#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 3.51 -1.37 1.61 1.04 -1.26 -4.67 113.70 112.56 2yti s SER 2 Ca 0.00 -0.47 -0.07 0.00 0.48 0.00 0.00 55.95 55.89 2yti s SER 2 Cb 0.00 -1.51 0.03 0.00 0.10 0.00 0.00 66.02 64.64 2yti s SER 2 CO 0.00 0.14 0.98 -1.20 0.98 0.00 0.00 173.24 174.14 2yti n SER 3 N 3.69 -3.86 -4.91 7.02 7.64 -1.26 -4.98 113.62 116.96 2yti n SER 3 Ca -0.19 -0.69 -0.29 0.00 1.01 0.00 0.00 58.87 58.71 2yti n SER 3 Cb 0.52 -4.50 -0.04 0.00 -1.01 0.00 0.00 64.21 59.19 2yti n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yti s GLY 4 N -3.77 1.95 -0.04 0.23 0.00 -1.26 -5.11 107.32 99.33 2yti s GLY 4 Ca 0.36 -0.68 -0.04 0.00 0.00 0.00 0.00 44.72 44.36 2yti s GLY 4 CO 0.78 -0.61 0.10 -0.56 0.00 0.00 0.00 173.10 172.81 2yti s SER 5 N -2.93 -0.10 -0.21 1.64 0.01 -1.26 -5.07 113.70 105.78 2yti s SER 5 Ca 0.41 0.19 -0.17 0.00 1.31 0.00 0.00 55.95 57.69 2yti s SER 5 Cb -0.11 0.21 -0.13 0.00 0.21 0.00 0.00 66.02 66.20 2yti s SER 5 CO 0.28 -0.04 -0.07 -0.24 0.41 0.00 0.00 173.24 173.58 2yti n SER 6 N 2.98 1.89 0.00 2.44 2.88 -1.26 -5.12 113.62 117.43 2yti n SER 6 Ca -0.13 0.43 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 2yti n SER 6 Cb 0.59 -0.89 0.00 0.00 -0.75 0.00 0.00 64.21 63.16 2yti n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yti n GLY 7 N 1.42 1.15 3.63 0.46 0.00 -1.26 -5.11 105.19 105.48 2yti n GLY 7 Ca -0.32 -2.11 -0.27 0.00 0.00 0.00 0.00 46.02 43.31 2yti n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2yti s THR 8 N -1.10 3.58 0.00 2.61 -4.23 -1.26 -4.94 115.64 110.29 2yti s THR 8 Ca 0.00 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 2yti s THR 8 Cb 0.00 -2.76 0.00 0.00 1.34 0.00 0.00 72.50 71.08 2yti s THR 8 CO 0.00 -0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.64 2yti n GLY 9 N 0.12 -2.87 3.80 3.99 0.00 -1.26 -5.09 105.19 103.88 2yti n GLY 9 Ca -0.11 -0.36 -0.22 0.00 0.00 0.00 0.00 46.02 45.33 2yti n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yti s GLU 10 N -0.74 2.70 0.01 1.61 0.41 -1.26 -5.13 118.70 116.29 2yti s GLU 10 Ca 0.00 -1.26 0.08 0.00 -0.41 0.00 0.00 54.97 53.39 2yti s GLU 10 Cb 0.00 -2.43 -0.02 0.00 -1.78 0.00 0.00 34.13 29.90 2yti s GLU 10 CO 0.00 0.24 -0.26 0.15 -0.49 0.00 0.00 175.26 174.91 2yti s LYS 11 N -3.88 1.94 0.00 1.61 3.01 -1.26 -5.01 119.74 116.15 2yti s LYS 11 Ca 0.36 -1.00 0.15 0.00 -1.01 0.00 0.00 55.97 54.48 2yti s LYS 11 Cb -0.06 -1.98 0.85 0.00 -1.01 0.00 0.00 37.83 35.63 2yti s LYS 11 CO 0.25 0.53 1.37 -0.35 0.51 0.00 0.00 175.35 177.65 2yti n PRO 12 N 2.14 0.37 -1.74 -1.68 -0.04 -1.26 -3.26 135.00 129.53 2yti n PRO 12 Ca -0.16 0.06 -0.36 0.00 -0.04 0.00 0.00 63.50 63.00 2yti n PRO 12 Cb 0.52 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.53 2yti n PRO 12 