#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 2.39 -3.47 -0.67 4.71 -1.26 -4.77 120.64 117.57 1qky n GLU 2 Ca 0.00 -2.13 -0.10 0.00 -0.01 0.00 0.00 57.16 54.91 1qky n GLU 2 Cb 0.00 -2.99 -0.02 0.00 -1.01 0.00 0.00 31.44 27.42 1qky n GLU 2 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1qky s ALA 3 N 3.72 -1.70 -0.80 0.62 0.00 -1.26 -5.10 121.76 117.24 1qky s ALA 3 Ca 0.53 0.73 -0.26 0.00 0.00 0.00 0.00 51.96 52.95 1qky s ALA 3 Cb 0.14 0.66 0.03 0.00 0.00 0.00 0.00 23.12 23.96 1qky s ALA 3 CO -0.01 -0.74 1.32 0.42 0.00 0.00 0.00 175.76 176.76 1qky s ILE 4 N -3.45 3.76 -0.07 0.00 1.09 -1.26 -4.97 121.20 116.31 1qky s ILE 4 Ca 0.03 0.15 -0.01 0.00 -1.10 0.00 0.00 60.65 59.72 1qky s ILE 4 Cb -0.01 -4.95 0.03 0.00 -1.06 0.00 0.00 42.46 36.47 1qky s ILE 4 CO -0.11 -1.87 0.00 -0.60 -0.10 0.00 0.00 174.94 172.26 1qky s ARG 5 N 5.58 0.58 0.24 2.79 3.52 -1.26 -3.36 118.95 127.04 1qky s ARG 5 Ca 0.38 0.11 -0.30 0.00 -0.13 0.00 0.00 55.73 55.79 1qky s ARG 5 Cb -0.06 -0.93 -0.09 0.00 -1.56 0.00 0.00 34.95 32.31 1qky s ARG 5 CO 0.09 -0.29 0.94 0.00 -0.81 0.00 0.00 175.30 175.24 1qky h THR 7 N 3.14 0.04 -1.80 0.00 2.02 -1.90 -3.46 112.91 110.95 1qky h THR 7 Ca -0.45 -1.06 0.35 0.00 0.77 0.00 0.00 66.41 66.02 1qky h THR 7 Cb 1.20 1.79 -0.09 0.00 -1.74 0.00 0.00 68.15 69.31 1qky h THR 7 CO 0.68 0.02 0.90 -0.83 0.37 0.00 0.00 175.52 176.66 1qky s GLY 8 N -4.30 -0.26 0.44 2.16 0.00 -1.26 -5.01 107.32 99.09 1qky s GLY 8 Ca 0.03 0.34 0.16 0.00 0.00 0.00 0.00 44.72 45.25 1qky s GLY 8 CO 0.73 3.47 1.96 -0.84 0.00 0.00 0.00 173.10 178.41 1qky h THR 9 N 2.00 1.06 -0.04 0.90 2.02 -1.98 -0.63 112.91 116.24 1qky h THR 9 Ca -0.26 -0.81 -0.08 0.00 0.77 0.00 0.00 66.41 66.04 1qky h THR 9 Cb 1.19 1.45 -0.01 0.00 -1.74 0.00 0.00 68.15 69.04 1qky h THR 9 CO 0.30 0.22 -0.33 0.11 0.37 0.00 0.00 175.52 176.19 1qky h LYS 10 N 0.00 0.07 0.00 6.66 1.57 -1.98 -2.28 116.57 120.61 1qky h LYS 10 Ca -0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1qky h LYS 10 Cb 0.43 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1qky h LYS 10 CO 0.03 0.40 0.00 0.22 -0.57 0.00 0.00 179.45 179.53 1qky h ASP 11 N 0.06 0.00 0.04 0.86 3.58 -1.50 -0.72 116.42 118.74 1qky h ASP 11 Ca 0.01 0.00 -0.29 0.00 0.42 0.00 0.00 57.03 57.16 1qky h ASP 11 Cb 0.63 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.64 1qky h ASP 11 CO 0.05 0.00 -1.62 0.00 -2.88 0.00 0.00 179.24 174.79 1qky h TYR 13 N -0.66 0.00 0.13 0.00 0.05 -0.64 0.72 116.97 