#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ysi h SER 2 N 0.00 0.45 0.12 1.61 4.64 -2.04 -3.34 113.55 115.00 2ysi h SER 2 Ca 0.00 -0.47 -0.25 0.00 -0.47 0.00 0.00 61.79 60.60 2ysi h SER 2 Cb 0.00 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 2ysi h SER 2 CO 0.00 0.83 -1.26 0.28 -0.87 0.00 0.00 176.83 175.80 2ysi h SER 3 N 0.09 0.40 -1.34 4.97 0.02 -2.14 -3.48 113.55 112.07 2ysi h SER 3 Ca 0.03 -0.87 0.00 0.00 -0.84 0.00 0.00 61.79 60.11 2ysi h SER 3 Cb 0.69 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.10 2ysi h SER 3 CO 0.04 1.56 0.00 0.61 -1.14 0.00 0.00 176.83 177.90 2ysi n GLY 4 N 1.72 1.67 3.53 -3.77 0.00 -1.25 -5.12 105.19 101.96 2ysi n GLY 4 Ca -0.22 -1.96 -0.31 0.00 0.00 0.00 0.00 46.02 43.53 2ysi n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ysi s SER 5 N -1.00 4.19 0.08 1.61 0.01 -1.26 -4.01 113.70 113.33 2ysi s SER 5 Ca 0.00 -0.36 -0.35 0.00 1.31 0.00 0.00 55.95 56.55 2ysi s SER 5 Cb 0.00 -0.79 -0.17 0.00 0.21 0.00 0.00 66.02 65.28 2ysi s SER 5 CO 0.00 0.23 1.54 0.28 0.41 0.00 0.00 173.24 175.70 2ysi h SER 6 N 4.14 -1.34 0.00 2.44 0.02 -2.01 -3.35 113.55 113.45 2ysi h SER 6 Ca -0.48 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2ysi h SER 6 Cb 1.16 0.44 0.00 0.00 0.14 0.00 0.00 62.40 64.14 2ysi h SER 6 CO 0.50 -0.66 0.00 0.61 -1.14 0.00 0.00 176.83 176.14 2ysi n GLY 7 N -1.55 2.05 0.56 -3.77 0.00 -1.26 -4.78 105.19 96.43 2ysi n GLY 7 Ca -0.12 -0.24 0.01 0.00 0.00 0.00 0.00 46.02 45.67 2ysi n GLY 7 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2ysi n THR 8 N 0.00 0.29 -4.02 2.61 -1.04 -1.26 -4.83 114.28 106.02 2ysi n THR 8 Ca 0.00 -0.16 -0.23 0.00 -2.04 0.00 0.00 64.05 61.62 2ysi n THR 8 Cb 0.00 -0.35 -0.06 0.00 -1.82 0.00 0.00 70.33 68.10 2ysi n THR 8 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 2ysi s GLU 9 N -1.37 2.44 1.23 -2.82 -1.05 -1.26 -5.13 118.70 110.74 2ysi s GLU 9 Ca 0.07 -1.52 -0.19 0.00 -0.15 0.00 0.00 54.97 53.18 2ysi s GLU 9 Cb 0.05 -2.23 0.29 0.00 -0.44 0.00 0.00 34.13 31.80 2ysi s GLU 9 CO 0.02 0.08 1.07 -1.21 0.95 0.00 0.00 175.26 176.18 2ysi s GLU 10 N -3.89 -1.40 0.00 -4.83 0.41 -1.26 -4.87 118.70 102.86 2ysi s GLU 10 Ca 0.39 0.04 0.10 0.00 -0.41 0.00 0.00 54.97 55.09 2ysi s GLU 10 Cb -0.03 -1.57 0.62 0.00 -1.78 0.00 0.00 34.13 31.37 2ysi s GLU 10 CO 0.24 -3.85 1.19 -0.89 -0.49 0.00 0.00 175.26 171.46 2ysi n ILE 11 N -4.88 0.00 -1.86 -1.63 5.41 -1.26 -4.81 119.36 110.33 2ysi n ILE 11 Ca 0.12 0.00 -0.30 0.00 1.00 0.00 0.00 62.75 63.57 2ysi n ILE 11 Cb 0.59 -0.35 0.03 0.00 -0.71 0.00 