#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ovo s ALA 2 N 0.00 3.51 0.32 1.96 0.00 -1.26 -4.91 121.76 121.38 3ovo s ALA 2 Ca 0.00 -0.22 0.13 0.00 0.00 0.00 0.00 51.96 51.87 3ovo s ALA 2 Cb 0.00 -2.92 0.62 0.00 0.00 0.00 0.00 23.12 20.82 3ovo s ALA 2 CO 0.00 -0.43 1.76 0.00 0.00 0.00 0.00 175.76 177.08 3ovo h ALA 3 N 7.31 1.22 -2.51 0.00 0.00 -1.88 -3.46 119.26 119.94 3ovo h ALA 3 Ca -0.34 -0.41 -0.15 0.00 0.00 0.00 0.00 54.91 54.01 3ovo h ALA 3 Cb 1.15 -0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.73 3ovo h ALA 3 CO 0.77 0.56 -0.52 0.14 0.00 0.00 0.00 179.25 180.19 3ovo s VAL 4 N -3.96 0.09 0.26 0.00 -7.23 -1.26 -5.18 120.40 103.12 3ovo s VAL 4 Ca -0.02 -1.71 -0.22 0.00 -1.81 0.00 0.00 61.98 58.22 3ovo s VAL 4 Cb 0.14 -1.98 0.03 0.00 0.56 0.00 0.00 36.38 35.13 3ovo s VAL 4 CO 0.73 -0.39 0.73 -0.94 -0.31 0.00 0.00 175.10 174.92 3ovo s SER 5 N -3.02 -0.28 0.16 4.85 1.04 -1.26 -4.65 113.70 110.54 3ovo s SER 5 Ca 0.22 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.11 3ovo s SER 5 Cb 0.06 0.69 -0.04 0.00 0.10 0.00 0.00 66.02 66.83 3ovo s SER 5 CO 0.01 -1.27 0.04 0.68 0.98 0.00 0.00 173.24 173.68 3ovo s VAL 6 N -3.84 0.37 -0.51 5.02 -7.23 -1.26 -5.09 120.40 107.86 3ovo s VAL 6 Ca 0.10 -1.95 -0.23 0.00 -1.81 0.00 0.00 61.98 58.09 3ovo s VAL 6 Cb -0.05 -2.15 0.04 0.00 0.56 0.00 0.00 36.38 34.77 3ovo s VAL 6 CO 0.05 -0.40 0.84 -0.62 -0.31 0.00 0.00 175.10 174.66 3ovo s ASP 7 N -3.13 6.34 -0.22 4.85 2.15 -1.26 -4.90 116.67 120.51 3ovo s ASP 7 Ca 0.26 -0.37 0.14 0.00 0.43 0.00 0.00 52.55 53.02 3ovo s ASP 7 Cb 0.07 -2.40 0.80 0.00 -0.30 0.00 0.00 42.92 41.10 3ovo s ASP 7 CO 0.04 -1.08 1.72 0.00 -0.17 0.00 0.00 175.17 175.69 3ovo h SER 9 N 3.99 0.00 -0.66 0.00 4.64 -1.99 -2.74 113.55 116.78 3ovo h SER 9 Ca 0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 3ovo h SER 9 Cb 1.90 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.82 3ovo h SER 9 CO 0.45 0.00 0.27 -0.62 -0.87 0.00 0.00 176.83 176.06 3ovo n GLU 10 N -2.79 2.69 -4.00 4.77 1.02 -1.26 -4.88 120.64 116.18 3ovo n GLU 10 Ca 0.00 -3.07 -0.22 0.00 -0.02 0.00 0.00 57.16 53.85 3ovo n GLU 10 Cb 0.22 -2.06 -0.03 0.00 -0.02 0.00 0.00 31.44 29.55 3ovo n GLU 10 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3ovo s TYR 11 N -3.14 3.38 0.52 -0.32 1.51 -1.04 -4.48 117.35 113.78 3ovo s TYR 11 Ca 0.52 -0.01 -0.12 0.00 -1.01 0.00 0.00 57.07 56.44 3ovo s TYR 11 Cb 0.43 -1.55 -0.06 0.00 -0.11 0.00 0.00 41.96 40.67 3ovo s TYR 11 CO 0.09 0.47 0.92 -1.25 -1.11 0.00 0.00 175.55 174.67 3ovo s PRO 12 N -3.77 3.75 -0.06 -1.71 0.04 -1.26 -5.05 135.00 126.95 3ovo s PRO 12 Ca 0.34 0.68 0.03 0.00 0.04 0.00 0.00 61.00 62.08 3ovo s PRO 12 Cb -0.09 