#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 5.32 0.31 1.61 1.04 -1.26 -5.08 113.70 115.63 2yti s SER 2 Ca 0.00 -0.32 -0.29 0.00 0.48 0.00 0.00 55.95 55.82 2yti s SER 2 Cb 0.00 -1.29 -0.10 0.00 0.10 0.00 0.00 66.02 64.73 2yti s SER 2 CO 0.00 -0.02 1.40 -0.94 0.98 0.00 0.00 173.24 174.65 2yti s SER 3 N -3.74 6.64 0.00 7.02 1.04 -1.26 -5.02 113.70 118.37 2yti s SER 3 Ca 0.32 2.76 0.00 0.00 0.48 0.00 0.00 55.95 59.51 2yti s SER 3 Cb -0.08 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.40 2yti s SER 3 CO 0.24 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.40 2yti n GLY 4 N 1.26 -1.11 3.36 7.32 0.00 -1.26 -5.07 105.19 109.69 2yti n GLY 4 Ca 0.03 -0.71 -0.19 0.00 0.00 0.00 0.00 46.02 45.14 2yti n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yti s SER 5 N -1.47 2.71 -0.69 1.61 1.04 -1.26 -5.10 113.70 110.54 2yti s SER 5 Ca 0.00 -1.03 0.02 0.00 0.48 0.00 0.00 55.95 55.42 2yti s SER 5 Cb 0.00 -0.16 0.17 0.00 0.10 0.00 0.00 66.02 66.13 2yti s SER 5 CO 0.00 -0.15 0.49 -0.44 0.98 0.00 0.00 173.24 174.12 2yti s SER 6 N -3.35 5.01 -0.81 7.02 0.01 -1.26 -5.03 113.70 115.29 2yti s SER 6 Ca 0.24 -3.50 -0.24 0.00 1.31 0.00 0.00 55.95 53.77 2yti s SER 6 Cb -0.01 -1.73 -0.17 0.00 0.21 0.00 0.00 66.02 64.33 2yti s SER 6 CO 0.08 -0.18 2.38 0.61 0.41 0.00 0.00 173.24 176.55 2yti n GLY 7 N 2.52 -0.19 2.80 3.44 0.00 -1.26 -4.85 105.19 107.65 2yti n GLY 7 Ca 0.15 0.30 -0.16 0.00 0.00 0.00 0.00 46.02 46.30 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 12.54 -0.13 0.00 2.61 2.01 -1.26 -5.10 115.64 126.32 2yti s THR 8 Ca 0.99 0.30 0.00 0.00 0.31 0.00 0.00 61.69 63.30 2yti s THR 8 Cb -0.25 -0.19 0.00 0.00 0.01 0.00 0.00 72.50 72.07 2yti s THR 8 CO 0.17 0.13 0.00 0.61 -0.69 0.00 0.00 174.62 174.83 2yti n GLY 9 N 4.80 0.49 3.64 4.40 0.00 -1.26 -5.13 105.19 112.12 2yti n GLY 9 Ca -0.15 -1.49 -0.09 0.00 0.00 0.00 0.00 46.02 44.30 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 -4.91 0.48 0.64 1.61 -1.05 -1.26 -5.17 118.70 109.04 2yti s GLU 10 Ca 0.00 0.58 -0.15 0.00 -0.15 0.00 0.00 54.97 55.25 2yti s GLU 10 Cb 0.00 0.23 -0.01 0.00 -0.44 0.00 0.00 34.13 33.91 2yti s GLU 10 CO 0.00 -0.06 1.11 0.15 0.95 0.00 0.00 175.26 177.41 2yti s LYS 11 N 0.27 2.89 0.00 -4.83 3.01 -1.26 -4.90 119.74 114.93 2yti s LYS 11 Ca 0.03 1.40 0.11 0.00 -1.01 0.00 0.00 55.97 56.50 2yti s LYS 11 Cb -0.05 -1.96 0.66 0.00 -1.01 0.00 0.00 37.83 35.47 2yti s LYS 11 CO -0.07 -1.18 1.09 -0.35 0.51 0.00 0.00 175.35 175.35 2yti n PRO 12 N -2.28 0.49 -2.50 -1.68 -0.04 -1.26 -3.53 135.00 124.20 2yti n PRO 12 Ca 0.10 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.23 2yti n PRO 12 Cb 0.52 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 