#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 -1.04 -1.86 1.96 0.00 -1.26 -4.90 120.51 113.41 1omt n ALA 2 Ca 0.00 0.04 -0.32 0.00 0.00 0.00 0.00 53.44 53.16 1omt n ALA 2 Cb 0.00 -2.28 -0.04 0.00 0.00 0.00 0.00 19.45 17.13 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 -2.80 3.08 -0.28 0.00 0.00 -1.26 -5.05 121.76 115.45 1omt s ALA 3 Ca 0.35 0.20 -0.02 0.00 0.00 0.00 0.00 51.96 52.49 1omt s ALA 3 Cb -0.19 -3.10 0.12 0.00 0.00 0.00 0.00 23.12 19.95 1omt s ALA 3 CO 0.43 -0.15 0.23 0.14 0.00 0.00 0.00 175.76 176.41 1omt s VAL 4 N -2.53 -0.27 -0.30 0.00 -7.23 -1.26 -5.10 120.40 103.71 1omt s VAL 4 Ca 0.59 -0.54 -0.11 0.00 -1.81 0.00 0.00 61.98 60.11 1omt s VAL 4 Cb -0.10 -0.94 0.17 0.00 0.56 0.00 0.00 36.38 36.06 1omt s VAL 4 CO 0.28 -0.53 0.89 -0.94 -0.31 0.00 0.00 175.10 174.49 1omt s SER 5 N 2.26 -0.77 -0.03 4.85 1.04 -1.26 -5.04 113.70 114.75 1omt s SER 5 Ca 0.09 0.81 -0.25 0.00 0.48 0.00 0.00 55.95 57.07 1omt s SER 5 Cb -0.15 1.78 -0.04 0.00 0.10 0.00 0.00 66.02 67.71 1omt s SER 5 CO -0.32 -0.15 0.79 -0.69 0.98 0.00 0.00 173.24 173.85 1omt s VAL 6 N 2.70 4.95 -0.55 5.02 1.01 -1.26 -5.01 120.40 127.26 1omt s VAL 6 Ca 0.01 1.64 -0.22 0.00 0.00 0.00 0.00 61.98 63.42 1omt s VAL 6 Cb -0.09 -4.13 0.05 0.00 0.00 0.00 0.00 36.38 32.21 1omt s VAL 6 CO -0.17 0.25 0.81 -0.62 0.00 0.00 0.00 175.10 175.36 1omt s ASP 7 N 0.72 6.26 -1.08 3.32 -1.08 -1.26 -4.93 116.67 118.62 1omt s ASP 7 Ca 0.42 -0.71 -0.05 0.00 -0.52 0.00 0.00 52.55 51.69 1omt s ASP 7 Cb -0.19 -2.37 0.12 0.00 -1.46 0.00 0.00 42.92 39.02 1omt s ASP 7 CO 0.22 -1.11 2.46 0.00 0.52 0.00 0.00 175.17 177.25 1omt h SER 9 N 4.15 0.00 -0.36 0.00 0.02 -1.97 -3.27 113.55 112.12 1omt h SER 9 Ca 0.62 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.57 1omt h SER 9 Cb 0.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.95 1omt h SER 9 CO 1.31 0.04 0.00 -0.62 -1.14 0.00 0.00 176.83 176.41 1omt n GLU 10 N -2.70 2.83 -3.34 3.45 -0.58 -1.26 -4.89 120.64 114.16 1omt n GLU 10 Ca -0.01 -1.72 -0.19 0.00 -0.42 0.00 0.00 57.16 54.83 1omt n GLU 10 Cb 0.57 -1.74 -0.01 0.00 -0.57 0.00 0.00 31.44 29.69 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 -1.82 2.88 0.83 -0.32 1.51 -1.23 -4.65 117.35 114.55 1omt s TYR 11 Ca 0.30 -0.36 -0.09 0.00 -1.01 0.00 0.00 57.07 55.91 1omt s TYR 11 Cb 0.21 -2.17 0.15 0.00 -0.11 0.00 0.00 41.96 40.04 1omt s TYR 11 CO 0.13 -0.18 1.15 -1.25 -1.11 0.00 0.00 175.55 174.29 1omt s PRO 12 N -4.21 1.29 -0.03 -1.71 0.04 -1.26 -5.02 135.00 124.10 1omt s PRO 12 Ca 0.49 -0.61 0.05 0.00 0.04 0.00 0.00 61.00 