#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1brz n LYS 3 N 0.00 -3.11 0.00 0.11 4.76 -1.26 -4.67 118.16 113.99 1brz n LYS 3 Ca 0.00 2.27 0.00 0.00 -2.87 0.00 0.00 58.31 57.71 1brz n LYS 3 Cb 0.00 -3.73 0.00 0.00 -1.84 0.00 0.00 35.03 29.46 1brz n LYS 3 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1brz s LYS 5 N 0.00 0.20 -0.04 0.00 1.02 -1.26 -1.15 119.74 118.50 1brz s LYS 5 Ca 0.00 -0.23 -0.02 0.00 0.02 0.00 0.00 55.97 55.74 1brz s LYS 5 Cb 0.00 -1.17 0.03 0.00 -0.52 0.00 0.00 37.83 36.17 1brz s LYS 5 CO 0.00 -0.89 0.09 0.15 -0.92 0.00 0.00 175.35 173.78 1brz s LYS 6 N 2.21 0.04 0.66 1.68 1.02 -0.60 -5.00 119.74 119.75 1brz s LYS 6 Ca 0.07 0.26 -0.16 0.00 0.02 0.00 0.00 55.97 56.17 1brz s LYS 6 Cb -0.15 -0.17 -0.00 0.00 -0.52 0.00 0.00 37.83 36.99 1brz s LYS 6 CO -0.27 -0.14 1.16 0.14 -0.92 0.00 0.00 175.35 175.32 1brz s VAL 7 N 0.95 2.82 -0.05 3.17 -7.23 -1.26 -0.97 120.40 117.83 1brz s VAL 7 Ca -0.08 0.43 0.00 0.00 -1.81 0.00 0.00 61.98 60.52 1brz s VAL 7 Cb -0.10 -3.01 0.05 0.00 0.56 0.00 0.00 36.38 33.87 1brz s VAL 7 CO -0.04 -0.19 1.66 0.00 -0.31 0.00 0.00 175.10 176.22 1brz n TYR 8 N -2.22 0.29 0.00 2.82 4.19 0.16 -4.78 117.16 117.61 1brz n TYR 8 Ca 0.12 -0.98 0.00 0.00 3.31 0.00 0.00 57.90 60.35 1brz n TYR 8 Cb 0.51 -0.49 0.00 0.00 0.49 0.00 0.00 39.34 39.85 1brz n TYR 8 CO 0.00 0.00 0.00 -0.85 0.91 0.00 0.00 176.86 176.92 1brz n GLU 9 N 0.94 0.00 0.00 2.98 0.28 -1.26 -0.93 120.64 122.64 1brz n GLU 9 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.06 1brz n GLU 9 Cb 0.55 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.42 1brz n GLU 9 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1brz n ASN 10 N 0.00 0.00 0.00 -1.84 4.13 -1.26 -4.86 115.26 111.43 1brz n ASN 10 Ca 0.00 0.88 0.00 0.00 1.68 0.00 0.00 54.58 57.14 1brz n ASN 10 Cb 0.00 -0.38 0.00 0.00 -1.54 0.00 0.00 39.78 37.86 1brz n ASN 10 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1brz n TYR 11 N -2.37 0.00 -1.51 3.10 9.36 -0.11 -4.15 117.16 121.49 1brz n TYR 11 Ca 0.00 0.00 -0.28 0.00 3.32 0.00 0.00 57.90 60.94 1brz n TYR 11 Cb 0.00 0.00 -0.18 0.00 -0.63 0.00 0.00 39.34 38.53 1brz n TYR 11 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1brz n PRO 12 N 0.92 0.09 -1.54 2.98 -0.02 -1.26 -4.74 135.00 131.43 1brz n PRO 12 Ca 0.00 -0.07 -0.28 0.00 -2.02 0.00 0.00 63.50 61.12 1brz n PRO 12 Cb 0.00 -1.49 -0.07 0.00 -0.02 0.00 0.00 33.50 31.92 1brz n PRO 12 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1brz n VAL 13 N 6.50 -0.04 -1.25 -1.45 0.31 -1.26 -4.16 118.33 116.98 1brz n VAL 13 Ca 0.64 -0.59 -0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1brz n VAL 13 Cb 0.15 -2.08 -0.00 0.00 -0.91 0.00 0.00 33.84 31.00 1brz n VAL 13 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1brz n SER 14 N 15.48 -0.03 -3.15 4.52 3.41 -1.26 -5.11 113.62 127.48 1brz n SER 14 Ca 0.46 -0.10 0.05 0.00 -0.26 0.00 0.00 58.87 59.02 1brz n SER 14 Cb 0.42 