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 -0.85 3.31 -3.77 0.54 4.02 -1.26 -5.02 117.16 114.12 2yti n TYR 13 Ca 0.08 -3.00 -0.37 0.00 -0.01 0.00 0.00 57.90 54.60 2yti n TYR 13 Cb 0.04 -0.74 -0.06 0.00 -0.02 0.00 0.00 39.34 38.56 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 -3.86 3.70 0.62 -0.72 2.20 -1.23 -1.74 119.74 118.72 2yti s LYS 14 Ca 0.47 -0.05 -0.14 0.00 -0.36 0.00 0.00 55.97 55.88 2yti s LYS 14 Cb 0.33 -3.25 -0.02 0.00 -1.51 0.00 0.00 37.83 33.37 2yti s LYS 14 CO -0.22 0.64 1.06 0.00 -0.36 0.00 0.00 175.35 176.47 2yti n ASN 16 N -2.35 1.29 0.25 0.00 2.85 -1.26 -3.31 115.26 112.73 2yti n ASN 16 Ca 0.08 -0.03 -0.17 0.00 -0.11 0.00 0.00 54.58 54.35 2yti n ASN 16 Cb 0.53 0.56 -0.09 0.00 1.24 0.00 0.00 39.78 42.01 2yti n ASN 16 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 2yti h GLU 17 N 0.00 -0.87 0.00 1.20 3.07 -1.99 -3.38 114.58 112.61 2yti h GLU 17 Ca -0.46 0.06 -0.36 0.00 -0.50 0.00 0.00 59.36 58.10 2yti h GLU 17 Cb 1.95 0.20 -0.06 0.00 -0.84 0.00 0.00 28.75 30.00 2yti h GLU 17 CO -0.00 -0.58 -2.23 0.00 -1.40 0.00 0.00 179.01 174.79 2yti n GLY 19 N 1.81 1.56 3.91 0.00 0.00 -1.21 -5.07 105.19 106.20 2yti n GLY 19 Ca -0.42 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.03 2.50 0.02 1.61 2.20 -1.26 -4.73 119.74 120.05 2yti s LYS 20 Ca 0.00 0.00 0.06 0.00 -0.36 0.00 0.00 55.97 55.68 2yti s LYS 20 Cb 0.00 -2.14 -0.02 0.00 -1.51 0.00 0.00 37.83 34.16 2yti s LYS 20 CO 0.00 -1.10 -0.19 0.08 -0.36 0.00 0.00 175.35 173.78 2yti s VAL 21 N -3.24 1.55 0.22 4.02 1.01 -1.26 0.16 120.40 122.85 2yti s VAL 21 Ca 0.58 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 2yti s VAL 21 Cb -0.11 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 2yti s VAL 21 CO 0.47 0.28 0.20 -0.36 0.00 0.00 0.00 175.10 175.69 2yti s PHE 22 N -0.66 1.07 -0.11 5.22 0.40 -0.71 -4.99 117.98 118.19 2yti s PHE 22 Ca 0.07 -1.29 0.08 0.00 -0.60 0.00 0.00 56.93 55.19 2yti s PHE 22 Cb -0.08 -0.44 -0.13 0.00 0.51 0.00 0.00 43.02 42.88 2yti s PHE 22 CO 0.01 -0.72 0.01 -2.37 0.70 0.00 0.00 175.22 172.84 2yti n THR 23 N -0.32 0.76 -5.15 0.64 5.66 -1.26 -4.26 114.28 110.35 2yti n THR 23 Ca 0.02 -0.44 -0.32 0.00 -3.05 0.00 0.00 64.05 60.26 2yti n THR 23 Cb 0.65 -0.76 -0.16 0.00 -1.55 0.00 0.00 70.33 68.51 2yti n THR 23 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 2yti s GLN 24 N -2.27 2.62 0.15 1.09 0.74 -1.26 -4.98 119.66 115.75 2yti s GLN 24 Ca -0.08 -0.85 -0.26 0.00 0.05 0.00 0.00 55.36 54.22 2yti s GLN 24 Cb 0.04 -2.25 -0.00 0.00 1.10 0.00 0.00 33.01 31.90 2yti s GLN 24 CO 0.42 0.41 1.59 -0.97 -0.55 0.00 0.00 175.29 176.19 2yti h ASN 25 N 6.00 -1.21 -0.92 6.67 -0.73 -1.97 -0.80 115.58 122.62 2yti h ASN 25 Ca -0.34 0.18 0.23 0.00 1.87 0.00 0.00 56.30 58.25 