#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2flg s ILE 2 N 0.00 0.08 -0.50 1.53 -5.25 -1.26 -5.12 121.20 110.67 2flg s ILE 2 Ca 0.00 -0.64 -0.15 0.00 -0.99 0.00 0.00 60.65 58.88 2flg s ILE 2 Cb 0.00 -0.59 0.10 0.00 2.95 0.00 0.00 42.46 44.93 2flg s ILE 2 CO 0.00 -0.35 0.43 -0.44 -1.79 0.00 0.00 174.94 172.79 2flg s SER 3 N -1.48 6.10 0.00 4.36 0.01 -1.26 -4.82 113.70 116.61 2flg s SER 3 Ca -0.13 -1.60 0.00 0.00 1.31 0.00 0.00 55.95 55.53 2flg s SER 3 Cb -0.06 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 64.00 2flg s SER 3 CO 0.02 -0.75 0.17 0.00 0.41 0.00 0.00 173.24 173.09 2flg n GLN 4 N 5.19 4.25 -3.59 12.44 10.64 -1.26 -5.08 117.38 139.96 2flg n GLN 4 Ca -0.13 -0.17 0.02 0.00 -1.83 0.00 0.00 57.00 54.89 2flg n GLN 4 Cb 0.42 -0.67 -0.01 0.00 -0.86 0.00 0.00 30.24 29.12 2flg n GLN 4 CO 0.00 0.00 0.00 -3.38 -1.83 0.00 0.00 177.06 171.85 2flg s HIS 5 N -0.66 -0.00 0.17 2.61 -3.43 -1.26 -5.11 115.29 107.62 2flg s HIS 5 Ca 0.00 -0.00 -0.03 0.00 -0.80 0.00 0.00 55.06 54.23 2flg s HIS 5 Cb 0.00 0.50 0.01 0.00 -1.43 0.00 0.00 32.58 31.66 2flg s HIS 5 CO 0.00 -0.01 0.27 1.04 -2.00 0.00 0.00 174.74 174.04 2flg n GLN 6 N -0.30 0.39 -3.58 -0.38 6.02 -1.26 -4.60 117.38 113.66 2flg n GLN 6 Ca -0.04 -1.26 -0.36 0.00 -0.01 0.00 0.00 57.00 55.33 2flg n GLN 6 Cb 0.61 1.30 -0.08 0.00 1.02 0.00 0.00 30.24 33.08 2flg n GLN 6 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2flg n VAL 8 N 3.95 0.02 -2.11 0.00 0.24 -1.26 -4.75 118.33 114.43 2flg n VAL 8 Ca -0.13 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 2flg n VAL 8 Cb 0.52 1.34 -0.00 0.00 -1.47 0.00 0.00 33.84 34.22 2flg n VAL 8 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2flg n LYS 9 N -0.01 0.00 -3.86 7.34 4.76 -1.26 -5.08 118.16 120.05 2flg n LYS 9 Ca 0.00 -0.97 -0.17 0.00 -2.87 0.00 0.00 58.31 54.29 2flg n LYS 9 Cb 0.10 -0.15 -0.16 0.00 -1.84 0.00 0.00 35.03 32.97 2flg n LYS 9 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2flg s LYS 10 N 0.00 0.22 -0.04 1.97 2.47 -1.26 -5.13 119.74 117.97 2flg s LYS 10 Ca 0.07 0.14 -0.30 0.00 -1.56 0.00 0.00 55.97 54.32 2flg s LYS 10 Cb 0.08 -0.49 -0.03 0.00 -1.46 0.00 0.00 37.83 35.94 2flg s LYS 10 CO -0.04 -0.18 1.07 -0.65 0.16 0.00 0.00 175.35 175.72 2flg s GLN 11 N 1.25 4.44 0.04 4.03 -0.21 -1.26 -4.94 119.66 123.02 2flg s GLN 11 Ca -0.07 1.52 0.00 0.00 0.02 0.00 0.00 55.36 56.83 2flg s GLN 11 Cb -0.13 -3.50 -0.03 0.00 1.00 0.00 0.00 33.01 30.35 2flg s GLN 11 CO -0.02 -0.27 -0.04 0.00 -2.12 0.00 0.00 175.29 172.84 2flg s PRO 13 N -2.62 -0.74 0.00 0.00 0.04 -1.26 -4.97 135.00 125.46 2flg s PRO 13 Ca -0.04 0.11 0.25 0.00 0.04 0.00 0.00 61.00 61.37 2flg s PRO 13 Cb -0.02 -1.64 0.49 0.00 0.04 0.00 0.00 