#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ysi s SER 2 N 0.00 1.99 0.49 1.61 0.01 -1.26 -5.15 113.70 111.39 2ysi s SER 2 Ca 0.00 -0.37 0.06 0.00 1.31 0.00 0.00 55.95 56.95 2ysi s SER 2 Cb 0.00 -0.31 0.00 0.00 0.21 0.00 0.00 66.02 65.93 2ysi s SER 2 CO 0.00 -0.29 0.34 -0.55 0.41 0.00 0.00 173.24 173.15 2ysi s SER 3 N 2.07 4.66 0.00 2.44 0.15 -1.26 -5.13 113.70 116.63 2ysi s SER 3 Ca 0.03 -1.11 0.00 0.00 0.70 0.00 0.00 55.95 55.57 2ysi s SER 3 Cb -0.14 0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.17 2ysi s SER 3 CO -0.07 -0.88 0.00 0.61 1.20 0.00 0.00 173.24 174.11 2ysi n GLY 4 N -1.59 4.48 0.26 9.45 0.00 -1.26 -5.07 105.19 111.47 2ysi n GLY 4 Ca -0.01 -0.50 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 2ysi n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2ysi h SER 5 N 0.00 -0.50 -4.64 1.61 0.87 -2.00 -3.47 113.55 105.41 2ysi h SER 5 Ca 0.00 -0.03 -0.29 0.00 -1.23 0.00 0.00 61.79 60.24 2ysi h SER 5 Cb 0.00 0.13 -0.15 0.00 -0.44 0.00 0.00 62.40 61.94 2ysi h SER 5 CO 0.00 -0.07 -0.65 -0.44 -0.53 0.00 0.00 176.83 175.14 2ysi s SER 6 N -4.89 1.08 -0.00 6.23 0.01 -1.26 -5.11 113.70 109.75 2ysi s SER 6 Ca -0.10 -1.22 -0.00 0.00 1.31 0.00 0.00 55.95 55.93 2ysi s SER 6 Cb 0.01 0.15 -0.00 0.00 0.21 0.00 0.00 66.02 66.39 2ysi s SER 6 CO 0.33 -0.63 0.25 1.23 0.41 0.00 0.00 173.24 174.84 2ysi h GLY 7 N 2.65 -0.01 -0.80 3.44 0.00 -2.03 -3.47 103.07 102.84 2ysi h GLY 7 Ca -0.37 0.01 -0.44 0.00 0.00 0.00 0.00 47.33 46.52 2ysi h GLY 7 CO 0.62 -0.01 0.31 -0.51 0.00 0.00 0.00 176.54 176.96 2ysi s THR 8 N -1.54 1.90 -0.08 4.70 -4.23 -1.26 -5.07 115.64 110.06 2ysi s THR 8 Ca -0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.50 2ysi s THR 8 Cb 0.00 -2.80 -0.03 0.00 1.34 0.00 0.00 72.50 71.01 2ysi s THR 8 CO 0.01 0.00 -0.03 -1.61 -0.54 0.00 0.00 174.62 172.44 2ysi s GLU 9 N -5.56 2.94 1.45 3.99 2.02 -1.26 -5.11 118.70 117.16 2ysi s GLU 9 Ca 0.69 -0.48 -0.23 0.00 0.02 0.00 0.00 54.97 54.98 2ysi s GLU 9 Cb -0.09 -2.72 0.38 0.00 0.10 0.00 0.00 34.13 31.80 2ysi s GLU 9 CO 0.53 0.65 0.90 0.39 0.02 0.00 0.00 175.26 177.76 2ysi n GLU 10 N 2.29 -4.58 0.00 1.61 4.71 -1.26 -4.83 120.64 118.58 2ysi n GLU 10 Ca -0.18 -1.35 0.08 0.00 -0.01 0.00 0.00 57.16 55.69 2ysi n GLU 10 Cb 0.53 -1.97 0.47 0.00 -1.01 0.00 0.00 31.44 29.46 2ysi n GLU 10 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 2ysi n ILE 11 N -5.76 0.00 -1.78 -3.67 5.41 -1.26 -4.81 119.36 107.49 2ysi n ILE 11 Ca 0.12 0.00 -0.31 0.00 1.00 0.00 0.00 62.75 63.56 2ysi n ILE 11 Cb 0.60 -0.48 0.03 0.00 -0.71 0.00 0.00 39.64 39.08 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 3.32 0.02 1.39 0.52 -1.26 -4.03 118.94 116.90 2ysi s TRP 12 Ca 0.24 1.38 0.04 0.00 0.02 0.00 0.00 56.10 57.78 2ysi s TRP 12 Cb 0.11 -2.83 -0.03 0.00 -1.15 0.00 0.00 33.47 29.57 2ysi s TRP 12 CO 0.18 -0.96 -0.06 0.08 0.02 0.00 0.00 176.95 176.21 2ysi s VAL 13 N -3.02 3.69 -0.19 4.03 1.01 0.87 -4.88 120.40 121.91 2ysi s VAL 13 Ca 0.57 -0.83 -0.22 0.00 0.00 0.00 0.00 61.98 61.51 2ysi s VAL 13 Cb -0.13 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 2ysi s VAL 13 CO 0.51 0.34 0.66 -0.70 0.00 0.00 0.00 175.10 175.92 2ysi s GLU 14 N -1.58 4.23 0.32 2.72 2.12 -1.26 -1.49 118.70 123.76 2ysi s GLU 14 Ca 0.18 0.68 0.01 0.00 0.36 0.00 0.00 54.97 56.21 2ysi s GLU 14 Cb -0.11 -3.58 -0.02 0.00 0.26 0.00 0.00 34.13 30.69 2ysi s GLU 14 CO 0.09 -0.25 0.36 -0.80 -0.54 0.00 0.00 175.26 174.12 2ysi s ASN 15 N 1.19 1.09 -0.04 -1.70 0.01 -0.52 -5.01 114.94 109.95 2ysi s ASN 15 Ca 0.30 -1.56 -0.02 0.00 -0.71 0.00 0.00 52.86 50.87 2ysi s ASN 15 Cb -0.16 0.59 0.03 0.00 0.41 0.00 0.00 41.25 42.12 2ysi s ASN 15 CO 0.11 -1.15 0.07 -0.75 -1.51 0.00 0.00 177.10 173.87 2ysi s LYS 16 N -3.37 -0.06 0.87 -0.60 2.47 -1.26 0.07 119.74 117.86 2ysi s LYS 16 Ca 0.35 0.39 -0.14 0.00 -1.56 0.00 0.00 55.97 55.01 2ysi s LYS 16 Cb 0.01 -0.47 0.01 0.00 -1.46 0.00 0.00 37.83 35.92 2ysi s LYS 16 CO 0.22 -0.32 0.45 0.25 0.16 0.00 0.00 175.35 176.11 2ysi n THR 17 N 5.24 0.70 0.99 3.43 -2.24 0.17 -4.80 114.28 117.77 2ysi n THR 17 Ca -0.05 -0.27 0.02 0.00 -2.27 0.00 0.00 64.05 61.48 2ysi n THR 17 Cb 0.50 -0.67 0.12 0.00 -2.10 0.00 0.00 70.33 68.17 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 -1.33 0.49 -0.04 -0.78 -0.04 -1.26 -2.12 135.00 129.92 2ysi n PRO 18 Ca 0.08 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.52 2ysi n PRO 18 Cb 0.52 -1.12 -0.10 0.00 -0.04 0.00 0.00 33.50 32.75 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 -0.62 1.79 0.00 3.54 8.00 -1.26 -5.02 116.55 122.98 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 1.11 0.00 0.00 -0.02 0.00 0.00 41.12 42.22 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 2.03 0.98 2.82 0.44 0.00 -0.90 -5.15 105.19 105.41 2ysi n GLY 20 Ca -0.15 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.71 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 0.04 0.01 0.05 1.61 3.01 -1.25 -4.96 119.74 118.25 2ysi s