#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 1.34 -3.44 -1.24 0.00 -1.26 -5.10 120.64 110.94 1qky n GLU 2 Ca 0.00 -2.27 -0.10 0.00 0.00 0.00 0.00 57.16 54.79 1qky n GLU 2 Cb 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 31.44 30.97 1qky n GLU 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1qky n ALA 3 N -0.76 -0.77 -2.72 4.31 0.00 -1.26 -5.17 120.51 114.14 1qky n ALA 3 Ca -0.03 -1.22 -0.17 0.00 0.00 0.00 0.00 53.44 52.02 1qky n ALA 3 Cb 0.84 0.98 -0.14 0.00 0.00 0.00 0.00 19.45 21.13 1qky n ALA 3 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1qky s ILE 4 N -2.55 0.69 -0.06 0.00 1.09 -1.26 -5.14 121.20 113.97 1qky s ILE 4 Ca 0.19 -0.59 -0.10 0.00 -1.10 0.00 0.00 60.65 59.05 1qky s ILE 4 Cb -0.02 -0.62 0.02 0.00 -1.06 0.00 0.00 42.46 40.78 1qky s ILE 4 CO 0.14 0.04 0.24 -0.60 -0.10 0.00 0.00 174.94 174.66 1qky s ARG 5 N -0.62 0.41 -0.02 2.79 6.06 -1.26 -4.32 118.95 121.99 1qky s ARG 5 Ca 0.00 0.09 0.01 0.00 -2.50 0.00 0.00 55.73 53.33 1qky s ARG 5 Cb -0.05 0.19 -0.04 0.00 0.06 0.00 0.00 34.95 35.11 1qky s ARG 5 CO 0.00 -0.08 0.00 0.00 -2.50 0.00 0.00 175.30 172.72 1qky n THR 7 N 1.55 0.50 -4.26 0.00 5.66 -1.26 -4.93 114.28 111.54 1qky n THR 7 Ca -0.15 -0.49 -0.15 0.00 -3.05 0.00 0.00 64.05 60.21 1qky n THR 7 Cb 0.53 -0.23 -0.05 0.00 -1.55 0.00 0.00 70.33 69.03 1qky n THR 7 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1qky n GLY 8 N 1.22 3.43 0.09 1.09 0.00 -1.26 -5.05 105.19 104.70 1qky n GLY 8 Ca 0.00 -1.94 -0.11 0.00 0.00 0.00 0.00 46.02 43.97 1qky n GLY 8 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1qky n THR 9 N -0.52 1.46 0.30 2.61 -1.04 -1.26 -4.24 114.28 111.60 1qky n THR 9 Ca 0.00 0.11 0.16 0.00 -2.04 0.00 0.00 64.05 62.28 1qky n THR 9 Cb 0.40 -2.26 0.75 0.00 -1.82 0.00 0.00 70.33 67.40 1qky n THR 9 CO 0.00 0.00 0.00 0.07 -0.64 0.00 0.00 175.07 174.50 1qky h LYS 10 N -1.00 0.00 -0.95 -2.82 5.09 -1.99 -3.28 116.57 111.62 1qky h LYS 10 Ca -0.14 0.00 0.12 0.00 0.09 0.00 0.00 60.65 60.72 1qky h LYS 10 Cb 0.85 0.00 -0.13 0.00 0.10 0.00 0.00 32.23 33.04 1qky h LYS 10 CO -0.08 0.00 -0.47 -3.47 -2.09 0.00 0.00 179.45 173.34 1qky n ASP 11 N -2.69 -0.82 0.00 7.07 2.03 -1.26 -1.01 116.55 119.86 1qky n ASP 11 Ca -0.00 1.68 0.03 0.00 0.52 0.00 0.00 54.79 57.02 1qky n ASP 11 Cb 0.17 -0.30 0.18 0.00 -0.72 0.00 0.00 41.12 40.45 1qky n ASP 11 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1qky h TYR 13 N 0.00 0.07 0.06 0.00 -1.99 -1.33 -0.53 116.97 