#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1omt n ALA 2 N 0.00 -2.66 -3.33 1.96 0.00 -1.26 -4.92 120.51 110.30 1omt n ALA 2 Ca 0.00 0.34 -0.47 0.00 0.00 0.00 0.00 53.44 53.31 1omt n ALA 2 Cb 0.00 -2.15 -0.02 0.00 0.00 0.00 0.00 19.45 17.28 1omt n ALA 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1omt s ALA 3 N -2.85 4.02 -0.50 0.00 0.00 -1.26 -4.92 121.76 116.24 1omt s ALA 3 Ca 0.08 -3.20 0.06 0.00 0.00 0.00 0.00 51.96 48.90 1omt s ALA 3 Cb -0.02 -3.48 0.20 0.00 0.00 0.00 0.00 23.12 19.82 1omt s ALA 3 CO 0.77 -2.24 0.48 0.28 0.00 0.00 0.00 175.76 175.05 1omt n VAL 4 N 4.17 0.03 -3.51 0.00 0.31 -1.26 -5.08 118.33 112.98 1omt n VAL 4 Ca 0.09 -4.14 -0.14 0.00 -0.01 0.00 0.00 64.34 60.15 1omt n VAL 4 Cb 0.46 -1.91 -0.04 0.00 -0.91 0.00 0.00 33.84 31.44 1omt n VAL 4 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1omt s SER 5 N -0.95 -0.51 -0.00 4.52 0.15 -1.26 -5.10 113.70 110.55 1omt s SER 5 Ca 0.33 0.18 0.05 0.00 0.70 0.00 0.00 55.95 57.21 1omt s SER 5 Cb 0.07 0.54 -0.03 0.00 -1.71 0.00 0.00 66.02 64.89 1omt s SER 5 CO -0.14 -0.80 -0.15 -0.69 1.20 0.00 0.00 173.24 172.66 1omt s VAL 6 N -2.78 3.03 -0.22 4.45 1.01 -1.26 -5.10 120.40 119.53 1omt s VAL 6 Ca -0.03 -0.93 -0.13 0.00 0.00 0.00 0.00 61.98 60.88 1omt s VAL 6 Cb -0.00 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 1omt s VAL 6 CO -0.04 0.45 0.29 -0.62 0.00 0.00 0.00 175.10 175.18 1omt s ASP 7 N -1.14 6.28 -0.32 3.32 -1.08 -1.26 -4.97 116.67 117.50 1omt s ASP 7 Ca 0.14 0.31 0.16 0.00 -0.52 0.00 0.00 52.55 52.64 1omt s ASP 7 Cb -0.11 -2.17 0.46 0.00 -1.46 0.00 0.00 42.92 39.65 1omt s ASP 7 CO 0.04 -0.02 1.03 0.00 0.52 0.00 0.00 175.17 176.74 1omt n SER 9 N -0.31 1.32 -1.55 0.00 2.88 -1.26 -3.86 113.62 110.85 1omt n SER 9 Ca 0.16 -1.38 -0.14 0.00 -1.33 0.00 0.00 58.87 56.18 1omt n SER 9 Cb 0.80 0.01 0.10 0.00 -0.75 0.00 0.00 64.21 64.37 1omt n SER 9 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1omt n GLU 10 N -0.02 2.79 -4.42 -1.46 4.71 -1.26 -5.02 120.64 115.96 1omt n GLU 10 Ca 0.18 -3.76 -0.24 0.00 -0.01 0.00 0.00 57.16 53.33 1omt n GLU 10 Cb 0.34 -2.04 -0.11 0.00 -1.01 0.00 0.00 31.44 28.61 1omt n GLU 10 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1omt s TYR 11 N -3.48 2.16 0.86 -0.32 1.51 -1.25 -4.20 117.35 112.64 1omt s TYR 11 Ca 0.48 -0.39 -0.12 0.00 -1.01 0.00 0.00 57.07 56.03 1omt s TYR 11 Cb 0.41 -1.01 0.11 0.00 -0.11 0.00 0.00 41.96 41.35 1omt s TYR 11 CO 0.00 0.54 1.12 -1.25 -1.11 0.00 0.00 175.55 174.85 1omt s PRO 12 N -3.10 1.53 0.01 -1.71 0.04 -1.26 -4.89 135.00 125.62 1omt s PRO 12 Ca 0.23 0.42 0.06 0.00 0.04 0.00 0.00 61.00 61.76 1omt s PRO 12 Cb -0.06 