#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jyt h PRO 2 N 0.00 0.15 0.00 5.55 0.11 -1.95 -3.40 132.00 132.47 2jyt h PRO 2 Ca 0.00 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2jyt h PRO 2 Cb 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.10 2jyt h PRO 2 CO 0.00 0.50 0.00 0.00 -0.21 0.00 0.00 178.00 178.29 2jyt n ASP 4 N 4.32 0.03 0.00 0.00 2.03 -1.26 -5.06 116.55 116.60 2jyt n ASP 4 Ca 0.00 0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.32 2jyt n ASP 4 Cb 0.00 -0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2jyt n ASP 4 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2jyt n ASN 5 N -2.54 0.00 -0.82 1.67 5.15 -1.24 -4.94 115.26 112.54 2jyt n ASN 5 Ca 0.00 0.00 0.07 0.00 -0.60 0.00 0.00 54.58 54.05 2jyt n ASN 5 Cb 0.00 0.00 0.20 0.00 -0.53 0.00 0.00 39.78 39.45 2jyt n ASN 5 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 2jyt n VAL 6 N -0.42 1.37 -4.06 3.44 0.24 -1.26 -4.92 118.33 112.72 2jyt n VAL 6 Ca 0.00 -1.22 -0.33 0.00 -2.04 0.00 0.00 64.34 60.75 2jyt n VAL 6 Cb 0.00 0.30 -0.15 0.00 -1.47 0.00 0.00 33.84 32.51 2jyt n VAL 6 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2jyt s SER 7 N -1.20 3.80 -0.14 -1.34 0.15 -1.26 -4.91 113.70 108.79 2jyt s SER 7 Ca 0.31 -0.90 -0.03 0.00 0.70 0.00 0.00 55.95 56.03 2jyt s SER 7 Cb 0.20 -1.55 0.05 0.00 -1.71 0.00 0.00 66.02 63.01 2jyt s SER 7 CO 0.16 -0.08 0.04 -0.55 1.20 0.00 0.00 173.24 174.01 2jyt s SER 8 N 1.25 2.28 0.09 5.45 0.15 -1.26 -4.39 113.70 117.27 2jyt s SER 8 Ca 0.00 -0.51 0.04 0.00 0.70 0.00 0.00 55.95 56.18 2jyt s SER 8 Cb -0.16 -0.42 -0.03 0.00 -1.71 0.00 0.00 66.02 63.70 2jyt s SER 8 CO -0.09 -0.29 -0.11 0.00 1.20 0.00 0.00 173.24 173.96 2jyt s PRO 10 N -2.59 2.50 2.20 0.00 0.04 -1.26 -4.05 135.00 131.83 2jyt s PRO 10 Ca 0.04 -0.63 0.00 0.00 0.04 0.00 0.00 61.00 60.45 2jyt s PRO 10 Cb -0.04 -2.41 0.00 0.00 0.04 0.00 0.00 34.50 32.08 2jyt s PRO 10 CO 0.01 -0.81 0.00 0.43 0.04 0.00 0.00 177.00 176.67 2jyt n SER 11 N -2.47 -2.41 -4.50 6.66 7.64 -1.26 -4.05 113.62 113.24 2jyt n SER 11 Ca 0.08 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.53 2jyt n SER 11 Cb 0.60 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.77 2jyt n SER 11 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2jyt s SER 12 N -4.00 6.51 -0.01 6.43 1.04 -1.26 -4.80 113.70 117.61 2jyt s SER 12 Ca 0.00 -1.63 0.08 0.00 0.48 0.00 0.00 55.95 54.88 2jyt s SER 12 Cb 0.00 -2.47 -0.02 0.00 0.10 0.00 0.00 66.02 63.62 2jyt s SER 12 CO 0.00 -1.31 -0.26 -0.62 0.98 0.00 0.00 173.24 172.03 2jyt s ASP 13 N 4.16 3.03 0.32 7.02 2.15 -1.26 -3.61 116.67 128.48 2jyt s ASP 13 Ca 0.37 -0.48 0.01 0.00 0.43 0.00 0.00 52.55 52.87 2jyt s ASP 13 Cb -0.04 -0.33 -0.03 0.00 -0.30 0.00 0.00 42.92 42.22 2jyt s ASP 