#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ro3 n GLU 3 N 0.00 0.94 0.00 0.00 4.07 -1.26 -4.77 120.64 119.61 1ro3 n GLU 3 Ca 0.00 -1.98 0.00 0.00 -0.06 0.00 0.00 57.16 55.12 1ro3 n GLU 3 Cb 0.00 -1.20 0.00 0.00 -0.06 0.00 0.00 31.44 30.18 1ro3 n GLU 3 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1ro3 n SER 4 N 0.77 0.00 -3.64 4.31 2.88 -1.26 -5.13 113.62 111.55 1ro3 n SER 4 Ca 0.08 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.54 1ro3 n SER 4 Cb 0.67 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 64.06 1ro3 n SER 4 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1ro3 s GLY 5 N -1.33 -0.16 0.74 0.46 0.00 -1.26 -4.42 107.32 101.36 1ro3 s GLY 5 Ca 0.00 2.70 -0.11 0.00 0.00 0.00 0.00 44.72 47.30 1ro3 s GLY 5 CO 0.00 1.90 1.08 2.56 0.00 0.00 0.00 173.10 178.63 1ro3 s PRO 6 N 0.33 2.53 0.00 2.90 0.04 -1.18 0.38 135.00 139.99 1ro3 s PRO 6 Ca 0.02 0.80 0.00 0.00 0.04 0.00 0.00 61.00 61.86 1ro3 s PRO 6 Cb -0.05 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.54 1ro3 s PRO 6 CO -0.07 -1.35 0.00 0.00 0.04 0.00 0.00 177.00 175.62 1ro3 n ARG 9 N 0.00 0.00 0.00 0.00 1.85 -1.23 -2.23 116.66 115.05 1ro3 n ARG 9 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1ro3 n ARG 9 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1ro3 n ARG 9 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 1ro3 n ASN 10 N -3.27 1.10 0.00 2.89 0.23 -1.24 -4.24 115.26 110.72 1ro3 n ASN 10 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1ro3 n ASN 10 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1ro3 n ASN 10 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ro3 n LYS 12 N 0.00 0.31 0.00 0.00 2.85 -1.26 -4.95 118.16 115.12 1ro3 n LYS 12 Ca 0.00 -1.33 0.00 0.00 -1.05 0.00 0.00 58.31 55.93 1ro3 n LYS 12 Cb 0.00 -0.62 0.00 0.00 -0.65 0.00 0.00 35.03 33.76 1ro3 n LYS 12 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1ro3 n PHE 13 N 2.61 0.00 0.00 5.58 7.35 -0.95 -4.39 117.46 127.66 1ro3 n PHE 13 Ca 0.13 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.82 1ro3 n PHE 13 Cb 0.62 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.45 1ro3 n PHE 13 CO 0.00 0.00 0.00 1.47 -0.76 0.00 0.00 176.76 177.47 1ro3 n LEU 14 N 0.00 0.00 -2.75 -2.13 -0.00 -1.26 -4.81 117.00 106.05 1ro3 n LEU 14 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 55.92 1ro3 n LEU 14 Cb 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 43.42 43.50 1ro3 n LEU 14 CO 0.00 0.00 0.25 2.29 -0.00 0.00 0.00 177.39 179.93 1ro3 n LYS 15 N 0.00 1.12 -2.02 1.47 2.85 -1.26 -5.05 118.16 115.27 1ro3 n LYS 15 Ca 0.00 -2.34 -0.00 0.00 -1.05 0.00 0.00 58.31 54.92 1ro3 n LYS 15 Cb 0.00 -0.72 0.00 0.00 -0.65 0.00 0.00 35.03 33.66 1ro3 n LYS 15 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1ro3 n GLU 16 N -0.16 -0.14 0.00 -1.58 1.02 -1.26 -4.81 120.64 113.71 1ro3 n GLU 16 Ca 0.05 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 57.62 1ro3 n GLU 16 Cb 0.79 -0.55 0.00 0.00 -0.02 0.00 0.00 31.44 31.66 1ro3 n GLU 16 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ro3 n GLY 17 N 0.95 -0.22 2.30 0.62 0.00 -1.26 -5.05 105.19 102.53 1ro3 n GLY 17 Ca -0.00 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 1ro3 n GLY 17 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ro3 n THR 18 N 0.00 -0.71 -1.22 2.61 -1.04 -1.26 -4.78 114.28 107.87 1ro3 n THR 18 Ca 0.00 -3.56 -0.38 0.00 -2.04 0.00 0.00 64.05 58.08 1ro3 n THR 18 Cb 0.00 -1.47 0.03 0.00 -1.82 0.00 0.00 70.33 67.08 1ro3 n THR 18 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ro3 