#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yu8 s SER 2 N 0.00 7.00 0.21 1.61 0.15 -1.26 -5.08 113.70 116.33 2yu8 s SER 2 Ca 0.00 1.63 0.06 0.00 0.70 0.00 0.00 55.95 58.34 2yu8 s SER 2 Cb 0.00 -2.51 -0.05 0.00 -1.71 0.00 0.00 66.02 61.75 2yu8 s SER 2 CO 0.00 -0.25 -0.10 -0.94 1.20 0.00 0.00 173.24 173.15 2yu8 s SER 3 N -2.05 2.35 0.00 5.45 1.04 -1.26 -5.17 113.70 114.06 2yu8 s SER 3 Ca 0.57 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.92 2yu8 s SER 3 Cb -0.12 -0.10 0.00 0.00 0.10 0.00 0.00 66.02 65.91 2yu8 s SER 3 CO 0.16 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.71 2yu8 n GLY 4 N -0.39 5.41 3.56 7.32 0.00 -1.26 -5.15 105.19 114.69 2yu8 n GLY 4 Ca -0.08 -2.00 -0.31 0.00 0.00 0.00 0.00 46.02 43.64 2yu8 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yu8 s SER 5 N 0.29 4.36 -0.17 1.61 0.01 -1.26 -5.05 113.70 113.49 2yu8 s SER 5 Ca 0.00 -0.33 -0.24 0.00 1.31 0.00 0.00 55.95 56.69 2yu8 s SER 5 Cb 0.00 -0.87 -0.21 0.00 0.21 0.00 0.00 66.02 65.15 2yu8 s SER 5 CO 0.00 0.22 0.44 -1.28 0.41 0.00 0.00 173.24 173.03 2yu8 h SER 6 N 4.01 0.00 0.00 2.44 0.87 -2.08 -3.50 113.55 115.29 2yu8 h SER 6 Ca -0.48 -0.70 0.00 0.00 -1.23 0.00 0.00 61.79 59.38 2yu8 h SER 6 Cb 1.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 2yu8 h SER 6 CO 0.52 1.23 0.00 0.61 -0.53 0.00 0.00 176.83 178.66 2yu8 n GLY 7 N 1.53 0.62 3.56 5.77 0.00 -1.26 -4.98 105.19 110.42 2yu8 n GLY 7 Ca -0.21 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 44.65 2yu8 n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2yu8 s THR 8 N 0.00 3.27 0.00 2.61 -4.23 -1.26 -4.68 115.64 111.35 2yu8 s THR 8 Ca 0.00 0.19 0.00 0.00 -1.18 0.00 0.00 61.69 60.70 2yu8 s THR 8 Cb 0.00 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.24 2yu8 s THR 8 CO 0.00 -0.54 0.00 0.61 -0.54 0.00 0.00 174.62 174.15 2yu8 n GLY 9 N 5.74 -1.91 3.83 3.99 0.00 -1.26 -5.16 105.19 110.41 2yu8 n GLY 9 Ca 0.26 0.91 -0.34 0.00 0.00 0.00 0.00 46.02 46.85 2yu8 n GLY 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2yu8 s GLU 10 N 0.00 3.24 0.07 1.61 -1.05 -1.26 -5.03 118.70 116.27 2yu8 s GLU 10 Ca 0.00 -0.39 -0.06 0.00 -0.15 0.00 0.00 54.97 54.38 2yu8 s GLU 10 Cb 0.00 -2.98 -0.02 0.00 -0.44 0.00 0.00 34.13 30.70 2yu8 s GLU 10 CO 0.00 0.67 0.10 0.15 0.95 0.00 0.00 175.26 177.13 2yu8 s LYS 11 N -1.70 0.73 0.50 -4.83 3.01 -1.26 -5.04 119.74 111.15 2yu8 s LYS 11 Ca 0.23 -1.04 0.29 0.00 -1.01 0.00 0.00 55.97 54.44 2yu8 s LYS 11 Cb -0.12 0.28 1.22 0.00 -1.01 0.00 0.00 37.83 38.20 2yu8 s LYS 11 CO 0.14 -0.20 1.94 -1.00 0.51 0.00 0.00 175.35 176.74 2yu8 h PRO 12 N 2.98 0.00 -5.05 -1.68 0.13 -1.93 -3.41 132.00 123.05 2yu8 h PRO 12 Ca -0.34 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.11 2yu8 h PRO 12 Cb 1.18 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.13 