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 32.24 3ovo s PRO 12 CO 0.28 -0.30 -0.13 0.15 0.04 0.00 0.00 177.00 177.04 3ovo s LYS 13 N -4.44 1.65 0.50 4.56 1.02 -1.26 -5.03 119.74 116.74 3ovo s LYS 13 Ca 0.54 -0.46 0.33 0.00 0.02 0.00 0.00 55.97 56.41 3ovo s LYS 13 Cb -0.10 -1.40 1.58 0.00 -0.52 0.00 0.00 37.83 37.40 3ovo s LYS 13 CO 0.40 0.10 2.00 -1.00 -0.92 0.00 0.00 175.35 175.93 3ovo h PRO 14 N 6.70 0.00 -5.32 -1.68 0.13 -2.02 -3.44 132.00 126.37 3ovo h PRO 14 Ca -0.31 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.39 3ovo h PRO 14 Cb 1.18 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.08 3ovo h PRO 14 CO 0.48 0.00 -0.78 0.00 -0.23 0.00 0.00 178.00 177.46 3ovo s ALA 15 N -3.73 1.16 -0.13 -0.56 0.00 -1.26 -5.05 121.76 112.20 3ovo s ALA 15 Ca -0.01 -0.92 -0.07 0.00 0.00 0.00 0.00 51.96 50.97 3ovo s ALA 15 Cb 0.10 -0.13 0.05 0.00 0.00 0.00 0.00 23.12 23.13 3ovo s ALA 15 CO 0.42 0.19 0.30 0.00 0.00 0.00 0.00 175.76 176.68 3ovo s PRO 17 N 1.17 -0.76 0.00 0.00 0.04 -1.26 -5.08 135.00 129.11 3ovo s PRO 17 Ca -0.08 0.82 0.00 0.00 0.04 0.00 0.00 61.00 61.77 3ovo s PRO 17 Cb -0.09 -1.57 0.00 0.00 0.04 0.00 0.00 34.50 32.88 3ovo s PRO 17 CO -0.09 -3.61 0.50 1.17 0.04 0.00 0.00 177.00 175.01 3ovo n LYS 18 N -4.84 0.60 -1.62 4.56 4.81 -1.26 -5.16 118.16 115.25 3ovo n LYS 18 Ca 0.03 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.10 3ovo n LYS 18 Cb 0.55 -1.10 0.05 0.00 0.02 0.00 0.00 35.03 34.55 3ovo n LYS 18 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3ovo n ASP 19 N -0.26 0.80 -4.49 3.14 8.00 -1.26 -5.29 116.55 117.18 3ovo n ASP 19 Ca 0.00 0.81 -0.43 0.00 0.71 0.00 0.00 54.79 55.88 3ovo n ASP 19 Cb 0.05 -1.39 -0.06 0.00 -0.02 0.00 0.00 41.12 39.70 3ovo n ASP 19 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3ovo s TYR 20 N -1.51 2.97 -0.44 1.24 5.04 -1.26 -4.70 117.35 118.70 3ovo s TYR 20 Ca 0.75 -0.23 0.07 0.00 -2.44 0.00 0.00 57.07 55.22 3ovo s TYR 20 Cb -0.42 -3.66 0.23 0.00 0.35 0.00 0.00 41.96 38.46 3ovo s TYR 20 CO 0.47 -1.09 0.64 0.54 -1.34 0.00 0.00 175.55 174.78 3ovo n ARG 21 N 6.61 0.65 -1.81 4.97 1.74 0.82 -5.03 116.66 124.62 3ovo n ARG 21 Ca -0.02 -2.59 -0.38 0.00 -0.77 0.00 0.00 57.85 54.08 3ovo n ARG 21 Cb 0.47 -1.38 0.04 0.00 -1.02 0.00 0.00 32.46 30.56 3ovo n ARG 21 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3ovo s PRO 22 N -0.19 3.21 0.02 5.56 0.04 -1.18 -3.88 135.00 138.59 3ovo s PRO 22 Ca 0.33 2.23 0.01 0.00 0.04 0.00 0.00 61.00 63.61 3ovo s PRO 22 Cb 0.16 -2.30 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 3ovo s PRO 22 CO -0.16 -1.13 -0.04 0.14 0.04 0.00 0.00 177.00 175.84 3ovo s VAL 23 N -1.31 0.25 -0.27 -0.36 -7.23 -0.60 -1.17 