#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yti s SER 2 N 0.00 -0.46 -0.23 1.61 1.04 -1.26 -5.18 113.70 109.23 2yti s SER 2 Ca 0.00 0.81 -0.26 0.00 0.48 0.00 0.00 55.95 56.98 2yti s SER 2 Cb 0.00 0.79 0.08 0.00 0.10 0.00 0.00 66.02 66.99 2yti s SER 2 CO 0.00 -0.20 0.75 -0.94 0.98 0.00 0.00 173.24 173.82 2yti s SER 3 N -0.05 -0.70 -0.30 7.02 1.04 -1.26 -5.15 113.70 114.31 2yti s SER 3 Ca 0.02 1.26 -0.05 0.00 0.48 0.00 0.00 55.95 57.66 2yti s SER 3 Cb -0.04 1.25 0.19 0.00 0.10 0.00 0.00 66.02 67.51 2yti s SER 3 CO -0.04 -0.30 0.84 -0.83 0.98 0.00 0.00 173.24 173.89 2yti s GLY 4 N 0.09 -0.89 0.00 7.32 0.00 -1.26 -5.04 107.32 107.54 2yti s GLY 4 Ca -0.01 1.94 0.00 0.00 0.00 0.00 0.00 44.72 46.65 2yti s GLY 4 CO 0.02 3.79 0.00 -1.26 0.00 0.00 0.00 173.10 175.65 2yti n SER 5 N 5.34 1.24 -4.14 1.64 2.88 -1.26 -5.03 113.62 114.29 2yti n SER 5 Ca 0.02 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.23 2yti n SER 5 Cb 0.55 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.98 2yti n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2yti n SER 6 N -2.68 -2.47 0.00 -3.46 7.64 -1.26 -4.73 113.62 106.65 2yti n SER 6 Ca 0.00 -1.01 0.00 0.00 1.01 0.00 0.00 58.87 58.87 2yti n SER 6 Cb 0.41 -2.86 0.00 0.00 -1.01 0.00 0.00 64.21 60.75 2yti n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yti n GLY 7 N -1.61 3.95 3.15 0.23 0.00 -1.26 -5.15 105.19 104.51 2yti n GLY 7 Ca -0.04 -0.94 -0.22 0.00 0.00 0.00 0.00 46.02 44.82 2yti n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yti s THR 8 N 0.00 1.21 0.00 2.61 2.01 -1.26 -5.11 115.64 115.10 2yti s THR 8 Ca 0.00 -0.90 0.00 0.00 0.31 0.00 0.00 61.69 61.10 2yti s THR 8 Cb 0.00 -1.06 0.00 0.00 0.01 0.00 0.00 72.50 71.45 2yti s THR 8 CO 0.00 0.14 0.00 0.61 -0.69 0.00 0.00 174.62 174.68 2yti n GLY 9 N 2.17 3.90 3.01 4.40 0.00 -1.26 -5.13 105.19 112.28 2yti n GLY 9 Ca -0.17 -1.60 -0.17 0.00 0.00 0.00 0.00 46.02 44.08 2yti n GLY 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2yti s GLU 10 N -3.71 0.64 0.29 1.61 -1.05 -1.26 -5.16 118.70 110.06 2yti s GLU 10 Ca 0.00 -0.34 0.11 0.00 -0.15 0.00 0.00 54.97 54.58 2yti s GLU 10 Cb 0.00 -0.60 -0.05 0.00 -0.44 0.00 0.00 34.13 33.04 2yti s GLU 10 CO 0.00 0.16 -0.11 0.15 0.95 0.00 0.00 175.26 176.42 2yti s LYS 11 N -0.35 1.92 0.00 -4.83 3.01 -1.26 -5.01 119.74 113.22 2yti s LYS 11 Ca 0.02 -1.69 0.15 0.00 -1.01 0.00 0.00 55.97 53.44 2yti s LYS 11 Cb -0.04 -1.89 0.82 0.00 -1.01 0.00 0.00 37.83 35.71 2yti s LYS 11 CO -0.00 0.29 1.38 -0.35 0.51 0.00 0.00 175.35 177.17 2yti n PRO 12 N -0.76 0.33 -3.89 -1.68 -0.04 -1.26 -4.25 135.00 123.44 2yti n PRO 12 Ca -0.05 0.08 -0.32 0.00 -0.04 0.00 0.00 63.50 63.17 2yti n PRO 12 Cb 0.60 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.44 2yti n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2yti