#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 -2.66 -0.62 -1.18 0.00 -1.26 -4.94 120.51 109.85 1omt n ALA 2 Ca 0.00 0.17 -0.31 0.00 0.00 0.00 0.00 53.44 53.30 1omt n ALA 2 Cb 0.00 -0.76 0.20 0.00 0.00 0.00 0.00 19.45 18.89 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 0.67 -3.71 -2.99 0.00 0.00 -1.26 -5.01 120.51 108.22 1omt n ALA 3 Ca 0.00 -1.23 -0.07 0.00 0.00 0.00 0.00 53.44 52.14 1omt n ALA 3 Cb 0.00 -1.68 -0.02 0.00 0.00 0.00 0.00 19.45 17.75 1omt n ALA 3 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1omt s VAL 4 N -2.30 -0.75 0.00 0.00 -7.23 -1.26 -5.13 120.40 103.73 1omt s VAL 4 Ca 0.60 -1.03 0.00 0.00 -1.81 0.00 0.00 61.98 59.74 1omt s VAL 4 Cb -0.16 -0.23 0.00 0.00 0.56 0.00 0.00 36.38 36.54 1omt s VAL 4 CO 0.66 -0.23 0.00 -1.20 -0.31 0.00 0.00 175.10 174.02 1omt n SER 5 N 3.34 0.00 -4.94 4.85 7.64 -1.26 -4.84 113.62 118.41 1omt n SER 5 Ca 0.18 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.80 1omt n SER 5 Cb 0.54 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.71 1omt n SER 5 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1omt s VAL 6 N -1.78 5.28 -0.14 0.44 1.01 -1.26 -5.08 120.40 118.87 1omt s VAL 6 Ca 0.00 -0.64 -0.18 0.00 0.00 0.00 0.00 61.98 61.16 1omt s VAL 6 Cb 0.00 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1omt s VAL 6 CO 0.00 -0.16 0.46 -0.62 0.00 0.00 0.00 175.10 174.78 1omt s ASP 7 N -3.34 6.63 -0.57 3.32 2.15 -1.26 -5.00 116.67 118.60 1omt s ASP 7 Ca 0.36 0.75 0.06 0.00 0.43 0.00 0.00 52.55 54.15 1omt s ASP 7 Cb -0.11 -2.27 0.31 0.00 -0.30 0.00 0.00 42.92 40.55 1omt s ASP 7 CO 0.29 -0.02 0.84 0.00 -0.17 0.00 0.00 175.17 176.11 1omt n SER 9 N 0.22 0.78 -1.95 0.00 2.88 -1.26 -3.80 113.62 110.50 1omt n SER 9 Ca 0.30 0.28 -0.11 0.00 -1.33 0.00 0.00 58.87 58.00 1omt n SER 9 Cb 0.43 0.53 0.23 0.00 -0.75 0.00 0.00 64.21 64.66 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 -2.59 2.96 -4.31 -1.46 -0.58 -1.26 -4.92 120.64 108.48 1omt n GLU 10 Ca 0.00 -2.68 -0.24 0.00 -0.42 0.00 0.00 57.16 53.82 1omt n GLU 10 Cb 0.54 -2.09 -0.08 0.00 -0.57 0.00 0.00 31.44 29.25 1omt n GLU 10 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1omt s TYR 11 N -2.76 2.60 0.43 -0.32 2.02 -1.25 -4.32 117.35 113.76 1omt s TYR 11 Ca 0.49 -0.32 -0.10 0.00 -0.37 0.00 0.00 57.07 56.78 1omt s TYR 11 Cb 0.40 -1.30 -0.06 0.00 -0.40 0.00 0.00 41.96 40.60 1omt s TYR 11 CO 0.11 0.56 0.79 -1.25 -1.57 0.00 0.00 175.55 174.20 1omt s PRO 12 N -3.68 3.73 -0.03 -1.71 0.04 -1.26 -5.01 135.00 127.08 1omt s PRO 12 Ca 