#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rik n LYS 2 N 0.00 0.69 -2.51 -0.72 4.76 -1.11 -4.82 118.16 114.46 1rik n LYS 2 Ca 0.00 0.19 -0.24 0.00 -2.87 0.00 0.00 58.31 55.40 1rik n LYS 2 Cb 0.00 -1.63 0.04 0.00 -1.84 0.00 0.00 35.03 31.61 1rik n LYS 2 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1rik s PHE 3 N -2.54 2.98 -0.07 2.13 0.40 -1.15 -4.98 117.98 114.75 1rik s PHE 3 Ca -0.23 0.26 -0.22 0.00 -0.60 0.00 0.00 56.93 56.13 1rik s PHE 3 Cb 0.08 -2.83 0.05 0.00 0.51 0.00 0.00 43.02 40.82 1rik s PHE 3 CO 0.72 -0.97 0.51 0.00 0.70 0.00 0.00 175.22 176.18 1rik s ALA 4 N -2.92 -1.30 0.21 5.36 0.00 -1.26 -3.51 121.76 118.35 1rik s ALA 4 Ca 0.57 0.99 -0.29 0.00 0.00 0.00 0.00 51.96 53.23 1rik s ALA 4 Cb -0.10 -0.18 -0.08 0.00 0.00 0.00 0.00 23.12 22.75 1rik s ALA 4 CO 0.41 -0.30 0.91 0.00 0.00 0.00 0.00 175.76 176.78 1rik h PRO 6 N 4.32 0.00 0.00 0.00 0.13 -2.02 -3.32 132.00 131.11 1rik h PRO 6 Ca -0.45 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.27 1rik h PRO 6 Cb 1.20 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.27 1rik h PRO 6 CO 0.68 0.00 -2.41 0.39 -0.23 0.00 0.00 178.00 176.43 1rik n GLU 7 N -2.67 0.55 -4.15 0.86 4.71 -1.26 -5.04 120.64 113.64 1rik n GLU 7 Ca 0.03 0.21 -0.25 0.00 -0.01 0.00 0.00 57.16 57.14 1rik n GLU 7 Cb 0.34 -1.43 -0.07 0.00 -1.01 0.00 0.00 31.44 29.27 1rik n GLU 7 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1rik n PRO 9 N -1.21 1.91 -2.61 0.00 -0.04 -1.26 -3.68 135.00 128.10 1rik n PRO 9 Ca -0.01 -1.77 -0.30 0.00 -0.04 0.00 0.00 63.50 61.38 1rik n PRO 9 Cb 0.64 -1.69 -0.02 0.00 -0.04 0.00 0.00 33.50 32.39 1rik n PRO 9 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1rik s LYS 10 N -2.06 3.71 -0.07 0.54 -0.14 -1.26 -4.93 119.74 115.52 1rik s LYS 10 Ca 0.35 0.49 -0.04 0.00 -1.36 0.00 0.00 55.97 55.40 1rik s LYS 10 Cb 0.27 -2.32 0.03 0.00 -1.68 0.00 0.00 37.83 34.14 1rik s LYS 10 CO -0.00 -0.18 0.18 -0.98 -0.76 0.00 0.00 175.35 173.61 1rik s ARG 11 N -4.29 0.15 0.05 1.68 1.70 -1.26 -2.78 118.95 114.21 1rik s ARG 11 Ca 0.51 0.36 0.01 0.00 -0.47 0.00 0.00 55.73 56.15 1rik s ARG 11 Cb -0.10 -0.07 -0.03 0.00 -0.57 0.00 0.00 34.95 34.17 1rik s ARG 11 CO 0.38 -0.12 -0.06 -0.06 -1.08 0.00 0.00 175.30 174.36 1rik s PHE 12 N 0.83 0.65 -0.07 5.89 0.40 -1.23 -4.84 117.98 119.62 1rik s PHE 12 Ca -0.06 -0.66 0.13 0.00 -0.60 0.00 0.00 56.93 55.73 1rik s PHE 12 Cb -0.08 -0.40 -0.01 0.00 0.51 0.00 0.00 43.02 43.05 1rik s PHE 12 CO -0.05 -0.14 1.40 0.52 0.70 0.00 0.00 175.22 177.65 1rik h MET 13 N 4.00 0.00 -6.18 0.44 2.86 -1.92 -2.91 114.93 111.22 1rik h MET 13 Ca -0.35 0.00 -0.47 0.00 -2.06 0.00 0.00 59.70 56.82 1rik h MET 13 Cb 1.19 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.84 1rik h MET 13 CO 0.49 0.65 -0.43 1.03 1.06 0.00 0.00 176.91 179.72 1rik s ARG 14 N -2.90 3.44 -0.21 1.72 3.00 -1.26 -4.80 118.95 117.95 1rik s ARG 14 Ca 0.03 -0.72 -0.11 0.00 0.00 0.00 0.00 55.73 54.94 1rik s ARG 14 Cb 0.08 -2.89 -0.19 0.00 0.00 0.00 0.00 34.95 31.95 1rik s ARG 14 CO 0.77 0.43 0.04 0.45 0.00 0.00 0.00 175.30 176.99 1rik n SER 15 N -1.29 1.99 -0.00 0.23 2.88 -1.26 -3.57 113.62 112.59 1rik n SER 15 Ca -0.09 0.22 -0.13 0.00 -1.33 0.00 0.00 58.87 57.55 1rik n SER 15 Cb 0.56 -0.79 -0.10 0.00 -0.75 0.00 0.00 64.21 63.14 1rik n SER 15 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 1rik h ASP 16 N -0.47 -0.01 -0.78 -3.46 1.82 -1.99 -2.18 116.42 109.35 1rik h ASP 16 Ca -0.50 -0.45 0.02 0.00 -0.39 0.00 0.00 57.03 55.71 1rik h ASP 16 Cb 1.72 