#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ech n GLU 3 N 3.36 3.45 -3.31 0.00 -0.58 -1.26 -4.71 120.64 117.59 2ech n GLU 3 Ca 0.11 -2.66 0.03 0.00 -0.42 0.00 0.00 57.16 54.22 2ech n GLU 3 Cb 0.39 -3.00 -0.04 0.00 -0.57 0.00 0.00 31.44 28.22 2ech n GLU 3 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2ech s SER 4 N 2.23 -0.13 1.13 1.62 1.04 -1.26 -4.95 113.70 113.38 2ech s SER 4 Ca 0.55 0.18 -0.19 0.00 0.48 0.00 0.00 55.95 56.97 2ech s SER 4 Cb 0.15 1.13 0.27 0.00 0.10 0.00 0.00 66.02 67.67 2ech s SER 4 CO -0.07 -0.03 1.23 -0.83 0.98 0.00 0.00 173.24 174.53 2ech s GLY 5 N 1.87 1.70 0.37 7.32 0.00 -1.26 -4.57 107.32 112.75 2ech s GLY 5 Ca -0.02 -1.21 0.05 0.00 0.00 0.00 0.00 44.72 43.54 2ech s GLY 5 CO -0.15 -0.31 1.98 -2.55 0.00 0.00 0.00 173.10 172.07 2ech h PRO 6 N -2.29 0.62 -0.50 2.90 0.11 -1.94 -0.89 132.00 130.01 2ech h PRO 6 Ca -0.43 -0.07 0.09 0.00 0.11 0.00 0.00 66.00 65.70 2ech h PRO 6 Cb 1.25 -0.12 -0.07 0.00 0.11 0.00 0.00 31.00 32.16 2ech h PRO 6 CO 0.30 0.48 0.08 0.00 -0.21 0.00 0.00 178.00 178.65 2ech n ARG 9 N 9.23 0.54 0.00 0.00 3.00 0.56 -0.70 116.66 129.30 2ech n ARG 9 Ca 0.13 -0.14 0.00 0.00 -0.00 0.00 0.00 57.85 57.83 2ech n ARG 9 Cb 0.50 -2.66 0.00 0.00 0.00 0.00 0.00 32.46 30.30 2ech n ARG 9 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2ech n ASN 10 N 13.71 0.00 0.00 6.15 2.85 -0.49 -1.19 115.26 136.28 2ech n ASN 10 Ca 0.51 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.98 2ech n ASN 10 Cb 0.33 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.35 2ech n ASN 10 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ech n LYS 12 N 0.00 1.77 0.00 0.00 4.76 -0.16 -4.89 118.16 119.63 2ech n LYS 12 Ca 0.00 -4.37 0.00 0.00 -2.87 0.00 0.00 58.31 51.07 2ech n LYS 12 Cb 0.39 -2.20 0.00 0.00 -1.84 0.00 0.00 35.03 31.38 2ech n LYS 12 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2ech n PHE 13 N 1.84 0.00 -0.47 2.13 3.01 -1.26 -0.32 117.46 122.40 2ech n PHE 13 Ca 0.23 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.69 2ech n PHE 13 Cb 0.38 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.85 2ech n PHE 13 CO 0.00 0.00 0.00 1.47 1.01 0.00 0.00 176.76 179.24 2ech n LEU 14 N 0.00 0.00 -4.34 4.37 -0.00 -1.26 -4.65 117.00 111.12 2ech n LEU 14 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 56.01 55.69 2ech n LEU 14 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.36 2ech n LEU 14 CO 0.00 -0.83 1.64 0.29 -0.00 0.00 0.00 177.39 178.49 2ech n LYS 15 N -1.22 1.53 0.00 1.47 5.02 -1.26 -4.39 118.16 119.31 2ech n LYS 15 Ca 0.00 -2.29 0.00 