1 ILE A 30 11.686 6.285 0.193 1.00 0.28 C ATOM 0 H ILE A 30 14.461 4.465 -0.531 1.00 0.14 H new ATOM 0 HA ILE A 30 13.483 5.375 1.875 1.00 0.14 H new ATOM 0 HB ILE A 30 12.581 2.948 0.276 1.00 0.17 H new ATOM 0 HG12 ILE A 30 12.699 4.938 -1.113 1.00 0.22 H new ATOM 0 HG13 ILE A 30 11.027 4.517 -0.800 1.00 0.22 H new ATOM 0 HG21 ILE A 30 10.386 3.375 1.306 1.00 0.17 H new ATOM 0 HG22 ILE A 30 11.622 2.995 2.529 1.00 0.17 H new ATOM 0 HG23 ILE A 30 11.101 4.679 2.284 1.00 0.17 H new ATOM 0 HD11 ILE A 30 11.370 6.932 -0.625 1.00 0.28 H new ATOM 0 HD12 ILE A 30 10.904 6.251 0.952 1.00 0.28 H new ATOM 0 HD13 ILE A 30 12.602 6.679 0.634 1.00 0.28 H new ATOM 526 N LYS A 31 14.578 2.256 1.997 1.00 0.15 N ATOM 527 CA LYS A 31 15.042 1.223 2.897 1.00 0.20 C ATOM 528 C LYS A 31 16.274 1.698 3.642 1.00 0.21 C ATOM 529 O LYS A 31 16.519 1.321 4.786 1.00 0.26 O ATOM 530 CB LYS A 31 15.365 -0.051 2.128 1.00 0.26 C ATOM 531 CG LYS A 31 14.149 -0.698 1.501 1.00 0.80 C ATOM 532 CD LYS A 31 14.371 -2.180 1.270 1.00 0.82 C ATOM 533 CE LYS A 31 15.630 -2.435 0.457 1.00 0.65 C ATOM 534 NZ LYS A 31 15.842 -3.886 0.201 1.00 1.35 N ATOM 0 H LYS A 31 14.641 2.019 1.007 1.00 0.15 H new ATOM 0 HA LYS A 31 14.249 1.008 3.613 1.00 0.20 H new ATOM 0 HB2 LYS A 31 16.089 0.179 1.346 1.00 0.26 H new ATOM 0 HB3 LYS A 31 15.840 -0.764 2.803 1.00 0.26 H new ATOM 0 HG2 LYS A 31 13.284 -0.554 2.148 1.00 0.80 H new ATOM 0 HG3 LYS A 31 13.923 -0.210 0.553 1.00 0.80 H new ATOM 0 HD2 LYS A 31 14.447 -2.691 2.230 1.00 0.82 H new ATOM 0 HD3 LYS A 31 13.510 -2.601 0.751 1.00 0.82 H new ATOM 0 HE2 LYS A 31 15.562 -1.905 -0.493 1.00 0.65 H new ATOM 0 HE3 LYS A 31 16.492 -2.030 0.987 1.00 0.65 H new ATOM 0 HZ1 LYS A 31 16.710 -4.017 -0.356 1.00 1.35 H new ATOM 0 HZ2 LYS A 31 15.933 -4.389 1.107 1.00 1.35 H new ATOM 0 HZ3 LYS A 31 15.031 -4.267 -0.327 1.00 1.35 H new ATOM 548 N HIS A 32 17.046 2.537 2.973 1.00 0.19 N ATOM 549 CA HIS A 32 18.262 3.086 3.544 1.00 0.23 C ATOM 550 C HIS A 32 17.936 4.068 4.659 1.00 0.23 C ATOM 551 O HIS A 32 18.728 4.270 5.580 1.00 0.29 O ATOM 552 CB HIS A 32 19.058 3.799 2.454 1.00 0.25 C ATOM 553 CG HIS A 32 20.518 3.911 2.753 1.00 0.32 C ATOM 554 ND1 HIS A 32 21.102 5.057 3.251 1.00 0.37 N ATOM 555 CD2 HIS A 32 21.517 3.009 2.618 1.00 0.38 C ATOM 556 CE1 HIS A 32 22.398 4.854 3.408 1.00 0.44 C ATOM 557 NE2 HIS A 32 22.675 3.620 3.032 1.00 0.44 N ATOM 0 H HIS A 32 16.849 2.855 2.024 1.00 0.19 H new ATOM 0 HA HIS A 32 18.852 2.270 3.960 1.00 0.23 H new ATOM 0 HB2 HIS A 32 18.929 3.264 1.513 1.00 0.25 H new ATOM 0 HB3 HIS A 32 18.647 4.799 2.311 1.00 0.25 H new ATOM 0 HD2 HIS A 32 21.422 1.997 2.253 1.00 0.38 H new ATOM 0 HE1 HIS A 32 23.110 5.576 3.781 1.00 0.44 H new ATOM 0 HE2 HIS A 32 23.600 3.190 3.046 1.00 0.44 H new ATOM 566 N ARG A 33 16.762 4.678 4.563 1.00 0.19 N ATOM 567 CA ARG A 33 16.325 5.664 5.539 1.00 0.21 C ATOM 568 C ARG A 33 15.351 5.088 6.556 1.00 0.21 C ATOM 569 O ARG A 33 15.357 5.481 7.723 1.00 0.27 O ATOM 570 CB ARG A 33 15.647 6.820 4.816 1.00 0.24 C ATOM 571 CG ARG A 33 16.557 7.547 3.848 1.00 0.29 C ATOM 572 CD ARG A 33 15.793 8.573 3.027 1.00 0.36 C ATOM 573 NE ARG A 33 15.200 9.616 3.860 1.00 0.47 N ATOM 574 CZ ARG A 33 15.855 10.700 4.266 1.00 0.64 C ATOM 575 NH1 ARG A 33 17.129 10.871 3.941 1.00 1.13 N ATOM 576 NH2 ARG A 33 15.237 11.613 5.003 1.00 0.71 N ATOM 0 H ARG A 33 16.092 4.505 3.813 1.00 0.19 H new ATOM 0 HA ARG A 33 17.211 6.000 6.078 1.00 0.21 H new ATOM 0 HB2 ARG A 33 14.782 6.440 4.273 1.00 0.24 H new ATOM 0 HB3 ARG A 33 15.274 7.530 5.554 1.00 0.24 H new ATOM 0 HG2 ARG A 33 17.355 8.043 4.400 1.00 0.29 H new ATOM 0 HG3 ARG A 33 17.031 6.826 3.182 1.00 0.29 H new ATOM 0 HD2 ARG A 33 16.466 9.029 2.301 1.00 0.36 H new ATOM 0 HD3 ARG A 33 15.007 8.071 2.462 1.00 0.36 H new ATOM 0 HE ARG A 33 14.227 9.507 4.147 1.00 0.47 H new ATOM 0 HH11 ARG A 33 17.610 10.170 3.378 1.00 1.13 H new ATOM 0 HH12 ARG A 33 17.628 11.704 4.254 1.00 1.13 H new ATOM 0 HH21 ARG A 33 14.258 11.484 5.259 1.00 0.71 H new ATOM 0 HH22 ARG A 33 15.741 12.444 5.314 1.00 0.71 H new ATOM 590 N PHE A 34 14.514 4.157 6.119 1.00 0.17 N ATOM 591 CA PHE A 34 13.498 3.594 6.996 1.00 0.21 C ATOM 592 C PHE A 34 13.662 2.091 7.226 1.00 0.22 C ATOM 593 O PHE A 34 13.392 1.599 8.322 1.00 0.31 O ATOM 594 CB PHE A 34 12.126 3.910 6.411 1.00 0.23 C ATOM 595 CG PHE A 34 11.950 5.376 6.130 1.00 0.21 C ATOM 596 CD1 PHE A 34 12.297 5.905 4.900 1.00 0.21 C ATOM 597 CD2 PHE A 34 11.419 6.221 7.093 1.00 0.29 C ATOM 598 CE1 PHE A 34 12.122 7.249 4.634 1.00 0.24 C ATOM 599 CE2 PHE A 34 11.238 7.564 6.833 1.00 0.29 C ATOM 600 CZ PHE A 34 11.655 8.091 5.619 1.00 0.23 C ATOM 0 H PHE A 34 14.518 3.779 5.172 1.00 0.17 H new ATOM 0 HA PHE A 34 13.609 4.051 7.979 1.00 0.21 H new ATOM 0 HB2 PHE A 34 11.988 3.346 5.488 1.00 0.23 H new ATOM 0 HB3 PHE A 34 11.353 3.580 7.105 1.00 0.23 H new ATOM 0 HD1 PHE A 34 12.710 5.260 4.139 1.00 0.21 H new ATOM 0 HD2 PHE A 34 11.144 5.823 8.058 1.00 0.29 H new ATOM 0 HE1 PHE A 34 12.351 7.640 3.654 1.00 0.24 H new ATOM 0 HE2 PHE A 34 10.774 8.202 7.571 1.00 0.29 H new ATOM 0 HZ PHE A 34 11.614 9.156 5.447 1.00 0.23 H new ATOM 610 N ASP A 35 14.101 1.363 6.208 1.00 0.19 N ATOM 611 CA ASP A 35 14.288 -0.082 6.346 1.00 0.22 C ATOM 612 C ASP A 35 15.739 -0.403 6.657 1.00 0.29 C ATOM 613 O ASP A 35 16.268 -1.433 6.241 1.00 0.34 O ATOM 614 CB ASP A 35 13.861 -0.816 5.077 1.00 0.23 C ATOM 615 CG ASP A 35 13.598 -2.289 5.316 1.00 0.28 C ATOM 616 OD1 ASP A 35 14.358 -2.908 6.088 1.00 1.10 O ATOM 617 OD2 ASP A 35 12.630 -2.824 4.733 1.00 0.94 O ATOM 0 H ASP A 35 14.333 1.739 5.288 1.00 0.19 H new ATOM 0 HA ASP A 35 13.660 -0.420 7.171 1.00 0.22 H new ATOM 0 HB2 ASP A 35 12.960 -0.350 4.678 1.00 0.23 H new ATOM 0 HB3 ASP A 35 14.638 -0.708 4.320 1.00 0.23 H new ATOM 622 N THR A 36 16.382 0.496 7.384 1.00 0.31 N ATOM 623 CA THR A 36 17.775 0.321 7.760 1.00 0.39 C ATOM 624 C THR A 36 18.007 -1.053 8.377 1.00 0.46 C ATOM 625 O THR A 36 19.120 -1.579 8.346 1.00 0.54 O ATOM 626 CB THR A 36 18.222 1.404 8.754 1.00 0.43 C ATOM 627 OG1 THR A 36 17.470 1.297 9.968 1.00 0.47 O ATOM 628 CG2 THR A 36 18.035 2.789 8.156 1.00 0.39 C ATOM 0 H THR A 36 15.959 1.358 7.727 1.00 0.31 H new ATOM 0 HA THR A 36 18.367 0.409 6.849 1.00 0.39 H new ATOM 0 HB THR A 36 19.280 1.256 8.971 1.00 0.43 H new ATOM 0 HG1 THR A 36 17.763 1.990 10.596 1.00 0.47 H new ATOM 0 HG21 THR A 36 18.357 3.542 8.875 1.00 0.39 H new ATOM 0 HG22 THR A 36 18.631 2.876 7.247 1.00 0.39 H new ATOM 0 HG23 THR A 36 16.983 2.943 7.916 1.00 0.39 H new ATOM 636 N ASP A 37 16.950 -1.629 8.936 1.00 0.45 N ATOM 637 CA ASP A 37 17.035 -2.942 9.553 1.00 0.51 C ATOM 638 C ASP A 37 16.985 -4.044 8.498 1.00 0.50 C ATOM 639 O ASP A 37 17.408 -5.174 8.744 1.00 0.58 O ATOM 640 CB ASP A 37 15.902 -3.128 10.561 1.00 0.51 C ATOM 641 CG ASP A 37 16.082 -2.271 11.799 1.00 1.04 C ATOM 642 OD1 ASP A 37 16.747 -2.733 12.750 1.00 0.98 O ATOM 643 OD2 ASP A 37 15.559 -1.136 11.817 1.00 1.71 O ATOM 0 H ASP A 37 16.023 -1.205 8.974 1.00 0.45 H new ATOM 0 HA ASP A 37 17.989 -3.011 10.075 1.00 0.51 H new ATOM 0 HB2 ASP A 37 14.953 -2.880 10.086 1.00 0.51 H new ATOM 0 HB3 ASP A 37 15.848 -4.177 10.853 1.00 0.51 H new ATOM 648 N GLY A 38 16.462 -3.706 7.320 1.00 0.43 N ATOM 649 CA GLY A 38 16.370 -4.671 6.245 1.00 0.46 C ATOM 650 C GLY A 38 15.334 -5.738 6.521 1.00 0.42 C ATOM 651 O GLY A 38 15.414 -6.847 5.993 1.00 0.46 O ATOM 0 H GLY A 38 16.101 -2.779 7.095 1.00 0.43 H new ATOM 0 HA2 GLY A 38 16.120 -4.156 5.317 1.00 0.46 H new ATOM 0 HA3 GLY A 38 17.342 -5.141 6.097 1.00 0.46 H new ATOM 655 N THR A 39 14.354 -5.397 7.347 1.00 0.35 N ATOM 656 CA THR A 39 13.293 -6.328 7.703 1.00 0.33 C ATOM 657 C THR A 39 11.934 -5.839 7.210 1.00 0.30 C ATOM 658 O THR A 39 10.895 -6.348 7.630 1.00 0.41 O ATOM 659 CB THR A 39 13.229 -6.540 9.227 1.00 0.35 C ATOM 660 OG1 THR A 39 12.133 -7.400 9.558 1.00 0.65 O ATOM 661 CG2 THR A 39 13.077 -5.210 9.950 1.00 0.64 C ATOM 0 H THR A 39 14.272 -4.479 7.784 1.00 0.35 H new ATOM 0 HA THR A 39 13.527 -7.275 7.217 1.00 0.33 H new ATOM 0 HB THR A 39 14.161 -7.005 9.547 1.00 0.35 H new ATOM 0 HG1 THR A 39 11.450 -7.344 8.858 1.00 0.65 H new ATOM 0 HG21 THR A 39 13.034 -5.383 11.025 1.00 0.64 H new ATOM 0 HG22 THR A 39 13.929 -4.571 9.719 1.00 0.64 H new ATOM 0 HG23 THR A 39 12.159 -4.722 9.624 1.00 0.64 H new ATOM 669 N GLY A 40 11.943 -4.851 6.318 1.00 0.22 N ATOM 670 CA GLY A 40 10.703 -4.320 5.795 1.00 0.21 C ATOM 671 C GLY A 40 10.315 -3.014 6.453 1.00 0.20 C ATOM 672 O GLY A 40 10.622 -2.786 7.624 1.00 0.32 O ATOM 0 H GLY A 40 12.787 -4.412 5.951 1.00 0.22 H new ATOM 0 HA2 GLY A 40 10.800 -4.168 4.720 1.00 0.21 H new ATOM 0 HA3 GLY A 40 9.907 -5.050 5.943 1.00 0.21 H new ATOM 676 N LEU A 41 9.641 -2.155 5.701 1.00 0.12 N ATOM 677 CA LEU A 41 9.214 -0.865 6.219 1.00 0.10 C ATOM 678 C LEU A 41 8.185 -1.033 7.323 1.00 0.10 C ATOM 679 O LEU A 41 7.163 -1.693 7.140 1.00 0.14 O ATOM 680 CB LEU A 41 8.628 -0.008 5.102 1.00 0.10 C ATOM 681 CG LEU A 41 9.649 0.555 4.120 1.00 0.11 C ATOM 682 CD1 LEU A 41 10.615 1.480 4.840 1.00 0.12 C ATOM 683 CD2 LEU A 41 10.396 -0.574 3.435 1.00 0.14 C ATOM 0 H LEU A 41 9.379 -2.329 4.731 1.00 0.12 H new ATOM 0 HA LEU A 41 10.091 -0.367 6.632 1.00 0.10 H new ATOM 0 HB2 LEU A 41 7.904 -0.605 4.548 1.00 0.10 H new ATOM 0 HB3 LEU A 41 8.081 0.822 5.550 1.00 0.10 H new ATOM 0 HG LEU A 41 9.125 1.132 3.358 1.00 0.11 H new ATOM 0 HD11 LEU A 41 11.339 1.876 4.128 1.00 0.12 H new ATOM 0 HD12 LEU A 41 10.062 2.304 5.291 1.00 0.12 H new ATOM 0 HD13 LEU A 41 11.138 0.925 5.619 1.00 0.12 H new ATOM 0 HD21 LEU A 41 11.122 -0.159 2.736 1.00 0.14 H new ATOM 0 HD22 LEU A 41 10.914 -1.174 4.183 1.00 0.14 H new ATOM 0 HD23 LEU A 41 9.689 -1.202 2.893 1.00 0.14 H new ATOM 695 N GLY A 42 8.464 -0.435 8.472 1.00 0.09 N ATOM 696 CA GLY A 42 7.540 -0.513 9.581 1.00 0.11 C ATOM 697 C GLY A 42 6.334 0.364 9.338 1.00 0.10 C ATOM 698 O GLY A 42 6.310 1.129 8.379 1.00 0.11 O ATOM 0 H GLY A 42 9.312 0.101 8.655 1.00 0.09 H new ATOM 0 HA2 GLY A 42 7.221 -1.546 9.723 1.00 0.11 H new ATOM 0 HA3 GLY A 42 8.040 -0.205 10.499 1.00 0.11 H new ATOM 702 N LEU A 43 5.329 0.263 10.191 1.00 0.12 N ATOM 703 CA LEU A 43 4.138 1.075 10.024 1.00 0.12 C ATOM 704 C LEU A 43 4.504 2.552 10.017 1.00 0.11 C ATOM 705 O LEU A 43 4.189 3.277 9.074 1.00 0.12 O ATOM 706 CB LEU A 43 3.125 0.780 11.135 1.00 0.14 C ATOM 707 CG LEU A 43 1.779 1.504 11.010 1.00 0.14 C ATOM 708 CD1 LEU A 43 1.855 2.880 11.646 1.00 0.14 C ATOM 709 CD2 LEU A 43 1.356 1.615 9.551 1.00 0.14 C ATOM 0 H LEU A 43 5.313 -0.364 10.995 1.00 0.12 H new ATOM 0 HA LEU A 43 3.680 0.825 9.067 1.00 0.12 H new ATOM 0 HB2 LEU A 43 2.939 -0.294 11.158 1.00 0.14 H new ATOM 0 HB3 LEU A 43 3.574 1.046 12.092 1.00 0.14 H new ATOM 0 HG LEU A 43 1.028 0.918 11.539 1.00 0.14 H new ATOM 0 HD11 LEU A 43 0.891 3.380 11.548 1.00 0.14 H new ATOM 0 HD12 LEU A 43 2.106 2.779 12.702 1.00 0.14 H new ATOM 0 HD13 LEU A 43 2.622 3.470 11.145 1.00 0.14 H new ATOM 0 HD21 LEU A 43 0.399 2.132 9.488 1.00 0.14 H new ATOM 0 HD22 LEU A 43 2.108 2.175 8.996 1.00 0.14 H new ATOM 0 HD23 LEU A 43 1.258 0.617 9.124 1.00 0.14 H new ATOM 721 N THR A 44 5.178 2.989 11.072 1.00 0.11 N ATOM 722 CA THR A 44 5.597 4.378 11.191 1.00 0.12 C ATOM 723 C THR A 44 6.722 4.688 10.212 1.00 0.12 C ATOM 724 O THR A 44 6.775 5.771 9.631 1.00 0.16 O ATOM 725 CB THR A 44 6.068 4.703 12.620 1.00 0.15 C ATOM 726 OG1 THR A 44 5.018 4.438 13.557 1.00 0.18 O ATOM 727 CG2 THR A 44 6.495 6.158 12.726 1.00 0.18 C ATOM 0 H THR A 44 5.447 2.399 11.860 1.00 0.11 H new ATOM 0 HA THR A 44 4.730 4.996 10.957 1.00 0.12 H new ATOM 0 HB THR A 44 6.924 4.069 12.851 1.00 0.15 H new ATOM 0 HG1 THR A 44 5.328 4.646 14.463 1.00 0.18 H new ATOM 0 HG21 THR A 44 6.824 6.367 13.744 1.00 0.18 H new ATOM 0 HG22 THR A 44 7.315 6.348 12.033 1.00 0.18 H new ATOM 0 HG23 THR A 44 5.653 6.803 12.477 1.00 0.18 H new ATOM 735 N SER A 45 7.613 3.723 10.028 1.00 0.11 N ATOM 736 CA SER A 45 8.741 3.883 9.121 1.00 0.13 C ATOM 737 C SER A 45 8.256 3.962 7.683 1.00 0.13 C ATOM 738 O SER A 45 8.873 4.611 6.839 1.00 0.19 O ATOM 739 CB SER A 45 9.721 2.722 9.291 1.00 0.17 C ATOM 740 OG SER A 45 10.554 2.917 10.419 1.00 0.31 O ATOM 0 H SER A 45 7.576 2.818 10.497 1.00 0.11 H new ATOM 0 HA SER A 45 9.256 4.813 9.362 1.00 0.13 H new ATOM 0 HB2 SER A 45 9.168 1.789 9.401 1.00 0.17 H new ATOM 0 HB3 SER A 45 10.334 2.626 8.395 1.00 0.17 H new ATOM 0 HG SER