#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 -1.31 -2.44 -1.18 0.00 -1.26 -5.00 120.51 109.32 1omt n ALA 2 Ca 0.00 0.30 -0.31 0.00 0.00 0.00 0.00 53.44 53.43 1omt n ALA 2 Cb 0.00 -4.59 -0.13 0.00 0.00 0.00 0.00 19.45 14.72 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 -3.30 2.55 -0.95 0.00 0.00 -1.26 -5.07 121.76 113.74 1omt s ALA 3 Ca 0.44 -1.14 -0.07 0.00 0.00 0.00 0.00 51.96 51.19 1omt s ALA 3 Cb -0.19 -0.76 0.24 0.00 0.00 0.00 0.00 23.12 22.40 1omt s ALA 3 CO 0.66 0.56 0.88 0.14 0.00 0.00 0.00 175.76 178.01 1omt s VAL 4 N -0.85 5.18 0.00 0.00 -7.23 -1.26 -4.95 120.40 111.30 1omt s VAL 4 Ca 0.13 -3.37 0.00 0.00 -1.81 0.00 0.00 61.98 56.93 1omt s VAL 4 Cb -0.10 -4.17 0.00 0.00 0.56 0.00 0.00 36.38 32.66 1omt s VAL 4 CO 0.03 -1.10 0.00 -0.24 -0.31 0.00 0.00 175.10 173.49 1omt n SER 5 N 2.86 0.00 -4.84 4.85 2.88 -1.26 -4.64 113.62 113.47 1omt n SER 5 Ca 0.20 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.39 1omt n SER 5 Cb 0.40 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.80 1omt n SER 5 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1omt s VAL 6 N 0.00 4.76 0.30 2.46 0.11 -1.26 -5.03 120.40 121.74 1omt s VAL 6 Ca 0.00 0.91 -0.29 0.00 -2.93 0.00 0.00 61.98 59.67 1omt s VAL 6 Cb 0.00 -3.73 -0.10 0.00 -1.53 0.00 0.00 36.38 31.02 1omt s VAL 6 CO 0.00 0.12 1.20 -0.62 -3.33 0.00 0.00 175.10 172.47 1omt s ASP 7 N -1.89 7.03 -0.31 3.54 2.15 -1.26 -4.95 116.67 120.98 1omt s ASP 7 Ca 0.43 2.47 0.18 0.00 0.43 0.00 0.00 52.55 56.07 1omt s ASP 7 Cb -0.14 -2.64 0.46 0.00 -0.30 0.00 0.00 42.92 40.31 1omt s ASP 7 CO 0.20 -0.33 1.07 0.00 -0.17 0.00 0.00 175.17 175.94 1omt n SER 9 N -0.36 0.89 -1.50 0.00 7.64 -1.26 -3.69 113.62 115.34 1omt n SER 9 Ca 0.06 -0.73 0.10 0.00 1.01 0.00 0.00 58.87 59.31 1omt n SER 9 Cb 0.82 0.18 0.35 0.00 -1.01 0.00 0.00 64.21 64.54 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 -0.88 3.47 -3.98 1.43 4.71 -1.26 -4.94 120.64 119.19 1omt n GLU 10 Ca 0.10 -2.82 -0.21 0.00 -0.01 0.00 0.00 57.16 54.22 1omt n GLU 10 Cb 0.35 -1.80 -0.02 0.00 -1.01 0.00 0.00 31.44 28.95 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 -1.63 3.43 0.73 -0.32 1.51 -1.24 -4.27 117.35 115.56 1omt s TYR 11 Ca 0.50 -0.02 -0.11 0.00 -1.01 0.00 0.00 57.07 56.43 1omt s TYR 11 Cb 0.31 -1.56 0.03 0.00 -0.11 0.00 0.00 41.96 40.62 1omt s TYR 11 CO 0.26 0.45 1.08 -1.25 -1.11 0.00 0.00 175.55 174.98 1omt s PRO 12 N -3.93 2.65 -0.03 -1.71 0.04 -1.26 -4.88 135.00 125.88 1omt s PRO 12 Ca 0.34 0.69 0.05 0.00 0.04 0.00 0.00 61.00 62.12 1omt s PRO 12 Cb -0.09 