120.40 109.72 3ovo s VAL 23 Ca 0.70 -0.81 -0.07 0.00 -1.81 0.00 0.00 61.98 60.00 3ovo s VAL 23 Cb -0.40 -0.35 -0.00 0.00 0.56 0.00 0.00 36.38 36.19 3ovo s VAL 23 CO 0.48 -0.36 0.06 0.00 -0.31 0.00 0.00 175.10 174.97 3ovo s GLY 25 N 1.53 1.59 0.27 0.00 0.00 -0.19 -1.29 107.32 109.24 3ovo s GLY 25 Ca 0.04 -0.17 0.21 0.00 0.00 0.00 0.00 44.72 44.79 3ovo s GLY 25 CO 0.02 0.38 1.63 -1.14 0.00 0.00 0.00 173.10 173.98 3ovo n SER 26 N -4.07 0.54 -0.55 1.64 3.41 0.10 -0.72 113.62 113.97 3ovo n SER 26 Ca 0.06 0.70 0.11 0.00 -0.26 0.00 0.00 58.87 59.49 3ovo n SER 26 Cb 0.56 -0.79 0.40 0.00 -0.26 0.00 0.00 64.21 64.11 3ovo n SER 26 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3ovo n ASP 27 N -2.18 1.66 -1.03 4.04 5.75 -1.26 -4.90 116.55 118.64 3ovo n ASP 27 Ca 0.00 -1.68 -0.11 0.00 -0.01 0.00 0.00 54.79 52.99 3ovo n ASP 27 Cb 0.10 -0.09 -0.03 0.00 -1.03 0.00 0.00 41.12 40.07 3ovo n ASP 27 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3ovo n ASN 28 N 0.32 -4.12 -4.89 -1.12 3.02 0.10 -5.03 115.26 103.53 3ovo n ASN 28 Ca 0.17 0.18 -0.35 0.00 -0.03 0.00 0.00 54.58 54.54 3ovo n ASN 28 Cb 0.34 -2.89 -0.05 0.00 -0.61 0.00 0.00 39.78 36.57 3ovo n ASN 28 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3ovo s LYS 29 N -3.54 3.45 -0.47 3.52 2.20 -1.26 -4.90 119.74 118.74 3ovo s LYS 29 Ca 0.00 -0.24 -0.22 0.00 -0.36 0.00 0.00 55.97 55.14 3ovo s LYS 29 Cb 0.00 -3.13 0.03 0.00 -1.51 0.00 0.00 37.83 33.22 3ovo s LYS 29 CO 0.00 0.71 0.75 0.99 -0.36 0.00 0.00 175.35 177.45 3ovo s THR 30 N -1.22 4.68 -0.02 3.43 2.01 -1.26 -1.02 115.64 122.24 3ovo s THR 30 Ca 0.23 0.23 -0.21 0.00 0.31 0.00 0.00 61.69 62.25 3ovo s THR 30 Cb -0.12 -4.32 -0.05 0.00 0.01 0.00 0.00 72.50 68.02 3ovo s THR 30 CO 0.13 -0.75 0.61 -0.31 -0.69 0.00 0.00 174.62 173.61 3ovo s TYR 31 N 3.19 3.65 0.32 4.92 2.02 -0.39 -4.90 117.35 126.17 3ovo s TYR 31 Ca 0.27 1.19 0.26 0.00 -0.37 0.00 0.00 57.07 58.41 3ovo s TYR 31 Cb -0.13 -2.64 1.24 0.00 -0.40 0.00 0.00 41.96 40.02 3ovo s TYR 31 CO 0.20 0.29 1.98 0.66 -1.57 0.00 0.00 175.55 177.10 3ovo h SER 32 N 5.94 0.00 -5.21 2.29 4.64 -1.88 -1.60 113.55 117.72 3ovo h SER 32 Ca -0.44 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 60.95 3ovo h SER 32 Cb 1.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 3ovo h SER 32 CO 0.71 0.17 0.44 0.54 -0.87 0.00 0.00 176.83 177.82 3ovo s ASN 33 N -6.20 0.03 0.31 4.97 2.20 -1.25 -0.12 114.94 114.88 3ovo s ASN 33 Ca -0.02 -0.96 0.05 0.00 -0.94 0.00 0.00 52.86 51.00 3ovo s ASN 33 Cb 0.12 0.68 0.51 0.00 -2.00 0.00 0.00 41.25 40.57 3ovo s ASN 33 CO 0.61 -1.37 1.77 0.50 -2.94 0.00 0.00 177.10 175.67 3ovo h LYS 34 N 2.00 0.39 -0.40 3.55 3.64 -1.90 -2.47 116.57 121.38 