#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yu8 h SER 2 N 0.00 0.24 -2.51 1.61 0.87 -2.15 -3.46 113.55 108.16 2yu8 h SER 2 Ca 0.00 -0.91 -0.60 0.00 -1.23 0.00 0.00 61.79 59.05 2yu8 h SER 2 Cb 0.00 -0.08 0.13 0.00 -0.44 0.00 0.00 62.40 62.02 2yu8 h SER 2 CO 0.00 1.13 -0.16 -1.54 -0.53 0.00 0.00 176.83 175.72 2yu8 n SER 3 N -4.41 0.06 -3.42 6.23 3.41 -1.26 -4.98 113.62 109.24 2yu8 n SER 3 Ca -0.11 1.00 -0.09 0.00 -0.26 0.00 0.00 58.87 59.40 2yu8 n SER 3 Cb 0.61 -1.20 -0.01 0.00 -0.26 0.00 0.00 64.21 63.34 2yu8 n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2yu8 s GLY 4 N -0.84 0.43 0.32 5.00 0.00 -1.26 -5.19 107.32 105.78 2yu8 s GLY 4 Ca 0.63 -0.76 -0.18 0.00 0.00 0.00 0.00 44.72 44.41 2yu8 s GLY 4 CO 0.58 -0.40 0.84 -0.56 0.00 0.00 0.00 173.10 173.56 2yu8 s SER 5 N -3.04 -0.04 -0.00 1.64 0.01 -1.26 -5.19 113.70 105.81 2yu8 s SER 5 Ca 0.18 -0.93 -0.17 0.00 1.31 0.00 0.00 55.95 56.33 2yu8 s SER 5 Cb -0.04 0.74 0.03 0.00 0.21 0.00 0.00 66.02 66.96 2yu8 s SER 5 CO 0.11 -1.46 0.37 -0.55 0.41 0.00 0.00 173.24 172.12 2yu8 s SER 6 N -3.11 -0.25 -0.30 2.44 0.15 -1.26 -5.16 113.70 106.21 2yu8 s SER 6 Ca 0.16 0.12 -0.11 0.00 0.70 0.00 0.00 55.95 56.82 2yu8 s SER 6 Cb -0.04 0.36 0.16 0.00 -1.71 0.00 0.00 66.02 64.78 2yu8 s SER 6 CO 0.09 -0.51 0.83 -0.83 1.20 0.00 0.00 173.24 174.02 2yu8 s GLY 7 N -1.48 -0.49 0.00 9.45 0.00 -1.26 -5.05 107.32 108.50 2yu8 s GLY 7 Ca -0.11 2.63 0.00 0.00 0.00 0.00 0.00 44.72 47.24 2yu8 s GLY 7 CO 0.03 3.27 0.00 2.41 0.00 0.00 0.00 173.10 178.81 2yu8 n THR 8 N 5.24 0.00 -3.15 0.90 -1.04 -1.26 -5.05 114.28 109.92 2yu8 n THR 8 Ca -0.09 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 61.97 2yu8 n THR 8 Cb 0.51 -0.67 -0.01 0.00 -1.82 0.00 0.00 70.33 68.35 2yu8 n THR 8 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2yu8 s GLY 9 N -4.15 -1.03 0.77 3.41 0.00 -1.26 -5.16 107.32 99.90 2yu8 s GLY 9 Ca 0.00 1.68 -0.12 0.00 0.00 0.00 0.00 44.72 46.28 2yu8 s GLY 9 CO 0.00 3.58 1.12 -1.83 0.00 0.00 0.00 173.10 175.97 2yu8 s GLU 10 N 2.87 2.14 0.03 2.90 -1.05 -1.26 -4.98 118.70 119.34 2yu8 s GLU 10 Ca 0.15 1.36 -0.18 0.00 -0.15 0.00 0.00 54.97 56.15 2yu8 s GLU 10 Cb -0.12 -1.87 0.04 0.00 -0.44 0.00 0.00 34.13 31.74 2yu8 s GLU 10 CO -0.22 -1.76 0.41 0.15 0.95 0.00 0.00 175.26 174.79 2yu8 s LYS 11 N -4.55 0.88 0.27 -4.83 -0.14 -1.26 -5.01 119.74 105.10 2yu8 s LYS 11 Ca 0.65 -0.29 0.24 0.00 -1.36 0.00 0.00 55.97 55.21 2yu8 s LYS 11 Cb -0.20 0.40 1.00 0.00 -1.68 0.00 0.00 37.83 37.34 2yu8 s LYS 11 CO 0.52 -0.29 1.72 -0.35 -0.76 0.00 0.00 175.35 176.19 2yu8 n PRO 12 N 0.67 0.20 -3.48 -1.68 -0.04 -1.26 -4.52 135.00 124.88 2yu8 n PRO 12 Ca -0.19 0.44 -0.42 0.00 -0.04 0.00 0.00 63.50 63.28 2yu8 n PRO 12 Cb 0.59 -1.89 -0.10 0.00 -0.04 0.00 0.00 33.50 32.06 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 -3.34 3.24 -0.00 0.54 2.02 -1.24 -5.05 117.35 113.51 2yu8 s TYR 13 Ca 0.04 -0.57 0.01 0.00 -0.37 0.00 0.00 57.07 56.18 2yu8 s TYR 13 Cb 0.09 -2.57 0.00 0.00 -0.40 0.00 0.00 41.96 39.09 2yu8 s TYR 13 CO 0.39 -0.56 -0.02 0.21 -1.57 0.00 0.00 175.55 174.00 2yu8 s LYS 14 N 1.68 0.17 -0.11 -0.62 2.20 -1.26 -0.29 119.74 121.51 2yu8 s LYS 14 Ca 0.05 -0.06 -0.29 0.00 -0.36 0.00 0.00 55.97 55.32 2yu8 s LYS 14 Cb -0.19 -0.18 -0.01 0.00 -1.51 0.00 0.00 37.83 35.94 2yu8 s LYS 14 CO 0.10 0.03 0.97 0.00 -0.36 0.00 0.00 175.35 176.09 2yu8 n ASN 16 N 4.92 2.81 -0.12 0.00 2.85 -1.26 -2.74 115.26 121.72 2yu8 n ASN 16 Ca 0.08 -2.26 -0.21 0.00 -0.11 0.00 0.00 54.58 52.08 2yu8 n ASN 16 Cb 0.49 -0.44 -0.07 0.00 1.24 0.00 0.00 39.78 41.00 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 0.47 0.55 -0.09 1.20 -0.58 -1.26 -4.86 120.64 116.06 2yu8 n GLU 17 Ca 0.14 0.23 -0.18 0.00 -0.42 0.00 0.00 57.16 56.93 2yu8 n GLU 17 Cb 0.55 -1.43 -0.07 0.00 -0.57 0.00 0.00 31.44 29.92 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 2.02 1.21 3.96 0.00 0.00 -1.11 -5.10 105.19 106.17 2yu8 n GLY 19 Ca -0.35 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.45 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 3.10 0.05 1.61 1.02 -1.25 -4.88 119.74 119.39 2yu8 s LYS 20 Ca 0.00 -0.63 0.03 0.00 0.02 0.00 0.00 55.97 55.39 2yu8 s LYS 20 Cb 0.00 -2.64 -0.02 0.00 -0.52 0.00 0.00 37.83 34.64 2yu8 s LYS 20 CO 0.00 -0.15 -0.10 0.08 -0.92 0.00 0.00 175.35 174.26 2yu8 s VAL 21 N -2.43 0.75 0.08 3.17 1.01 -1.26 -0.05 120.40 121.66 2yu8 s VAL 21 Ca 0.47 -1.07 -0.03 0.00 0.00 0.00 0.00 61.98 61.35 2yu8 s VAL 21 Cb -0.10 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 2yu8 s VAL 21 CO 0.36 -0.26 0.04 -0.36 0.00 0.00 0.00 175.10 174.88 2yu8 s PHE 22 N -1.20 0.49 -0.13 5.22 0.40 0.60 -4.99 117.98 118.38 2yu8 s PHE 22 Ca -0.06 -0.98 0.18 0.00 -0.60 0.00 0.00 56.93 55.47 2yu8 s PHE 22 Cb -0.09 -0.32 -0.22 0.00 0.51 0.00 0.00 43.02 42.90 2yu8 s PHE 22 CO 0.01 -0.45 0.51 -2.37 0.70 0.00 0.00 175.22 173.62 2yu8 n THR 23 N 0.03 1.01 -4.90 0.64 5.66 -1.26 -3.69 114.28 111.76 2yu8 n THR 23 Ca -0.13 -0.71 -0.31 0.00 -3.05 0.00 0.00 64.05 59.86 2yu8 n THR 23 Cb 0.62 -0.51 -0.14 0.00 -1.55 0.00 0.00 70.33 68.75 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 -2.91 2.14 0.08 1.09 -1.52 -1.26 -4.91 119.66 112.38 2yu8 s GLN 24 Ca -0.06 -0.92 -0.22 0.00 -1.95 0.00 0.00 55.36 52.20 2yu8 s GLN 24 Cb 0.09 -2.16 -0.13 0.00 -0.22 0.00 0.00 33.01 30.59 2yu8 s GLN 24 CO 0.84 0.56 1.66 -2.95 -0.25 0.00 0.00 175.29 175.15 2yu8 h ASN 25 N 4.98 0.11 -0.68 5.90 7.08 -1.99 -3.08 115.58 127.91 2yu8 h ASN 25 