#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 1.45 0.41 1.61 0.15 -1.26 -5.16 113.70 110.90 2yu8 s SER 2 Ca 0.00 -0.63 -0.01 0.00 0.70 0.00 0.00 55.95 56.01 2yu8 s SER 2 Cb 0.00 -0.02 -0.03 0.00 -1.71 0.00 0.00 66.02 64.26 2yu8 s SER 2 CO 0.00 -0.13 0.64 -0.44 1.20 0.00 0.00 173.24 174.51 2yu8 s SER 3 N -1.81 6.16 0.37 5.45 0.01 -1.26 -5.08 113.70 117.54 2yu8 s SER 3 Ca -0.03 0.52 -0.17 0.00 1.31 0.00 0.00 55.95 57.59 2yu8 s SER 3 Cb -0.09 -1.95 -0.09 0.00 0.21 0.00 0.00 66.02 64.09 2yu8 s SER 3 CO 0.02 -0.47 0.81 -0.83 0.41 0.00 0.00 173.24 173.17 2yu8 s GLY 4 N -4.10 2.32 0.11 3.44 0.00 -1.26 -5.06 107.32 102.77 2yu8 s GLY 4 Ca 0.44 0.15 -0.16 0.00 0.00 0.00 0.00 44.72 45.15 2yu8 s GLY 4 CO 0.39 0.38 0.53 -0.45 0.00 0.00 0.00 173.10 173.95 2yu8 s SER 5 N -2.31 6.89 -0.54 1.64 0.15 -1.26 -5.05 113.70 113.21 2yu8 s SER 5 Ca 0.57 1.11 -0.01 0.00 0.70 0.00 0.00 55.95 58.32 2yu8 s SER 5 Cb -0.10 -2.30 0.14 0.00 -1.71 0.00 0.00 66.02 62.05 2yu8 s SER 5 CO 0.17 0.18 0.33 -0.55 1.20 0.00 0.00 173.24 174.57 2yu8 s SER 6 N -1.46 5.00 -0.17 5.45 0.15 -1.26 -5.06 113.70 116.34 2yu8 s SER 6 Ca 0.33 -2.70 0.01 0.00 0.70 0.00 0.00 55.95 54.29 2yu8 s SER 6 Cb -0.16 -1.79 0.02 0.00 -1.71 0.00 0.00 66.02 62.38 2yu8 s SER 6 CO 0.18 -0.37 -0.19 -0.83 1.20 0.00 0.00 173.24 173.24 2yu8 s GLY 7 N 0.68 1.34 0.80 9.45 0.00 -1.26 -5.12 107.32 113.21 2yu8 s GLY 7 Ca 0.15 -1.17 -0.11 0.00 0.00 0.00 0.00 44.72 43.59 2yu8 s GLY 7 CO -0.03 0.33 1.09 -0.51 0.00 0.00 0.00 173.10 173.98 2yu8 s THR 8 N 1.33 3.16 -0.17 0.90 -4.23 -1.26 -4.71 115.64 110.65 2yu8 s THR 8 Ca 0.05 0.38 -0.05 0.00 -1.18 0.00 0.00 61.69 60.89 2yu8 s THR 8 Cb -0.13 -3.06 0.02 0.00 1.34 0.00 0.00 72.50 70.67 2yu8 s THR 8 CO -0.12 -0.49 0.10 0.61 -0.54 0.00 0.00 174.62 174.17 2yu8 n GLY 9 N -1.86 -4.28 3.70 3.99 0.00 -1.26 -4.89 105.19 100.60 2yu8 n GLY 9 Ca 0.07 0.75 -0.44 0.00 0.00 0.00 0.00 46.02 46.40 2yu8 n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2yu8 n GLU 10 N 0.87 2.40 -3.30 1.61 2.13 -1.26 -4.97 120.64 118.12 2yu8 n GLU 10 Ca -0.16 0.86 -0.36 0.00 0.66 0.00 0.00 57.16 58.16 2yu8 n GLU 10 Cb 0.25 -2.62 -0.06 0.00 0.27 0.00 0.00 31.44 29.28 2yu8 n GLU 10 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2yu8 s LYS 11 N 0.24 4.07 0.54 5.31 3.01 -1.26 -4.98 119.74 126.67 2yu8 s LYS 11 Ca 0.71 0.60 0.33 0.00 -1.01 0.00 0.00 55.97 56.60 2yu8 s LYS 11 Cb -0.59 -2.98 1.36 0.00 -1.01 0.00 0.00 37.83 34.61 2yu8 s LYS 11 CO 0.43 0.49 1.98 -1.00 0.51 0.00 0.00 175.35 177.76 2yu8 h PRO 12 N 3.71 0.00 -5.39 -1.68 0.13 -1.93 -3.41 132.00 123.44 2yu8 h PRO 12 Ca -0.49 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.00 2yu8 h PRO 12 Cb 1.20 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 2yu8 