#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ys0 s SER 2 N 0.00 -0.48 -0.99 1.61 0.01 -1.26 -5.10 113.70 107.49 2ys0 s SER 2 Ca 0.00 0.82 -0.13 0.00 1.31 0.00 0.00 55.95 57.96 2ys0 s SER 2 Cb 0.00 1.05 0.23 0.00 0.21 0.00 0.00 66.02 67.50 2ys0 s SER 2 CO 0.00 -0.14 1.01 -0.55 0.41 0.00 0.00 173.24 173.98 2ys0 s SER 3 N 0.87 7.01 0.00 2.44 0.15 -1.26 -5.01 113.70 117.90 2ys0 s SER 3 Ca -0.04 -3.02 0.00 0.00 0.70 0.00 0.00 55.95 53.60 2ys0 s SER 3 Cb -0.04 -2.25 0.00 0.00 -1.71 0.00 0.00 66.02 62.02 2ys0 s SER 3 CO -0.12 -0.53 0.00 0.61 1.20 0.00 0.00 173.24 174.40 2ys0 n GLY 4 N 3.64 1.90 3.11 9.45 0.00 -1.26 -2.66 105.19 119.37 2ys0 n GLY 4 Ca 0.21 0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.99 2ys0 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ys0 s SER 5 N -3.22 5.98 0.00 1.61 1.04 -1.26 -5.01 113.70 112.84 2ys0 s SER 5 Ca 0.00 -3.68 -0.30 0.00 0.48 0.00 0.00 55.95 52.45 2ys0 s SER 5 Cb 0.00 -1.91 0.11 0.00 0.10 0.00 0.00 66.02 64.32 2ys0 s SER 5 CO 0.00 -0.19 1.26 -0.55 0.98 0.00 0.00 173.24 174.73 2ys0 s SER 6 N -0.09 -0.06 0.00 7.02 0.15 -1.09 -5.11 113.70 114.52 2ys0 s SER 6 Ca 0.27 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.75 2ys0 s SER 6 Cb -0.08 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.43 2ys0 s SER 6 CO -0.12 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 174.57 2ys0 n GLY 7 N -0.53 -1.78 4.42 9.45 0.00 -1.26 -4.69 105.19 110.80 2ys0 n GLY 7 Ca -0.07 0.61 -0.40 0.00 0.00 0.00 0.00 46.02 46.16 2ys0 n GLY 7 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2ys0 n TRP 8 N 0.00 -1.39 -3.92 1.61 7.02 -1.26 -4.91 117.44 114.59 2ys0 n TRP 8 Ca 0.00 0.73 -0.10 0.00 -1.02 0.00 0.00 57.50 57.11 2ys0 n TRP 8 Cb 0.00 -2.31 -0.10 0.00 -2.42 0.00 0.00 31.31 26.48 2ys0 n TRP 8 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2ys0 s THR 9 N -3.29 0.11 0.34 -0.99 -4.23 -1.26 -4.08 115.64 102.25 2ys0 s THR 9 Ca 0.78 -0.94 0.09 0.00 -1.18 0.00 0.00 61.69 60.44 2ys0 s THR 9 Cb -0.44 -0.63 -0.06 0.00 1.34 0.00 0.00 72.50 72.71 2ys0 s THR 9 CO 0.99 -0.52 0.00 0.00 -0.54 0.00 0.00 174.62 174.56 2ys0 s ASN 11 N -3.71 1.40 0.22 0.00 2.47 -1.26 -4.93 114.94 109.13 2ys0 s ASN 11 Ca 0.35 -0.92 -0.10 0.00 0.42 0.00 0.00 52.86 52.60 2ys0 s ASN 11 Cb 0.01 0.04 0.33 0.00 -1.45 0.00 0.00 41.25 40.17 2ys0 s ASN 11 CO 0.19 -0.35 1.64 0.11 -3.72 0.00 0.00 177.10 174.97 2ys0 h LYS 12 N 3.19 0.08 0.30 0.43 6.56 -1.97 -1.47 116.57 123.69 2ys0 h LYS 12 Ca -0.36 -0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.21 2ys0 h LYS 12 Cb 1.18 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.83 2ys0 h LYS 12 CO 0.59 0.05 -0.14 0.35 -2.06 0.00 0.00 179.45 178.25 2ys0 h PHE 13 N 0.09 -0.37 -0.80 -1.35 3.57 -2.00 -3.06 116.94 113.01 2ys0 h PHE 13 Ca 0.35 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 62.00 2ys0 h PHE 13 Cb 0.58 0.12 -0.15 0.00 2.79 0.00 0.00 35.95 39.29 2ys0 h PHE 13 CO -0.42 -0.15 -0.20 0.00 -2.23 0.00 0.00 178.31 175.31 2ys0 h ARG 14 N -0.52 -0.00 -4.29 1.11 3.08 -1.69 -3.41 114.38 108.66 2ys0 h ARG 14 Ca -0.04 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.47 2ys0 h ARG 14 Cb 0.39 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 2ys0 h ARG 14 CO 0.07 -0.00 0.97 0.00 -1.07 0.00 0.00 179.97 179.94 2ys0 n GLY 16 N 5.37 0.97 1.89 0.00 0.00 -1.20 -5.05 105.19 107.16 2ys0 n GLY 16 Ca 0.40 -0.20 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 2ys0 n GLY 16 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2ys0 n GLU 17 N -0.15 -0.72 -4.09 1.61 0.28 -0.22 -5.06 120.64 112.29 2ys0 n GLU 17 Ca 0.00 -1.00 -0.22 0.00 -0.16 0.00 0.00 57.16 55.78 2ys0 n GLU 17 Cb 0.15 -0.68 -0.05 0.00 1.43 0.00 0.00 31.44 32.29 2ys0 n GLU 17 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 2ys0 s LYS 18 N -4.42 2.78 0.25 3.44 0.00 -1.26 -4.88 119.74 115.66 2ys0 s LYS 18 Ca 0.37 -1.16 -0.17 0.00 0.00 0.00 0.00 55.97 55.01 2ys0 s LYS 18 Cb -0.01 -2.48 -0.12 0.00 0.00 0.00 0.00 37.83 35.23 2ys0 s LYS 18 CO 0.26 0.34 0.15 -2.13 0.00 0.00 0.00 175.35 173.97 2ys0 n ARG 19 N -1.17 0.00 -3.69 1.78 3.00 -1.26 -4.98 116.66 110.34 2ys0 n ARG 19 Ca -0.06 0.00 -0.10 0.00 -0.00 0.00 0.00 57.85 57.68 2ys0 n ARG 19 Cb 0.58 -0.73 -0.10 0.00 0.00 0.00 0.00 32.46 32.21 2ys0 n ARG 19 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 2ys0 s LEU 20 N 2.89 -0.13 -0.12 6.15 2.34 -1.26 -5.08 118.68 123.47 2ys0 s LEU 20 Ca 0.44 0.95 -0.12 0.00 0.06 0.00 0.00 54.13 55.46 2ys0 s LEU 20 Cb -0.53 1.46 -0.04 0.00 -0.56 0.00 0.00 46.19 46.52 2ys0 s LEU 20 CO 0.44 -0.19 -0.24 0.41 -1.06 0.00 0.00 176.35 175.71 2ys0 n THR 21 N 4.14 1.11 -2.08 5.48 -1.04 -1.26 -4.77 114.28 115.86 2ys0 n THR 21 Ca -0.22 0.24 -0.28 0.00 -2.04 0.00 0.00 64.05 61.74 2ys0 n THR 21 Cb 0.56 -2.08 -0.06 0.00 -1.82 0.00 0.00 70.33 66.93 2ys0 n THR 21 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2ys0 s ARG 22 N -2.38 2.53 -0.29 -2.82 3.00 -1.26 -4.79 118.95 112.95 2ys0 s ARG 22 Ca -0.20 -1.09 -0.22 0.00 0.00 0.00 0.00 55.73 54.22 2ys0 s ARG 22 Cb 0.03 -5.23 0.15 0.00 0.00 0.00 0.00 34.95 29.90 2ys0 s ARG 22 CO 0.30 -3.89 1.12 -1.12 0.00 0.00 0.00 175.30 171.71 2ys0 s SER 23 N 6.61 -0.35 0.10 0.23 0.01 -1.26 -5.06 113.70 113.98 2ys0 s SER 23 Ca 0.68 0.64 -0.29 0.00 1.31 0.00 0.00 55.95 58.29 2ys0 s SER 23 Cb -0.01 0.81 -0.11 0.00 0.21 0.00 0.00 66.02 66.91 2ys0 s SER 23 CO 0.12 -0.11 1.63 -0.07 0.41 0.00 0.00 173.24 175.22 2ys0 h LEU 24 N 4.51 -0.79 0.00 2.44 3.38 -1.99 -3.45 115.31 119.41 2ys0 h LEU 24 Ca -0.28 0.08 -0.61 0.00 0.09 0.00 0.00 57.88 57.16 2ys0 h LEU 24 Cb 1.18 0.28 -0.12 0.00 0.09 0.00 0.00 40.66 42.09 2ys0 h LEU 24 CO 0.15 -0.40 -0.46 0.00 0.09 0.00 0.00 178.44 177.82 2ys0 s ALA 26 N -2.95 0.60 -0.65 0.00 0.00 -1.09 -4.93 121.76 112.74 2ys0 s ALA 26 Ca 0.08 -0.03 -0.02 0.00 0.00 0.00 0.00 51.96 51.99 2ys0 s ALA 26 Cb 0.00 -0.37 0.44 0.00 0.00 0.00 0.00 23.12 23.19 2ys0 s ALA 26 CO 0.06 0.00 2.04 0.00 0.00 0.00 0.00 175.76 177.86 2ys0 s SER 28 N -1.72 2.05 0.31 0.00 1.04 -1.26 -3.27 113.70 110.84 2ys0 s SER 28 Ca 0.63 -1.40 0.02 0.00 0.48 0.00 0.00 55.95 55.68 2ys0 s SER 28 Cb 0.50 0.04 0.59 0.00 0.10 0.00 0.00 66.02 67.24 2ys0 s SER 28 CO -0.01 -0.67 1.90 -2.24 0.98 0.00 0.00 173.24 173.20 2ys0 h ASP 29 N 2.17 0.86 -0.87 7.02 2.03 -1.92 -2.24 116.42 123.47 2ys0 h ASP 29 Ca -0.40 0.01 0.22 0.00 -0.73 0.00 0.00 57.03 56.14 2ys0 h ASP 29 Cb 1.25 -0.17 -0.15 0.00 -0.83 0.00 0.00 39.33 39.43 2ys0 h ASP 29 CO 0.66 0.53 0.04 -0.78 -1.03 0.00 0.00 179.24 178.66 2ys0 h ASP 30 N 0.96 -0.36 -1.17 4.15 3.58 -1.96 0.53 116.42 122.16 2ys0 h ASP 30 Ca 0.40 0.23 0.38 0.00 0.42 0.00 0.00 57.03 58.46 2ys0 h ASP 30 Cb 0.29 0.40 -0.13 0.00 1.72 0.00 0.00 39.33 41.61 2ys0 h ASP 30 CO -0.16 -0.25 0.73 0.00 -2.88 0.00 0.00 179.24 176.68 2ys0 h LYS 32 N 0.19 0.42 0.60 0.00 1.79 -0.08 1.04 116.57 120.52 2ys0 h LYS 32 Ca 0.76 -0.03 -0.03 0.00 -2.18 0.00 0.00 60.65 59.18 2ys0 h LYS 32 Cb 2.14 -0.09 0.01 0.00 -1.58 0.00 0.00 32.23 32.71 2ys0 h LYS 32 CO -0.47 0.28 -0.29 0.22 -1.08 0.00 0.00 179.45 178.11 2ys0 h ASP 33 N 0.43 -0.68 0.65 0.86 1.82 -0.14 -3.35 116.42 116.01 2ys0 h ASP 33 Ca 0.36 0.02 -0.03 0.00 -0.39 0.00 0.00 57.03 56.99 2ys0 h ASP 33 Cb 0.49 0.18 0.00 0.00 0.68 0.00 0.00 39.33 40.67 2ys0 h ASP 33 CO -0.35 -0.37 -0.36 1.56 -1.61 0.00 0.00 179.24 178.10 2ys0 h GLN 34 N -1.03 -0.90 0.00 0.28 4.20 -1.32 -3.48 115.11 112.87 2ys0 h GLN 34 Ca -0.08 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2ys0 