0.33 0.45 0.07 0.00 0.04 0.00 0.00 61.00 61.89 1omt s PRO 12 Cb -0.04 -2.36 -0.02 0.00 0.04 0.00 0.00 34.50 32.12 1omt s PRO 12 CO 0.19 -0.11 -0.23 0.15 0.04 0.00 0.00 177.00 177.05 1omt s LYS 13 N -4.10 2.21 0.00 4.56 1.02 -1.26 -5.00 119.74 117.18 1omt s LYS 13 Ca 0.51 -0.87 0.00 0.00 0.02 0.00 0.00 55.97 55.63 1omt s LYS 13 Cb -0.10 -2.13 0.00 0.00 -0.52 0.00 0.00 37.83 35.07 1omt s LYS 13 CO 0.35 0.58 0.78 -0.35 -0.92 0.00 0.00 175.35 175.79 1omt n PRO 14 N 2.38 0.99 -3.65 -1.68 -0.04 -1.26 -4.63 135.00 127.11 1omt n PRO 14 Ca -0.16 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.23 1omt n PRO 14 Cb 0.51 -1.21 -0.08 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 -1.57 -1.37 -0.12 0.55 0.00 -1.26 -5.15 121.76 112.85 1omt s ALA 15 Ca 0.00 1.69 -0.06 0.00 0.00 0.00 0.00 51.96 53.59 1omt s ALA 15 Cb 0.00 -1.44 -0.04 0.00 0.00 0.00 0.00 23.12 21.64 1omt s ALA 15 CO 0.00 -0.80 0.12 0.00 0.00 0.00 0.00 175.76 175.07 1omt n THR 17 N 2.10 0.00 0.10 0.00 -2.24 -1.26 -4.98 114.28 108.00 1omt n THR 17 Ca -0.20 -0.04 0.02 0.00 -2.27 0.00 0.00 64.05 61.57 1omt n THR 17 Cb 0.55 -0.51 -0.03 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 0.00 0.10 -4.70 3.22 -0.00 -1.26 -4.99 117.00 109.38 1omt n LEU 18 Ca 0.03 -0.28 -0.55 0.00 -0.00 0.00 0.00 56.01 55.20 1omt n LEU 18 Cb 0.13 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.48 1omt n LEU 18 CO 0.08 0.03 1.33 -1.84 -0.00 0.00 0.00 177.39 176.99 1omt n GLU 19 N -1.33 1.35 -2.67 1.47 0.00 -1.26 -4.84 120.64 113.36 1omt n GLU 19 Ca 0.00 0.49 -0.42 0.00 0.00 0.00 0.00 57.16 57.23 1omt n GLU 19 Cb 0.08 -2.20 -0.03 0.00 0.00 0.00 0.00 31.44 29.29 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 3.39 3.53 -0.50 -1.84 5.04 -1.26 -4.75 117.35 120.96 1omt s TYR 20 Ca 0.96 1.59 0.05 0.00 -2.44 0.00 0.00 57.07 57.24 1omt s TYR 20 Cb -0.99 -3.19 0.19 0.00 0.35 0.00 0.00 41.96 38.32 1omt s TYR 20 CO 0.62 -0.27 0.77 -0.98 -1.34 0.00 0.00 175.55 174.35 1omt s ARG 21 N 1.76 0.98 -0.05 4.97 1.70 -1.06 -5.03 118.95 122.22 1omt s ARG 21 Ca 0.50 -0.97 -0.30 0.00 -0.47 0.00 0.00 55.73 54.49 1omt s ARG 21 Cb -0.20 -0.04 -0.06 0.00 -0.57 0.00 0.00 34.95 34.08 1omt s ARG 21 CO 0.21 -1.21 1.72 -1.25 -1.08 0.00 0.00 175.30 173.69 1omt s PRO 22 N 0.89 4.13 -0.20 3.89 0.04 -1.01 -3.63 135.00 139.11 1omt s PRO 22 Ca 0.29 2.24 -0.04 0.00 0.04 0.00 0.00 61.00 63.53 1omt s PRO 22 Cb 0.01 -4.03 -0.02 0.00 0.04 0.00 0.00 34.50 30.51 1omt s PRO 22 CO -0.06 -0.91 -0.04 -0.51 0.04 0.00 0.00 177.00 175.52 1omt s LEU 23 