#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4aiy h VAL 2 N 0.00 1.32 -0.79 -2.13 -1.51 -2.05 -3.29 116.25 107.79 4aiy h VAL 2 Ca 0.00 -2.70 0.14 0.00 -1.23 0.00 0.00 66.70 62.91 4aiy h VAL 2 Cb 0.00 2.55 -0.09 0.00 -2.13 0.00 0.00 31.29 31.61 4aiy h VAL 2 CO 0.00 0.72 0.36 -1.13 -1.23 0.00 0.00 177.57 176.29 4aiy h ASN 3 N 0.00 0.40 0.67 4.19 -0.73 -2.04 -1.36 115.58 116.72 4aiy h ASN 3 Ca -0.01 0.10 -0.03 0.00 1.87 0.00 0.00 56.30 58.23 4aiy h ASN 3 Cb 1.49 0.04 -0.01 0.00 0.27 0.00 0.00 38.32 40.11 4aiy h ASN 3 CO 0.09 0.17 -0.44 -0.61 -0.37 0.00 0.00 177.43 176.27 4aiy h GLN 4 N 0.53 -1.02 0.00 6.67 4.15 -1.98 0.94 115.11 124.40 4aiy h GLN 4 Ca 0.43 0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.92 4aiy h GLN 4 Cb 0.61 0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.54 4aiy h GLN 4 CO -0.37 -0.68 0.00 1.58 -1.93 0.00 0.00 178.83 177.43 4aiy n HIS 5 N -5.57 0.43 -0.10 3.99 -0.00 -0.99 -1.22 115.22 111.76 4aiy n HIS 5 Ca -0.13 0.20 -0.18 0.00 0.46 0.00 0.00 57.72 58.07 4aiy n HIS 5 Cb 0.46 -0.83 -0.06 0.00 -0.12 0.00 0.00 29.99 29.44 4aiy n HIS 5 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 4aiy n LEU 6 N -1.93 1.74 -0.01 0.27 4.77 -0.55 -4.40 117.00 116.90 4aiy n LEU 6 Ca 0.00 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 4aiy n LEU 6 Cb 0.08 -0.70 0.31 0.00 -2.33 0.00 0.00 43.42 40.78 4aiy n LEU 6 CO 0.09 0.16 0.98 0.00 -1.33 0.00 0.00 177.39 177.29 4aiy h GLY 8 N 0.80 0.00 2.00 0.00 0.00 -1.30 0.33 103.07 104.90 4aiy h GLY 8 Ca 0.12 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.39 4aiy h GLY 8 CO 0.00 0.00 -0.32 0.23 0.00 0.00 0.00 176.54 176.45 4aiy h SER 9 N 0.00 0.00 0.74 0.19 0.87 -1.46 -2.75 113.55 111.14 4aiy h SER 9 Ca 0.17 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.55 4aiy h SER 9 Cb 0.89 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.82 4aiy h SER 9 CO -0.00 0.32 -1.38 0.45 -0.53 0.00 0.00 176.83 175.69 4aiy h HIS 10 N 0.00 0.00 -0.74 2.24 3.86 -0.49 -3.31 115.15 116.72 4aiy h HIS 10 Ca -0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 4aiy h HIS 10 Cb 0.57 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.01 4aiy h HIS 10 CO 0.00 0.65 0.42 -0.07 0.86 0.00 0.00 177.93 179.79 4aiy h LEU 11 N 0.00 0.91 -1.05 2.43 3.38 -1.09 -1.97 115.31 117.92 4aiy h LEU 11 Ca -0.17 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 4aiy h LEU 11 Cb 1.64 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 42.14 4aiy h LEU 11 CO 0.05 0.73 0.04 -0.37 0.09 0.00 0.00 178.44 178.98 4aiy h VAL 12 N 1.01 1.22 -0.75 1.22 -1.51 -1.64 -0.11 116.25 115.69 4aiy h VAL 12 Ca 0.26 -0.87 0.05 0.00 -1.23 0.00 0.00 66.70 64.90 4aiy h VAL 12 Cb 0.01 0.83 -0.05 0.00 -2.13 0.00 0.00 31.29 29.94 4aiy h VAL 12 CO -0.05 0.31 0.46 -0.33 -1.23 0.00 0.00 177.57 176.74 4aiy h GLU 13 N 0.69 0.85 -0.05 5.19 5.08 -1.45 -1.54 114.58 123.35 4aiy h GLU 13 Ca 0.14 -0.05 -0.22 0.00 -1.00 0.00 0.00 59.36 58.23 4aiy h GLU 13 Cb 0.36 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.42 4aiy h GLU 13 CO 0.01 0.56 -0.88 0.00 -1.00 0.00 0.00 179.01 177.70 4aiy h ALA 14 N 1.35 0.36 0.27 3.43 0.00 -1.18 -2.80 119.26 120.68 4aiy h ALA 14 Ca 0.32 -0.66 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 4aiy h ALA 14 Cb 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 4aiy h ALA 14 CO -0.14 0.75 -0.20 -0.07 0.00 0.00 0.00 179.25 179.58 4aiy h LEU 15 N 0.34 -0.54 -0.11 0.00 3.38 -0.22 0.22 115.31 118.39 4aiy h LEU 15 Ca -0.07 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 4aiy h LEU 15 Cb 1.50 