#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 2.27 -0.27 -0.72 -0.04 -1.26 -4.38 135.00 130.61 1ruu n PRO 2 Ca 0.00 -2.10 0.08 0.00 -0.04 0.00 0.00 63.50 61.45 1ruu n PRO 2 Cb 0.00 -2.98 0.16 0.00 -0.04 0.00 0.00 33.50 30.64 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 6.18 2.72 -2.40 0.55 0.00 -1.26 -5.04 120.51 121.25 1ruu n ALA 3 Ca 0.53 -2.82 -0.13 0.00 0.00 0.00 0.00 53.44 51.02 1ruu n ALA 3 Cb 0.35 -0.38 -0.11 0.00 0.00 0.00 0.00 19.45 19.31 1ruu n ALA 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ruu s LYS 4 N -2.91 0.84 0.00 0.00 1.02 -1.26 -5.06 119.74 112.38 1ruu s LYS 4 Ca 0.33 -1.21 -0.04 0.00 0.02 0.00 0.00 55.97 55.07 1ruu s LYS 4 Cb 0.30 -0.44 -0.17 0.00 -0.52 0.00 0.00 37.83 37.01 1ruu s LYS 4 CO -0.01 0.05 2.57 -0.35 -0.92 0.00 0.00 175.35 176.69 1ruu n PRO 5 N 0.37 1.33 -3.15 -1.68 -0.04 -1.26 -4.55 135.00 126.03 1ruu n PRO 5 Ca -0.15 -0.64 0.05 0.00 -0.04 0.00 0.00 63.50 62.72 1ruu n PRO 5 Cb 0.59 -1.79 -0.01 0.00 -0.04 0.00 0.00 33.50 32.24 1ruu n PRO 5 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1ruu s GLU 6 N 1.53 0.43 0.04 0.54 2.12 -1.26 -5.18 118.70 116.92 1ruu s GLU 6 Ca 0.43 0.74 -0.04 0.00 0.36 0.00 0.00 54.97 56.45 1ruu s GLU 6 Cb 0.20 0.41 -0.02 0.00 0.26 0.00 0.00 34.13 34.98 1ruu s GLU 6 CO 0.00 -0.48 0.06 0.00 -0.54 0.00 0.00 175.26 174.29 1ruu s ALA 7 N 2.89 0.05 0.69 6.30 0.00 -1.26 -4.97 121.76 125.47 1ruu s ALA 7 Ca 0.13 -0.65 -0.11 0.00 0.00 0.00 0.00 51.96 51.32 1ruu s ALA 7 Cb -0.13 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1ruu s ALA 7 CO -0.18 -0.30 1.06 -1.25 0.00 0.00 0.00 175.76 175.09 1ruu s PRO 8 N -2.62 2.98 0.17 0.00 0.04 -1.26 -4.91 135.00 129.40 1ruu s PRO 8 Ca -0.05 0.83 0.00 0.00 0.04 0.00 0.00 61.00 61.82 1ruu s PRO 8 Cb -0.01 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1ruu s PRO 8 CO -0.05 -1.03 0.00 0.41 0.04 0.00 0.00 177.00 176.37 1ruu n GLY 9 N -2.27 -3.13 2.77 0.56 0.00 -1.26 -4.65 105.19 97.21 1ruu n GLY 9 Ca 0.07 -1.19 -0.40 0.00 0.00 0.00 0.00 46.02 44.50 1ruu n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ruu n GLU 10 N -1.91 2.49 -3.63 1.61 1.02 -1.26 -4.83 120.64 114.13 1ruu n GLU 10 Ca -0.00 -2.20 -0.37 0.00 -0.02 0.00 0.00 57.16 54.57 1ruu n GLU 10 Cb 0.15 -3.02 -0.07 0.00 -0.02 0.00 0.00 31.44 28.48 1ruu n GLU 10 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1ruu s ASP 11 N 3.62 5.92 -0.53 1.62 -1.08 -1.26 -4.97 116.67 119.99 1ruu s ASP 11 Ca 0.53 -3.48 0.04 0.00 -0.52 0.00 0.00 52.55 49.11 1ruu s ASP 11 Cb 0.14 -1.92 0.16 0.00 -1.46 0.00 0.00 42.92 39.84 1ruu s ASP 11 CO -0.02 -0.25 0.37 0.00 0.52 0.00 0.00 175.17 175.79 1ruu s ALA 12 N -1.00 2.51 0.65 3.66 0.00 -1.26 -5.06 121.76 121.25 1ruu s ALA 12 Ca 0.25 -3.00 -0.17 0.00 0.00 0.00 0.00 51.96 49.03 1ruu s ALA 12 Cb -0.10 -1.89 -0.03 0.00 0.00 0.00 0.00 23.12 21.09 1ruu s ALA 12 CO -0.10 -2.05 0.90 -1.13 0.00 0.00 0.00 175.76 173.39 1ruu n SER 13 N 2.74 0.42 -4.55 0.00 3.41 -1.26 -4.88 113.62 109.49 1ruu n SER 13 Ca 0.20 0.74 -0.38 0.00 -0.26 0.00 0.00 58.87 59.17 1ruu n SER 13 Cb 0.39 -1.37 -0.03 0.00 -0.26 0.00 0.00 