#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kw2 s THR 2 N 0.00 5.04 0.27 1.12 2.01 -1.26 -5.03 115.64 117.79 2kw2 s THR 2 Ca 0.00 1.43 -0.31 0.00 0.31 0.00 0.00 61.69 63.12 2kw2 s THR 2 Cb 0.00 -4.04 -0.12 0.00 0.01 0.00 0.00 72.50 68.35 2kw2 s THR 2 CO 0.00 0.23 1.50 -1.20 -0.69 0.00 0.00 174.62 174.46 2kw2 n SER 3 N 3.96 3.33 0.29 3.53 7.64 -1.26 -4.89 113.62 126.22 2kw2 n SER 3 Ca -0.01 1.15 0.13 0.00 1.01 0.00 0.00 58.87 61.15 2kw2 n SER 3 Cb 0.51 -1.52 0.84 0.00 -1.01 0.00 0.00 64.21 63.04 2kw2 n SER 3 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2kw2 h THR 4 N 3.19 0.64 -0.56 0.44 2.02 -1.96 -1.63 112.91 115.06 2kw2 h THR 4 Ca -0.46 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 66.65 2kw2 h THR 4 Cb 1.25 1.03 -0.03 0.00 -1.74 0.00 0.00 68.15 68.66 2kw2 h THR 4 CO 0.77 0.01 0.26 0.15 0.37 0.00 0.00 175.52 177.09 2kw2 h PHE 5 N 0.00 0.82 -0.76 3.16 3.57 -1.90 -1.55 116.94 120.28 2kw2 h PHE 5 Ca -0.00 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.41 2kw2 h PHE 5 Cb 0.03 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 2kw2 h PHE 5 CO 0.00 0.64 0.31 0.22 -2.23 0.00 0.00 178.31 177.24 2kw2 h ASP 6 N 0.76 1.05 0.42 0.41 3.58 -1.67 0.29 116.42 121.26 2kw2 h ASP 6 Ca 0.19 -0.17 -0.02 0.00 0.42 0.00 0.00 57.03 57.45 2kw2 h ASP 6 Cb 0.13 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 40.92 2kw2 h ASP 6 CO -0.02 0.93 -0.20 0.03 -2.88 0.00 0.00 179.24 177.09 2kw2 h ARG 7 N 1.10 -0.55 -0.48 0.28 2.47 -1.35 -2.09 114.38 113.76 2kw2 h ARG 7 Ca 0.25 0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.99 2kw2 h ARG 7 Cb 0.21 0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.63 2kw2 h ARG 7 CO -0.02 -0.32 0.20 0.28 0.56 0.00 0.00 179.97 180.66 2kw2 h VAL 8 N -0.64 1.18 -0.19 2.04 2.07 -1.15 -1.23 116.25 118.33 2kw2 h VAL 8 Ca -0.06 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 2kw2 h VAL 8 Cb 0.48 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2kw2 h VAL 8 CO 0.10 0.22 0.11 0.00 0.02 0.00 0.00 177.57 178.01 2kw2 h ALA 9 N 1.53 0.24 -0.36 1.67 0.00 -0.88 -1.80 119.26 119.67 2kw2 h ALA 9 Ca 0.17 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2kw2 h ALA 9 Cb 0.13 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2kw2 h ALA 9 CO -0.02 -0.23 0.23 1.15 0.00 0.00 0.00 179.25 180.39 2kw2 h THR 10 N 0.21 1.08 0.02 0.00 2.02 -0.93 -2.10 112.91 113.21 2kw2 h THR 10 Ca 0.07 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 2kw2 h THR 10 Cb 0.06 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 2kw2 h THR 10 CO -0.01 0.09 -0.01 0.40 0.37 0.00 0.00 175.52 176.36 2kw2 h ILE 11 N 0.48 1.04 -0.01 3.11 1.08 -0.97 -1.18 117.51 121.05 2kw2 h ILE 11 Ca 0.13 -0.15 -0.08 0.00 -0.39 0.00 0.00 64.86 64.37 2kw2 h ILE 11 Cb -0.05 1.14 -0.01 0.00 -3.07 0.00 0.00 36.82 34.83 2kw2 h ILE 11 CO -0.03 0.04 -0.38 0.40 -0.69 0.00 0.00 178.15 177.49 2kw2 h ILE 12 N -0.09 1.28 -0.45 -0.67 2.04 -1.39 -0.77 117.51 117.46 2kw2 h ILE 12 Ca -0.00 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 64.53 2kw2 h ILE 12 Cb 0.08 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2kw2 h ILE 12 CO 0.00 0.38 0.25 0.00 0.00 0.00 0.00 178.15 178.78 2kw2 h ALA 13 N 1.60 0.58 -0.06 1.87 0.00 -0.82 -1.56 119.26 120.87 2kw2 h ALA 13 Ca -0.00 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 2kw2 h ALA 13 Cb 0.68 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.30 2kw2 h ALA 13 CO 0.05 0.10 -0.35 