#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 1.23 -2.17 2.61 -0.02 -1.26 -4.04 135.00 131.35 1den n PRO 2 Ca 0.00 0.44 -0.01 0.00 -2.02 0.00 0.00 63.50 61.92 1den n PRO 2 Cb 0.00 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1den n PRO 2 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1den n LEU 3 N 0.44 -4.21 0.00 2.45 0.00 0.11 -4.69 117.00 111.10 1den n LEU 3 Ca 0.10 0.02 -0.27 0.00 0.00 0.00 0.00 56.01 55.86 1den n LEU 3 Cb 0.40 -2.03 0.17 0.00 0.00 0.00 0.00 43.42 41.96 1den n LEU 3 CO 0.56 -0.59 0.75 0.54 0.00 0.00 0.00 177.39 178.64 1den n ARG 4 N -1.18 -0.81 -0.11 1.96 5.12 -0.43 -4.99 116.66 116.23 1den n ARG 4 Ca 0.01 -2.34 -0.22 0.00 -1.93 0.00 0.00 57.85 53.37 1den n ARG 4 Cb 0.45 -1.08 -0.11 0.00 -1.16 0.00 0.00 32.46 30.56 1den n ARG 4 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1den n LYS 5 N -3.42 0.56 0.00 5.56 5.02 -1.26 -4.08 118.16 120.55 1den n LYS 5 Ca 0.17 0.56 0.07 0.00 -2.02 0.00 0.00 58.31 57.08 1den n LYS 5 Cb 0.58 -1.73 0.38 0.00 -0.02 0.00 0.00 35.03 34.25 1den n LYS 5 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 1den n LEU 6 N -4.42 0.00 -2.27 -0.35 -0.00 -1.26 -2.56 117.00 106.14 1den n LEU 6 Ca -0.33 0.20 -0.31 0.00 -0.00 0.00 0.00 56.01 55.57 1den n LEU 6 Cb 0.69 -0.20 0.11 0.00 -0.00 0.00 0.00 43.42 44.02 1den n LEU 6 CO 0.18 -0.11 1.39 0.00 -0.00 0.00 0.00 177.39 178.85 1den n ILE 8 N -0.92 0.00 0.00 0.00 5.41 -1.06 -4.62 119.36 118.17 1den n ILE 8 Ca 0.60 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.35 1den n ILE 8 Cb 0.94 -0.28 0.00 0.00 -0.71 0.00 0.00 39.64 39.59 1den n ILE 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1den n LEU 9 N -0.94 0.00 0.00 1.39 -0.00 -1.22 -4.70 117.00 111.53 1den n LEU 9 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1den n LEU 9 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.56 1den n LEU 9 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 177.39 178.96 1den n HIS 10 N 0.00 0.00 -1.44 1.47 -0.00 -1.26 0.31 115.22 114.30 1den n HIS 10 Ca 0.00 0.00 -0.39 0.00 0.46 0.00 0.00 57.72 57.79 1den n HIS 10 Cb 0.00 0.00 0.03 0.00 -0.12 0.00 0.00 29.99 29.90 1den n HIS 10 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1den n ARG 11 N 0.00 0.46 -3.70 1.57 5.12 -1.26 -4.28 116.66 114.57 1den n ARG 11 Ca 0.00 0.18 -0.13 0.00 -1.93 0.00 0.00 57.85 55.97 1den n ARG 11 Cb 0.00 -1.57 -0.13 0.00 -1.16 0.00 0.00 32.46 29.60 1den n ARG 11 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 1den s ASN 12 N -1.10 -0.07 0.34 0.55 0.01 -1.26 -4.79 114.94 108.61 1den s ASN 12 Ca 0.66 0.58 0.12 0.00 -0.71 0.00 0.00 52.86 53.51 1den s ASN 12 Cb -0.48 0.55 1.05 0.00 0.41 0.00 0.00 41.25 42.77 1den s ASN 12 CO 0.57 -0.19 1.59 -0.65 -1.51 0.00 0.00 177.10 176.91 1den h PRO 