#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 -0.21 -1.70 -0.72 -0.04 -1.26 -4.91 135.00 126.17 1ruu n PRO 2 Ca 0.00 0.00 -0.66 0.00 -0.04 0.00 0.00 63.50 62.80 1ruu n PRO 2 Cb 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.36 1ruu n PRO 2 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ruu n ALA 3 N -3.00 -1.29 0.05 0.55 0.00 -1.26 -4.90 120.51 110.67 1ruu n ALA 3 Ca 0.00 0.48 -0.11 0.00 0.00 0.00 0.00 53.44 53.81 1ruu n ALA 3 Cb 0.00 -1.89 -0.05 0.00 0.00 0.00 0.00 19.45 17.51 1ruu n ALA 3 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1ruu h LYS 4 N 5.03 -0.21 -3.18 0.00 6.56 -2.05 -3.16 116.57 119.55 1ruu h LYS 4 Ca -0.42 0.01 -0.54 0.00 -1.06 0.00 0.00 60.65 58.64 1ruu h LYS 4 Cb 1.35 0.05 0.02 0.00 -0.57 0.00 0.00 32.23 33.08 1ruu h LYS 4 CO 0.96 -0.14 3.30 -0.35 -2.06 0.00 0.00 179.45 181.16 1ruu n PRO 5 N -5.26 3.00 -2.73 3.15 -0.04 -1.26 -3.99 135.00 127.86 1ruu n PRO 5 Ca -0.05 -1.87 -0.02 0.00 -0.04 0.00 0.00 63.50 61.52 1ruu n PRO 5 Cb 0.18 -2.64 0.10 0.00 -0.04 0.00 0.00 33.50 31.09 1ruu n PRO 5 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1ruu n GLU 6 N 3.84 1.49 -3.56 0.54 2.13 -1.20 -5.01 120.64 118.87 1ruu n GLU 6 Ca 0.64 -2.17 -0.27 0.00 0.66 0.00 0.00 57.16 56.02 1ruu n GLU 6 Cb 0.19 -0.41 -0.10 0.00 0.27 0.00 0.00 31.44 31.39 1ruu n GLU 6 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ruu n ALA 7 N -1.10 3.29 -1.52 4.31 0.00 -1.26 -5.04 120.51 119.19 1ruu n ALA 7 Ca -0.07 -4.07 -0.30 0.00 0.00 0.00 0.00 53.44 49.00 1ruu n ALA 7 Cb 0.85 -0.90 0.10 0.00 0.00 0.00 0.00 19.45 19.50 1ruu n ALA 7 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ruu s PRO 8 N -1.30 1.94 0.09 0.00 0.04 -1.26 -5.08 135.00 129.43 1ruu s PRO 8 Ca 0.32 0.63 -0.14 0.00 0.04 0.00 0.00 61.00 61.84 1ruu s PRO 8 Cb 0.05 -1.90 0.05 0.00 0.04 0.00 0.00 34.50 32.74 1ruu s PRO 8 CO -0.13 -1.72 0.68 0.41 0.04 0.00 0.00 177.00 176.28 1ruu n GLY 9 N -2.02 0.76 1.45 0.56 0.00 -1.26 -5.04 105.19 99.64 1ruu n GLY 9 Ca 0.07 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1ruu n GLY 9 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1ruu n GLU 10 N -0.48 0.72 -2.72 1.61 0.00 -1.26 -4.76 120.64 113.74 1ruu n GLU 10 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 56.72 1ruu n GLU 10 Cb 0.37 -1.14 -0.01 0.00 0.00 0.00 0.00 31.44 30.66 1ruu n GLU 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1ruu s ASP 11 N 1.70 6.84 -0.37 -1.84 1.01 -1.26 -4.98 116.67 117.77 1ruu s ASP 11 Ca 0.00 -2.43 -0.29 0.00 0.71 0.00 0.00 52.55 50.54 1ruu s ASP 11 Cb 0.00 -2.51 0.01 0.00 1.01 0.00 0.00 42.92 41.43 1ruu s ASP 11 CO 0.00 -1.09 1.30 0.00 0.21 0.00 0.00 175.17 175.59 1ruu s ALA 12 N 3.42 3.22 0.03 5.23 0.00 -1.26 -5.03 121.76 127.38 1ruu s ALA 12 Ca 0.48 -0.10 0.07 0.00 0.00 0.00 0.00 51.96 52.41 1ruu s ALA 12 Cb 0.01 -3.85 -0.02 0.00 0.00 0.00 0.00 23.12 19.25 1ruu s ALA 12 CO 0.01 -2.06 -0.21 0.45 0.00 0.00 0.00 175.76 173.96 1ruu s SER 13 N 3.06 2.47 1.22 0.00 0.15 -1.26 -5.11 113.70 114.23 1ruu s SER 13 Ca 0.56 -0.48 -0.20 0.00 0.70 0.00 0.00 55.95 56.53 1ruu s SER 13 Cb -0.14 -0.22 0.29 0.00 -1.71 0.00 0.00 66.02 64.25 1ruu s SER 