0.93 0.00 0.00 0.00 179.25 179.97 2kw2 h GLU 14 N 0.59 0.34 0.65 0.00 4.39 -0.94 -1.73 114.58 117.88 2kw2 h GLU 14 Ca 0.16 -0.29 -0.03 0.00 0.34 0.00 0.00 59.36 59.54 2kw2 h GLU 14 Cb 0.05 0.06 0.01 0.00 -0.10 0.00 0.00 28.75 28.77 2kw2 h GLU 14 CO -0.03 0.94 -0.31 1.15 -1.16 0.00 0.00 179.01 179.61 2kw2 h THR 15 N -0.17 0.05 -0.23 1.13 2.02 -1.14 -3.27 112.91 111.31 2kw2 h THR 15 Ca -0.03 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.79 2kw2 h THR 15 Cb 1.02 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 2kw2 h THR 15 CO 0.07 0.01 0.00 0.00 0.37 0.00 0.00 175.52 175.97 2kw2 n ASP 17 N 0.65 -6.58 -3.95 0.00 2.03 -1.05 -5.02 116.55 102.63 2kw2 n ASP 17 Ca 0.17 -0.49 -0.28 0.00 0.52 0.00 0.00 54.79 54.71 2kw2 n ASP 17 Cb 0.40 -4.04 -0.17 0.00 -0.72 0.00 0.00 41.12 36.60 2kw2 n ASP 17 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2kw2 s ILE 18 N -3.09 1.22 0.59 5.18 1.01 -0.68 -5.03 121.20 120.41 2kw2 s ILE 18 Ca 0.10 -0.42 -0.20 0.00 0.00 0.00 0.00 60.65 60.13 2kw2 s ILE 18 Cb -0.03 -1.20 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 2kw2 s ILE 18 CO 0.81 0.40 1.30 -2.84 0.00 0.00 0.00 174.94 174.61 2kw2 s PRO 19 N 1.58 2.91 0.49 2.79 0.02 -1.26 -4.22 135.00 137.31 2kw2 s PRO 19 Ca 0.04 2.08 0.19 0.00 0.02 0.00 0.00 61.00 63.34 2kw2 s PRO 19 Cb -0.13 -2.05 1.22 0.00 0.02 0.00 0.00 34.50 33.57 2kw2 s PRO 19 CO -0.08 -1.33 2.06 0.00 -0.33 0.00 0.00 177.00 177.31 2kw2 h ARG 20 N 1.03 0.00 -0.02 5.54 2.47 -1.92 -2.12 114.38 119.35 2kw2 h ARG 20 Ca -0.51 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.16 2kw2 h ARG 20 Cb 1.31 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.62 2kw2 h ARG 20 CO 0.55 0.13 -0.24 1.05 0.56 0.00 0.00 179.97 182.02 2kw2 h GLU 21 N 0.00 0.04 0.00 0.04 4.11 -2.02 -2.50 114.58 114.25 2kw2 h GLU 21 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2kw2 h GLU 21 Cb 0.26 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2kw2 h GLU 21 CO 0.02 0.28 -0.80 0.25 0.07 0.00 0.00 179.01 178.83 2kw2 n THR 22 N -4.24 0.06 -2.97 -1.06 -2.24 -0.84 -4.87 114.28 98.12 2kw2 n THR 22 Ca -0.02 -0.08 -0.41 0.00 -2.27 0.00 0.00 64.05 61.27 2kw2 n THR 22 Cb 0.31 0.42 -0.05 0.00 -2.10 0.00 0.00 70.33 68.91 2kw2 n THR 22 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2kw2 s ILE 23 N -3.07 4.92 0.15 2.28 1.01 -0.94 -4.98 121.20 120.57 2kw2 s ILE 23 Ca 0.08 1.45 0.03 0.00 0.00 0.00 0.00 60.65 62.21 2kw2 s ILE 23 Cb 0.16 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.52 2kw2 s ILE 23 CO 0.78 0.03 -0.06 0.42 0.00 0.00 0.00 174.94 176.11 2kw2 s THR 24 N 2.25 0.89 0.51 2.92 -4.23 -1.26 -4.92 115.64 111.80 2kw2 s THR 24 Ca 0.34 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 59.04 2kw2 s THR 24 Cb -0.16 -1.91 0.33 0.00 1.34 0.00 0.00 72.50 72.10 2kw2 s THR 24 CO 0.10 -0.68 2.07 1.55 -0.54 0.00 0.00 174.62 177.12 2kw2 h PRO 25 N 2.79 0.06 -0.01 3.99 0.13 -1.97 -2.44 132.00 134.55 2kw2 h PRO 25 Ca -0.36 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2kw2 h PRO 25 Cb 1.19 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2kw2 h PRO 25 CO 0.64 0.04 -0.26 0.39 -0.23 0.00 0.00 178.00 178.57 2kw2 n GLU 26 N -4.46 0.77 -1.67 0.86 1.02 -1.26 -1.76 120.64 114.14 2kw2 n GLU 26 Ca 0.04 -0.44 -0.36 0.00 -0.02 0.00 0.00 57.16 56.37 2kw2 n GLU 26 Cb 0.33 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.23 2kw2 n GLU 26 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2kw2 s