#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 -2.97 -3.28 1.96 0.00 -1.26 -5.14 120.51 109.82 1omt n ALA 2 Ca 0.00 -0.30 0.04 0.00 0.00 0.00 0.00 53.44 53.18 1omt n ALA 2 Cb 0.00 -1.40 -0.04 0.00 0.00 0.00 0.00 19.45 18.00 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 0.01 -3.18 -0.40 0.00 0.00 -1.26 -5.09 121.76 111.83 1omt s ALA 3 Ca 0.04 1.81 0.08 0.00 0.00 0.00 0.00 51.96 53.89 1omt s ALA 3 Cb 0.06 -2.24 0.26 0.00 0.00 0.00 0.00 23.12 21.20 1omt s ALA 3 CO -0.04 -0.82 0.60 1.33 0.00 0.00 0.00 175.76 176.83 1omt n VAL 4 N 4.17 -0.54 -3.29 0.00 0.24 -1.26 -5.00 118.33 112.65 1omt n VAL 4 Ca -0.09 -3.81 0.03 0.00 -2.04 0.00 0.00 64.34 58.43 1omt n VAL 4 Cb 0.56 -1.32 -0.04 0.00 -1.47 0.00 0.00 33.84 31.57 1omt n VAL 4 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1omt s SER 5 N -1.41 -0.34 0.35 -1.34 0.15 -1.26 -4.65 113.70 105.20 1omt s SER 5 Ca 0.35 0.45 -0.14 0.00 0.70 0.00 0.00 55.95 57.31 1omt s SER 5 Cb 0.20 1.38 -0.08 0.00 -1.71 0.00 0.00 66.02 65.81 1omt s SER 5 CO -0.12 -0.06 0.76 -0.69 1.20 0.00 0.00 173.24 174.33 1omt s VAL 6 N 2.30 4.70 -0.18 4.45 1.01 -1.26 -5.06 120.40 126.36 1omt s VAL 6 Ca -0.01 0.88 -0.09 0.00 0.00 0.00 0.00 61.98 62.76 1omt s VAL 6 Cb -0.04 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 1omt s VAL 6 CO -0.16 -0.30 0.11 -0.62 0.00 0.00 0.00 175.10 174.13 1omt s ASP 7 N -2.53 6.03 -0.54 3.32 2.15 -1.26 -5.01 116.67 118.83 1omt s ASP 7 Ca 0.54 0.21 0.06 0.00 0.43 0.00 0.00 52.55 53.78 1omt s ASP 7 Cb -0.10 -2.04 0.35 0.00 -0.30 0.00 0.00 42.92 40.83 1omt s ASP 7 CO 0.21 0.21 0.95 0.00 -0.17 0.00 0.00 175.17 176.37 1omt h SER 9 N 2.94 0.00 -0.01 0.00 0.87 -2.02 -3.13 113.55 112.20 1omt h SER 9 Ca 0.14 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1omt h SER 9 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 1omt h SER 9 CO 0.79 0.02 -0.18 -0.62 -0.53 0.00 0.00 176.83 176.31 1omt n GLU 10 N -2.52 1.79 -2.24 2.24 4.71 -1.26 -4.94 120.64 118.42 1omt n GLU 10 Ca 0.04 -1.43 -0.27 0.00 -0.01 0.00 0.00 57.16 55.49 1omt n GLU 10 Cb 0.47 -1.47 0.04 0.00 -1.01 0.00 0.00 31.44 29.47 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 -2.19 3.22 0.41 -0.32 1.51 -1.18 -4.48 117.35 114.32 1omt s TYR 11 Ca 0.26 0.72 -0.13 0.00 -1.01 0.00 0.00 57.07 56.90 1omt s TYR 11 Cb 0.19 -2.89 -0.07 0.00 -0.11 0.00 0.00 41.96 39.08 1omt s TYR 11 CO 0.41 -1.00 0.82 -1.25 -1.11 0.00 0.00 175.55 173.41 1omt s PRO 12 N -5.12 3.88 -0.08 -1.71 0.04 -1.26 -5.01 135.00 125.74 1omt s PRO 12 Ca 0.56 0.65 -0.04 0.00 0.04 0.00 0.00 61.00 62.20 1omt s PRO 12 Cb -0.11 -2.34 -0.04 0.00 0.04 0.00 0.00 34.50 32.06 1omt s PRO 12 CO 0.47 -0.04 0.09 0.15 0.04 0.00 0.00 177.00 177.70 1omt s LYS 13 N -3.67 3.23 -0.00 4.56 1.02 -1.26 -4.97 119.74 118.65 1omt s LYS 13 Ca 0.54 -0.29 0.00 0.00 0.02 0.00 0.00 55.97 56.24 1omt s LYS 13 Cb -0.10 -3.00 0.01 0.00 -0.52 0.00 0.00 37.83 34.21 1omt s LYS 13 CO 0.27 0.73 0.83 -0.35 -0.92 0.00 0.00 175.35 175.91 1omt n PRO 14 N 1.83 1.02 -3.25 -1.68 -0.04 -1.26 -4.58 135.00 127.05 1omt n PRO 14 Ca -0.18 -0.03 0.03 0.00 -0.04 0.00 0.00 63.50 63.29 1omt n PRO 14 Cb 0.54 -1.19 -0.02 0.00 -0.04 0.00 0.00 33.50 32.80 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 -1.64 -2.62 0.23 0.55 0.00 -1.26 -5.15 121.76 111.87 1omt s ALA 15 Ca 0.01 1.82 -0.23 0.00 0.00 0.00 0.00 51.96 53.56 1omt s ALA 15 Cb 0.00 -2.20 -0.09 0.00 0.00 0.00 0.00 23.12 20.84 1omt s ALA 15 CO 0.00 -1.27 0.79 0.00 0.00 0.00 0.00 175.76 175.29 1omt n THR 17 N 0.94 0.00 0.00 0.00 -2.24 -1.26 -4.98 114.28 106.73 1omt n THR 17 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1omt n THR 17 Cb 0.50 -0.10 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 0.41 -4.55 3.22 -0.00 -1.26 -5.03 117.00 109.78 1omt n LEU 18 Ca 0.01 0.00 -0.43 0.00 -0.00 0.00 0.00 56.01 55.59 1omt n LEU 18 Cb 0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.47 1omt n LEU 18 CO 0.04 0.07 0.42 -1.84 -0.00 0.00 0.00 177.39 176.08 1omt n GLU 19 N -1.70 1.07 -3.19 1.47 0.00 -1.26 -4.86 120.64 112.17 1omt n GLU 19 Ca 0.00 0.38 -0.39 0.00 0.00 0.00 0.00 57.16 57.15 1omt n GLU 19 Cb 0.36 -1.75 -0.06 0.00 0.00 0.00 0.00 31.44 29.99 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 -1.19 3.43 -0.49 -1.84 5.04 -1.26 -4.92 117.35 116.12 1omt s TYR 20 Ca 0.61 0.91 0.06 0.00 -2.44 0.00 0.00 57.07 56.21 1omt s TYR 20 Cb -0.66 -2.70 0.23 0.00 0.35 0.00 0.00 41.96 39.18 1omt s TYR 20 CO 0.59 -0.03 0.87 0.54 -1.34 0.00 0.00 175.55 176.18 1omt n ARG 21 N 4.46 0.71 -1.78 4.97 1.74 -1.22 -5.07 116.66 120.47 1omt n ARG 21 Ca -0.04 -1.74 -0.42 0.00 -0.77 0.00 0.00 57.85 54.88 1omt n ARG 21 Cb 0.51 -1.42 -0.03 0.00 -1.02 0.00 0.00 32.46 30.50 1omt n ARG 21 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1omt s PRO 22 N 0.71 4.14 -0.15 5.56 0.04 -0.79 -3.35 135.00 141.16 1omt s PRO 22 Ca 0.31 2.55 -0.00 0.00 0.04 0.00 0.00 61.00 63.90 1omt s PRO 22 Cb 0.19 -3.08 -0.01 0.00 0.04 0.00 0.00 34.50 31.64 1omt s PRO 22 CO -0.21 -0.70 -0.14 -0.51 0.04 0.00 0.00 177.00 175.49 1omt s LEU 23 N 0.88 2.58 0.11 -3.56 1.02 -0.91 0.34 118.68 119.14 1omt s LEU 23 Ca 0.72 -0.42 -0.30 0.00 0.02 0.00 0.00 54.13 54.15 1omt s LEU 23 Cb -0.48 -1.59 -0.06 0.00 0.02 0.00 0.00 46.19 44.08 1omt s LEU 23 CO 0.35 0.10 1.03 0.00 0.02 0.00 0.00 176.35 177.85 1omt n GLY 25 N 2.41 -0.95 0.03 0.00 0.00 -0.48 -2.16 105.19 104.04 1omt n GLY 25 Ca 0.04 -1.49 -0.02 0.00 0.00 0.00 0.00 46.02 44.54 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 0.00 0.64 -0.32 1.61 3.41 0.78 -1.62 113.62 118.12 1omt n SER 26 Ca 0.00 0.30 0.32 0.00 -0.26 0.00 0.00 58.87 59.23 1omt n SER 26 Cb 0.00 -0.62 0.59 0.00 -0.26 0.00 0.00 64.21 63.92 1omt n SER 26 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1omt h ASP 27 N -0.34 0.32 0.00 4.04 2.03 -1.97 -3.43 116.42 117.08 1omt h ASP 27 Ca 0.00 0.26 0.00 0.00 -0.73 0.00 0.00 57.03 56.56 1omt h ASP 27 Cb 0.22 0.27 0.00 0.00 -0.83 0.00 0.00 39.33 38.99 1omt h ASP 27 CO 0.00 -0.43 0.00 -0.46 -1.03 0.00 0.00 179.24 177.32 1omt n ASN 28 N -5.25 0.00 -4.27 4.15 0.23 -1.26 -5.12 115.26 103.74 1omt n ASN 28 Ca 0.38 0.00 -0.39 0.00 -0.53 0.00 0.00 54.58 54.04 1omt n ASN 28 Cb 1.28 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.86 1omt n ASN 28 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 1omt s LYS 29 N 0.00 2.58 0.63 -3.83 -2.85 -1.26 -4.87 119.74 110.13 1omt s LYS 29 Ca 0.00 -1.33 -0.17 0.00 -1.00 0.00 0.00 55.97 53.47 1omt s LYS 29 Cb 0.00 -3.61 -0.01 0.00 -2.06 0.00 0.00 37.83 32.15 1omt s LYS 29 CO 0.00 -0.81 1.17 0.99 0.10 0.00 0.00 175.35 176.80 1omt s THR 30 N 1.40 2.78 0.01 3.79 2.01 -1.26 -1.38 115.64 122.99 1omt s THR 30 Ca 0.01 0.43 0.05 0.00 0.31 0.00 0.00 61.69 62.49 1omt s THR 30 Cb -0.21 -3.06 -0.02 0.00 0.01 0.00 0.00 72.50 69.22 1omt s THR 30 CO 0.02 -0.16 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.34 1omt s TYR 31 N -1.89 1.24 0.43 4.92 2.02 -0.72 -4.85 117.35 118.51 1omt s TYR 31 Ca 0.74 -0.29 0.24 0.00 -0.37 0.00 0.00 57.07 57.39 1omt s TYR 31 Cb -0.27 -0.77 1.25 0.00 -0.40 0.00 0.00 41.96 41.78 1omt s TYR 31 CO 0.37 0.01 1.75 0.78 -1.57 0.00 0.00 175.55 176.89 1omt h GLY 32 N 5.38 0.99 0.00 0.71 0.00 -1.87 -2.42 103.07 105.86 1omt h GLY 32 Ca -0.36 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1omt h GLY 32 CO 0.46 -0.16 0.00 1.16 0.00 0.00 0.00 176.54 178.01 1omt n ASN 33 N -4.55 0.00 -0.20 0.19 0.23 -1.25 -1.89 115.26 107.78 1omt n ASN 33 Ca 0.28 0.00 -0.08 0.00 -0.53 0.00 0.00 54.58 54.25 1omt n ASN 33 Cb 1.05 0.00 0.02 0.00 -2.08 0.00 0.00 39.78 38.78 1omt n ASN 33 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 1omt h LYS 34 N 0.00 0.89 0.50 -3.83 2.10 -1.87 -0.38 116.57 113.98 1omt h LYS 34 Ca 0.00 -0.19 -0.02 0.00 -2.00 0.00 0.00 60.65 58.43 1omt h LYS 34 Cb 