#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 -1.01 0.03 1.61 0.01 -1.26 -5.17 113.70 107.91 2yu8 s SER 2 Ca 0.00 1.45 0.02 0.00 1.31 0.00 0.00 55.95 58.73 2yu8 s SER 2 Cb 0.00 1.97 -0.02 0.00 0.21 0.00 0.00 66.02 68.19 2yu8 s SER 2 CO 0.00 -0.21 -0.08 -0.44 0.41 0.00 0.00 173.24 172.92 2yu8 s SER 3 N 2.49 0.89 0.00 2.44 0.01 -1.26 -5.14 113.70 113.13 2yu8 s SER 3 Ca -0.07 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 56.77 2yu8 s SER 3 Cb -0.09 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.13 2yu8 s SER 3 CO -0.19 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 173.96 2yu8 n GLY 4 N 1.89 -2.28 3.98 3.44 0.00 -1.26 -5.16 105.19 105.80 2yu8 n GLY 4 Ca -0.20 -1.39 -0.21 0.00 0.00 0.00 0.00 46.02 44.22 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 -0.63 5.03 0.19 1.61 0.01 -1.26 -5.15 113.70 113.50 2yu8 s SER 5 Ca 0.00 -0.91 0.04 0.00 1.31 0.00 0.00 55.95 56.40 2yu8 s SER 5 Cb 0.00 0.17 -0.05 0.00 0.21 0.00 0.00 66.02 66.35 2yu8 s SER 5 CO 0.00 -1.16 -0.05 -0.44 0.41 0.00 0.00 173.24 171.99 2yu8 s SER 6 N -4.49 1.84 -1.14 2.44 0.01 -1.26 -5.05 113.70 106.06 2yu8 s SER 6 Ca 0.53 -1.12 -0.16 0.00 1.31 0.00 0.00 55.95 56.51 2yu8 s SER 6 Cb -0.05 -0.01 -0.06 0.00 0.21 0.00 0.00 66.02 66.11 2yu8 s SER 6 CO 0.33 -0.42 2.18 0.61 0.41 0.00 0.00 173.24 176.35 2yu8 n GLY 7 N -0.32 3.53 3.27 3.44 0.00 -1.26 -4.85 105.19 109.01 2yu8 n GLY 7 Ca -0.07 -1.36 -0.15 0.00 0.00 0.00 0.00 46.02 44.44 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 3.80 0.51 -0.02 2.61 -4.23 -1.26 -5.17 115.64 111.88 2yu8 s THR 8 Ca 0.53 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 59.06 2yu8 s THR 8 Cb 0.14 -2.44 0.01 0.00 1.34 0.00 0.00 72.50 71.55 2yu8 s THR 8 CO -0.00 -0.17 -0.06 -0.83 -0.54 0.00 0.00 174.62 173.02 2yu8 s GLY 9 N -3.24 0.39 0.23 3.99 0.00 -1.26 -5.15 107.32 102.27 2yu8 s GLY 9 Ca 0.33 -0.21 0.08 0.00 0.00 0.00 0.00 44.72 44.93 2yu8 s GLY 9 CO 0.10 0.01 0.04 -0.54 0.00 0.00 0.00 173.10 172.71 2yu8 s GLU 10 N 0.24 2.48 0.08 2.90 8.01 -1.26 -5.14 118.70 126.02 2yu8 s GLU 10 Ca -0.03 -1.22 0.06 0.00 0.01 0.00 0.00 54.97 53.79 2yu8 s GLU 10 Cb -0.07 -2.33 -0.04 0.00 -4.31 0.00 0.00 34.13 27.38 2yu8 s GLU 10 CO -0.00 0.41 -0.06 0.15 0.01 0.00 0.00 175.26 175.77 2yu8 s LYS 11 N -3.42 2.34 0.34 1.61 3.01 -1.26 -5.01 119.74 117.34 2yu8 s LYS 11 Ca 0.30 -0.92 0.26 0.00 -1.01 0.00 0.00 55.97 54.61 2yu8 s LYS 11 Cb -0.08 -2.42 1.10 0.00 -1.01 0.00 0.00 37.83 35.43 2yu8 s LYS 11 CO 0.20 0.53 1.79 -1.00 0.51 0.00 0.00 175.35 177.38 2yu8 h PRO 12 N 3.68 0.00 -4.55 -1.68 0.13 -1.91 -3.40 132.00 124.27 2yu8 h PRO 12 Ca -0.48 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 63.93 2yu8 h PRO 12 Cb 1.17 