#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 0.00 -2.93 1.96 0.00 -1.26 -5.07 120.51 113.21 1omt n ALA 2 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 1omt n ALA 2 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 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 -1.18 3.49 -0.68 0.00 0.00 -1.26 -5.00 121.76 117.13 1omt s ALA 3 Ca 0.00 -2.06 -0.09 0.00 0.00 0.00 0.00 51.96 49.80 1omt s ALA 3 Cb 0.00 -3.27 0.18 0.00 0.00 0.00 0.00 23.12 20.02 1omt s ALA 3 CO 0.00 -1.97 0.56 0.08 0.00 0.00 0.00 175.76 174.43 1omt s VAL 4 N 2.16 4.69 -0.30 0.00 1.01 -1.26 -4.99 120.40 121.72 1omt s VAL 4 Ca 0.09 -2.45 -0.13 0.00 0.00 0.00 0.00 61.98 59.50 1omt s VAL 4 Cb -0.23 -3.98 0.14 0.00 0.00 0.00 0.00 36.38 32.31 1omt s VAL 4 CO 0.08 -0.92 0.82 -0.94 0.00 0.00 0.00 175.10 174.14 1omt s SER 5 N 1.86 -0.85 0.37 3.32 1.04 -1.26 -4.96 113.70 113.22 1omt s SER 5 Ca 0.14 1.18 -0.14 0.00 0.48 0.00 0.00 55.95 57.62 1omt s SER 5 Cb -0.18 1.92 -0.08 0.00 0.10 0.00 0.00 66.02 67.77 1omt s SER 5 CO -0.05 -0.17 0.78 -0.69 0.98 0.00 0.00 173.24 174.10 1omt s VAL 6 N 2.55 4.67 0.60 5.02 1.01 -1.26 -5.02 120.40 127.98 1omt s VAL 6 Ca -0.05 0.92 -0.20 0.00 0.00 0.00 0.00 61.98 62.65 1omt s VAL 6 Cb -0.09 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1omt s VAL 6 CO -0.18 -0.34 1.31 -0.67 0.00 0.00 0.00 175.10 175.22 1omt n ASP 7 N -0.76 2.33 -0.72 3.32 2.03 -1.26 -4.91 116.55 116.57 1omt n ASP 7 Ca 0.04 0.90 -0.02 0.00 0.52 0.00 0.00 54.79 56.23 1omt n ASP 7 Cb 0.54 -1.56 -0.03 0.00 -0.72 0.00 0.00 41.12 39.35 1omt n ASP 7 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1omt n SER 9 N 0.02 1.60 -2.24 0.00 7.64 -1.26 -4.05 113.62 115.33 1omt n SER 9 Ca -0.10 -1.54 -0.22 0.00 1.01 0.00 0.00 58.87 58.02 1omt n SER 9 Cb 0.61 -0.01 0.02 0.00 -1.01 0.00 0.00 64.21 63.82 1omt n SER 9 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1omt n GLU 10 N 0.25 3.32 -4.10 1.43 4.71 -1.26 -5.04 120.64 119.96 1omt n GLU 10 Ca 0.19 -4.18 -0.08 0.00 -0.01 0.00 0.00 57.16 53.08 1omt n GLU 10 Cb 0.37 -2.18 -0.10 0.00 -1.01 0.00 0.00 31.44 28.52 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 -3.58 0.58 0.73 -0.32 2.02 -1.26 -4.22 117.35 111.30 1omt s TYR 11 Ca 0.47 -0.97 -0.11 0.00 -0.37 0.00 0.00 57.07 56.09 1omt s TYR 11 Cb 0.40 -0.40 0.03 0.00 -0.40 0.00 0.00 41.96 41.60 1omt s TYR 11 CO -0.03 -0.31 1.08 -1.25 -1.57 0.00 0.00 175.55 173.47 1omt s PRO 12 N -3.60 2.58 0.03 -1.71 0.04 -1.26 -4.97 135.00 126.11 1omt s PRO 12 Ca 0.05 1.09 0.04 0.00 0.04 0.00 0.00 61.00 62.22 1omt s PRO 12 Cb 0.05 