#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1den n PRO 2 N 0.00 0.57 -2.38 2.61 -0.04 -1.26 -4.59 135.00 129.92 1den n PRO 2 Ca 0.00 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.09 1den n PRO 2 Cb 0.00 -1.10 -0.03 0.00 -0.04 0.00 0.00 33.50 32.33 1den n PRO 2 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1den s LEU 3 N -1.20 3.48 0.39 1.53 0.20 -1.01 -4.44 118.68 117.62 1den s LEU 3 Ca 0.06 -1.82 -0.17 0.00 0.69 0.00 0.00 54.13 52.89 1den s LEU 3 Cb 0.03 -2.58 -0.09 0.00 -0.43 0.00 0.00 46.19 43.11 1den s LEU 3 CO 0.04 -1.94 0.84 0.00 -0.29 0.00 0.00 176.35 175.00 1den s ARG 4 N 5.32 4.05 0.59 1.98 1.70 -1.26 -5.01 118.95 126.32 1den s ARG 4 Ca 0.58 0.83 0.37 0.00 -0.47 0.00 0.00 55.73 57.05 1den s ARG 4 Cb 0.01 -2.31 1.71 0.00 -0.57 0.00 0.00 34.95 33.78 1den s ARG 4 CO 0.05 0.03 2.11 1.57 -1.08 0.00 0.00 175.30 177.97 1den h LYS 5 N 1.89 0.00 0.00 3.89 2.10 -1.99 -2.71 116.57 119.74 1den h LYS 5 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1den h LYS 5 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1den h LYS 5 CO 0.63 0.00 0.00 1.47 -2.00 0.00 0.00 179.45 179.56 1den n LEU 6 N -3.09 0.27 0.06 7.07 -0.00 -1.26 -2.25 117.00 117.79 1den n LEU 6 Ca -0.01 0.57 -0.07 0.00 -0.00 0.00 0.00 56.01 56.50 1den n LEU 6 Cb 0.23 -0.54 0.08 0.00 -0.00 0.00 0.00 43.42 43.19 1den n LEU 6 CO 0.25 -0.39 0.44 0.00 -0.00 0.00 0.00 177.39 177.69 1den h ILE 8 N 0.26 0.53 0.00 0.00 2.04 -1.66 -3.29 117.51 115.39 1den h ILE 8 Ca -0.01 -1.71 -0.03 0.00 1.00 0.00 0.00 64.86 64.11 1den h ILE 8 Cb 1.16 2.23 -0.00 0.00 -0.74 0.00 0.00 36.82 39.47 1den h ILE 8 CO 0.10 0.30 -0.15 -0.07 0.00 0.00 0.00 178.15 178.33 1den h LEU 9 N 0.00 0.00 -0.33 1.44 3.38 -1.54 -3.49 115.31 114.77 1den h LEU 9 Ca -0.00 0.00 0.29 0.00 0.09 0.00 0.00 57.88 58.26 1den h LEU 9 Cb 1.21 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.85 1den h LEU 9 CO 0.04 0.15 -0.67 1.41 0.09 0.00 0.00 178.44 179.45 1den n HIS 10 N -3.39 -2.93 -1.58 1.13 8.25 -1.24 -4.91 115.22 110.56 1den n HIS 10 Ca -0.00 1.53 -0.38 0.00 -0.26 0.00 0.00 57.72 58.60 1den n HIS 10 Cb 0.34 -2.66 0.04 0.00 1.12 0.00 0.00 29.99 28.83 1den n HIS 10 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1den n ARG 11 N -3.87 0.87 -3.21 -0.41 0.00 -1.26 -4.42 116.66 104.36 1den n ARG 11 Ca -0.03 0.33 -0.25 0.00 -0.00 0.00 0.00 57.85 57.90 1den n ARG 11 Cb 0.53 -2.03 -0.06 0.00 -0.00 0.00 0.00 32.46 30.90 1den n ARG 11 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1den n ASN 12 N -0.23 2.95 -4.41 2.89 6.94 -1.26 -4.94 115.26 117.20 1den n ASN 12 Ca 0.12 -3.32 -0.42 0.00 -0.02 0.00 0.00 54.58 50.95 1den n ASN 12 Cb 0.46 -0.63 -0.01 0.00 -2.36 0.00 0.00 39.78 37.25 1den n ASN 12 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 1den n PRO 13 N 0.57 2.96 -0.48 -0.53 -0.04 -1.26 -4.05 135.00 132.16 1den n PRO 13 Ca 0.28 -3.06 -0.28 0.00 -0.04 0.00 0.00 63.50 60.40 1den n PRO 13 Cb 0.46 -3.47 0.27 0.00 -0.04 0.00 0.00 33.50 30.71 1den n PRO 13 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1den s GLY 14 N 4.27 1.51 -0.32 0.55 0.00 -0.80 -4.62 107.32 107.91 1den s GLY 14 Ca 0.54 -0.27 0.00 0.00 0.00 0.00 0.00 44.72 45.00 1den s GLY 14 CO 0.06 0.52 1.80 0.54 0.00 0.00 0.00 173.10 176.02 1den n ARG 15 N -5.12 1.83 -0.03 2.90 1.74 -1.26 -4.22 116.66 112.50 1den n ARG 15 Ca 0.04 -1.74 0.05 0.00 -0.77 0.00 0.00 57.85 55.43 1den n ARG 15 Cb 0.55 -1.68 -0.16 0.00 -1.02 0.00 0.00 32.46 30.15 1den n ARG 15 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1den n TYR 17 N -2.43 -2.63 -2.95 0.00 4.01 -1.24 -4.83 117.16 107.09 1den n TYR 17 Ca -0.12 1.42 0.00 0.00 -0.16 0.00 0.00 57.90 59.04 1den n TYR 17 Cb 0.74 -3.00 0.00 0.00 -0.31 0.00 0.00 39.34 36.77 1den n TYR 17 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1den n GLN 18 N 0.82 0.00 -3.64 -0.72 -0.06 -1.26 -4.66 117.38 107.86 1den n GLN 18 Ca -0.17 0.00 -0.09 0.00 -2.00 0.00 0.00 57.00 54.74 1den n GLN 18 Cb 0.26 0.00 -0.07 0.00 -4.06 0.00 0.00 30.24 26.37 1den n GLN 18 CO 0.00 0.00 0.00 0.21 -0.20 0.00 0.00 177.06 177.07 1den s LYS 19 N -0.82 0.74 -0.47 3.69 2.20 -1.26 -4.04 119.74 119.78 1den s LYS 19 Ca 0.00 1.16 0.06 0.00 -0.36 0.00 0.00 55.97 56.83 1den s LYS 19 Cb 0.00 0.20 0.19 0.00 -1.51 0.00 0.00 37.83 36.72 1den s LYS 19 CO 0.00 -0.14 0.60 -0.89 -0.36 0.00 0.00 175.35 174.56 1den n ILE 20 N 3.91 -0.49 -2.15 5.43 2.08 -1.26 -4.95 119.36 121.93 1den n ILE 20 Ca -0.19 -2.16 -0.41 0.00 0.56 0.00 0.00 62.75 60.55 1den n ILE 20 Cb 0.58 -0.12 -0.03 0.00 -0.75 0.00 0.00 39.64 39.32 1den n ILE 20 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1den s PRO 21 N 0.39 4.36 0.00 0.38 0.04 -1.26 -3.07 135.00 135.83 1den s PRO 21 Ca 0.32 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.50 1den s PRO 21 Cb 0.06 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.44 1den s PRO 21 CO -0.13 -0.27 0.00 0.00 0.04 0.00 0.00 177.00 176.63 1den n ALA 22 N 2.24 0.00 -2.30 8.56 0.00 -0.54 -4.94 120.51 123.52 1den n ALA 22 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.38 1den n ALA 22 Cb 0.42 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.77 1den n ALA 22 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1den s PHE 23 N -0.75 0.88 -0.01 0.00 0.40 0.67 -0.84 117.98 118.32 1den s PHE 23 Ca 0.00 -0.83 0.02 0.00 -0.60 0.00 0.00 56.93 55.53 1den s PHE 23 Cb 0.00 -0.51 -0.01 0.00 0.51 0.00 0.00 43.02 43.02 1den s PHE 23 CO 0.00 -0.12 -0.08 1.52 0.70 0.00 0.00 175.22 177.24 1den s TYR 24 N -3.19 0.71 -0.36 0.36 1.13 0.51 -2.66 117.35 113.84 1den s TYR 24 Ca 0.08 -0.13 -0.29 0.00 -1.41 0.00 0.00 57.07 55.32 1den s TYR 24 Cb 