34.50 33.37 2flg s PRO 13 CO -0.05 -3.42 1.42 1.04 0.04 0.00 0.00 177.00 176.03 2flg n GLN 14 N -4.59 1.89 -0.32 4.56 3.00 -1.26 -3.94 117.38 116.72 2flg n GLN 14 Ca 0.10 -1.42 0.07 0.00 -0.01 0.00 0.00 57.00 55.75 2flg n GLN 14 Cb 0.59 -1.47 0.22 0.00 0.00 0.00 0.00 30.24 29.58 2flg n GLN 14 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2flg n ASN 15 N 0.68 3.50 -4.27 1.08 4.13 -1.26 -4.99 115.26 114.13 2flg n ASN 15 Ca 0.15 -2.31 -0.15 0.00 1.68 0.00 0.00 54.58 53.95 2flg n ASN 15 Cb 0.49 -0.37 -0.10 0.00 -1.54 0.00 0.00 39.78 38.25 2flg n ASN 15 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2flg s SER 16 N -1.21 1.96 -0.77 6.41 0.01 -1.25 -3.87 113.70 114.97 2flg s SER 16 Ca 0.34 -1.03 0.03 0.00 1.31 0.00 0.00 55.95 56.60 2flg s SER 16 Cb 0.21 -0.04 0.31 0.00 0.21 0.00 0.00 66.02 66.72 2flg s SER 16 CO 0.17 -0.31 1.19 0.61 0.41 0.00 0.00 173.24 175.30 2flg n GLY 17 N -0.25 5.50 3.24 3.44 0.00 0.95 -4.77 105.19 113.30 2flg n GLY 17 Ca -0.09 -2.72 -0.34 0.00 0.00 0.00 0.00 46.02 42.86 2flg n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2flg s PHE 19 N -2.22 -0.26 -0.40 0.00 -0.71 -1.22 -4.73 117.98 108.43 2flg s PHE 19 Ca 0.51 0.60 -0.28 0.00 -1.04 0.00 0.00 56.93 56.72 2flg s PHE 19 Cb -0.12 0.38 0.02 0.00 -1.21 0.00 0.00 43.02 42.09 2flg s PHE 19 CO 0.68 -0.13 1.07 0.50 -1.34 0.00 0.00 175.22 176.01 2flg s ARG 20 N 0.36 3.85 1.23 1.99 3.52 -1.24 -1.58 118.95 127.09 2flg s ARG 20 Ca 0.02 0.72 -0.17 0.00 -0.13 0.00 0.00 55.73 56.17 2flg s ARG 20 Cb -0.05 -3.83 0.26 0.00 -1.56 0.00 0.00 34.95 29.77 2flg s ARG 20 CO -0.12 -1.14 0.64 0.72 -0.81 0.00 0.00 175.30 174.59 2flg n HIS 21 N 7.30 -2.16 0.71 5.12 8.25 0.86 -4.77 115.22 130.53 2flg n HIS 21 Ca 0.11 -0.26 0.09 0.00 -0.26 0.00 0.00 57.72 57.40 2flg n HIS 21 Cb 0.48 -1.52 0.42 0.00 1.12 0.00 0.00 29.99 30.49 2flg n HIS 21 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2flg n LEU 22 N -3.95 0.00 -1.16 2.41 4.77 -1.26 -2.36 117.00 115.44 2flg n LEU 22 Ca 0.05 0.44 0.02 0.00 -0.03 0.00 0.00 56.01 56.49 2flg n LEU 22 Cb 0.55 -0.44 0.25 0.00 -2.33 0.00 0.00 43.42 41.44 2flg n LEU 22 CO 0.48 -0.16 0.77 -0.90 -1.33 0.00 0.00 177.39 176.24 2flg n ASP 23 N -1.44 3.58 -2.99 -1.43 5.68 -1.26 -4.94 116.55 113.74 2flg n ASP 23 Ca 0.06 -3.30 -0.17 0.00 -0.50 0.00 0.00 54.79 50.87 2flg n ASP 23 Cb 0.20 -0.61 0.07 0.00 -1.14 0.00 0.00 41.12 39.64 2flg n ASP 23 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2flg n GLU 24 N -0.68 -6.08 -3.89 0.11 1.02 -1.00 -5.00 120.64 105.12 2flg n GLU 24 Ca 0.29 0.68 -0.30 0.00 -0.02 0.00 0.00 57.16 57.80 2flg n GLU 24 Cb 1.03 -5.24 -0.15 0.00 -0.02 0.00 0.00 31.44 27.06 2flg n GLU 24 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2flg