60.97 1omt s PRO 12 Cb -0.08 -2.07 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 1omt s PRO 12 CO 0.31 -1.86 -0.18 0.15 0.04 0.00 0.00 177.00 175.45 1omt s LYS 13 N -5.52 1.68 0.00 4.56 1.02 -1.26 -5.00 119.74 115.22 1omt s LYS 13 Ca 0.69 -0.65 0.00 0.00 0.02 0.00 0.00 55.97 56.03 1omt s LYS 13 Cb -0.06 -1.53 0.00 0.00 -0.52 0.00 0.00 37.83 35.73 1omt s LYS 13 CO 0.48 0.32 0.79 -0.35 -0.92 0.00 0.00 175.35 175.68 1omt n PRO 14 N 2.89 0.99 -3.62 -1.68 -0.04 -1.26 -4.66 135.00 127.62 1omt n PRO 14 Ca -0.17 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.27 1omt n PRO 14 Cb 0.53 -1.20 -0.05 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 -1.60 -2.07 -0.13 0.55 0.00 -1.26 -5.15 121.76 112.10 1omt s ALA 15 Ca 0.00 2.34 -0.07 0.00 0.00 0.00 0.00 51.96 54.23 1omt s ALA 15 Cb 0.00 -1.68 -0.04 0.00 0.00 0.00 0.00 23.12 21.40 1omt s ALA 15 CO 0.00 -0.71 0.12 0.00 0.00 0.00 0.00 175.76 175.17 1omt n THR 17 N 2.34 0.00 0.00 0.00 -2.24 -1.26 -4.96 114.28 108.17 1omt n THR 17 Ca -0.19 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1omt n THR 17 Cb 0.54 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 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 0.00 3.22 -0.00 -1.26 -5.03 117.00 113.93 1omt n LEU 18 Ca 0.04 -0.46 0.00 0.00 -0.00 0.00 0.00 56.01 55.59 1omt n LEU 18 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.61 1omt n LEU 18 CO 0.12 0.00 0.00 -1.84 -0.00 0.00 0.00 177.39 175.67 1omt n GLU 19 N -0.96 -0.99 -4.01 1.47 0.00 -1.26 -5.00 120.64 109.90 1omt n GLU 19 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 57.16 56.98 1omt n GLU 19 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 31.44 31.28 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 -0.72 0.48 -0.50 -1.84 5.04 -1.26 -4.89 117.35 113.66 1omt s TYR 20 Ca 0.00 -0.08 0.06 0.00 -2.44 0.00 0.00 57.07 54.61 1omt s TYR 20 Cb 0.00 -0.52 0.20 0.00 0.35 0.00 0.00 41.96 41.99 1omt s TYR 20 CO 0.00 -0.16 0.77 0.54 -1.34 0.00 0.00 175.55 175.36 1omt n ARG 21 N 4.16 0.52 -1.89 4.97 1.74 -1.18 -5.04 116.66 119.95 1omt n ARG 21 Ca -0.25 -1.92 -0.43 0.00 -0.77 0.00 0.00 57.85 54.48 1omt n ARG 21 Cb 0.50 -1.35 -0.03 0.00 -1.02 0.00 0.00 32.46 30.57 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 0.86 3.86 -0.19 5.56 0.04 -1.07 -3.58 135.00 140.48 1omt s PRO 22 Ca 0.30 2.09 -0.05 0.00 0.04 0.00 0.00 61.00 63.38 1omt s PRO 22 Cb 0.03 -4.11 -0.02 0.00 0.04 0.00 0.00 34.50 30.43 1omt s PRO 22 CO -0.07 -1.24 -0.01 -0.51 0.04 0.00 0.00 177.00 175.21 1omt s LEU 23 N 5.26 3.24 0.75 -3.56 1.43 -0.91 