#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2khd h SER 2 N 0.00 0.00 -0.74 7.83 4.64 -2.05 -2.88 113.55 120.34 2khd h SER 2 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2khd h SER 2 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2khd h SER 2 CO 0.00 0.00 0.30 0.78 -0.87 0.00 0.00 176.83 177.04 2khd h ASN 3 N 0.00 1.01 -1.43 4.97 2.35 -2.14 -3.41 115.58 116.93 2khd h ASN 3 Ca 0.00 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.49 2khd h ASN 3 Cb 0.38 -0.26 -0.26 0.00 0.05 0.00 0.00 38.32 38.23 2khd h ASN 3 CO 0.00 0.90 -0.46 -1.58 -1.65 0.00 0.00 177.43 174.65 2khd s GLN 4 N -5.57 0.47 0.21 0.81 -0.44 -1.09 -5.13 119.66 108.92 2khd s GLN 4 Ca -0.13 0.38 -0.30 0.00 -2.50 0.00 0.00 55.36 52.81 2khd s GLN 4 Cb 0.15 -0.07 -0.09 0.00 -1.64 0.00 0.00 33.01 31.35 2khd s GLN 4 CO 0.82 -0.97 1.41 0.99 0.50 0.00 0.00 175.29 178.05 2khd s THR 5 N 2.66 2.86 -0.08 -0.34 2.01 -1.23 -4.41 115.64 117.11 2khd s THR 5 Ca 0.11 0.70 -0.02 0.00 0.31 0.00 0.00 61.69 62.78 2khd s THR 5 Cb -0.12 -3.44 0.03 0.00 0.01 0.00 0.00 72.50 68.98 2khd s THR 5 CO -0.27 0.10 0.04 0.00 -0.69 0.00 0.00 174.62 173.80 2khd s VAL 7 N 2.07 3.71 0.30 0.00 -7.23 -1.26 -5.04 120.40 112.95 2khd s VAL 7 Ca 0.04 -0.43 -0.30 0.00 -1.81 0.00 0.00 61.98 59.49 2khd s VAL 7 Cb -0.13 -2.60 -0.11 0.00 0.56 0.00 0.00 36.38 34.10 2khd s VAL 7 CO -0.05 0.52 1.53 -1.61 -0.31 0.00 0.00 175.10 175.17 2khd s GLU 8 N 0.17 4.17 0.39 4.82 8.01 -1.26 -4.97 118.70 130.03 2khd s GLU 8 Ca -0.03 2.49 -0.17 0.00 0.01 0.00 0.00 54.97 57.27 2khd s GLU 8 Cb -0.14 -3.04 -0.10 0.00 -4.31 0.00 0.00 34.13 26.55 2khd s GLU 8 CO 0.03 -0.54 0.85 -0.80 0.01 0.00 0.00 175.26 174.81 2khd s ASN 9 N 0.32 6.81 -0.32 -0.19 0.02 -1.26 -5.05 114.94 115.27 2khd s ASN 9 Ca 0.60 1.47 -0.00 0.00 -1.02 0.00 0.00 52.86 53.90 2khd s ASN 9 Cb -0.46 -2.45 0.13 0.00 0.02 0.00 0.00 41.25 38.49 2khd s ASN 9 CO 0.49 -0.32 0.27 -1.83 0.02 0.00 0.00 177.10 175.74 2khd s GLU 10 N -3.23 0.40 -0.19 -0.60 1.03 -1.26 -5.13 118.70 109.72 2khd s GLU 10 Ca 0.58 -0.53 -0.10 0.00 0.03 0.00 0.00 54.97 54.95 2khd s GLU 10 Cb -0.10 -0.85 -0.05 0.00 -0.80 0.00 0.00 34.13 32.34 2khd s GLU 10 CO 0.18 -1.09 0.12 0.14 -1.33 0.00 0.00 175.26 173.28 2khd s VAL 11 N 1.94 5.34 -0.07 1.83 -7.23 -1.26 -4.94 120.40 116.01 2khd s VAL 11 Ca 0.12 0.16 0.16 0.00 -1.81 0.00 0.00 61.98 60.61 2khd s VAL 11 Cb -0.16 -3.43 0.30 0.00 0.56 0.00 0.00 36.38 33.66 2khd s VAL 11 CO -0.23 0.45 1.14 0.00 -0.31 0.00 0.00 175.10 176.16 2khd s GLU 13 N -0.50 3.49 0.53 0.00 0.41 -1.26 -4.97 118.70 116.40 2khd s GLU 13 Ca 0.20 1.74 -0.21 0.00 -0.41 0.00 0.00 54.97 56.29 2khd s GLU 13 Cb 0.26 -2.19 -0.05 0.00 -1.78 0.00 0.00 34.13 30.37 2khd s GLU 13 CO -0.09 -0.77 1.24 0.00 -0.49 0.00 0.00 175.26 175.15 2khd s ALA 14 N -1.63 2.77 0.27 5.21 0.00 -1.26 -4.91 121.76 122.21 2khd s ALA 14 Ca 0.69 1.09 -0.04 0.00 0.00 0.00 0.00 51.96 53.70 2khd s ALA 14 Cb -0.27 -3.47 0.34 0.00 0.00 0.00 0.00 23.12 19.72 2khd s ALA 14 CO 0.32 -1.06 1.92 0.00 0.00 0.00 0.00 175.76 176.94 2khd n GLY 16 N -1.31 0.72 3.71 0.00 0.00 -1.26 -3.52 105.19 103.53 2khd n GLY 16 Ca 0.10 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 45.07 2khd n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2khd n ALA 18 N -4.21 0.00 -1.77 0.00 0.00 -1.23 -4.43 120.51 108.87 2khd n ALA 18 Ca -0.25 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.84 2khd n ALA 18 Cb 0.66 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.10 2khd n ALA 18 