#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 -3.13 -1.18 0.00 -1.26 -4.35 120.51 110.60 1omt n ALA 2 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.18 1omt n ALA 2 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 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 2.10 4.02 -2.76 0.00 0.00 -1.26 -5.02 120.51 117.59 1omt n ALA 3 Ca 0.00 -4.48 -0.42 0.00 0.00 0.00 0.00 53.44 48.54 1omt n ALA 3 Cb 0.00 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 18.61 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 -3.43 4.23 0.03 0.00 1.01 -1.26 -4.95 120.40 116.03 1omt s VAL 4 Ca 0.44 -0.53 -0.27 0.00 0.00 0.00 0.00 61.98 61.62 1omt s VAL 4 Cb 0.24 -4.81 0.07 0.00 0.00 0.00 0.00 36.38 31.88 1omt s VAL 4 CO -0.09 -1.63 0.63 -0.94 0.00 0.00 0.00 175.10 173.07 1omt s SER 5 N 3.89 -0.60 -0.03 3.32 1.04 -1.26 -4.95 113.70 115.11 1omt s SER 5 Ca 0.31 0.40 0.05 0.00 0.48 0.00 0.00 55.95 57.18 1omt s SER 5 Cb -0.10 0.55 -0.01 0.00 0.10 0.00 0.00 66.02 66.57 1omt s SER 5 CO 0.04 -0.74 -0.17 -0.69 0.98 0.00 0.00 173.24 172.65 1omt s VAL 6 N -2.22 1.40 -0.01 5.02 1.01 -1.26 -5.12 120.40 119.23 1omt s VAL 6 Ca -0.06 -0.72 -0.23 0.00 0.00 0.00 0.00 61.98 60.97 1omt s VAL 6 Cb -0.00 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.13 1omt s VAL 6 CO 0.01 0.40 0.69 -0.62 0.00 0.00 0.00 175.10 175.58 1omt s ASP 7 N -0.09 7.06 -0.38 3.32 2.15 -1.26 -4.98 116.67 122.50 1omt s ASP 7 Ca -0.01 1.27 0.13 0.00 0.43 0.00 0.00 52.55 54.37 1omt s ASP 7 Cb -0.10 -2.42 0.42 0.00 -0.30 0.00 0.00 42.92 40.53 1omt s ASP 7 CO 0.01 -0.01 0.96 0.00 -0.17 0.00 0.00 175.17 175.96 1omt n SER 9 N -0.13 1.97 -0.02 0.00 2.88 -1.26 -3.68 113.62 113.38 1omt n SER 9 Ca 0.21 -1.90 0.00 0.00 -1.33 0.00 0.00 58.87 55.85 1omt n SER 9 Cb 0.72 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 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 0.55 0.55 -3.01 -1.46 4.71 -1.26 -5.03 120.64 115.69 1omt n GLU 10 Ca 0.14 -0.90 -0.28 0.00 -0.01 0.00 0.00 57.16 56.11 1omt n GLU 10 Cb 0.33 -1.01 -0.02 0.00 -1.01 0.00 0.00 31.44 29.74 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 -0.40 3.51 0.34 -0.32 1.51 -1.24 -3.95 117.35 116.79 1omt s TYR 11 Ca 0.01 0.72 -0.27 0.00 -1.01 0.00 0.00 57.07 56.52 1omt s TYR 11 Cb 0.00 -2.20 -0.09 0.00 -0.11 0.00 0.00 41.96 39.56 1omt s TYR 11 CO 0.01 -0.04 1.07 -1.25 -1.11 0.00 0.00 175.55 174.22 1omt s PRO 12 N -4.15 4.41 0.24 -1.71 0.04 -1.26 -4.89 135.00 127.67 1omt s PRO 12 Ca 0.46 1.65 -0.22 0.00 0.04 0.00 0.00 61.00 62.93 1omt s PRO 12 Cb -0.10 -2.87 -0.09 0.00 0.04 0.00 0.00 34.50 