h PRO 12 CO 0.65 0.03 0.36 0.71 -0.23 0.00 0.00 178.00 179.53 2yu8 s TYR 13 N -3.71 2.86 -0.05 1.56 2.02 -1.26 -5.01 117.35 113.77 2yu8 s TYR 13 Ca 0.01 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.33 2yu8 s TYR 13 Cb 0.09 -3.95 0.02 0.00 -0.40 0.00 0.00 41.96 37.73 2yu8 s TYR 13 CO 0.55 -1.31 -0.02 0.21 -1.57 0.00 0.00 175.55 173.40 2yu8 s LYS 14 N 3.46 0.67 -0.02 -0.62 2.20 -1.26 -0.86 119.74 123.31 2yu8 s LYS 14 Ca 0.22 -0.01 -0.30 0.00 -0.36 0.00 0.00 55.97 55.52 2yu8 s LYS 14 Cb -0.17 -0.80 -0.05 0.00 -1.51 0.00 0.00 37.83 35.31 2yu8 s LYS 14 CO 0.14 -0.15 1.30 0.00 -0.36 0.00 0.00 175.35 176.28 2yu8 n ASN 16 N 5.18 0.66 0.01 0.00 2.04 -1.26 -1.09 115.26 120.80 2yu8 n ASN 16 Ca 0.12 0.20 -0.13 0.00 -0.44 0.00 0.00 54.58 54.34 2yu8 n ASN 16 Cb 0.45 -0.08 -0.09 0.00 -2.53 0.00 0.00 39.78 37.53 2yu8 n ASN 16 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 2yu8 h GLU 17 N 0.00 0.00 0.00 -3.83 4.39 -1.97 -3.40 114.58 109.77 2yu8 h GLU 17 Ca 0.00 -0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 2yu8 h GLU 17 Cb 0.70 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.34 2yu8 h GLU 17 CO 0.00 0.29 -1.21 0.00 -1.16 0.00 0.00 179.01 176.93 2yu8 n GLY 19 N 3.20 1.38 3.99 0.00 0.00 -0.25 -5.08 105.19 108.43 2yu8 n GLY 19 Ca -0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 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 2.04 0.01 1.61 1.02 -1.15 -4.81 119.74 118.47 2yu8 s LYS 20 Ca 0.00 -1.06 -0.08 0.00 0.02 0.00 0.00 55.97 54.86 2yu8 s LYS 20 Cb 0.00 -2.42 0.00 0.00 -0.52 0.00 0.00 37.83 34.89 2yu8 s LYS 20 CO 0.00 -1.13 0.14 0.08 -0.92 0.00 0.00 175.35 173.52 2yu8 s VAL 21 N -2.96 0.09 0.12 3.17 1.01 -1.26 0.48 120.40 121.06 2yu8 s VAL 21 Ca 0.63 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.79 2yu8 s VAL 21 Cb -0.07 -0.57 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 2yu8 s VAL 21 CO 0.42 -0.43 0.12 -0.36 0.00 0.00 0.00 175.10 174.85 2yu8 s PHE 22 N -1.72 0.62 -0.25 5.22 0.40 -0.04 -4.98 117.98 117.22 2yu8 s PHE 22 Ca -0.12 -1.02 0.21 0.00 -0.60 0.00 0.00 56.93 55.40 2yu8 s PHE 22 Cb -0.06 -0.31 0.04 0.00 0.51 0.00 0.00 43.02 43.20 2yu8 s PHE 22 CO 0.00 -0.56 1.13 0.00 0.70 0.00 0.00 175.22 176.49 2yu8 h THR 23 N 2.81 0.11 -3.10 0.64 1.03 -1.98 -3.36 112.91 109.05 2yu8 h THR 23 Ca -0.34 -1.19 -0.41 0.00 -0.01 0.00 0.00 66.41 64.46 2yu8 h THR 23 Cb 1.20 1.70 -0.14 0.00 -1.07 0.00 0.00 68.15 69.84 2yu8 h THR 23 CO 0.57 0.06 -0.67 -1.10 -0.01 0.00 0.00 175.52 174.37 2yu8 s GLN 24 N -3.26 1.38 -0.07 0.00 -1.52 -1.26 -4.96 119.66 109.96 2yu8 s GLN 24 Ca 0.01 -1.69 -0.25 0.00 -1.95 0.00 0.00 55.36 51.48 2yu8 s GLN 24 Cb 0.09 -0.80 -0.25 0.00 -0.22 0.00 0.00 33.01 31.82 2yu8 s GLN 24 CO 0.77 -0.03 0.95 -2.95 -0.25 0.00 