#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 2.86 -3.56 -1.18 0.00 -1.26 -5.07 120.51 112.30 1omt n ALA 2 Ca 0.00 -1.78 -0.13 0.00 0.00 0.00 0.00 53.44 51.53 1omt n ALA 2 Cb 0.00 -0.72 -0.12 0.00 0.00 0.00 0.00 19.45 18.62 1omt n ALA 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1omt s ALA 3 N -1.10 -0.67 -0.47 0.00 0.00 -1.26 -5.08 121.76 113.17 1omt s ALA 3 Ca 0.19 0.84 0.07 0.00 0.00 0.00 0.00 51.96 53.05 1omt s ALA 3 Cb 0.30 -1.26 0.18 0.00 0.00 0.00 0.00 23.12 22.34 1omt s ALA 3 CO -0.09 -0.92 0.64 0.08 0.00 0.00 0.00 175.76 175.47 1omt s VAL 4 N 2.45 -0.79 -0.30 0.00 1.01 -1.26 -4.44 120.40 117.07 1omt s VAL 4 Ca 0.05 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 1omt s VAL 4 Cb -0.14 -0.20 0.19 0.00 0.00 0.00 0.00 36.38 36.24 1omt s VAL 4 CO -0.11 -0.19 0.73 -0.55 0.00 0.00 0.00 175.10 174.98 1omt s SER 5 N 1.01 -1.16 0.31 3.32 0.15 -1.26 -4.92 113.70 111.15 1omt s SER 5 Ca 0.27 0.53 0.07 0.00 0.70 0.00 0.00 55.95 57.51 1omt s SER 5 Cb -0.01 1.89 -0.03 0.00 -1.71 0.00 0.00 66.02 66.16 1omt s SER 5 CO -0.07 -0.22 0.32 0.54 1.20 0.00 0.00 173.24 175.01 1omt s VAL 6 N 2.88 3.93 -0.38 4.45 0.11 -1.26 -5.08 120.40 125.05 1omt s VAL 6 Ca 0.14 -1.27 -0.10 0.00 -2.93 0.00 0.00 61.98 57.82 1omt s VAL 6 Cb -0.12 -3.32 0.04 0.00 -1.53 0.00 0.00 36.38 31.45 1omt s VAL 6 CO -0.20 -0.21 0.22 -0.62 -3.33 0.00 0.00 175.10 170.95 1omt s ASP 7 N -4.00 5.70 -0.41 3.54 2.15 -1.26 -4.95 116.67 117.44 1omt s ASP 7 Ca 0.40 -1.12 0.10 0.00 0.43 0.00 0.00 52.55 52.36 1omt s ASP 7 Cb -0.07 -2.01 0.41 0.00 -0.30 0.00 0.00 42.92 40.95 1omt s ASP 7 CO 0.27 -0.42 0.98 0.00 -0.17 0.00 0.00 175.17 175.84 1omt n SER 9 N -0.21 0.61 -1.45 0.00 2.88 -1.26 -3.73 113.62 110.46 1omt n SER 9 Ca 0.26 -0.08 0.08 0.00 -1.33 0.00 0.00 58.87 57.80 1omt n SER 9 Cb 0.67 0.34 0.34 0.00 -0.75 0.00 0.00 64.21 64.80 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 -1.87 3.86 -3.33 -1.46 4.71 -1.26 -4.96 120.64 116.32 1omt n GLU 10 Ca 0.04 -2.90 -0.21 0.00 -0.01 0.00 0.00 57.16 54.07 1omt n GLU 10 Cb 0.40 -1.95 -0.00 0.00 -1.01 0.00 0.00 31.44 28.88 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 -2.27 3.24 0.09 -0.32 1.51 -1.24 -4.11 117.35 114.24 1omt s TYR 11 Ca 0.48 0.05 -0.27 0.00 -1.01 0.00 0.00 57.07 56.32 1omt s TYR 11 Cb 0.34 -2.06 -0.06 0.00 -0.11 0.00 0.00 41.96 40.08 1omt s TYR 11 CO 0.18 -0.08 0.83 -1.25 -1.11 0.00 0.00 175.55 174.12 1omt s PRO 12 N -4.31 4.58 -0.13 -1.71 0.04 -1.26 -5.03 135.00 127.18 1omt s PRO 12 Ca 0.44 1.21 -0.07 0.00 0.04 0.00 0.00 61.00 62.62 1omt s PRO 12 Cb -0.10 -3.