0.27 118.68 125.16 1omt s LEU 23 Ca 0.81 -0.19 -0.12 0.00 -1.03 0.00 0.00 54.13 53.61 1omt s LEU 23 Cb -0.33 -1.81 0.04 0.00 0.03 0.00 0.00 46.19 44.12 1omt s LEU 23 CO 0.33 0.09 1.12 0.00 0.23 0.00 0.00 176.35 178.12 1omt s GLY 25 N -4.31 2.07 0.28 0.00 0.00 -0.46 -1.26 107.32 103.64 1omt s GLY 25 Ca 0.60 -1.79 0.01 0.00 0.00 0.00 0.00 44.72 43.53 1omt s GLY 25 CO 0.52 -1.71 1.75 1.48 0.00 0.00 0.00 173.10 175.14 1omt h SER 26 N 2.15 0.60 0.16 1.64 4.64 -0.44 -1.06 113.55 121.24 1omt h SER 26 Ca -0.38 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 1omt h SER 26 Cb 1.25 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1omt h SER 26 CO 0.62 0.76 0.00 -0.90 -0.87 0.00 0.00 176.83 176.43 1omt n ASP 27 N -4.18 0.19 -0.01 4.97 5.75 -1.26 -4.78 116.55 117.23 1omt n ASP 27 Ca 0.01 0.58 0.00 0.00 -0.01 0.00 0.00 54.79 55.37 1omt n ASP 27 Cb 0.34 -0.61 0.00 0.00 -1.03 0.00 0.00 41.12 39.83 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 -1.75 -0.74 -4.48 -1.12 4.05 -0.40 -5.07 115.26 105.75 1omt n ASN 28 Ca 0.00 0.00 -0.32 0.00 0.45 0.00 0.00 54.58 54.72 1omt n ASN 28 Cb 0.06 -0.36 -0.12 0.00 1.23 0.00 0.00 39.78 40.59 1omt n ASN 28 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1omt s LYS 29 N -3.16 2.29 0.30 1.20 2.20 -1.26 -4.88 119.74 116.43 1omt s LYS 29 Ca 0.00 -0.85 -0.05 0.00 -0.36 0.00 0.00 55.97 54.71 1omt s LYS 29 Cb 0.00 -2.30 -0.05 0.00 -1.51 0.00 0.00 37.83 33.97 1omt s LYS 29 CO 0.00 0.58 0.57 0.99 -0.36 0.00 0.00 175.35 177.13 1omt s THR 30 N -0.87 5.01 -0.12 3.43 2.01 -1.26 -1.36 115.64 122.48 1omt s THR 30 Ca 0.14 0.06 0.02 0.00 0.31 0.00 0.00 61.69 62.22 1omt s THR 30 Cb -0.11 -3.74 0.01 0.00 0.01 0.00 0.00 72.50 68.68 1omt s THR 30 CO 0.04 -0.36 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.13 1omt s TYR 31 N -2.12 2.21 0.18 4.92 1.51 -0.50 -4.94 117.35 118.62 1omt s TYR 31 Ca 0.44 -1.10 -0.09 0.00 -1.01 0.00 0.00 57.07 55.31 1omt s TYR 31 Cb -0.11 -1.57 0.26 0.00 -0.11 0.00 0.00 41.96 40.43 1omt s TYR 31 CO 0.31 -0.55 1.11 0.41 -1.11 0.00 0.00 175.55 175.72 1omt n GLY 32 N 4.25 -1.32 0.00 0.71 0.00 -1.26 -2.14 105.19 105.42 1omt n GLY 32 Ca -0.19 0.78 0.00 0.00 0.00 0.00 0.00 46.02 46.61 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 -5.11 0.00 -0.18 1.61 0.23 -1.25 -2.61 115.26 107.95 1omt n ASN 33 Ca 0.10 -0.27 -0.09 0.00 -0.53 0.00 0.00 54.58 53.78 1omt n ASN 33 Cb 0.32 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.03 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 0.85 -0.25 -3.83 2.10 -1.85 -1.67 116.57 111.93 