#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cka n ASP 2029N 0.00 0.00 -4.10 -1.43 5.75 -1.26 -5.10 116.55 110.41 2cka n ASP 2029Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 54.79 54.66 2cka n ASP 2029Cb 0.00 0.04 -0.11 0.00 -1.03 0.00 0.00 41.12 40.02 2cka n ASP 2029CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2cka s VAL 2030N -1.58 0.61 -0.39 2.12 1.01 -1.26 -5.07 120.40 115.84 2cka s VAL 2030Ca 0.00 -1.36 0.05 0.00 0.00 0.00 0.00 61.98 60.67 2cka s VAL 2030Cb 0.00 -0.96 0.47 0.00 0.00 0.00 0.00 36.38 35.88 2cka s VAL 2030CO 0.00 -0.53 1.48 -0.67 0.00 0.00 0.00 175.10 175.38 2cka n ASP 2031N 0.98 5.03 0.00 3.32 2.03 -1.26 -4.99 116.55 121.66 2cka n ASP 2031Ca -0.19 -3.77 0.00 0.00 0.52 0.00 0.00 54.79 51.34 2cka n ASP 2031Cb 0.57 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 40.38 2cka n ASP 2031CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2cka n LEU 2032N -0.87 0.00 0.01 -2.67 4.77 -1.26 -4.28 117.00 112.70 2cka n LEU 2032Ca 0.46 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.55 2cka n LEU 2032Cb 0.91 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 42.45 2cka n LEU 2032CO 0.45 0.00 0.84 -1.84 -1.33 0.00 0.00 177.39 175.51 2cka n GLU 2033N 0.00 0.02 -1.72 3.23 0.28 -1.26 -0.95 120.64 120.24 2cka n GLU 2033Ca 0.00 0.16 -0.42 0.00 -0.16 0.00 0.00 57.16 56.73 2cka n GLU 2033Cb 0.00 -1.53 -0.03 0.00 1.43 0.00 0.00 31.44 31.31 2cka n GLU 2033CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 2cka n THR 2034N -1.57 0.14 -2.78 3.84 -1.04 -1.26 -4.67 114.28 106.94 2cka n THR 2034Ca 0.05 -0.03 -0.43 0.00 -2.04 0.00 0.00 64.05 61.60 2cka n THR 2034Cb 0.25 -1.93 -0.03 0.00 -1.82 0.00 0.00 70.33 66.80 2cka n THR 2034CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2cka s ARG 2035N 0.92 3.34 -0.09 -2.82 1.81 -1.26 0.06 118.95 120.90 2cka s ARG 2035Ca 0.74 -1.05 -0.30 0.00 -1.72 0.00 0.00 55.73 53.41 2cka s ARG 2035Cb -0.52 -4.61 -0.03 0.00 -0.45 0.00 0.00 34.95 29.34 2cka s ARG 2035CO 0.35 -1.92 1.26 0.42 -0.68 0.00 0.00 175.30 174.73 2cka s ILE 2036N 4.10 4.18 0.32 1.52 -1.09 -0.97 -4.74 121.20 124.53 2cka s ILE 2036Ca 0.31 1.48 -0.29 0.00 -2.23 0.00 0.00 60.65 59.93 2cka s ILE 2036Cb -0.09 -3.96 -0.10 0.00 -1.58 0.00 0.00 42.46 36.73 2cka s ILE 2036CO 0.02 -0.06 1.27 -2.84 -1.23 0.00 0.00 174.94 172.11 2cka s PRO 2037N 2.81 4.40 0.15 2.79 0.02 -1.26 -4.17 135.00 139.74 2cka s PRO 2037Ca 0.57 2.15 0.08 0.00 0.02 0.00 0.00 61.00 63.81 2cka s PRO 2037Cb -0.24 -3.09 -0.04 0.00 0.02 0.00 0.00 34.50 31.14 2cka s PRO 2037CO 0.20 -0.12 -0.17 0.14 -0.33 0.00 0.00 177.00 176.71 2cka s VAL 2038N -1.12 