#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 4.91 0.18 1.61 0.15 -1.26 -5.11 113.70 114.18 2yu8 s SER 2 Ca 0.00 0.41 -0.24 0.00 0.70 0.00 0.00 55.95 56.82 2yu8 s SER 2 Cb 0.00 -1.11 0.06 0.00 -1.71 0.00 0.00 66.02 63.26 2yu8 s SER 2 CO 0.00 -1.51 0.92 -0.94 1.20 0.00 0.00 173.24 172.91 2yu8 s SER 3 N -4.50 -0.18 0.00 5.45 1.04 -1.26 -5.10 113.70 109.16 2yu8 s SER 3 Ca 0.59 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.57 2yu8 s SER 3 Cb -0.11 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.55 2yu8 s SER 3 CO 0.44 -0.99 0.00 0.61 0.98 0.00 0.00 173.24 174.28 2yu8 n GLY 4 N -0.48 0.72 3.56 7.32 0.00 -1.26 -5.03 105.19 110.03 2yu8 n GLY 4 Ca -0.06 -0.68 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 2yu8 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yu8 s SER 5 N -0.54 6.55 -0.09 1.61 0.15 -1.26 -4.96 113.70 115.16 2yu8 s SER 5 Ca 0.00 -1.62 -0.33 0.00 0.70 0.00 0.00 55.95 54.69 2yu8 s SER 5 Cb 0.00 -2.57 -0.11 0.00 -1.71 0.00 0.00 66.02 61.63 2yu8 s SER 5 CO 0.00 -1.46 1.93 -1.20 1.20 0.00 0.00 173.24 173.71 2yu8 n SER 6 N 8.86 3.48 -2.75 5.45 7.64 -1.26 -4.87 113.62 130.16 2yu8 n SER 6 Ca 0.36 0.90 -0.10 0.00 1.01 0.00 0.00 58.87 61.03 2yu8 n SER 6 Cb 0.50 -1.40 0.03 0.00 -1.01 0.00 0.00 64.21 62.34 2yu8 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yu8 n GLY 7 N 4.61 1.82 3.06 0.23 0.00 -1.26 -5.01 105.19 108.64 2yu8 n GLY 7 Ca 0.24 -1.22 -0.34 0.00 0.00 0.00 0.00 46.02 44.70 2yu8 n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2yu8 s THR 8 N -2.62 3.99 -0.14 2.61 -1.32 -1.26 -5.02 115.64 111.87 2yu8 s THR 8 Ca 0.29 -3.95 -0.30 0.00 -1.21 0.00 0.00 61.69 56.51 2yu8 s THR 8 Cb 0.43 -3.50 0.12 0.00 -1.51 0.00 0.00 72.50 68.04 2yu8 s THR 8 CO 0.01 -1.06 0.95 -0.83 -2.21 0.00 0.00 174.62 171.47 2yu8 s GLY 9 N -0.45 -0.32 -0.27 6.08 0.00 -1.26 -5.14 107.32 105.96 2yu8 s GLY 9 Ca 0.27 1.90 -0.01 0.00 0.00 0.00 0.00 44.72 46.88 2yu8 s GLY 9 CO -0.13 1.01 0.40 -0.54 0.00 0.00 0.00 173.10 173.84 2yu8 s GLU 10 N -1.15 0.39 -0.02 2.90 2.02 -1.26 -5.15 118.70 116.43 2yu8 s GLU 10 Ca -0.03 0.36 -0.04 0.00 0.02 0.00 0.00 54.97 55.29 2yu8 s GLU 10 Cb -0.00 -0.36 0.00 0.00 0.10 0.00 0.00 34.13 33.87 2yu8 s GLU 10 CO 0.03 -0.82 0.08 0.15 0.02 0.00 0.00 175.26 174.72 2yu8 s LYS 11 N 2.56 0.21 0.16 1.61 3.01 -1.26 -5.03 119.74 120.99 2yu8 s LYS 11 Ca 0.12 -0.08 0.20 0.00 -1.01 0.00 0.00 55.97 55.20 2yu8 s LYS 11 Cb -0.14 0.09 0.84 0.00 -1.01 0.00 0.00 37.83 37.61 2yu8 s LYS 11 CO -0.23 -0.04 1.61 -0.35 0.51 0.00 0.00 175.35 176.86 2yu8 n PRO 12 N 2.52 0.12 -3.36 -1.68 -0.04 -1.26 -4.60 135.00 126.70 2yu8 n PRO 12 Ca -0.16 0.36 -0.40 0.00 -0.04 0.00 0.00 63.50 63.26 2yu8 n PRO 12 Cb 0.58 -1.73 -0.09 0.00 -0.04 0.00 0.00 33.50 32.22 2yu8 