Ca -0.46 -0.10 0.07 0.00 -3.08 0.00 0.00 56.30 52.72 2yu8 h ASN 25 Cb 1.14 -0.03 -0.09 0.00 -2.08 0.00 0.00 38.32 37.26 2yu8 h ASN 25 CO 0.47 0.18 -0.52 0.28 -2.08 0.00 0.00 177.43 175.76 2yu8 h SER 26 N 0.03 -1.85 -0.66 6.14 0.02 -1.99 0.21 113.55 115.45 2yu8 h SER 26 Ca 0.03 0.27 0.13 0.00 -0.84 0.00 0.00 61.79 61.38 2yu8 h SER 26 Cb 0.10 0.80 -0.12 0.00 0.14 0.00 0.00 62.40 63.31 2yu8 h SER 26 CO -0.00 -0.28 -0.16 0.45 -1.14 0.00 0.00 176.83 175.70 2yu8 h HIS 27 N -0.15 -0.33 -0.28 3.45 3.86 -1.99 -0.03 115.15 119.67 2yu8 h HIS 27 Ca 0.11 0.06 0.03 0.00 -1.16 0.00 0.00 60.37 59.41 2yu8 h HIS 27 Cb 0.44 0.25 -0.03 0.00 1.06 0.00 0.00 27.41 29.14 2yu8 h HIS 27 CO -0.89 -0.28 0.11 1.25 0.86 0.00 0.00 177.93 178.98 2yu8 h LEU 28 N 0.00 0.15 -0.73 2.43 5.85 -0.78 -0.52 115.31 121.71 2yu8 h LEU 28 Ca 0.32 0.02 0.14 0.00 0.84 0.00 0.00 57.88 59.20 2yu8 h LEU 28 Cb 0.49 -0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.42 2yu8 h LEU 28 CO -0.68 0.12 0.25 0.00 -0.34 0.00 0.00 178.44 177.80 2yu8 h ALA 29 N 1.16 0.99 0.24 1.25 0.00 0.12 -1.37 119.26 121.65 2yu8 h ALA 29 Ca 0.12 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2yu8 h ALA 29 Cb 0.07 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2yu8 h ALA 29 CO -0.11 -0.25 -0.12 0.00 0.00 0.00 0.00 179.25 178.77 2yu8 h ARG 30 N 0.38 -0.31 -0.79 0.00 3.08 -0.82 -3.24 114.38 112.67 2yu8 h ARG 30 Ca 0.40 0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.63 2yu8 h ARG 30 Cb 0.63 0.07 -0.15 0.00 0.08 0.00 0.00 29.97 30.60 2yu8 h ARG 30 CO -0.42 0.03 -0.22 1.25 -1.07 0.00 0.00 179.97 179.54 2yu8 h HIS 31 N -0.73 -0.51 -1.55 3.04 2.76 -0.61 0.52 115.15 118.07 2yu8 h HIS 31 Ca -0.03 0.07 0.50 0.00 -2.20 0.00 0.00 60.37 58.71 2yu8 h HIS 31 Cb 0.49 0.35 -0.12 0.00 1.55 0.00 0.00 27.41 29.68 2yu8 h HIS 31 CO 0.04 -0.35 1.04 0.00 -1.30 0.00 0.00 177.93 177.36 2yu8 h ARG 32 N -0.02 0.02 -0.80 5.26 3.08 -1.29 0.61 114.38 121.24 2yu8 h ARG 32 Ca 0.37 -0.00 0.18 0.00 0.07 0.00 0.00 59.98 60.59 2yu8 h ARG 32 Cb 0.58 -0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.52 2yu8 h ARG 32 CO -0.82 0.01 0.27 0.00 -1.07 0.00 0.00 179.97 178.37 2yu8 h ARG 33 N 0.02 0.34 -1.41 0.04 2.47 -0.06 0.20 114.38 115.99 2yu8 h ARG 33 Ca 0.88 -0.02 0.41 0.00 -1.26 0.00 0.00 59.98 59.99 2yu8 h ARG 33 Cb 3.06 -0.08 -0.06 0.00 -1.65 0.00 0.00 29.97 31.25 2yu8 h ARG 33 CO -0.32 0.23 1.15 -0.39 0.56 0.00 0.00 179.97 181.19 2yu8 h VAL 34 N 0.35 0.14 -1.89 2.04 -1.51 0.09 -2.35 116.25 113.11 2yu8 h VAL 34 Ca 0.47 0.00 -0.78 0.00 -1.23 0.00 0.00 66.70 65.16 2yu8 h VAL 34 Cb 0.81 0.16 -0.20 0.00 -2.13 0.00 0.00 31.29 29.94 2yu8 h VAL 34 CO -0.50 0.00 1.62 1.41 -1.23 0.00 0.00 177.57 178.87 2yu8 n HIS 35 N -3.80 2.64 -3.71 5.19 8.25 0.72 -4.48 115.22 120.03 2yu8 n HIS 35 Ca 0.31 -2.70 -0.28 0.00 -0.26 0.00 0.00 57.72 54.79 2yu8 n HIS 35 Cb 1.58 -1.67 -0.16 0.00 1.12 0.00 0.00 29.99 30.86 2yu8 n HIS 35 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2yu8 s THR 36 N -1.07 0.53 -1.03 1.59 -4.23 -0.89 -4.91 115.64 105.62 2yu8 s THR 36 Ca 0.38 -0.74 -0.17 0.00 -1.18 0.00 0.00 61.69 59.98 2yu8 s THR 36 Cb 0.10 -1.15 0.01 0.00 1.34 0.00 0.00 72.50 72.80 2yu8 s THR 36 CO 0.02 -0.35 0.70 0.61 -0.54 0.00 0.00 174.62 175.06 2yu8 n GLY 37 N 5.03 -1.07 0.00 3.99 0.00 -1.26 -4.90 105.19 106.99 2yu8 n GLY 37 Ca -0.07 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 -1.80 4.71 3.78 -0.02 0.00 -1.26 -5.12 105.19 105.47 2yu8 n GLY 38 Ca -0.15 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.56 2yu8 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yu8 s LYS 39 N -4.08 4.56 -0.02 1.61 3.01 -1.26 -4.70 119.74 118.87 2yu8 s LYS 39 Ca 0.00 1.39 -0.26 0.00 -1.01 0.00 0.00 55.97 56.10 2yu8 s LYS 39 Cb 0.00 -2.83 -0.20 0.00 -1.01 0.00 0.00 37.83 33.79 2yu8 s LYS 39 CO 0.00 0.25 1.27 -1.00 0.51 0.00 0.00 175.35 176.38 2yu8 h PRO 40 N 3.22 0.02 -2.13 -1.68 0.13 -2.00 -3.47 132.00 126.09 2yu8 h PRO 40 Ca -0.47 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.59 2yu8 h PRO 40 Cb 1.20 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.14 2yu8 h PRO 40 CO 0.65 0.50 0.15 0.45 -0.23 0.00 0.00 178.00 179.52 2yu8 s SER 41 N -5.72 -0.61 0.49 1.44 0.15 -1.26 -5.15 113.70 103.03 2yu8 s SER 41 Ca -0.16 0.64 -0.20 0.00 0.70 0.00 0.00 55.95 56.93 2yu8 s SER 41 Cb 0.02 0.52 -0.11 0.00 -1.71 0.00 0.00 66.02 64.74 2yu8 s SER 41 CO 0.68 -0.61 0.49 0.61 1.20 0.00 0.00 173.24 175.61 2yu8 n GLY 42 N 0.90 -1.60 0.26 9.45 0.00 -1.26 -4.90 105.19 108.04 2yu8 n GLY 42 Ca -0.19 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 2yu8 n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yu8 h PRO 43 N 0.54 0.93 0.00 1.61 0.13 -2.01 -3.47 132.00 129.73 2yu8 h PRO 43 Ca -0.43 -0.49 -0.58 0.00 -0.87 0.00 0.00 66.00 63.63 2yu8 h PRO 43 Cb 1.40 0.02 -0.12 0.00 0.13 0.00 0.00 31.00 32.42 2yu8 h PRO 43 CO 0.49 1.14 -0.47 0.45 -0.23 0.00 0.00 178.00 179.39 2yu8 n SER 44 N -4.08 1.88 -2.31 1.44 2.88 -1.26 -4.90 113.62 107.27 2yu8 n SER 44 Ca -0.02 -3.17 -0.09 0.00 -1.33 0.00 0.00 58.87 54.26 2yu8 n SER 44 Cb 0.54 0.82 0.05 0.00 -0.75 0.00 0.00 64.21 64.87 2yu8 n SER 44 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2yu8 n SER 45 N -1.46 -2.46 0.00 -3.46 7.64 -1.26 -5.20 113.62 107.42 2yu8 n SER 45 Ca -0.10 -0.34 0.00 0.00 1.01 0.00 0.00 58.87 59.44 2yu8 n SER 45 Cb 0.62 -2.96 0.00 0.00 -1.01 0.00 0.00 64.21 60.86 2yu8 n SER 45 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64