n ILE 19 N 1.76 0.64 -0.06 12.58 0.00 -0.98 0.25 119.36 133.54 1ro3 n ILE 19 Ca 0.21 -0.47 -0.07 0.00 0.00 0.00 0.00 62.75 62.42 1ro3 n ILE 19 Cb 0.53 -0.25 -0.07 0.00 0.00 0.00 0.00 39.64 39.86 1ro3 n ILE 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ro3 s LYS 21 N -1.91 0.83 -0.67 0.00 -0.14 -1.26 -4.65 119.74 111.94 1ro3 s LYS 21 Ca -0.10 -1.10 -0.22 0.00 -1.36 0.00 0.00 55.97 53.19 1ro3 s LYS 21 Cb -0.02 -0.59 0.07 0.00 -1.68 0.00 0.00 37.83 35.62 1ro3 s LYS 21 CO 0.37 0.10 0.97 0.50 -0.76 0.00 0.00 175.35 176.53 1ro3 s ARG 22 N -2.52 3.12 0.00 1.68 6.06 -1.26 -4.44 118.95 121.60 1ro3 s ARG 22 Ca 0.03 -0.86 0.00 0.00 -2.50 0.00 0.00 55.73 52.40 1ro3 s ARG 22 Cb -0.05 -4.25 0.00 0.00 0.06 0.00 0.00 34.95 30.71 1ro3 s ARG 22 CO 0.01 -1.82 0.00 0.00 -2.50 0.00 0.00 175.30 170.99 1ro3 n ALA 23 N 7.69 0.00 -0.09 6.12 0.00 -1.26 -4.78 120.51 128.20 1ro3 n ALA 23 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.32 1ro3 n ALA 23 Cb 0.46 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.88 1ro3 n ALA 23 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1ro3 h ARG 24 N 0.00 -0.30 0.00 0.00 -0.00 -1.86 -3.40 114.38 108.81 1ro3 h ARG 24 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 59.98 60.00 1ro3 h ARG 24 Cb 0.00 0.07 0.00 0.00 -0.00 0.00 0.00 29.97 30.04 1ro3 h ARG 24 CO 0.00 -0.20 0.00 0.41 -0.00 0.00 0.00 179.97 180.18 1ro3 n GLY 25 N -1.42 0.61 0.00 0.08 0.00 -1.26 -4.77 105.19 98.43 1ro3 n GLY 25 Ca -0.01 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.63 1ro3 n GLY 25 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ro3 n ASP 26 N 0.00 0.00 -4.95 1.61 2.03 -1.26 -4.92 116.55 109.06 1ro3 n ASP 26 Ca 0.00 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.07 1ro3 n ASP 26 Cb 0.00 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.42 1ro3 n ASP 26 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1ro3 s ASP 27 N 0.00 5.76 0.00 1.67 2.15 -1.26 -4.78 116.67 120.21 1ro3 s ASP 27 Ca 0.00 0.37 0.00 0.00 0.43 0.00 0.00 52.55 53.35 1ro3 s ASP 27 Cb 0.00 -1.55 0.00 0.00 -0.30 0.00 0.00 42.92 41.07 1ro3 s ASP 27 CO 0.00 -0.79 0.00 0.23 -0.17 0.00 0.00 175.17 174.44 1ro3 n MET 28 N -2.20 0.00 0.00 4.34 2.81 -1.24 -4.81 117.12 116.01 1ro3 n MET 28 Ca 0.02 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 1ro3 n MET 28 Cb 0.58 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.09 1ro3 n MET 28 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1ro3 n ASP 29 N 0.00 0.00 -3.64 7.83 -0.08 0.33 -4.80 116.55 116.19 1ro3 n ASP 29 Ca 0.00 0.00 -0.03 0.00 -1.51 0.00 0.00 54.79 53.25 1ro3 n ASP 29 Cb 0.00 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.40 1ro3 n ASP 29 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 1ro3 s ASP 30 N 1.85 -0.86 0.49 1.67 1.01 0.43 -3.05 116.67 118.21 1ro3 s ASP 30 Ca 0.00 1.37 0.02 0.00 0.71 0.00 0.00 52.55 54.65 1ro3 s ASP 30 Cb 0.00 2.00 -0.02 0.00 1.01 0.00 0.00 42.92 45.91 1ro3 s ASP 30 CO 0.00 -0.23 0.03 -0.72 0.21 0.00 0.00 175.17 174.46 1ro3 s TYR 31 N 2.81 1.85 -0.49 4.23 1.13 0.69 -4.11 117.35 123.46 1ro3 s TYR 31 Ca -0.04 -1.02 -0.19 0.00 -1.41 0.00 0.00 57.07 54.41 1ro3 s TYR 31 Cb -0.12 -1.52 0.05 0.00 -1.10 0.00 0.00 41.96 39.27 1ro3 s TYR 31 CO -0.17 0.12 0.60 0.00 -2.51 0.00 0.00 175.55 173.59 1ro3 n ASN 33 N 6.08 2.74 0.00 0.00 5.15 -1.22 -4.62 115.26 123.40 1ro3 n ASN 33 Ca -0.06 -2.12 0.00 0.00 -0.60 0.00 0.00 54.58 51.80 1ro3 n ASN 33 Cb 0.46 -0.37 0.00 0.00 -0.53 0.00 0.00 39.78 39.34 1ro3 n ASN 33 