A 45 11.170 2.160 10.506 1.00 0.31 H new ATOM 746 N TRP A 46 7.145 3.291 7.416 1.00 0.10 N ATOM 747 CA TRP A 46 6.555 3.285 6.090 1.00 0.09 C ATOM 748 C TRP A 46 5.843 4.602 5.829 1.00 0.08 C ATOM 749 O TRP A 46 5.976 5.197 4.760 1.00 0.10 O ATOM 750 CB TRP A 46 5.572 2.125 5.961 1.00 0.09 C ATOM 751 CG TRP A 46 5.018 1.978 4.585 1.00 0.09 C ATOM 752 CD1 TRP A 46 5.342 1.017 3.677 1.00 0.11 C ATOM 753 CD2 TRP A 46 4.049 2.821 3.952 1.00 0.08 C ATOM 754 NE1 TRP A 46 4.635 1.209 2.519 1.00 0.12 N ATOM 755 CE2 TRP A 46 3.835 2.307 2.662 1.00 0.10 C ATOM 756 CE3 TRP A 46 3.342 3.957 4.350 1.00 0.08 C ATOM 757 CZ2 TRP A 46 2.946 2.889 1.766 1.00 0.10 C ATOM 758 CZ3 TRP A 46 2.457 4.535 3.459 1.00 0.08 C ATOM 759 CH2 TRP A 46 2.266 3.998 2.180 1.00 0.09 C ATOM 0 H TRP A 46 6.633 2.741 8.106 1.00 0.10 H new ATOM 0 HA TRP A 46 7.348 3.161 5.352 1.00 0.09 H new ATOM 0 HB2 TRP A 46 6.072 1.199 6.246 1.00 0.09 H new ATOM 0 HB3 TRP A 46 4.751 2.272 6.663 1.00 0.09 H new ATOM 0 HD1 TRP A 46 6.052 0.220 3.845 1.00 0.11 H new ATOM 0 HE1 TRP A 46 4.696 0.626 1.684 1.00 0.12 H new ATOM 0 HE3 TRP A 46 3.484 4.376 5.335 1.00 0.08 H new ATOM 0 HZ2 TRP A 46 2.799 2.479 0.778 1.00 0.10 H new ATOM 0 HZ3 TRP A 46 1.904 5.415 3.754 1.00 0.08 H new ATOM 0 HH2 TRP A 46 1.566 4.471 1.507 1.00 0.09 H new ATOM 770 N LEU A 47 5.083 5.050 6.822 1.00 0.08 N ATOM 771 CA LEU A 47 4.349 6.302 6.720 1.00 0.08 C ATOM 772 C LEU A 47 5.311 7.462 6.514 1.00 0.08 C ATOM 773 O LEU A 47 5.049 8.366 5.723 1.00 0.11 O ATOM 774 CB LEU A 47 3.510 6.522 7.981 1.00 0.09 C ATOM 775 CG LEU A 47 2.350 5.541 8.161 1.00 0.15 C ATOM 776 CD1 LEU A 47 1.748 5.678 9.550 1.00 0.60 C ATOM 777 CD2 LEU A 47 1.289 5.771 7.098 1.00 0.62 C ATOM 0 H LEU A 47 4.960 4.562 7.709 1.00 0.08 H new ATOM 0 HA LEU A 47 3.681 6.250 5.860 1.00 0.08 H new ATOM 0 HB2 LEU A 47 4.163 6.454 8.851 1.00 0.09 H new ATOM 0 HB3 LEU A 47 3.110 7.536 7.962 1.00 0.09 H new ATOM 0 HG LEU A 47 2.736 4.528 8.050 1.00 0.15 H new ATOM 0 HD11 LEU A 47 0.924 4.973 9.661 1.00 0.60 H new ATOM 0 HD12 LEU A 47 2.510 5.466 10.300 1.00 0.60 H new ATOM 0 HD13 LEU A 47 1.377 6.694 9.687 1.00 0.60 H new ATOM 0 HD21 LEU A 47 0.471 5.065 7.241 1.00 0.62 H new ATOM 0 HD22 LEU A 47 0.907 6.789 7.179 1.00 0.62 H new ATOM 0 HD23 LEU A 47 1.726 5.625 6.110 1.00 0.62 H new ATOM 789 N LEU A 48 6.428 7.423 7.229 1.00 0.08 N ATOM 790 CA LEU A 48 7.441 8.461 7.121 1.00 0.10 C ATOM 791 C LEU A 48 8.155 8.368 5.780 1.00 0.10 C ATOM 792 O LEU A 48 8.659 9.364 5.259 1.00 0.11 O ATOM 793 CB LEU A 48 8.447 8.330 8.263 1.00 0.12 C ATOM 794 CG LEU A 48 7.856 8.516 9.658 1.00 0.13 C ATOM 795 CD1 LEU A 48 8.824 8.022 10.720 1.00 0.17 C ATOM 796 CD2 LEU A 48 7.505 9.976 9.888 1.00 0.17 C ATOM 0 H LEU A 48 6.654 6.681 7.891 1.00 0.08 H new ATOM 0 HA LEU A 48 6.954 9.434 7.188 1.00 0.10 H new ATOM 0 HB2 LEU A 48 8.912 7.346 8.208 1.00 0.12 H new ATOM 0 HB3 LEU A 48 9.239 9.065 8.118 1.00 0.12 H new ATOM 0 HG LEU A 48 6.943 7.924 9.731 1.00 0.13 H new ATOM 0 HD11 LEU A 48 8.384 8.163 11.707 1.00 0.17 H new ATOM 0 HD12 LEU A 48 9.028 6.963 10.562 1.00 0.17 H new ATOM 0 HD13 LEU A 48 9.755 8.585 10.654 1.00 0.17 H new ATOM 0 HD21 LEU A 48 7.084 10.096 10.886 1.00 0.17 H new ATOM 0 HD22 LEU A 48 8.404 10.585 9.797 1.00 0.17 H new ATOM 0 HD23 LEU A 48 6.774 10.296 9.145 1.00 0.17 H new ATOM 808 N ALA A 49 8.196 7.161 5.229 1.00 0.10 N ATOM 809 CA ALA A 49 8.837 6.927 3.944 1.00 0.11 C ATOM 810 C ALA A 49 8.100 7.668 2.838 1.00 0.11 C ATOM 811 O ALA A 49 8.710 8.152 1.884 1.00 0.15 O ATOM 812 CB ALA A 49 8.896 5.438 3.646 1.00 0.11 C ATOM 0 H ALA A 49 7.791 6.327 5.655 1.00 0.10 H new ATOM 0 HA ALA A 49 9.857 7.309 3.990 1.00 0.11 H new ATOM 0 HB1 ALA A 49 9.378 5.279 2.681 1.00 0.11 H new ATOM 0 HB2 ALA A 49 9.467 4.933 4.425 1.00 0.11 H new ATOM 0 HB3 ALA A 49 7.885 5.032 3.617 1.00 0.11 H new ATOM 818 N ALA A 50 6.781 7.750 2.972 1.00 0.08 N ATOM 819 CA ALA A 50 5.955 8.442 1.997 1.00 0.08 C ATOM 820 C ALA A 50 6.092 9.949 2.157 1.00 0.10 C ATOM 821 O ALA A 50 6.184 10.685 1.176 1.00 0.13 O ATOM 822 CB ALA A 50 4.500 8.027 2.143 1.00 0.10 C ATOM 0 H ALA A 50 6.262 7.343 3.750 1.00 0.08 H new ATOM 0 HA ALA A 50 6.297 8.166 0.999 1.00 0.08 H new ATOM 0 HB1 ALA A 50 3.895 8.555 1.405 1.00 0.10 H new ATOM 0 HB2 ALA A 50 4.410 6.952 1.984 1.00 0.10 H new ATOM 0 HB3 ALA A 50 4.149 8.276 3.145 1.00 0.10 H new ATOM 828 N LYS A 51 6.109 10.396 3.406 1.00 0.09 N ATOM 829 CA LYS A 51 6.237 11.814 3.707 1.00 0.11 C ATOM 830 C LYS A 51 7.572 12.342 3.209 1.00 0.13 C ATOM 831 O LYS A 51 7.671 13.478 2.748 1.00 0.15 O ATOM 832 CB LYS A 51 6.105 12.047 5.210 1.00 0.14 C ATOM 833 CG LYS A 51 4.782 11.564 5.780 1.00 0.14 C ATOM 834 CD LYS A 51 4.691 11.809 7.277 1.00 0.21 C ATOM 835 CE LYS A 51 3.427 11.204 7.865 1.00 0.61 C ATOM 836 NZ LYS A 51 2.203 11.692 7.171 1.00 1.40 N ATOM 0 H LYS A 51 6.036 9.795 4.227 1.00 0.09 H new ATOM 0 HA LYS A 51 5.438 12.352 3.197 1.00 0.11 H new ATOM 0 HB2 LYS A 51 6.921 11.537 5.723 1.00 0.14 H new ATOM 0 HB3 LYS A 51 6.214 13.112 5.416 1.00 0.14 H new ATOM 0 HG2 LYS A 51 3.961 12.075 5.277 1.00 0.14 H new ATOM 0 HG3 LYS A 51 4.666 10.499 5.578 1.00 0.14 H new ATOM 0 HD2 LYS A 51 5.564 11.381 7.770 1.00 0.21 H new ATOM 0 HD3 LYS A 51 4.708 12.881 7.473 1.00 0.21 H new ATOM 0 HE2 LYS A 51 3.477 10.118 7.792 1.00 0.61 H new ATOM 0 HE3 LYS A 51 3.366 11.450 8.925 1.00 0.61 H new ATOM 0 HZ1 LYS A 51 1.571 12.147 7.860 1.00 1.40 H new ATOM 0 HZ2 LYS A 51 2.470 12.381 6.439 1.00 1.40 H new ATOM 0 HZ3 LYS A 51 1.712 10.889 6.728 1.00 1.40 H new ATOM 850 N SER A 52 8.602 11.509 3.310 1.00 0.12 N ATOM 851 CA SER A 52 9.933 11.889 2.854 1.00 0.15 C ATOM 852 C SER A 52 9.916 12.171 1.355 1.00 0.14 C ATOM 853 O SER A 52 10.754 12.911 0.840 1.00 0.16 O ATOM 854 CB SER A 52 10.943 10.785 3.169 1.00 0.17 C ATOM 855 OG SER A 52 10.573 9.563 2.554 1.00 1.23 O ATOM 0 H SER A 52 8.541 10.569 3.702 1.00 0.12 H new ATOM 0 HA SER A 52 10.233 12.795 3.381 1.00 0.15 H new ATOM 0 HB2 SER A 52 11.933 11.084 2.824 1.00 0.17 H new ATOM 0 HB3 SER A 52 11.010 10.647 4.248 1.00 0.17 H new ATOM 0 HG SER A 52 9.617 9.581 2.339 1.00 1.23 H new ATOM 861 N LEU A 53 8.951 11.572 0.661 1.00 0.12 N ATOM 862 CA LEU A 53 8.803 11.757 -0.777 1.00 0.12 C ATOM 863 C LEU A 53 7.888 12.938 -1.081 1.00 0.12 C ATOM 864 O LEU A 53 7.411 13.085 -2.204 1.00 0.15 O ATOM 865 CB LEU A 53 8.205 10.498 -1.405 1.00 0.13 C ATOM 866 CG LEU A 53 9.001 9.216 -1.183 1.00 0.12 C ATOM 867 CD1 LEU A 53 8.240 8.023 -1.734 1.00 0.13 C ATOM 868 CD2 LEU A 53 10.367 9.328 -1.834 1.00 0.14 C ATOM 0 H LEU A 53 8.257 10.951 1.076 1.00 0.12 H new ATOM 0 HA LEU A 53 9.791 11.952 -1.195 1.00 0.12 H new ATOM 0 HB2 LEU A 53 7.200 10.356 -1.007 1.00 0.13 H new ATOM 0 HB3 LEU A 53 8.102 10.661 -2.478 1.00 0.13 H new ATOM 0 HG LEU A 53 9.141 9.069 -0.112 1.00 0.12 H new ATOM 0 HD11 LEU A 53 8.819 7.114 -1.569 1.00 0.13 H new ATOM 0 HD12 LEU A 53 7.279 7.938 -1.226 1.00 0.13 H new ATOM 0 HD13 LEU A 53 8.075 8.159 -2.803 1.00 0.13 H new ATOM 0 HD21 LEU A 53 10.926 8.407 -1.669 1.00 0.14 H new ATOM 0 HD22 LEU A 53 10.247 9.492 -2.905 1.00 0.14 H new ATOM 0 HD23 LEU A 53 10.911 10.165 -1.397 1.00 0.14 H new ATOM 880 N GLU A 54 7.649 13.784 -0.088 1.00 0.12 N ATOM 881 CA GLU A 54 6.753 14.913 -0.272 1.00 0.13 C ATOM 882 C GLU A 54 5.333 14.407 -0.529 1.00 0.11 C ATOM 883 O GLU A 54 4.469 15.151 -0.994 1.00 0.13 O ATOM 884 CB GLU A 54 7.222 15.778 -1.440 1.00 0.17 C ATOM 885 CG GLU A 54 8.691 16.147 -1.363 1.00 0.23 C ATOM 886 CD GLU A 54 9.142 16.994 -2.537 1.00 0.63 C ATOM 887 OE1 GLU A 54 9.509 16.415 -3.582 1.00 1.14 O ATOM 888 OE2 GLU A 54 9.127 18.237 -2.414 1.00 0.59 O ATOM 0 H GLU A 54 8.059 13.710 0.843 1.00 0.12 H new ATOM 0 HA GLU A 54 6.758 15.521 0.633 1.00 0.13 H new ATOM 0 HB2 GLU A 54 7.037 15.247 -2.374 1.00 0.17 H new ATOM 0 HB3 GLU A 54 6.627 16.691 -1.469 1.00 0.17 H new ATOM 0 HG2 GLU A 54 8.877 16.689 -0.436 1.00 0.23 H new ATOM 0 HG3 GLU A 54 9.289 15.236 -1.326 1.00 0.23 H new ATOM 895 N LEU A 55 5.105 13.129 -0.219 1.00 0.11 N ATOM 896 CA LEU A 55 3.811 12.500 -0.411 1.00 0.13 C ATOM 897 C LEU A 55 3.086 12.374 0.923 1.00 0.17 C ATOM 898 O LEU A 55 3.662 11.924 1.913 1.00 0.33 O ATOM 899 CB LEU A 55 4.005 11.120 -1.045 1.00 0.20 C ATOM 900 CG LEU A 55 2.766 10.231 -1.081 1.00 0.38 C ATOM 901 CD1 LEU A 55 1.782 10.726 -2.130 1.00 0.69 C ATOM 902 CD2 LEU A 55 3.159 8.786 -1.351 1.00 0.72 C ATOM 0 H LEU A 55 5.815 12.509 0.171 1.00 0.11 H new ATOM 0 HA LEU A 55 3.205 13.116 -1.075 1.00 0.13 H new ATOM 0 HB2 LEU A 55 4.362 11.256 -2.066 1.00 0.20 H new ATOM 0 HB3 LEU A 55 4.790 10.596 -0.499 1.00 0.20 H new ATOM 0 HG LEU A 55 2.277 10.279 -0.108 1.00 0.38 H new ATOM 0 HD11 LEU A 55 0.905 10.079 -2.140 1.00 0.69 H new ATOM 0 HD12 LEU A 55 1.478 11.745 -1.892 1.00 0.69 H new ATOM 0 HD13 LEU A 55 2.257 10.709 -3.111 1.00 0.69 H new ATOM 0 HD21 LEU A 55 2.264 8.164 -1.374 1.00 0.72 H new ATOM 0 HD22 LEU A 55 3.670 8.721 -2.311 1.00 0.72 H new ATOM 0 HD23 LEU A 55 3.824 8.436 -0.561 1.00 0.72 H new ATOM 914 N LYS A 56 1.820 12.772 0.945 1.00 0.15 N ATOM 915 CA LYS A 56 1.029 12.718 2.163 1.00 0.16 C ATOM 916 C LYS A 56 0.515 11.309 2.428 1.00 0.16 C ATOM 917 O LYS A 56 0.100 10.600 1.511 1.00 0.20 O ATOM 918 CB LYS A 56 -0.146 13.693 2.079 1.00 0.18 C ATOM 919 CG LYS A 56 -0.987 13.736 3.344 1.00 0.61 C ATOM 920 CD LYS A 56 -2.130 14.730 3.222 1.00 0.62 C ATOM 921 CE LYS A 56 -3.009 14.721 4.462 1.00 1.18 C ATOM 922 NZ LYS A 56 -2.231 15.014 5.697 1.00 1.86 N ATOM 0 H LYS A 56 1.321 13.135 0.133 1.00 0.15 H new ATOM 0 HA LYS A 56 1.676 13.006 2.991 1.00 0.16 H new ATOM 0 HB2 LYS A 56 0.235 14.693 1.871 1.00 0.18 H new ATOM 0 HB3 LYS A 56 -0.781 13.413 1.239 1.00 0.18 H new ATOM 0 HG2 LYS A 56 -1.388 12.743 3.549 1.00 0.61 H new ATOM 0 HG3 LYS A 56 -0.357 14.007 4.191 1.00 0.61 H new ATOM 0 HD2 LYS A 56 -1.728 15.731 3.067 1.00 0.62 H new ATOM 0 HD3 LYS A 56 -2.732 14.489 2.346 1.00 0.62 H new ATOM 0 HE2 LYS A 56 -3.803 15.459 4.349 1.00 1.18 H new ATOM 0 HE3 LYS A 56 -3.490 13.748 4.559 1.00 1.18 H new ATOM 0 HZ1 LYS A 56 -2.885 15.183 6.488 1.00 1.86 H new ATOM 0 HZ2 LYS A 56 -1.618 14.204 5.921 1.00 1.86 H new ATOM 0 HZ3 LYS A 56 -1.645 15.860 5.546 1.00 1.86 H new ATOM 936 N VAL A 57 0.553 10.912 3.692 1.00 0.14 N ATOM 937 CA VAL A 57 0.087 9.597 4.105 1.00 0.14 C ATOM 938 C VAL A 57 -0.359 9.625 5.560 1.00 0.15 C ATOM 939 O VAL A 57 0.065 10.489 6.327 1.00 0.15 O ATOM 940 CB VAL A 57 1.179 8.528 3.930 1.00 0.12 C ATOM 941 CG1 VAL A 57 1.632 8.464 2.482 1.00 0.12 C ATOM 942 CG2 VAL A 57 2.355 8.808 4.851 1.00 0.13 C ATOM 0 H VAL A 57 0.906 11.489 4.456 1.00 0.14 H new ATOM 0 HA VAL A 57 -0.757 9.337 3.466 1.00 0.14 H new ATOM 0 HB VAL A 57 0.760 7.559 4.201 1.00 0.12 H new ATOM 0 HG11 VAL A 57 2.405 7.703 2.376 1.00 0.12 H new ATOM 0 HG12 VAL A 57 0.784 8.211 1.846 1.00 0.12 H new ATOM 0 HG13 VAL A 57 2.033 9.432 2.183 1.00 0.12 H new ATOM 0 HG21 VAL A 57 3.117 8.041 4.712 1.00 0.13 H new ATOM 0 HG22 VAL A 57 2.777 9.785 4.615 1.00 0.13 H new ATOM 0 HG23 VAL A 57 2.016 8.799 5.887 1.00 0.13 H new ATOM 952 N LYS A 58 -1.211 8.683 5.940 1.00 0.17 N ATOM 953 CA LYS A 58 -1.705 8.630 7.308 1.00 0.20 C ATOM 954 C LYS A 58 -2.429 7.323 7.593 1.00 0.16 C ATOM 955 O LYS A 58 -3.439 7.009 6.964 1.00 0.18 O ATOM 956 CB LYS A 58 -2.646 9.804 7.567 1.00 0.26 C ATOM 957 CG LYS A 58 -3.214 9.830 8.976 1.00 0.63 C ATOM 958 CD LYS A 58 -2.158 10.222 9.998 1.00 1.21 C ATOM 959 CE LYS A 58 -2.706 10.168 11.415 1.00 1.69 C ATOM 960 NZ LYS A 58 -1.733 10.696 12.410 1.00 2.33 N ATOM 0 H LYS A 58 -1.571 7.952 5.327 1.00 0.17 H new ATOM 0 HA LYS A 58 -0.844 8.692 7.974 1.00 0.20 H new ATOM 0 HB2 LYS A 58 -2.110 10.735 7.383 1.00 0.26 H new ATOM 0 HB3 LYS A 58 -3.469 9.763 6.853 1.00 0.26 H new ATOM 0 HG2 LYS A 58 -4.044 10.535 9.021 1.00 0.63 H new ATOM 0 HG3 LYS A 58 -3.616 8.848 9.225 1.00 0.63 H new ATOM 0 HD2 LYS A 58 -1.302 9.553 9.912 1.00 1.21 H new ATOM 0 HD3 LYS A 58 -1.799 11.229 9.784 1.00 1.21 H new ATOM 0 HE2 LYS A 58 -3.629 10.745 11.469 1.00 1.69 H new ATOM 0 HE3 LYS A 58 -2.959 9.138 11.667 1.00 1.69 H new ATOM 0 HZ1 LYS A 58 -2.146 10.641 13.363 1.00 2.33 H new ATOM 0 HZ2 LYS A 58 -0.861 10.130 12.378 1.00 2.33 H new ATOM 0 HZ3 LYS A 58 -1.510 11.687 12.186 1.00 2.33 H new ATOM 974 N GLN A 59 -1.904 6.563 8.546 1.00 0.15 N ATOM 975 CA GLN A 59 -2.510 5.303 8.932 1.00 0.13 C ATOM 976 C GLN A 59 -3.605 