#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 -0.21 -2.73 1.96 0.00 -1.26 -4.81 120.51 113.46 1omt n ALA 2 Ca 0.00 0.22 -0.10 0.00 0.00 0.00 0.00 53.44 53.56 1omt n ALA 2 Cb 0.00 -1.86 0.03 0.00 0.00 0.00 0.00 19.45 17.62 1omt n ALA 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1omt n ALA 3 N 1.25 3.12 -3.21 0.00 0.00 -1.26 -5.04 120.51 115.37 1omt n ALA 3 Ca -0.14 -3.08 -0.46 0.00 0.00 0.00 0.00 53.44 49.76 1omt n ALA 3 Cb 0.62 -0.94 -0.04 0.00 0.00 0.00 0.00 19.45 19.09 1omt n ALA 3 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1omt s VAL 4 N -2.88 5.11 0.30 0.00 -7.23 -1.26 -5.05 120.40 109.40 1omt s VAL 4 Ca 0.29 -1.51 -0.03 0.00 -1.81 0.00 0.00 61.98 58.92 1omt s VAL 4 Cb 0.44 -4.45 -0.04 0.00 0.56 0.00 0.00 36.38 32.89 1omt s VAL 4 CO 0.02 -1.04 0.54 -0.94 -0.31 0.00 0.00 175.10 173.37 1omt s SER 5 N 3.34 6.39 0.02 4.85 1.04 -1.26 -4.82 113.70 123.25 1omt s SER 5 Ca 0.11 0.61 -0.05 0.00 0.48 0.00 0.00 55.95 57.10 1omt s SER 5 Cb -0.22 -2.10 -0.01 0.00 0.10 0.00 0.00 66.02 63.79 1omt s SER 5 CO 0.01 -0.21 0.07 -0.69 0.98 0.00 0.00 173.24 173.40 1omt s VAL 6 N -2.14 0.11 0.33 5.02 1.01 -1.26 -5.16 120.40 118.32 1omt s VAL 6 Ca 0.42 -0.87 -0.00 0.00 0.00 0.00 0.00 61.98 61.53 1omt s VAL 6 Cb -0.10 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 1omt s VAL 6 CO 0.32 -0.48 0.54 1.51 0.00 0.00 0.00 175.10 176.99 1omt s ASP 7 N -1.60 6.31 -0.17 3.32 -4.77 -1.26 -5.02 116.67 113.48 1omt s ASP 7 Ca -0.13 0.47 0.24 0.00 -3.30 0.00 0.00 52.55 49.83 1omt s ASP 7 Cb -0.07 -2.04 0.48 0.00 -1.09 0.00 0.00 42.92 40.20 1omt s ASP 7 CO -0.01 -0.27 1.14 0.00 0.70 0.00 0.00 175.17 176.73 1omt h SER 9 N 2.04 0.00 -1.42 0.00 0.87 -2.01 -3.33 113.55 109.71 1omt h SER 9 Ca -0.18 0.00 -0.66 0.00 -1.23 0.00 0.00 61.79 59.72 1omt h SER 9 Cb 1.48 0.00 -0.25 0.00 -0.44 0.00 0.00 62.40 63.19 1omt h SER 9 CO 0.15 0.86 0.85 -0.62 -0.53 0.00 0.00 176.83 177.54 1omt n GLU 10 N -3.14 2.59 -4.11 2.24 4.71 -1.26 -4.92 120.64 116.75 1omt n GLU 10 Ca -0.08 -3.10 -0.08 0.00 -0.01 0.00 0.00 57.16 53.90 1omt n GLU 10 Cb 0.94 -2.20 -0.10 0.00 -1.01 0.00 0.00 31.44 29.07 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 -3.44 0.62 0.35 -0.32 2.02 -1.25 -4.23 117.35 111.10 1omt s TYR 11 Ca 0.55 -1.10 -0.18 0.00 -0.37 0.00 0.00 57.07 55.97 1omt s TYR 11 Cb 0.44 -0.42 -0.10 0.00 -0.40 0.00 0.00 41.96 41.48 1omt s TYR 11 CO -0.23 -0.40 0.82 -1.25 -1.57 0.00 0.00 175.55 172.92 1omt s PRO 12 N -3.95 4.15 -0.12 -1.71 0.04 -1.26 -5.04 135.00 127.10 1omt s PRO 12 Ca 0.11 0.88 -0.05 0.00 0.04 0.00 0.00 61.00 61.98 1omt s PRO 12 Cb 0.08 -2.43 