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.58 1omt s PRO 12 CO 0.11 -1.95 -0.19 0.15 0.04 0.00 0.00 177.00 175.16 1omt s LYS 13 N -5.24 2.19 0.00 4.56 1.02 -1.26 -4.99 119.74 116.02 1omt s LYS 13 Ca 0.63 -0.90 0.00 0.00 0.02 0.00 0.00 55.97 55.72 1omt s LYS 13 Cb -0.14 -2.21 0.00 0.00 -0.52 0.00 0.00 37.83 34.95 1omt s LYS 13 CO 0.53 0.57 0.82 -0.35 -0.92 0.00 0.00 175.35 176.00 1omt n PRO 14 N 1.90 0.94 -3.15 -1.68 -0.04 -1.26 -4.53 135.00 127.17 1omt n PRO 14 Ca -0.16 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.35 1omt n PRO 14 Cb 0.52 -1.12 -0.02 0.00 -0.04 0.00 0.00 33.50 32.85 1omt n PRO 14 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1omt s ALA 15 N -1.75 -3.22 -0.02 0.55 0.00 -1.26 -5.15 121.76 110.90 1omt s ALA 15 Ca 0.00 1.51 -0.12 0.00 0.00 0.00 0.00 51.96 53.35 1omt s ALA 15 Cb 0.00 -2.44 -0.05 0.00 0.00 0.00 0.00 23.12 20.63 1omt s ALA 15 CO 0.00 -1.43 0.34 0.00 0.00 0.00 0.00 175.76 174.66 1omt n THR 17 N 1.76 0.00 0.00 0.00 -2.24 -1.26 -4.98 114.28 107.56 1omt n THR 17 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1omt n THR 17 Cb 0.53 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 1omt n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1omt n LEU 18 N 0.00 0.00 -4.55 3.22 -0.00 -1.26 -5.02 117.00 109.39 1omt n LEU 18 Ca 0.02 0.00 -0.50 0.00 -0.00 0.00 0.00 56.01 55.53 1omt n LEU 18 Cb 0.08 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.46 1omt n LEU 18 CO 0.05 0.00 0.60 -1.84 -0.00 0.00 0.00 177.39 176.20 1omt n GLU 19 N -1.05 0.88 -3.07 1.47 0.00 -1.26 -4.85 120.64 112.76 1omt n GLU 19 Ca 0.00 0.31 -0.40 0.00 0.00 0.00 0.00 57.16 57.07 1omt n GLU 19 Cb 0.12 -1.74 -0.05 0.00 0.00 0.00 0.00 31.44 29.76 1omt n GLU 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.13 176.66 1omt s TYR 20 N -0.31 3.47 -0.48 -1.84 5.04 -1.26 -4.80 117.35 117.17 1omt s TYR 20 Ca 0.74 1.10 0.06 0.00 -2.44 0.00 0.00 57.07 56.53 1omt s TYR 20 Cb -0.91 -2.82 0.19 0.00 0.35 0.00 0.00 41.96 38.77 1omt s TYR 20 CO 0.54 -0.06 0.75 1.03 -1.34 0.00 0.00 175.55 176.46 1omt s ARG 21 N 1.43 0.95 0.07 4.97 0.52 -1.06 -5.05 118.95 120.78 1omt s ARG 21 Ca 0.33 -0.83 -0.31 0.00 -0.52 0.00 0.00 55.73 54.40 1omt s ARG 21 Cb -0.17 -0.02 -0.08 0.00 0.52 0.00 0.00 34.95 35.21 1omt s ARG 21 CO 0.14 -1.20 1.60 -1.25 0.02 0.00 0.00 175.30 174.61 1omt s PRO 22 N 1.08 4.21 -0.09 3.54 0.04 -1.13 -3.72 135.00 138.93 1omt s PRO 22 Ca 0.27 2.28 -0.00 0.00 0.04 0.00 0.00 61.00 63.58 1omt s PRO 22 Cb 0.00 -3.55 -0.03 0.00 0.04 0.00 0.00 34.50 30.96 1omt s PRO 22 CO -0.06 -0.69 -0.06 -0.51 0.04 0.00 0.00 177.00 175.71 1omt s LEU 23 N 2.45 3.18 -0.24 -3.56 1.43 -1.03 0.30 118.68 