5.550 9.957 1.00 0.13 C ATOM 977 O GLN A 59 -3.386 6.223 10.963 1.00 0.16 O ATOM 978 CB GLN A 59 -1.463 4.354 9.509 1.00 0.16 C ATOM 979 CG GLN A 59 -2.029 2.994 9.887 1.00 0.20 C ATOM 980 CD GLN A 59 -1.957 2.707 11.375 1.00 0.44 C ATOM 981 OE1 GLN A 59 -2.147 3.734 12.194 1.00 1.13 O flip ATOM 982 NE2 GLN A 59 -1.750 1.565 11.786 1.00 0.36 N flip ATOM 0 H GLN A 59 -1.058 6.801 9.064 1.00 0.15 H new ATOM 0 HA GLN A 59 -2.943 4.841 8.045 1.00 0.13 H new ATOM 0 HB2 GLN A 59 -0.665 4.218 8.780 1.00 0.16 H new ATOM 0 HB3 GLN A 59 -1.015 4.811 10.391 1.00 0.16 H new ATOM 0 HG2 GLN A 59 -3.068 2.938 9.563 1.00 0.20 H new ATOM 0 HG3 GLN A 59 -1.485 2.219 9.348 1.00 0.20 H new ATOM 0 HE21 GLN A 59 -1.609 0.802 11.124 1.00 0.36 H new ATOM 0 HE22 GLN A 59 -1.720 1.382 12.789 1.00 0.36 H new ATOM 991 N VAL A 60 -4.781 5.004 9.698 1.00 0.13 N ATOM 992 CA VAL A 60 -5.907 5.184 10.599 1.00 0.16 C ATOM 993 C VAL A 60 -6.763 3.930 10.662 1.00 0.15 C ATOM 994 O VAL A 60 -6.732 3.095 9.757 1.00 0.18 O ATOM 995 CB VAL A 60 -6.782 6.372 10.161 1.00 0.20 C ATOM 996 CG1 VAL A 60 -7.293 6.157 8.744 1.00 0.22 C ATOM 997 CG2 VAL A 60 -7.935 6.570 11.132 1.00 0.23 C ATOM 0 H VAL A 60 -4.981 4.435 8.875 1.00 0.13 H new ATOM 0 HA VAL A 60 -5.498 5.387 11.589 1.00 0.16 H new ATOM 0 HB VAL A 60 -6.174 7.277 10.170 1.00 0.20 H new ATOM 0 HG11 VAL A 60 -7.910 7.005 8.447 1.00 0.22 H new ATOM 0 HG12 VAL A 60 -6.447 6.068 8.062 1.00 0.22 H new ATOM 0 HG13 VAL A 60 -7.888 5.244 8.706 1.00 0.22 H new ATOM 0 HG21 VAL A 60 -8.543 7.414 10.807 1.00 0.23 H new ATOM 0 HG22 VAL A 60 -8.548 5.669 11.157 1.00 0.23 H new ATOM 0 HG23 VAL A 60 -7.541 6.769 12.129 1.00 0.23 H new ATOM 1007 N LYS A 61 -7.529 3.802 11.736 1.00 0.19 N ATOM 1008 CA LYS A 61 -8.392 2.651 11.918 1.00 0.20 C ATOM 1009 C LYS A 61 -9.785 2.941 11.382 1.00 0.21 C ATOM 1010 O LYS A 61 -10.545 3.709 11.973 1.00 0.23 O ATOM 1011 CB LYS A 61 -8.472 2.273 13.394 1.00 0.23 C ATOM 1012 CG LYS A 61 -9.230 0.982 13.646 1.00 0.28 C ATOM 1013 CD LYS A 61 -9.314 0.665 15.129 1.00 0.37 C ATOM 1014 CE LYS A 61 -10.086 -0.620 15.383 1.00 1.05 C ATOM 1015 NZ LYS A 61 -9.514 -1.769 14.628 1.00 2.03 N ATOM 0 H LYS A 61 -7.568 4.484 12.494 1.00 0.19 H new ATOM 0 HA LYS A 61 -7.968 1.815 11.362 1.00 0.20 H new ATOM 0 HB2 LYS A 61 -7.462 2.176 13.792 1.00 0.23 H new ATOM 0 HB3 LYS A 61 -8.954 3.082 13.943 1.00 0.23 H new ATOM 0 HG2 LYS A 61 -10.235 1.063 13.233 1.00 0.28 H new ATOM 0 HG3 LYS A 61 -8.736 0.162 13.125 1.00 0.28 H new ATOM 0 HD2 LYS A 61 -8.309 0.573 15.540 1.00 0.37 H new ATOM 0 HD3 LYS A 61 -9.798 1.490 15.651 1.00 0.37 H new ATOM 0 HE2 LYS A 61 -10.076 -0.845 16.449 1.00 1.05 H new ATOM 0 HE3 LYS A 61 -11.128 -0.480 15.097 1.00 1.05 H new ATOM 0 HZ1 LYS A 61 -9.544 -2.623 15.220 1.00 2.03 H new ATOM 0 HZ2 LYS A 61 -10.070 -1.927 13.763 1.00 2.03 H new ATOM 0 HZ3 LYS A 61 -8.528 -1.560 14.372 1.00 2.03 H new ATOM 1029 N LYS A 62 -10.112 2.320 10.260 1.00 0.20 N ATOM 1030 CA LYS A 62 -11.410 2.511 9.634 1.00 0.22 C ATOM 1031 C LYS A 62 -12.115 1.180 9.437 1.00 0.23 C ATOM 1032 O LYS A 62 -11.489 0.122 9.466 1.00 0.38 O ATOM 1033 CB LYS A 62 -11.248 3.210 8.285 1.00 0.23 C ATOM 1034 CG LYS A 62 -10.543 4.553 8.376 1.00 0.30 C ATOM 1035 CD LYS A 62 -11.360 5.556 9.173 1.00 0.50 C ATOM 1036 CE LYS A 62 -10.740 6.944 9.129 1.00 0.75 C ATOM 1037 NZ LYS A 62 -11.516 7.925 9.937 1.00 1.04 N ATOM 0 H LYS A 62 -9.495 1.678 9.763 1.00 0.20 H new ATOM 0 HA LYS A 62 -12.015 3.134 10.293 1.00 0.22 H new ATOM 0 HB2 LYS A 62 -10.687 2.560 7.613 1.00 0.23 H new ATOM 0 HB3 LYS A 62 -12.232 3.355 7.840 1.00 0.23 H new ATOM 0 HG2 LYS A 62 -9.567 4.422 8.844 1.00 0.30 H new ATOM 0 HG3 LYS A 62 -10.366 4.941 7.373 1.00 0.30 H new ATOM 0 HD2 LYS A 62 -12.374 5.597 8.776 1.00 0.50 H new ATOM 0 HD3 LYS A 62 -11.436 5.223 10.208 1.00 0.50 H new ATOM 0 HE2 LYS A 62 -9.717 6.896 9.501 1.00 0.75 H new ATOM 0 HE3 LYS A 62 -10.688 7.286 8.095 1.00 0.75 H new ATOM 0 HZ1 LYS A 62 -11.061 8.858 9.881 1.00 1.04 H new ATOM 0 HZ2 LYS A 62 -12.486 7.990 9.567 1.00 1.04 H new ATOM 0 HZ3 LYS A 62 -11.544 7.613 10.929 1.00 1.04 H new ATOM 1051 N THR A 63 -13.423 1.242 9.246 1.00 0.17 N ATOM 1052 CA THR A 63 -14.211 0.043 9.034 1.00 0.15 C ATOM 1053 C THR A 63 -14.343 -0.249 7.548 1.00 0.13 C ATOM 1054 O THR A 63 -14.409 0.667 6.731 1.00 0.15 O ATOM 1055 CB THR A 63 -15.614 0.168 9.652 1.00 0.20 C ATOM 1056 OG1 THR A 63 -16.354 1.197 8.986 1.00 0.24 O ATOM 1057 CG2 THR A 63 -15.522 0.486 11.139 1.00 0.24 C ATOM 0 H THR A 63 -13.959 2.110 9.234 1.00 0.17 H new ATOM 0 HA THR A 63 -13.689 -0.777 9.526 1.00 0.15 H new ATOM 0 HB THR A 63 -16.128 -0.786 9.529 1.00 0.20 H new ATOM 0 HG1 THR A 63 -16.635 1.872 9.638 1.00 0.24 H new ATOM 0 HG21 THR A 63 -16.526 0.570 11.556 1.00 0.24 H new ATOM 0 HG22 THR A 63 -14.983 -0.312 11.649 1.00 0.24 H new ATOM 0 HG23 THR A 63 -14.992 1.428 11.277 1.00 0.24 H new ATOM 1065 N ILE A 64 -14.374 -1.527 7.202 1.00 0.12 N ATOM 1066 CA ILE A 64 -14.491 -1.943 5.811 1.00 0.13 C ATOM 1067 C ILE A 64 -15.554 -1.135 5.071 1.00 0.17 C ATOM 1068 O ILE A 64 -15.338 -0.680 3.947 1.00 0.21 O ATOM 1069 CB ILE A 64 -14.842 -3.436 5.722 1.00 0.15 C ATOM 1070 CG1 ILE A 64 -13.787 -4.271 6.445 1.00 0.16 C ATOM 1071 CG2 ILE A 64 -14.968 -3.868 4.272 1.00 0.20 C ATOM 1072 CD1 ILE A 64 -13.962 -5.758 6.255 1.00 0.20 C ATOM 0 H ILE A 64 -14.320 -2.298 7.868 1.00 0.12 H new ATOM 0 HA ILE A 64 -13.525 -1.763 5.339 1.00 0.13 H new ATOM 0 HB ILE A 64 -15.804 -3.598 6.209 1.00 0.15 H new ATOM 0 HG12 ILE A 64 -12.799 -3.981 6.088 1.00 0.16 H new ATOM 0 HG13 ILE A 64 -13.821 -4.042 7.510 1.00 0.16 H new ATOM 0 HG21 ILE A 64 -15.217 -4.928 4.229 1.00 0.20 H new ATOM 0 HG22 ILE A 64 -15.755 -3.290 3.787 1.00 0.20 H new ATOM 0 HG23 ILE A 64 -14.023 -3.696 3.758 1.00 0.20 H new ATOM 0 HD11 ILE A 64 -13.178 -6.289 6.796 1.00 0.20 H new ATOM 0 HD12 ILE A 64 -14.936 -6.062 6.638 1.00 0.20 H new ATOM 0 HD13 ILE A 64 -13.898 -5.999 5.194 1.00 0.20 H new ATOM 1084 N ASP A 65 -16.697 -0.953 5.718 1.00 0.21 N ATOM 1085 CA ASP A 65 -17.804 -0.211 5.129 1.00 0.26 C ATOM 1086 C ASP A 65 -17.417 1.242 4.858 1.00 0.24 C ATOM 1087 O ASP A 65 -18.069 1.928 4.071 1.00 0.27 O ATOM 1088 CB ASP A 65 -19.022 -0.265 6.050 1.00 0.33 C ATOM 1089 CG ASP A 65 -20.218 0.470 5.476 1.00 1.34 C ATOM 1090 OD1 ASP A 65 -20.286 1.707 5.633 1.00 2.08 O ATOM 1091 OD2 ASP A 65 -21.087 -0.192 4.870 1.00 1.99 O ATOM 0 H ASP A 65 -16.883 -1.311 6.655 1.00 0.21 H new ATOM 0 HA ASP A 65 -18.052 -0.678 4.176 1.00 0.26 H new ATOM 0 HB2 ASP A 65 -19.291 -1.306 6.230 1.00 0.33 H new ATOM 0 HB3 ASP A 65 -18.763 0.169 7.016 1.00 0.33 H new ATOM 1096 N ARG A 66 -16.358 1.706 5.512 1.00 0.20 N ATOM 1097 CA ARG A 66 -15.893 3.077 5.337 1.00 0.20 C ATOM 1098 C ARG A 66 -14.877 3.171 4.204 1.00 0.15 C ATOM 1099 O ARG A 66 -14.728 4.219 3.575 1.00 0.14 O ATOM 1100 CB ARG A 66 -15.273 3.588 6.636 1.00 0.24 C ATOM 1101 CG ARG A 66 -16.283 3.810 7.753 1.00 0.71 C ATOM 1102 CD ARG A 66 -17.143 5.036 7.497 1.00 0.66 C ATOM 1103 NE ARG A 66 -17.960 5.383 8.658 1.00 1.54 N ATOM 1104 CZ ARG A 66 -18.775 6.432 8.699 1.00 1.70 C ATOM 1105 NH1 ARG A 66 -18.903 7.218 7.638 1.00 0.95 N ATOM 1106 NH2 ARG A 66 -19.470 6.693 9.798 1.00 2.72 N ATOM 0 H ARG A 66 -15.806 1.153 6.168 1.00 0.20 H new ATOM 0 HA ARG A 66 -16.751 3.697 5.078 1.00 0.20 H new ATOM 0 HB2 ARG A 66 -14.522 2.874 6.975 1.00 0.24 H new ATOM 0 HB3 ARG A 66 -14.754 4.526 6.436 1.00 0.24 H new ATOM 0 HG2 ARG A 66 -16.921 2.931 7.847 1.00 0.71 H new ATOM 0 HG3 ARG A 66 -15.758 3.925 8.701 1.00 0.71 H new ATOM 0 HD2 ARG A 66 -16.504 5.880 7.238 1.00 0.66 H new ATOM 0 HD3 ARG A 66 -17.791 4.852 6.640 1.00 0.66 H new ATOM 0 HE ARG A 66 -17.901 4.787 9.483 1.00 1.54 H new ATOM 0 HH11 ARG A 66 -18.375 7.018 6.788 1.00 0.95 H new ATOM 0 HH12 ARG A 66 -19.529 8.022 7.672 1.00 0.95 H new ATOM 0 HH21 ARG A 66 -19.380 6.088 10.614 1.00 2.72 H new ATOM 0 HH22 ARG A 66 -20.095 7.499 9.827 1.00 2.72 H new ATOM 1120 N LEU A 67 -14.179 2.069 3.949 1.00 0.13 N ATOM 1121 CA LEU A 67 -13.176 2.025 2.893 1.00 0.11 C ATOM 1122 C LEU A 67 -13.760 2.461 1.556 1.00 0.13 C ATOM 1123 O LEU A 67 -13.031 2.853 0.646 1.00 0.14 O ATOM 1124 CB LEU A 67 -12.592 0.620 2.779 1.00 0.11 C ATOM 1125 CG LEU A 67 -11.359 0.358 3.650 1.00 0.12 C ATOM 1126 CD1 LEU A 67 -11.524 0.971 5.034 1.00 0.12 C ATOM 1127 CD2 LEU A 67 -11.102 -1.134 3.763 1.00 0.15 C ATOM 0 H LEU A 67 -14.290 1.194 4.461 1.00 0.13 H new ATOM 0 HA LEU A 67 -12.381 2.722 3.156 1.00 0.11 H new ATOM 0 HB2 LEU A 67 -13.365 -0.101 3.044 1.00 0.11 H new ATOM 0 HB3 LEU A 67 -12.328 0.436 1.738 1.00 0.11 H new ATOM 0 HG LEU A 67 -10.501 0.830 3.171 1.00 0.12 H new ATOM 0 HD11 LEU A 67 -10.634 0.769 5.630 1.00 0.12 H new ATOM 0 HD12 LEU A 67 -11.662 2.048 4.941 1.00 0.12 H new ATOM 0 HD13 LEU A 67 -12.395 0.535 5.524 1.00 0.12 H new ATOM 0 HD21 LEU A 67 -10.223 -1.306 4.384 1.00 0.15 H new ATOM 0 HD22 LEU A 67 -11.967 -1.619 4.216 1.00 0.15 H new ATOM 0 HD23 LEU A 67 -10.931 -1.550 2.770 1.00 0.15 H new ATOM 1139 N ASN A 68 -15.076 2.379 1.436 1.00 0.15 N ATOM 1140 CA ASN A 68 -15.745 2.789 0.214 1.00 0.19 C ATOM 1141 C ASN A 68 -15.797 4.315 0.113 1.00 0.19 C ATOM 1142 O ASN A 68 -16.112 4.863 -0.942 1.00 0.22 O ATOM 1143 CB ASN A 68 -17.161 2.214 0.174 1.00 0.25 C ATOM 1144 CG ASN A 68 -17.781 2.284 -1.207 1.00 0.88 C ATOM 1145 OD1 ASN A 68 -18.690 1.363 -1.491 1.00 1.69 O flip ATOM 1146 ND2 ASN A 68 -17.449 3.158 -2.008 1.00 0.83 N flip ATOM 0 H ASN A 68 -15.698 2.034 2.167 1.00 0.15 H new ATOM 0 HA ASN A 68 -15.179 2.405 -0.635 1.00 0.19 H new ATOM 0 HB2 ASN A 68 -17.137 1.176 0.505 1.00 0.25 H new ATOM 0 HB3 ASN A 68 -17.790 2.758 0.878 1.00 0.25 H new ATOM 0 HD21 ASN A 68 -16.744 3.848 -1.747 1.00 0.83 H new ATOM 0 HD22 ASN A 68 -17.879 3.192 -2.932 1.00 0.83 H new ATOM 1153 N PHE A 69 -15.480 5.001 1.214 1.00 0.17 N ATOM 1154 CA PHE A 69 -15.511 6.458 1.236 1.00 0.18 C ATOM 1155 C PHE A 69 -14.150 7.062 1.587 1.00 0.15 C ATOM 1156 O PHE A 69 -13.990 8.282 1.569 1.00 0.18 O ATOM 1157 CB PHE A 69 -16.565 6.934 2.234 1.00 0.22 C ATOM 1158 CG PHE A 69 -17.892 6.256 2.060 1.00 0.25 C ATOM 1159 CD1 PHE A 69 -18.808 6.716 1.129 1.00 0.32 C ATOM 1160 CD2 PHE A 69 -18.218 5.149 2.825 1.00 0.27 C ATOM 1161 CE1 PHE A 69 -20.026 6.085 0.966 1.00 0.36 C ATOM 1162 CE2 PHE A 69 -19.435 4.515 2.667 1.00 0.31 C ATOM 1163 CZ PHE A 69 -20.340 4.983 1.736 1.00 0.34 C ATOM 0 H PHE A 69 -15.201 4.570 2.095 1.00 0.17 H new ATOM 0 HA PHE A 69 -15.767 6.797 0.232 1.00 0.18 H new ATOM 0 HB2 PHE A 69 -16.204 6.756 3.247 1.00 0.22 H new ATOM 0 HB3 PHE A 69 -16.697 8.011 2.127 1.00 0.22 H new ATOM 0 HD1 PHE A 69 -18.568 7.578 0.524 1.00 0.32 H new ATOM 0 HD2 PHE A 69 -17.513 4.777 3.553 1.00 0.27 H new ATOM 0 HE1 PHE A 69 -20.732 6.454 0.237 1.00 0.36 H new ATOM 0 HE2 PHE A 69 -19.678 3.654 3.272 1.00 0.31 H new ATOM 0 HZ PHE A 69 -21.292 4.488 1.610 1.00 0.34 H new ATOM 1173 N ILE A 70 -13.168 6.219 1.907 1.00 0.12 N ATOM 1174 CA ILE A 70 -11.840 6.713 2.262 1.00 0.11 C ATOM 1175 C ILE A 70 -11.049 7.106 1.020 1.00 0.12 C ATOM 1176 O ILE A 70 -11.489 6.884 -0.108 1.00 0.13 O ATOM 1177 CB ILE A 70 -11.030 5.675 3.063 1.00 0.11 C ATOM 1178 CG1 ILE A 70 -10.770 4.432 2.218 1.00 0.11 C ATOM 1179 CG2 ILE A 70 -11.753 5.311 4.350 1.00 0.13 C ATOM 1180 CD1 ILE A 70 -10.008 3.355 2.954 1.00 0.15 C ATOM 0 H ILE A 70 -13.266 5.204 1.928 1.00 0.12 H new ATOM 0 HA ILE A 70 -11.998 7.591 2.889 1.00 0.11 H new ATOM 0 HB ILE A 70 -10.068 6.116 3.326 1.00 0.11 H new ATOM 0 HG12 ILE A 70 -11.723 4.026 1.880 1.00 0.11 H new ATOM 0 HG13 ILE A 70 -10.211 4.718 1.327 1.00 0.11 H new ATOM 0 HG21 ILE A 70 -11.166 4.577 4.902 1.00 0.13 H new ATOM 0 HG22 ILE A 70 -11.883 6.205 4.960 1.00 0.13 H new ATOM 0 HG23 ILE A 70 -12.730 4.890 4.112 1.00 0.13 H new ATOM 0 HD11 ILE A 70 -9.858 2.500 2.295 1.00 0.15 H new ATOM 0 HD12 ILE A 70 -9.040 3.745 3.269 1.00 0.15 H new ATOM 0 HD13 ILE A 70 -10.576 3.042 3.830 1.00 0.15 H new ATOM 1192 N SER A 71 -9.878 7.692 1.240 1.00 0.12 N ATOM 1193 CA SER A 71 -9.024 8.132 0.145 1.00 0.14 C ATOM 1194 C SER A 71 -8.364 6.949 -0.557 1.00 0.13 C ATOM 1195 O SER A 71 -7.317 6.464 -0.130 1.00 0.15 O ATOM 1196 CB SER A 71 -7.953 9.092 0.662 1.00 0.17 C ATOM 1197 OG SER A 71 -8.537 10.260 1.212 1.00 1.14 O ATOM 0 H SER A 71 -9.498 7.873 2.169 1.00 0.12 H new ATOM 0 HA SER A 71 -9.653 8.649 -0.580 1.00 0.14 H new ATOM 0 HB2 SER A 71 -7.348 