0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.42 4aiy h LEU 15 CO 0.16 -0.29 0.00 0.00 0.09 0.00 0.00 178.44 178.40 4aiy n TYR 16 N -3.56 0.08 0.04 1.13 4.11 -0.66 -0.43 117.16 117.89 4aiy n TYR 16 Ca -0.05 0.04 -0.21 0.00 -0.00 0.00 0.00 57.90 57.68 4aiy n TYR 16 Cb 0.20 -0.56 -0.14 0.00 -0.00 0.00 0.00 39.34 38.83 4aiy n TYR 16 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.86 178.11 4aiy h LEU 17 N 0.00 0.46 -0.34 -3.48 5.85 -1.08 -0.73 115.31 115.99 4aiy h LEU 17 Ca 0.00 -0.92 -0.12 0.00 0.84 0.00 0.00 57.88 57.68 4aiy h LEU 17 Cb 0.15 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 4aiy h LEU 17 CO 0.00 1.47 -0.26 0.58 -0.34 0.00 0.00 178.44 179.89 4aiy h VAL 18 N -0.33 1.29 0.00 1.05 2.07 0.27 -2.64 116.25 117.96 4aiy h VAL 18 Ca -0.19 -1.42 -0.05 0.00 0.82 0.00 0.00 66.70 65.86 4aiy h VAL 18 Cb 1.70 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 32.91 4aiy h VAL 18 CO 0.13 0.46 -0.24 0.00 0.02 0.00 0.00 177.57 177.95 4aiy n GLY 20 N -0.17 1.16 0.07 0.00 0.00 -0.28 -1.89 105.19 104.07 4aiy n GLY 20 Ca -0.01 0.29 0.03 0.00 0.00 0.00 0.00 46.02 46.33 4aiy n GLY 20 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 4aiy n GLU 21 N 0.00 0.65 -0.80 1.61 1.02 -1.26 -4.78 120.64 117.08 4aiy n GLU 21 Ca 0.00 -0.01 -0.32 0.00 -0.02 0.00 0.00 57.16 56.81 4aiy n GLU 21 Cb 0.00 -1.62 0.16 0.00 -0.02 0.00 0.00 31.44 29.95 4aiy n GLU 21 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 4aiy s ARG 22 N -3.09 1.18 0.55 3.49 0.52 -0.79 -5.02 118.95 115.79 4aiy s ARG 22 Ca -0.06 1.59 0.07 0.00 -0.52 0.00 0.00 55.73 56.80 4aiy s ARG 22 Cb 0.10 -1.74 0.10 0.00 0.52 0.00 0.00 34.95 33.93 4aiy s ARG 22 CO 0.85 -2.52 0.76 0.41 0.02 0.00 0.00 175.30 174.82 4aiy n GLY 23 N 0.23 1.67 3.43 -3.53 0.00 -1.26 -4.82 105.19 100.91 4aiy n GLY 23 Ca 0.12 -2.17 -0.15 0.00 0.00 0.00 0.00 46.02 43.82 4aiy n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 4aiy s PHE 24 N -2.35 -0.53 -0.28 1.61 -0.71 -1.26 -5.01 117.98 109.44 4aiy s PHE 24 Ca 0.56 1.09 -0.14 0.00 -1.04 0.00 0.00 56.93 57.41 4aiy s PHE 24 Cb -0.04 0.25 -0.04 0.00 -1.21 0.00 0.00 43.02 41.98 4aiy s PHE 24 CO 0.36 -0.43 0.31 -0.59 -1.34 0.00 0.00 175.22 173.53 4aiy s PHE 25 N -0.59 3.23 -0.31 3.49 -0.12 -1.26 -5.04 117.98 117.38 4aiy s PHE 25 Ca -0.07 0.27 -0.07 0.00 -0.05 0.00 0.00 56.93 57.01 4aiy s PHE 25 Cb -0.03 -2.52 0.01 0.00 -0.63 0.00 0.00 43.02 39.86 4aiy s PHE 25 CO 0.05 -0.23 0.10 -0.47 -0.05 0.00 0.00 175.22 174.62 4aiy s TYR 26 N 1.96 3.17 -0.32 3.49 5.04 -1.26 -5.05 117.35 124.38 4aiy s TYR 26 Ca 0.12 -1.02 0.02 0.00 -2.44 0.00 0.00 57.07 53.76 4aiy s TYR 26 Cb -0.16 -2.28 0.10 0.00 0.35 0.00 0.00 41.96 39.97 4aiy s TYR 26 CO 0.10 -0.60 0.06 0.99 -1.34 0.00 0.00 175.55 174.77 4aiy s THR 27 N 1.50 1.73 -0.48 4.34 2.01 -1.26 -4.96 115.64 118.52 4aiy s THR 27 Ca 0.02 -1.94 0.26 0.00 0.31 0.00 0.00 61.69 60.34 4aiy s THR 27 Cb -0.18 -2.27 0.31 0.00 0.01 0.00 0.00 72.50 70.37 4aiy s THR 27 CO 0.03 -0.60 1.75 1.55 -0.69 0.00 0.00 174.62 176.66 4aiy h PRO 28 N 7.80 0.00 -4.95 4.92 0.13 -2.01 -3.38 132.00 134.50 4aiy h PRO 28 Ca -0.08 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.54 4aiy h PRO 28 Cb 1.02 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.16 4aiy h PRO 28 CO 0.50 0.00 1.74 1.17 -0.23 0.00 0.00 178.00 181.18 4aiy n LYS 29 N -2.63 1.57 0.00 0.86 0.00 -1.26 -5.13 118.16 111.57 4aiy n LYS 29 Ca 0.04 -2.15 0.09 0.00 0.00 0.00 0.00 58.31 56.29 4aiy n LYS 29 Cb 0.41 -3.29 0.52 0.00 0.00 0.00 0.00 35.03 32.67 4aiy n LYS 29 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81