#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 -3.58 -1.18 0.00 -1.26 -5.09 120.51 109.40 1omt n ALA 2 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1omt n ALA 2 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 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 -4.33 -1.99 -0.15 0.00 0.00 -1.26 -5.15 121.76 108.88 1omt s ALA 3 Ca 0.00 1.53 -0.02 0.00 0.00 0.00 0.00 51.96 53.47 1omt s ALA 3 Cb 0.00 -0.42 0.05 0.00 0.00 0.00 0.00 23.12 22.74 1omt s ALA 3 CO 0.00 -0.47 0.02 0.08 0.00 0.00 0.00 175.76 175.40 1omt s VAL 4 N -1.93 0.47 -0.01 0.00 1.01 -1.26 -5.12 120.40 113.56 1omt s VAL 4 Ca 0.05 -0.33 -0.29 0.00 0.00 0.00 0.00 61.98 61.41 1omt s VAL 4 Cb -0.01 -0.87 0.10 0.00 0.00 0.00 0.00 36.38 35.61 1omt s VAL 4 CO -0.04 -0.06 0.89 -0.55 0.00 0.00 0.00 175.10 175.35 1omt s SER 5 N 1.90 -0.36 -0.27 3.32 0.15 -1.26 -4.70 113.70 112.48 1omt s SER 5 Ca 0.01 0.01 0.10 0.00 0.70 0.00 0.00 55.95 56.77 1omt s SER 5 Cb -0.15 0.38 0.46 0.00 -1.71 0.00 0.00 66.02 65.00 1omt s SER 5 CO -0.07 -0.61 1.18 0.52 1.20 0.00 0.00 173.24 175.46 1omt n VAL 6 N -0.23 2.29 -0.27 4.45 0.31 -1.26 -5.05 118.33 118.57 1omt n VAL 6 Ca -0.09 -3.88 0.00 0.00 -0.01 0.00 0.00 64.34 60.36 1omt n VAL 6 Cb 0.62 -0.69 0.00 0.00 -0.91 0.00 0.00 33.84 32.86 1omt n VAL 6 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1omt n ASP 7 N -0.72 -0.60 -3.16 4.52 2.03 -1.26 -4.87 116.55 112.49 1omt n ASP 7 Ca 0.36 0.07 -0.27 0.00 0.52 0.00 0.00 54.79 55.47 1omt n ASP 7 Cb 0.92 -0.12 -0.06 0.00 -0.72 0.00 0.00 41.12 41.14 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 0.30 0.65 -2.01 0.00 7.64 -1.26 -4.01 113.62 114.93 1omt n SER 9 Ca 0.30 -0.05 -0.24 0.00 1.01 0.00 0.00 58.87 59.90 1omt n SER 9 Cb 0.41 0.48 0.13 0.00 -1.01 0.00 0.00 64.21 64.23 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 -2.03 2.50 -4.28 1.43 -0.58 -1.26 -4.98 120.64 111.44 1omt n GLU 10 Ca 0.03 -3.31 -0.23 0.00 -0.42 0.00 0.00 57.16 53.22 1omt n GLU 10 Cb 0.44 -2.15 -0.07 0.00 -0.57 0.00 0.00 31.44 29.08 1omt n GLU 10 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1omt s TYR 11 N -3.52 2.65 1.08 -0.32 1.51 -1.26 -4.37 117.35 113.11 1omt s TYR 11 Ca 0.56 -0.28 -0.17 0.00 -1.01 0.00 0.00 57.07 56.17 1omt s TYR 11 Cb 0.47 -1.29 0.23 0.00 -0.11 0.00 0.00 41.96 41.26 1omt s TYR 11 CO 0.03 0.57 1.17 -1.25 -1.11 0.00 0.00 175.55 174.96 1omt s PRO 12 N -3.69 -0.24 0.03 -1.71 0.04 -1.26 -4.93 135.00 123.24 1omt s PRO 12 Ca 0.33 -0.06 0.07 0.00 0.04 0.00 0.00 61.00 61.37 1omt s PRO 12 Cb -0.05 -1.71 -0.02 0.00 0.04 0.00 0.00 34.50 32.76 1omt