116.57 1qky h TYR 13 Ca -0.41 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.37 1qky h TYR 13 Cb 1.56 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.30 1qky h TYR 13 CO 0.07 0.13 -0.06 0.82 -1.05 0.00 0.00 178.16 178.07 1qky h ILE 14 N 0.00 0.00 -0.78 -2.88 5.03 -1.44 -2.74 117.51 114.70 1qky h ILE 14 Ca -0.00 -0.06 -0.03 0.00 -0.12 0.00 0.00 64.86 64.64 1qky h ILE 14 Cb 0.27 0.00 -0.04 0.00 -3.03 0.00 0.00 36.82 34.03 1qky h ILE 14 CO 0.02 0.00 0.35 1.55 -0.68 0.00 0.00 178.15 179.39 1qky h PRO 15 N -0.24 1.14 -0.40 2.37 0.13 -1.73 0.18 132.00 133.45 1qky h PRO 15 Ca -0.02 -0.18 0.04 0.00 -0.87 0.00 0.00 66.00 64.97 1qky h PRO 15 Cb 0.14 -0.20 -0.04 0.00 0.13 0.00 0.00 31.00 31.03 1qky h PRO 15 CO 0.03 0.90 0.18 0.00 -0.23 0.00 0.00 178.00 178.88 1qky h ARG 17 N 0.37 0.85 0.00 0.00 1.12 -1.09 0.17 114.38 115.79 1qky h ARG 17 Ca 0.18 -0.18 -0.06 0.00 -1.11 0.00 0.00 59.98 58.81 1qky h ARG 17 Cb 0.11 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 29.94 1qky h ARG 17 CO -0.14 0.77 -0.27 -0.92 -3.11 0.00 0.00 179.97 176.29 1qky h TYR 18 N 0.82 0.00 0.00 2.20 3.20 0.71 -1.37 116.97 122.53 1qky h TYR 18 Ca 0.18 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.05 1qky h TYR 18 Cb 0.30 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.57 1qky h TYR 18 CO 0.02 0.27 0.00 -0.89 -1.64 0.00 0.00 178.16 175.92 1qky n ILE 19 N -3.72 0.00 0.33 1.81 -0.00 0.70 -4.66 119.36 113.81 1qky n ILE 19 Ca -0.01 0.23 0.21 0.00 -0.00 0.00 0.00 62.75 63.17 1qky n ILE 19 Cb 0.38 -0.98 1.12 0.00 -0.00 0.00 0.00 39.64 40.16 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 0.15 0.00 1.39 2.02 -0.83 -3.46 112.91 112.18 1qky h THR 20 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1qky h THR 20 Cb 0.00 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1qky h THR 20 CO 0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 1qky n GLY 21 N -1.09 1.34 3.75 2.16 0.00 -0.52 -4.74 105.19 106.09 1qky n GLY 21 Ca -0.03 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 1qky n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qky s PHE 23 N -0.61 3.18 -0.25 0.00 5.36 -1.26 -4.41 117.98 120.00 1qky s PHE 23 Ca 0.49 -1.42 -0.02 0.00 -0.96 0.00 0.00 56.93 55.01 1qky s PHE 23 Cb -0.33 -4.21 0.14 0.00 -0.34 0.00 0.00 43.02 38.28 1qky s PHE 23 CO 0.40 -1.42 0.40 1.21 -1.46 0.00 0.00 175.22 174.35 1qky s ASN 24 N 3.43 0.10 0.16 6.13 2.47 -1.26 -4.99 114.94 120.98 1qky s ASN 24 Ca 0.29 0.26 -0.12 0.00 