n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2yu8 s TYR 13 N -3.20 3.23 0.05 0.54 2.02 -1.25 -5.05 117.35 113.68 2yu8 s TYR 13 Ca 0.05 0.31 -0.08 0.00 -0.37 0.00 0.00 57.07 56.97 2yu8 s TYR 13 Cb 0.09 -2.65 -0.00 0.00 -0.40 0.00 0.00 41.96 39.00 2yu8 s TYR 13 CO 0.34 -0.32 0.17 0.21 -1.57 0.00 0.00 175.55 174.38 2yu8 s LYS 14 N 2.12 0.69 -0.19 -0.62 2.20 -1.26 -0.33 119.74 122.35 2yu8 s LYS 14 Ca 0.15 -0.72 -0.18 0.00 -0.36 0.00 0.00 55.97 54.86 2yu8 s LYS 14 Cb -0.16 0.28 -0.03 0.00 -1.51 0.00 0.00 37.83 36.41 2yu8 s LYS 14 CO 0.11 -0.20 0.51 0.00 -0.36 0.00 0.00 175.35 175.41 2yu8 n ASN 16 N 4.71 1.25 -0.09 0.00 5.15 -1.26 -2.30 115.26 122.71 2yu8 n ASN 16 Ca -0.05 -2.04 -0.14 0.00 -0.60 0.00 0.00 54.58 51.74 2yu8 n ASN 16 Cb 0.50 -0.21 -0.05 0.00 -0.53 0.00 0.00 39.78 39.50 2yu8 n ASN 16 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2yu8 n GLU 17 N 0.08 0.50 -0.10 1.20 -0.58 -1.26 -4.88 120.64 115.61 2yu8 n GLU 17 Ca 0.07 0.21 -0.19 0.00 -0.42 0.00 0.00 57.16 56.82 2yu8 n GLU 17 Cb 0.22 -1.37 -0.07 0.00 -0.57 0.00 0.00 31.44 29.65 2yu8 n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2yu8 n GLY 19 N 1.98 1.55 3.79 0.00 0.00 -0.97 -5.07 105.19 106.48 2yu8 n GLY 19 Ca -0.37 0.00 -0.38 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 4.15 0.00 1.61 1.02 -1.26 -4.79 119.74 120.48 2yu8 s LYS 20 Ca 0.00 0.57 -0.01 0.00 0.02 0.00 0.00 55.97 56.55 2yu8 s LYS 20 Cb 0.00 -3.29 -0.04 0.00 -0.52 0.00 0.00 37.83 33.98 2yu8 s LYS 20 CO 0.00 0.52 0.15 0.08 -0.92 0.00 0.00 175.35 175.18 2yu8 s VAL 21 N -0.63 5.18 0.18 3.17 1.01 -1.26 0.33 120.40 128.39 2yu8 s VAL 21 Ca 0.27 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.98 2yu8 s VAL 21 Cb -0.18 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 2yu8 s VAL 21 CO 0.15 0.30 0.02 -0.36 0.00 0.00 0.00 175.10 175.21 2yu8 s PHE 22 N -1.31 1.23 -0.10 5.22 0.40 0.55 -4.97 117.98 119.00 2yu8 s PHE 22 Ca 0.27 -1.07 -0.02 0.00 -0.60 0.00 0.00 56.93 55.51 2yu8 s PHE 22 Cb -0.12 -0.70 -0.26 0.00 0.51 0.00 0.00 43.02 42.45 2yu8 s PHE 22 CO 0.19 -0.26 0.44 -2.37 0.70 0.00 0.00 175.22 173.91 2yu8 n THR 23 N -0.26 1.75 -4.27 0.64 5.66 -1.26 -3.92 114.28 112.61 2yu8 n THR 23 Ca -0.05 -0.69 -0.24 0.00 -3.05 0.00 0.00 64.05 60.02 2yu8 n THR 23 Cb 0.64 -1.58 -0.08 0.00 -1.55 0.00 0.00 70.33 67.76 2yu8 n THR 23 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 2yu8 s GLN 24 N -2.57 2.30 0.03 1.09 -1.52 -1.26 -4.85 119.66 112.88 2yu8 s GLN 24 Ca -0.18 -1.32 -0.20 0.00 -1.95 0.00 0.00 55.36 51.71 2yu8 s GLN 24 Cb 0.07 -2.21 -0.18 0.00 -0.22 0.00 0.00 33.01 30.47 2yu8 s GLN 24 CO 0.78 0.39 1.23 -2.95 -0.25 0.00 0.00 175.29 174.50 2yu8 h ASN 25 N 2.19 0.49 -0.45 5.90 -1.07 -1.99 -3.20 115.58 117.46 2yu8 h ASN 25 Ca -0.45 -0.61 0.09 0.00 0.07 