#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 2.05 -1.49 -1.18 0.00 -1.26 -5.00 120.51 113.63 1omt n ALA 2 Ca 0.00 -0.19 -0.50 0.00 0.00 0.00 0.00 53.44 52.75 1omt n ALA 2 Cb 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 19.45 19.49 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 -3.16 -2.17 -3.14 0.00 0.00 -1.26 -4.93 120.51 105.84 1omt n ALA 3 Ca -0.03 0.47 -0.09 0.00 0.00 0.00 0.00 53.44 53.80 1omt n ALA 3 Cb 0.09 -1.80 -0.03 0.00 0.00 0.00 0.00 19.45 17.71 1omt n ALA 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1omt s VAL 4 N -0.60 -0.65 0.00 0.00 0.11 -1.26 -5.10 120.40 112.91 1omt s VAL 4 Ca 0.71 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.85 1omt s VAL 4 Cb -0.95 -0.34 0.00 0.00 -1.53 0.00 0.00 36.38 33.56 1omt s VAL 4 CO 0.56 -0.32 0.00 -1.54 -3.33 0.00 0.00 175.10 170.47 1omt n SER 5 N 3.72 0.00 -4.81 3.54 3.41 -1.26 -5.01 113.62 113.21 1omt n SER 5 Ca 0.16 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.47 1omt n SER 5 Cb 0.52 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.42 1omt n SER 5 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1omt s VAL 6 N -2.00 1.49 -0.08 -3.33 0.11 -1.26 -5.14 120.40 110.19 1omt s VAL 6 Ca 0.00 -1.76 0.03 0.00 -2.93 0.00 0.00 61.98 57.32 1omt s VAL 6 Cb 0.00 -2.25 0.01 0.00 -1.53 0.00 0.00 36.38 32.61 1omt s VAL 6 CO 0.00 0.00 -0.16 -0.62 -3.33 0.00 0.00 175.10 170.99 1omt s ASP 7 N -4.04 2.22 -0.52 3.54 -1.08 -1.26 -5.06 116.67 110.47 1omt s ASP 7 Ca 0.21 -0.39 0.07 0.00 -0.52 0.00 0.00 52.55 51.93 1omt s ASP 7 Cb 0.00 -1.00 0.25 0.00 -1.46 0.00 0.00 42.92 40.72 1omt s ASP 7 CO 0.12 0.08 0.65 0.00 0.52 0.00 0.00 175.17 176.54 1omt n SER 9 N 1.06 0.73 -1.63 0.00 3.41 -1.26 -4.03 113.62 111.91 1omt n SER 9 Ca 0.26 0.21 -0.09 0.00 -0.26 0.00 0.00 58.87 58.99 1omt n SER 9 Cb 0.47 0.59 0.22 0.00 -0.26 0.00 0.00 64.21 65.24 1omt n SER 9 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1omt n GLU 10 N -2.49 2.49 -4.19 4.33 4.71 -1.26 -4.97 120.64 119.25 1omt n GLU 10 Ca 0.00 -3.08 -0.24 0.00 -0.01 0.00 0.00 57.16 53.84 1omt n GLU 10 Cb 0.53 -2.01 -0.06 0.00 -1.01 0.00 0.00 31.44 28.88 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 -3.16 2.92 0.30 -0.32 2.02 -1.26 -3.84 117.35 114.00 1omt s TYR 11 Ca 0.50 -0.14 -0.25 0.00 -0.37 0.00 0.00 57.07 56.81 1omt s TYR 11 Cb 0.43 -1.34 -0.10 0.00 -0.40 0.00 0.00 41.96 40.55 1omt s TYR 11 CO 0.07 0.55 0.91 -1.25 -1.57 0.00 0.00 175.55 174.26 1omt s PRO 12 N -3.51 4.56 -0.13 -1.71 0.04 -1.26 -5.00 135.00 127.99 1omt s PRO 12 Ca 0.31 1.27 -0.06 0.00 0.04 