8.593 1.419 1.00 0.17 H new ATOM 0 HB3 SER A 71 -7.282 9.366 -0.152 1.00 0.17 H new ATOM 0 HG SER A 71 -7.831 10.857 1.537 1.00 1.14 H new ATOM 1203 N LEU A 72 -8.989 6.494 -1.634 1.00 0.12 N ATOM 1204 CA LEU A 72 -8.466 5.380 -2.414 1.00 0.12 C ATOM 1205 C LEU A 72 -7.599 5.902 -3.566 1.00 0.13 C ATOM 1206 O LEU A 72 -7.832 7.000 -4.070 1.00 0.15 O ATOM 1207 CB LEU A 72 -9.619 4.534 -2.966 1.00 0.13 C ATOM 1208 CG LEU A 72 -9.713 3.109 -2.411 1.00 0.15 C ATOM 1209 CD1 LEU A 72 -9.714 3.118 -0.891 1.00 0.17 C ATOM 1210 CD2 LEU A 72 -10.961 2.418 -2.940 1.00 0.16 C ATOM 0 H LEU A 72 -9.863 6.881 -1.989 1.00 0.12 H new ATOM 0 HA LEU A 72 -7.851 4.757 -1.765 1.00 0.12 H new ATOM 0 HB2 LEU A 72 -10.557 5.049 -2.758 1.00 0.13 H new ATOM 0 HB3 LEU A 72 -9.519 4.478 -4.050 1.00 0.13 H new ATOM 0 HG LEU A 72 -8.837 2.553 -2.746 1.00 0.15 H new ATOM 0 HD11 LEU A 72 -9.781 2.095 -0.521 1.00 0.17 H new ATOM 0 HD12 LEU A 72 -8.793 3.575 -0.529 1.00 0.17 H new ATOM 0 HD13 LEU A 72 -10.569 3.691 -0.531 1.00 0.17 H new ATOM 0 HD21 LEU A 72 -11.015 1.406 -2.538 1.00 0.16 H new ATOM 0 HD22 LEU A 72 -11.845 2.978 -2.634 1.00 0.16 H new ATOM 0 HD23 LEU A 72 -10.919 2.374 -4.028 1.00 0.16 H new ATOM 1222 N PRO A 73 -6.585 5.128 -4.001 1.00 0.13 N ATOM 1223 CA PRO A 73 -6.269 3.816 -3.433 1.00 0.11 C ATOM 1224 C PRO A 73 -5.607 3.918 -2.068 1.00 0.10 C ATOM 1225 O PRO A 73 -4.711 4.734 -1.855 1.00 0.13 O ATOM 1226 CB PRO A 73 -5.300 3.216 -4.449 1.00 0.12 C ATOM 1227 CG PRO A 73 -4.638 4.391 -5.075 1.00 0.19 C ATOM 1228 CD PRO A 73 -5.667 5.488 -5.096 1.00 0.14 C ATOM 0 HA PRO A 73 -7.165 3.218 -3.270 1.00 0.11 H new ATOM 0 HB2 PRO A 73 -4.574 2.562 -3.966 1.00 0.12 H new ATOM 0 HB3 PRO A 73 -5.826 2.615 -5.191 1.00 0.12 H new ATOM 0 HG2 PRO A 73 -3.759 4.692 -4.505 1.00 0.19 H new ATOM 0 HG3 PRO A 73 -4.299 4.156 -6.084 1.00 0.19 H new ATOM 0 HD2 PRO A 73 -5.213 6.466 -4.933 1.00 0.14 H new ATOM 0 HD3 PRO A 73 -6.185 5.533 -6.054 1.00 0.14 H new ATOM 1236 N ALA A 74 -6.057 3.080 -1.146 1.00 0.09 N ATOM 1237 CA ALA A 74 -5.518 3.066 0.205 1.00 0.09 C ATOM 1238 C ALA A 74 -4.699 1.804 0.449 1.00 0.08 C ATOM 1239 O ALA A 74 -4.926 0.777 -0.188 1.00 0.14 O ATOM 1240 CB ALA A 74 -6.647 3.176 1.218 1.00 0.09 C ATOM 0 H ALA A 74 -6.797 2.398 -1.310 1.00 0.09 H new ATOM 0 HA ALA A 74 -4.856 3.924 0.323 1.00 0.09 H new ATOM 0 HB1 ALA A 74 -6.233 3.165 2.226 1.00 0.09 H new ATOM 0 HB2 ALA A 74 -7.189 4.108 1.059 1.00 0.09 H new ATOM 0 HB3 ALA A 74 -7.329 2.334 1.096 1.00 0.09 H new ATOM 1246 N LEU A 75 -3.746 1.886 1.371 1.00 0.07 N ATOM 1247 CA LEU A 75 -2.898 0.743 1.685 1.00 0.07 C ATOM 1248 C LEU A 75 -3.314 0.093 2.997 1.00 0.07 C ATOM 1249 O LEU A 75 -3.132 0.663 4.071 1.00 0.10 O ATOM 1250 CB LEU A 75 -1.435 1.172 1.773 1.00 0.08 C ATOM 1251 CG LEU A 75 -0.482 0.105 2.312 1.00 0.07 C ATOM 1252 CD1 LEU A 75 -0.307 -1.014 1.300 1.00 0.07 C ATOM 1253 CD2 LEU A 75 0.861 0.721 2.669 1.00 0.09 C ATOM 0 H LEU A 75 -3.542 2.727 1.911 1.00 0.07 H new ATOM 0 HA LEU A 75 -3.015 0.015 0.882 1.00 0.07 H new ATOM 0 HB2 LEU A 75 -1.099 1.470 0.780 1.00 0.08 H new ATOM 0 HB3 LEU A 75 -1.368 2.054 2.410 1.00 0.08 H new ATOM 0 HG LEU A 75 -0.916 -0.318 3.218 1.00 0.07 H new ATOM 0 HD11 LEU A 75 0.375 -1.764 1.701 1.00 0.07 H new ATOM 0 HD12 LEU A 75 -1.274 -1.474 1.096 1.00 0.07 H new ATOM 0 HD13 LEU A 75 0.104 -0.608 0.376 1.00 0.07 H new ATOM 0 HD21 LEU A 75 1.526 -0.053 3.051 1.00 0.09 H new ATOM 0 HD22 LEU A 75 1.302 1.172 1.780 1.00 0.09 H new ATOM 0 HD23 LEU A 75 0.719 1.486 3.432 1.00 0.09 H new ATOM 1265 N VAL A 76 -3.862 -1.109 2.904 1.00 0.06 N ATOM 1266 CA VAL A 76 -4.288 -1.842 4.083 1.00 0.07 C ATOM 1267 C VAL A 76 -3.087 -2.462 4.788 1.00 0.07 C ATOM 1268 O VAL A 76 -2.594 -3.516 4.387 1.00 0.08 O ATOM 1269 CB VAL A 76 -5.295 -2.947 3.722 1.00 0.08 C ATOM 1270 CG1 VAL A 76 -4.723 -3.841 2.640 1.00 0.08 C ATOM 1271 CG2 VAL A 76 -5.674 -3.758 4.952 1.00 0.10 C ATOM 0 H VAL A 76 -4.022 -1.597 2.023 1.00 0.06 H new ATOM 0 HA VAL A 76 -4.776 -1.132 4.751 1.00 0.07 H new ATOM 0 HB VAL A 76 -6.202 -2.478 3.340 1.00 0.08 H new ATOM 0 HG11 VAL A 76 -5.444 -4.620 2.392 1.00 0.08 H new ATOM 0 HG12 VAL A 76 -4.511 -3.247 1.751 1.00 0.08 H new ATOM 0 HG13 VAL A 76 -3.801 -4.301 2.997 1.00 0.08 H new ATOM 0 HG21 VAL A 76 -6.387 -4.533 4.671 1.00 0.10 H new ATOM 0 HG22 VAL A 76 -4.781 -4.221 5.372 1.00 0.10 H new ATOM 0 HG23 VAL A 76 -6.126 -3.102 5.696 1.00 0.10 H new ATOM 1281 N TRP A 77 -2.622 -1.798 5.837 1.00 0.07 N ATOM 1282 CA TRP A 77 -1.476 -2.279 6.591 1.00 0.08 C ATOM 1283 C TRP A 77 -1.730 -3.678 7.138 1.00 0.09 C ATOM 1284 O TRP A 77 -2.789 -3.954 7.700 1.00 0.13 O ATOM 1285 CB TRP A 77 -1.158 -1.325 7.739 1.00 0.10 C ATOM 1286 CG TRP A 77 0.201 -1.544 8.319 1.00 0.09 C ATOM 1287 CD1 TRP A 77 0.497 -2.040 9.555 1.00 0.10 C ATOM 1288 CD2 TRP A 77 1.452 -1.281 7.680 1.00 0.09 C ATOM 1289 NE1 TRP A 77 1.858 -2.098 9.723 1.00 0.11 N ATOM 1290 CE2 TRP A 77 2.467 -1.637 8.587 1.00 0.10 C ATOM 1291 CE3 TRP A 77 1.811 -0.778 6.430 1.00 0.09 C ATOM 1292 CZ2 TRP A 77 3.817 -1.503 8.280 1.00 0.11 C ATOM 1293 CZ3 TRP A 77 3.152 -0.647 6.126 1.00 0.11 C ATOM 1294 CH2 TRP A 77 4.140 -1.009 7.048 1.00 0.12 C ATOM 0 H TRP A 77 -3.021 -0.926 6.184 1.00 0.07 H new ATOM 0 HA TRP A 77 -0.623 -2.322 5.914 1.00 0.08 H new ATOM 0 HB2 TRP A 77 -1.234 -0.298 7.382 1.00 0.10 H new ATOM 0 HB3 TRP A 77 -1.906 -1.446 8.523 1.00 0.10 H new ATOM 0 HD1 TRP A 77 -0.232 -2.342 10.292 1.00 0.10 H new ATOM 0 HE1 TRP A 77 2.338 -2.431 10.559 1.00 0.11 H new ATOM 0 HE3 TRP A 77 1.054 -0.496 5.713 1.00 0.09 H new ATOM 0 HZ2 TRP A 77 4.582 -1.780 8.990 1.00 0.11 H new ATOM 0 HZ3 TRP A 77 3.443 -0.259 5.161 1.00 0.11 H new ATOM 0 HH2 TRP A 77 5.180 -0.896 6.780 1.00 0.12 H new ATOM 1305 N ARG A 78 -0.748 -4.554 6.970 1.00 0.10 N ATOM 1306 CA ARG A 78 -0.855 -5.922 7.449 1.00 0.13 C ATOM 1307 C ARG A 78 0.346 -6.291 8.306 1.00 0.15 C ATOM 1308 O ARG A 78 1.481 -6.319 7.831 1.00 0.17 O ATOM 1309 CB ARG A 78 -0.980 -6.892 6.274 1.00 0.16 C ATOM 1310 CG ARG A 78 -2.383 -6.967 5.698 1.00 0.19 C ATOM 1311 CD ARG A 78 -3.293 -7.827 6.560 1.00 0.30 C ATOM 1312 NE ARG A 78 -2.804 -9.199 6.672 1.00 0.23 N ATOM 1313 CZ ARG A 78 -3.390 -10.132 7.415 1.00 0.33 C ATOM 1314 NH1 ARG A 78 -4.478 -9.841 8.114 1.00 0.79 N ATOM 1315 NH2 ARG A 78 -2.887 -11.358 7.461 1.00 0.38 N ATOM 0 H ARG A 78 0.133 -4.339 6.504 1.00 0.10 H new ATOM 0 HA ARG A 78 -1.753 -5.996 8.063 1.00 0.13 H new ATOM 0 HB2 ARG A 78 -0.289 -6.589 5.488 1.00 0.16 H new ATOM 0 HB3 ARG A 78 -0.676 -7.887 6.600 1.00 0.16 H new ATOM 0 HG2 ARG A 78 -2.799 -5.963 5.617 1.00 0.19 H new ATOM 0 HG3 ARG A 78 -2.342 -7.377 4.689 1.00 0.19 H new ATOM 0 HD2 ARG A 78 -3.372 -7.388 7.554 1.00 0.30 H new ATOM 0 HD3 ARG A 78 -4.296 -7.833 6.134 1.00 0.30 H new ATOM 0 HE ARG A 78 -1.966 -9.455 6.151 1.00 0.23 H new ATOM 0 HH11 ARG A 78 -4.868 -8.899 8.082 1.00 0.79 H new ATOM 0 HH12 ARG A 78 -4.926 -10.559 8.683 1.00 0.79 H new ATOM 0 HH21 ARG A 78 -2.049 -11.586 6.926 1.00 0.38 H new ATOM 0 HH22 ARG A 78 -3.338 -12.073 8.032 1.00 0.38 H new ATOM 1329 N GLU A 79 0.081 -6.572 9.573 1.00 0.17 N ATOM 1330 CA GLU A 79 1.127 -6.944 10.515 1.00 0.20 C ATOM 1331 C GLU A 79 1.797 -8.253 10.106 1.00 0.23 C ATOM 1332 O GLU A 79 2.895 -8.567 10.564 1.00 0.28 O ATOM 1333 CB GLU A 79 0.547 -7.082 11.921 1.00 0.21 C ATOM 1334 CG GLU A 79 -0.168 -5.835 12.408 1.00 0.28 C ATOM 1335 CD GLU A 79 -0.671 -5.970 13.832 1.00 0.86 C ATOM 1336 OE1 GLU A 79 -1.729 -6.604 14.032 1.00 1.13 O ATOM 1337 OE2 GLU A 79 -0.005 -5.444 14.750 1.00 1.75 O ATOM 0 H GLU A 79 -0.856 -6.549 9.975 1.00 0.17 H new ATOM 0 HA GLU A 79 1.879 -6.155 10.509 1.00 0.20 H new ATOM 0 HB2 GLU A 79 -0.150 -7.920 11.937 1.00 0.21 H new ATOM 0 HB3 GLU A 79 1.352 -7.324 12.615 1.00 0.21 H new ATOM 0 HG2 GLU A 79 0.510 -4.984 12.345 1.00 0.28 H new ATOM 0 HG3 GLU A 79 -1.009 -5.622 11.748 1.00 0.28 H new ATOM 1344 N ASP A 80 1.131 -9.015 9.244 1.00 0.24 N ATOM 1345 CA ASP A 80 1.668 -10.288 8.786 1.00 0.32 C ATOM 1346 C ASP A 80 2.618 -10.104 7.603 1.00 0.35 C ATOM 1347 O ASP A 80 3.054 -11.081 6.993 1.00 0.45 O ATOM 1348 CB ASP A 80 0.532 -11.234 8.400 1.00 0.34 C ATOM 1349 CG ASP A 80 -0.366 -11.566 9.576 1.00 1.29 C ATOM 1350 OD1 ASP A 80 -1.288 -10.774 9.864 1.00 2.00 O ATOM 1351 OD2 ASP A 80 -0.146 -12.620 10.210 1.00 1.86 O ATOM 0 H ASP A 80 0.222 -8.773 8.851 1.00 0.24 H new ATOM 0 HA ASP A 80 2.235 -10.722 9.609 1.00 0.32 H new ATOM 0 HB2 ASP A 80 -0.063 -10.779 7.608 1.00 0.34 H new ATOM 0 HB3 ASP A 80 0.951 -12.155 7.995 1.00 0.34 H new ATOM 1356 N GLY A 81 2.939 -8.852 7.278 1.00 0.32 N ATOM 1357 CA GLY A 81 3.836 -8.589 6.172 1.00 0.40 C ATOM 1358 C GLY A 81 3.224 -8.965 4.841 1.00 0.45 C ATOM 1359 O GLY A 81 3.926 -9.358 3.910 1.00 0.82 O ATOM 0 H GLY A 81 2.594 -8.022 7.760 1.00 0.32 H new ATOM 0 HA2 GLY A 81 4.100 -7.531 6.163 1.00 0.40 H new ATOM 0 HA3 GLY A 81 4.761 -9.147 6.316 1.00 0.40 H new ATOM 1363 N ARG A 82 1.905 -8.853 4.760 1.00 0.18 N ATOM 1364 CA ARG A 82 1.173 -9.172 3.544 1.00 0.18 C ATOM 1365 C ARG A 82 0.166 -8.074 3.243 1.00 0.14 C ATOM 1366 O ARG A 82 -1.040 -8.313 3.216 1.00 0.17 O ATOM 1367 CB ARG A 82 0.453 -10.507 3.705 1.00 0.22 C ATOM 1368 CG ARG A 82 1.347 -11.615 4.229 1.00 0.29 C ATOM 1369 CD ARG A 82 2.260 -12.152 3.142 1.00 0.60 C ATOM 1370 NE ARG A 82 3.029 -13.312 3.589 1.00 0.96 N ATOM 1371 CZ ARG A 82 4.022 -13.848 2.887 1.00 1.46 C ATOM 1372 NH1 ARG A 82 4.373 -13.319 1.723 1.00 1.68 N ATOM 1373 NH2 ARG A 82 4.667 -14.910 3.350 1.00 1.85 N ATOM 0 H ARG A 82 1.316 -8.540 5.532 1.00 0.18 H new ATOM 0 HA ARG A 82 1.877 -9.246 2.715 1.00 0.18 H new ATOM 0 HB2 ARG A 82 -0.389 -10.377 4.385 1.00 0.22 H new ATOM 0 HB3 ARG A 82 0.041 -10.808 2.742 1.00 0.22 H new ATOM 0 HG2 ARG A 82 1.947 -11.239 5.057 1.00 0.29 H new ATOM 0 HG3 ARG A 82 0.732 -12.425 4.623 1.00 0.29 H new ATOM 0 HD2 ARG A 82 1.663 -12.427 2.272 1.00 0.60 H new ATOM 0 HD3 ARG A 82 2.944 -11.366 2.823 1.00 0.60 H new ATOM 0 HE ARG A 82 2.791 -13.732 4.487 1.00 0.96 H new ATOM 0 HH11 ARG A 82 3.881 -12.500 1.366 1.00 1.68 H new ATOM 0 HH12 ARG A 82 5.135 -13.731 1.185 1.00 1.68 H new ATOM 0 HH21 ARG A 82 4.401 -15.317 4.247 1.00 1.85 H new ATOM 0 HH22 ARG A 82 5.429 -15.320 2.809 1.00 1.85 H new ATOM 1387 N HIS A 83 0.669 -6.869 3.011 1.00 0.11 N ATOM 1388 CA HIS A 83 -0.192 -5.727 2.737 1.00 0.09 C ATOM 1389 C HIS A 83 -0.651 -5.724 1.285 1.00 0.08 C ATOM 1390 O HIS A 83 -0.194 -6.526 0.470 1.00 0.10 O ATOM 1391 CB HIS A 83 0.520 -4.399 3.041 1.00 0.12 C ATOM 1392 CG HIS A 83 1.710 -4.516 3.945 1.00 0.12 C ATOM 1393 ND1 HIS A 83 1.598 -5.003 5.224 1.00 0.22 N ATOM 1394 CD2 HIS A 83 3.004 -4.194 3.705 1.00 0.13 C ATOM 1395 CE1 HIS A 83 2.816 -4.968 5.733 1.00 0.23 C ATOM 1396 NE2 HIS A 83 3.704 -4.484 4.849 1.00 0.15 N ATOM 0 H HIS A 83 1.667 -6.657 3.007 1.00 0.11 H new ATOM 0 HA HIS A 83 -1.059 -5.821 3.391 1.00 0.09 H new ATOM 0 HB2 HIS A 83 0.839 -3.950 2.100 1.00 0.12 H new ATOM 0 HB3 HIS A 83 -0.197 -3.714 3.494 1.00 0.12 H new ATOM 0 HD2 HIS A 83 3.407 -3.787 2.789 1.00 0.13 H new ATOM 0 HE1 HIS A 83 3.066 -5.288 6.734 1.00 0.23 H new ATOM 0 HE2 HIS A 83 4.705 -4.357 4.999 1.00 0.15 H new ATOM 1404 N PHE A 84 -1.565 -4.814 0.979 1.00 0.09 N ATOM 1405 CA PHE A 84 -2.086 -4.663 -0.369 1.00 0.08 C ATOM 1406 C PHE A 84 -2.791 -3.321 -0.502 1.00 0.08 C ATOM 1407 O PHE A 84 -3.307 -2.781 0.476 1.00 0.08 O ATOM 1408 CB PHE A 84 -3.019 -5.819 -0.743 1.00 0.09 C ATOM 1409 CG PHE A 84 -4.152 -6.053 0.217 1.00 0.09 C ATOM 1410 CD1 PHE A 84 -3.991 -6.899 1.301 1.00 0.11 C ATOM 1411 CD2 PHE A 84 -5.369 -5.407 0.050 1.00 0.12 C ATOM 1412 CE1 PHE A 84 -5.018 -7.098 2.200 1.00 0.14 C ATOM 1413 CE2 PHE A 84 -6.403 -5.607 0.945 1.00 0.14 C ATOM 1414 CZ PHE A 84 -6.269 -6.520 1.958 1.00 0.15 C ATOM 0 H PHE A 84 -1.964 -4.163 1.656 1.00 0.09 H new ATOM 0 HA PHE A 84 -1.250 -4.690 -1.068 1.00 0.08 H new ATOM 0 HB2 PHE A 84 -3.434 -5.626 -1.732 1.00 0.09 H new ATOM 0 HB3 PHE A 84 -2.430 -6.733 -0.817 1.00 0.09 H new ATOM 0 HD1 PHE A 84 -3.050 -7.409 1.444 1.00 0.11 H new ATOM 0 HD2 PHE A 84 -5.510 -4.741 -0.788 1.00 0.12 H new ATOM 0 HE1 PHE A 84 -4.858 -7.696 3.085 1.00 0.14 H new ATOM 0 HE2 PHE A 84 -7.318 -5.043 0.846 1.00 0.14 H new ATOM 0 HZ PHE A 84 -7.121 -6.791 2.564 1.00 0.15 H new ATOM 1424 N ILE A 85 -2.810 -2.783 -1.714 1.00 0.09 N ATOM 1425 CA ILE A 85 -3.421 -1.484 -1.958 1.00 0.09 C ATOM 1426 C ILE