#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 0.60 -3.92 -0.72 -0.04 -1.26 -4.64 135.00 125.01 1ruu n PRO 2 Ca 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 1ruu n PRO 2 Cb 0.00 -1.47 -0.11 0.00 -0.04 0.00 0.00 33.50 31.87 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 -2.00 -0.03 -0.04 0.55 0.00 -1.26 -5.09 121.76 113.88 1ruu s ALA 3 Ca 0.27 -0.30 -0.19 0.00 0.00 0.00 0.00 51.96 51.73 1ruu s ALA 3 Cb 0.13 0.08 -0.13 0.00 0.00 0.00 0.00 23.12 23.19 1ruu s ALA 3 CO 0.21 -0.13 0.82 0.87 0.00 0.00 0.00 175.76 177.52 1ruu h LYS 4 N 4.95 -0.31 -6.07 0.00 1.57 -2.05 -3.41 116.57 111.25 1ruu h LYS 4 Ca -0.30 0.02 -0.50 0.00 -1.87 0.00 0.00 60.65 58.00 1ruu h LYS 4 Cb 1.21 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.54 1ruu h LYS 4 CO 0.43 0.04 1.25 -1.25 -0.57 0.00 0.00 179.45 179.35 1ruu s PRO 5 N -3.45 2.79 0.70 3.15 0.04 -1.26 -4.99 135.00 131.99 1ruu s PRO 5 Ca -0.11 0.30 -0.08 0.00 0.04 0.00 0.00 61.00 61.15 1ruu s PRO 5 Cb 0.01 -4.38 0.05 0.00 0.04 0.00 0.00 34.50 30.22 1ruu s PRO 5 CO 0.41 -2.60 1.03 -1.21 0.04 0.00 0.00 177.00 174.67 1ruu s GLU 6 N 6.65 2.34 0.40 4.56 0.41 -1.26 -4.97 118.70 126.82 1ruu s GLU 6 Ca 0.58 -0.09 0.00 0.00 -0.41 0.00 0.00 54.97 55.05 1ruu s GLU 6 Cb -0.11 -2.14 0.00 0.00 -1.78 0.00 0.00 34.13 30.10 1ruu s GLU 6 CO 0.18 -1.19 0.00 0.00 -0.49 0.00 0.00 175.26 173.76 1ruu n ALA 7 N -2.94 -3.02 -1.18 5.21 0.00 -1.26 -4.91 120.51 112.41 1ruu n ALA 7 Ca 0.07 0.58 -0.29 0.00 0.00 0.00 0.00 53.44 53.81 1ruu n ALA 7 Cb 0.60 -1.17 0.18 0.00 0.00 0.00 0.00 19.45 19.06 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 -3.11 0.37 0.00 0.00 0.04 -1.26 -5.08 135.00 125.96 1ruu s PRO 8 Ca 0.00 0.48 0.00 0.00 0.04 0.00 0.00 61.00 61.52 1ruu s PRO 8 Cb 0.00 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.81 1ruu s PRO 8 CO 0.00 -2.76 0.00 0.41 0.04 0.00 0.00 177.00 174.69 1ruu n GLY 9 N -1.13 -2.80 3.06 0.56 0.00 -1.26 -5.09 105.19 98.51 1ruu n GLY 9 Ca 0.05 -1.33 -0.13 0.00 0.00 0.00 0.00 46.02 44.61 1ruu n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ruu s GLU 10 N -1.27 0.18 -0.80 1.61 2.02 -1.26 -5.10 118.70 114.09 1ruu s GLU 10 Ca 0.00 0.80 -0.06 0.00 0.02 0.00 0.00 54.97 55.73 1ruu s GLU 10 Cb 0.00 0.03 0.20 0.00 0.10 0.00 0.00 34.13 34.47 1ruu s GLU 10 CO 0.00 -0.28 0.69 0.16 0.02 0.00 0.00 175.26 175.85 1ruu s ASP 11 N 2.44 6.07 -0.14 -0.19 -4.77 -1.26 -5.02 116.67 113.80 1ruu s ASP 11 Ca 0.01 -3.10 -0.12 0.00 -3.30 0.00 0.00 52.55 46.03 1ruu s ASP 11 Cb -0.12 -2.01 0.04 0.00 -1.09 0.00 0.00 42.92 39.74 1ruu s ASP 11 CO -0.09 -0.37 0.37 0.00 0.70 0.00 0.00 175.17 175.77 1ruu s ALA 12 N -0.45 -0.91 -0.29 2.11 0.00 -1.26 -5.01 121.76 115.95 1ruu s ALA 12 Ca 0.21 1.07 -0.26 0.00 0.00 0.00 0.00 51.96 52.98 1ruu s ALA 12 Cb -0.13 -0.62 0.04 0.00 0.00 0.00 0.00 23.12 22.40 1ruu s ALA 12 CO -0.08 -0.18 0.43 0.45 0.00 0.00 0.00 175.76 176.39 1ruu n SER 13 N 3.00 -5.59 -3.34 0.00 2.88 -1.26 -4.75 113.62 104.56 1ruu n SER 13 Ca -0.14 0.01 -0.30 0.00 -1.33 0.00 0.00 58.87 57.11 1ruu n SER 13 Cb 0.57 -1.52 -0.03 0.00 -0.75 0.00 0.00 64.21 62.48 1ruu n SER 13 