2yu8 h PRO 12 CO 0.59 0.11 0.02 0.71 -0.23 0.00 0.00 178.00 179.20 2yu8 s TYR 13 N -3.75 3.08 0.01 1.56 2.02 -1.26 -5.03 117.35 113.98 2yu8 s TYR 13 Ca 0.00 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.32 2yu8 s TYR 13 Cb 0.10 -3.37 -0.01 0.00 -0.40 0.00 0.00 41.96 38.28 2yu8 s TYR 13 CO 0.59 -0.93 -0.05 0.21 -1.57 0.00 0.00 175.55 173.79 2yu8 s LYS 14 N 2.58 0.40 -0.16 -0.62 2.20 -1.26 -0.31 119.74 122.56 2yu8 s LYS 14 Ca 0.16 -0.33 -0.25 0.00 -0.36 0.00 0.00 55.97 55.20 2yu8 s LYS 14 Cb -0.18 -0.32 -0.02 0.00 -1.51 0.00 0.00 37.83 35.81 2yu8 s LYS 14 CO 0.14 0.08 0.80 0.00 -0.36 0.00 0.00 175.35 176.01 2yu8 n ASN 16 N 5.10 0.41 -0.00 0.00 4.13 -1.26 -1.97 115.26 121.67 2yu8 n ASN 16 Ca 0.03 -0.42 -0.02 0.00 1.68 0.00 0.00 54.58 55.86 2yu8 n ASN 16 Cb 0.49 -0.10 -0.01 0.00 -1.54 0.00 0.00 39.78 38.63 2yu8 n ASN 16 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 2yu8 h GLU 17 N 0.44 -0.10 0.00 3.52 4.39 -1.97 -3.43 114.58 117.43 2yu8 h GLU 17 Ca 0.00 0.01 -0.35 0.00 0.34 0.00 0.00 59.36 59.36 2yu8 h GLU 17 Cb 0.38 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.00 2yu8 h GLU 17 CO 0.00 -0.07 -2.19 0.00 -1.16 0.00 0.00 179.01 175.59 2yu8 n GLY 19 N 1.85 0.99 3.68 0.00 0.00 -0.83 -5.08 105.19 105.80 2yu8 n GLY 19 Ca -0.41 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 2yu8 n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yu8 s LYS 20 N 0.00 3.63 0.12 1.61 1.02 -1.24 -4.84 119.74 120.04 2yu8 s LYS 20 Ca 0.00 -0.34 -0.02 0.00 0.02 0.00 0.00 55.97 55.64 2yu8 s LYS 20 Cb 0.00 -3.09 -0.05 0.00 -0.52 0.00 0.00 37.83 34.18 2yu8 s LYS 20 CO 0.00 0.46 0.31 0.08 -0.92 0.00 0.00 175.35 175.28 2yu8 s VAL 21 N -0.17 5.27 0.10 3.17 1.01 -1.26 0.04 120.40 128.55 2yu8 s VAL 21 Ca 0.07 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.82 2yu8 s VAL 21 Cb -0.12 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2yu8 s VAL 21 CO 0.01 0.03 -0.05 -0.36 0.00 0.00 0.00 175.10 174.74 2yu8 s PHE 22 N -1.64 0.86 -0.04 5.22 0.08 0.57 -4.98 117.98 118.05 2yu8 s PHE 22 Ca 0.38 -0.96 -0.14 0.00 0.12 0.00 0.00 56.93 56.32 2yu8 s PHE 22 Cb -0.12 -0.51 -0.31 0.00 -0.57 0.00 0.00 43.02 41.50 2yu8 s PHE 22 CO 0.27 -0.21 0.75 0.00 -0.10 0.00 0.00 175.22 175.93 2yu8 h THR 23 N 2.97 1.10 -2.37 0.64 1.03 -1.99 -3.36 112.91 110.92 2yu8 h THR 23 Ca -0.35 -2.54 -0.59 0.00 -0.01 0.00 0.00 66.41 62.92 2yu8 h THR 23 Cb 1.17 2.87 -0.12 0.00 -1.07 0.00 0.00 68.15 70.99 2yu8 h THR 23 CO 0.65 0.80 -0.71 -1.10 -0.01 0.00 0.00 175.52 175.15 2yu8 s GLN 24 N -2.55 2.00 0.03 0.00 -1.52 -1.26 -4.87 119.66 111.49 2yu8 s GLN 24 Ca -0.15 -1.53 -0.26 0.00 -1.95 0.00 0.00 55.36 51.47 2yu8 s GLN 24 Cb 0.04 -2.00 -0.17 0.00 -0.22 0.00 0.00 33.01 30.66 2yu8 s GLN 24 CO 0.86 0.36 1.37 -2.95 -0.25 0.00 0.00 175.29 174.68 2yu8 h ASN 25 