SER 27 N -2.54 4.61 -0.03 1.62 0.01 -0.92 -4.83 113.70 111.63 2kw2 s SER 27 Ca 0.24 0.91 -0.30 0.00 1.31 0.00 0.00 55.95 58.10 2kw2 s SER 27 Cb 0.19 -2.51 -0.04 0.00 0.21 0.00 0.00 66.02 63.87 2kw2 s SER 27 CO 0.53 -2.78 1.29 -2.28 0.41 0.00 0.00 173.24 170.41 2kw2 s HIS 28 N 11.55 3.05 0.17 2.43 2.46 -1.26 -1.75 115.29 131.93 2kw2 s HIS 28 Ca 0.91 1.04 -0.21 0.00 0.47 0.00 0.00 55.06 57.26 2kw2 s HIS 28 Cb -0.16 -3.53 0.08 0.00 -0.13 0.00 0.00 32.58 28.83 2kw2 s HIS 28 CO 0.25 -1.83 1.61 0.00 -2.47 0.00 0.00 174.74 172.30 2kw2 h ALA 29 N 7.60 -0.08 -0.22 1.58 0.00 -1.54 0.79 119.26 127.39 2kw2 h ALA 29 Ca -0.36 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 2kw2 h ALA 29 Cb 1.17 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 19.57 2kw2 h ALA 29 CO 0.89 -0.66 -0.09 0.82 0.00 0.00 0.00 179.25 180.20 2kw2 h ILE 30 N -0.21 1.30 0.00 0.00 2.04 -1.82 0.24 117.51 119.06 2kw2 h ILE 30 Ca 0.18 -1.14 0.00 0.00 1.00 0.00 0.00 64.86 64.91 2kw2 h ILE 30 Cb 0.50 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 2kw2 h ILE 30 CO -0.51 0.35 0.00 -0.67 0.00 0.00 0.00 178.15 177.32 2kw2 n ASP 31 N -4.55 0.00 0.03 1.72 2.03 -1.03 -3.14 116.55 111.61 2kw2 n ASP 31 Ca -0.04 0.52 -0.11 0.00 0.52 0.00 0.00 54.79 55.68 2kw2 n ASP 31 Cb 0.32 -0.28 -0.08 0.00 -0.72 0.00 0.00 41.12 40.35 2kw2 n ASP 31 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2kw2 h ASP 32 N 0.00 -0.14 1.42 1.67 3.58 -1.04 -3.33 116.42 118.58 2kw2 h ASP 32 Ca 0.00 -0.42 0.00 0.00 0.42 0.00 0.00 57.03 57.03 2kw2 h ASP 32 Cb 0.00 0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.09 2kw2 h ASP 32 CO 0.00 0.45 0.00 -0.07 -2.88 0.00 0.00 179.24 176.74 2kw2 h LEU 33 N -0.84 0.00 0.18 2.28 3.38 -1.28 -3.47 115.31 115.57 2kw2 h LEU 33 Ca -0.02 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2kw2 h LEU 33 Cb 0.55 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2kw2 h LEU 33 CO 0.03 0.00 -0.07 0.61 0.09 0.00 0.00 178.44 179.10 2kw2 n GLY 34 N 0.65 0.67 3.61 0.83 0.00 0.61 -4.96 105.19 106.59 2kw2 n GLY 34 Ca 0.03 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 2kw2 n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kw2 s ILE 35 N -2.02 4.75 0.70 -0.61 1.01 0.20 -4.91 121.20 120.31 2kw2 s ILE 35 Ca 0.00 1.19 -0.10 0.00 0.00 0.00 0.00 60.65 61.73 2kw2 s ILE 35 Cb 0.00 -4.19 0.02 0.00 0.01 0.00 0.00 42.46 38.30 2kw2 s ILE 35 CO 0.00 -0.31 1.07 -0.62 0.00 0.00 0.00 174.94 175.08 2kw2 s ASP 36 N 1.67 5.38 0.49 3.58 -1.08 -1.26 -2.91 116.67 122.53 2kw2 s ASP 36 Ca 0.34 1.01 0.28 0.00 -0.52 0.00 0.00 52.55 53.66 2kw2 s ASP 36 Cb -0.14 -1.82 1.52 0.00 -1.46 0.00 0.00 42.92 41.02 2kw2 s ASP 36 CO 0.14 -1.35 1.83 0.28 0.52 0.00 0.00 175.17 176.59 2kw2 h SER 37 N -0.61 0.00 0.11 -0.34 0.02 -1.98 0.01 113.55 110.77 2kw2 h SER 37 Ca -0.45 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.34 2kw2 h SER 37 Cb 1.26 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.81 2kw2 h SER 37 CO 0.63 0.00 -0.73 -0.07 -1.14 0.00 0.00 176.83 175.53 2kw2 h LEU 38 N 0.00 0.35 -0.77 5.07 3.38 -2.02 -3.32 115.31 118.00 2kw2 h LEU 38 Ca 0.00 -0.94 -0.09 0.00 0.09 0.00 0.00 57.88 56.94 2kw2 h LEU 38 Cb 0.26 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2kw2 h LEU 38 CO 0.00 1.34 -0.41 -0.78 0.09 0.00 0.00 178.44 178.68 2kw2 h ASP 39 N -0.51 0.00 0.96 -0.43 3.58 -1.69 -2.98 116.42 115.34 2kw2 h ASP 39 Ca -0.14 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.31 