1.69 0.05 3.83 -7.23 -0.78 -0.77 120.40 116.07 2cka s VAL 2038Ca 0.48 -1.83 -0.00 0.00 -1.81 0.00 0.00 61.98 58.82 2cka s VAL 2038Cb -0.38 -1.73 -0.03 0.00 0.56 0.00 0.00 36.38 34.79 2cka s VAL 2038CO 0.51 -0.31 -0.03 -0.51 -0.31 0.00 0.00 175.10 174.44 2cka s ILE 2039N -1.97 0.24 0.36 -0.62 2.07 0.86 0.30 121.20 122.44 2cka s ILE 2039Ca 0.13 -1.58 -0.27 0.00 -1.41 0.00 0.00 60.65 57.52 2cka s ILE 2039Cb -0.06 -1.20 -0.12 0.00 0.13 0.00 0.00 42.46 41.21 2cka s ILE 2039CO 0.05 -0.85 1.26 0.59 -1.91 0.00 0.00 174.94 174.08 2cka n ASN 2040N 0.50 2.56 0.09 4.50 5.03 0.77 -0.36 115.26 128.35 2cka n ASN 2040Ca -0.17 1.17 0.12 0.00 0.87 0.00 0.00 54.58 56.58 2cka n ASN 2040Cb 0.59 -1.47 0.45 0.00 -1.02 0.00 0.00 39.78 38.34 2cka n ASN 2040CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2cka n LYS 2041N 0.42 0.16 0.24 3.52 5.02 -0.40 -0.94 118.16 126.18 2cka n LYS 2041Ca 0.06 0.28 0.14 0.00 -2.02 0.00 0.00 58.31 56.76 2cka n LYS 2041Cb 0.37 -1.75 0.36 0.00 -0.02 0.00 0.00 35.03 33.99 2cka n LYS 2041CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2cka h VAL 2042N 0.00 0.00 -3.75 -0.18 2.07 -1.90 -3.48 116.25 109.01 2cka h VAL 2042Ca 0.00 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.71 2cka h VAL 2042Cb 0.48 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2cka h VAL 2042CO 0.00 0.00 -0.34 0.47 0.02 0.00 0.00 177.57 177.72 2cka n ASP 2043N -3.07 -4.12 0.05 0.57 8.00 -0.11 -5.02 116.55 112.85 2cka n ASP 2043Ca 0.03 0.48 0.00 0.00 0.71 0.00 0.00 54.79 56.01 2cka n ASP 2043Cb 0.45 -2.53 0.00 0.00 -0.02 0.00 0.00 41.12 39.02 2cka n ASP 2043CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2cka n GLY 2044N 0.19 -1.87 3.55 0.44 0.00 -1.26 -4.98 105.19 101.28 2cka n GLY 2044Ca 0.00 0.50 -0.40 0.00 0.00 0.00 0.00 46.02 46.12 2cka n GLY 2044CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cka s THR 2045N -1.26 3.52 -0.09 2.61 2.01 -1.26 -4.83 115.64 116.35 2cka s THR 2045Ca 0.00 0.33 -0.10 0.00 0.31 0.00 0.00 61.69 62.23 2cka s THR 2045Cb 0.00 -4.29 -0.05 0.00 0.01 0.00 0.00 72.50 68.17 2cka s THR 2045CO 0.00 -1.22 0.23 -0.22 -0.69 0.00 0.00 174.62 172.73 2cka s LEU 2046N 7.61 4.40 -0.14 4.42 2.96 -1.26 -0.16 118.68 136.50 2cka s LEU 2046Ca 0.56 0.61 0.02 0.00 -0.22 0.00 0.00 54.13 55.09 2cka s LEU 2046Cb -0.11 -2.25 0.02 0.00 0.50 0.00 0.00 46.19 44.34 2cka s LEU 2046CO 0.20 0.35 -0.18 -0.76 -1.32 0.00 0.00 176.35 174.64 2cka s LEU 2047N -0.86 1.90 0.17 -0.68 1.43 0.15 -4.97 118.68 115.81 2cka s LEU 2047Ca 0.17 -0.53 0.04 0.00 -1.03 0.00 0.00 54.13 52.79 2cka s LEU 2047Cb -0.13 -1.28 -0.05 0.00 0.03 0.00 0.00 46.19 44.76 2cka s LEU 2047CO 