#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 3.93 0.00 -3.66 0.00 3.41 -1.26 -4.68 113.62 111.36 1c55 n SER 3 Ca -0.24 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 57.95 1c55 n SER 3 Cb 0.52 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.47 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 0.00 4.68 -3.74 6.66 -2.24 -1.26 -4.94 114.28 113.44 1c55 n THR 4 Ca 0.00 -4.19 -0.37 0.00 -2.27 0.00 0.00 64.05 57.23 1c55 n THR 4 Cb 0.00 -2.27 -0.11 0.00 -2.10 0.00 0.00 70.33 65.85 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 1.32 0.55 0.00 0.00 1.43 -0.65 -4.93 118.68 116.40 1c55 s LEU 6 Ca 0.06 0.52 0.27 0.00 -1.03 0.00 0.00 54.13 53.95 1c55 s LEU 6 Cb -0.15 -2.16 0.98 0.00 0.03 0.00 0.00 46.19 44.89 1c55 s LEU 6 CO 0.05 -4.31 1.70 -0.67 0.23 0.00 0.00 176.35 173.36 1c55 n ASP 7 N -4.87 1.56 -4.90 2.29 -0.08 -1.26 -4.60 116.55 104.69 1c55 n ASP 7 Ca 0.15 -1.55 -0.33 0.00 -1.51 0.00 0.00 54.79 51.56 1c55 n ASP 7 Cb 0.60 -0.02 -0.05 0.00 2.34 0.00 0.00 41.12 43.99 1c55 n ASP 7 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1c55 s LEU 8 N -1.92 4.35 0.70 -2.67 1.43 -1.26 -5.04 118.68 114.27 1c55 s LEU 8 Ca 0.37 0.43 -0.11 0.00 -1.03 0.00 0.00 54.13 53.78 1c55 s LEU 8 Cb 0.20 -2.88 0.01 0.00 0.03 0.00 0.00 46.19 43.55 1c55 s LEU 8 CO 0.32 0.19 1.07 0.00 0.23 0.00 0.00 176.35 178.16 1c55 s ALA 9 N -1.44 2.79 0.42 4.21 0.00 -1.26 -2.36 121.76 124.12 1c55 s ALA 9 Ca 0.32 -0.17 -0.07 0.00 0.00 0.00 0.00 51.96 52.05 1c55 s ALA 9 Cb -0.13 -3.08 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 1c55 s ALA 9 CO 0.22 -1.13 0.73 0.00 0.00 0.00 0.00 175.76 175.57 1c55 n GLY 11 N -1.70 2.71 3.12 0.00 0.00 -1.26 -5.00 105.19 103.07 1c55 n GLY 11 Ca 0.00 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 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 0.00 2.69 0.02 4.61 0.00 -1.26 -5.02 121.76 122.79 1c55 s ALA 12 Ca 0.00 -1.77 -0.07 0.00 0.00 0.00 0.00 51.96 50.12 1c55 s ALA 12 Cb 0.00 -1.76 -0.03 0.00 0.00 0.00 0.00 23.12 21.33 1c55 s ALA 12 CO 0.00 -1.24 1.11 1.03 0.00 0.00 0.00 175.76 176.66 1c55 h SER 13 N 7.88 -0.30 -1.40 0.00 0.87 -1.98 -1.22 113.55 117.40 1c55 h SER 13 Ca -0.20 0.03 0.43 0.00 -1.23 0.00 0.00 61.79 60.83 1c55 h SER 13 Cb 1.05 0.11 -0.11 0.00 -0.44 0.00 0.00 62.40 63.01 1c55 h SER 13 CO 0.50 -0.11 0.94 -0.09 -0.53 0.00 0.00 176.83 177.53 1c55 h ARG 14 N -0.16 0.09 -0.46 2.24 9.65 -1.97 0.67 114.38 124.45 1c55 h ARG 14 Ca -0.00 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 58.82 1c55 h ARG 14 Cb 0.15 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.69 1c55 h ARG 14 CO -0.05 0.06 0.08 1.49 2.80 0.00 0.00 179.97 