N 2.24 -0.34 -0.73 5.90 -1.07 -1.98 -3.21 115.58 116.39 2yu8 h ASN 25 Ca -0.43 -0.14 0.07 0.00 0.07 0.00 0.00 56.30 55.86 2yu8 h ASN 25 Cb 1.24 0.09 -0.09 0.00 -2.07 0.00 0.00 38.32 37.49 2yu8 h ASN 25 CO 0.59 -0.04 -0.42 -0.24 0.07 0.00 0.00 177.43 177.39 2yu8 n SER 26 N -5.16 -0.75 -0.35 6.14 2.88 -1.26 0.23 113.62 115.36 2yu8 n SER 26 Ca -0.10 1.30 0.14 0.00 -1.33 0.00 0.00 58.87 58.88 2yu8 n SER 26 Cb 0.24 -0.18 0.35 0.00 -0.75 0.00 0.00 64.21 63.87 2yu8 n SER 26 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 2yu8 h HIS 27 N 0.00 1.04 -0.16 0.66 3.86 -1.98 0.24 115.15 118.80 2yu8 h HIS 27 Ca 0.13 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.30 2yu8 h HIS 27 Cb 0.31 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 28.47 2yu8 h HIS 27 CO -0.74 0.19 -0.19 1.25 0.86 0.00 0.00 177.93 179.30 2yu8 h LEU 28 N 0.70 0.44 -0.56 2.43 5.85 0.30 0.21 115.31 124.68 2yu8 h LEU 28 Ca 0.59 -0.50 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 2yu8 h LEU 28 Cb 1.00 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 2yu8 h LEU 28 CO -0.40 0.85 0.33 0.00 -0.34 0.00 0.00 178.44 178.88 2yu8 h ALA 29 N 0.60 0.71 -0.08 1.25 0.00 0.11 -1.96 119.26 119.89 2yu8 h ALA 29 Ca 0.02 -0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.65 2yu8 h ALA 29 Cb 0.74 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2yu8 h ALA 29 CO 0.04 0.20 -0.80 0.07 0.00 0.00 0.00 179.25 178.77 2yu8 h ARG 30 N 0.75 0.55 0.02 0.00 0.11 -0.62 -3.29 114.38 111.90 2yu8 h ARG 30 Ca 0.20 -0.48 0.02 0.00 0.10 0.00 0.00 59.98 59.82 2yu8 h ARG 30 Cb -0.00 0.11 -0.03 0.00 1.11 0.00 0.00 29.97 31.16 2yu8 h ARG 30 CO -0.04 1.11 -0.15 1.25 0.10 0.00 0.00 179.97 182.24 2yu8 h HIS 31 N 0.36 -0.40 -1.74 4.08 2.76 -0.32 -1.59 115.15 118.31 2yu8 h HIS 31 Ca -0.05 0.01 0.53 0.00 -2.20 0.00 0.00 60.37 58.66 2yu8 h HIS 31 Cb 1.41 0.17 -0.10 0.00 1.55 0.00 0.00 27.41 30.45 2yu8 h HIS 31 CO 0.06 -0.23 1.21 0.00 -1.30 0.00 0.00 177.93 177.68 2yu8 h ARG 32 N -0.26 0.01 -0.56 5.26 3.08 -1.43 0.51 114.38 120.99 2yu8 h ARG 32 Ca 0.05 -0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.20 2yu8 h ARG 32 Cb 0.32 -0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.28 2yu8 h ARG 32 CO -0.14 0.01 0.04 0.00 -1.07 0.00 0.00 179.97 178.81 2yu8 h ARG 33 N 0.01 0.15 -0.83 0.04 2.47 -1.43 0.13 114.38 114.92 2yu8 h ARG 33 Ca 0.90 -0.01 0.24 0.00 -1.26 0.00 0.00 59.98 59.85 2yu8 h ARG 33 Cb 3.37 -0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 31.62 2yu8 h ARG 33 CO -0.17 0.10 1.02 -0.39 0.56 0.00 0.00 179.97 181.09 2yu8 h VAL 34 N 0.16 0.08 0.00 2.04 -1.51 -0.12 0.29 116.25 117.19 2yu8 h VAL 34 Ca 0.29 0.00 -0.11 0.00 -1.23 0.00 0.00 66.70 65.64 2yu8 h VAL 34 Cb 0.44 0.16 -0.02 0.00 -2.13 0.00 0.00 31.29 29.75 2yu8 h VAL 34 CO -0.44 0.00 -0.65 0.45 -1.23 