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2yti n TYR 13 N -1.12 3.10 -3.41 0.54 4.02 -1.26 -4.97 117.16 114.06 2yti n TYR 13 Ca 0.10 -2.66 -0.38 0.00 -0.01 0.00 0.00 57.90 54.95 2yti n TYR 13 Cb 0.08 -1.15 -0.08 0.00 -0.02 0.00 0.00 39.34 38.17 2yti n TYR 13 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 2yti s LYS 14 N -3.91 4.16 0.46 -0.72 2.20 -1.20 -2.48 119.74 118.24 2yti s LYS 14 Ca 0.57 0.16 -0.24 0.00 -0.36 0.00 0.00 55.97 56.10 2yti s LYS 14 Cb 0.46 -3.54 -0.07 0.00 -1.51 0.00 0.00 37.83 33.16 2yti s LYS 14 CO -0.21 -0.05 1.26 0.00 -0.36 0.00 0.00 175.35 175.99 2yti n ASN 16 N -0.36 0.12 0.11 0.00 3.02 -1.26 -2.56 115.26 114.33 2yti n ASN 16 Ca 0.06 0.05 -0.13 0.00 -0.03 0.00 0.00 54.58 54.53 2yti n ASN 16 Cb 0.46 1.36 -0.08 0.00 -0.61 0.00 0.00 39.78 40.91 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 -0.19 0.00 3.52 3.07 -1.98 -3.39 114.58 115.61 2yti h GLU 17 Ca -0.24 0.01 -0.15 0.00 -0.50 0.00 0.00 59.36 58.49 2yti h GLU 17 Cb 1.56 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 29.49 2yti h GLU 17 CO 0.02 -0.10 -1.52 0.00 -1.40 0.00 0.00 179.01 176.01 2yti n GLY 19 N 2.61 1.78 3.90 0.00 0.00 -1.06 -5.07 105.19 107.36 2yti n GLY 19 Ca -0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 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 0.00 2.58 0.09 1.61 2.20 -1.24 -4.73 119.74 120.25 2yti s LYS 20 Ca 0.00 0.21 0.05 0.00 -0.36 0.00 0.00 55.97 55.87 2yti s LYS 20 Cb 0.00 -2.07 -0.03 0.00 -1.51 0.00 0.00 37.83 34.22 2yti s LYS 20 CO 0.00 -1.13 -0.14 0.08 -0.36 0.00 0.00 175.35 173.80 2yti s VAL 21 N -3.33 1.15 0.21 4.02 1.01 -1.26 0.63 120.40 122.84 2yti s VAL 21 Ca 0.58 -1.45 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 2yti s VAL 21 Cb -0.11 -1.23 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 2yti s VAL 21 CO 0.49 -0.31 0.39 -0.36 0.00 0.00 0.00 175.10 175.31 2yti s PHE 22 N -1.64 0.39 -0.25 5.22 0.40 -1.03 -4.99 117.98 116.08 2yti s PHE 22 Ca 0.02 -0.74 -0.02 0.00 -0.60 0.00 0.00 56.93 55.59 2yti s PHE 22 Cb -0.08 0.07 -0.15 0.00 0.51 0.00 0.00 43.02 43.37 2yti s PHE 22 CO 0.02 -0.87 -0.25 2.41 0.70 0.00 0.00 175.22 177.23 2yti n THR 23 N -0.32 1.42 -4.17 0.64 -1.04 -1.26 -4.37 114.28 105.19 2yti n THR 23 Ca -0.04 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.05 61.13 2yti n THR 23 Cb 0.63 -1.50 -0.08 0.00 -1.82 0.00 0.00 70.33 67.56 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 -2.49 3.10 0.09 -2.82 2.00 -1.26 -4.96 119.66 113.31 2yti s GLN 24 Ca -0.34 -0.39 -0.29 0.00 -2.00 0.00 0.00 55.36 52.34 2yti s GLN 24 Cb 0.10 -2.89 -0.12 0.00 0.80 0.00 0.00 33.01 30.90 2yti s GLN 24 CO 0.54 0.69 1.46 -0.97 -0.50 0.00 0.00 175.29 176.51 2yti h ASN 25 N 4.67 -1.34 -1.00 6.67 -1.24 -1.98 -2.49 115.58 118.87 2yti h ASN 25 Ca -0.51 