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1ruu n PRO 14 N 0.29 2.07 -0.28 -1.46 -0.04 -1.26 -4.63 135.00 129.69 1ruu n PRO 14 Ca -0.06 -1.68 0.03 0.00 -0.04 0.00 0.00 63.50 61.74 1ruu n PRO 14 Cb 0.60 -2.66 0.13 0.00 -0.04 0.00 0.00 33.50 31.54 1ruu n PRO 14 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1ruu n GLU 15 N 5.06 2.24 0.00 0.54 0.28 -1.26 -3.90 120.64 123.60 1ruu n GLU 15 Ca 0.49 -1.05 0.00 0.00 -0.16 0.00 0.00 57.16 56.44 1ruu n GLU 15 Cb 0.23 -1.70 0.00 0.00 1.43 0.00 0.00 31.44 31.40 1ruu n GLU 15 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1ruu n GLU 16 N 0.21 0.00 0.15 3.44 2.13 -1.26 -4.90 120.64 120.41 1ruu n GLU 16 Ca 0.09 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.82 1ruu n GLU 16 Cb 0.53 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.19 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 -0.71 -2.44 4.31 5.85 -1.91 -2.28 115.31 118.13 1ruu h LEU 17 Ca 0.00 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1ruu h LEU 17 Cb 0.00 0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 1ruu h LEU 17 CO 0.00 -0.34 -0.01 0.28 -0.34 0.00 0.00 178.44 178.03 1ruu h SER 18 N -0.51 0.00 -0.12 1.25 0.02 -1.95 -1.31 113.55 110.93 1ruu h SER 18 Ca -0.03 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1ruu h SER 18 Cb 0.44 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1ruu h SER 18 CO -0.03 0.01 0.06 -0.09 -1.14 0.00 0.00 176.83 175.63 1ruu h ARG 19 N 0.00 0.21 -0.03 3.45 1.12 -1.63 0.23 114.38 117.73 1ruu h ARG 19 Ca -0.00 -0.02 -0.03 0.00 -1.11 0.00 0.00 59.98 58.82 1ruu h ARG 19 Cb 0.18 -0.04 0.00 0.00 -0.01 0.00 0.00 29.97 30.10 1ruu h ARG 19 CO 0.00 0.18 -0.09 1.88 -3.11 0.00 0.00 179.97 178.84 1ruu h TYR 20 N 0.21 0.14 -0.28 2.20 0.05 -1.01 -2.82 116.97 115.47 1ruu h TYR 20 Ca 0.06 -0.06 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 1ruu h TYR 20 Cb 0.06 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 1ruu h TYR 20 CO 0.00 0.71 0.14 -0.92 -1.05 0.00 0.00 178.16 177.04 1ruu h TYR 21 N -0.47 0.40 -0.88 4.88 5.03 -1.46 -1.70 116.97 122.78 1ruu h TYR 21 Ca -0.00 -0.02 0.07 0.00 2.58 0.00 0.00 58.73 61.36 1ruu h TYR 21 Cb 0.71 -0.13 -0.06 0.00 1.55 0.00 0.00 36.73 38.81 1ruu h TYR 21 CO 0.14 0.36 0.57 0.00 -1.32 0.00 0.00 178.16 177.91 1ruu h ALA 22 N 1.00 1.57 0.42 1.82 0.00 -0.64 0.50 119.26 123.92 1ruu h ALA 22 Ca 0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1ruu h ALA 22 Cb 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1ruu h ALA 22 CO -0.01 0.29 -0.20 1.03 0.00 0.00 0.00 179.25 180.36 1ruu h SER 23 N 0.96 -0.48 0.02 0.00 0.87 -1.21 -2.33 113.55 111.39 1ruu h SER 23 Ca 0.39 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.81 1ruu h SER 23 Cb 0.26 0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 1ruu h SER 23 CO -0.15 -0.15 -0.08 0.25 -0.53 0.00 0.00 176.83 176.17 1ruu h LEU 24 N -0.82 0.14 -1.99 2.23 6.46 -1.01 -0.81 115.31 119.51 1ruu h LEU 24 Ca -0.06 -0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.67 1ruu h LEU 24 Cb 0.55 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.44 1ruu h LEU 24 CO 0.09 