0.02 -0.46 0.02 0.00 -1.10 0.00 0.00 41.96 40.44 1den s TYR 24 CO -0.03 -0.01 1.15 -0.47 -2.51 0.00 0.00 175.55 173.68 1den s TYR 25 N -0.18 2.93 -0.60 -3.49 5.04 -1.26 -1.15 117.35 118.63 1den s TYR 25 Ca 0.03 0.98 -0.28 0.00 -2.44 0.00 0.00 57.07 55.36 1den s TYR 25 Cb -0.03 -3.97 0.03 0.00 0.35 0.00 0.00 41.96 38.34 1den s TYR 25 CO -0.00 -1.15 1.26 -0.80 -1.34 0.00 0.00 175.55 173.52 1den s ASN 26 N 2.20 6.32 -0.18 4.32 -0.87 -0.52 -4.88 114.94 121.34 1den s ASN 26 Ca 0.49 0.05 -0.03 0.00 -1.57 0.00 0.00 52.86 51.80 1den s ASN 26 Cb -0.12 -2.55 -0.04 0.00 -0.02 0.00 0.00 41.25 38.52 1den s ASN 26 CO 0.22 -1.60 2.78 0.00 -2.57 0.00 0.00 177.10 175.93 1den n GLN 27 N 8.66 1.86 0.00 -0.60 6.02 -1.26 -2.41 117.38 129.65 1den n GLN 27 Ca 0.08 -1.24 0.00 0.00 -0.01 0.00 0.00 57.00 55.83 1den n GLN 27 Cb 0.49 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 29.99 1den n GLN 27 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1den n LYS 28 N 1.48 0.00 0.00 -1.09 4.01 -1.26 -5.01 118.16 116.29 1den n LYS 28 Ca 0.33 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.13 1den n LYS 28 Cb 0.68 -0.74 0.00 0.00 -0.51 0.00 0.00 35.03 34.46 1den n LYS 28 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1den n LYS 29 N -1.99 0.00 0.00 1.97 4.81 -1.01 -5.10 118.16 116.83 1den n LYS 29 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1den n LYS 29 Cb 0.24 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.29 1den n LYS 29 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1den n LYS 30 N 0.00 0.00 -3.77 1.64 2.85 -1.12 -5.04 118.16 112.72 1den n LYS 30 Ca 0.00 0.00 -0.05 0.00 -1.05 0.00 0.00 58.31 57.21 1den n LYS 30 Cb 0.00 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.36 1den n LYS 30 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 1den s GLN 31 N 0.00 1.39 -0.22 -1.58 0.74 -1.26 -5.02 119.66 113.71 1den s GLN 31 Ca 0.00 -0.75 -0.22 0.00 0.05 0.00 0.00 55.36 54.44 1den s GLN 31 Cb 0.00 0.48 -0.02 0.00 1.10 0.00 0.00 33.01 34.57 1den s GLN 31 CO 0.00 -0.63 0.68 0.00 -0.55 0.00 0.00 175.29 174.79 1den s GLU 33 N 2.29 3.15 0.27 0.00 2.56 -0.30 -4.83 118.70 121.84 1den s GLU 33 Ca 0.30 -0.86 -0.14 0.00 0.00 0.00 0.00 54.97 54.27 1den s GLU 33 Cb -0.16 -2.77 -0.08 0.00 2.00 0.00 0.00 34.13 33.12 1den s GLU 33 CO 0.09 0.03 0.68 0.20 -0.56 0.00 0.00 175.26 175.70 1den s GLY 34 N -4.16 2.38 -0.00 -1.50 0.00 -1.26 -0.36 107.32 102.41 1den s GLY 34 Ca 0.44 -0.02 -0.04 0.00 0.00 0.00 0.00 44.72 45.10 1den s GLY 34 CO 0.32 0.20 0.08 -0.11 0.00 0.00 0.00 173.10 173.60 1den s PHE 35 N -1.83 0.07 -0.37 1.90 -0.71 -0.02 -4.78 117.98 112.23 1den s PHE 35 Ca 0.49 -0.15 -0.11 0.00 -1.04 0.00 0.00 56.93 56.13 1den s PHE 35 Cb -0.12 -0.07 0.02 0.00 -1.21 0.00 0.00 43.02 41.65 1den s PHE 35 CO 0.19 -0.21 0.21 0.99 -1.34 0.00 