64.21 62.94 1ruu n SER 13 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1ruu s PRO 14 N -2.89 2.82 -0.41 4.33 0.04 -1.26 -4.81 135.00 132.81 1ruu s PRO 14 Ca 0.75 0.22 0.05 0.00 0.04 0.00 0.00 61.00 62.06 1ruu s PRO 14 Cb -0.39 -4.42 0.19 0.00 0.04 0.00 0.00 34.50 29.92 1ruu s PRO 14 CO 0.49 -2.60 0.41 0.39 0.04 0.00 0.00 177.00 175.72 1ruu n GLU 15 N 9.21 0.33 -1.07 4.56 1.02 -1.26 -4.89 120.64 128.53 1ruu n GLU 15 Ca 0.18 -3.11 -0.02 0.00 -0.02 0.00 0.00 57.16 54.18 1ruu n GLU 15 Cb 0.51 -1.55 -0.01 0.00 -0.02 0.00 0.00 31.44 30.37 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 2.48 -1.55 0.29 3.49 2.13 -1.26 -4.90 120.64 121.32 1ruu n GLU 16 Ca 0.27 0.50 -0.13 0.00 0.66 0.00 0.00 57.16 58.46 1ruu n GLU 16 Cb 0.50 -4.71 -0.07 0.00 0.27 0.00 0.00 31.44 27.43 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 -0.85 -1.38 4.31 5.85 -1.90 -2.56 115.31 118.78 1ruu h LEU 17 Ca -0.05 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ruu h LEU 17 Cb 0.85 0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1ruu h LEU 17 CO 0.07 -0.51 0.00 -1.28 -0.34 0.00 0.00 178.44 176.39 1ruu h SER 18 N -0.81 0.00 0.30 1.25 0.87 -1.97 -0.63 113.55 112.56 1ruu h SER 18 Ca -0.07 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.46 1ruu h SER 18 Cb 0.65 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.61 1ruu h SER 18 CO 0.07 0.00 -0.16 -0.09 -0.53 0.00 0.00 176.83 176.11 1ruu h ARG 19 N 0.00 0.00 0.01 2.24 1.12 -1.86 0.24 114.38 116.13 1ruu h ARG 19 Ca 0.00 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1ruu h ARG 19 Cb 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.19 1ruu h ARG 19 CO 0.00 0.16 -0.00 1.88 -3.11 0.00 0.00 179.97 178.90 1ruu h TYR 20 N 0.00 -0.01 -0.16 2.20 0.05 -1.01 -2.88 116.97 115.16 1ruu h TYR 20 Ca -0.00 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 1ruu h TYR 20 Cb 0.36 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.09 1ruu h TYR 20 CO 0.00 0.67 0.08 -0.92 -1.05 0.00 0.00 178.16 176.94 1ruu h TYR 21 N -0.69 0.23 -0.90 4.88 3.20 -1.51 -0.80 116.97 121.37 1ruu h TYR 21 Ca -0.00 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.91 1ruu h TYR 21 Cb 0.68 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.82 1ruu h TYR 21 CO 0.16 0.24 0.59 0.00 -1.64 0.00 0.00 178.16 177.51 1ruu h ALA 22 N 0.97 1.46 0.35 1.82 0.00 -0.67 0.39 119.26 123.58 1ruu h ALA 22 Ca 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1ruu h ALA 22 Cb 0.09 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ruu h ALA 22 CO -0.01 0.43 -0.17 1.03 0.00 0.00 0.00 179.25 180.53 1ruu h SER 23 N 1.09 -0.40 -0.28 0.00 0.87 -1.27 -2.65 113.55 110.92 1ruu h SER 23 Ca 0.37 -0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.76 1ruu h SER 23 Cb 0.09 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 1ruu h SER 23 CO -0.12 -0.04 0.11 0.25 -0.53 0.00 0.00 176.83 176.49 1ruu h LEU 24 N -0.79 0.44 -1.59 2.23 5.85 -0.96 -1.03 115.31 119.45 1ruu h LEU 24 Ca -0.05 -0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.73 1ruu h LEU 24 Cb 0.52 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.40 