#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 -2.47 -0.94 -1.18 0.00 -1.26 -4.90 120.51 109.76 1omt n ALA 2 Ca 0.00 0.27 0.02 0.00 0.00 0.00 0.00 53.44 53.73 1omt n ALA 2 Cb 0.00 -1.03 -0.01 0.00 0.00 0.00 0.00 19.45 18.41 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 0.99 -0.48 -3.49 0.00 0.00 -1.26 -4.59 120.51 111.69 1omt n ALA 3 Ca 0.00 0.05 -0.27 0.00 0.00 0.00 0.00 53.44 53.23 1omt n ALA 3 Cb 0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 19.45 19.19 1omt n ALA 3 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1omt n VAL 4 N -2.05 -0.27 0.00 0.00 0.24 -1.26 -5.08 118.33 109.92 1omt n VAL 4 Ca 0.00 -3.95 0.00 0.00 -2.04 0.00 0.00 64.34 58.35 1omt n VAL 4 Cb 0.08 -1.85 0.00 0.00 -1.47 0.00 0.00 33.84 30.60 1omt n VAL 4 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1omt n SER 5 N 2.32 0.00 -4.94 -1.34 3.41 -1.26 -4.86 113.62 106.95 1omt n SER 5 Ca 0.26 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.61 1omt n SER 5 Cb 0.45 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.37 1omt n SER 5 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1omt s VAL 6 N -2.00 5.30 0.36 -3.33 1.01 -1.26 -4.98 120.40 115.50 1omt s VAL 6 Ca 0.00 -0.59 -0.12 0.00 0.00 0.00 0.00 61.98 61.27 1omt s VAL 6 Cb 0.00 -3.73 -0.08 0.00 0.00 0.00 0.00 36.38 32.57 1omt s VAL 6 CO 0.00 -0.10 0.74 -0.62 0.00 0.00 0.00 175.10 175.12 1omt s ASP 7 N -3.18 6.63 -0.42 3.32 -1.08 -1.26 -5.01 116.67 115.68 1omt s ASP 7 Ca 0.36 1.18 0.07 0.00 -0.52 0.00 0.00 52.55 53.64 1omt s ASP 7 Cb -0.11 -2.34 0.43 0.00 -1.46 0.00 0.00 42.92 39.44 1omt s ASP 7 CO 0.29 -0.30 1.09 0.00 0.52 0.00 0.00 175.17 176.76 1omt n SER 9 N -0.42 1.71 -2.49 0.00 7.64 -1.26 -4.13 113.62 114.66 1omt n SER 9 Ca 0.35 0.29 -0.36 0.00 1.01 0.00 0.00 58.87 60.16 1omt n SER 9 Cb 0.69 -0.61 0.06 0.00 -1.01 0.00 0.00 64.21 63.34 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 -3.34 2.66 -4.30 1.43 4.71 -1.26 -4.94 120.64 115.61 1omt n GLU 10 Ca -0.26 -3.26 -0.16 0.00 -0.01 0.00 0.00 57.16 53.47 1omt n GLU 10 Cb 1.05 -2.25 -0.10 0.00 -1.01 0.00 0.00 31.44 29.13 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 -3.77 1.44 0.70 -0.32 2.02 -1.26 -4.63 117.35 111.52 1omt s TYR 11 Ca 0.60 -0.95 -0.03 0.00 -0.37 0.00 0.00 57.07 56.32 1omt s TYR 11 Cb 0.48 -0.82 0.09 0.00 -0.40 0.00 0.00 41.96 41.31 1omt s TYR 11 CO -0.13 -0.09 0.98 -1.25 -1.57 0.00 0.00 175.55 173.48 1omt s PRO 12 N -3.88 1.92 -0.01 -1.71 0.04 -1.26 -5.06 135.00 125.04 1omt s PRO 12 Ca 0.27 -0.75 0.01 0.00 0.04 0.00 0.00 61.00 60.56 1omt