#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ech s GLU 3 N 1.32 4.21 0.10 0.00 -6.30 -1.26 -5.01 118.70 111.76 2ech s GLU 3 Ca -0.06 1.92 0.04 0.00 -2.50 0.00 0.00 54.97 54.37 2ech s GLU 3 Cb -0.13 -3.86 -0.04 0.00 0.00 0.00 0.00 34.13 30.10 2ech s GLU 3 CO -0.02 -0.77 0.08 -1.12 0.02 0.00 0.00 175.26 173.45 2ech s SER 4 N 2.61 5.45 -0.30 -1.70 0.01 -1.26 -4.54 113.70 113.97 2ech s SER 4 Ca 0.64 -0.07 -0.14 0.00 1.31 0.00 0.00 55.95 57.69 2ech s SER 4 Cb -0.27 -1.43 0.19 0.00 0.21 0.00 0.00 66.02 64.72 2ech s SER 4 CO 0.22 0.15 1.14 -0.83 0.41 0.00 0.00 173.24 174.33 2ech s GLY 5 N -2.57 -1.51 0.00 3.44 0.00 -1.26 -4.76 107.32 100.67 2ech s GLY 5 Ca 0.29 1.63 0.00 0.00 0.00 0.00 0.00 44.72 46.64 2ech s GLY 5 CO 0.22 4.42 0.29 -1.05 0.00 0.00 0.00 173.10 176.98 2ech n PRO 6 N 3.72 0.00 0.10 2.90 -0.02 -1.26 -2.08 135.00 138.36 2ech n PRO 6 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 2ech n PRO 6 Cb 0.64 -0.43 0.00 0.00 -0.02 0.00 0.00 33.50 33.69 2ech n PRO 6 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ech n ARG 9 N 8.49 0.00 0.00 0.00 3.00 -0.52 -2.39 116.66 125.24 2ech n ARG 9 Ca 0.27 0.10 0.00 0.00 -0.01 0.00 0.00 57.85 58.20 2ech n ARG 9 Cb 0.45 -0.16 0.00 0.00 0.00 0.00 0.00 32.46 32.75 2ech n ARG 9 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2ech n ASN 10 N -1.62 0.20 0.00 0.55 3.02 -1.26 -4.44 115.26 111.70 2ech n ASN 10 Ca 0.00 -0.57 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 2ech n ASN 10 Cb 0.00 0.68 0.00 0.00 -0.61 0.00 0.00 39.78 39.85 2ech n ASN 10 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ech s LYS 12 N 0.00 3.87 -0.36 0.00 -0.14 -1.26 -4.85 119.74 117.00 2ech s LYS 12 Ca 0.00 0.55 -0.33 0.00 -1.36 0.00 0.00 55.97 54.82 2ech s LYS 12 Cb 0.00 -3.78 -0.11 0.00 -1.68 0.00 0.00 37.83 32.27 2ech s LYS 12 CO 0.00 -0.83 2.23 1.19 -0.76 0.00 0.00 175.35 177.18 2ech n PHE 13 N 6.50 1.60 -0.24 3.18 3.72 -1.26 -1.43 117.46 129.52 2ech n PHE 13 Ca 0.05 0.21 0.00 0.00 -0.05 0.00 0.00 57.45 57.66 2ech n PHE 13 Cb 0.48 -2.56 0.00 0.00 -0.94 0.00 0.00 39.48 36.46 2ech n PHE 13 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 176.76 178.18 2ech n LEU 14 N 10.54 0.00 -3.53 4.37 -0.00 -1.26 -4.86 117.00 122.26 2ech n LEU 14 Ca 0.40 0.00 -0.38 0.00 -0.00 0.00 0.00 56.01 56.03 2ech n LEU 14 Cb 0.27 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.67 2ech n LEU 14 CO 0.75 -0.39 2.58 2.29 -0.00 0.00 0.00 177.39 182.62 2ech n LYS 15 N -0.46 2.44 0.00 1.47 2.85 -1.26 -4.63 118.16 118.57 2ech n LYS 15 Ca 0.00 -2.10 0.00 0.00 -1.05 0.00 0.00 58.31 55.16 2ech n LYS 15 Cb 0.00 -2.95 0.00 