0.00 175.22 175.06 1den s THR 36 N -1.07 4.63 0.98 -4.49 2.01 -1.26 -1.47 115.64 114.98 1den s THR 36 Ca -0.12 -0.79 -0.11 0.00 0.31 0.00 0.00 61.69 60.98 1den s THR 36 Cb -0.07 -3.56 0.18 0.00 0.01 0.00 0.00 72.50 69.07 1den s THR 36 CO 0.01 -0.20 1.09 0.86 -0.69 0.00 0.00 174.62 175.68 1den s TRP 37 N 1.57 1.77 -0.44 4.92 -0.00 -1.17 -4.80 118.94 120.78 1den s TRP 37 Ca 0.03 1.45 0.06 0.00 -0.00 0.00 0.00 56.10 57.63 1den s TRP 37 Cb -0.19 -3.20 0.20 0.00 -0.00 0.00 0.00 33.47 30.29 1den s TRP 37 CO 0.07 -2.99 0.54 0.43 -0.00 0.00 0.00 176.95 175.00 1den n SER 38 N -4.33 -1.26 -0.97 5.86 7.64 -1.26 -4.06 113.62 115.25 1den n SER 38 Ca 0.08 -2.70 0.01 0.00 1.01 0.00 0.00 58.87 57.27 1den n SER 38 Cb 0.54 0.22 -0.00 0.00 -1.01 0.00 0.00 64.21 63.96 1den n SER 38 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1den n GLY 39 N 2.32 -0.91 3.54 0.23 0.00 -1.26 -1.90 105.19 107.21 1den n GLY 39 Ca 0.22 -0.95 -0.16 0.00 0.00 0.00 0.00 46.02 45.14 1den n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1den n GLY 41 N 6.45 0.11 0.00 0.00 0.00 -1.26 -4.51 105.19 105.99 1den n GLY 41 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.55 1den n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1den n GLY 42 N 2.43 -1.91 0.00 -0.02 0.00 -1.26 -4.92 105.19 99.51 1den n GLY 42 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.65 1den n GLY 42 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1den n ASN 43 N 0.00 -0.10 0.00 1.61 5.03 -1.26 -5.09 115.26 115.45 1den n ASN 43 Ca 0.00 -0.09 0.00 0.00 0.87 0.00 0.00 54.58 55.36 1den n ASN 43 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1den n ASN 43 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1den n SER 44 N -0.42 0.00 -2.39 6.41 7.64 -1.26 -4.84 113.62 118.76 1den n SER 44 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 1den n SER 44 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1den n SER 44 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1den n ASN 45 N 0.00 -3.17 -4.45 6.43 2.85 -1.24 -4.45 115.26 111.23 1den n ASN 45 Ca 0.00 0.27 -0.44 0.00 -0.11 0.00 0.00 54.58 54.30 1den n ASN 45 Cb 0.00 -2.75 -0.05 0.00 1.24 0.00 0.00 39.78 38.22 1den n ASN 45 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 1den s ARG 46 N -4.90 3.16 -0.11 1.20 3.52 -1.26 -4.23 118.95 116.32 1den s ARG 46 Ca 0.00 -0.80 0.02 0.00 -0.13 0.00 0.00 55.73 54.82 1den s ARG 46 Cb 0.00 -4.13 0.01 0.00 -1.56 0.00 0.00 34.95 29.27 1den s ARG 46 CO 0.00 -1.42 -0.16 -0.06 -0.81 0.00 0.00 175.30 172.85 1den s PHE 47 N 3.17 2.02 0.03 5.12 0.08 -1.09 -4.97 117.98 122.34 1den s PHE 47 Ca 0.19 -0.94 -0.22 0.00 0.12 0.00 0.00 56.93 56.08 1den s PHE 47 Cb -0.18 -1.44 -0.15 0.00 -0.57 0.00 0.00 43.02 40.67 1den s PHE 47 CO 0.12 -0.47 1.40 0.87 -0.10 0.00 0.00 175.22 177.04 1den