A 85 -4.864 -1.601 -2.434 1.00 0.08 C ATOM 1427 O ILE A 85 -5.130 -2.100 -3.526 1.00 0.09 O ATOM 1428 CB ILE A 85 -2.619 -0.683 -3.002 1.00 0.11 C ATOM 1429 CG1 ILE A 85 -1.175 -0.500 -2.536 1.00 0.12 C ATOM 1430 CG2 ILE A 85 -3.272 0.667 -3.265 1.00 0.13 C ATOM 1431 CD1 ILE A 85 -0.363 0.402 -3.439 1.00 0.12 C ATOM 0 H ILE A 85 -2.410 -3.225 -2.542 1.00 0.09 H new ATOM 0 HA ILE A 85 -3.413 -0.962 -1.001 1.00 0.09 H new ATOM 0 HB ILE A 85 -2.614 -1.245 -3.936 1.00 0.11 H new ATOM 0 HG12 ILE A 85 -1.176 -0.087 -1.527 1.00 0.12 H new ATOM 0 HG13 ILE A 85 -0.692 -1.476 -2.480 1.00 0.12 H new ATOM 0 HG21 ILE A 85 -2.689 1.215 -4.005 1.00 0.13 H new ATOM 0 HG22 ILE A 85 -4.284 0.515 -3.641 1.00 0.13 H new ATOM 0 HG23 ILE A 85 -3.311 1.239 -2.338 1.00 0.13 H new ATOM 0 HD11 ILE A 85 0.652 0.488 -3.050 1.00 0.12 H new ATOM 0 HD12 ILE A 85 -0.332 -0.021 -4.443 1.00 0.12 H new ATOM 0 HD13 ILE A 85 -0.823 1.390 -3.476 1.00 0.12 H new ATOM 1443 N LEU A 86 -5.789 -1.126 -1.607 1.00 0.08 N ATOM 1444 CA LEU A 86 -7.200 -1.141 -1.957 1.00 0.08 C ATOM 1445 C LEU A 86 -7.477 -0.033 -2.960 1.00 0.08 C ATOM 1446 O LEU A 86 -7.181 1.131 -2.702 1.00 0.10 O ATOM 1447 CB LEU A 86 -8.067 -0.951 -0.712 1.00 0.09 C ATOM 1448 CG LEU A 86 -9.573 -0.936 -0.974 1.00 0.10 C ATOM 1449 CD1 LEU A 86 -9.995 -2.189 -1.724 1.00 0.11 C ATOM 1450 CD2 LEU A 86 -10.343 -0.811 0.332 1.00 0.14 C ATOM 0 H LEU A 86 -5.585 -0.727 -0.691 1.00 0.08 H new ATOM 0 HA LEU A 86 -7.447 -2.106 -2.399 1.00 0.08 H new ATOM 0 HB2 LEU A 86 -7.844 -1.751 -0.006 1.00 0.09 H new ATOM 0 HB3 LEU A 86 -7.787 -0.014 -0.231 1.00 0.09 H new ATOM 0 HG LEU A 86 -9.805 -0.069 -1.593 1.00 0.10 H new ATOM 0 HD11 LEU A 86 -11.070 -2.162 -1.902 1.00 0.11 H new ATOM 0 HD12 LEU A 86 -9.470 -2.236 -2.678 1.00 0.11 H new ATOM 0 HD13 LEU A 86 -9.748 -3.069 -1.130 1.00 0.11 H new ATOM 0 HD21 LEU A 86 -11.413 -0.802 0.124 1.00 0.14 H new ATOM 0 HD22 LEU A 86 -10.106 -1.657 0.977 1.00 0.14 H new ATOM 0 HD23 LEU A 86 -10.063 0.116 0.832 1.00 0.14 H new ATOM 1462 N THR A 87 -8.046 -0.394 -4.102 1.00 0.08 N ATOM 1463 CA THR A 87 -8.328 0.582 -5.145 1.00 0.09 C ATOM 1464 C THR A 87 -9.823 0.764 -5.367 1.00 0.09 C ATOM 1465 O THR A 87 -10.253 1.765 -5.941 1.00 0.11 O ATOM 1466 CB THR A 87 -7.676 0.169 -6.474 1.00 0.10 C ATOM 1467 OG1 THR A 87 -8.273 -1.039 -6.957 1.00 0.14 O ATOM 1468 CG2 THR A 87 -6.181 -0.038 -6.295 1.00 0.13 C ATOM 0 H THR A 87 -8.320 -1.350 -4.329 1.00 0.08 H new ATOM 0 HA THR A 87 -7.907 1.528 -4.805 1.00 0.09 H new ATOM 0 HB THR A 87 -7.836 0.968 -7.198 1.00 0.10 H new ATOM 0 HG1 THR A 87 -8.513 -1.611 -6.199 1.00 0.14 H new ATOM 0 HG21 THR A 87 -5.738 -0.330 -7.247 1.00 0.13 H new ATOM 0 HG22 THR A 87 -5.724 0.890 -5.951 1.00 0.13 H new ATOM 0 HG23 THR A 87 -6.008 -0.823 -5.558 1.00 0.13 H new ATOM 1476 N LYS A 88 -10.612 -0.201 -4.918 1.00 0.09 N ATOM 1477 CA LYS A 88 -12.054 -0.129 -5.084 1.00 0.10 C ATOM 1478 C LYS A 88 -12.755 -1.221 -4.293 1.00 0.11 C ATOM 1479 O LYS A 88 -12.181 -2.276 -4.022 1.00 0.11 O ATOM 1480 CB LYS A 88 -12.412 -0.244 -6.563 1.00 0.12 C ATOM 1481 CG LYS A 88 -13.902 -0.171 -6.839 1.00 0.16 C ATOM 1482 CD LYS A 88 -14.185 -0.140 -8.332 1.00 0.21 C ATOM 1483 CE LYS A 88 -15.676 -0.053 -8.618 1.00 0.55 C ATOM 1484 NZ LYS A 88 -15.958 -0.006 -10.079 1.00 1.43 N ATOM 0 H LYS A 88 -10.280 -1.038 -4.439 1.00 0.09 H new ATOM 0 HA LYS A 88 -12.392 0.834 -4.702 1.00 0.10 H new ATOM 0 HB2 LYS A 88 -11.911 0.553 -7.112 1.00 0.12 H new ATOM 0 HB3 LYS A 88 -12.026 -1.188 -6.948 1.00 0.12 H new ATOM 0 HG2 LYS A 88 -14.400 -1.030 -6.390 1.00 0.16 H new ATOM 0 HG3 LYS A 88 -14.318 0.720 -6.369 1.00 0.16 H new ATOM 0 HD2 LYS A 88 -13.677 0.714 -8.781 1.00 0.21 H new ATOM 0 HD3 LYS A 88 -13.776 -1.036 -8.799 1.00 0.21 H new ATOM 0 HE2 LYS A 88 -16.181 -0.913 -8.178 1.00 0.55 H new ATOM 0 HE3 LYS A 88 -16.086 0.837 -8.140 1.00 0.55 H new ATOM 0 HZ1 LYS A 88 -16.985 0.053 -10.233 1.00 1.43 H new ATOM 0 HZ2 LYS A 88 -15.497 0.828 -10.495 1.00 1.43 H new ATOM 0 HZ3 LYS A 88 -15.589 -0.867 -10.532 1.00 1.43 H new ATOM 1498 N VAL A 89 -13.998 -0.956 -3.919 1.00 0.13 N ATOM 1499 CA VAL A 89 -14.792 -1.912 -3.167 1.00 0.15 C ATOM 1500 C VAL A 89 -16.192 -2.040 -3.762 1.00 0.17 C ATOM 1501 O VAL A 89 -16.945 -1.067 -3.819 1.00 0.20 O ATOM 1502 CB VAL A 89 -14.893 -1.516 -1.678 1.00 0.18 C ATOM 1503 CG1 VAL A 89 -13.509 -1.259 -1.104 1.00 0.18 C ATOM 1504 CG2 VAL A 89 -15.782 -0.297 -1.493 1.00 0.21 C ATOM 0 H VAL A 89 -14.479 -0.081 -4.126 1.00 0.13 H new ATOM 0 HA VAL A 89 -14.287 -2.875 -3.233 1.00 0.15 H new ATOM 0 HB VAL A 89 -15.347 -2.346 -1.138 1.00 0.18 H new ATOM 0 HG11 VAL A 89 -13.597 -0.981 -0.054 1.00 0.18 H new ATOM 0 HG12 VAL A 89 -12.905 -2.163 -1.191 1.00 0.18 H new ATOM 0 HG13 VAL A 89 -13.031 -0.449 -1.655 1.00 0.18 H new ATOM 0 HG21 VAL A 89 -15.834 -0.042 -0.435 1.00 0.21 H new ATOM 0 HG22 VAL A 89 -15.367 0.544 -2.049 1.00 0.21 H new ATOM 0 HG23 VAL A 89 -16.783 -0.517 -1.863 1.00 0.21 H new ATOM 1514 N SER A 90 -16.533 -3.240 -4.216 1.00 0.20 N ATOM 1515 CA SER A 90 -17.842 -3.484 -4.806 1.00 0.24 C ATOM 1516 C SER A 90 -18.816 -4.019 -3.763 1.00 0.23 C ATOM 1517 O SER A 90 -19.136 -5.206 -3.753 1.00 0.22 O ATOM 1518 CB SER A 90 -17.727 -4.470 -5.968 1.00 0.27 C ATOM 1519 OG SER A 90 -16.817 -4.000 -6.948 1.00 1.15 O ATOM 0 H SER A 90 -15.923 -4.057 -4.187 1.00 0.20 H new ATOM 0 HA SER A 90 -18.225 -2.536 -5.183 1.00 0.24 H new ATOM 0 HB2 SER A 90 -17.396 -5.439 -5.595 1.00 0.27 H new ATOM 0 HB3 SER A 90 -18.707 -4.620 -6.420 1.00 0.27 H new ATOM 0 HG SER A 90 -16.394 -4.763 -7.394 1.00 1.15 H new ATOM 1525 N LYS A 91 -19.283 -3.136 -2.889 1.00 0.28 N ATOM 1526 CA LYS A 91 -20.219 -3.523 -1.841 1.00 0.31 C ATOM 1527 C LYS A 91 -21.417 -4.255 -2.434 1.00 0.33 C ATOM 1528 O LYS A 91 -22.025 -5.106 -1.784 1.00 0.35 O ATOM 1529 CB LYS A 91 -20.693 -2.291 -1.069 1.00 0.41 C ATOM 1530 CG LYS A 91 -21.111 -2.592 0.361 1.00 0.80 C ATOM 1531 CD LYS A 91 -19.925 -3.032 1.203 1.00 1.43 C ATOM 1532 CE LYS A 91 -20.336 -3.333 2.635 1.00 1.61 C ATOM 1533 NZ LYS A 91 -21.318 -4.450 2.710 1.00 1.86 N ATOM 0 H LYS A 91 -19.029 -2.148 -2.885 1.00 0.28 H new ATOM 0 HA LYS A 91 -19.703 -4.195 -1.155 1.00 0.31 H new ATOM 0 HB2 LYS A 91 -19.893 -1.551 -1.057 1.00 0.41 H new ATOM 0 HB3 LYS A 91 -21.534 -1.843 -1.598 1.00 0.41 H new ATOM 0 HG2 LYS A 91 -21.565 -1.705 0.804 1.00 0.80 H new ATOM 0 HG3 LYS A 91 -21.871 -3.374 0.363 1.00 0.80 H new ATOM 0 HD2 LYS A 91 -19.473 -3.919 0.760 1.00 1.43 H new ATOM 0 HD3 LYS A 91 -19.165 -2.251 1.199 1.00 1.43 H new ATOM 0 HE2 LYS A 91 -19.452 -3.587 3.220 1.00 1.61 H new ATOM 0 HE3 LYS A 91 -20.769 -2.439 3.084 1.00 1.61 H new ATOM 0 HZ1 LYS A 91 -21.406 -4.770 3.696 1.00 1.86 H new ATOM 0 HZ2 LYS A 91 -22.244 -4.122 2.369 1.00 1.86 H new ATOM 0 HZ3 LYS A 91 -20.991 -5.240 2.118 1.00 1.86 H new ATOM 1547 N GLU A 92 -21.748 -3.918 -3.676 1.00 0.36 N ATOM 1548 CA GLU A 92 -22.869 -4.542 -4.366 1.00 0.41 C ATOM 1549 C GLU A 92 -22.679 -6.049 -4.431 1.00 0.35 C ATOM 1550 O GLU A 92 -23.642 -6.816 -4.385 1.00 0.39 O ATOM 1551 CB GLU A 92 -23.000 -3.977 -5.779 1.00 0.49 C ATOM 1552 CG GLU A 92 -23.311 -2.491 -5.815 1.00 0.57 C ATOM 1553 CD GLU A 92 -23.398 -1.947 -7.227 1.00 1.27 C ATOM 1554 OE1 GLU A 92 -24.465 -2.097 -7.859 1.00 1.29 O ATOM 1555 OE2 GLU A 92 -22.396 -1.368 -7.702 1.00 2.09 O ATOM 0 H GLU A 92 -21.254 -3.215 -4.226 1.00 0.36 H new ATOM 0 HA GLU A 92 -23.780 -4.325 -3.809 1.00 0.41 H new ATOM 0 HB2 GLU A 92 -22.072 -4.158 -6.321 1.00 0.49 H new ATOM 0 HB3 GLU A 92 -23.787 -4.517 -6.305 1.00 0.49 H new ATOM 0 HG2 GLU A 92 -24.255 -2.309 -5.301 1.00 0.57 H new ATOM 0 HG3 GLU A 92 -22.540 -1.949 -5.268 1.00 0.57 H new ATOM 1562 N ALA A 93 -21.424 -6.462 -4.537 1.00 0.30 N ATOM 1563 CA ALA A 93 -21.081 -7.874 -4.609 1.00 0.30 C ATOM 1564 C ALA A 93 -20.219 -8.302 -3.423 1.00 0.26 C ATOM 1565 O ALA A 93 -19.918 -9.485 -3.262 1.00 0.34 O ATOM 1566 CB ALA A 93 -20.364 -8.163 -5.916 1.00 0.36 C ATOM 0 H ALA A 93 -20.622 -5.834 -4.575 1.00 0.30 H new ATOM 0 HA ALA A 93 -22.005 -8.451 -4.569 1.00 0.30 H new ATOM 0 HB1 ALA A 93 -20.109 -9.222 -5.965 1.00 0.36 H new ATOM 0 HB2 ALA A 93 -21.015 -7.907 -6.752 1.00 0.36 H new ATOM 0 HB3 ALA A 93 -19.453 -7.568 -5.970 1.00 0.36 H new ATOM 1572 N ASN A 94 -19.820 -7.337 -2.594 1.00 0.18 N ATOM 1573 CA ASN A 94 -18.993 -7.617 -1.431 1.00 0.18 C ATOM 1574 C ASN A 94 -17.571 -7.953 -1.851 1.00 0.19 C ATOM 1575 O ASN A 94 -16.875 -8.704 -1.173 1.00 0.33 O ATOM 1576 CB ASN A 94 -19.587 -8.767 -0.617 1.00 0.24 C ATOM 1577 CG ASN A 94 -21.077 -8.604 -0.390 1.00 0.21 C ATOM 1578 OD1 ASN A 94 -21.892 -9.077 -1.182 1.00 0.53 O ATOM 1579 ND2 ASN A 94 -21.440 -7.931 0.694 1.00 0.44 N ATOM 0 H ASN A 94 -20.060 -6.353 -2.711 1.00 0.18 H new ATOM 0 HA ASN A 94 -18.968 -6.723 -0.808 1.00 0.18 H new ATOM 0 HB2 ASN A 94 -19.402 -9.708 -1.134 1.00 0.24 H new ATOM 0 HB3 ASN A 94 -19.080 -8.827 0.346 1.00 0.24 H new ATOM 0 HD21 ASN A 94 -22.429 -7.788 0.898 1.00 0.44 H new ATOM 0 HD22 ASN A 94 -20.730 -7.556 1.323 1.00 0.44 H new ATOM 1586 N ARG A 95 -17.144 -7.391 -2.975 1.00 0.15 N ATOM 1587 CA ARG A 95 -15.799 -7.630 -3.482 1.00 0.15 C ATOM 1588 C ARG A 95 -14.895 -6.442 -3.191 1.00 0.13 C ATOM 1589 O ARG A 95 -15.367 -5.356 -2.855 1.00 0.15 O ATOM 1590 CB ARG A 95 -15.835 -7.904 -4.984 1.00 0.18 C ATOM 1591 CG ARG A 95 -16.915 -8.888 -5.388 1.00 0.26 C ATOM 1592 CD ARG A 95 -16.951 -9.086 -6.892 1.00 0.30 C ATOM 1593 NE ARG A 95 -17.079 -7.818 -7.609 1.00 1.01 N ATOM 1594 CZ ARG A 95 -17.092 -7.720 -8.934 1.00 1.19 C ATOM 1595 NH1 ARG A 95 -16.999 -8.810 -9.683 1.00 0.65 N ATOM 1596 NH2 ARG A 95 -17.202 -6.531 -9.510 1.00 1.98 N ATOM 0 H ARG A 95 -17.709 -6.768 -3.552 1.00 0.15 H new ATOM 0 HA ARG A 95 -15.396 -8.506 -2.974 1.00 0.15 H new ATOM 0 HB2 ARG A 95 -15.992 -6.965 -5.514 1.00 0.18 H new ATOM 0 HB3 ARG A 95 -14.865 -8.289 -5.299 1.00 0.18 H new ATOM 0 HG2 ARG A 95 -16.738 -9.845 -4.898 1.00 0.26 H new ATOM 0 HG3 ARG A 95 -17.884 -8.528 -5.044 1.00 0.26 H new ATOM 0 HD2 ARG A 95 -16.041 -9.593 -7.213 1.00 0.30 H new ATOM 0 HD3 ARG A 95 -17.787 -9.735 -7.152 1.00 0.30 H new ATOM 0 HE ARG A 95 -17.163 -6.961 -7.062 1.00 1.01 H new ATOM 0 HH11 ARG A 95 -16.917 -9.726 -9.242 1.00 0.65 H new ATOM 0 HH12 ARG A 95 -17.009 -8.732 -10.700 1.00 0.65 H new ATOM 0 HH21 ARG A 95 -17.277 -5.691 -8.936 1.00 1.98 H new ATOM 0 HH22 ARG A 95 -17.212 -6.456 -10.527 1.00 1.98 H new ATOM 1610 N TYR A 96 -13.593 -6.655 -3.319 1.00 0.11 N ATOM 1611 CA TYR A 96 -12.623 -5.604 -3.060 1.00 0.10 C ATOM 1612 C TYR A 96 -11.477 -5.646 -4.057 1.00 0.08 C ATOM 1613 O TYR A 96 -10.789 -6.659 -4.187 1.00 0.09 O ATOM 1614 CB TYR A 96 -12.085 -5.747 -1.642 1.00 0.11 C ATOM 1615 CG TYR A 96 -13.156 -5.599 -0.593 1.00 0.11 C ATOM 1616 CD1 TYR A 96 -14.046 -6.633 -0.333 1.00 0.10 C ATOM 1617 CD2 TYR A 96 -13.288 -4.420 0.122 1.00 0.14 C ATOM 1618 CE1 TYR A 96 -15.039 -6.494 0.616 1.00 0.12 C ATOM 1619 CE2 TYR A 96 -14.279 -4.271 1.071 1.00 0.16 C ATOM 1620 CZ TYR A 96 -15.152 -5.311 1.315 1.00 0.13 C ATOM 1621 OH TYR A 96 -16.143 -5.167 2.257 1.00 0.17 O ATOM 0 H TYR A 96 -13.185 -7.547 -3.601 1.00 0.11 H new ATOM 0 HA TYR A 96 -13.124 -4.642 -3.170 1.00 0.10 H new ATOM 0 HB2 TYR A 96 -11.611 -6.722 -1.535 1.00 0.11 H new ATOM 0 HB3 TYR A 96 -11.312 -4.997 -1.474 1.00 0.11 H new ATOM 0 HD1 TYR A 96 -13.960 -7.559 -0.881 1.00 0.10 H new ATOM 0 HD2 TYR A 96 -12.605 -3.605 -0.066 1.00 0.14 H new ATOM 0 HE1 TYR A 96 -15.723 -7.307 0.810 1.00 0.12 H new ATOM 0 HE2 TYR A 96 -14.371 -3.345 1.620 1.00 0.16 H new ATOM 0 HH TYR A 96 -16.239 -6.002 2.762 1.00 0.17 H new ATOM 1631 N LEU A 97 -11.274 -4.539 -4.759 1.00 0.08 N ATOM 1632 CA LEU A 97 -10.205 -4.449 -5.739 1.00 0.07 C ATOM 1633 C LEU A 97 -8.921 -3.978 -5.078 1.00 0.07 C ATOM 1634 O LEU A 97 -8.814 -2.829 -4.654 1.00 0.08 O ATOM 1635 CB LEU A 97 -10.582 -3.486 -6.859 1.00 0.09 C ATOM 1636 CG LEU A 97 -9.547 -3.362 -7.976 1.00 0.10 C ATOM 1637 CD1 LEU A 97 -9.398 -4.680 -8.721 1.00 0.15 C ATOM 1638 CD2 LEU A 97 -9.930 -2.242 -8.931 1.00 0.13 C ATOM 0 H LEU A 97 -11.836 -3.693 -4.667 1.00 0.08 H new ATOM 0 HA LEU A 97 -10.050 -5.442 -6.162 1.00 0.07 H new ATOM 0 HB2 LEU A 97 -11.528 -3.810 -7.294 1.00 0.09 H new ATOM 0 HB3 LEU A 97 -10.751 -2.499 -6.428 1.00 0.09 H new ATOM 0 HG LEU A 97 -8.584 -3.117 -7.528 1.00 0.10 H new ATOM 0 HD11 LEU A 97 -8.656 -4.569 -9.512 1.00 0.15 H new ATOM 0 HD12 