USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 834 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 84 ASN : amide:sc= -0.0882 K(o=-0.088,f=-4.8!) USER MOD Set 1.2: A 86 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 74 HIS : no HD1:sc= -0.279 X(o=-0.3,f=-0.044) USER MOD Set 2.2: A 96 MET CE :methyl 149:sc= -0.0181 (180deg=-0.0286) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -149:sc= 1.24 (180deg=1.17) USER MOD Single : A 6 ASN : amide:sc= 0.586 K(o=0.59,f=0) USER MOD Single : A 8 LYS NZ :NH3+ -179:sc= 0.0969 (180deg=0.0956) USER MOD Single : A 9 HIS : no HE2:sc= -1.15! C(o=-1.1!,f=-5.5!) USER MOD Single : A 14 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.0213 K(o=-0.021,f=-1.7!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -153:sc= 2.12 (180deg=-0.224) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00633 USER MOD Single : A 22 SER OG : rot 82:sc= 0.0339 USER MOD Single : A 24 HIS : no HE2:sc= -0.14 K(o=-0.14,f=-4.7!) USER MOD Single : A 25 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 CYS SG : rot -67:sc= 0.709 USER MOD Single : A 31 ASN : amide:sc= 0.978 K(o=0.98,f=-0.35) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 MET CE :methyl -145:sc= 0 (180deg=-2.47!) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 98:sc= 1.05 USER MOD Single : A 46 SER OG : rot 79:sc= 1.22 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc=-0.00926 X(o=-0.0093,f=-0.086) USER MOD Single : A 52 SER OG : rot 180:sc= 0.123 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 CYS SG : rot 180:sc= -0.701 USER MOD Single : A 69 TYR OH : rot 30:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.14) USER MOD Single : A 71 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0179) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0141) USER MOD Single : A 77 LYS NZ :NH3+ -107:sc= 1.04 (180deg=-1.37) USER MOD Single : A 81 SER OG : rot 79:sc= 1.23 USER MOD Single : A 89 GLN : amide:sc= -0.254 K(o=-0.25,f=-2.6!) USER MOD Single : A 91 LYS NZ :NH3+ 175:sc= 0.677 (180deg=0.439) USER MOD Single : A 97 ASN : amide:sc=-0.00305 X(o=-0.0031,f=0) USER MOD Single : A 98 THR OG1 : rot 86:sc= 1.29 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 SER OG : rot 99:sc= 1.31 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.235 -14.306 -15.698 1.00 1.74 N ATOM 2 CA MET A 1 -8.680 -13.084 -16.420 1.00 1.02 C ATOM 3 C MET A 1 -9.029 -11.990 -15.410 1.00 0.87 C ATOM 4 O MET A 1 -10.057 -12.065 -14.730 1.00 1.29 O ATOM 5 CB MET A 1 -9.890 -13.375 -17.322 1.00 1.60 C ATOM 6 CG MET A 1 -9.469 -14.088 -18.612 1.00 2.33 C ATOM 7 SD MET A 1 -10.447 -13.570 -20.038 1.00 3.31 S ATOM 8 CE MET A 1 -9.548 -14.367 -21.382 1.00 4.33 C ATOM 0 H1 MET A 1 -7.540 -14.818 -16.278 1.00 1.74 H new ATOM 0 H2 MET A 1 -7.799 -14.035 -14.794 1.00 1.74 H new ATOM 0 H3 MET A 1 -9.055 -14.920 -15.517 1.00 1.74 H new ATOM 0 HA MET A 1 -7.863 -12.747 -17.058 1.00 1.02 H new ATOM 0 HB2 MET A 1 -10.608 -13.992 -16.782 1.00 1.60 H new ATOM 0 HB3 MET A 1 -10.394 -12.441 -17.569 1.00 1.60 H new ATOM 0 HG2 MET A 1 -8.415 -13.889 -18.806 1.00 2.33 H new ATOM 0 HG3 MET A 1 -9.570 -15.165 -18.478 1.00 2.33 H new ATOM 0 HE1 MET A 1 -10.034 -14.139 -22.331 1.00 4.33 H new ATOM 0 HE2 MET A 1 -8.522 -13.999 -21.402 1.00 4.33 H new ATOM 0 HE3 MET A 1 -9.544 -15.446 -21.227 1.00 4.33 H new ATOM 20 N GLU A 2 -8.162 -10.980 -15.313 1.00 0.51 N ATOM 21 CA GLU A 2 -8.349 -9.855 -14.387 1.00 0.37 C ATOM 22 C GLU A 2 -8.066 -8.534 -15.107 1.00 0.34 C ATOM 23 O GLU A 2 -7.617 -8.524 -16.259 1.00 0.48 O ATOM 24 CB GLU A 2 -7.408 -9.986 -13.179 1.00 0.53 C ATOM 25 CG GLU A 2 -7.403 -11.406 -12.590 1.00 0.96 C ATOM 26 CD GLU A 2 -6.359 -12.279 -13.277 1.00 1.61 C ATOM 27 OE1 GLU A 2 -5.178 -11.884 -13.319 1.00 2.09 O ATOM 28 OE2 GLU A 2 -6.714 -13.371 -13.759 1.00 2.16 O ATOM 0 H GLU A 2 -7.311 -10.916 -15.872 1.00 0.51 H new ATOM 0 HA GLU A 2 -9.381 -9.868 -14.036 1.00 0.37 H new ATOM 0 HB2 GLU A 2 -6.395 -9.717 -13.480 1.00 0.53 H new ATOM 0 HB3 GLU A 2 -7.710 -9.277 -12.408 1.00 0.53 H new ATOM 0 HG2 GLU A 2 -7.196 -11.359 -11.521 1.00 0.96 H new ATOM 0 HG3 GLU A 2 -8.390 -11.855 -12.705 1.00 0.96 H new ATOM 35 N GLY A 3 -8.322 -7.424 -14.421 1.00 0.25 N ATOM 36 CA GLY A 3 -8.091 -6.091 -14.977 1.00 0.28 C ATOM 37 C GLY A 3 -8.991 -5.061 -14.304 1.00 0.22 C ATOM 38 O GLY A 3 -9.826 -5.401 -13.455 1.00 0.22 O ATOM 0 H GLY A 3 -8.693 -7.420 -13.471 1.00 0.25 H new ATOM 0 HA2 GLY A 3 -7.046 -5.812 -14.842 1.00 0.28 H new ATOM 0 HA3 GLY A 3 -8.282 -6.101 -16.050 1.00 0.28 H new ATOM 42 N PHE A 4 -8.823 -3.801 -14.696 1.00 0.24 N ATOM 43 CA PHE A 4 -9.621 -2.701 -14.155 1.00 0.21 C ATOM 44 C PHE A 4 -10.899 -2.544 -14.971 1.00 0.22 C ATOM 45 O PHE A 4 -10.916 -2.787 -16.180 1.00 0.27 O ATOM 46 CB PHE A 4 -8.825 -1.390 -14.184 1.00 0.23 C ATOM 47 CG PHE A 4 -7.973 -1.178 -12.958 1.00 0.26 C ATOM 48 CD1 PHE A 4 -8.559 -0.886 -11.737 1.00 0.30 C ATOM 49 CD2 PHE A 4 -6.596 -1.290 -13.054 1.00 0.34 C ATOM 50 CE1 PHE A 4 -7.769 -0.708 -10.616 1.00 0.37 C ATOM 51 CE2 PHE A 4 -5.808 -1.108 -11.936 1.00 0.41 C ATOM 52 CZ PHE A 4 -6.423 -0.761 -10.704 1.00 0.41 C ATOM 0 H PHE A 4 -8.135 -3.513 -15.392 1.00 0.24 H new ATOM 0 HA PHE A 4 -9.874 -2.931 -13.120 1.00 0.21 H new ATOM 0 HB2 PHE A 4 -8.186 -1.381 -15.067 1.00 0.23 H new ATOM 0 HB3 PHE A 4 -9.518 -0.555 -14.284 1.00 0.23 H new ATOM 0 HD1 PHE A 4 -9.633 -0.797 -11.661 1.00 0.30 H new ATOM 0 HD2 PHE A 4 -6.138 -1.520 -14.005 1.00 0.34 H new ATOM 0 HE1 PHE A 4 -8.234 -0.524 -9.659 1.00 0.37 H new ATOM 0 HE2 PHE A 4 -4.736 -1.228 -11.997 1.00 0.41 H new ATOM 0 HZ PHE A 4 -5.815 -0.540 -9.839 1.00 0.41 H new ATOM 62 N LEU A 5 -11.957 -2.133 -14.297 1.00 0.19 N ATOM 63 CA LEU A 5 -13.262 -1.932 -14.917 1.00 0.21 C ATOM 64 C LEU A 5 -14.034 -0.865 -14.148 1.00 0.20 C ATOM 65 O LEU A 5 -13.994 -0.824 -12.914 1.00 0.21 O ATOM 66 CB LEU A 5 -14.077 -3.240 -14.890 1.00 0.23 C ATOM 67 CG LEU A 5 -14.012 -4.012 -16.212 1.00 0.24 C ATOM 68 CD1 LEU A 5 -14.805 -5.317 -16.099 1.00 0.27 C ATOM 69 CD2 LEU A 5 -14.536 -3.165 -17.372 1.00 0.31 C ATOM 0 H LEU A 5 -11.939 -1.927 -13.298 1.00 0.19 H new ATOM 0 HA LEU A 5 -13.109 -1.619 -15.950 1.00 0.21 H new ATOM 0 HB2 LEU A 5 -13.707 -3.876 -14.086 1.00 0.23 H new ATOM 0 HB3 LEU A 5 -15.117 -3.009 -14.661 1.00 0.23 H new ATOM 0 HG LEU A 5 -12.968 -4.250 -16.418 1.00 0.24 H new ATOM 0 HD11 LEU A 5 -14.752 -5.858 -17.044 1.00 0.27 H new ATOM 0 HD12 LEU A 5 -14.382 -5.932 -15.305 1.00 0.27 H new ATOM 0 HD13 LEU A 5 -15.846 -5.091 -15.868 1.00 0.27 H new ATOM 0 HD21 LEU A 5 -14.478 -3.739 -18.297 1.00 0.31 H new ATOM 0 HD22 LEU A 5 -15.573 -2.889 -17.181 1.00 0.31 H new ATOM 0 HD23 LEU A 5 -13.931 -2.263 -17.466 1.00 0.31 H new ATOM 81 N ASN A 6 -14.785 -0.039 -14.869 1.00 0.22 N ATOM 82 CA ASN A 6 -15.625 0.982 -14.239 1.00 0.23 C ATOM 83 C ASN A 6 -16.966 0.322 -13.953 1.00 0.22 C ATOM 84 O ASN A 6 -17.518 -0.345 -14.829 1.00 0.26 O ATOM 85 CB ASN A 6 -15.793 2.214 -15.142 1.00 0.28 C ATOM 86 CG ASN A 6 -14.438 2.811 -15.529 1.00 0.72 C ATOM 87 OD1 ASN A 6 -13.904 3.666 -14.823 1.00 1.49 O ATOM 88 ND2 ASN A 6 -13.885 2.361 -16.644 1.00 1.24 N ATOM 0 H ASN A 6 -14.832 -0.054 -15.888 1.00 0.22 H new ATOM 0 HA ASN A 6 -15.164 1.346 -13.321 1.00 0.23 H new ATOM 0 HB2 ASN A 6 -16.340 1.935 -16.043 1.00 0.28 H new ATOM 0 HB3 ASN A 6 -16.390 2.966 -14.626 1.00 0.28 H new ATOM 0 HD21 ASN A 6 -12.981 2.724 -16.948 1.00 1.24 H new ATOM 0 HD22 ASN A 6 -14.362 1.651 -17.200 1.00 1.24 H new ATOM 95 N ARG A 7 -17.460 0.452 -12.723 1.00 0.23 N ATOM 96 CA ARG A 7 -18.719 -0.186 -12.318 1.00 0.24 C ATOM 97 C ARG A 7 -19.751 0.841 -11.865 1.00 0.25 C ATOM 98 O ARG A 7 -19.458 1.722 -11.053 1.00 0.32 O ATOM 99 CB ARG A 7 -18.448 -1.184 -11.183 1.00 0.28 C ATOM 100 CG ARG A 7 -19.709 -1.971 -10.806 1.00 0.34 C ATOM 101 CD ARG A 7 -19.378 -3.174 -9.917 1.00 0.54 C ATOM 102 NE ARG A 7 -19.448 -2.817 -8.494 1.00 0.95 N ATOM 103 CZ ARG A 7 -19.853 -3.693 -7.575 1.00 1.16 C ATOM 104 NH1 ARG A 7 -19.192 -4.828 -7.407 1.00 1.46 N ATOM 105 NH2 ARG A 7 -20.918 -3.432 -6.827 1.00 1.71 N ATOM 0 H ARG A 7 -17.009 0.994 -11.986 1.00 0.23 H new ATOM 0 HA ARG A 7 -19.126 -0.708 -13.184 1.00 0.24 H new ATOM 0 HB2 ARG A 7 -17.664 -1.877 -11.488 1.00 0.28 H new ATOM 0 HB3 ARG A 7 -18.078 -0.649 -10.308 1.00 0.28 H new ATOM 0 HG2 ARG A 7 -20.406 -1.314 -10.286 1.00 0.34 H new ATOM 0 HG3 ARG A 7 -20.209 -2.314 -11.712 1.00 0.34 H new ATOM 0 HD2 ARG A 7 -20.074 -3.986 -10.126 1.00 0.54 H new ATOM 0 HD3 ARG A 7 -18.379 -3.541 -10.154 1.00 0.54 H new ATOM 0 HE ARG A 7 -19.180 -1.877 -8.202 1.00 0.95 H new ATOM 0 HH11 ARG A 7 -18.374 -5.031 -7.981 1.00 1.46 H new ATOM 0 HH12 ARG A 7 -19.501 -5.499 -6.704 1.00 1.46 H new ATOM 0 HH21 ARG A 7 -21.429 -2.559 -6.955 1.00 1.71 H new ATOM 0 HH22 ARG A 7 -21.225 -4.105 -6.125 1.00 1.71 H new ATOM 119 N LYS A 8 -20.965 0.689 -12.382 1.00 0.27 N ATOM 120 CA LYS A 8 -22.091 1.553 -12.041 1.00 0.29 C ATOM 121 C LYS A 8 -23.304 0.671 -11.769 1.00 0.29 C ATOM 122 O LYS A 8 -23.808 -0.005 -12.667 1.00 0.38 O ATOM 123 CB LYS A 8 -22.368 2.535 -13.184 1.00 0.36 C ATOM 124 CG LYS A 8 -23.653 3.352 -12.966 1.00 0.37 C ATOM 125 CD LYS A 8 -24.724 3.015 -14.008 1.00 0.50 C ATOM 126 CE LYS A 8 -26.144 3.208 -13.464 1.00 0.62 C ATOM 127 NZ LYS A 8 -26.335 4.547 -12.840 1.00 1.02 N ATOM 0 H LYS A 8 -21.198 -0.042 -13.054 1.00 0.27 H new ATOM 0 HA LYS A 8 -21.863 2.141 -11.152 1.00 0.29 H new ATOM 0 HB2 LYS A 8 -21.523 3.215 -13.286 1.00 0.36 H new ATOM 0 HB3 LYS A 8 -22.448 1.983 -14.121 1.00 0.36 H new ATOM 0 HG2 LYS A 8 -24.043 3.156 -11.967 1.00 0.37 H new ATOM 0 HG3 LYS A 8 -23.420 4.416 -13.015 1.00 0.37 H new ATOM 0 HD2 LYS A 8 -24.585 3.645 -14.886 1.00 0.50 H new ATOM 0 HD3 LYS A 8 -24.599 1.982 -14.334 1.00 0.50 H new ATOM 0 HE2 LYS A 8 -26.861 3.082 -14.275 1.00 0.62 H new ATOM 0 HE3 LYS A 8 -26.357 2.433 -12.728 1.00 0.62 H new ATOM 0 HZ1 LYS A 8 -27.305 4.623 -12.472 1.00 1.02 H new ATOM 0 HZ2 LYS A 8 -25.658 4.666 -12.059 1.00 1.02 H new ATOM 0 HZ3 LYS A 8 -26.175 5.288 -13.552 1.00 1.02 H new ATOM 141 N HIS A 9 -23.760 0.669 -10.522 1.00 0.43 N ATOM 142 CA HIS A 9 -24.912 -0.140 -10.113 1.00 0.52 C ATOM 143 C HIS A 9 -26.221 0.539 -10.516 1.00 0.58 C ATOM 144 O HIS A 9 -26.499 1.667 -10.112 1.00 0.73 O ATOM 145 CB HIS A 9 -24.892 -0.416 -8.593 1.00 0.68 C ATOM 146 CG HIS A 9 -24.620 0.784 -7.709 1.00 0.88 C ATOM 147 ND1 HIS A 9 -24.642 0.717 -6.340 1.00 1.21 N ATOM 148 CD2 HIS A 9 -24.290 2.076 -7.984 1.00 1.22 C ATOM 149 CE1 HIS A 9 -24.342 1.871 -5.802 1.00 1.69 C ATOM 150 NE2 HIS A 9 -24.120 2.733 -6.779 1.00 1.75 N ATOM 0 H HIS A 9 -23.349 1.221 -9.769 1.00 0.43 H new ATOM 0 HA HIS A 9 -24.845 -1.097 -10.630 1.00 0.52 H new ATOM 0 HB2 HIS A 9 -25.853 -0.843 -8.308 1.00 0.68 H new ATOM 0 HB3 HIS A 9 -24.134 -1.172 -8.390 1.00 0.68 H new ATOM 0 HD1 HIS A 9 -24.864 -0.125 -5.809 1.00 1.21 H new ATOM 0 HD2 HIS A 9 -24.181 2.510 -8.967 1.00 1.22 H new ATOM 0 HE1 HIS A 9 -24.286 2.082 -4.744 1.00 1.69 H new ATOM 158 N GLU A 10 -27.022 -0.167 -11.314 1.00 0.60 N ATOM 159 CA GLU A 10 -28.317 0.341 -11.776 1.00 0.73 C ATOM 160 C GLU A 10 -29.412 -0.066 -10.786 1.00 0.83 C ATOM 161 O GLU A 10 -30.331 0.703 -10.514 1.00 1.00 O ATOM 162 CB GLU A 10 -28.635 -0.205 -13.180 1.00 0.79 C ATOM 163 CG GLU A 10 -28.578 0.903 -14.244 1.00 1.28 C ATOM 164 CD GLU A 10 -29.603 0.661 -15.347 1.00 1.19 C ATOM 165 OE1 GLU A 10 -29.966 -0.507 -15.585 1.00 1.52 O ATOM 166 OE2 GLU A 10 -30.044 1.637 -15.984 1.00 1.72 O ATOM 0 H GLU A 10 -26.795 -1.100 -11.657 1.00 0.60 H new ATOM 0 HA GLU A 10 -28.274 1.429 -11.832 1.00 0.73 H new ATOM 0 HB2 GLU A 10 -27.925 -0.992 -13.435 1.00 0.79 H new ATOM 0 HB3 GLU A 10 -29.626 -0.659 -13.179 1.00 0.79 H new ATOM 0 HG2 GLU A 10 -28.764 1.870 -13.776 1.00 1.28 H new ATOM 0 HG3 GLU A 10 -27.578 0.945 -14.676 1.00 1.28 H new ATOM 173 N TRP A 11 -29.297 -1.282 -10.253 1.00 0.82 N ATOM 174 CA TRP A 11 -30.262 -1.814 -9.293 1.00 0.96 C ATOM 175 C TRP A 11 -29.576 -2.850 -8.394 1.00 0.94 C ATOM 176 O TRP A 11 -28.707 -3.609 -8.838 1.00 0.84 O ATOM 177 CB TRP A 11 -31.459 -2.434 -10.045 1.00 1.08 C ATOM 178 CG TRP A 11 -32.387 -3.248 -9.179 1.00 1.26 C ATOM 179 CD1 TRP A 11 -33.480 -2.804 -8.490 1.00 1.54 C ATOM 180 CD2 TRP A 11 -32.284 -4.659 -8.908 1.00 1.26 C ATOM 181 NE1 TRP A 11 -34.039 -3.860 -7.826 1.00 1.67 N ATOM 182 CE2 TRP A 11 -33.339 -5.003 -8.058 1.00 