#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 4.39 -0.68 -0.72 0.04 -1.26 -4.97 135.00 131.81 1ruu s PRO 2 Ca 0.00 1.87 -0.26 0.00 0.04 0.00 0.00 61.00 62.65 1ruu s PRO 2 Cb 0.00 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.18 1ruu s PRO 2 CO 0.00 -0.33 1.95 0.00 0.04 0.00 0.00 177.00 178.66 1ruu s ALA 3 N 1.13 1.94 0.14 8.56 0.00 -1.26 -4.93 121.76 127.35 1ruu s ALA 3 Ca 0.61 -0.81 -0.18 0.00 0.00 0.00 0.00 51.96 51.58 1ruu s ALA 3 Cb -0.32 -4.38 0.04 0.00 0.00 0.00 0.00 23.12 18.46 1ruu s ALA 3 CO 0.29 -4.25 0.46 -1.59 0.00 0.00 0.00 175.76 170.68 1ruu s LYS 4 N 7.21 1.17 0.10 0.00 -2.85 -1.26 -5.15 119.74 118.95 1ruu s LYS 4 Ca 0.71 -0.68 -0.30 0.00 -1.00 0.00 0.00 55.97 54.70 1ruu s LYS 4 Cb -0.12 0.50 -0.06 0.00 -2.06 0.00 0.00 37.83 36.10 1ruu s LYS 4 CO 0.15 -0.48 1.18 -1.25 0.10 0.00 0.00 175.35 175.05 1ruu s PRO 5 N -3.80 4.47 -0.02 1.78 0.04 -1.26 -5.02 135.00 131.18 1ruu s PRO 5 Ca 0.04 1.77 -0.29 0.00 0.04 0.00 0.00 61.00 62.56 1ruu s PRO 5 Cb 0.01 -3.32 0.10 0.00 0.04 0.00 0.00 34.50 31.33 1ruu s PRO 5 CO -0.11 -0.17 0.85 -1.21 0.04 0.00 0.00 177.00 176.41 1ruu s GLU 6 N 0.61 0.85 0.57 4.56 2.02 -1.26 -5.16 118.70 120.89 1ruu s GLU 6 Ca 0.56 -0.17 0.00 0.00 0.02 0.00 0.00 54.97 55.38 1ruu s GLU 6 Cb -0.30 0.40 0.00 0.00 0.10 0.00 0.00 34.13 34.33 1ruu s GLU 6 CO 0.31 -0.34 0.00 0.00 0.02 0.00 0.00 175.26 175.25 1ruu n ALA 7 N 0.06 -3.79 -1.17 5.21 0.00 -1.26 -4.96 120.51 114.61 1ruu n ALA 7 Ca -0.11 0.85 -0.14 0.00 0.00 0.00 0.00 53.44 54.03 1ruu n ALA 7 Cb 0.61 -1.53 0.17 0.00 0.00 0.00 0.00 19.45 18.70 1ruu n ALA 7 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ruu n PRO 8 N -4.33 -2.18 -0.68 0.00 -0.04 -1.26 -5.04 135.00 121.46 1ruu n PRO 8 Ca -0.07 -1.27 -0.31 0.00 -0.04 0.00 0.00 63.50 61.80 1ruu n PRO 8 Cb 0.68 -1.11 0.17 0.00 -0.04 0.00 0.00 33.50 33.20 1ruu n PRO 8 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ruu n GLY 9 N -2.29 -1.57 3.60 0.55 0.00 -1.26 -5.07 105.19 99.16 1ruu n GLY 9 Ca 0.11 -0.81 -0.07 0.00 0.00 0.00 0.00 46.02 45.25 1ruu n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ruu s GLU 10 N -4.05 0.66 -0.89 1.61 2.56 -1.26 -5.10 118.70 112.23 1ruu s GLU 10 Ca 0.62 1.22 -0.18 0.00 0.00 0.00 0.00 54.97 56.63 1ruu s GLU 10 Cb -0.21 0.23 0.14 0.00 2.00 0.00 0.00 34.13 36.29 1ruu s GLU 10 CO 0.64 -0.16 1.03 -0.51 -0.56 0.00 0.00 175.26 175.70 1ruu s ASP 11 N 1.81 6.62 0.50 -1.70 1.01 -1.26 -5.02 116.67 118.62 1ruu s ASP 11 Ca -0.09 -2.10 0.03 0.00 0.71 0.00 0.00 52.55 51.10 1ruu s ASP 11 Cb -0.06 -2.36 0.03 0.00 1.01 0.00 0.00 42.92 41.54 1ruu s ASP 11 CO -0.19 -0.99 0.24 0.00 0.21 0.00 0.00 175.17 174.44 1ruu n ALA 12 N 6.10 0.65 -1.57 5.23 0.00 -1.26 -5.12 120.51 124.54 1ruu n ALA 12 Ca 0.20 -2.10 -0.42 0.00 0.00 0.00 0.00 53.44 51.11 1ruu n ALA 12 Cb 0.48 0.98 0.01 0.00 0.00 0.00 0.00 19.45 20.92 1ruu n ALA 12 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ruu n SER 13 N -1.63 0.78 -3.77 0.00 2.88 -1.26 -4.82 113.62 105.79 1ruu n SER 13 Ca -0.09 1.03 -0.42 0.00 -1.33 0.00 0.00 58.87 58.07 1ruu n SER 13 Cb 0.59 -1.29 -0.04 0.00 -0.75 0.00 0.00 64.21 