#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 0.52 -2.46 -0.72 4.81 -0.97 -4.88 118.16 114.46 1rik n LYS 2 Ca 0.00 0.38 -0.23 0.00 -0.87 0.00 0.00 58.31 57.59 1rik n LYS 2 Cb 0.00 -1.58 0.06 0.00 0.02 0.00 0.00 35.03 33.53 1rik n LYS 2 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1rik s PHE 3 N -2.54 2.75 -0.05 5.64 0.40 0.94 -4.92 117.98 120.21 1rik s PHE 3 Ca -0.26 0.14 -0.22 0.00 -0.60 0.00 0.00 56.93 55.99 1rik s PHE 3 Cb 0.05 -2.96 0.05 0.00 0.51 0.00 0.00 43.02 40.67 1rik s PHE 3 CO 0.39 -1.17 0.48 0.00 0.70 0.00 0.00 175.22 175.62 1rik s ALA 4 N -2.99 -1.24 0.12 5.36 0.00 -1.26 -2.26 121.76 119.50 1rik s ALA 4 Ca 0.59 0.86 -0.27 0.00 0.00 0.00 0.00 51.96 53.15 1rik s ALA 4 Cb -0.10 -0.07 -0.07 0.00 0.00 0.00 0.00 23.12 22.89 1rik s ALA 4 CO 0.41 -0.30 0.83 0.00 0.00 0.00 0.00 175.76 176.70 1rik h PRO 6 N 4.99 0.00 0.00 0.00 0.13 -2.02 -3.35 132.00 131.76 1rik h PRO 6 Ca -0.45 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.29 1rik h PRO 6 Cb 1.21 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.28 1rik h PRO 6 CO 0.69 0.00 -2.28 0.39 -0.23 0.00 0.00 178.00 176.58 1rik n GLU 7 N -2.77 0.55 -3.51 0.86 4.71 -1.26 -5.04 120.64 114.18 1rik n GLU 7 Ca 0.03 0.24 -0.21 0.00 -0.01 0.00 0.00 57.16 57.21 1rik n GLU 7 Cb 0.39 -1.43 -0.02 0.00 -1.01 0.00 0.00 31.44 29.37 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 -1.64 1.76 -2.85 0.00 -0.04 -1.26 -3.99 135.00 126.97 1rik n PRO 9 Ca 0.04 -1.62 -0.29 0.00 -0.04 0.00 0.00 63.50 61.59 1rik n PRO 9 Cb 0.62 -1.64 -0.02 0.00 -0.04 0.00 0.00 33.50 32.42 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 -1.84 3.69 -0.12 0.54 -0.14 -1.26 -4.94 119.74 115.67 1rik s LYS 10 Ca 0.31 0.33 -0.07 0.00 -1.36 0.00 0.00 55.97 55.18 1rik s LYS 10 Cb 0.26 -2.42 0.05 0.00 -1.68 0.00 0.00 37.83 34.03 1rik s LYS 10 CO 0.03 -0.06 0.30 -0.98 -0.76 0.00 0.00 175.35 173.88 1rik s ARG 11 N -4.08 0.28 0.02 1.68 3.03 -1.26 -1.88 118.95 116.74 1rik s ARG 11 Ca 0.49 0.59 0.03 0.00 2.03 0.00 0.00 55.73 58.87 1rik s ARG 11 Cb -0.10 -0.06 -0.01 0.00 -1.03 0.00 0.00 34.95 33.75 1rik s ARG 11 CO 0.35 -0.15 -0.09 -0.06 -1.13 0.00 0.00 175.30 174.23 1rik s PHE 12 N 1.16 0.76 0.35 5.89 0.40 -0.96 -4.86 117.98 120.73 1rik s PHE 12 Ca -0.08 -0.27 0.16 0.00 -0.60 0.00 0.00 56.93 56.14 1rik s PHE 12 Cb -0.09 -0.47 0.81 0.00 0.51 0.00 0.00 43.02 43.79 1rik s PHE 12 CO -0.09 -0.02 1.85 0.00 0.70 0.00 0.00 175.22 177.66 1rik h MET 13 N 5.36 0.00 -6.23 0.44 -0.00 -1.90 0.28 114.93 112.88 1rik h MET 13 Ca -0.33 0.00 -0.45 0.00 -0.00 0.00 0.00 59.70 58.92 1rik h MET 13 Cb 1.19 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.78 1rik h MET 13 CO 0.46 0.34 -0.40 1.03 -0.00 0.00 0.00 176.91 178.34 1rik s ARG 14 N -4.11 3.35 -0.17 -0.10 3.00 -1.26 -4.53 118.95 115.14 1rik s ARG 14 Ca -0.02 -0.82 -0.11 0.00 0.00 0.00 0.00 55.73 54.77 1rik s ARG 14 Cb 0.14 -2.87 -0.23 0.00 0.00 0.00 0.00 34.95 31.99 1rik s ARG 14 CO 0.70 0.32 0.23 -1.13 0.00 0.00 0.00 175.30 175.42 1rik n SER 15 N -1.48 2.03 -0.12 0.23 3.41 -1.26 -3.59 113.62 112.83 1rik n SER 15 Ca -0.06 0.25 -0.12 0.00 -0.26 0.00 0.00 58.87 58.68 1rik n SER 15 Cb 0.57 -0.86 -0.02 0.00 -0.26 0.00 0.00 64.21 63.64 1rik n SER 15 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1rik h ASP 16 N -0.31 0.81 0.09 4.04 1.82 -1.98 -1.74 116.42 119.15 1rik h ASP 16 Ca -0.43 -0.41 -0.00 0.00 -0.39 0.00 0.00 57.03 55.79 1rik h ASP 16 Cb 1.78 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 