#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5aiy n VAL 2 N 0.00 0.00 -3.48 -2.13 0.24 -1.26 -4.96 118.33 106.75 5aiy n VAL 2 Ca 0.00 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.27 5aiy n VAL 2 Cb 0.00 0.00 -0.00 0.00 -1.47 0.00 0.00 33.84 32.37 5aiy n VAL 2 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 5aiy n ASN 3 N -3.85 -0.39 -0.22 -1.34 4.05 -1.26 -5.01 115.26 107.24 5aiy n ASN 3 Ca 0.00 -1.40 0.18 0.00 0.45 0.00 0.00 54.58 53.81 5aiy n ASN 3 Cb 0.00 0.69 0.50 0.00 1.23 0.00 0.00 39.78 42.20 5aiy n ASN 3 CO 0.00 0.00 0.00 -0.61 -3.05 0.00 0.00 177.26 173.60 5aiy h GLN 4 N 0.00 0.41 -0.13 1.20 4.15 -1.97 0.14 115.11 118.92 5aiy h GLN 4 Ca -0.07 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.36 5aiy h GLN 4 Cb 0.27 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 5aiy h GLN 4 CO 0.09 0.27 0.39 1.25 -1.93 0.00 0.00 178.83 178.90 5aiy h HIS 5 N 0.43 0.00 0.00 3.99 2.76 -1.98 -1.52 115.15 118.82 5aiy h HIS 5 Ca 0.44 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.59 5aiy h HIS 5 Cb 1.05 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.01 5aiy h HIS 5 CO -0.00 0.00 -1.10 1.28 -1.30 0.00 0.00 177.93 176.81 5aiy n LEU 6 N -3.13 0.00 -0.09 0.26 4.77 0.32 -4.60 117.00 114.53 5aiy n LEU 6 Ca 0.01 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.88 5aiy n LEU 6 Cb 0.47 0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.55 5aiy n LEU 6 CO 0.17 0.03 0.75 0.00 -1.33 0.00 0.00 177.39 177.02 5aiy h GLY 8 N 0.26 0.15 1.43 0.00 0.00 -1.54 -1.58 103.07 101.79 5aiy h GLY 8 Ca 0.07 -0.07 0.05 0.00 0.00 0.00 0.00 47.33 47.39 5aiy h GLY 8 CO 0.02 0.06 0.24 1.48 0.00 0.00 0.00 176.54 178.34 5aiy h SER 9 N 0.15 0.00 0.00 0.19 4.64 -1.73 -1.37 113.55 115.43 5aiy h SER 9 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 5aiy h SER 9 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 5aiy h SER 9 CO -0.00 0.00 -1.69 1.41 -0.87 0.00 0.00 176.83 175.68 5aiy n HIS 10 N -3.61 0.00 0.04 4.77 8.25 -0.62 -4.21 115.22 119.85 5aiy n HIS 10 Ca 0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.42 5aiy n HIS 10 Cb 0.35 -0.36 0.15 0.00 1.12 0.00 0.00 29.99 31.25 5aiy n HIS 10 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 5aiy h LEU 11 N 0.00 0.42 -0.92 2.41 3.38 -0.99 -2.86 115.31 116.75 5aiy h LEU 11 Ca 0.00 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 5aiy h LEU 11 Cb 0.77 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 5aiy h LEU 11 CO 0.00 0.81 -0.06 -0.37 0.09 0.00 0.00 178.44 178.92 5aiy h VAL 12 N 0.32 1.24 -0.29 1.22 -1.51 -1.64 -1.71 116.25 113.88 5aiy h VAL 12 Ca 0.02 -1.06 0.06 0.00 -1.23 0.00 0.00 66.70 64.49 5aiy h VAL 12 Cb 0.92 0.98 -0.05 0.00 -2.13 0.00 0.00 31.29 31.00 5aiy h VAL 12 CO 0.08 0.36 -0.04 -0.33 -1.23 0.00 0.00 177.57 176.41 5aiy h GLU 13 N 0.68 0.03 0.00 5.19 5.08 -1.67 -0.83 114.58 123.06 5aiy h GLU 13 Ca 0.13 -0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.37 5aiy h GLU 13 Cb 0.50 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 5aiy h GLU 13 CO 0.03 0.02 -0.56 0.00 -1.00 0.00 0.00 179.01 177.49 5aiy h ALA 14 N 1.27 0.96 0.53 3.43 0.00 -1.57 -2.59 119.26 121.28 5aiy h ALA 14 Ca 0.14 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 5aiy h ALA 14 Cb 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 5aiy h ALA 14 CO -0.27 0.71 -0.29 -0.07 0.00 0.00 0.00 179.25 179.32 5aiy h LEU 15 N 0.00 -0.71 -0.28 0.00 3.38 -0.22 -1.15 115.31 116.33 5aiy h LEU 15 Ca -0.01 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 5aiy h LEU 15 Cb 1.07 