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2khd s GLY 19 N 0.00 2.69 -0.30 0.00 0.00 -1.26 -4.93 107.32 103.52 2khd s GLY 19 Ca 0.00 0.85 -0.05 0.00 0.00 0.00 0.00 44.72 45.52 2khd s GLY 19 CO 0.00 1.25 0.88 1.85 0.00 0.00 0.00 173.10 177.08 2khd s GLU 20 N -3.02 0.30 0.73 2.90 2.56 -1.26 -5.05 118.70 115.85 2khd s GLU 20 Ca 0.68 0.26 0.00 0.00 0.00 0.00 0.00 54.97 55.92 2khd s GLU 20 Cb -0.25 0.13 0.00 0.00 2.00 0.00 0.00 34.13 36.00 2khd s GLU 20 CO 0.30 -0.55 0.00 -0.89 -0.56 0.00 0.00 175.26 173.55 2khd n ILE 21 N 5.15 0.00 -2.83 -3.70 5.41 -1.26 -4.81 119.36 117.32 2khd n ILE 21 Ca 0.08 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.81 2khd n ILE 21 Cb 0.57 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.48 2khd n ILE 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2khd n GLY 22 N 0.00 -3.13 3.78 7.39 0.00 -1.26 -4.90 105.19 107.06 2khd n GLY 22 Ca 0.00 0.70 -0.37 0.00 0.00 0.00 0.00 46.02 46.35 2khd n GLY 22 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2khd s PHE 23 N -1.00 3.39 0.00 1.61 0.08 -1.26 -4.61 117.98 116.18 2khd s PHE 23 Ca -0.08 1.68 0.00 0.00 0.12 0.00 0.00 56.93 58.64 2khd s PHE 23 Cb 0.01 -3.11 0.00 0.00 -0.57 0.00 0.00 43.02 39.34 2khd s PHE 23 CO 0.52 -0.46 0.00 -0.89 -0.10 0.00 0.00 175.22 174.29 2khd n ILE 24 N 0.22 0.00 -2.64 0.64 5.41 -1.26 -4.51 119.36 117.22 2khd n ILE 24 Ca 0.04 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.39 2khd n ILE 24 Cb 0.49 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 39.37 2khd n ILE 24 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 176.55 176.82 2khd s ILE 25 N 0.00 3.84 0.34 1.39 -4.36 -1.26 -5.04 121.20 116.11 2khd s ILE 25 Ca 0.00 1.77 -0.04 0.00 -0.26 0.00 0.00 60.65 62.13 2khd s ILE 25 Cb 0.00 -4.10 -0.04 0.00 1.25 0.00 0.00 42.46 39.57 2khd s ILE 25 CO 0.00 0.36 0.60 0.00 0.24 0.00 0.00 174.94 176.14 2khd s ARG 26 N -1.50 3.58 0.71 0.37 1.70 -1.26 -4.77 118.95 117.78 2khd s ARG 26 Ca 0.45 -0.04 -0.15 0.00 -0.47 0.00 0.00 55.73 55.52 2khd s ARG 26 Cb -0.27 -2.59 0.03 0.00 -0.57 0.00 0.00 34.95 31.54 2khd s ARG 26 CO 0.34 0.11 1.19 -1.21 -1.08 0.00 0.00 175.30 174.65 2khd s GLU 27 N -3.98 2.31 0.00 3.89 2.02 -1.26 -4.84 118.70 116.84 2khd s GLU 27 Ca 0.44 1.71 0.00 0.00 0.02 0.00 0.00 54.97 57.14 2khd s GLU 27 Cb -0.10 -1.86 0.00 0.00 0.10 0.00 0.00 34.13 32.27 2khd s GLU 27 CO 0.34 -1.69 0.00 0.41 0.02 0.00 0.00 175.26 174.34 2khd n GLY 28 N 0.26 -0.09 2.13 -1.39 0.00 -1.26 -5.05 105.19 99.78 2khd n GLY 28 Ca 0.13 -1.86 -0.03 0.00 0.00 0.00 0.00 46.02 44.26 2khd n GLY 28 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2khd n ASP 29 N -0.63 -3.96 -3.25 1.61 -0.08 -1.26 -4.35 116.55 104.63 2khd n ASP 29 Ca 0.00 -0.16 -0.07 0.00 -1.51 0.00 0.00 54.79 53.05 2khd n ASP 29 Cb 0.00 -2.44 0.00 0.00 2.34 0.00 0.00 41.12 41.02 2khd n ASP 29 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2khd n ASP 30 N -1.75 -7.01 -4.27 1.67 8.00 -1.26 -4.72 116.55 107.21 2khd n ASP 30 Ca -0.01 -0.28 -0.31 0.00 0.71 0.00 0.00 54.79 54.90 2khd n ASP 30 Cb 0.52 -4.32 -0.16 0.00 -0.02 0.00 0.00 41.12 37.14 2khd n ASP 30 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2khd s VAL 31 N -2.95 2.03 0.09 2.53 1.01 -1.26 -2.61 120.40 119.24 2khd s VAL 31 Ca 0.02 -1.06 0.09 0.00 0.00 0.00 0.00 61.98 61.04 2khd s VAL 31 Cb -0.00 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 2khd s VAL 31 CO 0.79 0.56 -0.23 0.00 0.00 0.00 0.00 175.10 176.22 2khd s ALA 32 N -0.19 2.46 -0.14 5.51 0.00 0.09 -4.96 121.76 124.53 2khd s ALA 32 Ca -0.03 -1.35 -0.05 0.00 0.00 0.00 0.00 51.96 50.53 2khd s ALA 32 Cb -0.13 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 2khd s ALA 32 CO 0.03 0.56 0.03 -1.21 0.00 0.00 0.00 175.76 175.17 2khd s GLU 33 N -1.79 3.56 -0.06 0.00 2.02 -1.26 -1.60 118.70 119.56 2khd s GLU 33 Ca 0.15 -0.38 0.05 0.00 0.02 0.00 0.00 54.97 54.80 2khd s GLU 33 Cb -0.10 -3.02 -0.00 0.00 0.10 0.00 0.00 34.13 31.11 2khd s GLU 33 CO 0.06 0.44 -0.21 0.08 0.02 0.00 0.00 175.26 175.66 2khd s VAL 34 N -0.14 1.74 -0.10 2.63 1.01 0.04 -4.99 120.40 120.58 2khd s VAL 34 Ca 0.06 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.17 2khd s VAL 34 Cb -0.12 -1.49 0.02 0.00 0.00 0.00 0.00 36.38 34.78 2khd s VAL 34 CO 0.02 0.49 -0.10 -0.94 0.00 0.00 0.00 175.10 174.57 2khd s SER 35 N 0.12 2.14 -0.09 3.32 1.04 -1.26 -2.41 113.70 116.56 2khd s SER 35 Ca -0.09 -0.33 0.03 0.00 0.48 0.00 0.00 55.95 56.05 2khd s SER 35 Cb -0.14 -0.89 -0.01 0.00 0.10 0.00 0.00 66.02 65.08 2khd s SER 35 CO 0.04 -0.06 -0.20 -0.22 0.98 0.00 0.00 173.24 173.78 2khd s LEU 36 N 1.37 2.32 -0.12 2.42 2.96 -1.08 -4.97 118.68 121.58 2khd s LEU 36 Ca -0.01 -0.45 -0.00 0.00 -0.22 0.00 0.00 54.13 53.45 2khd s LEU 36 Cb -0.14 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.07 2khd s LEU 36 CO -0.05 0.21 -0.11 0.12 -1.32 0.00 0.00 176.35 175.19 2khd s PHE 37 N 0.08 2.84 0.00 5.38 5.36 -1.26 -1.08 117.98 129.30 2khd s PHE 37 Ca -0.09 -0.46 0.00 0.00 -0.96 0.00 0.00 56.93 55.42 2khd s PHE 37 Cb -0.15 -1.82 0.00 0.00 -0.34 0.00 0.00 43.02 40.71 2khd s PHE 37 CO 0.06 -0.08 0.00 0.41 -1.46 0.00 0.00 175.22 174.15 2khd n GLY 38 N 3.23 1.84 0.00 13.12 0.00 -0.55 -5.01 105.19 117.82 2khd n GLY 38 Ca -0.18 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.09 2khd n GLY 38 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2khd n SER 39 N -0.16 0.00 -4.15 1.61 2.88 -1.26 -4.57 113.62 107.97 2khd n SER 39 Ca 0.00 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.24 2khd n SER 39 Cb 0.00 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 63.66 2khd n SER 39 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2khd s ASP 40 N -1.87 2.12 0.22 -3.46 1.01 -1.26 -4.25 116.67 109.18 2khd s ASP 40 Ca 0.00 0.64 -0.08 0.00 0.71 0.00 0.00 52.55 53.82 2khd s ASP 40 Cb 0.00 -0.92 0.16 0.00 1.01 0.00 0.00 42.92 43.17 2khd s ASP 40 CO 0.00 -3.38 1.78 0.50 0.21 0.00 0.00 175.17 174.28 2khd h LYS 41 N -2.07 1.20 -0.56 8.23 3.64 -1.34 -2.51 116.57 123.16 2khd h LYS 41 Ca -0.47 -0.22 0.08 0.00 -1.27 0.00 0.00 60.65 58.78 2khd h LYS 41 Cb 1.29 -0.20 -0.06 0.00 -0.41 0.00 0.00 32.23 32.85 2khd h LYS 41 CO 0.42 0.97 0.21 0.00 -2.27 0.00 0.00 179.45 178.79 2khd h ALA 42 N 1.18 0.70 -0.79 5.00 0.00 -1.92 0.15 119.26 123.59 2khd h ALA 42 Ca 0.27 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2khd h ALA 42 Cb 0.21 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2khd h ALA 42 CO -0.02 -0.18 0.45 1.25 0.00 0.00 0.00 179.25 180.75 2khd h HIS 43 N 0.40 1.06 -0.70 0.00 -0.00 -1.82 -2.27 115.15 111.82 2khd h HIS 43 Ca 0.27 -0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 60.56 2khd h HIS 43 Cb 0.30 -0.34 -0.03 0.00 -0.00 0.00 0.00 27.41 27.34 2khd h HIS 43 CO -0.16 0.73 0.18 -0.07 -0.00 0.00 0.00 177.93 178.60 2khd h LEU 44 N 1.08 1.05 -0.90 0.26 3.38 -0.73 -2.67 115.31 116.78 2khd h LEU 44 Ca 0.28 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 58.05 2khd h LEU 44 Cb -0.00 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 2khd h LEU 44 CO -0.05 1.00 0.59 -0.33 0.09 0.00 0.00 178.44 179.74 