31.48 1omt s PRO 12 CO 0.36 0.04 0.78 0.21 0.04 0.00 0.00 177.00 178.44 1omt s LYS 13 N -1.96 4.37 0.00 4.56 2.20 -1.25 -4.93 119.74 122.72 1omt s LYS 13 Ca 0.51 1.01 0.00 0.00 -0.36 0.00 0.00 55.97 57.13 1omt s LYS 13 Cb -0.27 -2.91 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 1omt s LYS 13 CO 0.34 0.39 0.77 -0.35 -0.36 0.00 0.00 175.35 176.14 1omt n PRO 14 N 0.79 0.94 -3.19 4.03 -0.04 -1.26 -4.59 135.00 131.68 1omt n PRO 14 Ca -0.02 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.49 1omt n PRO 14 Cb 0.51 -1.17 -0.03 0.00 -0.04 0.00 0.00 33.50 32.77 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 -1.65 -3.44 0.01 0.55 0.00 -1.26 -5.15 121.76 110.82 1omt s ALA 15 Ca 0.00 1.57 -0.16 0.00 0.00 0.00 0.00 51.96 53.37 1omt s ALA 15 Cb 0.00 -2.42 -0.06 0.00 0.00 0.00 0.00 23.12 20.64 1omt s ALA 15 CO 0.00 -1.27 0.44 0.00 0.00 0.00 0.00 175.76 174.93 1omt n THR 17 N 1.87 0.00 0.00 0.00 -2.24 -1.26 -4.95 114.28 107.70 1omt n THR 17 Ca -0.13 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1omt n THR 17 Cb 0.52 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 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 -1.45 0.00 0.00 3.22 -0.00 -1.26 -5.01 117.00 112.49 1omt n LEU 18 Ca 0.06 -0.16 0.00 0.00 -0.00 0.00 0.00 56.01 55.91 1omt n LEU 18 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.79 1omt n LEU 18 CO 0.26 0.00 0.00 -1.84 -0.00 0.00 0.00 177.39 175.81 1omt n GLU 19 N -1.09 -0.95 -3.83 1.47 0.00 -1.26 -4.98 120.64 110.01 1omt n GLU 19 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 57.16 56.91 1omt n GLU 19 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 31.44 31.27 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 -0.73 1.03 -0.50 -1.84 5.04 -1.26 -4.88 117.35 114.21 1omt s TYR 20 Ca 0.00 -0.43 0.06 0.00 -2.44 0.00 0.00 57.07 54.26 1omt s TYR 20 Cb 0.00 -0.99 0.22 0.00 0.35 0.00 0.00 41.96 41.53 1omt s TYR 20 CO 0.00 -0.42 0.82 0.54 -1.34 0.00 0.00 175.55 175.16 1omt n ARG 21 N 5.06 0.66 -2.00 4.97 1.74 -1.09 -5.05 116.66 120.95 1omt n ARG 21 Ca -0.09 -1.86 -0.41 0.00 -0.77 0.00 0.00 57.85 54.72 1omt n ARG 21 Cb 0.50 -1.45 -0.02 0.00 -1.02 0.00 0.00 32.46 30.47 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 0.77 4.26 0.02 5.56 0.04 -0.53 -3.81 135.00 141.32 1omt s PRO 22 Ca 0.31 2.32 0.08 0.00 0.04 0.00 0.00 61.00 63.74 1omt s PRO 22 Cb 0.12 -3.11 -0.03 0.00 0.04 0.00 0.00 34.50 31.53 1omt s PRO 22 CO -0.16 -0.44 -0.22 -0.51 0.04 0.00 0.00 177.00 175.71 1omt s LEU 23 N -0.29 2.37 0.47 -3.56 1.43 -0.79 0.31 118.68 118.62 1omt s LEU 23 Ca 0.60 