#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ruu s PRO 2 N 0.00 2.95 0.08 -0.72 0.04 -1.26 -4.99 135.00 131.10 1ruu s PRO 2 Ca 0.00 0.80 -0.31 0.00 0.04 0.00 0.00 61.00 61.53 1ruu s PRO 2 Cb 0.00 -4.28 -0.07 0.00 0.04 0.00 0.00 34.50 30.18 1ruu s PRO 2 CO 0.00 -2.34 1.40 0.00 0.04 0.00 0.00 177.00 176.09 1ruu s ALA 3 N 7.91 3.58 -0.29 8.56 0.00 -1.26 -4.25 121.76 136.01 1ruu s ALA 3 Ca 0.68 1.04 -0.06 0.00 0.00 0.00 0.00 51.96 53.62 1ruu s ALA 3 Cb -0.15 -3.56 0.01 0.00 0.00 0.00 0.00 23.12 19.42 1ruu s ALA 3 CO 0.25 -0.71 0.23 1.63 0.00 0.00 0.00 175.76 177.16 1ruu n LYS 4 N 4.43 -2.38 -2.22 0.00 5.02 -1.26 -4.88 118.16 116.87 1ruu n LYS 4 Ca 0.12 2.09 -0.32 0.00 -2.02 0.00 0.00 58.31 58.18 1ruu n LYS 4 Cb 0.43 -4.68 -0.04 0.00 -0.02 0.00 0.00 35.03 30.72 1ruu n LYS 4 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ruu s PRO 5 N -1.78 2.93 -0.26 1.97 0.04 -1.26 -4.40 135.00 132.24 1ruu s PRO 5 Ca 0.10 -1.01 -0.05 0.00 0.04 0.00 0.00 61.00 60.07 1ruu s PRO 5 Cb -0.03 -5.25 0.01 0.00 0.04 0.00 0.00 34.50 29.27 1ruu s PRO 5 CO 0.62 -3.23 0.13 0.39 0.04 0.00 0.00 177.00 174.95 1ruu n GLU 6 N 8.58 -2.48 -1.81 4.56 1.02 -1.26 -4.95 120.64 124.31 1ruu n GLU 6 Ca 0.42 2.13 -0.38 0.00 -0.02 0.00 0.00 57.16 59.32 1ruu n GLU 6 Cb 0.47 -4.17 0.05 0.00 -0.02 0.00 0.00 31.44 27.77 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 -1.62 2.69 1.00 0.62 0.00 -1.26 -5.01 121.76 118.17 1ruu s ALA 7 Ca 0.06 1.26 -0.13 0.00 0.00 0.00 0.00 51.96 53.16 1ruu s ALA 7 Cb -0.01 -3.55 0.19 0.00 0.00 0.00 0.00 23.12 19.75 1ruu s ALA 7 CO 0.60 -1.39 1.11 -1.25 0.00 0.00 0.00 175.76 174.83 1ruu s PRO 8 N -3.06 0.44 -0.59 0.00 0.04 -1.26 -4.94 135.00 125.63 1ruu s PRO 8 Ca 0.75 0.39 -0.27 0.00 0.04 0.00 0.00 61.00 61.91 1ruu s PRO 8 Cb -0.38 -1.75 -0.01 0.00 0.04 0.00 0.00 34.50 32.39 1ruu s PRO 8 CO 0.44 -2.69 1.78 0.20 0.04 0.00 0.00 177.00 176.77 1ruu s GLY 9 N -3.65 0.35 0.00 0.56 0.00 -1.26 -4.89 107.32 98.43 1ruu s GLY 9 Ca 0.65 -0.62 -0.01 0.00 0.00 0.00 0.00 44.72 44.75 1ruu s GLY 9 CO 0.56 3.31 1.20 -1.84 0.00 0.00 0.00 173.10 176.34 1ruu n GLU 10 N 9.09 0.59 -2.30 2.90 0.00 -1.26 -4.77 120.64 124.89 1ruu n GLU 10 Ca 0.19 -0.12 -0.43 0.00 0.00 0.00 0.00 57.16 56.81 1ruu n GLU 10 Cb 0.51 -1.38 0.00 0.00 0.00 0.00 0.00 31.44 30.57 1ruu n GLU 10 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1ruu n ASP 11 N 2.01 4.81 -3.87 -1.84 9.92 -1.26 -4.89 116.55 121.44 1ruu n ASP 11 Ca 0.05 -3.02 -0.08 0.00 -0.53 0.00 0.00 54.79 51.21 1ruu n ASP 11 Cb 0.29 -1.55 -0.03 0.00 -0.64 0.00 0.00 41.12 39.18 1ruu n ASP 11 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ruu s ALA 12 N 1.48 -0.90 -0.49 2.24 0.00 -1.26 -5.06 121.76 117.75 1ruu s ALA 12 Ca 0.43 -0.44 -0.33 0.00 0.00 0.00 0.00 51.96 51.62 1ruu s ALA 12 Cb 0.08 0.92 0.05 0.00 0.00 0.00 0.00 23.12 24.17 1ruu s ALA 12 CO -0.01 -0.94 0.66 0.45 0.00 0.00 0.00 175.76 175.91 1ruu n SER 13 N -0.42 -5.66 -4.64 0.00 2.88 -1.26 -4.83 113.62 99.69 1ruu n SER 13 Ca -0.05 -0.19 -0.43 0.00 -1.33 0.00 0.00 58.87 56.88 1ruu n SER 13 Cb 0.61 -2.02 -0.03 0.00 -0.75 0.00 