13 CO 0.27 0.19 1.10 -2.16 1.20 0.00 0.00 173.24 173.84 1ruu s PRO 14 N -1.00 -1.37 -1.68 5.44 0.04 -1.26 -3.09 135.00 132.08 1ruu s PRO 14 Ca 0.08 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.03 1ruu s PRO 14 Cb -0.09 -1.58 0.00 0.00 0.04 0.00 0.00 34.50 32.87 1ruu s PRO 14 CO 0.01 -3.81 0.00 0.39 0.04 0.00 0.00 177.00 173.63 1ruu n GLU 15 N -4.83 -1.24 0.05 4.56 1.02 -1.26 -4.51 120.64 114.43 1ruu n GLU 15 Ca 0.13 1.00 0.00 0.00 -0.02 0.00 0.00 57.16 58.28 1ruu n GLU 15 Cb 0.60 -5.30 0.00 0.00 -0.02 0.00 0.00 31.44 26.71 1ruu n GLU 15 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1ruu n GLU 16 N -2.55 0.00 0.23 3.49 1.02 -1.26 -4.89 120.64 116.69 1ruu n GLU 16 Ca -0.18 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 56.87 1ruu n GLU 16 Cb 0.59 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.97 1ruu n GLU 16 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1ruu h LEU 17 N 0.00 -0.51 -1.56 -4.62 5.85 -1.77 -2.88 115.31 109.82 1ruu h LEU 17 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1ruu h LEU 17 Cb 0.00 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1ruu h LEU 17 CO 0.00 -0.35 0.00 -1.28 -0.34 0.00 0.00 178.44 176.47 1ruu h SER 18 N -0.61 0.00 -0.01 1.25 0.87 -1.93 -1.06 113.55 112.07 1ruu h SER 18 Ca -0.06 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 1ruu h SER 18 Cb 0.46 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.42 1ruu h SER 18 CO 0.10 0.00 0.00 -0.09 -0.53 0.00 0.00 176.83 176.31 1ruu h ARG 19 N 0.00 0.00 -0.02 2.24 1.12 -1.85 0.45 114.38 116.32 1ruu h ARG 19 Ca 0.00 0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 58.86 1ruu h ARG 19 Cb 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.16 1ruu h ARG 19 CO 0.00 0.00 -0.05 1.88 -3.11 0.00 0.00 179.97 178.69 1ruu h TYR 20 N 0.00 0.08 -0.13 2.20 0.05 -1.17 -2.89 116.97 115.11 1ruu h TYR 20 Ca 0.00 -0.03 -0.12 0.00 0.05 0.00 0.00 58.73 58.63 1ruu h TYR 20 Cb 0.01 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1ruu h TYR 20 CO 0.00 0.65 -0.38 -0.92 -1.05 0.00 0.00 178.16 176.46 1ruu h TYR 21 N -0.51 0.64 -0.83 4.88 3.20 -1.49 -1.86 116.97 121.00 1ruu h TYR 21 Ca -0.00 -0.25 -0.01 0.00 3.14 0.00 0.00 58.73 61.61 1ruu h TYR 21 Cb 0.65 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.77 1ruu h TYR 21 CO 0.13 1.00 0.50 0.00 -1.64 0.00 0.00 178.16 178.15 1ruu h ALA 22 N 0.52 1.06 -0.13 1.82 0.00 -0.28 0.41 119.26 122.68 1ruu h ALA 22 Ca -0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1ruu h ALA 22 Cb 1.00 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1ruu h ALA 22 CO 0.08 0.53 -0.06 1.03 0.00 0.00 0.00 179.25 180.84 1ruu h SER 23 N 1.15 0.27 -0.47 0.00 0.87 -1.54 -3.05 113.55 110.78 1ruu h SER 23 Ca 0.30 -0.41 -0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1ruu h SER 23 Cb -0.04 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 1ruu h SER 23 CO -0.06 0.61 0.29 0.25 -0.53 0.00 0.00 176.83 177.40 1ruu h LEU 24 N -0.08 0.57 -2.23 2.23 5.85 -1.10 -1.45 115.31 119.10 1ruu h LEU 24 Ca 0.03 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ruu h LEU 24 Cb 0.51 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.40 