#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c55 n SER 3 N 3.10 0.00 -0.43 0.00 3.41 -1.26 -4.53 113.62 113.92 1c55 n SER 3 Ca 0.22 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.85 1c55 n SER 3 Cb 0.51 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.51 1c55 n SER 3 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1c55 n THR 4 N -0.91 0.26 -2.26 6.66 -2.24 -1.26 -4.86 114.28 109.66 1c55 n THR 4 Ca 0.00 -0.17 -0.42 0.00 -2.27 0.00 0.00 64.05 61.19 1c55 n THR 4 Cb 0.00 -0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.02 1c55 n THR 4 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1c55 s LEU 6 N 0.60 3.54 0.00 0.00 1.43 0.17 -4.93 118.68 119.49 1c55 s LEU 6 Ca 0.60 1.45 0.22 0.00 -1.03 0.00 0.00 54.13 55.36 1c55 s LEU 6 Cb -0.35 -4.41 1.31 0.00 0.03 0.00 0.00 46.19 42.78 1c55 s LEU 6 CO 0.33 -0.64 1.85 -0.67 0.23 0.00 0.00 176.35 177.44 1c55 n ASP 7 N -1.89 0.04 -4.87 2.29 2.03 -1.26 -4.36 116.55 108.53 1c55 n ASP 7 Ca 0.06 -1.32 -0.35 0.00 0.52 0.00 0.00 54.79 53.70 1c55 n ASP 7 Cb 0.54 -0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.88 1c55 n ASP 7 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1c55 s LEU 8 N -1.69 4.38 0.47 -2.67 1.43 -1.26 -5.03 118.68 114.31 1c55 s LEU 8 Ca 0.33 0.72 -0.22 0.00 -1.03 0.00 0.00 54.13 53.93 1c55 s LEU 8 Cb 0.15 -2.73 -0.07 0.00 0.03 0.00 0.00 46.19 43.57 1c55 s LEU 8 CO 0.26 0.25 1.15 0.00 0.23 0.00 0.00 176.35 178.23 1c55 s ALA 9 N -1.28 2.93 0.29 4.21 0.00 -1.26 -2.26 121.76 124.39 1c55 s ALA 9 Ca 0.28 0.89 0.08 0.00 0.00 0.00 0.00 51.96 53.21 1c55 s ALA 9 Cb -0.14 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1c55 s ALA 9 CO 0.15 -0.64 0.16 0.00 0.00 0.00 0.00 175.76 175.44 1c55 n GLY 11 N -1.15 0.19 3.16 0.00 0.00 -1.26 -4.76 105.19 101.36 1c55 n GLY 11 Ca -0.05 -0.10 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 1c55 n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c55 s ALA 12 N -0.95 0.89 0.09 4.61 0.00 -1.26 -5.05 121.76 120.10 1c55 s ALA 12 Ca 0.00 -1.36 -0.23 0.00 0.00 0.00 0.00 51.96 50.37 1c55 s ALA 12 Cb 0.00 0.31 -0.14 0.00 0.00 0.00 0.00 23.12 23.29 1c55 s ALA 12 CO 0.00 -0.31 1.73 1.03 0.00 0.00 0.00 175.76 178.21 1c55 h SER 13 N 2.97 -0.08 -0.32 0.00 0.87 -2.00 -2.63 113.55 112.37 1c55 h SER 13 Ca -0.35 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.24 1c55 h SER 13 Cb 1.17 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 63.13 1c55 h SER 13 CO 0.64 -0.05 0.16 -0.09 -0.53 0.00 0.00 176.83 176.96 1c55 h ARG 14 N -0.07 0.32 -0.64 2.24 2.43 -1.97 0.68 114.38 117.36 1c55 h ARG 14 Ca 0.00 -0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.28 1c55 h ARG 14 Cb 0.07 -0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 