1.51 C ATOM 183 CE3 TRP A 11 -31.400 -5.660 -9.306 1.00 1.19 C ATOM 184 CZ2 TRP A 11 -33.527 -6.298 -7.605 1.00 1.62 C ATOM 185 CZ3 TRP A 11 -31.577 -6.958 -8.859 1.00 1.35 C ATOM 186 CH2 TRP A 11 -32.633 -7.275 -8.016 1.00 1.53 C ATOM 0 H TRP A 11 -28.535 -1.923 -10.474 1.00 0.82 H new ATOM 0 HA TRP A 11 -30.637 -1.008 -8.662 1.00 0.96 H new ATOM 0 HB2 TRP A 11 -32.030 -1.634 -10.516 1.00 1.08 H new ATOM 0 HB3 TRP A 11 -31.080 -3.069 -10.846 1.00 1.08 H new ATOM 0 HD1 TRP A 11 -33.842 -1.787 -8.473 1.00 1.54 H new ATOM 0 HE1 TRP A 11 -34.869 -3.799 -7.236 1.00 1.67 H new ATOM 0 HE3 TRP A 11 -30.577 -5.423 -9.963 1.00 1.19 H new ATOM 0 HZ2 TRP A 11 -34.349 -6.541 -6.948 1.00 1.62 H new ATOM 0 HZ3 TRP A 11 -30.888 -7.730 -9.169 1.00 1.35 H new ATOM 0 HH2 TRP A 11 -32.760 -8.293 -7.677 1.00 1.53 H new ATOM 197 N GLU A 12 -30.005 -2.880 -7.139 1.00 1.16 N ATOM 198 CA GLU A 12 -29.498 -3.814 -6.128 1.00 1.26 C ATOM 199 C GLU A 12 -30.192 -3.535 -4.796 1.00 1.56 C ATOM 200 O GLU A 12 -30.396 -4.439 -3.984 1.00 2.03 O ATOM 201 CB GLU A 12 -27.969 -3.715 -5.968 1.00 1.34 C ATOM 202 CG GLU A 12 -27.461 -2.268 -5.936 1.00 1.63 C ATOM 203 CD GLU A 12 -25.972 -2.236 -5.597 1.00 1.81 C ATOM 204 OE1 GLU A 12 -25.237 -3.154 -6.014 1.00 2.05 O ATOM 205 OE2 GLU A 12 -25.532 -1.287 -4.920 1.00 2.09 O ATOM 0 H GLU A 12 -30.725 -2.250 -6.784 1.00 1.16 H new ATOM 0 HA GLU A 12 -29.719 -4.829 -6.457 1.00 1.26 H new ATOM 0 HB2 GLU A 12 -27.672 -4.219 -5.048 1.00 1.34 H new ATOM 0 HB3 GLU A 12 -27.488 -4.245 -6.790 1.00 1.34 H new ATOM 0 HG2 GLU A 12 -27.631 -1.794 -6.903 1.00 1.63 H new ATOM 0 HG3 GLU A 12 -28.021 -1.695 -5.197 1.00 1.63 H new ATOM 212 N ALA A 13 -30.563 -2.271 -4.593 1.00 1.77 N ATOM 213 CA ALA A 13 -31.252 -1.826 -3.382 1.00 2.14 C ATOM 214 C ALA A 13 -31.926 -0.476 -3.657 1.00 2.15 C ATOM 215 O ALA A 13 -32.148 -0.116 -4.815 1.00 2.54 O ATOM 216 CB ALA A 13 -30.255 -1.706 -2.221 1.00 2.70 C ATOM 0 H ALA A 13 -30.393 -1.524 -5.267 1.00 1.77 H new ATOM 0 HA ALA A 13 -32.012 -2.556 -3.102 1.00 2.14 H new ATOM 0 HB1 ALA A 13 -30.779 -1.374 -1.325 1.00 2.70 H new ATOM 0 HB2 ALA A 13 -29.795 -2.677 -2.034 1.00 2.70 H new ATOM 0 HB3 ALA A 13 -29.482 -0.982 -2.479 1.00 2.70 H new ATOM 222 N HIS A 14 -32.241 0.262 -2.588 1.00 2.38 N ATOM 223 CA HIS A 14 -32.890 1.584 -2.675 1.00 2.81 C ATOM 224 C HIS A 14 -34.344 1.445 -3.146 1.00 2.77 C ATOM 225 O HIS A 14 -35.149 0.794 -2.476 1.00 3.31 O ATOM 226 CB HIS A 14 -32.098 2.554 -3.579 1.00 3.51 C ATOM 227 CG HIS A 14 -30.699 2.820 -3.104 1.00 3.99 C ATOM 228 ND1 HIS A 14 -30.386 3.789 -2.185 1.00 4.73 N ATOM 229 CD2 HIS A 14 -29.511 2.249 -3.428 1.00 4.33 C ATOM 230 CE1 HIS A 14 -29.096 3.820 -1.955 1.00 5.34 C ATOM 231 NE2 HIS A 14 -28.524 2.888 -2.701 1.00 5.13 N ATOM 0 H HIS A 14 -32.054 -0.038 -1.631 1.00 2.38 H new ATOM 0 HA HIS A 14 -32.896 2.015 -1.674 1.00 2.81 H new ATOM 0 HB2 HIS A 14 -32.057 2.144 -4.588 1.00 3.51 H new ATOM 0 HB3 HIS A 14 -32.637 3.500 -3.641 1.00 3.51 H new ATOM 0 HD2 HIS A 14 -29.363 1.440 -4.128 1.00 4.33 H new ATOM 0 HE1 HIS A 14 -28.589 4.489 -1.276 1.00 5.34 H new ATOM 0 HE2 HIS A 14 -27.526 2.678 -2.734 1.00 5.13 H new ATOM 239 N ASN A 15 -34.690 2.059 -4.284 1.00 2.64 N ATOM 240 CA ASN A 15 -36.060 1.995 -4.807 1.00 2.83 C ATOM 241 C ASN A 15 -36.064 2.198 -6.324 1.00 2.48 C ATOM 242 O ASN A 15 -35.532 3.192 -6.826 1.00 2.96 O ATOM 243 CB ASN A 15 -36.929 3.068 -4.121 1.00 3.64 C ATOM 244 CG ASN A 15 -38.424 2.767 -4.285 1.00 4.19 C ATOM 245 OD1 ASN A 15 -38.814 1.710 -4.783 1.00 4.25 O ATOM 246 ND2 ASN A 15 -39.264 3.704 -3.875 1.00 4.99 N ATOM 0 H ASN A 15 -34.045 2.603 -4.857 1.00 2.64 H new ATOM 0 HA ASN A 15 -36.475 1.010 -4.593 1.00 2.83 H new ATOM 0 HB2 ASN A 15 -36.680 3.116 -3.061 1.00 3.64 H new ATOM 0 HB3 ASN A 15 -36.705 4.046 -4.546 1.00 3.64 H new ATOM 0 HD21 ASN A 15 -40.270 3.563 -3.967 1.00 4.99 H new ATOM 0 HD22 ASN A 15 -38.905 4.567 -3.467 1.00 4.99 H new ATOM 253 N LYS A 16 -36.676 1.244 -7.038 1.00 2.30 N ATOM 254 CA LYS A 16 -36.789 1.258 -8.506 1.00 2.46 C ATOM 255 C LYS A 16 -35.421 1.055 -9.179 1.00 2.10 C ATOM 256 O LYS A 16 -35.142 -0.033 -9.682 1.00 2.44 O ATOM 257 CB LYS A 16 -37.481 2.546 -8.999 1.00 3.26 C ATOM 258 CG LYS A 16 -38.954 2.579 -8.576 1.00 3.87 C ATOM 259 CD LYS A 16 -39.713 3.713 -9.275 1.00 4.83 C ATOM 260 CE LYS A 16 -40.032 3.364 -10.736 1.00 5.52 C ATOM 261 NZ LYS A 16 -39.668 4.475 -11.660 1.00 6.03 N ATOM 0 H LYS A 16 -37.113 0.429 -6.608 1.00 2.30 H new ATOM 0 HA LYS A 16 -37.417 0.416 -8.797 1.00 2.46 H new ATOM 0 HB2 LYS A 16 -36.964 3.417 -8.596 1.00 3.26 H new ATOM 0 HB3 LYS A 16 -37.410 2.608 -10.085 1.00 3.26 H new ATOM 0 HG2 LYS A 16 -39.424 1.625 -8.814 1.00 3.87 H new ATOM 0 HG3 LYS A 16 -39.021 2.707 -7.496 1.00 3.87 H new ATOM 0 HD2 LYS A 16 -40.640 3.916 -8.738 1.00 4.83 H new ATOM 0 HD3 LYS A 16 -39.118 4.625 -9.240 1.00 4.83 H new ATOM 0 HE2 LYS A 16 -39.491 2.462 -11.021 1.00 5.52 H new ATOM 0 HE3 LYS A 16 -41.095 3.143 -10.834 1.00 5.52 H new ATOM 0 HZ1 LYS A 16 -39.898 4.203 -12.637 1.00 6.03 H new ATOM 0 HZ2 LYS A 16 -40.203 5.329 -11.403 1.00 6.03 H new ATOM 0 HZ3 LYS A 16 -38.649 4.669 -11.585 1.00 6.03 H new ATOM 275 N LYS A 17 -34.576 2.086 -9.172 1.00 1.88 N ATOM 276 CA LYS A 17 -33.236 2.029 -9.766 1.00 1.62 C ATOM 277 C LYS A 17 -32.397 3.195 -9.241 1.00 1.62 C ATOM 278 O LYS A 17 -32.933 4.191 -8.744 1.00 2.06 O ATOM 279 CB LYS A 17 -33.310 2.105 -11.304 1.00 1.84 C ATOM 280 CG LYS A 17 -33.633 0.743 -11.934 1.00 2.30 C ATOM 281 CD LYS A 17 -32.931 0.564 -13.285 1.00 2.75 C ATOM 282 CE LYS A 17 -33.421 -0.697 -14.010 1.00 3.27 C ATOM 283 NZ LYS A 17 -32.311 -1.406 -14.717 1.00 3.75 N ATOM 0 H LYS A 17 -34.800 2.989 -8.753 1.00 1.88 H new ATOM 0 HA LYS A 17 -32.776 1.081 -9.488 1.00 1.62 H new ATOM 0 HB2 LYS A 17 -34.072 2.828 -11.595 1.00 1.84 H new ATOM 0 HB3 LYS A 17 -32.360 2.469 -11.695 1.00 1.84 H new ATOM 0 HG2 LYS A 17 -33.327 -0.054 -11.256 1.00 2.30 H new ATOM 0 HG3 LYS A 17 -34.711 0.650 -12.068 1.00 2.30 H new ATOM 0 HD2 LYS A 17 -33.113 1.438 -13.910 1.00 2.75 H new ATOM 0 HD3 LYS A 17 -31.854 0.501 -13.131 1.00 2.75 H new ATOM 0 HE2 LYS A 17 -33.882 -1.373 -13.290 1.00 3.27 H new ATOM 0 HE3 LYS A 17 -34.193 -0.424 -14.730 1.00 3.27 H new ATOM 0 HZ1 LYS A 17 -32.696 -1.936 -15.525 1.00 3.75 H new ATOM 0 HZ2 LYS A 17 -31.617 -0.711 -15.058 1.00 3.75 H new ATOM 0 HZ3 LYS A 17 -31.846 -2.065 -14.060 1.00 3.75 H new ATOM 297 N ALA A 18 -31.080 3.069 -9.372 1.00 1.43 N ATOM 298 CA ALA A 18 -30.137 4.102 -8.940 1.00 1.61 C ATOM 299 C ALA A 18 -29.645 4.879 -10.161 1.00 1.86 C ATOM 300 O ALA A 18 -28.601 4.560 -10.736 1.00 2.10 O ATOM 301 CB ALA A 18 -28.952 3.459 -8.206 1.00 1.58 C ATOM 0 H ALA A 18 -30.633 2.248 -9.781 1.00 1.43 H new ATOM 0 HA ALA A 18 -30.637 4.787 -8.255 1.00 1.61 H new ATOM 0 HB1 ALA A 18 -28.256 4.235 -7.889 1.00 1.58 H new ATOM 0 HB2 ALA A 18 -29.315 2.918 -7.332 1.00 1.58 H new ATOM 0 HB3 ALA A 18 -28.442 2.766 -8.875 1.00 1.58 H new ATOM 307 N SER A 19 -30.407 5.894 -10.553 1.00 2.24 N ATOM 308 CA SER A 19 -30.072 6.730 -11.713 1.00 2.71 C ATOM 309 C SER A 19 -29.098 7.849 -11.319 1.00 2.85 C ATOM 310 O SER A 19 -29.247 8.994 -11.743 1.00 3.33 O ATOM 311 CB SER A 19 -31.354 7.324 -12.310 1.00 3.28 C ATOM 312 OG SER A 19 -32.402 6.357 -12.339 1.00 3.62 O ATOM 0 H SER A 19 -31.271 6.164 -10.083 1.00 2.24 H new ATOM 0 HA SER A 19 -29.583 6.107 -12.462 1.00 2.71 H new ATOM 0 HB2 SER A 19 -31.667 8.187 -11.722 1.00 3.28 H new ATOM 0 HB3 SER A 19 -31.157 7.682 -13.321 1.00 3.28 H new ATOM 0 HG SER A 19 -33.209 6.760 -12.722 1.00 3.62 H new ATOM 318 N SER A 20 -28.103 7.498 -10.507 1.00 2.92 N ATOM 319 CA SER A 20 -27.089 8.449 -10.042 1.00 3.46 C ATOM 320 C SER A 20 -25.812 8.300 -10.879 1.00 3.36 C ATOM 321 O SER A 20 -25.634 7.306 -11.597 1.00 3.74 O ATOM 322 CB SER A 20 -26.777 8.209 -8.547 1.00 4.13 C ATOM 323 OG SER A 20 -27.657 7.241 -7.972 1.00 4.31 O ATOM 0 H SER A 20 -27.975 6.550 -10.152 1.00 2.92 H new ATOM 0 HA SER A 20 -27.474 9.462 -10.159 1.00 3.46 H new ATOM 0 HB2 SER A 20 -25.746 7.872 -8.440 1.00 4.13 H new ATOM 0 HB3 SER A 20 -26.864 9.149 -8.002 1.00 4.13 H new ATOM 0 HG SER A 20 -27.430 7.113 -7.027 1.00 4.31 H new ATOM 329 N ARG A 21 -24.913 9.277 -10.771 1.00 3.28 N ATOM 330 CA ARG A 21 -23.637 9.253 -11.497 1.00 3.37 C ATOM 331 C ARG A 21 -22.608 8.408 -10.728 1.00 2.30 C ATOM 332 O ARG A 21 -21.471 8.837 -10.507 1.00 2.78 O ATOM 333 CB ARG A 21 -23.114 10.684 -11.692 1.00 4.44 C ATOM 334 CG ARG A 21 -22.075 10.752 -12.816 1.00 5.18 C ATOM 335 CD ARG A 21 -21.185 11.988 -12.677 1.00 5.89 C ATOM 336 NE ARG A 21 -20.100 11.746 -11.719 1.00 6.25 N ATOM 337 CZ ARG A 21 -19.413 12.747 -11.178 1.00 6.92 C ATOM 338 NH1 ARG A 21 -19.865 13.342 -10.081 1.00 7.43 N ATOM 339 NH2 ARG A 21 -18.278 13.144 -11.736 1.00 7.30 N ATOM 0 H ARG A 21 -25.043 10.101 -10.185 1.00 3.28 H new ATOM 0 HA ARG A 21 -23.796 8.803 -12.477 1.00 3.37 H new ATOM 0 HB2 ARG A 21 -23.946 11.349 -11.923 1.00 4.44 H new ATOM 0 HB3 ARG A 21 -22.670 11.041 -10.762 1.00 4.44 H new ATOM 0 HG2 ARG A 21 -21.458 9.853 -12.799 1.00 5.18 H new ATOM 0 HG3 ARG A 21 -22.581 10.773 -13.781 1.00 5.18 H new ATOM 0 HD2 ARG A 21 -20.766 12.251 -13.648 1.00 5.89 H new ATOM 0 HD3 ARG A 21 -21.784 12.837 -12.348 1.00 5.89 H new ATOM 0 HE ARG A 21 -19.867 10.787 -11.462 1.00 6.25 H new ATOM 0 HH11 ARG A 21 -20.738 13.031 -9.655 1.00 7.43 H new ATOM 0 HH12 ARG A 21 -19.339 14.110 -9.664 1.00 7.43 H new ATOM 0 HH21 ARG A 21 -17.935 12.682 -12.578 1.00 7.30 H new ATOM 0 HH22 ARG A 21 -17.748 13.912 -11.324 1.00 7.30 H new ATOM 353 N SER A 22 -23.023 7.210 -10.317 1.00 1.32 N ATOM 354 CA SER A 22 -22.169 6.287 -9.571 1.00 0.74 C ATOM 355 C SER A 22 -21.298 5.495 -10.543 1.00 0.68 C ATOM 356 O SER A 22 -21.751 4.529 -11.148 1.00 1.69 O ATOM 357 CB SER A 22 -23.029 5.334 -8.709 1.00 1.62 C ATOM 358 OG SER A 22 -24.405 5.710 -8.726 1.00 1.86 O ATOM 0 H SER A 22 -23.962 6.852 -10.492 1.00 1.32 H new ATOM 0 HA SER A 22 -21.524 6.858 -8.903 1.00 0.74 H new ATOM 0 HB2 SER A 22 -22.925 4.314 -9.079 1.00 1.62 H new ATOM 0 HB3 SER A 22 -22.662 5.340 -7.683 1.00 1.62 H new ATOM 0 HG SER A 22 -24.830 5.361 -9.537 1.00 1.86 H new ATOM 364 N TRP A 23 -20.049 5.916 -10.682 1.00 0.69 N ATOM 365 CA TRP A 23 -19.085 5.268 -11.575 1.00 0.41 C ATOM 366 C TRP A 23 -17.755 5.126 -10.837 1.00 0.40 C ATOM 367 O TRP A 23 -16.951 6.060 -10.804 1.00 0.55 O ATOM 368 CB TRP A 23 -18.915 6.096 -12.870 1.00 0.43 C ATOM 369 CG TRP A 23 -19.885 5.705 -13.956 1.00 0.40 C ATOM 370 CD1 TRP A 23 -20.954 6.431 -14.413 1.00 0.45 C ATOM 371 CD2 TRP A 23 -19.867 4.484 -14.728 1.00 0.34 C ATOM 372 NE1 TRP A 23 -21.582 5.715 -15.397 1.00 0.42 N ATOM 373 CE2 TRP A 23 -20.947 4.529 -15.618 1.00 0.36 C ATOM 374 CE3 TRP A 23 -19.041 3.359 -14.746 1.00 0.30 C ATOM 375 CZ2 TRP A 23 -21.214 3.490 -16.504 1.00 0.35 C ATOM 376 CZ3 TRP A 23 -19.297 2.326 -15.626 1.00 0.29 C ATOM 377 CH2 TRP A 23 -20.374 2.389 -16.500 1.00 0.31 C ATOM 0 H TRP A 23 -19.670 6.718 -10.179 1.00 0.69 H new ATOM 0 HA TRP A 23 -19.445 4.280 -11.860 1.00 0.41 H new ATOM 0 HB2 TRP A 23 -19.046 7.153 -12.638 1.00 0.43 H new ATOM 0 HB3 TRP A 23 -17.897 5.975 -13.240 1.00 0.43 H new ATOM 0 HD1 TRP A 23 -21.252 7.406 -14.056 1.00 0.45 H new ATOM 0 HE1 TRP A 23 -22.414 6.027 -15.898 1.00 0.42 H new ATOM 0 HE3 TRP A 23 -18.200 3.296 -14.071 1.00 0.30 H new ATOM 0 HZ2 TRP A 23 -22.056 3.541 -17.179 1.00 0.35 H new ATOM 0 HZ3 TRP A 23 -18.652 1.460 -15.634 1.00 0.29 H new ATOM 0 HH2 TRP A 23 -20.558 1.572 -17.182 1.00 0.31 H new ATOM 388 N HIS A 24 -17.537 3.956 -10.233 1.00 0.37 N ATOM 389 CA HIS A 24 -16.310 3.672 -9.473 1.00 0.45 C ATOM 390 C HIS A 24 -15.403 2.722 -10.255 1.00 0.36 C ATOM 391 O HIS A 24 -15.863 1.726 -10.819 1.00 0.34 O ATOM 392 CB HIS A 24 -16.637 3.072 -8.081 1.00 0.61 C ATOM 393 CG HIS A 24 -17.774 2.080 -8.064 1.00 1.18 C ATOM 394 ND1 HIS A 24 -19.095 2.448 -8.052 1.00 2.08 N ATOM 395 CD2 HIS A 24 -17.791 0.722 -8.047 1.00 1.66 C ATOM 396 CE1 HIS A 24 -19.879 1.396 -8.026 1.00 2.98 C ATOM 397 NE2 HIS A 24 -19.114 0.314 -8.022 1.00 2.74 N ATOM 0 H HIS A 24 -18.199 3.181 -10.254 1.00 0.37 H new ATOM 0 HA HIS A 24 -15.787 4.616 -9.322 1.00 0.45 H new ATOM 0 HB2 HIS A 24 -15.743 2.583 -7.694 1.00 0.61 H new ATOM 0 HB3 HIS A 24 -16.876 3.887 -7.398 1.00 0.61 H new ATOM 0 HD1 HIS A 24 -19.425 3.413 -8.062 1.00 2.08 H new ATOM 0 HD2 HIS A 24 -16.926 0.075 -8.052 1.00 1.66 H new ATOM 0 HE1 HIS A 24 -20.959 1.410 -8.011 1.00 2.98 H new ATOM 405 N ASN A 25 -14.107 3.031 -10.259 1.00 0.37 N ATOM 406 CA ASN A 25 -13.098 2.213 -10.935 1.00 0.35 C ATOM 407 C ASN A 25 -12.672 1.102 -9.977 1.00 0.34 C ATOM 408 O ASN A 25 -12.045 1.375 -8.951 1.00 0.55 O ATOM 409 CB ASN A 25 -11.895 3.093 -11.322 1.00 0.44 C ATOM 410 CG ASN A 25 -10.909 2.343 -12.230 1.00 0.99 C ATOM 411 OD1 ASN A 25 -11.296 1.462 -12.999 1.00 1.71 O ATOM 412 ND2 ASN A 25 -9.634 2.700 -12.144 1.00 1.49 N ATOM 0 H ASN A 25 -13.726 3.855 -9.794 1.00 0.37 H new ATOM 0 HA ASN A 25 -13.502 1.774 -11.847 1.00 0.35 H new ATOM 0 HB2 ASN A 25 -12.249 3.989 -11.832 1.00 0.44 H new ATOM 0 HB3 ASN A 25 -11.380 3.422 -10.419 1.00 0.44 H new ATOM 0 HD21 ASN A 25 -8.935 2.240 -12.727 1.00 1.49 H new ATOM 0 HD22 ASN A 25 -9.353 3.435 -11.495 1.00 1.49 H new ATOM 419 N VAL A 26 -13.046 -0.133 -10.293 1.00 0.22 N ATOM 420 CA VAL A 26 -12.738 -1.286 -9.447 1.00 0.21 C ATOM 421 C VAL A 26 -11.968 -2.347 -10.237 1.00 0.18 C ATOM 422 O VAL A 26 -12.067 -2.426 -11.463 1.00 0.23 O ATOM 423 CB VAL A 26 -14.054 -1.852 -8.877 1.00 0.25 C ATOM 424 CG1 VAL A 26 -14.865 -2.599 -9.944 1.00 0.31 C ATOM 425 CG2 VAL A 26 -13.796 -2.755 -7.672 1.00 0.31 C ATOM 0 H VAL A 26 -13.569 -0.365 -11.138 1.00 0.22 H new ATOM 0 HA VAL A 26 -12.098 -0.976 -8.621 1.00 0.21 H new ATOM 0 HB VAL A 26 -14.646 -0.999 -8.545 1.00 0.25 H new ATOM 0 HG11 VAL A 26 -15.784 -2.982 -9.501 1.00 0.31 H new ATOM 0 HG12 VAL A 26 -15.111 -1.917 -10.758 1.00 0.31 H new ATOM 0 HG13 VAL A 26 -14.276 -3.430 -10.333 1.00 0.31 H new ATOM 0 HG21 VAL A 26 -14.744 -3.137 -7.294 1.00 0.31 H new ATOM 0 HG22 VAL A 26 -13.162 -3.589 -7.972 1.00 0.31 H new ATOM 0 HG23 VAL A 26 -13.298 -2.183 -6.889 1.00 0.31 H new ATOM 435 N TYR A 27 -11.202 -3.165 -9.519 1.00 0.16 N ATOM 436 CA TYR A 27 -10.407 -4.239 -10.121 1.00 0.16 C ATOM 437 C TYR A 27 -11.173 -5.556 -10.000 1.00 0.19 C ATOM 438 O TYR A 27 -11.378 -6.066 -8.894 1.00 0.34 O ATOM 439 CB TYR A 27 -9.051 -4.326 -9.415 1.00 0.17 C ATOM 440 CG TYR A 27 -8.000 -5.068 -10.214 1.00 0.18 C ATOM 441 CD1 TYR A 27 -7.229 -4.389 -11.143 1.00 0.28 C ATOM 442 CD2 TYR A 27 -7.794 -6.423 -10.011 1.00 0.26 C ATOM 443 CE1 TYR A 27 -6.262 -5.063 -11.869 1.00 0.33 C ATOM 444 CE2 TYR A 27 -6.827 -7.096 -10.742 1.00 0.30 C ATOM 445 CZ TYR A 27 -6.063 -6.412 -11.663 1.00 0.29 C ATOM 446 OH TYR A 27 -5.100 -7.079 -12.385 1.00 0.37 O ATOM 0 H TYR A 27 -11.113 -3.104 -8.505 1.00 0.16 H new ATOM 0 HA TYR A 27 -10.231 -4.033 -11.177 1.00 0.16 H new ATOM 0 HB2 TYR A 27 -8.693 -3.318 -9.207 1.00 0.17 H new ATOM 0 HB3 TYR A 27 -9.182 -4.822 -8.453 1.00 0.17 H new ATOM 0 HD1 TYR A 27 -7.383 -3.332 -11.301 1.00 0.28 H new ATOM 0 HD2 TYR A 27 -8.387 -6.956 -9.283 1.00 0.26 H new ATOM 0 HE1 TYR A 27 -5.664 -4.533 -12.596 1.00 0.33 H new ATOM 0 HE2 TYR A 27 -6.673 -8.154 -10.590 1.00 0.30 H new ATOM 0 HH TYR A 27 -5.087 -8.022 -12.120 1.00 0.37 H new ATOM 456 N CYS A 28 -11.612 -6.087 -11.136 1.00 0.16 N ATOM 457 CA CYS A 28 -12.382 -7.334 -11.181 1.00 0.19 C ATOM 458 C CYS A 28 -11.472 -8.525 -11.483 1.00 0.19 C ATOM 459 O CYS A 28 -10.683 -8.490 -12.428 1.00 0.23 O ATOM 460 CB CYS A 28 -13.470 -7.222 -12.253 1.00 0.23 C ATOM 461 SG CYS A 28 -14.571 -5.822 -11.976 1.00 0.34 S ATOM 0 H CYS A 28 -11.447 -5.670 -12.052 1.00 0.16 H new ATOM 0 HA CYS A 28 -12.843 -7.497 -10.207 1.00 0.19 H new ATOM 0 HB2 CYS A 28 -13.002 -7.123 -13.232 1.00 0.23 H new ATOM 0 HB3 CYS A 28 -14.055 -8.142 -12.270 1.00 0.23 H new ATOM 0 HG CYS A 28 -15.272 -6.027 -10.900 1.00 0.34 H new ATOM 467 N VAL A 29 -11.590 -9.574 -10.675 1.00 0.21 N ATOM 468 CA VAL A 29 -10.792 -10.789 -10.840 1.00 0.24 C ATOM 469 C VAL A 29 -11.724 -11.995 -10.956 1.00 0.26 C ATOM 470 O VAL A 29 -12.434 -12.322 -10.005 1.00 0.38 O ATOM 471 CB VAL A 29 -9.851 -10.965 -9.632 1.00 0.29 C ATOM 472 CG1 VAL A 29 -9.142 -12.321 -9.669 1.00 0.37 C ATOM 473 CG2 VAL A 29 -8.817 -9.840 -9.567 1.00 0.33 C ATOM 0 H VAL A 29 -12.239 -9.608 -9.889 1.00 0.21 H new ATOM 0 HA VAL A 29 -10.191 -10.709 -11.746 1.00 0.24 H new ATOM 0 HB VAL A 29 -10.470 -10.923 -8.736 1.00 0.29 H new ATOM 0 HG11 VAL A 29 -8.486 -12.412 -8.803 1.00 0.37 H new ATOM 0 HG12 VAL A 29 -9.883 -13.120 -9.649 1.00 0.37 H new ATOM 0 HG13 VAL A 29 -8.551 -12.398 -10.582 1.00 0.37 H new ATOM 0 HG21 VAL A 29 -8.168 -9.992 -8.705 1.00 0.33 H new ATOM 0 HG22 VAL A 29 -8.218 -9.844 -10.477 1.00 0.33 H new ATOM 0 HG23 VAL A 29 -9.328 -8.882 -9.473 1.00 0.33 H new ATOM 483 N ILE A 30 -11.713 -12.658 -12.116 1.00 0.28 N ATOM 484 CA ILE A 30 -12.552 -13.842 -12.347 1.00 0.32 C ATOM 485 C ILE A 30 -11.803 -15.097 -11.890 1.00 0.35 C ATOM 486 O ILE A 30 -10.724 -15.405 -12.400 1.00 0.44 O ATOM 487 CB ILE A 30 -12.917 -13.973 -13.834 1.00 0.40 C ATOM 488 CG1 ILE A 30 -13.492 -12.657 -14.375 1.00 0.47 C ATOM 489 CG2 ILE A 30 -13.917 -15.114 -14.043 1.00 0.50 C ATOM 490 CD1 ILE A 30 -13.819 -12.753 -15.864 1.00 0.57 C ATOM 0 H ILE A 30 -11.132 -12.396 -12.912 1.00 0.28 H new ATOM 0 HA ILE A 30 -13.473 -13.731 -11.774 1.00 0.32 H new ATOM 0 HB ILE A 30 -12.005 -14.201 -14.386 1.00 0.40 H new ATOM 0 HG12 ILE A 30 -14.394 -12.399 -13.820 1.00 0.47 H new ATOM 0 HG13 ILE A 30 -12.775 -11.852 -14.211 1.00 0.47 H new ATOM 0 HG21 ILE A 30 -14.164 -15.192 -15.102 1.00 0.50 H new ATOM 0 HG22 ILE A 30 -13.476 -16.051 -13.703 1.00 0.50 H new ATOM 0 HG23 ILE A 30 -14.824 -14.912 -13.473 1.00 0.50 H new ATOM 0 HD11 ILE A 30 -14.224 -11.802 -16.210 1.00 0.57 H new ATOM 0 HD12 ILE A 30 -12.912 -12.985 -16.422 1.00 0.57 H new ATOM 0 HD13 ILE A 30 -14.555 -13.540 -16.025 1.00 0.57 H new ATOM 502 N ASN A 31 -12.389 -15.821 -10.938 1.00 0.46 N ATOM 503 CA ASN A 31 -11.801 -17.056 -10.403 1.00 0.58 C ATOM 504 C ASN A 31 -12.595 -18.270 -10.901 1.00 0.71 C ATOM 505 O ASN A 31 -12.903 -19.182 -10.133 1.00 1.20 O ATOM 506 CB ASN A 31 -11.791 -17.007 -8.865 1.00 0.73 C ATOM 507 CG ASN A 31 -10.840 -18.061 -8.290 1.00 0.93 C ATOM 508 OD1 ASN A 31 -9.659 -18.100 -8.638 1.00 1.27 O ATOM 509 ND2 ASN A 31 -11.345 -18.914 -7.412 1.00 1.47 N ATOM 0 H ASN A 31 -13.283 -15.572 -10.514 1.00 0.46 H new ATOM 0 HA ASN A 31 -10.773 -17.148 -10.753 1.00 0.58 H new ATOM 0 HB2 ASN A 31 -11.486 -16.015 -8.531 1.00 0.73 H new ATOM 0 HB3 ASN A 31 -12.799 -17.175 -8.485 1.00 0.73 H new ATOM 0 HD21 ASN A 31 -10.751 -19.634 -7.000 1.00 1.47 H new ATOM 0 HD22 ASN A 31 -12.328 -18.851 -7.148 1.00 1.47 H new ATOM 516 N ASN A 32 -12.913 -18.266 -12.202 1.00 0.85 N ATOM 517 CA ASN A 32 -13.666 -19.353 -12.863 1.00 1.00 C ATOM 518 C ASN A 32 -15.078 -19.504 -12.272 1.00 1.00 C ATOM 519 O ASN A 32 -15.252 -20.095 -11.203 1.00 1.97 O ATOM 520 CB ASN A 32 -12.903 -20.692 -12.771 1.00 1.24 C ATOM 521 CG ASN A 32 -11.729 -20.723 -13.757 1.00 1.73 C ATOM 522 OD1 ASN A 32 -11.920 -20.902 -14.960 1.00 2.06 O ATOM 523 ND2 ASN A 32 -10.512 -20.551 -13.256 1.00 2.52 N ATOM 0 H ASN A 32 -12.656 -17.507 -12.833 1.00 0.85 H new ATOM 0 HA ASN A 32 -13.767 -19.082 -13.914 1.00 1.00 H new ATOM 0 HB2 ASN A 32 -12.534 -20.836 -11.756 1.00 1.24 H new ATOM 0 HB3 ASN A 32 -13.583 -21.517 -12.983 1.00 1.24 H new ATOM 0 HD21 ASN A 32 -9.700 -20.565 -13.873 1.00 2.52 H new ATOM 0 HD22 ASN A 32 -10.389 -20.405 -12.254 1.00 2.52 H new ATOM 530 N GLN A 33 -16.080 -18.968 -12.983 1.00 0.75 N ATOM 531 CA GLN A 33 -17.502 -19.026 -12.570 1.00 0.67 C ATOM 532 C GLN A 33 -17.846 -17.909 -11.571 1.00 0.56 C ATOM 533 O GLN A 33 -18.944 -17.318 -11.645 1.00 0.71 O ATOM 534 CB GLN A 33 -17.859 -20.401 -11.974 1.00 0.83 C ATOM 535 CG GLN A 33 -19.347 -20.715 -12.149 1.00 1.46 C ATOM 536 CD GLN A 33 -19.776 -21.807 -11.172 1.00 1.85 C ATOM 537 OE1 GLN A 33 -20.344 -21.521 -10.118 1.00 2.11 O ATOM 538 NE2 GLN A 33 -19.496 -23.053 -11.515 1.00 2.67 N ATOM 0 H GLN A 33 -15.933 -18.478 -13.866 1.00 0.75 H new ATOM 0 HA GLN A 33 -18.100 -18.875 -13.469 1.00 0.67 H new ATOM 0 HB2 GLN A 33 -17.263 -21.175 -12.457 1.00 0.83 H new ATOM 0 HB3 GLN A 33 -17.604 -20.417 -10.914 1.00 0.83 H new ATOM 0 HG2 GLN A 33 -19.938 -19.815 -11.981 1.00 1.46 H new ATOM 0 HG3 GLN A 33 -19.540 -21.037 -13.172 1.00 1.46 H new ATOM 0 HE21 GLN A 33 -19.024 -23.245 -12.399 1.00 2.67 H new ATOM 0 HE22 GLN A 33 -19.752 -23.822 -10.896 1.00 2.67 H new ATOM 547 N GLU A 34 -16.911 -17.634 -10.640 1.00 0.53 N ATOM 548 CA GLU A 34 -17.085 -16.598 -9.616 1.00 0.49 C ATOM 549 C GLU A 34 -16.041 -15.497 -9.807 1.00 0.45 C ATOM 550 O GLU A 34 -15.011 -15.717 -10.444 1.00 0.64 O ATOM 551 CB GLU A 34 -16.947 -17.216 -8.217 1.00 0.61 C ATOM 552 CG GLU A 34 -15.771 -18.211 -8.145 1.00 1.25 C ATOM 553 CD GLU A 34 -14.961 -18.053 -6.857 1.00 1.42 C ATOM 554 OE1 GLU A 34 -15.335 -17.237 -5.993 1.00 1.79 O ATOM 555 OE2 GLU A 34 -13.930 -18.743 -6.720 1.00 1.89 O ATOM 0 H GLU A 34 -16.019 -18.125 -10.581 1.00 0.53 H new ATOM 0 HA GLU A 34 -18.080 -16.164 -9.714 1.00 0.49 H new ATOM 0 HB2 GLU A 34 -16.799 -16.424 -7.483 1.00 0.61 H new ATOM 0 HB3 GLU A 34 -17.873 -17.727 -7.952 1.00 0.61 H new ATOM 0 HG2 GLU A 34 -16.154 -19.229 -8.209 1.00 1.25 H new ATOM 0 HG3 GLU A 34 -15.117 -18.062 -9.004 1.00 1.25 H new ATOM 562 N MET A 35 -16.303 -14.318 -9.252 1.00 0.36 N ATOM 563 CA MET A 35 -15.379 -13.187 -9.361 1.00 0.35 C ATOM 564 C MET A 35 -15.277 -12.445 -8.029 1.00 0.32 C ATOM 565 O MET A 35 -16.107 -12.627 -7.131 1.00 0.42 O ATOM 566 CB MET A 35 -15.835 -12.233 -10.473 1.00 0.41 C ATOM 567 CG MET A 35 -17.198 -11.604 -10.164 1.00 0.43 C ATOM 568 SD MET A 35 -17.910 -10.760 -11.590 1.00 0.60 S ATOM 569 CE MET A 35 -16.883 -9.281 -11.682 1.00 1.25 C ATOM 0 H MET A 35 -17.150 -14.117 -8.720 1.00 0.36 H new ATOM 0 HA MET A 35 -14.391 -13.571 -9.615 1.00 0.35 H new ATOM 0 HB2 MET A 35 -15.093 -11.445 -10.602 1.00 0.41 H new ATOM 0 HB3 MET A 35 -15.891 -12.776 -11.416 1.00 0.41 H new ATOM 0 HG2 MET A 35 -17.884 -12.380 -9.826 1.00 0.43 H new ATOM 0 HG3 MET A 35 -17.089 -10.895 -9.343 1.00 0.43 H new ATOM 0 HE1 MET A 35 -17.488 -8.438 -12.016 1.00 1.25 H new ATOM 0 HE2 MET A 35 -16.469 -9.063 -10.697 1.00 1.25 H new ATOM 0 HE3 MET A 35 -16.070 -9.446 -12.389 1.00 1.25 H new ATOM 579 N GLY A 36 -14.254 -11.602 -7.916 1.00 0.27 N ATOM 580 CA GLY A 36 -14.008 -10.808 -6.712 1.00 0.29 C ATOM 581 C GLY A 36 -13.694 -9.360 -7.086 1.00 0.25 C ATOM 582 O GLY A 36 -13.013 -9.104 -8.085 1.00 0.28 O ATOM 0 H GLY A 36 -13.570 -11.449 -8.657 1.00 0.27 H new ATOM 0 HA2 GLY A 36 -14.882 -10.841 -6.061 1.00 0.29 H new ATOM 0 HA3 GLY A 36 -13.176 -11.234 -6.151 1.00 0.29 H new ATOM 586 N PHE A 37 -14.200 -8.422 -6.285 1.00 0.24 N ATOM 587 CA PHE A 37 -13.990 -6.984 -6.513 1.00 0.25 C ATOM 588 C PHE A 37 -12.923 -6.442 -5.558 1.00 0.25 C ATOM 589 O PHE A 37 -13.117 -6.426 -4.340 1.00 0.40 O ATOM 590 CB PHE A 37 -15.309 -6.227 -6.313 1.00 0.30 C ATOM 591 CG PHE A 37 -16.342 -6.565 -7.362 1.00 0.28 C ATOM 592 CD1 PHE A 37 -16.248 -6.025 -8.635 1.00 0.39 C ATOM 593 CD2 PHE A 37 -17.390 -7.415 -7.049 1.00 0.43 C ATOM 594 CE1 PHE A 37 -17.202 -6.334 -9.590 1.00 0.41 C ATOM 595 CE2 PHE A 37 -18.341 -7.723 -8.002 1.00 0.45 C ATOM 596 CZ PHE A 37 -18.224 -7.187 -9.297 1.00 0.33 C ATOM 0 H PHE A 37 -14.765 -8.632 -5.462 1.00 0.24 H new ATOM 0 HA PHE A 37 -13.646 -6.838 -7.537 1.00 0.25 H new ATOM 0 HB2 PHE A 37 -15.710 -6.459 -5.326 1.00 0.30 H new ATOM 0 HB3 PHE A 37 -15.114 -5.155 -6.334 1.00 0.30 H new ATOM 0 HD1 PHE A 37 -15.431 -5.363 -8.882 1.00 0.39 H new ATOM 0 HD2 PHE A 37 -17.464 -7.838 -6.058 1.00 0.43 H new ATOM 0 HE1 PHE A 37 -17.136 -5.896 -10.575 1.00 0.41 H new ATOM 0 HE2 PHE A 37 -19.169 -8.371 -7.754 1.00 0.45 H new ATOM 0 HZ PHE A 37 -18.943 -7.451 -10.058 1.00 0.33 H new ATOM 606 N TYR A 38 -11.794 -6.002 -6.121 1.00 0.20 N ATOM 607 CA TYR A 38 -10.669 -5.465 -5.337 1.00 0.21 C ATOM 608 C TYR A 38 -10.294 -4.053 -5.804 1.00 0.21 C ATOM 609 O TYR A 38 -10.863 -3.529 -6.763 1.00 0.23 O ATOM 610 CB TYR A 38 -9.466 -6.404 -5.475 1.00 0.23 C ATOM 611 CG TYR A 38 -9.792 -7.827 -5.074 1.00 0.27 C ATOM 612 CD1 TYR A 38 -9.724 -8.203 -3.745 1.00 0.42 C ATOM 613 CD2 TYR A 38 -10.171 -8.753 -6.032 1.00 0.27 C ATOM 614 CE1 TYR A 38 -10.033 -9.497 -3.370 1.00 0.50 C ATOM 615 CE2 TYR A 38 -10.478 -10.051 -5.657 1.00 0.35 C ATOM 616 CZ TYR A 38 -10.406 -10.416 -4.329 1.00 0.44 C ATOM 617 OH TYR A 38 -10.712 -11.705 -3.956 1.00 0.55 O ATOM 0 H TYR A 38 -11.631 -6.006 -7.128 1.00 0.20 H new ATOM 0 HA TYR A 38 -10.969 -5.401 -4.291 1.00 0.21 H new ATOM 0 HB2 