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.09 2yu8 h PRO 12 CO 0.55 0.00 -0.12 0.71 -0.23 0.00 0.00 178.00 178.91 2yu8 s TYR 13 N -3.42 3.14 -0.04 1.56 2.02 -1.26 -5.03 117.35 114.32 2yu8 s TYR 13 Ca 0.03 -0.87 0.02 0.00 -0.37 0.00 0.00 57.07 55.88 2yu8 s TYR 13 Cb 0.09 -3.53 0.02 0.00 -0.40 0.00 0.00 41.96 38.14 2yu8 s TYR 13 CO 0.43 -0.99 -0.07 0.21 -1.57 0.00 0.00 175.55 173.55 2yu8 s LYS 14 N 2.13 1.01 0.01 -0.62 2.20 -1.26 -0.73 119.74 122.47 2yu8 s LYS 14 Ca 0.09 -0.20 -0.30 0.00 -0.36 0.00 0.00 55.97 55.19 2yu8 s LYS 14 Cb -0.24 -0.94 -0.06 0.00 -1.51 0.00 0.00 37.83 35.08 2yu8 s LYS 14 CO 0.08 -0.02 1.53 0.00 -0.36 0.00 0.00 175.35 176.58 2yu8 n ASN 16 N 5.79 2.45 -0.08 0.00 2.85 -1.26 -2.82 115.26 122.19 2yu8 n ASN 16 Ca 0.15 -2.23 -0.08 0.00 -0.11 0.00 0.00 54.58 52.30 2yu8 n ASN 16 Cb 0.42 -0.43 -0.03 0.00 1.24 0.00 0.00 39.78 40.99 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 0.32 0.47 -0.11 1.20 -0.58 -1.26 -4.89 120.64 115.80 2yu8 n GLU 17 Ca 0.11 0.19 -0.23 0.00 -0.42 0.00 0.00 57.16 56.81 2yu8 n GLU 17 Cb 0.49 -1.33 -0.09 0.00 -0.57 0.00 0.00 31.44 29.94 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 0.98 3.97 0.00 0.00 -1.13 -5.09 105.19 105.66 2yu8 n GLY 19 Ca -0.44 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.36 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 2.39 0.03 1.61 1.02 -1.25 -4.84 119.74 118.70 2yu8 s LYS 20 Ca 0.00 -0.77 -0.01 0.00 0.02 0.00 0.00 55.97 55.21 2yu8 s LYS 20 Cb 0.00 -2.43 -0.02 0.00 -0.52 0.00 0.00 37.83 34.85 2yu8 s LYS 20 CO 0.00 -0.87 -0.01 0.08 -0.92 0.00 0.00 175.35 173.63 2yu8 s VAL 21 N -2.86 0.14 0.10 3.17 1.01 -1.26 0.31 120.40 121.00 2yu8 s VAL 21 Ca 0.59 -1.15 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 2yu8 s VAL 21 Cb -0.10 -0.65 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 2yu8 s VAL 21 CO 0.40 -0.63 0.09 -0.36 0.00 0.00 0.00 175.10 174.59 2yu8 s PHE 22 N -2.19 0.51 0.04 5.22 0.08 0.09 -4.98 117.98 116.73 2yu8 s PHE 22 Ca -0.09 -0.96 -0.16 0.00 0.12 0.00 0.00 56.93 55.84 2yu8 s PHE 22 Cb -0.04 -0.29 -0.33 0.00 -0.57 0.00 0.00 43.02 41.78 2yu8 s PHE 22 CO -0.04 -0.50 1.04 0.00 -0.10 0.00 0.00 175.22 175.62 2yu8 h THR 23 N 2.90 1.29 -1.64 0.64 1.03 -1.98 -3.36 112.91 111.79 2yu8 h THR 23 Ca -0.34 -2.59 -0.58 0.00 -0.01 0.00 0.00 66.41 62.89 2yu8 h THR 23 Cb 1.18 2.90 -0.10 0.00 -1.07 0.00 0.00 68.15 71.07 2yu8 h THR 23 CO 0.60 0.78 -0.53 -1.10 -0.01 0.00 0.00 175.52 175.26 2yu8 s GLN 24 N -2.76 2.16 -0.08 0.00 -1.52 -1.26 -4.85 119.66 111.35 2yu8 s GLN 24 Ca -0.09 -1.89 -0.25 0.00 -1.95 0.00 0.00 55.36 51.18 2yu8 s GLN 24 Cb 0.04 -1.91 -0.28 0.00 -0.22 0.00 0.00 33.01 30.64 2yu8 s GLN 24 CO 0.94 -0.08 0.87 -0.97 -0.25 0.00 0.00 