0.00 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 31.20 1omt h LYS 34 CO 0.00 0.80 -0.24 0.00 -2.00 0.00 0.00 179.45 178.01 1omt h ASN 36 N -1.01 0.49 0.10 0.00 -0.26 -1.92 -0.50 115.58 112.48 1omt h ASN 36 Ca -0.07 0.09 -0.00 0.00 -0.56 0.00 0.00 56.30 55.76 1omt h ASN 36 Cb 0.61 0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.88 1omt h ASN 36 CO 0.11 0.09 -0.05 0.15 -1.06 0.00 0.00 177.43 176.68 1omt h PHE 37 N 0.43 -0.12 0.48 1.19 3.57 -0.84 -3.30 116.94 118.36 1omt h PHE 37 Ca 0.60 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 62.09 1omt h PHE 37 Cb 1.46 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 40.22 1omt h PHE 37 CO -0.00 0.34 -0.46 0.00 -2.23 0.00 0.00 178.31 175.95 1omt n ASN 39 N -5.23 0.00 -0.00 0.00 3.02 -0.33 0.25 115.26 112.97 1omt n ASN 39 Ca -0.11 0.86 -0.12 0.00 -0.03 0.00 0.00 54.58 55.18 1omt n ASN 39 Cb 0.42 -0.42 -0.09 0.00 -0.61 0.00 0.00 39.78 39.08 1omt n ASN 39 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1omt h ALA 40 N 0.85 -0.09 -0.11 5.41 0.00 -1.28 -1.91 119.26 122.13 1omt h ALA 40 Ca 0.80 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 55.46 1omt h ALA 40 Cb 3.29 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 21.05 1omt h ALA 40 CO -0.01 -0.19 -0.30 0.28 0.00 0.00 0.00 179.25 179.03 1omt h VAL 41 N -0.81 0.32 0.00 0.00 2.07 0.37 0.98 116.25 119.18 1omt h VAL 41 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1omt h VAL 41 Cb 0.62 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1omt h VAL 41 CO 0.01 0.00 -0.06 -0.37 0.02 0.00 0.00 177.57 177.17 1omt h VAL 42 N -0.39 0.69 -0.01 2.57 -1.51 -1.15 0.39 116.25 116.86 1omt h VAL 42 Ca 0.09 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.32 1omt h VAL 42 Cb 0.53 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 30.83 1omt h VAL 42 CO -0.33 0.06 -0.34 1.21 -1.23 0.00 0.00 177.57 176.94 1omt n GLU 43 N -3.95 0.61 -0.34 5.19 2.13 -0.29 -3.76 120.64 120.22 1omt n GLU 43 Ca -0.03 -0.37 0.08 0.00 0.66 0.00 0.00 57.16 57.51 1omt n GLU 43 Cb 0.15 -1.49 0.22 0.00 0.27 0.00 0.00 31.44 30.59 1omt n GLU 43 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1omt n SER 44 N -0.88 3.49 0.00 4.31 3.41 0.18 -4.91 113.62 119.23 1omt n SER 44 Ca 0.10 -2.87 0.00 0.00 -0.26 0.00 0.00 58.87 55.84 1omt n SER 44 Cb 0.35 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 1omt n SER 44 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1omt n ASN 45 N -0.52 0.00 0.00 4.04 6.94 -1.09 -2.96 115.26 121.68 1omt n ASN 45 Ca 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.75 1omt n