#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 -2.50 -3.83 -1.18 0.00 -1.26 -4.97 120.51 106.77 1omt n ALA 2 Ca 0.00 0.38 0.08 0.00 0.00 0.00 0.00 53.44 53.90 1omt n ALA 2 Cb 0.00 -2.25 0.02 0.00 0.00 0.00 0.00 19.45 17.22 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 -0.65 -2.54 -3.67 0.00 0.00 -1.26 -5.11 120.51 107.28 1omt n ALA 3 Ca -0.08 -0.92 -0.29 0.00 0.00 0.00 0.00 53.44 52.14 1omt n ALA 3 Cb 0.64 0.49 -0.13 0.00 0.00 0.00 0.00 19.45 20.46 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 -2.10 1.26 0.00 0.00 -7.23 -1.26 -5.07 120.40 106.00 1omt s VAL 4 Ca 0.22 -2.53 0.00 0.00 -1.81 0.00 0.00 61.98 57.85 1omt s VAL 4 Cb -0.02 -1.88 0.00 0.00 0.56 0.00 0.00 36.38 35.04 1omt s VAL 4 CO 0.05 -0.93 0.00 -1.20 -0.31 0.00 0.00 175.10 172.70 1omt n SER 5 N 3.49 0.00 -4.72 4.85 7.64 -1.26 -4.99 113.62 118.63 1omt n SER 5 Ca 0.11 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.65 1omt n SER 5 Cb 0.36 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.47 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 -2.00 4.45 0.51 0.44 1.01 -1.26 -5.09 120.40 118.46 1omt s VAL 6 Ca 0.00 -0.35 -0.21 0.00 0.00 0.00 0.00 61.98 61.42 1omt s VAL 6 Cb 0.00 -2.95 -0.06 0.00 0.00 0.00 0.00 36.38 33.37 1omt s VAL 6 CO 0.00 0.48 1.15 -0.62 0.00 0.00 0.00 175.10 176.11 1omt s ASP 7 N -1.29 5.91 -0.10 3.32 2.15 -1.26 -4.95 116.67 120.45 1omt s ASP 7 Ca 0.17 2.26 0.19 0.00 0.43 0.00 0.00 52.55 55.60 1omt s ASP 7 Cb -0.12 -2.59 0.43 0.00 -0.30 0.00 0.00 42.92 40.34 1omt s ASP 7 CO 0.07 -1.09 1.19 0.00 -0.17 0.00 0.00 175.17 175.17 1omt n SER 9 N -0.21 0.64 -0.58 0.00 7.64 -1.26 -3.57 113.62 116.28 1omt n SER 9 Ca 0.12 0.14 0.09 0.00 1.01 0.00 0.00 58.87 60.23 1omt n SER 9 Cb 0.95 0.02 0.04 0.00 -1.01 0.00 0.00 64.21 64.21 1omt n SER 9 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1omt n GLU 10 N -2.00 1.58 -3.08 1.43 0.00 -1.26 -4.97 120.64 112.34 1omt n GLU 10 Ca 0.04 -1.26 -0.23 0.00 0.00 0.00 0.00 57.16 55.71 1omt n GLU 10 Cb 0.42 -1.34 0.01 0.00 0.00 0.00 0.00 31.44 30.52 1omt n GLU 10 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1omt s TYR 11 N -1.77 3.29 0.51 -1.84 2.02 -1.23 -4.42 117.35 113.91 1omt s TYR 11 Ca 0.18 0.26 -0.10 0.00 -0.37 0.00 0.00 57.07 57.03 1omt s TYR 11 Cb 0.15 -2.21 -0.05 0.00 -0.40 0.00 0.00 41.96 39.45 1omt s TYR 11 CO 0.33 -0.24 0.90 -1.25 -1.57 0.00 0.00 175.55 173.72 1omt s PRO 12 N -4.49 3.69 -0.04 -1.71 0.04 -1.26 -5.03 135.00 126.20 1omt s PRO 12 Ca 0.46 0.59 0.00 0.00 0.04 0.00 0.00 61.00 62.09 1omt s PRO 12 Cb -0.10 -2.24 -0.03 0.00 0.04 0.00 0.00 34.50 32.17 1omt s PRO 12 CO 0.37 -0.30 -0.00 0.15 0.04 0.00 0.00 177.00 177.27 1omt s LYS 13 N -4.54 2.86 0.00 4.56 1.02 -1.26 -4.98 119.74 117.40 1omt s LYS 13 Ca 0.53 -0.52 0.00 0.00 0.02 0.00 0.00 55.97 56.00 1omt s LYS 13 Cb -0.10 -2.72 0.00 0.00 -0.52 0.00 0.00 37.83 34.49 1omt s LYS 13 CO 0.42 0.66 0.73 -0.35 -0.92 0.00 0.00 175.35 175.89 1omt n PRO 14 N 1.74 0.99 0.00 -1.68 -0.04 -1.26 -4.79 135.00 129.96 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 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.73 