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 53.25 1omt s LEU 23 Cb -0.42 -1.41 0.01 0.00 0.03 0.00 0.00 46.19 44.40 1omt s LEU 23 CO 0.43 0.28 0.68 0.00 0.23 0.00 0.00 176.35 177.96 1omt s GLY 25 N -4.29 1.51 0.43 0.00 0.00 -1.04 -3.55 107.32 100.37 1omt s GLY 25 Ca 0.51 -1.72 0.17 0.00 0.00 0.00 0.00 44.72 43.68 1omt s GLY 25 CO 0.37 -1.75 1.94 1.48 0.00 0.00 0.00 173.10 175.14 1omt h SER 26 N 2.50 0.00 0.00 1.64 4.64 0.14 -1.40 113.55 121.06 1omt h SER 26 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1omt h SER 26 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1omt h SER 26 CO 0.64 0.25 0.06 -2.24 -0.87 0.00 0.00 176.83 174.67 1omt h ASP 27 N 0.00 0.00 -0.16 4.97 3.04 -1.93 -3.45 116.42 118.89 1omt h ASP 27 Ca -0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1omt h ASP 27 Cb 0.48 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.77 1omt h ASP 27 CO 0.03 0.00 0.00 -3.20 -2.04 0.00 0.00 179.24 174.03 1omt n ASN 28 N -2.33 -0.65 -3.69 4.15 5.15 -0.53 -5.09 115.26 112.27 1omt n ASN 28 Ca -0.02 0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.75 1omt n ASN 28 Cb 0.10 -0.24 -0.05 0.00 -0.53 0.00 0.00 39.78 39.06 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 -0.75 1.13 -4.47 1.20 5.02 -1.25 -4.96 118.16 114.08 1omt n LYS 29 Ca 0.00 -2.44 -0.23 0.00 -2.02 0.00 0.00 58.31 53.62 1omt n LYS 29 Cb 0.24 0.73 -0.10 0.00 -0.02 0.00 0.00 35.03 35.88 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 -2.26 1.95 0.00 -0.18 2.01 -1.26 -2.51 115.64 113.39 1omt s THR 30 Ca 0.02 -2.19 0.01 0.00 0.31 0.00 0.00 61.69 59.83 1omt s THR 30 Cb 0.00 -2.47 -0.00 0.00 0.01 0.00 0.00 72.50 70.04 1omt s THR 30 CO 0.01 -0.30 -0.03 -0.31 -0.69 0.00 0.00 174.62 173.30 1omt s TYR 31 N -2.81 0.23 0.21 4.92 2.02 -0.08 -4.94 117.35 116.89 1omt s TYR 31 Ca 0.30 -0.12 -0.09 0.00 -0.37 0.00 0.00 57.07 56.79 1omt s TYR 31 Cb 0.02 -0.15 0.15 0.00 -0.40 0.00 0.00 41.96 41.58 1omt s TYR 31 CO 0.13 -0.03 1.81 0.78 -1.57 0.00 0.00 175.55 176.68 1omt h GLY 32 N 5.85 1.16 0.00 0.71 0.00 -1.89 -2.10 103.07 106.80 1omt h GLY 32 Ca -0.27 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.51 1omt h GLY 32 CO 0.49 0.53 0.00 1.16 0.00 0.00 0.00 176.54 178.72 1omt n ASN 33 N -4.41 0.00 0.14 0.19 6.94 -1.25 -1.45 115.26 115.42 1omt n ASN 33 Ca 0.07 -0.44 0.05 0.00 -0.02 0.00 0.00 54.58 54.24 1omt n ASN 33 Cb 0.11 0.00 0.49 0.00 -2.36 0.00 0.00 39.78 38.02 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 0.22 -0.11 -3.83 2.10 -1.92 -1.29 116.57 111.74 1omt h LYS 34 Ca 0.00 -0.03 -0.13 0.00 -2.00 0.00 0.00 60.65 58.50 