2khd h GLU 45 N 1.06 1.14 -0.27 1.13 5.08 -0.21 0.50 114.58 123.00 2khd h GLU 45 Ca 0.22 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 2khd h GLU 45 Cb 0.36 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2khd h GLU 45 CO 0.00 0.75 0.12 0.78 -1.00 0.00 0.00 179.01 179.67 2khd h GLY 46 N 1.18 0.43 1.72 -3.84 0.00 -1.15 -2.34 103.07 99.06 2khd h GLY 46 Ca 0.34 -0.22 -0.09 0.00 0.00 0.00 0.00 47.33 47.36 2khd h GLY 46 CO -0.09 0.21 -0.29 0.50 0.00 0.00 0.00 176.54 176.87 2khd h LYS 47 N 0.30 0.33 -0.88 4.80 1.57 -1.11 -2.79 116.57 118.78 2khd h LYS 47 Ca 0.09 -0.12 0.06 0.00 -1.87 0.00 0.00 60.65 58.81 2khd h LYS 47 Cb 0.15 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.38 2khd h LYS 47 CO -0.01 0.59 0.57 1.25 -0.57 0.00 0.00 179.45 181.29 2khd h LEU 48 N 0.29 0.88 -0.98 2.94 5.85 0.52 -1.43 115.31 123.38 2khd h LEU 48 Ca 0.04 0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.93 2khd h LEU 48 Cb 0.66 -0.18 -0.10 0.00 0.37 0.00 0.00 40.66 41.41 2khd h LEU 48 CO 0.05 0.57 0.58 0.00 -0.34 0.00 0.00 178.44 179.30 2khd h ALA 49 N 1.52 1.56 -0.45 1.25 0.00 -1.19 0.57 119.26 122.53 2khd h ALA 49 Ca 0.38 0.07 -0.12 0.00 0.00 0.00 0.00 54.91 55.24 2khd h ALA 49 Cb 0.19 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2khd h ALA 49 CO -0.14 0.01 -0.18 0.93 0.00 0.00 0.00 179.25 179.87 2khd h GLU 50 N 0.79 0.92 -0.45 0.00 5.08 -1.40 -1.47 114.58 118.05 2khd h GLU 50 Ca 0.54 -0.38 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 2khd h GLU 50 Cb 0.76 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 2khd h GLU 50 CO -0.35 1.04 0.23 1.88 -1.00 0.00 0.00 179.01 180.81 2khd h TYR 51 N 0.76 0.63 -0.52 4.33 -1.99 -0.86 -2.02 116.97 117.30 2khd h TYR 51 Ca 0.11 -0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.77 2khd h TYR 51 Cb 0.74 -0.20 -0.02 0.00 2.00 0.00 0.00 36.73 39.25 2khd h TYR 51 CO 0.05 0.50 0.16 0.82 -0.00 0.00 0.00 178.16 179.69 2khd h ILE 52 N 0.59 1.23 -1.00 -2.88 2.04 -0.87 -2.60 117.51 114.02 2khd h ILE 52 Ca 0.16 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.27 2khd h ILE 52 Cb 0.08 0.76 -0.05 0.00 -0.74 0.00 0.00 36.82 36.87 2khd h ILE 52 CO -0.02 0.28 0.66 0.77 0.00 0.00 0.00 178.15 179.84 2khd h SER 53 N 0.70 1.13 -0.66 1.72 4.64 -0.97 -0.79 113.55 119.32 2khd h SER 53 Ca 0.17 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.43 2khd h SER 53 Cb 0.27 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2khd h SER 53 CO -0.01 0.80 0.26 -0.07 -0.87 0.00 0.00 176.83 176.94 2khd h LEU 54 N 1.32 0.91 -0.64 5.97 3.38 -1.11 -0.03 115.31 125.11 2khd h LEU 54 Ca 0.38 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 2khd h LEU 54 Cb -0.10 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.39 2khd h LEU 54 CO -0.10 0.83 0.19 0.00 0.09 0.00 0.00 178.44 179.46 2khd h ALA 55 N 1.11 0.83 -0.42 1.53 0.00 -0.99 0.22 119.26 121.55 2khd h ALA 55 Ca 0.22 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2khd h ALA 55 Cb 0.21 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2khd h ALA 55 CO -0.02 0.51 0.06 0.87 0.00 0.00 0.00 179.25 180.67 2khd h LYS 56 N 0.92 0.71 -0.34 0.00 1.57 -0.78 0.17 116.57 118.81 2khd h LYS 56 Ca 0.20 -0.20 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 2khd h LYS 56 Cb 0.30 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2khd h LYS 56 CO -0.01 0.75 -0.08 0.37 -0.57 0.00 0.00 179.45 179.92 2khd h GLN 57 N 0.56 0.65 -0.31 3.15 4.15 -0.76 -3.11 115.11 119.44 2khd h GLN 57 Ca 0.13 -0.25 -0.03 0.00 0.77 0.00 0.00 58.65 59.27 