13 N 7.58 0.06 0.00 -0.60 0.11 -1.81 -3.22 132.00 134.12 1den h PRO 13 Ca -0.31 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1den h PRO 13 Cb 1.14 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1den h PRO 13 CO 0.28 0.04 0.00 0.41 -0.21 0.00 0.00 178.00 178.53 1den n GLY 14 N -1.36 -0.87 3.45 -0.55 0.00 -1.23 -1.44 105.19 103.19 1den n GLY 14 Ca 0.30 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 44.34 1den n GLY 14 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1den s ARG 15 N -3.45 3.14 0.00 1.61 3.00 -1.26 -4.70 118.95 117.29 1den s ARG 15 Ca 0.00 -0.84 0.00 0.00 -1.00 0.00 0.00 55.73 53.89 1den s ARG 15 Cb 0.00 -4.18 0.00 0.00 0.00 0.00 0.00 34.95 30.77 1den s ARG 15 CO 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 175.30 173.70 1den n TYR 17 N 0.00 -0.31 -2.25 0.00 4.01 -1.26 -5.00 117.16 112.35 1den n TYR 17 Ca 0.00 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.51 1den n TYR 17 Cb 0.00 0.09 0.14 0.00 -0.31 0.00 0.00 39.34 39.26 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 -1.69 -0.50 -4.06 -0.72 7.27 -1.26 -4.86 117.38 111.55 1den n GLN 18 Ca 0.00 -2.17 -0.19 0.00 0.07 0.00 0.00 57.00 54.71 1den n GLN 18 Cb 0.00 -0.85 -0.16 0.00 2.41 0.00 0.00 30.24 31.64 1den n GLN 18 CO 0.00 0.00 0.00 0.21 0.07 0.00 0.00 177.06 177.34 1den s LYS 19 N -5.13 0.64 -0.49 3.69 2.20 -1.26 -1.76 119.74 117.62 1den s LYS 19 Ca 0.62 -0.03 0.04 0.00 -0.36 0.00 0.00 55.97 56.24 1den s LYS 19 Cb -0.03 -0.72 0.17 0.00 -1.51 0.00 0.00 37.83 35.74 1den s LYS 19 CO 0.42 -0.11 0.38 0.42 -0.36 0.00 0.00 175.35 176.11 1den s ILE 20 N 1.00 1.06 0.15 5.43 -1.09 0.14 -4.80 121.20 123.08 1den s ILE 20 Ca -0.10 -3.10 -0.31 0.00 -2.23 0.00 0.00 60.65 54.90 1den s ILE 20 Cb -0.14 -1.72 -0.09 0.00 -1.58 0.00 0.00 42.46 38.93 1den s ILE 20 CO -0.01 -1.17 1.50 -2.84 -1.23 0.00 0.00 174.94 171.19 1den s PRO 21 N -0.36 4.26 0.00 2.79 0.02 -1.26 -2.75 135.00 137.70 1den s PRO 21 Ca 0.30 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.57 1den s PRO 21 Cb 0.01 -3.19 0.00 0.00 0.02 0.00 0.00 34.50 31.34 1den s PRO 21 CO -0.19 -0.54 0.00 0.00 -0.33 0.00 0.00 177.00 175.94 1den n ALA 22 N 3.95 0.00 -2.19 -1.55 0.00 -0.38 -4.91 120.51 115.42 1den n ALA 22 Ca 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.46 1den n ALA 22 Cb 0.40 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.75 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 2.00 1.03 -0.11 0.00 0.40 0.80 -0.87 117.98 121.23 1den s PHE 23 Ca 0.00 -1.22 -0.17 0.00 -0.60 0.00 0.00 56.93 54.94 1den s PHE 23 Cb 0.00 -0.57 0.04 0.00 0.51 0.00 0.00 43.02 43.00 1den s PHE 23 CO 0.00 -0.47 0.43 -0.47 0.70 0.00 0.00 175.22 175.41 1den s TYR 24 N -3.98 -0.42 -0.24 0.36 6.14 0.43 -1.85 117.35 117.79 1den s TYR 24 Ca 0.28 