ASN 45 Cb 0.78 -0.40 0.00 0.00 -2.36 0.00 0.00 39.78 37.80 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1omt n GLY 46 N -2.00 0.59 0.01 4.83 0.00 0.13 -4.92 105.19 103.82 1omt n GLY 46 Ca 0.00 -0.56 0.13 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.71 0.03 -2.72 2.61 -2.24 -1.15 -4.85 114.28 103.25 1omt n THR 47 Ca 0.00 -0.02 -0.34 0.00 -2.27 0.00 0.00 64.05 61.41 1omt n THR 47 Cb 0.00 0.01 -0.06 0.00 -2.10 0.00 0.00 70.33 68.18 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 -3.11 4.02 0.18 3.22 2.96 -1.26 -5.06 118.68 119.62 1omt s LEU 48 Ca 0.11 1.82 0.00 0.00 -0.22 0.00 0.00 54.13 55.84 1omt s LEU 48 Cb 0.18 -4.40 -0.04 0.00 0.50 0.00 0.00 46.19 42.42 1omt s LEU 48 CO 0.65 -0.42 0.07 0.42 -1.32 0.00 0.00 176.35 175.76 1omt s THR 49 N -1.97 0.29 0.42 3.68 -4.23 -1.26 -4.90 115.64 107.68 1omt s THR 49 Ca 0.60 -1.97 0.07 0.00 -1.18 0.00 0.00 61.69 59.22 1omt s THR 49 Cb -0.14 -2.29 -0.03 0.00 1.34 0.00 0.00 72.50 71.38 1omt s THR 49 CO 0.18 -0.26 0.30 -0.22 -0.54 0.00 0.00 174.62 174.08 1omt s LEU 50 N -3.15 3.26 -0.14 4.79 0.20 -1.26 0.28 118.68 122.66 1omt s LEU 50 Ca 0.30 -0.89 0.05 0.00 0.69 0.00 0.00 54.13 54.28 1omt s LEU 50 Cb 0.07 -1.79 -0.12 0.00 -0.43 0.00 0.00 46.19 43.92 1omt s LEU 50 CO 0.07 -0.63 -0.06 -0.24 -0.29 0.00 0.00 176.35 175.20 1omt n SER 51 N -1.44 2.52 -3.62 3.68 2.88 -0.64 -4.58 113.62 112.42 1omt n SER 51 Ca 0.02 -0.05 -0.06 0.00 -1.33 0.00 0.00 58.87 57.45 1omt n SER 51 Cb 0.63 0.20 -0.02 0.00 -0.75 0.00 0.00 64.21 64.27 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 -2.29 -0.23 0.00 0.66 0.00 -1.25 -4.90 115.29 107.28 1omt s HIS 52 Ca -0.14 0.03 0.00 0.00 -3.00 0.00 0.00 55.06 51.95 1omt s HIS 52 Cb 0.04 0.58 0.00 0.00 -4.00 0.00 0.00 32.58 29.20 1omt s HIS 52 CO 0.40 -0.63 0.00 1.19 -1.00 0.00 0.00 174.74 174.71 1omt n PHE 53 N -0.35 -2.44 -4.20 0.38 3.01 -1.26 -1.30 117.46 111.29 1omt n PHE 53 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.39 1omt n PHE 53 Cb 0.61 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.08 1omt n PHE 53 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1omt n GLY 54 N 3.16 -0.33 3.92 1.37 0.00 1.04 -4.09 105.19 110.27 1omt n GLY 54 Ca 0.00 -0.83 -0.27 0.00 0.00 0.00 0.00 46.02 44.92 1omt n GLY 54 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1omt s LYS 55 N 0.00 2.82 0.00 1.61 2.47 -1.22 -1.77 119.74 123.65 1omt s LYS 55 Ca 0.00 0.01 0.28 0.00 -1.56 0.00 0.00 55.97 54.70 1omt s LYS 55 Cb 0.00 -2.23 1.00 0.00 -1.46 0.00 0.00 37.83 35.13 1omt s LYS 55 CO 0.00 -0.80 1.71 0.00 0.16 0.00 0.00 175.35 176.43