s TYR 13 N -2.33 3.38 -0.06 0.54 1.51 -1.26 -5.06 117.35 114.08 2yti s TYR 13 Ca 0.18 -2.96 -0.01 0.00 -1.01 0.00 0.00 57.07 53.27 2yti s TYR 13 Cb 0.10 -2.97 0.03 0.00 -0.11 0.00 0.00 41.96 39.00 2yti s TYR 13 CO 0.20 -0.83 -0.01 0.21 -1.11 0.00 0.00 175.55 174.02 2yti s LYS 14 N 0.11 0.58 0.72 -0.62 2.20 -1.26 -0.24 119.74 121.23 2yti s LYS 14 Ca 0.15 0.07 -0.15 0.00 -0.36 0.00 0.00 55.97 55.67 2yti s LYS 14 Cb -0.23 -0.84 0.03 0.00 -1.51 0.00 0.00 37.83 35.28 2yti s LYS 14 CO -0.03 -0.22 1.22 0.00 -0.36 0.00 0.00 175.35 175.96 2yti n ASN 16 N -2.61 1.40 0.23 0.00 3.02 -1.26 -3.30 115.26 112.73 2yti n ASN 16 Ca 0.14 -0.02 -0.16 0.00 -0.03 0.00 0.00 54.58 54.51 2yti n ASN 16 Cb 0.50 0.70 -0.08 0.00 -0.61 0.00 0.00 39.78 40.29 2yti n ASN 16 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2yti h GLU 17 N 0.00 -0.78 0.00 3.52 3.07 -1.99 -3.38 114.58 115.03 2yti h GLU 17 Ca -0.42 0.05 -0.35 0.00 -0.50 0.00 0.00 59.36 58.14 2yti h GLU 17 Cb 1.91 0.18 -0.05 0.00 -0.84 0.00 0.00 28.75 29.94 2yti h GLU 17 CO 0.01 -0.52 -2.19 0.00 -1.40 0.00 0.00 179.01 174.91 2yti n GLY 19 N 1.83 1.63 3.90 0.00 0.00 -1.21 -5.08 105.19 106.26 2yti n GLY 19 Ca -0.41 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.33 2yti n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yti s LYS 20 N -0.02 3.51 0.09 1.61 2.20 -1.25 -4.77 119.74 121.11 2yti s LYS 20 Ca 0.00 0.30 0.09 0.00 -0.36 0.00 0.00 55.97 56.01 2yti s LYS 20 Cb 0.00 -2.31 -0.03 0.00 -1.51 0.00 0.00 37.83 33.98 2yti s LYS 20 CO 0.00 -0.31 -0.24 0.08 -0.36 0.00 0.00 175.35 174.51 2yti s VAL 21 N -2.85 1.99 0.18 4.02 1.01 -1.26 0.61 120.40 124.10 2yti s VAL 21 Ca 0.49 -1.53 -0.02 0.00 0.00 0.00 0.00 61.98 60.92 2yti s VAL 21 Cb -0.10 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 2yti s VAL 21 CO 0.47 0.13 0.13 -0.36 0.00 0.00 0.00 175.10 175.47 2yti s PHE 22 N -0.99 0.97 -0.23 5.22 0.08 0.67 -4.99 117.98 118.71 2yti s PHE 22 Ca 0.10 -1.26 0.04 0.00 0.12 0.00 0.00 56.93 55.94 2yti s PHE 22 Cb -0.10 -0.46 -0.19 0.00 -0.57 0.00 0.00 43.02 41.70 2yti s PHE 22 CO 0.04 -0.62 -0.10 2.41 -0.10 0.00 0.00 175.22 176.85 2yti n THR 23 N -0.21 1.51 -4.11 0.64 -1.04 -1.26 -4.28 114.28 105.53 2yti n THR 23 Ca -0.01 -0.63 -0.23 0.00 -2.04 0.00 0.00 64.05 61.14 2yti n THR 23 Cb 0.65 -1.29 -0.06 0.00 -1.82 0.00 0.00 70.33 67.80 2yti n THR 23 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2yti s GLN 24 N -2.52 2.46 0.04 -2.82 2.00 -1.26 -4.92 119.66 112.64 2yti s GLN 24 Ca -0.29 -1.43 -0.21 0.00 -2.00 0.00 0.00 55.36 51.43 2yti s GLN 24 Cb 0.08 -2.26 -0.14 0.00 0.80 0.00 0.00 33.01 31.50 2yti s GLN 24 CO 0.66 0.20 1.41 -2.95 -0.50 0.00 0.00 175.29 174.11 2yti h ASN 25 N 1.58 0.28 0.40 6.67 7.08 -2.00 -3.15 115.58 126.44 2yti h ASN 25 Ca -0.44 -0.40 -0.01 0.00 -3.08 0.00 0.00 56.30 52.37 2yti h ASN 25 Cb 1.25 -0.08 -0.02 0.00 -2.08 0.00 0.00 38.32 37.39 2yti h ASN 25 CO 0.62 0.61 -0.47 0.28 -2.08 0.00 0.00 177.43 176.39 2yti h SER 26 N -0.06 -1.32 -1.45 6.14 0.02 -1.98 0.16 113.55 115.06 2yti h SER 26 Ca 0.03 0.11 0.45 0.00 -0.84 0.00 0.00 61.79 61.55 2yti h SER 26 Cb 0.50 0.44 -0.11 0.00 0.14 0.00 0.00 62.40 63.37 2yti h SER 26 CO 0.02 -0.60 0.97 0.45 -1.14 0.00 0.00 176.83 176.53 2yti h HIS 27 N -0.89 0.37 0.04 3.45 3.86 -1.99 0.15 115.15 120.13 2yti h HIS 27 Ca -0.05 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2yti h HIS 27 Cb 0.79 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 29.17 2yti h HIS 27 CO -0.28 -0.14 -0.02 1.25 0.86 0.00 0.00 177.93 179.61 2yti h LEU 28 N 0.07 -0.04 -0.80 2.43 5.85 -1.21 -3.07 115.31 118.53 2yti h LEU 28 Ca 0.82 0.00 0.18 0.00 0.84 0.00 0.00 57.88 59.72 2yti h LEU 28 Cb 2.78 0.01 -0.15 0.00 0.37 0.00 0.00 40.66 43.68 2yti h LEU 28 CO -0.29 0.35 -0.09 0.00 -0.34 0.00 0.00 178.44 178.06 2yti h ALA 29 N -1.22 0.70 -0.98 1.25 0.00 0.56 0.48 119.26 120.04 2yti h ALA 29 Ca -0.00 0.29 0.04 0.00 0.00 0.00 0.00 54.91 55.23 2yti h ALA 29 Cb 0.04 0.53 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 2yti h ALA 29 CO 0.01 -0.43 0.64 0.07 0.00 0.00 0.00 179.25 179.54 2yti h ARG 30 N 0.04 1.18 -0.13 0.00 0.11 -0.92 -2.57 114.38 112.09 2yti h ARG 30 Ca 0.42 -0.07 -0.01 0.00 0.10 0.00 0.00 59.98 60.42 2yti h ARG 30 Cb 0.71 -0.27 -0.01 0.00 1.11 0.00 0.00 29.97 31.52 2yti h ARG 30 CO -0.77 0.78 0.06 1.25 0.10 0.00 0.00 179.97 181.39 2yti h HIS 31 N 1.22 0.20 -0.25 4.08 2.76 -0.01 -2.29 115.15 120.87 2yti h HIS 31 Ca 0.39 -0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.62 2yti h HIS 31 Cb 0.03 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 28.92 2yti h HIS 31 CO -0.00 0.28 0.76 0.00 -1.30 0.00 0.00 177.93 177.67 2yti h ARG 32 N 0.07 0.00 -0.94 5.26 3.08 -0.76 0.25 114.38 121.34 2yti h ARG 32 Ca 0.05 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.14 2yti h ARG 32 Cb 0.16 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.15 2yti h ARG 32 CO -0.00 0.00 0.62 0.78 -1.07 0.00 0.00 179.97 180.29 2yti h GLY 33 N 0.00 1.38 1.30 0.04 0.00 -1.43 -0.78 103.07 103.59 2yti h GLY 33 Ca 0.12 -0.46 0.04 0.00 0.00 0.00 0.00 47.33 47.03 2yti h GLY 33 CO -0.00 0.36 0.32 0.16 0.00 0.00 0.00 176.54 177.38 2yti h ILE 34 N 1.14 0.15 0.08 2.60 3.07 -0.68 -1.06 117.51 122.82 2yti h ILE 34 Ca 0.39 0.00 -0.33 0.00 1.55 0.00 0.00 64.86 66.47 2yti h ILE 34 Cb 0.09 0.71 -0.02 0.00 -0.27 0.00 0.00 36.82 37.33 2yti h ILE 34 CO -0.13 0.00 -1.82 1.41 -1.05 0.00 0.00 178.15 176.55 2yti n HIS 35 N -3.22 1.13 -3.81 0.16 8.25 -0.33 -3.74 115.22 113.66 2yti n HIS 35 Ca 0.01 0.30 -0.30 0.00 -0.26 0.00 0.00 57.72 57.47 2yti