0.07 0.02 -0.08 0.68 0.23 0.00 0.00 176.35 177.26 2cka s VAL 2048N 1.10 1.16 0.00 -1.59 -7.23 -1.26 -1.87 120.40 110.71 2cka s VAL 2048Ca -0.02 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.09 2cka s VAL 2048Cb -0.14 -1.99 0.00 0.00 0.56 0.00 0.00 36.38 34.80 2cka s VAL 2048CO -0.06 -0.62 0.00 0.61 -0.31 0.00 0.00 175.10 174.72 2cka n GLY 2049N -0.27 2.68 0.22 2.32 0.00 -1.26 -1.92 105.19 106.96 2cka n GLY 2049Ca -0.09 -0.27 0.13 0.00 0.00 0.00 0.00 46.02 45.80 2cka n GLY 2049CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cka n GLU 2050N 13.06 0.86 0.17 1.61 1.02 -1.26 -2.82 120.64 133.28 2cka n GLU 2050Ca 0.00 -0.44 0.07 0.00 -0.02 0.00 0.00 57.16 56.77 2cka n GLU 2050Cb 0.00 -1.49 0.08 0.00 -0.02 0.00 0.00 31.44 30.01 2cka n GLU 2050CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2cka h ASP 2051N 1.07 0.00 -2.90 1.62 5.19 -1.74 -3.44 116.42 116.21 2cka h ASP 2051Ca 0.00 0.00 -0.62 0.00 -0.62 0.00 0.00 57.03 55.79 2cka h ASP 2051Cb 0.45 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.91 2cka h ASP 2051CO 0.00 0.27 -0.49 0.00 -3.12 0.00 0.00 179.24 175.91 2cka s ALA 2052N -3.08 3.98 0.89 3.45 0.00 -1.13 -4.67 121.76 121.21 2cka s ALA 2052Ca 0.05 -0.80 -0.14 0.00 0.00 0.00 0.00 51.96 51.07 2cka s ALA 2052Cb 0.07 -1.86 0.14 0.00 0.00 0.00 0.00 23.12 21.47 2cka s ALA 2052CO 0.72 0.80 1.25 -1.25 0.00 0.00 0.00 175.76 177.28 2cka s PRO 2053N -2.38 1.28 0.61 0.00 0.04 -1.26 -4.73 135.00 128.56 2cka s PRO 2053Ca 0.34 -0.18 -0.12 0.00 0.04 0.00 0.00 61.00 61.08 2cka s PRO 2053Cb -0.13 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 2cka s PRO 2053CO 0.26 -2.01 1.03 1.03 0.04 0.00 0.00 177.00 177.34 2cka s ARG 2054N -5.73 3.63 0.43 4.56 0.52 -1.26 -2.28 118.95 118.82 2cka s ARG 2054Ca 0.68 0.78 0.10 0.00 -0.52 0.00 0.00 55.73 56.76 2cka s ARG 2054Cb -0.07 -2.09 0.93 0.00 0.52 0.00 0.00 34.95 34.25 2cka s ARG 2054CO 0.51 -0.54 2.04 -0.09 0.02 0.00 0.00 175.30 177.24 2cka h ARG 2055N -0.19 0.34 0.00 3.54 9.65 0.14 0.40 114.38 128.26 2cka h ARG 2055Ca -0.44 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.39 2cka h ARG 2055Cb 1.19 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 29.70 2cka h ARG 2055CO 0.62 0.28 -0.05 0.00 2.80 0.00 0.00 179.97 183.62 2cka h ALA 2056N 1.78 1.14 0.00 2.80 0.00 -1.32 -2.49 119.26 121.16 2cka h ALA 2056Ca 0.09 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 2cka h ALA 2056Cb 0.07 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 2cka h ALA 2056CO -0.01 0.07 -2.05 0.39 0.00 0.00 0.00 179.25 177.64 2cka n GLU 2057N -3.35 0.93 -0.18 0.00 1.02 -0.09 -4.74 120.64 114.24 2cka n GLU 