0.00 0.00 61.00 62.57 1omt s PRO 12 Cb -0.08 -2.86 -0.04 0.00 0.04 0.00 0.00 34.50 31.57 1omt s PRO 12 CO 0.22 0.32 0.07 0.15 0.04 0.00 0.00 177.00 177.79 1omt s LYS 13 N -1.96 3.52 0.00 4.56 1.02 -1.25 -4.97 119.74 120.66 1omt s LYS 13 Ca 0.48 -0.30 0.00 0.00 0.02 0.00 0.00 55.97 56.18 1omt s LYS 13 Cb -0.19 -3.08 0.00 0.00 -0.52 0.00 0.00 37.83 34.04 1omt s LYS 13 CO 0.24 0.56 0.75 -0.35 -0.92 0.00 0.00 175.35 175.63 1omt n PRO 14 N 2.64 0.98 -3.65 -1.68 -0.04 -1.26 -4.72 135.00 127.26 1omt n PRO 14 Ca -0.18 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.16 1omt n PRO 14 Cb 0.53 -1.23 -0.08 0.00 -0.04 0.00 0.00 33.50 32.69 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 -1.64 -0.03 0.55 0.00 -1.26 -5.16 121.76 112.69 1omt s ALA 15 Ca 0.00 1.96 0.04 0.00 0.00 0.00 0.00 51.96 53.96 1omt s ALA 15 Cb 0.00 -1.15 -0.00 0.00 0.00 0.00 0.00 23.12 21.97 1omt s ALA 15 CO 0.00 -0.32 -0.14 0.00 0.00 0.00 0.00 175.76 175.30 1omt n THR 17 N 3.05 0.00 -0.59 0.00 -2.24 -1.26 -4.97 114.28 108.27 1omt n THR 17 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1omt n THR 17 Cb 0.54 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 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 0.46 0.00 3.22 -0.00 -1.26 -5.06 117.00 114.36 1omt n LEU 18 Ca 0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 56.01 55.55 1omt n LEU 18 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1omt n LEU 18 CO 0.00 0.12 0.00 -0.62 -0.00 0.00 0.00 177.39 176.89 1omt n GLU 19 N -0.03 -0.38 -3.65 1.47 -0.58 -1.26 -5.00 120.64 111.22 1omt n GLU 19 Ca 0.00 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.51 1omt n GLU 19 Cb 0.18 0.00 -0.17 0.00 -0.57 0.00 0.00 31.44 30.88 1omt n GLU 19 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 1omt s TYR 20 N -0.52 0.16 -0.45 -0.32 5.04 -1.26 -4.86 117.35 115.13 1omt s TYR 20 Ca 0.00 -0.05 0.06 0.00 -2.44 0.00 0.00 57.07 54.65 1omt s TYR 20 Cb 0.00 -0.60 0.22 0.00 0.35 0.00 0.00 41.96 41.93 1omt s TYR 20 CO 0.00 -0.35 0.65 0.54 -1.34 0.00 0.00 175.55 175.04 1omt n ARG 21 N 5.28 0.59 -1.94 4.97 1.74 -1.14 -5.04 116.66 121.12 1omt n ARG 21 Ca -0.05 -2.48 -0.42 0.00 -0.77 0.00 0.00 57.85 54.13 1omt n ARG 21 Cb 0.49 -1.44 -0.03 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 0.12 4.18 -0.08 5.56 0.04 -0.49 -3.62 135.00 140.71 1omt s PRO 22 Ca 0.33 2.29 0.01 0.00 0.04 0.00 0.00 61.00 63.67 1omt s PRO 22 Cb 0.12 -3.87 -0.03 0.00 0.04 0.00 0.00 34.50 30.77 1omt s PRO 22 CO -0.16 -0.81 -0.10 -0.51 0.04 0.00 0.00 177.00 175.45 1omt s LEU 23 N 3.57 2.94 0.63 -3.56 