2khd h GLN 57 Cb 0.39 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.03 2khd h GLN 57 CO 0.01 0.82 0.07 0.28 -1.93 0.00 0.00 178.83 178.08 2khd h VAL 58 N 0.44 1.22 -3.29 2.39 2.07 -0.43 -3.42 116.25 115.23 2khd h VAL 58 Ca 0.09 -0.74 -0.48 0.00 0.82 0.00 0.00 66.70 66.39 2khd h VAL 58 Cb 0.57 1.11 -0.36 0.00 -1.52 0.00 0.00 31.29 31.09 2khd h VAL 58 CO 0.03 0.25 -0.79 -0.47 0.02 0.00 0.00 177.57 176.61 2khd s TYR 59 N -5.29 1.12 0.41 1.57 5.04 0.58 -5.08 117.35 115.70 2khd s TYR 59 Ca -0.13 -0.45 -0.25 0.00 -2.44 0.00 0.00 57.07 53.80 2khd s TYR 59 Cb 0.09 -0.98 -0.08 0.00 0.35 0.00 0.00 41.96 41.33 2khd s TYR 59 CO 0.75 -0.37 1.17 0.00 -1.34 0.00 0.00 175.55 175.76 2khd s ALA 60 N 1.48 3.13 -1.40 3.97 0.00 -1.22 -3.21 121.76 124.51 2khd s ALA 60 Ca -0.01 0.96 -0.10 0.00 0.00 0.00 0.00 51.96 52.81 2khd s ALA 60 Cb -0.13 -3.38 0.03 0.00 0.00 0.00 0.00 23.12 19.64 2khd s ALA 60 CO -0.04 -0.54 1.11 -1.71 0.00 0.00 0.00 175.76 174.58 2khd n ASN 61 N -0.01 -5.53 -4.72 0.00 2.85 -1.26 -4.92 115.26 101.67 2khd n ASN 61 Ca 0.05 -0.62 -0.42 0.00 -0.11 0.00 0.00 54.58 53.48 2khd n ASN 61 Cb 0.47 -4.69 -0.03 0.00 1.24 0.00 0.00 39.78 36.76 2khd n ASN 61 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2khd s VAL 62 N -3.33 4.14 0.24 3.44 0.11 -1.20 -5.03 120.40 118.78 2khd s VAL 62 Ca 0.56 1.65 -0.09 0.00 -2.93 0.00 0.00 61.98 61.17 2khd s VAL 62 Cb -0.26 -4.06 -0.07 0.00 -1.53 0.00 0.00 36.38 30.47 2khd s VAL 62 CO 0.76 0.19 0.56 -1.61 -3.33 0.00 0.00 175.10 171.67 2khd s GLU 63 N 0.48 3.78 0.19 1.54 2.02 -1.26 -4.95 118.70 120.50 2khd s GLU 63 Ca 0.54 0.24 -0.18 0.00 0.02 0.00 0.00 54.97 55.59 2khd s GLU 63 Cb -0.28 -2.64 0.03 0.00 0.10 0.00 0.00 34.13 31.35 2khd s GLU 63 CO 0.31 0.29 0.54 1.52 0.02 0.00 0.00 175.26 177.94 2khd s TYR 64 N -1.87 -0.19 0.07 1.61 -0.85 -1.26 -2.51 117.35 112.36 2khd s TYR 64 Ca 0.47 -0.15 -0.16 0.00 -0.52 0.00 0.00 57.07 56.71 2khd s TYR 64 Cb -0.11 0.43 0.03 0.00 0.38 0.00 0.00 41.96 42.69 2khd s TYR 64 CO 0.23 -0.91 0.38 -1.83 -1.52 0.00 0.00 175.55 171.90 2khd s GLU 65 N -3.85 0.95 -0.09 -3.49 1.03 -0.97 -5.02 118.70 107.25 2khd s GLU 65 Ca 0.08 -0.52 0.03 0.00 0.03 0.00 0.00 54.97 54.59 2khd s GLU 65 Cb -0.01 0.42 0.01 0.00 -0.80 0.00 0.00 34.13 33.74 2khd s GLU 65 CO -0.04 -0.34 -0.20 0.54 -1.33 0.00 0.00 175.26 173.90 2khd s VAL 66 N -2.97 1.72 0.69 1.83 0.11 -1.26 -2.03 120.40 118.50 2khd s VAL 66 Ca -0.02 -0.82 -0.11 0.00 -2.93 0.00 0.00 61.98 58.10 2khd s VAL 66 Cb 0.00 -1.51 0.01 0.00 -1.53 0.00 0.00 36.38 33.35 2khd s VAL 66 CO -0.06 0.48 1.06 0.00 -3.33 0.00 0.00 175.10 173.26 2khd s ALA 67 N 0.50 2.71 -0.18 1.54 0.00 -0.66 -4.93 121.76 120.74 2khd s ALA 67 Ca -0.16 0.01 -0.29 0.00 0.00 0.00 0.00 51.96 51.52 2khd s ALA 67 Cb -0.17 -3.15 -0.06 0.00 0.00 0.00 0.00 23.12 19.74 2khd s ALA 67 CO 0.06 -1.19 2.18 -0.35 0.00 0.00 0.00 175.76 176.47 2khd n PRO 68 N -3.10 2.10 -4.92 0.00 -0.04 -1.26 -4.74 135.00 123.04 2khd n PRO 68 Ca 0.07 0.62 -0.27 0.00 -0.04 0.00 0.00 63.50 63.88 2khd n PRO 68 Cb 0.54 -3.19 -0.16 0.00 -0.04 0.00 0.00 33.50 30.65 2khd n PRO 68 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2khd s VAL 69 N 7.65 1.57 0.57 0.52 1.01 -1.26 -4.99 120.40 125.46 2khd s VAL 69 Ca 0.99 -0.79 -0.19 0.00 0.00 0.00 0.00 61.98 61.99 2khd s VAL 69 Cb -0.36 -1.