#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wxn n THR 2 N 0.00 2.57 -2.41 2.61 -2.24 -1.26 -5.07 114.28 108.48 1wxn n THR 2 Ca 0.00 -5.24 -0.41 0.00 -2.27 0.00 0.00 64.05 56.13 1wxn n THR 2 Cb 0.00 -1.21 -0.04 0.00 -2.10 0.00 0.00 70.33 66.99 1wxn n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wxn s ALA 3 N -3.41 3.42 0.06 6.98 0.00 -1.26 -0.95 121.76 126.60 1wxn s ALA 3 Ca 0.47 0.92 0.02 0.00 0.00 0.00 0.00 51.96 53.37 1wxn s ALA 3 Cb 0.33 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 20.02 1wxn s ALA 3 CO -0.14 -0.32 -0.07 0.00 0.00 0.00 0.00 175.76 175.22 1wxn s SER 5 N -1.99 1.67 -0.48 0.00 0.01 -1.26 -0.42 113.70 111.23 1wxn s SER 5 Ca -0.04 -0.27 0.03 0.00 1.31 0.00 0.00 55.95 56.98 1wxn s SER 5 Cb -0.06 -0.54 0.13 0.00 0.21 0.00 0.00 66.02 65.77 1wxn s SER 5 CO -0.01 0.09 0.24 0.00 0.41 0.00 0.00 173.24 173.97 1wxn n GLY 7 N 3.35 0.36 0.12 0.00 0.00 -1.26 -0.99 105.19 106.77 1wxn n GLY 7 Ca 0.06 0.63 -0.17 0.00 0.00 0.00 0.00 46.02 46.55 1wxn n GLY 7 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1wxn n ASN 8 N 6.10 1.62 -4.80 1.61 5.15 -1.26 -4.95 115.26 118.73 1wxn n ASN 8 Ca 0.00 0.23 -0.37 0.00 -0.60 0.00 0.00 54.58 53.84 1wxn n ASN 8 Cb 0.00 -0.48 -0.06 0.00 -0.53 0.00 0.00 39.78 38.70 1wxn n ASN 8 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1wxn s SER 9 N -6.62 7.19 -0.02 1.20 0.01 -0.16 -4.95 113.70 110.34 1wxn s SER 9 Ca -0.17 1.59 0.02 0.00 1.31 0.00 0.00 55.95 58.70 1wxn s SER 9 Cb 0.07 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.82 1wxn s SER 9 CO 0.78 0.01 -0.07 -1.59 0.41 0.00 0.00 173.24 172.78 1wxn s LYS 10 N -1.92 0.80 0.00 12.44 -2.85 -1.19 0.16 119.74 127.19 1wxn s LYS 10 Ca 0.45 -0.24 0.00 0.00 -1.00 0.00 0.00 55.97 55.18 1wxn s LYS 10 Cb -0.18 -0.77 0.00 0.00 -2.06 0.00 0.00 37.83 34.82 1wxn s LYS 10 CO 0.22 0.08 0.00 0.41 0.10 0.00 0.00 175.35 176.17 1wxn n GLY 11 N 3.33 2.67 3.12 0.59 0.00 0.44 -0.50 105.19 114.84 1wxn n GLY 11 Ca -0.18 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.57 1wxn n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wxn s ILE 12 N 0.55 1.29 -0.13 -0.61 -1.09 -0.30 -0.27 121.20 120.64 1wxn s ILE 12 Ca 0.00 -0.66 -0.08 0.00 -2.23 0.00 0.00 60.65 57.68 1wxn s ILE 12 Cb 0.00 -1.10 -0.04 0.00 -1.58 0.00 0.00 42.46 39.74 1wxn s ILE 12 CO 0.00 0.37 0.15 -0.72 -1.23 0.00 0.00 174.94 173.51 1wxn s TYR 13 N -0.11 3.57 -0.00 3.97 1.13 -0.12 -0.84 117.35 124.95 1wxn s TYR 13 Ca 0.00 0.51 0.01 0.00 -1.41 0.00 0.00 57.07 56.19 1wxn s TYR 13 Cb -0.09 -2.00 -0.04 0.00 -1.10 0.00 0.00 41.96 38.74 1wxn s TYR 13 CO 0.01 0.65 0.00 -1.58 -2.51 0.00 0.00 175.55 172.12 1wxn s TRP 14 N -0.76 3.08 -0.17 -3.49 0.52 0.11 -4.85 118.94 113.39 1wxn s TRP 14 Ca 0.14 0.09 -0.29 0.00 0.02 0.00 0.00 56.10 56.06 1wxn s TRP 14 Cb -0.12 -1.68 -0.00 0.00 -1.15 0.00 0.00 33.47 30.52 1wxn s TRP 14 CO 0.03 0.46 1.06 -0.06 0.02 0.00 0.00 176.95 178.46 1wxn s PHE 15 N -1.08 3.35 -1.11 -1.98 0.08 -1.26 -0.10 117.98 115.87 1wxn s PHE 15 Ca 0.19 1.46 -0.05 0.00 0.12 