0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 64.37 1brz n SER 14 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1brz s LYS 15 N 0.00 0.16 0.00 4.33 1.02 -1.26 -5.03 119.74 118.96 1brz s LYS 15 Ca 0.00 0.25 0.00 0.00 0.02 0.00 0.00 55.97 56.24 1brz s LYS 15 Cb 0.00 0.14 0.00 0.00 -0.52 0.00 0.00 37.83 37.45 1brz s LYS 15 CO 0.00 -0.20 0.00 0.00 -0.92 0.00 0.00 175.35 174.23 1brz n GLN 17 N 0.00 0.13 -3.64 0.00 1.13 -1.26 -4.44 117.38 109.30 1brz n GLN 17 Ca 0.00 0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 54.99 1brz n GLN 17 Cb 0.00 -1.06 -0.07 0.00 0.11 0.00 0.00 30.24 29.22 1brz n GLN 17 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1brz s LEU 18 N -0.03 -0.66 0.00 1.08 1.43 -1.26 -5.17 118.68 114.07 1brz s LEU 18 Ca 0.00 1.14 -0.13 0.00 -1.03 0.00 0.00 54.13 54.11 1brz s LEU 18 Cb 0.00 2.09 0.20 0.00 0.03 0.00 0.00 46.19 48.50 1brz s LEU 18 CO 0.00 -0.19 0.44 0.00 0.23 0.00 0.00 176.35 176.84 1brz n ALA 19 N 3.32 -2.71 0.00 4.21 0.00 -1.26 -4.14 120.51 119.92 1brz n ALA 19 Ca -0.17 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.49 1brz n ALA 19 Cb 0.57 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1brz n ALA 19 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1brz n ASN 20 N -3.53 0.00 0.00 0.00 5.15 -1.26 -4.71 115.26 110.91 1brz n ASN 20 Ca 0.07 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.05 1brz n ASN 20 Cb 0.31 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.56 1brz n ASN 20 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1brz n GLN 21 N 0.00 0.00 -0.12 1.20 3.00 -1.26 0.26 117.38 120.47 1brz n GLN 21 Ca 0.00 0.14 -0.09 0.00 -0.01 0.00 0.00 57.00 57.05 1brz n GLN 21 Cb 0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 30.24 29.86 1brz n GLN 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1brz n ASN 23 N -4.77 0.00 -0.25 0.00 5.15 -0.09 -0.82 115.26 114.47 1brz n ASN 23 Ca -0.00 0.73 0.05 0.00 -0.60 0.00 0.00 54.58 54.75 1brz n ASN 23 Cb 0.07 -0.23 0.16 0.00 -0.53 0.00 0.00 39.78 39.26 1brz n ASN 23 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1brz h TYR 24 N 0.00 0.04 0.00 1.20 3.20 0.36 0.22 116.97 121.99 1brz h TYR 24 Ca 0.00 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1brz h TYR 24 Cb 0.00 0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.37 1brz h TYR 24 CO -0.09 -0.20 0.00 -0.25 -1.64 0.00 0.00 178.16 175.99 1brz n ASP 25 N -5.29 0.00 -0.32 -2.11 8.00 -0.52 -2.23 116.55 114.09 1brz n ASP 25 Ca 0.13 0.82 0.15 0.00 0.71 0.00 0.00 54.79 56.60 1brz n ASP 25 Cb 0.46 -0.32 0.38 0.00 -0.02 0.00 0.00 41.12 41.63 1brz n ASP 25 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1brz n LYS 27 N -4.67 0.16 0.00 0.00 4.81 0.78 -0.81 118.16 118.43 1brz n LYS 27 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.66 1brz n LYS 27 Cb 0.61 -1.14 0.00 0.00 0.02 0.00 0.00 35.03 34.52 1brz n LYS 27 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1brz n LEU 28 N -0.64 0.00 0.14 3.14 0.00 0.18 -4.40 