#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 -0.86 0.09 1.61 1.04 -1.26 -5.17 113.70 109.14 2yti s SER 2 Ca 0.00 1.31 -0.26 0.00 0.48 0.00 0.00 55.95 57.48 2yti s SER 2 Cb 0.00 1.57 0.09 0.00 0.10 0.00 0.00 66.02 67.78 2yti s SER 2 CO 0.00 -0.20 1.13 -0.55 0.98 0.00 0.00 173.24 174.60 2yti s SER 3 N 1.92 -0.06 0.00 7.02 0.15 -1.26 -5.10 113.70 116.37 2yti s SER 3 Ca -0.08 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.19 2yti s SER 3 Cb -0.06 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 2yti s SER 3 CO -0.18 -0.65 0.00 0.61 1.20 0.00 0.00 173.24 174.21 2yti n GLY 4 N -0.62 0.13 3.24 9.45 0.00 -1.26 -5.17 105.19 110.96 2yti n GLY 4 Ca -0.04 -0.54 -0.11 0.00 0.00 0.00 0.00 46.02 45.32 2yti n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yti s SER 5 N 0.00 -0.08 0.05 1.61 0.15 -1.26 -5.18 113.70 109.00 2yti s SER 5 Ca 0.00 -0.28 -0.10 0.00 0.70 0.00 0.00 55.95 56.26 2yti s SER 5 Cb 0.00 0.35 0.01 0.00 -1.71 0.00 0.00 66.02 64.67 2yti s SER 5 CO 0.00 -0.63 0.22 -0.55 1.20 0.00 0.00 173.24 173.48 2yti s SER 6 N -2.20 0.01 -0.24 5.45 0.15 -1.26 -5.04 113.70 110.56 2yti s SER 6 Ca -0.03 -0.38 -0.01 0.00 0.70 0.00 0.00 55.95 56.23 2yti s SER 6 Cb -0.00 0.32 0.15 0.00 -1.71 0.00 0.00 66.02 64.78 2yti s SER 6 CO -0.05 -0.61 2.05 0.61 1.20 0.00 0.00 173.24 176.44 2yti n GLY 7 N 0.51 3.72 3.20 9.45 0.00 -1.26 -4.80 105.19 116.01 2yti n GLY 7 Ca -0.18 -0.86 -0.39 0.00 0.00 0.00 0.00 46.02 44.59 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 -1.72 3.91 0.00 2.61 -4.23 -1.26 -4.98 115.64 109.98 2yti s THR 8 Ca 0.25 -1.75 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 2yti s THR 8 Cb 0.19 -3.54 0.00 0.00 1.34 0.00 0.00 72.50 70.49 2yti s THR 8 CO -0.01 -0.66 0.00 0.61 -0.54 0.00 0.00 174.62 174.02 2yti n GLY 9 N 4.81 4.42 3.35 3.99 0.00 -1.26 -5.18 105.19 115.33 2yti n GLY 9 Ca -0.07 -0.95 -0.19 0.00 0.00 0.00 0.00 46.02 44.81 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 -4.72 1.58 -0.51 1.61 0.41 -1.26 -5.10 118.70 110.70 2yti s GLU 10 Ca 0.00 -1.90 0.07 0.00 -0.41 0.00 0.00 54.97 52.73 2yti s GLU 10 Cb 0.00 -0.21 0.27 0.00 -1.78 0.00 0.00 34.13 32.40 2yti s GLU 10 CO 0.00 -0.41 0.68 0.36 -0.49 0.00 0.00 175.26 175.40 2yti n LYS 11 N -0.59 1.75 0.09 1.61 2.85 -1.26 -4.90 118.16 117.71 2yti n LYS 11 Ca 0.00 -4.01 0.10 0.00 -1.05 0.00 0.00 58.31 53.35 2yti n LYS 11 Cb 0.65 -1.80 0.44 0.00 -0.65 0.00 0.00 35.03 33.67 2yti n LYS 11 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2yti n PRO 12 N 0.92 0.14 -3.83 -1.58 -0.04 -1.26 -4.41 135.00 124.93 2yti n PRO 12 Ca 0.26 0.38 -0.29 0.00 -0.04 0.00 0.00 63.50 63.80 2yti n PRO 12 Cb 0.48 -1.76 -0.16 0.00 -0.04 0.00 0.00 33.50 32.02 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 -3.22 1.92 -0.09 0.54 2.02 -1.25 -5.07 117.35 112.19 2yti s TYR 13 Ca 0.05 -1.60 -0.01 0.00 -0.37 0.00 0.00 57.07 55.14 2yti s TYR 13 Cb 0.09 -1.57 0.03 0.00 -0.40 0.00 0.00 41.96 40.11 2yti s TYR 13 CO 0.35 -0.77 -0.03 0.21 -1.57 0.00 0.00 175.55 173.74 2yti s LYS 14 N 1.55 0.95 0.77 -0.62 2.20 -1.26 -0.41 119.74 122.92 2yti s LYS 14 Ca 0.01 -0.03 -0.14 0.00 -0.36 0.00 0.00 55.97 55.45 2yti s LYS 14 Cb -0.18 -1.20 0.06 0.00 -1.51 0.00 0.00 37.83 35.00 2yti s LYS 14 CO -0.12 -0.29 1.22 0.00 -0.36 0.00 0.00 175.35 175.81 2yti n ASN 16 N -2.95 1.50 0.18 0.00 5.15 -1.26 -3.20 115.26 114.68 2yti n ASN 16 Ca 0.14 -0.03 -0.16 0.00 -0.60 0.00 0.00 54.58 53.93 2yti n ASN 16 Cb 0.50 0.55 -0.08 0.00 -0.53 0.00 0.00 39.78 40.22 2yti n ASN 16 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 2yti h GLU 17 N 0.00 -0.73 0.00 1.20 4.39 -1.99 -3.37 114.58 114.09 2yti h GLU 17 Ca -0.43 0.05 -0.28 0.00 0.34 0.00 0.00 59.36 59.04 2yti h GLU 17 Cb 1.89 0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 30.66 2yti h GLU 17 CO -0.00 -0.48 -2.01 0.00 -1.16 0.00 0.00 179.01 175.36 2yti n GLY 19 N 2.30 1.96 3.80 0.00 0.00 -1.19 -5.07 105.19 106.99 2yti n GLY 19 Ca -0.33 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.06 1.51 0.01 1.61 2.20 -1.25 -4.68 119.74 119.09 2yti s LYS 20 Ca 0.00 0.41 0.03 0.00 -0.36 0.00 0.00 55.97 56.05 2yti s LYS 20 Cb 0.00 -1.87 -0.01 0.00 -1.51 0.00 0.00 37.83 34.43 2yti s LYS 20 CO 0.00 -1.97 -0.10 0.08 -0.36 0.00 0.00 175.35 173.00 2yti s VAL 21 N -3.25 0.79 0.28 4.02 1.01 -1.26 0.43 120.40 122.42 2yti s VAL 21 Ca 0.63 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.98 2yti s VAL 21 Cb -0.14 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 2yti s VAL 21 CO 0.53 0.06 0.17 -0.36 0.00 0.00 0.00 175.10 175.50 2yti s PHE 22 N -0.56 1.50 -0.18 5.22 0.40 0.45 -5.00 117.98 119.81 2yti s PHE 22 Ca 0.01 -1.41 0.06 0.00 -0.60 0.00 0.00 56.93 54.99 2yti s PHE 22 Cb -0.06 -0.76 -0.16 0.00 0.51 0.00 0.00 43.02 42.56 2yti s PHE 22 CO 0.00 -0.60 -0.09 0.25 0.70 0.00 0.00 175.22 175.48 2yti n THR 23 N -0.50 1.13 -4.72 0.64 -2.24 -1.26 -3.96 114.28 103.37 2yti n THR 23 Ca 0.02 -0.53 -0.33 0.00 -2.27 0.00 0.00 64.05 60.95 2yti n THR 23 Cb 0.65 -0.97 -0.15 0.00 -2.10 0.00 0.00 70.33 67.76 2yti n THR 23 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2yti s GLN 24 N -2.39 3.30 0.22 -0.78 2.00 -1.26 -4.89 119.66 115.86 2yti s GLN 24 Ca -0.20 -0.72 -0.08 0.00 -2.00 0.00 0.00 55.36 52.36 2yti s GLN 24 Cb 0.06 -2.61 0.34 0.00 0.80 0.00 0.00 33.01 31.60 2yti s GLN 24 CO 0.53 0.14 1.30 0.27 -0.50 0.00 0.00 175.29 177.03 2yti n ASN 25 N 3.73 -0.35 -0.17 6.67 6.94 -1.26 -0.03 115.26 130.79 2yti n ASN 25 Ca -0.18 1.44 -0.12 