0.14 0.13 0.00 0.71 0.00 0.00 56.30 56.77 2yti h ASN 25 Cb 1.19 0.50 -0.14 0.00 0.73 0.00 0.00 38.32 40.60 2yti h ASN 25 CO 0.58 -0.46 -0.47 -1.54 -1.29 0.00 0.00 177.43 174.26 2yti n SER 26 N -4.96 -0.80 -0.34 1.15 3.41 -1.26 0.14 113.62 110.95 2yti n SER 26 Ca -0.07 1.75 0.21 0.00 -0.26 0.00 0.00 58.87 60.50 2yti n SER 26 Cb 0.34 -0.33 0.46 0.00 -0.26 0.00 0.00 64.21 64.41 2yti n SER 26 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 2yti h HIS 27 N 0.00 0.84 0.11 7.33 3.86 -1.88 0.21 115.15 125.62 2yti h HIS 27 Ca 0.27 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.51 2yti h HIS 27 Cb 0.52 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.75 2yti h HIS 27 CO -0.93 0.03 -0.05 1.25 0.86 0.00 0.00 177.93 179.08 2yti h LEU 28 N 0.46 -0.13 -0.49 2.43 5.85 0.15 -3.03 115.31 120.56 2yti h LEU 28 Ca 0.64 -0.33 0.10 0.00 0.84 0.00 0.00 57.88 59.13 2yti h LEU 28 Cb 1.44 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 42.41 2yti h LEU 28 CO -0.41 0.48 -0.19 0.00 -0.34 0.00 0.00 178.44 177.98 2yti h ALA 29 N -0.56 0.19 -0.57 1.25 0.00 0.24 0.22 119.26 120.03 2yti h ALA 29 Ca -0.02 0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.15 2yti h ALA 29 Cb 0.45 0.49 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 2yti h ALA 29 CO 0.03 -0.52 0.38 0.07 0.00 0.00 0.00 179.25 179.21 2yti h ARG 30 N -0.08 0.44 -0.00 0.00 0.11 -0.74 -2.34 114.38 111.77 2yti h ARG 30 Ca 0.23 -0.03 -0.00 0.00 0.10 0.00 0.00 59.98 60.28 2yti h ARG 30 Cb 0.44 -0.10 -0.00 0.00 1.11 0.00 0.00 29.97 31.42 2yti h ARG 30 CO -0.54 0.29 -0.00 1.25 0.10 0.00 0.00 179.97 181.07 2yti h HIS 31 N 0.45 0.00 0.00 4.08 2.76 -0.51 -2.88 115.15 119.05 2yti h HIS 31 Ca 0.26 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.43 2yti h HIS 31 Cb 0.42 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.38 2yti h HIS 31 CO -0.00 0.45 0.55 0.00 -1.30 0.00 0.00 177.93 177.62 2yti h ARG 32 N -0.45 0.00 -0.29 5.26 3.08 -0.54 0.15 114.38 121.60 2yti h ARG 32 Ca 0.00 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.09 2yti h ARG 32 Cb 0.45 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 2yti h ARG 32 CO 0.00 0.00 0.19 0.78 -1.07 0.00 0.00 179.97 179.87 2yti h GLY 33 N 0.00 0.27 1.81 0.04 0.00 -1.44 -1.00 103.07 102.75 2yti h GLY 33 Ca 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 47.33 47.26 2yti h GLY 33 CO 0.00 0.08 0.07 0.16 0.00 0.00 0.00 176.54 176.85 2yti h ILE 34 N 0.24 0.84 0.16 2.60 3.07 -0.89 -2.44 117.51 121.09 2yti h ILE 34 Ca 0.12 0.00 -0.34 0.00 1.55 0.00 0.00 64.86 66.19 2yti h ILE 34 Cb 0.19 0.95 0.00 0.00 -0.27 0.00 0.00 36.82 37.69 2yti h ILE 34 CO -0.02 0.00 -1.73 0.45 -1.05 0.00 0.00 178.15 175.80 2yti h HIS 35 N 0.00 0.60 -2.72 0.16 3.86 -1.39 -3.40 115.15 112.27 2yti h HIS 35 Ca 0.04 -0.44 -0.55 0.00 -1.16 0.00 0.00 60.37 58.27 2yti h HIS 35 Cb 0.19 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 2yti h HIS 35 CO 0.00 1.68 1.01 0.95 0.86 0.00 0.00 177.93 182.42 2yti s THR 36 N -2.55 3.67 0.00 2.45 -4.23 -0.92 -2.79 115.64 111.28 2yti s THR 36 Ca -0.18 0.89 0.00 0.00 -1.18 0.00 0.00 61.69 61.21 2yti s THR 36 Cb 0.05 -3.57 0.00 0.00 1.34 0.00 0.00 72.50 70.32 2yti s THR 36 CO 0.81 -0.06 0.00 0.61 -0.54 0.00 0.00 174.62 175.44 2yti n GLY 37 N 3.95 3.03 3.84 3.99 0.00 -1.26 -4.89 105.19 113.85 2yti n GLY 37 Ca 0.16 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 44.99 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 4.10 -0.10 1.61 2.56 -1.12 -5.07 118.70 120.67 2yti s GLU 38 Ca 0.00 0.80 -0.03 0.00 0.00 0.00 0.00 54.97 55.74 2yti s GLU 38 Cb 0.00 -2.45 -0.03 0.00 2.00 0.00 0.00 34.13 33.64 2yti s GLU 38 CO 0.00 0.16 0.01 0.21 -0.56 0.00 0.00 175.26 175.08 2yti s LYS 39 N -2.86 3.16 0.20 4.30 2.20 -1.26 -4.95 119.74 120.52 2yti s LYS 39 Ca 0.54 -0.39 -0.30 0.00 -0.36 0.00 0.00 55.97 55.46 2yti s LYS 39 Cb -0.11 -2.87 -0.09 0.00 -1.51 0.00 0.00 37.83 33.25 2yti s LYS 39 CO 0.17 0.64 1.30 -1.25 -0.36 0.00 0.00 175.35 175.85 2yti s PRO 40 N -0.70 4.39 0.00 4.03 0.04 -1.26 -4.90 135.00 136.61 2yti s PRO 40 Ca 0.11 2.04 -0.04 0.00 0.04 0.00 0.00 61.00 63.16 2yti s PRO 40 Cb -0.12 -3.20 -0.18 0.00 0.04 0.00 0.00 34.50 31.05 2yti s PRO 40 CO 0.02 -0.24 3.03 0.43 0.04 0.00 0.00 177.00 180.28 2yti n SER 41 N 2.60 5.19 -4.88 6.66 7.64 -1.26 -4.85 113.62 124.73 2yti n SER 41 Ca 0.06 -2.44 -0.28 0.00 1.01 0.00 0.00 58.87 57.22 2yti n SER 41 Cb 0.43 -1.30 -0.02 0.00 -1.01 0.00 0.00 64.21 62.31 2yti n SER 41 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yti s GLY 42 N 2.01 2.54 -0.68 0.23 0.00 -1.26 -5.05 107.32 105.12 2yti s GLY 42 Ca 0.43 -0.99 -0.26 0.00 0.00 0.00 0.00 44.72 43.91 2yti s GLY 42 CO 0.00 -2.01 1.88 2.56 0.00 0.00 0.00 173.10 175.53 2yti s PRO 43 N -4.20 2.61 0.23 2.90 0.04 -1.26 -4.96 135.00 130.36 2yti s PRO 43 Ca 0.26 0.41 -0.30 0.00 0.04 0.00 0.00 61.00 61.41 2yti s PRO 43 Cb -0.02 -4.54 -0.10 0.00 0.04 0.00 0.00 34.50 29.89 2yti s PRO 43 CO 0.16 -2.88 1.39 -1.54 0.04 0.00 0.00 177.00 174.17 2yti s SER 44 N 8.10 6.75 0.07 6.66 1.04 -1.26 -5.02 113.70 130.04 2yti s SER 44 Ca 0.68 2.56 -0.08 0.00 0.48 0.00 0.00 55.95 59.59 2yti s SER 44 Cb -0.11 -2.62 -0.00 0.00 0.10 0.00 0.00 66.02 63.39 2yti s SER 44 CO 0.16 -0.63 0.17 -0.55 0.98 0.00 0.00 173.24 173.37 2yti s SER 45 N 0.32 0.12 0.00 7.02 0.15 -1.26 -5.30 113.70 114.76 2yti s SER 45 Ca 0.58 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.64 2yti s SER 45 Cb -0.40 0.31 0.00 0.00 -1.71 0.00 0.00 66.02 64.22 2yti s SER 45 CO 0.42 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 174.81