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 1omt s PRO 12 CO 0.29 -1.24 -0.17 0.15 0.04 0.00 0.00 177.00 176.07 1omt s LYS 13 N -5.18 2.35 0.00 4.56 1.02 -1.26 -4.99 119.74 116.24 1omt s LYS 13 Ca 0.59 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.79 1omt s LYS 13 Cb -0.13 -2.28 0.00 0.00 -0.52 0.00 0.00 37.83 34.90 1omt s LYS 13 CO 0.54 0.60 0.79 -0.35 -0.92 0.00 0.00 175.35 176.00 1omt n PRO 14 N 2.18 0.97 -3.15 -1.68 -0.04 -1.26 -4.55 135.00 127.47 1omt n PRO 14 Ca -0.17 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.34 1omt n PRO 14 Cb 0.52 -1.19 -0.01 0.00 -0.04 0.00 0.00 33.50 32.78 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 -1.62 -3.05 0.07 0.55 0.00 -1.26 -5.16 121.76 111.30 1omt s ALA 15 Ca 0.00 1.57 -0.10 0.00 0.00 0.00 0.00 51.96 53.43 1omt s ALA 15 Cb 0.00 -2.39 -0.06 0.00 0.00 0.00 0.00 23.12 20.67 1omt s ALA 15 CO 0.00 -1.42 0.40 0.00 0.00 0.00 0.00 175.76 174.73 1omt n THR 17 N 0.94 0.00 0.00 0.00 -2.24 -1.26 -4.95 114.28 106.77 1omt n THR 17 Ca -0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1omt n THR 17 Cb 0.52 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 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 0.00 0.00 3.22 4.32 -1.26 -5.02 117.00 118.26 1omt n LEU 18 Ca 0.07 -0.14 0.00 0.00 -0.02 0.00 0.00 56.01 55.92 1omt n LEU 18 Cb 0.30 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.10 1omt n LEU 18 CO 0.20 0.00 0.00 -1.84 -1.22 0.00 0.00 177.39 174.53 1omt n GLU 19 N -1.19 -0.53 -4.16 3.23 0.00 -1.26 -5.00 120.64 111.73 1omt n GLU 19 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 57.16 56.97 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 -0.60 0.69 -0.50 -1.84 5.04 -1.26 -4.89 117.35 113.99 1omt s TYR 20 Ca 0.00 -0.17 0.06 0.00 -2.44 0.00 0.00 57.07 54.51 1omt s TYR 20 Cb 0.00 -0.61 0.19 0.00 0.35 0.00 0.00 41.96 41.89 1omt s TYR 20 CO 0.00 -0.16 0.75 1.03 -1.34 0.00 0.00 175.55 175.83 1omt s ARG 21 N 0.80 1.00 -0.06 4.97 1.81 -1.16 -5.03 118.95 121.28 1omt s ARG 21 Ca -0.10 -0.96 -0.29 0.00 -1.72 0.00 0.00 55.73 52.65 1omt s ARG 21 Cb -0.13 -0.04 -0.07 0.00 -0.45 0.00 0.00 34.95 34.26 1omt s ARG 21 CO 0.00 -1.24 1.88 -1.25 -0.68 0.00 0.00 175.30 174.01 1omt s PRO 22 N 0.93 3.95 -0.14 3.54 0.04 -1.22 -3.53 135.00 138.57 1omt s PRO 22 Ca 0.29 2.29 -0.03 0.00 0.04 0.00 0.00 61.00 63.58 1omt s PRO 22 Cb 0.01 -4.14 -0.03 0.00 0.04 0.00 0.00 34.50 30.38 1omt s PRO 22 CO -0.06 -1.16 -0.03 -0.51 0.04 0.00 0.00 177.00 175.29 1omt s LEU 23 N 5.06 3.34 -0.22 -3.56 1.02 -1.07 0.23 118.68 123.49 1omt s LEU 