1.43 -0.82 0.16 118.68 123.04 1omt s LEU 23 Ca 0.75 -0.15 -0.05 0.00 -1.03 0.00 0.00 54.13 53.65 1omt s LEU 23 Cb -0.37 -1.63 0.03 0.00 0.03 0.00 0.00 46.19 44.25 1omt s LEU 23 CO 0.32 0.31 0.94 0.00 0.23 0.00 0.00 176.35 178.14 1omt s GLY 25 N -4.41 1.00 0.55 0.00 0.00 -0.75 -3.77 107.32 99.94 1omt s GLY 25 Ca 0.57 -1.45 0.35 0.00 0.00 0.00 0.00 44.72 44.19 1omt s GLY 25 CO 0.44 -1.55 2.03 1.48 0.00 0.00 0.00 173.10 175.50 1omt h SER 26 N 2.86 0.00 0.31 1.64 4.64 0.91 -1.66 113.55 122.24 1omt h SER 26 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1omt h SER 26 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1omt h SER 26 CO 0.63 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.69 1omt n ASP 27 N -3.04 0.00 0.00 4.97 5.68 -1.26 -4.81 116.55 118.09 1omt n ASP 27 Ca 0.00 0.43 0.00 0.00 -0.50 0.00 0.00 54.79 54.72 1omt n ASP 27 Cb 0.26 -0.46 0.00 0.00 -1.14 0.00 0.00 41.12 39.79 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 -1.46 -1.52 -4.62 -1.12 4.05 -0.63 -5.07 115.26 104.90 1omt n ASN 28 Ca 0.03 0.00 -0.31 0.00 0.45 0.00 0.00 54.58 54.75 1omt n ASN 28 Cb 0.11 -0.31 -0.08 0.00 1.23 0.00 0.00 39.78 40.72 1omt n ASN 28 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 177.26 172.62 1omt s LYS 29 N -1.72 2.11 0.36 1.20 -2.85 -1.25 -4.96 119.74 112.63 1omt s LYS 29 Ca 0.00 -2.32 0.09 0.00 -1.00 0.00 0.00 55.97 52.73 1omt s LYS 29 Cb 0.00 -1.34 -0.06 0.00 -2.06 0.00 0.00 37.83 34.36 1omt s LYS 29 CO 0.00 -0.35 -0.01 0.99 0.10 0.00 0.00 175.35 176.07 1omt s THR 30 N -2.94 2.31 -0.03 3.79 2.01 -1.26 -1.81 115.64 117.70 1omt s THR 30 Ca 0.12 -2.04 0.00 0.00 0.31 0.00 0.00 61.69 60.08 1omt s THR 30 Cb 0.03 -2.80 0.03 0.00 0.01 0.00 0.00 72.50 69.76 1omt s THR 30 CO 0.07 -0.14 0.00 -0.31 -0.69 0.00 0.00 174.62 173.55 1omt s TYR 31 N -2.60 0.36 0.23 4.92 1.51 -0.55 -4.95 117.35 116.27 1omt s TYR 31 Ca 0.35 -0.02 -0.14 0.00 -1.01 0.00 0.00 57.07 56.25 1omt s TYR 31 Cb 0.03 -0.46 0.28 0.00 -0.11 0.00 0.00 41.96 41.71 1omt s TYR 31 CO 0.18 -0.15 1.59 0.78 -1.11 0.00 0.00 175.55 176.84 1omt h GLY 32 N 7.40 0.38 0.00 0.71 0.00 -1.89 -2.17 103.07 107.50 1omt h GLY 32 Ca -0.39 0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1omt h GLY 32 CO 0.44 -0.27 0.00 1.16 0.00 0.00 0.00 176.54 177.86 1omt n ASN 33 N -5.50 0.00 0.26 0.19 6.94 -1.25 -1.40 115.26 114.51 1omt n ASN 33 Ca 0.10 -0.53 0.13 0.00 -0.02 0.00 0.00 54.58 54.26 1omt n ASN 33 Cb 0.40 0.00 0.72 0.00 -2.36 0.00 0.00 39.78 38.53 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 0.00 0.02 -3.83 2.10 -1.87 -1.12 116.57 