0.00 64.21 62.02 1ruu n SER 13 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1ruu s PRO 14 N -2.76 3.95 -0.52 -1.46 0.04 -1.26 -4.92 135.00 128.06 1ruu s PRO 14 Ca 0.33 1.89 0.05 0.00 0.04 0.00 0.00 61.00 63.31 1ruu s PRO 14 Cb -0.04 -4.02 0.19 0.00 0.04 0.00 0.00 34.50 30.68 1ruu s PRO 14 CO 0.87 -1.12 0.47 0.39 0.04 0.00 0.00 177.00 177.65 1ruu n GLU 15 N 7.44 1.06 -0.24 4.56 1.02 -1.26 -4.87 120.64 128.34 1ruu n GLU 15 Ca 0.18 -3.75 0.00 0.00 -0.02 0.00 0.00 57.16 53.57 1ruu n GLU 15 Cb 0.44 -1.84 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 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 2.07 0.00 0.53 3.49 2.13 -1.26 -4.83 120.64 122.76 1ruu n GLU 16 Ca 0.26 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.87 1ruu n GLU 16 Cb 0.44 -3.19 -0.10 0.00 0.27 0.00 0.00 31.44 28.87 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 -1.16 -2.59 4.31 5.85 -1.93 -2.63 115.31 117.15 1ruu h LEU 17 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1ruu h LEU 17 Cb 0.00 0.31 0.00 0.00 0.37 0.00 0.00 40.66 41.34 1ruu h LEU 17 CO 0.00 -0.82 0.00 -1.28 -0.34 0.00 0.00 178.44 176.00 1ruu h SER 18 N -1.35 0.00 -0.26 1.25 0.87 -1.94 -0.54 113.55 111.59 1ruu h SER 18 Ca -0.14 0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.50 1ruu h SER 18 Cb 1.04 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.99 1ruu h SER 18 CO 0.22 0.00 0.19 -0.09 -0.53 0.00 0.00 176.83 176.62 1ruu h ARG 19 N 0.00 0.00 -0.03 2.24 1.12 -1.86 0.50 114.38 116.36 1ruu h ARG 19 Ca 0.00 0.00 -0.05 0.00 -1.11 0.00 0.00 59.98 58.82 1ruu h ARG 19 Cb 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.06 1ruu h ARG 19 CO 0.00 0.00 -0.18 1.88 -3.11 0.00 0.00 179.97 178.56 1ruu h TYR 20 N 0.00 0.23 -0.20 2.20 0.05 -1.13 -2.93 116.97 115.19 1ruu h TYR 20 Ca 0.12 -0.11 -0.11 0.00 0.05 0.00 0.00 58.73 58.68 1ruu h TYR 20 Cb 0.50 -0.03 -0.00 0.00 1.01 0.00 0.00 36.73 38.21 1ruu h TYR 20 CO 0.00 0.83 -0.32 -0.92 -1.05 0.00 0.00 178.16 176.70 1ruu h TYR 21 N -0.43 0.71 -0.61 4.88 3.20 -1.36 -1.04 116.97 122.32 1ruu h TYR 21 Ca -0.01 -0.24 -0.08 0.00 3.14 0.00 0.00 58.73 61.53 1ruu h TYR 21 Cb 0.86 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.96 1ruu h TYR 21 CO 0.15 0.97 0.07 0.00 -1.64 0.00 0.00 178.16 177.71 1ruu h ALA 22 N 0.61 0.98 -0.04 1.82 0.00 -0.19 0.40 119.26 122.83 1ruu h ALA 22 Ca 0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1ruu h ALA 22 Cb 0.91 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1ruu h ALA 22 CO 0.07 0.64 -0.02 1.03 0.00 0.00 0.00 179.25 180.97 1ruu h SER 23 N 0.94 0.09 -0.35 0.00 0.87 -1.53 -3.07 113.55 110.50 1ruu h SER 23 Ca 0.18 -0.40 -0.02 0.00 -1.23 0.00 0.00 61.79 60.32 1ruu h SER 23 Cb 0.45 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 1ruu h SER 23 CO 0.02 0.47 0.17 0.25 -0.53 0.00 0.00 176.83 177.21 1ruu h LEU 24 N -0.29 0.50 -2.01 2.23 6.46 -1.00 -0.84 115.31 120.36 1ruu h LEU 24 Ca 0.01 -0.04 0.15 0.00 -0.12 0.00 0.00 57.88 57.88 1ruu h LEU 24 Cb 0.44 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.22 1ruu h LEU 24 CO 0.01 0.45 0.38 -0.09 -0.62 