N 4.26 3.02 -0.05 -3.56 1.43 -0.95 0.28 118.68 123.11 1omt s LEU 23 Ca 0.77 -0.31 -0.30 0.00 -1.03 0.00 0.00 54.13 53.26 1omt s LEU 23 Cb -0.35 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.09 1omt s LEU 23 CO 0.32 0.04 1.02 0.00 0.23 0.00 0.00 176.35 177.96 1omt n GLY 25 N 3.04 -1.99 0.13 0.00 0.00 -0.23 -1.47 105.19 104.68 1omt n GLY 25 Ca 0.08 -1.56 -0.10 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.15 0.32 0.13 1.61 0.87 0.40 -2.89 113.55 112.84 1omt h SER 26 Ca -0.14 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1omt h SER 26 Cb 0.41 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1omt h SER 26 CO 0.10 1.06 0.00 -0.90 -0.53 0.00 0.00 176.83 176.56 1omt n ASP 27 N -3.67 0.27 0.00 6.23 5.68 -1.26 -4.79 116.55 119.00 1omt n ASP 27 Ca -0.04 0.61 0.00 0.00 -0.50 0.00 0.00 54.79 54.86 1omt n ASP 27 Cb 0.82 -0.65 0.00 0.00 -1.14 0.00 0.00 41.12 40.15 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 -1.12 -5.02 -1.12 5.15 -1.09 -5.09 115.26 105.13 1omt n ASN 28 Ca 0.00 0.00 -0.19 0.00 -0.60 0.00 0.00 54.58 53.79 1omt n ASN 28 Cb 0.05 -0.19 0.04 0.00 -0.53 0.00 0.00 39.78 39.15 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 -0.86 2.50 0.10 1.20 -2.85 -1.26 -4.78 119.74 113.79 1omt s LYS 29 Ca 0.00 -1.46 0.10 0.00 -1.00 0.00 0.00 55.97 53.62 1omt s LYS 29 Cb 0.00 -2.68 -0.04 0.00 -2.06 0.00 0.00 37.83 33.05 1omt s LYS 29 CO 0.00 -0.64 -0.27 0.99 0.10 0.00 0.00 175.35 175.53 1omt s THR 30 N -2.56 2.24 -0.17 3.79 2.01 -1.26 -1.07 115.64 118.62 1omt s THR 30 Ca 0.59 -1.63 0.01 0.00 0.31 0.00 0.00 61.69 60.97 1omt s THR 30 Cb -0.07 -1.95 0.02 0.00 0.01 0.00 0.00 72.50 70.50 1omt s THR 30 CO 0.37 0.18 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.97 1omt s TYR 31 N -0.98 2.67 0.14 4.92 1.51 -0.82 -4.93 117.35 119.86 1omt s TYR 31 Ca 0.13 -1.54 -0.06 0.00 -1.01 0.00 0.00 57.07 54.59 1omt s TYR 31 Cb -0.10 -1.86 0.20 0.00 -0.11 0.00 0.00 41.96 40.10 1omt s TYR 31 CO 0.05 -0.76 0.80 0.41 -1.11 0.00 0.00 175.55 174.94 1omt n GLY 32 N 4.56 -0.92 0.00 0.71 0.00 -1.26 -2.25 105.19 106.04 1omt n GLY 32 Ca -0.20 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.37 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 -4.81 0.00 0.27 1.61 6.94 -1.24 -2.41 115.26 115.62 1omt n ASN 33 Ca 0.07 -0.64 0.15 0.00 -0.02 0.00 0.00 54.58 54.14 1omt n ASN 33 Cb 0.24 0.00 0.75 0.00 -2.36 0.00 0.00 39.78 38.41 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 -1.83 -1.66 116.57 111.36 1omt h LYS 34 