0.00 -0.65 0.00 0.00 35.03 31.43 2ech n LYS 15 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2ech n GLU 16 N 5.63 0.00 0.00 -1.58 2.13 -1.26 -4.37 120.64 121.19 2ech n GLU 16 Ca 0.54 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.36 2ech n GLU 16 Cb 0.32 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.03 2ech n GLU 16 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ech n GLY 17 N 0.01 0.59 3.01 8.31 0.00 -0.76 -4.91 105.19 111.44 2ech n GLY 17 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2ech n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ech s THR 18 N -0.96 0.98 0.09 2.61 2.01 -1.22 -4.99 115.64 114.17 2ech s THR 18 Ca 0.00 -0.43 -0.26 0.00 0.31 0.00 0.00 61.69 61.32 2ech s THR 18 Cb 0.00 -0.89 -0.06 0.00 0.01 0.00 0.00 72.50 71.55 2ech s THR 18 CO 0.00 0.31 0.80 -0.63 -0.69 0.00 0.00 174.62 174.41 2ech s ILE 19 N 0.47 4.58 -0.08 1.82 1.01 -1.26 -1.06 121.20 126.68 2ech s ILE 19 Ca -0.09 1.72 -0.16 0.00 0.00 0.00 0.00 60.65 62.11 2ech s ILE 19 Cb -0.13 -4.15 -0.12 0.00 0.01 0.00 0.00 42.46 38.06 2ech s ILE 19 CO 0.02 0.41 0.59 0.00 0.00 0.00 0.00 174.94 175.96 2ech n LYS 21 N -4.86 0.00 0.00 0.00 5.02 -1.26 -5.07 118.16 111.99 2ech n LYS 21 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 2ech n LYS 21 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.24 2ech n LYS 21 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2ech n ARG 22 N 0.00 0.00 -3.79 1.97 0.00 -1.26 -4.51 116.66 109.07 2ech n ARG 22 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.85 57.81 2ech n ARG 22 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 32.46 32.45 2ech n ARG 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ech s ALA 23 N 0.00 -1.52 -0.30 5.13 0.00 -1.26 -3.98 121.76 119.83 2ech s ALA 23 Ca 0.00 -0.07 -0.12 0.00 0.00 0.00 0.00 51.96 51.77 2ech s ALA 23 Cb 0.00 0.69 0.13 0.00 0.00 0.00 0.00 23.12 23.93 2ech s ALA 23 CO 0.00 -1.04 0.71 0.50 0.00 0.00 0.00 175.76 175.92 2ech s ARG 24 N -3.12 0.56 -1.18 0.00 3.52 -1.26 -4.72 118.95 112.75 2ech s ARG 24 Ca 0.14 1.31 -0.05 0.00 -0.13 0.00 0.00 55.73 57.00 2ech s ARG 24 Cb -0.02 0.67 -0.02 0.00 -1.56 0.00 0.00 34.95 34.01 2ech s ARG 24 CO 0.04 -0.18 0.84 0.41 -0.81 0.00 0.00 175.30 175.61 2ech n GLY 25 N 5.13 -0.66 0.00 8.12 0.00 -1.26 -4.95 105.19 111.57 2ech n GLY 25 Ca -0.13 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2ech n GLY 25 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ech n ASP 26 N -3.06 0.00 0.00 1.61 2.03 -1.26 -5.11 116.55 110.76 2ech n ASP 26 Ca -0.20 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.11 2ech n