#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 1.11 -0.29 1.96 0.00 -1.26 -5.12 120.51 116.91 1omt n ALA 2 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1omt n ALA 2 Cb 0.00 0.00 0.28 0.00 0.00 0.00 0.00 19.45 19.73 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 -1.99 -4.54 -3.63 0.00 0.00 -1.26 -5.03 120.51 104.06 1omt n ALA 3 Ca 0.00 -1.78 -0.24 0.00 0.00 0.00 0.00 53.44 51.43 1omt n ALA 3 Cb 0.00 -1.60 -0.17 0.00 0.00 0.00 0.00 19.45 17.68 1omt n ALA 3 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1omt s VAL 4 N -2.16 -0.09 0.12 0.00 1.01 -1.26 -5.14 120.40 112.88 1omt s VAL 4 Ca 0.65 0.05 0.09 0.00 0.00 0.00 0.00 61.98 62.77 1omt s VAL 4 Cb -0.14 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 1omt s VAL 4 CO 0.57 -0.11 -0.21 -0.44 0.00 0.00 0.00 175.10 174.90 1omt s SER 5 N 2.15 2.66 -0.12 3.32 0.01 -1.26 -4.79 113.70 115.66 1omt s SER 5 Ca 0.03 -0.72 -0.05 0.00 1.31 0.00 0.00 55.95 56.52 1omt s SER 5 Cb -0.15 -0.15 -0.04 0.00 0.21 0.00 0.00 66.02 65.89 1omt s SER 5 CO -0.07 0.06 0.07 -0.69 0.41 0.00 0.00 173.24 173.03 1omt s VAL 6 N -1.29 4.94 0.62 3.43 1.01 -1.26 -5.10 120.40 122.76 1omt s VAL 6 Ca 0.09 -0.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.96 1omt s VAL 6 Cb -0.09 -3.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 1omt s VAL 6 CO 0.05 0.59 1.03 -0.62 0.00 0.00 0.00 175.10 176.14 1omt s ASP 7 N -0.73 6.12 -0.41 3.32 2.15 -1.26 -4.98 116.67 120.87 1omt s ASP 7 Ca 0.12 1.35 0.11 0.00 0.43 0.00 0.00 52.55 54.56 1omt s ASP 7 Cb -0.12 -2.37 0.37 0.00 -0.30 0.00 0.00 42.92 40.50 1omt s ASP 7 CO 0.03 -0.92 0.84 0.00 -0.17 0.00 0.00 175.17 174.94 1omt h SER 9 N 2.97 0.00 -0.73 0.00 0.87 -1.99 -3.30 113.55 111.36 1omt h SER 9 Ca 0.09 0.00 -0.38 0.00 -1.23 0.00 0.00 61.79 60.26 1omt h SER 9 Cb 0.89 0.00 -0.23 0.00 -0.44 0.00 0.00 62.40 62.63 1omt h SER 9 CO 0.60 0.96 0.49 -0.62 -0.53 0.00 0.00 176.83 177.73 1omt n GLU 10 N -3.09 1.92 -4.56 2.24 4.71 -1.26 -4.90 120.64 115.70 1omt n GLU 10 Ca -0.13 -2.21 -0.26 0.00 -0.01 0.00 0.00 57.16 54.55 1omt n GLU 10 Cb 1.01 -1.87 -0.11 0.00 -1.01 0.00 0.00 31.44 29.47 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 -2.43 2.38 0.61 -0.32 2.02 -1.25 -4.61 117.35 113.76 1omt s TYR 11 Ca 0.42 -0.59 -0.03 0.00 -0.37 0.00 0.00 57.07 56.50 1omt s TYR 11 Cb 0.35 -1.49 0.04 0.00 -0.40 0.00 0.00 41.96 40.47 1omt s TYR 11 CO 0.08 0.49 0.88 -1.25 -1.57 0.00 0.00 175.55 174.18 1omt s PRO 12 N -3.67 2.47 -0.04 -1.71 0.04 -1.26 -5.05 135.00 125.78 1omt s PRO 12 Ca 0.33 -0.48 0.06 0.00 0.04 0.00 0.00 61.00 