29.45 1c55 h ARG 14 CO -0.01 0.21 0.13 1.49 -1.51 0.00 0.00 179.97 180.27 1c55 h GLU 15 N 0.33 0.24 0.00 0.20 4.22 -1.92 0.03 114.58 117.67 1c55 h GLU 15 Ca 0.13 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.56 1c55 h GLU 15 Cb 0.05 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1c55 h GLU 15 CO -0.09 0.16 -0.47 0.00 -2.18 0.00 0.00 179.01 176.42 1c55 h TYR 17 N 0.00 0.47 0.12 0.00 5.03 0.22 0.81 116.97 123.62 1c55 h TYR 17 Ca 0.00 -0.12 0.01 0.00 2.58 0.00 0.00 58.73 61.21 1c55 h TYR 17 Cb 0.94 -0.11 -0.02 0.00 1.55 0.00 0.00 36.73 39.09 1c55 h TYR 17 CO 0.00 0.70 -0.17 0.22 -1.32 0.00 0.00 178.16 177.58 1c55 h ASP 18 N 0.10 -0.48 0.33 -2.11 1.82 -1.39 -1.93 116.42 112.76 1c55 h ASP 18 Ca 0.04 0.05 -0.02 0.00 -0.39 0.00 0.00 57.03 56.72 1c55 h ASP 18 Cb 0.57 0.18 0.00 0.00 0.68 0.00 0.00 39.33 40.77 1c55 h ASP 18 CO 0.03 -0.25 -0.16 1.55 -1.61 0.00 0.00 179.24 178.80 1c55 h PRO 19 N -0.35 -0.43 -0.74 0.28 0.13 -1.68 -1.72 132.00 127.49 1c55 h PRO 19 Ca 0.02 0.03 0.21 0.00 -0.87 0.00 0.00 66.00 65.39 1c55 h PRO 19 Cb 0.36 0.10 -0.03 0.00 0.13 0.00 0.00 31.00 31.56 1c55 h PRO 19 CO -0.08 -0.10 0.72 0.00 -0.23 0.00 0.00 178.00 178.30 1c55 h PHE 21 N 0.00 0.69 0.00 0.00 3.04 -1.24 -2.41 116.94 117.02 1c55 h PHE 21 Ca 0.35 -0.51 -0.17 0.00 3.98 0.00 0.00 57.97 61.62 1c55 h PHE 21 Cb 1.79 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 40.25 1c55 h PHE 21 CO 0.00 1.65 -0.83 0.87 -2.02 0.00 0.00 178.31 177.98 1c55 h LYS 22 N 0.03 0.00 0.00 1.11 1.79 0.23 -2.46 116.57 117.27 1c55 h LYS 22 Ca -0.33 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.12 1c55 h LYS 22 Cb 2.04 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.69 1c55 h LYS 22 CO 0.17 0.83 -0.16 0.00 -1.08 0.00 0.00 179.45 179.20 1c55 h ALA 23 N 1.17 0.02 0.00 3.86 0.00 0.20 -3.43 119.26 121.08 1c55 h ALA 23 Ca -0.01 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1c55 h ALA 23 Cb 1.47 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1c55 h ALA 23 CO 0.11 0.11 -0.05 1.19 0.00 0.00 0.00 179.25 180.61 1c55 n PHE 24 N -4.66 0.08 0.00 0.00 3.72 -0.93 -5.06 117.46 110.61 1c55 n PHE 24 Ca -0.08 0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1c55 n PHE 24 Cb 0.28 -0.29 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 1c55 n PHE 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1c55 n GLY 25 N 1.73 1.28 3.52 1.37 0.00 -0.93 -5.00 105.19 107.16 1c55 n GLY 25 Ca -0.01 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 1c55 n GLY 25 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1c55 s ARG 26 N 0.00 3.79 -0.74 1.61 3.00 -1.26 -4.67 118.95 120.68 1c55 s ARG 26 Ca 0.00 -0.41 -0.16 0.00 0.00 0.00 0.00 55.73 55.17 1c55 s ARG 26 Cb 0.00 -3.45 -0.12 0.00 0.00 