121.21 1omt s LEU 23 Ca 0.72 -0.06 -0.09 0.00 -1.03 0.00 0.00 54.13 53.68 1omt s LEU 23 Cb -0.39 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1omt s LEU 23 CO 0.31 0.30 0.11 0.00 0.23 0.00 0.00 176.35 177.30 1omt n GLY 25 N 4.58 -3.29 0.09 0.00 0.00 -0.87 -1.13 105.19 104.57 1omt n GLY 25 Ca -0.16 -1.27 -0.01 0.00 0.00 0.00 0.00 46.02 44.59 1omt n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1omt n SER 26 N -1.84 0.86 0.00 1.61 3.41 0.99 -2.96 113.62 115.69 1omt n SER 26 Ca 0.00 0.38 0.15 0.00 -0.26 0.00 0.00 58.87 59.14 1omt n SER 26 Cb 0.00 0.15 0.84 0.00 -0.26 0.00 0.00 64.21 64.94 1omt n SER 26 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1omt n ASP 27 N -2.90 0.00 -0.73 4.04 5.75 -1.26 -4.88 116.55 116.58 1omt n ASP 27 Ca -0.10 -0.63 0.00 0.00 -0.01 0.00 0.00 54.79 54.05 1omt n ASP 27 Cb 0.85 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.83 1omt n ASP 27 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1omt n ASN 28 N -1.11 -1.70 -4.06 -1.12 4.13 -1.24 -5.06 115.26 105.10 1omt n ASN 28 Ca 0.19 0.00 -0.32 0.00 1.68 0.00 0.00 54.58 56.14 1omt n ASN 28 Cb 0.16 -0.43 -0.16 0.00 -1.54 0.00 0.00 39.78 37.81 1omt n ASN 28 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 1omt s LYS 29 N -3.54 2.45 0.54 3.52 -2.85 -1.26 -4.91 119.74 113.69 1omt s LYS 29 Ca 0.00 -0.91 -0.17 0.00 -1.00 0.00 0.00 55.97 53.89 1omt s LYS 29 Cb 0.00 -2.53 -0.06 0.00 -2.06 0.00 0.00 37.83 33.18 1omt s LYS 29 CO 0.00 -0.35 1.04 0.99 0.10 0.00 0.00 175.35 177.12 1omt s THR 30 N 1.31 3.92 0.05 3.79 2.01 -1.26 -2.05 115.64 123.41 1omt s THR 30 Ca 0.00 1.00 0.04 0.00 0.31 0.00 0.00 61.69 63.05 1omt s THR 30 Cb -0.15 -3.46 -0.02 0.00 0.01 0.00 0.00 72.50 68.88 1omt s THR 30 CO -0.10 -0.44 -0.13 -0.31 -0.69 0.00 0.00 174.62 172.95 1omt s TYR 31 N -2.32 1.11 0.32 4.92 2.02 -0.57 -4.95 117.35 117.88 1omt s TYR 31 Ca 0.64 -0.41 0.01 0.00 -0.37 0.00 0.00 57.07 56.94 1omt s TYR 31 Cb -0.15 -0.64 0.56 0.00 -0.40 0.00 0.00 41.96 41.32 1omt s TYR 31 CO 0.30 0.03 1.96 0.78 -1.57 0.00 0.00 175.55 177.05 1omt h GLY 32 N 4.62 1.12 0.00 0.71 0.00 -1.88 -2.74 103.07 104.90 1omt h GLY 32 Ca -0.39 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.56 1omt h GLY 32 CO 0.42 0.34 0.00 1.16 0.00 0.00 0.00 176.54 178.46 1omt n ASN 33 N -4.45 0.00 0.30 0.19 6.94 -1.24 -2.57 115.26 114.43 1omt n ASN 33 Ca 0.10 -0.58 0.17 0.00 -0.02 0.00 0.00 54.58 54.25 1omt n ASN 33 Cb 0.11 0.00 0.94 0.00 -2.36 0.00 0.00 39.78 38.47 1omt n ASN 33 CO 0.00 0.00 0.00 0.07 -1.03 0.00 0.00 177.26 176.30 1omt h LYS 34 N 0.00 0.00 0.10 -3.83 2.10 -1.90 -0.52 116.57 112.52 1omt h LYS 34 Ca 0.00 