175.29 175.80 2yu8 h ASN 25 N 1.53 0.25 -0.65 5.90 -1.24 -1.98 -3.29 115.58 116.10 2yu8 h ASN 25 Ca -0.43 -0.95 0.07 0.00 0.71 0.00 0.00 56.30 55.70 2yu8 h ASN 25 Cb 1.25 -0.08 -0.10 0.00 0.73 0.00 0.00 38.32 40.12 2yu8 h ASN 25 CO 0.72 1.18 -0.57 -1.28 -1.29 0.00 0.00 177.43 176.19 2yu8 h SER 26 N -0.63 -1.98 -0.75 1.15 0.87 -1.99 0.26 113.55 110.48 2yu8 h SER 26 Ca -0.07 0.28 0.17 0.00 -1.23 0.00 0.00 61.79 60.93 2yu8 h SER 26 Cb 1.30 0.84 -0.11 0.00 -0.44 0.00 0.00 62.40 63.99 2yu8 h SER 26 CO 0.08 -0.33 0.18 0.45 -0.53 0.00 0.00 176.83 176.67 2yu8 h HIS 27 N -0.24 0.28 0.16 2.24 3.86 -2.01 -1.19 115.15 118.25 2yu8 h HIS 27 Ca 0.11 0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 2yu8 h HIS 27 Cb 0.52 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.99 2yu8 h HIS 27 CO -0.85 -0.10 -0.08 1.25 0.86 0.00 0.00 177.93 179.02 2yu8 h LEU 28 N 0.26 -0.18 -0.84 2.43 5.85 -0.80 -1.64 115.31 120.38 2yu8 h LEU 28 Ca 0.43 -0.04 0.20 0.00 0.84 0.00 0.00 57.88 59.30 2yu8 h LEU 28 Cb 0.74 0.05 -0.12 0.00 0.37 0.00 0.00 40.66 41.70 2yu8 h LEU 28 CO -0.53 -0.08 0.30 0.00 -0.34 0.00 0.00 178.44 177.80 2yu8 h ALA 29 N 0.56 1.25 0.10 1.25 0.00 0.54 -0.89 119.26 122.07 2yu8 h ALA 29 Ca -0.02 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2yu8 h ALA 29 Cb 0.21 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2yu8 h ALA 29 CO 0.04 -0.34 -0.05 0.00 0.00 0.00 0.00 179.25 178.90 2yu8 h ARG 30 N 0.34 -0.13 -0.55 0.00 3.08 -1.09 -3.18 114.38 112.86 2yu8 h ARG 30 Ca 0.51 0.01 0.11 0.00 0.07 0.00 0.00 59.98 60.68 2yu8 h ARG 30 Cb 0.93 0.03 -0.11 0.00 0.08 0.00 0.00 29.97 30.91 2yu8 h ARG 30 CO -0.53 0.17 -0.15 1.25 -1.07 0.00 0.00 179.97 179.64 2yu8 h HIS 31 N -0.43 -0.32 -1.03 3.04 2.76 -0.26 0.52 115.15 119.43 2yu8 h HIS 31 Ca -0.01 0.05 0.40 0.00 -2.20 0.00 0.00 60.37 58.61 2yu8 h HIS 31 Cb 0.36 0.23 -0.17 0.00 1.55 0.00 0.00 27.41 29.37 2yu8 h HIS 31 CO 0.02 -0.25 0.58 0.00 -1.30 0.00 0.00 177.93 176.98 2yu8 h ARG 32 N -0.01 0.08 -0.95 5.26 3.08 -1.19 0.49 114.38 121.14 2yu8 h ARG 32 Ca 0.26 -0.00 0.29 0.00 0.07 0.00 0.00 59.98 60.60 2yu8 h ARG 32 Cb 0.41 -0.02 -0.15 0.00 0.08 0.00 0.00 29.97 30.29 2yu8 h ARG 32 CO -0.57 0.05 0.34 0.00 -1.07 0.00 0.00 179.97 178.73 2yu8 h ARG 33 N 0.08 0.18 -1.15 0.04 3.08 -0.96 0.47 114.38 116.12 2yu8 h ARG 33 Ca 0.82 -0.01 0.37 0.00 0.07 0.00 0.00 59.98 61.23 2yu8 h ARG 33 Cb 2.15 -0.04 -0.13 0.00 0.08 0.00 0.00 29.97 32.03 2yu8 h ARG 33 CO -0.70 0.12 0.71 -0.39 -1.07 0.00 0.00 179.97 178.64 2yu8 h VAL 34 N 0.19 0.23 0.10 2.04 -1.51 -0.15 -2.00 116.25 115.15 2yu8 h VAL 34 Ca 0.65 -0.07 -0.01 0.00 -1.23 0.00 0.00 66.70 66.04 2yu8 h VAL 34 Cb 1.44 0.01 0.00 0.00 -2.13 0.00 0.00 31.29 30.61 2yu8 h VAL 