TYR A 38 -9.116 -6.392 -6.507 1.00 0.23 H new ATOM 0 HB3 TYR A 38 -8.648 -6.034 -4.857 1.00 0.23 H new ATOM 0 HD1 TYR A 38 -9.428 -7.482 -2.997 1.00 0.42 H new ATOM 0 HD2 TYR A 38 -10.227 -8.463 -7.071 1.00 0.27 H new ATOM 0 HE1 TYR A 38 -9.983 -9.787 -2.331 1.00 0.50 H new ATOM 0 HE2 TYR A 38 -10.773 -10.775 -6.402 1.00 0.35 H new ATOM 0 HH TYR A 38 -10.956 -12.226 -4.749 1.00 0.55 H new ATOM 627 N LYS A 39 -9.333 -3.435 -5.107 1.00 0.25 N ATOM 628 CA LYS A 39 -8.877 -2.076 -5.431 1.00 0.29 C ATOM 629 C LYS A 39 -7.923 -2.078 -6.633 1.00 0.28 C ATOM 630 O LYS A 39 -7.991 -1.188 -7.478 1.00 0.33 O ATOM 631 CB LYS A 39 -8.200 -1.463 -4.198 1.00 0.36 C ATOM 632 CG LYS A 39 -7.634 -0.059 -4.463 1.00 0.70 C ATOM 633 CD LYS A 39 -7.965 0.916 -3.323 1.00 1.15 C ATOM 634 CE LYS A 39 -7.633 0.327 -1.943 1.00 1.82 C ATOM 635 NZ LYS A 39 -6.518 1.058 -1.280 1.00 2.51 N ATOM 0 H LYS A 39 -8.854 -3.856 -4.311 1.00 0.25 H new ATOM 0 HA LYS A 39 -9.741 -1.472 -5.707 1.00 0.29 H new ATOM 0 HB2 LYS A 39 -8.921 -1.411 -3.382 1.00 0.36 H new ATOM 0 HB3 LYS A 39 -7.394 -2.118 -3.869 1.00 0.36 H new ATOM 0 HG2 LYS A 39 -6.553 -0.121 -4.586 1.00 0.70 H new ATOM 0 HG3 LYS A 39 -8.040 0.325 -5.399 1.00 0.70 H new ATOM 0 HD2 LYS A 39 -7.407 1.842 -3.465 1.00 1.15 H new ATOM 0 HD3 LYS A 39 -9.024 1.172 -3.362 1.00 1.15 H new ATOM 0 HE2 LYS A 39 -8.519 0.365 -1.310 1.00 1.82 H new ATOM 0 HE3 LYS A 39 -7.364 -0.724 -2.052 1.00 1.82 H new ATOM 0 HZ1 LYS A 39 -6.325 0.630 -0.352 1.00 2.51 H new ATOM 0 HZ2 LYS A 39 -5.665 1.000 -1.872 1.00 2.51 H new ATOM 0 HZ3 LYS A 39 -6.784 2.055 -1.152 1.00 2.51 H new ATOM 649 N ASP A 40 -7.043 -3.075 -6.710 1.00 0.28 N ATOM 650 CA ASP A 40 -6.079 -3.188 -7.815 1.00 0.32 C ATOM 651 C ASP A 40 -5.480 -4.597 -7.853 1.00 0.33 C ATOM 652 O ASP A 40 -5.941 -5.496 -7.143 1.00 0.32 O ATOM 653 CB ASP A 40 -4.966 -2.112 -7.697 1.00 0.38 C ATOM 654 CG ASP A 40 -3.870 -2.505 -6.698 1.00 0.57 C ATOM 655 OD1 ASP A 40 -4.203 -2.836 -5.540 1.00 0.84 O ATOM 656 OD2 ASP A 40 -2.678 -2.471 -7.067 1.00 0.94 O ATOM 0 H ASP A 40 -6.974 -3.822 -6.019 1.00 0.28 H new ATOM 0 HA ASP A 40 -6.607 -3.013 -8.752 1.00 0.32 H new ATOM 0 HB2 ASP A 40 -4.518 -1.949 -8.677 1.00 0.38 H new ATOM 0 HB3 ASP A 40 -5.411 -1.166 -7.389 1.00 0.38 H new ATOM 661 N ALA A 41 -4.446 -4.776 -8.681 1.00 0.40 N ATOM 662 CA ALA A 41 -3.758 -6.071 -8.818 1.00 0.45 C ATOM 663 C ALA A 41 -3.104 -6.501 -7.497 1.00 0.45 C ATOM 664 O ALA A 41 -3.169 -7.671 -7.118 1.00 0.47 O ATOM 665 CB ALA A 41 -2.699 -5.987 -9.920 1.00 0.55 C ATOM 0 H ALA A 41 -4.063 -4.038 -9.271 1.00 0.40 H new ATOM 0 HA ALA A 41 -4.503 -6.820 -9.085 1.00 0.45 H new ATOM 0 HB1 ALA A 41 -2.195 -6.949 -10.014 1.00 0.55 H new ATOM 0 HB2 ALA A 41 -3.178 -5.734 -10.866 1.00 0.55 H new ATOM 0 HB3 ALA A 41 -1.969 -5.219 -9.665 1.00 0.55 H new ATOM 671 N LYS A 42 -2.491 -5.547 -6.788 1.00 0.46 N ATOM 672 CA LYS A 42 -1.838 -5.823 -5.501 1.00 0.48 C ATOM 673 C LYS A 42 -2.881 -6.204 -4.447 1.00 0.43 C ATOM 674 O LYS A 42 -2.724 -7.201 -3.735 1.00 0.47 O ATOM 675 CB LYS A 42 -1.049 -4.596 -5.035 1.00 0.54 C ATOM 676 CG LYS A 42 0.111 -4.279 -5.987 1.00 0.77 C ATOM 677 CD LYS A 42 1.170 -3.412 -5.305 1.00 1.12 C ATOM 678 CE LYS A 42 2.144 -4.264 -4.476 1.00 1.96 C ATOM 679 NZ LYS A 42 2.511 -3.589 -3.200 1.00 2.76 N ATOM 0 H LYS A 42 -2.433 -4.573 -7.084 1.00 0.46 H new ATOM 0 HA LYS A 42 -1.150 -6.658 -5.633 1.00 0.48 H new ATOM 0 HB2 LYS A 42 -1.715 -3.736 -4.973 1.00 0.54 H new ATOM 0 HB3 LYS A 42 -0.660 -4.771 -4.032 1.00 0.54 H new ATOM 0 HG2 LYS A 42 0.565 -5.208 -6.331 1.00 0.77 H new ATOM 0 HG3 LYS A 42 -0.270 -3.764 -6.869 1.00 0.77 H new ATOM 0 HD2 LYS A 42 1.724 -2.852 -6.058 1.00 1.12 H new ATOM 0 HD3 LYS A 42 0.683 -2.681 -4.659 1.00 1.12 H new ATOM 0 HE2 LYS A 42 1.690 -5.231 -4.260 1.00 1.96 H new ATOM 0 HE3 LYS A 42 3.045 -4.458 -5.058 1.00 1.96 H new ATOM 0 HZ1 LYS A 42 3.169 -4.191 -2.665 1.00 2.76 H new ATOM 0 HZ2 LYS A 42 2.967 -2.678 -3.408 1.00 2.76 H new ATOM 0 HZ3 LYS A 42 1.654 -3.426 -2.634 1.00 2.76 H new ATOM 693 N SER A 43 -3.955 -5.416 -4.364 1.00 0.38 N ATOM 694 CA SER A 43 -5.047 -5.669 -3.412 1.00 0.38 C ATOM 695 C SER A 43 -5.776 -6.981 -3.742 1.00 0.39 C ATOM 696 O SER A 43 -6.287 -7.660 -2.848 1.00 0.45 O ATOM 697 CB SER A 43 -6.019 -4.489 -3.415 1.00 0.37 C ATOM 698 OG SER A 43 -5.311 -3.260 -3.268 1.00 1.04 O ATOM 0 H SER A 43 -4.095 -4.591 -4.947 1.00 0.38 H new ATOM 0 HA SER A 43 -4.622 -5.773 -2.414 1.00 0.38 H new ATOM 0 HB2 SER A 43 -6.587 -4.480 -4.346 1.00 0.37 H new ATOM 0 HB3 SER A 43 -6.739 -4.601 -2.604 1.00 0.37 H new ATOM 0 HG SER A 43 -5.175 -2.854 -4.149 1.00 1.04 H new ATOM 704 N ALA A 44 -5.803 -7.341 -5.032 1.00 0.37 N ATOM 705 CA ALA A 44 -6.446 -8.571 -5.499 1.00 0.43 C ATOM 706 C ALA A 44 -5.619 -9.799 -5.113 1.00 0.51 C ATOM 707 O ALA A 44 -6.166 -10.809 -4.668 1.00 0.59 O ATOM 708 CB ALA A 44 -6.625 -8.525 -7.017 1.00 0.43 C ATOM 0 H ALA A 44 -5.380 -6.788 -5.777 1.00 0.37 H new ATOM 0 HA ALA A 44 -7.423 -8.647 -5.022 1.00 0.43 H new ATOM 0 HB1 ALA A 44 -7.104 -9.444 -7.355 1.00 0.43 H new ATOM 0 HB2 ALA A 44 -7.248 -7.672 -7.284 1.00 0.43 H new ATOM 0 HB3 ALA A 44 -5.651 -8.427 -7.495 1.00 0.43 H new ATOM 714 N ALA A 45 -4.297 -9.702 -5.282 1.00 0.54 N ATOM 715 CA ALA A 45 -3.377 -10.800 -4.950 1.00 0.64 C ATOM 716 C ALA A 45 -3.289 -10.987 -3.432 1.00 0.68 C ATOM 717 O ALA A 45 -3.306 -12.113 -2.931 1.00 0.76 O ATOM 718 CB ALA A 45 -1.987 -10.515 -5.527 1.00 0.69 C ATOM 0 H ALA A 45 -3.835 -8.870 -5.649 1.00 0.54 H new ATOM 0 HA ALA A 45 -3.762 -11.720 -5.391 1.00 0.64 H new ATOM 0 HB1 ALA A 45 -1.314 -11.334 -5.275 1.00 0.69 H new ATOM 0 HB2 ALA A 45 -2.055 -10.421 -6.611 1.00 0.69 H new ATOM 0 HB3 ALA A 45 -1.602 -9.586 -5.106 1.00 0.69 H new ATOM 724 N SER A 46 -3.203 -9.870 -2.708 1.00 0.65 N ATOM 725 CA SER A 46 -3.117 -9.885 -1.241 1.00 0.73 C ATOM 726 C SER A 46 -4.444 -10.354 -0.619 1.00 0.74 C ATOM 727 O SER A 46 -4.449 -11.012 0.420 1.00 0.84 O ATOM 728 CB SER A 46 -2.752 -8.488 -0.725 1.00 0.75 C ATOM 729 OG SER A 46 -1.605 -7.979 -1.403 1.00 1.21 O ATOM 0 H SER A 46 -3.191 -8.935 -3.115 1.00 0.65 H new ATOM 0 HA SER A 46 -2.338 -10.588 -0.947 1.00 0.73 H new ATOM 0 HB2 SER A 46 -3.594 -7.811 -0.869 1.00 0.75 H new ATOM 0 HB3 SER A 46 -2.557 -8.531 0.347 1.00 0.75 H new ATOM 0 HG SER A 46 -1.869 -7.639 -2.283 1.00 1.21 H new ATOM 735 N GLY A 47 -5.560 -10.018 -1.269 1.00 0.70 N ATOM 736 CA GLY A 47 -6.890 -10.409 -0.795 1.00 0.74 C ATOM 737 C GLY A 47 -7.448 -9.386 0.193 1.00 0.75 C ATOM 738 O GLY A 47 -7.865 -9.740 1.295 1.00 0.88 O ATOM 0 H GLY A 47 -5.569 -9.472 -2.131 1.00 0.70 H new ATOM 0 HA2 GLY A 47 -7.567 -10.506 -1.644 1.00 0.74 H new ATOM 0 HA3 GLY A 47 -6.836 -11.387 -0.317 1.00 0.74 H new ATOM 742 N ILE A 48 -7.459 -8.118 -0.216 1.00 0.67 N ATOM 743 CA ILE A 48 -7.974 -7.023 0.617 1.00 0.72 C ATOM 744 C ILE A 48 -9.384 -6.655 0.136 1.00 0.75 C ATOM 745 O ILE A 48 -9.576 -6.352 -1.038 1.00 0.75 O ATOM 746 CB ILE A 48 -7.037 -5.805 0.522 1.00 0.71 C ATOM 747 CG1 ILE A 48 -5.587 -6.209 0.850 1.00 0.78 C ATOM 748 CG2 ILE A 48 -7.499 -4.692 1.465 1.00 0.82 C ATOM 749 CD1 ILE A 48 -4.641 -5.007 0.836 1.00 0.97 C ATOM 0 H ILE A 48 -7.114 -7.818 -1.128 1.00 0.67 H new ATOM 0 HA ILE A 48 -8.019 -7.339 1.659 1.00 0.72 H new ATOM 0 HB ILE A 48 -7.072 -5.431 -0.501 1.00 0.71 H new ATOM 0 HG12 ILE A 48 -5.556 -6.684 1.831 1.00 0.78 H new ATOM 0 HG13 ILE A 48 -5.244 -6.949 0.127 1.00 0.78 H new ATOM 0 HG21 ILE A 48 -6.823 -3.841 1.382 1.00 0.82 H new ATOM 0 HG22 ILE A 48 -8.508 -4.382 1.195 1.00 0.82 H new ATOM 0 HG23 ILE A 48 -7.495 -5.060 2.491 1.00 0.82 H new ATOM 0 HD11 ILE A 48 -3.629 -5.337 1.072 1.00 0.97 H new ATOM 0 HD12 ILE A 48 -4.651 -4.548 -0.152 1.00 0.97 H new ATOM 0 HD13 ILE A 48 -4.967 -4.278 1.578 1.00 0.97 H new ATOM 761 N PRO A 49 -10.397 -6.684 1.027 1.00 0.84 N ATOM 762 CA PRO A 49 -11.788 -6.355 0.653 1.00 0.93 C ATOM 763 C PRO A 49 -11.975 -4.855 0.370 1.00 0.93 C ATOM 764 O PRO A 49 -11.622 -4.007 1.196 1.00 1.08 O ATOM 765 CB PRO A 49 -12.610 -6.809 1.860 1.00 1.07 C ATOM 766 CG PRO A 49 -11.664 -6.780 3.018 1.00 1.06 C ATOM 767 CD PRO A 49 -10.284 -7.043 2.455 1.00 0.92 C ATOM 0 HA PRO A 49 -12.092 -6.846 -0.271 1.00 0.93 H new ATOM 0 HB2 PRO A 49 -13.459 -6.146 2.029 1.00 1.07 H new ATOM 0 HB3 PRO A 49 -13.013 -7.810 1.707 1.00 1.07 H new ATOM 0 HG2 PRO A 49 -11.699 -5.815 3.523 1.00 1.06 H new ATOM 0 HG3 PRO A 49 -11.932 -7.536 3.756 1.00 1.06 H new ATOM 0 HD2 PRO A 49 -9.528 -6.440 2.958 1.00 0.92 H new ATOM 0 HD3 PRO A 49 -9.995 -8.087 2.581 1.00 0.92 H new ATOM 775 N TYR A 50 -12.515 -4.537 -0.809 1.00 0.87 N ATOM 776 CA TYR A 50 -12.739 -3.144 -1.229 1.00 0.91 C ATOM 777 C TYR A 50 -14.208 -2.744 -1.052 1.00 1.12 C ATOM 778 O TYR A 50 -14.537 -1.904 -0.211 1.00 1.91 O ATOM 779 CB TYR A 50 -12.307 -2.982 -2.695 1.00 0.92 C ATOM 780 CG TYR A 50 -12.377 -1.554 -3.198 1.00 0.94 C ATOM 781 CD1 TYR A 50 -11.690 -0.545 -2.534 1.00 1.02 C ATOM 782 CD2 TYR A 50 -13.122 -1.244 -4.326 1.00 1.13 C ATOM 783 CE1 TYR A 50 -11.751 0.759 -2.996 1.00 1.13 C ATOM 784 CE2 TYR A 50 -13.179 0.062 -4.785 1.00 1.24 C ATOM 785 CZ TYR A 50 -12.494 1.055 -4.118 1.00 1.17 C ATOM 786 OH TYR A 50 -12.552 2.353 -4.575 1.00 1.34 O ATOM 0 H TYR A 50 -12.809 -5.229 -1.498 1.00 0.87 H new ATOM 0 HA TYR A 50 -12.142 -2.484 -0.600 1.00 0.91 H new ATOM 0 HB2 TYR A 50 -11.286 -3.347 -2.806 1.00 0.92 H new ATOM 0 HB3 TYR A 50 -12.940 -3.610 -3.322 1.00 0.92 H new ATOM 0 HD1 TYR A 50 -11.107 -0.778 -1.655 1.00 1.02 H new ATOM 0 HD2 TYR A 50 -13.659 -2.022 -4.848 1.00 1.13 H new ATOM 0 HE1 TYR A 50 -11.217 1.542 -2.478 1.00 1.13 H new ATOM 0 HE2 TYR A 50 -13.759 0.302 -5.664 1.00 1.24 H new ATOM 0 HH TYR A 50 -13.116 2.393 -5.375 1.00 1.34 H new ATOM 796 N HIS A 51 -15.086 -3.346 -1.856 1.00 1.28 N ATOM 797 CA HIS A 51 -16.529 -3.057 -1.810 1.00 1.53 C ATOM 798 C HIS A 51 -17.216 -3.864 -0.701 1.00 1.61 C ATOM 799 O HIS A 51 -16.571 -4.638 0.014 1.00 2.07 O ATOM 800 CB HIS A 51 -17.165 -3.381 -3.182 1.00 2.01 C ATOM 801 CG HIS A 51 -17.671 -2.166 -3.899 1.00 2.54 C ATOM 802 ND1 HIS A 51 -18.940 -2.062 -4.404 1.00 3.19 N ATOM 803 CD2 HIS A 51 -17.076 -0.981 -4.197 1.00 2.89 C ATOM 804 CE1 HIS A 51 -19.125 -0.898 -4.979 1.00 3.87 C ATOM 805 NE2 HIS A 51 -18.002 -0.204 -4.871 1.00 3.74 N ATOM 0 H HIS A 51 -14.825 -4.043 -2.554 1.00 1.28 H new ATOM 0 HA HIS A 51 -16.666 -1.999 -1.588 1.00 1.53 H new ATOM 0 HB2 HIS A 51 -16.427 -3.883 -3.808 1.00 2.01 H new ATOM 0 HB3 HIS A 51 -17.989 -4.079 -3.037 1.00 2.01 H new ATOM 0 HD2 HIS A 51 -16.063 -0.697 -3.952 1.00 2.89 H new ATOM 0 HE1 HIS A 51 -20.034 -0.564 -5.457 1.00 3.87 H new ATOM 0 HE2 HIS A 51 -17.846 0.740 -5.224 1.00 3.74 H new ATOM 813 N SER A 52 -18.532 -3.682 -0.576 1.00 1.60 N ATOM 814 CA SER A 52 -19.338 -4.392 0.425 1.00 1.96 C ATOM 815 C SER A 52 -19.476 -5.861 0.009 1.00 1.85 C ATOM 816 O SER A 52 -19.148 -6.769 0.775 1.00 2.45 O ATOM 817 CB SER A 52 -20.728 -3.733 0.568 1.00 2.44 C ATOM 818 OG SER A 52 -20.998 -2.836 -0.511 1.00 2.65 O ATOM 0 H SER A 52 -19.069 -3.042 -1.161 1.00 1.60 H new ATOM 0 HA SER A 52 -18.842 -4.338 1.394 1.00 1.96 H new ATOM 0 HB2 SER A 52 -21.496 -4.506 0.600 1.00 2.44 H new ATOM 0 HB3 SER A 52 -20.780 -3.192 1.513 1.00 2.44 H new ATOM 0 HG SER A 52 -21.885 -2.438 -0.391 1.00 2.65 H new ATOM 824 N GLU A 53 -19.923 -6.071 -1.231 1.00 1.45 N ATOM 825 CA GLU A 53 -20.072 -7.407 -1.804 1.00 1.37 C ATOM 826 C GLU A 53 -18.805 -7.729 -2.596 1.00 1.08 C ATOM 827 O GLU A 53 -18.725 -7.450 -3.792 1.00 1.24 O ATOM 828 CB GLU A 53 -21.302 -7.452 -2.722 1.00 1.73 C ATOM 829 CG GLU A 53 -22.592 -7.149 -1.954 1.00 2.39 C ATOM 830 CD GLU A 53 -23.802 -7.324 -2.862 1.00 2.88 C ATOM 831 OE1 GLU A 53 -24.235 -8.476 -3.067 1.00 3.46 O ATOM 832 OE2 GLU A 53 -24.322 -6.308 -3.373 1.00 3.23 O ATOM 0 H GLU A 53 -20.191 -5.318 -1.865 1.00 1.45 H new ATOM 0 HA GLU A 53 -20.214 -8.144 -1.013 1.00 1.37 H new ATOM 0 HB2 GLU A 53 -21.181 -6.730 -3.529 1.00 1.73 H new ATOM 0 HB3 GLU A 53 -21.376 -8.437 -3.184 1.00 1.73 H new ATOM 0 HG2 GLU A 53 -22.675 -7.813 -1.094 1.00 2.39 H new ATOM 0 HG3 GLU A 53 -22.563 -6.130 -1.568 1.00 2.39 H new ATOM 839 N VAL A 54 -17.800 -8.279 -1.914 1.00 0.84 N ATOM 840 CA VAL A 54 -16.516 -8.596 -2.552 1.00 0.66 C ATOM 841 C VAL A 54 -16.627 -9.815 -3.473 1.00 0.55 C ATOM 842 O VAL A 54 -16.273 -9.725 -4.648 1.00 0.49 O ATOM 843 CB VAL A 54 -15.395 -8.806 -1.502 1.00 0.81 C ATOM 844 CG1 VAL A 54 -14.058 -8.290 -2.040 1.00 0.77 C ATOM 845 CG2 VAL A 54 -15.729 -8.118 -0.174 1.00 1.34 C ATOM 0 H VAL A 54 -17.847 -8.515 -0.923 1.00 0.84 H new ATOM 0 HA VAL A 54 -16.247 -7.736 -3.166 1.00 0.66 H new ATOM 0 HB VAL A 54 -15.316 -9.877 -1.314 1.00 0.81 H new ATOM 0 HG11 VAL A 54 -13.281 -8.444 -1.292 1.00 0.77 H new ATOM 0 HG12 VAL A 54 -13.798 -8.832 -2.950 1.00 0.77 H new ATOM 0 HG13 VAL A 54 -14.141 -7.226 -2.262 1.00 0.77 H new ATOM 0 HG21 VAL A 54 -14.920 -8.287 0.537 1.00 1.34 H new ATOM 0 HG22 VAL A 54 -15.849 -7.047 -0.339 1.00 1.34 H new ATOM 0 HG23 VAL A 54 -16.656 -8.529 0.226 1.00 1.34 H new ATOM 855 N PRO A 55 -17.128 -10.970 -2.969 1.00 0.62 N ATOM 856 CA PRO A 55 -17.274 -12.193 -3.767 1.00 0.59 C ATOM 857 C PRO A 55 -18.672 -12.305 -4.388 1.00 0.58 C ATOM 858 O PRO A 55 -19.680 -12.169 -3.687 1.00 0.83 O ATOM 859 CB PRO A 55 -17.044 -13.300 -2.738 1.00 0.76 C ATOM 860 CG PRO A 55 -17.402 -12.703 -1.401 1.00 0.87 C ATOM 861 CD PRO A 55 -17.597 -11.208 -1.595 1.00 0.83 C ATOM 0 HA PRO A 55 -16.586 -12.231 -4.612 1.00 0.59 H new ATOM 0 HB2 PRO A 55 -17.663 -14.170 -2.956 1.00 0.76 H new ATOM 0 HB3 PRO A 55 -16.007 -13.636 -2.751 1.00 0.76 H new ATOM 0 HG2 PRO A 55 -18.312 -13.159 -1.011 1.00 0.87 H new ATOM 0 HG3 PRO A 55 -16.613 -12.894 -0.674 1.00 0.87 H new ATOM 0 HD2 PRO A 55 -18.642 -10.921 -1.473 1.00 0.83 H new ATOM 0 HD3 PRO A 55 -17.022 -10.632 -0.870 1.00 0.83 H new ATOM 869 N VAL A 56 -18.731 -12.566 -5.694 1.00 0.41 N ATOM 870 CA VAL A 56 -20.013 -12.710 -6.392 1.00 0.43 C ATOM 871 C VAL A 56 -19.957 -13.870 -7.383 1.00 0.42 C ATOM 872 O VAL A 56 -18.904 -14.189 -7.946 1.00 0.43 O ATOM 873 CB VAL A 56 -20.423 -11.381 -7.072 1.00 0.44 C ATOM 874 CG1 VAL A 56 -20.599 -11.496 -8.594 1.00 0.62 C ATOM 875 CG2 VAL A 56 -21.718 -10.863 -6.446 1.00 0.63 C ATOM 0 H VAL A 56 -17.911 -12.682 -6.290 1.00 0.41 H new ATOM 0 HA VAL A 56 -20.785 -12.945 -5.660 1.00 0.43 H new ATOM 0 HB VAL A 56 -19.604 -10.682 -6.905 1.00 0.44 H new ATOM 0 HG11 VAL A 56 -20.886 -10.527 -9.001 1.00 0.62 H new ATOM 0 HG12 VAL A 56 -19.660 -11.816 -9.046 1.00 0.62 H new ATOM 0 HG13 VAL A 56 -21.376 -12.228 -8.816 1.00 0.62 H new ATOM 0 HG21 VAL A 56 -22.005 -9.927 -6.926 1.00 0.63 H new ATOM 0 HG22 VAL A 56 -22.509 -11.600 -6.585 1.00 0.63 H new ATOM 0 HG23 VAL A 56 -21.564 -10.692 -5.381 1.00 0.63 H new ATOM 885 N SER A 57 -21.113 -14.491 -7.567 1.00 0.47 N ATOM 886 CA SER A 57 -21.291 -15.629 -8.455 1.00 0.48 C ATOM 887 C SER A 57 -21.969 -15.190 -9.758 1.00 0.46 C ATOM 888 O SER A 57 -22.959 -14.455 -9.728 1.00 0.59 O ATOM 889 CB SER A 57 -22.159 -16.669 -7.742 1.00 0.61 C ATOM 890 OG SER A 57 -21.941 -16.656 -6.331 1.00 0.91 O ATOM 0 H SER A 57 -21.971 -14.211 -7.093 1.00 0.47 H new ATOM 0 HA SER A 57 -20.319 -16.056 -8.703 1.00 0.48 H new ATOM 0 HB2 SER A 57 -23.210 -16.471 -7.950 1.00 0.61 H new ATOM 0 HB3 SER A 57 -21.937 -17.661 -8.136 1.00 0.61 H new ATOM 0 HG SER A 57 -22.511 -17.330 -5.906 1.00 0.91 H new ATOM 896 N LEU A 58 -21.454 -15.659 -10.899 1.00 0.44 N ATOM 897 CA LEU A 58 -22.031 -15.327 -12.210 1.00 0.49 C ATOM 898 C LEU A 58 -23.102 -16.362 -12.581 1.00 0.60 C ATOM 899 O LEU A 58 -23.098 -16.912 -13.683 1.00 0.89 O ATOM 900 CB LEU A 58 -20.928 -15.291 -13.283 1.00 0.67 C ATOM 901 CG LEU A 58 -19.947 -14.134 -13.054 1.00 0.70 C ATOM 902 CD1 LEU A 58 -18.694 -14.315 -13.917 1.00 0.86 C ATOM 903 CD2 LEU A 58 -20.616 -12.786 -13.343 1.00 0.60 C ATOM 0 H LEU A 58 -20.638 -16.270 -10.943 1.00 0.44 H new ATOM 0 HA LEU A 58 -22.493 -14.341 -12.157 1.00 0.49 H new ATOM 0 HB2 LEU A 58 -20.384 -16.235 -13.277 1.00 0.67 H new ATOM 0 HB3 LEU A 58 -21.383 -15.192 -14.269 1.00 0.67 H new ATOM 0 HG LEU A 58 -19.647 -14.143 -12.006 1.00 0.70 H new ATOM 0 HD11 LEU A 58 -18.009 -13.485 -13.742 1.00 0.86 H new ATOM 0 HD12 LEU A 58 -18.204 -15.252 -13.654 1.00 0.86 H new ATOM 0 HD13 LEU A 58 -18.977 -14.336 -14.969 1.00 0.86 H new ATOM 0 HD21 LEU A 58 -19.901 -11.981 -13.174 1.00 0.60 H new ATOM 0 HD22 LEU A 58 -20.951 -12.761 -14.380 1.00 0.60 H new ATOM 0 HD23 LEU A 58 -21.472 -12.656 -12.681 1.00 0.60 H new ATOM 915 N LYS A 59 -24.022 -16.616 -11.644 1.00 0.70 N ATOM 916 CA LYS A 59 -25.111 -17.576 -11.847 1.00 0.90 C ATOM 917 C LYS A 59 -26.167 -16.960 -12.769 1.00 0.87 C ATOM 918 O LYS A 59 -26.902 -16.055 -12.362 1.00 0.95 O ATOM 919 CB LYS A 59 -25.726 -17.957 -10.491 1.00 1.13 C ATOM 920 CG LYS A 59 -26.435 -19.314 -10.558 1.00 1.41 C ATOM 921 CD LYS A 59 -27.051 -19.695 -9.212 1.00 1.78 C ATOM 922 CE LYS A 59 -26.082 -20.534 -8.374 1.00 2.18 C ATOM 923 NZ LYS A 59 -26.694 -20.947 -7.078 1.00 2.83 N ATOM 0 H LYS A 59 -24.033 -16.165 -10.729 1.00 0.70 H new ATOM 0 HA LYS A 59 -24.723 -18.481 -12.315 1.00 0.90 H new ATOM 0 HB2 LYS A 59 -24.944 -17.991 -9.732 1.00 1.13 H new ATOM 0 HB3 LYS A 59 -26.436 -17.189 -10.183 1.00 1.13 H new ATOM 0 HG2 LYS A 59 -27.215 -19.280 -11.319 1.00 1.41 H new ATOM 0 HG3 LYS A 59 -25.724 -20.082 -10.864 1.00 1.41 H new ATOM 0 HD2 LYS A 59 -27.321 -18.792 -8.664 1.00 1.78 H new ATOM 0 HD3 LYS A 59 -27.972 -20.255 -9.376 1.00 1.78 H new ATOM 0 HE2 LYS A 59 -25.787 -21.420 -8.936 1.00 2.18 H new ATOM 0 HE3 LYS A 59 -25.175 -19.961 -8.183 1.00 2.18 H new ATOM 0 HZ1 LYS A 59 -26.010 -21.513 -6.536 1.00 2.83 H new ATOM 0 HZ2 LYS A 59 -26.953 -20.101 -6.531 1.00 2.83 H new ATOM 0 HZ3 LYS A 59 -27.546 -21.515 -7.262 1.00 2.83 H new ATOM 937 N GLU A 60 -26.212 -17.430 -14.021 1.00 0.89 N ATOM 938 CA GLU A 60 -27.144 -16.912 -15.033 1.00 0.93 C ATOM 939 C GLU A 60 -26.876 -15.417 -15.248 1.00 0.71 C ATOM 940 O GLU A 60 -27.770 -14.579 -15.107 1.00 0.82 O ATOM 941 CB GLU A 60 -28.604 -17.160 -14.617 1.00 1.20 C ATOM 942 CG GLU A 60 -28.855 -18.637 -14.292 1.00 1.43 C ATOM 943 CD GLU A 60 -30.350 -18.904 -14.168 1.00 1.80 C ATOM 944 OE1 GLU A 60 -31.042 -18.137 -13.471 1.00 2.33 O ATOM 945 OE2 GLU A 60 -30.835 -19.888 -14.764 1.00 2.04 O ATOM 0 H GLU A 60 -25.607 -18.177 -14.362 1.00 0.89 H new ATOM 0 HA GLU A 60 -26.983 -17.441 -15.972 1.00 0.93 H new ATOM 0 HB2 GLU A 60 -28.844 -16.549 -13.746 1.00 1.20 H new ATOM 0 HB3 GLU A 60 -29.270 -16.845 -15.420 1.00 1.20 H new ATOM 0 HG2 GLU A 60 -28.430 -19.266 -15.074 1.00 1.43 H new ATOM 0 HG3 GLU A 60 -28.353 -18.902 -13.362 1.00 1.43 H new ATOM 952 N ALA A 61 -25.620 -15.103 -15.561 1.00 0.51 N ATOM 953 CA ALA A 61 -25.178 -13.728 -15.775 1.00 0.35 C ATOM 954 C ALA A 61 -25.529 -13.259 -17.185 1.00 0.35 C ATOM 955 O ALA A 61 -24.841 -13.602 -18.152 1.00 0.43 O ATOM 956 CB ALA A 61 -23.664 -13.634 -15.554 1.00 0.31 C ATOM 0 H ALA A 61 -24.880 -15.796 -15.673 1.00 0.51 H new ATOM 0 HA ALA A 61 -25.691 -13.082 -15.062 1.00 0.35 H new ATOM 0 HB1 ALA A 61 -23.336 -12.607 -15.714 1.00 0.31 H new ATOM 0 HB2 ALA A 61 -23.426 -13.936 -14.534 1.00 0.31 H new ATOM 0 HB3 ALA A 61 -23.152 -14.292 -16.256 1.00 0.31 H new ATOM 962 N ILE A 62 -26.585 -12.453 -17.293 1.00 0.34 N ATOM 963 CA ILE A 62 -27.015 -11.906 -18.578 1.00 0.37 C ATOM 964 C ILE A 62 -26.110 -10.724 -18.926 1.00 0.31 C ATOM 965 O ILE A 62 -25.825 -9.878 -18.069 1.00 0.31 O ATOM 966 CB ILE A 62 -28.485 -11.465 -18.527 1.00 0.46 C ATOM 967 CG1 ILE A 62 -29.332 -12.463 -17.721 1.00 0.53 C ATOM 968 CG2 ILE A 62 -29.034 -11.327 -19.947 1.00 0.57 C ATOM 969 CD1 ILE A 62 -30.832 -12.177 -17.858 1.00 1.27 C ATOM 0 H ILE A 62 -27.160 -12.164 -16.502 1.00 0.34 H new ATOM 0 HA ILE A 62 -26.935 -12.675 -19.346 1.00 0.37 H new ATOM 0 HB ILE A 62 -28.539 -10.498 -18.027 1.00 0.46 H new ATOM 0 HG12 ILE A 62 -29.122 -13.477 -18.063 1.00 0.53 H new ATOM 0 HG13 ILE A 62 -29.047 -12.416 -16.670 1.00 0.53 H new ATOM 0 HG21 ILE A 62 -30.077 -11.014 -19.905 1.00 0.57 H new ATOM 0 HG22 ILE A 62 -28.453 -10.582 -20.491 1.00 0.57 H new ATOM 0 HG23 ILE A 62 -28.964 -12.287 -20.459 1.00 0.57 H new ATOM 0 HD11 ILE A 62 -31.396 -12.904 -17.274 1.00 1.27 H new ATOM 0 HD12 ILE A 62 -31.046 -11.173 -17.492 1.00 1.27 H new ATOM 0 HD13 ILE A 62 -31.122 -12.250 -18.906 1.00 1.27 H new ATOM 981 N CYS A 63 -25.642 -10.676 -20.169 1.00 0.34 N ATOM 982 CA CYS A 63 -24.740 -9.617 -20.618 1.00 0.33 C ATOM 983 C CYS A 63 -25.176 -9.062 -21.975 1.00 0.34 C ATOM 984 O CYS A 63 -25.489 -9.815 -22.897 1.00 0.52 O ATOM 985 CB CYS A 63 -23.305 -10.162 -20.690 1.00 0.37 C ATOM 986 SG CYS A 63 -22.065 -8.872 -20.485 1.00 0.53 S ATOM 0 H CYS A 63 -25.873 -11.361 -20.888 1.00 0.34 H new ATOM 0 HA CYS A 63 -24.776 -8.797 -19.901 1.00 0.33 H new ATOM 0 HB2 CYS A 63 -23.168 -10.919 -19.918 1.00 0.37 H new ATOM 0 HB3 CYS A 63 -23.155 -10.656 -21.650 1.00 0.37 H new ATOM 0 HG CYS A 63 -20.878 -9.397 -20.553 1.00 0.53 H new ATOM 992 N GLU A 64 -25.181 -7.732 -22.079 1.00 0.26 N ATOM 993 CA GLU A 64 -25.562 -7.018 -23.306 1.00 0.29 C ATOM 994 C GLU A 64 -24.585 -5.866 -23.537 1.00 0.24 C ATOM 995 O GLU A 64 -24.088 -5.274 -22.580 1.00 0.36 O ATOM 996 CB GLU A 64 -26.983 -6.447 -23.186 1.00 0.33 C ATOM 997 CG GLU A 64 -27.993 -7.479 -22.682 1.00 0.81 C ATOM 998 CD GLU A 64 -29.310 -6.795 -22.351 1.00 1.41 C ATOM 999 OE1 GLU A 64 -29.376 -6.089 -21.324 1.00 1.96 O ATOM 1000 OE2 GLU A 64 -30.281 -6.959 -23.110 1.00 1.83 O ATOM 0 H GLU A 64 -24.920 -7.113 -21.311 1.00 0.26 H new ATOM 0 HA GLU A 64 -25.533 -7.719 -24.140 1.00 0.29 H new ATOM 0 HB2 GLU A 64 -26.971 -5.594 -22.507 1.00 0.33 H new ATOM 0 HB3 GLU A 64 -27.304 -6.075 -24.159 1.00 0.33 H new ATOM 0 HG2 GLU A 64 -28.152 -8.246 -23.440 1.00 0.81 H new ATOM 0 HG3 GLU A 64 -27.602 -7.982 -21.797 1.00 0.81 H new ATOM 1007 N VAL A 65 -24.326 -5.530 -24.796 1.00 0.34 N ATOM 1008 CA VAL A 65 -23.418 -4.427 -25.128 1.00 0.32 C ATOM 1009 C VAL A 65 -24.162 -3.086 -25.025 1.00 0.31 C ATOM 1010 O VAL A 65 -25.275 -2.946 -25.534 1.00 0.43 O ATOM 1011 CB VAL A 65 -22.841 -4.615 -26.545 1.00 0.45 C ATOM 1012 CG1 VAL A 65 -21.723 -3.600 -26.815 1.00 0.34 C ATOM 1013 CG2 VAL A 65 -22.318 -6.044 -26.739 1.00 0.39 C ATOM 0 H VAL A 65 -24.729 -6.002 -25.606 1.00 0.34 H new ATOM 0 HA VAL A 65 -22.591 -4.425 -24.418 1.00 0.32 H new ATOM 0 HB VAL A 65 -23.646 -4.444 -27.259 1.00 0.45 H new ATOM 0 HG11 VAL A 65 -21.330 -3.751 -27.820 1.00 0.34 H new ATOM 0 HG12 VAL A 65 -22.121 -2.589 -26.728 1.00 0.34 H new ATOM 0 HG13 VAL A 65 -20.923 -3.738 -26.088 1.00 0.34 H new ATOM 0 HG21 VAL A 65 -21.916 -6.151 -27.747 1.00 0.39 H new ATOM 0 HG22 VAL A 65 -21.532 -6.246 -26.012 1.00 0.39 H new ATOM 0 HG23 VAL A 65 -23.134 -6.753 -26.597 1.00 0.39 H new ATOM 1023 N ALA A 66 -23.530 -2.109 -24.371 1.00 0.25 N ATOM 1024 CA ALA A 66 -24.092 -0.766 -24.192 1.00 0.31 C ATOM 1025 C ALA A 66 -23.181 0.253 -24.873 1.00 0.34 C ATOM 1026 O ALA A 66 -22.222 0.762 -24.276 1.00 0.36 O ATOM 1027 CB ALA A 66 -24.243 -0.442 -22.698 1.00 0.36 C ATOM 0 H ALA A 66 -22.609 -2.227 -23.948 1.00 0.25 H new ATOM 0 HA ALA A 66 -25.082 -0.724 -24.646 1.00 0.31 H new ATOM 0 HB1 ALA A 66 -24.661 0.558 -22.583 1.00 0.36 H new ATOM 0 HB2 ALA A 66 -24.909 -1.169 -22.233 1.00 0.36 H new ATOM 0 HB3 ALA A 66 -23.266 -0.484 -22.216 1.00 0.36 H new ATOM 1033 N LEU A 67 -23.485 0.537 -26.136 1.00 0.55 N ATOM 1034 CA LEU A 67 -22.714 1.489 -26.936 1.00 0.71 C ATOM 1035 C LEU A 67 -23.380 2.871 -26.919 1.00 0.89 C ATOM 1036 O LEU A 67 -22.692 3.886 -26.960 1.00 1.22 O ATOM 1037 CB LEU A 67 -22.573 0.972 -28.376 1.00 0.76 C ATOM 1038 CG LEU A 67 -21.523 1.761 -29.177 1.00 0.99 C ATOM 1039 CD1 LEU A 67 -20.213 1.904 -28.398 1.00 1.38 C ATOM 1040 CD2 LEU A 67 -21.251 1.088 -30.519 1.00 1.39 C ATOM 0 H LEU A 67 -24.269 0.117 -26.634 1.00 0.55 H new ATOM 0 HA LEU A 67 -21.719 1.588 -26.502 1.00 0.71 H new ATOM 0 HB2 LEU A 67 -22.296 -0.082 -28.356 1.00 0.76 H new ATOM 0 HB3 LEU A 67 -23.537 1.038 -28.880 1.00 0.76 H new ATOM 0 HG LEU A 67 -21.930 2.757 -29.351 1.00 0.99 H new ATOM 0 HD11 LEU A 67 -19.495 2.467 -28.994 1.00 1.38 H new ATOM 0 HD12 LEU A 67 -20.401 2.432 -27.463 1.00 1.38 H new ATOM 0 HD13 LEU A 67 -19.809 0.915 -28.181 1.00 1.38 H new ATOM 0 HD21 LEU A 67 -20.506 1.662 -31.069 1.00 1.39 H new ATOM 0 HD22 LEU A 67 -20.879 0.077 -30.350 1.00 1.39 H new ATOM 0 HD23 LEU A 67 -22.174 1.043 -31.097 1.00 1.39 H new ATOM 1052 N ASP A 68 -24.718 2.909 -26.844 1.00 0.90 N ATOM 1053 CA ASP A 68 -25.470 4.175 -26.807 1.00 1.14 C ATOM 1054 C ASP A 68 -25.927 4.470 -25.371 1.00 0.87 C ATOM 1055 O ASP A 68 -27.112 4.373 -25.043 1.00 1.00 O ATOM 1056 CB ASP A 68 -26.678 4.114 -27.759 1.00 1.59 C ATOM 1057 CG ASP A 68 -27.265 5.511 -27.980 1.00 