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.48 1omt h LYS 34 Cb 0.00 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.34 1omt h LYS 34 CO 0.00 0.03 -0.82 0.00 -2.00 0.00 0.00 179.45 176.66 1omt h ASN 36 N -0.51 0.00 0.12 0.00 -0.26 -1.85 -0.09 115.58 112.99 1omt h ASN 36 Ca -0.16 0.00 -0.19 0.00 -0.56 0.00 0.00 56.30 55.39 1omt h ASN 36 Cb 1.53 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 38.80 1omt h ASN 36 CO 0.08 0.26 -0.89 0.15 -1.06 0.00 0.00 177.43 175.97 1omt h PHE 37 N 0.00 0.45 0.00 1.19 3.57 -1.16 -3.23 116.94 117.76 1omt h PHE 37 Ca -0.00 -0.33 -0.04 0.00 3.53 0.00 0.00 57.97 61.13 1omt h PHE 37 Cb 0.52 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 1omt h PHE 37 CO 0.00 1.35 -0.20 0.00 -2.23 0.00 0.00 178.31 177.22 1omt h ASN 39 N 0.00 0.47 1.53 0.00 2.35 -1.09 0.41 115.58 119.25 1omt h ASN 39 Ca -0.00 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.52 1omt h ASN 39 Cb 0.45 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 1omt h ASN 39 CO 0.03 0.87 -0.03 0.00 -1.65 0.00 0.00 177.43 176.65 1omt h ALA 40 N 1.14 0.99 0.08 -0.83 0.00 -1.33 -0.65 119.26 118.67 1omt h ALA 40 Ca 0.02 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.62 1omt h ALA 40 Cb 0.96 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1omt h ALA 40 CO 0.08 0.03 -1.49 0.28 0.00 0.00 0.00 179.25 178.16 1omt h VAL 41 N 0.00 1.18 0.00 0.00 2.07 -0.47 -2.89 116.25 116.14 1omt h VAL 41 Ca -0.00 -2.86 0.00 0.00 0.82 0.00 0.00 66.70 64.66 1omt h VAL 41 Cb 0.80 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 33.28 1omt h VAL 41 CO 0.00 0.79 -0.89 0.55 0.02 0.00 0.00 177.57 178.05 1omt n VAL 42 N -3.38 0.36 0.10 2.57 3.14 0.06 0.13 118.33 121.31 1omt n VAL 42 Ca -0.14 -0.34 0.11 0.00 -2.96 0.00 0.00 64.34 61.01 1omt n VAL 42 Cb 1.03 -0.08 -0.02 0.00 -1.06 0.00 0.00 33.84 33.71 1omt n VAL 42 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1omt n GLU 43 N -2.22 0.60 -1.01 1.45 0.00 -0.26 -3.82 120.64 115.38 1omt n GLU 43 Ca 0.02 0.07 -0.03 0.00 0.00 0.00 0.00 57.16 57.21 1omt n GLU 43 Cb 0.47 -1.77 0.33 0.00 0.00 0.00 0.00 31.44 30.47 1omt n GLU 43 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 1omt n SER 44 N -2.59 5.06 -0.19 4.31 3.41 -1.09 -4.86 113.62 117.67 1omt n SER 44 Ca -0.01 -3.17 -0.03 0.00 -0.26 0.00 0.00 58.87 55.41 1omt n SER 44 Cb 0.55 -0.74 -0.01 0.00 -0.26 0.00 0.00 64.21 63.75 1omt n SER 44 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1omt n ASN 45 N 0.01 -5.04 -0.15 4.04 5.03 -1.25 -1.56 115.26 116.35 1omt n ASN 45 Ca 0.39 0.06 -0.02 0.00 0.87 0.00 0.00 54.58 55.88 1omt n ASN 45 Cb 1.36 -2.76 -0.01 0.00 -1.02 0.00 0.00 39.78 37.35 