34 CO -0.69 0.04 -0.05 0.45 -1.23 0.00 0.00 177.57 176.08 2yu8 h HIS 35 N 0.20 -0.13 -2.34 5.19 3.86 -0.23 -3.46 115.15 118.25 2yu8 h HIS 35 Ca 0.76 -0.00 -0.61 0.00 -1.16 0.00 0.00 60.37 59.36 2yu8 h HIS 35 Cb 2.09 0.04 0.13 0.00 1.06 0.00 0.00 27.41 30.73 2yu8 h HIS 35 CO -0.01 -0.08 -0.21 0.25 0.86 0.00 0.00 177.93 178.74 2yu8 n THR 36 N -4.00 1.95 -2.09 2.45 -2.24 -0.75 -3.54 114.28 106.06 2yu8 n THR 36 Ca -0.02 -0.50 -0.01 0.00 -2.27 0.00 0.00 64.05 61.25 2yu8 n THR 36 Cb 0.06 -0.68 0.01 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 1.59 0.39 0.00 3.38 0.00 -1.26 -4.90 105.19 104.39 2yu8 n GLY 37 Ca 0.11 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.02 2.96 2.94 -0.02 0.00 -1.23 -5.12 105.19 103.70 2yu8 n GLY 38 Ca -0.02 -1.31 -0.15 0.00 0.00 0.00 0.00 46.02 44.54 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 -1.93 0.35 0.15 1.61 2.20 -1.26 -5.05 119.74 115.81 2yu8 s LYS 39 Ca 0.00 -0.15 -0.10 0.00 -0.36 0.00 0.00 55.97 55.36 2yu8 s LYS 39 Cb 0.00 -0.34 -0.02 0.00 -1.51 0.00 0.00 37.83 35.96 2yu8 s LYS 39 CO 0.00 0.09 1.49 -1.00 -0.36 0.00 0.00 175.35 175.56 2yu8 h PRO 40 N 6.08 0.92 -6.59 4.03 0.13 -2.02 -3.44 132.00 131.10 2yu8 h PRO 40 Ca -0.28 -0.48 -0.53 0.00 -0.87 0.00 0.00 66.00 63.85 2yu8 h PRO 40 Cb 1.19 0.01 0.05 0.00 0.13 0.00 0.00 31.00 32.39 2yu8 h PRO 40 CO 0.50 1.13 1.03 -1.13 -0.23 0.00 0.00 178.00 179.31 2yu8 n SER 41 N -4.06 3.96 -4.05 1.44 3.41 -1.26 -4.99 113.62 108.07 2yu8 n SER 41 Ca -0.02 1.04 -0.14 0.00 -0.26 0.00 0.00 58.87 59.49 2yu8 n SER 41 Cb 0.54 -1.55 -0.12 0.00 -0.26 0.00 0.00 64.21 62.82 2yu8 n SER 41 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2yu8 s GLY 42 N 1.71 0.48 0.00 5.00 0.00 -1.26 -5.02 107.32 108.23 2yu8 s GLY 42 Ca 0.78 -0.69 0.16 0.00 0.00 0.00 0.00 44.72 44.96 2yu8 s GLY 42 CO 0.34 -0.73 1.35 -1.55 0.00 0.00 0.00 173.10 172.52 2yu8 n PRO 43 N 1.69 0.47 -3.83 2.90 -0.04 -1.26 -4.25 135.00 130.68 2yu8 n PRO 43 Ca -0.21 0.01 -0.30 0.00 -0.04 0.00 0.00 63.50 62.96 2yu8 n PRO 43 Cb 0.55 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.37 2yu8 n PRO 43 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2yu8 s SER 44 N -2.05 4.13 0.13 3.54 1.04 -1.26 -4.99 113.70 114.24 2yu8 s SER 44 Ca 0.23 -2.31 -0.21 0.00 0.48 0.00 0.00 55.95 54.13 2yu8 s SER 44 Cb 0.11 -1.23 -0.04 0.00 0.10 0.00 0.00 66.02 64.96 2yu8 s SER 44 CO 0.18 -0.33 1.70 0.77 0.98 0.00 0.00 173.24 176.54 2yu8 h SER 45 N 7.27 -0.25 0.00 7.02 4.64 -2.03 -3.53 113.55 126.66 2yu8 h SER 45 Ca -0.06 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2yu8 h SER 45 Cb 0.97 0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2yu8 h SER 45 CO 0.52 -0.10 0.00 0.61 -0.87 0.00 0.00 176.83 176.99