#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ys0 h SER 2 N 0.00 0.69 -1.45 1.61 0.02 -2.12 -3.45 113.55 108.84 2ys0 h SER 2 Ca 0.00 -0.41 0.18 0.00 -0.84 0.00 0.00 61.79 60.72 2ys0 h SER 2 Cb 0.00 -0.19 -0.27 0.00 0.14 0.00 0.00 62.40 62.08 2ys0 h SER 2 CO 0.00 0.94 0.41 -0.55 -1.14 0.00 0.00 176.83 176.49 2ys0 s SER 3 N -6.36 -0.39 0.15 3.07 0.15 -1.26 -5.14 113.70 103.93 2ys0 s SER 3 Ca -0.13 0.57 -0.32 0.00 0.70 0.00 0.00 55.95 56.76 2ys0 s SER 3 Cb 0.09 1.33 -0.12 0.00 -1.71 0.00 0.00 66.02 65.61 2ys0 s SER 3 CO 0.81 -0.08 1.73 0.61 1.20 0.00 0.00 173.24 177.50 2ys0 n GLY 4 N 4.24 1.46 3.07 9.45 0.00 -1.26 -4.94 105.19 117.21 2ys0 n GLY 4 Ca -0.13 0.67 -0.35 0.00 0.00 0.00 0.00 46.02 46.21 2ys0 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ys0 n SER 5 N 4.44 4.17 -1.84 1.61 7.64 -1.26 -4.91 113.62 123.46 2ys0 n SER 5 Ca 0.17 -3.16 -0.12 0.00 1.01 0.00 0.00 58.87 56.77 2ys0 n SER 5 Cb 0.33 -1.02 0.00 0.00 -1.01 0.00 0.00 64.21 62.51 2ys0 n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2ys0 n SER 6 N 2.19 6.04 -0.99 6.43 2.88 -1.26 -4.68 113.62 124.24 2ys0 n SER 6 Ca 0.22 -2.84 -0.08 0.00 -1.33 0.00 0.00 58.87 54.85 2ys0 n SER 6 Cb 0.37 -1.13 0.00 0.00 -0.75 0.00 0.00 64.21 62.70 2ys0 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ys0 n GLY 7 N 0.92 0.13 2.42 0.46 0.00 -1.26 -4.97 105.19 102.89 2ys0 n GLY 7 Ca 0.24 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 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 -3.89 1.40 -3.93 1.61 7.02 -1.26 -4.56 117.44 113.83 2ys0 n TRP 8 Ca -0.07 -3.87 -0.08 0.00 -1.02 0.00 0.00 57.50 52.45 2ys0 n TRP 8 Cb 0.56 -0.44 -0.03 0.00 -2.42 0.00 0.00 31.31 28.98 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 -3.02 0.00 -0.03 -0.99 -4.23 -1.26 -4.05 115.64 102.06 2ys0 s THR 9 Ca 0.43 -1.21 0.01 0.00 -1.18 0.00 0.00 61.69 59.74 2ys0 s THR 9 Cb 0.32 -2.20 0.02 0.00 1.34 0.00 0.00 72.50 71.98 2ys0 s THR 9 CO -0.10 0.00 -0.04 0.00 -0.54 0.00 0.00 174.62 173.94 2ys0 s ASN 11 N 0.62 6.07 0.15 0.00 3.84 -1.26 -4.78 114.94 119.57 2ys0 s ASN 11 Ca -0.08 0.29 -0.29 0.00 0.21 0.00 0.00 52.86 52.99 2ys0 s ASN 11 Cb -0.11 -1.72 -0.07 0.00 -0.55 0.00 0.00 41.25 38.80 2ys0 s ASN 11 CO -0.00 -0.47 1.51 0.11 -2.79 0.00 0.00 177.10 175.46 2ys0 h LYS 12 N 0.64 -0.03 -0.20 0.43 6.56 -1.95 0.12 116.57 122.15 2ys0 h LYS 12 Ca -0.48 0.00 0.03 0.00 -1.06 0.00 0.00 60.65 59.14 2ys0 h LYS 12 Cb 1.24 