0.00 0.00 178.44 178.56 1ruu h ARG 25 N 0.56 0.00 0.63 1.25 1.12 -0.18 -1.91 114.38 115.84 1ruu h ARG 25 Ca 0.14 0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 58.98 1ruu h ARG 25 Cb 0.09 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 30.06 1ruu h ARG 25 CO -0.02 0.00 -0.30 1.25 -3.11 0.00 0.00 179.97 177.79 1ruu h HIS 26 N 0.00 -0.78 -0.27 2.20 2.76 -1.05 -1.20 115.15 116.81 1ruu h HIS 26 Ca 0.25 -0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.44 1ruu h HIS 26 Cb 1.01 0.26 -0.04 0.00 1.55 0.00 0.00 27.41 30.19 1ruu h HIS 26 CO 0.00 -0.48 0.04 -0.92 -1.30 0.00 0.00 177.93 175.27 1ruu h TYR 27 N -1.22 0.06 -0.21 5.26 3.20 -1.62 -1.17 116.97 121.27 1ruu h TYR 27 Ca -0.09 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.86 1ruu h TYR 27 Cb 0.65 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.93 1ruu h TYR 27 CO 0.00 0.00 0.21 1.25 -1.64 0.00 0.00 178.16 177.99 1ruu h LEU 28 N 0.13 0.00 0.21 2.82 5.85 -1.39 -0.81 115.31 122.11 1ruu h LEU 28 Ca 0.13 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1ruu h LEU 28 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1ruu h LEU 28 CO -0.18 0.00 -0.10 -1.13 -0.34 0.00 0.00 178.44 176.69 1ruu h ASN 29 N 0.00 -0.23 0.85 1.25 -1.24 0.04 0.37 115.58 116.61 1ruu h ASN 29 Ca 0.10 -0.29 0.00 0.00 0.71 0.00 0.00 56.30 56.81 1ruu h ASN 29 Cb 0.53 0.06 0.00 0.00 0.73 0.00 0.00 38.32 39.64 1ruu h ASN 29 CO -0.00 0.27 0.00 0.00 -1.29 0.00 0.00 177.43 176.41 1ruu n LEU 30 N -4.98 0.68 0.09 0.34 -0.00 -1.00 -1.76 117.00 110.37 1ruu n LEU 30 Ca -0.08 0.65 -0.21 0.00 -0.00 0.00 0.00 56.01 56.36 1ruu n LEU 30 Cb 0.26 -0.53 -0.15 0.00 -0.00 0.00 0.00 43.42 43.00 1ruu n LEU 30 CO 0.26 -0.49 -0.39 0.58 -0.00 0.00 0.00 177.39 177.35 1ruu h VAL 31 N 0.00 1.10 -0.31 1.47 2.07 -1.16 -3.36 116.25 116.06 1ruu h VAL 31 Ca 0.00 -2.66 -0.06 0.00 0.82 0.00 0.00 66.70 64.79 1ruu h VAL 31 Cb 0.42 2.84 -0.01 0.00 -1.52 0.00 0.00 31.29 33.02 1ruu h VAL 31 CO 0.00 0.84 -0.05 0.71 0.02 0.00 0.00 177.57 179.09 1ruu h THR 32 N 0.10 1.27 -0.94 2.57 1.35 -0.57 -3.22 112.91 113.47 1ruu h THR 32 Ca -0.29 -1.07 0.23 0.00 -0.55 0.00 0.00 66.41 64.74 1ruu h THR 32 Cb 2.09 1.34 -0.13 0.00 -1.73 0.00 0.00 68.15 69.72 1ruu h THR 32 CO 0.20 0.34 0.47 0.03 -0.25 0.00 0.00 175.52 176.31 1ruu h ARG 33 N 0.36 0.44 -1.00 4.72 3.08 -1.50 0.11 114.38 120.58 1ruu h ARG 33 Ca 0.08 -0.03 0.20 0.00 0.07 0.00 0.00 59.98 60.30 1ruu h ARG 33 Cb 0.53 -0.10 -0.11 0.00 0.08 0.00 0.00 29.97 30.37 1ruu h ARG 33 CO 0.03 0.29 0.61 1.96 -1.07 0.00 0.00 179.97 181.79 1ruu h GLN 34 N 0.45 0.72 -1.58 0.04 4.20 -1.70 -3.27 115.11 113.97 1ruu h GLN 34 Ca 0.60 -0.04 -0.48 0.00 0.06 0.00 0.00 58.65 58.79 1ruu h GLN 34 Cb 1.15 -0.16 -0.34 0.00 0.30 0.00 0.00 27.48 28.43 1ruu h GLN 34 CO -0.52 0.47 -0.99 0.54 -0.67 0.00 0.00 178.83 177.67 1ruu n ARG 35 N -4.79 0.77 0.00 1.46 5.12 0.21 -5.17 116.66 114.27 1ruu n ARG 35 Ca 0.24 -2.93 0.13 0.00 -1.93 0.00 0.00 57.85 53.35 1ruu n ARG 35 Cb 0.60 -1.32 0.23 0.00 -1.16 0.00 0.00 32.46 30.81 1ruu n ARG 35 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68