62.72 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 0.32 1.84 -0.14 -1.46 -0.04 -1.26 -4.43 135.00 129.83 1ruu n PRO 14 Ca 0.10 -2.11 0.07 0.00 -0.04 0.00 0.00 63.50 61.52 1ruu n PRO 14 Cb 0.38 -3.09 0.09 0.00 -0.04 0.00 0.00 33.50 30.84 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 7.00 1.22 0.18 0.54 1.02 -1.26 -4.55 120.64 124.80 1ruu n GLU 15 Ca 0.50 -2.08 0.00 0.00 -0.02 0.00 0.00 57.16 55.56 1ruu n GLU 15 Cb 0.41 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.61 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 -1.00 0.00 0.14 3.49 1.02 -1.26 -4.90 120.64 118.13 1ruu n GLU 16 Ca 0.10 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.14 1ruu n GLU 16 Cb 0.60 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.96 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 -0.82 -1.82 -4.62 5.85 -1.89 -1.74 115.31 110.27 1ruu h LEU 17 Ca 0.00 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1ruu h LEU 17 Cb 0.00 0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 1ruu h LEU 17 CO 0.00 -0.37 -0.06 0.28 -0.34 0.00 0.00 178.44 177.95 1ruu h SER 18 N -0.54 0.00 0.02 1.25 0.02 -1.92 -2.42 113.55 109.95 1ruu h SER 18 Ca -0.03 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1ruu h SER 18 Cb 0.49 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 1ruu h SER 18 CO -0.06 0.06 -0.02 -0.09 -1.14 0.00 0.00 176.83 175.58 1ruu h ARG 19 N 0.00 0.00 0.10 3.45 1.12 -1.57 0.27 114.38 117.74 1ruu h ARG 19 Ca -0.00 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.86 1ruu h ARG 19 Cb 0.40 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.36 1ruu h ARG 19 CO 0.01 0.02 -0.05 1.88 -3.11 0.00 0.00 179.97 178.72 1ruu h TYR 20 N 0.00 -0.12 -0.51 2.20 0.05 -0.93 -3.05 116.97 114.61 1ruu h TYR 20 Ca -0.00 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 1ruu h TYR 20 Cb 0.03 0.04 -0.02 0.00 1.01 0.00 0.00 36.73 37.79 1ruu h TYR 20 CO 0.00 0.36 0.27 -0.92 -1.05 0.00 0.00 178.16 176.82 1ruu h TYR 21 N -0.70 0.71 0.00 4.88 3.20 -1.42 0.56 116.97 124.20 1ruu h TYR 21 Ca -0.01 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.82 1ruu h TYR 21 Cb 0.54 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 1ruu h TYR 21 CO 0.10 0.53 -0.08 0.00 -1.64 0.00 0.00 178.16 177.07 1ruu h ALA 22 N 1.11 1.68 0.04 1.82 0.00 -0.63 0.31 119.26 123.59 1ruu h ALA 22 Ca 0.18 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1ruu h ALA 22 Cb 0.06 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.85 1ruu h ALA 22 CO -0.03 0.10 -0.38 1.03 0.00 0.00 0.00 179.25 179.97 1ruu h SER 23 N 0.00 0.27 -0.00 0.00 0.87 -1.27 -3.33 113.55 110.08 1ruu h SER 23 Ca -0.00 -0.88 -0.05 0.00 -1.23 0.00 0.00 61.79 59.63 1ruu h SER 23 Cb 0.16 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 1ruu h SER 23 CO 0.01 1.12 -0.11 0.25 -0.53 0.00 0.00 176.83 177.57 1ruu h LEU 24 N -0.55 0.24 -2.00 2.23 7.12 -0.54 -1.16 115.31 120.66 1ruu h LEU 24 Ca -0.06 -0.05 0.16 0.00 0.13 0.00 0.00 57.88 58.07 1ruu h LEU 24 Cb 1.21 -0.06 -0.02 0.00 -0.53 0.00 0.00 40.66 41.25 1ruu h LEU 24 CO 0.07 0.39 0.47 -0.09 -0.13 0.00 0.00 178.44 179.15 