#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 2.51 -4.78 -0.72 -0.04 -1.26 -4.86 135.00 125.86 1ruu n PRO 2 Ca 0.00 -1.56 -0.33 0.00 -0.04 0.00 0.00 63.50 61.56 1ruu n PRO 2 Cb 0.00 -2.45 -0.12 0.00 -0.04 0.00 0.00 33.50 30.88 1ruu n PRO 2 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ruu s ALA 3 N 2.61 2.79 0.07 0.55 0.00 -1.26 -5.06 121.76 121.46 1ruu s ALA 3 Ca 0.52 -0.94 -0.28 0.00 0.00 0.00 0.00 51.96 51.25 1ruu s ALA 3 Cb 0.16 -1.08 -0.17 0.00 0.00 0.00 0.00 23.12 22.02 1ruu s ALA 3 CO -0.04 0.55 1.63 0.87 0.00 0.00 0.00 175.76 178.77 1ruu h LYS 4 N 5.36 -0.49 -5.97 0.00 6.56 -2.09 -3.37 116.57 116.56 1ruu h LYS 4 Ca -0.47 0.03 -0.54 0.00 -1.06 0.00 0.00 60.65 58.62 1ruu h LYS 4 Cb 1.16 0.11 -0.08 0.00 -0.57 0.00 0.00 32.23 32.85 1ruu h LYS 4 CO 0.51 -0.31 1.42 -1.25 -2.06 0.00 0.00 179.45 177.76 1ruu s PRO 5 N -5.96 3.38 -0.30 3.15 0.04 -1.26 -4.84 135.00 129.22 1ruu s PRO 5 Ca -0.16 -1.07 0.01 0.00 0.04 0.00 0.00 61.00 59.83 1ruu s PRO 5 Cb 0.04 -5.32 0.19 0.00 0.04 0.00 0.00 34.50 29.46 1ruu s PRO 5 CO 0.63 -2.54 0.65 -2.00 0.04 0.00 0.00 177.00 173.78 1ruu s GLU 6 N 5.36 0.52 0.11 4.56 2.12 -1.26 -5.12 118.70 124.99 1ruu s GLU 6 Ca 0.53 0.70 -0.08 0.00 0.36 0.00 0.00 54.97 56.48 1ruu s GLU 6 Cb -0.01 0.36 -0.01 0.00 0.26 0.00 0.00 34.13 34.74 1ruu s GLU 6 CO -0.05 -0.78 0.19 0.00 -0.54 0.00 0.00 175.26 174.09 1ruu s ALA 7 N 2.86 -0.07 0.90 6.30 0.00 -1.26 -5.11 121.76 125.39 1ruu s ALA 7 Ca 0.15 -0.76 -0.14 0.00 0.00 0.00 0.00 51.96 51.20 1ruu s ALA 7 Cb -0.12 0.59 0.15 0.00 0.00 0.00 0.00 23.12 23.74 1ruu s ALA 7 CO -0.23 -0.54 1.23 -1.25 0.00 0.00 0.00 175.76 174.97 1ruu s PRO 8 N -3.90 1.16 0.00 0.00 0.04 -1.26 -4.93 135.00 126.12 1ruu s PRO 8 Ca 0.09 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.05 1ruu s PRO 8 Cb 0.05 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.71 1ruu s PRO 8 CO -0.07 -2.11 0.00 0.41 0.04 0.00 0.00 177.00 175.26 1ruu n GLY 9 N -3.23 0.48 3.58 0.56 0.00 -1.26 -5.07 105.19 100.26 1ruu n GLY 9 Ca 0.11 -1.76 -0.22 0.00 0.00 0.00 0.00 46.02 44.14 1ruu n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ruu n GLU 10 N 0.00 -1.61 -3.74 1.61 2.13 -1.26 -3.11 120.64 114.66 1ruu n GLU 10 Ca 0.00 1.05 -0.30 0.00 0.66 0.00 0.00 57.16 58.57 1ruu n GLU 10 Cb 0.00 -2.97 0.02 0.00 0.27 0.00 0.00 31.44 28.76 1ruu n GLU 10 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1ruu n ASP 11 N -1.98 -5.20 -4.59 4.31 2.03 -1.26 -4.96 116.55 104.89 1ruu n ASP 11 Ca -0.21 -0.97 -0.29 0.00 0.52 0.00 0.00 54.79 53.84 1ruu n ASP 11 Cb 0.65 -2.72 0.21 0.00 -0.72 0.00 0.00 41.12 38.53 1ruu n ASP 11 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ruu s ALA 12 N -3.30 0.41 0.83 -1.67 0.00 -1.18 -5.00 121.76 111.84 1ruu s ALA 12 Ca 0.30 -0.12 -0.14 0.00 0.00 0.00 0.00 51.96 52.00 1ruu s ALA 12 Cb -0.13 -3.22 0.01 0.00 0.00 0.00 0.00 23.12 19.78 1ruu s ALA 12 CO 0.89 -3.24 0.59 -1.13 0.00 0.00 0.00 175.76 172.86 1ruu n SER 13 N -4.50 -1.19 -2.52 0.00 3.41 -1.26 -5.02 113.62 102.54 1ruu n SER 13 Ca 0.05 0.49 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 1ruu n SER 13 Cb 0.55 -1.