113.25 1qky h TYR 13 Ca 0.00 -0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.72 1qky h TYR 13 Cb 0.00 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 38.71 1qky h TYR 13 CO 0.00 0.16 -0.03 0.82 -0.00 0.00 0.00 178.16 179.11 1qky h ILE 14 N 0.07 0.00 -0.76 -2.88 1.08 -1.81 -3.07 117.51 110.14 1qky h ILE 14 Ca 0.02 -0.02 0.01 0.00 -0.39 0.00 0.00 64.86 64.47 1qky h ILE 14 Cb 0.20 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 33.91 1qky h ILE 14 CO 0.01 0.00 0.50 1.55 -0.69 0.00 0.00 178.15 179.53 1qky h PRO 15 N -0.10 1.00 -0.28 2.37 0.13 -1.83 0.15 132.00 133.45 1qky h PRO 15 Ca -0.01 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1qky h PRO 15 Cb 0.06 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 30.95 1qky h PRO 15 CO 0.01 0.66 0.14 0.00 -0.23 0.00 0.00 178.00 178.58 1qky h ARG 17 N 0.32 0.61 -0.34 0.00 1.12 -1.39 -0.51 114.38 114.19 1qky h ARG 17 Ca 0.10 -0.19 -0.09 0.00 -1.11 0.00 0.00 59.98 58.68 1qky h ARG 17 Cb 0.10 -0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 29.99 1qky h ARG 17 CO -0.01 0.73 -0.16 -0.92 -3.11 0.00 0.00 179.97 176.49 1qky h TYR 18 N 0.55 0.66 0.00 2.20 3.20 0.16 -1.35 116.97 122.40 1qky h TYR 18 Ca 0.10 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1qky h TYR 18 Cb 0.56 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 1qky h TYR 18 CO 0.02 0.73 -0.22 0.82 -1.64 0.00 0.00 178.16 177.88 1qky h ILE 19 N 0.55 0.19 -0.04 1.81 5.03 -0.39 -3.38 117.51 121.28 1qky h ILE 19 Ca 0.09 -1.16 0.00 0.00 -0.12 0.00 0.00 64.86 63.67 1qky h ILE 19 Cb 0.59 0.38 0.00 0.00 -3.03 0.00 0.00 36.82 34.76 1qky h ILE 19 CO 0.04 0.06 0.00 1.07 -0.68 0.00 0.00 178.15 178.64 1qky n THR 20 N -4.70 0.03 0.00 -0.27 5.66 -0.21 -4.96 114.28 109.83 1qky n THR 20 Ca -0.05 -0.25 0.00 0.00 -3.05 0.00 0.00 64.05 60.71 1qky n THR 20 Cb 0.15 0.42 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 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 1.16 1.67 3.85 1.09 0.00 -0.51 -4.65 105.19 107.80 1qky n GLY 21 Ca 0.19 -0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.77 2.89 -0.43 0.00 5.36 -1.26 -4.13 117.98 117.64 1qky s PHE 23 Ca 0.58 -1.19 0.05 0.00 -0.96 0.00 0.00 56.93 55.41 1qky s PHE 23 Cb -0.11 -4.45 0.17 0.00 -0.34 0.00 0.00 43.02 38.29 1qky s PHE 23 CO 0.38 -1.67 0.51 1.21 -1.46 0.00 0.00 175.22 174.19 1qky s ASN 24 N 4.16 0.01 -0.18 6.13 2.47 -1.26 -5.06 114.94 121.20 1qky s ASN 24 Ca 0.38 -1.76 -0.05 0.00 0.42 0.00 0.00 52.86 51.86 