1omt h LYS 34 Ca 0.00 -0.23 0.05 0.00 -2.00 0.00 0.00 60.65 58.47 1omt h LYS 34 Cb 0.00 -0.10 -0.04 0.00 -0.90 0.00 0.00 32.23 31.18 1omt h LYS 34 CO 0.00 0.84 -0.04 0.00 -2.00 0.00 0.00 179.45 178.25 1omt h ASN 36 N 0.03 -0.38 -0.47 0.00 2.35 -1.90 0.10 115.58 115.32 1omt h ASN 36 Ca 0.12 -0.05 0.08 0.00 -0.55 0.00 0.00 56.30 55.90 1omt h ASN 36 Cb 0.17 0.10 -0.07 0.00 0.05 0.00 0.00 38.32 38.57 1omt h ASN 36 CO -0.23 -0.19 0.05 0.15 -1.65 0.00 0.00 177.43 175.56 1omt h PHE 37 N -0.54 0.07 -0.04 1.19 3.57 -1.08 0.77 116.94 120.88 1omt h PHE 37 Ca -0.05 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 1omt h PHE 37 Cb 0.40 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1omt h PHE 37 CO -0.03 -0.05 -0.21 0.00 -2.23 0.00 0.00 178.31 175.80 1omt h ASN 39 N 0.06 0.00 1.08 0.00 2.35 0.12 -0.59 115.58 118.61 1omt h ASN 39 Ca 0.01 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.59 1omt h ASN 39 Cb 0.40 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 1omt h ASN 39 CO 0.03 0.13 -0.95 0.00 -1.65 0.00 0.00 177.43 174.98 1omt h ALA 40 N 1.87 0.56 0.02 -0.83 0.00 -0.25 -0.60 119.26 120.03 1omt h ALA 40 Ca -0.00 -0.80 -0.21 0.00 0.00 0.00 0.00 54.91 53.90 1omt h ALA 40 Cb 0.64 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1omt h ALA 40 CO 0.02 1.02 -0.96 0.28 0.00 0.00 0.00 179.25 179.60 1omt h VAL 41 N 0.00 1.57 0.00 0.00 2.07 -0.76 0.70 116.25 119.84 1omt h VAL 41 Ca -0.06 -2.94 -0.23 0.00 0.82 0.00 0.00 66.70 64.30 1omt h VAL 41 Cb 1.63 2.66 -0.04 0.00 -1.52 0.00 0.00 31.29 34.02 1omt h VAL 41 CO 0.09 0.85 -1.34 -0.37 0.02 0.00 0.00 177.57 176.82 1omt h VAL 42 N 0.06 1.01 0.00 2.57 -1.51 -1.15 0.60 116.25 117.83 1omt h VAL 42 Ca -0.04 -2.71 -0.07 0.00 -1.23 0.00 0.00 66.70 62.64 1omt h VAL 42 Cb 1.64 2.46 -0.01 0.00 -2.13 0.00 0.00 31.29 33.25 1omt h VAL 42 CO 0.14 0.58 -1.35 1.21 -1.23 0.00 0.00 177.57 176.92 1omt n GLU 43 N -3.11 0.62 -0.20 5.19 2.13 -0.24 -3.82 120.64 121.21 1omt n GLU 43 Ca -0.09 0.10 0.06 0.00 0.66 0.00 0.00 57.16 57.89 1omt n GLU 43 Cb 0.95 -1.76 0.16 0.00 0.27 0.00 0.00 31.44 31.06 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 -2.69 2.03 -0.06 4.31 3.41 0.24 -4.85 113.62 116.01 1omt n SER 44 Ca -0.05 -2.02 -0.01 0.00 -0.26 0.00 0.00 58.87 56.53 1omt n SER 44 Cb 0.68 -0.26 -0.00 0.00 -0.26 0.00 0.00 64.21 64.36 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 0.57 -3.81 -0.08 4.04 5.15 -1.24 -2.39 115.26 117.50 1omt n ASN 45 Ca 0.12 0.02 -0.01 0.00 -0.60 0.00 0.00 54.58 54.11 1omt n ASN 45 Cb 0.33 -1.38 -0.00 0.00 -0.53 0.00 0.00 