#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 0.06 0.00 -1.24 4.71 -1.26 -4.94 120.64 117.97 1qky n GLU 2 Ca 0.00 0.26 0.00 0.00 -0.01 0.00 0.00 57.16 57.41 1qky n GLU 2 Cb 0.00 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 28.93 1qky n GLU 2 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1qky n ALA 3 N -1.41 0.00 -3.65 0.62 0.00 -1.26 -4.88 120.51 109.93 1qky n ALA 3 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.38 1qky n ALA 3 Cb 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.54 1qky n ALA 3 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1qky s ILE 4 N 0.00 0.00 -0.08 0.00 2.07 -1.26 -5.06 121.20 116.87 1qky s ILE 4 Ca 0.00 -0.51 0.01 0.00 -1.41 0.00 0.00 60.65 58.73 1qky s ILE 4 Cb 0.00 -1.52 0.02 0.00 0.13 0.00 0.00 42.46 41.09 1qky s ILE 4 CO 0.00 0.00 -0.07 -0.60 -1.91 0.00 0.00 174.94 172.36 1qky s ARG 5 N -3.81 1.27 -0.06 3.50 3.00 -1.26 -4.37 118.95 117.22 1qky s ARG 5 Ca 0.06 -0.21 0.02 0.00 -1.00 0.00 0.00 55.73 54.60 1qky s ARG 5 Cb -0.03 -1.27 0.02 0.00 0.00 0.00 0.00 34.95 33.67 1qky s ARG 5 CO -0.03 -0.15 -0.09 0.00 0.00 0.00 0.00 175.30 175.03 1qky n THR 7 N 4.02 1.46 -3.23 0.00 -1.04 -1.26 -4.57 114.28 109.66 1qky n THR 7 Ca -0.22 0.13 -0.36 0.00 -2.04 0.00 0.00 64.05 61.56 1qky n THR 7 Cb 0.51 -2.29 -0.06 0.00 -1.82 0.00 0.00 70.33 66.67 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 -4.51 2.54 0.44 3.41 0.00 -1.26 -5.00 107.32 102.94 1qky s GLY 8 Ca -0.21 0.01 0.11 0.00 0.00 0.00 0.00 44.72 44.64 1qky s GLY 8 CO 0.34 0.34 2.03 -0.84 0.00 0.00 0.00 173.10 174.97 1qky h THR 9 N 2.83 1.10 -0.33 0.90 2.02 -1.98 -1.24 112.91 116.21 1qky h THR 9 Ca -0.48 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.34 1qky h THR 9 Cb 1.19 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1qky h THR 9 CO 0.65 0.12 0.00 2.29 0.37 0.00 0.00 175.52 178.96 1qky n LYS 10 N -4.42 1.92 0.02 6.66 2.85 -1.26 -4.51 118.16 119.42 1qky n LYS 10 Ca -0.00 -1.41 -0.10 0.00 -1.05 0.00 0.00 58.31 55.74 1qky n LYS 10 Cb 0.15 -1.36 -0.04 0.00 -0.65 0.00 0.00 35.03 33.13 1qky n LYS 10 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 1qky h ASP 11 N 2.50 -0.71 -0.06 -5.58 3.32 -1.62 -1.63 116.42 112.64 1qky h ASP 11 Ca 0.00 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1qky h ASP 11 Cb 0.56 0.31 0.00 0.00 0.22 0.00 0.00 39.33 40.42 1qky h ASP 11 CO 0.00 -0.29 0.00 0.00 -1.72 0.00 0.00 179.24 177.23 1qky h TYR 13 N 1.61 0.00 0.00 0.00 -1.99 -1.55 0.14 116.97 