0.42 0.00 0.00 52.86 53.71 1qky s ASN 24 Cb -0.07 1.21 0.01 0.00 -1.45 0.00 0.00 41.25 40.95 1qky s ASN 24 CO -0.08 -0.30 0.36 -0.44 -3.72 0.00 0.00 177.10 172.92 1qky s SER 25 N 2.57 -0.08 -0.24 -4.21 0.01 -1.26 -0.39 113.70 110.10 1qky s SER 25 Ca 0.13 -0.64 -0.19 0.00 1.31 0.00 0.00 55.95 56.56 1qky s SER 25 Cb -0.15 0.47 0.07 0.00 0.21 0.00 0.00 66.02 66.61 1qky s SER 25 CO -0.17 -0.91 0.63 -0.60 0.41 0.00 0.00 173.24 172.60 1qky s ARG 26 N -3.90 0.70 -0.07 12.44 3.00 0.63 -4.94 118.95 126.79 1qky s ARG 26 Ca 0.11 0.98 -0.22 0.00 -1.00 0.00 0.00 55.73 55.59 1qky s ARG 26 Cb 0.02 0.26 -0.04 0.00 0.00 0.00 0.00 34.95 35.19 1qky s ARG 26 CO -0.04 -0.11 0.65 0.00 0.00 0.00 0.00 175.30 175.80 1qky s ILE 28 N 0.74 0.17 -1.27 0.00 1.10 0.58 -4.76 121.20 117.76 1qky s ILE 28 Ca 0.35 0.03 -0.01 0.00 -0.51 0.00 0.00 60.65 60.51 1qky s ILE 28 Cb -0.17 -0.23 0.01 0.00 0.15 0.00 0.00 42.46 42.22 1qky s ILE 28 CO 0.17 0.11 0.11 -3.20 -2.11 0.00 0.00 174.94 170.01 1qky n ASN 29 N 3.79 -4.48 0.00 4.50 5.15 -1.26 -0.22 115.26 122.74 1qky n ASN 29 Ca -0.23 0.05 0.00 0.00 -0.60 0.00 0.00 54.58 53.80 1qky n ASN 29 Cb 0.53 -3.76 0.00 0.00 -0.53 0.00 0.00 39.78 36.02 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 -3.05 -1.80 -3.83 1.20 4.81 -1.26 -4.98 118.16 109.24 1qky n LYS 30 Ca -0.15 0.44 -0.32 0.00 -0.87 0.00 0.00 58.31 57.41 1qky n LYS 30 Cb 0.62 -4.91 -0.04 0.00 0.02 0.00 0.00 35.03 30.71 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 -1.97 6.42 0.06 3.14 0.15 0.69 -0.17 113.70 122.02 1qky s SER 31 Ca 0.00 0.41 -0.23 0.00 0.70 0.00 0.00 55.95 56.83 1qky s SER 31 Cb 0.00 -2.02 -0.06 0.00 -1.71 0.00 0.00 66.02 62.23 1qky s SER 31 CO 0.00 0.17 0.68 0.00 1.20 0.00 0.00 173.24 175.29 1qky s LYS 33 N -0.57 2.53 0.06 0.00 -0.14 0.59 -4.95 119.74 117.26 1qky s LYS 33 Ca 0.34 -0.77 -0.03 0.00 -1.36 0.00 0.00 55.97 54.15 1qky s LYS 33 Cb -0.20 -2.01 -0.05 0.00 -1.68 0.00 0.00 37.83 33.89 1qky s LYS 33 CO 0.21 0.21 0.26 0.00 -0.76 0.00 0.00 175.35 175.26 1qky n TYR 35 N 0.48 0.03 -0.49 0.00 4.11 0.48 -4.94 117.16 116.83 1qky n TYR 35 Ca -0.06 -2.18 0.00 0.00 -0.00 0.00 0.00 57.90 55.65 1qky n TYR 35 Cb 0.52 0.36 0.00 0.00 -0.00 0.00 0.00 39.34 40.21 1qky n TYR 35 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1qky n GLY 36 N -0.67 1.82 0.36 -7.48 0.00 -1.22 -4.83 105.19 93.16 1qky n GLY 36 Ca 0.01 -1.79 0.09 0.00 0.00 0.00 0.00 46.02 44.33 1qky n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32