LEU A 97 -9.075 -5.456 -8.027 1.00 0.15 H new ATOM 0 HD13 LEU A 97 -10.356 -4.961 -9.159 1.00 0.15 H new ATOM 0 HD21 LEU A 97 -9.183 -2.166 -9.721 1.00 0.13 H new ATOM 0 HD22 LEU A 97 -10.904 -2.457 -9.372 1.00 0.13 H new ATOM 0 HD23 LEU A 97 -9.978 -1.299 -8.386 1.00 0.13 H new ATOM 1650 N ILE A 98 -7.945 -4.869 -5.002 1.00 0.08 N ATOM 1651 CA ILE A 98 -6.670 -4.544 -4.390 1.00 0.09 C ATOM 1652 C ILE A 98 -5.526 -4.818 -5.346 1.00 0.09 C ATOM 1653 O ILE A 98 -5.670 -5.589 -6.291 1.00 0.10 O ATOM 1654 CB ILE A 98 -6.446 -5.359 -3.108 1.00 0.09 C ATOM 1655 CG1 ILE A 98 -6.400 -6.854 -3.428 1.00 0.09 C ATOM 1656 CG2 ILE A 98 -7.535 -5.063 -2.092 1.00 0.09 C ATOM 1657 CD1 ILE A 98 -5.041 -7.339 -3.886 1.00 0.11 C ATOM 0 H ILE A 98 -8.013 -5.823 -5.357 1.00 0.08 H new ATOM 0 HA ILE A 98 -6.695 -3.483 -4.143 1.00 0.09 H new ATOM 0 HB ILE A 98 -5.488 -5.069 -2.677 1.00 0.09 H new ATOM 0 HG12 ILE A 98 -6.696 -7.415 -2.542 1.00 0.09 H new ATOM 0 HG13 ILE A 98 -7.134 -7.073 -4.204 1.00 0.09 H new ATOM 0 HG21 ILE A 98 -7.360 -5.649 -1.190 1.00 0.09 H new ATOM 0 HG22 ILE A 98 -7.522 -4.002 -1.843 1.00 0.09 H new ATOM 0 HG23 ILE A 98 -8.506 -5.325 -2.512 1.00 0.09 H new ATOM 0 HD11 ILE A 98 -5.087 -8.408 -4.094 1.00 0.11 H new ATOM 0 HD12 ILE A 98 -4.750 -6.806 -4.791 1.00 0.11 H new ATOM 0 HD13 ILE A 98 -4.306 -7.153 -3.103 1.00 0.11 H new ATOM 1669 N PHE A 99 -4.392 -4.183 -5.104 1.00 0.10 N ATOM 1670 CA PHE A 99 -3.230 -4.389 -5.949 1.00 0.11 C ATOM 1671 C PHE A 99 -2.272 -5.368 -5.289 1.00 0.12 C ATOM 1672 O PHE A 99 -1.734 -5.094 -4.220 1.00 0.14 O ATOM 1673 CB PHE A 99 -2.521 -3.070 -6.239 1.00 0.12 C ATOM 1674 CG PHE A 99 -1.503 -3.189 -7.333 1.00 0.12 C ATOM 1675 CD1 PHE A 99 -1.878 -3.068 -8.662 1.00 0.16 C ATOM 1676 CD2 PHE A 99 -0.173 -3.432 -7.034 1.00 0.12 C ATOM 1677 CE1 PHE A 99 -0.944 -3.186 -9.671 1.00 0.18 C ATOM 1678 CE2 PHE A 99 0.765 -3.552 -8.039 1.00 0.13 C ATOM 1679 CZ PHE A 99 0.380 -3.429 -9.360 1.00 0.15 C ATOM 0 H PHE A 99 -4.252 -3.526 -4.336 1.00 0.10 H new ATOM 0 HA PHE A 99 -3.568 -4.806 -6.898 1.00 0.11 H new ATOM 0 HB2 PHE A 99 -3.260 -2.318 -6.516 1.00 0.12 H new ATOM 0 HB3 PHE A 99 -2.033 -2.717 -5.331 1.00 0.12 H new ATOM 0 HD1 PHE A 99 -2.912 -2.879 -8.910 1.00 0.16 H new ATOM 0 HD2 PHE A 99 0.134 -3.529 -6.003 1.00 0.12 H new ATOM 0 HE1 PHE A 99 -1.248 -3.088 -10.703 1.00 0.18 H new ATOM 0 HE2 PHE A 99 1.799 -3.742 -7.793 1.00 0.13 H new ATOM 0 HZ PHE A 99 1.113 -3.523 -10.148 1.00 0.15 H new ATOM 1689 N ASP A 100 -2.070 -6.513 -5.928 1.00 0.17 N ATOM 1690 CA ASP A 100 -1.180 -7.536 -5.394 1.00 0.20 C ATOM 1691 C ASP A 100 0.272 -7.067 -5.417 1.00 0.15 C ATOM 1692 O ASP A 100 0.861 -6.884 -6.483 1.00 0.14 O ATOM 1693 CB ASP A 100 -1.323 -8.831 -6.190 1.00 0.28 C ATOM 1694 CG ASP A 100 -0.798 -10.034 -5.432 1.00 0.32 C ATOM 1695 OD1 ASP A 100 0.431 -10.119 -5.230 1.00 0.17 O ATOM 1696 OD2 ASP A 100 -1.618 -10.888 -5.035 1.00 0.58 O ATOM 0 H ASP A 100 -2.510 -6.757 -6.816 1.00 0.17 H new ATOM 0 HA ASP A 100 -1.464 -7.721 -4.358 1.00 0.20 H new ATOM 0 HB2 ASP A 100 -2.373 -8.989 -6.436 1.00 0.28 H new ATOM 0 HB3 ASP A 100 -0.785 -8.736 -7.133 1.00 0.28 H new ATOM 1701 N LEU A 101 0.839 -6.874 -4.232 1.00 0.14 N ATOM 1702 CA LEU A 101 2.220 -6.426 -4.103 1.00 0.12 C ATOM 1703 C LEU A 101 3.201 -7.551 -4.427 1.00 0.13 C ATOM 1704 O LEU A 101 4.366 -7.300 -4.736 1.00 0.16 O ATOM 1705 CB LEU A 101 2.460 -5.894 -2.685 1.00 0.14 C ATOM 1706 CG LEU A 101 1.883 -4.500 -2.403 1.00 0.11 C ATOM 1707 CD1 LEU A 101 0.553 -4.306 -3.110 1.00 0.10 C ATOM 1708 CD2 LEU A 101 1.712 -4.286 -0.909 1.00 0.11 C ATOM 0 H LEU A 101 0.361 -7.022 -3.343 1.00 0.14 H new ATOM 0 HA LEU A 101 2.391 -5.624 -4.821 1.00 0.12 H new ATOM 0 HB2 LEU A 101 2.030 -6.598 -1.973 1.00 0.14 H new ATOM 0 HB3 LEU A 101 3.534 -5.869 -2.501 1.00 0.14 H new ATOM 0 HG LEU A 101 2.588 -3.763 -2.788 1.00 0.11 H new ATOM 0 HD11 LEU A 101 0.167 -3.310 -2.893 1.00 0.10 H new ATOM 0 HD12 LEU A 101 0.694 -4.414 -4.185 1.00 0.10 H new ATOM 0 HD13 LEU A 101 -0.158 -5.055 -2.760 1.00 0.10 H new ATOM 0 HD21 LEU A 101 1.302 -3.292 -0.728 1.00 0.11 H new ATOM 0 HD22 LEU A 101 1.031 -5.038 -0.509 1.00 0.11 H new ATOM 0 HD23 LEU A 101 2.680 -4.374 -0.416 1.00 0.11 H new ATOM 1720 N GLU A 102 2.723 -8.788 -4.356 1.00 0.14 N ATOM 1721 CA GLU A 102 3.555 -9.950 -4.646 1.00 0.16 C ATOM 1722 C GLU A 102 3.639 -10.189 -6.149 1.00 0.16 C ATOM 1723 O GLU A 102 4.724 -10.360 -6.704 1.00 0.20 O ATOM 1724 CB GLU A 102 2.982 -11.190 -3.965 1.00 0.17 C ATOM 1725 CG GLU A 102 2.851 -11.055 -2.462 1.00 0.21 C ATOM 1726 CD GLU A 102 2.171 -12.252 -1.826 1.00 0.23 C ATOM 1727 OE1 GLU A 102 2.866 -13.253 -1.551 1.00 0.32 O ATOM 1728 OE2 GLU A 102 0.945 -12.188 -1.603 1.00 0.29 O ATOM 0 H GLU A 102 1.762 -9.012 -4.100 1.00 0.14 H new ATOM 0 HA GLU A 102 4.557 -9.756 -4.262 1.00 0.16 H new ATOM 0 HB2 GLU A 102 2.001 -11.405 -4.388 1.00 0.17 H new ATOM 0 HB3 GLU A 102 3.620 -12.044 -4.190 1.00 0.17 H new ATOM 0 HG2 GLU A 102 3.841 -10.930 -2.025 1.00 0.21 H new ATOM 0 HG3 GLU A 102 2.284 -10.154 -2.230 1.00 0.21 H new ATOM 1735 N GLN A 103 2.479 -10.197 -6.797 1.00 0.15 N ATOM 1736 CA GLN A 103 2.404 -10.413 -8.234 1.00 0.16 C ATOM 1737 C GLN A 103 2.530 -9.099 -8.994 1.00 0.15 C ATOM 1738 O GLN A 103 2.827 -9.090 -10.189 1.00 0.17 O ATOM 1739 CB GLN A 103 1.087 -11.092 -8.606 1.00 0.17 C ATOM 1740 CG GLN A 103 0.986 -12.532 -8.133 1.00 0.23 C ATOM 1741 CD GLN A 103 1.047 -12.667 -6.626 1.00 0.56 C ATOM 1742 OE1 GLN A 103 2.128 -12.771 -6.045 1.00 1.11 O ATOM 1743 NE2 GLN A 103 -0.116 -12.685 -5.984 1.00 0.45 N ATOM 0 H GLN A 103 1.575 -10.056 -6.346 1.00 0.15 H new ATOM 0 HA GLN A 103 3.235 -11.060 -8.514 1.00 0.16 H new ATOM 0 HB2 GLN A 103 0.262 -10.521 -8.181 1.00 0.17 H new ATOM 0 HB3 GLN A 103 0.968 -11.066 -9.689 1.00 0.17 H new ATOM 0 HG2 GLN A 103 0.051 -12.962 -8.493 1.00 0.23 H new ATOM 0 HG3 GLN A 103 1.795 -13.112 -8.577 1.00 0.23 H new ATOM 0 HE21 GLN A 103 -0.988 -12.596 -6.506 1.00 0.45 H new ATOM 0 HE22 GLN A 103 -0.137 -12.788 -4.969 1.00 0.45 H new ATOM 1752 N ARG A 104 2.299 -7.988 -8.296 1.00 0.15 N ATOM 1753 CA ARG A 104 2.384 -6.669 -8.906 1.00 0.15 C ATOM 1754 C ARG A 104 1.225 -6.452 -9.867 1.00 0.16 C ATOM 1755 O ARG A 104 1.361 -5.763 -10.877 1.00 0.20 O ATOM 1756 CB ARG A 104 3.716 -6.509 -9.639 1.00 0.16 C ATOM 1757 CG ARG A 104 4.918 -6.885 -8.788 1.00 0.17 C ATOM 1758 CD ARG A 104 6.221 -6.586 -9.508 1.00 0.21 C ATOM 1759 NE ARG A 104 7.387 -7.042 -8.753 1.00 0.79 N ATOM 1760 CZ ARG A 104 8.638 -6.899 -9.175 1.00 0.98 C ATOM 1761 NH1 ARG A 104 8.887 -6.309 -10.337 1.00 0.64 N ATOM 1762 NH2 ARG A 104 9.644 -7.343 -8.435 1.00 1.67 N ATOM 0 H ARG A 104 2.051 -7.979 -7.307 1.00 0.15 H new ATOM 0 HA ARG A 104 2.326 -5.919 -8.118 1.00 0.15 H new ATOM 0 HB2 ARG A 104 3.706 -7.128 -10.536 1.00 0.16 H new ATOM 0 HB3 ARG A 104 3.821 -5.475 -9.967 1.00 0.16 H new ATOM 0 HG2 ARG A 104 4.886 -6.336 -7.847 1.00 0.17 H new ATOM 0 HG3 ARG A 104 4.873 -7.945 -8.540 1.00 0.17 H new ATOM 0 HD2 ARG A 104 6.212 -7.068 -10.486 1.00 0.21 H new ATOM 0 HD3 ARG A 104 6.300 -5.513 -9.682 1.00 0.21 H new ATOM 0 HE ARG A 104 7.231 -7.495 -7.852 1.00 0.79 H new ATOM 0 HH11 ARG A 104 8.116 -5.964 -10.909 1.00 0.64 H new ATOM 0 HH12 ARG A 104 9.849 -6.201 -10.658 1.00 0.64 H new ATOM 0 HH21 ARG A 104 9.458 -7.795 -7.540 1.00 1.67 H new ATOM 0 HH22 ARG A 104 10.604 -7.232 -8.761 1.00 1.67 H new ATOM 1776 N ASN A 105 0.082 -7.044 -9.540 1.00 0.14 N ATOM 1777 CA ASN A 105 -1.103 -6.925 -10.374 1.00 0.16 C ATOM 1778 C ASN A 105 -2.353 -6.735 -9.523 1.00 0.13 C ATOM 1779 O ASN A 105 -2.386 -7.134 -8.359 1.00 0.15 O ATOM 1780 CB ASN A 105 -1.260 -8.170 -11.244 1.00 0.22 C ATOM 1781 CG ASN A 105 -1.459 -9.425 -10.417 1.00 0.42 C ATOM 1782 OD1 ASN A 105 -1.958 -9.370 -9.293 1.00 1.23 O ATOM 1783 ND2 ASN A 105 -1.073 -10.569 -10.971 1.00 0.45 N ATOM 0 H ASN A 105 -0.047 -7.611 -8.702 1.00 0.14 H new ATOM 0 HA ASN A 105 -0.981 -6.049 -11.011 1.00 0.16 H new ATOM 0 HB2 ASN A 105 -2.111 -8.039 -11.913 1.00 0.22 H new ATOM 0 HB3 ASN A 105 -0.376 -8.287 -11.871 1.00 0.22 H new ATOM 0 HD21 ASN A 105 -1.186 -11.446 -10.462 1.00 0.45 H new ATOM 0 HD22 ASN A 105 -0.664 -10.571 -11.905 1.00 0.45 H new ATOM 1790 N PRO A 106 -3.403 -6.125 -10.096 1.00 0.14 N ATOM 1791 CA PRO A 106 -4.662 -5.894 -9.391 1.00 0.13 C ATOM 1792 C PRO A 106 -5.401 -7.194 -9.115 1.00 0.15 C ATOM 1793 O PRO A 106 -5.161 -8.209 -9.770 1.00 0.21 O ATOM 1794 CB PRO A 106 -5.473 -5.013 -10.348 1.00 0.15 C ATOM 1795 CG PRO A 106 -4.504 -4.547 -11.379 1.00 0.20 C ATOM 1796 CD PRO A 106 -3.452 -5.612 -11.470 1.00 0.22 C ATOM 0 HA PRO A 106 -4.500 -5.433 -8.417 1.00 0.13 H new ATOM 0 HB2 PRO A 106 -6.289 -5.575 -10.802 1.00 0.15 H new ATOM 0 HB3 PRO A 106 -5.921 -4.170 -9.821 1.00 0.15 H new ATOM 0 HG2 PRO A 106 -4.997 -4.402 -12.340 1.00 0.20 H new ATOM 0 HG3 PRO A 106 -4.066 -3.589 -11.098 1.00 0.20 H new ATOM 0 HD2 PRO A 106 -3.722 -6.390 -12.185 1.00 0.22 H new ATOM 0 HD3 PRO A 106 -2.491 -5.207 -11.787 1.00 0.22 H new ATOM 1804 N ARG A 107 -6.299 -7.156 -8.144 1.00 0.11 N ATOM 1805 CA ARG A 107 -7.071 -8.331 -7.773 1.00 0.13 C ATOM 1806 C ARG A 107 -8.374 -7.939 -7.098 1.00 0.11 C ATOM 1807 O ARG A 107 -8.469 -6.888 -6.469 1.00 0.11 O ATOM 1808 CB ARG A 107 -6.258 -9.226 -6.840 1.00 0.16 C ATOM 1809 CG ARG A 107 -5.179 -10.022 -7.553 1.00 0.18 C ATOM 1810 CD ARG A 107 -4.419 -10.920 -6.589 1.00 0.27 C ATOM 1811 NE ARG A 107 -5.299 -11.848 -5.881 1.00 0.35 N ATOM 1812 CZ ARG A 107 -4.858 -12.877 -5.165 1.00 0.98 C ATOM 1813 NH1 ARG A 107 -3.556 -13.102 -5.058 1.00 1.70 N ATOM 1814 NH2 ARG A 107 -5.718 -13.681 -4.554 1.00 1.02 N ATOM 0 H ARG A 107 -6.512 -6.322 -7.597 1.00 0.11 H new ATOM 0 HA ARG A 107 -7.305 -8.879 -8.686 1.00 0.13 H new ATOM 0 HB2 ARG A 107 -5.795 -8.609 -6.070 1.00 0.16 H new ATOM 0 HB3 ARG A 107 -6.932 -9.916 -6.333 1.00 0.16 H new ATOM 0 HG2 ARG A 107 -5.632 -10.629 -8.337 1.00 0.18 H new ATOM 0 HG3 ARG A 107 -4.484 -9.339 -8.040 1.00 0.18 H new ATOM 0 HD2 ARG A 107 -3.667 -11.485 -7.139 1.00 0.27 H new ATOM 0 HD3 ARG A 107 -3.887 -10.303 -5.864 1.00 0.27 H new ATOM 0 HE ARG A 107 -6.306 -11.698 -5.940 1.00 0.35 H new ATOM 0 HH11 ARG A 107 -2.892 -12.485 -5.525 1.00 1.70 H new ATOM 0 HH12 ARG A 107 -3.218 -13.892 -4.508 1.00 1.70 H new ATOM 0 HH21 ARG A 107 -6.720 -13.510 -4.633 1.00 1.02 H new ATOM 0 HH22 ARG A 107 -5.377 -14.470 -4.005 1.00 1.02 H new ATOM 1828 N VAL A 108 -9.371 -8.796 -7.235 1.00 0.13 N ATOM 1829 CA VAL A 108 -10.674 -8.558 -6.636 1.00 0.12 C ATOM 1830 C VAL A 108 -10.979 -9.628 -5.597 1.00 0.12 C ATOM 1831 O VAL A 108 -11.318 -10.761 -5.938 1.00 0.15 O ATOM 1832 CB VAL A 108 -11.790 -8.547 -7.698 1.00 0.14 C ATOM 1833 CG1 VAL A 108 -13.151 -8.342 -7.047 1.00 0.66 C ATOM 1834 CG2 VAL A 108 -11.522 -7.472 -8.739 1.00 0.61 C ATOM 0 H VAL A 108 -9.303 -9.668 -7.759 1.00 0.13 H new ATOM 0 HA VAL A 108 -10.642 -7.579 -6.159 1.00 0.12 H new ATOM 0 HB VAL A 108 -11.798 -9.515 -8.199 1.00 0.14 H new ATOM 0 HG11 VAL A 108 -13.925 -8.337 -7.815 1.00 0.66 H new ATOM 0 HG12 VAL A 108 -13.343 -9.152 -6.343 1.00 0.66 H new ATOM 0 HG13 VAL A 108 -13.161 -7.390 -6.516 1.00 0.66 H new ATOM 0 HG21 VAL A 108 -12.320 -7.478 -9.482 1.00 0.61 H new ATOM 0 HG22 VAL A 108 -11.485 -6.497 -8.254 1.00 0.61 H new ATOM 0 HG23 VAL A 108 -10.569 -7.670 -9.229 1.00 0.61 H new ATOM 1844 N LEU A 109 -10.856 -9.262 -4.328 1.00 0.12 N ATOM 1845 CA LEU A 109 -11.108 -10.199 -3.243 1.00 0.12 C ATOM 1846 C LEU A 109 -12.553 -10.141 -2.790 1.00 0.12 C ATOM 1847 O LEU A 109 -13.229 -9.123 -2.940 1.00 0.17 O ATOM 1848 CB LEU A 109 -10.203 -9.896 -2.051 1.00 0.11 C ATOM 1849 CG LEU A 109 -8.715 -10.153 -2.276 1.00 0.12 C ATOM 1850 CD1 LEU A 109 -8.153 -9.178 -3.298 1.00 0.12 C ATOM 1851 CD2 LEU A 109 -7.961 -10.050 -0.959 1.00 0.14 C ATOM 0 H LEU A 109 -10.584 -8.326 -4.026 1.00 0.12 H new ATOM 0 HA LEU A 109 -10.895 -11.198 -3.622 1.00 0.12 H new ATOM 0 HB2 LEU A 109 -10.336 -8.851 -1.772 1.00 0.11 H new ATOM 0 HB3 LEU A 109 -10.534 -10.496 -1.203 1.00 0.11 H new ATOM 0 HG LEU A 109 -8.589 -11.162 -2.668 1.00 0.12 H new ATOM 0 HD11 LEU A 109 -7.091 -9.377 -3.445 1.00 0.12 H new ATOM 0 HD12 LEU A 109 -8.679 -9.300 -4.245 1.00 0.12 H new ATOM 0 HD13 LEU A 109 -8.285 -8.158 -2.938 1.00 0.12 H new ATOM 0 HD21 LEU A 109 -6.901 -10.235 -1.131 1.00 0.14 H new ATOM 0 HD22 LEU A 109 -8.092 -9.052 -0.542 1.00 0.14 H new ATOM 0 HD23 