#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ruu n PRO 2 N 0.00 -1.71 0.29 -0.72 -0.04 -1.26 -4.94 135.00 126.62 1ruu n PRO 2 Ca 0.00 -1.26 0.15 0.00 -0.04 0.00 0.00 63.50 62.35 1ruu n PRO 2 Cb 0.00 -1.01 0.89 0.00 -0.04 0.00 0.00 33.50 33.35 1ruu n PRO 2 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ruu h ALA 3 N -2.20 1.58 -2.31 0.55 0.00 -2.11 -3.44 119.26 111.32 1ruu h ALA 3 Ca -0.28 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.68 1ruu h ALA 3 Cb 0.81 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.44 1ruu h ALA 3 CO 0.19 -0.02 0.40 -1.59 0.00 0.00 0.00 179.25 178.23 1ruu s LYS 4 N -4.67 0.92 0.82 0.00 -2.85 -1.26 -5.19 119.74 107.51 1ruu s LYS 4 Ca -0.05 -0.21 -0.14 0.00 -1.00 0.00 0.00 55.97 54.57 1ruu s LYS 4 Cb 0.15 0.43 0.20 0.00 -2.06 0.00 0.00 37.83 36.55 1ruu s LYS 4 CO 0.56 -0.38 0.91 -0.35 0.10 0.00 0.00 175.35 176.19 1ruu n PRO 5 N 0.00 -1.74 -3.42 1.78 -0.04 -1.26 -4.98 135.00 125.34 1ruu n PRO 5 Ca -0.12 -1.43 -0.38 0.00 -0.04 0.00 0.00 63.50 61.53 1ruu n PRO 5 Cb 0.61 -1.12 -0.04 0.00 -0.04 0.00 0.00 33.50 32.92 1ruu n PRO 5 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ruu n GLU 6 N -3.53 3.18 -3.15 0.54 1.02 -1.26 -4.89 120.64 112.56 1ruu n GLU 6 Ca 0.12 -4.52 0.02 0.00 -0.02 0.00 0.00 57.16 52.76 1ruu n GLU 6 Cb 0.44 -2.44 -0.01 0.00 -0.02 0.00 0.00 31.44 29.41 1ruu n GLU 6 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ruu s ALA 7 N -1.81 -2.66 0.86 0.62 0.00 -1.26 -5.17 121.76 112.34 1ruu s ALA 7 Ca 0.31 0.53 -0.11 0.00 0.00 0.00 0.00 51.96 52.68 1ruu s ALA 7 Cb -0.02 -2.74 0.11 0.00 0.00 0.00 0.00 23.12 20.47 1ruu s ALA 7 CO -0.06 -2.17 1.09 -1.25 0.00 0.00 0.00 175.76 173.37 1ruu s PRO 8 N 2.08 1.54 0.00 0.00 0.04 -1.26 -4.88 135.00 132.53 1ruu s PRO 8 Ca 0.15 0.85 0.00 0.00 0.04 0.00 0.00 61.00 62.05 1ruu s PRO 8 Cb -0.04 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.66 1ruu s PRO 8 CO -0.12 -2.05 0.00 0.41 0.04 0.00 0.00 177.00 175.28 1ruu n GLY 9 N -1.27 0.67 2.81 0.56 0.00 -1.26 -5.06 105.19 101.64 1ruu n GLY 9 Ca 0.07 -0.77 -0.15 0.00 0.00 0.00 0.00 46.02 45.17 1ruu n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ruu s GLU 10 N 0.00 0.24 -0.51 1.61 2.12 -1.26 -5.10 118.70 115.80 1ruu s GLU 10 Ca 0.00 0.33 0.03 0.00 0.36 0.00 0.00 54.97 55.69 1ruu s GLU 10 Cb 0.00 -0.93 0.15 0.00 0.26 0.00 0.00 34.13 33.61 1ruu s GLU 10 CO 0.00 -0.63 0.34 -0.51 -0.54 0.00 0.00 175.26 173.92 1ruu s ASP 11 N 2.40 3.37 -1.19 -1.70 1.11 -1.26 -5.05 116.67 114.34 1ruu s ASP 11 Ca 0.08 -3.10 -0.22 0.00 0.18 0.00 0.00 52.55 49.50 1ruu s ASP 11 Cb -0.15 -1.04 -0.06 0.00 1.07 0.00 0.00 42.92 42.74 1ruu s ASP 11 CO -0.13 -0.19 1.90 0.00 1.18 0.00 0.00 175.17 177.93 1ruu n ALA 12 N 2.90 2.28 -2.88 5.23 0.00 -1.26 -4.95 120.51 121.83 1ruu n ALA 12 Ca 0.18 -3.21 -0.36 0.00 0.00 0.00 0.00 53.44 50.05 1ruu n ALA 12 Cb 0.38 -3.51 -0.06 0.00 0.00 0.00 0.00 19.45 16.26 1ruu n ALA 12 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ruu s SER 13 N 5.91 6.34 1.22 0.00 0.15 -1.26 -5.09 113.70 120.97 1ruu s SER 13 Ca 0.65 0.42 -0.19 0.00 0.70 0.00 0.00 55.95 57.53 1ruu s SER 13 Cb 0.01 -2.03 0.28 0.00 -1.71 0.00 0.00 66.02 62.58 