2kw2 h ASP 39 Cb 1.52 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.57 2kw2 h ASP 39 CO 0.10 0.41 -0.04 0.15 -2.88 0.00 0.00 179.24 176.99 2kw2 h PHE 40 N 0.00 0.00 -0.71 0.28 3.04 -1.16 -2.98 116.94 115.41 2kw2 h PHE 40 Ca -0.00 0.00 0.04 0.00 3.98 0.00 0.00 57.97 61.99 2kw2 h PHE 40 Cb 1.00 0.00 -0.05 0.00 2.56 0.00 0.00 35.95 39.46 2kw2 h PHE 40 CO 0.00 0.04 0.43 -0.07 -2.02 0.00 0.00 178.31 176.69 2kw2 h LEU 41 N 0.00 0.68 -0.95 0.59 3.38 -1.62 -1.25 115.31 116.15 2kw2 h LEU 41 Ca -0.00 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 2kw2 h LEU 41 Cb 0.53 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 2kw2 h LEU 41 CO 0.00 0.46 -0.07 0.44 0.09 0.00 0.00 178.44 179.37 2kw2 h ASP 42 N 0.82 0.67 -0.01 -0.43 5.19 -1.72 -1.27 116.42 119.67 2kw2 h ASP 42 Ca 0.30 -0.18 -0.00 0.00 -0.62 0.00 0.00 57.03 56.53 2kw2 h ASP 42 Cb 0.08 -0.18 -0.00 0.00 0.18 0.00 0.00 39.33 39.42 2kw2 h ASP 42 CO -0.14 0.78 0.00 0.40 -3.12 0.00 0.00 179.24 177.17 2kw2 h ILE 43 N 0.64 1.09 -0.33 0.35 2.04 -1.51 -1.69 117.51 118.10 2kw2 h ILE 43 Ca 0.12 -0.28 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 2kw2 h ILE 43 Cb 0.50 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2kw2 h ILE 43 CO 0.03 0.07 -0.01 0.00 0.00 0.00 0.00 178.15 178.24 2kw2 h ALA 44 N 0.89 1.38 -0.02 1.87 0.00 -1.06 -0.95 119.26 121.36 2kw2 h ALA 44 Ca 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2kw2 h ALA 44 Cb 0.12 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2kw2 h ALA 44 CO -0.00 0.43 0.01 0.35 0.00 0.00 0.00 179.25 180.04 2kw2 h PHE 45 N 0.48 0.04 -0.44 0.00 3.57 -1.13 -0.97 116.94 118.50 2kw2 h PHE 45 Ca 0.10 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.56 2kw2 h PHE 45 Cb 0.33 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 2kw2 h PHE 45 CO 0.01 0.23 0.11 0.00 -2.23 0.00 0.00 178.31 176.43 2kw2 h ALA 46 N 0.80 1.37 -0.37 2.41 0.00 -0.95 -2.61 119.26 119.92 2kw2 h ALA 46 Ca 0.01 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 2kw2 h ALA 46 Cb 0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2kw2 h ALA 46 CO -0.00 0.45 -0.33 0.82 0.00 0.00 0.00 179.25 180.20 2kw2 h ILE 47 N 0.64 1.28 -0.78 0.00 2.04 -1.02 -1.16 117.51 118.50 2kw2 h ILE 47 Ca 0.15 -1.50 -0.01 0.00 1.00 0.00 0.00 64.86 64.50 2kw2 h ILE 47 Cb 0.24 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 2kw2 h ILE 47 CO -0.00 0.50 0.47 0.44 0.00 0.00 0.00 178.15 179.55 2kw2 h ASP 48 N 0.67 0.94 -0.12 1.72 3.32 -0.93 -1.47 116.42 120.55 2kw2 h ASP 48 Ca 0.06 -0.07 -0.17 0.00 0.02 0.00 0.00 57.03 56.87 2kw2 h ASP 48 Cb 0.91 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 40.23 2kw2 h ASP 48 CO 0.08 0.73 -0.60 0.11 -1.72 0.00 0.00 179.24 177.85 2kw2 h LYS 49 N 1.07 0.62 0.56 3.56 1.57 -1.45 -1.93 116.57 120.57 2kw2 h LYS 49 Ca 0.28 -0.51 -0.03 0.00 -1.87 0.00 0.00 60.65 58.53 2kw2 h LYS 49 Cb -0.03 0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.39 2kw2 h LYS 49 CO -0.05 1.13 -0.27 0.00 -0.57 0.00 0.00 179.45 179.68 2kw2 h ALA 50 N 0.50 -0.75 0.00 3.86 0.00 -1.09 -3.31 119.26 118.47 2kw2 h ALA 50 Ca -0.04 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2kw2 h ALA 50 Cb 1.24 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2kw2 h ALA 50 CO 0.12 -0.73 -0.35 0.74 0.00 0.00 0.00 179.25 179.03 2kw2 h PHE 51 N -1.13 0.00 -2.35 0.00 -1.00 -1.44 -3.48 116.94 107.54 2kw2 h PHE 51 Ca -0.08 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.56 