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 1omt s PRO 12 CO 0.34 0.32 0.12 0.15 0.04 0.00 0.00 177.00 177.97 1omt s LYS 13 N -0.25 3.51 0.00 4.56 1.02 -1.26 -4.97 119.74 122.35 1omt s LYS 13 Ca 0.41 -0.18 0.00 0.00 0.02 0.00 0.00 55.97 56.22 1omt s LYS 13 Cb -0.22 -3.18 0.00 0.00 -0.52 0.00 0.00 37.83 33.91 1omt s LYS 13 CO 0.26 0.69 0.79 -0.35 -0.92 0.00 0.00 175.35 175.82 1omt n PRO 14 N 2.24 0.99 -3.74 -1.68 -0.04 -1.26 -4.69 135.00 126.82 1omt n PRO 14 Ca -0.19 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.14 1omt n PRO 14 Cb 0.54 -1.20 -0.12 0.00 -0.04 0.00 0.00 33.50 32.68 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 -1.60 -0.61 0.01 0.55 0.00 -1.26 -5.16 121.76 113.70 1omt s ALA 15 Ca 0.00 0.94 -0.00 0.00 0.00 0.00 0.00 51.96 52.90 1omt s ALA 15 Cb 0.00 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 1omt s ALA 15 CO 0.00 -0.18 0.10 0.00 0.00 0.00 0.00 175.76 175.69 1omt n THR 17 N 0.99 0.00 0.00 0.00 -2.24 -1.26 -5.00 114.28 106.77 1omt n THR 17 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1omt n THR 17 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 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 1.48 -4.60 3.22 -0.00 -1.26 -5.02 117.00 110.82 1omt n LEU 18 Ca 0.00 0.00 -0.46 0.00 -0.00 0.00 0.00 56.01 55.55 1omt n LEU 18 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.40 1omt n LEU 18 CO 0.00 0.25 0.70 -1.84 -0.00 0.00 0.00 177.39 176.50 1omt n GLU 19 N -2.00 1.44 -2.64 1.47 0.00 -1.26 -4.85 120.64 112.81 1omt n GLU 19 Ca 0.00 0.51 -0.43 0.00 0.00 0.00 0.00 57.16 57.24 1omt n GLU 19 Cb 0.34 -1.97 -0.02 0.00 0.00 0.00 0.00 31.44 29.78 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 -0.65 3.34 -0.44 -1.84 5.04 -1.26 -4.79 117.35 116.74 1omt s TYR 20 Ca 0.64 1.45 0.07 0.00 -2.44 0.00 0.00 57.07 56.79 1omt s TYR 20 Cb -0.73 -3.27 0.23 0.00 0.35 0.00 0.00 41.96 38.54 1omt s TYR 20 CO 0.56 -0.54 0.64 0.54 -1.34 0.00 0.00 175.55 175.41 1omt n ARG 21 N 6.02 0.64 -1.90 4.97 5.12 -1.02 -5.02 116.66 125.46 1omt n ARG 21 Ca 0.11 -2.60 -0.43 0.00 -1.93 0.00 0.00 57.85 53.00 1omt n ARG 21 Cb 0.47 -1.38 -0.03 0.00 -1.16 0.00 0.00 32.46 30.35 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 -0.19 3.67 -0.08 5.56 0.04 -0.34 -3.30 135.00 140.36 1omt s PRO 22 Ca 0.33 1.92 -0.00 0.00 0.04 0.00 0.00 61.00 63.28 1omt s PRO 22 Cb 0.15 -4.15 -0.03 0.00 0.04 0.00 0.00 34.50 30.51 1omt s PRO 22 CO -0.16 -1.46 -0.05 -0.51 0.04 0.00 0.00 177.00 174.86 1omt s LEU 23 N 5.90 3.28 0.54 -3.56 1.43 -0.75 0.14 118.68 125.65 