0.00 -2.02 0.00 0.00 58.31 54.00 2ech n LYS 15 Cb 0.00 -3.53 0.00 0.00 -0.02 0.00 0.00 35.03 31.48 2ech n LYS 15 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2ech n GLU 16 N 7.97 0.00 0.00 1.97 2.13 -1.26 -4.06 120.64 127.39 2ech n GLU 16 Ca 0.46 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.28 2ech n GLU 16 Cb 0.45 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.16 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 0.00 0.69 3.18 8.31 0.00 -0.92 -4.92 105.19 111.53 2ech n GLY 17 Ca 0.00 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.23 3.13 -0.18 2.61 2.01 -1.20 -4.97 115.64 115.81 2ech s THR 18 Ca 0.00 -1.42 -0.28 0.00 0.31 0.00 0.00 61.69 60.29 2ech s THR 18 Cb 0.00 -2.83 -0.05 0.00 0.01 0.00 0.00 72.50 69.62 2ech s THR 18 CO 0.00 -0.18 2.11 -0.63 -0.69 0.00 0.00 174.62 175.23 2ech s ILE 19 N 1.26 3.08 -0.08 1.82 1.01 -1.26 -1.28 121.20 125.75 2ech s ILE 19 Ca -0.03 0.09 0.14 0.00 0.00 0.00 0.00 60.65 60.85 2ech s ILE 19 Cb -0.20 -3.09 -0.18 0.00 0.01 0.00 0.00 42.46 39.00 2ech s ILE 19 CO -0.01 -0.05 0.78 0.00 0.00 0.00 0.00 174.94 175.66 2ech s LYS 21 N -2.76 0.31 -1.11 0.00 2.47 -0.90 -5.05 119.74 112.70 2ech s LYS 21 Ca -0.03 0.46 -0.18 0.00 -1.56 0.00 0.00 55.97 54.66 2ech s LYS 21 Cb 0.08 0.09 0.11 0.00 -1.46 0.00 0.00 37.83 36.66 2ech s LYS 21 CO 0.82 -0.08 1.42 0.50 0.16 0.00 0.00 175.35 178.17 2ech s ARG 22 N 0.49 3.84 -0.95 4.03 6.06 -1.26 -1.28 118.95 129.86 2ech s ARG 22 Ca -0.03 -1.95 -0.07 0.00 -2.50 0.00 0.00 55.73 51.19 2ech s ARG 22 Cb -0.04 -5.18 -0.05 0.00 0.06 0.00 0.00 34.95 29.74 2ech s ARG 22 CO -0.03 -1.96 2.94 0.00 -2.50 0.00 0.00 175.30 173.75 2ech n ALA 23 N 7.11 6.90 -2.55 6.12 0.00 -1.26 -4.75 120.51 132.08 2ech n ALA 23 Ca 0.35 -3.19 -0.41 0.00 0.00 0.00 0.00 53.44 50.19 2ech n ALA 23 Cb 0.47 -2.75 -0.03 0.00 0.00 0.00 0.00 19.45 17.14 2ech n ALA 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2ech s ARG 24 N 0.32 3.24 0.00 0.00 3.00 -1.26 -3.18 118.95 121.06 2ech s ARG 24 Ca 0.63 -0.16 0.00 0.00 -1.00 0.00 0.00 55.73 55.20 2ech s ARG 24 Cb 0.25 -4.16 0.00 0.00 0.00 0.00 0.00 34.95 31.05 2ech s ARG 24 CO -0.08 -2.08 0.00 0.41 0.00 0.00 0.00 175.30 173.54 2ech n GLY 25 N 5.33 -2.36 0.22 8.12 0.00 -1.26 -4.99 105.19 110.25 2ech n GLY 25 Ca 0.04 0.77 -0.08 0.00 0.00 0.00 0.00 46.02 46.75 2ech n GLY 25 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2ech h ASP 26 N 0.00 -0.40 0.00 1.61 2.03 -2.03 -3.48 116.42 114.16 2ech h ASP 26 Ca 0.00 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.29 2ech h ASP 26 Cb 0.00 0.10 0.00 