3ovo h LYS 34 Ca -0.31 -0.13 -0.15 0.00 -1.27 0.00 0.00 60.65 58.79 3ovo h LYS 34 Cb 1.23 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 3ovo h LYS 34 CO 0.40 0.60 -0.33 0.00 -2.27 0.00 0.00 179.45 177.84 3ovo h ASN 36 N 0.75 0.70 -0.13 0.00 4.21 -1.93 -0.80 115.58 118.39 3ovo h ASN 36 Ca 0.07 -0.05 -0.01 0.00 1.21 0.00 0.00 56.30 57.52 3ovo h ASN 36 Cb 0.92 -0.18 -0.01 0.00 -1.12 0.00 0.00 38.32 37.94 3ovo h ASN 36 CO 0.09 0.55 0.05 0.15 -1.29 0.00 0.00 177.43 176.97 3ovo h PHE 37 N 0.80 0.20 -0.26 1.19 3.57 -1.17 -1.79 116.94 119.48 3ovo h PHE 37 Ca 0.21 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.63 3ovo h PHE 37 Cb -0.03 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 3ovo h PHE 37 CO -0.02 0.30 -0.12 0.00 -2.23 0.00 0.00 178.31 176.24 3ovo h ASN 39 N 0.40 0.49 -0.60 0.00 -0.26 -1.06 -1.98 115.58 112.57 3ovo h ASN 39 Ca 0.08 -0.20 -0.04 0.00 -0.56 0.00 0.00 56.30 55.58 3ovo h ASN 39 Cb 0.45 -0.14 -0.03 0.00 -1.06 0.00 0.00 38.32 37.55 3ovo h ASN 39 CO 0.03 0.81 0.23 0.00 -1.06 0.00 0.00 177.43 177.44 3ovo h ALA 40 N 1.22 0.78 -0.57 -0.83 0.00 -0.28 0.34 119.26 119.92 3ovo h ALA 40 Ca 0.04 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.79 3ovo h ALA 40 Cb 0.81 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3ovo h ALA 40 CO 0.07 0.41 0.37 0.28 0.00 0.00 0.00 179.25 180.38 3ovo h VAL 41 N 0.84 1.14 -0.46 0.00 2.07 0.03 -0.48 116.25 119.39 3ovo h VAL 41 Ca 0.20 -0.26 -0.14 0.00 0.82 0.00 0.00 66.70 67.32 3ovo h VAL 41 Cb 0.22 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 3ovo h VAL 41 CO -0.01 0.14 -0.26 -0.37 0.02 0.00 0.00 177.57 177.08 3ovo h VAL 42 N 0.76 1.27 0.00 2.57 -1.51 -1.17 -1.47 116.25 116.70 3ovo h VAL 42 Ca 0.21 -1.43 -0.02 0.00 -1.23 0.00 0.00 66.70 64.23 3ovo h VAL 42 Cb -0.07 1.19 -0.00 0.00 -2.13 0.00 0.00 31.29 30.28 3ovo h VAL 42 CO -0.05 0.49 -0.09 -0.33 -1.23 0.00 0.00 177.57 176.36 3ovo h GLU 43 N 0.83 0.00 -0.01 5.19 5.08 -0.01 -0.68 114.58 124.98 3ovo h GLU 43 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3ovo h GLU 43 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 3ovo h GLU 43 CO 0.08 0.09 -0.03 -1.13 -1.00 0.00 0.00 179.01 177.01 3ovo n SER 44 N -4.14 0.88 -3.63 1.42 3.41 -0.22 -4.92 113.62 106.43 3ovo n SER 44 Ca -0.03 -1.17 -0.21 0.00 -0.26 0.00 0.00 58.87 57.20 3ovo n SER 44 Cb 0.17 -0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.17 3ovo n SER 44 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3ovo n ASN 45 N -0.39 -2.18 0.00 4.04 3.02 -0.26 -3.00 115.26 116.49 3ovo n ASN 45 Ca 0.19 -0.73 0.00 0.00 -0.03 0.00 0.00 54.58 54.01 3ovo n ASN 45 Cb 0.27 -4.46 0.00 0.00 -0.61 0.00 0.00 39.78 34.99 3ovo