1omt s LEU 23 Ca 0.82 0.00 -0.03 0.00 -1.03 0.00 0.00 54.13 53.89 1omt s LEU 23 Cb -0.30 -1.73 0.01 0.00 0.03 0.00 0.00 46.19 44.19 1omt s LEU 23 CO 0.33 0.34 0.81 0.00 0.23 0.00 0.00 176.35 178.07 1omt s GLY 25 N -4.29 2.00 0.47 0.00 0.00 -0.81 -3.50 107.32 101.20 1omt s GLY 25 Ca 0.52 -2.02 0.23 0.00 0.00 0.00 0.00 44.72 43.45 1omt s GLY 25 CO 0.42 -1.82 1.96 0.23 0.00 0.00 0.00 173.10 173.89 1omt h SER 26 N 2.16 0.00 0.30 1.64 0.87 0.26 -1.29 113.55 117.49 1omt h SER 26 Ca -0.41 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 1omt h SER 26 Cb 1.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 1omt h SER 26 CO 0.69 0.20 0.00 -0.90 -0.53 0.00 0.00 176.83 176.30 1omt n ASP 27 N -3.71 0.12 0.00 6.23 5.68 -1.26 -4.82 116.55 118.78 1omt n ASP 27 Ca -0.01 0.54 0.00 0.00 -0.50 0.00 0.00 54.79 54.81 1omt n ASP 27 Cb 0.32 -0.56 0.00 0.00 -1.14 0.00 0.00 41.12 39.74 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 -1.64 -0.81 -4.55 -1.12 2.85 -0.48 -5.07 115.26 104.43 1omt n ASN 28 Ca 0.02 0.00 -0.31 0.00 -0.11 0.00 0.00 54.58 54.17 1omt n ASN 28 Cb 0.10 -0.37 -0.07 0.00 1.24 0.00 0.00 39.78 40.69 1omt n ASN 28 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 1omt n LYS 29 N -1.09 0.78 -4.50 1.20 2.85 -1.26 -4.93 118.16 111.22 1omt n LYS 29 Ca 0.00 -3.60 -0.26 0.00 -1.05 0.00 0.00 58.31 53.40 1omt n LYS 29 Cb 0.35 1.04 -0.10 0.00 -0.65 0.00 0.00 35.03 35.66 1omt n LYS 29 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1omt s THR 30 N -2.81 2.27 -0.17 0.58 2.01 -1.26 -1.92 115.64 114.34 1omt s THR 30 Ca 0.02 -2.10 -0.04 0.00 0.31 0.00 0.00 61.69 59.88 1omt s THR 30 Cb 0.00 -2.76 0.06 0.00 0.01 0.00 0.00 72.50 69.81 1omt s THR 30 CO 0.01 -0.15 0.07 -0.31 -0.69 0.00 0.00 174.62 173.55 1omt s TYR 31 N -2.61 0.41 0.07 4.92 1.51 -0.18 -4.94 117.35 116.52 1omt s TYR 31 Ca 0.34 -0.41 -0.07 0.00 -1.01 0.00 0.00 57.07 55.92 1omt s TYR 31 Cb 0.03 -0.77 0.05 0.00 -0.11 0.00 0.00 41.96 41.16 1omt s TYR 31 CO 0.18 -0.51 0.50 0.41 -1.11 0.00 0.00 175.55 175.02 1omt n GLY 32 N 5.22 -0.72 0.88 0.71 0.00 -1.26 -1.82 105.19 108.20 1omt n GLY 32 Ca -0.07 0.37 -0.04 0.00 0.00 0.00 0.00 46.02 46.28 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 -4.45 -0.33 -0.25 1.61 0.23 -1.23 -1.20 115.26 109.64 1omt n ASN 33 Ca 0.02 -1.52 0.15 0.00 -0.53 0.00 0.00 54.58 52.71 1omt n ASN 33 Cb 0.12 0.63 0.43 0.00 -2.08 0.00 0.00 39.78 38.87 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 0.55 0.05 -3.83 2.10 -1.81 -1.70 116.57 111.92 1omt h LYS 34 Ca -0.07 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.54 