h LYS 48 N 7.36 0.20 -6.00 0.44 1.57 -1.93 0.19 116.57 118.40 1den h LYS 48 Ca -0.31 -0.08 -0.56 0.00 -1.87 0.00 0.00 60.65 57.83 1den h LYS 48 Cb 1.18 -0.01 -0.14 0.00 0.08 0.00 0.00 32.23 33.34 1den h LYS 48 CO 0.49 0.52 -0.75 0.95 -0.57 0.00 0.00 179.45 180.10 1den s THR 49 N -4.67 2.25 0.33 -0.16 -4.23 -1.26 -4.68 115.64 103.22 1den s THR 49 Ca -0.15 -2.34 0.18 0.00 -1.18 0.00 0.00 61.69 58.20 1den s THR 49 Cb 0.04 -2.25 0.15 0.00 1.34 0.00 0.00 72.50 71.78 1den s THR 49 CO 0.71 -0.44 1.87 0.40 -0.54 0.00 0.00 174.62 176.62 1den h ILE 50 N 2.33 1.00 0.21 2.99 2.04 -1.89 -2.20 117.51 122.00 1den h ILE 50 Ca -0.40 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 64.31 1den h ILE 50 Cb 1.25 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 38.99 1den h ILE 50 CO 0.61 0.30 -0.10 -0.33 0.00 0.00 0.00 178.15 178.63 1den h GLU 51 N 0.00 -0.28 -0.87 2.37 5.08 -1.96 -1.69 114.58 117.23 1den h GLU 51 Ca -0.00 0.02 0.20 0.00 -1.00 0.00 0.00 59.36 58.58 1den h GLU 51 Cb 0.63 0.06 -0.12 0.00 0.50 0.00 0.00 28.75 29.83 1den h GLU 51 CO 0.04 0.09 0.37 0.93 -1.00 0.00 0.00 179.01 179.45 1den h GLU 52 N -0.91 0.41 0.42 2.33 4.39 -1.99 0.46 114.58 119.69 1den h GLU 52 Ca -0.03 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 1den h GLU 52 Cb 0.50 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1den h GLU 52 CO 0.05 0.27 -0.20 0.00 -1.16 0.00 0.00 179.01 177.97 1den h ARG 54 N -0.70 0.00 -0.75 0.00 3.08 -0.19 -1.29 114.38 114.53 1den h ARG 54 Ca -0.06 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.07 1den h ARG 54 Cb 0.50 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.51 1den h ARG 54 CO 0.09 0.32 0.49 0.00 -1.07 0.00 0.00 179.97 179.80 1den h ARG 55 N 0.00 0.72 0.00 0.04 3.08 -0.10 0.18 114.38 118.30 1den h ARG 55 Ca -0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1den h ARG 55 Cb 0.58 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1den h ARG 55 CO 0.04 0.48 -0.15 1.15 -1.07 0.00 0.00 179.97 180.42 1den h THR 56 N 0.75 0.00 0.00 2.04 2.02 -1.54 -3.25 112.91 112.93 1den h THR 56 Ca 0.33 -0.32 -0.04 0.00 0.77 0.00 0.00 66.41 67.15 1den h THR 56 Cb 0.32 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.72 1den h THR 56 CO -0.11 0.00 -0.17 0.00 0.37 0.00 0.00 175.52 175.61 1den n ILE 58 N -3.19 0.00 0.00 0.00 2.08 -0.09 -4.91 119.36 113.25 1den n ILE 58 Ca 0.02 -0.31 0.00 0.00 0.56 0.00 0.00 62.75 63.02 1den n ILE 58 Cb 0.51 0.30 0.00 0.00 -0.75 0.00 0.00 39.64 39.71 1den n ILE 58 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 1den n ARG 59 N -1.90 0.00 0.00 0.38 0.00 -0.37 -4.98 116.66 109.78 1den n ARG 59 Ca -0.02 0.00 0.16 0.00 -0.00 0.00 0.00 57.85 57.99 1den n ARG 59 Cb 0.36 0.00 0.94 0.00 0.00 0.00 0.00 32.46 33.76 1den n ARG 59 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80