h GLN 34 Cb 0.61 0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.60 2ys0 h GLN 34 CO 0.13 -0.60 0.00 0.41 -0.67 0.00 0.00 178.83 178.11 2ys0 n GLY 35 N -1.47 1.98 2.13 3.46 0.00 0.36 -5.04 105.19 106.60 2ys0 n GLY 35 Ca -0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 2ys0 n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ys0 n ASP 36 N 0.00 5.12 -4.66 1.61 8.00 -1.21 -5.04 116.55 120.36 2ys0 n ASP 36 Ca 0.00 -3.75 -0.42 0.00 0.71 0.00 0.00 54.79 51.33 2ys0 n ASP 36 Cb 0.00 -0.41 -0.03 0.00 -0.02 0.00 0.00 41.12 40.66 2ys0 n ASP 36 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ys0 h ILE 39 N 1.91 0.34 -1.02 0.00 2.10 -1.92 0.56 117.51 119.48 2ys0 h ILE 39 Ca -0.38 -0.07 -0.65 0.00 1.08 0.00 0.00 64.86 64.84 2ys0 h ILE 39 Cb 1.41 0.13 -0.33 0.00 -1.09 0.00 0.00 36.82 36.94 2ys0 h ILE 39 CO 0.62 0.04 0.44 -3.20 -1.08 0.00 0.00 178.15 174.96 2ys0 n ASN 40 N -4.53 6.95 -0.02 2.19 5.15 -1.26 -4.65 115.26 119.10 2ys0 n ASN 40 Ca 0.30 -3.78 -0.01 0.00 -0.60 0.00 0.00 54.58 50.49 2ys0 n ASN 40 Cb 1.19 -0.82 -0.00 0.00 -0.53 0.00 0.00 39.78 39.62 2ys0 n ASN 40 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2ys0 h TYR 41 N 2.12 0.00 -0.15 1.20 3.20 -0.17 -3.18 116.97 119.99 2ys0 h TYR 41 Ca 0.54 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 62.31 2ys0 h TYR 41 Cb 0.94 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 2ys0 h TYR 41 CO 1.26 0.00 -0.35 0.66 -1.64 0.00 0.00 178.16 178.09 2ys0 h SER 42 N -0.33 0.31 -0.82 -2.11 4.64 -1.83 0.36 113.55 113.77 2ys0 h SER 42 Ca 0.00 -0.12 0.03 0.00 -0.47 0.00 0.00 61.79 61.23 2ys0 h SER 42 Cb 0.10 -0.09 -0.05 0.00 -0.31 0.00 0.00 62.40 62.06 2ys0 h SER 42 CO 0.00 0.65 0.53 0.28 -0.87 0.00 0.00 176.83 177.42 2ys0 h SER 43 N 0.26 0.87 0.00 4.97 0.02 -1.81 0.30 113.55 118.16 2ys0 h SER 43 Ca 0.03 -0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.80 2ys0 h SER 43 Cb 0.75 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.07 2ys0 h SER 43 CO 0.06 0.60 -1.07 0.58 -1.14 0.00 0.00 176.83 175.86 2ys0 h VAL 44 N 1.02 0.73 0.12 2.27 2.07 -1.60 -3.27 116.25 117.59 2ys0 h VAL 44 Ca 0.33 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.92 2ys0 h VAL 44 Cb 0.02 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2ys0 h VAL 44 CO -0.12 0.25 -0.06 0.00 0.02 0.00 0.00 177.57 177.66 2ys0 n GLN 46 N -2.78 1.58 0.06 0.00 1.13 0.90 -4.14 117.38 114.13 2ys0 n GLN 46 Ca -0.02 -0.84 0.00 0.00 -1.94 0.00 0.00 57.00 54.21 