#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 0.64 0.52 1.61 0.02 -2.05 -2.24 113.55 112.05 2ysi h SER 2 Ca 0.00 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2ysi h SER 2 Cb 0.00 -0.15 0.01 0.00 0.14 0.00 0.00 62.40 62.40 2ysi h SER 2 CO 0.00 0.46 -0.25 -1.28 -1.14 0.00 0.00 176.83 174.62 2ysi h SER 3 N 0.77 -0.59 -1.05 3.07 0.87 -2.14 -3.44 113.55 111.05 2ysi h SER 3 Ca 0.23 0.02 -0.14 0.00 -1.23 0.00 0.00 61.79 60.68 2ysi h SER 3 Cb -0.03 0.15 -0.18 0.00 -0.44 0.00 0.00 62.40 61.91 2ysi h SER 3 CO -0.08 -0.37 -0.49 -0.83 -0.53 0.00 0.00 176.83 174.53 2ysi s GLY 4 N -1.85 -1.19 -0.07 5.77 0.00 -1.21 -5.03 107.32 103.74 2ysi s GLY 4 Ca -0.10 -0.28 -0.12 0.00 0.00 0.00 0.00 44.72 44.22 2ysi s GLY 4 CO 0.31 3.61 0.45 0.23 0.00 0.00 0.00 173.10 177.70 2ysi h SER 5 N 5.66 -0.19 -3.77 1.64 0.87 -1.70 -3.47 113.55 112.59 2ysi h SER 5 Ca 0.06 -0.15 -0.50 0.00 -1.23 0.00 0.00 61.79 59.97 2ysi h SER 5 Cb 1.13 0.05 0.21 0.00 -0.44 0.00 0.00 62.40 63.34 2ysi h SER 5 CO 0.05 0.34 -0.02 -1.54 -0.53 0.00 0.00 176.83 175.13 2ysi n SER 6 N -4.91 -0.68 0.00 6.23 3.41 -1.26 -4.94 113.62 111.47 2ysi n SER 6 Ca -0.05 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 2ysi n SER 6 Cb 0.17 -1.36 0.00 0.00 -0.26 0.00 0.00 64.21 62.76 2ysi n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ysi n GLY 7 N 0.73 0.00 3.49 5.00 0.00 -1.26 -5.17 105.19 107.98 2ysi n GLY 7 Ca 0.08 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 2ysi n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ysi s THR 8 N 0.00 1.98 0.45 2.61 -4.23 -1.26 -5.14 115.64 110.05 2ysi s THR 8 Ca 0.00 -2.17 -0.10 0.00 -1.18 0.00 0.00 61.69 58.24 2ysi s THR 8 Cb 0.00 -2.55 -0.06 0.00 1.34 0.00 0.00 72.50 71.23 2ysi s THR 8 CO 0.00 -0.25 0.81 -1.83 -0.54 0.00 0.00 174.62 172.82 2ysi s GLU 9 N -3.66 3.73 0.55 3.99 -1.05 -1.26 -5.10 118.70 115.90 2ysi s GLU 9 Ca 0.31 0.47 0.07 0.00 -0.15 0.00 0.00 54.97 55.67 2ysi s GLU 9 Cb 0.03 -2.34 0.05 0.00 -0.44 0.00 0.00 34.13 31.43 2ysi s GLU 9 CO 0.14 -0.14 0.50 -1.21 0.95 0.00 0.00 175.26 175.51 2ysi s GLU 10 N -4.17 2.28 0.00 -4.83 0.41 -1.26 -5.01 118.70 106.11 2ysi s GLU 10 Ca 0.51 -1.91 0.29 0.00 -0.41 0.00 0.00 54.97 53.45 2ysi s GLU 10 Cb -0.10 -2.25 1.30 0.00 -1.78 0.00 0.00 34.13 31.30 2ysi s GLU 10 CO 0.36 -0.67 1.88 -0.89 -0.49 0.00 0.00 175.26 175.46 2ysi n ILE 11 N -1.88 0.01 -1.74 -1.63 2.08 -1.26 -4.90 119.36 110.04 2ysi n ILE 11 Ca 0.03 -0.17 -0.32 0.00 0.56 0.00 0.00 62.75 62.85 2ysi n ILE 11 