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.62 2khd s VAL 69 CO 0.37 0.45 1.18 0.00 0.00 0.00 0.00 175.10 177.09 2khd s ALA 70 N 0.06 2.62 0.42 5.51 0.00 -1.26 -4.90 121.76 124.21 2khd s ALA 70 Ca -0.05 0.94 0.15 0.00 0.00 0.00 0.00 51.96 53.00 2khd s ALA 70 Cb -0.13 -3.42 0.97 0.00 0.00 0.00 0.00 23.12 20.55 2khd s ALA 70 CO 0.03 -1.00 1.96 0.38 0.00 0.00 0.00 175.76 177.13 2khd h ASP 71 N 1.05 0.00 -0.32 0.00 2.03 -1.99 -0.71 116.42 116.48 2khd h ASP 71 Ca -0.50 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.80 2khd h ASP 71 Cb 1.28 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.78 2khd h ASP 71 CO 0.56 0.23 0.00 0.59 -1.03 0.00 0.00 179.24 179.59 2khd n ASN 72 N -4.20 1.96 -4.77 4.15 5.03 -1.26 -2.16 115.26 114.02 2khd n ASN 72 Ca -0.02 -1.92 -0.36 0.00 0.87 0.00 0.00 54.58 53.15 2khd n ASN 72 Cb 0.29 -0.21 0.00 0.00 -1.02 0.00 0.00 39.78 38.84 2khd n ASN 72 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2khd s ALA 73 N -1.58 2.76 -2.59 5.41 0.00 -0.27 -4.82 121.76 120.67 2khd s ALA 73 Ca 0.28 0.90 0.23 0.00 0.00 0.00 0.00 51.96 53.37 2khd s ALA 73 Cb 0.15 -3.39 0.36 0.00 0.00 0.00 0.00 23.12 20.24 2khd s ALA 73 CO 0.20 -0.81 1.36 0.25 0.00 0.00 0.00 175.76 176.76 2khd n THR 74 N -1.08 0.37 -4.03 0.00 -2.24 -1.26 -3.02 114.28 103.02 2khd n THR 74 Ca 0.11 -0.69 -0.08 0.00 -2.27 0.00 0.00 64.05 61.12 2khd n THR 74 Cb 0.50 1.12 -0.09 0.00 -2.10 0.00 0.00 70.33 69.76 2khd n THR 74 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2khd s GLU 75 N -1.61 0.74 -0.04 -0.78 -1.05 -1.26 -1.48 118.70 113.22 2khd s GLU 75 Ca 0.36 -1.17 0.04 0.00 -0.15 0.00 0.00 54.97 54.04 2khd s GLU 75 Cb 0.22 0.26 -0.00 0.00 -0.44 0.00 0.00 34.13 34.17 2khd s GLU 75 CO 0.31 -0.19 -0.15 -1.17 0.95 0.00 0.00 175.26 175.01 2khd s LEU 76 N -2.92 1.87 -0.17 1.83 2.96 -0.24 -4.91 118.68 117.09 2khd s LEU 76 Ca 0.09 -0.31 -0.04 0.00 -0.22 0.00 0.00 54.13 53.64 2khd s LEU 76 Cb 0.07 -0.87 -0.03 0.00 0.50 0.00 0.00 46.19 45.86 2khd s LEU 76 CO -0.08 0.13 -0.02 -1.00 -1.32 0.00 0.00 176.35 174.05 2khd s HIS 77 N 0.12 3.05 0.04 5.38 3.76 -1.26 -2.62 115.29 123.76 2khd s HIS 77 Ca -0.04 -0.30 -0.16 0.00 -0.15 0.00 0.00 55.06 54.40 2khd s HIS 77 Cb -0.11 -2.00 0.03 0.00 1.11 0.00 0.00 32.58 31.61 2khd s HIS 77 CO 0.02 -0.07 0.37 0.00 -0.85 0.00 0.00 174.74 174.21 2khd s ALA 78 N 0.52 -0.88 0.09 -1.40 0.00 -1.01 -1.65 121.76 117.43 2khd s ALA 78 Ca -0.02 0.20 0.06 0.00 0.00 0.00 0.00 51.96 52.20 2khd s ALA 78 Cb -0.14 0.32 -0.03 0.00 0.00 0.00 0.00 23.12 23.27 2khd s ALA 78 CO 0.02 -0.43 -0.16 1.03 0.00 0.00 0.00 175.76 176.22 2khd s ARG 79 N -2.45 0.94 0.05 0.00 0.52 -0.86 -0.78 118.95 116.37 2khd s ARG 79 Ca -0.06 -1.05 0.05 0.00 -0.52 0.00 0.00 55.73 54.16 2khd s ARG 79 Cb -0.01 -1.02 -0.02 0.00 0.52 0.00 0.00 34.95 34.42 2khd s ARG 79 CO -0.02 0.23 -0.14 -0.06 0.02 0.00 0.00 175.30 175.33 2khd s PHE 80 N -1.32 1.20 -0.06 -0.53 0.40 -0.63 -2.28 117.98 114.76 2khd s PHE 80 Ca 0.02 -0.40 0.03 0.00 -0.60 0.00 0.00 56.93 55.97 2khd s PHE 80 Cb -0.10 -0.69 -0.03 0.00 0.51 0.00 0.00 43.02 42.72 2khd s PHE 80 CO 0.03 0.04 -0.13 0.15 0.70 0.00 0.00 175.22 176.01 2khd s LYS 81 N -1.41 2.61 0.12 0.44 1.02 -1.04 -0.73 119.74 120.75 2khd s LYS 81 Ca -0.00 -0.68 0.03 0.00 0.02 0.00 0.00 55.97 55.34 2khd s LYS 81 Cb -0.09 -2.43 -0.04 0.00 -0.52 0.00 0.00 37.83 34.75 2khd s LYS 81 CO 0.02 0.59 -0.09 -0.06 -0.92 0.00 0.00 175.35 174.89 2khd s PHE 82 N -0.64 1.10 0.24 3.18 0.08 -1.07 -4.16 117.98 116.71 2khd s PHE 82 Ca 0.09 -0.78 -0.04 0.00 0.12 0.00 0.00 56.93 56.33 2khd s PHE 82 Cb -0.11 -0.59 0.27 0.00 -0.57 0.00 0.00 43.02 42.02 2khd s PHE 82 CO 0.01 -0.01 1.73 1.49 -0.10 0.00 0.00 175.22 178.34 2khd h GLU 83 N 3.04 0.85 -4.62 0.44 4.81 -1.95 -3.44 114.58 113.70 2khd h GLU 83 Ca -0.36 -0.24 -0.22 0.00 -0.13 0.00 0.00 59.36 58.41 2khd h GLU 83 Cb 1.18 -0.09 -0.15 0.00 0.63 0.00 0.00 28.75 30.32 2khd h GLU 83 CO 0.61 0.86 -0.70 0.14 -0.73 0.00 0.00 179.01 179.19 2khd s VAL 84 N -4.98 0.66 0.22 0.32 -7.23 -1.26 -4.99 120.40 103.14 2khd s VAL 84 Ca -0.10 -1.89 -0.06 0.00 -1.81 0.00 0.00 61.98 58.12 2khd s VAL 84 Cb 0.14 -1.63 0.12 0.00 0.56 0.00 0.00 36.38 35.57 2khd s VAL 84 CO 0.82 -0.86 1.73 -1.28 -0.31 0.00 0.00 175.10 175.20 2khd h SER 85 N 3.04 0.97 -1.05 4.85 0.87 -1.97 -2.95 113.55 117.32 2khd h SER 85 Ca -0.35 -0.22 0.41 0.00 -1.23 0.00 0.00 61.79 60.40 2khd h SER 85 Cb 1.17 -0.26 -0.17 0.00 -0.44 0.00 0.00 62.40 62.70 2khd h SER 85 CO 0.64 0.96 0.59 0.00 -0.53 0.00 0.00 176.83 178.49 2khd h ALA 86 N 1.15 2.23 -0.25 6.23 0.00 -1.99 2.09 119.26 128.71 2khd h ALA 86 Ca 0.20 0.24 -0.08 0.00 0.00 0.00 0.00 54.91 55.27 2khd h ALA 86 Cb 0.40 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2khd h ALA 86 CO 0.01 -0.97 -0.17 0.93 0.00 0.00 0.00 179.25 179.04 2khd h GLU 87 N 0.05 0.44 -0.45 0.00 4.39 -1.95 -2.81 114.58 114.26 2khd h GLU 87 Ca 0.84 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 60.38 2khd h GLU 87 Cb 2.24 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 30.82 2khd h GLU 87 CO -0.70 0.60 0.22 -0.22 -1.16 0.00 0.00 179.01 177.75 2khd h LYS 88 N 0.40 0.64 0.03 2.33 3.64 0.33 0.60 116.57 124.54 2khd h LYS 88 Ca 0.07 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2khd h LYS 88 Cb 0.54 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2khd h LYS 88 CO 0.03 0.53 -0.01 1.25 -2.27 0.00 0.00 179.45 178.98 2khd h LEU 89 N 0.58 -0.04 -0.19 5.20 5.85 -1.26 0.37 115.31 125.83 2khd h LEU 89 Ca 0.15 -0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.68 2khd h LEU 89 Cb 0.10 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 2khd h LEU 89 CO -0.02 0.10 -0.15 0.40 -0.34 0.00 0.00 178.44 178.43 2khd h ILE 90 N -0.17 1.32 -0.45 4.05 5.03 -1.40 -2.25 117.51 123.64 2khd h ILE 90 Ca -0.00 -1.28 -0.02 0.00 -0.12 0.00 0.00 64.86 63.44 2khd h ILE 90 Cb 0.16 1.74 -0.02 0.00 -3.03 0.00 0.00 36.82 35.66 2khd h ILE 90 CO 0.01 0.39 0.21 0.15 -0.68 0.00 0.00 178.15 178.22 2khd h PHE 91 N 0.12 0.66 -0.75 1.37 3.57 0.25 -2.34 116.94 119.82 2khd h PHE 91 Ca 0.04 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 2khd h PHE 91 Cb 0.67 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.18 2khd h PHE 91 CO 0.07 0.54 0.35 1.49 -2.23 0.00 0.00 178.31 178.53 2khd h GLU 92 N 0.59 1.08 -0.45 1.11 4.81 -0.25 -1.18 114.58 120.28 2khd h GLU 92 Ca 0.15 -0.16 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2khd h GLU 92 Cb 0.14 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 2khd h GLU 92 CO -0.02 0.84 0.18 -0.07 -0.73 0.00 0.00 179.01 179.22 2khd h LEU 93 N 1.07 0.62 -0.36 1.64 3.38 -1.08 0.28 115.31 120.87 2khd h LEU 93 Ca 0.26 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 2khd h LEU 93 Cb 0.13 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2khd h LEU 93 CO -0.03 0.62 -0.01 0.11 0.09 0.00 0.00 178.44 179.22 2khd h LYS 94 N 0.59 0.63 -0.28 1.13 1.57 -1.12 -0.79 116.57 118.31 2khd h LYS 94 Ca 0.15 -0.21 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 2khd h LYS 94 Cb 0.19 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2khd h LYS 94 CO -0.01 0.75 -0.31 1.79 -0.57 0.00 0.00 179.45 181.10 2khd h THR 95 N 0.44 1.28 -0.47 -0.16 1.35 -1.06 -2.77 112.91 111.52 2khd h THR 95 Ca 0.10 -1.41 -0.13 0.00 -0.55 0.00 