117.00 115.42 1brz n LEU 28 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 56.01 55.90 1brz n LEU 28 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 43.42 43.35 1brz n LEU 28 CO 0.01 0.00 0.45 0.44 0.00 0.00 0.00 177.39 178.28 1brz h ASP 29 N 0.00 -0.35 -0.26 1.96 5.19 0.63 -3.28 116.42 120.30 1brz h ASP 29 Ca 0.00 -0.19 0.00 0.00 -0.62 0.00 0.00 57.03 56.22 1brz h ASP 29 Cb 0.00 0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.60 1brz h ASP 29 CO 0.00 0.09 0.00 0.29 -3.12 0.00 0.00 179.24 176.50 1brz n LYS 30 N -5.09 2.34 -2.83 3.56 5.02 -1.22 -4.96 118.16 114.99 1brz n LYS 30 Ca -0.09 -2.11 -0.09 0.00 -2.02 0.00 0.00 58.31 54.00 1brz n LYS 30 Cb 0.27 -1.47 0.04 0.00 -0.02 0.00 0.00 35.03 33.84 1brz n LYS 30 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1brz n HIS 31 N 1.37 -1.18 -0.15 2.13 8.25 -1.19 -5.05 115.22 119.40 1brz n HIS 31 Ca 0.17 0.46 0.00 0.00 -0.26 0.00 0.00 57.72 58.08 1brz n HIS 31 Cb 0.58 -3.18 0.00 0.00 1.12 0.00 0.00 29.99 28.51 1brz n HIS 31 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1brz n ALA 32 N -3.03 0.00 0.00 -1.41 0.00 0.01 -4.90 120.51 111.18 1brz n ALA 32 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1brz n ALA 32 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1brz n ALA 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1brz n ARG 33 N 0.00 0.00 -3.55 0.00 5.12 0.57 -4.73 116.66 114.07 1brz n ARG 33 Ca 0.00 0.00 -0.03 0.00 -1.93 0.00 0.00 57.85 55.89 1brz n ARG 33 Cb 0.00 -0.44 -0.05 0.00 -1.16 0.00 0.00 32.46 30.81 1brz n ARG 33 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1brz s SER 34 N -1.29 -0.88 -0.99 0.55 1.04 -0.30 -4.81 113.70 107.02 1brz s SER 34 Ca 0.00 1.23 -0.02 0.00 0.48 0.00 0.00 55.95 57.64 1brz s SER 34 Cb 0.00 1.97 0.29 0.00 0.10 0.00 0.00 66.02 68.38 1brz s SER 34 CO 0.00 -0.23 1.26 0.61 0.98 0.00 0.00 173.24 175.85 1brz n GLY 35 N 5.43 4.93 3.70 7.32 0.00 -1.24 -0.61 105.19 124.72 1brz n GLY 35 Ca -0.09 -2.68 -0.30 0.00 0.00 0.00 0.00 46.02 42.95 1brz n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1brz s GLU 36 N -2.48 -0.90 -0.08 1.61 2.02 0.56 -0.91 118.70 118.51 1brz s GLU 36 Ca 0.32 -0.30 -0.11 0.00 0.02 0.00 0.00 54.97 54.91 1brz s GLU 36 Cb 0.04 -1.66 0.03 0.00 0.10 0.00 0.00 34.13 32.64 1brz s GLU 36 CO 0.05 -3.45 0.29 0.00 0.02 0.00 0.00 175.26 172.16 1brz s PHE 38 N -0.22 -0.27 -0.07 0.00 0.08 -0.26 -4.95 117.98 112.27 1brz s PHE 38 Ca -0.03 0.62 -0.31 0.00 0.12 0.00 0.00 56.93 57.33 1brz s PHE 38 Cb -0.03 0.10 0.12 0.00 -0.57 0.00 0.00 43.02 42.64 1brz s PHE 38 CO 0.01 -0.24 0.99 1.52 -0.10 0.00 0.00 175.22 177.41 1brz s TYR 39 N -0.35 -0.28 0.00 0.36 1.13 -1.26 -1.43 117.35 115.51 1brz s TYR 39 Ca -0.05 0.21 0.00 0.00 -1.41 0.00 0.00 57.07 55.82 1brz s TYR 39 Cb -0.03 0.52 0.00 0.00 -1.10 0.00 0.00 41.96 41.35 1brz s TYR 39 CO 0.02 -0.43 0.00 -0.40 -2.51 0.00 0.00 175.55 172.23 1brz n ASP 40 N -0.11 0.00 0.00 -0.18 5.68 -1.26 -5.02 116.55 115.67 