2ys0 n GLN 46 Cb 0.06 -1.51 0.00 0.00 0.11 0.00 0.00 30.24 28.90 2ys0 n GLN 46 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ys0 n GLY 47 N 1.46 -0.74 2.68 1.08 0.00 -0.25 -4.59 105.19 104.82 2ys0 n GLY 47 Ca 0.23 0.13 -0.13 0.00 0.00 0.00 0.00 46.02 46.25 2ys0 n GLY 47 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2ys0 n GLU 48 N -2.81 -4.62 -3.79 1.61 4.07 -1.03 -4.99 120.64 109.07 2ys0 n GLU 48 Ca 0.00 0.54 -0.28 0.00 -0.06 0.00 0.00 57.16 57.36 2ys0 n GLU 48 Cb 0.00 -4.67 -0.11 0.00 -0.06 0.00 0.00 31.44 26.60 2ys0 n GLU 48 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2ys0 n LYS 49 N -3.17 1.77 -3.35 5.31 4.81 -1.26 -5.01 118.16 117.27 2ys0 n LYS 49 Ca -0.11 -4.39 -0.45 0.00 -0.87 0.00 0.00 58.31 52.49 2ys0 n LYS 49 Cb 0.58 -2.22 -0.00 0.00 0.02 0.00 0.00 35.03 33.41 2ys0 n LYS 49 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2ys0 s SER 50 N -1.47 7.31 -0.26 3.14 0.15 -1.26 -4.76 113.70 116.54 2ys0 s SER 50 Ca 0.28 -3.62 -0.15 0.00 0.70 0.00 0.00 55.95 53.15 2ys0 s SER 50 Cb -0.01 -2.20 -0.13 0.00 -1.71 0.00 0.00 66.02 61.97 2ys0 s SER 50 CO -0.15 -0.28 -0.27 -0.24 1.20 0.00 0.00 173.24 173.50 2ys0 n SER 51 N 2.67 1.94 -3.66 5.45 2.88 -1.26 -4.97 113.62 116.67 2ys0 n SER 51 Ca 0.24 0.36 -0.19 0.00 -1.33 0.00 0.00 58.87 57.94 2ys0 n SER 51 Cb 0.39 -0.84 -0.17 0.00 -0.75 0.00 0.00 64.21 62.84 2ys0 n SER 51 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ys0 s GLY 52 N -5.36 0.16 0.00 0.46 0.00 -1.26 -5.00 107.32 96.32 2ys0 s GLY 52 Ca -0.37 0.28 0.11 0.00 0.00 0.00 0.00 44.72 44.74 2ys0 s GLY 52 CO 0.50 1.52 1.10 -1.55 0.00 0.00 0.00 173.10 174.67 2ys0 n PRO 53 N 5.31 0.49 -1.55 2.90 -0.04 -1.26 -4.75 135.00 136.09 2ys0 n PRO 53 Ca -0.04 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.05 2ys0 n PRO 53 Cb 0.50 -1.36 -0.03 0.00 -0.04 0.00 0.00 33.50 32.57 2ys0 n PRO 53 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2ys0 n SER 54 N -0.86 2.38 -4.31 3.54 2.88 -1.26 -4.92 113.62 111.07 2ys0 n SER 54 Ca 0.08 -0.41 -0.37 0.00 -1.33 0.00 0.00 58.87 56.85 2ys0 n SER 54 Cb 0.04 -1.57 -0.13 0.00 -0.75 0.00 0.00 64.21 61.80 2ys0 n SER 54 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2ys0 s SER 55 N 11.71 4.97 0.00 -3.46 0.01 -1.26 -5.22 113.70 120.45 2ys0 s SER 55 Ca 0.99 -0.75 0.00 0.00 1.31 0.00 0.00 55.95 57.50 2ys0 s SER 55 Cb -0.22 -1.84 0.00 0.00 0.21 0.00 0.00 66.02 64.17 2ys0 s SER 55 CO 0.28 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.36