2kw2 h PHE 51 Cb 0.62 0.00 0.04 0.00 3.61 0.00 0.00 35.95 40.22 2kw2 h PHE 51 CO 0.01 0.00 -0.23 0.41 -1.61 0.00 0.00 178.31 176.89 2kw2 n GLY 52 N 1.13 0.35 1.63 -1.45 0.00 -0.74 -4.98 105.19 101.13 2kw2 n GLY 52 Ca 0.03 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.50 2kw2 n GLY 52 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2kw2 n ILE 53 N -3.53 0.00 -4.04 -0.61 -5.35 -1.12 -5.04 119.36 99.67 2kw2 n ILE 53 Ca -0.02 -1.08 -0.32 0.00 -0.27 0.00 0.00 62.75 61.07 2kw2 n ILE 53 Cb 0.53 0.23 -0.15 0.00 -1.74 0.00 0.00 39.64 38.51 2kw2 n ILE 53 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 2kw2 s LYS 54 N -2.82 1.89 -0.60 6.28 2.20 -1.26 -4.61 119.74 120.81 2kw2 s LYS 54 Ca 0.01 -1.57 -0.23 0.00 -0.36 0.00 0.00 55.97 53.82 2kw2 s LYS 54 Cb 0.00 -3.01 0.06 0.00 -1.51 0.00 0.00 37.83 33.37 2kw2 s LYS 54 CO 0.01 -0.73 0.91 -1.17 -0.36 0.00 0.00 175.35 174.00 2kw2 s LEU 55 N 1.02 4.38 -1.23 5.43 0.20 -1.26 -5.00 118.68 122.23 2kw2 s LEU 55 Ca -0.00 -0.77 -0.17 0.00 0.69 0.00 0.00 54.13 53.88 2kw2 s LEU 55 Cb -0.20 -2.56 0.10 0.00 -0.43 0.00 0.00 46.19 43.11 2kw2 s LEU 55 CO -0.06 -1.30 1.58 -2.16 -0.29 0.00 0.00 176.35 174.12 2kw2 s PRO 56 N 3.82 3.97 0.22 0.98 0.04 -1.26 -4.77 135.00 138.00 2kw2 s PRO 56 Ca 0.24 -2.10 0.02 0.00 0.04 0.00 0.00 61.00 59.20 2kw2 s PRO 56 Cb -0.16 -5.34 0.21 0.00 0.04 0.00 0.00 34.50 29.25 2kw2 s PRO 56 CO 0.13 -2.07 1.54 1.25 0.04 0.00 0.00 177.00 177.90 2kw2 h LEU 57 N 11.55 0.39 -1.23 -3.56 5.85 -1.99 -1.94 115.31 124.38 2kw2 h LEU 57 Ca 0.37 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.91 2kw2 h LEU 57 Cb 0.89 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.76 2kw2 h LEU 57 CO 1.37 0.88 0.54 1.05 -0.34 0.00 0.00 178.44 181.94 2kw2 h GLU 58 N 0.26 0.97 0.21 1.25 4.11 -2.00 -0.56 114.58 118.81 2kw2 h GLU 58 Ca -0.00 -0.06 -0.32 0.00 0.07 0.00 0.00 59.36 59.05 2kw2 h GLU 58 Cb 1.09 -0.22 0.03 0.00 0.50 0.00 0.00 28.75 30.16 2kw2 h GLU 58 CO 0.10 0.64 -1.40 -0.22 0.07 0.00 0.00 179.01 178.20 2kw2 h LYS 59 N 1.00 0.56 -0.71 1.06 3.64 -1.90 -3.08 116.57 117.14 2kw2 h LYS 59 Ca 0.33 -0.88 -0.06 0.00 -1.27 0.00 0.00 60.65 58.76 2kw2 h LYS 59 Cb 0.06 0.32 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 2kw2 h LYS 59 CO -0.10 1.42 0.20 -1.49 -2.27 0.00 0.00 179.45 177.21 2kw2 h TRP 60 N 0.19 1.17 -0.55 1.91 4.06 -1.11 -1.06 115.95 120.56 2kw2 h TRP 60 Ca -0.23 -0.13 0.07 0.00 2.06 0.00 0.00 58.89 60.67 2kw2 h TRP 60 Cb 2.08 -0.33 -0.06 0.00 -1.00 0.00 0.00 29.16 29.85 2kw2 h TRP 60 CO 0.12 0.94 0.22 1.15 -3.56 0.00 0.00 178.44 177.31 2kw2 h THR 61 N 1.06 0.83 -0.17 1.49 2.02 -1.19 -2.54 112.91 114.41 2kw2 h THR 61 Ca 0.23 -0.14 -0.09 0.00 0.77 0.00 0.00 66.41 67.17 2kw2 h THR 61 Cb 0.34 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 2kw2 h THR 61 CO -0.00 0.08 -0.30 -0.61 0.37 0.00 0.00 175.52 175.05 2kw2 h GLN 62 N 0.41 0.32 -0.40 6.66 5.75 -1.32 -1.38 115.11 125.16 2kw2 h GLN 62 Ca 0.27 -0.12 0.03 0.00 -0.15 0.00 0.00 58.65 58.67 2kw2 h GLN 62 Cb 0.28 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.78 2kw2 h GLN 62 CO -0.25 0.60 0.20 0.93 -2.65 0.00 0.00 178.83 177.65 2kw2 h GLU 63 N 0.28 0.39 -0.26 1.69 4.39 -0.88 -1.47 114.58 118.72 2kw2 h GLU 63 Ca 0.04 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.65 2kw2 h GLU 63 Cb 0.68 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.23 2kw2 h GLU 63 CO 0.05 0.26 -0.08 0.28 -1.16 0.00 