0.00 0.00 56.30 55.39 2yu8 h ASN 25 Cb 1.23 -0.14 -0.10 0.00 -2.07 0.00 0.00 38.32 37.24 2yu8 h ASN 25 CO 0.59 1.02 -0.32 0.28 0.07 0.00 0.00 177.43 179.07 2yu8 h SER 26 N -0.01 -1.07 -0.79 6.14 0.02 -1.99 0.27 113.55 116.12 2yu8 h SER 26 Ca -0.01 0.20 0.13 0.00 -0.84 0.00 0.00 61.79 61.26 2yu8 h SER 26 Cb 0.98 0.51 -0.09 0.00 0.14 0.00 0.00 62.40 63.95 2yu8 h SER 26 CO 0.07 -0.31 0.38 0.45 -1.14 0.00 0.00 176.83 176.29 2yu8 h HIS 27 N -0.22 0.67 -0.26 3.45 3.86 -1.99 0.63 115.15 121.28 2yu8 h HIS 27 Ca 0.19 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.40 2yu8 h HIS 27 Cb 0.53 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.81 2yu8 h HIS 27 CO -0.56 0.17 0.03 1.25 0.86 0.00 0.00 177.93 179.68 2yu8 h LEU 28 N 0.58 0.43 -0.11 2.43 5.85 -0.94 0.97 115.31 124.52 2yu8 h LEU 28 Ca 0.42 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.87 2yu8 h LEU 28 Cb 0.56 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 2yu8 h LEU 28 CO -0.34 0.60 0.01 0.00 -0.34 0.00 0.00 178.44 178.37 2yu8 h ALA 29 N 0.85 0.10 -0.23 1.25 0.00 0.38 -2.00 119.26 119.61 2yu8 h ALA 29 Ca 0.08 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 2yu8 h ALA 29 Cb 0.36 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2yu8 h ALA 29 CO 0.01 -0.45 -0.26 0.07 0.00 0.00 0.00 179.25 178.62 2yu8 h ARG 30 N 0.06 0.44 0.32 0.00 0.11 -0.88 -3.17 114.38 111.25 2yu8 h ARG 30 Ca 0.05 -0.16 -0.00 0.00 0.10 0.00 0.00 59.98 59.96 2yu8 h ARG 30 Cb 0.05 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 31.09 2yu8 h ARG 30 CO -0.07 0.67 -0.24 1.25 0.10 0.00 0.00 179.97 181.67 2yu8 h HIS 31 N 0.39 -0.64 -1.22 4.08 2.76 -0.33 -1.79 115.15 118.39 2yu8 h HIS 31 Ca 0.06 -0.00 0.35 0.00 -2.20 0.00 0.00 60.37 58.58 2yu8 h HIS 31 Cb 0.66 0.24 -0.05 0.00 1.55 0.00 0.00 27.41 29.81 2yu8 h HIS 31 CO 0.02 -0.37 1.22 0.54 -1.30 0.00 0.00 177.93 178.04 2yu8 n ARG 32 N -5.37 0.01 -0.24 5.26 1.74 -0.79 0.38 116.66 117.64 2yu8 n ARG 32 Ca -0.09 0.99 0.05 0.00 -0.77 0.00 0.00 57.85 58.02 2yu8 n ARG 32 Cb 0.28 -2.41 0.18 0.00 -1.02 0.00 0.00 32.46 29.49 2yu8 n ARG 32 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2yu8 h ARG 33 N 0.00 0.29 -0.98 5.56 2.47 -1.46 0.00 114.38 120.27 2yu8 h ARG 33 Ca 0.58 -0.02 0.33 0.00 -1.26 0.00 0.00 59.98 59.61 2yu8 h ARG 33 Cb 3.01 -0.07 -0.16 0.00 -1.65 0.00 0.00 29.97 31.10 2yu8 h ARG 33 CO -0.01 0.19 0.44 -0.39 0.56 0.00 0.00 179.97 180.77 2yu8 h VAL 34 N 0.30 0.19 0.36 2.04 -1.51 -0.27 -1.58 116.25 115.79 2yu8 h VAL 34 Ca 0.41 -0.06 -0.02 0.00 -1.23 0.00 0.00 66.70 65.80 2yu8 h VAL 34 Cb 0.67 -0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.83 2yu8 h VAL 34 CO -0.48 0.03 -0.17 0.45 -1.23 0.00 0.00 177.57 176.17 2yu8 h HIS 35 N 0.18 -0.45 -2.35 5.19 3.86 -1.18 -3.38 115.15 117.02 