0.00 175.29 173.78 2yu8 h ASN 25 N 2.44 0.21 -0.31 5.90 7.08 -1.99 -3.27 115.58 125.64 2yu8 h ASN 25 Ca -0.39 -0.86 0.03 0.00 -3.08 0.00 0.00 56.30 52.01 2yu8 h ASN 25 Cb 1.22 -0.06 -0.06 0.00 -2.08 0.00 0.00 38.32 37.34 2yu8 h ASN 25 CO 0.65 1.04 -0.36 -1.28 -2.08 0.00 0.00 177.43 175.40 2yu8 h SER 26 N -0.60 -1.22 -0.77 6.14 0.87 -1.99 0.28 113.55 116.24 2yu8 h SER 26 Ca -0.04 0.16 0.15 0.00 -1.23 0.00 0.00 61.79 60.83 2yu8 h SER 26 Cb 1.10 0.51 -0.14 0.00 -0.44 0.00 0.00 62.40 63.42 2yu8 h SER 26 CO 0.05 -0.25 -0.24 0.45 -0.53 0.00 0.00 176.83 176.32 2yu8 h HIS 27 N -0.22 -0.58 -0.34 2.24 3.86 -2.01 0.12 115.15 118.22 2yu8 h HIS 27 Ca 0.05 0.07 0.06 0.00 -1.16 0.00 0.00 60.37 59.40 2yu8 h HIS 27 Cb 0.37 0.37 -0.06 0.00 1.06 0.00 0.00 27.41 29.16 2yu8 h HIS 27 CO -0.72 -0.36 -0.01 1.25 0.86 0.00 0.00 177.93 178.95 2yu8 h LEU 28 N -0.03 -0.16 -0.68 2.43 5.85 -1.24 -1.65 115.31 119.82 2yu8 h LEU 28 Ca 0.35 0.08 0.14 0.00 0.84 0.00 0.00 57.88 59.29 2yu8 h LEU 28 Cb 0.58 0.15 -0.10 0.00 0.37 0.00 0.00 40.66 41.65 2yu8 h LEU 28 CO -0.81 -0.05 0.13 0.00 -0.34 0.00 0.00 178.44 177.38 2yu8 h ALA 29 N 1.30 0.83 0.47 1.25 0.00 0.12 -1.99 119.26 121.24 2yu8 h ALA 29 Ca 0.16 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.22 2yu8 h ALA 29 Cb 0.23 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2yu8 h ALA 29 CO -0.28 -0.34 -0.23 0.00 0.00 0.00 0.00 179.25 178.40 2yu8 h ARG 30 N 0.23 -0.61 -0.81 0.00 -0.00 -0.71 -3.13 114.38 109.35 2yu8 h ARG 30 Ca 0.38 0.04 0.13 0.00 -0.50 0.00 0.00 59.98 60.03 2yu8 h ARG 30 Cb 0.62 0.14 -0.14 0.00 0.00 0.00 0.00 29.97 30.59 2yu8 h ARG 30 CO -0.49 -0.36 -0.37 1.25 0.00 0.00 0.00 179.97 179.99 2yu8 h HIS 31 N -0.73 -1.05 -1.43 3.04 -0.00 -0.65 0.56 115.15 114.89 2yu8 h HIS 31 Ca -0.06 0.09 0.47 0.00 -0.00 0.00 0.00 60.37 60.87 2yu8 h HIS 31 Cb 0.53 0.58 -0.12 0.00 -0.00 0.00 0.00 27.41 28.41 2yu8 h HIS 31 CO -0.02 -0.40 0.95 0.54 -0.00 0.00 0.00 177.93 179.00 2yu8 n ARG 32 N -5.45 -0.03 -0.28 5.26 1.74 -0.81 0.57 116.66 117.67 2yu8 n ARG 32 Ca 0.07 1.13 0.09 0.00 -0.77 0.00 0.00 57.85 58.37 2yu8 n ARG 32 Cb 0.38 -2.32 0.22 0.00 -1.02 0.00 0.00 32.46 29.72 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 0.15 -1.09 5.56 3.08 0.05 0.55 114.38 122.68 2yu8 h ARG 33 Ca 0.84 -0.01 0.30 0.00 0.07 0.00 0.00 59.98 61.17 2yu8 h ARG 33 Cb 2.87 -0.03 -0.08 0.00 0.08 0.00 0.00 29.97 32.81 2yu8 h ARG 33 CO -0.33 0.10 0.73 -0.39 -1.07 0.00 0.00 179.97 179.00 2yu8 h VAL 34 N 0.15 0.47 0.03 2.04 -1.51 -0.03 -1.72 116.25 115.68 2yu8 h VAL 34 Ca 0.48 -0.09 -0.00 0.00 -1.23 0.00 0.00 66.70 65.86 2yu8 h VAL 34 Cb 0.90 0.19 0.00 0.00 -2.13 0.00 0.00 31.29 30.25 2yu8 h VAL 34 CO -0.67 0.05 -0.01 0.45 -1.23 0.00 0.00 177.57 176.16 2yu8 h HIS 35 N 