#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 -0.06 -3.10 1.96 0.00 -1.26 -4.89 120.51 113.17 1omt n ALA 2 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1omt n ALA 2 Cb 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.03 -2.65 -2.88 0.00 0.00 -1.26 -4.82 120.51 108.87 1omt n ALA 3 Ca 0.00 0.48 -0.43 0.00 0.00 0.00 0.00 53.44 53.49 1omt n ALA 3 Cb 0.01 -1.87 -0.03 0.00 0.00 0.00 0.00 19.45 17.56 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 -1.64 4.52 -0.30 0.00 -7.23 -1.26 -4.91 120.40 109.58 1omt s VAL 4 Ca 0.17 -1.03 -0.16 0.00 -1.81 0.00 0.00 61.98 59.14 1omt s VAL 4 Cb -0.03 -4.75 0.20 0.00 0.56 0.00 0.00 36.38 32.36 1omt s VAL 4 CO 0.60 -1.50 1.23 -0.55 -0.31 0.00 0.00 175.10 174.57 1omt s SER 5 N 3.73 -0.12 0.50 4.85 0.15 -1.26 -4.44 113.70 117.11 1omt s SER 5 Ca 0.29 0.19 -0.16 0.00 0.70 0.00 0.00 55.95 56.97 1omt s SER 5 Cb -0.10 1.02 -0.08 0.00 -1.71 0.00 0.00 66.02 65.15 1omt s SER 5 CO -0.01 -0.03 0.96 0.54 1.20 0.00 0.00 173.24 175.90 1omt s VAL 6 N 1.05 4.55 -0.28 4.45 0.11 -1.26 -5.00 120.40 124.01 1omt s VAL 6 Ca -0.08 1.17 -0.26 0.00 -2.93 0.00 0.00 61.98 59.88 1omt s VAL 6 Cb -0.02 -3.71 0.00 0.00 -1.53 0.00 0.00 36.38 31.11 1omt s VAL 6 CO -0.11 -0.65 0.90 -0.62 -3.33 0.00 0.00 175.10 171.29 1omt s ASP 7 N -3.03 6.82 -0.78 3.54 -1.08 -1.26 -4.93 116.67 115.95 1omt s ASP 7 Ca 0.58 0.93 -0.02 0.00 -0.52 0.00 0.00 52.55 53.52 1omt s ASP 7 Cb -0.10 -2.46 0.28 0.00 -1.46 0.00 0.00 42.92 39.18 1omt s ASP 7 CO 0.30 -0.66 2.19 0.00 0.52 0.00 0.00 175.17 177.52 1omt h SER 9 N 3.06 0.00 -1.29 0.00 0.02 -2.00 -3.24 113.55 110.10 1omt h SER 9 Ca 0.53 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 60.79 1omt h SER 9 Cb 0.18 0.00 -0.30 0.00 0.14 0.00 0.00 62.40 62.43 1omt h SER 9 CO 1.31 0.37 0.77 -0.62 -1.14 0.00 0.00 176.83 177.52 1omt n GLU 10 N -3.21 2.79 -4.33 3.45 4.71 -1.26 -4.95 120.64 117.85 1omt n GLU 10 Ca 0.02 -3.45 -0.17 0.00 -0.01 0.00 0.00 57.16 53.55 1omt n GLU 10 Cb 0.67 -2.28 -0.10 0.00 -1.01 0.00 0.00 31.44 28.71 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 -3.88 1.54 0.65 -0.32 2.02 -1.23 -4.58 117.35 111.57 1omt s TYR 11 Ca 0.60 -0.93 -0.05 0.00 -0.37 0.00 0.00 57.07 56.33 1omt s TYR 11 Cb 0.48 -0.89 0.05 0.00 -0.40 0.00 0.00 41.96 41.20 1omt s TYR 11 CO -0.13 -0.05 0.94 -1.25 -1.57 0.00 0.00 175.55 173.49 1omt s PRO 12 N -3.86 2.36 0.02 -1.71 0.04 -1.26 -5.04 135.00 125.55 1omt s PRO 12 Ca 0.28 -0.36 0.07 0.00 0.04 0.00 0.00 61.00 61.02 1omt s PRO 12 Cb 0.06 -2.26 -0.02 0.00 0.04 0.00 0.00 34.50 32.31 1omt s PRO 12 CO 0.08 -1.05 -0.20 0.15 0.04 0.00 0.00 177.00 176.03 1omt s LYS 13 N -5.10 1.42 0.00 4.56 1.02 -1.26 -5.01 119.74 115.38 1omt s LYS 13 Ca 0.59 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.75 1omt s LYS 13 Cb -0.11 -1.46 0.00 0.00 -0.52 0.00 0.00 37.83 35.74 1omt s LYS 13 CO 0.43 0.38 0.71 -0.35 -0.92 0.00 0.00 175.35 175.61 1omt n PRO 14 N 2.15 0.94 0.00 -1.68 -0.04 -1.26 -4.81 135.00 130.30 1omt n PRO 14 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 1omt n PRO 14 Cb 0.53 -1.23 0.00 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 