60.96 1omt s PRO 12 Cb 0.05 -2.34 -0.01 0.00 0.04 0.00 0.00 34.50 32.24 1omt s PRO 12 CO 0.17 -0.90 -0.23 0.15 0.04 0.00 0.00 177.00 176.23 1omt s LYS 13 N -4.97 2.14 -0.00 4.56 1.02 -1.26 -5.00 119.74 116.23 1omt s LYS 13 Ca 0.58 -0.81 0.00 0.00 0.02 0.00 0.00 55.97 55.75 1omt s LYS 13 Cb -0.10 -1.91 0.01 0.00 -0.52 0.00 0.00 37.83 35.31 1omt s LYS 13 CO 0.42 0.39 0.77 -0.35 -0.92 0.00 0.00 175.35 175.66 1omt n PRO 14 N 2.83 1.02 -3.51 -1.68 -0.04 -1.26 -4.70 135.00 127.67 1omt n PRO 14 Ca -0.17 -0.02 0.01 0.00 -0.04 0.00 0.00 63.50 63.28 1omt n PRO 14 Cb 0.52 -1.24 -0.05 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 -1.53 -2.71 0.26 0.55 0.00 -1.26 -5.17 121.76 111.89 1omt s ALA 15 Ca 0.00 2.01 0.09 0.00 0.00 0.00 0.00 51.96 54.06 1omt s ALA 15 Cb 0.00 -2.00 -0.04 0.00 0.00 0.00 0.00 23.12 21.08 1omt s ALA 15 CO 0.00 -0.57 0.07 0.00 0.00 0.00 0.00 175.76 175.26 1omt n THR 17 N -0.97 0.00 0.04 0.00 -2.24 -1.26 -4.97 114.28 104.87 1omt n THR 17 Ca -0.07 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.72 1omt n THR 17 Cb 0.58 -0.01 -0.01 0.00 -2.10 0.00 0.00 70.33 68.80 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 0.04 -4.72 3.22 -0.00 -1.26 -5.01 117.00 109.27 1omt n LEU 18 Ca 0.00 -0.38 -0.61 0.00 -0.00 0.00 0.00 56.01 55.02 1omt n LEU 18 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.34 1omt n LEU 18 CO 0.00 0.01 1.24 -0.62 -0.00 0.00 0.00 177.39 178.02 1omt n GLU 19 N -1.15 0.73 -3.10 1.47 1.02 -1.26 -4.84 120.64 113.52 1omt n GLU 19 Ca 0.00 0.27 -0.41 0.00 -0.02 0.00 0.00 57.16 57.00 1omt n GLU 19 Cb 0.02 -1.88 -0.06 0.00 -0.02 0.00 0.00 31.44 29.49 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 3.24 3.23 -0.46 -0.32 5.04 -1.26 -4.81 117.35 122.00 1omt s TYR 20 Ca 1.00 0.66 0.06 0.00 -2.44 0.00 0.00 57.07 56.36 1omt s TYR 20 Cb -1.22 -2.98 0.22 0.00 0.35 0.00 0.00 41.96 38.33 1omt s TYR 20 CO 0.71 -0.45 0.65 0.54 -1.34 0.00 0.00 175.55 175.67 1omt n ARG 21 N 5.87 0.58 -1.86 4.97 1.74 -1.24 -5.05 116.66 121.67 1omt n ARG 21 Ca -0.00 -2.44 -0.42 0.00 -0.77 0.00 0.00 57.85 54.22 1omt n ARG 21 Cb 0.49 -1.45 -0.03 0.00 -1.02 0.00 0.00 32.46 30.45 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 0.18 4.18 -0.13 5.56 0.04 -0.89 -2.79 135.00 141.16 1omt s PRO 22 Ca 0.32 2.42 0.02 0.00 0.04 0.00 0.00 61.00 63.80 1omt s PRO 22 Cb 0.12 -3.50 -0.00 0.00 0.04 0.00 0.00 34.50 31.15 1omt s PRO 22 CO -0.16 -0.74 -0.18 -0.51 0.04 0.00 0.00 177.00 175.45 1omt s LEU 23 N 2.36 2.40 0.65 -3.56 1.43 -0.89 0.33 118.68 121.40 1omt s LEU 23 Ca 0.75 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 