1qky s ASN 24 Cb -0.03 1.00 -0.03 0.00 -1.45 0.00 0.00 41.25 40.74 1qky s ASN 24 CO -0.09 -0.17 -0.01 -0.44 -3.72 0.00 0.00 177.10 172.67 1qky s SER 25 N 1.09 4.88 -0.14 -4.21 0.01 -1.26 -0.35 113.70 113.72 1qky s SER 25 Ca 0.23 -0.15 -0.01 0.00 1.31 0.00 0.00 55.95 57.33 1qky s SER 25 Cb -0.06 -1.82 0.04 0.00 0.21 0.00 0.00 66.02 64.39 1qky s SER 25 CO -0.07 0.11 -0.02 -0.60 0.41 0.00 0.00 173.24 173.07 1qky s ARG 26 N 0.70 1.05 -0.11 12.44 3.52 0.58 -4.99 118.95 132.13 1qky s ARG 26 Ca -0.01 -0.29 -0.30 0.00 -0.13 0.00 0.00 55.73 55.00 1qky s ARG 26 Cb -0.14 -1.70 -0.02 0.00 -1.56 0.00 0.00 34.95 31.53 1qky s ARG 26 CO 0.02 -0.42 1.08 0.00 -0.81 0.00 0.00 175.30 175.17 1qky s ILE 28 N 2.29 -0.03 -1.20 0.00 1.10 0.59 -4.78 121.20 119.17 1qky s ILE 28 Ca 0.50 0.12 -0.05 0.00 -0.51 0.00 0.00 60.65 60.71 1qky s ILE 28 Cb -0.20 -0.09 0.04 0.00 0.15 0.00 0.00 42.46 42.36 1qky s ILE 28 CO 0.17 0.05 0.32 -3.20 -2.11 0.00 0.00 174.94 170.17 1qky n ASN 29 N 3.70 -3.97 0.00 4.50 5.15 -1.26 -0.30 115.26 123.08 1qky n ASN 29 Ca -0.21 -0.16 0.00 0.00 -0.60 0.00 0.00 54.58 53.62 1qky n ASN 29 Cb 0.55 -3.30 0.00 0.00 -0.53 0.00 0.00 39.78 36.49 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 -3.41 -0.76 -3.84 1.20 4.81 -1.26 -4.97 118.16 109.94 1qky n LYS 30 Ca -0.07 0.18 -0.25 0.00 -0.87 0.00 0.00 58.31 57.30 1qky n LYS 30 Cb 0.57 -4.57 -0.03 0.00 0.02 0.00 0.00 35.03 31.02 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 -1.93 6.34 -0.42 3.14 0.15 0.59 -0.32 113.70 121.26 1qky s SER 31 Ca 0.00 0.22 -0.21 0.00 0.70 0.00 0.00 55.95 56.67 1qky s SER 31 Cb 0.00 -1.93 0.02 0.00 -1.71 0.00 0.00 66.02 62.40 1qky s SER 31 CO 0.00 -0.04 0.66 0.00 1.20 0.00 0.00 173.24 175.06 1qky s LYS 33 N 2.84 3.38 -0.59 0.00 -0.14 0.64 -4.96 119.74 120.91 1qky s LYS 33 Ca 0.24 -0.64 -0.16 0.00 -1.36 0.00 0.00 55.97 54.04 1qky s LYS 33 Cb -0.14 -3.86 0.13 0.00 -1.68 0.00 0.00 37.83 32.29 1qky s LYS 33 CO 0.18 -0.57 0.59 0.00 -0.76 0.00 0.00 175.35 174.79 1qky s TYR 35 N 1.69 2.14 1.02 0.00 1.51 0.52 -4.94 117.35 119.29 1qky s TYR 35 Ca 0.07 0.54 -0.11 0.00 -1.01 0.00 0.00 57.07 56.55 1qky s TYR 35 Cb -0.26 -4.32 0.19 0.00 -0.11 0.00 0.00 41.96 37.47 1qky s TYR 35 CO 0.02 -2.14 1.05 0.41 -1.11 0.00 0.00 175.55 173.78 1qky n GLY 36 N 5.34 -1.07 3.17 0.71 0.00 -1.26 -4.55 105.19 107.53 1qky n GLY 36 Ca 0.15 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 1qky n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32