s PRO 12 CO 0.20 -3.06 -0.19 0.15 0.04 0.00 0.00 177.00 174.14 1omt s LYS 13 N -5.48 1.33 0.00 4.56 1.02 -1.26 -5.01 119.74 114.91 1omt s LYS 13 Ca 0.70 -0.85 0.00 0.00 0.02 0.00 0.00 55.97 55.84 1omt s LYS 13 Cb -0.10 -1.40 0.00 0.00 -0.52 0.00 0.00 37.83 35.82 1omt s LYS 13 CO 0.55 0.36 0.75 -0.35 -0.92 0.00 0.00 175.35 175.74 1omt n PRO 14 N 2.02 0.94 -3.66 -1.68 -0.04 -1.26 -4.73 135.00 126.58 1omt n PRO 14 Ca -0.17 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.15 1omt n PRO 14 Cb 0.54 -1.20 -0.08 0.00 -0.04 0.00 0.00 33.50 32.72 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 -1.58 -1.48 -0.55 0.55 0.00 -1.26 -5.04 121.76 112.41 1omt s ALA 15 Ca 0.00 1.61 0.05 0.00 0.00 0.00 0.00 51.96 53.62 1omt s ALA 15 Cb 0.00 -0.87 0.06 0.00 0.00 0.00 0.00 23.12 22.31 1omt s ALA 15 CO 0.00 -0.29 0.77 0.00 0.00 0.00 0.00 175.76 176.24 1omt n THR 17 N 0.18 0.00 -0.08 0.00 -2.24 -1.26 -3.92 114.28 106.97 1omt n THR 17 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1omt n THR 17 Cb 0.17 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1omt n THR 17 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1omt n LEU 18 N 0.00 0.04 -4.71 3.22 4.77 -1.26 -4.94 117.00 114.11 1omt n LEU 18 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1omt n LEU 18 Cb 0.00 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 40.83 1omt n LEU 18 CO 0.00 -0.02 1.38 -1.84 -1.33 0.00 0.00 177.39 175.58 1omt n GLU 19 N -2.00 2.73 -3.12 3.23 0.28 -1.25 -4.91 120.64 115.59 1omt n GLU 19 Ca 0.00 0.99 -0.40 0.00 -0.16 0.00 0.00 57.16 57.59 1omt n GLU 19 Cb 0.00 -2.84 -0.06 0.00 1.43 0.00 0.00 31.44 29.97 1omt n GLU 19 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 1omt s TYR 20 N 1.45 3.37 -0.48 -1.84 5.04 -1.26 -4.59 117.35 119.05 1omt s TYR 20 Ca 0.77 0.91 0.05 0.00 -2.44 0.00 0.00 57.07 56.36 1omt s TYR 20 Cb -0.52 -2.80 0.19 0.00 0.35 0.00 0.00 41.96 39.19 1omt s TYR 20 CO 0.34 -0.18 0.76 -0.98 -1.34 0.00 0.00 175.55 174.14 1omt s ARG 21 N 1.95 0.92 -0.10 4.97 1.70 -0.55 -5.00 118.95 122.83 1omt s ARG 21 Ca 0.28 -0.81 -0.29 0.00 -0.47 0.00 0.00 55.73 54.44 1omt s ARG 21 Cb -0.16 -0.02 -0.06 0.00 -0.57 0.00 0.00 34.95 34.15 1omt s ARG 21 CO 0.10 -1.16 1.81 -1.25 -1.08 0.00 0.00 175.30 173.72 1omt s PRO 22 N 1.07 3.92 -0.12 3.89 0.04 -0.97 -3.58 135.00 139.25 1omt s PRO 22 Ca 0.27 2.15 -0.03 0.00 0.04 0.00 0.00 61.00 63.42 1omt s PRO 22 Cb 0.01 -4.10 -0.03 0.00 0.04 0.00 0.00 34.50 30.41 1omt s PRO 22 CO -0.06 -1.18 -0.00 -0.51 0.04 0.00 0.00 177.00 175.29 1omt s LEU 23 N 5.07 3.52 -0.38 -3.56 1.43 -1.01 