0.93 -0.29 0.00 0.64 0.00 0.00 57.07 58.63 1den s TYR 24 Cb 0.07 0.17 0.01 0.00 0.42 0.00 0.00 41.96 42.63 1den s TYR 24 CO 0.05 -0.32 1.09 -0.47 0.64 0.00 0.00 175.55 176.54 1den s TYR 25 N -0.36 3.21 -0.11 4.97 5.04 -1.26 -1.06 117.35 127.78 1den s TYR 25 Ca -0.05 1.33 -0.22 0.00 -2.44 0.00 0.00 57.07 55.69 1den s TYR 25 Cb -0.03 -3.40 -0.03 0.00 0.35 0.00 0.00 41.96 38.84 1den s TYR 25 CO 0.03 -0.75 0.66 -0.80 -1.34 0.00 0.00 175.55 173.35 1den s ASN 26 N 1.45 6.87 -0.41 4.32 0.01 -0.51 -4.78 114.94 121.89 1den s ASN 26 Ca 0.46 1.05 -0.03 0.00 -0.71 0.00 0.00 52.86 53.64 1den s ASN 26 Cb -0.15 -2.38 0.13 0.00 0.41 0.00 0.00 41.25 39.25 1den s ASN 26 CO 0.10 -0.16 2.50 0.00 -1.51 0.00 0.00 177.10 178.02 1den n GLN 27 N 4.18 2.21 0.00 -0.60 6.02 -1.26 -1.81 117.38 126.12 1den n GLN 27 Ca -0.02 -2.11 0.00 0.00 -0.01 0.00 0.00 57.00 54.87 1den n GLN 27 Cb 0.51 -1.97 0.00 0.00 1.02 0.00 0.00 30.24 29.80 1den n GLN 27 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1den n LYS 28 N 0.64 0.00 0.06 -1.09 3.00 -1.26 -4.86 118.16 114.65 1den n LYS 28 Ca 0.43 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.53 1den n LYS 28 Cb 0.57 -0.16 -0.15 0.00 0.00 0.00 0.00 35.03 35.29 1den n LYS 28 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 1den h LYS 29 N 0.00 0.34 -3.99 1.64 3.64 -2.01 -3.49 116.57 112.70 1den h LYS 29 Ca 0.00 -0.57 -0.11 0.00 -1.27 0.00 0.00 60.65 58.69 1den h LYS 29 Cb 0.00 0.21 0.09 0.00 -0.41 0.00 0.00 32.23 32.12 1den h LYS 29 CO 0.00 1.24 -0.37 1.63 -2.27 0.00 0.00 179.45 179.68 1den n LYS 30 N -3.53 -1.29 -3.70 1.90 5.02 -0.75 -5.05 118.16 110.76 1den n LYS 30 Ca -0.24 0.38 -0.01 0.00 -2.02 0.00 0.00 58.31 56.42 1den n LYS 30 Cb 1.07 -3.49 -0.01 0.00 -0.02 0.00 0.00 35.03 32.58 1den n LYS 30 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1den s GLN 31 N -3.77 0.77 -0.23 1.97 0.74 -1.24 -5.03 119.66 112.87 1den s GLN 31 Ca 0.17 -0.43 -0.17 0.00 0.05 0.00 0.00 55.36 54.97 1den s GLN 31 Cb -0.02 0.26 -0.03 0.00 1.10 0.00 0.00 33.01 34.31 1den s GLN 31 CO 0.32 -0.35 0.46 0.00 -0.55 0.00 0.00 175.29 175.17 1den s GLU 33 N 1.83 3.32 0.16 0.00 2.56 -0.22 -4.87 118.70 121.48 1den s GLU 33 Ca 0.20 -0.71 -0.27 0.00 0.00 0.00 0.00 54.97 54.19 1den s GLU 33 Cb -0.15 -2.79 -0.08 0.00 2.00 0.00 0.00 34.13 33.11 1den s GLU 33 CO 0.09 0.20 0.85 0.20 -0.56 0.00 0.00 175.26 176.04 1den s GLY 34 N -4.07 2.97 0.04 -1.50 0.00 -1.26 -0.43 107.32 103.07 1den s GLY 34 Ca 0.40 0.46 0.02 0.00 0.00 0.00 0.00 44.72 45.60 1den s GLY 34 CO 0.32 1.09 -0.08 -0.11 0.00 0.00 0.00 173.10 174.32 1den s PHE 35 N -0.81 0.71 0.08 1.90 -0.71 -0.05 -4.80 117.98 114.30 1den s PHE 35 Ca 0.39 -0.43 -0.30 0.00 -1.04 0.00 0.00 56.93 55.56 1den s PHE 35 Cb -0.24 -0.42 -0.05 0.00 -1.21 0.00 0.00 43.02 