n ALA 15 N -0.24 0.00 -2.35 0.55 0.00 -1.26 -5.18 120.51 112.03 1omt n ALA 15 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1omt n ALA 15 Cb 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.46 1omt n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1omt n THR 17 N -0.39 0.00 0.00 0.00 -2.24 -1.26 -5.00 114.28 105.39 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 0.61 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 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 0.00 -4.67 3.22 -0.00 -1.26 -5.04 117.00 109.25 1omt n LEU 18 Ca 0.00 -0.12 -0.47 0.00 -0.00 0.00 0.00 56.01 55.42 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 0.00 1.30 -1.84 -0.00 0.00 0.00 177.39 176.85 1omt n GLU 19 N -0.47 2.18 -2.74 1.47 0.00 -1.26 -4.86 120.64 114.96 1omt n GLU 19 Ca 0.00 0.79 -0.43 0.00 0.00 0.00 0.00 57.16 57.53 1omt n GLU 19 Cb 0.00 -2.59 -0.03 0.00 0.00 0.00 0.00 31.44 28.82 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 2.04 3.28 -0.43 -1.84 5.04 -1.26 -4.87 117.35 119.31 1omt s TYR 20 Ca 0.84 1.27 0.07 0.00 -2.44 0.00 0.00 57.07 56.81 1omt s TYR 20 Cb -0.68 -3.30 0.25 0.00 0.35 0.00 0.00 41.96 38.59 1omt s TYR 20 CO 0.42 -0.53 0.69 0.54 -1.34 0.00 0.00 175.55 175.33 1omt n ARG 21 N 6.35 0.76 -2.00 4.97 5.12 -1.24 -5.05 116.66 125.57 1omt n ARG 21 Ca 0.10 -2.65 -0.42 0.00 -1.93 0.00 0.00 57.85 52.95 1omt n ARG 21 Cb 0.47 -1.32 -0.03 0.00 -1.16 0.00 0.00 32.46 30.42 1omt n ARG 21 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1omt s PRO 22 N -0.52 4.25 -0.06 5.56 0.04 -0.91 -2.34 135.00 141.02 1omt s PRO 22 Ca 0.34 2.30 0.04 0.00 0.04 0.00 0.00 61.00 63.72 1omt s PRO 22 Cb 0.21 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.60 1omt s PRO 22 CO -0.16 -0.50 -0.18 -0.51 0.04 0.00 0.00 177.00 175.70 1omt s LEU 23 N 0.41 1.89 -0.24 -3.56 1.43 -0.80 0.27 118.68 118.08 1omt s LEU 23 Ca 0.64 -0.39 -0.29 0.00 -1.03 0.00 0.00 54.13 53.07 1omt s LEU 23 Cb -0.42 -1.04 0.00 0.00 0.03 0.00 0.00 46.19 44.76 1omt s LEU 23 CO 0.37 0.13 1.14 0.00 0.23 0.00 0.00 176.35 178.22 1omt n GLY 25 N 3.64 -3.03 0.07 0.00 0.00 -0.66 -1.55 105.19 103.66 1omt n GLY 25 Ca 0.13 -1.29 -0.08 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.58 0.00 0.26 1.61 0.87 0.35 -2.20 113.55 113.86 1omt h SER 26 Ca 0.00 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 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 1.00 0.00 -0.90 -0.53 0.00 0.00 176.83 176.40 1omt n ASP 27 N -3.19 0.00 0.00 6.23 5.68 -1.26 -4.81 116.55 119.19 1omt n ASP 27 Ca -0.09 -0.06 0.00 0.00 -0.50 0.00 0.00 54.79 54.14 1omt n ASP 27 Cb 1.00 -0.23 0.00 0.00 -1.14 0.00 0.00 41.12 40.74 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 -1.23 -2.28 -4.68 -1.12 5.15 -1.21 -5.03 115.26 104.85 1omt n ASN 28 Ca 0.09 0.00 -0.36 0.00 -0.60 0.00 0.00 54.58 53.70 1omt n ASN 28 Cb 0.12 -0.38 -0.09 0.00 -0.53 0.00 0.00 39.78 38.91 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 -1.07 4.13 0.47 1.20 2.20 -1.26 -4.84 119.74 120.57 1omt s LYS 29 Ca 0.00 -0.14 -0.24 0.00 -0.36 0.00 0.00 55.97 55.23 1omt s LYS 29 Cb 0.00 -3.50 -0.07 0.00 -1.51 