0.00 0.00 34.95 31.38 1c55 s ARG 26 CO 0.00 -0.15 1.92 0.00 0.00 0.00 0.00 175.30 177.07 1c55 n ALA 27 N 4.87 3.54 -3.47 2.13 0.00 -1.26 -4.60 120.51 121.73 1c55 n ALA 27 Ca -0.15 -2.66 -0.27 0.00 0.00 0.00 0.00 53.44 50.36 1c55 n ALA 27 Cb 0.52 -3.36 -0.08 0.00 0.00 0.00 0.00 19.45 16.52 1c55 n ALA 27 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1c55 n HIS 28 N 6.30 3.33 -2.66 0.00 -0.00 -1.26 -4.96 115.22 115.97 1c55 n HIS 28 Ca 0.45 -4.14 0.00 0.00 -0.00 0.00 0.00 57.72 54.03 1c55 n HIS 28 Cb 0.29 -0.55 0.00 0.00 -0.00 0.00 0.00 29.99 29.73 1c55 n HIS 28 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1c55 n GLY 29 N 1.04 5.30 0.37 1.57 0.00 -1.26 -2.58 105.19 109.62 1c55 n GLY 29 Ca 0.28 -1.34 -0.01 0.00 0.00 0.00 0.00 46.02 44.95 1c55 n GLY 29 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1c55 n LYS 30 N 0.00 0.10 -3.57 1.61 5.02 0.30 -4.91 118.16 116.71 1c55 n LYS 30 Ca 0.00 -0.24 -0.41 0.00 -2.02 0.00 0.00 58.31 55.65 1c55 n LYS 30 Cb 0.00 0.28 -0.08 0.00 -0.02 0.00 0.00 35.03 35.21 1c55 n LYS 30 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1c55 s MET 32 N 0.85 1.35 -0.82 0.00 1.75 0.14 -4.73 119.30 117.84 1c55 s MET 32 Ca 0.10 -1.62 -0.03 0.00 -1.25 0.00 0.00 55.69 52.89 1c55 s MET 32 Cb -0.22 -1.04 0.02 0.00 2.84 0.00 0.00 34.83 36.43 1c55 s MET 32 CO -0.03 0.12 0.13 -1.71 -0.65 0.00 0.00 175.02 172.88 1c55 n ASN 33 N -0.41 -2.93 -0.54 1.11 2.85 -1.26 0.19 115.26 114.27 1c55 n ASN 33 Ca -0.07 0.11 -0.07 0.00 -0.11 0.00 0.00 54.58 54.43 1c55 n ASN 33 Cb 0.61 -2.52 -0.03 0.00 1.24 0.00 0.00 39.78 39.09 1c55 n ASN 33 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1c55 n ASN 34 N -1.84 -4.85 -4.13 1.20 5.03 -1.26 -4.96 115.26 104.44 1c55 n ASN 34 Ca -0.07 0.17 -0.09 0.00 0.87 0.00 0.00 54.58 55.47 1c55 n ASN 34 Cb 0.56 -2.97 -0.10 0.00 -1.02 0.00 0.00 39.78 36.25 1c55 n ASN 34 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1c55 s LYS 35 N -2.27 0.79 -0.51 3.52 1.02 0.49 -2.07 119.74 120.71 1c55 s LYS 35 Ca 0.00 -1.34 -0.29 0.00 0.02 0.00 0.00 55.97 54.37 1c55 s LYS 35 Cb 0.00 0.13 0.02 0.00 -0.52 0.00 0.00 37.83 37.46 1c55 s LYS 35 CO 0.00 -0.15 1.24 0.00 -0.92 0.00 0.00 175.35 175.52 1c55 s ARG 37 N 4.84 3.96 0.14 0.00 6.06 0.22 -0.65 118.95 133.52 1c55 s ARG 37 Ca 0.49 -0.08 0.05 0.00 -2.50 0.00 0.00 55.73 53.69 1c55 s ARG 37 Cb -0.09 -3.67 -0.04 0.00 0.06 0.00 0.00 34.95 31.21 1c55 s ARG 37 CO 0.29 -0.28 0.08 0.00 -2.50 0.00 0.00 175.30 172.89 1c55 s TYR 39 N -1.61 0.51 0.00 0.00 1.13 -1.07 -4.46 117.35 111.86 1c55 s TYR 39 Ca 0.29 -1.04 0.00 0.00 -1.41 0.00 0.00 57.07 54.91 1c55 s TYR 39 Cb -0.11 -0.37 0.00 0.00 -1.10 0.00 0.00 41.96 40.39 1c55 s TYR 39 CO 0.22 -0.40 0.08 0.25 -2.51 0.00 0.00 175.55 173.19