2.35 C ATOM 1058 OD1 ASP A 68 -26.634 6.332 -28.673 1.00 3.07 O ATOM 1059 OD2 ASP A 68 -28.364 5.789 -27.462 1.00 2.62 O ATOM 0 H ASP A 68 -25.305 2.075 -26.808 1.00 0.90 H new ATOM 0 HA ASP A 68 -24.817 4.982 -27.140 1.00 1.14 H new ATOM 0 HB2 ASP A 68 -26.373 3.687 -28.714 1.00 1.59 H new ATOM 0 HB3 ASP A 68 -27.441 3.455 -27.344 1.00 1.59 H new ATOM 1064 N TYR A 69 -24.964 4.828 -24.523 1.00 0.81 N ATOM 1065 CA TYR A 69 -25.210 5.156 -23.113 1.00 0.69 C ATOM 1066 C TYR A 69 -24.648 6.554 -22.801 1.00 0.97 C ATOM 1067 O TYR A 69 -24.012 7.181 -23.653 1.00 1.47 O ATOM 1068 CB TYR A 69 -24.549 4.092 -22.209 1.00 0.58 C ATOM 1069 CG TYR A 69 -25.008 4.166 -20.768 1.00 0.53 C ATOM 1070 CD1 TYR A 69 -26.357 4.100 -20.466 1.00 0.72 C ATOM 1071 CD2 TYR A 69 -24.082 4.316 -19.746 1.00 0.55 C ATOM 1072 CE1 TYR A 69 -26.781 4.194 -19.155 1.00 0.85 C ATOM 1073 CE2 TYR A 69 -24.511 4.406 -18.432 1.00 0.64 C ATOM 1074 CZ TYR A 69 -25.859 4.347 -18.143 1.00 0.76 C ATOM 1075 OH TYR A 69 -26.290 4.450 -16.839 1.00 0.97 O ATOM 0 H TYR A 69 -23.983 4.900 -24.794 1.00 0.81 H new ATOM 0 HA TYR A 69 -26.283 5.160 -22.921 1.00 0.69 H new ATOM 0 HB2 TYR A 69 -24.771 3.101 -22.604 1.00 0.58 H new ATOM 0 HB3 TYR A 69 -23.467 4.215 -22.246 1.00 0.58 H new ATOM 0 HD1 TYR A 69 -27.080 3.975 -21.258 1.00 0.72 H new ATOM 0 HD2 TYR A 69 -23.028 4.363 -19.975 1.00 0.55 H new ATOM 0 HE1 TYR A 69 -27.835 4.148 -18.923 1.00 0.85 H new ATOM 0 HE2 TYR A 69 -23.792 4.522 -17.635 1.00 0.64 H new ATOM 0 HH TYR A 69 -27.125 3.948 -16.730 1.00 0.97 H new ATOM 1085 N LYS A 70 -24.878 7.035 -21.574 1.00 1.40 N ATOM 1086 CA LYS A 70 -24.388 8.356 -21.127 1.00 1.81 C ATOM 1087 C LYS A 70 -23.081 8.171 -20.352 1.00 1.82 C ATOM 1088 O LYS A 70 -23.016 7.327 -19.456 1.00 2.53 O ATOM 1089 CB LYS A 70 -25.444 9.038 -20.243 1.00 2.43 C ATOM 1090 CG LYS A 70 -26.826 9.000 -20.903 1.00 2.98 C ATOM 1091 CD LYS A 70 -27.731 10.130 -20.412 1.00 3.79 C ATOM 1092 CE LYS A 70 -28.656 9.678 -19.276 1.00 4.45 C ATOM 1093 NZ LYS A 70 -27.900 9.218 -18.080 1.00 4.84 N ATOM 0 H LYS A 70 -25.405 6.528 -20.863 1.00 1.40 H new ATOM 0 HA LYS A 70 -24.205 8.991 -21.994 1.00 1.81 H new ATOM 0 HB2 LYS A 70 -25.487 8.541 -19.274 1.00 2.43 H new ATOM 0 HB3 LYS A 70 -25.154 10.072 -20.058 1.00 2.43 H new ATOM 0 HG2 LYS A 70 -26.712 9.072 -21.985 1.00 2.98 H new ATOM 0 HG3 LYS A 70 -27.300 8.041 -20.695 1.00 2.98 H new ATOM 0 HD2 LYS A 70 -27.117 10.962 -20.069 1.00 3.79 H new ATOM 0 HD3 LYS A 70 -28.332 10.499 -21.243 1.00 3.79 H new ATOM 0 HE2 LYS A 70 -29.311 10.503 -18.994 1.00 4.45 H new ATOM 0 HE3 LYS A 70 -29.296 8.870 -19.631 1.00 4.45 H new ATOM 0 HZ1 LYS A 70 -28.559 9.068 -17.289 1.00 4.84 H new ATOM 0 HZ2 LYS A 70 -27.413 8.326 -18.299 1.00 4.84 H new ATOM 0 HZ3 LYS A 70 -27.199 9.939 -17.814 1.00 4.84 H new ATOM 1107 N LYS A 71 -22.034 8.931 -20.727 1.00 1.80 N ATOM 1108 CA LYS A 71 -20.702 8.821 -20.096 1.00 2.22 C ATOM 1109 C LYS A 71 -20.159 7.426 -20.410 1.00 2.19 C ATOM 1110 O LYS A 71 -20.234 6.512 -19.582 1.00 2.78 O ATOM 1111 CB LYS A 71 -20.793 9.069 -18.577 1.00 2.97 C ATOM 1112 CG LYS A 71 -19.411 9.250 -17.948 1.00 3.56 C ATOM 1113 CD LYS A 71 -19.188 8.249 -16.810 1.00 4.44 C ATOM 1114 CE LYS A 71 -17.740 8.271 -16.322 1.00 5.27 C ATOM 1115 NZ LYS A 71 -17.387 9.585 -15.719 1.00 5.62 N ATOM 0 H LYS A 71 -22.085 9.631 -21.467 1.00 1.80 H new ATOM 0 HA LYS A 71 -20.025 9.578 -20.491 1.00 2.22 H new ATOM 0 HB2 LYS A 71 -21.397 9.957 -18.389 1.00 2.97 H new ATOM 0 HB3 LYS A 71 -21.302 8.231 -18.102 1.00 2.97 H new ATOM 0 HG2 LYS A 71 -18.642 9.118 -18.709 1.00 3.56 H new ATOM 0 HG3 LYS A 71 -19.312 10.266 -17.567 1.00 3.56 H new ATOM 0 HD2 LYS A 71 -19.856 8.484 -15.981 1.00 4.44 H new ATOM 0 HD3 LYS A 71 -19.443 7.246 -17.151 1.00 4.44 H new ATOM 0 HE2 LYS A 71 -17.591 7.480 -15.587 1.00 5.27 H new ATOM 0 HE3 LYS A 71 -17.071 8.061 -17.156 1.00 5.27 H new ATOM 0 HZ1 LYS A 71 -16.414 9.549 -15.353 1.00 5.62 H new ATOM 0 HZ2 LYS A 71 -17.457 10.329 -16.442 1.00 5.62 H new ATOM 0 HZ3 LYS A 71 -18.043 9.797 -14.940 1.00 5.62 H new ATOM 1129 N LYS A 72 -19.695 7.248 -21.647 1.00 2.22 N ATOM 1130 CA LYS A 72 -19.250 5.936 -22.117 1.00 2.54 C ATOM 1131 C LYS A 72 -18.014 5.965 -23.017 1.00 1.92 C ATOM 1132 O LYS A 72 -17.592 6.999 -23.539 1.00 2.45 O ATOM 1133 CB LYS A 72 -20.404 5.338 -22.925 1.00 3.71 C ATOM 1134 CG LYS A 72 -20.914 6.350 -23.966 1.00 4.59 C ATOM 1135 CD LYS A 72 -21.534 5.665 -25.177 1.00 5.67 C ATOM 1136 CE LYS A 72 -21.833 6.674 -26.299 1.00 6.56 C ATOM 1137 NZ LYS A 72 -20.618 6.988 -27.101 1.00 7.03 N ATOM 0 H LYS A 72 -19.618 7.993 -22.340 1.00 2.22 H new ATOM 0 HA LYS A 72 -18.973 5.355 -21.237 1.00 2.54 H new ATOM 0 HB2 LYS A 72 -20.072 4.428 -23.426 1.00 3.71 H new ATOM 0 HB3 LYS A 72 -21.216 5.055 -22.256 1.00 3.71 H new ATOM 0 HG2 LYS A 72 -21.653 7.004 -23.503 1.00 4.59 H new ATOM 0 HG3 LYS A 72 -20.088 6.982 -24.291 1.00 4.59 H new ATOM 0 HD2 LYS A 72 -20.857 4.896 -25.548 1.00 5.67 H new ATOM 0 HD3 LYS A 72 -22.455 5.163 -24.881 1.00 5.67 H new ATOM 0 HE2 LYS A 72 -22.606 6.271 -26.953 1.00 6.56 H new ATOM 0 HE3 LYS A 72 -22.229 7.592 -25.866 1.00 6.56 H new ATOM 0 HZ1 LYS A 72 -20.861 7.671 -27.847 1.00 7.03 H new ATOM 0 HZ2 LYS A 72 -19.889 7.396 -26.482 1.00 7.03 H new ATOM 0 HZ3 LYS A 72 -20.254 6.116 -27.536 1.00 7.03 H new ATOM 1151 N LYS A 73 -17.514 4.757 -23.229 1.00 1.52 N ATOM 1152 CA LYS A 73 -16.387 4.444 -24.100 1.00 1.35 C ATOM 1153 C LYS A 73 -16.798 3.178 -24.853 1.00 1.05 C ATOM 1154 O LYS A 73 -16.911 3.157 -26.077 1.00 1.79 O ATOM 1155 CB LYS A 73 -15.119 4.177 -23.275 1.00 1.94 C ATOM 1156 CG LYS A 73 -14.572 5.453 -22.636 1.00 2.32 C ATOM 1157 CD LYS A 73 -13.762 5.134 -21.376 1.00 2.93 C ATOM 1158 CE LYS A 73 -13.496 6.388 -20.538 1.00 3.52 C ATOM 1159 NZ LYS A 73 -12.711 7.403 -21.298 1.00 3.96 N ATOM 0 H LYS A 73 -17.900 3.928 -22.778 1.00 1.52 H new ATOM 0 HA LYS A 73 -16.160 5.270 -24.774 1.00 1.35 H new ATOM 0 HB2 LYS A 73 -15.340 3.448 -22.496 1.00 1.94 H new ATOM 0 HB3 LYS A 73 -14.355 3.737 -23.916 1.00 1.94 H new ATOM 0 HG2 LYS A 73 -13.943 5.982 -23.352 1.00 2.32 H new ATOM 0 HG3 LYS A 73 -15.397 6.119 -22.383 1.00 2.32 H new ATOM 0 HD2 LYS A 73 -14.300 4.402 -20.774 1.00 2.93 H new ATOM 0 HD3 LYS A 73 -12.813 4.678 -21.659 1.00 2.93 H new ATOM 0 HE2 LYS A 73 -14.444 6.823 -20.223 1.00 3.52 H new ATOM 0 HE3 LYS A 73 -12.955 6.113 -19.633 1.00 3.52 H new ATOM 0 HZ1 LYS A 73 -12.463 8.193 -20.668 1.00 3.96 H new ATOM 0 HZ2 LYS A 73 -11.841 6.966 -21.664 1.00 3.96 H new ATOM 0 HZ3 LYS A 73 -13.281 7.759 -22.092 1.00 3.96 H new ATOM 1173 N HIS A 74 -17.081 2.149 -24.055 1.00 0.67 N ATOM 1174 CA HIS A 74 -17.554 0.840 -24.506 1.00 0.38 C ATOM 1175 C HIS A 74 -18.091 0.132 -23.259 1.00 0.30 C ATOM 1176 O HIS A 74 -17.333 -0.495 -22.511 1.00 0.37 O ATOM 1177 CB HIS A 74 -16.426 0.030 -25.178 1.00 0.64 C ATOM 1178 CG HIS A 74 -16.449 0.135 -26.677 1.00 0.91 C ATOM 1179 ND1 HIS A 74 -15.486 0.783 -27.402 1.00 1.30 N ATOM 1180 CD2 HIS A 74 -17.343 -0.308 -27.599 1.00 1.38 C ATOM 1181 CE1 HIS A 74 -15.759 0.750 -28.684 1.00 1.47 C ATOM 1182 NE2 HIS A 74 -16.893 0.086 -28.846 1.00 1.53 N ATOM 0 H HIS A 74 -16.984 2.206 -23.041 1.00 0.67 H new ATOM 0 HA HIS A 74 -18.331 0.942 -25.264 1.00 0.38 H new ATOM 0 HB2 HIS A 74 -15.463 0.381 -24.808 1.00 0.64 H new ATOM 0 HB3 HIS A 74 -16.516 -1.017 -24.890 1.00 0.64 H new ATOM 0 HD2 HIS A 74 -18.244 -0.868 -27.395 1.00 1.38 H new ATOM 0 HE1 HIS A 74 -15.163 1.188 -29.471 1.00 1.47 H new ATOM 0 HE2 HIS A 74 -17.355 -0.102 -29.736 1.00 1.53 H new ATOM 1190 N VAL A 75 -19.392 0.302 -23.004 1.00 0.26 N ATOM 1191 CA VAL A 75 -20.049 -0.251 -21.814 1.00 0.23 C ATOM 1192 C VAL A 75 -20.812 -1.535 -22.148 1.00 0.22 C ATOM 1193 O VAL A 75 -21.139 -1.797 -23.307 1.00 0.26 O ATOM 1194 CB VAL A 75 -21.016 0.825 -21.248 1.00 0.25 C ATOM 1195 CG1 VAL A 75 -21.544 0.473 -19.856 1.00 0.28 C ATOM 1196 CG2 VAL A 75 -20.338 2.199 -21.197 1.00 0.31 C ATOM 0 H VAL A 75 -20.019 0.826 -23.615 1.00 0.26 H new ATOM 0 HA VAL A 75 -19.295 -0.509 -21.070 1.00 0.23 H new ATOM 0 HB VAL A 75 -21.865 0.856 -21.931 1.00 0.25 H new ATOM 0 HG11 VAL A 75 -22.214 1.260 -19.511 1.00 0.28 H new ATOM 0 HG12 VAL A 75 -22.086 -0.472 -19.901 1.00 0.28 H new ATOM 0 HG13 VAL A 75 -20.708 0.379 -19.163 1.00 0.28 H new ATOM 0 HG21 VAL A 75 -21.036 2.935 -20.797 1.00 0.31 H new ATOM 0 HG22 VAL A 75 -19.458 2.147 -20.555 1.00 0.31 H new ATOM 0 HG23 VAL A 75 -20.037 2.494 -22.202 1.00 0.31 H new ATOM 1206 N PHE A 76 -21.119 -2.309 -21.114 1.00 0.22 N ATOM 1207 CA PHE A 76 -21.885 -3.543 -21.248 1.00 0.23 C ATOM 1208 C PHE A 76 -22.699 -3.757 -19.976 1.00 0.22 C ATOM 1209 O PHE A 76 -22.200 -3.579 -18.861 1.00 0.27 O ATOM 1210 CB PHE A 76 -20.996 -4.759 -21.568 1.00 0.26 C ATOM 1211 CG PHE A 76 -19.966 -5.121 -20.517 1.00 0.24 C ATOM 1212 CD1 PHE A 76 -20.287 -6.020 -19.509 1.00 0.27 C ATOM 1213 CD2 PHE A 76 -18.688 -4.593 -20.588 1.00 0.26 C ATOM 1214 CE1 PHE A 76 -19.336 -6.377 -18.567 1.00 0.29 C ATOM 1215 CE2 PHE A 76 -17.734 -4.954 -19.652 1.00 0.28 C ATOM 1216 CZ PHE A 76 -18.055 -5.848 -18.643 1.00 0.29 C ATOM 0 H PHE A 76 -20.843 -2.098 -20.155 1.00 0.22 H new ATOM 0 HA PHE A 76 -22.559 -3.444 -22.099 1.00 0.23 H new ATOM 0 HB2 PHE A 76 -21.640 -5.623 -21.730 1.00 0.26 H new ATOM 0 HB3 PHE A 76 -20.477 -4.568 -22.507 1.00 0.26 H new ATOM 0 HD1 PHE A 76 -21.280 -6.442 -19.459 1.00 0.27 H new ATOM 0 HD2 PHE A 76 -18.435 -3.898 -21.375 1.00 0.26 H new ATOM 0 HE1 PHE A 76 -19.591 -7.066 -17.775 1.00 0.29 H new ATOM 0 HE2 PHE A 76 -16.739 -4.539 -19.708 1.00 0.28 H new ATOM 0 HZ PHE A 76 -17.309 -6.133 -17.916 1.00 0.29 H new ATOM 1226 N LYS A 77 -23.967 -4.108 -20.158 1.00 0.23 N ATOM 1227 CA LYS A 77 -24.896 -4.323 -19.044 1.00 0.28 C ATOM 1228 C LYS A 77 -24.801 -5.753 -18.529 1.00 0.31 C ATOM 1229 O LYS A 77 -25.225 -6.693 -19.201 1.00 0.58 O ATOM 1230 CB LYS A 77 -26.334 -4.025 -19.491 1.00 0.36 C ATOM 1231 CG LYS A 77 -26.422 -2.719 -20.287 1.00 1.20 C ATOM 1232 CD LYS A 77 -27.764 -2.015 -20.068 1.00 1.33 C ATOM 1233 CE LYS A 77 -28.922 -2.777 -20.721 1.00 1.76 C ATOM 1234 NZ LYS A 77 -29.444 -3.853 -19.832 1.00 1.95 N ATOM 0 H LYS A 77 -24.384 -4.252 -21.078 1.00 0.23 H new ATOM 0 HA LYS A 77 -24.623 -3.645 -18.236 1.00 0.28 H new ATOM 0 HB2 LYS A 77 -26.703 -4.849 -20.102 1.00 0.36 H new ATOM 0 HB3 LYS A 77 -26.981 -3.962 -18.616 1.00 0.36 H new ATOM 0 HG2 LYS A 77 -25.610 -2.056 -19.990 1.00 1.20 H new ATOM 0 HG3 LYS A 77 -26.290 -2.929 -21.348 1.00 1.20 H new ATOM 0 HD2 LYS A 77 -27.952 -1.916 -18.999 1.00 1.33 H new ATOM 0 HD3 LYS A 77 -27.716 -1.006 -20.478 1.00 1.33 H new ATOM 0 HE2 LYS A 77 -29.726 -2.081 -20.961 1.00 1.76 H new ATOM 0 HE3 LYS A 77 -28.586 -3.213 -21.662 1.00 1.76 H new ATOM 0 HZ1 LYS A 77 -29.149 -4.780 -20.199 1.00 1.95 H new ATOM 0 HZ2 LYS A 77 -29.065 -3.724 -18.872 1.00 1.95 H new ATOM 0 HZ3 LYS A 77 -30.483 -3.806 -19.804 1.00 1.95 H new ATOM 1248 N LEU A 78 -24.261 -5.899 -17.324 1.00 0.23 N ATOM 1249 CA LEU A 78 -24.106 -7.195 -16.667 1.00 0.24 C ATOM 1250 C LEU A 78 -25.147 -7.320 -15.561 1.00 0.29 C ATOM 1251 O LEU A 78 -25.074 -6.619 -14.549 1.00 0.36 O ATOM 1252 CB LEU A 78 -22.695 -7.302 -16.086 1.00 0.30 C ATOM 1253 CG LEU A 78 -22.392 -8.690 -15.538 1.00 0.48 C ATOM 1254 CD1 LEU A 78 -22.856 -9.780 -16.500 1.00 0.30 C ATOM 1255 CD2 LEU A 78 -20.904 -8.845 -15.235 1.00 0.86 C ATOM 0 H LEU A 78 -23.915 -5.116 -16.770 1.00 0.23 H new ATOM 0 HA LEU A 78 -24.252 -8.001 -17.386 1.00 0.24 H new ATOM 0 HB2 LEU A 78 -21.968 -7.054 -16.859 1.00 0.30 H new ATOM 0 HB3 LEU A 78 -22.577 -6.567 -15.290 1.00 0.30 H new ATOM 0 HG LEU A 78 -22.947 -8.803 -14.607 1.00 0.48 H new ATOM 0 HD11 LEU A 78 -22.625 -10.759 -16.080 1.00 0.30 H new ATOM 0 HD12 LEU A 78 -23.932 -9.696 -16.654 1.00 0.30 H new ATOM 0 HD13 LEU A 78 -22.343 -9.665 -17.455 1.00 0.30 H new ATOM 0 HD21 LEU A 78 -20.714 -9.845 -14.845 1.00 0.86 H new ATOM 0 HD22 LEU A 78 -20.329 -8.697 -16.149 1.00 0.86 H new ATOM 0 HD23 LEU A 78 -20.604 -8.104 -14.494 1.00 0.86 H new ATOM 1267 N ARG A 79 -26.119 -8.198 -15.761 1.00 0.31 N ATOM 1268 CA ARG A 79 -27.191 -8.404 -14.786 1.00 0.40 C ATOM 1269 C ARG A 79 -27.239 -9.854 -14.329 1.00 0.45 C ATOM 1270 O ARG A 79 -27.423 -10.767 -15.137 1.00 0.51 O ATOM 1271 CB ARG A 79 -28.542 -8.009 -15.402 1.00 0.50 C ATOM 1272 CG ARG A 79 -29.709 -8.340 -14.463 1.00 1.11 C ATOM 1273 CD ARG A 79 -31.046 -7.893 -15.057 1.00 1.51 C ATOM 1274 NE ARG A 79 -32.122 -8.010 -14.068 1.00 1.91 N ATOM 1275 CZ ARG A 79 -33.374 -7.653 -14.348 1.00 2.46 C ATOM 1276 NH1 ARG A 79 -34.186 -8.505 -14.948 1.00 2.93 N ATOM 1277 NH2 ARG A 79 -33.819 -6.452 -14.016 1.00 2.99 N ATOM 0 H ARG A 79 -26.191 -8.784 -16.593 1.00 0.31 H new ATOM 0 HA ARG A 79 -26.989 -7.776 -13.919 1.00 0.40 H new ATOM 0 HB2 ARG A 79 -28.544 -6.942 -15.623 1.00 0.50 H new ATOM 0 HB3 ARG A 79 -28.677 -8.531 -16.349 1.00 0.50 H new ATOM 0 HG2 ARG A 79 -29.733 -9.413 -14.274 1.00 1.11 H new ATOM 0 HG3 ARG A 79 -29.554 -7.851 -13.501 1.00 1.11 H new ATOM 0 HD2 ARG A 79 -30.970 -6.860 -15.398 1.00 1.51 H new ATOM 0 HD3 ARG A 79 -31.282 -8.500 -15.931 1.00 1.51 H new ATOM 0 HE ARG A 79 -31.906 -8.375 -13.140 1.00 1.91 H new ATOM 0 HH11 ARG A 79 -33.854 -9.437 -15.197 1.00 2.93 H new ATOM 0 HH12 ARG A 79 -35.145 -8.231 -15.162 1.00 2.93 H new ATOM 0 HH21 ARG A 79 -33.202 -5.792 -13.542 1.00 2.99 H new ATOM 0 HH22 ARG A 79 -34.779 -6.186 -14.234 1.00 2.99 H new ATOM 1291 N LEU A 80 -27.131 -10.056 -13.019 1.00 0.54 N ATOM 1292 CA LEU A 80 -27.223 -11.392 -12.435 1.00 0.68 C ATOM 1293 C LEU A 80 -28.706 -11.680 -12.193 1.00 0.84 C ATOM 1294 O LEU A 80 -29.415 -10.840 -11.630 1.00 1.06 O ATOM 1295 CB LEU A 80 -26.436 -11.474 -11.119 1.00 0.82 C ATOM 1296 CG LEU A 80 -25.064 -10.792 -11.210 1.00 0.82 C ATOM 1297 CD1 LEU A 80 -24.283 -10.986 -9.909 1.00 1.06 C ATOM 1298 CD2 LEU A 80 -24.257 -11.323 -12.398 1.00 1.26 C ATOM 0 H LEU A 80 -26.979 -9.310 -12.340 1.00 0.54 H new ATOM 0 HA LEU A 80 -26.791 -12.130 -13.110 1.00 0.68 H new ATOM 0 HB2 LEU A 80 -27.017 -11.009 -10.323 1.00 0.82 H new ATOM 0 HB3 LEU A 80 -26.300 -12.520 -10.845 1.00 0.82 H new ATOM 0 HG LEU A 80 -25.231 -9.726 -11.365 1.00 0.82 H new ATOM 0 HD11 LEU A 80 -23.313 -10.496 -9.991 1.00 1.06 H new ATOM 0 HD12 LEU A 80 -24.841 -10.549 -9.081 1.00 1.06 H new ATOM 0 HD13 LEU A 80 -24.138 -12.051 -9.727 1.00 1.06 H new ATOM 0 HD21 LEU A 80 -23.291 -10.820 -12.435 1.00 1.26 H new ATOM 0 HD22 LEU A 80 -24.104 -12.396 -12.283 1.00 1.26 H new ATOM 0 HD23 LEU A 80 -24.801 -11.131 -13.323 1.00 1.26 H new ATOM 1310 N SER A 81 -29.185 -12.836 -12.644 1.00 1.01 N ATOM 1311 CA SER A 81 -30.581 -13.214 -12.507 1.00 1.23 C ATOM 1312 C SER A 81 -31.052 -13.214 -11.045 1.00 1.40 C ATOM 1313 O SER A 81 -32.213 -12.921 -10.765 1.00 1.92 O ATOM 1314 CB SER A 81 -30.745 -14.578 -13.137 1.00 1.52 C ATOM 1315 OG SER A 81 -30.386 -14.536 -14.515 1.00 2.18 O ATOM 0 H SER A 81 -28.612 -13.536 -13.115 1.00 1.01 H new ATOM 0 HA SER A 81 -31.206 -12.478 -13.012 1.00 1.23 H new ATOM 0 HB2 SER A 81 -30.122 -15.304 -12.615 1.00 1.52 H new ATOM 0 HB3 SER A 81 -31.778 -14.911 -13.034 1.00 1.52 H new ATOM 0 HG SER A 81 -29.410 -14.555 -14.599 1.00 2.18 H new ATOM 1321 N ASP A 82 -30.140 -13.515 -10.126 1.00 1.33 N ATOM 1322 CA ASP A 82 -30.437 -13.531 -8.695 1.00 1.76 C ATOM 1323 C ASP A 82 -29.311 -12.816 -7.952 1.00 1.31 C ATOM 1324 O ASP A 82 -28.623 -13.410 -7.119 1.00 1.74 O ATOM 1325 CB ASP A 82 -30.568 -14.984 -8.213 1.00 2.76 C ATOM 1326 CG ASP A 82 -31.175 -15.044 -6.813 1.00 3.46 C ATOM 1327 OD1 ASP A 82 -32.241 -14.431 -6.594 1.00 3.98 O ATOM 1328 OD2 ASP A 82 -30.591 -15.707 -5.929 1.00 3.77 O ATOM 0 H ASP A 82 -29.174 -13.755 -10.351 1.00 1.33 H new ATOM 0 HA ASP A 82 -31.378 -13.018 -8.498 1.00 1.76 H new ATOM 0 HB2 ASP A 82 -31.192 -15.547 -8.908 1.00 2.76 H new ATOM 0 HB3 ASP A 82 -29.587 -15.459 -8.209 1.00 2.76 H new ATOM 1333 N GLY A 83 -29.103 -11.539 -8.272 1.00 1.09 N ATOM 1334 CA GLY A 83 -28.039 -10.769 -7.641 1.00 1.53 C ATOM 1335 C GLY A 83 -28.261 -9.263 -7.755 1.00 1.31 C ATOM 1336 O GLY A 83 -29.161 -8.706 -7.092 1.00 1.88 O ATOM 0 H GLY A 83 -29.653 -11.022 -8.958 1.00 1.09 H new ATOM 0 HA2 GLY A 83 -27.971 -11.044 -6.589 1.00 1.53 H new ATOM 0 HA3 GLY A 83 -27.085 -11.028 -8.101 1.00 1.53 H new ATOM 1340 N ASN A 84 -27.403 -8.600 -8.570 1.00 0.93 N ATOM 1341 CA ASN A 84 -27.440 -7.148 -8.759 1.00 0.71 C ATOM 1342 C ASN A 84 -27.343 -6.830 -10.250 1.00 0.62 C ATOM 1343 O ASN A 84 -26.965 -7.696 -11.049 1.00 0.65 O ATOM 1344 CB ASN A 84 -26.224 -6.493 -8.059 1.00 0.84 C ATOM 1345 CG ASN A 84 -26.093 -6.858 -6.567 1.00 1.02 C ATOM 1346 OD1 ASN A 84 -26.214 -8.019 -6.179 1.00 1.73 O ATOM 1347 ND2 ASN A 84 -25.807 -5.871 -5.731 1.00 1.32 N ATOM 0 H ASN A 84 -26.672 -9.065 -9.108 1.00 0.93 H new ATOM 0 HA ASN A 84 -28.370 -6.765 -8.339 1.00 0.71 H new ATOM 0 HB2 ASN A 84 -25.313 -6.792 -8.578 1.00 0.84 H new ATOM 0 HB3 ASN A 84 -26.303 -5.410 -8.153 1.00 0.84 H new ATOM 0 HD21 ASN A 84 -25.681 -6.064 -4.737 1.00 1.32 H new ATOM 0 HD22 ASN A 84 -25.713 -4.918 -6.081 1.00 1.32 H new ATOM 1354 N GLU A 85 -27.640 -5.575 -10.600 1.00 0.59 N ATOM 1355 CA GLU A 85 -27.556 -5.067 -11.975 1.00 0.55 C ATOM 1356 C GLU A 85 -26.390 -4.081 -12.041 1.00 0.47 C ATOM 1357 O GLU A 85 -26.425 -3.042 -11.372 1.00 0.60 O ATOM 1358 CB GLU A 85 -28.854 -4.343 -12.336 1.00 0.70 C ATOM 1359 CG GLU A 85 -29.914 -5.317 -12.847 1.00 1.16 C ATOM 1360 CD GLU A 85 -31.232 -4.592 -13.091 1.00 1.18 C ATOM 1361 OE1 GLU A 85 -31.258 -3.653 -13.910 1.00 1.43 O ATOM 1362 OE2 GLU A 85 -32.243 -4.963 -12.465 1.00 1.39 O ATOM 0 H GLU A 85 -27.950 -4.873 -9.928 1.00 0.59 H new ATOM 0 HA GLU A 85 -27.404 -5.889 -12.674 1.00 0.55 H new ATOM 0 HB2 GLU A 85 -29.234 -3.816 -11.460 1.00 0.70 H new ATOM 0 HB3 GLU A 85 -28.652 -3.590 -13.098 1.00 0.70 H new ATOM 0 HG2 GLU A 85 -29.572 -5.784 -13.771 1.00 1.16 H new ATOM 0 HG3 GLU A 85 -30.061 -6.117 -12.121 1.00 1.16 H new ATOM 1369 N TYR A 86 -25.360 -4.404 -12.821 1.00 0.33 N ATOM 1370 CA TYR A 86 -24.175 -3.542 -12.936 1.00 0.31 C ATOM 1371 C TYR A 86 -23.864 -3.170 -14.390 1.00 0.29 C ATOM 1372 O TYR A 86 -23.937 -4.008 -15.290 1.00 0.40 O ATOM 1373 CB TYR A 86 -22.938 -4.262 -12.371 1.00 0.37 C ATOM 1374 CG TYR A 86 -23.051 -4.764 -10.948 1.00 0.41 C ATOM 1375 CD1 TYR A 86 -23.362 -3.900 -9.908 1.00 0.57 C ATOM 1376 CD2 TYR A 86 -22.767 -6.093 -10.675 1.00 0.53 C ATOM 1377 CE1 TYR A 86 -23.386 -4.369 -8.606 1.00 0.67 C ATOM 1378 CE2 TYR A 86 -22.805 -6.560 -9.378 1.00 0.62 C ATOM 1379 CZ TYR A 86 -23.106 -5.697 -8.347 1.00 0.63 C ATOM 1380 OH TYR A 86 -23.116 -6.165 -7.052 1.00 0.77 O ATOM 0 H TYR A 86 -25.318 -5.254 -13.384 1.00 0.33 H new ATOM 0 HA TYR A 86 -24.399 -2.635 -12.374 1.00 0.31 H new ATOM 0 HB2 TYR A 86 -22.710 -5.110 -13.017 1.00 0.37 H new ATOM 0 HB3 TYR A 86 -22.089 -3.581 -12.428 1.00 0.37 H new ATOM 0 HD1 TYR A 86 -23.585 -2.864 -10.114 1.00 0.57 H new ATOM 0 HD2 TYR A 86 -22.515 -6.766 -11.481 1.00 0.53 H new ATOM 0 HE1 TYR A 86 -23.623 -3.698 -7.794 1.00 0.67 H new ATOM 0 HE2 TYR A 86 -22.599 -7.600 -9.171 1.00 0.62 H new ATOM 0 HH TYR A 86 -22.899 -7.121 -7.048 1.00 0.77 H new ATOM 1390 N LEU A 87 -23.434 -1.921 -14.590 1.00 0.24 N ATOM 1391 CA LEU A 87 -23.008 -1.425 -15.901 1.00 0.23 C ATOM 1392 C LEU A 87 -21.487 -1.370 -15.877 1.00 0.22 C ATOM 1393 O LEU A 87 -20.912 -0.542 -15.164 1.00 0.32 O ATOM 1394 CB LEU A 87 -23.545 -0.015 -16.188 1.00 0.26 C ATOM 1395 CG LEU A 87 -25.065 0.029 -16.353 1.00 0.34 C ATOM 1396 CD1 LEU A 87 -25.476 1.331 -17.039 1.00 0.35 C ATOM 1397 CD2 LEU A 87 -25.588 -1.172 -17.137 1.00 0.38 C ATOM 0 H LEU A 87 -23.372 -1.225 -13.847 1.00 0.24 H new ATOM 0 HA LEU A 87 -23.393 -2.086 -16.678 1.00 0.23 H new ATOM 0 HB2 LEU A 87 -23.255 0.650 -15.374 1.00 0.26 H new ATOM 0 HB3 LEU A 87 -23.076 0.368 -17.095 1.00 0.26 H new ATOM 0 HG LEU A 87 -25.510 -0.014 -15.359 1.00 0.34 H new ATOM 0 HD11 LEU A 87 -26.560 1.356 -17.153 1.00 0.35 H new ATOM 0 HD12 LEU A 87 -25.156 2.178 -16.433 1.00 0.35 H new ATOM 0 HD13 LEU A 87 -25.006 1.389 -18.021 1.00 0.35 H new ATOM 0 HD21 LEU A 87 -26.672 -1.101 -17.231 1.00 0.38 H new ATOM 0 HD22 LEU A 87 -25.138 -1.183 -18.130 1.00 0.38 H new ATOM 0 HD23 LEU A 87 -25.329 -2.091 -16.611 1.00 0.38 H new ATOM 1409 N PHE A 88 -20.836 -2.250 -16.628 1.00 0.18 N ATOM 1410 CA PHE A 88 -19.373 -2.299 -16.670 1.00 0.19 C ATOM 1411 C PHE A 88 -18.870 -1.613 -17.931 1.00 0.20 C ATOM 1412 O PHE A 88 -19.353 -1.882 -19.031 1.00 0.27 O ATOM 1413 CB PHE A 88 -18.891 -3.746 -16.605 1.00 0.20 C ATOM 1414 CG PHE A 88 -18.921 -4.301 -15.203 1.00 0.20 C ATOM 1415 CD1 PHE A 88 -17.955 -3.928 -14.287 1.00 0.21 C ATOM 1416 CD2 PHE A 88 -19.910 -5.197 -14.836 1.00 0.24 C ATOM 1417 CE1 PHE A 88 -17.981 -4.443 -13.006 1.00 0.22 C ATOM 1418 CE2 PHE A 88 -19.938 -5.712 -13.555 1.00 0.25 C ATOM 1419 CZ PHE A 88 -18.979 -5.304 -12.625 1.00 0.22 C ATOM 0 H PHE A 88 -21.296 -2.942 -17.219 1.00 0.18 H new ATOM 0 HA PHE A 88 -18.971 -1.770 -15.806 1.00 0.19 H new ATOM 0 HB2 PHE A 88 -19.516 -4.363 -17.250 1.00 0.20 H new ATOM 0 HB3 PHE A 88 -17.875 -3.805 -16.994 1.00 0.20 H new ATOM 0 HD1 PHE A 88 -17.179 -3.233 -14.574 1.00 0.21 H new ATOM 0 HD2 PHE A 88 -20.661 -5.494 -15.553 1.00 0.24 H new ATOM 0 HE1 PHE A 88 -17.212 -4.167 -12.300 1.00 0.22 H new ATOM 0 HE2 PHE A 88 -20.697 -6.427 -13.274 1.00 0.25 H new ATOM 0 HZ PHE A 88 -19.023 -5.665 -11.608 1.00 0.22 H new ATOM 1429 N GLN A 89 -17.914 -0.706 -17.761 1.00 0.23 N ATOM 1430 CA GLN A 89 -17.351 0.054 -18.874 1.00 0.26 C ATOM 1431 C GLN A 89 -15.839 -0.166 -18.955 1.00 0.22 C ATOM 1432 O GLN A 89 -15.108 0.066 -17.986 1.00 0.25 O ATOM 1433 CB GLN A 89 -17.720 1.541 -18.698 1.00 0.32 C ATOM 1434 CG GLN A 89 -16.612 2.504 -19.132 1.00 0.52 C ATOM 1435 CD GLN A 89 -17.175 3.911 -19.342 1.00 0.75 C ATOM 1436 OE1 GLN A 89 -16.772 4.617 -20.263 1.00 1.34 O ATOM 1437 NE2 GLN A 89 -18.115 4.317 -18.495 1.00 1.63 N ATOM 0 H GLN A 89 -17.509 -0.477 -16.854 1.00 0.23 H new ATOM 0 HA GLN A 89 -17.769 -0.291 -19.820 1.00 0.26 H new ATOM 0 HB2 GLN A 89 -18.621 1.754 -19.274 1.00 0.32 H new ATOM 0 HB3 GLN A 89 -17.960 1.725 -17.651 1.00 0.32 H new ATOM 0 HG2 GLN A 89 -15.828 2.529 -18.376 1.00 0.52 H new ATOM 0 HG3 GLN A 89 -16.154 2.148 -20.055 1.00 0.52 H new ATOM 0 HE21 GLN A 89 -18.424 3.702 -17.742 1.00 1.63 H new ATOM 0 HE22 GLN A 89 -18.528 5.244 -18.598 1.00 1.63 H new ATOM 1446 N ALA A 90 -15.391 -0.609 -20.132 1.00 0.22 N ATOM 1447 CA ALA A 90 -13.976 -0.871 -20.406 1.00 0.24 C ATOM 1448 C ALA A 90 -13.365 0.299 -21.175 1.00 0.27 C ATOM 1449 O ALA A 90 -14.078 1.168 -21.688 1.00 0.32 O ATOM 1450 CB ALA A 90 -13.827 -2.156 -21.231 1.00 0.29 C ATOM 0 H ALA A 90 -16.003 -0.797 -20.926 1.00 0.22 H new ATOM 0 HA ALA A 90 -13.455 -0.990 -19.456 1.00 0.24 H new ATOM 0 HB1 ALA A 90 -12.771 -2.341 -21.429 1.00 0.29 H new ATOM 0 HB2 ALA A 90 -14.245 -2.996 -20.675 1.00 0.29 H new ATOM 0 HB3 ALA A 90 -14.359 -2.046 -22.176 1.00 0.29 H new ATOM 1456 N LYS A 91 -12.041 0.309 -21.253 1.00 0.35 N ATOM 1457 CA LYS A 91 -11.303 1.358 -21.951 1.00 0.44 C ATOM 1458 C LYS A 91 -11.244 1.073 -23.458 1.00 0.49 C ATOM 1459 O LYS A 91 -11.530 1.955 -24.275 1.00 0.68 O ATOM 1460 CB LYS A 91 -9.875 1.497 -21.375 1.00 0.65 C ATOM 1461 CG LYS A 91 -9.482 0.361 -20.414 1.00 1.26 C ATOM 1462 CD LYS A 91 -10.063 0.592 -19.015 1.00 1.43 C ATOM 1463 CE LYS A 91 -10.280 -0.717 -18.250 1.00 1.86 C ATOM 1464 NZ LYS A 91 -9.055 -1.570 -18.248 1.00 2.29 N ATOM 0 H LYS A 91 -11.447 -0.408 -20.836 1.00 0.35 H new ATOM 0 HA LYS A 91 -11.831 2.299 -21.799 1.00 0.44 H new ATOM 0 HB2 LYS A 91 -9.162 1.527 -22.199 1.00 0.65 H new ATOM 0 HB3 LYS A 91 -9.796 2.449 -20.850 1.00 0.65 H new ATOM 0 HG2 LYS A 91 -9.840 -0.591 -20.806 1.00 1.26 H new ATOM 0 HG3 LYS A 91 -8.396 0.292 -20.353 1.00 1.26 H new ATOM 0 HD2 LYS A 91 -9.391 1.235 -18.447 1.00 1.43 H new ATOM 0 HD3 LYS A 91 -11.012 1.121 -19.101 1.00 1.43 H new ATOM 0 HE2 LYS A 91 -10.569 -0.494 -17.223 1.00 1.86 H new ATOM 0 HE3 LYS A 91 -11.106 -1.268 -18.700 1.00 1.86 H new ATOM 0 HZ1 LYS A 91 -9.215 -2.406 -17.650 1.00 2.29 H new ATOM 0 HZ2 LYS A 91 -8.842 -1.874 -19.219 1.00 2.29 H new ATOM 0 HZ3 LYS A 91 -8.253 -1.025 -17.873 1.00 2.29 H new ATOM 1478 N ASP A 92 -10.852 -0.153 -23.813 1.00 0.49 N ATOM 1479 CA ASP A 92 -10.723 -0.567 -25.223 1.00 0.66 C ATOM 1480 C ASP A 92 -11.823 -1.560 -25.611 1.00 0.59 C ATOM 1481 O ASP A 92 -12.328 -2.317 -24.773 1.00 0.75 O ATOM 1482 CB ASP A 92 -9.336 -1.203 -25.445 1.00 0.84 C ATOM 1483 CG ASP A 92 -9.015 -1.338 -26.932 1.00 1.34 C ATOM 1484 OD1 ASP A 92 -8.517 -0.362 -27.530 1.00 1.77 O ATOM 1485 OD2 ASP A 92 -9.261 -2.418 -27.507 1.00 2.01 O ATOM 0 H ASP A 92 -10.616 -0.885 -23.143 1.00 0.49 H new ATOM 0 HA ASP A 92 -10.829 0.315 -25.855 1.00 0.66 H new ATOM 0 HB2 ASP A 92 -8.573 -0.593 -24.961 1.00 0.84 H new ATOM 0 HB3 ASP A 92 -9.305 -2.186 -24.974 1.00 0.84 H new ATOM 1490 N ASP A 93 -12.169 -1.562 -26.904 1.00 0.62 N ATOM 1491 CA ASP A 93 -13.191 -2.465 -27.467 1.00 0.63 C ATOM 1492 C ASP A 93 -12.740 -3.928 -27.343 1.00 0.49 C ATOM 1493 O ASP A 93 -13.544 -4.817 -27.050 1.00 0.54 O ATOM 1494 CB ASP A 93 -13.437 -2.105 -28.946 1.00 0.83 C ATOM 1495 CG ASP A 93 -14.474 -3.028 -29.589 1.00 1.55 C ATOM 1496 OD1 ASP A 93 -15.683 -2.751 -29.478 1.00 2.21 O ATOM 1497 OD2 ASP A 93 -14.076 -4.030 -30.218 1.00 2.13 O ATOM 0 H ASP A 93 -11.750 -0.938 -27.594 1.00 0.62 H new ATOM 0 HA ASP A 93 -14.120 -2.345 -26.909 1.00 0.63 H new ATOM 0 HB2 ASP A 93 -13.776 -1.072 -29.017 1.00 0.83 H new ATOM 0 HB3 ASP A 93 -12.499 -2.172 -29.497 1.00 0.83 H new ATOM 1502 N GLU A 94 -11.439 -4.164 -27.548 1.00 0.41 N ATOM 1503 CA GLU A 94 -10.852 -5.506 -27.448 1.00 0.41 C ATOM 1504 C GLU A 94 -11.022 -6.047 -26.024 1.00 0.36 C ATOM 1505 O GLU A 94 -11.371 -7.212 -25.824 1.00 0.41 O ATOM 1506 CB GLU A 94 -9.365 -5.451 -27.827 1.00 0.49 C ATOM 1507 CG GLU A 94 -8.849 -6.818 -28.305 1.00 1.21 C ATOM 1508 CD GLU A 94 -8.765 -6.868 -29.827 1.00 1.93 C ATOM 1509 OE1 GLU A 94 -8.096 -6.004 -30.423 1.00 2.43 O ATOM 1510 OE2 GLU A 94 -9.380 -7.768 -30.434 1.00 2.59 O ATOM 0 H GLU A 94 -10.767 -3.435 -27.787 1.00 0.41 H new ATOM 0 HA GLU A 94 -11.366 -6.176 -28.137 1.00 0.41 H new ATOM 0 HB2 GLU A 94 -9.217 -4.711 -28.613 1.00 0.49 H new ATOM 0 HB3 GLU A 94 -8.782 -5.123 -26.967 1.00 0.49 H new ATOM 0 HG2 GLU A 94 -7.865 -7.010 -27.876 1.00 1.21 H new ATOM 0 HG3 GLU A 94 -9.512 -7.606 -27.948 1.00 1.21 H new ATOM 1517 N GLU A 95 -10.802 -5.176 -25.035 1.00 0.31 N ATOM 1518 CA GLU A 95 -10.952 -5.539 -23.624 1.00 0.29 C ATOM 1519 C GLU A 95 -12.430 -5.809 -23.304 1.00 0.24 C ATOM 1520 O GLU A 95 -12.755 -6.806 -22.658 1.00 0.23 O ATOM 1521 CB GLU A 95 -10.394 -4.428 -22.725 1.00 0.33 C ATOM 1522 CG GLU A 95 -9.977 -4.984 -21.359 1.00 0.42 C ATOM 1523 CD GLU A 95 -9.720 -3.859 -20.370 1.00 0.84 C ATOM 1524 OE1 GLU A 95 -8.576 -3.362 -20.306 1.00 1.21 O ATOM 1525 OE2 GLU A 95 -10.657 -3.466 -19.655 1.00 1.30 O ATOM 0 H GLU A 95 -10.518 -4.208 -25.188 1.00 0.31 H new ATOM 0 HA GLU A 95 -10.385 -6.449 -23.431 1.00 0.29 H new ATOM 0 HB2 GLU A 95 -9.536 -3.961 -23.209 1.00 0.33 H new ATOM 0 HB3 GLU A 95 -11.147 -3.651 -22.591 1.00 0.33 H new ATOM 0 HG2 GLU A 95 -10.759 -5.640 -20.975 1.00 0.42 H new ATOM 0 HG3 GLU A 95 -9.078 -5.590 -21.468 1.00 0.42 H new ATOM 1532 N MET A 96 -13.317 -4.926 -23.790 1.00 0.24 N ATOM 1533 CA MET A 96 -14.772 -5.061 -23.590 1.00 0.22 C ATOM 1534 C MET A 96 -15.264 -6.426 -24.084 1.00 0.22 C ATOM 1535 O MET A 96 -15.973 -7.134 -23.369 1.00 0.23 O ATOM 1536 CB MET A 96 -15.510 -3.937 -24.339 1.00 0.26 C ATOM 1537 CG MET A 96 -17.036 -4.108 -24.286 1.00 0.39 C ATOM 1538 SD MET A 96 -17.698 -4.935 -25.749 1.00 0.94 S ATOM 1539 CE MET A 96 -17.584 -3.634 -26.991 1.00 0.77 C ATOM 0 H MET A 96 -13.050 -4.103 -24.330 1.00 0.24 H new ATOM 0 HA MET A 96 -14.982 -4.983 -22.523 1.00 0.22 H new ATOM 0 HB2 MET A 96 -15.239 -2.975 -23.905 1.00 0.26 H new ATOM 0 HB3 MET A 96 -15.184 -3.921 -25.379 1.00 0.26 H new ATOM 0 HG2 MET A 96 -17.302 -4.682 -23.398 1.00 0.39 H new ATOM 0 HG3 MET A 96 -17.504 -3.129 -24.185 1.00 0.39 H new ATOM 0 HE1 MET A 96 -17.416 -4.080 -27.971 1.00 0.77 H new ATOM 0 HE2 MET A 96 -18.513 -3.064 -27.007 1.00 0.77 H new ATOM 0 HE3 MET A 96 -16.755 -2.970 -26.747 1.00 0.77 H new ATOM 1549 N ASN A 97 -14.871 -6.790 -25.307 1.00 0.25 N ATOM 1550 CA ASN A 97 -15.264 -8.074 -25.906 1.00 0.28 C ATOM 1551 C ASN A 97 -14.775 -9.248 -25.047 1.00 0.26 C ATOM 1552 O ASN A 97 -15.531 -10.179 -24.768 1.00 0.29 O ATOM 1553 CB ASN A 97 -14.696 -8.186 -27.331 1.00 0.35 C ATOM 1554 CG ASN A 97 -15.368 -9.332 -28.094 1.00 0.49 C ATOM 1555 OD1 ASN A 97 -16.459 -9.169 -28.639 1.00 1.05 O ATOM 1556 ND2 ASN A 97 -14.723 -10.488 -28.127 1.00 1.24 N ATOM 0 H ASN A 97 -14.279 -6.214 -25.906 1.00 0.25 H new ATOM 0 HA ASN A 97 -16.352 -8.114 -25.952 1.00 0.28 H new ATOM 0 HB2 ASN A 97 -14.851 -7.248 -27.864 1.00 0.35 H new ATOM 0 HB3 ASN A 97 -13.620 -8.354 -27.287 1.00 0.35 H new ATOM 0 HD21 ASN A 97 -15.129 -11.285 -28.617 1.00 1.24 H new ATOM 0 HD22 ASN A 97 -13.820 -10.582 -27.662 1.00 1.24 H new ATOM 1563 N THR A 98 -13.508 -9.191 -24.627 1.00 0.25 N ATOM 1564 CA THR A 98 -12.904 -10.243 -23.797 1.00 0.27 C ATOM 1565 C THR A 98 -13.627 -10.374 -22.445 1.00 0.23 C ATOM 1566 O THR A 98 -13.851 -11.486 -21.965 1.00 0.27 O ATOM 1567 CB THR A 98 -11.408 -9.948 -23.590 1.00 0.31 C ATOM 1568 OG1 THR A 98 -10.818 -9.553 -24.823 1.00 0.38 O ATOM 1569 CG2 THR A 98 -10.672 -11.174 -23.044 1.00 0.39 C ATOM 0 H THR A 98 -12.875 -8.423 -24.849 1.00 0.25 H new ATOM 0 HA THR A 98 -13.010 -11.195 -24.316 1.00 0.27 H new ATOM 0 HB THR A 98 -11.321 -9.141 -22.863 1.00 0.31 H new ATOM 0 HG1 THR A 98 -10.941 -8.589 -24.951 1.00 0.38 H new ATOM 0 HG21 THR A 98 -9.617 -10.935 -22.908 1.00 0.39 H new ATOM 0 HG22 THR A 98 -11.105 -11.462 -22.086 1.00 0.39 H new ATOM 0 HG23 THR A 98 -10.769 -12.000 -23.748 1.00 0.39 H new ATOM 1577 N TRP A 99 -14.003 -9.238 -21.845 1.00 0.20 N ATOM 1578 CA TRP A 99 -14.714 -9.226 -20.557 1.00 0.20 C ATOM 1579 C TRP A 99 -16.063 -9.944 -20.687 1.00 0.21 C ATOM 1580 O TRP A 99 -16.372 -10.854 -19.913 1.00 0.24 O ATOM 1581 CB TRP A 99 -14.941 -7.777 -20.083 1.00 0.21 C ATOM 1582 CG TRP A 99 -13.782 -7.201 -19.317 1.00 0.22 C ATOM 1583 CD1 TRP A 99 -13.047 -6.098 -19.655 1.00 0.26 C ATOM 1584 CD2 TRP A 99 -13.228 -7.693 -18.077 1.00 0.22 C ATOM 1585 NE1 TRP A 99 -12.097 -5.891 -18.698 1.00 0.28 N ATOM 1586 CE2 TRP A 99 -12.173 -6.840 -17.728 1.00 0.26 C ATOM 1587 CE3 TRP A 99 -13.525 -8.764 -17.233 1.00 0.23 C ATOM 1588 CZ2 TRP A 99 -11.422 -7.033 -16.581 1.00 0.28 C ATOM 1589 CZ3 TRP A 99 -12.775 -8.962 -16.082 1.00 0.26 C ATOM 1590 CH2 TRP A 99 -11.733 -8.102 -15.759 1.00 0.29 C ATOM 0 H TRP A 99 -13.827 -8.311 -22.231 1.00 0.20 H new ATOM 0 HA TRP A 99 -14.102 -9.748 -19.822 1.00 0.20 H new ATOM 0 HB2 TRP A 99 -15.140 -7.148 -20.950 1.00 0.21 H new ATOM 0 HB3 TRP A 99 -15.831 -7.745 -19.455 1.00 0.21 H new ATOM 0 HD1 TRP A 99 -13.195 -5.490 -20.536 1.00 0.26 H new ATOM 0 HE1 TRP A 99 -11.421 -5.127 -18.709 1.00 0.28 H new ATOM 0 HE3 TRP A 99 -14.335 -9.436 -17.474 1.00 0.23 H new ATOM 0 HZ2 TRP A 99 -10.611 -6.364 -16.333 1.00 0.28 H new ATOM 0 HZ3 TRP A 99 -13.004 -9.793 -15.431 1.00 0.26 H new ATOM 0 HH2 TRP A 99 -11.161 -8.269 -14.859 1.00 0.29 H new ATOM 1601 N ILE A 100 -16.855 -9.537 -21.682 1.00 0.21 N ATOM 1602 CA ILE A 100 -18.172 -10.136 -21.940 1.00 0.24 C ATOM 1603 C ILE A 100 -18.031 -11.638 -22.241 1.00 0.28 C ATOM 1604 O ILE A 100 -18.812 -12.454 -21.748 1.00 0.34 O ATOM 1605 CB ILE A 100 -18.856 -9.401 -23.105 1.00 0.25 C ATOM 1606 CG1 ILE A 100 -19.129 -7.939 -22.726 1.00 0.25 C ATOM 1607 CG2 ILE A 100 -20.165 -10.086 -23.503 1.00 0.30 C ATOM 1608 CD1 ILE A 100 -19.699 -7.149 -23.903 1.00 0.29 C ATOM 0 H ILE A 100 -16.606 -8.789 -22.329 1.00 0.21 H new ATOM 0 HA ILE A 100 -18.793 -10.032 -21.050 1.00 0.24 H new ATOM 0 HB ILE A 100 -18.180 -9.432 -23.960 1.00 0.25 H new ATOM 0 HG12 ILE A 100 -19.828 -7.904 -21.891 1.00 0.25 H new ATOM 0 HG13 ILE A 100 -18.204 -7.472 -22.387 1.00 0.25 H new ATOM 0 HG21 ILE A 100 -20.624 -9.542 -24.329 1.00 0.30 H new ATOM 0 HG22 ILE A 100 -19.960 -11.111 -23.813 1.00 0.30 H new ATOM 0 HG23 ILE A 100 -20.845 -10.094 -22.651 1.00 0.30 H new ATOM 0 HD11 ILE A 100 -19.879 -6.119 -23.596 1.00 0.29 H new ATOM 0 HD12 ILE A 100 -18.988 -7.163 -24.729 1.00 0.29 H new ATOM 0 HD13 ILE A 100 -20.637 -7.601 -24.225 1.00 0.29 H new ATOM 1620 N GLN A 101 -17.016 -11.998 -23.036 1.00 0.29 N ATOM 1621 CA GLN A 101 -16.752 -13.400 -23.395 1.00 0.35 C ATOM 1622 C GLN A 101 -16.409 -14.231 -22.154 1.00 0.36 C ATOM 1623 O GLN A 101 -16.942 -15.326 -21.964 1.00 0.43 O ATOM 1624 CB GLN A 101 -15.594 -13.476 -24.398 1.00 0.40 C ATOM 1625 CG GLN A 101 -16.007 -12.967 -25.784 1.00 0.48 C ATOM 1626 CD GLN A 101 -16.127 -14.123 -26.773 1.00 1.05 C ATOM 1627 OE1 GLN A 101 -15.119 -14.686 -27.203 1.00 1.81 O ATOM 1628 NE2 GLN A 101 -17.348 -14.477 -27.138 1.00 1.76 N ATOM 0 H GLN A 101 -16.359 -11.334 -23.446 1.00 0.29 H new ATOM 0 HA GLN A 101 -17.656 -13.808 -23.847 1.00 0.35 H new ATOM 0 HB2 GLN A 101 -14.755 -12.886 -24.029 1.00 0.40 H new ATOM 0 HB3 GLN A 101 -15.249 -14.507 -24.477 1.00 0.40 H new ATOM 0 HG2 GLN A 101 -16.960 -12.442 -25.714 1.00 0.48 H new ATOM 0 HG3 GLN A 101 -15.272 -12.248 -26.146 1.00 0.48 H new ATOM 0 HE21 GLN A 101 -18.157 -13.985 -26.758 1.00 1.76 H new ATOM 0 HE22 GLN A 101 -17.481 -15.242 -27.799 1.00 1.76 H new ATOM 1637 N ALA A 102 -15.518 -13.698 -21.312 1.00 0.32 N ATOM 1638 CA ALA A 102 -15.094 -14.380 -20.084 1.00 0.37 C ATOM 1639 C ALA A 102 -16.276 -14.595 -19.137 1.00 0.38 C ATOM 1640 O ALA A 102 -16.458 -15.681 -18.597 1.00 0.48 O ATOM 1641 CB ALA A 102 -13.999 -13.566 -19.388 1.00 0.38 C ATOM 0 H ALA A 102 -15.074 -12.792 -21.459 1.00 0.32 H new ATOM 0 HA ALA A 102 -14.697 -15.359 -20.355 1.00 0.37 H new ATOM 0 HB1 ALA A 102 -13.689 -14.078 -18.477 1.00 0.38 H new ATOM 0 HB2 ALA A 102 -13.143 -13.462 -20.055 1.00 0.38 H new ATOM 0 HB3 ALA A 102 -14.385 -12.578 -19.136 1.00 0.38 H new ATOM 1647 N ILE A 103 -17.086 -13.560 -18.954 1.00 0.33 N ATOM 1648 CA ILE A 103 -18.265 -13.635 -18.082 1.00 0.38 C ATOM 1649 C ILE A 103 -19.305 -14.628 -18.634 1.00 0.47 C ATOM 1650 O ILE A 103 -20.075 -15.216 -17.874 1.00 0.55 O ATOM 1651 CB ILE A 103 -18.879 -12.232 -17.938 1.00 0.37 C ATOM 1652 CG1 ILE A 103 -17.911 -11.303 -17.186 1.00 0.35 C ATOM 1653 CG2 ILE A 103 -20.234 -12.280 -17.221 1.00 0.49 C ATOM 1654 CD1 ILE A 103 -18.101 -9.835 -17.578 1.00 0.35 C ATOM 0 H ILE A 103 -16.952 -12.651 -19.398 1.00 0.33 H new ATOM 0 HA ILE A 103 -17.955 -13.998 -17.102 1.00 0.38 H new ATOM 0 HB ILE A 103 -19.048 -11.838 -18.940 1.00 0.37 H new ATOM 0 HG12 ILE A 103 -18.063 -11.414 -16.112 1.00 0.35 H new ATOM 0 HG13 ILE A 103 -16.884 -11.604 -17.395 1.00 0.35 H new ATOM 0 HG21 ILE A 103 -20.637 -11.271 -17.137 1.00 0.49 H new ATOM 0 HG22 ILE A 103 -20.925 -12.901 -17.791 1.00 0.49 H new ATOM 0 HG23 ILE A 103 -20.104 -12.702 -16.225 1.00 0.49 H new ATOM 0 HD11 ILE A 103 -17.397 -9.216 -17.022 1.00 0.35 H new ATOM 0 HD12 ILE A 103 -17.922 -9.718 -18.647 1.00 0.35 H new ATOM 0 HD13 ILE A 103 -19.119 -9.525 -17.344 1.00 0.35 H new ATOM 1666 N SER A 104 -19.330 -14.802 -19.955 1.00 0.53 N ATOM 1667 CA SER A 104 -20.281 -15.701 -20.603 1.00 0.66 C ATOM 1668 C SER A 104 -19.805 -17.167 -20.620 1.00 0.72 C ATOM 1669 O SER A 104 -20.631 -18.075 -20.516 1.00 0.89 O ATOM 1670 CB SER A 104 -20.530 -15.218 -22.036 1.00 0.81 C ATOM 1671 OG SER A 104 -21.019 -13.878 -22.036 1.00 1.05 O ATOM 0 H SER A 104 -18.698 -14.328 -20.600 1.00 0.53 H new ATOM 0 HA SER A 104 -21.203 -15.678 -20.022 1.00 0.66 H new ATOM 0 HB2 SER A 104 -19.605 -15.273 -22.610 1.00 0.81 H new ATOM 0 HB3 SER A 104 -21.249 -15.873 -22.527 1.00 0.81 H new ATOM 0 HG SER A 104 -20.281 -13.260 -22.220 1.00 1.05 H new ATOM 1677 N SER A 105 -18.497 -17.405 -20.793 1.00 0.80 N ATOM 1678 CA SER A 105 -17.972 -18.784 -20.881 1.00 1.13 C ATOM 1679 C SER A 105 -16.800 -19.073 -19.926 1.00 1.23 C ATOM 1680 O SER A 105 -15.979 -19.947 -20.216 1.00 1.61 O ATOM 1681 CB SER A 105 -17.534 -19.055 -22.327 1.00 1.48 C ATOM 1682 OG SER A 105 -18.495 -18.544 -23.246 1.00 1.63 O ATOM 0 H SER A 105 -17.789 -16.676 -20.874 1.00 0.80 H new ATOM 0 HA SER A 105 -18.780 -19.448 -20.575 1.00 1.13 H new ATOM 0 HB2 SER A 105 -16.564 -18.593 -22.512 1.00 1.48 H new ATOM 0 HB3 SER A 105 -17.410 -20.127 -22.480 1.00 1.48 H new ATOM 0 HG SER A 105 -18.199 -18.724 -24.163 1.00 1.63 H new ATOM 1688 N ALA A 106 -16.721 -18.382 -18.792 1.00 1.29 N ATOM 1689 CA ALA A 106 -15.642 -18.617 -17.823 1.00 1.59 C ATOM 1690 C ALA A 106 -16.097 -18.233 -16.416 1.00 2.40 C ATOM 1691 O ALA A 106 -15.241 -18.123 -15.515 1.00 3.00 O ATOM 1692 CB ALA A 106 -14.385 -17.828 -18.219 1.00 1.90 C ATOM 1693 OXT ALA A 106 -17.316 -18.065 -16.203 1.00 3.05 O ATOM 0 H ALA A 106 -17.385 -17.658 -18.518 1.00 1.29 H new ATOM 0 HA ALA A 106 -15.396 -19.679 -17.827 1.00 1.59 H new ATOM 0 HB1 ALA A 106 -13.595 -18.013 -17.491 1.00 1.90 H new ATOM 0 HB2 ALA A 106 -14.051 -18.147 -19.206 1.00 1.90 H new ATOM 0 HB3 ALA A 106 -14.616 -16.763 -18.241 1.00 1.90 H new TER 1699 ALA A 106