0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.02 5aiy h LEU 15 CO 0.07 -0.46 0.00 0.00 0.09 0.00 0.00 178.44 178.14 5aiy n TYR 16 N -4.15 0.38 0.05 1.13 4.11 -0.75 -1.66 117.16 116.25 5aiy n TYR 16 Ca -0.09 0.14 -0.12 0.00 -0.00 0.00 0.00 57.90 57.83 5aiy n TYR 16 Cb 0.31 -0.73 -0.00 0.00 -0.00 0.00 0.00 39.34 38.91 5aiy n TYR 16 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.86 178.11 5aiy h LEU 17 N 0.00 0.55 -0.12 -3.48 6.46 -1.11 0.76 115.31 118.38 5aiy h LEU 17 Ca 0.00 -0.38 -0.23 0.00 -0.12 0.00 0.00 57.88 57.14 5aiy h LEU 17 Cb 0.34 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 40.11 5aiy h LEU 17 CO 0.00 1.14 -1.01 0.58 -0.62 0.00 0.00 178.44 178.54 5aiy h VAL 18 N 0.30 1.43 0.00 1.05 2.07 -0.48 -3.09 116.25 117.53 5aiy h VAL 18 Ca -0.05 -2.60 -0.04 0.00 0.82 0.00 0.00 66.70 64.84 5aiy h VAL 18 Cb 1.38 2.55 -0.01 0.00 -1.52 0.00 0.00 31.29 33.69 5aiy h VAL 18 CO 0.14 0.77 -0.17 0.00 0.02 0.00 0.00 177.57 178.33 5aiy n GLY 20 N 0.49 2.33 0.15 0.00 0.00 0.25 -2.41 105.19 106.01 5aiy n GLY 20 Ca 0.01 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 45.96 5aiy n GLY 20 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 5aiy h GLU 21 N 0.00 0.00 -6.91 1.61 5.08 -1.93 -3.45 114.58 108.99 5aiy h GLU 21 Ca 0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.99 5aiy h GLU 21 Cb 0.00 0.00 0.21 0.00 0.50 0.00 0.00 28.75 29.46 5aiy h GLU 21 CO 0.00 0.17 -0.17 0.54 -1.00 0.00 0.00 179.01 178.55 5aiy n ARG 22 N -3.00 -4.23 -3.73 2.33 1.74 -1.01 -5.05 116.66 103.72 5aiy n ARG 22 Ca 0.00 -1.25 -0.20 0.00 -0.77 0.00 0.00 57.85 55.64 5aiy n ARG 22 Cb 0.63 -1.94 -0.05 0.00 -1.02 0.00 0.00 32.46 30.09 5aiy n ARG 22 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 5aiy n GLY 23 N 1.77 3.63 3.55 -0.13 0.00 -1.26 -4.91 105.19 107.83 5aiy n GLY 23 Ca 0.11 -2.18 -0.10 0.00 0.00 0.00 0.00 46.02 43.85 5aiy n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 5aiy s PHE 24 N -2.44 -0.34 -0.21 1.61 -0.71 -1.26 -5.03 117.98 109.60 5aiy s PHE 24 Ca 0.08 0.03 -0.05 0.00 -1.04 0.00 0.00 56.93 55.95 5aiy s PHE 24 Cb 0.00 0.54 -0.02 0.00 -1.21 0.00 0.00 43.02 42.34 5aiy s PHE 24 CO 0.05 -0.96 -0.00 -0.59 -1.34 0.00 0.00 175.22 172.38 5aiy s PHE 25 N -3.82 3.02 -0.28 3.49 -0.12 -1.26 -5.08 117.98 113.93 5aiy s PHE 25 Ca 0.06 -0.60 -0.06 0.00 -0.05 0.00 0.00 56.93 56.28 5aiy s PHE 25 Cb -0.02 -2.11 0.01 0.00 -0.63 0.00 0.00 43.02 40.27 5aiy s PHE 25 CO -0.06 -0.35 0.06 -0.47 -0.05 0.00 0.00 175.22 174.35 5aiy s TYR 26 N 1.22 3.12 -0.35 3.49 5.04 -1.26 -5.05 117.35 123.56 5aiy s TYR 26 Ca 0.03 -0.98 0.02 0.00 -2.44 0.00 0.00 57.07 53.70 5aiy s TYR 26 Cb -0.15 -2.22 0.10 0.00 0.35 0.00 0.00 41.96 40.05 5aiy s TYR 26 CO 0.01 -0.57 0.10 0.95 -1.34 0.00 0.00 175.55 174.69 5aiy s THR 27 N 1.49 1.70 -1.48 4.34 -4.23 -1.26 -5.00 115.64 111.20 5aiy s THR 27 Ca 0.03 -2.07 -0.09 0.00 -1.18 0.00 0.00 61.69 58.38 5aiy s THR 27 Cb -0.17 -2.25 -0.09 0.00 1.34 0.00 0.00 72.50 71.33 5aiy s THR 27 CO 0.01 -0.67 2.90 -0.81 -0.54 0.00 0.00 174.62 175.52 5aiy n PRO 28 N 4.35 3.45 -2.76 3.99 -0.04 -1.26 -4.47 135.00 138.26 5aiy n PRO 28 Ca 0.02 -2.06 -0.06 0.00 -0.04 0.00 0.00 63.50 61.36 5aiy n PRO 28 Cb 0.41 -2.72 0.03 0.00 -0.04 0.00 0.00 33.50 31.17 5aiy n PRO 28 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 5aiy n LYS 29 N 3.60 0.65 0.00 0.54 4.81 -1.26 -5.09 118.16 121.40 5aiy n LYS 29 Ca 0.73 -1.90 0.03 0.00 -0.87 0.00 0.00 58.31 56.31 5aiy n LYS 29 Cb 0.25 -1.46 0.16 0.00 0.02 0.00 0.00 35.03 34.00 5aiy n LYS 29 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98