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1omt n GLY 46 N -0.37 0.53 0.04 7.41 0.00 0.35 -4.90 105.19 108.25 1omt n GLY 46 Ca -0.03 -0.97 0.13 0.00 0.00 0.00 0.00 46.02 45.16 1omt n GLY 46 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1omt n THR 47 N -2.94 0.24 -2.78 2.61 -2.24 -0.60 -4.81 114.28 103.76 1omt n THR 47 Ca -0.02 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.21 1omt n THR 47 Cb 0.06 -0.25 -0.05 0.00 -2.10 0.00 0.00 70.33 68.00 1omt n THR 47 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1omt s LEU 48 N -3.69 4.54 -0.06 3.22 2.96 -1.26 -5.03 118.68 119.35 1omt s LEU 48 Ca 0.10 1.79 -0.01 0.00 -0.22 0.00 0.00 54.13 55.80 1omt s LEU 48 Cb 0.16 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.33 1omt s LEU 48 CO 0.64 0.02 -0.01 0.42 -1.32 0.00 0.00 176.35 176.09 1omt s THR 49 N -0.40 0.42 0.57 3.68 -4.23 -1.26 -4.89 115.64 109.53 1omt s THR 49 Ca 0.44 0.04 -0.17 0.00 -1.18 0.00 0.00 61.69 60.82 1omt s THR 49 Cb -0.24 -0.53 -0.04 0.00 1.34 0.00 0.00 72.50 73.03 1omt s THR 49 CO 0.30 0.24 1.07 -0.22 -0.54 0.00 0.00 174.62 175.47 1omt s LEU 50 N 1.59 3.59 -0.07 4.79 0.20 -1.26 0.33 118.68 127.86 1omt s LEU 50 Ca -0.01 1.93 0.15 0.00 0.69 0.00 0.00 54.13 56.89 1omt s LEU 50 Cb -0.13 -4.55 -0.22 0.00 -0.43 0.00 0.00 46.19 40.86 1omt s LEU 50 CO -0.04 -1.17 0.24 -0.24 -0.29 0.00 0.00 176.35 174.85 1omt n SER 51 N -1.76 1.37 -3.49 3.68 2.88 -0.29 -4.68 113.62 111.34 1omt n SER 51 Ca 0.10 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.54 1omt n SER 51 Cb 0.52 1.40 -0.02 0.00 -0.75 0.00 0.00 64.21 65.36 1omt n SER 51 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 1omt s HIS 52 N -2.82 -0.39 1.01 0.66 0.00 -1.25 -5.08 115.29 107.41 1omt s HIS 52 Ca -0.06 0.27 -0.16 0.00 -3.00 0.00 0.00 55.06 52.11 1omt s HIS 52 Cb 0.08 0.54 0.21 0.00 -4.00 0.00 0.00 32.58 29.40 1omt s HIS 52 CO 0.64 -0.60 1.23 -0.06 -1.00 0.00 0.00 174.74 174.95 1omt s PHE 53 N -3.13 1.51 0.00 0.38 0.40 -1.26 -2.38 117.98 113.51 1omt s PHE 53 Ca 0.03 0.47 0.00 0.00 -0.60 0.00 0.00 56.93 56.83 1omt s PHE 53 Cb -0.01 -3.80 0.00 0.00 0.51 0.00 0.00 43.02 39.72 1omt s PHE 53 CO -0.09 -2.89 0.00 0.41 0.70 0.00 0.00 175.22 173.35 1omt n GLY 54 N -2.76 -1.54 3.96 4.36 0.00 0.87 -4.63 105.19 105.44 1omt n GLY 54 Ca 0.13 -1.28 -0.23 0.00 0.00 0.00 0.00 46.02 44.65 1omt n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1omt s LYS 55 N 0.00 2.63 0.00 1.61 1.02 -1.23 -2.78 119.74 121.00 1omt s LYS 55 Ca 0.00 -0.58 0.22 0.00 0.02 0.00 0.00 55.97 55.63 1omt s LYS 55 Cb 0.00 -2.44 1.31 0.00 -0.52 0.00 0.00 37.83 36.18 1omt s LYS 55 CO 0.00 -0.70 1.68 0.00 -0.92 0.00 0.00 175.35 175.41