LYS 21 Ca 0.00 0.38 -0.30 0.00 -1.01 0.00 0.00 55.97 55.03 2ysi s LYS 21 Cb 0.00 -0.28 -0.05 0.00 -1.01 0.00 0.00 37.83 36.49 2ysi s LYS 21 CO 0.00 -0.23 1.15 0.08 0.51 0.00 0.00 175.35 176.86 2ysi s VAL 22 N 1.61 4.22 0.36 3.17 1.01 -1.26 0.42 120.40 129.93 2ysi s VAL 22 Ca -0.04 1.59 0.05 0.00 0.00 0.00 0.00 61.98 63.59 2ysi s VAL 22 Cb -0.12 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 2ysi s VAL 22 CO -0.05 0.12 0.19 -0.72 0.00 0.00 0.00 175.10 174.65 2ysi s TYR 23 N 1.07 1.73 -0.04 5.22 1.13 0.11 -4.79 117.35 121.78 2ysi s TYR 23 Ca 0.57 -1.46 0.05 0.00 -1.41 0.00 0.00 57.07 54.82 2ysi s TYR 23 Cb -0.28 -0.93 -0.01 0.00 -1.10 0.00 0.00 41.96 39.65 2ysi s TYR 23 CO 0.29 -0.57 -0.17 0.71 -2.51 0.00 0.00 175.55 173.30 2ysi s TYR 24 N -3.38 1.71 -0.13 -3.49 2.02 0.50 -1.44 117.35 113.14 2ysi s TYR 24 Ca 0.32 -0.46 0.02 0.00 -0.37 0.00 0.00 57.07 56.58 2ysi s TYR 24 Cb 0.03 -1.14 0.00 0.00 -0.40 0.00 0.00 41.96 40.44 2ysi s TYR 24 CO 0.20 -0.14 -0.19 -0.47 -1.57 0.00 0.00 175.55 173.37 2ysi s TYR 25 N -0.04 2.69 0.04 2.71 6.14 -0.55 -1.16 117.35 127.18 2ysi s TYR 25 Ca -0.02 -1.09 -0.26 0.00 0.64 0.00 0.00 57.07 56.34 2ysi s TYR 25 Cb -0.11 -1.82 -0.05 0.00 0.42 0.00 0.00 41.96 40.40 2ysi s TYR 25 CO 0.02 -0.47 0.81 1.21 0.64 0.00 0.00 175.55 177.76 2ysi s ASN 26 N 0.64 7.26 0.10 4.32 3.04 -0.97 -0.09 114.94 129.25 2ysi s ASN 26 Ca -0.10 1.51 0.25 0.00 0.04 0.00 0.00 52.86 54.56 2ysi s ASN 26 Cb -0.16 -2.49 0.60 0.00 -1.54 0.00 0.00 41.25 37.66 2ysi s ASN 26 CO 0.02 -0.04 1.53 0.00 -3.04 0.00 0.00 177.10 175.57 2ysi n ALA 27 N 2.99 2.80 -0.05 1.71 0.00 -1.26 -0.33 120.51 126.38 2ysi n ALA 27 Ca -0.01 -0.19 -0.21 0.00 0.00 0.00 0.00 53.44 53.03 2ysi n ALA 27 Cb 0.50 -1.27 -0.13 0.00 0.00 0.00 0.00 19.45 18.55 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 -1.96 0.71 -0.01 0.00 0.00 -1.26 -4.47 116.66 109.67 2ysi n ARG 28 Ca 0.05 0.25 0.07 0.00 -0.00 0.00 0.00 57.85 58.22 2ysi n ARG 28 Cb 0.41 -1.65 -0.14 0.00 0.00 0.00 0.00 32.46 31.07 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 -3.52 0.40 -3.02 5.15 -2.24 -1.25 -4.99 114.28 104.79 2ysi n THR 29 Ca -0.37 -0.58 -0.17 0.00 -2.27 0.00 0.00 64.05 60.65 2ysi n THR 29 Cb 1.00 -0.17 0.04 0.00 -2.10 0.00 0.00 70.33 69.10 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 -2.44 -4.62 -3.61 -0.78 1.74 0.55 -5.01 116.66 102.49 2ysi n ARG 30 Ca -0.09 0.67 -0.22 0.00 -0.77 0.00 0.00 57.85 57.44 2ysi n ARG 30 Cb 0.69 -5.09 -0.02 