23 Ca 0.84 -0.06 -0.28 0.00 0.02 0.00 0.00 54.13 54.65 1omt s LEU 23 Cb -0.36 -1.79 0.01 0.00 0.02 0.00 0.00 46.19 44.06 1omt s LEU 23 CO 0.36 0.22 1.01 0.00 0.02 0.00 0.00 176.35 177.96 1omt n GLY 25 N 3.35 -2.01 0.09 0.00 0.00 -0.71 -1.78 105.19 104.12 1omt n GLY 25 Ca 0.11 -1.45 -0.18 0.00 0.00 0.00 0.00 46.02 44.49 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 -0.25 0.01 0.00 1.61 0.87 0.36 -2.69 113.55 113.45 1omt h SER 26 Ca 0.00 -0.74 0.00 0.00 -1.23 0.00 0.00 61.79 59.82 1omt h SER 26 Cb 0.00 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1omt h SER 26 CO 0.00 1.27 0.10 -0.90 -0.53 0.00 0.00 176.83 176.77 1omt n ASP 27 N -4.50 0.49 -0.07 6.23 5.75 -1.26 -4.76 116.55 118.43 1omt n ASP 27 Ca -0.22 0.70 0.00 0.00 -0.01 0.00 0.00 54.79 55.26 1omt n ASP 27 Cb 0.60 -0.73 0.00 0.00 -1.03 0.00 0.00 41.12 39.96 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 -2.19 -0.19 -4.02 -1.12 5.15 -1.24 -5.10 115.26 106.55 1omt n ASN 28 Ca -0.01 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.66 1omt n ASN 28 Cb 0.13 -0.05 -0.16 0.00 -0.53 0.00 0.00 39.78 39.17 1omt n ASN 28 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 1omt s LYS 29 N 0.07 2.16 0.87 1.20 -2.85 -1.26 -4.87 119.74 115.06 1omt s LYS 29 Ca 0.00 -0.94 -0.11 0.00 -1.00 0.00 0.00 55.97 53.91 1omt s LYS 29 Cb 0.00 -2.53 0.12 0.00 -2.06 0.00 0.00 37.83 33.36 1omt s LYS 29 CO 0.00 -0.44 1.17 0.99 0.10 0.00 0.00 175.35 177.18 1omt s THR 30 N 1.33 2.04 0.05 3.79 2.01 -1.26 -1.74 115.64 121.87 1omt s THR 30 Ca -0.02 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.05 1omt s THR 30 Cb -0.17 -2.20 -0.03 0.00 0.01 0.00 0.00 72.50 70.12 1omt s THR 30 CO -0.08 -0.02 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.38 1omt s TYR 31 N -2.43 1.26 0.35 4.92 2.02 -0.26 -4.85 117.35 118.37 1omt s TYR 31 Ca 0.70 -0.40 0.09 0.00 -0.37 0.00 0.00 57.07 57.09 1omt s TYR 31 Cb -0.25 -0.73 0.81 0.00 -0.40 0.00 0.00 41.96 41.39 1omt s TYR 31 CO 0.55 0.05 1.85 0.78 -1.57 0.00 0.00 175.55 177.21 1omt h GLY 32 N 4.65 1.31 0.00 0.71 0.00 -1.88 -2.84 103.07 105.02 1omt h GLY 32 Ca -0.40 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.62 1omt h GLY 32 CO 0.42 0.06 0.00 1.16 0.00 0.00 0.00 176.54 178.18 1omt n ASN 33 N -4.59 0.00 -0.16 0.19 0.23 -1.24 -2.98 115.26 106.71 1omt n ASN 33 Ca 0.19 -0.39 0.01 0.00 -0.53 0.00 0.00 54.58 53.86 1omt n ASN 33 Cb 0.51 0.00 0.28 0.00 -2.08 0.00 0.00 39.78 38.48 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 0.87 0.29 -3.83 2.10 -1.89 -1.17 116.57 112.94 1omt h LYS 34 Ca 