LEU A 109 -8.349 -10.790 -0.259 1.00 0.14 H new ATOM 1863 N GLU A 110 -13.019 -11.246 -2.236 1.00 0.13 N ATOM 1864 CA GLU A 110 -14.372 -11.325 -1.730 1.00 0.13 C ATOM 1865 C GLU A 110 -14.385 -10.849 -0.289 1.00 0.12 C ATOM 1866 O GLU A 110 -13.381 -10.972 0.412 1.00 0.12 O ATOM 1867 CB GLU A 110 -14.894 -12.757 -1.821 1.00 0.15 C ATOM 1868 CG GLU A 110 -14.500 -13.456 -3.109 1.00 0.19 C ATOM 1869 CD GLU A 110 -15.024 -14.876 -3.188 1.00 0.26 C ATOM 1870 OE1 GLU A 110 -16.194 -15.055 -3.586 1.00 0.33 O ATOM 1871 OE2 GLU A 110 -14.265 -15.809 -2.853 1.00 0.34 O ATOM 0 H GLU A 110 -12.476 -12.102 -2.126 1.00 0.13 H new ATOM 0 HA GLU A 110 -15.023 -10.691 -2.331 1.00 0.13 H new ATOM 0 HB2 GLU A 110 -14.516 -13.329 -0.974 1.00 0.15 H new ATOM 0 HB3 GLU A 110 -15.981 -12.747 -1.739 1.00 0.15 H new ATOM 0 HG2 GLU A 110 -14.878 -12.886 -3.957 1.00 0.19 H new ATOM 0 HG3 GLU A 110 -13.413 -13.469 -3.193 1.00 0.19 H new ATOM 1878 N GLN A 111 -15.507 -10.317 0.163 1.00 0.13 N ATOM 1879 CA GLN A 111 -15.599 -9.817 1.527 1.00 0.13 C ATOM 1880 C GLN A 111 -15.034 -10.825 2.516 1.00 0.12 C ATOM 1881 O GLN A 111 -14.283 -10.469 3.419 1.00 0.13 O ATOM 1882 CB GLN A 111 -17.041 -9.487 1.884 1.00 0.14 C ATOM 1883 CG GLN A 111 -17.200 -9.034 3.316 1.00 0.16 C ATOM 1884 CD GLN A 111 -18.572 -8.469 3.609 1.00 0.17 C ATOM 1885 OE1 GLN A 111 -19.570 -8.890 3.022 1.00 0.36 O ATOM 1886 NE2 GLN A 111 -18.624 -7.505 4.515 1.00 0.31 N ATOM 0 H GLN A 111 -16.361 -10.220 -0.387 1.00 0.13 H new ATOM 0 HA GLN A 111 -15.006 -8.904 1.587 1.00 0.13 H new ATOM 0 HB2 GLN A 111 -17.406 -8.705 1.218 1.00 0.14 H new ATOM 0 HB3 GLN A 111 -17.663 -10.366 1.715 1.00 0.14 H new ATOM 0 HG2 GLN A 111 -17.011 -9.877 3.981 1.00 0.16 H new ATOM 0 HG3 GLN A 111 -16.447 -8.278 3.538 1.00 0.16 H new ATOM 0 HE21 GLN A 111 -17.769 -7.190 4.974 1.00 0.31 H new ATOM 0 HE22 GLN A 111 -19.519 -7.077 4.754 1.00 0.31 H new ATOM 1895 N SER A 112 -15.391 -12.085 2.335 1.00 0.13 N ATOM 1896 CA SER A 112 -14.890 -13.130 3.208 1.00 0.14 C ATOM 1897 C SER A 112 -13.369 -13.142 3.166 1.00 0.14 C ATOM 1898 O SER A 112 -12.708 -13.381 4.177 1.00 0.16 O ATOM 1899 CB SER A 112 -15.440 -14.493 2.787 1.00 0.16 C ATOM 1900 OG SER A 112 -16.838 -14.567 2.998 1.00 0.95 O ATOM 0 H SER A 112 -16.020 -12.406 1.599 1.00 0.13 H new ATOM 0 HA SER A 112 -15.222 -12.928 4.227 1.00 0.14 H new ATOM 0 HB2 SER A 112 -15.218 -14.668 1.734 1.00 0.16 H new ATOM 0 HB3 SER A 112 -14.942 -15.280 3.353 1.00 0.16 H new ATOM 0 HG SER A 112 -17.165 -15.448 2.719 1.00 0.95 H new ATOM 1906 N GLU A 113 -12.824 -12.881 1.982 1.00 0.13 N ATOM 1907 CA GLU A 113 -11.383 -12.844 1.792 1.00 0.13 C ATOM 1908 C GLU A 113 -10.803 -11.563 2.369 1.00 0.14 C ATOM 1909 O GLU A 113 -9.842 -11.595 3.137 1.00 0.17 O ATOM 1910 CB GLU A 113 -11.044 -12.945 0.308 1.00 0.14 C ATOM 1911 CG GLU A 113 -11.436 -14.272 -0.311 1.00 0.18 C ATOM 1912 CD GLU A 113 -10.709 -15.446 0.316 1.00 0.25 C ATOM 1913 OE1 GLU A 113 -11.219 -15.993 1.317 1.00 0.30 O ATOM 1914 OE2 GLU A 113 -9.631 -15.818 -0.194 1.00 0.31 O ATOM 0 H GLU A 113 -13.364 -12.692 1.138 1.00 0.13 H new ATOM 0 HA GLU A 113 -10.945 -13.694 2.315 1.00 0.13 H new ATOM 0 HB2 GLU A 113 -11.547 -12.140 -0.228 1.00 0.14 H new ATOM 0 HB3 GLU A 113 -9.973 -12.794 0.177 1.00 0.14 H new ATOM 0 HG2 GLU A 113 -12.511 -14.416 -0.203 1.00 0.18 H new ATOM 0 HG3 GLU A 113 -11.224 -14.247 -1.380 1.00 0.18 H new ATOM 1921 N PHE A 114 -11.394 -10.435 1.991 1.00 0.11 N ATOM 1922 CA PHE A 114 -10.936 -9.145 2.474 1.00 0.12 C ATOM 1923 C PHE A 114 -11.076 -9.076 3.988 1.00 0.13 C ATOM 1924 O PHE A 114 -10.126 -8.747 4.695 1.00 0.19 O ATOM 1925 CB PHE A 114 -11.722 -8.013 1.813 1.00 0.12 C ATOM 1926 CG PHE A 114 -11.225 -6.653 2.200 1.00 0.12 C ATOM 1927 CD1 PHE A 114 -11.746 -5.998 3.304 1.00 0.14 C ATOM 1928 CD2 PHE A 114 -10.243 -6.025 1.454 1.00 0.12 C ATOM 1929 CE1 PHE A 114 -11.295 -4.741 3.656 1.00 0.15 C ATOM 1930 CE2 PHE A 114 -9.791 -4.767 1.800 1.00 0.13 C ATOM 1931 CZ PHE A 114 -10.290 -4.142 2.929 1.00 0.14 C ATOM 0 H PHE A 114 -12.189 -10.391 1.353 1.00 0.11 H new ATOM 0 HA PHE A 114 -9.884 -9.028 2.212 1.00 0.12 H new ATOM 0 HB2 PHE A 114 -11.663 -8.121 0.730 1.00 0.12 H new ATOM 0 HB3 PHE A 114 -12.774 -8.101 2.085 1.00 0.12 H new ATOM 0 HD1 PHE A 114 -12.513 -6.475 3.896 1.00 0.14 H new ATOM 0 HD2 PHE A 114 -9.826 -6.524 0.592 1.00 0.12 H new ATOM 0 HE1 PHE A 114 -11.730 -4.228 4.501 1.00 0.15 H new ATOM 0 HE2 PHE A 114 -9.049 -4.272 1.191 1.00 0.13 H new ATOM 0 HZ PHE A 114 -9.893 -3.187 3.239 1.00 0.14 H new ATOM 1941 N GLU A 115 -12.269 -9.390 4.478 1.00 0.12 N ATOM 1942 CA GLU A 115 -12.530 -9.389 5.911 1.00 0.14 C ATOM 1943 C GLU A 115 -11.521 -10.274 6.618 1.00 0.15 C ATOM 1944 O GLU A 115 -11.112 -10.007 7.748 1.00 0.18 O ATOM 1945 CB GLU A 115 -13.937 -9.911 6.199 1.00 0.14 C ATOM 1946 CG GLU A 115 -15.046 -8.966 5.784 1.00 0.14 C ATOM 1947 CD GLU A 115 -16.409 -9.420 6.271 1.00 0.41 C ATOM 1948 OE1 GLU A 115 -16.777 -10.585 6.008 1.00 0.60 O ATOM 1949 OE2 GLU A 115 -17.108 -8.611 6.916 1.00 0.66 O ATOM 0 H GLU A 115 -13.071 -9.649 3.903 1.00 0.12 H new ATOM 0 HA GLU A 115 -12.445 -8.365 6.275 1.00 0.14 H new ATOM 0 HB2 GLU A 115 -14.073 -10.862 5.683 1.00 0.14 H new ATOM 0 HB3 GLU A 115 -14.027 -10.112 7.267 1.00 0.14 H new ATOM 0 HG2 GLU A 115 -14.837 -7.971 6.176 1.00 0.14 H new ATOM 0 HG3 GLU A 115 -15.061 -8.884 4.697 1.00 0.14 H new ATOM 1956 N ALA A 116 -11.130 -11.333 5.928 1.00 0.13 N ATOM 1957 CA ALA A 116 -10.177 -12.292 6.457 1.00 0.15 C ATOM 1958 C ALA A 116 -8.750 -11.747 6.429 1.00 0.16 C ATOM 1959 O ALA A 116 -7.846 -12.334 7.023 1.00 0.21 O ATOM 1960 CB ALA A 116 -10.264 -13.583 5.663 1.00 0.17 C ATOM 0 H ALA A 116 -11.463 -11.551 4.989 1.00 0.13 H new ATOM 0 HA ALA A 116 -10.431 -12.484 7.500 1.00 0.15 H new ATOM 0 HB1 ALA A 116 -9.549 -14.303 6.060 1.00 0.17 H new ATOM 0 HB2 ALA A 116 -11.272 -13.991 5.742 1.00 0.17 H new ATOM 0 HB3 ALA A 116 -10.034 -13.383 4.616 1.00 0.17 H new ATOM 1966 N LEU A 117 -8.550 -10.627 5.740 1.00 0.16 N ATOM 1967 CA LEU A 117 -7.228 -10.027 5.640 1.00 0.18 C ATOM 1968 C LEU A 117 -7.178 -8.674 6.347 1.00 0.19 C ATOM 1969 O LEU A 117 -6.192 -8.342 7.003 1.00 0.28 O ATOM 1970 CB LEU A 117 -6.842 -9.866 4.169 1.00 0.19 C ATOM 1971 CG LEU A 117 -6.793 -11.172 3.375 1.00 0.19 C ATOM 1972 CD1 LEU A 117 -6.722 -10.892 1.883 1.00 0.22 C ATOM 1973 CD2 LEU A 117 -5.608 -12.015 3.815 1.00 0.23 C ATOM 0 H LEU A 117 -9.284 -10.120 5.246 1.00 0.16 H new ATOM 0 HA LEU A 117 -6.515 -10.689 6.132 1.00 0.18 H new ATOM 0 HB2 LEU A 117 -7.555 -9.193 3.692 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -5.865 -9.386 4.114 1.00 0.19 H new ATOM 0 HG LEU A 117 -7.709 -11.729 3.574 1.00 0.19 H new ATOM 0 HD11 LEU A 117 -6.688 -11.835 1.337 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -7.602 -10.327 1.577 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -5.825 -10.313 1.664 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -5.587 -12.941 3.241 1.00 0.23 H new ATOM 0 HD22 LEU A 117 -4.685 -11.461 3.645 1.00 0.23 H new ATOM 0 HD23 LEU A 117 -5.701 -12.248 4.876 1.00 0.23 H new ATOM 1985 N TYR A 118 -8.252 -7.904 6.218 1.00 0.14 N ATOM 1986 CA TYR A 118 -8.327 -6.584 6.832 1.00 0.14 C ATOM 1987 C TYR A 118 -8.132 -6.667 8.343 1.00 0.20 C ATOM 1988 O TYR A 118 -8.613 -7.595 8.992 1.00 0.28 O ATOM 1989 CB TYR A 118 -9.670 -5.928 6.517 1.00 0.14 C ATOM 1990 CG TYR A 118 -9.717 -4.458 6.861 1.00 0.17 C ATOM 1991 CD1 TYR A 118 -8.732 -3.585 6.419 1.00 0.22 C ATOM 1992 CD2 TYR A 118 -10.751 -3.946 7.630 1.00 0.19 C ATOM 1993 CE1 TYR A 118 -8.778 -2.241 6.735 1.00 0.27 C ATOM 1994 CE2 TYR A 118 -10.807 -2.605 7.951 1.00 0.23 C ATOM 1995 CZ TYR A 118 -9.788 -1.752 7.486 1.00 0.27 C ATOM 1996 OH TYR A 118 -9.872 -0.419 7.816 1.00 0.33 O ATOM 0 H TYR A 118 -9.084 -8.172 5.693 1.00 0.14 H new ATOM 0 HA TYR A 118 -7.524 -5.976 6.416 1.00 0.14 H new ATOM 0 HB2 TYR A 118 -9.886 -6.052 5.456 1.00 0.14 H new ATOM 0 HB3 TYR A 118 -10.456 -6.447 7.065 1.00 0.14 H new ATOM 0 HD1 TYR A 118 -7.917 -3.962 5.819 1.00 0.22 H new ATOM 0 HD2 TYR A 118 -11.527 -4.609 7.984 1.00 0.19 H new ATOM 0 HE1 TYR A 118 -8.003 -1.578 6.380 1.00 0.27 H new ATOM 0 HE2 TYR A 118 -11.618 -2.217 8.549 1.00 0.23 H new ATOM 0 HH TYR A 118 -10.262 -0.327 8.710 1.00 0.33 H new ATOM 2006 N GLN A 119 -7.424 -5.686 8.896 1.00 0.22 N ATOM 2007 CA GLN A 119 -7.167 -5.648 10.332 1.00 0.29 C ATOM 2008 C GLN A 119 -7.740 -4.383 10.973 1.00 0.26 C ATOM 2009 O GLN A 119 -7.367 -4.025 12.090 1.00 0.40 O ATOM 2010 CB GLN A 119 -5.664 -5.731 10.608 1.00 0.36 C ATOM 2011 CG GLN A 119 -4.998 -6.956 10.006 1.00 0.56 C ATOM 2012 CD GLN A 119 -3.551 -7.096 10.434 1.00 0.70 C ATOM 2013 OE1 GLN A 119 -2.876 -6.105 10.713 1.00 1.49 O ATOM 2014 NE2 GLN A 119 -3.067 -8.330 10.484 1.00 0.36 N ATOM 0 H GLN A 119 -7.019 -4.909 8.373 1.00 0.22 H new ATOM 0 HA GLN A 119 -7.665 -6.510 10.776 1.00 0.29 H new ATOM 0 HB2 GLN A 119 -5.182 -4.836 10.215 1.00 0.36 H new ATOM 0 HB3 GLN A 119 -5.501 -5.733 11.686 1.00 0.36 H new ATOM 0 HG2 GLN A 119 -5.550 -7.848 10.302 1.00 0.56 H new ATOM 0 HG3 GLN A 119 -5.048 -6.896 8.919 1.00 0.56 H new ATOM 0 HE21 GLN A 119 -3.663 -9.122 10.244 1.00 0.36 H new ATOM 0 HE22 GLN A 119 -2.098 -8.487 10.763 1.00 0.36 H new ATOM 2023 N GLY A 120 -8.643 -3.707 10.266 1.00 0.26 N ATOM 2024 CA GLY A 120 -9.242 -2.495 10.798 1.00 0.25 C ATOM 2025 C GLY A 120 -8.349 -1.274 10.659 1.00 0.22 C ATOM 2026 O GLY A 120 -8.767 -0.161 10.974 1.00 0.35 O ATOM 0 H GLY A 120 -8.969 -3.976 9.338 1.00 0.26 H new ATOM 0 HA2 GLY A 120 -10.185 -2.308 10.284 1.00 0.25 H new ATOM 0 HA3 GLY A 120 -9.478 -2.646 11.851 1.00 0.25 H new ATOM 2030 N HIS A 121 -7.120 -1.473 10.189 1.00 0.20 N ATOM 2031 CA HIS A 121 -6.184 -0.369 10.017 1.00 0.18 C ATOM 2032 C HIS A 121 -5.772 -0.231 8.561 1.00 0.17 C ATOM 2033 O HIS A 121 -5.378 -1.205 7.919 1.00 0.26 O ATOM 2034 CB HIS A 121 -4.948 -0.570 10.894 1.00 0.21 C ATOM 2035 CG HIS A 121 -5.167 -0.184 12.323 1.00 0.23 C ATOM 2036 ND1 HIS A 121 -5.073 -1.077 13.371 1.00 0.29 N ATOM 2037 CD2 HIS A 121 -5.471 1.012 12.874 1.00 0.24 C ATOM 2038 CE1 HIS A 121 -5.313 -0.443 14.506 1.00 0.32 C ATOM 2039 NE2 HIS A 121 -5.557 0.824 14.231 1.00 0.29 N ATOM 0 H HIS A 121 -6.751 -2.386 9.922 1.00 0.20 H new ATOM 0 HA HIS A 121 -6.687 0.548 10.323 1.00 0.18 H new ATOM 0 HB2 HIS A 121 -4.646 -1.616 10.850 1.00 0.21 H new ATOM 0 HB3 HIS A 121 -4.124 0.017 10.489 1.00 0.21 H new ATOM 0 HD2 HIS A 121 -5.619 1.942 12.345 1.00 0.24 H new ATOM 0 HE1 HIS A 121 -5.310 -0.887 15.491 1.00 0.32 H new ATOM 0 HE2 HIS A 121 -5.775 1.547 14.916 1.00 0.29 H new ATOM 2048 N ILE A 122 -5.867 0.988 8.044 1.00 0.09 N ATOM 2049 CA ILE A 122 -5.508 1.254 6.662 1.00 0.08 C ATOM 2050 C ILE A 122 -4.712 2.547 6.541 1.00 0.08 C ATOM 2051 O ILE A 122 -4.860 3.460 7.353 1.00 0.12 O ATOM 2052 CB ILE A 122 -6.760 1.331 5.769 1.00 0.08 C ATOM 2053 CG1 ILE A 122 -6.359 1.321 4.299 1.00 0.09 C ATOM 2054 CG2 ILE A 122 -7.579 2.572 6.091 1.00 0.10 C ATOM 2055 CD1 ILE A 122 -7.500 0.972 3.373 1.00 0.12 C ATOM 0 H ILE A 122 -6.189 1.805 8.562 1.00 0.09 H new ATOM 0 HA ILE A 122 -4.886 0.426 6.324 1.00 0.08 H new ATOM 0 HB ILE A 122 -7.380 0.457 5.968 1.00 0.08 H new ATOM 0 HG12 ILE A 122 -5.968 2.302 4.029 1.00 0.09 H new ATOM 0 HG13 ILE A 122 -5.550 0.605 4.155 1.00 0.09 H new ATOM 0 HG21 ILE A 122 -8.458 2.605 5.448 1.00 0.10 H new ATOM 0 HG22 ILE A 122 -7.894 2.540 7.134 1.00 0.10 H new ATOM 0 HG23 ILE A 122 -6.973 3.462 5.922 1.00 0.10 H new ATOM 0 HD11 ILE A 122 -7.148 0.982 2.342 1.00 0.12 H new ATOM 0 HD12 ILE A 122 -7.877 -0.021 3.618 1.00 0.12 H new ATOM 0 HD13 ILE A 122 -8.300 1.703 3.490 1.00 0.12 H new ATOM 2067 N ILE A 123 -3.869 2.619 5.519 1.00 0.08 N ATOM 2068 CA ILE A 123 -3.044 3.793 5.294 1.00 0.08 C ATOM 2069 C ILE A 123 -3.536 4.598 4.099 1.00 0.08 C ATOM 2070 O ILE A 123 -3.493 4.131 2.960 1.00 0.09 O ATOM 2071 CB ILE A 123 -1.572 3.402 5.073 1.00 0.09 C ATOM 2072 CG1 ILE A 123 -1.063 2.622 6.282 1.00 0.10 C ATOM 2073 CG2 ILE A 123 -0.718 4.639 4.833 1.00 0.09 C ATOM 2074 CD1 ILE A 123 0.356 2.123 6.138 1.00 0.10 C ATOM 0 H ILE A 123 -3.740 1.875 4.833 1.00 0.08 H new ATOM 0 HA ILE A 123 -3.120 4.410 6.189 1.00 0.08 H new ATOM 0 HB ILE A 123 -1.502 2.770 4.188 1.00 0.09 H new ATOM 0 HG12 ILE A 123 -1.126 3.258 7.165 1.00 0.10 H new ATOM 0 HG13 ILE A 123 -1.721 1.770 6.455 1.00 0.10 H new ATOM 0 HG21 