#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qky n GLU 2 N 0.00 0.00 -4.01 -1.24 0.28 -1.26 -5.20 120.64 109.22 1qky n GLU 2 Ca 0.00 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 56.89 1qky n GLU 2 Cb 0.00 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 32.83 1qky n GLU 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1qky s ALA 3 N -1.89 0.12 -1.29 -1.84 0.00 -1.26 -5.06 121.76 110.53 1qky s ALA 3 Ca 0.00 -1.14 -0.18 0.00 0.00 0.00 0.00 51.96 50.64 1qky s ALA 3 Cb 0.00 1.04 0.05 0.00 0.00 0.00 0.00 23.12 24.22 1qky s ALA 3 CO 0.00 -0.85 1.76 -0.89 0.00 0.00 0.00 175.76 175.79 1qky n ILE 4 N -0.48 3.74 -3.02 0.00 5.41 -1.26 -4.93 119.36 118.82 1qky n ILE 4 Ca -0.02 -3.89 -0.19 0.00 1.00 0.00 0.00 62.75 59.66 1qky n ILE 4 Cb 0.61 -2.33 0.01 0.00 -0.71 0.00 0.00 39.64 37.22 1qky n ILE 4 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1qky s ARG 5 N 4.44 2.84 0.34 0.38 0.52 -1.26 -0.68 118.95 125.54 1qky s ARG 5 Ca 0.55 -1.06 0.05 0.00 -0.52 0.00 0.00 55.73 54.75 1qky s ARG 5 Cb 0.04 -2.70 -0.03 0.00 0.52 0.00 0.00 34.95 32.77 1qky s ARG 5 CO 0.08 -0.30 0.21 0.00 0.02 0.00 0.00 175.30 175.31 1qky n THR 7 N -0.69 0.77 -4.43 0.00 -1.04 -1.26 -4.88 114.28 102.75 1qky n THR 7 Ca 0.02 0.26 -0.21 0.00 -2.04 0.00 0.00 64.05 62.08 1qky n THR 7 Cb 0.64 -1.61 -0.10 0.00 -1.82 0.00 0.00 70.33 67.44 1qky n THR 7 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1qky s GLY 8 N -3.79 1.87 0.18 3.41 0.00 -1.26 -5.04 107.32 102.69 1qky s GLY 8 Ca -0.07 -1.93 -0.12 0.00 0.00 0.00 0.00 44.72 42.59 1qky s GLY 8 CO 0.10 -1.82 1.80 -0.84 0.00 0.00 0.00 173.10 172.34 1qky h THR 9 N 2.25 1.19 0.00 0.90 2.02 -1.98 -1.32 112.91 115.97 1qky h THR 9 Ca -0.40 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 66.31 1qky h THR 9 Cb 1.23 0.40 -0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1qky h THR 9 CO 0.68 0.20 -0.06 0.07 0.37 0.00 0.00 175.52 176.78 1qky h LYS 10 N 0.82 0.00 0.12 6.66 5.09 -1.97 -1.78 116.57 125.50 1qky h LYS 10 Ca 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.95 1qky h LYS 10 Cb 0.02 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.35 1qky h LYS 10 CO -0.04 0.06 -0.06 0.22 -2.09 0.00 0.00 179.45 177.54 1qky h ASP 11 N 0.00 -0.14 0.07 7.07 1.82 -1.68 -3.16 116.42 120.40 1qky h ASP 11 Ca -0.00 -0.26 -0.00 0.00 -0.39 0.00 0.00 57.03 56.38 1qky h ASP 11 Cb 0.45 0.04 -0.00 0.00 0.68 0.00 0.00 39.33 40.50 1qky h ASP 11 CO 0.01 0.19 -0.00 0.00 -1.61 0.00 0.00 179.24 177.82 1qky h TYR 13 N 0.00 1.02 0.33 0.00 -1.99 -1.31 -3.26 116.97 111.76 1qky h TYR 13 Ca -0.00 -0.12 -0.01 0.00 2.00 0.00 0.00 58.73 60.60 1qky h TYR 13 Cb 0.04 -0.29 -0.02 0.00 2.00 0.00 0.00 36.73 38.46 1qky h TYR 13 CO 0.00 0.86 -0.42 0.82 -0.00 0.00 0.00 178.16 179.42 1qky h ILE 14 N 0.89 0.00 -0.25 -2.88 2.04 -1.24 -0.33 117.51 115.74 1qky h ILE 14 Ca 0.19 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.03 1qky h ILE 14 Cb 0.34 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 1qky h ILE 14 CO 0.00 0.00 0.07 1.55 0.00 0.00 0.00 178.15 179.77 1qky h PRO 15 N -0.77 0.39 -0.22 2.37 0.13 -1.70 0.17 132.00 132.37 1qky h PRO 15 Ca -0.04 -0.09 0.02 0.00 -0.87 0.00 0.00 66.00 65.03 1qky h PRO 15 Cb 0.69 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 31.74 1qky h PRO 15 CO -0.10 0.47 0.06 0.00 -0.23 0.00 0.00 178.00 178.20 1qky h ARG 17 N 0.15 0.62 -0.79 0.00 2.43 -0.93 0.82 114.38 116.67 1qky h ARG 17 Ca 0.10 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1qky h ARG 17 Cb 0.08 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.45 1qky h ARG 17 CO -0.11 0.44 0.52 -0.92 -1.51 0.00 0.00 179.97 178.38 1qky h TYR 18 N 0.62 1.01 0.00 2.20 5.03 0.58 0.11 116.97 126.51 1qky h TYR 18 Ca 0.17 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.50 1qky h TYR 18 Cb -0.03 -0.34 0.00 0.00 1.55 0.00 0.00 36.73 37.91 1qky h TYR 18 CO -0.04 0.64 0.00 -0.89 -1.32 0.00 0.00 178.16 176.55 1qky n ILE 19 N -4.41 0.00 0.21 1.81 5.41 0.60 -4.48 119.36 118.50 1qky n ILE 19 Ca 0.09 0.37 0.07 0.00 1.00 0.00 0.00 62.75 64.28 1qky n ILE 19 Cb 0.03 -0.85 0.46 0.00 -0.71 0.00 0.00 39.64 38.58 1qky n ILE 19 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1qky h THR 20 N 0.00 0.84 0.00 1.39 2.02 -0.94 -3.47 112.91 112.75 1qky h THR 20 Ca 0.00 -1.16 0.00 0.00 0.77 0.00 0.00 66.41 66.02 1qky h THR 20 Cb 0.00 1.70 0.00 0.00 -1.74 0.00 0.00 68.15 68.11 1qky h THR 20 CO 0.00 0.28 0.00 0.61 0.37 0.00 0.00 175.52 176.78 1qky n GLY 21 N -0.16 2.20 3.73 2.16 0.00 0.38 -4.97 105.19 108.52 1qky n GLY 21 Ca -0.01 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 1qky n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qky n PHE 23 N 3.13 0.05 -1.99 0.00 1.16 -1.26 -3.85 117.46 114.70 1qky n PHE 23 Ca 0.08 -0.02 -0.26 0.00 -1.87 0.00 0.00 57.45 55.38 1qky n PHE 23 Cb 0.43 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.23 1qky n PHE 23 CO 0.00 0.00 0.00 1.21 -1.87 0.00 0.00 176.76 176.10 1qky s ASN 24 N -1.92 4.81 0.32 5.98 3.84 -1.26 -4.72 114.94 121.99 1qky s ASN 24 Ca 0.36 -1.30 0.09 0.00 0.21 0.00 0.00 