2057Ca -0.02 -0.07 -0.03 0.00 -0.02 0.00 0.00 57.16 57.02 2cka n GLU 2057Cb 0.20 -1.44 0.04 0.00 -0.02 0.00 0.00 31.44 30.22 2cka n GLU 2057CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2cka h LEU 2058N 0.00 -0.74 -0.14 -4.62 7.12 0.19 0.32 115.31 117.44 2cka h LEU 2058Ca -0.28 0.19 -0.02 0.00 0.13 0.00 0.00 57.88 57.90 2cka h LEU 2058Cb 1.59 0.43 -0.01 0.00 -0.53 0.00 0.00 40.66 42.14 2cka h LEU 2058CO 0.02 -0.24 0.02 -0.08 -0.13 0.00 0.00 178.44 178.03 2cka h GLU 2059N -0.07 0.23 -0.73 1.25 4.81 -1.85 0.22 114.58 118.42 2cka h GLU 2059Ca 0.26 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.37 2cka h GLU 2059Cb 0.48 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 2cka h GLU 2059CO -0.61 0.42 0.21 0.52 -0.73 0.00 0.00 179.01 178.81 2cka h MET 2060N 0.00 1.15 -0.05 1.92 2.86 -1.75 -1.01 114.93 118.06 2cka h MET 2060Ca 0.04 -0.26 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2cka h MET 2060Cb 0.30 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 2cka h MET 2060CO 0.00 0.99 0.02 2.35 1.06 0.00 0.00 176.91 181.33 2cka h TRP 2061N 1.10 0.08 -0.27 -0.22 7.01 -0.04 -2.65 115.95 120.95 2cka h TRP 2061Ca 0.23 -0.01 -0.05 0.00 2.11 0.00 0.00 58.89 61.17 2cka h TRP 2061Cb 0.33 -0.02 -0.02 0.00 -2.10 0.00 0.00 29.16 27.35 2cka h TRP 2061CO 0.03 0.23 -0.06 -0.07 -2.79 0.00 0.00 178.44 175.77 2cka h LEU 2062N -0.10 0.40 -2.19 0.65 3.38 -0.45 -1.70 115.31 115.30 2cka h LEU 2062Ca 0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2cka h LEU 2062Cb 0.19 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2cka h LEU 2062CO -0.00 0.52 -0.05 -0.61 0.09 0.00 0.00 178.44 178.38 2cka h GLN 2063N 0.41 0.00 -0.46 1.13 5.75 -0.88 -0.82 115.11 120.23 2cka h GLN 2063Ca 0.08 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.58 2cka h GLN 2063Cb 0.37 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.92 2cka h GLN 2063CO 0.02 0.05 0.00 0.41 -2.65 0.00 0.00 178.83 176.66 2cka n GLY 2064N -0.75 2.39 2.47 2.39 0.00 -0.69 -4.74 105.19 106.27 2cka n GLY 2064Ca -0.02 -0.55 -0.24 0.00 0.00 0.00 0.00 46.02 45.21 2cka n GLY 2064CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2cka s HIS 2065N -1.04 0.65 0.34 1.61 3.76 -0.31 -4.98 115.29 115.32 2cka s HIS 2065Ca 0.33 -1.92 0.32 0.00 -0.15 0.00 0.00 55.06 53.63 2cka s HIS 2065Cb 0.17 -0.75 1.53 0.00 1.11 0.00 0.00 32.58 34.65 2cka s HIS 2065CO 0.23 -0.88 2.07 -1.00 -0.85 0.00 0.00 174.74 174.31 2cka h PRO 2066N 5.92 0.00 0.00 8.40 0.13 -1.85 -2.21 132.00 142.40 2cka h PRO 2066Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 2cka h PRO 2066Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2cka