53.28 1omt s LEU 23 Cb -0.42 -1.52 -0.02 0.00 0.03 0.00 0.00 46.19 44.26 1omt s LEU 23 CO 0.33 0.14 1.05 0.00 0.23 0.00 0.00 176.35 178.10 1omt s GLY 25 N -4.22 1.89 0.61 0.00 0.00 -1.00 -2.02 107.32 102.58 1omt s GLY 25 Ca 0.56 -1.96 0.38 0.00 0.00 0.00 0.00 44.72 43.71 1omt s GLY 25 CO 0.53 -1.70 2.20 1.76 0.00 0.00 0.00 173.10 175.89 1omt h SER 26 N 2.26 0.00 0.32 1.64 0.02 -1.55 -1.17 113.55 115.07 1omt h SER 26 Ca -0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.56 1omt h SER 26 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1omt h SER 26 CO 0.65 0.02 0.00 -0.90 -1.14 0.00 0.00 176.83 175.46 1omt n ASP 27 N -3.18 0.28 -0.01 3.07 5.68 -1.26 -4.82 116.55 116.31 1omt n ASP 27 Ca -0.02 0.60 0.00 0.00 -0.50 0.00 0.00 54.79 54.87 1omt n ASP 27 Cb 0.18 -0.65 0.00 0.00 -1.14 0.00 0.00 41.12 39.51 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 -1.84 -0.76 -0.94 -1.12 5.15 -0.44 -5.06 115.26 110.24 1omt n ASN 28 Ca 0.01 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.99 1omt n ASN 28 Cb 0.11 -0.37 0.00 0.00 -0.53 0.00 0.00 39.78 39.00 1omt n ASN 28 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1omt n LYS 29 N -0.97 0.98 -4.32 1.20 5.02 -1.25 -4.97 118.16 113.84 1omt n LYS 29 Ca 0.00 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.09 1omt n LYS 29 Cb 0.37 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.27 1omt n LYS 29 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1omt s THR 30 N -1.19 1.71 -0.10 -0.18 2.01 -1.26 -2.37 115.64 114.26 1omt s THR 30 Ca 0.00 -1.97 0.02 0.00 0.31 0.00 0.00 61.69 60.05 1omt s THR 30 Cb 0.00 -1.85 0.01 0.00 0.01 0.00 0.00 72.50 70.68 1omt s THR 30 CO 0.00 -0.41 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.07 1omt s TYR 31 N -2.33 1.79 0.15 4.92 2.02 -0.79 -4.95 117.35 118.17 1omt s TYR 31 Ca 0.16 -0.79 -0.09 0.00 -0.37 0.00 0.00 57.07 55.98 1omt s TYR 31 Cb -0.04 -1.31 0.20 0.00 -0.40 0.00 0.00 41.96 40.41 1omt s TYR 31 CO 0.06 -0.42 0.96 0.41 -1.57 0.00 0.00 175.55 174.99 1omt n GLY 32 N 4.13 -1.19 0.00 0.71 0.00 -1.26 -2.09 105.19 105.49 1omt n GLY 32 Ca -0.20 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.50 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 -4.94 0.00 -0.31 1.61 0.23 -1.25 -2.09 115.26 108.50 1omt n ASN 33 Ca 0.08 -0.61 0.13 0.00 -0.53 0.00 0.00 54.58 53.64 1omt n ASN 33 Cb 0.27 0.00 0.30 0.00 -2.08 0.00 0.00 39.78 38.27 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 0.48 0.26 -3.83 2.10 -1.81 0.31 116.57 114.08 1omt h LYS 34 Ca 0.00 