0.00 66.41 64.42 2khd h THR 95 Cb 0.47 1.40 -0.01 0.00 -1.73 0.00 0.00 68.15 68.28 2khd h THR 95 CO 0.02 0.45 -0.21 -0.09 -0.25 0.00 0.00 175.52 175.44 2khd h ARG 96 N 0.50 0.97 -0.34 4.72 9.65 -0.28 -1.57 114.38 128.03 2khd h ARG 96 Ca 0.06 -0.41 0.04 0.00 -1.10 0.00 0.00 59.98 58.58 2khd h ARG 96 Cb 0.78 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 29.28 2khd h ARG 96 CO 0.06 1.08 0.09 0.00 2.80 0.00 0.00 179.97 184.00 2khd h ALA 97 N 0.91 0.37 -0.65 2.80 0.00 -0.91 0.27 119.26 122.06 2khd h ALA 97 Ca 0.11 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2khd h ALA 97 Cb 0.78 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 2khd h ALA 97 CO 0.06 -0.31 0.21 -0.07 0.00 0.00 0.00 179.25 179.15 2khd h LEU 98 N 0.22 0.94 -1.35 0.00 3.38 -1.35 -1.09 115.31 116.06 2khd h LEU 98 Ca 0.15 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2khd h LEU 98 Cb 0.15 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2khd h LEU 98 CO -0.18 0.90 -0.13 0.00 0.09 0.00 0.00 178.44 179.12 2khd h ALA 99 N 1.08 1.47 -0.06 1.53 0.00 -0.40 -1.14 119.26 121.74 2khd h ALA 99 Ca 0.21 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2khd h ALA 99 Cb 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2khd h ALA 99 CO -0.01 0.38 0.00 0.54 0.00 0.00 0.00 179.25 180.16 2khd n ARG 100 N -4.26 1.62 -0.21 0.00 5.12 0.88 -4.03 116.66 115.78 2khd n ARG 100 Ca -0.00 -0.92 -0.08 0.00 -1.93 0.00 0.00 57.85 54.92 2khd n ARG 100 Cb 0.28 -1.45 0.03 0.00 -1.16 0.00 0.00 32.46 30.15 2khd n ARG 100 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2khd h LEU 101 N 2.09 0.81 -8.96 0.55 5.85 0.08 -3.40 115.31 112.33 2khd h LEU 101 Ca 0.00 -0.17 -0.63 0.00 0.84 0.00 0.00 57.88 57.92 2khd h LEU 101 Cb 0.45 -0.21 -0.15 0.00 0.37 0.00 0.00 40.66 41.12 2khd h LEU 101 CO 0.00 0.76 -0.28 -1.61 -0.34 0.00 0.00 178.44 176.97 2khd s GLU 102 N -5.54 4.02 -1.09 1.25 2.02 -1.26 -5.00 118.70 113.11 2khd s GLU 102 Ca -0.13 -0.01 -0.04 0.00 0.02 0.00 0.00 54.97 54.82 2khd s GLU 102 Cb 0.13 -3.64 0.30 0.00 0.10 0.00 0.00 34.13 31.02 2khd s GLU 102 CO 0.79 -0.23 1.55 1.58 0.02 0.00 0.00 175.26 178.98 2khd n HIS 103 N 5.17 2.31 0.68 1.61 -0.00 -1.26 -4.67 115.22 119.05 2khd n HIS 103 Ca -0.09 -2.57 0.12 0.00 -0.00 0.00 0.00 57.72 55.17 2khd n HIS 103 Cb 0.51 -1.28 0.21 0.00 -0.00 0.00 0.00 29.99 29.43 2khd n HIS 103 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2khd n HIS 104 N 1.29 0.42 -1.42 1.57 8.25 -1.26 -5.05 115.22 119.02 2khd n HIS 104 Ca 0.29 0.12 0.07 0.00 -0.26 0.00 0.00 57.72 57.95 2khd n HIS 104 Cb 0.32 -0.57 -0.04 0.00 1.12 0.00 0.00 29.99 30.82 2khd n HIS 104 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2khd n HIS 105 N -1.96 -3.50 -2.63 4.41 -0.00 -1.26 -4.76 115.22 105.52 2khd n HIS 105 Ca 0.04 1.92 -0.42 0.00 0.46 0.00 0.00 57.72 59.72 2khd n HIS 105 Cb 0.41 -3.05 -0.04 0.00 -0.12 0.00 0.00 29.99 27.19 2khd n HIS 105 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2khd s HIS 106 N -4.85 3.66 0.14 1.57 3.76 -1.26 -4.94 115.29 113.36 2khd s HIS 106 Ca 0.00 1.64 -0.13 0.00 -0.15 0.00 0.00 55.06 56.42 2khd s HIS 106 Cb 0.00 -3.18 -0.01 0.00 1.11 0.00 0.00 32.58 30.50 2khd s HIS 106 CO 0.00 -0.27 1.57 1.25 -0.85 0.00 0.00 174.74 176.44 2khd h HIS 107 N 6.15 0.88 0.00 1.40 2.76 -2.06 -3.57 115.15 120.71 2khd h HIS 107 Ca -0.42 -0.16 0.00 0.00 -2.20 0.00 0.00 60.37 57.58 2khd h HIS 107 Cb 1.21 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 29.95 2khd h HIS 107 CO 0.66 0.87 0.00 1.58 -1.30 0.00 0.00 177.93 179.74