115.17 1qky h TYR 13 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1qky h TYR 13 Cb 0.35 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.08 1qky h TYR 13 CO 0.03 0.00 0.00 -0.89 -0.00 0.00 0.00 178.16 177.30 1qky n ILE 14 N -2.96 0.00 -0.20 -2.88 2.08 -1.26 -3.40 119.36 110.73 1qky n ILE 14 Ca -0.03 0.60 -0.09 0.00 0.56 0.00 0.00 62.75 63.80 1qky n ILE 14 Cb 0.11 -1.23 0.02 0.00 -0.75 0.00 0.00 39.64 37.80 1qky n ILE 14 CO 0.00 0.00 0.00 1.55 0.56 0.00 0.00 176.55 178.66 1qky h PRO 15 N 0.00 0.96 -0.43 0.38 0.13 -1.82 0.15 132.00 131.38 1qky h PRO 15 Ca 0.00 -0.26 0.07 0.00 -0.87 0.00 0.00 66.00 64.95 1qky h PRO 15 Cb 0.00 -0.11 -0.06 0.00 0.13 0.00 0.00 31.00 30.95 1qky h PRO 15 CO 0.00 0.91 0.04 0.00 -0.23 0.00 0.00 178.00 178.72 1qky h ARG 17 N 0.16 0.46 -0.94 0.00 1.12 -1.53 -1.56 114.38 112.08 1qky h ARG 17 Ca 0.21 -0.22 0.15 0.00 -1.11 0.00 0.00 59.98 59.01 1qky h ARG 17 Cb 0.29 -0.00 -0.08 0.00 -0.01 0.00 0.00 29.97 30.17 1qky h ARG 17 CO -0.32 0.78 0.60 -0.92 -3.11 0.00 0.00 179.97 177.00 1qky h TYR 18 N 0.14 0.93 0.10 2.20 5.03 0.73 0.14 116.97 126.24 1qky h TYR 18 Ca 0.04 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.37 1qky h TYR 18 Cb 0.67 -0.29 0.00 0.00 1.55 0.00 0.00 36.73 38.66 1qky h TYR 18 CO 0.07 0.33 -0.05 0.82 -1.32 0.00 0.00 178.16 178.01 1qky h ILE 19 N 0.77 0.38 0.00 1.81 5.03 -0.65 -3.37 117.51 121.48 1qky h ILE 19 Ca 0.48 -1.13 0.00 0.00 -0.12 0.00 0.00 64.86 64.09 1qky h ILE 19 Cb 0.71 0.69 0.00 0.00 -3.03 0.00 0.00 36.82 35.19 1qky h ILE 19 CO -0.25 0.12 0.00 1.07 -0.68 0.00 0.00 178.15 178.41 1qky n THR 20 N -4.85 0.14 0.00 -0.27 5.66 -0.59 -4.93 114.28 109.45 1qky n THR 20 Ca -0.04 0.04 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1qky n THR 20 Cb 0.15 -0.70 0.00 0.00 -1.55 0.00 0.00 70.33 68.23 1qky n THR 20 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1qky n GLY 21 N 0.37 2.08 3.76 1.09 0.00 0.47 -3.98 105.19 108.98 1qky n GLY 21 Ca 0.14 0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.97 0.00 -2.83 0.00 -1.74 -1.26 -4.22 117.46 106.44 1qky n PHE 23 Ca 0.10 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.56 1qky n PHE 23 Cb 0.48 -0.02 -0.03 0.00 1.52 0.00 0.00 39.48 41.43 1qky n PHE 23 CO 0.00 0.00 0.00 1.21 -0.56 0.00 0.00 176.76 177.41 1qky s ASN 24 N -1.04 6.32 0.04 5.98 2.47 -1.26 -4.99 114.94 122.46 1qky s ASN 24 Ca 0.00 -1.27 -0.05 0.00 0.42 0.00 0.00 52.86 51.96 1qky s ASN 24 Cb 0.00 -2.43 -0.01 0.00 -1.45 0.00 0.00 41.25 37.35 