0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 32.88 2ys0 h LYS 12 CO 0.59 -0.02 0.01 0.74 -2.06 0.00 0.00 179.45 178.71 2ys0 h PHE 13 N -0.03 0.01 -0.54 -1.35 0.04 -2.00 -2.75 116.94 110.32 2ys0 h PHE 13 Ca 0.14 0.01 0.10 0.00 2.80 0.00 0.00 57.97 61.03 2ys0 h PHE 13 Cb 0.40 0.02 -0.11 0.00 2.20 0.00 0.00 35.95 38.46 2ys0 h PHE 13 CO -1.00 -0.01 -0.27 0.00 -0.60 0.00 0.00 178.31 176.42 2ys0 h ARG 14 N 0.08 -0.14 -5.15 1.51 2.47 -1.23 -3.37 114.38 108.56 2ys0 h ARG 14 Ca 0.09 0.01 -0.20 0.00 -1.26 0.00 0.00 59.98 58.62 2ys0 h ARG 14 Cb 0.11 0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 28.39 2ys0 h ARG 14 CO -0.14 -0.09 1.15 0.00 0.56 0.00 0.00 179.97 181.45 2ys0 n GLY 16 N 6.06 0.98 3.82 0.00 0.00 -0.04 -4.98 105.19 111.03 2ys0 n GLY 16 Ca 0.58 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.29 2ys0 n GLY 16 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2ys0 s GLU 17 N 0.05 3.11 -0.59 1.61 -1.05 0.35 -4.91 118.70 117.25 2ys0 s GLU 17 Ca 0.00 -0.54 0.00 0.00 -0.15 0.00 0.00 54.97 54.28 2ys0 s GLU 17 Cb 0.00 -2.87 0.44 0.00 -0.44 0.00 0.00 34.13 31.26 2ys0 s GLU 17 CO 0.00 0.61 1.79 1.63 0.95 0.00 0.00 175.26 180.24 2ys0 n LYS 18 N 0.70 2.95 -3.48 -4.83 4.76 -1.26 -4.48 118.16 112.51 2ys0 n LYS 18 Ca -0.09 -3.59 -0.09 0.00 -2.87 0.00 0.00 58.31 51.66 2ys0 n LYS 18 Cb 0.52 -2.28 -0.02 0.00 -1.84 0.00 0.00 35.03 31.41 2ys0 n LYS 18 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2ys0 s ARG 19 N -3.80 0.93 -0.30 1.97 1.70 -1.26 -5.16 118.95 113.03 2ys0 s ARG 19 Ca 0.59 -0.33 -0.06 0.00 -0.47 0.00 0.00 55.73 55.46 2ys0 s ARG 19 Cb 0.47 0.43 0.16 0.00 -0.57 0.00 0.00 34.95 35.44 2ys0 s ARG 19 CO -0.06 -0.40 0.63 -0.48 -1.08 0.00 0.00 175.30 173.90 2ys0 s LEU 20 N -2.52 -1.25 -1.14 -1.89 2.34 -1.26 -4.94 118.68 108.02 2ys0 s LEU 20 Ca 0.04 1.28 -0.17 0.00 0.06 0.00 0.00 54.13 55.33 2ys0 s LEU 20 Cb -0.01 2.25 0.12 0.00 -0.56 0.00 0.00 46.19 47.99 2ys0 s LEU 20 CO -0.10 -0.24 1.44 -0.89 -1.06 0.00 0.00 176.35 175.50 2ys0 s THR 21 N 2.88 4.62 -1.55 5.48 2.01 -1.26 -4.39 115.64 123.44 2ys0 s THR 21 Ca 0.06 -2.02 -0.14 0.00 0.31 0.00 0.00 61.69 59.90 2ys0 s THR 21 Cb -0.13 -4.97 0.09 0.00 0.01 0.00 0.00 72.50 67.50 2ys0 s THR 21 CO -0.20 -1.73 0.95 0.54 -0.69 0.00 0.00 174.62 173.50 2ys0 n ARG 22 N 6.86 -5.24 -2.31 4.92 1.74 -1.26 -4.93 116.66 116.44 2ys0 n ARG 22 Ca 0.36 0.57 -0.33 0.00 -0.77 0.00 0.00 57.85 57.68 2ys0 n ARG 22 Cb 0.46 -5.43 -0.02 0.00 -1.02 0.00 0.00 