Cb 0.63 0.18 0.04 0.00 -0.75 0.00 0.00 39.64 39.74 2ysi n ILE 11 CO 0.00 0.00 0.00 0.26 0.56 0.00 0.00 176.55 177.37 2ysi s TRP 12 N -1.99 2.97 0.08 1.39 0.52 -1.26 -4.27 118.94 116.38 2ysi s TRP 12 Ca 0.41 1.48 0.04 0.00 0.02 0.00 0.00 56.10 58.05 2ysi s TRP 12 Cb 0.21 -2.97 -0.04 0.00 -1.15 0.00 0.00 33.47 29.52 2ysi s TRP 12 CO 0.34 -1.28 0.04 0.08 0.02 0.00 0.00 176.95 176.15 2ysi s VAL 13 N -2.74 4.26 -0.22 4.03 1.01 0.12 -4.86 120.40 122.00 2ysi s VAL 13 Ca 0.61 -0.86 -0.20 0.00 0.00 0.00 0.00 61.98 61.53 2ysi s VAL 13 Cb -0.16 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 2ysi s VAL 13 CO 0.47 0.14 0.60 -0.70 0.00 0.00 0.00 175.10 175.61 2ysi s GLU 14 N -2.30 4.16 0.22 2.72 2.12 -1.26 -1.54 118.70 122.82 2ysi s GLU 14 Ca 0.27 0.53 -0.01 0.00 0.36 0.00 0.00 54.97 56.12 2ysi s GLU 14 Cb -0.12 -3.61 -0.04 0.00 0.26 0.00 0.00 34.13 30.63 2ysi s GLU 14 CO 0.19 -0.30 0.18 -0.80 -0.54 0.00 0.00 175.26 174.00 2ysi s ASN 15 N 1.32 0.29 -0.09 -1.70 0.01 -0.58 -5.01 114.94 109.18 2ysi s ASN 15 Ca 0.26 -1.38 -0.01 0.00 -0.71 0.00 0.00 52.86 51.02 2ysi s ASN 15 Cb -0.16 0.42 0.03 0.00 0.41 0.00 0.00 41.25 41.95 2ysi s ASN 15 CO 0.09 -0.90 -0.02 -0.75 -1.51 0.00 0.00 177.10 174.02 2ysi s LYS 16 N -4.06 0.85 0.79 -0.60 2.47 -1.26 -0.13 119.74 117.80 2ysi s LYS 16 Ca 0.37 -0.01 -0.15 0.00 -1.56 0.00 0.00 55.97 54.62 2ysi s LYS 16 Cb 0.06 -1.19 -0.01 0.00 -1.46 0.00 0.00 37.83 35.22 2ysi s LYS 16 CO 0.13 -0.31 0.53 0.25 0.16 0.00 0.00 175.35 176.11 2ysi n THR 17 N 5.09 1.36 0.98 3.43 -2.24 0.13 -4.80 114.28 118.22 2ysi n THR 17 Ca -0.09 -0.34 0.02 0.00 -2.27 0.00 0.00 64.05 61.38 2ysi n THR 17 Cb 0.50 -0.73 0.10 0.00 -2.10 0.00 0.00 70.33 68.10 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 -1.09 0.49 -0.02 -0.78 -0.04 -1.26 -2.02 135.00 130.27 2ysi n PRO 18 Ca 0.09 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.57 2ysi n PRO 18 Cb 0.51 -1.11 -0.07 0.00 -0.04 0.00 0.00 33.50 32.79 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 -0.61 2.96 0.00 3.54 8.00 -1.26 -5.02 116.55 124.16 2ysi n ASP 19 Ca 0.03 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.53 2ysi n ASP 19 Cb 0.01 1.17 0.00 0.00 -0.02 0.00 0.00 41.12 42.28 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 2.16 0.95 2.69 0.44 0.00 -0.86 -5.14 105.19 105.43 2ysi n GLY 20 Ca -0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.76 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 0.10 -0.03 0.02 1.61 3.01 -1.25 -4.95 119.74 118.26 