n HIS 35 Cb 0.41 -1.14 -0.15 0.00 1.12 0.00 0.00 29.99 30.23 2yti n HIS 35 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2yti s THR 36 N -2.50 1.42 0.00 1.59 -1.32 -0.42 -4.97 115.64 109.44 2yti s THR 36 Ca -0.25 -1.96 0.00 0.00 -1.21 0.00 0.00 61.69 58.27 2yti s THR 36 Cb 0.07 -2.05 0.00 0.00 -1.51 0.00 0.00 72.50 69.01 2yti s THR 36 CO 0.71 -0.71 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 2yti n GLY 37 N 4.36 0.86 3.56 6.08 0.00 -1.12 -4.57 105.19 114.36 2yti n GLY 37 Ca 0.02 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 2yti n GLY 37 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yti s GLU 38 N 0.00 3.22 0.25 1.61 -6.30 -1.21 -4.96 118.70 111.31 2yti s GLU 38 Ca 0.00 0.16 -0.18 0.00 -2.50 0.00 0.00 54.97 52.45 2yti s GLU 38 Cb 0.00 -4.15 -0.12 0.00 0.00 0.00 0.00 34.13 29.85 2yti s GLU 38 CO 0.00 -2.06 0.20 1.63 0.02 0.00 0.00 175.26 175.05 2yti n LYS 39 N 8.96 0.00 -1.04 4.30 4.76 -1.26 -4.33 118.16 129.55 2yti n LYS 39 Ca 0.09 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.23 2yti n LYS 39 Cb 0.49 -0.77 0.25 0.00 -1.84 0.00 0.00 35.03 33.17 2yti n LYS 39 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2yti n PRO 40 N 0.92 -3.16 -3.35 1.97 -0.04 -1.25 -4.97 135.00 125.13 2yti n PRO 40 Ca 0.11 -1.75 -0.04 0.00 -0.04 0.00 0.00 63.50 61.77 2yti n PRO 40 Cb 0.26 -1.64 -0.06 0.00 -0.04 0.00 0.00 33.50 32.02 2yti n PRO 40 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2yti s SER 41 N -4.46 -0.48 0.00 3.54 0.01 -1.26 -5.14 113.70 105.91 2yti s SER 41 Ca 0.71 0.66 0.00 0.00 1.31 0.00 0.00 55.95 58.63 2yti s SER 41 Cb -0.07 1.60 0.00 0.00 0.21 0.00 0.00 66.02 67.76 2yti s SER 41 CO 0.55 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.54 2yti n GLY 42 N 5.40 0.13 0.23 3.44 0.00 -1.26 -4.90 105.19 108.22 2yti n GLY 42 Ca -0.04 -1.43 0.16 0.00 0.00 0.00 0.00 46.02 44.71 2yti n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yti h PRO 43 N 0.00 0.00 -6.96 1.61 0.13 -2.08 -3.46 132.00 121.24 2yti h PRO 43 Ca 0.00 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.54 2yti h PRO 43 Cb 0.00 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 30.87 2yti h PRO 43 CO 0.00 0.00 -0.90 -1.13 -0.23 0.00 0.00 178.00 175.74 2yti n SER 44 N -2.79 -1.50 -4.34 1.44 3.41 -1.26 -4.93 113.62 103.66 2yti n SER 44 Ca 0.01 -1.16 -0.21 0.00 -0.26 0.00 0.00 58.87 57.25 2yti n SER 44 Cb 0.27 -2.12 -0.11 0.00 -0.26 0.00 0.00 64.21 61.99 2yti n SER 44 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2yti s SER 45 N -3.64 2.69 0.00 4.04 0.15 -1.26 -5.22 113.70 110.46 2yti s SER 45 Ca 0.53 -0.88 0.00 0.00 0.70 0.00 0.00 55.95 56.30 2yti s SER 45 Cb -0.30 -0.16 0.00 0.00 -1.71 0.00 0.00 66.02 63.85 2yti s SER 45 CO 0.98 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.98