1brz n ASP 40 Ca -0.06 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.23 1brz n ASP 40 Cb 0.60 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.58 1brz n ASP 40 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1brz n GLU 41 N -1.00 0.00 -0.10 0.11 0.00 -1.26 -4.89 120.64 113.50 1brz n GLU 41 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.28 1brz n GLU 41 Cb 0.00 0.00 0.21 0.00 0.00 0.00 0.00 31.44 31.65 1brz n GLU 41 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1brz n LYS 42 N 0.00 2.31 -1.07 5.31 4.01 -1.26 -4.92 118.16 122.54 1brz n LYS 42 Ca 0.00 -1.95 0.00 0.00 -0.51 0.00 0.00 58.31 55.85 1brz n LYS 42 Cb 0.33 -1.48 0.00 0.00 -0.51 0.00 0.00 35.03 33.37 1brz n LYS 42 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1brz n ARG 43 N 1.23 0.00 -2.85 1.97 0.63 -1.26 -4.97 116.66 111.42 1brz n ARG 43 Ca 0.17 0.43 -0.43 0.00 -0.92 0.00 0.00 57.85 57.10 1brz n ARG 43 Cb 0.56 -3.81 0.00 0.00 0.45 0.00 0.00 32.46 29.66 1brz n ARG 43 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1brz n ASN 44 N 1.93 5.54 -4.85 6.15 3.02 -1.26 -4.99 115.26 120.81 1brz n ASN 44 Ca 0.00 -3.14 -0.37 0.00 -0.03 0.00 0.00 54.58 51.04 1brz n ASN 44 Cb 0.05 -1.43 -0.06 0.00 -0.61 0.00 0.00 39.78 37.73 1brz n ASN 44 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1brz s LEU 45 N -0.60 4.40 -0.01 3.41 2.96 -1.26 -4.26 118.68 123.32 1brz s LEU 45 Ca 0.37 0.61 -0.03 0.00 -0.22 0.00 0.00 54.13 54.86 1brz s LEU 45 Cb 0.02 -2.24 -0.00 0.00 0.50 0.00 0.00 46.19 44.46 1brz s LEU 45 CO 0.01 0.36 0.05 -1.10 -1.32 0.00 0.00 176.35 174.36 1brz s GLN 46 N -0.91 0.23 -0.42 1.98 -0.21 -0.52 -4.97 119.66 114.84 1brz s GLN 46 Ca 0.17 -0.21 -0.17 0.00 0.02 0.00 0.00 55.36 55.17 1brz s GLN 46 Cb -0.13 0.09 0.02 0.00 1.00 0.00 0.00 33.01 33.99 1brz s GLN 46 CO 0.07 -0.04 0.41 0.00 -2.12 0.00 0.00 175.29 173.60 1brz s ILE 48 N 2.04 4.68 -0.43 0.00 -1.09 0.56 0.37 121.20 127.33 1brz s ILE 48 Ca 0.11 0.68 -0.10 0.00 -2.23 0.00 0.00 60.65 59.10 1brz s ILE 48 Cb -0.17 -4.27 0.08 0.00 -1.58 0.00 0.00 42.46 36.51 1brz s ILE 48 CO 0.13 -0.58 0.29 0.00 -1.23 0.00 0.00 174.94 173.54 1brz s ASP 50 N 2.24 6.56 -0.10 0.00 -1.08 0.22 -1.56 116.67 122.95 1brz s ASP 50 Ca 0.03 0.66 0.18 0.00 -0.52 0.00 0.00 52.55 52.91 1brz s ASP 50 Cb -0.24 -2.18 -0.27 0.00 -1.46 0.00 0.00 42.92 38.78 1brz s ASP 50 CO 0.02 0.26 0.27 -1.22 0.52 0.00 0.00 175.17 175.02 1brz n TYR 51 N 2.54 0.00 0.00 -5.34 4.02 -0.30 0.21 117.16 118.29 1brz n TYR 51 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.74 1brz n TYR 51 Cb 0.53 -0.66 0.00 0.00 -0.02 0.00 0.00 39.34 39.19 1brz n TYR 51 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1brz n GLU 53 N -0.70 0.00 0.00 0.00 -0.00 -1.26 -5.02 120.64 113.66 1brz n GLU 53 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.16 1brz n GLU 53 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.44 1brz n GLU 53 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79