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 41.69 1rik h ASP 16 CO -0.14 0.44 0.51 0.45 -1.61 0.00 0.00 179.24 178.89 1rik h HIS 17 N -0.48 0.96 -0.41 0.28 3.86 -2.00 -1.60 115.15 115.76 1rik h HIS 17 Ca -0.00 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.25 1rik h HIS 17 Cb 0.46 -0.32 -0.03 0.00 1.06 0.00 0.00 27.41 28.58 1rik h HIS 17 CO 0.08 0.59 0.23 1.25 0.86 0.00 0.00 177.93 180.94 1rik h LEU 18 N 1.02 0.36 -1.60 2.43 6.46 -1.61 -1.41 115.31 120.96 1rik h LEU 18 Ca 0.29 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 58.06 1rik h LEU 18 Cb -0.08 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 39.77 1rik h LEU 18 CO -0.08 0.26 0.18 0.74 -0.62 0.00 0.00 178.44 178.92 1rik h THR 19 N 0.47 1.10 -0.75 1.05 2.02 -0.85 -0.95 112.91 115.00 1rik h THR 19 Ca 0.17 -0.26 0.06 0.00 0.77 0.00 0.00 66.41 67.15 1rik h THR 19 Cb 0.03 0.66 -0.05 0.00 -1.74 0.00 0.00 68.15 67.06 1rik h THR 19 CO -0.09 0.11 0.49 0.25 0.37 0.00 0.00 175.52 176.65 1rik h LEU 20 N 0.45 0.72 0.01 2.58 5.85 -0.30 -2.23 115.31 122.40 1rik h LEU 20 Ca 0.12 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1rik h LEU 20 Cb 0.01 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1rik h LEU 20 CO -0.02 0.47 -0.01 1.12 -0.34 0.00 0.00 178.44 179.66 1rik h HIS 21 N 0.82 -0.02 0.00 1.25 2.07 -0.94 -2.91 115.15 115.42 1rik h HIS 21 Ca 0.32 -0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.84 1rik h HIS 21 Cb 0.21 0.01 0.00 0.00 2.57 0.00 0.00 27.41 30.19 1rik h HIS 21 CO -0.00 0.19 0.20 0.82 -3.07 0.00 0.00 177.93 176.06 1rik h ILE 22 N -0.22 0.00 -0.30 6.12 2.04 -1.21 -0.99 117.51 122.95 1rik h ILE 22 Ca -0.00 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.94 1rik h ILE 22 Cb 0.22 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 1rik h ILE 22 CO 0.00 0.00 0.26 -0.07 0.00 0.00 0.00 178.15 178.34 1rik h LEU 23 N 0.00 0.00 -0.48 1.44 -0.00 -1.42 -1.13 115.31 113.72 1rik h LEU 23 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.88 57.97 1rik h LEU 23 Cb 0.39 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.98 1rik h LEU 23 CO 0.00 0.00 0.06 -0.07 -0.00 0.00 0.00 178.44 178.43 1rik h LEU 24 N 0.00 -0.07 -0.45 1.67 3.38 -1.40 -0.61 115.31 117.84 1rik h LEU 24 Ca 0.14 0.10 -0.17 0.00 0.09 0.00 0.00 57.88 58.03 1rik h LEU 24 Cb 0.65 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1rik h LEU 24 CO -0.00 -0.00 -0.63 0.45 0.09 0.00 0.00 178.44 178.34 1rik h HIS 25 N 0.19 0.67 0.61 1.13 3.86 -1.45 -3.31 115.15 116.86 1rik h HIS 25 Ca 0.24 -0.26 -0.02 0.00 -1.16 0.00 0.00 60.37 59.17 1rik h HIS 25 Cb 0.34 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 1rik h HIS 25 CO -0.25 1.01 -0.42 0.93 0.86 0.00 0.00 177.93 180.06 1rik h GLU 26 N 0.38 -0.96 -2.28 2.45 4.39 -0.95 -3.44 114.58 114.18 1rik h GLU 26 Ca -0.01 0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.73 1rik h GLU 26 Cb 1.19 0.22 -0.24 0.00 -0.10 0.00 0.00 28.75 29.82 1rik h GLU 26 CO 0.12 -0.64 -0.17 -0.80 -1.16 0.00 0.00 179.01 176.36 1rik s ASN 27 N -4.35 -0.74 -0.30 1.42 -0.87 -0.33 -5.11 114.94 104.66 1rik s ASN 27 Ca -0.18 1.26 -0.08 0.00 -1.57 0.00 0.00 52.86 52.29 1rik s ASN 27 Cb 0.04 1.36 0.15 0.00 -0.02 0.00 0.00 41.25 42.78 1rik s ASN 27 CO 0.61 -0.22 0.63 -0.75 -2.57 0.00 0.00 177.10 174.80 1rik s LYS 28 N 1.96 0.57 0.00 -0.60 2.47 -1.25 -4.55 119.74 118.34 1rik s LYS 28 Ca -0.08 1.33 0.24 0.00 -1.56 0.00 0.00 55.97 55.90 1rik s LYS 28 Cb -0.08 0.78 0.23 0.00 -1.46 0.00 0.00 37.83 37.29 1rik s LYS 28 CO -0.16 -0.32 1.28 1.63 0.16 0.00 0.00 175.35 177.94