0.00 -0.07 -0.01 0.00 -2.00 0.00 0.00 60.65 58.57 1omt h LYS 34 Cb 0.00 -0.19 0.00 0.00 -0.90 0.00 0.00 32.23 31.14 1omt h LYS 34 CO 0.00 0.60 -0.14 0.00 -2.00 0.00 0.00 179.45 177.92 1omt h ASN 36 N -0.67 0.27 0.37 0.00 -0.26 -1.92 0.93 115.58 114.29 1omt h ASN 36 Ca -0.04 0.19 -0.02 0.00 -0.56 0.00 0.00 56.30 55.87 1omt h ASN 36 Cb 0.29 0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.74 1omt h ASN 36 CO 0.06 -0.29 -0.18 0.15 -1.06 0.00 0.00 177.43 176.11 1omt h PHE 37 N 0.04 -0.46 0.23 1.19 3.57 -1.12 -3.31 116.94 117.07 1omt h PHE 37 Ca 0.85 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 62.35 1omt h PHE 37 Cb 2.52 0.15 -0.04 0.00 2.79 0.00 0.00 35.95 41.38 1omt h PHE 37 CO -0.01 -0.27 -0.46 0.00 -2.23 0.00 0.00 178.31 175.35 1omt n ASN 39 N -5.50 0.01 -0.03 0.00 3.02 0.12 0.24 115.26 113.13 1omt n ASN 39 Ca -0.09 0.98 -0.13 0.00 -0.03 0.00 0.00 54.58 55.31 1omt n ASN 39 Cb 0.41 -0.49 -0.11 0.00 -0.61 0.00 0.00 39.78 38.98 1omt n ASN 39 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1omt h ALA 40 N 0.99 -0.03 0.30 5.41 0.00 -1.16 -2.14 119.26 122.63 1omt h ALA 40 Ca 0.90 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.47 1omt h ALA 40 Cb 3.56 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 21.33 1omt h ALA 40 CO -0.04 -0.15 -0.49 0.28 0.00 0.00 0.00 179.25 178.85 1omt h VAL 41 N -0.75 0.05 0.00 0.00 2.07 0.34 0.48 116.25 118.44 1omt h VAL 41 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1omt h VAL 41 Cb 0.70 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1omt h VAL 41 CO 0.00 0.00 -0.04 1.62 0.02 0.00 0.00 177.57 179.17 1omt h VAL 42 N -0.84 0.63 -0.00 2.57 3.04 -1.28 -0.09 116.25 120.27 1omt h VAL 42 Ca -0.03 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.48 1omt h VAL 42 Cb 0.79 1.11 0.00 0.00 -2.01 0.00 0.00 31.29 31.18 1omt h VAL 42 CO -0.17 0.04 -0.53 1.21 -1.01 0.00 0.00 177.57 177.11 1omt n GLU 43 N -3.90 0.19 -0.47 4.17 2.13 -0.68 -3.89 120.64 118.20 1omt n GLU 43 Ca -0.03 -0.12 0.08 0.00 0.66 0.00 0.00 57.16 57.75 1omt n GLU 43 Cb 0.13 -1.50 0.27 0.00 0.27 0.00 0.00 31.44 30.61 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 -1.30 4.01 -0.70 4.31 3.41 0.16 -4.92 113.62 118.60 1omt n SER 44 Ca 0.07 -2.83 -0.09 0.00 -0.26 0.00 0.00 58.87 55.76 1omt n SER 44 Cb 0.34 -0.52 -0.04 0.00 -0.26 0.00 0.00 64.21 63.74 1omt n SER 44 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1omt n ASN 45 N -0.13 -5.28 -0.22 4.04 4.13 -1.03 -1.41 115.26 115.36 1omt n ASN 45 Ca 0.21 0.23 -0.03 0.00 1.68 0.00 0.00 54.58 56.67 1omt n