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.61 1omt h LYS 34 Cb 0.00 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.22 1omt h LYS 34 CO 0.00 0.32 -0.13 0.00 -2.00 0.00 0.00 179.45 177.64 1omt h ASN 36 N -0.79 0.00 0.00 0.00 2.35 -1.78 -0.82 115.58 114.54 1omt h ASN 36 Ca -0.04 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1omt h ASN 36 Cb 0.51 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.88 1omt h ASN 36 CO 0.06 0.00 -0.02 0.15 -1.65 0.00 0.00 177.43 175.97 1omt h PHE 37 N 0.00 0.00 0.00 1.19 3.57 -0.69 -3.24 116.94 117.77 1omt h PHE 37 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1omt h PHE 37 Cb 0.10 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.84 1omt h PHE 37 CO 0.00 0.90 -0.03 0.00 -2.23 0.00 0.00 178.31 176.95 1omt h ASN 39 N 0.00 0.12 1.49 0.00 2.35 -1.25 0.26 115.58 118.55 1omt h ASN 39 Ca -0.00 -0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.65 1omt h ASN 39 Cb 0.05 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1omt h ASN 39 CO 0.00 0.45 -0.28 0.00 -1.65 0.00 0.00 177.43 175.94 1omt h ALA 40 N 1.56 0.85 0.00 -0.83 0.00 -0.93 -1.69 119.26 118.23 1omt h ALA 40 Ca 0.01 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 1omt h ALA 40 Cb 0.63 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1omt h ALA 40 CO 0.05 0.36 -0.90 0.28 0.00 0.00 0.00 179.25 179.03 1omt h VAL 41 N 0.00 0.76 0.00 0.00 2.07 -0.35 -1.66 116.25 117.06 1omt h VAL 41 Ca -0.00 -2.19 0.00 0.00 0.82 0.00 0.00 66.70 65.33 1omt h VAL 41 Cb 1.11 2.28 0.00 0.00 -1.52 0.00 0.00 31.29 33.16 1omt h VAL 41 CO 0.04 0.43 -0.78 -0.37 0.02 0.00 0.00 177.57 176.91 1omt h VAL 42 N 0.00 0.00 0.03 2.57 -1.51 -0.42 0.60 116.25 117.51 1omt h VAL 42 Ca -0.07 -0.93 -0.32 0.00 -1.23 0.00 0.00 66.70 64.16 1omt h VAL 42 Cb 1.48 1.53 -0.05 0.00 -2.13 0.00 0.00 31.29 32.12 1omt h VAL 42 CO 0.06 0.00 -1.84 -1.84 -1.23 0.00 0.00 177.57 172.72 1omt n GLU 43 N -2.67 0.66 -0.07 5.19 -0.00 -0.65 -3.83 120.64 119.28 1omt n GLU 43 Ca 0.01 0.26 0.04 0.00 -0.00 0.00 0.00 57.16 57.47 1omt n GLU 43 Cb 0.53 -1.75 0.15 0.00 -0.00 0.00 0.00 31.44 30.37 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 -3.11 0.80 -1.98 -1.84 2.88 -0.63 -4.85 113.62 104.89 1omt n SER 44 Ca -0.22 -1.91 -0.19 0.00 -1.33 0.00 0.00 58.87 55.22 1omt n SER 44 Cb 1.06 -0.09 -0.03 0.00 -0.75 0.00 0.00 64.21 64.40 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 -0.10 -5.47 -1.26 -3.46 3.02 -1.22 -0.87 115.26 105.90 1omt n ASN 45 Ca 0.07 0.13 -0.12 0.00 -0.03 0.00 0.00 54.58 54.63 1omt n ASN 45 Cb 0.14 -4.56 -0.02 0.00 -0.61 0.00 