1omt h LYS 34 Cb 0.00 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.29 1omt h LYS 34 CO 0.00 0.23 -0.42 0.00 -2.00 0.00 0.00 179.45 177.26 1omt h ASN 36 N 0.07 0.64 0.53 0.00 -0.26 -1.86 -1.28 115.58 113.42 1omt h ASN 36 Ca -0.02 -0.16 -0.03 0.00 -0.56 0.00 0.00 56.30 55.53 1omt h ASN 36 Cb 1.05 -0.17 0.01 0.00 -1.06 0.00 0.00 38.32 38.15 1omt h ASN 36 CO 0.09 0.63 -0.26 0.15 -1.06 0.00 0.00 177.43 176.98 1omt h PHE 37 N 0.61 -0.66 -0.20 1.19 3.57 -1.25 -3.16 116.94 117.05 1omt h PHE 37 Ca 0.16 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.69 1omt h PHE 37 Cb 0.18 0.22 -0.06 0.00 2.79 0.00 0.00 35.95 39.08 1omt h PHE 37 CO 0.00 -0.33 -0.16 0.00 -2.23 0.00 0.00 178.31 175.59 1omt h ASN 39 N -0.16 0.35 -0.36 0.00 2.35 -1.28 1.00 115.58 117.49 1omt h ASN 39 Ca 0.12 0.12 -0.12 0.00 -0.55 0.00 0.00 56.30 55.87 1omt h ASN 39 Cb 0.34 0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1omt h ASN 39 CO -0.30 -0.06 -0.23 0.00 -1.65 0.00 0.00 177.43 175.19 1omt h ALA 40 N 1.63 0.51 0.96 -0.83 0.00 -0.97 -1.28 119.26 119.27 1omt h ALA 40 Ca 0.71 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 1omt h ALA 40 Cb 2.03 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 19.71 1omt h ALA 40 CO -0.38 0.48 -0.46 0.28 0.00 0.00 0.00 179.25 179.18 1omt h VAL 41 N 0.57 0.03 0.00 0.00 2.07 0.14 0.36 116.25 119.42 1omt h VAL 41 Ca 0.07 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 1omt h VAL 41 Cb 0.79 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1omt h VAL 41 CO 0.06 0.00 -0.02 1.62 0.02 0.00 0.00 177.57 179.25 1omt h VAL 42 N -1.31 0.16 0.00 2.57 3.04 -1.18 0.83 116.25 120.36 1omt h VAL 42 Ca -0.13 -0.17 0.00 0.00 -1.01 0.00 0.00 66.70 65.39 1omt h VAL 42 Cb 0.99 1.14 0.00 0.00 -2.01 0.00 0.00 31.29 31.41 1omt h VAL 42 CO 0.22 0.02 -0.93 1.21 -1.01 0.00 0.00 177.57 177.07 1omt n GLU 43 N -3.28 0.33 -0.36 4.17 2.13 -0.48 -3.77 120.64 119.37 1omt n GLU 43 Ca -0.02 0.03 0.10 0.00 0.66 0.00 0.00 57.16 57.93 1omt n GLU 43 Cb 0.14 -1.64 0.29 0.00 0.27 0.00 0.00 31.44 30.51 1omt n GLU 43 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1omt n SER 44 N -2.08 3.85 -0.01 4.31 2.88 0.12 -4.90 113.62 117.80 1omt n SER 44 Ca 0.02 -2.06 -0.00 0.00 -1.33 0.00 0.00 58.87 55.50 1omt n SER 44 Cb 0.45 -0.45 -0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1omt n SER 44 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1omt n ASN 45 N 1.36 -4.92 0.00 -3.46 0.23 -0.75 -1.98 115.26 105.74 1omt n ASN 45 Ca 0.22 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.28 1omt n ASN 45 Cb 0.62 -2.43 0.00 