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 1omt s PRO 12 CO -0.07 0.13 0.08 0.15 0.04 0.00 0.00 177.00 177.33 1omt s LYS 13 N -2.86 3.42 0.00 4.56 1.02 -1.26 -4.97 119.74 119.64 1omt s LYS 13 Ca 0.55 -0.26 0.00 0.00 0.02 0.00 0.00 55.97 56.28 1omt s LYS 13 Cb -0.11 -3.07 0.00 0.00 -0.52 0.00 0.00 37.83 34.13 1omt s LYS 13 CO 0.17 0.64 0.76 -0.35 -0.92 0.00 0.00 175.35 175.66 1omt n PRO 14 N 2.37 1.00 -3.60 -1.68 -0.04 -1.26 -4.83 135.00 126.96 1omt n PRO 14 Ca -0.19 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.23 1omt n PRO 14 Cb 0.54 -1.23 -0.02 0.00 -0.04 0.00 0.00 33.50 32.74 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 -1.53 -2.07 0.13 0.55 0.00 -1.26 -5.18 121.76 112.39 1omt s ALA 15 Ca 0.00 1.64 -0.08 0.00 0.00 0.00 0.00 51.96 53.52 1omt s ALA 15 Cb 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 1omt s ALA 15 CO 0.00 -0.53 0.22 0.00 0.00 0.00 0.00 175.76 175.45 1omt n THR 17 N -0.14 0.00 -0.03 0.00 -2.24 -1.26 -4.96 114.28 105.65 1omt n THR 17 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1omt n THR 17 Cb 0.63 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 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 0.20 0.00 3.22 -0.00 -1.26 -5.03 117.00 114.12 1omt n LEU 18 Ca 0.00 -0.53 -0.08 0.00 -0.00 0.00 0.00 56.01 55.41 1omt n LEU 18 Cb 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 43.42 43.49 1omt n LEU 18 CO 0.00 0.05 0.08 -1.84 -0.00 0.00 0.00 177.39 175.68 1omt n GLU 19 N -0.66 -1.91 -4.01 1.47 0.00 -1.26 -4.97 120.64 109.30 1omt n GLU 19 Ca 0.00 -0.36 -0.27 0.00 0.00 0.00 0.00 57.16 56.53 1omt n GLU 19 Cb 0.01 -0.53 -0.17 0.00 0.00 0.00 0.00 31.44 30.75 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 1.55 -0.44 -1.84 5.04 -1.26 -4.95 117.35 114.26 1omt s TYR 20 Ca 0.16 -0.76 0.08 0.00 -2.44 0.00 0.00 57.07 54.11 1omt s TYR 20 Cb -0.03 -1.25 0.28 0.00 0.35 0.00 0.00 41.96 41.31 1omt s TYR 20 CO 0.14 -0.50 0.81 0.54 -1.34 0.00 0.00 175.55 175.20 1omt n ARG 21 N 4.78 0.84 -1.92 4.97 5.12 -1.24 -5.07 116.66 124.14 1omt n ARG 21 Ca -0.14 -2.45 -0.41 0.00 -1.93 0.00 0.00 57.85 52.91 1omt n ARG 21 Cb 0.50 -1.35 -0.02 0.00 -1.16 0.00 0.00 32.46 30.44 1omt n ARG 21 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1omt s PRO 22 N -0.43 4.21 0.02 5.56 0.04 -0.68 -2.26 135.00 141.46 1omt s PRO 22 Ca 0.32 2.42 0.06 0.00 0.04 0.00 0.00 61.00 63.84 1omt s PRO 22 Cb 0.25 -3.05 -0.02 0.00 0.04 0.00 0.00 34.50 31.72 1omt s PRO 22 CO -0.14 -0.46 -0.17 -0.51 0.04 0.00 0.00 177.00 175.76 1omt s LEU 23 N -1.08 2.12 0.28 -3.56 1.02 -0.92 0.41 118.68 116.95 1omt s LEU 23 Ca 0.57 -0.42 0.06 0.00 