0.26 -0.03 -0.86 5.19 3.86 -0.06 -3.41 115.15 120.10 2yu8 h HIS 35 Ca 0.59 -0.00 -0.46 0.00 -1.16 0.00 0.00 60.37 59.34 2yu8 h HIS 35 Cb 1.77 0.01 -0.07 0.00 1.06 0.00 0.00 27.41 30.18 2yu8 h HIS 35 CO -0.00 0.51 1.21 0.95 0.86 0.00 0.00 177.93 181.46 2yu8 s THR 36 N -2.18 3.71 -0.45 2.45 -4.23 -0.65 -4.65 115.64 109.64 2yu8 s THR 36 Ca -0.11 -0.73 0.06 0.00 -1.18 0.00 0.00 61.69 59.74 2yu8 s THR 36 Cb -0.01 -4.60 0.33 0.00 1.34 0.00 0.00 72.50 69.56 2yu8 s THR 36 CO 0.41 -1.45 1.16 0.61 -0.54 0.00 0.00 174.62 174.80 2yu8 n GLY 37 N 6.63 0.62 0.47 3.99 0.00 -1.26 -4.82 105.19 110.82 2yu8 n GLY 37 Ca 0.39 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.43 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 0.25 -2.11 3.90 -0.02 0.00 -1.26 -5.04 105.19 100.90 2yu8 n GLY 38 Ca 0.04 0.67 -0.28 0.00 0.00 0.00 0.00 46.02 46.45 2yu8 n GLY 38 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2yu8 n LYS 39 N -1.58 -0.70 -2.04 1.61 3.00 -1.26 -4.73 118.16 112.46 2yu8 n LYS 39 Ca 0.00 -0.02 -0.38 0.00 -0.00 0.00 0.00 58.31 57.91 2yu8 n LYS 39 Cb 0.00 -2.04 -0.03 0.00 0.00 0.00 0.00 35.03 32.96 2yu8 n LYS 39 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2yu8 s PRO 40 N -6.48 2.62 -0.10 1.64 0.04 -1.26 -4.84 135.00 126.61 2yu8 s PRO 40 Ca 0.18 0.56 -0.03 0.00 0.04 0.00 0.00 61.00 61.75 2yu8 s PRO 40 Cb -0.10 -4.43 -0.01 0.00 0.04 0.00 0.00 34.50 30.00 2yu8 s PRO 40 CO 0.71 -2.78 -0.06 0.77 0.04 0.00 0.00 177.00 175.69 2yu8 h SER 41 N 14.79 0.00 0.00 6.66 0.02 -1.99 -3.49 113.55 129.54 2yu8 h SER 41 Ca -0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2yu8 h SER 41 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2yu8 h SER 41 CO 1.22 0.51 0.00 0.61 -1.14 0.00 0.00 176.83 178.03 2yu8 n GLY 42 N 1.74 0.26 0.22 -3.77 0.00 -1.26 -4.96 105.19 97.42 2yu8 n GLY 42 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 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 0.00 0.49 -5.37 1.61 0.13 -2.00 -3.47 132.00 123.39 2yu8 h PRO 43 Ca 0.00 -0.25 -0.33 0.00 -0.87 0.00 0.00 66.00 64.54 2yu8 h PRO 43 Cb 0.00 0.01 0.14 0.00 0.13 0.00 0.00 31.00 31.28 2yu8 h PRO 43 CO 0.00 0.83 -0.66 0.43 -0.23 0.00 0.00 178.00 178.37 2yu8 n SER 44 N -4.01 -3.97 -4.98 1.44 7.64 -1.26 -5.02 113.62 103.46 2yu8 n SER 44 Ca -0.02 -0.53 -0.21 0.00 1.01 0.00 0.00 58.87 59.12 2yu8 n SER 44 Cb 0.52 -4.68 0.03 0.00 -1.01 0.00 0.00 64.21 59.07 2yu8 n SER 44 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yu8 s SER 45 N -3.78 5.03 0.00 6.43 0.01 -1.26 -5.09 113.70 115.04 2yu8 s SER 45 Ca 0.26 -0.90 0.00 0.00 1.31 0.00 0.00 55.95 56.62 2yu8 s SER 45 Cb -0.11 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.24 2yu8 s SER 45 CO 0.66 -1.14 0.00 0.61 0.41 0.00 0.00 173.24 173.79