s PRO 12 Cb 0.06 -2.28 0.01 0.00 0.04 0.00 0.00 34.50 32.32 1omt s PRO 12 CO 0.07 -1.31 -0.03 0.15 0.04 0.00 0.00 177.00 175.91 1omt s LYS 13 N -5.15 0.41 -0.01 4.56 1.02 -1.26 -5.01 119.74 114.31 1omt s LYS 13 Ca 0.63 -0.10 0.01 0.00 0.02 0.00 0.00 55.97 56.53 1omt s LYS 13 Cb -0.08 -0.44 0.04 0.00 -0.52 0.00 0.00 37.83 36.82 1omt s LYS 13 CO 0.44 0.02 0.77 -0.35 -0.92 0.00 0.00 175.35 175.31 1omt n PRO 14 N 3.37 1.14 -3.53 -1.68 -0.04 -1.26 -4.79 135.00 128.21 1omt n PRO 14 Ca -0.18 -0.14 -0.15 0.00 -0.04 0.00 0.00 63.50 63.00 1omt n PRO 14 Cb 0.56 -1.31 -0.05 0.00 -0.04 0.00 0.00 33.50 32.65 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 -1.47 -1.81 0.06 0.55 0.00 -1.26 -5.18 121.76 112.65 1omt s ALA 15 Ca 0.03 1.31 -0.02 0.00 0.00 0.00 0.00 51.96 53.28 1omt s ALA 15 Cb 0.02 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 1omt s ALA 15 CO 0.01 -0.40 -0.01 0.00 0.00 0.00 0.00 175.76 175.36 1omt n THR 17 N 0.09 0.00 0.10 0.00 -2.24 -1.26 -4.96 114.28 106.00 1omt n THR 17 Ca -0.14 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.65 1omt n THR 17 Cb 0.61 -0.09 -0.01 0.00 -2.10 0.00 0.00 70.33 68.75 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 0.35 -4.67 3.22 -0.00 -1.26 -4.98 117.00 109.66 1omt n LEU 18 Ca 0.00 -0.62 -0.46 0.00 -0.00 0.00 0.00 56.01 54.93 1omt n LEU 18 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.38 1omt n LEU 18 CO 0.00 0.08 1.55 -1.84 -0.00 0.00 0.00 177.39 177.18 1omt n GLU 19 N -0.77 2.34 -2.68 1.47 0.00 -1.26 -4.88 120.64 114.86 1omt n GLU 19 Ca 0.01 0.85 -0.42 0.00 0.00 0.00 0.00 57.16 57.59 1omt n GLU 19 Cb 0.04 -2.77 -0.03 0.00 0.00 0.00 0.00 31.44 28.67 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 4.48 3.61 -0.50 -1.84 5.04 -1.26 -4.91 117.35 121.97 1omt s TYR 20 Ca 0.93 1.65 0.06 0.00 -2.44 0.00 0.00 57.07 57.26 1omt s TYR 20 Cb -0.61 -3.16 0.19 0.00 0.35 0.00 0.00 41.96 38.74 1omt s TYR 20 CO 0.48 -0.15 0.77 -0.98 -1.34 0.00 0.00 175.55 174.33 1omt s ARG 21 N 1.24 1.00 0.06 4.97 1.70 -1.22 -5.07 118.95 121.63 1omt s ARG 21 Ca 0.52 -0.98 -0.31 0.00 -0.47 0.00 0.00 55.73 54.49 1omt s ARG 21 Cb -0.21 -0.05 -0.08 0.00 -0.57 0.00 0.00 34.95 34.04 1omt s ARG 21 CO 0.26 -1.23 1.65 -1.25 -1.08 0.00 0.00 175.30 173.65 1omt s PRO 22 N 0.88 4.20 -0.06 3.89 0.04 -1.05 -3.32 135.00 139.59 1omt s PRO 22 Ca 0.29 2.31 0.02 0.00 0.04 0.00 0.00 61.00 63.67 1omt s PRO 22 Cb 0.01 -3.61 -0.03 0.00 0.04 0.00 0.00 34.50 30.91 1omt s PRO 22 CO -0.06 -0.73 -0.10 -0.51 0.04 0.00 0.00 177.00 175.64 1omt s LEU 23 N 2.69 2.96 -0.19 -3.56 