41.10 1den s PHE 35 CO 0.28 -0.06 1.05 0.99 -1.34 0.00 0.00 175.22 176.15 1den s THR 36 N -1.16 4.35 -0.06 -4.49 2.01 -1.26 -1.25 115.64 113.78 1den s THR 36 Ca -0.07 1.82 0.01 0.00 0.31 0.00 0.00 61.69 63.76 1den s THR 36 Cb -0.09 -4.16 0.02 0.00 0.01 0.00 0.00 72.50 68.28 1den s THR 36 CO 0.00 0.21 -0.07 0.86 -0.69 0.00 0.00 174.62 174.93 1den s TRP 37 N 0.49 1.11 1.30 4.92 -0.00 -1.11 -4.60 118.94 121.06 1den s TRP 37 Ca 0.52 -0.41 -0.22 0.00 -0.00 0.00 0.00 56.10 56.00 1den s TRP 37 Cb -0.25 -0.91 0.33 0.00 -0.00 0.00 0.00 33.47 32.63 1den s TRP 37 CO 0.30 -0.28 1.05 -1.12 -0.00 0.00 0.00 176.95 176.91 1den s SER 38 N 1.02 0.03 0.37 5.86 0.01 -0.52 0.24 113.70 120.71 1den s SER 38 Ca -0.09 0.61 0.12 0.00 1.31 0.00 0.00 55.95 57.91 1den s SER 38 Cb -0.14 -0.81 0.93 0.00 0.21 0.00 0.00 66.02 66.20 1den s SER 38 CO -0.00 -4.67 1.82 1.23 0.41 0.00 0.00 173.24 172.03 1den h GLY 39 N -2.95 1.27 -2.38 3.44 0.00 -1.62 -3.39 103.07 97.44 1den h GLY 39 Ca -0.42 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 46.63 1den h GLY 39 CO 0.28 -0.02 0.05 0.00 0.00 0.00 0.00 176.54 176.85 1den n GLY 41 N -0.38 -2.29 0.00 0.00 0.00 -1.26 -4.20 105.19 97.06 1den n GLY 41 Ca -0.07 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 0.12 4.64 0.00 -0.02 0.00 -1.22 -3.55 105.19 105.16 1den n GLY 42 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.95 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 0.00 0.00 1.61 3.02 -1.26 -4.87 115.26 113.76 1den n ASN 43 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1den n ASN 43 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1den n ASN 43 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1den n SER 44 N 0.00 2.35 -1.16 6.41 7.64 -1.26 -4.80 113.62 122.81 1den n SER 44 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1den n SER 44 Cb 0.00 0.44 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 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 -0.77 2.78 -4.55 6.43 5.15 0.15 -4.74 115.26 119.71 1den n ASN 45 Ca 0.00 -1.68 -0.42 0.00 -0.60 0.00 0.00 54.58 51.88 1den n ASN 45 Cb 0.03 -0.51 -0.07 0.00 -0.53 0.00 0.00 39.78 38.70 1den n ASN 45 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1den s ARG 46 N 0.29 3.53 -0.02 1.20 3.00 -1.25 -3.79 118.95 121.91 1den s ARG 46 Ca 0.00 -0.14 0.02 0.00 -1.00 0.00 0.00 55.73 54.61 1den s ARG 46 Cb 0.00 -3.86 0.00 0.00 0.00 0.00 0.00 34.95 31.09 1den s ARG 46 CO 0.00 -0.80 -0.08 -0.06 0.00 0.00 0.00 175.30 174.35 1den s PHE 47 N 2.66 0.85 -0.07 5.12 0.08 -0.77 -4.94 117.98 120.91 1den s PHE 47 Ca 0.22 -0.19 -0.26 0.00 0.12 0.00 0.00 56.93 56.82 1den s PHE 47 Cb -0.15 -0.59 -0.23 0.00 -0.57 0.00 0.00 43.02 41.48 1den s PHE 47 CO 0.16 -0.07 1.04 0.87 -0.10 0.00 0.00 175.22 177.11 1den h LYS 