1qky s ASN 24 CO 0.00 -1.37 0.08 -0.44 -3.72 0.00 0.00 177.10 171.65 1qky s SER 25 N 3.77 0.22 -0.02 -4.21 0.01 -1.26 -0.29 113.70 111.92 1qky s SER 25 Ca 0.27 -0.60 -0.22 0.00 1.31 0.00 0.00 55.95 56.71 1qky s SER 25 Cb -0.12 0.23 0.05 0.00 0.21 0.00 0.00 66.02 66.38 1qky s SER 25 CO 0.04 -0.53 0.48 -0.60 0.41 0.00 0.00 173.24 173.04 1qky s ARG 26 N -2.83 0.88 -0.21 12.44 3.52 0.51 -4.95 118.95 128.30 1qky s ARG 26 Ca -0.03 -0.04 -0.11 0.00 -0.13 0.00 0.00 55.73 55.42 1qky s ARG 26 Cb 0.00 0.40 -0.05 0.00 -1.56 0.00 0.00 34.95 33.74 1qky s ARG 26 CO -0.06 -0.27 0.16 0.00 -0.81 0.00 0.00 175.30 174.32 1qky s ILE 28 N 0.66 0.04 -1.21 0.00 1.10 0.55 -4.91 121.20 117.43 1qky s ILE 28 Ca 0.08 -0.34 -0.30 0.00 -0.51 0.00 0.00 60.65 59.59 1qky s ILE 28 Cb -0.12 -0.17 0.04 0.00 0.15 0.00 0.00 42.46 42.36 1qky s ILE 28 CO 0.01 -0.19 0.56 0.59 -2.11 0.00 0.00 174.94 173.81 1qky n ASN 29 N 2.45 -3.26 0.00 4.50 3.02 -1.26 -0.35 115.26 120.36 1qky n ASN 29 Ca -0.17 -1.26 0.00 0.00 -0.03 0.00 0.00 54.58 53.12 1qky n ASN 29 Cb 0.58 -1.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.23 1qky n ASN 29 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1qky n LYS 30 N -4.88 -1.04 -4.43 3.52 0.00 -1.26 -4.93 118.16 105.14 1qky n LYS 30 Ca -0.13 0.24 -0.26 0.00 0.00 0.00 0.00 58.31 58.15 1qky n LYS 30 Cb 0.56 -4.48 -0.13 0.00 0.00 0.00 0.00 35.03 30.97 1qky n LYS 30 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1qky s SER 31 N -1.81 2.78 0.04 3.14 0.01 0.52 -0.33 113.70 118.05 1qky s SER 31 Ca 0.00 -0.67 -0.19 0.00 1.31 0.00 0.00 55.95 56.40 1qky s SER 31 Cb 0.00 -0.18 -0.06 0.00 0.21 0.00 0.00 66.02 65.99 1qky s SER 31 CO 0.00 0.12 0.56 0.00 0.41 0.00 0.00 173.24 174.34 1qky s LYS 33 N -0.79 2.62 -0.63 0.00 -0.14 0.90 -4.91 119.74 116.79 1qky s LYS 33 Ca 0.29 -1.14 -0.16 0.00 -1.36 0.00 0.00 55.97 53.60 1qky s LYS 33 Cb -0.19 -3.18 0.15 0.00 -1.68 0.00 0.00 37.83 32.93 1qky s LYS 33 CO 0.18 -0.55 0.62 0.00 -0.76 0.00 0.00 175.35 174.84 1qky h TYR 35 N 8.69 0.12 0.00 0.00 -1.99 -1.00 -3.48 116.97 119.31 1qky h TYR 35 Ca -0.19 -0.06 0.00 0.00 2.00 0.00 0.00 58.73 60.47 1qky h TYR 35 Cb 1.08 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.80 1qky h TYR 35 CO 0.83 0.86 0.00 0.41 -0.00 0.00 0.00 178.16 180.26 1qky n GLY 36 N 1.05 2.00 0.00 3.88 0.00 -0.34 -4.55 105.19 107.23 1qky n GLY 36 Ca -0.10 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1qky n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32