0.25 118.68 124.00 1omt s LEU 23 Ca 0.81 0.06 -0.15 0.00 -1.03 0.00 0.00 54.13 53.82 1omt s LEU 23 Cb -0.34 -1.82 0.00 0.00 0.03 0.00 0.00 46.19 44.06 1omt s LEU 23 CO 0.34 0.30 0.32 0.00 0.23 0.00 0.00 176.35 177.54 1omt n GLY 25 N 5.10 -2.62 0.23 0.00 0.00 -0.17 -0.96 105.19 106.77 1omt n GLY 25 Ca -0.10 -0.87 0.11 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.57 0.00 0.47 1.61 0.87 0.48 -1.78 113.55 112.63 1omt h SER 26 Ca -0.34 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 1omt h SER 26 Cb 1.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.96 1omt h SER 26 CO 0.23 0.17 0.00 -0.90 -0.53 0.00 0.00 176.83 175.80 1omt n ASP 27 N -3.28 0.00 -0.03 6.23 5.68 -1.26 -4.86 116.55 119.03 1omt n ASP 27 Ca 0.01 -0.06 0.00 0.00 -0.50 0.00 0.00 54.79 54.23 1omt n ASP 27 Cb 0.43 -0.29 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 1omt n ASP 27 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1omt n ASN 28 N -1.29 -0.95 -4.83 -1.12 3.02 -0.67 -5.06 115.26 104.36 1omt n ASN 28 Ca 0.12 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.34 1omt n ASN 28 Cb 0.20 -0.45 -0.06 0.00 -0.61 0.00 0.00 39.78 38.86 1omt n ASN 28 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1omt s LYS 29 N -3.74 3.20 -0.03 3.52 2.20 -1.26 -4.80 119.74 118.82 1omt s LYS 29 Ca 0.00 -0.45 -0.06 0.00 -0.36 0.00 0.00 55.97 55.10 1omt s LYS 29 Cb 0.00 -2.94 -0.04 0.00 -1.51 0.00 0.00 37.83 33.34 1omt s LYS 29 CO 0.00 0.65 0.23 0.99 -0.36 0.00 0.00 175.35 176.86 1omt s THR 30 N -1.28 5.36 -0.11 3.43 2.01 -1.26 -1.00 115.64 122.78 1omt s THR 30 Ca 0.26 0.16 0.02 0.00 0.31 0.00 0.00 61.69 62.43 1omt s THR 30 Cb -0.12 -3.53 0.01 0.00 0.01 0.00 0.00 72.50 68.87 1omt s THR 30 CO 0.17 0.43 -0.16 -0.31 -0.69 0.00 0.00 174.62 174.07 1omt s TYR 31 N -1.23 2.04 0.22 4.92 2.02 -0.81 -4.95 117.35 119.56 1omt s TYR 31 Ca 0.24 -0.97 0.01 0.00 -0.37 0.00 0.00 57.07 55.98 1omt s TYR 31 Cb -0.13 -1.46 0.54 0.00 -0.40 0.00 0.00 41.96 40.51 1omt s TYR 31 CO 0.14 -0.50 1.14 0.41 -1.57 0.00 0.00 175.55 175.17 1omt n GLY 32 N 4.22 -1.01 0.00 0.71 0.00 -1.26 -2.39 105.19 105.46 1omt n GLY 32 Ca -0.19 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.55 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 -5.02 0.00 -0.23 1.61 6.94 -1.23 -1.49 115.26 115.84 1omt n ASN 33 Ca 0.17 -0.82 0.06 0.00 -0.02 0.00 0.00 54.58 53.97 1omt n ASN 33 Cb 0.54 0.00 0.32 0.00 -2.36 0.00 0.00 39.78 38.29 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 0.81 0.06 -3.83 5.09 -1.85 -0.37 116.57 116.47 1omt h LYS 34 Ca 0.00 -0.05 -0.00 0.00 