#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aw6 n LYS 2 N 0.00 0.26 -3.35 3.17 5.02 -1.26 -5.05 118.16 116.95 1aw6 n LYS 2 Ca 0.00 0.11 -0.18 0.00 -2.02 0.00 0.00 58.31 56.22 1aw6 n LYS 2 Cb 0.00 -0.95 0.06 0.00 -0.02 0.00 0.00 35.03 34.12 1aw6 n LYS 2 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1aw6 n LEU 3 N -3.81 -5.01 0.00 -0.35 4.32 -1.26 -5.04 117.00 105.85 1aw6 n LEU 3 Ca -0.14 -0.73 0.00 0.00 -0.02 0.00 0.00 56.01 55.12 1aw6 n LEU 3 Cb 0.41 -3.00 0.00 0.00 -1.62 0.00 0.00 43.42 39.22 1aw6 n LEU 3 CO 0.07 0.07 0.00 0.18 -1.22 0.00 0.00 177.39 176.49 1aw6 n LEU 4 N -3.31 0.00 -1.51 2.23 4.32 -1.26 -5.01 117.00 112.46 1aw6 n LEU 4 Ca -0.07 0.00 -0.05 0.00 -0.02 0.00 0.00 56.01 55.87 1aw6 n LEU 4 Cb 0.60 0.00 0.17 0.00 -1.62 0.00 0.00 43.42 42.58 1aw6 n LEU 4 CO 0.60 0.00 0.78 -1.54 -1.22 0.00 0.00 177.39 176.01 1aw6 n SER 5 N -0.48 3.61 -4.39 -1.43 3.41 -1.26 -4.90 113.62 108.19 1aw6 n SER 5 Ca 0.00 -2.73 -0.21 0.00 -0.26 0.00 0.00 58.87 55.67 1aw6 n SER 5 Cb 0.00 -0.65 -0.10 0.00 -0.26 0.00 0.00 64.21 63.20 1aw6 n SER 5 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1aw6 s SER 6 N -0.39 2.27 0.00 4.04 0.15 -1.26 -5.10 113.70 113.40 1aw6 s SER 6 Ca 0.32 -1.42 0.00 0.00 0.70 0.00 0.00 55.95 55.55 1aw6 s SER 6 Cb 0.26 0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 1aw6 s SER 6 CO 0.08 -0.67 0.00 -0.38 1.20 0.00 0.00 173.24 173.47 1aw6 n ILE 7 N -0.69 0.00 -0.97 6.45 2.08 -1.26 -4.84 119.36 120.13 1aw6 n ILE 7 Ca -0.03 0.00 -0.11 0.00 0.56 0.00 0.00 62.75 63.17 1aw6 n ILE 7 Cb 0.66 0.00 -0.12 0.00 -0.75 0.00 0.00 39.64 39.44 1aw6 n ILE 7 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1aw6 n GLU 8 N -1.56 0.00 -2.12 0.38 4.07 -1.26 -4.82 120.64 115.32 1aw6 n GLU 8 Ca 0.00 0.00 -0.27 0.00 -0.06 0.00 0.00 57.16 56.83 1aw6 n GLU 8 Cb 0.00 -0.71 0.07 0.00 -0.06 0.00 0.00 31.44 30.74 1aw6 n GLU 8 CO 0.00 0.00 0.00 1.14 -0.06 0.00 0.00 177.13 178.21 1aw6 s GLN 9 N 4.58 2.16 -0.17 5.31 0.00 -1.26 -5.11 119.66 125.18 1aw6 s GLN 9 Ca 0.67 -0.15 -0.08 0.00 -0.00 0.00 0.00 55.36 55.81 1aw6 s GLN 9 Cb -0.43 -2.11 0.07 0.00 0.00 0.00 0.00 33.01 30.53 1aw6 s GLN 9 CO 0.29 -1.32 0.38 0.00 0.00 0.00 0.00 175.29 174.64 1aw6 s ALA 10 N -3.33 -0.98 1.32 2.60 0.00 -1.26 -4.93 121.76 115.18 1aw6 s ALA 10 Ca 0.60 1.40 -0.19 0.00 0.00 0.00 0.00 51.96 53.78 1aw6 s ALA 10 Cb -0.11 -1.03 0.33 0.00 0.00 0.00 0.00 23.12 22.31 1aw6 s ALA 10 CO 0.46 -0.45 