h PRO 2066CO 0.30 0.08 0.00 -0.85 -0.23 0.00 0.00 178.00 177.30 2cka n GLU 2067N -3.36 0.47 -4.42 0.86 0.28 -1.26 -4.74 120.64 108.46 2cka n GLU 2067Ca -0.01 0.02 -0.25 0.00 -0.16 0.00 0.00 57.16 56.76 2cka n GLU 2067Cb 0.25 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 31.51 2cka n GLU 2067CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 2cka s PHE 2068N -2.49 2.21 0.20 -1.84 0.08 -0.83 -1.28 117.98 114.04 2cka s PHE 2068Ca 0.29 -0.37 -0.15 0.00 0.12 0.00 0.00 56.93 56.81 2cka s PHE 2068Cb 0.19 -1.04 0.01 0.00 -0.57 0.00 0.00 43.02 41.61 2cka s PHE 2068CO 0.41 0.55 0.48 0.00 -0.10 0.00 0.00 175.22 176.56 2cka s ALA 2069N -2.08 -0.65 0.39 5.36 0.00 0.51 -4.77 121.76 120.53 2cka s ALA 2069Ca 0.23 -0.47 -0.27 0.00 0.00 0.00 0.00 51.96 51.45 2cka s ALA 2069Cb -0.06 0.89 -0.10 0.00 0.00 0.00 0.00 23.12 23.85 2cka s ALA 2069CO 0.11 -0.79 1.40 0.54 0.00 0.00 0.00 175.76 177.02 2cka s VAL 2070N -3.92 2.31 0.08 0.00 0.11 -1.26 -0.10 120.40 117.62 2cka s VAL 2070Ca 0.13 0.30 -0.31 0.00 -2.93 0.00 0.00 61.98 59.17 2cka s VAL 2070Cb -0.00 -3.18 -0.10 0.00 -1.53 0.00 0.00 36.38 31.56 2cka s VAL 2070CO 0.00 0.06 1.90 -0.67 -3.33 0.00 0.00 175.10 173.07 2cka n ASP 2071N 0.33 4.11 0.25 3.54 2.03 0.06 -4.60 116.55 122.27 2cka n ASP 2071Ca 0.02 0.95 0.12 0.00 0.52 0.00 0.00 54.79 56.39 2cka n ASP 2071Cb 0.41 -1.54 0.67 0.00 -0.72 0.00 0.00 41.12 39.95 2cka n ASP 2071CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2cka h PRO 2072N 9.50 0.00 0.08 -0.67 0.13 -1.91 -1.83 132.00 137.30 2cka h PRO 2072Ca -0.48 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.38 2cka h PRO 2072Cb 1.23 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.38 2cka h PRO 2072CO 0.95 0.14 -1.14 -0.09 -0.23 0.00 0.00 178.00 177.63 2cka h ARG 2073N 0.00 0.54 -0.83 0.86 2.43 -1.98 -1.94 114.38 113.45 2cka h ARG 2073Ca -0.00 -0.68 -0.02 0.00 -0.81 0.00 0.00 59.98 58.47 2cka h ARG 2073Cb 0.39 0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 30.12 2cka h ARG 2073CO 0.02 1.28 0.42 0.35 -1.51 0.00 0.00 179.97 180.53 2cka h PHE 2074N 0.26 1.16 -0.01 2.20 3.57 -1.80 0.41 116.94 122.73 2cka h PHE 2074Ca -0.15 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.32 2cka h PHE 2074Cb 1.81 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 40.17 2cka h PHE 2074CO 0.09 0.82 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.87 2cka h LEU 2075N 1.17 -0.16 -1.16 0.59 3.38 -1.27 -0.16 115.31 117.69 2cka h LEU 2075Ca 0.29 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.24 2cka h LEU 2075Cb 0.08 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2cka h LEU 