1.02 -1.03 0.28 118.68 120.85 1omt s LEU 23 Ca 0.74 -0.11 -0.08 0.00 0.02 0.00 0.00 54.13 54.70 1omt s LEU 23 Cb -0.39 -1.62 -0.04 0.00 0.02 0.00 0.00 46.19 44.15 1omt s LEU 23 CO 0.32 0.35 0.09 0.00 0.02 0.00 0.00 176.35 177.13 1omt n GLY 25 N 3.62 -2.42 0.17 0.00 0.00 -0.83 -1.87 105.19 103.86 1omt n GLY 25 Ca -0.16 -1.45 0.08 0.00 0.00 0.00 0.00 46.02 44.48 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 -1.02 0.00 0.28 1.61 0.87 0.58 -3.06 113.55 112.81 1omt h SER 26 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1omt h SER 26 Cb 0.02 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 1omt h SER 26 CO 0.00 0.20 0.00 -0.90 -0.53 0.00 0.00 176.83 175.61 1omt n ASP 27 N -3.07 0.00 -0.03 6.23 5.68 -1.26 -4.86 116.55 119.25 1omt n ASP 27 Ca 0.02 -0.36 0.00 0.00 -0.50 0.00 0.00 54.79 53.95 1omt n ASP 27 Cb 0.62 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 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 -1.17 -1.05 -4.69 -1.12 5.15 -1.16 -5.05 115.26 106.18 1omt n ASN 28 Ca 0.15 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.78 1omt n ASN 28 Cb 0.15 -0.50 -0.09 0.00 -0.53 0.00 0.00 39.78 38.82 1omt n ASN 28 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1omt s LYS 29 N -4.03 3.32 0.26 1.20 2.20 -1.26 -4.79 119.74 116.64 1omt s LYS 29 Ca 0.00 -0.36 -0.18 0.00 -0.36 0.00 0.00 55.97 55.07 1omt s LYS 29 Cb 0.00 -2.95 -0.09 0.00 -1.51 0.00 0.00 37.83 33.28 1omt s LYS 29 CO 0.00 0.59 0.73 0.99 -0.36 0.00 0.00 175.35 177.30 1omt s THR 30 N -0.55 4.60 -0.06 3.43 2.01 -1.26 -1.97 115.64 121.84 1omt s THR 30 Ca 0.10 1.17 0.04 0.00 0.31 0.00 0.00 61.69 63.30 1omt s THR 30 Cb -0.12 -3.77 0.00 0.00 0.01 0.00 0.00 72.50 68.63 1omt s THR 30 CO 0.02 0.06 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.53 1omt s TYR 31 N -1.69 1.82 0.19 4.92 2.02 -0.70 -4.97 117.35 118.95 1omt s TYR 31 Ca 0.47 -0.63 -0.07 0.00 -0.37 0.00 0.00 57.07 56.46 1omt s TYR 31 Cb -0.14 -1.26 0.28 0.00 -0.40 0.00 0.00 41.96 40.44 1omt s TYR 31 CO 0.20 -0.26 1.09 0.41 -1.57 0.00 0.00 175.55 175.41 1omt n GLY 32 N 3.46 -1.24 0.00 0.71 0.00 -1.26 -2.45 105.19 104.41 1omt n GLY 32 Ca -0.20 0.76 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 -0.28 1.61 0.23 -1.25 -2.53 115.26 107.92 1omt n ASN 33 Ca 0.10 -0.83 0.09 0.00 -0.53 0.00 0.00 54.58 53.41 1omt n ASN 33 Cb 0.33 0.00 0.23 0.00 -2.08 0.00 0.00 39.78 38.26 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 0.15 0.57 -3.83 2.10 -1.85 0.29 116.57 114.00 1omt h LYS 34 Ca 0.00 -0.01 -0.03 0.00 -2.00 0.00 0.00 60.65 58.61 1omt