0.25 -0.06 -0.09 -0.62 0.00 0.00 178.44 178.01 1ruu h ARG 25 N 0.15 0.00 0.72 1.25 2.43 0.06 -2.38 114.38 116.61 1ruu h ARG 25 Ca 0.03 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1ruu h ARG 25 Cb 0.25 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1ruu h ARG 25 CO 0.01 0.06 -0.35 1.25 -1.51 0.00 0.00 179.97 179.44 1ruu h HIS 26 N 0.00 -0.90 -0.34 2.20 2.76 -0.56 -0.64 115.15 117.66 1ruu h HIS 26 Ca -0.00 -0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.21 1ruu h HIS 26 Cb 0.12 0.30 -0.06 0.00 1.55 0.00 0.00 27.41 29.31 1ruu h HIS 26 CO 0.00 -0.56 -0.04 -0.92 -1.30 0.00 0.00 177.93 175.11 1ruu h TYR 27 N -1.13 -0.10 -0.05 5.26 3.20 -1.64 -0.62 116.97 121.90 1ruu h TYR 27 Ca -0.10 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.81 1ruu h TYR 27 Cb 0.74 0.10 -0.00 0.00 1.54 0.00 0.00 36.73 39.11 1ruu h TYR 27 CO 0.03 -0.11 0.11 1.25 -1.64 0.00 0.00 178.16 177.80 1ruu h LEU 28 N 0.04 0.00 0.08 2.82 5.85 -1.40 -0.25 115.31 122.46 1ruu h LEU 28 Ca 0.17 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 1ruu h LEU 28 Cb 0.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1ruu h LEU 28 CO -0.32 0.00 -0.04 -1.13 -0.34 0.00 0.00 178.44 176.61 1ruu h ASN 29 N 0.00 -0.09 0.87 1.25 -0.73 0.49 -2.40 115.58 114.96 1ruu h ASN 29 Ca 0.02 -0.52 0.00 0.00 1.87 0.00 0.00 56.30 57.68 1ruu h ASN 29 Cb 0.25 0.02 0.00 0.00 0.27 0.00 0.00 38.32 38.87 1ruu h ASN 29 CO -0.00 0.54 0.00 0.00 -0.37 0.00 0.00 177.43 177.60 1ruu n LEU 30 N -4.83 0.32 0.06 0.34 -0.00 -0.92 -1.22 117.00 110.74 1ruu n LEU 30 Ca -0.08 0.55 -0.13 0.00 -0.00 0.00 0.00 56.01 56.35 1ruu n LEU 30 Cb 0.30 -0.48 -0.14 0.00 -0.00 0.00 0.00 43.42 43.10 1ruu n LEU 30 CO 0.28 -0.25 -0.19 0.58 -0.00 0.00 0.00 177.39 177.81 1ruu h VAL 31 N 0.00 1.32 0.15 1.47 2.07 -1.10 -3.37 116.25 116.78 1ruu h VAL 31 Ca 0.00 -2.98 -0.34 0.00 0.82 0.00 0.00 66.70 64.20 1ruu h VAL 31 Cb 0.43 2.78 -0.00 0.00 -1.52 0.00 0.00 31.29 32.98 1ruu h VAL 31 CO 0.00 0.83 -1.73 0.71 0.02 0.00 0.00 177.57 177.40 1ruu h THR 32 N 0.05 0.93 -0.95 2.57 1.35 -1.26 -3.37 112.91 112.23 1ruu h THR 32 Ca -0.17 -2.57 0.29 0.00 -0.55 0.00 0.00 66.41 63.40 1ruu h THR 32 Cb 1.95 2.70 -0.15 0.00 -1.73 0.00 0.00 68.15 70.92 1ruu h THR 32 CO 0.15 0.83 0.39 -0.09 -0.25 0.00 0.00 175.52 176.56 1ruu h ARG 33 N 0.08 0.23 -0.89 4.72 2.43 -1.33 0.12 114.38 119.74 1ruu h ARG 33 Ca -0.33 -0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.01 1ruu h ARG 33 Cb 2.06 -0.05 -0.11 0.00 -0.42 0.00 0.00 29.97 31.45 1ruu h ARG 33 CO 0.15 0.15 0.45 0.37 -1.51 0.00 0.00 179.97 179.58 1ruu h GLN 34 N 0.24 0.55 -1.71 0.20 -0.00 -1.72 -2.78 115.11 109.88 1ruu h GLN 34 Ca 0.65 -0.03 -0.56 0.00 -0.00 0.00 0.00 58.65 58.71 1ruu h GLN 34 Cb 1.44 -0.12 -0.42 0.00 0.00 0.00 0.00 27.48 28.38 1ruu h GLN 34 CO -0.66 0.36 -0.77 0.54 0.00 0.00 0.00 178.83 178.31 1ruu n ARG 35 N -4.91 3.06 0.00 1.69 1.74 0.35 -5.19 116.66 113.39 1ruu n ARG 35 Ca 0.20 -4.44 0.10 0.00 -0.77 0.00 0.00 57.85 52.93 1ruu n ARG 35 Cb 0.53 -2.13 0.08 0.00 -1.02 0.00 0.00 32.46 29.92 1ruu n ARG 35 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09