2yti h ASN 25 Cb 1.17 0.53 -0.17 0.00 0.27 0.00 0.00 38.32 40.12 2yti h ASN 25 CO 0.49 -0.37 -0.01 -1.28 -0.37 0.00 0.00 177.43 175.88 2yti h SER 26 N -0.36 -0.49 -0.11 1.15 0.87 -1.98 1.36 113.55 113.99 2yti h SER 26 Ca 0.12 0.26 -0.07 0.00 -1.23 0.00 0.00 61.79 60.88 2yti h SER 26 Cb 0.57 0.46 -0.02 0.00 -0.44 0.00 0.00 62.40 62.98 2yti h SER 26 CO -0.48 -0.30 -0.12 0.45 -0.53 0.00 0.00 176.83 175.86 2yti h HIS 27 N 0.04 0.47 0.04 2.24 3.86 -1.61 -2.34 115.15 117.86 2yti h HIS 27 Ca 0.53 -0.07 -0.00 0.00 -1.16 0.00 0.00 60.37 59.67 2yti h HIS 27 Cb 1.01 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 29.35 2yti h HIS 27 CO -0.51 0.56 -0.02 1.25 0.86 0.00 0.00 177.93 180.06 2yti h LEU 28 N 0.42 -0.05 -0.96 2.43 5.85 0.23 -3.05 115.31 120.17 2yti h LEU 28 Ca 0.08 0.00 0.16 0.00 0.84 0.00 0.00 57.88 58.96 2yti h LEU 28 Cb 0.46 0.01 -0.16 0.00 0.37 0.00 0.00 40.66 41.34 2yti h LEU 28 CO 0.03 0.17 -0.35 0.00 -0.34 0.00 0.00 178.44 177.95 2yti h ALA 29 N -1.56 0.27 -0.73 1.25 0.00 0.26 0.62 119.26 119.36 2yti h ALA 29 Ca -0.01 0.30 0.09 0.00 0.00 0.00 0.00 54.91 55.29 2yti h ALA 29 Cb 0.05 0.92 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 2yti h ALA 29 CO 0.01 -0.56 0.38 0.07 0.00 0.00 0.00 179.25 179.15 2yti h ARG 30 N -0.01 0.63 0.30 0.00 0.11 -1.58 -2.50 114.38 111.33 2yti h ARG 30 Ca 0.37 -0.04 -0.01 0.00 0.10 0.00 0.00 59.98 60.40 2yti h ARG 30 Cb 0.62 -0.14 -0.01 0.00 1.11 0.00 0.00 29.97 31.55 2yti h ARG 30 CO -0.97 0.42 -0.20 1.25 0.10 0.00 0.00 179.97 180.57 2yti h HIS 31 N 0.65 -0.52 -0.99 4.08 2.76 0.29 -1.73 115.15 119.70 2yti h HIS 31 Ca 0.36 -0.00 0.29 0.00 -2.20 0.00 0.00 60.37 58.81 2yti h HIS 31 Cb 0.35 0.19 -0.04 0.00 1.55 0.00 0.00 27.41 29.46 2yti h HIS 31 CO -0.09 -0.31 0.96 0.00 -1.30 0.00 0.00 177.93 177.19 2yti h ARG 32 N -0.48 0.00 -0.99 5.26 3.08 -0.73 0.21 114.38 120.73 2yti h ARG 32 Ca -0.03 0.00 0.18 0.00 0.07 0.00 0.00 59.98 60.20 2yti h ARG 32 Cb 0.41 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.37 2yti h ARG 32 CO 0.02 0.00 0.61 0.78 -1.07 0.00 0.00 179.97 180.31 2yti h GLY 33 N 0.00 1.61 0.20 0.04 0.00 -1.19 0.57 103.07 104.30 2yti h GLY 33 Ca 0.47 -0.35 0.23 0.00 0.00 0.00 0.00 47.33 47.69 2yti h GLY 33 CO -0.00 -0.01 0.63 0.16 0.00 0.00 0.00 176.54 177.32 2yti h ILE 34 N 0.76 0.61 0.13 2.60 3.07 -0.74 -1.18 117.51 122.76 2yti h ILE 34 Ca 0.54 -0.09 -0.24 0.00 1.55 0.00 0.00 64.86 66.63 2yti h ILE 34 Cb 0.86 0.33 0.01 0.00 -0.27 0.00 0.00 36.82 37.74 2yti h ILE 34 CO -0.32 0.05 -1.13 0.45 -1.05 0.00 0.00 178.15 176.14 2yti h HIS 35 N 0.26 0.51 -3.63 0.16 3.86 -1.08 -3.44 115.15 111.78 2yti h HIS 35 Ca 0.47 -0.37 -0.57 0.00 -1.16 0.00 0.00 60.37 58.75 2yti h HIS 35 Cb 1.42 -0.02 -0.07 0.00 