0.00 39.64 39.21 2ysi n ILE 11 CO 0.00 0.00 0.00 0.26 0.00 0.00 0.00 176.55 176.81 2ysi s TRP 12 N -2.00 3.41 0.05 1.39 0.52 -1.26 -3.97 118.94 117.08 2ysi s TRP 12 Ca 0.15 1.14 0.05 0.00 0.02 0.00 0.00 56.10 57.47 2ysi s TRP 12 Cb 0.07 -2.94 -0.04 0.00 -1.15 0.00 0.00 33.47 29.41 2ysi s TRP 12 CO 0.12 -1.02 -0.08 0.08 0.02 0.00 0.00 176.95 176.07 2ysi s VAL 13 N -3.28 3.54 -0.18 4.03 1.01 0.15 -4.87 120.40 120.80 2ysi s VAL 13 Ca 0.57 -0.98 -0.22 0.00 0.00 0.00 0.00 61.98 61.35 2ysi s VAL 13 Cb -0.11 -2.59 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 2ysi s VAL 13 CO 0.53 0.27 0.68 -0.70 0.00 0.00 0.00 175.10 175.87 2ysi s GLU 14 N -1.77 4.25 0.24 2.72 2.12 -1.26 -1.38 118.70 123.62 2ysi s GLU 14 Ca 0.19 0.72 -0.06 0.00 0.36 0.00 0.00 54.97 56.19 2ysi s GLU 14 Cb -0.11 -3.56 -0.02 0.00 0.26 0.00 0.00 34.13 30.70 2ysi s GLU 14 CO 0.11 -0.22 0.32 -0.80 -0.54 0.00 0.00 175.26 174.12 2ysi s ASN 15 N 1.14 0.20 -0.07 -1.70 0.01 -0.68 -5.00 114.94 108.84 2ysi s ASN 15 Ca 0.31 -1.22 -0.01 0.00 -0.71 0.00 0.00 52.86 51.23 2ysi s ASN 15 Cb -0.16 0.51 0.03 0.00 0.41 0.00 0.00 41.25 42.03 2ysi s ASN 15 CO 0.11 -1.03 -0.00 -0.75 -1.51 0.00 0.00 177.10 173.92 2ysi s LYS 16 N -3.95 0.68 0.81 -0.60 2.47 -1.26 0.03 119.74 117.93 2ysi s LYS 16 Ca 0.31 0.08 -0.15 0.00 -1.56 0.00 0.00 55.97 54.65 2ysi s LYS 16 Cb 0.03 -1.02 -0.01 0.00 -1.46 0.00 0.00 37.83 35.37 2ysi s LYS 16 CO 0.12 -0.30 0.52 0.25 0.16 0.00 0.00 175.35 176.11 2ysi n THR 17 N 5.12 1.21 0.98 3.43 -2.24 0.11 -4.80 114.28 118.09 2ysi n THR 17 Ca -0.08 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 2ysi n THR 17 Cb 0.50 -0.73 0.01 0.00 -2.10 0.00 0.00 70.33 68.01 2ysi n THR 17 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2ysi n PRO 18 N -1.19 0.49 -0.04 -0.78 -0.04 -1.26 -2.18 135.00 130.00 2ysi n PRO 18 Ca 0.09 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.51 2ysi n PRO 18 Cb 0.51 -1.01 -0.08 0.00 -0.04 0.00 0.00 33.50 32.89 2ysi n PRO 18 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ysi n ASP 19 N -0.51 2.66 0.00 3.54 8.00 -1.26 -5.03 116.55 123.95 2ysi n ASP 19 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2ysi n ASP 19 Cb 0.00 0.82 0.00 0.00 -0.02 0.00 0.00 41.12 41.92 2ysi n ASP 19 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ysi n GLY 20 N 2.36 0.89 2.75 0.44 0.00 -0.93 -5.14 105.19 105.56 2ysi n GLY 20 Ca -0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 2ysi n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ysi s LYS 21 N 0.00 0.38 0.12 1.61 3.01 -1.26 -4.96 119.74 118.64 2ysi s LYS 21 Ca 0.00 0.18 -0.31 0.00 -1.01 0.00 0.00 55.97 54.83 2ysi s LYS 21 Cb 0.00 -0.78 -0.07 0.00 -1.01 0.00 0.00 37.83 35.97 2ysi s LYS 21 CO 0.00 -0.28 1.24 0.08 0.51 0.00 0.00 175.35 176.90 2ysi s VAL 22 N 1.89 3.70 0.35 3.17 1.01 -1.26 0.09 120.40 129.34 2ysi s VAL 22 Ca 0.03 1.28 0.05 0.00 0.00 0.00 0.00 61.98 63.34 2ysi s VAL 22 Cb -0.12 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 2ysi s VAL 22 CO -0.04 0.13 0.21 -0.72 0.00 0.00 0.00 175.10 174.68 2ysi s TYR 23 N 0.70 1.72 -0.04 5.22 1.13 0.11 -4.83 117.35 121.36 2ysi s TYR 23 Ca 0.58 -1.49 0.05 0.00 -1.41 0.00 0.00 57.07 54.80 2ysi s TYR 23 Cb -0.32 -0.88 -0.01 0.00 -1.10 0.00 0.00 41.96 39.65 2ysi s TYR 23 CO 0.32 -0.62 -0.19 0.71 -2.51 0.00 0.00 175.55 173.26 2ysi s TYR 24 N -3.41 1.79 -0.14 -3.49 2.02 0.06 -1.68 117.35 112.50 2ysi s TYR 24 Ca 0.34 -0.47 0.01 0.00 -0.37 0.00 0.00 57.07 56.58 2ysi s TYR 24 Cb 0.03 -1.19 -0.00 0.00 -0.40 0.00 0.00 41.96 40.40 2ysi s TYR 24 CO 0.21 -0.13 -0.17 -0.47 -1.57 0.00 0.00 175.55 173.42 2ysi s TYR 25 N -0.13 2.74 -0.01 2.71 6.14 -0.48 -0.47 117.35 127.86 2ysi s TYR 25 Ca -0.00 -0.99 -0.26 0.00 0.64 0.00 0.00 57.07 56.45 2ysi s TYR 25 Cb -0.11 -1.85 -0.04 0.00 0.42 0.00 0.00 41.96 40.39 2ysi s TYR 25 CO 0.01 -0.43 0.81 1.21 0.64 0.00 0.00 175.55 177.80 2ysi s ASN 26 N 0.65 7.19 0.13 4.32 3.04 -0.88 0.34 114.94 129.73 2ysi s ASN 26 Ca -0.09 1.43 0.26 0.00 0.04 0.00 0.00 52.86 54.50 2ysi s ASN 26 Cb -0.16 -2.48 0.66 0.00 -1.54 0.00 0.00 41.25 37.73 2ysi s ASN 26 CO 0.02 -0.11 1.59 0.00 -3.04 0.00 0.00 177.10 175.56 2ysi n ALA 27 N 3.47 2.65 -0.02 1.71 0.00 -1.25 -0.19 120.51 126.87 2ysi n ALA 27 Ca 0.01 -0.15 -0.22 0.00 0.00 0.00 0.00 53.44 53.08 2ysi n ALA 27 Cb 0.51 -1.32 -0.13 0.00 0.00 0.00 0.00 19.45 18.50 2ysi n ALA 27 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2ysi n ARG 28 N -2.05 0.72 -0.01 0.00 0.00 -1.26 -4.41 116.66 109.66 2ysi n ARG 28 Ca 0.05 0.33 0.05 0.00 -0.00 0.00 0.00 57.85 58.28 2ysi n ARG 28 Cb 0.41 -1.72 -0.13 0.00 0.00 0.00 0.00 32.46 31.03 2ysi n ARG 28 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2ysi n THR 29 N -3.69 0.59 -3.23 5.15 -2.24 -1.25 -5.00 114.28 104.60 2ysi n THR 29 Ca -0.32 -0.62 -0.16 0.00 -2.27 0.00 0.00 64.05 60.68 2ysi n THR 29 Cb 0.97 -0.27 0.06 0.00 -2.10 0.00 0.00 70.33 68.99 2ysi n THR 29 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2ysi n ARG 30 N -2.53 -5.45 -4.69 -0.78 1.74 0.73 -5.02 116.66 100.66 2ysi n ARG 30 Ca -0.11 0.58 -0.30 0.00 -0.77 0.00 0.00 57.85 