13 CO -0.07 0.31 0.51 0.28 -0.17 0.00 0.00 175.17 176.03 2jyt s THR 14 N -0.63 5.13 -0.20 1.71 -1.32 0.18 -4.88 115.64 115.64 2jyt s THR 14 Ca 0.10 -0.52 -0.25 0.00 -1.21 0.00 0.00 61.69 59.81 2jyt s THR 14 Cb -0.10 -3.85 -0.01 0.00 -1.51 0.00 0.00 72.50 67.03 2jyt s THR 14 CO -0.01 -0.49 0.81 0.00 -2.21 0.00 0.00 174.62 172.73 2jyt s GLN 17 N 0.95 4.08 0.31 0.00 0.74 -1.26 -1.06 119.66 123.41 2jyt s GLN 17 Ca 0.11 0.13 -0.16 0.00 0.05 0.00 0.00 55.36 55.49 2jyt s GLN 17 Cb -0.19 -3.61 -0.09 0.00 1.10 0.00 0.00 33.01 30.21 2jyt s GLN 17 CO -0.11 -0.20 0.75 -0.51 -0.55 0.00 0.00 175.29 174.67 2jyt s LEU 18 N 1.83 4.11 0.05 3.68 1.43 -0.33 -4.95 118.68 124.50 2jyt s LEU 18 Ca 0.17 1.34 0.12 0.00 -1.03 0.00 0.00 54.13 54.73 2jyt s LEU 18 Cb -0.15 -4.02 0.54 0.00 0.03 0.00 0.00 46.19 42.59 2jyt s LEU 18 CO 0.09 -0.17 1.39 1.07 0.23 0.00 0.00 176.35 178.96 2jyt n THR 19 N -0.18 1.23 1.28 5.49 5.66 -1.26 -2.06 114.28 124.44 2jyt n THR 19 Ca 0.03 0.33 0.11 0.00 -3.05 0.00 0.00 64.05 61.47 2jyt n THR 19 Cb 0.53 -1.18 0.63 0.00 -1.55 0.00 0.00 70.33 68.75 2jyt n THR 19 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2jyt n SER 20 N -1.63 0.00 -0.83 1.09 2.88 -1.26 -4.86 113.62 109.01 2jyt n SER 20 Ca 0.02 -0.48 0.00 0.00 -1.33 0.00 0.00 58.87 57.08 2jyt n SER 20 Cb 0.13 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 2jyt n SER 20 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jyt n GLY 21 N 0.45 0.57 3.41 0.46 0.00 -0.87 -5.10 105.19 104.10 2jyt n GLY 21 Ca 0.15 -0.37 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 2jyt n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jyt s GLU 22 N -2.69 0.80 -0.21 1.61 2.12 -1.21 -5.04 118.70 114.07 2jyt s GLU 22 Ca 0.00 0.28 -0.05 0.00 0.36 0.00 0.00 54.97 55.56 2jyt s GLU 22 Cb 0.00 0.37 -0.02 0.00 0.26 0.00 0.00 34.13 34.74 2jyt s GLU 22 CO 0.00 -0.20 0.01 -1.58 -0.54 0.00 0.00 175.26 172.95 2jyt s TRP 23 N -0.75 3.04 -0.00 5.30 0.52 -1.26 -1.19 118.94 124.60 2jyt s TRP 23 Ca -0.08 -0.49 0.02 0.00 0.02 0.00 0.00 56.10 55.57 2jyt s TRP 23 Cb -0.03 -2.12 -0.01 0.00 -1.15 0.00 0.00 33.47 30.17 2jyt s TRP 23 CO 0.05 -0.29 -0.07 0.20 0.02 0.00 0.00 176.95 176.86 2jyt s GLY 24 N 1.16 0.35 0.25 0.98 0.00 -0.23 -4.77 107.32 105.07 2jyt s GLY 24 Ca 0.03 -0.34 -0.19 0.00 0.00 0.00 0.00 44.72 44.22 2jyt s GLY 24 CO 0.02 -0.30 0.74 0.00 0.00 0.00 0.00 173.10 173.56 2jyt s PRO 27 N -2.25 3.81 0.82 0.00 0.04 -1.26 -0.65 135.00 135.52 2jyt s PRO 27 Ca -0.08 2.20 -0.14 0.00 0.04 0.00 0.00 61.00 63.02 2jyt s PRO 27 Cb -0.04 -4.17 0.01 0.00 0.04 0.00 0.00 34.50 30.34 2jyt s PRO 27 CO -0.03 -1.31 0.61 0.44 0.04 0.00 0.00 177.00 176.75 2jyt n ILE 28 N 6.29 1.24 -1.34 0.56 -5.35 -1.24 -4.83 119.36 114.70 2jyt n ILE 28 Ca 0.22 -0.29 -0.24 0.00 -0.27 0.00 0.00 62.75 62.16 2jyt n ILE 28 Cb 0.43 -0.79 -0.09 0.00 -1.74 0.00 0.00 39.64 37.46 2jyt n ILE 28 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 2jyt n PRO 29 N -1.52 2.69 -3.36 6.28 -0.02 -1.26 -4.69 135.00 133.13 2jyt n PRO 29 Ca 0.10 -1.95 -0.19 0.00 -2.02 0.00 0.00 63.50 59.44 2jyt n PRO 29 Cb 0.51 -2.23 0.06 0.00 -0.02 0.00 0.00 33.50 31.82 2jyt n PRO 29 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2jyt n GLU 30 N 1.96 -2.15 -2.13 -0.52 4.71 -1.26 -5.00 120.64 116.25 2jyt n GLU 30 Ca 0.52 0.77 -0.27 0.00 -0.01 0.00 0.00 57.16 58.17 2jyt n GLU 30 Cb 0.61 -5.42 0.09 0.00 -1.01 0.00 0.00 31.44 25.71 2jyt n GLU 30 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2jyt s ALA 31 N -3.41 2.98 -0.09 0.62 0.00 -1.26 -5.07 121.76 115.54 2jyt s ALA 31 Ca 0.45 -0.96 -0.14 0.00 0.00 0.00 0.00 51.96 51.31 2jyt s ALA 31 Cb -0.08 -2.65 -0.05 0.00 0.00 0.00 0.00 23.12 20.33 2jyt s ALA 31 CO 0.77 -1.52 0.35 0.54 0.00 0.00 0.00 175.76 175.89 2jyt s VAL 32 N -3.38 5.21 -0.19 0.00 0.11 -1.26 -5.07 120.40 115.81 2jyt s VAL 32 Ca 0.63 0.68 -0.04 0.00 -2.93 0.00 0.00 61.98 60.31 2jyt s VAL 32 Cb -0.10 -3.66 0.08 0.00 -1.53 0.00 0.00 36.38 31.17 2jyt s VAL 32 CO 0.47 0.48 0.16 0.00 -3.33 0.00 0.00 175.10 172.88 2jyt n SER 35 N -1.67 0.50 -1.23 0.00 3.41 -1.26 -4.19 113.62 109.18 2jyt n SER 35 Ca 0.01 -0.39 -0.16 0.00 -0.26 0.00 0.00 58.87 58.07 2jyt n SER 35 Cb 0.57 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.45 2jyt n SER 35 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2jyt n ASP 36 N -0.99 -4.96 0.00 4.04 -0.08 -1.26 -4.83 116.55 108.47 2jyt n ASP 36 Ca 0.00 0.40 0.00 0.00 -1.51 0.00 0.00 54.79 53.68 2jyt n ASP 36 Cb 0.00 -3.88 0.00 0.00 2.34 0.00 0.00 41.12 39.58 2jyt n ASP 36 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jyt n HIS 37 N -2.52 0.00 -0.75 -0.67 1.44 -1.26 -4.97 115.22 106.48 2jyt n HIS 37 Ca -0.16 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.47 2jyt n HIS 37 Cb 0.53 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.61 2jyt n HIS 37 CO 0.00 0.00 0.00 0.94 -2.81 0.00 0.00 176.34 174.47 2jyt n GLN 38 N 0.00 1.47 0.00 -1.40 -0.06 -1.26 -4.96 117.38 111.17 2jyt n GLN 38 Ca 0.00 -0.68 0.00 0.00 -2.00 0.00 0.00 57.00 54.32 2jyt n GLN 38 Cb 0.00 -1.42 0.00 0.00 -4.06 0.00 0.00 30.24 24.76 2jyt n GLN 38 CO 0.00 0.00 0.00 1.58 -0.20 0.00 0.00 177.06 178.44 2jyt n HIS 39 N 1.45 0.00 -1.72 3.69 -0.00 -1.26 -4.65 115.22 112.74 2jyt n HIS 39 Ca 0.19 0.00 -0.40 0.00 0.46 0.00 0.00 57.72 57.97 2jyt n HIS 39 Cb 0.61 0.00 0.02 0.00 -0.12 0.00 0.00 29.99 30.50 2jyt n HIS 39 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2jyt s PRO 42 N -2.59 2.22 -0.02 0.00 0.04 -1.26 -4.82 135.00 128.57 2jyt s PRO 42 Ca 0.37 