1ruu s SER 13 CO 0.12 0.36 1.02 -0.81 1.20 0.00 0.00 173.24 175.13 1ruu n PRO 14 N 1.67 -2.91 -1.30 5.44 -0.04 -1.26 -3.27 135.00 133.33 1ruu n PRO 14 Ca -0.17 -1.62 -0.10 0.00 -0.04 0.00 0.00 63.50 61.56 1ruu n PRO 14 Cb 0.54 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.46 1ruu n PRO 14 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ruu n GLU 15 N -4.54 -1.26 0.06 0.54 1.02 -1.26 -4.51 120.64 110.69 1ruu n GLU 15 Ca 0.14 0.83 0.00 0.00 -0.02 0.00 0.00 57.16 58.11 1ruu n GLU 15 Cb 0.54 -4.99 0.00 0.00 -0.02 0.00 0.00 31.44 26.97 1ruu n GLU 15 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1ruu n GLU 16 N -1.63 0.00 0.31 3.49 2.13 -1.26 -4.88 120.64 118.81 1ruu n GLU 16 Ca -0.10 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.57 1ruu n GLU 16 Cb 0.48 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.11 1ruu n GLU 16 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1ruu h LEU 17 N 0.00 -0.90 -1.57 4.31 5.85 -1.78 -2.72 115.31 118.50 1ruu h LEU 17 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1ruu h LEU 17 Cb 0.00 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1ruu h LEU 17 CO 0.00 -0.55 0.00 -1.28 -0.34 0.00 0.00 178.44 176.27 1ruu h SER 18 N -0.88 0.00 -0.69 1.25 0.87 -1.93 -1.93 113.55 110.24 1ruu h SER 18 Ca -0.08 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.50 1ruu h SER 18 Cb 0.70 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.63 1ruu h SER 18 CO 0.08 0.00 0.46 -0.09 -0.53 0.00 0.00 176.83 176.75 1ruu h ARG 19 N 0.00 0.88 -0.09 2.24 1.12 -1.82 0.21 114.38 116.92 1ruu h ARG 19 Ca 0.00 -0.05 -0.02 0.00 -1.11 0.00 0.00 59.98 58.80 1ruu h ARG 19 Cb 0.31 -0.20 -0.00 0.00 -0.01 0.00 0.00 29.97 30.07 1ruu h ARG 19 CO 0.00 0.58 -0.01 1.88 -3.11 0.00 0.00 179.97 179.31 1ruu h TYR 20 N 0.91 0.19 -0.24 2.20 0.05 -1.20 -2.29 116.97 116.58 1ruu h TYR 20 Ca 0.26 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 59.00 1ruu h TYR 20 Cb -0.06 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.62 1ruu h TYR 20 CO -0.00 0.47 0.15 -0.92 -1.05 0.00 0.00 178.16 176.81 1ruu h TYR 21 N -0.14 0.31 -0.68 4.88 5.03 -1.45 0.12 116.97 125.04 1ruu h TYR 21 Ca 0.02 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.31 1ruu h TYR 21 Cb 0.40 -0.10 -0.03 0.00 1.55 0.00 0.00 36.73 38.54 1ruu h TYR 21 CO 0.05 0.22 0.33 0.00 -1.32 0.00 0.00 178.16 177.44 1ruu h ALA 22 N 1.06 1.30 0.01 1.82 0.00 -0.65 0.34 119.26 123.15 1ruu h ALA 22 Ca 0.09 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ruu h ALA 22 Cb -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1ruu h ALA 22 CO -0.02 0.54 -0.00 1.03 0.00 0.00 0.00 179.25 180.80 1ruu h SER 23 N 0.96 -0.01 -0.86 0.00 0.87 -1.16 -3.04 113.55 110.30 1ruu h SER 23 Ca 0.24 -0.58 0.07 0.00 -1.23 0.00 0.00 61.79 60.29 1ruu h SER 23 Cb 0.09 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.00 1ruu h SER 23 CO -0.03 0.58 0.56 0.25 -0.53 0.00 0.00 176.83 177.66 1ruu h LEU 24 N -0.61 0.82 -1.36 2.23 5.85 -0.60 -0.34 115.31 121.30 1ruu h LEU 24 Ca -0.00 0.01 0.13 0.00 0.84 0.00 0.00 57.88 58.85 1ruu h LEU 24 Cb 0.59 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.40 1ruu h LEU 24 CO 0.00 0.51 