0.00 0.00 177.57 175.70 2yu8 h HIS 35 N 0.00 0.00 0.00 5.19 3.86 -0.89 -3.39 115.15 119.92 2yu8 h HIS 35 Ca 0.40 0.00 -0.64 0.00 -1.16 0.00 0.00 60.37 58.97 2yu8 h HIS 35 Cb 2.43 0.00 0.02 0.00 1.06 0.00 0.00 27.41 30.92 2yu8 h HIS 35 CO 0.00 1.14 2.66 0.25 0.86 0.00 0.00 177.93 182.84 2yu8 n THR 36 N -4.53 2.49 0.00 2.45 -2.24 0.10 -4.19 114.28 108.36 2yu8 n THR 36 Ca -0.20 -2.03 0.00 0.00 -2.27 0.00 0.00 64.05 59.54 2yu8 n THR 36 Cb 0.54 -2.40 0.00 0.00 -2.10 0.00 0.00 70.33 66.38 2yu8 n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yu8 n GLY 37 N 4.27 1.51 3.61 3.38 0.00 -1.25 -4.94 105.19 111.76 2yu8 n GLY 37 Ca 0.51 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 2yu8 n GLY 37 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2yu8 s GLY 38 N 0.00 -0.15 0.13 -0.02 0.00 -1.26 -4.78 107.32 101.24 2yu8 s GLY 38 Ca 0.00 2.44 -0.32 0.00 0.00 0.00 0.00 44.72 46.84 2yu8 s GLY 38 CO 0.00 1.39 1.78 1.17 0.00 0.00 0.00 173.10 177.44 2yu8 n LYS 39 N 1.29 2.64 -0.35 2.90 4.81 -1.26 -4.98 118.16 123.21 2yu8 n LYS 39 Ca -0.10 0.96 -0.10 0.00 -0.87 0.00 0.00 58.31 58.20 2yu8 n LYS 39 Cb 0.57 -2.82 0.08 0.00 0.02 0.00 0.00 35.03 32.88 2yu8 n LYS 39 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2yu8 n PRO 40 N 5.06 -1.75 -3.77 1.64 -0.04 -1.26 -5.05 135.00 129.83 2yu8 n PRO 40 Ca 0.18 -0.59 -0.26 0.00 -0.04 0.00 0.00 63.50 62.79 2yu8 n PRO 40 Cb 0.35 -0.55 -0.03 0.00 -0.04 0.00 0.00 33.50 33.23 2yu8 n PRO 40 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2yu8 s SER 41 N -2.50 6.35 -0.48 3.54 0.15 -1.26 -5.07 113.70 114.43 2yu8 s SER 41 Ca 0.24 0.30 0.06 0.00 0.70 0.00 0.00 55.95 57.25 2yu8 s SER 41 Cb -0.02 -1.96 0.25 0.00 -1.71 0.00 0.00 66.02 62.57 2yu8 s SER 41 CO 0.18 -0.05 0.91 0.61 1.20 0.00 0.00 173.24 176.09 2yu8 n GLY 42 N -0.87 0.16 3.72 9.45 0.00 -1.26 -5.15 105.19 111.23 2yu8 n GLY 42 Ca -0.06 0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 2yu8 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yu8 s PRO 43 N 0.60 1.30 -0.29 1.61 0.04 -1.26 -5.08 135.00 131.93 2yu8 s PRO 43 Ca 0.31 0.84 -0.23 0.00 0.04 0.00 0.00 61.00 61.96 2yu8 s PRO 43 Cb 0.24 -1.81 0.14 0.00 0.04 0.00 0.00 34.50 33.10 2yu8 s PRO 43 CO -0.22 -2.21 1.09 -1.54 0.04 0.00 0.00 177.00 174.16 2yu8 s SER 44 N -3.42 -0.39 -0.53 6.66 1.04 -1.26 -5.11 113.70 110.69 2yu8 s SER 44 Ca 0.63 0.71 0.04 0.00 0.48 0.00 0.00 55.95 57.82 2yu8 s SER 44 Cb -0.18 0.82 0.16 0.00 0.10 0.00 0.00 66.02 66.93 2yu8 s SER 44 CO 0.57 -0.12 0.38 -0.44 0.98 0.00 0.00 173.24 174.61 2yu8 s SER 45 N 0.44 3.15 0.00 7.02 0.01 -1.26 -5.38 113.70 117.68 2yu8 s SER 45 Ca 0.01 -3.29 0.23 0.00 1.31 0.00 0.00 55.95 54.22 2yu8 s SER 45 Cb -0.05 -1.00 1.38 0.00 0.21 0.00 0.00 66.02 66.56 2yu8 s SER 45 CO -0.10 -0.15 1.75 0.61 0.41 0.00 0.00 173.24 175.76