#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 7.22 0.07 1.61 0.15 -1.26 -5.02 113.70 116.47 2yu8 s SER 2 Ca 0.00 -3.37 -0.24 0.00 0.70 0.00 0.00 55.95 53.04 2yu8 s SER 2 Cb 0.00 -2.27 -0.06 0.00 -1.71 0.00 0.00 66.02 61.98 2yu8 s SER 2 CO 0.00 -0.45 0.74 -0.44 1.20 0.00 0.00 173.24 174.29 2yu8 s SER 3 N 1.85 7.22 0.00 5.45 0.01 -1.26 -5.06 113.70 121.91 2yu8 s SER 3 Ca 0.34 1.45 0.00 0.00 1.31 0.00 0.00 55.95 59.05 2yu8 s SER 3 Cb -0.08 -2.46 0.00 0.00 0.21 0.00 0.00 66.02 63.70 2yu8 s SER 3 CO -0.05 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.29 2yu8 n GLY 4 N 2.17 -3.23 2.90 3.44 0.00 -1.26 -4.82 105.19 104.40 2yu8 n GLY 4 Ca -0.04 -0.41 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 2yu8 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yu8 n SER 5 N 0.00 3.81 -4.13 1.61 2.88 -1.26 -4.98 113.62 111.55 2yu8 n SER 5 Ca 0.00 -3.24 -0.41 0.00 -1.33 0.00 0.00 58.87 53.89 2yu8 n SER 5 Cb 0.00 -0.89 -0.01 0.00 -0.75 0.00 0.00 64.21 62.56 2yu8 n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2yu8 n SER 6 N 1.85 5.43 0.00 -3.46 2.88 -1.26 -4.50 113.62 114.57 2yu8 n SER 6 Ca 0.23 -3.20 0.00 0.00 -1.33 0.00 0.00 58.87 54.57 2yu8 n SER 6 Cb 0.37 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 62.59 2yu8 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yu8 n GLY 7 N 2.07 0.87 3.43 0.46 0.00 -1.26 -5.15 105.19 105.61 2yu8 n GLY 7 Ca 0.25 -0.07 -0.05 0.00 0.00 0.00 0.00 46.02 46.14 2yu8 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yu8 s THR 8 N -0.20 -0.79 0.00 2.61 2.01 -1.26 -5.15 115.64 112.85 2yu8 s THR 8 Ca 0.00 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.10 2yu8 s THR 8 Cb 0.00 -0.81 0.00 0.00 0.01 0.00 0.00 72.50 71.70 2yu8 s THR 8 CO 0.00 0.04 0.00 0.61 -0.69 0.00 0.00 174.62 174.58 2yu8 n GLY 9 N 5.40 0.83 3.25 4.40 0.00 -1.26 -4.89 105.19 112.92 2yu8 n GLY 9 Ca -0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.48 2yu8 n GLY 9 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2yu8 n GLU 10 N 0.00 3.68 -3.51 1.61 0.28 -1.26 -4.94 120.64 116.50 2yu8 n GLU 10 Ca 0.00 -4.16 -0.42 0.00 -0.16 0.00 0.00 57.16 52.43 2yu8 n GLU 10 Cb 0.00 -2.75 -0.05 0.00 1.43 0.00 0.00 31.44 30.07 2yu8 n GLU 10 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2yu8 s LYS 11 N -0.46 3.21 0.33 3.44 -0.14 -1.26 -4.89 119.74 119.96 2yu8 s LYS 11 Ca 0.36 -2.63 0.26 0.00 -1.36 0.00 0.00 55.97 52.60 2yu8 s LYS 11 Cb -0.02 -4.12 1.09 0.00 -1.68 0.00 0.00 37.83 33.10 2yu8 s LYS 11 CO -0.01 -1.24 1.78 -1.00 -0.76 0.00 0.00 175.35 174.12 2yu8 h PRO 12 N 7.22 0.00 -5.41 -1.68 0.13 -1.92 -3.42 132.00 126.92 2yu8 h PRO 12 Ca 0.07 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.57 2yu8 h PRO 12 Cb 0.97 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.97 