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 -0.23 0.00 -2.71 0.55 0.00 -1.26 -5.17 120.51 111.69 1omt n ALA 15 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 1omt n ALA 15 Cb 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.51 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 -0.63 0.00 0.17 0.00 -2.24 -1.26 -4.97 114.28 105.35 1omt n THR 17 Ca -0.08 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.72 1omt n THR 17 Cb 0.57 -0.33 -0.01 0.00 -2.10 0.00 0.00 70.33 68.45 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 0.37 -4.59 3.22 -0.00 -1.26 -5.01 117.00 109.73 1omt n LEU 18 Ca 0.00 -0.59 -0.47 0.00 -0.00 0.00 0.00 56.01 54.95 1omt n LEU 18 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.39 1omt n LEU 18 CO 0.00 0.08 0.70 -1.84 -0.00 0.00 0.00 177.39 176.33 1omt n GLU 19 N -0.86 1.32 -3.65 1.47 0.00 -1.26 -4.90 120.64 112.77 1omt n GLU 19 Ca 0.01 0.47 -0.36 0.00 0.00 0.00 0.00 57.16 57.28 1omt n GLU 19 Cb 0.06 -1.94 -0.08 0.00 0.00 0.00 0.00 31.44 29.49 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 -0.46 3.44 -0.50 -1.84 5.04 -1.26 -4.86 117.35 116.90 1omt s TYR 20 Ca 0.68 0.45 0.06 0.00 -2.44 0.00 0.00 57.07 55.82 1omt s TYR 20 Cb -0.78 -2.24 0.20 0.00 0.35 0.00 0.00 41.96 39.50 1omt s TYR 20 CO 0.54 0.27 0.79 0.54 -1.34 0.00 0.00 175.55 176.36 1omt n ARG 21 N 3.52 0.57 -1.80 4.97 5.12 -1.22 -5.05 116.66 122.78 1omt n ARG 21 Ca -0.14 -1.90 -0.42 0.00 -1.93 0.00 0.00 57.85 53.46 1omt n ARG 21 Cb 0.52 -1.39 -0.03 0.00 -1.16 0.00 0.00 32.46 30.40 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 0.83 4.16 -0.12 5.56 0.04 -1.13 -3.09 135.00 141.25 1omt s PRO 22 Ca 0.30 2.47 -0.02 0.00 0.04 0.00 0.00 61.00 63.79 1omt s PRO 22 Cb 0.06 -3.97 -0.03 0.00 0.04 0.00 0.00 34.50 30.61 1omt s PRO 22 CO -0.10 -0.88 -0.06 -0.51 0.04 0.00 0.00 177.00 175.49 1omt s LEU 23 N 3.89 3.17 -0.45 -3.56 1.02 -1.03 0.28 118.68 122.01 1omt s LEU 23 Ca 0.82 -0.10 -0.29 0.00 0.02 0.00 0.00 54.13 54.58 1omt s LEU 23 Cb -0.40 -1.73 0.03 0.00 0.02 0.00 0.00 46.19 44.10 1omt s LEU 23 CO 0.37 0.25 1.12 0.00 0.02 0.00 0.00 176.35 178.10 1omt n GLY 25 N 4.70 -2.84 0.08 0.00 0.00 -1.07 -1.90 105.19 104.15 1omt n GLY 25 Ca 0.12 -1.37 -0.11 0.00 0.00 0.00 0.00 46.02 44.65 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 -1.21 0.20 0.21 1.61 0.87 0.42 -3.10 113.55 112.55 1omt h SER 26 Ca 0.00 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 1omt h SER 26 Cb 0.00 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1omt h SER 26 CO 0.00 1.17 0.00 -0.90 -0.53 0.00 0.00 176.83 176.57 1omt n ASP 27 N -3.41 0.00 0.00 6.23 5.68 -1.26 -4.79 116.55 118.99 1omt n ASP 27 Ca -0.05 0.36 0.00 0.00 -0.50 0.00 0.00 54.79 54.60 1omt n ASP 27 Cb 0.99 -0.41 0.00 0.00 -1.14 0.00 0.00 41.12 40.56 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 -1.41 -2.09 -4.37 -1.12 5.15 -1.18 -5.04 115.26 105.21 1omt n ASN 28 Ca 0.03 0.00 -0.36 0.00 -0.60 0.00 0.00 54.58 53.65 1omt n ASN 28 Cb 0.08 -0.35 -0.13 0.00 -0.53 0.00 0.00 39.78 38.85 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 -1.00 3.50 0.98 1.20 -2.85 -1.26 -4.74 119.74 115.57 1omt s LYS 29 Ca 