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1omt s PRO 12 CO -0.08 -1.39 -0.05 0.21 0.04 0.00 0.00 177.00 175.73 1omt s LYS 13 N -4.91 2.53 0.00 4.56 2.20 -1.26 -4.99 119.74 117.87 1omt s LYS 13 Ca 0.60 -0.76 0.00 0.00 -0.36 0.00 0.00 55.97 55.45 1omt s LYS 13 Cb -0.16 -2.51 0.00 0.00 -1.51 0.00 0.00 37.83 33.66 1omt s LYS 13 CO 0.55 0.58 0.73 -0.35 -0.36 0.00 0.00 175.35 176.50 1omt n PRO 14 N 1.27 0.92 -3.42 4.03 -0.04 -1.26 -4.66 135.00 131.84 1omt n PRO 14 Ca -0.14 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.34 1omt n PRO 14 Cb 0.52 -1.19 -0.05 0.00 -0.04 0.00 0.00 33.50 32.75 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 -1.59 -2.86 0.55 0.55 0.00 -1.26 -5.16 121.76 111.98 1omt s ALA 15 Ca 0.00 1.95 -0.15 0.00 0.00 0.00 0.00 51.96 53.76 1omt s ALA 15 Cb 0.00 -2.08 -0.07 0.00 0.00 0.00 0.00 23.12 20.97 1omt s ALA 15 CO 0.00 -0.70 1.00 0.00 0.00 0.00 0.00 175.76 176.06 1omt n THR 17 N -1.94 0.00 -0.00 0.00 -2.24 -1.26 -5.01 114.28 103.83 1omt n THR 17 Ca 0.06 -0.13 0.03 0.00 -2.27 0.00 0.00 64.05 61.74 1omt n THR 17 Cb 0.54 -1.28 -0.04 0.00 -2.10 0.00 0.00 70.33 67.45 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 -4.68 3.22 -0.00 -1.26 -4.98 117.00 109.30 1omt n LEU 18 Ca 0.03 0.00 -0.44 0.00 -0.00 0.00 0.00 56.01 55.60 1omt n LEU 18 Cb 0.12 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.51 1omt n LEU 18 CO 0.09 0.00 1.48 -0.62 -0.00 0.00 0.00 177.39 178.33 1omt n GLU 19 N -1.68 2.56 -2.88 1.47 1.02 -1.26 -4.90 120.64 114.97 1omt n GLU 19 Ca -0.01 0.93 -0.41 0.00 -0.02 0.00 0.00 57.16 57.65 1omt n GLU 19 Cb 0.14 -2.81 -0.04 0.00 -0.02 0.00 0.00 31.44 28.70 1omt n GLU 19 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1omt s TYR 20 N 3.29 3.46 -0.43 -0.32 5.04 -1.26 -4.66 117.35 122.46 1omt s TYR 20 Ca 0.86 1.31 0.07 0.00 -2.44 0.00 0.00 57.07 56.87 1omt s TYR 20 Cb -0.56 -3.01 0.18 0.00 0.35 0.00 0.00 41.96 38.92 1omt s TYR 20 CO 0.43 -0.19 0.69 1.03 -1.34 0.00 0.00 175.55 176.16 1omt s ARG 21 N 1.93 0.84 -0.02 4.97 0.52 -1.14 -5.02 118.95 121.03 1omt s ARG 21 Ca 0.40 -0.45 -0.30 0.00 -0.52 0.00 0.00 55.73 54.86 1omt s ARG 21 Cb -0.17 0.06 -0.06 0.00 0.52 0.00 0.00 34.95 35.29 1omt s ARG 21 CO 0.14 -1.16 1.71 -1.25 0.02 0.00 0.00 175.30 174.77 1omt s PRO 22 N 1.60 4.18 -0.06 3.54 0.04 -1.08 -3.50 135.00 139.71 1omt s PRO 22 Ca 0.20 2.28 0.02 0.00 0.04 0.00 0.00 61.00 63.54 1omt s PRO 22 Cb -0.02 -3.98 -0.03 0.00 0.04 0.00 0.00 34.50 30.51 1omt s PRO 22 CO -0.07 -0.85 -0.10 -0.51 0.04 0.00 0.00 177.00 175.50 1omt s LEU 23 N 3.97 2.97 -0.23 -3.56 1.02 -1.02 0.27 118.68 