0.97 0.00 0.00 0.00 0.00 175.76 176.74 1aw6 h ASP 12 N -3.10 0.42 -0.19 0.00 1.82 -1.80 -2.99 116.42 110.58 1aw6 h ASP 12 Ca -0.51 0.03 -0.02 0.00 -0.39 0.00 0.00 57.03 56.14 1aw6 h ASP 12 Cb 1.34 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 41.28 1aw6 h ASP 12 CO 0.37 0.29 0.07 0.40 -1.61 0.00 0.00 179.24 178.76 1aw6 h ILE 13 N 0.55 1.12 0.01 2.25 1.08 -1.87 -1.44 117.51 119.22 1aw6 h ILE 13 Ca 0.24 -0.41 -0.20 0.00 -0.39 0.00 0.00 64.86 64.10 1aw6 h ILE 13 Cb 0.13 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 34.72 1aw6 h ILE 13 CO -0.16 0.15 -0.90 0.00 -0.69 0.00 0.00 178.15 176.55 1aw6 h ARG 15 N 0.09 -0.45 0.14 0.00 2.43 -1.13 -1.38 114.38 114.08 1aw6 h ARG 15 Ca -0.04 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1aw6 h ARG 15 Cb 1.54 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 31.20 1aw6 h ARG 15 CO 0.14 -0.30 -0.07 -0.07 -1.51 0.00 0.00 179.97 178.16 1aw6 h LEU 16 N -0.47 -0.16 -0.52 3.80 3.38 -1.54 -2.93 115.31 116.87 1aw6 h LEU 16 Ca 0.01 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1aw6 h LEU 16 Cb 0.50 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1aw6 h LEU 16 CO -0.24 0.18 0.00 0.11 0.09 0.00 0.00 178.44 178.57 1aw6 h LYS 17 N -0.51 0.00 -5.19 1.13 1.79 -1.58 -3.47 116.57 108.73 1aw6 h LYS 17 Ca -0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1aw6 h LYS 17 Cb 0.40 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.05 1aw6 h LYS 17 CO 0.03 0.00 -0.10 1.63 -1.08 0.00 0.00 179.45 179.94 1aw6 n LYS 18 N -2.68 -1.43 -4.54 3.15 5.02 -0.55 -5.05 118.16 112.08 1aw6 n LYS 18 Ca 0.03 1.55 -0.25 0.00 -2.02 0.00 0.00 58.31 57.62 1aw6 n LYS 18 Cb 0.38 -5.47 -0.10 0.00 -0.02 0.00 0.00 35.03 29.82 1aw6 n LYS 18 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1aw6 s LEU 19 N -3.59 2.32 0.31 -0.35 1.02 -1.04 -5.07 118.68 112.28 1aw6 s LEU 19 Ca 0.05 -1.46 -0.11 0.00 0.02 0.00 0.00 54.13 52.63 1aw6 s LEU 19 Cb -0.01 -0.49 -0.07 0.00 0.02 0.00 0.00 46.19 45.63 1aw6 s LEU 19 CO 0.70 -0.66 0.66 -0.54 0.02 0.00 0.00 176.35 176.54 1aw6 s LYS 20 N -3.82 3.84 -0.46 1.70 1.02 -1.26 -4.88 119.74 115.88 1aw6 s LYS 20 Ca 0.30 0.42 0.05 0.00 0.02 0.00 0.00 55.97 56.76 1aw6 s LYS 20 Cb 0.07 -2.51 0.19 0.00 -0.52 0.00 0.00 37.83 35.05 1aw6 s LYS 20 CO 0.14 0.17 0.41 0.00 -0.92 0.00 0.00 175.35 175.15 1aw6 h SER 22 N 5.28 0.00 0.00 0.00 4.64 -1.97 -3.45 113.55 118.06 1aw6 h SER 22 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1aw6 