ASN 45 Cb 0.86 -3.58 -0.01 0.00 -1.54 0.00 0.00 39.78 35.51 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1omt n GLY 46 N -0.30 0.61 0.31 7.41 0.00 -0.20 -4.88 105.19 108.14 1omt n GLY 46 Ca -0.09 -0.92 0.14 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.91 0.00 0.00 2.61 -2.24 -0.50 -4.40 114.28 106.84 1omt n THR 47 Ca -0.03 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1omt n THR 47 Cb 0.10 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 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 -0.39 2.14 -0.86 3.22 7.94 -1.26 -4.96 117.00 122.84 1omt n LEU 48 Ca 0.16 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 55.17 1omt n LEU 48 Cb 0.33 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.24 1omt n LEU 48 CO 0.22 0.00 -0.25 0.35 -1.11 0.00 0.00 177.39 176.59 1omt n THR 49 N -0.74 0.00 -4.48 1.96 -2.24 -1.26 -3.56 114.28 103.96 1omt n THR 49 Ca 0.00 0.24 -0.23 0.00 -2.27 0.00 0.00 64.05 61.80 1omt n THR 49 Cb 0.00 -0.53 -0.11 0.00 -2.10 0.00 0.00 70.33 67.59 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 -6.13 2.47 -0.15 3.22 0.20 -1.26 0.26 118.68 117.29 1omt s LEU 50 Ca 0.00 -1.29 0.06 0.00 0.69 0.00 0.00 54.13 53.59 1omt s LEU 50 Cb 0.00 -0.62 -0.14 0.00 -0.43 0.00 0.00 46.19 45.00 1omt s LEU 50 CO 0.00 -0.45 -0.05 -0.24 -0.29 0.00 0.00 176.35 175.32 1omt n SER 51 N -0.71 2.21 -3.64 3.68 2.88 -0.74 -4.63 113.62 112.68 1omt n SER 51 Ca -0.04 -0.05 -0.08 0.00 -1.33 0.00 0.00 58.87 57.37 1omt n SER 51 Cb 0.65 0.27 -0.02 0.00 -0.75 0.00 0.00 64.21 64.36 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 -2.33 -0.32 0.91 0.66 0.00 -1.25 -4.96 115.29 107.99 1omt s HIS 52 Ca -0.15 0.01 -0.15 0.00 -3.00 0.00 0.00 55.06 51.78 1omt s HIS 52 Cb 0.05 0.62 0.16 0.00 -4.00 0.00 0.00 32.58 29.41 1omt s HIS 52 CO 0.47 -0.94 1.27 -0.06 -1.00 0.00 0.00 174.74 174.48 1omt s PHE 53 N -3.64 2.06 0.00 0.38 0.40 -1.26 -1.67 117.98 114.26 1omt s PHE 53 Ca 0.07 0.46 0.00 0.00 -0.60 0.00 0.00 56.93 56.86 1omt s PHE 53 Cb -0.03 -3.90 0.00 0.00 0.51 0.00 0.00 43.02 39.60 1omt s PHE 53 CO -0.03 -2.35 0.00 0.41 0.70 0.00 0.00 175.22 173.96 1omt n GLY 54 N -3.61 -2.04 3.71 4.36 0.00 0.64 -4.50 105.19 103.76 1omt n GLY 54 Ca 0.13 -1.41 -0.38 0.00 0.00 0.00 0.00 46.02 44.35 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 4.34 0.00 1.61 1.02 -1.21 -1.70 119.74 123.80 1omt s LYS 55 Ca 0.00 0.54 0.05 0.00 0.02 0.00 0.00 55.97 56.57 1omt s LYS 55 Cb 0.00 -3.45 0.28 0.00 -0.52 0.00 0.00 37.83 34.13 1omt s LYS 55 CO 0.00 0.10 0.75 0.00 -0.92 0.00 0.00 175.35 175.28