2yu8 h PRO 12 CO 0.76 0.00 0.08 0.71 -0.23 0.00 0.00 178.00 179.32 2yu8 s TYR 13 N -3.41 3.18 -0.02 1.56 2.02 -1.25 -5.04 117.35 114.39 2yu8 s TYR 13 Ca 0.03 0.36 -0.02 0.00 -0.37 0.00 0.00 57.07 57.08 2yu8 s TYR 13 Cb 0.09 -3.03 0.00 0.00 -0.40 0.00 0.00 41.96 38.62 2yu8 s TYR 13 CO 0.42 -0.56 0.05 0.21 -1.57 0.00 0.00 175.55 174.10 2yu8 s LYS 14 N 2.59 0.08 -0.12 -0.62 2.20 -1.26 -1.09 119.74 121.52 2yu8 s LYS 14 Ca 0.23 0.01 -0.29 0.00 -0.36 0.00 0.00 55.97 55.56 2yu8 s LYS 14 Cb -0.15 0.04 -0.01 0.00 -1.51 0.00 0.00 37.83 36.20 2yu8 s LYS 14 CO 0.14 -0.01 1.07 0.00 -0.36 0.00 0.00 175.35 176.18 2yu8 n ASN 16 N 5.38 2.68 -0.08 0.00 2.85 -1.26 -2.89 115.26 121.95 2yu8 n ASN 16 Ca 0.10 -2.27 -0.10 0.00 -0.11 0.00 0.00 54.58 52.21 2yu8 n ASN 16 Cb 0.47 -0.45 -0.03 0.00 1.24 0.00 0.00 39.78 41.01 2yu8 n ASN 16 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2yu8 n GLU 17 N 0.37 0.46 -0.11 1.20 -0.58 -1.26 -4.89 120.64 115.83 2yu8 n GLU 17 Ca 0.12 0.18 -0.22 0.00 -0.42 0.00 0.00 57.16 56.82 2yu8 n GLU 17 Cb 0.54 -1.30 -0.08 0.00 -0.57 0.00 0.00 31.44 30.03 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 1.74 0.91 3.95 0.00 0.00 -1.14 -4.20 105.19 106.46 2yu8 n GLY 19 Ca -0.42 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 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 2.42 0.03 1.61 1.02 -1.25 -4.84 119.74 118.73 2yu8 s LYS 20 Ca 0.00 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 55.43 2yu8 s LYS 20 Cb 0.00 -2.36 -0.02 0.00 -0.52 0.00 0.00 37.83 34.93 2yu8 s LYS 20 CO 0.00 -0.91 -0.04 0.08 -0.92 0.00 0.00 175.35 173.56 2yu8 s VAL 21 N -2.95 0.18 0.18 3.17 1.01 -1.26 -0.06 120.40 120.67 2yu8 s VAL 21 Ca 0.58 -1.10 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 2yu8 s VAL 21 Cb -0.10 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 2yu8 s VAL 21 CO 0.41 -0.59 0.26 -0.36 0.00 0.00 0.00 175.10 174.82 2yu8 s PHE 22 N -1.93 0.61 -0.08 5.22 0.40 -0.25 -4.99 117.98 116.96 2yu8 s PHE 22 Ca -0.11 -0.94 0.22 0.00 -0.60 0.00 0.00 56.93 55.50 2yu8 s PHE 22 Cb -0.07 -0.17 -0.26 0.00 0.51 0.00 0.00 43.02 43.04 2yu8 s PHE 22 CO -0.03 -0.73 0.59 -2.37 0.70 0.00 0.00 175.22 173.38 2yu8 n THR 23 N -0.24 0.22 -4.68 0.64 5.66 -1.26 -3.87 114.28 110.75 2yu8 n THR 23 Ca -0.04 -0.53 -0.26 0.00 -3.05 0.00 0.00 64.05 60.17 2yu8 n THR 23 Cb 0.63 -0.11 -0.14 0.00 -1.55 0.00 0.00 70.33 69.16 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 -3.43 1.43 0.07 1.09 -0.21 -1.26 -4.92 119.66 112.42 2yu8 s GLN 24 Ca -0.06 -0.94 -0.20 0.00 0.02 0.00 0.00 55.36 54.18 2yu8 s GLN 24 Cb 0.13 -1.53 -0.11 0.00 1.00 0.00 0.00 33.01 32.50 2yu8 s GLN 24 CO 0.88 0.39 1.49 -2.95 -2.12 0.00 0.00 175.29 172.98 2yu8 h ASN 25 N 4.91 0.35 -0.56 5.90 -1.07 -1.99 -2.87 115.58 120.25 2yu8 h ASN 25 Ca -0.43 -0.32 0.11 0.00 0.07 0.00 0.00 56.30 55.73 2yu8 h ASN 25 Cb 1.16 -0.09 -0.11 0.00 -2.07 0.00 0.00 38.32 37.21 2yu8 h ASN 25 CO 0.44 0.58 -0.19 0.28 0.07 0.00 0.00 177.43 178.62 2yu8 h SER 26 N 0.10 -0.67 -0.33 6.14 0.02 -1.99 0.20 113.55 117.02 2yu8 h SER 26 Ca 0.05 0.18 0.03 0.00 -0.84 0.00 0.00 61.79 61.22 2yu8 h SER 26 Cb 0.41 0.40 -0.03 0.00 0.14 0.00 0.00 62.40 63.32 2yu8 h SER 26 CO 0.01 -0.22 0.13 0.45 -1.14 0.00 0.00 176.83 176.06 2yu8 h HIS 27 N -0.05 0.24 -0.14 3.45 3.86 -1.98 -2.13 115.15 118.39 2yu8 h HIS 27 Ca 0.26 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.50 2yu8 h HIS 27 Cb 0.46 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 2yu8 h HIS 27 CO -0.50 0.11 0.05 1.25 0.86 0.00 0.00 177.93 179.70 2yu8 h LEU 28 N 0.28 0.06 -0.75 2.43 5.85 -0.90 -1.72 115.31 120.56 2yu8 h LEU 28 Ca 0.15 0.01 0.14 0.00 0.84 0.00 0.00 57.88 59.02 2yu8 h LEU 28 Cb 0.10 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.04 2yu8 h LEU 28 CO -0.13 0.06 0.31 0.00 -0.34 0.00 0.00 178.44 178.33 2yu8 h ALA 29 N 1.09 1.06 -0.16 1.25 0.00 -0.35 -1.51 119.26 120.63 2yu8 h ALA 29 Ca 0.06 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2yu8 h ALA 29 Cb 0.03 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2yu8 h ALA 29 CO -0.06 -0.20 0.06 0.00 0.00 0.00 0.00 179.25 179.05 2yu8 h ARG 30 N 0.46 0.24 -0.23 0.00 3.08 -0.97 -3.15 114.38 113.80 2yu8 h ARG 30 Ca 0.41 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.47 2yu8 h ARG 30 Cb 0.61 -0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.55 2yu8 h ARG 30 CO -0.39 0.33 -0.33 1.25 -1.07 0.00 0.00 179.97 179.76 2yu8 h HIS 31 N 0.09 -0.91 -1.48 3.04 2.76 -0.40 0.65 115.15 118.89 2yu8 h HIS 31 Ca 0.05 0.05 0.43 0.00 -2.20 0.00 0.00 60.37 58.70 2yu8 h HIS 31 Cb 0.19 0.44 -0.06 0.00 1.55 0.00 0.00 27.41 29.53 2yu8 h HIS 31 CO -0.01 -0.40 1.20 0.54 -1.30 0.00 0.00 177.93 177.96 2yu8 n ARG 32 N -5.41 0.00 -0.22 5.26 1.74 -0.78 0.53 116.66 117.78 2yu8 n ARG 32 Ca -0.02 0.93 0.03 0.00 -0.77 0.00 0.00 57.85 58.02 2yu8 n ARG 32 Cb 0.33 -2.20 0.13 0.00 -1.02 0.00 0.00 32.46 29.71 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 0.17 -0.51 5.56 2.47 -0.97 0.45 114.38 121.55 2yu8 h ARG 33 Ca 0.70 -0.01 0.15 0.00 -1.26 0.00 0.00 59.98 59.56 2yu8 h ARG 33 Cb 3.09 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 31.35 2yu8 h ARG 33 CO -0.01 0.11 0.63 -0.39 0.56 0.00 0.00 179.97 180.87 2yu8 h VAL 34 N 0.17 0.24 0.10 2.04 -1.51 -0.10 0.36 116.25 117.56 2yu8 h VAL 34 Ca 0.36 0.00 -0.32 0.00 -1.23 0.00 0.00 66.70 65.51 2yu8 h VAL 34 Cb 0.60 0.49 -0.02 0.00 -2.13 0.00 0.00 31.29 30.23 2yu8 h VAL 34 CO -0.53 0.00 -1.71 0.45 -1.23 0.00 0.00 177.57 174.55 2yu8 h HIS 35 N 0.00 