32.46 26.45 2ys0 n ARG 22 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2ys0 s SER 23 N -3.34 6.20 -0.01 0.55 0.15 -1.26 -4.99 113.70 111.00 2ys0 s SER 23 Ca 0.65 1.79 -0.22 0.00 0.70 0.00 0.00 55.95 58.87 2ys0 s SER 23 Cb -0.33 -2.54 -0.19 0.00 -1.71 0.00 0.00 66.02 61.25 2ys0 s SER 23 CO 0.84 -0.88 1.19 -0.07 1.20 0.00 0.00 173.24 175.52 2ys0 h LEU 24 N 0.96 0.30 0.00 3.45 3.38 -1.92 -3.47 115.31 118.01 2ys0 h LEU 24 Ca -0.48 -0.63 -0.36 0.00 0.09 0.00 0.00 57.88 56.51 2ys0 h LEU 24 Cb 1.21 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.81 2ys0 h LEU 24 CO 0.59 0.88 -0.24 0.00 0.09 0.00 0.00 178.44 179.76 2ys0 s ALA 26 N -2.48 2.83 -0.56 0.00 0.00 0.65 -4.94 121.76 117.26 2ys0 s ALA 26 Ca 0.04 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 51.03 2ys0 s ALA 26 Cb -0.00 -1.53 0.45 0.00 0.00 0.00 0.00 23.12 22.04 2ys0 s ALA 26 CO 0.02 -0.04 1.76 0.00 0.00 0.00 0.00 175.76 177.51 2ys0 s SER 28 N -2.37 3.30 0.47 0.00 1.04 -1.26 -0.86 113.70 114.02 2ys0 s SER 28 Ca 0.60 -1.70 0.25 0.00 0.48 0.00 0.00 55.95 55.57 2ys0 s SER 28 Cb 0.47 0.58 1.14 0.00 0.10 0.00 0.00 66.02 68.31 2ys0 s SER 28 CO -0.02 -0.94 1.93 -0.78 0.98 0.00 0.00 173.24 174.41 2ys0 h ASP 29 N 1.60 0.00 -0.23 7.02 3.58 -1.91 -2.94 116.42 123.54 2ys0 h ASP 29 Ca -0.38 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 56.93 2ys0 h ASP 29 Cb 1.29 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.27 2ys0 h ASP 29 CO 0.61 0.19 0.18 0.47 -2.88 0.00 0.00 179.24 177.81 2ys0 n ASP 30 N -3.52 4.78 -0.09 2.28 9.92 -1.26 -3.77 116.55 124.88 2ys0 n ASP 30 Ca -0.01 -2.58 -0.10 0.00 -0.53 0.00 0.00 54.79 51.57 2ys0 n ASP 30 Cb 0.35 -0.88 -0.14 0.00 -0.64 0.00 0.00 41.12 39.81 2ys0 n ASP 30 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2ys0 h LYS 32 N 0.00 0.44 -0.17 0.00 1.57 -1.83 0.71 116.57 117.28 2ys0 h LYS 32 Ca -0.50 -0.32 -0.00 0.00 -1.87 0.00 0.00 60.65 57.96 2ys0 h LYS 32 Cb 2.06 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 34.42 2ys0 h LYS 32 CO 0.01 0.94 0.11 -0.44 -0.57 0.00 0.00 179.45 179.50 2ys0 h ASP 33 N 0.01 0.20 0.03 0.86 5.19 -1.80 -3.18 116.42 117.74 2ys0 h ASP 33 Ca -0.01 -0.03 -0.13 0.00 -0.62 0.00 0.00 57.03 56.23 2ys0 h ASP 33 Cb 0.98 -0.05 0.01 0.00 0.18 0.00 0.00 39.33 40.45 2ys0 h ASP 33 CO 0.08 0.18 -0.55 1.56 -3.12 0.00 0.00 179.24 177.39 2ys0 h GLN 34 N 0.21 0.31 0.00 3.56 1.08 -1.70 -3.49 115.11 115.08 2ys0 h GLN 34 Ca 0.06 -0.38 0.00 0.00 -1.45 0.00 0.00 