0.00 -0.83 0.00 0.00 39.33 38.60 2ech h ASP 26 CO 0.00 0.05 0.00 -0.90 -1.03 0.00 0.00 179.24 177.36 2ech n ASP 27 N -5.09 0.00 -3.65 4.15 5.68 -1.25 -5.17 116.55 111.22 2ech n ASP 27 Ca -0.06 0.00 -0.09 0.00 -0.50 0.00 0.00 54.79 54.14 2ech n ASP 27 Cb 0.20 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.10 2ech n ASP 27 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ech s MET 28 N 4.99 0.65 0.01 0.11 0.23 -1.19 -4.20 119.30 119.91 2ech s MET 28 Ca 0.00 1.07 0.00 0.00 -1.03 0.00 0.00 55.69 55.73 2ech s MET 28 Cb 0.00 0.15 0.00 0.00 -1.53 0.00 0.00 34.83 33.45 2ech s MET 28 CO 0.00 -0.14 0.00 -0.25 -2.03 0.00 0.00 175.02 172.60 2ech n ASP 29 N 3.97 -0.17 -3.43 -1.18 8.00 -1.26 -4.84 116.55 117.64 2ech n ASP 29 Ca -0.19 0.03 0.01 0.00 0.71 0.00 0.00 54.79 55.35 2ech n ASP 29 Cb 0.57 -0.10 -0.04 0.00 -0.02 0.00 0.00 41.12 41.53 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 -4.28 -0.64 0.19 -2.24 1.01 -0.41 -4.28 116.67 106.02 2ech s ASP 30 Ca 0.00 0.88 0.11 0.00 0.71 0.00 0.00 52.55 54.25 2ech s ASP 30 Cb 0.00 1.71 -0.04 0.00 1.01 0.00 0.00 42.92 45.60 2ech s ASP 30 CO 0.00 -0.12 -0.24 -0.31 0.21 0.00 0.00 175.17 174.71 2ech s TYR 31 N 2.47 2.29 -0.39 4.23 1.51 -1.24 -0.56 117.35 125.66 2ech s TYR 31 Ca -0.03 -0.36 -0.29 0.00 -1.01 0.00 0.00 57.07 55.38 2ech s TYR 31 Cb -0.07 -1.13 0.02 0.00 -0.11 0.00 0.00 41.96 40.67 2ech s TYR 31 CO -0.18 0.50 1.22 0.00 -1.11 0.00 0.00 175.55 175.98 2ech n ASN 33 N 7.81 3.74 0.00 0.00 0.23 -1.20 -2.17 115.26 123.68 2ech n ASN 33 Ca 0.14 -3.42 0.00 0.00 -0.53 0.00 0.00 54.58 50.76 2ech n ASN 33 Cb 0.48 -0.69 0.00 0.00 -2.08 0.00 0.00 39.78 37.49 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 -0.70 2.01 0.08 4.83 0.00 -1.26 -4.69 105.19 105.47 2ech n GLY 34 Ca 0.38 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.25 2ech n GLY 34 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ech h LYS 35 N 0.38 0.00 -3.29 1.61 1.79 -1.94 -3.46 116.57 111.66 2ech h LYS 35 Ca 0.00 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2ech h LYS 35 Cb 0.00 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.57 2ech h LYS 35 CO 0.00 0.95 0.06 -0.08 -1.08 0.00 0.00 179.45 179.30 2ech s THR 36 N -2.23 0.01 -0.41 -0.16 -1.32 -1.26 -5.07 115.64 105.19 2ech s THR 36 Ca -0.21 -1.00 0.08 0.00 -1.21 0.00 0.00 61.69 59.35 2ech s THR 36 Cb -0.01 -1.86 0.43 0.00 -1.51 0.00 0.00 72.50 69.55 2ech s THR 36 CO 0.63 -0.05 1.09 0.00 -2.21 0.00 0.00 174.62 174.08 2ech n ASP 38 N -0.42 7.49 -2.14 0.00 8.00 -1.26 -4.57 116.55 123.65 2ech n ASP 38 Ca 0.34 -3.73 0.00 