2ysi s LYS 21 Ca 0.00 0.33 -0.30 0.00 -1.01 0.00 0.00 55.97 54.99 2ysi s LYS 21 Cb 0.00 -0.70 -0.06 0.00 -1.01 0.00 0.00 37.83 36.06 2ysi s LYS 21 CO 0.00 -0.39 1.33 0.08 0.51 0.00 0.00 175.35 176.88 2ysi s VAL 22 N 2.19 3.79 0.38 3.17 1.01 -1.26 0.22 120.40 129.89 2ysi s VAL 22 Ca 0.04 1.21 0.04 0.00 0.00 0.00 0.00 61.98 63.28 2ysi s VAL 22 Cb -0.13 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 2ysi s VAL 22 CO -0.05 0.04 0.17 -0.72 0.00 0.00 0.00 175.10 174.54 2ysi s TYR 23 N 1.86 1.75 -0.02 5.22 1.13 0.82 -4.83 117.35 123.29 2ysi s TYR 23 Ca 0.62 -1.38 0.06 0.00 -1.41 0.00 0.00 57.07 54.95 2ysi s TYR 23 Cb -0.31 -1.02 -0.01 0.00 -1.10 0.00 0.00 41.96 39.52 2ysi s TYR 23 CO 0.27 -0.46 -0.21 0.71 -2.51 0.00 0.00 175.55 173.35 2ysi s TYR 24 N -3.31 1.90 -0.12 -3.49 2.02 -0.52 -1.53 117.35 112.29 2ysi s TYR 24 Ca 0.29 -0.38 0.03 0.00 -0.37 0.00 0.00 57.07 56.64 2ysi s TYR 24 Cb 0.03 -1.23 0.01 0.00 -0.40 0.00 0.00 41.96 40.37 2ysi s TYR 24 CO 0.18 -0.05 -0.22 -0.47 -1.57 0.00 0.00 175.55 173.42 2ysi s TYR 25 N -0.44 2.54 -0.04 2.71 6.14 -0.59 -0.59 117.35 127.08 2ysi s TYR 25 Ca 0.07 -1.19 -0.22 0.00 0.64 0.00 0.00 57.07 56.36 2ysi s TYR 25 Cb -0.09 -1.72 -0.04 0.00 0.42 0.00 0.00 41.96 40.53 2ysi s TYR 25 CO -0.00 -0.53 0.66 1.21 0.64 0.00 0.00 175.55 177.53 2ysi s ASN 26 N 0.68 6.99 0.22 4.32 3.04 -0.76 0.11 114.94 129.55 2ysi s ASN 26 Ca -0.11 1.18 0.25 0.00 0.04 0.00 0.00 52.86 54.22 2ysi s ASN 26 Cb -0.16 -2.40 0.53 0.00 -1.54 0.00 0.00 41.25 37.69 2ysi s ASN 26 CO 0.02 -0.03 1.56 0.00 -3.04 0.00 0.00 177.10 175.61 2ysi h ALA 27 N 6.30 0.84 0.11 1.71 0.00 -1.91 0.33 119.26 126.63 2ysi h ALA 27 Ca -0.43 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.18 2ysi h ALA 27 Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2ysi h ALA 27 CO 0.73 0.00 -1.58 -0.09 0.00 0.00 0.00 179.25 178.31 2ysi h ARG 28 N 0.00 0.23 0.00 0.00 1.12 -1.92 -3.38 114.38 110.42 2ysi h ARG 28 Ca 0.00 -0.39 -0.09 0.00 -1.11 0.00 0.00 59.98 58.40 2ysi h ARG 28 Cb 0.80 0.14 -0.02 0.00 -0.01 0.00 0.00 29.97 30.89 2ysi h ARG 28 CO 0.00 1.19 -1.80 0.25 -3.11 0.00 0.00 179.97 176.49 2ysi n THR 29 N -3.85 0.51 -3.03 0.20 -2.24 -1.25 -4.99 114.28 99.63 2ysi n THR 29 Ca -0.28 -0.60 -0.17 0.00 -2.27 0.00 0.00 64.05 60.74 2ysi n THR 29 Cb 0.92 -0.24 0.04 0.00 -2.10 0.00 0.00 70.33 68.95 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 -2.51 -4.58 -4.31 -0.78 1.74 0.12 -5.02 116.66 101.32 2ysi n ARG 30 Ca -0.09 0.63 -0.27 0.00 -0.77 