2075CO -0.04 -0.08 0.07 0.00 0.09 0.00 0.00 178.44 178.48 2cka h ALA 2076N 0.90 1.32 -0.54 1.53 0.00 -0.86 -2.69 119.26 118.92 2cka h ALA 2076Ca 0.03 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2cka h ALA 2076Cb 0.13 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2cka h ALA 2076CO -0.06 0.47 0.04 -0.92 0.00 0.00 0.00 179.25 178.78 2cka h TYR 2077N 0.64 0.99 -0.60 0.00 3.20 0.31 0.26 116.97 121.76 2cka h TYR 2077Ca 0.14 -0.16 -0.09 0.00 3.14 0.00 0.00 58.73 61.76 2cka h TYR 2077Cb 0.29 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 2cka h TYR 2077CO 0.01 0.90 0.02 0.52 -1.64 0.00 0.00 178.16 177.97 2cka h MET 2078N 0.80 1.04 0.01 1.82 2.86 -0.72 -1.13 114.93 119.61 2cka h MET 2078Ca 0.16 -0.31 -0.20 0.00 -2.06 0.00 0.00 59.70 57.28 2cka h MET 2078Cb 0.47 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.01 2cka h MET 2078CO 0.02 1.00 -0.92 1.05 1.06 0.00 0.00 176.91 179.12 2cka h GLU 2079N 0.96 0.09 -0.02 1.72 4.11 -1.38 -3.00 114.58 117.06 2cka h GLU 2079Ca 0.17 -0.12 0.00 0.00 0.07 0.00 0.00 59.36 59.49 2cka h GLU 2079Cb 0.52 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 2cka h GLU 2079CO 0.03 0.95 0.01 0.22 0.07 0.00 0.00 179.01 180.28 2cka h ASP 2080N 0.04 0.00 0.00 3.06 3.58 -0.13 -3.46 116.42 119.51 2cka h ASP 2080Ca -0.03 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.42 2cka h ASP 2080Cb 1.60 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.65 2cka h ASP 2080CO 0.13 0.00 0.00 0.54 -2.88 0.00 0.00 179.24 177.03 2cka n ARG 2081N -4.27 0.00 0.00 0.28 1.74 -0.48 -4.56 116.66 109.37 2cka n ARG 2081Ca -0.03 0.40 0.00 0.00 -0.77 0.00 0.00 57.85 57.46 2cka n ARG 2081Cb 0.10 -3.31 0.00 0.00 -1.02 0.00 0.00 32.46 28.23 2cka n ARG 2081CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2cka n ARG 2082N -2.78 0.00 0.00 5.56 0.63 -0.89 -4.87 116.66 114.31 2cka n ARG 2082Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2cka n ARG 2082Cb 0.01 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.92 2cka n ARG 2082CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2cka n LYS 2083N 0.00 0.00 -5.03 -0.14 5.02 -1.26 -4.62 118.16 112.13 2cka n LYS 2083Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 2cka n LYS 2083Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 34.86 2cka n LYS 2083CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2cka s GLN 2084N 0.00 1.74 0.00 1.97 -0.21 -1.26 -5.30 119.66 116.61 2cka s GLN 2084Ca 0.00 -0.83 0.27 0.00 0.02 0.00 0.00 55.36 54.82 2cka s GLN 2084Cb 0.00 -1.72 0.80 0.00 1.00 0.00 0.00 33.01 33.10 2cka s GLN 2084CO 0.00 0.47 1.61 0.36 -2.12 0.00 0.00 175.29 175.60