0.09 0.00 0.00 60.65 60.69 1omt h LYS 34 Cb 0.00 -0.18 0.00 0.00 0.10 0.00 0.00 32.23 32.15 1omt h LYS 34 CO 0.00 0.53 -0.03 0.00 -2.09 0.00 0.00 179.45 177.86 1omt h ASN 36 N -0.95 0.00 0.38 0.00 2.35 -1.88 0.43 115.58 115.91 1omt h ASN 36 Ca -0.01 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.42 1omt h ASN 36 Cb 0.55 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.90 1omt h ASN 36 CO 0.01 0.00 -1.69 0.15 -1.65 0.00 0.00 177.43 174.26 1omt h PHE 37 N 0.00 0.37 0.00 1.19 3.57 -1.00 -3.34 116.94 117.73 1omt h PHE 37 Ca 0.30 -0.27 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 1omt h PHE 37 Cb 1.54 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 40.26 1omt h PHE 37 CO 0.00 1.41 -0.34 0.00 -2.23 0.00 0.00 178.31 177.15 1omt h ASN 39 N 0.00 0.61 0.73 0.00 4.21 -1.16 -0.55 115.58 119.42 1omt h ASN 39 Ca -0.00 -0.30 -0.06 0.00 1.21 0.00 0.00 56.30 57.15 1omt h ASN 39 Cb 0.63 -0.17 -0.01 0.00 -1.12 0.00 0.00 38.32 37.65 1omt h ASN 39 CO 0.04 0.99 -0.27 0.00 -1.29 0.00 0.00 177.43 176.91 1omt h ALA 40 N 1.03 1.09 0.11 -0.83 0.00 -1.58 0.00 119.26 119.09 1omt h ALA 40 Ca 0.02 -0.24 -0.30 0.00 0.00 0.00 0.00 54.91 54.39 1omt h ALA 40 Cb 1.00 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.78 1omt h ALA 40 CO 0.09 0.33 -1.23 0.28 0.00 0.00 0.00 179.25 178.73 1omt h VAL 41 N 0.00 1.28 0.00 0.00 2.07 -0.71 -1.95 116.25 116.94 1omt h VAL 41 Ca -0.00 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 65.08 1omt h VAL 41 Cb 0.70 2.67 0.00 0.00 -1.52 0.00 0.00 31.29 33.14 1omt h VAL 41 CO 0.03 0.74 -0.31 0.55 0.02 0.00 0.00 177.57 178.61 1omt n VAL 42 N -3.80 0.29 -0.03 2.57 3.14 -0.28 0.96 118.33 121.18 1omt n VAL 42 Ca -0.14 -0.18 -0.13 0.00 -2.96 0.00 0.00 64.34 60.94 1omt n VAL 42 Cb 0.98 -0.26 -0.14 0.00 -1.06 0.00 0.00 33.84 33.36 1omt n VAL 42 CO 0.00 0.00 0.00 -1.84 -6.46 0.00 0.00 176.83 168.53 1omt n GLU 43 N -1.93 0.67 -0.46 1.45 -0.00 -0.03 -3.92 120.64 116.43 1omt n GLU 43 Ca 0.05 0.25 0.03 0.00 -0.00 0.00 0.00 57.16 57.49 1omt n GLU 43 Cb 0.40 -1.73 0.20 0.00 -0.00 0.00 0.00 31.44 30.31 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 -3.14 3.39 -0.03 -1.84 2.88 -0.73 -4.83 113.62 109.31 1omt n SER 44 Ca -0.24 -2.48 -0.00 0.00 -1.33 0.00 0.00 58.87 54.82 1omt n SER 44 Cb 1.06 -0.60 -0.00 0.00 -0.75 0.00 0.00 64.21 63.92 1omt n SER 44 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1omt n ASN 45 N 0.29 -5.24 0.00 -3.46 3.02 -1.21 -1.44 115.26 107.22 1omt n ASN 45 Ca 0.14 0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.70 1omt n ASN 45 Cb 0.74 -2.78 0.00 