58.65 56.88 2ys0 h GLN 34 Cb 0.01 0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 2ys0 h GLN 34 CO -0.01 1.09 0.00 0.41 -0.95 0.00 0.00 178.83 179.37 2ys0 n GLY 35 N 1.24 0.89 1.81 3.46 0.00 0.23 -5.04 105.19 107.79 2ys0 n GLY 35 Ca -0.11 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.85 2ys0 n GLY 35 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ys0 n ASP 36 N 0.00 2.58 -4.60 1.61 2.03 -0.26 -5.02 116.55 112.88 2ys0 n ASP 36 Ca 0.00 -3.01 -0.43 0.00 0.52 0.00 0.00 54.79 51.87 2ys0 n ASP 36 Cb 0.00 -0.41 -0.02 0.00 -0.72 0.00 0.00 41.12 39.96 2ys0 n ASP 36 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ys0 h ILE 39 N 0.77 0.27 -1.11 0.00 6.09 -1.93 0.65 117.51 122.26 2ys0 h ILE 39 Ca -0.32 -0.06 -0.65 0.00 -1.37 0.00 0.00 64.86 62.46 2ys0 h ILE 39 Cb 1.44 0.09 -0.34 0.00 0.47 0.00 0.00 36.82 38.48 2ys0 h ILE 39 CO 0.53 0.03 0.32 -3.20 -3.07 0.00 0.00 178.15 172.76 2ys0 n ASN 40 N -4.56 6.71 -0.09 2.19 5.15 -1.26 -4.60 115.26 118.79 2ys0 n ASN 40 Ca 0.33 -3.78 -0.22 0.00 -0.60 0.00 0.00 54.58 50.30 2ys0 n ASN 40 Cb 1.28 -0.78 -0.12 0.00 -0.53 0.00 0.00 39.78 39.64 2ys0 n ASN 40 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ys0 n TYR 41 N -0.78 1.00 0.08 1.20 9.36 0.23 -3.44 117.16 124.81 2ys0 n TYR 41 Ca 0.55 0.40 -0.05 0.00 3.32 0.00 0.00 57.90 62.12 2ys0 n TYR 41 Cb 0.69 -1.10 0.13 0.00 -0.63 0.00 0.00 39.34 38.42 2ys0 n TYR 41 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2ys0 h SER 42 N -0.89 0.29 -0.43 2.98 4.64 -1.81 0.52 113.55 118.85 2ys0 h SER 42 Ca -0.38 -0.16 -0.10 0.00 -0.47 0.00 0.00 61.79 60.68 2ys0 h SER 42 Cb 1.40 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.39 2ys0 h SER 42 CO -0.19 0.80 -0.14 -1.28 -0.87 0.00 0.00 176.83 175.15 2ys0 h SER 43 N 0.20 0.86 0.00 4.97 0.87 -1.75 0.72 113.55 119.41 2ys0 h SER 43 Ca -0.00 -0.38 -0.09 0.00 -1.23 0.00 0.00 61.79 60.09 2ys0 h SER 43 Cb 1.07 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.78 2ys0 h SER 43 CO 0.09 1.05 -0.55 0.58 -0.53 0.00 0.00 176.83 177.47 2ys0 h VAL 44 N 0.67 1.10 -0.35 2.23 2.07 -1.57 -3.39 116.25 117.03 2ys0 h VAL 44 Ca 0.10 -2.02 -0.14 0.00 0.82 0.00 0.00 66.70 65.46 2ys0 h VAL 44 Cb 0.69 2.28 -0.01 0.00 -1.52 0.00 0.00 31.29 32.73 2ys0 h VAL 44 CO 0.05 0.37 -0.32 0.00 0.02 0.00 0.00 177.57 177.69 2ys0 n GLN 46 N -4.17 1.35 0.00 0.00 6.02 0.25 -4.88 117.38 115.95 2ys0 n GLN 46 Ca -0.03 -1.80 0.00 0.00 -0.01 0.00 0.00 57.00 55.16 2ys0 n GLN 