41.57 1rik h ASP 16 CO -0.04 1.04 -0.04 0.45 -1.61 0.00 0.00 179.24 179.03 1rik h HIS 17 N 0.58 -0.11 -0.50 0.28 3.86 -2.00 0.52 115.15 117.77 1rik h HIS 17 Ca 0.08 -0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.32 1rik h HIS 17 Cb 0.74 0.04 -0.04 0.00 1.06 0.00 0.00 27.41 29.21 1rik h HIS 17 CO 0.06 -0.03 0.28 1.25 0.86 0.00 0.00 177.93 180.34 1rik h LEU 18 N -0.16 0.43 -1.55 2.43 6.46 -1.61 -1.19 115.31 120.12 1rik h LEU 18 Ca -0.01 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.75 1rik h LEU 18 Cb 0.13 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 39.97 1rik h LEU 18 CO 0.02 0.30 0.16 0.74 -0.62 0.00 0.00 178.44 179.04 1rik h THR 19 N 0.55 1.12 -0.48 1.05 2.02 -1.06 -1.09 112.91 115.01 1rik h THR 19 Ca 0.21 -0.33 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 1rik h THR 19 Cb 0.07 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 1rik h THR 19 CO -0.12 0.13 0.23 0.25 0.37 0.00 0.00 175.52 176.39 1rik h LEU 20 N 0.46 0.60 -0.12 2.58 6.46 0.35 -2.71 115.31 122.94 1rik h LEU 20 Ca 0.12 -0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1rik h LEU 20 Cb 0.05 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 39.83 1rik h LEU 20 CO -0.02 0.51 -0.02 1.12 -0.62 0.00 0.00 178.44 179.41 1rik h HIS 21 N 0.67 0.25 0.00 1.25 2.07 -0.82 -3.00 115.15 115.57 1rik h HIS 21 Ca 0.17 -0.05 0.00 0.00 -2.85 0.00 0.00 60.37 57.64 1rik h HIS 21 Cb 0.07 -0.06 0.00 0.00 2.57 0.00 0.00 27.41 29.99 1rik h HIS 21 CO 0.01 0.51 0.03 -0.89 -3.07 0.00 0.00 177.93 174.51 1rik n ILE 22 N -4.75 1.81 -0.23 6.12 5.41 -0.99 -2.20 119.36 124.52 1rik n ILE 22 Ca -0.06 0.48 0.06 0.00 1.00 0.00 0.00 62.75 64.23 1rik n ILE 22 Cb 0.24 -1.48 0.32 0.00 -0.71 0.00 0.00 39.64 38.01 1rik n ILE 22 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1rik h LEU 23 N 0.00 0.75 -1.24 1.39 3.38 -1.49 -1.08 115.31 117.01 1rik h LEU 23 Ca 0.00 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1rik h LEU 23 Cb 0.05 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1rik h LEU 23 CO 0.00 0.48 0.14 0.17 0.09 0.00 0.00 178.44 179.32 1rik h LEU 24 N 0.85 0.61 -0.51 1.67 8.10 -1.68 -2.66 115.31 121.69 1rik h LEU 24 Ca 0.34 -0.08 -0.01 0.00 0.11 0.00 0.00 57.88 58.24 1rik h LEU 24 Cb 0.26 -0.16 -0.02 0.00 -0.44 0.00 0.00 40.66 40.29 1rik h LEU 24 CO -0.12 0.58 0.27 0.45 -4.11 0.00 0.00 178.44 175.52 1rik h HIS 25 N 0.65 0.70 -0.44 0.17 3.86 -1.40 -2.88 115.15 115.80 1rik h HIS 25 Ca 0.15 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.35 1rik h HIS 25 Cb 0.20 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 1rik h HIS 25 CO 0.01 0.52 0.28 0.93 0.86 0.00 0.00 177.93 180.53 1rik h GLU 26 N 0.67 0.56 -6.09 2.45 4.39 -1.31 -3.35 114.58 111.90 1rik h GLU 26 Ca 0.18 -0.03 -0.57 0.00 0.34 0.00 0.00 59.36 59.28 1rik h GLU 26 Cb 0.06 -0.13 -0.09 0.00 -0.10 0.00 0.00 28.75 28.49 1rik h GLU 26 CO -0.03 0.37 1.40 1.21 -1.16 0.00 0.00 179.01 180.80 1rik s ASN 27 N -5.58 6.35 0.17 1.42 2.47 -1.05 -4.92 114.94 113.80 1rik s ASN 27 Ca -0.13 -1.30 -0.15 0.00 0.42 0.00 0.00 52.86 51.70 1rik s ASN 27 Cb 0.11 -2.57 0.02 0.00 -1.45 0.00 0.00 41.25 37.37 1rik s ASN 27 CO 0.73 -1.65 0.43 -0.75 -3.72 0.00 0.00 177.10 172.14 1rik s LYS 28 N 5.23 1.23 0.00 0.43 2.20 -1.26 -4.90 119.74 122.67 1rik s LYS 28 Ca 0.48 -0.90 0.15 0.00 -0.36 0.00 0.00 55.97 55.34 1rik s LYS 28 Cb -0.01 0.47 0.91 0.00 -1.51 0.00 0.00 37.83 37.68 1rik s LYS 28 CO -0.07 -0.50 1.32 0.36 -0.36 0.00 0.00 175.35 176.10