111.87 1omt h LYS 34 Ca 0.00 0.00 -0.27 0.00 -2.00 0.00 0.00 60.65 58.38 1omt h LYS 34 Cb 0.00 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.35 1omt h LYS 34 CO 0.00 0.12 -1.07 0.00 -2.00 0.00 0.00 179.45 176.50 1omt h ASN 36 N 0.36 0.44 -0.01 0.00 2.35 -1.83 -0.70 115.58 116.18 1omt h ASN 36 Ca -0.14 -0.25 -0.15 0.00 -0.55 0.00 0.00 56.30 55.21 1omt h ASN 36 Cb 1.73 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 39.98 1omt h ASN 36 CO 0.21 0.95 -0.59 0.15 -1.65 0.00 0.00 177.43 176.49 1omt h PHE 37 N 0.28 0.62 -0.50 1.19 3.57 -1.23 -3.07 116.94 117.80 1omt h PHE 37 Ca -0.01 -0.33 -0.10 0.00 3.53 0.00 0.00 57.97 61.06 1omt h PHE 37 Cb 1.15 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.80 1omt h PHE 37 CO 0.04 1.14 -0.08 0.00 -2.23 0.00 0.00 178.31 177.18 1omt h ASN 39 N 0.82 0.00 0.90 0.00 2.35 -1.17 0.12 115.58 118.60 1omt h ASN 39 Ca 0.14 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.69 1omt h ASN 39 Cb 0.60 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.94 1omt h ASN 39 CO 0.04 0.03 -1.18 0.00 -1.65 0.00 0.00 177.43 174.66 1omt h ALA 40 N 1.97 0.60 0.00 -0.83 0.00 -1.16 -0.91 119.26 118.93 1omt h ALA 40 Ca -0.00 -0.94 -0.12 0.00 0.00 0.00 0.00 54.91 53.85 1omt h ALA 40 Cb 0.21 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1omt h ALA 40 CO 0.00 1.13 -0.57 0.28 0.00 0.00 0.00 179.25 180.09 1omt h VAL 41 N 0.00 1.10 0.00 0.00 2.07 0.08 0.52 116.25 120.02 1omt h VAL 41 Ca -0.12 -2.20 -0.19 0.00 0.82 0.00 0.00 66.70 65.01 1omt h VAL 41 Cb 1.71 2.30 -0.03 0.00 -1.52 0.00 0.00 31.29 33.75 1omt h VAL 41 CO 0.08 0.56 -1.53 1.33 0.02 0.00 0.00 177.57 178.03 1omt n VAL 42 N -3.42 1.22 0.52 2.57 0.24 0.18 0.50 118.33 120.15 1omt n VAL 42 Ca 0.00 -0.71 0.12 0.00 -2.04 0.00 0.00 64.34 61.71 1omt n VAL 42 Cb 0.68 -0.74 0.10 0.00 -1.47 0.00 0.00 33.84 32.41 1omt n VAL 42 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1omt n GLU 43 N -2.88 0.33 -0.49 7.34 0.00 -0.35 -3.64 120.64 120.95 1omt n GLU 43 Ca -0.12 0.05 0.10 0.00 0.00 0.00 0.00 57.16 57.20 1omt n GLU 43 Cb 0.88 -1.67 0.33 0.00 0.00 0.00 0.00 31.44 30.99 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 -2.12 4.31 0.00 4.31 2.88 0.17 -4.89 113.62 118.28 1omt n SER 44 Ca 0.02 -2.25 0.00 0.00 -1.33 0.00 0.00 58.87 55.32 1omt n SER 44 Cb 0.45 -0.52 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 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 1.28 -3.63 0.00 -3.46 6.94 -1.23 -1.86 115.26 113.30 1omt n ASN 45 Ca 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.80 1omt n ASN 45 