ILE A 123 0.319 4.341 4.679 1.00 0.09 H new ATOM 0 HG22 ILE A 123 -1.079 5.165 3.949 1.00 0.09 H new ATOM 0 HG23 ILE A 123 -0.781 5.298 5.699 1.00 0.09 H new ATOM 0 HD11 ILE A 123 0.643 1.579 7.038 1.00 0.10 H new ATOM 0 HD12 ILE A 123 0.423 1.459 5.276 1.00 0.10 H new ATOM 0 HD13 ILE A 123 1.027 2.970 5.996 1.00 0.10 H new ATOM 2086 N LEU A 124 -4.005 5.808 4.372 1.00 0.08 N ATOM 2087 CA LEU A 124 -4.500 6.687 3.323 1.00 0.09 C ATOM 2088 C LEU A 124 -3.370 7.564 2.796 1.00 0.09 C ATOM 2089 O LEU A 124 -2.644 8.186 3.570 1.00 0.09 O ATOM 2090 CB LEU A 124 -5.637 7.562 3.854 1.00 0.10 C ATOM 2091 CG LEU A 124 -6.798 6.801 4.503 1.00 0.11 C ATOM 2092 CD1 LEU A 124 -7.824 7.775 5.059 1.00 0.16 C ATOM 2093 CD2 LEU A 124 -7.446 5.854 3.502 1.00 0.13 C ATOM 0 H LEU A 124 -4.053 6.203 5.311 1.00 0.08 H new ATOM 0 HA LEU A 124 -4.882 6.073 2.507 1.00 0.09 H new ATOM 0 HB2 LEU A 124 -5.227 8.259 4.585 1.00 0.10 H new ATOM 0 HB3 LEU A 124 -6.030 8.158 3.031 1.00 0.10 H new ATOM 0 HG LEU A 124 -6.403 6.207 5.327 1.00 0.11 H new ATOM 0 HD11 LEU A 124 -8.642 7.219 5.517 1.00 0.16 H new ATOM 0 HD12 LEU A 124 -7.353 8.411 5.809 1.00 0.16 H new ATOM 0 HD13 LEU A 124 -8.213 8.394 4.251 1.00 0.16 H new ATOM 0 HD21 LEU A 124 -8.268 5.323 3.983 1.00 0.13 H new ATOM 0 HD22 LEU A 124 -7.828 6.425 2.656 1.00 0.13 H new ATOM 0 HD23 LEU A 124 -6.706 5.135 3.150 1.00 0.13 H new ATOM 2105 N ILE A 125 -3.224 7.611 1.476 1.00 0.10 N ATOM 2106 CA ILE A 125 -2.173 8.409 0.861 1.00 0.11 C ATOM 2107 C ILE A 125 -2.751 9.557 0.042 1.00 0.12 C ATOM 2108 O ILE A 125 -3.820 9.440 -0.557 1.00 0.17 O ATOM 2109 CB ILE A 125 -1.257 7.548 -0.038 1.00 0.12 C ATOM 2110 CG1 ILE A 125 -0.559 6.472 0.792 1.00 0.11 C ATOM 2111 CG2 ILE A 125 -0.224 8.411 -0.757 1.00 0.13 C ATOM 2112 CD1 ILE A 125 -1.430 5.271 1.093 1.00 0.11 C ATOM 0 H ILE A 125 -3.817 7.108 0.816 1.00 0.10 H new ATOM 0 HA ILE A 125 -1.578 8.821 1.676 1.00 0.11 H new ATOM 0 HB ILE A 125 -1.880 7.066 -0.791 1.00 0.12 H new ATOM 0 HG12 ILE A 125 0.333 6.138 0.261 1.00 0.11 H new ATOM 0 HG13 ILE A 125 -0.225 6.911 1.732 1.00 0.11 H new ATOM 0 HG21 ILE A 125 0.407 7.779 -1.382 1.00 0.13 H new ATOM 0 HG22 ILE A 125 -0.734 9.145 -1.381 1.00 0.13 H new ATOM 0 HG23 ILE A 125 0.394 8.927 -0.022 1.00 0.13 H new ATOM 0 HD11 ILE A 125 -0.865 4.551 1.685 1.00 0.11 H new ATOM 0 HD12 ILE A 125 -2.310 5.590 1.652 1.00 0.11 H new ATOM 0 HD13 ILE A 125 -1.743 4.805 0.159 1.00 0.11 H new ATOM 2124 N ALA A 126 -2.023 10.662 0.026 1.00 0.12 N ATOM 2125 CA ALA A 126 -2.424 11.846 -0.715 1.00 0.14 C ATOM 2126 C ALA A 126 -1.195 12.576 -1.236 1.00 0.13 C ATOM 2127 O ALA A 126 -0.127 12.511 -0.630 1.00 0.21 O ATOM 2128 CB ALA A 126 -3.255 12.764 0.164 1.00 0.17 C ATOM 0 H ALA A 126 -1.139 10.763 0.525 1.00 0.12 H new ATOM 0 HA ALA A 126 -3.035 11.539 -1.564 1.00 0.14 H new ATOM 0 HB1 ALA A 126 -3.548 13.646 -0.405 1.00 0.17 H new ATOM 0 HB2 ALA A 126 -4.148 12.236 0.500 1.00 0.17 H new ATOM 0 HB3 ALA A 126 -2.667 13.069 1.030 1.00 0.17 H new ATOM 2134 N SER A 127 -1.341 13.262 -2.359 1.00 0.19 N ATOM 2135 CA SER A 127 -0.224 13.991 -2.943 1.00 0.19 C ATOM 2136 C SER A 127 -0.615 15.417 -3.303 1.00 0.26 C ATOM 2137 O SER A 127 -1.787 15.788 -3.241 1.00 0.28 O ATOM 2138 CB SER A 127 0.300 13.264 -4.181 1.00 0.23 C ATOM 2139 OG SER A 127 1.401 13.952 -4.751 1.00 0.27 O ATOM 0 H SER A 127 -2.214 13.330 -2.881 1.00 0.19 H new ATOM 0 HA SER A 127 0.566 14.037 -2.194 1.00 0.19 H new ATOM 0 HB2 SER A 127 0.600 12.251 -3.912 1.00 0.23 H new ATOM 0 HB3 SER A 127 -0.498 13.174 -4.918 1.00 0.23 H new ATOM 0 HG SER A 127 1.516 13.670 -5.682 1.00 0.27 H new ATOM 2145 N ARG A 128 0.380 16.212 -3.684 1.00 0.40 N ATOM 2146 CA ARG A 128 0.154 17.606 -4.059 1.00 0.53 C ATOM 2147 C ARG A 128 -1.062 17.746 -4.972 1.00 0.55 C ATOM 2148 O ARG A 128 -1.829 18.703 -4.862 1.00 0.83 O ATOM 2149 CB ARG A 128 1.393 18.170 -4.756 1.00 0.80 C ATOM 2150 CG ARG A 128 2.644 18.136 -3.896 1.00 0.95 C ATOM 2151 CD ARG A 128 3.844 18.711 -4.631 1.00 1.25 C ATOM 2152 NE ARG A 128 3.627 20.098 -5.034 1.00 1.65 N ATOM 2153 CZ ARG A 128 4.558 20.852 -5.610 1.00 1.99 C ATOM 2154 NH1 ARG A 128 5.759 20.350 -5.861 1.00 1.94 N ATOM 2155 NH2 ARG A 128 4.287 22.109 -5.937 1.00 2.54 N ATOM 0 H ARG A 128 1.354 15.915 -3.742 1.00 0.40 H new ATOM 0 HA ARG A 128 -0.039 18.171 -3.147 1.00 0.53 H new ATOM 0 HB2 ARG A 128 1.575 17.604 -5.669 1.00 0.80 H new ATOM 0 HB3 ARG A 128 1.195 19.200 -5.054 1.00 0.80 H new ATOM 0 HG2 ARG A 128 2.472 18.702 -2.980 1.00 0.95 H new ATOM 0 HG3 ARG A 128 2.856 17.108 -3.601 1.00 0.95 H new ATOM 0 HD2 ARG A 128 4.723 18.653 -3.990 1.00 1.25 H new ATOM 0 HD3 ARG A 128 4.053 18.106 -5.513 1.00 1.25 H new ATOM 0 HE ARG A 128 2.710 20.511 -4.864 1.00 1.65 H new ATOM 0 HH11 ARG A 128 5.970 19.384 -5.612 1.00 1.94 H new ATOM 0 HH12 ARG A 128 6.472 20.930 -6.303 1.00 1.94 H new ATOM 0 HH21 ARG A 128 3.363 22.498 -5.746 1.00 2.54 H new ATOM 0 HH22 ARG A 128 5.002 22.687 -6.379 1.00 2.54 H new ATOM 2169 N SER A 129 -1.233 16.780 -5.867 1.00 0.60 N ATOM 2170 CA SER A 129 -2.354 16.791 -6.800 1.00 0.69 C ATOM 2171 C SER A 129 -3.560 16.075 -6.203 1.00 0.72 C ATOM 2172 O SER A 129 -4.705 16.414 -6.502 1.00 1.08 O ATOM 2173 CB SER A 129 -1.952 16.129 -8.116 1.00 0.89 C ATOM 2174 OG SER A 129 -1.529 14.792 -7.909 1.00 1.55 O ATOM 0 H SER A 129 -0.610 15.979 -5.967 1.00 0.60 H new ATOM 0 HA SER A 129 -2.628 17.828 -6.993 1.00 0.69 H new ATOM 0 HB2 SER A 129 -2.796 16.144 -8.806 1.00 0.89 H new ATOM 0 HB3 SER A 129 -1.149 16.699 -8.583 1.00 0.89 H new ATOM 0 HG SER A 129 -1.279 14.391 -8.768 1.00 1.55 H new ATOM 2180 N SER A 130 -3.290 15.083 -5.360 1.00 0.58 N ATOM 2181 CA SER A 130 -4.344 14.311 -4.709 1.00 0.74 C ATOM 2182 C SER A 130 -5.315 13.725 -5.731 1.00 0.97 C ATOM 2183 O SER A 130 -5.319 14.112 -6.900 1.00 1.60 O ATOM 2184 CB SER A 130 -5.102 15.186 -3.708 1.00 1.13 C ATOM 2185 OG SER A 130 -5.807 16.226 -4.363 1.00 1.78 O ATOM 0 H SER A 130 -2.344 14.793 -5.110 1.00 0.58 H new ATOM 0 HA SER A 130 -3.872 13.485 -4.177 1.00 0.74 H new ATOM 0 HB2 SER A 130 -5.801 14.571 -3.141 1.00 1.13 H new ATOM 0 HB3 SER A 130 -4.401 15.614 -2.992 1.00 1.13 H new ATOM 0 HG SER A 130 -5.706 16.129 -5.333 1.00 1.78 H new ATOM 2191 N VAL A 131 -6.131 12.781 -5.276 1.00 1.26 N ATOM 2192 CA VAL A 131 -7.110 12.131 -6.136 1.00 1.73 C ATOM 2193 C VAL A 131 -8.468 12.816 -6.038 1.00 1.69 C ATOM 2194 O VAL A 131 -9.503 12.208 -6.312 1.00 2.16 O ATOM 2195 CB VAL A 131 -7.272 10.648 -5.762 1.00 2.26 C ATOM 2196 CG1 VAL A 131 -5.936 9.929 -5.857 1.00 2.59 C ATOM 2197 CG2 VAL A 131 -7.859 10.511 -4.365 1.00 2.28 C ATOM 0 H VAL A 131 -6.133 12.448 -4.312 1.00 1.26 H new ATOM 0 HA VAL A 131 -6.741 12.209 -7.159 1.00 1.73 H new ATOM 0 HB VAL A 131 -7.962 10.186 -6.468 1.00 2.26 H new ATOM 0 HG11 VAL A 131 -6.067 8.881 -5.589 1.00 2.59 H new ATOM 0 HG12 VAL A 131 -5.557 9.999 -6.877 1.00 2.59 H new ATOM 0 HG13 VAL A 131 -5.224 10.392 -5.173 1.00 2.59 H new ATOM 0 HG21 VAL A 131 -7.966 9.455 -4.117 1.00 2.28 H new ATOM 0 HG22 VAL A 131 -7.195 10.987 -3.643 1.00 2.28 H new ATOM 0 HG23 VAL A 131 -8.836 10.993 -4.332 1.00 2.28 H new ATOM 2207 N ALA A 132 -8.455 14.083 -5.643 1.00 1.45 N ATOM 2208 CA ALA A 132 -9.682 14.852 -5.503 1.00 1.75 C ATOM 2209 C ALA A 132 -10.470 14.875 -6.809 1.00 2.08 C ATOM 2210 O ALA A 132 -11.686 15.061 -6.809 1.00 2.50 O ATOM 2211 CB ALA A 132 -9.363 16.267 -5.051 1.00 1.89 C ATOM 0 H ALA A 132 -7.606 14.599 -5.414 1.00 1.45 H new ATOM 0 HA ALA A 132 -10.302 14.370 -4.747 1.00 1.75 H new ATOM 0 HB1 ALA A 132 -10.288 16.834 -4.949 1.00 1.89 H new ATOM 0 HB2 ALA A 132 -8.850 16.235 -4.090 1.00 1.89 H new ATOM 0 HB3 ALA A 132 -8.722 16.749 -5.789 1.00 1.89 H new ATOM 2217 N GLY A 133 -9.765 14.688 -7.919 1.00 2.20 N ATOM 2218 CA GLY A 133 -10.412 14.691 -9.217 1.00 2.72 C ATOM 2219 C GLY A 133 -10.095 13.448 -10.025 1.00 2.49 C ATOM 2220 O GLY A 133 -10.521 12.347 -9.677 1.00 2.56 O ATOM 0 H GLY A 133 -8.757 14.534 -7.943 1.00 2.20 H new ATOM 0 HA2 GLY A 133 -11.491 14.767 -9.082 1.00 2.72 H new ATOM 0 HA3 GLY A 133 -10.097 15.573 -9.774 1.00 2.72 H new ATOM 2224 N LYS A 134 -9.344 13.625 -11.107 1.00 2.56 N ATOM 2225 CA LYS A 134 -8.969 12.514 -11.970 1.00 2.53 C ATOM 2226 C LYS A 134 -7.490 12.584 -12.335 1.00 2.33 C ATOM 2227 O LYS A 134 -6.995 13.625 -12.764 1.00 2.66 O ATOM 2228 CB LYS A 134 -9.820 12.519 -13.239 1.00 3.01 C ATOM 2229 CG LYS A 134 -9.695 13.800 -14.049 1.00 3.36 C ATOM 2230 CD LYS A 134 -10.543 13.743 -15.310 1.00 4.13 C ATOM 2231 CE LYS A 134 -10.426 15.022 -16.124 1.00 4.97 C ATOM 2232 NZ LYS A 134 -9.017 15.308 -16.510 1.00 5.84 N ATOM 0 H LYS A 134 -8.983 14.531 -11.407 1.00 2.56 H new ATOM 0 HA LYS A 134 -9.146 11.587 -11.425 1.00 2.53 H new ATOM 0 HB2 LYS A 134 -9.531 11.674 -13.864 1.00 3.01 H new ATOM 0 HB3 LYS A 134 -10.865 12.371 -12.967 1.00 3.01 H new ATOM 0 HG2 LYS A 134 -10.003 14.649 -13.439 1.00 3.36 H new ATOM 0 HG3 LYS A 134 -8.651 13.962 -14.318 1.00 3.36 H new ATOM 0 HD2 LYS A 134 -10.233 12.894 -15.919 1.00 4.13 H new ATOM 0 HD3 LYS A 134 -11.586 13.577 -15.040 1.00 4.13 H new ATOM 0 HE2 LYS A 134 -11.038 14.938 -17.022 1.00 4.97 H new ATOM 0 HE3 LYS A 134 -10.821 15.858 -15.546 1.00 4.97 H new ATOM 0 HZ1 LYS A 134 -9.000 16.051 -17.237 1.00 5.84 H new ATOM 0 HZ2 LYS A 134 -8.487 15.629 -15.675 1.00 5.84 H new ATOM 0 HZ3 LYS A 134 -8.578 14.444 -16.888 1.00 5.84 H new ATOM 2246 N LEU A 135 -6.793 11.466 -12.161 1.00 2.03 N ATOM 2247 CA LEU A 135 -5.371 11.398 -12.470 1.00 2.01 C ATOM 2248 C LEU A 135 -5.146 10.920 -13.900 1.00 2.30 C ATOM 2249 O LEU A 135 -4.249 11.402 -14.592 1.00 2.68 O ATOM 2250 CB LEU A 135 -4.660 10.464 -11.490 1.00 1.88 C ATOM 2251 CG LEU A 135 -3.195 10.175 -11.824 1.00 2.28 C ATOM 2252 CD1 LEU A 135 -2.372 11.452 -11.770 1.00 2.66 C ATOM 2253 CD2 LEU A 135 -2.626 9.131 -10.875 1.00 2.33 C ATOM 0 H LEU A 135 -7.190 10.596 -11.808 1.00 2.03 H new ATOM 0 HA LEU A 135 -4.956 12.401 -12.373 1.00 2.01 H new ATOM 0 HB2 LEU A 135 -4.711 10.901 -10.493 1.00 1.88 H new ATOM 0 HB3 LEU A 135 -5.202 9.519 -11.453 1.00 1.88 H new ATOM 0 HG LEU A 135 -3.146 9.779 -12.838 1.00 2.28 H new ATOM 0 HD11 LEU A 135 -1.333 11.226 -12.010 1.00 2.66 H new ATOM 0 HD12 LEU A 135 -2.764 12.168 -12.492 1.00 2.66 H new ATOM 0 HD13 LEU A 135 -2.428 11.879 -10.769 1.00 2.66 H new ATOM 0 HD21 LEU A 135 -1.583 8.939 -11.128 1.00 2.33 H new ATOM 0 HD22 LEU A 135 -2.689 9.498 -9.851 1.00 2.33 H new ATOM 0 HD23 LEU A 135 -3.198 8.207 -10.965 1.00 2.33 H new ATOM 2265 N ALA A 136 -5.964 9.969 -14.336 1.00 2.40 N ATOM 2266 CA ALA A 136 -5.855 9.428 -15.685 1.00 2.83 C ATOM 2267 C ALA A 136 -7.219 9.010 -16.220 1.00 2.82 C ATOM 2268 O ALA A 136 -7.405 7.874 -16.655 1.00 3.32 O ATOM 2269 CB ALA A 136 -4.894 8.248 -15.707 1.00 3.52 C ATOM 0 H ALA A 136 -6.710 9.557 -13.775 1.00 2.40 H new ATOM 0 HA ALA A 136 -5.463 10.213 -16.333 1.00 2.83 H new ATOM 0 HB1 ALA A 136 -4.823 7.855 -16.721 1.00 3.52 H new ATOM 0 HB2 ALA A 136 -3.909 8.575 -15.375 1.00 3.52 H new ATOM 0 HB3 ALA A 136 -5.261 7.468 -15.040 1.00 3.52 H new ATOM 2275 N LYS A 137 -8.169 9.938 -16.187 1.00 2.71 N ATOM 2276 CA LYS A 137 -9.518 9.666 -16.670 1.00 3.21 C ATOM 2277 C LYS A 137 -9.849 10.539 -17.877 1.00 3.74 C ATOM 2278 O LYS A 137 -9.552 10.113 -19.013 1.00 4.08 O ATOM 2279 CB LYS A 137 -10.542 9.903 -15.556 1.00 3.53 C ATOM 2280 CG LYS A 137 -10.204 9.192 -14.254 1.00 4.27 C ATOM 2281 CD LYS A 137 -9.838 7.735 -14.492 1.00 4.96 C ATOM 2282 CE LYS A 137 -9.464 7.034 -13.195 1.00 5.65 C ATOM 2283 NZ LYS A 137 -9.041 5.626 -13.427 1.00 6.33 N ATOM 2284 OXT LYS A 137 -10.402 11.640 -17.677 1.00 4.29 O ATOM 0 H LYS A 137 -8.030 10.884 -15.831 1.00 2.71 H new ATOM 0 HA LYS A 137 -9.563 8.621 -16.976 1.00 3.21 H new ATOM 0 HB2 LYS A 137 -10.618 10.974 -15.366 1.00 3.53 H new ATOM 0 HB3 LYS A 137 -11.522 9.570 -15.898 1.00 3.53 H new ATOM 0 HG2 LYS A 137 -9.374 9.701 -13.765 1.00 4.27 H new ATOM 0 HG3 LYS A 137 -11.056 9.248 -13.576 1.00 4.27 H new ATOM 0 HD2 LYS A 137 -10.678 7.219 -14.956 1.00 4.96 H new ATOM 0 HD3 LYS A 137 -9.004 7.678 -15.191 1.00 4.96 H new ATOM 0 HE2 LYS A 137 -8.657 7.580 -12.707 1.00 5.65 H new ATOM 0 HE3 LYS A 137 -10.316 7.050 -12.515 1.00 5.65 H new ATOM 0 HZ1 LYS A 137 -8.795 5.183 -12.519 1.00 6.33 H new ATOM 0 HZ2 LYS A 137 -9.820 5.098 -13.869 1.00 6.33 H new ATOM 0 HZ3 LYS A 137 -8.212 5.612 -14.055 1.00 6.33 H new TER 2298 LYS A 137