0.54 -0.09 -0.34 0.00 0.00 178.44 179.06 1ruu h ARG 25 N 0.92 0.64 0.56 1.25 1.12 -0.36 -1.94 114.38 116.57 1ruu h ARG 25 Ca 0.38 -0.04 -0.03 0.00 -1.11 0.00 0.00 59.98 59.18 1ruu h ARG 25 Cb 0.28 -0.14 0.01 0.00 -0.01 0.00 0.00 29.97 30.10 1ruu h ARG 25 CO -0.15 0.43 -0.27 1.25 -3.11 0.00 0.00 179.97 178.12 1ruu h HIS 26 N 0.66 -0.70 -0.13 2.20 2.76 -0.93 0.23 115.15 119.23 1ruu h HIS 26 Ca 0.40 -0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.58 1ruu h HIS 26 Cb 0.63 0.23 -0.03 0.00 1.55 0.00 0.00 27.41 29.79 1ruu h HIS 26 CO -0.00 -0.43 -0.05 -0.92 -1.30 0.00 0.00 177.93 175.23 1ruu h TYR 27 N -0.77 -0.10 -0.02 5.26 3.20 -1.58 -1.47 116.97 121.49 1ruu h TYR 27 Ca -0.08 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.81 1ruu h TYR 27 Cb 0.58 0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.92 1ruu h TYR 27 CO -0.03 -0.08 0.08 1.25 -1.64 0.00 0.00 178.16 177.74 1ruu h LEU 28 N -0.02 0.00 0.13 2.82 5.85 -1.14 -0.47 115.31 122.48 1ruu h LEU 28 Ca 0.07 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1ruu h LEU 28 Cb 0.12 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1ruu h LEU 28 CO -0.15 0.00 -0.06 -1.13 -0.34 0.00 0.00 178.44 176.76 1ruu h ASN 29 N 0.00 -0.14 0.68 1.25 -1.24 0.49 -1.16 115.58 115.46 1ruu h ASN 29 Ca 0.01 -0.27 0.00 0.00 0.71 0.00 0.00 56.30 56.74 1ruu h ASN 29 Cb 0.18 0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.26 1ruu h ASN 29 CO -0.00 0.44 0.00 0.17 -1.29 0.00 0.00 177.43 176.75 1ruu h LEU 30 N -0.98 0.00 0.03 0.34 8.10 -1.16 -1.58 115.31 120.06 1ruu h LEU 30 Ca -0.02 0.00 -0.24 0.00 0.11 0.00 0.00 57.88 57.73 1ruu h LEU 30 Cb 0.41 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.60 1ruu h LEU 30 CO 0.03 0.00 -1.23 0.58 -4.11 0.00 0.00 178.44 173.71 1ruu h VAL 31 N 0.00 1.46 0.23 0.15 2.07 -1.15 -3.31 116.25 115.70 1ruu h VAL 31 Ca 0.00 -3.17 -0.33 0.00 0.82 0.00 0.00 66.70 64.02 1ruu h VAL 31 Cb 0.34 2.77 0.03 0.00 -1.52 0.00 0.00 31.29 32.91 1ruu h VAL 31 CO 0.00 0.86 -1.43 0.71 0.02 0.00 0.00 177.57 177.73 1ruu h THR 32 N 0.02 1.31 -1.00 2.57 1.35 -0.76 -3.30 112.91 113.09 1ruu h THR 32 Ca -0.11 -2.72 0.11 0.00 -0.55 0.00 0.00 66.41 63.15 1ruu h THR 32 Cb 1.87 2.99 -0.08 0.00 -1.73 0.00 0.00 68.15 71.20 1ruu h THR 32 CO 0.13 0.81 0.63 -0.09 -0.25 0.00 0.00 175.52 176.76 1ruu h ARG 33 N 0.16 0.99 -0.08 4.72 2.43 -1.45 0.25 114.38 121.39 1ruu h ARG 33 Ca -0.24 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 1ruu h ARG 33 Cb 2.12 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 31.45 1ruu h ARG 33 CO 0.27 0.66 0.00 0.00 -1.51 0.00 0.00 179.97 179.38 1ruu n GLN 34 N -4.59 0.98 0.06 0.20 10.64 -1.24 -4.21 117.38 119.21 1ruu n GLN 34 Ca 0.18 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.35 1ruu n GLN 34 Cb 0.32 -1.04 0.00 0.00 -0.86 0.00 0.00 30.24 28.66 1ruu n GLN 34 CO 0.00 0.00 0.00 -2.13 -1.83 0.00 0.00 177.06 173.10 1ruu n ARG 35 N -0.46 0.00 0.00 2.61 3.00 0.10 -5.08 116.66 116.83 1ruu n ARG 35 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 57.85 58.00 1ruu n ARG 35 Cb 0.02 -0.32 0.76 0.00 0.00 0.00 0.00 32.46 32.92 1ruu n ARG 35 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29