0.00 -1.02 0.00 0.00 32.46 27.02 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 2.43 -0.14 5.56 2.02 -1.23 -4.89 118.70 116.81 2ysi s GLU 31 Ca 0.31 -1.68 -0.00 0.00 0.02 0.00 0.00 54.97 53.62 2ysi s GLU 31 Cb -0.14 -2.32 0.03 0.00 0.10 0.00 0.00 34.13 31.81 2ysi s GLU 31 CO 0.39 -0.36 -0.07 -1.54 0.02 0.00 0.00 175.26 173.70 2ysi s SER 32 N -4.21 2.56 -0.04 -0.19 1.04 -1.26 -2.28 113.70 109.32 2ysi s SER 32 Ca 0.46 -0.51 -0.02 0.00 0.48 0.00 0.00 55.95 56.36 2ysi s SER 32 Cb -0.03 -0.90 0.02 0.00 0.10 0.00 0.00 66.02 65.21 2ysi s SER 32 CO 0.27 -0.15 0.09 0.00 0.98 0.00 0.00 173.24 174.43 2ysi s ALA 33 N 1.65 -0.16 0.15 5.32 0.00 -0.31 -4.99 121.76 123.42 2ysi s ALA 33 Ca 0.03 0.36 -0.29 0.00 0.00 0.00 0.00 51.96 52.05 2ysi s ALA 33 Cb -0.14 -0.24 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 2ysi s ALA 33 CO -0.08 -0.08 1.56 -1.49 0.00 0.00 0.00 175.76 175.67 2ysi h TRP 34 N 6.58 -1.47 -1.95 0.00 -0.00 -1.87 0.14 115.95 117.40 2ysi h TRP 34 Ca -0.33 0.08 -0.49 0.00 -0.00 0.00 0.00 58.89 58.14 2ysi h TRP 34 Cb 1.17 0.70 -0.04 0.00 -0.00 0.00 0.00 29.16 31.00 2ysi h TRP 34 CO 0.43 -0.46 -0.46 -0.08 -0.00 0.00 0.00 178.44 177.87 2ysi s THR 35 N -5.76 3.85 0.13 1.49 -1.32 -1.26 -3.29 115.64 109.49 2ysi s THR 35 Ca -0.14 -1.35 -0.14 0.00 -1.21 0.00 0.00 61.69 58.85 2ysi s THR 35 Cb 0.11 -3.27 -0.07 0.00 -1.51 0.00 0.00 72.50 67.76 2ysi s THR 35 CO 0.64 -0.22 0.54 -0.54 -2.21 0.00 0.00 174.62 172.82 2ysi s LYS 36 N -3.96 3.98 0.37 7.08 1.02 -1.26 -4.83 119.74 122.14 2ysi s LYS 36 Ca 0.39 0.48 -0.26 0.00 0.02 0.00 0.00 55.97 56.60 2ysi s LYS 36 Cb -0.07 -2.97 -0.09 0.00 -0.52 0.00 0.00 37.83 34.19 2ysi s LYS 36 CO 0.26 0.50 1.20 -1.25 -0.92 0.00 0.00 175.35 175.15 2ysi s PRO 37 N -1.86 4.16 -0.10 -1.68 0.04 -1.26 -4.93 135.00 129.37 2ysi s PRO 37 Ca 0.36 1.94 0.08 0.00 0.04 0.00 0.00 61.00 63.42 2ysi s PRO 37 Cb -0.15 -2.81 0.41 0.00 0.04 0.00 0.00 34.50 31.98 2ysi s PRO 37 CO 0.19 -0.25 1.18 -0.40 0.04 0.00 0.00 177.00 177.75 2ysi n ASP 38 N 0.34 3.20 -0.10 6.66 5.75 -1.26 -3.99 116.55 127.15 2ysi n ASP 38 Ca 0.03 -2.39 -0.17 0.00 -0.01 0.00 0.00 54.79 52.25 2ysi n ASP 38 Cb 0.45 -0.53 -0.13 0.00 -1.03 0.00 0.00 41.12 39.88 2ysi n ASP 38 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ysi n GLY 39 N 0.48 -0.53 0.81 6.12 0.00 -1.26 -5.29 105.19 105.52 2ysi n GLY 39 Ca 0.14 -0.21 0.13 0.00 0.00 0.00 0.00 46.02 46.08 2ysi n GLY 39 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65