0.00 -2.08 0.00 0.00 39.78 35.89 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1omt n GLY 46 N -0.45 0.66 0.12 4.83 0.00 0.12 -4.93 105.19 105.53 1omt n GLY 46 Ca -0.00 -0.53 0.13 0.00 0.00 0.00 0.00 46.02 45.61 1omt n GLY 46 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1omt h THR 47 N 0.00 0.00 -4.38 2.61 1.35 -1.64 -3.44 112.91 107.41 1omt h THR 47 Ca 0.00 -0.51 -0.51 0.00 -0.55 0.00 0.00 66.41 64.84 1omt h THR 47 Cb 0.00 1.50 0.07 0.00 -1.73 0.00 0.00 68.15 67.99 1omt h THR 47 CO 0.00 0.00 0.42 -0.22 -0.25 0.00 0.00 175.52 175.47 1omt s LEU 48 N -4.67 3.16 -0.25 3.87 2.96 -1.26 -4.96 118.68 117.53 1omt s LEU 48 Ca 0.10 1.38 -0.11 0.00 -0.22 0.00 0.00 54.13 55.29 1omt s LEU 48 Cb 0.12 -4.38 0.09 0.00 0.50 0.00 0.00 46.19 42.52 1omt s LEU 48 CO 0.59 -0.99 0.56 0.42 -1.32 0.00 0.00 176.35 175.62 1omt s THR 49 N -3.20 -0.46 0.47 3.68 -4.23 -1.26 -4.89 115.64 105.75 1omt s THR 49 Ca 0.56 0.06 -0.24 0.00 -1.18 0.00 0.00 61.69 60.88 1omt s THR 49 Cb -0.11 -0.85 -0.07 0.00 1.34 0.00 0.00 72.50 72.80 1omt s THR 49 CO 0.54 0.02 1.36 -0.22 -0.54 0.00 0.00 174.62 175.78 1omt s LEU 50 N 2.21 4.05 -0.01 4.79 2.96 -1.25 0.17 118.68 131.59 1omt s LEU 50 Ca -0.07 2.77 0.12 0.00 -0.22 0.00 0.00 54.13 56.73 1omt s LEU 50 Cb -0.09 -4.05 -0.18 0.00 0.50 0.00 0.00 46.19 42.37 1omt s LEU 50 CO -0.17 -1.21 0.30 -0.24 -1.32 0.00 0.00 176.35 173.72 1omt n SER 51 N -0.40 1.95 0.00 3.68 2.88 -1.23 -4.78 113.62 115.72 1omt n SER 51 Ca 0.07 -0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1omt n SER 51 Cb 0.44 1.46 0.00 0.00 -0.75 0.00 0.00 64.21 65.35 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 -1.81 0.00 -1.59 0.66 -0.00 -1.26 -5.06 115.22 106.16 1omt n HIS 52 Ca -0.01 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.40 1omt n HIS 52 Cb 0.29 0.00 0.22 0.00 -0.00 0.00 0.00 29.99 30.50 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 0.89 0.00 -1.40 0.40 -1.26 -2.58 117.98 112.02 1omt s PHE 53 Ca 0.00 0.31 0.00 0.00 -0.60 0.00 0.00 56.93 56.64 1omt s PHE 53 Cb 0.00 -3.93 0.00 0.00 0.51 0.00 0.00 43.02 39.60 1omt s PHE 53 CO 0.00 -3.31 0.00 0.41 0.70 0.00 0.00 175.22 173.02 1omt n GLY 54 N -2.67 -1.41 3.84 4.36 0.00 0.90 -4.63 105.19 105.59 1omt n GLY 54 Ca 0.16 -1.24 -0.35 0.00 0.00 0.00 0.00 46.02 44.58 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 3.98 0.00 1.61 1.02 -1.23 -2.49 119.74 122.62 1omt s LYS 55 Ca 0.00 0.49 0.18 0.00 0.02 0.00 0.00 55.97 56.66 1omt s LYS 55 Cb 0.00 -2.94 1.05 0.00 -0.52 0.00 0.00 37.83 35.42 1omt s LYS 55 CO 0.00 0.49 1.45 0.00 -0.92 0.00 0.00 175.35 176.37