122.10 1omt s LEU 23 Ca 0.76 -0.10 -0.08 0.00 0.02 0.00 0.00 54.13 54.73 1omt s LEU 23 Cb -0.36 -1.63 -0.04 0.00 0.02 0.00 0.00 46.19 44.19 1omt s LEU 23 CO 0.32 0.35 0.08 0.00 0.02 0.00 0.00 176.35 177.13 1omt n GLY 25 N 4.38 -2.57 0.15 0.00 0.00 -0.95 -1.72 105.19 104.47 1omt n GLY 25 Ca -0.16 -1.44 0.12 0.00 0.00 0.00 0.00 46.02 44.54 1omt n GLY 25 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1omt h SER 26 N -1.38 0.00 0.67 1.61 0.87 0.65 -3.06 113.55 112.91 1omt h SER 26 Ca -0.08 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1omt h SER 26 Cb 0.23 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 1omt h SER 26 CO 0.05 0.02 0.00 -0.90 -0.53 0.00 0.00 176.83 175.47 1omt n ASP 27 N -2.64 0.00 -0.29 6.23 5.75 -1.26 -4.88 116.55 119.46 1omt n ASP 27 Ca 0.04 0.24 0.00 0.00 -0.01 0.00 0.00 54.79 55.05 1omt n ASP 27 Cb 0.49 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 1omt n ASP 27 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1omt n ASN 28 N -1.40 -1.50 -4.53 -1.12 5.15 -1.16 -5.06 115.26 105.65 1omt n ASN 28 Ca 0.09 0.00 -0.33 0.00 -0.60 0.00 0.00 54.58 53.73 1omt n ASN 28 Cb 0.25 -0.46 -0.12 0.00 -0.53 0.00 0.00 39.78 38.92 1omt n ASN 28 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1omt s LYS 29 N -4.27 2.74 0.18 1.20 2.20 -1.26 -4.89 119.74 115.64 1omt s LYS 29 Ca 0.00 -0.61 -0.16 0.00 -0.36 0.00 0.00 55.97 54.84 1omt s LYS 29 Cb 0.00 -2.53 -0.07 0.00 -1.51 0.00 0.00 37.83 33.72 1omt s LYS 29 CO 0.00 0.60 0.61 0.99 -0.36 0.00 0.00 175.35 177.19 1omt s THR 30 N -0.65 4.76 -0.14 3.43 2.01 -1.26 -2.23 115.64 121.56 1omt s THR 30 Ca 0.10 0.96 0.02 0.00 0.31 0.00 0.00 61.69 63.08 1omt s THR 30 Cb -0.11 -3.76 0.01 0.00 0.01 0.00 0.00 72.50 68.65 1omt s THR 30 CO 0.01 0.21 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.64 1omt s TYR 31 N -1.51 2.51 0.18 4.92 1.51 -0.61 -4.94 117.35 119.40 1omt s TYR 31 Ca 0.40 -1.28 -0.10 0.00 -1.01 0.00 0.00 57.07 55.08 1omt s TYR 31 Cb -0.15 -1.73 0.23 0.00 -0.11 0.00 0.00 41.96 40.19 1omt s TYR 31 CO 0.20 -0.61 1.10 0.41 -1.11 0.00 0.00 175.55 175.54 1omt n GLY 32 N 4.19 -1.36 0.00 0.71 0.00 -1.26 -2.44 105.19 105.03 1omt n GLY 32 Ca -0.20 0.78 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1omt n GLY 32 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1omt n ASN 33 N -5.08 0.00 0.09 1.61 0.23 -1.25 -2.65 115.26 108.21 1omt n ASN 33 Ca 0.09 -0.38 -0.04 0.00 -0.53 0.00 0.00 54.58 53.72 1omt n ASN 33 Cb 0.31 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.99 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 -0.22 -0.97 -3.83 2.10 -1.83 -1.11 116.57 110.71 1omt h LYS 34 Ca 0.00 0.02 0.28 0.00 -2.00 0.00 0.00 60.65 58.95 1omt h LYS 34 Cb 0.00 0.05 -0.18 0.00 -0.90 0.00 0.00 32.23 31.21 1omt h LYS 34 CO 0.00 -0.15 0.12 0.00 -2.00 0.00 0.00 179.45 177.42 1omt h ASN 36 N 0.04 1.04 0.74 0.00 2.35 -1.89 -1.22 115.58 116.64 1omt h ASN 36 Ca 0.62 -0.19 -0.04 0.00 -0.55 0.00 0.00 56.30 56.14 1omt h ASN 36 Cb 1.33 -0.27 0.01 0.00 0.05 0.00 0.00 38.32 39.43 1omt h ASN 36 CO -0.86 0.95 -0.35 0.15 -1.65 0.00 0.00 177.43 175.67 1omt h PHE 37 N 1.07 -0.92 -0.89 1.19 3.57 0.20 -3.10 116.94 118.06 1omt h PHE 37 Ca 0.24 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.82 1omt h PHE 37 Cb 0.26 0.30 -0.08 0.00 2.79 0.00 0.00 35.95 39.22 1omt h PHE 37 CO 0.02 -0.57 0.53 0.00 -2.23 0.00 0.00 178.31 176.06 1omt h ASN 39 N 0.87 0.53 0.44 0.00 2.35 -1.20 1.10 115.58 119.68 1omt h ASN 39 Ca 0.43 0.09 -0.15 0.00 -0.55 0.00 0.00 56.30 56.12 1omt h ASN 39 Cb 0.40 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 1omt h ASN 39 CO -0.25 0.12 -0.65 0.00 -1.65 0.00 0.00 177.43 175.00 1omt h ALA 40 N 1.64 0.82 0.10 -0.83 0.00 -0.58 -1.14 119.26 119.28 1omt h ALA 40 Ca 0.59 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1omt h ALA 40 Cb 1.35 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1omt h ALA 40 CO -0.33 0.77 -0.05 0.28 0.00 0.00 0.00 179.25 179.92 1omt h VAL 41 N 0.13 0.00 0.00 0.00 2.07 0.17 -0.40 116.25 118.23 1omt h VAL 41 Ca -0.01 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1omt h VAL 41 Cb 1.17 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1omt h VAL 41 CO 0.10 0.00 0.26 1.62 0.02 0.00 0.00 177.57 179.57 1omt h VAL 42 N -0.25 0.00 0.01 2.57 3.04 -0.57 0.33 116.25 121.37 1omt h VAL 42 Ca -0.01 0.00 -0.31 0.00 -1.01 0.00 0.00 66.70 65.36 1omt h VAL 42 Cb 0.11 0.53 -0.05 0.00 -2.01 0.00 0.00 31.29 29.87 1omt h VAL 42 CO 0.02 0.00 -1.84 -1.84 -1.01 0.00 0.00 177.57 172.90 1omt n GLU 43 N -2.54 0.65 0.00 4.17 -0.00 -0.43 -3.84 120.64 118.66 1omt n GLU 43 Ca -0.02 0.25 0.14 0.00 -0.00 0.00 0.00 57.16 57.53 1omt n GLU 43 Cb 0.30 -1.74 0.56 0.00 -0.00 0.00 0.00 31.44 30.56 1omt n GLU 43 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1omt n SER 44 N -3.05 1.13 0.00 -1.84 2.88 0.86 -4.88 113.62 108.72 1omt n SER 44 Ca -0.21 -1.25 0.00 0.00 -1.33 0.00 0.00 58.87 56.08 1omt n SER 44 Cb 1.07 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 64.54 1omt n SER 44 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1omt n ASN 45 N -0.22 -0.99 0.00 -3.46 6.94 0.51 -3.48 115.26 114.57 1omt n ASN 45 Ca 