0.00 0.71 0.00 0.00 54.79 52.11 2ech n ASP 38 Cb 0.71 -1.04 0.00 0.00 -0.02 0.00 0.00 41.12 40.77 2ech n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ech s PRO 40 N -1.69 1.26 -1.29 0.00 0.04 -1.24 -4.84 135.00 127.23 2ech s PRO 40 Ca 0.00 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.56 2ech s PRO 40 Cb 0.00 -1.82 0.14 0.00 0.04 0.00 0.00 34.50 32.86 2ech s PRO 40 CO 0.00 -2.19 1.82 -2.13 0.04 0.00 0.00 177.00 174.54 2ech n ARG 41 N -3.82 3.43 -2.11 4.56 3.00 -1.26 -3.65 116.66 116.80 2ech n ARG 41 Ca 0.07 -3.45 -0.03 0.00 -0.00 0.00 0.00 57.85 54.43 2ech n ARG 41 Cb 0.56 -3.04 0.00 0.00 0.00 0.00 0.00 32.46 29.99 2ech n ARG 41 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2ech n ASN 42 N 4.87 -3.70 -4.45 6.15 5.15 -1.26 -4.70 115.26 117.32 2ech n ASN 42 Ca 0.41 0.18 -0.11 0.00 -0.60 0.00 0.00 54.58 54.47 2ech n ASN 42 Cb 0.39 -0.91 -0.09 0.00 -0.53 0.00 0.00 39.78 38.63 2ech n ASN 42 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 2ech n PRO 43 N 0.80 0.12 -0.23 1.20 -0.02 -1.26 -4.79 135.00 130.82 2ech n PRO 43 Ca -0.01 -1.19 -0.04 0.00 -2.02 0.00 0.00 63.50 60.24 2ech n PRO 43 Cb 0.31 -3.20 0.07 0.00 -0.02 0.00 0.00 33.50 30.65 2ech n PRO 43 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2ech h HIS 44 N 11.22 0.77 -1.95 6.00 3.86 -1.90 -1.49 115.15 131.67 2ech h HIS 44 Ca 0.00 0.02 -0.49 0.00 -1.16 0.00 0.00 60.37 58.74 2ech h HIS 44 Cb 1.00 -0.25 -0.04 0.00 1.06 0.00 0.00 27.41 29.18 2ech h HIS 44 CO 1.17 0.45 1.32 0.15 0.86 0.00 0.00 177.93 181.88 2ech s LYS 45 N -6.13 2.64 -0.18 2.45 3.01 -1.26 -2.27 119.74 118.02 2ech s LYS 45 Ca -0.13 0.54 -0.06 0.00 -1.01 0.00 0.00 55.97 55.31 2ech s LYS 45 Cb 0.15 -4.41 0.01 0.00 -1.01 0.00 0.00 37.83 32.57 2ech s LYS 45 CO 0.76 -2.74 0.24 0.41 0.51 0.00 0.00 175.35 174.54 2ech n GLY 46 N 5.73 -0.93 3.63 -3.33 0.00 -1.26 -4.83 105.19 104.20 2ech n GLY 46 Ca 0.20 0.42 -0.57 0.00 0.00 0.00 0.00 46.02 46.08 2ech n GLY 46 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ech n PRO 47 N -0.46 0.80 0.00 1.61 -0.02 -0.96 -1.59 135.00 134.37 2ech n PRO 47 Ca 0.05 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 2ech n PRO 47 Cb 0.20 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 2ech n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ech n ALA 48 N 3.38 0.00 1.60 3.55 0.00 -0.56 -4.97 120.51 123.51 2ech n ALA 48 Ca 0.23 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.79 2ech n ALA 48 Cb 0.12 0.00 0.76 0.00 0.00 0.00 0.00 19.45 20.33 2ech n ALA 48 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91