0.00 0.00 57.85 57.35 2ysi n ARG 30 Cb 0.70 -4.97 -0.07 0.00 -1.02 0.00 0.00 32.46 27.09 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 -5.64 2.17 -0.12 5.56 0.41 -1.22 -4.90 118.70 114.96 2ysi s GLU 31 Ca 0.31 -2.01 0.03 0.00 -0.41 0.00 0.00 54.97 52.89 2ysi s GLU 31 Cb -0.14 -1.85 0.01 0.00 -1.78 0.00 0.00 34.13 30.37 2ysi s GLU 31 CO 0.39 -0.20 -0.20 -1.54 -0.49 0.00 0.00 175.26 173.22 2ysi s SER 32 N -3.90 2.82 -0.07 -0.19 1.04 -1.26 -1.82 113.70 110.31 2ysi s SER 32 Ca 0.33 -0.52 -0.03 0.00 0.48 0.00 0.00 55.95 56.21 2ysi s SER 32 Cb 0.04 -1.29 0.04 0.00 0.10 0.00 0.00 66.02 64.91 2ysi s SER 32 CO 0.18 0.08 0.15 0.00 0.98 0.00 0.00 173.24 174.63 2ysi s ALA 33 N 0.74 -0.16 0.34 5.32 0.00 0.25 -4.98 121.76 123.27 2ysi s ALA 33 Ca -0.10 0.56 0.11 0.00 0.00 0.00 0.00 51.96 52.53 2ysi s ALA 33 Cb -0.16 -0.68 1.05 0.00 0.00 0.00 0.00 23.12 23.33 2ysi s ALA 33 CO 0.01 -0.43 1.57 -1.49 0.00 0.00 0.00 175.76 175.43 2ysi h TRP 34 N 8.01 0.38 -3.34 0.00 -0.00 -1.88 -1.39 115.95 117.73 2ysi h TRP 34 Ca -0.23 0.06 -0.44 0.00 -0.00 0.00 0.00 58.89 58.28 2ysi h TRP 34 Cb 1.12 0.00 -0.17 0.00 -0.00 0.00 0.00 29.16 30.12 2ysi h TRP 34 CO 0.43 -0.46 -0.75 -0.08 -0.00 0.00 0.00 178.44 177.58 2ysi s THR 35 N -5.77 1.51 0.61 1.49 -1.32 -1.26 -3.94 115.64 106.96 2ysi s THR 35 Ca -0.11 -1.91 -0.17 0.00 -1.21 0.00 0.00 61.69 58.29 2ysi s THR 35 Cb 0.32 -1.75 -0.03 0.00 -1.51 0.00 0.00 72.50 69.53 2ysi s THR 35 CO 0.78 -0.47 1.13 -0.54 -2.21 0.00 0.00 174.62 173.31 2ysi s LYS 36 N -3.04 3.01 0.97 7.08 3.01 -1.26 -4.91 119.74 124.61 2ysi s LYS 36 Ca 0.14 1.52 -0.16 0.00 -1.01 0.00 0.00 55.97 56.46 2ysi s LYS 36 Cb -0.03 -1.97 0.24 0.00 -1.01 0.00 0.00 37.83 35.06 2ysi s LYS 36 CO 0.04 -1.10 0.87 -0.35 0.51 0.00 0.00 175.35 175.32 2ysi n PRO 37 N -1.91 -2.70 -4.39 -1.68 -0.04 -1.26 -5.08 135.00 117.94 2ysi n PRO 37 Ca 0.11 -1.39 -0.28 0.00 -0.04 0.00 0.00 63.50 61.90 2ysi n PRO 37 Cb 0.51 -1.30 -0.13 0.00 -0.04 0.00 0.00 33.50 32.55 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 -3.85 3.29 0.00 3.54 1.01 -1.26 -4.74 116.67 114.67 2ysi s ASP 38 Ca 0.56 -0.78 0.00 0.00 0.71 0.00 0.00 52.55 53.04 2ysi s ASP 38 Cb -0.05 -0.22 0.00 0.00 1.01 0.00 0.00 42.92 43.65 2ysi s ASP 38 CO 0.43 0.15 0.00 0.61 0.21 0.00 0.00 175.17 176.58 2ysi n GLY 39 N 0.74 1.08 0.00 0.21 0.00 -1.26 -5.33 105.19 100.63 2ysi n GLY 39 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2ysi n GLY 39 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87