0.18 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.74 1omt n ASN 45 Cb 0.32 -0.16 0.00 0.00 -2.36 0.00 0.00 39.78 37.57 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 -2.33 0.77 0.25 4.83 0.00 0.10 -4.91 105.19 103.90 1omt n GLY 46 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.40 0.03 -0.06 2.61 -2.24 -1.23 -3.76 114.28 107.23 1omt n THR 47 Ca 0.00 -0.14 -0.13 0.00 -2.27 0.00 0.00 64.05 61.51 1omt n THR 47 Cb 0.00 0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.13 1omt n THR 47 CO 0.00 0.00 0.00 0.17 -0.57 0.00 0.00 175.07 174.67 1omt h LEU 48 N 1.17 -0.00 -1.14 3.22 8.10 -1.87 -3.48 115.31 121.31 1omt h LEU 48 Ca 0.00 -0.88 0.00 0.00 0.11 0.00 0.00 57.88 57.11 1omt h LEU 48 Cb 0.25 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.47 1omt h LEU 48 CO 0.00 0.91 -0.29 0.35 -4.11 0.00 0.00 178.44 175.30 1omt n THR 49 N -4.65 -3.90 -2.17 0.15 -2.24 -1.25 -1.35 114.28 98.87 1omt n THR 49 Ca -0.09 1.03 -0.30 0.00 -2.27 0.00 0.00 64.05 62.42 1omt n THR 49 Cb 0.43 -1.93 0.00 0.00 -2.10 0.00 0.00 70.33 66.73 1omt n THR 49 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1omt s LEU 50 N -0.28 3.40 -0.09 3.22 0.20 -1.26 0.32 118.68 124.20 1omt s LEU 50 Ca 0.00 1.28 0.12 0.00 0.69 0.00 0.00 54.13 56.21 1omt s LEU 50 Cb 0.00 -4.28 -0.17 0.00 -0.43 0.00 0.00 46.19 41.30 1omt s LEU 50 CO 0.00 -0.75 0.13 -0.24 -0.29 0.00 0.00 176.35 175.21 1omt n SER 51 N -2.47 1.92 -3.48 3.68 2.88 -0.70 -4.68 113.62 110.78 1omt n SER 51 Ca 0.04 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.49 1omt n SER 51 Cb 0.54 1.10 -0.02 0.00 -0.75 0.00 0.00 64.21 65.08 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 -2.53 -0.42 0.01 0.66 0.00 -1.25 -5.09 115.29 106.67 1omt s HIS 52 Ca -0.06 0.25 -0.00 0.00 -3.00 0.00 0.00 55.06 52.25 1omt s HIS 52 Cb 0.05 0.55 0.00 0.00 -4.00 0.00 0.00 32.58 29.19 1omt s HIS 52 CO 0.53 -0.68 0.01 1.19 -1.00 0.00 0.00 174.74 174.80 1omt n PHE 53 N -0.30 -3.80 -4.16 0.38 3.01 -1.26 -2.12 117.46 109.21 1omt n PHE 53 Ca -0.12 -0.01 0.03 0.00 1.01 0.00 0.00 57.45 58.35 1omt n PHE 53 Cb 0.63 -0.01 -0.01 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 4.40 -1.33 3.95 1.37 0.00 0.75 -4.44 105.19 109.88 1omt n GLY 54 Ca 0.00 -1.12 -0.24 0.00 0.00 0.00 0.00 46.02 44.67 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 -0.33 2.80 0.00 1.61 1.02 -1.20 -2.81 119.74 120.83 1omt s LYS 55 Ca 0.00 -0.43 0.16 0.00 0.02 0.00 0.00 55.97 55.73 1omt s LYS 55 Cb 0.00 -2.43 0.98 0.00 -0.52 0.00 0.00 37.83 35.86 1omt s LYS 55 CO 0.00 -0.59 1.38 0.00 -0.92 0.00 0.00 175.35 175.22