0.00 0.00 37.83 32.74 1omt s LYS 29 CO 0.00 0.11 1.30 0.99 -0.36 0.00 0.00 175.35 177.38 1omt s THR 30 N 0.91 2.52 -0.16 3.43 2.01 -1.26 -1.66 115.64 121.43 1omt s THR 30 Ca 0.11 0.42 0.01 0.00 0.31 0.00 0.00 61.69 62.54 1omt s THR 30 Cb -0.13 -3.23 0.02 0.00 0.01 0.00 0.00 72.50 69.17 1omt s THR 30 CO 0.04 0.03 -0.18 -0.31 -0.69 0.00 0.00 174.62 173.50 1omt s TYR 31 N -1.34 2.52 0.15 4.92 2.02 -0.67 -4.87 117.35 120.08 1omt s TYR 31 Ca 0.64 -1.43 -0.05 0.00 -0.37 0.00 0.00 57.07 55.86 1omt s TYR 31 Cb -0.37 -1.77 0.25 0.00 -0.40 0.00 0.00 41.96 39.66 1omt s TYR 31 CO 0.46 -0.72 0.85 0.41 -1.57 0.00 0.00 175.55 174.98 1omt n GLY 32 N 4.57 -0.93 0.00 0.71 0.00 -1.26 -2.08 105.19 106.20 1omt n GLY 32 Ca -0.19 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 -4.89 0.00 -0.18 1.61 0.23 -1.25 -2.13 115.26 108.65 1omt n ASN 33 Ca 0.09 -0.29 -0.01 0.00 -0.53 0.00 0.00 54.58 53.84 1omt n ASN 33 Cb 0.27 0.00 0.09 0.00 -2.08 0.00 0.00 39.78 38.06 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 0.22 0.77 -3.83 2.10 -1.75 -1.46 116.57 112.62 1omt h LYS 34 Ca 0.00 -0.01 -0.04 0.00 -2.00 0.00 0.00 60.65 58.60 1omt h LYS 34 Cb 0.00 -0.05 0.01 0.00 -0.90 0.00 0.00 32.23 31.29 1omt h LYS 34 CO 0.00 0.15 -0.37 0.00 -2.00 0.00 0.00 179.45 177.23 1omt h ASN 36 N -1.16 0.00 0.00 0.00 2.35 -1.87 -0.42 115.58 114.49 1omt h ASN 36 Ca -0.11 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 1omt h ASN 36 Cb 0.79 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.16 1omt h ASN 36 CO 0.17 0.00 -0.10 0.15 -1.65 0.00 0.00 177.43 176.01 1omt h PHE 37 N 0.00 0.00 -0.13 1.19 3.57 -0.70 -3.33 116.94 117.54 1omt h PHE 37 Ca 0.10 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.63 1omt h PHE 37 Cb 1.19 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 1omt h PHE 37 CO 0.00 0.75 0.09 0.00 -2.23 0.00 0.00 178.31 176.92 1omt h ASN 39 N 0.02 0.00 0.73 0.00 2.35 -1.28 0.35 115.58 117.75 1omt h ASN 39 Ca 0.06 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.62 1omt h ASN 39 Cb 0.22 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 1omt h ASN 39 CO -0.00 0.05 -0.87 0.00 -1.65 0.00 0.00 177.43 174.96 1omt h ALA 40 N 1.95 0.56 0.00 -0.83 0.00 -0.94 -2.00 119.26 118.00 1omt h ALA 40 Ca -0.00 -0.75 -0.07 0.00 0.00 0.00 0.00 54.91 54.08 1omt h ALA 40 Cb 0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1omt h ALA 40 CO 0.01 0.99 -0.35 0.28 0.00 0.00 0.00 179.25 180.18 1omt h VAL 41 N 0.05 0.67 0.00 0.00 2.07 -0.22 -2.55 116.25 116.27 1omt h VAL 41 Ca -0.03 -1.71 -0.17 0.00 0.82 0.00 0.00 66.70 65.61 1omt h VAL 41 Cb 1.51 2.16 -0.03 0.00 -1.52 0.00 0.00 31.29 33.41 1omt h VAL 41 CO 0.12 0.35 -1.46 1.33 0.02 0.00 0.00 177.57 177.93 1omt n VAL 42 N -3.27 1.16 1.21 2.57 0.24 0.90 -0.07 118.33 121.06 1omt n VAL 42 Ca 0.02 -0.69 0.13 0.00 -2.04 0.00 0.00 64.34 61.75 1omt n VAL 42 Cb 0.61 -0.71 0.34 0.00 -1.47 0.00 0.00 33.84 32.61 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 -2.86 0.79 0.00 7.34 2.13 -0.76 -3.72 120.64 123.55 1omt n GLU 43 Ca -0.10 -0.48 0.05 0.00 0.66 0.00 0.00 57.16 57.28 1omt n GLU 43 Cb 0.84 -1.49 0.04 0.00 0.27 