0.02 0.00 0.00 54.13 54.36 1omt s LEU 23 Cb -0.44 -0.80 -0.02 0.00 0.02 0.00 0.00 46.19 44.95 1omt s LEU 23 CO 0.51 0.13 0.37 0.00 0.02 0.00 0.00 176.35 177.38 1omt s GLY 25 N -4.03 2.18 0.48 0.00 0.00 -0.07 -1.74 107.32 104.14 1omt s GLY 25 Ca 0.38 -1.52 0.31 0.00 0.00 0.00 0.00 44.72 43.90 1omt s GLY 25 CO 0.29 -1.87 1.91 0.23 0.00 0.00 0.00 173.10 173.67 1omt h SER 26 N 0.58 0.00 1.04 1.64 0.87 0.35 -1.30 113.55 116.74 1omt h SER 26 Ca -0.35 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.21 1omt h SER 26 Cb 1.30 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 1omt h SER 26 CO 0.52 0.00 0.00 -0.90 -0.53 0.00 0.00 176.83 175.92 1omt n ASP 27 N -2.90 0.16 -0.12 6.23 5.68 -1.26 -4.89 116.55 119.45 1omt n ASP 27 Ca 0.01 0.52 0.00 0.00 -0.50 0.00 0.00 54.79 54.82 1omt n ASP 27 Cb 0.30 -0.56 0.00 0.00 -1.14 0.00 0.00 41.12 39.72 1omt n ASP 27 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1omt n ASN 28 N -1.66 -0.99 -4.54 -1.12 2.85 -0.49 -5.07 115.26 104.25 1omt n ASN 28 Ca 0.06 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 54.20 1omt n ASN 28 Cb 0.34 -0.37 -0.12 0.00 1.24 0.00 0.00 39.78 40.87 1omt n ASN 28 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1omt s LYS 29 N -3.40 2.66 0.47 1.20 2.20 -1.26 -4.85 119.74 116.76 1omt s LYS 29 Ca 0.00 -0.61 -0.03 0.00 -0.36 0.00 0.00 55.97 54.97 1omt s LYS 29 Cb 0.00 -2.51 -0.02 0.00 -1.51 0.00 0.00 37.83 33.79 1omt s LYS 29 CO 0.00 0.64 0.73 0.99 -0.36 0.00 0.00 175.35 177.35 1omt s THR 30 N -0.76 4.50 -0.01 3.43 2.01 -1.26 -0.90 115.64 122.65 1omt s THR 30 Ca 0.12 -0.15 0.01 0.00 0.31 0.00 0.00 61.69 61.98 1omt s THR 30 Cb -0.11 -3.69 0.00 0.00 0.01 0.00 0.00 72.50 68.71 1omt s THR 30 CO 0.01 -0.59 -0.01 -0.31 -0.69 0.00 0.00 174.62 173.02 1omt s TYR 31 N -2.65 0.20 0.27 4.92 2.02 -0.05 -4.93 117.35 117.13 1omt s TYR 31 Ca 0.47 -0.02 -0.09 0.00 -0.37 0.00 0.00 57.07 57.06 1omt s TYR 31 Cb -0.10 -0.17 0.43 0.00 -0.40 0.00 0.00 41.96 41.72 1omt s TYR 31 CO 0.41 -0.03 1.56 0.78 -1.57 0.00 0.00 175.55 176.71 1omt h GLY 32 N 6.34 0.66 0.00 0.71 0.00 -1.87 -2.43 103.07 106.48 1omt h GLY 32 Ca -0.29 0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1omt h GLY 32 CO 0.50 -0.36 0.00 1.16 0.00 0.00 0.00 176.54 177.84 1omt n ASN 33 N -5.61 0.00 -0.23 0.19 0.23 -1.25 -1.69 115.26 106.90 1omt n ASN 33 Ca 0.15 -0.62 0.02 0.00 -0.53 0.00 0.00 54.58 53.60 1omt n ASN 33 Cb 0.48 0.00 0.11 0.00 -2.08 0.00 0.00 39.78 38.29 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 0.08 0.19 -3.83 2.10 -1.76 0.41 116.57 113.75 1omt h LYS 34 Ca 0.00 -0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 