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.24 1ruu n SER 13 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1ruu n PRO 14 N -1.50 -1.05 -1.58 4.33 -0.04 -1.26 -4.49 135.00 129.41 1ruu n PRO 14 Ca 0.09 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1ruu n PRO 14 Cb 0.51 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.97 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 -1.52 -0.21 -3.27 0.54 1.02 -1.26 -4.51 120.64 111.43 1ruu n GLU 15 Ca 0.00 0.64 -0.24 0.00 -0.02 0.00 0.00 57.16 57.54 1ruu n GLU 15 Cb 0.00 -1.32 0.02 0.00 -0.02 0.00 0.00 31.44 30.12 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 -0.01 -4.45 0.11 3.49 4.71 -1.26 -4.92 120.64 118.31 1ruu n GLU 16 Ca 0.00 0.69 -0.09 0.00 -0.01 0.00 0.00 57.16 57.76 1ruu n GLU 16 Cb 0.00 -5.50 -0.05 0.00 -1.01 0.00 0.00 31.44 24.88 1ruu n GLU 16 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1ruu h LEU 17 N -1.33 -0.74 -2.17 -4.62 5.85 -1.79 -1.71 115.31 108.80 1ruu h LEU 17 Ca -0.49 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 1ruu h LEU 17 Cb 1.33 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 42.62 1ruu h LEU 17 CO 0.56 -0.31 -0.06 -1.28 -0.34 0.00 0.00 178.44 177.01 1ruu h SER 18 N -0.45 0.00 -0.33 1.25 0.87 -1.92 -1.80 113.55 111.16 1ruu h SER 18 Ca -0.02 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.56 1ruu h SER 18 Cb 0.41 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 1ruu h SER 18 CO -0.08 0.06 0.22 -0.09 -0.53 0.00 0.00 176.83 176.41 1ruu h ARG 19 N 0.00 0.36 -0.25 2.24 1.12 -1.70 0.44 114.38 116.59 1ruu h ARG 19 Ca -0.00 -0.02 -0.05 0.00 -1.11 0.00 0.00 59.98 58.80 1ruu h ARG 19 Cb 0.24 -0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 30.11 1ruu h ARG 19 CO 0.01 0.24 -0.04 1.88 -3.11 0.00 0.00 179.97 178.95 1ruu h TYR 20 N 0.37 0.52 -0.06 2.20 0.05 -1.02 -1.91 116.97 117.12 1ruu h TYR 20 Ca 0.13 -0.10 -0.04 0.00 0.05 0.00 0.00 58.73 58.76 1ruu h TYR 20 Cb 0.06 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 37.67 1ruu h TYR 20 CO -0.00 0.67 -0.13 -0.92 -1.05 0.00 0.00 178.16 176.73 1ruu h TYR 21 N 0.22 0.25 -0.85 4.88 3.20 -1.35 -0.91 116.97 122.41 1ruu h TYR 21 Ca 0.07 -0.09 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1ruu h TYR 21 Cb 0.49 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.67 1ruu h TYR 21 CO 0.05 0.73 0.48 0.00 -1.64 0.00 0.00 178.16 177.77 1ruu h ALA 22 N 0.48 1.24 0.12 1.82 0.00 -0.28 0.38 119.26 123.03 1ruu h ALA 22 Ca 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1ruu h ALA 22 Cb 0.71 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ruu h ALA 22 CO 0.03 0.62 -0.06 1.03 0.00 0.00 0.00 179.25 180.87 1ruu h SER 23 N 1.19 -0.14 -0.71 0.00 0.87 -1.37 -3.11 113.55 110.28 1ruu h SER 23 Ca 0.30 -0.31 0.04 0.00 -1.23 0.00 0.00 61.79 60.60 1ruu h SER 23 Cb 0.00 0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 61.96 1ruu h SER 23 CO -0.05 0.25 0.47 0.25 -0.53 0.00 0.00 176.83 177.22 1ruu h LEU 24 N -0.56 0.71 -2.01 2.23 5.85 -0.98 -0.28 115.31 120.26 1ruu h LEU 24 Ca -0.02 -0.00 0.15 0.00 0.84 0.00 0.00 57.88 58.85 1ruu h LEU 24 Cb 0.44 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1ruu h LEU 24 CO 0.03 0.48 0.42 -0.09 -0.34 0.00 0.00 178.44 178.93 1ruu h ARG 25 N 0.81 0.00 0.51 1.25 1.12 -0.26 -1.60 114.38 116.22 1ruu h ARG 25 Ca 0.29 0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 59.14 1ruu h ARG 25 Cb 0.13 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 30.10 1ruu h ARG 25 CO -0.09 0.00 -0.25 1.25 -3.11 0.00 0.00 179.97 177.78 1ruu h HIS 26 N 0.00 -0.64 -0.36 2.20 2.76 -0.96 -1.44 115.15 116.70 1ruu h HIS 26 Ca 0.25 -0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.46 1ruu h HIS 26 Cb 1.08 0.21 -0.05 0.00 1.55 0.00 0.00 27.41 30.21 1ruu h HIS 26 CO 0.00 -0.40 0.06 -0.92 -1.30 0.00 0.00 177.93 175.37 1ruu h TYR 27 N -0.98 0.09 -0.21 5.26 3.20 -1.61 -0.74 116.97 121.99 1ruu h TYR 27 Ca -0.07 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.88 1ruu h TYR 27 Cb 0.53 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.80 1ruu h TYR 27 CO 0.03 0.00 0.19 1.25 -1.64 0.00 0.00 178.16 177.99 1ruu h LEU 28 N 0.18 0.00 0.59 2.82 5.85 -1.36 -0.73 115.31 122.65 1ruu h LEU 28 Ca 0.17 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 1ruu h LEU 28 Cb 0.20 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.24 1ruu h LEU 28 CO -0.23 0.00 -0.28 -1.13 -0.34 0.00 0.00 178.44 176.45 1ruu h ASN 29 N 0.00 -0.67 0.62 1.25 -0.73 0.00 0.60 115.58 116.65 1ruu h ASN 29 Ca 0.10 0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.29 1ruu h ASN 29 Cb 0.48 0.17 0.00 0.00 0.27 0.00 0.00 38.32 39.24 1ruu h ASN 29 CO -0.00 -0.28 0.00 0.17 -0.37 0.00 0.00 177.43 176.94 1ruu h LEU 30 N -1.17 0.00 0.15 0.34 8.10 -1.21 -1.32 115.31 120.20 1ruu h LEU 30 Ca -0.08 0.00 -0.30 0.00 0.11 0.00 0.00 57.88 57.61 1ruu h LEU 30 Cb 0.60 0.00 0.03 0.00 -0.44 0.00 0.00 40.66 40.85 1ruu h LEU 30 CO 0.13 0.00 -1.27 0.58 -4.11 0.00 0.00 178.44 173.78 1ruu h VAL 31 N 0.00 1.29 -0.34 0.15 2.07 -1.15 -3.36 116.25 114.91 1ruu h VAL 31 Ca 0.00 -2.50 -0.05 0.00 0.82 0.00 0.00 66.70 64.97 1ruu h VAL 31 Cb 0.31 2.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.84 1ruu h VAL 31 CO 0.00 0.76 0.01 0.71 0.02 0.00 0.00 177.57 179.07 1ruu h THR 32 N 0.22 1.25 -1.04 2.57 1.35 0.17 -3.23 112.91 114.21 1ruu h THR 32 Ca -0.20 -0.93 0.34 0.00 -0.55 0.00 0.00 66.41 65.07 1ruu h THR 32 Cb 1.95 1.20 -0.15 0.00 -1.73 0.00 0.00 68.15 69.42 1ruu h THR 32 CO 0.24 0.31 0.60 0.03 -0.25 0.00 0.00 175.52 176.45 1ruu h ARG 33 N 0.40 0.26 -0.80 4.72 3.08 -1.43 0.24 114.38 120.85 1ruu h ARG 33 Ca 0.10 -0.02 0.13 0.00 0.07 0.00 0.00 59.98 60.26 1ruu h ARG 33 Cb 0.42 -0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.33 1ruu h ARG 33 CO 0.01 0.17 0.40 1.96 -1.07 0.00 0.00 179.97 181.44 1ruu h GLN 34 N 0.27 0.58 -1.47 0.04 1.08 -1.72 -3.23 115.11 110.66 1ruu h GLN 34 Ca 0.75 -0.04 -0.46 0.00 -1.45 0.00 0.00 58.65 57.46 1ruu h GLN 34 Cb 1.82 -0.13 -0.41 0.00 -0.05 0.00 0.00 27.48 28.71 1ruu h GLN 34 CO -0.59 0.39 -1.06 0.54 -0.95 0.00 0.00 178.83 177.16 1ruu n ARG 35 N -4.88 1.74 0.00 1.46 3.00 0.64 -5.19 116.66 113.43 1ruu n ARG 35 Ca 0.15 -3.68 0.13 0.00 -0.01 0.00 0.00 57.85 54.44 1ruu n ARG 35 Cb 0.38 -1.64 0.40 0.00 0.00 0.00 0.00 32.46 31.60 1ruu n ARG 35 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.63 178.61