1.06 0.00 0.00 27.41 29.79 2yti h HIS 35 CO -0.00 1.44 0.85 0.95 0.86 0.00 0.00 177.93 182.03 2yti s THR 36 N -2.46 4.31 0.00 2.45 -4.23 -0.45 -4.79 115.64 110.47 2yti s THR 36 Ca -0.17 1.24 0.00 0.00 -1.18 0.00 0.00 61.69 61.59 2yti s THR 36 Cb 0.03 -4.54 0.00 0.00 1.34 0.00 0.00 72.50 69.33 2yti s THR 36 CO 0.80 -0.88 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 2yti n GLY 37 N 4.68 -0.10 3.61 3.99 0.00 -1.26 -4.77 105.19 111.34 2yti n GLY 37 Ca 0.11 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.98 2yti n GLY 37 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yti s GLU 38 N -1.59 3.34 0.04 1.61 8.01 -1.26 -4.97 118.70 123.87 2yti s GLU 38 Ca 0.00 1.97 0.02 0.00 0.01 0.00 0.00 54.97 56.96 2yti s GLU 38 Cb 0.00 -4.29 -0.04 0.00 -4.31 0.00 0.00 34.13 25.49 2yti s GLU 38 CO 0.00 -1.86 0.07 -1.59 0.01 0.00 0.00 175.26 171.88 2yti s LYS 39 N 5.87 2.93 0.95 1.61 0.00 -1.26 -5.06 119.74 124.78 2yti s LYS 39 Ca 0.93 -0.61 -0.12 0.00 0.00 0.00 0.00 55.97 56.17 2yti s LYS 39 Cb -0.32 -2.76 0.16 0.00 0.00 0.00 0.00 37.83 34.91 2yti s LYS 39 CO 0.35 0.60 1.09 -1.25 0.00 0.00 0.00 175.35 176.15 2yti s PRO 40 N -2.03 0.80 0.03 1.78 0.04 -1.26 -4.93 135.00 129.42 2yti s PRO 40 Ca 0.25 0.66 -0.05 0.00 0.04 0.00 0.00 61.00 61.90 2yti s PRO 40 Cb -0.12 -1.77 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 2yti s PRO 40 CO 0.17 -2.51 0.81 0.45 0.04 0.00 0.00 177.00 175.96 2yti n SER 41 N -4.05 -0.18 -3.16 6.66 2.88 -1.26 -4.87 113.62 109.65 2yti n SER 41 Ca 0.06 0.85 -0.18 0.00 -1.33 0.00 0.00 58.87 58.28 2yti n SER 41 Cb 0.56 -0.32 0.02 0.00 -0.75 0.00 0.00 64.21 63.72 2yti n SER 41 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yti n GLY 42 N -1.04 -0.89 0.06 0.46 0.00 -1.26 -4.93 105.19 97.59 2yti n GLY 42 Ca 0.00 0.87 -0.13 0.00 0.00 0.00 0.00 46.02 46.76 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 2.51 0.01 -1.54 1.61 0.13 -2.04 -3.27 132.00 129.40 2yti h PRO 43 Ca -0.23 -0.01 -0.71 0.00 -0.87 0.00 0.00 66.00 64.18 2yti h PRO 43 Cb 1.02 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 31.88 2yti h PRO 43 CO 0.16 0.49 0.96 -1.13 -0.23 0.00 0.00 178.00 178.25 2yti n SER 44 N -4.85 7.57 -0.03 1.44 3.41 -1.26 -4.65 113.62 115.25 2yti n SER 44 Ca -0.08 -3.79 -0.12 0.00 -0.26 0.00 0.00 58.87 54.62 2yti n SER 44 Cb 0.25 -1.03 -0.07 0.00 -0.26 0.00 0.00 64.21 63.10 2yti n SER 44 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2yti h SER 45 N 2.52 0.17 0.00 4.04 0.02 -1.92 -3.56 113.55 114.82 2yti h SER 45 Ca 0.58 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 2yti h SER 45 Cb 0.41 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.90 2yti h SER 45 CO 1.48 0.41 0.00 0.61 -1.14 0.00 0.00 176.83 178.19