1omt h LYS 34 Cb 0.00 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.31 1omt h LYS 34 CO 0.00 0.05 -0.09 0.00 -2.00 0.00 0.00 179.45 177.41 1omt h ASN 36 N -0.55 0.00 0.00 0.00 2.35 -1.81 -0.94 115.58 114.63 1omt h ASN 36 Ca -0.03 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.66 1omt h ASN 36 Cb 0.41 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1omt h ASN 36 CO 0.04 0.00 -0.33 0.15 -1.65 0.00 0.00 177.43 175.65 1omt h PHE 37 N 0.00 0.00 0.00 1.19 3.57 -0.35 -3.32 116.94 118.02 1omt h PHE 37 Ca 0.00 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 1omt h PHE 37 Cb 0.00 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 1omt h PHE 37 CO 0.00 1.09 -0.13 0.00 -2.23 0.00 0.00 178.31 177.04 1omt h ASN 39 N 0.00 0.00 0.97 0.00 -0.26 -1.29 0.23 115.58 115.23 1omt h ASN 39 Ca -0.00 0.00 -0.17 0.00 -0.56 0.00 0.00 56.30 55.57 1omt h ASN 39 Cb 0.43 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.66 1omt h ASN 39 CO 0.02 0.14 -1.10 0.00 -1.06 0.00 0.00 177.43 175.43 1omt h ALA 40 N 1.86 0.62 0.00 -0.83 0.00 -1.09 -1.96 119.26 117.87 1omt h ALA 40 Ca -0.00 -0.82 -0.08 0.00 0.00 0.00 0.00 54.91 54.01 1omt h ALA 40 Cb 0.33 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1omt h ALA 40 CO 0.02 0.97 -0.46 0.28 0.00 0.00 0.00 179.25 180.06 1omt h VAL 41 N 0.00 0.61 0.00 0.00 2.07 -0.51 0.58 116.25 119.00 1omt h VAL 41 Ca -0.10 -1.88 -0.17 0.00 0.82 0.00 0.00 66.70 65.37 1omt h VAL 41 Cb 1.61 2.27 -0.03 0.00 -1.52 0.00 0.00 31.29 33.62 1omt h VAL 41 CO 0.07 0.35 -1.46 1.33 0.02 0.00 0.00 177.57 177.88 1omt n VAL 42 N -3.16 1.15 -0.00 2.57 0.24 0.67 0.15 118.33 119.95 1omt n VAL 42 Ca 0.02 -0.69 -0.05 0.00 -2.04 0.00 0.00 64.34 61.58 1omt n VAL 42 Cb 0.69 -0.70 -0.12 0.00 -1.47 0.00 0.00 33.84 32.24 1omt n VAL 42 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1omt n GLU 43 N -2.86 0.63 -0.06 7.34 -0.00 -0.74 -3.80 120.64 121.15 1omt n GLU 43 Ca -0.10 0.26 0.11 0.00 -0.00 0.00 0.00 57.16 57.43 1omt n GLU 43 Cb 0.84 -1.79 0.42 0.00 -0.00 0.00 0.00 31.44 30.90 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 -2.97 1.53 0.00 -1.84 2.88 0.19 -4.87 113.62 108.54 1omt n SER 44 Ca -0.14 -1.65 0.00 0.00 -1.33 0.00 0.00 58.87 55.75 1omt n SER 44 Cb 0.97 -0.08 0.00 0.00 -0.75 0.00 0.00 64.21 64.34 1omt n SER 44 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1omt n ASN 45 N 0.22 -3.35 0.00 -3.46 5.15 -1.19 -2.71 115.26 109.91 1omt n ASN 45 Ca 0.17 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.15 1omt n ASN 45 Cb 0.32 -0.92 0.00 0.00 -0.53 0.00 0.00 39.78 38.65 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1omt