184.35 1c55 h GLU 15 N 0.09 0.76 0.00 0.20 4.57 -1.66 -2.30 114.58 116.23 1c55 h GLU 15 Ca 0.79 -0.20 0.00 0.00 -1.18 0.00 0.00 59.36 58.77 1c55 h GLU 15 Cb 2.66 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 31.16 1c55 h GLU 15 CO -0.29 0.77 -0.93 0.00 -1.18 0.00 0.00 179.01 177.38 1c55 h TYR 17 N 0.00 0.69 0.04 0.00 3.20 0.17 -1.64 116.97 119.42 1c55 h TYR 17 Ca 0.00 -0.27 0.02 0.00 3.14 0.00 0.00 58.73 61.61 1c55 h TYR 17 Cb 0.91 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.04 1c55 h TYR 17 CO 0.00 1.02 -0.13 0.22 -1.64 0.00 0.00 178.16 177.64 1c55 h ASP 18 N 0.16 -0.36 0.52 -2.11 3.58 -1.56 -0.80 116.42 115.85 1c55 h ASP 18 Ca -0.01 0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.46 1c55 h ASP 18 Cb 1.02 0.14 0.01 0.00 1.72 0.00 0.00 39.33 42.22 1c55 h ASP 18 CO 0.09 -0.18 -0.25 1.55 -2.88 0.00 0.00 179.24 177.57 1c55 h PRO 19 N -0.23 -0.67 -0.92 0.28 0.13 -1.69 -2.16 132.00 126.73 1c55 h PRO 19 Ca 0.03 0.05 0.24 0.00 -0.87 0.00 0.00 66.00 65.45 1c55 h PRO 19 Cb 0.27 0.15 -0.05 0.00 0.13 0.00 0.00 31.00 31.50 1c55 h PRO 19 CO -0.10 -0.39 0.63 0.00 -0.23 0.00 0.00 178.00 177.92 1c55 h PHE 21 N 0.17 0.55 0.00 0.00 3.04 -1.04 0.70 116.94 120.37 1c55 h PHE 21 Ca 0.46 -0.21 -0.18 0.00 3.98 0.00 0.00 57.97 62.02 1c55 h PHE 21 Cb 1.52 -0.10 -0.03 0.00 2.56 0.00 0.00 35.95 39.90 1c55 h PHE 21 CO -0.00 0.92 -1.43 1.63 -2.02 0.00 0.00 178.31 177.41 1c55 n LYS 22 N -3.91 0.62 -0.02 1.11 4.76 0.11 -2.93 118.16 117.90 1c55 n LYS 22 Ca -0.03 0.24 -0.01 0.00 -2.87 0.00 0.00 58.31 55.64 1c55 n LYS 22 Cb 0.63 -1.81 -0.00 0.00 -1.84 0.00 0.00 35.03 32.00 1c55 n LYS 22 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1c55 h ALA 23 N 1.38 0.00 0.13 7.82 0.00 0.78 -3.42 119.26 125.96 1c55 h ALA 23 Ca -0.17 -0.16 -0.32 0.00 0.00 0.00 0.00 54.91 54.26 1c55 h ALA 23 Cb 1.63 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.48 1c55 h ALA 23 CO 0.05 0.07 -1.62 0.74 0.00 0.00 0.00 179.25 178.49 1c55 h PHE 24 N -0.30 0.52 0.00 0.00 0.04 -1.50 -3.49 116.94 112.21 1c55 h PHE 24 Ca 0.00 -0.38 0.00 0.00 2.80 0.00 0.00 57.97 60.39 1c55 h PHE 24 Cb 0.07 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.20 1c55 h PHE 24 CO -0.03 1.47 0.00 0.41 -0.60 0.00 0.00 178.31 179.56 1c55 n GLY 25 N 1.73 3.08 3.55 -1.45 0.00 0.15 -5.01 105.19 107.24 1c55 n GLY 25 Ca -0.19 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 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 3.47 -1.05 1.61 1.81 -1.26 -4.48 118.95 119.05 1c55 s ARG 26 Ca 0.00 0.03 -0.24 0.00 -1.72 0.00 0.00 55.73 53.81 1c55 s ARG 26 Cb 0.00 -3.96 -0.06 0.00 -0.45 0.00 0.00 34.95 30.48 1c55 s ARG 26 CO 0.00 -1.29 1.93 