0.00 179.01 178.36 2kw2 h VAL 64 N 0.40 1.29 -0.50 3.13 2.07 -1.14 0.19 116.25 121.68 2kw2 h VAL 64 Ca 0.17 -1.11 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 2kw2 h VAL 64 Cb 0.08 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 2kw2 h VAL 64 CO -0.12 0.35 0.30 0.78 0.02 0.00 0.00 177.57 178.89 2kw2 h ASN 65 N 0.26 0.60 0.43 0.57 2.35 -1.11 -2.32 115.58 116.36 2kw2 h ASN 65 Ca 0.06 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2kw2 h ASN 65 Cb 0.55 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.77 2kw2 h ASN 65 CO 0.03 0.47 -0.46 -0.67 -1.65 0.00 0.00 177.43 175.14 2kw2 n ASP 66 N -4.43 0.62 0.00 5.81 2.03 -0.57 -4.95 116.55 115.06 2kw2 n ASP 66 Ca 0.04 -0.40 0.00 0.00 0.52 0.00 0.00 54.79 54.95 2kw2 n ASP 66 Cb 0.08 0.24 0.00 0.00 -0.72 0.00 0.00 41.12 40.72 2kw2 n ASP 66 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kw2 n GLY 67 N 1.47 0.69 0.16 0.27 0.00 -0.87 -4.95 105.19 101.95 2kw2 n GLY 67 Ca 0.07 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 2kw2 n GLY 67 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kw2 h LYS 68 N 1.91 0.26 -4.19 1.61 1.79 -0.90 -3.47 116.57 113.59 2kw2 h LYS 68 Ca 0.00 -0.20 -0.14 0.00 -2.18 0.00 0.00 60.65 58.13 2kw2 h LYS 68 Cb 0.00 0.04 -0.14 0.00 -1.58 0.00 0.00 32.23 30.54 2kw2 h LYS 68 CO 0.00 0.84 -0.56 0.00 -1.08 0.00 0.00 179.45 178.65 2kw2 s ALA 69 N -3.63 0.46 0.24 3.86 0.00 -0.72 -4.96 121.76 117.02 2kw2 s ALA 69 Ca -0.04 -1.18 0.07 0.00 0.00 0.00 0.00 51.96 50.82 2kw2 s ALA 69 Cb 0.11 0.64 -0.04 0.00 0.00 0.00 0.00 23.12 23.83 2kw2 s ALA 69 CO 0.81 -0.48 0.13 -0.08 0.00 0.00 0.00 175.76 176.14 2kw2 s THR 70 N -3.97 4.20 0.51 0.00 -1.32 -1.26 -3.79 115.64 110.01 2kw2 s THR 70 Ca 0.15 -1.47 0.18 0.00 -1.21 0.00 0.00 61.69 59.35 2kw2 s THR 70 Cb 0.07 -3.24 0.31 0.00 -1.51 0.00 0.00 72.50 68.13 2kw2 s THR 70 CO -0.04 -0.31 2.09 0.71 -2.21 0.00 0.00 174.62 174.86 2kw2 h THR 71 N 1.71 0.92 -0.66 5.08 1.35 -1.95 -2.40 112.91 116.94 2kw2 h THR 71 Ca -0.47 -0.02 0.10 0.00 -0.55 0.00 0.00 66.41 65.47 2kw2 h THR 71 Cb 1.23 0.86 -0.08 0.00 -1.73 0.00 0.00 68.15 68.44 2kw2 h THR 71 CO 0.61 0.01 0.27 -0.08 -0.25 0.00 0.00 175.52 176.08 2kw2 h GLU 72 N 0.05 0.44 0.00 4.72 4.22 -1.96 0.48 114.58 122.54 2kw2 h GLU 72 Ca 0.10 -0.03 -0.02 0.00 0.08 0.00 0.00 59.36 59.50 2kw2 h GLU 72 Cb 0.34 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 2kw2 h GLU 72 CO -0.01 0.29 -0.09 0.37 -2.18 0.00 0.00 179.01 177.40 2kw2 h GLN 73 N 0.46 0.00 0.00 1.92 4.15 -1.82 -2.79 115.11 117.03 2kw2 h GLN 73 Ca 0.34 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.76 2kw2 h GLN 73 Cb 0.43 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.12 2kw2 h GLN 73 CO -0.32 0.09 0.00 0.66 -1.93 0.00 0.00 178.83 177.33 2kw2 n TYR 74 N -3.49 0.00 0.00 3.99 4.01 -0.91 -4.41 117.16 116.35 2kw2 n TYR 74 Ca -0.02 -0.14 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 2kw2 n TYR 74 Cb 0.23 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.25 2kw2 n TYR 74 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2kw2 n PHE 75 N -0.14 0.00 -1.95 -0.72 3.01 0.11 -4.70 117.46 113.07 2kw2 n PHE 75 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 2kw2 n PHE 75 Cb 0.19 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.64 2kw2 n PHE 75 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2kw2 s VAL 76 N -1.76 2.58 0.19 -4.37 1.01 -1.05 -1.36 120.40 115.63 2kw2 s VAL 76 Ca 0.00 