h SER 22 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 1aw6 h SER 22 CO 0.46 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.71 1aw6 n LYS 23 N -2.58 0.00 -1.23 4.77 4.01 -1.26 -5.00 118.16 116.87 1aw6 n LYS 23 Ca -0.01 0.00 -0.38 0.00 -0.51 0.00 0.00 58.31 57.42 1aw6 n LYS 23 Cb 0.75 -2.52 0.04 0.00 -0.51 0.00 0.00 35.03 32.79 1aw6 n LYS 23 CO 0.00 0.00 0.00 -0.85 -1.11 0.00 0.00 177.40 175.44 1aw6 n GLU 24 N -2.00 0.14 -4.10 1.97 0.28 -1.26 -4.83 120.64 110.84 1aw6 n GLU 24 Ca 0.00 0.06 -0.11 0.00 -0.16 0.00 0.00 57.16 56.95 1aw6 n GLU 24 Cb 0.00 -1.31 -0.11 0.00 1.43 0.00 0.00 31.44 31.45 1aw6 n GLU 24 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1aw6 s LYS 25 N -1.80 0.63 0.26 3.44 1.02 -1.26 -2.05 119.74 119.99 1aw6 s LYS 25 Ca 0.58 -1.02 -0.02 0.00 0.02 0.00 0.00 55.97 55.53 1aw6 s LYS 25 Cb -0.39 -0.13 0.35 0.00 -0.52 0.00 0.00 37.83 37.13 1aw6 s LYS 25 CO 0.65 -0.01 1.77 -1.00 -0.92 0.00 0.00 175.35 175.84 1aw6 h PRO 26 N 3.75 0.79 -5.72 -1.68 0.13 -1.99 -3.47 132.00 123.80 1aw6 h PRO 26 Ca -0.35 -0.20 -0.66 0.00 -0.87 0.00 0.00 66.00 63.91 1aw6 h PRO 26 Cb 1.18 -0.10 -0.14 0.00 0.13 0.00 0.00 31.00 32.08 1aw6 h PRO 26 CO 0.53 0.79 -0.58 -1.59 -0.23 0.00 0.00 178.00 176.92 1aw6 s LYS 27 N -5.01 3.32 0.46 0.86 -2.85 -1.26 -4.86 119.74 110.41 1aw6 s LYS 27 Ca -0.09 -0.34 -0.07 0.00 -1.00 0.00 0.00 55.97 54.47 1aw6 s LYS 27 Cb 0.15 -2.97 0.11 0.00 -2.06 0.00 0.00 37.83 33.06 1aw6 s LYS 27 CO 0.81 0.61 0.25 0.00 0.10 0.00 0.00 175.35 177.12 1aw6 h ALA 29 N -2.37 0.84 -0.00 0.00 0.00 -1.94 -3.11 119.26 112.69 1aw6 h ALA 29 Ca -0.11 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1aw6 h ALA 29 Cb 0.39 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1aw6 h ALA 29 CO 0.07 0.28 -0.01 -0.22 0.00 0.00 0.00 179.25 179.37 1aw6 h LYS 30 N 0.90 -0.01 -0.87 0.00 1.63 -1.90 -1.85 116.57 114.48 1aw6 h LYS 30 Ca 0.24 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.03 1aw6 h LYS 30 Cb -0.10 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 31.49 1aw6 h LYS 30 CO -0.05 -0.00 0.48 0.00 -3.45 0.00 0.00 179.45 176.43 1aw6 h LEU 32 N 1.21 0.69 -0.89 0.00 7.12 -1.53 0.70 115.31 122.61 1aw6 h LEU 32 Ca 0.31 -0.01 -0.12 0.00 0.13 0.00 0.00 57.88 58.19 1aw6 h LEU 32 Cb 0.01 -0.16 -0.02 0.00 -0.53 0.00 0.00 40.66 39.96 1aw6 h LEU 32 CO -0.05 0.48 -0.54 0.11 -0.13 0.00 0.00 178.44 178.31 1aw6 h LYS 33 N 0.81 0.04 -0.10 1.25 1.79 -0.31 -3.15 116.57 116.90 1aw6 h LYS 33 Ca 0.26 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 1aw6 h LYS 33 Cb 0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 1aw6 h LYS 33 CO -0.07 0.57 0.00 0.09 -1.08 0.00 0.00 179.45 178.96 1aw6 n ASN 34 N -3.90 2.10 -3.08 0.86 3.02 -0.80 -5.04 115.26 108.42 1aw6 n ASN 34 Ca -0.01 -1.79 -0.12 0.00 -0.03 0.00 0.00 54.58 52.63 1aw6 n ASN 34 Cb 0.55 -0.07 0.01 0.00 -0.61 0.00 0.00 39.78 39.67 1aw6 n ASN 34 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1aw6 n ASN 35 N -0.02 -6.96 -4.13 6.41 4.05 0.23 -5.04 115.26 109.81 1aw6 n ASN 35 Ca 0.04 0.54 -0.25 0.00 0.45 0.00 0.00 54.58 55.37 1aw6 n ASN 35 Cb 0.26 -3.35 -0.08 0.00 1.23 0.00 0.00 39.78 37.84 1aw6 n ASN 35 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 1aw6 s TRP 36 N -1.63 1.79 -0.91 1.20 0.51 -0.57 -5.01 118.94 114.32 1aw6 s TRP 36 Ca 0.15 -1.27 -0.00 0.00 -2.12 0.00 0.00 56.10 52.87 1aw6 s TRP 36 Cb -0.03 -1.14 0.31 0.00 -0.81 0.00 0.00 33.47 31.80 1aw6 s TRP 36 CO 0.59 -0.30 1.38 -1.91 -0.51 0.00 0.00 176.95 176.20 1aw6 n GLU 37 N -0.87 4.25 -1.40 4.98 4.07 -1.26 -4.86 120.64 125.56 1aw6 n GLU 37 Ca -0.05 -4.66 -0.29 0.00 -0.06 0.00 0.00 57.16 52.10 1aw6 n GLU 37 Cb 0.65 -2.41 -0.18 0.00 -0.06 0.00 0.00 31.44 29.44 1aw6 n GLU 37 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1aw6 n ARG 39 N 6.53 3.52 -2.56 0.00 0.63 -1.26 -4.77 116.66 118.76 1aw6 n ARG 39 Ca 0.63 -4.61 -0.31 0.00 -0.92 0.00 0.00 57.85 52.63 1aw6 n ARG 39 Cb 0.08 -2.39 -0.00 0.00 0.45 0.00 0.00 32.46 30.60 1aw6 n ARG 39 CO 0.00 0.00 0.00 2.48 -2.51 0.00 0.00 177.63 177.60 1aw6 n TYR 40 N 1.12 3.47 -4.04 -0.14 0.18 -1.26 -2.35 117.16 114.14 1aw6 n TYR 40 Ca 0.28 -3.20 -0.22 0.00 1.88 0.00 0.00 57.90 56.63 1aw6 n TYR 40 Cb 0.37 -0.52 -0.05 0.00 -0.38 0.00 0.00 39.34 38.75 1aw6 n TYR 40 CO 0.00 0.00 0.00 -1.12 -2.08 0.00 0.00 176.86 173.66 1aw6 s SER 41 N -2.86 4.94 0.00 9.48 0.01 -1.26 -4.95 113.70 119.06 1aw6 s SER 41 Ca 0.48 -0.61 0.00 0.00 1.31 0.00 0.00 55.95 57.13 1aw6 s SER 41 Cb 0.34 -0.90 0.00 0.00 0.21 0.00 0.00 66.02 65.67 1aw6 s SER 41 CO -0.20 -0.24 0.00 -0.81 0.41 0.00 0.00 173.24 172.39 1aw6 n PRO 42 N -1.19 0.00 0.00 12.44 -0.04 -1.26 -5.17 135.00 139.79 1aw6 n PRO 42 Ca -0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1aw6 n PRO 42 Cb 0.60 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.06 1aw6 n PRO 42 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82