ASP 26 Cb 0.65 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.05 2ech n ASP 26 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2ech n ASP 27 N -0.38 0.00 -4.23 1.67 5.75 -1.26 -5.10 116.55 112.99 2ech n ASP 27 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 54.79 54.64 2ech n ASP 27 Cb 0.00 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 39.99 2ech n ASP 27 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 2ech s MET 28 N 1.19 1.02 0.00 0.11 -1.94 -1.26 -5.03 119.30 113.39 2ech s MET 28 Ca 0.00 -1.41 0.00 0.00 -1.71 0.00 0.00 55.69 52.57 2ech s MET 28 Cb 0.00 -0.57 0.00 0.00 2.01 0.00 0.00 34.83 36.27 2ech s MET 28 CO 0.00 0.07 0.00 -0.25 -0.01 0.00 0.00 175.02 174.83 2ech n ASP 29 N -0.10 1.98 -3.90 3.03 8.00 -1.26 -4.80 116.55 119.49 2ech n ASP 29 Ca -0.11 -0.58 -0.29 0.00 0.71 0.00 0.00 54.79 54.52 2ech n ASP 29 Cb 0.60 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.57 2ech n ASP 29 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2ech s ASP 30 N -0.15 4.41 -0.08 -2.24 1.01 -1.26 -4.46 116.67 113.90 2ech s ASP 30 Ca 0.00 -3.33 -0.16 0.00 0.71 0.00 0.00 52.55 49.76 2ech s ASP 30 Cb 0.00 -1.57 -0.05 0.00 1.01 0.00 0.00 42.92 42.31 2ech s ASP 30 CO 0.00 -0.17 0.43 -0.31 0.21 0.00 0.00 175.17 175.32 2ech s TYR 31 N -0.72 3.59 -0.15 4.23 1.51 -1.26 -0.95 117.35 123.60 2ech s TYR 31 Ca 0.21 0.89 -0.29 0.00 -1.01 0.00 0.00 57.07 56.87 2ech s TYR 31 Cb -0.17 -2.43 -0.06 0.00 -0.11 0.00 0.00 41.96 39.20 2ech s TYR 31 CO -0.07 0.36 2.05 0.00 -1.11 0.00 0.00 175.55 176.78 2ech n ASN 33 N 10.01 5.78 0.00 0.00 0.23 -1.14 -1.83 115.26 128.32 2ech n ASN 33 Ca 0.25 -3.76 0.00 0.00 -0.53 0.00 0.00 54.58 50.54 2ech n ASN 33 Cb 0.44 -0.59 0.00 0.00 -2.08 0.00 0.00 39.78 37.55 2ech n ASN 33 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2ech n GLY 34 N -0.69 0.99 0.09 4.83 0.00 -1.26 -4.43 105.19 104.72 2ech n GLY 34 Ca 0.48 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.45 2ech n GLY 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ech n LYS 35 N 0.00 0.64 -3.83 1.61 4.01 -1.26 -4.85 118.16 114.48 2ech n LYS 35 Ca 0.00 0.20 -0.10 0.00 -0.51 0.00 0.00 58.31 57.90 2ech n LYS 35 Cb 0.00 -1.74 -0.08 0.00 -0.51 0.00 0.00 35.03 32.70 2ech n LYS 35 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 2ech s THR 36 N -2.71 0.11 -0.65 -0.18 -1.32 -1.26 -5.06 115.64 104.57 2ech s THR 36 Ca -0.05 -0.93 0.06 0.00 -1.21 0.00 0.00 61.69 59.56 2ech s THR 36 Cb 0.08 -1.02 0.03 0.00 -1.51 0.00 0.00 72.50 70.08 2ech s THR 36 CO 0.82 -0.51 0.61 0.00 -2.21 0.00 0.00 174.62 173.33 2ech n ASP 38 N 0.09 8.01 -2.76 0.00 2.03 -1.26 -4.04 116.55 118.63 2ech n ASP 38 Ca 0.03 -2.66 0.00 0.00 0.52 0.00 0.00 54.79 52.68 2ech n ASP 38 Cb 0.13 -1.50 0.00 0.00 -0.72 0.00 0.00 41.12 39.04 2ech n ASP 38 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ech n PRO 40 N -0.60 2.23 -2.67 0.00 -0.02 -1.26 -4.93 135.00 127.75 2ech n PRO 40 Ca 0.00 0.79 -0.40 0.00 -2.02 0.00 0.00 63.50 61.87 2ech n PRO 40 Cb 0.00 -2.41 -0.05 0.00 -0.02 0.00 0.00 33.50 31.01 2ech n PRO 40 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2ech s ARG 41 N -1.66 4.73 -0.26 -0.52 3.52 -1.26 -4.07 118.95 119.43 2ech s ARG 41 Ca 0.57 1.56 0.02 0.00 -0.13 0.00 0.00 55.73 57.75 2ech s ARG 41 Cb -0.56 -3.16 0.06 0.00 -1.56 0.00 0.00 34.95 29.74 2ech s ARG 41 CO 0.60 0.37 -0.08 1.21 -0.81 0.00 0.00 175.30 176.60 2ech s ASN 42 N -1.17 4.26 0.65 -2.12 2.47 -1.26 -5.01 114.94 112.76 2ech s ASN 42 Ca 0.44 -1.38 0.11 0.00 0.42 0.00 0.00 52.86 52.45 2ech s ASN 42 Cb -0.27 -1.42 0.52 0.00 -1.45 0.00 0.00 41.25 38.64 2ech s ASN 42 CO 0.33 -0.22 1.26 -0.65 -3.72 0.00 0.00 177.10 174.10 2ech h PRO 43 N 7.83 0.00 -3.17 0.43 0.11 -1.94 -3.37 132.00 131.88 2ech h PRO 43 Ca -0.18 0.00 -0.73 0.00 0.11 0.00 0.00 66.00 65.20 2ech h PRO 43 Cb 1.05 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.06 2ech h PRO 43 CO 0.45 0.00 2.64 0.72 -0.21 0.00 0.00 178.00 181.60 2ech n HIS 44 N -2.74 2.80 -1.33 0.65 8.25 -1.26 -4.97 115.22 116.62 2ech n HIS 44 Ca 0.04 -2.88 -0.34 0.00 -0.26 0.00 0.00 57.72 54.28 2ech n HIS 44 Cb 0.95 -2.09 0.10 0.00 1.12 0.00 0.00 29.99 30.08 2ech n HIS 44 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2ech s LYS 45 N 0.55 1.97 0.00 -0.41 -0.14 -1.26 -4.16 119.74 116.29 2ech s LYS 45 Ca 0.51 1.76 0.00 0.00 -1.36 0.00 0.00 55.97 56.88 2ech s LYS 45 Cb 0.15 -1.81 0.00 0.00 -1.68 0.00 0.00 37.83 34.49 2ech s LYS 45 CO -0.05 -1.96 0.00 0.41 -0.76 0.00 0.00 175.35 172.98 2ech n GLY 46 N 0.43 2.07 0.31 -3.33 0.00 -1.26 -5.01 105.19 98.39 2ech n GLY 46 Ca 0.13 -0.63 -0.08 0.00 0.00 0.00 0.00 46.02 45.44 2ech n GLY 46 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ech h PRO 47 N 0.00 -0.27 -4.48 1.61 0.11 -1.99 -3.35 132.00 123.64 2ech h PRO 47 Ca 0.00 0.02 -0.72 0.00 0.11 0.00 0.00 66.00 65.41 2ech h PRO 47 Cb 0.00 0.06 -0.21 0.00 0.11 0.00 0.00 31.00 30.96 2ech h PRO 47 CO 0.00 -0.18 -0.36 0.00 -0.21 0.00 0.00 178.00 177.25 2ech s ALA 48 N -6.03 3.50 0.00 -0.75 0.00 -1.26 -5.16 121.76 112.06 2ech s ALA 48 Ca -0.15 -1.84 0.00 0.00 0.00 0.00 0.00 51.96 49.97 2ech s ALA 48 Cb 0.12 -2.98 0.00 0.00 0.00 0.00 0.00 23.12 20.26 2ech s ALA 48 CO 0.67 -1.58 0.00 -2.37 0.00 0.00 0.00 175.76 172.48