0.00 -0.56 -0.11 0.00 -1.00 0.00 0.00 55.97 54.30 1omt s LYS 29 Cb 0.00 -3.15 0.16 0.00 -2.06 0.00 0.00 37.83 32.78 1omt s LYS 29 CO 0.00 -0.20 0.98 2.41 0.10 0.00 0.00 175.35 178.65 1omt n THR 30 N 4.85 0.00 -4.49 3.79 -1.04 -1.26 -2.60 114.28 113.53 1omt n THR 30 Ca -0.17 -0.12 -0.22 0.00 -2.04 0.00 0.00 64.05 61.50 1omt n THR 30 Cb 0.51 -0.93 -0.16 0.00 -1.82 0.00 0.00 70.33 67.93 1omt n THR 30 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1omt s TYR 31 N -2.55 1.18 0.16 -1.42 2.02 -0.37 -4.84 117.35 111.53 1omt s TYR 31 Ca 0.65 -0.35 -0.05 0.00 -0.37 0.00 0.00 57.07 56.95 1omt s TYR 31 Cb -0.23 -0.86 0.25 0.00 -0.40 0.00 0.00 41.96 40.72 1omt s TYR 31 CO 0.61 -0.17 0.88 0.41 -1.57 0.00 0.00 175.55 175.71 1omt n GLY 32 N 3.51 -0.96 0.00 0.71 0.00 -1.26 -2.45 105.19 104.72 1omt n GLY 32 Ca -0.20 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.42 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 -4.91 0.00 -0.35 1.61 0.23 -1.25 -2.84 115.26 107.74 1omt n ASN 33 Ca 0.09 -0.40 0.10 0.00 -0.53 0.00 0.00 54.58 53.83 1omt n ASN 33 Cb 0.28 0.00 0.27 0.00 -2.08 0.00 0.00 39.78 38.25 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 0.83 0.03 -3.83 2.10 -1.83 0.60 116.57 114.47 1omt h LYS 34 Ca 0.00 -0.05 -0.00 0.00 -2.00 0.00 0.00 60.65 58.60 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 0.55 -0.02 0.00 -2.00 0.00 0.00 179.45 177.98 1omt h ASN 36 N -0.68 0.00 0.00 0.00 2.35 -1.82 -0.91 115.58 114.52 1omt h ASN 36 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1omt h ASN 36 Cb 0.61 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.98 1omt h ASN 36 CO 0.01 0.00 -0.03 0.15 -1.65 0.00 0.00 177.43 175.90 1omt h PHE 37 N 0.00 0.00 -0.14 1.19 3.57 -0.67 -3.34 116.94 117.55 1omt h PHE 37 Ca 0.00 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.52 1omt h PHE 37 Cb 0.08 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 1omt h PHE 37 CO 0.00 0.00 -0.00 0.00 -2.23 0.00 0.00 178.31 176.08 1omt h ASN 39 N 0.04 0.00 -0.00 0.00 2.35 -1.35 2.35 115.58 118.97 1omt h ASN 39 Ca 0.07 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 1omt h ASN 39 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 1omt h ASN 39 CO -0.12 0.00 -0.03 0.00 -1.65 0.00 0.00 177.43 175.63 1omt h ALA 40 N 1.02 0.01 0.25 -0.83 0.00 -1.13 -2.06 119.26 116.52 1omt h ALA 40 Ca 0.76 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 55.31 1omt h ALA 40 Cb 3.24 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 21.00 1omt h ALA 40 CO -0.01 -0.11 -0.33 0.28 0.00 0.00 0.00 179.25 179.08 1omt h VAL 41 N -0.67 0.31 -0.17 0.00 2.07 0.41 0.63 116.25 118.82 1omt h VAL 41 Ca -0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 1omt h VAL 41 Cb 0.74 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1omt h VAL 41 CO 0.01 0.00 0.13 -0.37 0.02 0.00 0.00 177.57 177.35 1omt h VAL 42 N -0.64 0.88 0.00 2.57 -1.51 -0.78 0.99 116.25 117.76 1omt h VAL 42 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1omt h VAL 42 Cb 0.61 0.91 0.00 0.00 -2.13 0.00 0.00 31.29 30.68 1omt h VAL 42 CO -0.11 0.00 -0.56 1.21 -1.23 0.00 0.00 177.57 176.88 1omt n GLU 43 N -4.44 0.03 -0.51 5.19 2.13 -0.61 -3.80 120.64 118.63 1omt n GLU 43 Ca 0.01 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.92 1omt n GLU 43 Cb 0.26 -1.51 0.29 0.00 0.27 0.00 0.00 31.44 30.75 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 -1.55 4.25 -0.84 4.31 3.41 0.21 -4.91 113.62 118.50 1omt n SER 44 Ca 0.05 -2.60 -0.11 0.00 -0.26 0.00 0.00 58.87 55.95 1omt n SER 44 Cb 0.34 -0.51 -0.05 0.00 -0.26 0.00 0.00 64.21 63.73 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 0.42 -5.28 -0.67 4.04 4.13 -0.91 -1.50 115.26 115.49 1omt n ASN 45 Ca 0.22 0.27 -0.08 0.00 1.68 0.00 0.00 54.58 56.67 1omt n ASN 45 Cb 0.84 -3.75 -0.03 0.00 -1.54 0.00 0.00 39.78 35.30 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 -0.36 0.81 1.00 7.41 0.00 -0.26 -4.87 105.19 108.92 1omt n GLY 46 Ca -0.11 -0.66 0.11 0.00 0.00 0.00 0.00 46.02 45.36 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 -3.01 0.53 0.00 2.61 -2.24 -0.56 -4.51 114.28 107.09 1omt n THR 47 Ca -0.08 -0.67 0.00 0.00 -2.27 0.00 0.00 64.05 61.03 1omt n THR 47 Cb 0.32 0.65 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 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 1.15 1.13 -1.09 3.22 7.94 -1.26 -5.04 117.00 123.04 1omt n LEU 48 Ca 0.19 0.12 0.04 0.00 -1.11 0.00 0.00 56.01 55.24 1omt n LEU 48 Cb 0.51 -0.19 -0.02 0.00 0.53 0.00 0.00 43.42 44.25 1omt n LEU 48 CO 0.14 -0.19 -0.38 0.35 -1.11 0.00 0.00 177.39 176.21 1omt n THR 49 N -1.39 -1.67 -3.75 1.96 -2.24 -1.26 -4.07 114.28 101.85 1omt n THR 49 Ca 0.00 0.94 -0.23 0.00 -2.27 0.00 0.00 64.05 62.48 1omt n THR 49 Cb 0.00 -1.53 -0.03 0.00 -2.10 0.00 0.00 70.33 66.68 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 -5.17 3.10 -0.14 3.22 0.20 -1.26 0.29 118.68 118.92 1omt s LEU 50 Ca 0.00 -0.98 0.08 0.00 0.69 0.00 0.00 54.13 53.92 1omt s LEU 50 Cb 0.00 -1.64 -0.14 0.00 -0.43 0.00 0.00 46.19 43.97 1omt s LEU 50 CO 0.00 -0.81 -0.02 -0.24 -0.29 0.00 0.00 176.35 174.99 1omt n SER 51 N -1.59 2.07 -3.58 3.68 2.88 -0.80 -4.66 113.62 111.61 1omt n SER 51 Ca 0.01 -0.03 -0.07 0.00 -1.33 0.00 0.00 58.87 57.46 1omt n SER 51 Cb 0.63 0.44 -0.02 0.00 -0.75 0.00 0.00 64.21 64.51 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 -0.27 0.85 0.66 0.00 -1.25 -5.07 115.29 107.88 1omt s HIS 52 Ca -0.12 0.08 -0.14 0.00 -3.00 0.00 0.00 55.06 51.88 1omt s HIS 52 Cb 0.05 0.57 0.20 0.00 -4.00 0.00 0.00 32.58 29.40 1omt s HIS 52 CO 0.49 -0.62 0.98 1.19 -1.00 0.00 0.00 174.74 175.77 1omt n PHE 53 N -0.32 -3.89 -4.15 0.38 3.01 -1.26 -1.37 117.46 109.87 1omt n PHE 53 Ca -0.08 -0.87 0.00 0.00 1.01 0.00 0.00 57.45 57.51 1omt n PHE 53 Cb 0.61 -0.84 -0.00 0.00 -0.01 0.00 0.00 39.48 39.24 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 -2.39 -1.74 3.68 1.37 0.00 0.82 -4.34 105.19 102.58 1omt n GLY 54 Ca 0.13 -1.29 -0.39 0.00 0.00 0.00 0.00 46.02 44.47 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 -0.07 4.24 0.00 1.61 1.02 -1.21 -1.67 119.74 123.67 1omt s LYS 55 Ca 0.00 0.48 0.00 0.00 0.02 0.00 0.00 55.97 56.47 1omt s LYS 55 Cb 0.00 -3.53 0.00 0.00 -0.52 0.00 0.00 37.83 33.78 1omt s LYS 55 CO 0.00 -0.07 0.44 0.00 -0.92 0.00 0.00 175.35 174.79