1omt h LYS 34 Cb 0.31 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 1omt h LYS 34 CO 0.10 0.37 -0.02 0.00 -2.00 0.00 0.00 179.45 177.89 1omt h ASN 36 N -0.07 0.40 -0.33 0.00 2.35 -1.84 0.51 115.58 116.59 1omt h ASN 36 Ca -0.01 0.19 -0.17 0.00 -0.55 0.00 0.00 56.30 55.76 1omt h ASN 36 Cb 0.05 0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.57 1omt h ASN 36 CO 0.01 -0.20 -0.47 0.15 -1.65 0.00 0.00 177.43 175.27 1omt h PHE 37 N 0.19 1.11 -0.23 1.19 3.57 -1.15 -3.01 116.94 118.61 1omt h PHE 37 Ca 0.78 -0.37 -0.11 0.00 3.53 0.00 0.00 57.97 61.79 1omt h PHE 37 Cb 2.04 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 40.54 1omt h PHE 37 CO -0.01 1.20 -0.34 0.00 -2.23 0.00 0.00 178.31 176.93 1omt h ASN 39 N 0.42 0.00 1.31 0.00 2.35 -0.95 0.10 115.58 118.82 1omt h ASN 39 Ca 0.05 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.68 1omt h ASN 39 Cb 0.80 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.15 1omt h ASN 39 CO 0.06 0.17 -0.71 0.00 -1.65 0.00 0.00 177.43 175.30 1omt h ALA 40 N 1.83 0.67 0.00 -0.83 0.00 -1.28 -1.56 119.26 118.08 1omt h ALA 40 Ca -0.00 -0.52 -0.16 0.00 0.00 0.00 0.00 54.91 54.23 1omt h ALA 40 Cb 0.59 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1omt h ALA 40 CO 0.02 0.66 -0.81 0.28 0.00 0.00 0.00 179.25 179.40 1omt h VAL 41 N 0.00 1.20 0.00 0.00 2.07 -0.30 -0.53 116.25 118.69 1omt h VAL 41 Ca -0.04 -2.73 -0.04 0.00 0.82 0.00 0.00 66.70 64.71 1omt h VAL 41 Cb 1.41 2.58 -0.01 0.00 -1.52 0.00 0.00 31.29 33.75 1omt h VAL 41 CO 0.06 0.68 -1.04 -0.37 0.02 0.00 0.00 177.57 176.92 1omt h VAL 42 N 0.00 0.12 0.01 2.57 -1.51 -0.83 0.72 116.25 117.33 1omt h VAL 42 Ca -0.03 -1.23 -0.31 0.00 -1.23 0.00 0.00 66.70 63.91 1omt h VAL 42 Cb 1.58 1.64 -0.05 0.00 -2.13 0.00 0.00 31.29 32.34 1omt h VAL 42 CO 0.09 0.07 -1.80 -1.84 -1.23 0.00 0.00 177.57 172.86 1omt n GLU 43 N -2.75 0.65 0.00 5.19 -0.00 -0.59 -3.85 120.64 119.30 1omt n GLU 43 Ca -0.02 0.27 0.15 0.00 -0.00 0.00 0.00 57.16 57.56 1omt n GLU 43 Cb 0.61 -1.76 0.65 0.00 -0.00 0.00 0.00 31.44 30.94 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 -3.07 1.03 -0.04 -1.84 3.41 -0.21 -4.87 113.62 108.02 1omt n SER 44 Ca -0.20 -1.33 -0.01 0.00 -0.26 0.00 0.00 58.87 57.07 1omt n SER 44 Cb 1.06 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 65.01 1omt n SER 44 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1omt n ASN 45 N -0.20 -3.29 0.00 4.04 2.85 -1.16 -2.75 115.26 114.75 1omt n ASN 45 Ca 0.20 0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.69 1omt n