0.00 0.00 56.93 58.66 1wxn s PHE 15 Cb -0.12 -3.27 0.04 0.00 -0.57 0.00 0.00 43.02 39.10 1wxn s PHE 15 CO 0.10 -0.54 0.27 0.66 -0.10 0.00 0.00 175.22 175.61 1wxn n TYR 16 N 5.83 -1.66 -3.74 0.36 4.01 -1.20 -4.91 117.16 115.85 1wxn n TYR 16 Ca 0.11 0.25 -0.38 0.00 -0.16 0.00 0.00 57.90 57.73 1wxn n TYR 16 Cb 0.47 -2.77 -0.12 0.00 -0.31 0.00 0.00 39.34 36.60 1wxn n TYR 16 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1wxn s ARG 17 N -5.55 2.81 0.00 -0.72 1.70 -1.26 -4.95 118.95 110.99 1wxn s ARG 17 Ca 0.21 -1.05 0.03 0.00 -0.47 0.00 0.00 55.73 54.45 1wxn s ARG 17 Cb -0.11 -3.45 0.17 0.00 -0.57 0.00 0.00 34.95 30.99 1wxn s ARG 17 CO 0.26 -0.59 1.02 -0.35 -1.08 0.00 0.00 175.30 174.56 1wxn n PRO 18 N 4.85 0.90 -4.01 3.89 -0.04 -1.26 -4.50 135.00 134.84 1wxn n PRO 18 Ca -0.13 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.02 1wxn n PRO 18 Cb 0.46 -1.05 -0.15 0.00 -0.04 0.00 0.00 33.50 32.72 1wxn n PRO 18 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wxn s SER 19 N -1.19 3.95 -0.08 3.54 0.15 -1.26 -5.11 113.70 113.70 1wxn s SER 19 Ca 0.04 -1.18 -0.24 0.00 0.70 0.00 0.00 55.95 55.27 1wxn s SER 19 Cb 0.02 -1.34 -0.03 0.00 -1.71 0.00 0.00 66.02 62.96 1wxn s SER 19 CO 0.03 -0.19 0.74 0.00 1.20 0.00 0.00 173.24 175.02 1wxn n PRO 21 N 4.04 -2.40 -1.75 0.00 -0.04 -1.26 -5.02 135.00 128.57 1wxn n PRO 21 Ca 0.00 -1.47 -0.02 0.00 -0.04 0.00 0.00 63.50 61.98 1wxn n PRO 21 Cb 0.51 -1.28 0.07 0.00 -0.04 0.00 0.00 33.50 32.75 1wxn n PRO 21 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1wxn n THR 22 N -4.23 1.28 0.11 0.52 -2.24 -1.26 -4.66 114.28 103.80 1wxn n THR 22 Ca 0.13 -2.59 -0.02 0.00 -2.27 0.00 0.00 64.05 59.29 1wxn n THR 22 Cb 0.48 0.42 0.01 0.00 -2.10 0.00 0.00 70.33 69.14 1wxn n THR 22 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1wxn h ASP 23 N 1.64 0.00 -0.36 3.42 5.19 -1.99 -3.18 116.42 121.14 1wxn h ASP 23 Ca -0.05 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1wxn h ASP 23 Cb 1.47 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.98 1wxn h ASP 23 CO 0.22 0.75 0.00 0.54 -3.12 0.00 0.00 179.24 177.63 1wxn n ARG 24 N -3.41 2.78 -3.26 3.56 1.74 -1.26 -4.97 116.66 111.84 1wxn n ARG 24 Ca 0.00 -2.05 -0.15 0.00 -0.77 0.00 0.00 57.85 54.88 1wxn n ARG 24 Cb 0.79 -1.28 0.08 0.00 -1.02 0.00 0.00 32.46 31.02 1wxn n ARG 24 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wxn n GLY 25 N 0.59 -0.72 3.77 -0.13 0.00 -1.20 -4.87 105.19 102.62 1wxn n GLY 25 Ca 0.12 0.32 -0.40 0.00 0.00 0.00 0.00 46.02 46.07 1wxn n GLY 25 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wxn s TYR 26 N -3.36 2.63 -0.27 1.61 2.02 -1.26 -4.69 117.35 114.03 1wxn s TYR 26 Ca 0.23 1.34 -0.10 0.00 -0.37 0.00 0.00 57.07 58.17 1wxn s TYR 26 Cb -0.03 -3.80 -0.13 0.00 -0.40 0.00 0.00 41.96 37.60 1wxn s TYR 26 CO 0.70 -2.52 -0.32 2.41 -1.57 0.00 0.00 175.55 174.25 1wxn n THR 27 N -0.05 1.50 -5.13 -0.71 -1.04 -0.06 -4.86 114.28 103.93 1wxn n THR 27 Ca 0.04 -0.43 -0.29 0.00 -2.04 0.00 0.00 64.05 61.33 1wxn n THR 27 Cb 0.43 -1.76 -0.16 0.00 -1.82 0.00 0.00 70.33 67.02 1wxn n THR 27 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1wxn s GLY 28 N -5.75 1.14 -0.19 3.41 0.00 0.36 -4.98 107.32 101.32 1wxn s GLY 28 Ca -0.38 -0.96 -0.03 0.00 0.00 0.00 0.00 44.72 43.35 1wxn s GLY 28 CO 0.51 -0.70 -0.06 -0.45 0.00 0.00 0.00 173.10 172.40 1wxn s SER 29 N -0.34 4.30 0.21 1.64 0.15 -1.25 -0.80 113.70 117.60 1wxn s SER 29 Ca 0.03 -0.34 0.03 0.00 0.70 0.00 0.00 55.95 56.37 1wxn s SER 29 Cb -0.11 -1.71 -0.05 0.00 -1.71 0.00 0.00 66.02 62.44 1wxn s SER 29 CO 0.01 0.05 0.01 0.00 1.20 0.00 0.00 173.24 174.51 1wxn s ARG 31 N -3.89 3.75 0.34 0.00 6.06 -1.26 0.45 118.95 124.41 1wxn s ARG 31 Ca 0.27 -0.43 0.08 0.00 -2.50 0.00 0.00 55.73 53.16 1wxn s ARG 31 Cb 0.06 -3.47 -0.04 0.00 0.06 0.00 0.00 34.95 31.55 1wxn s ARG 31 CO 0.07 -0.20 0.12 -0.47 -2.50 0.00 0.00 175.30 172.33 1wxn s TYR 32 N 1.67 2.68 0.45 5.12 5.04 0.14 -4.90 117.35 127.55 1wxn s TYR 32 Ca 0.07 -0.40 0.23 0.00 -2.44 0.00 0.00 57.07 54.53 1wxn s TYR 32 Cb -0.16 -1.63 1.24 0.00 0.35 0.00 0.00 41.96 41.76 1wxn s TYR 32 CO 0.07 0.35 1.83 0.74 -1.34 0.00 0.00 175.55 177.19 1wxn h PHE 33 N 1.58 0.40 -0.01 4.97 0.04 -2.01 -0.88 116.94 121.03 1wxn h PHE 33 Ca -0.43 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.35 1wxn h PHE 33 Cb 1.25 -0.12 0.00 0.00 2.20 0.00 0.00 35.95 39.28 1wxn h PHE 33 CO 0.64 0.07 -0.19 1.28 -0.60 0.00 0.00 178.31 179.51 1wxn n LEU 34 N -4.46 1.61 0.00 1.54 7.99 -1.26 -5.08 117.00 117.34 1wxn n LEU 34 Ca 0.22 -0.83 0.00 0.00 -0.01 0.00 0.00 56.01 55.39 1wxn n LEU 34 Cb 0.89 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 44.20 1wxn n LEU 34 CO 0.32 0.31 0.00 0.61 -1.51 0.00 0.00 177.39 177.12 1wxn n GLY 35 N 0.93 -0.66 3.39 -0.72 0.00 -0.33 -3.26 105.19 104.53 1wxn n GLY 35 Ca 0.06 -0.47 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 1wxn n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wxn s THR 36 N -4.00 3.60 -0.44 2.61 2.01 0.85 0.24 115.64 120.51 1wxn s THR 36 Ca 0.00 -0.43 -0.26 0.00 0.31 0.00 0.00 61.69 61.31 1wxn s THR 36 Cb 0.00 -2.61 0.02 0.00 0.01 0.00 0.00 72.50 69.92 1wxn s THR 36 CO 0.00 0.44 0.95 0.00 -0.69 0.00 0.00 174.62 175.32 1wxn s THR 39 N 2.03 2.28 0.00 0.00 -4.23 0.02 -1.14 115.64 114.59 1wxn s THR 39 Ca 0.08 -1.46 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 1wxn s THR 39 Cb -0.24 -2.27 0.00 0.00 1.34 0.00 0.00 72.50 71.33 1wxn s THR 39 CO 0.07 0.07 0.00 -0.81 -0.54 0.00 0.00 174.62 173.41 1wxn n PRO 40 N 4.50 0.00 -1.19 3.99 -0.04 -1.11 -0.48 135.00 140.66 1wxn n PRO 40 Ca -0.15 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.30 1wxn n PRO 40 Cb 0.44 -0.14 0.01 0.00 -0.04 0.00 0.00 33.50 33.76 1wxn n PRO 40 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wxn n ALA 41 N -1.26 -0.92 -0.76 0.55 0.00 0.26 -3.14 120.51 115.25 1wxn n ALA 41 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1wxn n ALA 41 Cb 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1wxn n ALA 41 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03