0.00 39.78 34.73 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 -0.90 0.26 0.61 7.41 0.00 0.20 -4.86 105.19 107.90 1omt n GLY 46 Ca -0.22 -0.40 0.09 0.00 0.00 0.00 0.00 46.02 45.49 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 -3.64 0.00 0.00 2.61 -2.24 -0.05 -4.67 114.28 106.29 1omt n THR 47 Ca -0.14 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 1omt n THR 47 Cb 0.55 1.32 0.00 0.00 -2.10 0.00 0.00 70.33 70.10 1omt n THR 47 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1omt n LEU 48 N 0.65 2.89 0.00 3.22 7.94 -1.26 -5.04 117.00 125.40 1omt n LEU 48 Ca 0.09 0.02 0.00 0.00 -1.11 0.00 0.00 56.01 55.01 1omt n LEU 48 Cb 0.42 -0.01 0.00 0.00 0.53 0.00 0.00 43.42 44.35 1omt n LEU 48 CO 0.14 -0.01 0.00 0.35 -1.11 0.00 0.00 177.39 176.76 1omt n THR 49 N -0.53 -0.22 -1.25 1.96 -2.24 -1.26 -4.40 114.28 106.34 1omt n THR 49 Ca 0.00 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.46 1omt n THR 49 Cb 0.00 -0.08 0.10 0.00 -2.10 0.00 0.00 70.33 68.25 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 -0.37 3.08 -0.14 3.22 2.96 -1.26 -1.77 118.68 124.40 1omt s LEU 50 Ca 0.00 1.97 -0.02 0.00 -0.22 0.00 0.00 54.13 55.87 1omt s LEU 50 Cb 0.00 -4.54 -0.08 0.00 0.50 0.00 0.00 46.19 42.07 1omt s LEU 50 CO 0.00 -2.20 -0.15 -1.54 -1.32 0.00 0.00 176.35 171.14 1omt n SER 51 N -3.41 2.31 -3.59 3.68 3.41 -0.86 -4.68 113.62 110.49 1omt n SER 51 Ca 0.10 0.01 0.02 0.00 -0.26 0.00 0.00 58.87 58.74 1omt n SER 51 Cb 0.52 -0.29 -0.01 0.00 -0.26 0.00 0.00 64.21 64.17 1omt n SER 51 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1omt s HIS 52 N -2.28 -0.02 0.94 7.33 -3.43 -1.26 -4.99 115.29 111.59 1omt s HIS 52 Ca -0.20 -0.01 -0.13 0.00 -0.80 0.00 0.00 55.06 53.93 1omt s HIS 52 Cb 0.06 0.51 0.16 0.00 -1.43 0.00 0.00 32.58 31.88 1omt s HIS 52 CO 0.30 -0.07 1.15 -0.06 -2.00 0.00 0.00 174.74 174.06 1omt s PHE 53 N -2.12 2.26 0.07 0.38 0.40 -1.26 -2.26 117.98 115.44 1omt s PHE 53 Ca 0.14 0.79 0.00 0.00 -0.60 0.00 0.00 56.93 57.26 1omt s PHE 53 Cb 0.05 -3.44 0.00 0.00 0.51 0.00 0.00 43.02 40.13 1omt s PHE 53 CO -0.05 -2.54 0.00 0.41 0.70 0.00 0.00 175.22 173.74 1omt n GLY 54 N -2.17 -2.03 3.90 4.36 0.00 1.01 -4.60 105.19 105.66 1omt n GLY 54 Ca 0.08 -1.39 -0.28 0.00 0.00 0.00 0.00 46.02 44.43 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 -0.91 3.63 0.00 1.61 -2.85 -1.19 -1.88 119.74 118.14 1omt s LYS 55 Ca 0.00 0.04 0.04 0.00 -1.00 0.00 0.00 55.97 55.05 1omt s LYS 55 Cb 0.00 -2.60 0.23 0.00 -2.06 0.00 0.00 37.83 33.41 1omt s LYS 55 CO 0.00 0.15 0.71 0.00 0.10 0.00 0.00 175.35 176.31