0.00 -0.02 0.00 0.00 54.58 55.69 2yti n ASN 25 Cb 0.52 -0.41 -0.08 0.00 -2.36 0.00 0.00 39.78 37.46 2yti n ASN 25 CO 0.00 0.00 0.00 -1.28 -1.03 0.00 0.00 177.26 174.95 2yti h SER 26 N 0.00 -1.74 -1.22 0.53 0.87 -1.98 0.60 113.55 110.61 2yti h SER 26 Ca 0.38 0.25 0.35 0.00 -1.23 0.00 0.00 61.79 61.53 2yti h SER 26 Cb 0.58 0.74 -0.07 0.00 -0.44 0.00 0.00 62.40 63.21 2yti h SER 26 CO -0.85 -0.37 0.85 0.45 -0.53 0.00 0.00 176.83 176.37 2yti h HIS 27 N -0.33 0.21 0.00 2.24 3.86 -0.87 0.23 115.15 120.50 2yti h HIS 27 Ca 0.11 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 2yti h HIS 27 Cb 0.58 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.99 2yti h HIS 27 CO -0.73 -0.00 -0.06 1.25 0.86 0.00 0.00 177.93 179.25 2yti h LEU 28 N 0.11 0.00 -0.96 2.43 5.85 0.17 -2.86 115.31 120.04 2yti h LEU 28 Ca 0.62 0.00 0.19 0.00 0.84 0.00 0.00 57.88 59.53 2yti h LEU 28 Cb 2.21 0.00 -0.18 0.00 0.37 0.00 0.00 40.66 43.06 2yti h LEU 28 CO -0.12 0.28 -0.24 0.00 -0.34 0.00 0.00 178.44 178.02 2yti h ALA 29 N -1.51 0.63 -0.43 1.25 0.00 0.16 0.97 119.26 120.33 2yti h ALA 29 Ca 0.00 0.37 -0.08 0.00 0.00 0.00 0.00 54.91 55.21 2yti h ALA 29 Cb 0.06 0.74 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2yti h ALA 29 CO 0.00 -0.39 -0.06 0.07 0.00 0.00 0.00 179.25 178.88 2yti h ARG 30 N -0.00 0.74 -0.27 0.00 0.11 -1.14 -3.01 114.38 110.80 2yti h ARG 30 Ca 0.46 -0.21 -0.00 0.00 0.10 0.00 0.00 59.98 60.32 2yti h ARG 30 Cb 0.70 -0.08 -0.01 0.00 1.11 0.00 0.00 29.97 31.69 2yti h ARG 30 CO -0.99 0.79 0.16 1.25 0.10 0.00 0.00 179.97 181.28 2yti h HIS 31 N 0.68 0.36 0.00 4.08 2.76 0.11 -1.55 115.15 121.60 2yti h HIS 31 Ca 0.13 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.29 2yti h HIS 31 Cb 0.50 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.34 2yti h HIS 31 CO 0.02 0.28 0.34 0.00 -1.30 0.00 0.00 177.93 177.27 2yti h ARG 32 N 0.34 0.00 0.00 5.26 3.08 -0.83 0.33 114.38 122.57 2yti h ARG 32 Ca 0.10 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.15 2yti h ARG 32 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 2yti h ARG 32 CO -0.02 0.00 -0.00 0.78 -1.07 0.00 0.00 179.97 179.66 2yti h GLY 33 N 0.00 0.00 1.96 0.04 0.00 -1.33 -1.03 103.07 102.71 2yti h GLY 33 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 2yti h GLY 33 CO 0.00 0.00 -0.41 0.16 0.00 0.00 0.00 176.54 176.29 2yti h ILE 34 N 0.00 1.30 0.05 2.60 3.07 -1.11 -2.98 117.51 120.45 2yti h ILE 34 Ca -0.00 -1.44 -0.26 0.00 1.55 0.00 0.00 64.86 64.71 2yti h ILE 34 Cb 0.01 1.75 -0.02 0.00 -0.27 0.00 0.00 36.82 38.28 2yti h ILE 34 CO 0.00 0.41 -1.34 0.45 -1.05 0.00 0.00 178.15 176.62 2yti h HIS 35 N 0.04 0.19 -1.17 0.16 3.86 -1.39 -3.42 115.15 113.42 2yti h HIS 35 Ca 0.00 -0.14 -0.66 0.00 -1.16 