48 N 6.25 0.06 -6.59 0.44 6.56 -1.94 0.23 116.57 121.59 1den h LYS 48 Ca -0.32 -0.06 -0.65 0.00 -1.06 0.00 0.00 60.65 58.56 1den h LYS 48 Cb 1.17 0.02 -0.17 0.00 -0.57 0.00 0.00 32.23 32.68 1den h LYS 48 CO 0.49 0.79 -0.79 0.95 -2.06 0.00 0.00 179.45 178.83 1den s THR 49 N -3.26 2.72 0.37 -0.16 -4.23 -1.26 -4.73 115.64 105.08 1den s THR 49 Ca -0.17 -1.80 0.19 0.00 -1.18 0.00 0.00 61.69 58.73 1den s THR 49 Cb -0.00 -2.31 0.18 0.00 1.34 0.00 0.00 72.50 71.72 1den s THR 49 CO 0.70 -0.07 1.92 0.40 -0.54 0.00 0.00 174.62 177.04 1den h ILE 50 N 3.14 0.94 0.04 2.99 2.04 -1.90 -1.94 117.51 122.82 1den h ILE 50 Ca -0.47 -0.95 -0.00 0.00 1.00 0.00 0.00 64.86 64.44 1den h ILE 50 Cb 1.20 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 1den h ILE 50 CO 0.49 0.25 -0.02 -0.33 0.00 0.00 0.00 178.15 178.54 1den h GLU 51 N 0.00 -0.05 -0.73 2.37 4.39 -1.98 -1.63 114.58 116.96 1den h GLU 51 Ca -0.00 0.00 0.15 0.00 0.34 0.00 0.00 59.36 59.85 1den h GLU 51 Cb 0.53 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.14 1den h GLU 51 CO 0.03 0.59 0.49 0.93 -1.16 0.00 0.00 179.01 179.90 1den h GLU 52 N -0.76 0.37 0.48 2.33 3.07 -1.99 0.26 114.58 118.34 1den h GLU 52 Ca -0.01 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 1den h GLU 52 Cb 0.66 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1den h GLU 52 CO 0.01 0.24 -0.23 0.00 -1.40 0.00 0.00 179.01 177.63 1den h ARG 54 N -1.16 0.00 -0.85 0.00 3.08 -0.28 0.06 114.38 115.23 1den h ARG 54 Ca -0.07 0.00 0.16 0.00 0.07 0.00 0.00 59.98 60.14 1den h ARG 54 Cb 0.51 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.49 1den h ARG 54 CO 0.11 0.00 0.55 0.00 -1.07 0.00 0.00 179.97 179.56 1den h ARG 55 N 0.00 0.52 0.00 0.04 2.47 -0.59 0.47 114.38 117.29 1den h ARG 55 Ca 0.05 -0.03 -0.04 0.00 -1.26 0.00 0.00 59.98 58.70 1den h ARG 55 Cb 0.30 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 1den h ARG 55 CO -0.00 0.35 -1.24 2.41 0.56 0.00 0.00 179.97 182.04 1den n THR 56 N -4.53 0.14 0.11 2.04 -1.04 -1.03 -4.64 114.28 105.34 1den n THR 56 Ca 0.17 -0.14 0.08 0.00 -2.04 0.00 0.00 64.05 62.12 1den n THR 56 Cb 0.54 -0.26 0.01 0.00 -1.82 0.00 0.00 70.33 68.79 1den n THR 56 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1den s ILE 58 N -3.20 2.84 -0.62 0.00 -1.09 0.15 -4.53 121.20 114.75 1den s ILE 58 Ca 0.01 -2.06 -0.24 0.00 -2.23 0.00 0.00 60.65 56.12 1den s ILE 58 Cb 0.08 -2.69 0.05 0.00 -1.58 0.00 0.00 42.46 38.33 1den s ILE 58 CO 0.77 -0.30 1.00 -0.60 -1.23 0.00 0.00 174.94 174.58 1den s ARG 59 N -3.65 3.22 0.00 2.79 6.06 -1.26 -2.31 118.95 123.80 1den s ARG 59 Ca 0.33 -0.50 0.29 0.00 -2.50 0.00 0.00 55.73 53.35 1den s ARG 59 Cb -0.03 -4.15 1.24 0.00 0.06 0.00 0.00 34.95 32.07 1den s ARG 59 CO 0.18 -1.72 1.85 1.63 -2.50 0.00 0.00 175.30 174.74