0.00 0.00 31.44 31.10 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 -0.68 1.75 -0.11 4.31 3.41 -0.96 -4.95 113.62 116.38 1omt n SER 44 Ca 0.11 -1.37 -0.01 0.00 -0.26 0.00 0.00 58.87 57.34 1omt n SER 44 Cb 0.35 0.07 -0.01 0.00 -0.26 0.00 0.00 64.21 64.36 1omt n SER 44 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1omt n ASN 45 N 0.45 -3.35 0.00 4.04 2.85 -1.18 -2.67 115.26 115.39 1omt n ASN 45 Ca 0.06 0.03 0.00 0.00 -0.11 0.00 0.00 54.58 54.56 1omt n ASN 45 Cb 0.24 -0.98 0.00 0.00 1.24 0.00 0.00 39.78 40.29 1omt n ASN 45 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1omt n GLY 46 N -2.58 0.86 0.01 8.20 0.00 0.89 -4.85 105.19 107.72 1omt n GLY 46 Ca -0.01 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.24 0.00 0.00 2.61 5.66 -1.09 -4.15 114.28 115.07 1omt n THR 47 Ca 0.00 -0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1omt n THR 47 Cb 0.00 -0.47 0.00 0.00 -1.55 0.00 0.00 70.33 68.31 1omt n THR 47 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1omt n LEU 48 N -0.96 2.21 -0.17 1.09 7.94 -1.26 -5.08 117.00 120.77 1omt n LEU 48 Ca 0.23 0.07 0.02 0.00 -1.11 0.00 0.00 56.01 55.22 1omt n LEU 48 Cb 0.11 -0.08 -0.01 0.00 0.53 0.00 0.00 43.42 43.97 1omt n LEU 48 CO 0.17 -0.08 -0.05 0.35 -1.11 0.00 0.00 177.39 176.67 1omt n THR 49 N -0.85 0.00 -4.61 1.96 -2.24 -1.26 -4.41 114.28 102.86 1omt n THR 49 Ca 0.00 0.04 -0.28 0.00 -2.27 0.00 0.00 64.05 61.54 1omt n THR 49 Cb 0.00 -0.10 -0.11 0.00 -2.10 0.00 0.00 70.33 68.02 1omt n THR 49 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1omt s LEU 50 N -4.51 2.84 -0.16 3.22 2.34 -1.26 0.26 118.68 121.41 1omt s LEU 50 Ca 0.00 -1.37 -0.08 0.00 0.06 0.00 0.00 54.13 52.73 1omt s LEU 50 Cb 0.00 -0.87 -0.23 0.00 -0.56 0.00 0.00 46.19 44.53 1omt s LEU 50 CO 0.00 -0.46 0.22 -1.54 -1.06 0.00 0.00 176.35 173.51 1omt n SER 51 N -0.96 2.06 -3.64 1.48 3.41 -0.60 -4.62 113.62 110.75 1omt n SER 51 Ca -0.05 0.20 -0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1omt n SER 51 Cb 0.67 -0.81 -0.00 0.00 -0.26 0.00 0.00 64.21 63.80 1omt n SER 51 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1omt s HIS 52 N -2.52 -0.04 0.50 7.33 0.00 -1.24 -4.99 115.29 114.32 1omt s HIS 52 Ca -0.26 -0.16 -0.08 0.00 -3.00 0.00 0.00 55.06 51.55 1omt s HIS 52 Cb 0.07 0.60 0.12 0.00 -4.00 0.00 0.00 32.58 29.37 1omt s HIS 52 CO 0.70 -0.53 0.60 1.19 -1.00 0.00 0.00 174.74 175.70 1omt n PHE 53 N -0.56 -3.84 -4.76 0.38 3.01 -1.26 -1.97 117.46 108.46 1omt n PHE 53 Ca -0.06 -0.53 0.00 0.00 1.01 0.00 0.00 57.45 57.87 1omt n PHE 53 Cb 0.61 -0.50 0.00 0.00 -0.01 0.00 0.00 39.48 39.58 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 0.38 -0.77 3.90 1.37 0.00 0.76 -4.24 105.19 106.58 1omt n GLY 54 Ca 0.08 -1.05 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 1omt n GLY 54 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1omt s LYS 55 N 0.00 3.66 0.00 1.61 -2.85 -1.21 -1.18 119.74 119.76 1omt s LYS 55 Ca 0.00 0.09 0.00 0.00 -1.00 0.00 0.00 55.97 55.06 1omt s LYS 55 Cb 0.00 -2.59 0.00 0.00 -2.06 0.00 0.00 37.83 33.18 1omt s LYS 55 CO 0.00 0.15 0.23 0.00 0.10 0.00 0.00 175.35 175.83