46 Cb 0.50 0.44 0.00 0.00 1.02 0.00 0.00 30.24 32.20 2ys0 n GLN 46 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ys0 n GLY 47 N 1.98 0.81 0.26 1.08 0.00 -1.16 -3.94 105.19 104.21 2ys0 n GLY 47 Ca -0.09 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.35 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 0.00 0.32 -1.59 1.61 2.13 -1.26 -5.01 120.64 116.84 2ys0 n GLU 48 Ca 0.00 0.10 -0.40 0.00 0.66 0.00 0.00 57.16 57.52 2ys0 n GLU 48 Cb 0.00 -1.16 0.03 0.00 0.27 0.00 0.00 31.44 30.58 2ys0 n GLU 48 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2ys0 n LYS 49 N -3.19 1.07 -0.23 5.31 0.00 -1.26 -4.88 118.16 114.99 2ys0 n LYS 49 Ca -0.25 0.40 -0.11 0.00 0.00 0.00 0.00 58.31 58.34 2ys0 n LYS 49 Cb 0.73 -2.02 -0.09 0.00 0.00 0.00 0.00 35.03 33.65 2ys0 n LYS 49 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.40 178.17 2ys0 h SER 50 N 1.01 -1.74 -1.11 3.14 0.02 -1.97 -3.42 113.55 109.48 2ys0 h SER 50 Ca -0.46 0.25 -0.66 0.00 -0.84 0.00 0.00 61.79 60.08 2ys0 h SER 50 Cb 1.36 0.74 0.12 0.00 0.14 0.00 0.00 62.40 64.76 2ys0 h SER 50 CO 0.53 -0.28 -0.60 -0.24 -1.14 0.00 0.00 176.83 175.10 2ys0 n SER 51 N -4.99 -1.52 0.00 3.07 2.88 -1.26 -3.80 113.62 108.00 2ys0 n SER 51 Ca -0.01 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.60 2ys0 n SER 51 Cb 0.26 -0.94 0.00 0.00 -0.75 0.00 0.00 64.21 62.79 2ys0 n SER 51 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ys0 n GLY 52 N 2.05 1.42 3.57 0.46 0.00 -1.26 -4.87 105.19 106.56 2ys0 n GLY 52 Ca 0.17 -0.78 -0.27 0.00 0.00 0.00 0.00 46.02 45.14 2ys0 n GLY 52 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ys0 s PRO 53 N 0.00 2.52 0.05 1.61 0.04 -1.25 -4.84 135.00 133.13 2ys0 s PRO 53 Ca 0.00 -0.65 -0.28 0.00 0.04 0.00 0.00 61.00 60.12 2ys0 s PRO 53 Cb 0.00 -5.14 0.09 0.00 0.04 0.00 0.00 34.50 29.49 2ys0 s PRO 53 CO 0.00 -3.64 0.91 -1.54 0.04 0.00 0.00 177.00 172.78 2ys0 s SER 54 N 7.41 -0.30 -0.26 6.66 1.04 -1.26 -5.06 113.70 121.93 2ys0 s SER 54 Ca 0.69 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 57.00 2ys0 s SER 54 Cb -0.04 0.42 0.04 0.00 0.10 0.00 0.00 66.02 66.54 2ys0 s SER 54 CO 0.05 -0.71 -0.08 -0.44 0.98 0.00 0.00 173.24 173.04 2ys0 s SER 55 N -2.64 4.35 0.00 7.02 0.01 -1.26 -5.20 113.70 115.99 2ys0 s SER 55 Ca 0.07 -1.12 0.23 0.00 1.31 0.00 0.00 55.95 56.44 2ys0 s SER 55 Cb -0.01 -1.61 0.18 0.00 0.21 0.00 0.00 66.02 64.79 2ys0 s SER 55 CO -0.05 -0.16 1.23 0.61 0.41 0.00 0.00 173.24 175.27