52.86 52.22 1qky s ASN 24 Cb 0.20 -2.58 -0.06 0.00 -0.55 0.00 0.00 41.25 38.26 1qky s ASN 24 CO 0.32 -3.25 -0.10 -0.55 -2.79 0.00 0.00 177.10 170.73 1qky s SER 25 N 7.25 3.44 -0.28 -4.21 0.15 -1.26 -0.36 113.70 118.42 1qky s SER 25 Ca 0.71 -1.17 -0.21 0.00 0.70 0.00 0.00 55.95 55.98 1qky s SER 25 Cb -0.03 -0.29 0.08 0.00 -1.71 0.00 0.00 66.02 64.07 1qky s SER 25 CO 0.11 -0.21 0.72 -0.60 1.20 0.00 0.00 173.24 174.46 1qky s ARG 26 N -3.63 0.76 -0.03 5.44 3.52 0.93 -4.90 118.95 121.05 1qky s ARG 26 Ca 0.31 1.08 -0.23 0.00 -0.13 0.00 0.00 55.73 56.76 1qky s ARG 26 Cb 0.02 0.28 -0.04 0.00 -1.56 0.00 0.00 34.95 33.64 1qky s ARG 26 CO 0.15 -0.12 0.69 0.00 -0.81 0.00 0.00 175.30 175.21 1qky s ILE 28 N 0.42 -0.09 -1.25 0.00 1.10 0.63 -4.88 121.20 117.12 1qky s ILE 28 Ca 0.36 0.27 -0.03 0.00 -0.51 0.00 0.00 60.65 60.74 1qky s ILE 28 Cb -0.18 -0.17 0.00 0.00 0.15 0.00 0.00 42.46 42.26 1qky s ILE 28 CO 0.19 0.11 0.06 -3.20 -2.11 0.00 0.00 174.94 169.99 1qky n ASN 29 N 4.55 0.35 0.00 4.50 5.15 -1.26 -0.34 115.26 128.20 1qky n ASN 29 Ca -0.20 -1.06 0.00 0.00 -0.60 0.00 0.00 54.58 52.72 1qky n ASN 29 Cb 0.50 -1.31 0.00 0.00 -0.53 0.00 0.00 39.78 38.44 1qky n ASN 29 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1qky n LYS 30 N -4.01 0.00 -3.82 1.20 4.81 -1.26 -4.99 118.16 110.08 1qky n LYS 30 Ca -0.25 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 56.86 1qky n LYS 30 Cb 0.57 -3.24 -0.05 0.00 0.02 0.00 0.00 35.03 32.32 1qky n LYS 30 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1qky s SER 31 N -2.67 6.43 0.36 3.14 0.15 0.53 -0.35 113.70 121.30 1qky s SER 31 Ca 0.00 0.45 -0.23 0.00 0.70 0.00 0.00 55.95 56.86 1qky s SER 31 Cb 0.00 -2.04 -0.10 0.00 -1.71 0.00 0.00 66.02 62.17 1qky s SER 31 CO 0.00 0.21 0.93 0.00 1.20 0.00 0.00 173.24 175.58 1qky s LYS 33 N -2.55 0.21 0.23 0.00 -0.14 0.62 -4.89 119.74 113.22 1qky s LYS 33 Ca 0.55 -0.29 0.05 0.00 -1.36 0.00 0.00 55.97 54.91 1qky s LYS 33 Cb -0.14 0.08 -0.05 0.00 -1.68 0.00 0.00 37.83 36.04 1qky s LYS 33 CO 0.19 -0.04 -0.04 0.00 -0.76 0.00 0.00 175.35 174.70 1qky n TYR 35 N -0.43 0.93 0.00 0.00 4.01 0.51 -4.98 117.16 117.19 1qky n TYR 35 Ca -0.06 -0.47 0.00 0.00 -0.16 0.00 0.00 57.90 57.22 1qky n TYR 35 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.66 1qky n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1qky n GLY 36 N 1.65 2.06 2.48 2.72 0.00 -1.26 -3.84 105.19 109.00 1qky n GLY 36 Ca 0.24 0.23 -0.29 0.00 0.00 0.00 0.00 46.02 46.20 1qky n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32