n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ovo n GLY 46 N -1.48 0.78 0.17 7.41 0.00 -0.58 -4.91 105.19 106.57 3ovo n GLY 46 Ca -0.24 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.79 3ovo n GLY 46 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3ovo h THR 47 N 0.00 1.34 -3.67 2.61 1.35 -1.75 -3.43 112.91 109.37 3ovo h THR 47 Ca 0.00 -1.64 -0.50 0.00 -0.55 0.00 0.00 66.41 63.72 3ovo h THR 47 Cb 0.00 1.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.29 3ovo h THR 47 CO 0.00 0.47 0.39 -0.22 -0.25 0.00 0.00 175.52 175.90 3ovo s LEU 48 N -7.95 4.57 0.29 3.87 2.96 -1.26 -5.01 118.68 116.14 3ovo s LEU 48 Ca -0.02 1.96 0.03 0.00 -0.22 0.00 0.00 54.13 55.87 3ovo s LEU 48 Cb 0.14 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 43.16 3ovo s LEU 48 CO 0.74 -0.00 0.06 0.42 -1.32 0.00 0.00 176.35 176.25 3ovo s THR 49 N -0.65 0.97 -0.46 3.68 -4.23 -1.26 -4.81 115.64 108.89 3ovo s THR 49 Ca 0.45 -2.01 -0.25 0.00 -1.18 0.00 0.00 61.69 58.70 3ovo s THR 49 Cb -0.26 -2.66 0.03 0.00 1.34 0.00 0.00 72.50 70.94 3ovo s THR 49 CO 0.33 -0.06 0.90 -0.22 -0.54 0.00 0.00 174.62 175.02 3ovo s LEU 50 N -3.40 4.06 -0.03 4.79 2.96 -1.26 0.01 118.68 125.82 3ovo s LEU 50 Ca 0.35 0.06 -0.22 0.00 -0.22 0.00 0.00 54.13 54.11 3ovo s LEU 50 Cb 0.08 -3.14 -0.15 0.00 0.50 0.00 0.00 46.19 43.48 3ovo s LEU 50 CO 0.14 -1.03 0.96 -1.13 -1.32 0.00 0.00 176.35 173.97 3ovo h ASN 51 N 9.07 -0.30 -5.15 3.68 -0.00 -1.40 -3.42 115.58 118.04 3ovo h ASN 51 Ca -0.24 -0.23 -0.04 0.00 -0.00 0.00 0.00 56.30 55.79 3ovo h ASN 51 Cb 1.08 0.08 -0.10 0.00 -0.00 0.00 0.00 38.32 39.38 3ovo h ASN 51 CO 1.01 0.17 -0.06 -1.38 -0.00 0.00 0.00 177.43 177.17 3ovo s HIS 52 N -3.84 0.09 0.54 0.67 -3.43 -1.02 -4.73 115.29 103.57 3ovo s HIS 52 Ca -0.12 -0.45 -0.21 0.00 -0.80 0.00 0.00 55.06 53.47 3ovo s HIS 52 Cb 0.01 0.28 -0.05 0.00 -1.43 0.00 0.00 32.58 31.38 3ovo s HIS 52 CO 0.46 -0.92 1.22 -0.06 -2.00 0.00 0.00 174.74 173.44 3ovo s PHE 53 N -3.93 2.54 0.00 0.38 0.08 -1.26 -1.22 117.98 114.57 3ovo s PHE 53 Ca 0.14 1.50 0.00 0.00 0.12 0.00 0.00 56.93 58.69 3ovo s PHE 53 Cb -0.00 -3.50 0.00 0.00 -0.57 0.00 0.00 43.02 38.95 3ovo s PHE 53 CO 0.01 -2.08 0.00 0.41 -0.10 0.00 0.00 175.22 173.46 3ovo n GLY 54 N 0.50 -0.86 3.66 4.36 0.00 -0.31 -4.70 105.19 107.83 3ovo n GLY 54 Ca 0.11 -1.68 -0.39 0.00 0.00 0.00 0.00 46.02 44.06 3ovo n GLY 54 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3ovo n LYS 55 N -0.92 1.29 0.00 1.61 2.85 -1.26 -1.38 118.16 120.35 3ovo n LYS 55 Ca 0.00 0.48 0.06 0.00 -1.05 0.00 0.00 58.31 57.80 3ovo n LYS 55 Cb 0.00 -2.28 0.38 0.00 -0.65 0.00 0.00 35.03 32.48 3ovo n LYS 55 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35