s ARG 25 N -5.72 1.27 0.08 3.49 6.06 -1.25 -4.87 118.95 118.00 2flg s ARG 25 Ca 0.31 -1.25 -0.30 0.00 -2.50 0.00 0.00 55.73 51.98 2flg s ARG 25 Cb -0.14 -2.56 -0.05 0.00 0.06 0.00 0.00 34.95 32.26 2flg s ARG 25 CO 0.59 -0.82 1.10 -1.21 -2.50 0.00 0.00 175.30 172.46 2flg s GLU 26 N 1.34 4.53 -0.39 5.12 2.02 -1.26 -0.10 118.70 129.96 2flg s GLU 26 Ca 0.04 1.64 0.02 0.00 0.02 0.00 0.00 54.97 56.69 2flg s GLU 26 Cb -0.18 -3.36 0.11 0.00 0.10 0.00 0.00 34.13 30.80 2flg s GLU 26 CO -0.13 -0.08 0.14 -2.00 0.02 0.00 0.00 175.26 173.22 2flg s GLU 27 N 0.58 1.30 -1.14 1.61 -6.30 -0.61 -4.93 118.70 109.21 2flg s GLU 27 Ca 0.54 -1.81 -0.21 0.00 -2.50 0.00 0.00 54.97 50.98 2flg s GLU 27 Cb -0.27 -2.68 -0.06 0.00 0.00 0.00 0.00 34.13 31.12 2flg s GLU 27 CO 0.30 -1.04 1.91 0.00 0.02 0.00 0.00 175.26 176.46 2flg s LYS 29 N 5.41 3.44 0.58 0.00 -2.85 -1.26 -4.83 119.74 120.22 2flg s LYS 29 Ca 0.61 -0.36 -0.21 0.00 -1.00 0.00 0.00 55.97 55.01 2flg s LYS 29 Cb 0.05 -3.08 -0.04 0.00 -2.06 0.00 0.00 37.83 32.70 2flg s LYS 29 CO 0.10 0.65 1.35 0.00 0.10 0.00 0.00 175.35 177.55 2flg n LEU 31 N -1.28 0.00 0.00 0.00 4.77 -1.25 -4.56 117.00 114.68 2flg n LEU 31 Ca 0.12 -0.70 0.12 0.00 -0.03 0.00 0.00 56.01 55.52 2flg n LEU 31 Cb 0.46 -0.90 0.62 0.00 -2.33 0.00 0.00 43.42 41.27 2flg n LEU 31 CO 0.51 -2.69 0.90 0.18 -1.33 0.00 0.00 177.39 174.97 2flg n LEU 32 N 0.00 0.00 -1.44 2.23 4.32 -1.26 -2.86 117.00 117.98 2flg n LEU 32 Ca 0.11 0.28 -0.08 0.00 -0.02 0.00 0.00 56.01 56.30 2flg n LEU 32 Cb 0.48 -0.28 0.20 0.00 -1.62 0.00 0.00 43.42 42.20 2flg n LEU 32 CO 0.32 -0.05 0.85 0.59 -1.22 0.00 0.00 177.39 177.87 2flg n ASN 33 N -1.28 2.96 -3.76 -1.43 3.02 -1.26 -4.91 115.26 108.59 2flg n ASN 33 Ca 0.12 -3.67 -0.24 0.00 -0.03 0.00 0.00 54.58 50.75 2flg n ASN 33 Cb 0.19 -0.69 -0.17 0.00 -0.61 0.00 0.00 39.78 38.51 2flg n ASN 33 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2flg s TYR 34 N -3.23 0.74 -0.53 3.10 1.51 -1.14 -2.93 117.35 114.87 2flg s TYR 34 Ca 0.48 -0.34 -0.09 0.00 -1.01 0.00 0.00 57.07 56.11 2flg s TYR 34 Cb 0.42 -0.86 0.14 0.00 -0.11 0.00 0.00 41.96 41.55 2flg s TYR 34 CO 0.03 -0.40 0.41 -1.59 -1.11 0.00 0.00 175.55 172.90 2flg s LYS 35 N 1.95 2.64 -0.22 -0.62 -2.85 -1.15 -4.80 119.74 114.68 2flg s LYS 35 Ca 0.04 -1.92 -0.39 0.00 -1.00 0.00 0.00 55.97 52.69 2flg s LYS 35 Cb -0.13 -3.99 -0.15 0.00 -2.06 0.00 0.00 37.83 31.50 2flg s LYS 35 CO -0.06 -1.21 1.73 0.94 0.10 0.00 0.00 175.35 176.84 2flg n GLN 36 N 4.67 1.30 -0.03 1.78 7.27 -1.26 -4.59 117.38 126.52 2flg n GLN 36 Ca -0.04 0.48 -0.01 0.00 0.07 0.00 0.00 57.00 57.50 2flg n GLN 36 Cb 0.41 -2.18 -0.07 0.00 2.41 0.00 0.00 30.24 30.82 2flg n GLN 36 