0.40 -0.07 5.19 3.86 -0.28 -3.35 115.15 120.90 2yu8 h HIS 35 Ca 0.24 -0.29 -0.11 0.00 -1.16 0.00 0.00 60.37 59.05 2yu8 h HIS 35 Cb 1.49 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 29.90 2yu8 h HIS 35 CO 0.00 1.45 -0.10 0.25 0.86 0.00 0.00 177.93 180.39 2yu8 n THR 36 N -3.40 2.46 0.00 2.45 -2.24 0.13 -3.52 114.28 110.15 2yu8 n THR 36 Ca -0.21 -1.02 0.00 0.00 -2.27 0.00 0.00 64.05 60.54 2yu8 n THR 36 Cb 1.05 -1.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.61 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 1.76 0.00 0.00 3.38 0.00 -1.22 -5.00 105.19 104.11 2yu8 n GLY 37 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2yu8 n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yu8 n GLY 38 N 0.00 4.30 3.64 -0.02 0.00 -1.23 -5.01 105.19 106.87 2yu8 n GLY 38 Ca 0.00 -1.38 -0.09 0.00 0.00 0.00 0.00 46.02 44.55 2yu8 n GLY 38 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yu8 s LYS 39 N -4.01 0.49 0.24 1.61 2.20 -1.26 -4.28 119.74 114.71 2yu8 s LYS 39 Ca 0.00 0.56 -0.04 0.00 -0.36 0.00 0.00 55.97 56.13 2yu8 s LYS 39 Cb 0.00 0.24 0.06 0.00 -1.51 0.00 0.00 37.83 36.62 2yu8 s LYS 39 CO 0.00 -0.06 0.21 -0.35 -0.36 0.00 0.00 175.35 174.79 2yu8 n PRO 40 N 2.15 -1.43 -3.15 4.03 -0.04 -1.26 -4.95 135.00 130.35 2yu8 n PRO 40 Ca -0.12 -0.34 -0.45 0.00 -0.04 0.00 0.00 63.50 62.55 2yu8 n PRO 40 Cb 0.56 -0.32 -0.01 0.00 -0.04 0.00 0.00 33.50 33.69 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 -2.08 6.92 0.00 3.54 0.01 -1.26 -4.66 113.70 116.17 2yu8 s SER 41 Ca 0.14 -2.79 0.00 0.00 1.31 0.00 0.00 55.95 54.61 2yu8 s SER 41 Cb -0.01 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.92 2yu8 s SER 41 CO 0.10 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.69 2yu8 n GLY 42 N 4.11 0.54 0.00 3.44 0.00 -1.26 -5.00 105.19 107.02 2yu8 n GLY 42 Ca 0.23 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.31 2yu8 n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2yu8 n PRO 43 N 0.00 0.48 -2.62 1.61 -0.04 -1.26 -4.77 135.00 128.40 2yu8 n PRO 43 Ca 0.00 0.01 -0.40 0.00 -0.04 0.00 0.00 63.50 63.06 2yu8 n PRO 43 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 2yu8 n PRO 43 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2yu8 s SER 44 N -2.03 7.45 -0.49 3.54 0.15 -1.26 -4.72 113.70 116.33 2yu8 s SER 44 Ca 0.23 2.05 -0.45 0.00 0.70 0.00 0.00 55.95 58.48 2yu8 s SER 44 Cb 0.11 -2.61 -0.19 0.00 -1.71 0.00 0.00 66.02 61.61 2yu8 s SER 44 CO 0.18 -0.03 1.86 -0.24 1.20 0.00 0.00 173.24 176.22 2yu8 n SER 45 N 1.75 1.05 0.00 5.45 2.88 -1.26 -5.05 113.62 118.44 2yu8 n SER 45 Ca -0.00 0.94 0.00 0.00 -1.33 0.00 0.00 58.87 58.47 2yu8 n SER 45 Cb 0.46 -0.90 0.00 0.00 -0.75 0.00 0.00 64.21 63.02 2yu8 n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42