1.97 -0.35 0.00 0.04 0.00 0.00 61.00 63.04 2jyt s PRO 42 Cb -0.13 -1.82 -0.13 0.00 0.04 0.00 0.00 34.50 32.46 2jyt s PRO 42 CO 0.27 -1.83 1.73 0.94 0.04 0.00 0.00 177.00 178.15 2jyt n GLN 43 N -2.39 1.98 0.00 4.56 0.00 -1.26 -2.94 117.38 117.33 2jyt n GLN 43 Ca 0.15 0.72 0.00 0.00 -0.00 0.00 0.00 57.00 57.87 2jyt n GLN 43 Cb 0.49 -2.51 0.00 0.00 0.00 0.00 0.00 30.24 28.22 2jyt n GLN 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jyt n GLY 44 N 3.93 3.35 3.94 1.69 0.00 -1.26 -5.10 105.19 111.74 2jyt n GLY 44 Ca 0.21 -0.80 -0.24 0.00 0.00 0.00 0.00 46.02 45.19 2jyt n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jyt s TYR 45 N 0.00 3.18 0.24 1.61 2.02 -1.15 -4.77 117.35 118.48 2jyt s TYR 45 Ca 0.00 0.33 0.01 0.00 -0.37 0.00 0.00 57.07 57.04 2jyt s TYR 45 Cb 0.00 -2.51 -0.03 0.00 -0.40 0.00 0.00 41.96 39.02 2jyt s TYR 45 CO 0.00 -0.58 0.20 -0.08 -1.57 0.00 0.00 175.55 173.52 2jyt s THR 46 N -2.72 0.00 0.27 -0.71 -1.32 -0.16 -4.80 115.64 106.20 2jyt s THR 46 Ca 0.51 -1.96 -0.20 0.00 -1.21 0.00 0.00 61.69 58.83 2jyt s THR 46 Cb -0.10 -2.49 -0.09 0.00 -1.51 0.00 0.00 72.50 68.31 2jyt s THR 46 CO 0.40 0.00 0.77 0.00 -2.21 0.00 0.00 174.62 173.59 2jyt n VAL 48 N 0.45 0.00 -0.28 0.00 0.24 -1.22 -4.89 118.33 112.63 2jyt n VAL 48 Ca -0.00 -1.02 0.09 0.00 -2.04 0.00 0.00 64.34 61.37 2jyt n VAL 48 Cb 0.51 0.43 0.23 0.00 -1.47 0.00 0.00 33.84 33.55 2jyt n VAL 48 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jyt h ALA 49 N 1.36 1.10 -2.47 2.33 0.00 -1.98 -3.41 119.26 116.18 2jyt h ALA 49 Ca -0.12 0.21 -0.47 0.00 0.00 0.00 0.00 54.91 54.53 2jyt h ALA 49 Cb 0.51 0.30 0.12 0.00 0.00 0.00 0.00 17.79 18.72 2jyt h ALA 49 CO 0.18 -0.41 0.33 -1.21 0.00 0.00 0.00 179.25 178.14 2jyt s GLU 50 N -6.00 1.65 -0.04 0.00 8.01 -1.26 -4.92 118.70 116.14 2jyt s GLU 50 Ca -0.12 0.41 0.01 0.00 0.01 0.00 0.00 54.97 55.27 2jyt s GLU 50 Cb 0.24 -1.89 0.08 0.00 -4.31 0.00 0.00 34.13 28.25 2jyt s GLU 50 CO 0.76 -1.87 0.99 0.41 0.01 0.00 0.00 175.26 175.56 2jyt n GLY 51 N -2.31 2.12 3.61 -1.39 0.00 -1.26 -4.83 105.19 101.13 2jyt n GLY 51 Ca 0.07 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.69 2jyt n GLY 51 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jyt s GLN 52 N -0.55 2.01 -0.12 1.61 -0.21 -1.26 -4.78 119.66 116.36 2jyt s GLN 52 Ca 0.06 -2.24 -0.02 0.00 0.02 0.00 0.00 55.36 53.19 2jyt s GLN 52 Cb 0.05 -1.05 -0.03 0.00 1.00 0.00 0.00 33.01 32.99 2jyt s GLN 52 CO 0.01 -0.38 -0.05 0.00 -2.12 0.00 0.00 175.29 172.75 2jyt s GLN 54 N -0.17 2.42 0.00 0.00 2.00 -0.19 -4.81 119.66 118.91 2jyt s GLN 54 Ca 0.03 -1.28 0.13 0.00 -2.00 0.00 0.00 55.36 52.23 2jyt s GLN 54 Cb -0.13 -2.27 0.78 0.00 0.80 0.00 0.00 33.01 32.19 2jyt s GLN 54 CO 0.03 0.39 1.21 1.17 -0.50 0.00 0.00 175.29 177.58