n GLY 46 N -2.41 0.81 0.00 8.20 0.00 0.39 -4.87 105.19 107.32 1omt n GLY 46 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1omt n GLY 46 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1omt n THR 47 N -2.28 0.00 -0.07 2.61 5.66 -1.10 -3.54 114.28 115.57 1omt n THR 47 Ca 0.00 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.86 1omt n THR 47 Cb 0.00 -0.37 -0.13 0.00 -1.55 0.00 0.00 70.33 68.28 1omt n THR 47 CO 0.00 0.00 0.00 0.17 -3.05 0.00 0.00 175.07 172.19 1omt h LEU 48 N 0.00 -0.00 -1.34 1.09 8.10 -1.85 -3.47 115.31 117.84 1omt h LEU 48 Ca 0.00 -0.97 0.00 0.00 0.11 0.00 0.00 57.88 57.02 1omt h LEU 48 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.22 1omt h LEU 48 CO 0.00 0.97 -0.74 0.35 -4.11 0.00 0.00 178.44 174.91 1omt n THR 49 N -4.62 -9.26 -1.45 0.15 -2.24 -1.23 -0.62 114.28 95.00 1omt n THR 49 Ca -0.10 2.55 -0.35 0.00 -2.27 0.00 0.00 64.05 63.88 1omt n THR 49 Cb 0.47 -4.02 0.10 0.00 -2.10 0.00 0.00 70.33 64.77 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 -0.69 3.36 -0.01 3.22 2.96 -1.26 0.13 118.68 126.39 1omt s LEU 50 Ca 0.00 2.48 0.06 0.00 -0.22 0.00 0.00 54.13 56.46 1omt s LEU 50 Cb 0.00 -4.60 -0.10 0.00 0.50 0.00 0.00 46.19 41.99 1omt s LEU 50 CO 0.00 -2.31 0.14 -0.24 -1.32 0.00 0.00 176.35 172.62 1omt n SER 51 N -2.58 3.54 0.00 3.68 2.88 -0.71 -4.57 113.62 115.85 1omt n SER 51 Ca 0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 1omt n SER 51 Cb 0.49 1.28 0.00 0.00 -0.75 0.00 0.00 64.21 65.23 1omt n SER 51 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1omt n HIS 52 N -1.74 0.00 -0.52 0.66 1.44 -1.26 -4.94 115.22 108.87 1omt n HIS 52 Ca -0.01 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.70 1omt n HIS 52 Cb 0.18 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.29 1omt n HIS 52 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1omt n PHE 53 N -0.44 -2.91 -4.53 -1.40 3.01 -1.26 -2.05 117.46 107.88 1omt n PHE 53 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1omt n PHE 53 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 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 2.80 -0.62 3.86 1.37 0.00 1.36 -4.42 105.19 109.54 1omt n GLY 54 Ca 0.00 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.79 1omt n GLY 54 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1omt s LYS 55 N 0.00 3.88 0.00 1.61 0.00 -1.24 -2.36 119.74 121.63 1omt s LYS 55 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 55.97 56.32 1omt s LYS 55 Cb 0.00 -2.87 0.00 0.00 0.00 0.00 0.00 37.83 34.96 1omt s LYS 55 CO 0.00 0.45 0.12 0.00 0.00 0.00 0.00 175.35 175.92