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 2flg n GLU 37 N 5.29 1.73 0.00 3.69 2.13 -1.26 -5.05 120.64 127.17 2flg n GLU 37 Ca 0.25 -0.03 0.00 0.00 0.66 0.00 0.00 57.16 58.04 2flg n GLU 37 Cb 0.16 -1.21 0.00 0.00 0.27 0.00 0.00 31.44 30.66 2flg n GLU 37 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2flg n GLY 38 N 2.30 2.87 2.38 8.31 0.00 -1.26 -5.04 105.19 114.75 2flg n GLY 38 Ca -0.09 -0.38 -0.21 0.00 0.00 0.00 0.00 46.02 45.33 2flg n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2flg n ASP 39 N 0.00 4.10 -3.60 1.61 9.92 -1.26 -5.05 116.55 122.28 2flg n ASP 39 Ca 0.00 -3.46 0.01 0.00 -0.53 0.00 0.00 54.79 50.81 2flg n ASP 39 Cb 0.00 -0.43 -0.01 0.00 -0.64 0.00 0.00 41.12 40.04 2flg n ASP 39 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 2flg s LYS 40 N -3.53 0.15 0.27 -1.24 -2.85 -1.26 -5.15 119.74 106.13 2flg s LYS 40 Ca 0.45 -0.08 -0.28 0.00 -1.00 0.00 0.00 55.97 55.05 2flg s LYS 40 Cb 0.40 0.06 -0.09 0.00 -2.06 0.00 0.00 37.83 36.14 2flg s LYS 40 CO -0.07 -0.07 0.94 0.00 0.10 0.00 0.00 175.35 176.25 2flg s VAL 42 N -1.34 0.46 -1.06 0.00 -7.23 -1.26 -5.05 120.40 104.92 2flg s VAL 42 Ca 0.44 -0.22 -0.24 0.00 -1.81 0.00 0.00 61.98 60.15 2flg s VAL 42 Cb -0.23 -0.79 -0.09 0.00 0.56 0.00 0.00 36.38 35.83 2flg s VAL 42 CO 0.29 0.03 1.97 -1.83 -0.31 0.00 0.00 175.10 175.25 2flg s GLU 43 N 1.91 2.37 -0.54 4.82 -1.05 -1.26 -2.95 118.70 122.00 2flg s GLU 43 Ca 0.02 -0.74 -0.19 0.00 -0.15 0.00 0.00 54.97 53.91 2flg s GLU 43 Cb -0.15 -5.14 0.03 0.00 -0.44 0.00 0.00 34.13 28.43 2flg s GLU 43 CO -0.07 -3.92 0.64 -1.71 0.95 0.00 0.00 175.26 171.15 2flg n ASN 44 N 14.85 -6.60 -0.11 0.83 4.05 -1.15 -4.91 115.26 122.21 2flg n ASN 44 Ca 0.43 -0.03 -0.13 0.00 0.45 0.00 0.00 54.58 55.30 2flg n ASN 44 Cb 0.47 -3.51 -0.03 0.00 1.23 0.00 0.00 39.78 37.93 2flg n ASN 44 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2flg h PRO 45 N 1.45 0.83 -4.31 1.20 0.13 -1.91 -3.46 132.00 125.94 2flg h PRO 45 Ca -0.30 -0.44 -0.14 0.00 -0.87 0.00 0.00 66.00 64.26 2flg h PRO 45 Cb 1.21 0.02 -0.15 0.00 0.13 0.00 0.00 31.00 32.20 2flg h PRO 45 CO 0.25 1.07 -0.68 -0.80 -0.23 0.00 0.00 178.00 177.62 2flg s ASN 46 N -6.70 0.54 0.46 1.44 0.01 -1.26 -5.04 114.94 104.40 2flg s ASN 46 Ca -0.12 -1.02 0.31 0.00 -0.71 0.00 0.00 52.86 51.32 2flg s ASN 46 Cb 0.10 0.20 1.28 0.00 0.41 0.00 0.00 41.25 43.24 2flg s ASN 46 CO 0.86 -0.60 1.91 1.55 -1.51 0.00 0.00 177.10 179.30 2flg h PRO 47 N 3.10 0.00 -0.01 -0.60 0.13 -2.03 -3.52 132.00 129.07 2flg h PRO 47 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2flg h PRO 47 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2flg h PRO 47 CO 0.65 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.67