1ruu h LEU 24 CO 0.08 0.43 0.43 -0.09 -0.34 0.00 0.00 178.44 178.95 1ruu h ARG 25 N 0.48 0.44 0.96 1.25 1.12 -0.22 -1.90 114.38 116.52 1ruu h ARG 25 Ca 0.12 -0.03 -0.05 0.00 -1.11 0.00 0.00 59.98 58.91 1ruu h ARG 25 Cb 0.15 -0.10 0.01 0.00 -0.01 0.00 0.00 29.97 30.02 1ruu h ARG 25 CO -0.01 0.29 -0.48 1.25 -3.11 0.00 0.00 179.97 177.92 1ruu h HIS 26 N 0.45 -1.24 -0.30 2.20 2.76 -0.80 0.15 115.15 118.37 1ruu h HIS 26 Ca 0.30 -0.03 0.05 0.00 -2.20 0.00 0.00 60.37 58.49 1ruu h HIS 26 Cb 0.56 0.42 -0.05 0.00 1.55 0.00 0.00 27.41 29.89 1ruu h HIS 26 CO -0.00 -0.76 0.01 -0.92 -1.30 0.00 0.00 177.93 174.96 1ruu h TYR 27 N -1.31 0.01 -0.34 5.26 3.20 -1.62 -0.98 116.97 121.19 1ruu h TYR 27 Ca -0.13 0.02 0.10 0.00 3.14 0.00 0.00 58.73 61.86 1ruu h TYR 27 Cb 1.01 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.31 1ruu h TYR 27 CO -0.01 -0.04 0.27 1.25 -1.64 0.00 0.00 178.16 177.99 1ruu h LEU 28 N 0.10 0.00 0.53 2.82 5.85 -1.22 -0.69 115.31 122.70 1ruu h LEU 28 Ca 0.14 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 1ruu h LEU 28 Cb 0.18 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.22 1ruu h LEU 28 CO -0.23 0.00 -0.26 -1.13 -0.34 0.00 0.00 178.44 176.49 1ruu h ASN 29 N 0.00 -0.61 0.68 1.25 -0.73 0.68 0.22 115.58 117.08 1ruu h ASN 29 Ca 0.16 -0.03 0.00 0.00 1.87 0.00 0.00 56.30 58.30 1ruu h ASN 29 Cb 0.70 0.16 0.00 0.00 0.27 0.00 0.00 38.32 39.44 1ruu h ASN 29 CO -0.00 -0.21 0.00 0.17 -0.37 0.00 0.00 177.43 177.02 1ruu h LEU 30 N -1.12 0.00 0.04 0.34 8.10 -1.24 -1.33 115.31 120.11 1ruu h LEU 30 Ca -0.07 0.00 -0.25 0.00 0.11 0.00 0.00 57.88 57.67 1ruu h LEU 30 Cb 0.60 0.00 0.02 0.00 -0.44 0.00 0.00 40.66 40.84 1ruu h LEU 30 CO 0.12 0.00 -1.00 0.58 -4.11 0.00 0.00 178.44 174.03 1ruu h VAL 31 N 0.00 1.32 -0.20 0.15 2.07 -1.08 -3.37 116.25 115.14 1ruu h VAL 31 Ca 0.00 -2.29 -0.18 0.00 0.82 0.00 0.00 66.70 65.05 1ruu h VAL 31 Cb 0.34 2.57 -0.00 0.00 -1.52 0.00 0.00 31.29 32.67 1ruu h VAL 31 CO 0.00 0.69 -0.61 0.71 0.02 0.00 0.00 177.57 178.39 1ruu h THR 32 N 0.21 1.31 -1.08 2.57 1.35 0.08 -3.11 112.91 114.24 1ruu h THR 32 Ca -0.14 -1.85 0.29 0.00 -0.55 0.00 0.00 66.41 64.17 1ruu h THR 32 Cb 1.68 1.80 -0.08 0.00 -1.73 0.00 0.00 68.15 69.83 1ruu h THR 32 CO 0.19 0.58 0.72 0.03 -0.25 0.00 0.00 175.52 176.80 1ruu h ARG 33 N 0.50 0.23 -0.25 4.72 3.08 -1.44 0.89 114.38 122.11 1ruu h ARG 33 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1ruu h ARG 33 Cb 1.19 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1ruu h ARG 33 CO 0.12 0.15 0.00 1.04 -1.07 0.00 0.00 179.97 180.21 1ruu n GLN 34 N -4.47 2.85 -2.80 0.04 1.13 -1.22 -4.85 117.38 108.06 1ruu n GLN 34 Ca 0.25 -2.80 -0.01 0.00 -1.94 0.00 0.00 57.00 52.50 1ruu n GLN 34 Cb 1.00 -1.81 0.01 0.00 0.11 0.00 0.00 30.24 29.56 1ruu n GLN 34 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1ruu s ARG 35 N -2.76 0.43 0.00 -1.09 1.81 0.30 -5.09 118.95 112.55 1ruu s ARG 35 Ca 0.41 -0.30 0.00 0.00 -1.72 0.00 0.00 55.73 54.12 1ruu s ARG 35 Cb 0.33 0.01 0.00 0.00 -0.45 0.00 0.00 34.95 34.84 1ruu s ARG 35 CO 0.09 -0.57 0.00 0.98 -0.68 0.00 0.00 175.30 175.11