1ruu h ARG 25 N 0.25 0.00 0.42 1.25 2.43 -0.50 -1.80 114.38 116.43 1ruu h ARG 25 Ca 0.05 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1ruu h ARG 25 Cb 0.36 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1ruu h ARG 25 CO 0.02 0.00 -0.20 1.25 -1.51 0.00 0.00 179.97 179.53 1ruu h HIS 26 N 0.00 -0.53 -0.39 2.20 2.76 -1.31 -1.96 115.15 115.92 1ruu h HIS 26 Ca 0.27 -0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.49 1ruu h HIS 26 Cb 1.20 0.17 -0.06 0.00 1.55 0.00 0.00 27.41 30.28 1ruu h HIS 26 CO 0.00 -0.33 0.04 -0.92 -1.30 0.00 0.00 177.93 175.42 1ruu h TYR 27 N -0.85 0.05 -0.08 5.26 3.20 -1.64 -0.33 116.97 122.59 1ruu h TYR 27 Ca -0.06 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.86 1ruu h TYR 27 Cb 0.44 0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.74 1ruu h TYR 27 CO 0.04 -0.03 0.12 1.25 -1.64 0.00 0.00 178.16 177.90 1ruu h LEU 28 N 0.15 0.00 0.03 2.82 5.85 -1.41 -0.64 115.31 122.12 1ruu h LEU 28 Ca 0.19 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 1ruu h LEU 28 Cb 0.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1ruu h LEU 28 CO -0.28 0.00 -0.02 -1.13 -0.34 0.00 0.00 178.44 176.67 1ruu h ASN 29 N 0.00 -0.04 0.59 1.25 -1.24 -0.25 -1.48 115.58 114.41 1ruu h ASN 29 Ca 0.04 -0.63 0.00 0.00 0.71 0.00 0.00 56.30 56.42 1ruu h ASN 29 Cb 0.28 0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.34 1ruu h ASN 29 CO -0.00 0.65 0.00 0.00 -1.29 0.00 0.00 177.43 176.79 1ruu n LEU 30 N -4.78 0.00 0.02 0.34 -0.00 -0.92 -2.73 117.00 108.93 1ruu n LEU 30 Ca -0.09 0.41 -0.20 0.00 -0.00 0.00 0.00 56.01 56.13 1ruu n LEU 30 Cb 0.33 -0.41 -0.14 0.00 -0.00 0.00 0.00 43.42 43.20 1ruu n LEU 30 CO 0.31 -0.11 -0.71 0.58 -0.00 0.00 0.00 177.39 177.45 1ruu h VAL 31 N 0.00 0.72 -0.22 1.47 2.07 -1.15 -3.40 116.25 115.73 1ruu h VAL 31 Ca 0.00 -2.42 -0.14 0.00 0.82 0.00 0.00 66.70 64.96 1ruu h VAL 31 Cb 0.29 2.56 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 1ruu h VAL 31 CO 0.00 0.86 -0.44 0.71 0.02 0.00 0.00 177.57 178.72 1ruu h THR 32 N 0.07 1.31 -0.41 2.57 1.35 -1.10 -2.94 112.91 113.76 1ruu h THR 32 Ca -0.39 -1.63 0.12 0.00 -0.55 0.00 0.00 66.41 63.96 1ruu h THR 32 Cb 2.04 1.61 -0.02 0.00 -1.73 0.00 0.00 68.15 70.06 1ruu h THR 32 CO 0.11 0.51 0.57 0.08 -0.25 0.00 0.00 175.52 176.54 1ruu h ARG 33 N 0.45 0.00 -0.24 4.72 0.11 -1.72 0.20 114.38 117.89 1ruu h ARG 33 Ca 0.03 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.93 1ruu h ARG 33 Cb 0.95 0.00 -0.14 0.00 1.11 0.00 0.00 29.97 31.89 1ruu h ARG 33 CO 0.08 0.00 -0.60 1.04 0.10 0.00 0.00 179.97 180.59 1ruu n GLN 34 N -3.42 2.24 0.08 0.08 1.13 -1.11 -4.75 117.38 111.63 1ruu n GLN 34 Ca 0.08 -3.58 0.00 0.00 -1.94 0.00 0.00 57.00 51.55 1ruu n GLN 34 Cb 0.73 -1.83 0.00 0.00 0.11 0.00 0.00 30.24 29.25 1ruu n GLN 34 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 1ruu n ARG 35 N -0.99 0.00 0.00 -1.09 0.63 0.05 -5.07 116.66 110.20 1ruu n ARG 35 Ca 0.27 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 57.35 1ruu n ARG 35 Cb 0.78 0.00 0.74 0.00 0.45 0.00 0.00 32.46 34.44 1ruu n ARG 35 CO 0.00 0.00 0.00 0.98 -2.51 0.00 0.00 177.63 176.10