0.00 0.00 60.37 58.41 2yti h HIS 35 Cb 0.75 -0.01 -0.10 0.00 1.06 0.00 0.00 27.41 29.11 2yti h HIS 35 CO 0.00 1.15 1.79 0.95 0.86 0.00 0.00 177.93 182.68 2yti s THR 36 N -2.65 4.17 0.00 2.45 -4.23 -0.98 -3.51 115.64 110.90 2yti s THR 36 Ca -0.04 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 2yti s THR 36 Cb 0.08 -5.10 0.00 0.00 1.34 0.00 0.00 72.50 68.83 2yti s THR 36 CO 0.84 -1.93 0.00 0.61 -0.54 0.00 0.00 174.62 173.60 2yti n GLY 37 N 5.81 0.48 2.71 3.99 0.00 -1.26 -4.92 105.19 112.01 2yti n GLY 37 Ca 0.41 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.14 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 1.48 -0.59 1.61 2.12 -1.23 -5.05 118.70 117.05 2yti s GLU 38 Ca 0.00 -2.30 -0.03 0.00 0.36 0.00 0.00 54.97 53.00 2yti s GLU 38 Cb 0.00 -2.46 0.15 0.00 0.26 0.00 0.00 34.13 32.09 2yti s GLU 38 CO 0.00 -1.21 0.40 -1.59 -0.54 0.00 0.00 175.26 172.32 2yti s LYS 39 N -0.05 2.48 0.09 4.30 -2.85 -1.26 -4.94 119.74 117.52 2yti s LYS 39 Ca 0.21 -2.41 -0.15 0.00 -1.00 0.00 0.00 55.97 52.61 2yti s LYS 39 Cb -0.17 -3.71 -0.09 0.00 -2.06 0.00 0.00 37.83 31.80 2yti s LYS 39 CO -0.06 -1.16 1.42 -1.00 0.10 0.00 0.00 175.35 174.65 2yti h PRO 40 N 7.20 0.67 -3.97 1.78 0.13 -2.03 -3.45 132.00 132.34 2yti h PRO 40 Ca -0.04 -0.35 -0.28 0.00 -0.87 0.00 0.00 66.00 64.47 2yti h PRO 40 Cb 0.97 0.01 -0.29 0.00 0.13 0.00 0.00 31.00 31.82 2yti h PRO 40 CO 0.71 0.96 -0.74 -1.12 -0.23 0.00 0.00 178.00 177.59 2yti s SER 41 N -6.50 0.28 0.42 1.44 0.01 -1.26 -5.16 113.70 102.93 2yti s SER 41 Ca -0.12 -0.04 0.04 0.00 1.31 0.00 0.00 55.95 57.14 2yti s SER 41 Cb 0.08 -0.04 0.04 0.00 0.21 0.00 0.00 66.02 66.31 2yti s SER 41 CO 0.82 0.02 0.37 0.61 0.41 0.00 0.00 173.24 175.47 2yti n GLY 42 N 3.11 2.64 3.77 3.44 0.00 -1.26 -5.10 105.19 111.79 2yti n GLY 42 Ca -0.14 -2.25 -0.40 0.00 0.00 0.00 0.00 46.02 43.23 2yti n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yti s PRO 43 N -3.76 4.36 0.99 1.61 0.04 -1.26 -4.98 135.00 132.01 2yti s PRO 43 Ca 0.28 2.01 -0.17 0.00 0.04 0.00 0.00 61.00 63.17 2yti s PRO 43 Cb -0.02 -3.01 -0.08 0.00 0.04 0.00 0.00 34.50 31.43 2yti s PRO 43 CO 0.18 -0.11 -0.45 0.45 0.04 0.00 0.00 177.00 177.12 2yti n SER 44 N 0.74 -4.28 -4.70 6.66 2.88 -1.26 -4.92 113.62 108.74 2yti n SER 44 Ca 0.01 0.19 -0.37 0.00 -1.33 0.00 0.00 58.87 57.37 2yti n SER 44 Cb 0.44 -0.89 -0.08 0.00 -0.75 0.00 0.00 64.21 62.93 2yti n SER 44 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yti s SER 45 N -1.38 6.35 0.00 -3.46 0.01 -1.26 -5.33 113.70 108.63 2yti s SER 45 Ca 0.46 0.40 0.00 0.00 1.31 0.00 0.00 55.95 58.12 2yti s SER 45 Cb -0.16 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 63.90 2yti s SER 45 CO 0.75 0.06 0.41 0.61 0.41 0.00 0.00 173.24 175.49