0.00 -0.61 0.00 0.00 39.78 37.13 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1omt n GLY 46 N -0.02 0.60 0.78 7.41 0.00 0.27 -4.91 105.19 109.31 1omt n GLY 46 Ca -0.00 -0.44 0.09 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.70 0.44 -0.01 2.61 -2.24 -0.52 -4.32 114.28 107.54 1omt n THR 47 Ca 0.00 -0.53 -0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1omt n THR 47 Cb 0.00 0.42 -0.00 0.00 -2.10 0.00 0.00 70.33 68.65 1omt n THR 47 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1omt h LEU 48 N 2.74 -0.01 -1.33 3.22 5.85 -1.84 -3.48 115.31 120.46 1omt h LEU 48 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1omt h LEU 48 Cb 0.61 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1omt h LEU 48 CO 0.00 0.16 -0.50 0.35 -0.34 0.00 0.00 178.44 178.11 1omt n THR 49 N -2.96 -7.10 -1.75 1.05 -2.24 -1.26 -2.36 114.28 97.67 1omt n THR 49 Ca -0.00 1.79 -0.29 0.00 -2.27 0.00 0.00 64.05 63.28 1omt n THR 49 Cb 0.00 -3.22 0.12 0.00 -2.10 0.00 0.00 70.33 65.14 1omt n THR 49 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1omt s LEU 50 N -0.28 2.29 -0.02 3.22 2.34 -1.26 0.29 118.68 125.28 1omt s LEU 50 Ca 0.00 0.80 0.05 0.00 0.06 0.00 0.00 54.13 55.04 1omt s LEU 50 Cb 0.00 -3.17 -0.08 0.00 -0.56 0.00 0.00 46.19 42.38 1omt s LEU 50 CO 0.00 -2.27 0.09 -0.24 -1.06 0.00 0.00 176.35 172.87 1omt n SER 51 N -3.56 3.75 -3.60 1.48 2.88 -0.13 -4.54 113.62 109.90 1omt n SER 51 Ca 0.08 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.50 1omt n SER 51 Cb 0.60 1.07 -0.06 0.00 -0.75 0.00 0.00 64.21 65.07 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 -2.31 -0.57 0.95 0.66 0.00 -1.26 -5.07 115.29 107.70 1omt s HIS 52 Ca -0.02 1.21 -0.11 0.00 -3.00 0.00 0.00 55.06 53.14 1omt s HIS 52 Cb 0.03 0.37 0.16 0.00 -4.00 0.00 0.00 32.58 29.14 1omt s HIS 52 CO 0.22 -0.37 1.09 -0.06 -1.00 0.00 0.00 174.74 174.62 1omt s PHE 53 N -0.36 1.92 0.00 0.38 0.40 -1.26 -2.63 117.98 116.43 1omt s PHE 53 Ca -0.02 1.42 0.00 0.00 -0.60 0.00 0.00 56.93 57.73 1omt s PHE 53 Cb -0.03 -3.19 0.00 0.00 0.51 0.00 0.00 43.02 40.32 1omt s PHE 53 CO 0.01 -2.81 0.00 0.41 0.70 0.00 0.00 175.22 173.53 1omt n GLY 54 N -0.31 -1.98 3.94 4.36 0.00 0.69 -4.74 105.19 107.15 1omt n GLY 54 Ca 0.08 -1.61 -0.24 0.00 0.00 0.00 0.00 46.02 44.24 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 2.90 0.00 1.61 1.02 -1.21 -2.73 119.74 121.33 1omt s LYS 55 Ca 0.00 -0.38 0.17 0.00 0.02 0.00 0.00 55.97 55.79 1omt s LYS 55 Cb 0.00 -2.44 1.04 0.00 -0.52 0.00 0.00 37.83 35.91 1omt s LYS 55 CO 0.00 -0.51 1.44 0.00 -0.92 0.00 0.00 175.35 175.36