39.78 38.19 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 -1.94 0.50 0.00 8.20 0.00 0.21 -4.88 105.19 107.28 1omt n GLY 46 Ca -0.01 -0.47 0.14 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.91 0.00 -1.86 2.61 5.66 -1.01 -4.81 114.28 111.95 1omt n THR 47 Ca -0.01 -0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.69 1omt n THR 47 Cb 0.06 -0.49 0.04 0.00 -1.55 0.00 0.00 70.33 68.40 1omt n THR 47 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1omt s LEU 48 N -2.84 2.94 -0.13 1.09 2.96 -1.26 -5.01 118.68 116.43 1omt s LEU 48 Ca 0.19 1.19 -0.06 0.00 -0.22 0.00 0.00 54.13 55.23 1omt s LEU 48 Cb 0.19 -4.02 0.06 0.00 0.50 0.00 0.00 46.19 42.92 1omt s LEU 48 CO 0.51 -1.29 0.29 0.42 -1.32 0.00 0.00 176.35 174.95 1omt s THR 49 N -3.32 -0.18 0.10 3.68 -4.23 -1.26 -4.94 115.64 105.49 1omt s THR 49 Ca 0.58 0.18 -0.32 0.00 -1.18 0.00 0.00 61.69 60.95 1omt s THR 49 Cb -0.11 -0.45 -0.11 0.00 1.34 0.00 0.00 72.50 73.17 1omt s THR 49 CO 0.52 0.07 1.81 -0.11 -0.54 0.00 0.00 174.62 176.38 1omt n LEU 50 N 4.63 3.84 0.14 4.79 7.94 -1.26 0.33 117.00 137.40 1omt n LEU 50 Ca -0.19 1.00 0.06 0.00 -1.11 0.00 0.00 56.01 55.77 1omt n LEU 50 Cb 0.52 -1.51 0.04 0.00 0.53 0.00 0.00 43.42 43.01 1omt n LEU 50 CO 0.09 0.08 0.37 -1.28 -1.11 0.00 0.00 177.39 175.55 1omt h SER 51 N 8.29 0.00 -1.15 1.96 0.87 -1.37 -3.45 113.55 118.71 1omt h SER 51 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 1omt h SER 51 Cb 1.23 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 1omt h SER 51 CO 0.94 0.30 0.00 0.00 -0.53 0.00 0.00 176.83 177.54 1omt n HIS 52 N -3.05 0.00 -1.15 2.24 -0.00 -1.26 -4.97 115.22 107.04 1omt n HIS 52 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.44 1omt n HIS 52 Cb 0.67 0.00 0.19 0.00 -0.00 0.00 0.00 29.99 30.84 1omt n HIS 52 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1omt s PHE 53 N -2.00 1.94 0.01 -1.40 0.40 -1.26 -1.38 117.98 114.29 1omt s PHE 53 Ca 0.00 0.93 0.00 0.00 -0.60 0.00 0.00 56.93 57.26 1omt s PHE 53 Cb 0.00 -3.29 0.00 0.00 0.51 0.00 0.00 43.02 40.24 1omt s PHE 53 CO 0.00 -3.05 0.00 0.41 0.70 0.00 0.00 175.22 173.28 1omt n GLY 54 N -1.04 -2.06 3.87 4.36 0.00 0.77 -4.63 105.19 106.46 1omt n GLY 54 Ca 0.06 -1.42 -0.32 0.00 0.00 0.00 0.00 46.02 44.34 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 -0.27 3.80 0.00 1.61 1.02 -1.24 -2.78 119.74 121.88 1omt s LYS 55 Ca 0.00 0.28 0.00 0.00 0.02 0.00 0.00 55.97 56.27 1omt s LYS 55 Cb 0.00 -2.64 0.00 0.00 -0.52 0.00 0.00 37.83 34.67 1omt s LYS 55 CO 0.00 0.31 0.30 0.00 -0.92 0.00 0.00 175.35 175.04