Cb 0.75 -2.03 0.00 0.00 -2.36 0.00 0.00 39.78 36.15 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1omt n GLY 46 N -1.02 0.66 0.02 4.83 0.00 0.18 -4.91 105.19 104.96 1omt n GLY 46 Ca 0.00 -0.22 0.14 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.64 0.17 -1.84 2.61 -2.24 -0.78 -4.80 114.28 104.78 1omt n THR 47 Ca 0.00 -0.05 -0.31 0.00 -2.27 0.00 0.00 64.05 61.41 1omt n THR 47 Cb 0.00 -0.54 0.02 0.00 -2.10 0.00 0.00 70.33 67.71 1omt n THR 47 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1omt s LEU 48 N -3.36 3.25 -0.26 3.22 2.96 -1.26 -4.98 118.68 118.25 1omt s LEU 48 Ca 0.13 1.50 -0.12 0.00 -0.22 0.00 0.00 54.13 55.42 1omt s LEU 48 Cb 0.17 -4.48 0.09 0.00 0.50 0.00 0.00 46.19 42.47 1omt s LEU 48 CO 0.54 -1.02 0.60 0.42 -1.32 0.00 0.00 176.35 175.57 1omt s THR 49 N -3.07 -0.32 0.50 3.68 -4.23 -1.26 -4.91 115.64 106.03 1omt s THR 49 Ca 0.56 0.03 -0.23 0.00 -1.18 0.00 0.00 61.69 60.88 1omt s THR 49 Cb -0.12 -0.89 -0.06 0.00 1.34 0.00 0.00 72.50 72.76 1omt s THR 49 CO 0.52 0.01 1.31 -0.22 -0.54 0.00 0.00 174.62 175.71 1omt s LEU 50 N 2.01 3.96 -0.07 4.79 2.96 -1.25 0.14 118.68 131.22 1omt s LEU 50 Ca -0.08 2.66 0.12 0.00 -0.22 0.00 0.00 54.13 56.61 1omt s LEU 50 Cb -0.08 -4.18 -0.18 0.00 0.50 0.00 0.00 46.19 42.25 1omt s LEU 50 CO -0.18 -1.28 0.17 -0.24 -1.32 0.00 0.00 176.35 173.50 1omt n SER 51 N -0.66 1.96 -3.56 3.68 2.88 -1.25 -4.78 113.62 111.89 1omt n SER 51 Ca 0.08 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.56 1omt n SER 51 Cb 0.45 1.20 -0.02 0.00 -0.75 0.00 0.00 64.21 65.09 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 -2.61 -0.22 0.90 0.66 0.00 -1.26 -5.08 115.29 107.68 1omt s HIS 52 Ca -0.05 0.12 -0.14 0.00 -3.00 0.00 0.00 55.06 51.99 1omt s HIS 52 Cb 0.06 0.53 0.15 0.00 -4.00 0.00 0.00 32.58 29.32 1omt s HIS 52 CO 0.53 -0.38 1.24 -0.06 -1.00 0.00 0.00 174.74 175.08 1omt s PHE 53 N -2.76 2.20 0.00 0.38 0.40 -1.26 -2.49 117.98 114.45 1omt s PHE 53 Ca 0.08 0.54 0.00 0.00 -0.60 0.00 0.00 56.93 56.95 1omt s PHE 53 Cb -0.01 -3.79 0.00 0.00 0.51 0.00 0.00 43.02 39.73 1omt s PHE 53 CO -0.06 -2.30 0.00 0.41 0.70 0.00 0.00 175.22 173.97 1omt n GLY 54 N -3.39 -1.87 3.73 4.36 0.00 0.43 -4.70 105.19 103.76 1omt n GLY 54 Ca 0.11 -1.53 -0.38 0.00 0.00 0.00 0.00 46.02 44.23 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 4.30 0.00 1.61 3.01 -1.25 -3.02 119.74 124.40 1omt s LYS 55 Ca 0.00 0.45 0.07 0.00 -1.01 0.00 0.00 55.97 55.47 1omt s LYS 55 Cb 0.00 -3.41 0.40 0.00 -1.01 0.00 0.00 37.83 33.81 1omt s LYS 55 CO 0.00 0.21 0.86 0.00 0.51 0.00 0.00 175.35 176.94