57.25 2ysi n ARG 30 Cb 0.74 -4.86 -0.09 0.00 -1.02 0.00 0.00 32.46 27.22 2ysi n ARG 30 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2ysi s GLU 31 N -5.77 2.07 -0.13 5.56 0.41 -1.22 -4.93 118.70 114.69 2ysi s GLU 31 Ca 0.35 -2.25 0.02 0.00 -0.41 0.00 0.00 54.97 52.68 2ysi s GLU 31 Cb -0.15 -1.59 0.00 0.00 -1.78 0.00 0.00 34.13 30.61 2ysi s GLU 31 CO 0.51 -0.20 -0.21 -1.54 -0.49 0.00 0.00 175.26 173.33 2ysi s SER 32 N -3.79 3.25 -0.09 -0.19 1.04 -1.26 -2.07 113.70 110.59 2ysi s SER 32 Ca 0.21 -0.55 -0.04 0.00 0.48 0.00 0.00 55.95 56.05 2ysi s SER 32 Cb 0.06 -1.47 0.05 0.00 0.10 0.00 0.00 66.02 64.76 2ysi s SER 32 CO 0.11 0.11 0.20 0.00 0.98 0.00 0.00 173.24 174.63 2ysi s ALA 33 N 0.67 -0.35 0.12 5.32 0.00 0.39 -4.99 121.76 122.91 2ysi s ALA 33 Ca -0.10 0.76 -0.24 0.00 0.00 0.00 0.00 51.96 52.38 2ysi s ALA 33 Cb -0.16 -0.73 -0.06 0.00 0.00 0.00 0.00 23.12 22.17 2ysi s ALA 33 CO 0.02 -0.41 1.41 -1.49 0.00 0.00 0.00 175.76 175.29 2ysi h TRP 34 N 7.84 -1.42 -2.83 0.00 -0.00 -1.88 0.20 115.95 117.85 2ysi h TRP 34 Ca -0.26 0.09 -0.60 0.00 -0.00 0.00 0.00 58.89 58.12 2ysi h TRP 34 Cb 1.13 0.71 -0.10 0.00 -0.00 0.00 0.00 29.16 30.89 2ysi h TRP 34 CO 0.40 -0.30 -0.64 -0.08 -0.00 0.00 0.00 178.44 177.82 2ysi s THR 35 N -4.91 3.83 0.29 1.49 -1.32 -1.26 -3.07 115.64 110.68 2ysi s THR 35 Ca -0.09 -1.38 -0.29 0.00 -1.21 0.00 0.00 61.69 58.71 2ysi s THR 35 Cb 0.08 -2.93 -0.10 0.00 -1.51 0.00 0.00 72.50 68.04 2ysi s THR 35 CO 0.47 -0.12 1.10 -0.54 -2.21 0.00 0.00 174.62 173.32 2ysi s LYS 36 N -2.98 4.60 0.92 7.08 1.02 -1.26 -4.91 119.74 124.20 2ysi s LYS 36 Ca 0.28 1.79 -0.15 0.00 0.02 0.00 0.00 55.97 57.91 2ysi s LYS 36 Cb -0.09 -3.14 0.23 0.00 -0.52 0.00 0.00 37.83 34.30 2ysi s LYS 36 CO 0.19 0.18 0.81 -0.35 -0.92 0.00 0.00 175.35 175.27 2ysi n PRO 37 N 1.09 -2.60 -4.99 -1.68 -0.04 -1.26 -5.06 135.00 120.45 2ysi n PRO 37 Ca -0.01 -1.30 -0.30 0.00 -0.04 0.00 0.00 63.50 61.85 2ysi n PRO 37 Cb 0.45 -1.22 -0.17 0.00 -0.04 0.00 0.00 33.50 32.52 2ysi n PRO 37 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2ysi s ASP 38 N -3.70 2.76 0.00 3.54 1.01 -1.26 -4.81 116.67 114.20 2ysi s ASP 38 Ca 0.53 -0.50 0.00 0.00 0.71 0.00 0.00 52.55 53.29 2ysi s ASP 38 Cb -0.05 -1.26 0.00 0.00 1.01 0.00 0.00 42.92 42.62 2ysi s ASP 38 CO 0.41 0.12 0.00 0.61 0.21 0.00 0.00 175.17 176.51 2ysi n GLY 39 N 3.66 0.65 0.84 0.21 0.00 -1.26 -5.34 105.19 103.96 2ysi n GLY 39 Ca -0.20 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.93 2ysi n GLY 39 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70