h LYS 34 Cb 0.00 -0.03 0.01 0.00 -0.90 0.00 0.00 32.23 31.30 1omt h LYS 34 CO 0.00 0.10 -0.27 0.00 -2.00 0.00 0.00 179.45 177.28 1omt h ASN 36 N -0.93 0.00 0.00 0.00 2.35 -1.80 -1.90 115.58 113.30 1omt h ASN 36 Ca -0.08 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 1omt h ASN 36 Cb 0.58 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.95 1omt h ASN 36 CO 0.13 0.00 -0.19 0.15 -1.65 0.00 0.00 177.43 175.87 1omt h PHE 37 N 0.00 0.00 -0.34 1.19 3.57 -0.47 -3.36 116.94 117.53 1omt h PHE 37 Ca 0.01 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.53 1omt h PHE 37 Cb 0.95 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.66 1omt h PHE 37 CO 0.00 0.24 0.16 0.00 -2.23 0.00 0.00 178.31 176.47 1omt h ASN 39 N 0.33 0.00 -0.06 0.00 7.08 -1.56 1.83 115.58 123.20 1omt h ASN 39 Ca 0.15 0.00 -0.03 0.00 -3.08 0.00 0.00 56.30 53.34 1omt h ASN 39 Cb 0.07 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 36.31 1omt h ASN 39 CO -0.11 0.00 -0.07 0.00 -2.08 0.00 0.00 177.43 175.16 1omt h ALA 40 N 1.23 0.09 0.29 4.14 0.00 -1.16 -2.49 119.26 121.35 1omt h ALA 40 Ca 0.57 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1omt h ALA 40 Cb 2.46 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 20.21 1omt h ALA 40 CO -0.01 -0.09 -0.33 0.28 0.00 0.00 0.00 179.25 179.10 1omt h VAL 41 N -0.30 0.31 -0.77 0.00 2.07 0.29 0.41 116.25 118.26 1omt h VAL 41 Ca 0.01 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.70 1omt h VAL 41 Cb 0.60 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 1omt h VAL 41 CO 0.02 0.00 0.52 -0.37 0.02 0.00 0.00 177.57 177.76 1omt h VAL 42 N -0.67 0.73 0.00 2.57 -1.51 -0.94 0.18 116.25 116.62 1omt h VAL 42 Ca -0.01 -0.11 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 1omt h VAL 42 Cb 0.62 0.40 0.00 0.00 -2.13 0.00 0.00 31.29 30.18 1omt h VAL 42 CO -0.09 0.06 -0.71 1.21 -1.23 0.00 0.00 177.57 176.81 1omt n GLU 43 N -4.45 0.08 0.00 5.19 2.13 -0.83 -3.87 120.64 118.89 1omt n GLU 43 Ca 0.15 0.01 0.11 0.00 0.66 0.00 0.00 57.16 58.08 1omt n GLU 43 Cb 0.63 -1.53 -0.02 0.00 0.27 0.00 0.00 31.44 30.79 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 -1.64 1.88 -0.29 4.31 2.88 0.14 -4.95 113.62 115.95 1omt n SER 44 Ca 0.04 -1.44 -0.03 0.00 -1.33 0.00 0.00 58.87 56.11 1omt n SER 44 Cb 0.36 0.54 -0.00 0.00 -0.75 0.00 0.00 64.21 64.35 1omt n SER 44 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1omt n ASN 45 N -0.19 -2.06 -0.21 -3.46 4.05 0.29 -2.80 115.26 110.89 1omt n ASN 45 Ca 0.08 0.01 -0.03 0.00 0.45 0.00 0.00 54.58 55.10 1omt n ASN 45 Cb 0.44 -1.08 -0.01 0.00 1.23 0.00 0.00 39.78 40.36 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1omt n GLY 46 N -1.40 0.37 0.26 8.20 0.00 -0.53 -4.79 105.19 107.30 1omt n GLY 46 Ca -0.03 -0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.29 0.00 -0.02 2.61 5.66 -1.12 -4.04 114.28 115.07 1omt n THR 47 Ca -0.03 -0.13 -0.01 0.00 -3.05 0.00 0.00 64.05 60.83 1omt n THR 47 Cb 0.40 0.17 -0.01 0.00 -1.55 0.00 0.00 70.33 69.34 1omt n THR 47 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 1omt h LEU 48 N 1.26 -0.06 -1.21 1.09 5.85 -1.87 -3.48 115.31 116.89 1omt h LEU 48 Ca 0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1omt h LEU 48 Cb 0.39 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1omt h LEU 48 CO 0.00 0.44 -0.63 0.35 -0.34 0.00 0.00 178.44 178.26 1omt n THR 49 N -4.82 -5.00 -2.48 1.05 -2.24 -1.26 -2.50 114.28 97.03 1omt n THR 49 Ca -0.01 1.87 -0.28 0.00 -2.27 0.00 0.00 64.05 63.36 1omt n THR 49 Cb 0.03 -2.62 0.01 0.00 -2.10 0.00 0.00 70.33 65.65 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 -1.34 3.51 -0.12 3.22 0.20 -1.26 0.33 118.68 123.22 1omt s LEU 50 Ca 0.00 0.98 0.12 0.00 0.69 0.00 0.00 54.13 55.92 1omt s LEU 50 Cb 0.00 -3.93 -0.17 0.00 -0.43 0.00 0.00 46.19 41.66 1omt s LEU 50 CO 0.00 -0.69 0.07 -0.24 -0.29 0.00 0.00 176.35 175.19 1omt n SER 51 N -2.39 1.77 -3.56 3.68 2.88 -0.78 -4.65 113.62 110.58 1omt n SER 51 Ca 0.02 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.46 1omt n SER 51 Cb 0.55 0.89 -0.02 0.00 -0.75 0.00 0.00 64.21 64.89 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 -2.37 -0.43 0.92 0.66 0.00 -1.25 -5.02 115.29 107.79 1omt s HIS 52 Ca -0.06 0.14 -0.13 0.00 -3.00 0.00 0.00 55.06 52.01 1omt s HIS 52 Cb 0.04 0.61 0.18 0.00 -4.00 0.00 0.00 32.58 29.41 1omt s HIS 52 CO 0.54 -0.97 1.27 -0.06 -1.00 0.00 0.00 174.74 174.52 1omt s PHE 53 N -3.80 1.64 0.00 0.38 0.40 -1.26 -2.18 117.98 113.15 1omt s PHE 53 Ca 0.04 0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.61 1omt s PHE 53 Cb -0.03 -3.92 0.00 0.00 0.51 0.00 0.00 43.02 39.58 1omt s PHE 53 CO -0.07 -2.48 0.00 0.41 0.70 0.00 0.00 175.22 173.79 1omt n GLY 54 N -3.61 -1.44 3.94 4.36 0.00 0.81 -4.59 105.19 104.68 1omt n GLY 54 Ca 0.15 -1.25 -0.24 0.00 0.00 0.00 0.00 46.02 44.68 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 3.01 0.00 1.61 1.02 -1.22 -2.66 119.74 121.50 1omt s LYS 55 Ca 0.00 -0.37 0.17 0.00 0.02 0.00 0.00 55.97 55.78 1omt s LYS 55 Cb 0.00 -2.48 1.00 0.00 -0.52 0.00 0.00 37.83 35.83 1omt s LYS 55 CO 0.00 -0.40 1.41 0.00 -0.92 0.00 0.00 175.35 175.43