ASN 45 Cb 0.28 -0.84 0.00 0.00 1.24 0.00 0.00 39.78 40.46 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1omt n GLY 46 N -2.63 0.54 1.25 8.20 0.00 0.25 -4.91 105.19 107.89 1omt n GLY 46 Ca -0.01 -0.57 0.11 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.79 0.92 -0.06 2.61 5.66 -1.11 -4.30 114.28 115.20 1omt n THR 47 Ca 0.00 -0.90 -0.09 0.00 -3.05 0.00 0.00 64.05 60.00 1omt n THR 47 Cb 0.00 0.44 -0.09 0.00 -1.55 0.00 0.00 70.33 69.14 1omt n THR 47 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 1omt h LEU 48 N 3.93 -0.01 -1.27 1.09 5.85 -1.84 -3.47 115.31 119.61 1omt h LEU 48 Ca 0.00 -0.66 0.00 0.00 0.84 0.00 0.00 57.88 58.06 1omt h LEU 48 Cb 0.91 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.94 1omt h LEU 48 CO 0.00 0.82 -0.68 0.35 -0.34 0.00 0.00 178.44 178.59 1omt n THR 49 N -4.68 -6.91 -2.09 1.05 -2.24 -1.26 -0.77 114.28 97.38 1omt n THR 49 Ca -0.07 2.18 -0.34 0.00 -2.27 0.00 0.00 64.05 63.56 1omt n THR 49 Cb 0.32 -3.26 0.01 0.00 -2.10 0.00 0.00 70.33 65.30 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 -1.04 3.59 -0.07 3.22 2.96 -1.26 0.83 118.68 126.90 1omt s LEU 50 Ca 0.00 2.00 0.12 0.00 -0.22 0.00 0.00 54.13 56.03 1omt s LEU 50 Cb 0.00 -4.56 -0.18 0.00 0.50 0.00 0.00 46.19 41.95 1omt s LEU 50 CO 0.00 -1.27 0.16 -0.24 -1.32 0.00 0.00 176.35 173.68 1omt n SER 51 N -1.79 1.93 -3.58 3.68 2.88 -1.23 -4.75 113.62 110.77 1omt n SER 51 Ca 0.10 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.59 1omt n SER 51 Cb 0.52 1.19 -0.03 0.00 -0.75 0.00 0.00 64.21 65.14 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 -2.60 -0.19 0.71 0.66 0.00 -1.26 -4.96 115.29 107.65 1omt s HIS 52 Ca -0.06 0.17 -0.11 0.00 -3.00 0.00 0.00 55.06 52.06 1omt s HIS 52 Cb 0.06 0.51 0.02 0.00 -4.00 0.00 0.00 32.58 29.17 1omt s HIS 52 CO 0.53 -0.27 1.09 -0.06 -1.00 0.00 0.00 174.74 175.04 1omt s PHE 53 N -2.27 3.29 0.00 0.38 0.40 -1.26 -2.53 117.98 115.99 1omt s PHE 53 Ca 0.07 1.07 0.00 0.00 -0.60 0.00 0.00 56.93 57.47 1omt s PHE 53 Cb -0.01 -3.06 0.00 0.00 0.51 0.00 0.00 43.02 40.46 1omt s PHE 53 CO -0.05 -1.22 0.00 0.41 0.70 0.00 0.00 175.22 175.06 1omt n GLY 54 N -2.91 -1.81 3.71 4.36 0.00 0.37 -4.77 105.19 104.14 1omt n GLY 54 Ca 0.07 -1.81 -0.39 0.00 0.00 0.00 0.00 46.02 43.89 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 4.36 0.00 1.61 -2.85 -1.23 -2.95 119.74 118.69 1omt s LYS 55 Ca 0.00 0.61 0.07 0.00 -1.00 0.00 0.00 55.97 55.65 1omt s LYS 55 Cb 0.00 -3.45 0.43 0.00 -2.06 0.00 0.00 37.83 32.74 1omt s LYS 55 CO 0.00 0.09 0.89 0.00 0.10 0.00 0.00 175.35 176.43