0.00 -0.68 0.00 0.00 175.30 175.26 1c55 s ALA 27 N 3.79 1.77 -0.45 2.13 0.00 -1.26 -4.68 121.76 123.04 1c55 s ALA 27 Ca 0.35 -1.85 0.06 0.00 0.00 0.00 0.00 51.96 50.52 1c55 s ALA 27 Cb -0.11 -4.62 0.18 0.00 0.00 0.00 0.00 23.12 18.57 1c55 s ALA 27 CO 0.24 -4.98 0.56 -1.58 0.00 0.00 0.00 175.76 170.00 1c55 s HIS 28 N 10.39 -0.74 0.06 0.00 5.04 -1.26 -5.01 115.29 123.77 1c55 s HIS 28 Ca 0.69 -0.95 0.01 0.00 -1.54 0.00 0.00 55.06 53.27 1c55 s HIS 28 Cb -0.04 -0.11 -0.00 0.00 0.04 0.00 0.00 32.58 32.47 1c55 s HIS 28 CO 0.06 -1.10 0.03 0.41 -2.34 0.00 0.00 174.74 171.79 1c55 n GLY 29 N 3.33 3.95 0.00 1.59 0.00 -1.26 -2.48 105.19 110.32 1c55 n GLY 29 Ca 0.19 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1c55 n GLY 29 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1c55 n LYS 30 N -0.12 0.00 -3.88 1.61 3.00 0.23 -4.89 118.16 114.10 1c55 n LYS 30 Ca -0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 58.01 1c55 n LYS 30 Cb 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 35.03 34.98 1c55 n LYS 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1c55 s MET 32 N 0.26 2.84 -1.01 0.00 1.75 0.24 -4.47 119.30 118.93 1c55 s MET 32 Ca 0.15 -0.57 -0.06 0.00 -1.25 0.00 0.00 55.69 53.97 1c55 s MET 32 Cb -0.24 -2.71 0.05 0.00 2.84 0.00 0.00 34.83 34.77 1c55 s MET 32 CO -0.03 0.64 0.25 -1.71 -0.65 0.00 0.00 175.02 173.52 1c55 n ASN 33 N 1.46 -3.16 0.00 1.11 2.85 -1.26 0.19 115.26 116.45 1c55 n ASN 33 Ca -0.15 -0.09 0.00 0.00 -0.11 0.00 0.00 54.58 54.23 1c55 n ASN 33 Cb 0.53 -2.68 0.00 0.00 1.24 0.00 0.00 39.78 38.87 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 -2.00 0.00 -4.56 1.20 5.03 -1.26 -4.97 115.26 108.69 1c55 n ASN 34 Ca -0.04 0.00 -0.27 0.00 0.87 0.00 0.00 54.58 55.13 1c55 n ASN 34 Cb 0.55 -0.81 -0.09 0.00 -1.02 0.00 0.00 39.78 38.40 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 -0.28 2.04 -0.08 3.52 1.02 0.49 -2.40 119.74 124.06 1c55 s LYS 35 Ca 0.00 -1.25 -0.30 0.00 0.02 0.00 0.00 55.97 54.44 1c55 s LYS 35 Cb 0.00 -2.16 -0.05 0.00 -0.52 0.00 0.00 37.83 35.10 1c55 s LYS 35 CO 0.00 0.44 1.55 0.00 -0.92 0.00 0.00 175.35 176.42 1c55 s ARG 37 N 3.81 3.32 -0.08 0.00 3.00 -0.63 -1.63 118.95 126.74 1c55 s ARG 37 Ca 0.68 -0.68 -0.11 0.00 -1.00 0.00 0.00 55.73 54.62 1c55 s ARG 37 Cb -0.31 -2.76 -0.05 0.00 0.00 0.00 0.00 34.95 31.83 1c55 s ARG 37 CO 0.26 -0.01 0.26 0.00 0.00 0.00 0.00 175.30 175.81 1c55 s TYR 39 N -0.80 3.60 -2.79 0.00 1.13 -1.03 -4.61 117.35 112.84 1c55 s TYR 39 Ca 0.18 0.57 0.26 0.00 -1.41 0.00 0.00 57.07 56.67 1c55 s TYR 39 Cb -0.14 -1.98 0.55 0.00 -1.10 0.00 0.00 41.96 39.29 1c55 s TYR 39 CO 0.07 0.67 1.46 0.25 -2.51 0.00 0.00 175.55 175.50