2yu8 h HIS 35 Ca 0.72 -0.01 -0.74 0.00 -1.16 0.00 0.00 60.37 59.18 2yu8 h HIS 35 Cb 1.67 0.15 -0.19 0.00 1.06 0.00 0.00 27.41 30.10 2yu8 h HIS 35 CO -0.11 -0.28 1.21 -0.08 0.86 0.00 0.00 177.93 179.52 2yu8 s THR 36 N -3.17 5.11 -0.17 2.45 -1.32 -0.61 -4.77 115.64 113.17 2yu8 s THR 36 Ca -0.07 -2.63 -0.21 0.00 -1.21 0.00 0.00 61.69 57.57 2yu8 s THR 36 Cb 0.01 -4.87 -0.23 0.00 -1.51 0.00 0.00 72.50 65.91 2yu8 s THR 36 CO 0.21 -1.56 0.40 1.23 -2.21 0.00 0.00 174.62 172.69 2yu8 h GLY 37 N 9.45 0.08 0.00 6.08 0.00 -1.70 -3.44 103.07 113.54 2yu8 h GLY 37 Ca 0.29 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2yu8 h GLY 37 CO 1.20 0.18 0.00 0.61 0.00 0.00 0.00 176.54 178.53 2yu8 n GLY 38 N 1.56 0.23 2.62 4.60 0.00 -1.26 -4.95 105.19 107.99 2yu8 n GLY 38 Ca -0.27 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.65 2yu8 n GLY 38 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yu8 n LYS 39 N 0.00 -3.01 0.00 1.61 5.02 -1.26 -4.89 118.16 115.64 2yu8 n LYS 39 Ca 0.00 0.56 0.06 0.00 -2.02 0.00 0.00 58.31 56.91 2yu8 n LYS 39 Cb 0.00 -4.54 0.37 0.00 -0.02 0.00 0.00 35.03 30.84 2yu8 n LYS 39 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2yu8 n PRO 40 N -2.86 0.49 -3.71 1.97 -0.04 -1.26 -4.29 135.00 125.30 2yu8 n PRO 40 Ca -0.12 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.04 2yu8 n PRO 40 Cb 0.60 -1.40 -0.15 0.00 -0.04 0.00 0.00 33.50 32.51 2yu8 n PRO 40 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2yu8 s SER 41 N -1.90 3.93 -0.15 3.54 0.01 -1.26 -4.40 113.70 113.47 2yu8 s SER 41 Ca 0.19 -1.56 -0.34 0.00 1.31 0.00 0.00 55.95 55.54 2yu8 s SER 41 Cb 0.09 -0.78 0.13 0.00 0.21 0.00 0.00 66.02 65.67 2yu8 s SER 41 CO 0.14 -0.42 1.24 -0.83 0.41 0.00 0.00 173.24 173.79 2yu8 s GLY 42 N 1.70 -0.32 0.36 3.44 0.00 -0.86 -4.99 107.32 106.64 2yu8 s GLY 42 Ca 0.09 1.37 0.27 0.00 0.00 0.00 0.00 44.72 46.45 2yu8 s GLY 42 CO -0.26 0.42 1.81 -0.56 0.00 0.00 0.00 173.10 174.51 2yu8 h PRO 43 N 2.00 0.00 0.00 2.90 0.13 -1.99 -3.32 132.00 131.72 2yu8 h PRO 43 Ca -0.15 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.94 2yu8 h PRO 43 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2yu8 h PRO 43 CO 0.24 0.00 -1.12 0.43 -0.23 0.00 0.00 178.00 177.32 2yu8 n SER 44 N -2.52 1.93 -4.55 1.44 7.64 -1.26 -5.01 113.62 111.29 2yu8 n SER 44 Ca 0.02 0.36 -0.31 0.00 1.01 0.00 0.00 58.87 59.95 2yu8 n SER 44 Cb 0.25 -0.76 -0.11 0.00 -1.01 0.00 0.00 64.21 62.58 2yu8 n SER 44 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yu8 s SER 45 N -6.07 4.30 0.00 6.43 0.15 -1.25 -5.18 113.70 112.09 2yu8 s SER 45 Ca -0.29 -0.33 0.21 0.00 0.70 0.00 0.00 55.95 56.24 2yu8 s SER 45 Cb 0.05 -0.84 0.16 0.00 -1.71 0.00 0.00 66.02 63.68 2yu8 s SER 45 CO 0.42 0.23 1.15 0.61 1.20 0.00 0.00 173.24 176.85