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ro3 n GLY 34 N 1.05 2.67 0.09 8.20 0.00 -1.26 -4.78 105.19 111.16 1ro3 n GLY 34 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 1ro3 n GLY 34 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ro3 n LYS 35 N -2.00 0.51 -3.58 1.61 3.00 -1.26 -4.68 118.16 111.76 1ro3 n LYS 35 Ca 0.00 0.36 -0.11 0.00 -0.00 0.00 0.00 58.31 58.56 1ro3 n LYS 35 Cb 0.00 -1.56 -0.03 0.00 0.00 0.00 0.00 35.03 33.45 1ro3 n LYS 35 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1ro3 s THR 36 N -2.58 0.02 -0.72 3.15 -4.23 -1.26 -3.91 115.64 106.09 1ro3 s THR 36 Ca -0.25 -0.39 -0.02 0.00 -1.18 0.00 0.00 61.69 59.84 1ro3 s THR 36 Cb 0.05 -1.29 0.28 0.00 1.34 0.00 0.00 72.50 72.88 1ro3 s THR 36 CO 0.38 -0.07 2.23 0.00 -0.54 0.00 0.00 174.62 176.62 1ro3 n ASP 38 N -0.17 3.63 -0.01 0.00 4.64 -1.26 -3.52 116.55 119.87 1ro3 n ASP 38 Ca 0.53 -1.99 0.00 0.00 -1.38 0.00 0.00 54.79 51.94 1ro3 n ASP 38 Cb 0.35 -0.35 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 1ro3 n ASP 38 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1ro3 n PRO 40 N -0.92 2.26 -2.22 0.00 -0.04 -1.15 0.32 135.00 133.25 1ro3 n PRO 40 Ca 0.00 -2.11 0.01 0.00 -0.04 0.00 0.00 63.50 61.37 1ro3 n PRO 40 Cb 0.09 -2.99 0.04 0.00 -0.04 0.00 0.00 33.50 30.60 1ro3 n PRO 40 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1ro3 n ARG 41 N 6.03 0.95 -2.81 0.54 3.00 -1.26 -3.38 116.66 119.73 1ro3 n ARG 41 Ca 0.52 -2.70 -0.36 0.00 -0.00 0.00 0.00 57.85 55.32 1ro3 n ARG 41 Cb 0.35 -0.79 -0.01 0.00 0.00 0.00 0.00 32.46 32.02 1ro3 n ARG 41 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1ro3 n ASN 42 N -0.18 6.13 -0.73 6.15 2.04 -1.26 -2.32 115.26 125.08 1ro3 n ASN 42 Ca 0.04 -3.66 0.00 0.00 -0.44 0.00 0.00 54.58 50.52 1ro3 n ASN 42 Cb 0.94 -0.94 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 1ro3 n ASN 42 CO 0.00 0.00 0.00 -0.81 -0.44 0.00 0.00 177.26 176.01 1ro3 n PRO 43 N 0.02 0.75 0.00 -0.53 -0.04 -1.26 -1.29 135.00 132.65 1ro3 n PRO 43 Ca 0.39 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.85 1ro3 n PRO 43 Cb 0.32 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 1ro3 n PRO 43 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1ro3 n HIS 44 N 0.36 0.00 0.00 0.54 8.25 -1.26 -4.76 115.22 118.35 1ro3 n HIS 44 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1ro3 n HIS 44 Cb 0.27 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.38 1ro3 n HIS 44 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1ro3 n LYS 45 N 0.00 0.00 0.00 -0.41 4.76 -1.26 -4.14 118.16 117.10 1ro3 n LYS 45 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1ro3 n LYS 45 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1ro3 n LYS 45 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ro3 n GLY 46 N -0.84 0.00 0.00 0.72 0.00 -1.26 -4.77 105.19 99.04 1ro3 n GLY 46 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ro3 n GLY 46 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ro3 n PRO 47 N 0.00 0.00 -0.14 1.61 -0.04 -1.15 -5.08 135.00 130.20 1ro3 n PRO 47 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1ro3 n PRO 47 Cb 0.00 -0.03 0.00 0.00 -0.04 0.00 0.00 33.50 33.43 1ro3 n PRO 47 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ro3 n ALA 48 N -3.00 -2.03 -0.38 0.55 0.00 -0.41 -4.99 120.51 110.26 1ro3 n ALA 48 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1ro3 n ALA 48 Cb 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1ro3 n ALA 48 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91