1ruu h LEU 24 CO 0.02 0.44 0.00 -0.09 -0.34 0.00 0.00 178.44 178.46 1ruu h ARG 25 N 0.66 0.00 0.19 1.25 2.43 -0.09 -1.96 114.38 116.86 1ruu h ARG 25 Ca 0.18 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1ruu h ARG 25 Cb -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1ruu h ARG 25 CO -0.03 0.00 -0.09 1.25 -1.51 0.00 0.00 179.97 179.58 1ruu h HIS 26 N 0.00 -0.24 -0.21 2.20 2.76 -1.15 -2.60 115.15 115.90 1ruu h HIS 26 Ca 0.00 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.20 1ruu h HIS 26 Cb 0.01 0.08 -0.03 0.00 1.55 0.00 0.00 27.41 29.02 1ruu h HIS 26 CO 0.00 -0.07 0.02 -0.92 -1.30 0.00 0.00 177.93 175.66 1ruu h TYR 27 N -1.05 0.04 0.00 5.26 3.20 -1.62 -0.91 116.97 121.88 1ruu h TYR 27 Ca -0.03 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1ruu h TYR 27 Cb 0.27 0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.56 1ruu h TYR 27 CO 0.02 -0.00 0.05 1.25 -1.64 0.00 0.00 178.16 177.84 1ruu h LEU 28 N 0.10 0.00 0.14 2.82 5.85 -1.50 -0.20 115.31 122.53 1ruu h LEU 28 Ca 0.10 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1ruu h LEU 28 Cb 0.11 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1ruu h LEU 28 CO -0.14 0.00 -0.07 -1.13 -0.34 0.00 0.00 178.44 176.76 1ruu h ASN 29 N 0.00 -0.16 0.72 1.25 -0.73 -0.76 -1.57 115.58 114.34 1ruu h ASN 29 Ca 0.00 -0.23 0.00 0.00 1.87 0.00 0.00 56.30 57.94 1ruu h ASN 29 Cb 0.10 0.04 0.00 0.00 0.27 0.00 0.00 38.32 38.73 1ruu h ASN 29 CO 0.00 0.41 0.00 0.17 -0.37 0.00 0.00 177.43 177.64 1ruu h LEU 30 N -0.99 0.00 0.15 0.34 8.10 -1.08 -1.74 115.31 120.09 1ruu h LEU 30 Ca -0.02 0.00 -0.32 0.00 0.11 0.00 0.00 57.88 57.65 1ruu h LEU 30 Cb 0.38 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.60 1ruu h LEU 30 CO 0.03 0.00 -1.60 0.58 -4.11 0.00 0.00 178.44 173.34 1ruu h VAL 31 N 0.00 1.10 -0.27 0.15 2.07 -1.14 -3.38 116.25 114.78 1ruu h VAL 31 Ca 0.00 -2.70 -0.16 0.00 0.82 0.00 0.00 66.70 64.66 1ruu h VAL 31 Cb 0.36 2.79 -0.00 0.00 -1.52 0.00 0.00 31.29 32.92 1ruu h VAL 31 CO 0.00 0.83 -0.45 0.71 0.02 0.00 0.00 177.57 178.68 1ruu h THR 32 N 0.09 1.29 -0.90 2.57 1.35 -0.80 -3.29 112.91 113.22 1ruu h THR 32 Ca -0.28 -1.65 0.25 0.00 -0.55 0.00 0.00 66.41 64.19 1ruu h THR 32 Cb 2.06 1.69 -0.16 0.00 -1.73 0.00 0.00 68.15 70.01 1ruu h THR 32 CO 0.18 0.53 0.15 0.03 -0.25 0.00 0.00 175.52 176.15 1ruu h ARG 33 N 0.52 0.11 -0.92 4.72 3.08 -1.50 0.16 114.38 120.55 1ruu h ARG 33 Ca 0.02 -0.01 0.23 0.00 0.07 0.00 0.00 59.98 60.30 1ruu h ARG 33 Cb 1.05 -0.02 -0.13 0.00 0.08 0.00 0.00 29.97 30.95 1ruu h ARG 33 CO 0.10 0.07 0.42 1.96 -1.07 0.00 0.00 179.97 181.46 1ruu h GLN 34 N 0.11 0.39 -1.53 0.04 1.08 -1.75 -3.08 115.11 110.38 1ruu h GLN 34 Ca 0.56 -0.02 -0.45 0.00 -1.45 0.00 0.00 58.65 57.29 1ruu h GLN 34 Cb 1.15 -0.09 -0.40 0.00 -0.05 0.00 0.00 27.48 28.09 1ruu h GLN 34 CO -0.75 0.26 -1.11 0.54 -0.95 0.00 0.00 178.83 176.81 1ruu n ARG 35 N -5.04 1.47 0.00 1.46 1.74 0.28 -5.19 116.66 111.38 1ruu n ARG 35 Ca 0.23 -3.55 0.13 0.00 -0.77 0.00 0.00 57.85 53.89 1ruu n ARG 35 Cb 0.70 -1.59 0.77 0.00 -1.02 0.00 0.00 32.46 31.32 1ruu n ARG 35 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09