0.45 -0.12 0.00 0.00 0.00 0.00 61.98 62.31 2kw2 s VAL 76 Cb 0.00 -3.29 0.11 0.00 0.00 0.00 0.00 36.38 33.20 2kw2 s VAL 76 CO 0.00 0.05 1.85 -0.07 0.00 0.00 0.00 175.10 176.93 2kw2 h LEU 77 N 5.84 0.69 -1.28 3.92 3.38 -1.34 -0.31 115.31 126.21 2kw2 h LEU 77 Ca -0.44 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 2kw2 h LEU 77 Cb 1.21 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 2kw2 h LEU 77 CO 0.84 0.49 0.04 0.07 0.09 0.00 0.00 178.44 179.97 2kw2 h LYS 78 N 0.82 0.53 0.07 1.13 2.10 -1.64 -0.81 116.57 118.78 2kw2 h LYS 78 Ca 0.24 -0.10 -0.00 0.00 -2.00 0.00 0.00 60.65 58.78 2kw2 h LYS 78 Cb -0.06 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 31.19 2kw2 h LYS 78 CO -0.07 0.52 -0.04 -0.91 -2.00 0.00 0.00 179.45 176.96 2kw2 h ASN 79 N 0.51 -0.09 -0.70 7.07 4.21 -1.61 -1.60 115.58 123.38 2kw2 h ASN 79 Ca 0.11 -0.45 0.09 0.00 1.21 0.00 0.00 56.30 57.27 2kw2 h ASN 79 Cb 0.27 0.02 -0.07 0.00 -1.12 0.00 0.00 38.32 37.42 2kw2 h ASN 79 CO 0.00 0.44 0.34 0.25 -1.29 0.00 0.00 177.43 177.17 2kw2 h LEU 80 N -0.64 0.42 -1.17 1.61 5.85 -1.06 -0.99 115.31 119.33 2kw2 h LEU 80 Ca -0.01 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2kw2 h LEU 80 Cb 0.53 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 2kw2 h LEU 80 CO 0.02 0.24 0.10 0.00 -0.34 0.00 0.00 178.44 178.46 2kw2 h ALA 81 N 1.43 1.33 -0.12 1.25 0.00 -1.15 -1.19 119.26 120.82 2kw2 h ALA 81 Ca 0.35 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2kw2 h ALA 81 Cb 0.38 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2kw2 h ALA 81 CO -0.28 0.47 -0.04 0.00 0.00 0.00 0.00 179.25 179.41 2kw2 h ALA 82 N 1.45 0.16 -0.72 0.00 0.00 -0.53 -0.89 119.26 118.74 2kw2 h ALA 82 Ca 0.15 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2kw2 h ALA 82 Cb 0.26 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2kw2 h ALA 82 CO -0.00 -0.08 0.48 0.00 0.00 0.00 0.00 179.25 179.64 2kw2 h ARG 83 N -0.09 0.94 -0.29 0.00 2.47 -0.95 -1.47 114.38 114.99 2kw2 h ARG 83 Ca 0.03 -0.06 -0.12 0.00 -1.26 0.00 0.00 59.98 58.57 2kw2 h ARG 83 Cb 0.46 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.56 2kw2 h ARG 83 CO 0.01 0.62 -0.33 0.82 0.56 0.00 0.00 179.97 181.65 2kw2 h ILE 84 N 0.97 1.29 -0.54 2.04 2.04 -1.25 -2.14 117.51 119.90 2kw2 h ILE 84 Ca 0.27 -1.46 0.05 0.00 1.00 0.00 0.00 64.86 64.71 2kw2 h ILE 84 Cb -0.10 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 2kw2 h ILE 84 CO -0.06 0.47 0.36 -0.78 0.00 0.00 0.00 178.15 178.14 2kw2 h ASP 85 N 0.54 0.47 -0.40 1.72 3.58 -0.48 -0.14 116.42 121.72 2kw2 h ASP 85 Ca 0.06 -0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.43 2kw2 h ASP 85 Cb 0.83 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.76 2kw2 h ASP 85 CO 0.07 0.32 -0.04 -0.33 -2.88 0.00 0.00 179.24 176.38 2kw2 h GLU 86 N 0.54 0.73 -0.53 0.28 3.07 -0.68 -2.05 114.58 115.95 2kw2 h GLU 86 Ca 0.23 -0.25 -0.11 0.00 -0.50 0.00 0.00 59.36 58.73 2kw2 h GLU 86 Cb 0.22 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 2kw2 h GLU 86 CO -0.06 0.84 -0.10 -0.07 -1.40 0.00 0.00 179.01 178.22 2kw2 h LEU 87 N 0.55 1.01 -0.47 1.33 3.38 -0.79 0.02 115.31 120.35 2kw2 h LEU 87 Ca 0.11 -0.35 -0.15 0.00 0.09 0.00 0.00 57.88 57.58 2kw2 h LEU 87 Cb 0.53 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2kw2 h LEU 87 CO 0.03 1.12 -0.73 -0.37 0.09 0.00 0.00 178.44 178.58 2kw2 h VAL 88 N 0.88 1.47 -0.60 1.22 -1.51 -1.12 -2.95 116.25 113.64 2kw2 h VAL 88 Ca 0.14 -2.55 -0.10 0.00 -1.23 0.00 0.00 66.70 62.96 2kw2 h VAL 88 Cb 0.67 2.39 -0.02 0.00 -2.13 0.00 0.00 31.29 32.20 2kw2 h VAL 88 CO 0.05 0.72 -0.01 0.00 -1.23 0.00 0.00 177.57 177.09 2kw2 h ALA 89 N 1.27 0.85 -0.48 5.19 0.00 -1.22 -3.24 119.26 121.62 2kw2 h ALA 89 Ca -0.01 -0.32 0.07 0.00 0.00 0.00 0.00 54.91 54.65 2kw2 h ALA 89 Cb 1.34 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 2kw2 h ALA 89 CO 0.10 0.67 0.16 0.00 0.00 0.00 0.00 179.25 180.18 2kw2 h ALA 90 N 1.01 0.58 -0.65 0.00 0.00 -0.82 -1.64 119.26 117.74 2kw2 h ALA 90 Ca 0.17 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 2kw2 h ALA 90 Cb 0.57 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 2kw2 h ALA 90 CO 0.03 -0.23 0.22 1.57 0.00 0.00 0.00 179.25 180.84 2kw2 h LYS 91 N 0.33 0.97 0.00 0.00 2.10 -1.59 -0.20 116.57 118.20 2kw2 h LYS 91 Ca 0.23 -0.18 -0.04 0.00 -2.00 0.00 0.00 60.65 58.67 2kw2 h LYS 91 Cb 0.25 -0.16 -0.01 0.00 -0.90 0.00 0.00 32.23 31.42 2kw2 h LYS 91 CO -0.24 0.82 -0.17 0.78 -2.00 0.00 0.00 179.45 178.64 2kw2 h GLY 92 N 1.04 0.00 1.10 0.07 0.00 -1.47 -1.80 103.07 102.01 2kw2 h GLY 92 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.21 2kw2 h GLY 92 CO -0.01 0.00 -1.62 0.00 0.00 0.00 0.00 176.54 174.90 2kw2 h ALA 93 N 1.83 0.13 -0.63 3.60 0.00 -0.40 -3.31 119.26 120.48 2kw2 h ALA 93 Ca -0.00 -1.07 -0.02 0.00 0.00 0.00 0.00 54.91 53.82 2kw2 h ALA 93 Cb 0.45 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 2kw2 h ALA 93 CO 0.02 1.00 0.32 -0.07 0.00 0.00 0.00 179.25 180.52 2kw2 h LEU 94 N 0.10 0.79 -9.07 0.00 3.38 -0.90 -3.39 115.31 106.23 2kw2 h LEU 94 Ca -0.29 -0.07 -0.56 0.00 0.09 0.00 0.00 57.88 57.04 2kw2 h LEU 94 Cb 2.09 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 42.60 2kw2 h LEU 94 CO 0.19 0.66 1.03 -0.70 0.09 0.00 0.00 178.44 179.72 2kw2 s GLU 95 N -5.54 3.97 -0.23 1.13 -6.30 -0.69 -4.98 118.70 106.06 2kw2 s GLU 95 Ca -0.10 1.63 -0.03 0.00 -2.50 0.00 0.00 54.97 53.97 2kw2 s GLU 95 Cb 0.17 -3.93 0.11 0.00 0.00 0.00 0.00 34.13 30.47 2kw2 s GLU 95 CO 0.79 -1.06 0.25 -1.58 0.02 0.00 0.00 175.26 173.68 2kw2 s HIS 96 N 4.47 -0.36 0.63 5.30 5.65 -1.26 -4.89 115.29 124.83 2kw2 s HIS 96 Ca 0.64 0.19 -0.14 0.00 0.25 0.00 0.00 55.06 56.01 2kw2 s HIS 96 Cb -0.23 -0.35 -0.02 0.00 -1.18 0.00 0.00 32.58 30.80 2kw2 s HIS 96 CO 0.25 -0.68 1.07 -1.01 -0.65 0.00 0.00 174.74 173.71 2kw2 s HIS 97 N 2.35 2.95 0.20 3.88 3.76 -1.26 -4.98 115.29 122.19 2kw2 s HIS 97 Ca 0.08 1.50 -0.10 0.00 -0.15 0.00 0.00 55.06 56.39 2kw2 s HIS 97 Cb -0.15 -3.00 0.14 0.00 1.11 0.00 0.00 32.58 30.68 2kw2 s HIS 97 CO -0.17 -1.25 1.81 0.45 -0.85 0.00 0.00 174.74 174.73 2kw2 h HIS 98 N 0.04 1.04 -3.32 1.40 3.86 -2.05 -3.40 115.15 112.72 2kw2 h HIS 98 Ca -0.46 -0.03 -0.59 0.00 -1.16 0.00 0.00 60.37 58.12 2kw2 h HIS 98 Cb 1.22 -0.33 -0.09 0.00 1.06 0.00 0.00 27.41 29.28 2kw2 h HIS 98 CO 0.59 0.75 0.39 -1.01 0.86 0.00 0.00 177.93 179.51 2kw2 s HIS 99 N -5.80 3.34 -0.63 2.45 3.76 -1.26 -5.01 115.29 112.14 2kw2 s HIS 99 Ca -0.13 1.12 -0.27 0.00 -0.15 0.00 0.00 55.06 55.63 2kw2 s HIS 99 Cb 0.15 -3.00 0.01 0.00 1.11 0.00 0.00 32.58 30.85 2kw2 s HIS 99 CO 0.80 -0.33 1.50 -1.58 -0.85 0.00 0.00 174.74 174.28 2kw2 s HIS 100 N 2.55 2.10 -2.53 1.40 2.46 -1.26 -5.15 115.29 114.86 2kw2 s HIS 100 Ca 0.34 0.38 0.28 0.00 0.47 0.00 0.00 55.06 56.53 2kw2 s HIS 100 Cb -0.16 -4.39 1.00 0.00 -0.13 0.00 0.00 32.58 28.90 2kw2 s HIS 100 CO 0.09 -2.12 1.72 1.58 -2.47 0.00 0.00 174.74 173.53