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1omt h LYS 34 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1omt h LYS 34 CO 0.00 0.08 -0.01 0.00 -2.00 0.00 0.00 179.45 177.53 1omt h ASN 36 N -0.73 0.95 -0.10 0.00 2.35 -1.88 0.18 115.58 116.35 1omt h ASN 36 Ca -0.00 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.58 1omt h ASN 36 Cb 0.68 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.81 1omt h ASN 36 CO 0.00 0.84 -0.06 0.15 -1.65 0.00 0.00 177.43 176.71 1omt h PHE 37 N 1.01 0.25 0.00 1.19 3.57 -1.34 -2.90 116.94 118.73 1omt h PHE 37 Ca 0.24 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 1omt h PHE 37 Cb 0.19 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 1omt h PHE 37 CO 0.02 0.60 -0.10 0.00 -2.23 0.00 0.00 178.31 176.59 1omt h ASN 39 N 0.00 0.00 1.22 0.00 2.35 -0.78 0.23 115.58 118.61 1omt h ASN 39 Ca -0.00 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 1omt h ASN 39 Cb 0.19 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1omt h ASN 39 CO 0.01 0.21 -0.81 0.00 -1.65 0.00 0.00 177.43 175.19 1omt h ALA 40 N 1.79 0.68 0.00 -0.83 0.00 -0.85 -2.27 119.26 117.77 1omt h ALA 40 Ca -0.00 -0.35 -0.16 0.00 0.00 0.00 0.00 54.91 54.40 1omt h ALA 40 Cb 0.75 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1omt h ALA 40 CO 0.03 0.41 -0.92 0.28 0.00 0.00 0.00 179.25 179.04 1omt h VAL 41 N 0.00 0.97 0.02 0.00 2.07 -0.61 -0.48 116.25 118.21 1omt h VAL 41 Ca -0.05 -2.47 -0.27 0.00 0.82 0.00 0.00 66.70 64.73 1omt h VAL 41 Cb 1.26 2.42 -0.04 0.00 -1.52 0.00 0.00 31.29 33.41 1omt h VAL 41 CO 0.03 0.55 -1.49 -0.37 0.02 0.00 0.00 177.57 176.31 1omt h VAL 42 N 0.00 1.13 0.00 2.57 -1.51 -1.01 0.07 116.25 117.50 1omt h VAL 42 Ca -0.06 -2.92 0.00 0.00 -1.23 0.00 0.00 66.70 62.49 1omt h VAL 42 Cb 1.57 2.59 0.00 0.00 -2.13 0.00 0.00 31.29 33.31 1omt h VAL 42 CO 0.08 0.68 -0.92 1.21 -1.23 0.00 0.00 177.57 177.39 1omt n GLU 43 N -3.20 0.33 -0.31 5.19 2.13 -0.86 -3.84 120.64 120.08 1omt n GLU 43 Ca -0.12 0.03 0.10 0.00 0.66 0.00 0.00 57.16 57.83 1omt n GLU 43 Cb 1.02 -1.65 0.28 0.00 0.27 0.00 0.00 31.44 31.36 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 -2.09 3.36 -1.97 4.31 2.88 -0.19 -4.91 113.62 115.01 1omt n SER 44 Ca 0.02 -1.99 -0.18 0.00 -1.33 0.00 0.00 58.87 55.38 1omt n SER 44 Cb 0.45 -0.41 -0.02 0.00 -0.75 0.00 0.00 64.21 63.48 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 1.34 -5.30 -1.39 -3.46 4.13 -1.22 -1.34 115.26 108.02 1omt n ASN 45 Ca 0.21 0.06 -0.17 0.00 1.68 0.00 0.00 54.58 56.36 1omt n ASN 45 Cb 0.53 -4.37 -0.07 0.00 -1.54 0.00 0.00 39.78 34.33 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 -0.97 1.55 0.98 7.41 0.00 0.01 -4.82 105.19 109.35 1omt n GLY 46 Ca -0.21 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.62 0.47 -0.04 2.61 -2.24 -0.45 -4.39 114.28 107.62 1omt n THR 47 Ca -0.18 -0.64 -0.01 0.00 -2.27 0.00 0.00 64.05 60.95 1omt n THR 47 Cb 0.58 0.71 -0.00 0.00 -2.10 0.00 0.00 70.33 69.52 1omt n THR 47 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1omt h LEU 48 N 3.67 0.00 -1.33 3.22 5.85 -1.85 -3.49 115.31 121.39 1omt h LEU 48 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1omt h LEU 48 Cb 0.81 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.84 1omt h LEU 48 CO 0.00 0.37 -0.81 0.35 -0.34 0.00 0.00 178.44 178.00 1omt n THR 49 N -3.72 -8.41 -2.23 1.05 -2.24 -1.26 -3.36 114.28 94.11 1omt n THR 49 Ca -0.02 2.62 -0.26 0.00 -2.27 0.00 0.00 64.05 64.12 1omt n THR 49 Cb 0.06 -3.89 0.09 0.00 -2.10 0.00 0.00 70.33 64.49 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 -1.11 2.84 -0.11 3.22 0.20 -1.26 0.28 118.68 122.74 1omt s LEU 50 Ca 0.00 0.31 0.11 0.00 0.69 0.00 0.00 54.13 55.24 1omt s LEU 50 Cb 0.00 -2.84 -0.16 0.00 -0.43 0.00 0.00 46.19 42.76 1omt s LEU 50 CO 0.00 -1.77 0.07 -0.24 -0.29 0.00 0.00 176.35 174.13 1omt n SER 51 N -3.00 2.01 -3.60 3.68 2.88 -0.54 -4.50 113.62 110.55 1omt n SER 51 Ca 0.10 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.61 1omt n SER 51 Cb 0.60 0.90 -0.02 0.00 -0.75 0.00 0.00 64.21 64.95 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 -0.12 0.09 0.66 0.00 -1.25 -5.05 115.29 107.25 1omt s HIS 52 Ca -0.06 0.05 -0.02 0.00 -3.00 0.00 0.00 55.06 52.03 1omt s HIS 52 Cb 0.04 0.53 0.02 0.00 -4.00 0.00 0.00 32.58 29.17 1omt s HIS 52 CO 0.50 -0.27 0.09 1.19 -1.00 0.00 0.00 174.74 175.26 1omt n PHE 53 N -0.21 -3.21 -3.43 0.38 3.01 -1.26 -1.74 117.46 111.00 1omt n PHE 53 Ca -0.03 -0.08 0.07 0.00 1.01 0.00 0.00 57.45 58.42 1omt n PHE 53 Cb 0.60 -0.09 -0.02 0.00 -0.01 0.00 0.00 39.48 39.96 1omt n PHE 53 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1omt n GLY 54 N 2.28 -1.42 3.91 1.37 0.00 0.81 -4.27 105.19 107.87 1omt n GLY 54 Ca 0.01 -1.11 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 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 -0.84 2.90 0.00 1.61 1.02 -1.20 -1.94 119.74 121.29 1omt s LYS 55 Ca 0.00 0.04 0.21 0.00 0.02 0.00 0.00 55.97 56.24 1omt s LYS 55 Cb 0.00 -2.24 1.24 0.00 -0.52 0.00 0.00 37.83 36.30 1omt s LYS 55 CO 0.00 -0.74 1.62 0.00 -0.92 0.00 0.00 175.35 175.31