#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1den s PRO 2 N 0.00 1.77 0.75 -1.09 0.04 -1.26 -5.03 135.00 130.18 1den s PRO 2 Ca 0.00 0.64 -0.08 0.00 0.04 0.00 0.00 61.00 61.61 1den s PRO 2 Cb 0.00 -1.88 0.09 0.00 0.04 0.00 0.00 34.50 32.75 1den s PRO 2 CO 0.00 -1.84 1.06 -0.51 0.04 0.00 0.00 177.00 175.75 1den s LEU 3 N -5.92 2.81 0.88 -3.56 2.01 -1.26 -5.01 118.68 108.63 1den s LEU 3 Ca 0.62 0.34 -0.11 0.00 0.01 0.00 0.00 54.13 54.99 1den s LEU 3 Cb -0.15 -2.86 0.12 0.00 0.01 0.00 0.00 46.19 43.31 1den s LEU 3 CO 0.55 -1.81 1.09 -0.13 1.01 0.00 0.00 176.35 177.06 1den s ARG 4 N -5.34 1.39 0.31 1.70 1.81 -1.25 -4.96 118.95 112.61 1den s ARG 4 Ca 0.63 0.87 0.04 0.00 -1.72 0.00 0.00 55.73 55.55 1den s ARG 4 Cb -0.09 -1.82 0.52 0.00 -0.45 0.00 0.00 34.95 33.11 1den s ARG 4 CO 0.46 -2.17 1.80 0.87 -0.68 0.00 0.00 175.30 175.58 1den h LYS 5 N -1.50 0.47 -0.02 3.54 1.79 -1.98 -2.82 116.57 116.05 1den h LYS 5 Ca -0.49 -0.14 0.01 0.00 -2.18 0.00 0.00 60.65 57.85 1den h LYS 5 Cb 1.28 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.88 1den h LYS 5 CO 0.54 0.61 0.19 1.25 -1.08 0.00 0.00 179.45 180.96 1den h LEU 6 N 0.43 0.00 -2.76 2.94 7.12 -1.98 -0.88 115.31 120.18 1den h LEU 6 Ca 0.08 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.09 1den h LEU 6 Cb 0.51 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.64 1den h LEU 6 CO 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 178.44 178.34 1den n ILE 8 N 1.45 0.00 1.39 0.00 -5.35 -0.39 -4.85 119.36 111.61 1den n ILE 8 Ca 0.22 0.00 0.12 0.00 -0.27 0.00 0.00 62.75 62.82 1den n ILE 8 Cb 0.59 1.26 0.68 0.00 -1.74 0.00 0.00 39.64 40.43 1den n ILE 8 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1den n LEU 9 N 0.00 0.00 -0.64 7.28 4.77 -0.86 -4.99 117.00 122.57 1den n LEU 9 Ca 0.00 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 1den n LEU 9 Cb 0.39 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1den n LEU 9 CO 0.00 -0.02 -0.17 1.57 -1.33 0.00 0.00 177.39 177.44 1den n HIS 10 N -1.06 -1.69 -2.04 -1.77 -0.00 -1.26 -4.77 115.22 102.62 1den n HIS 10 Ca 0.16 0.88 -0.28 0.00 -0.00 0.00 0.00 57.72 58.49 1den n HIS 10 Cb 0.10 -2.18 -0.05 0.00 -0.00 0.00 0.00 29.99 27.86 1den n HIS 10 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.34 175.36 1den s ARG 11 N -3.85 2.56 -0.46 1.57 3.03 -1.26 -4.65 118.95 115.89 1den s ARG 11 Ca 0.00 -0.18 -0.16 0.00 2.03 0.00 0.00 55.73 57.42 1den s ARG 11 Cb 0.00 -4.98 0.05 0.00 -1.03 0.00 0.00 34.95 28.99 1den s ARG 11 CO 0.00 -3.31 0.40 -0.80 -1.13 0.00 0.00 175.30 170.46 1den s ASN 12 N 8.06 6.15 0.04 -2.89 0.01 -1.26 -4.97 114.94 120.08 1den s ASN 12 Ca 0.70 -1.11 -0.20 0.00 -0.71 0.00 0.00 52.86 51.54 1den s ASN 12 Cb -0.07 -2.19 -0.15 0.00 0.41 0.00 0.00 41.25 39.24 1den s ASN 12 CO 0.02 -0.62 1.31 1.55 -1.51 0.00 0.00 177.10 177.85 1den h PRO 13 N 8.75 0.38 0.00 -0.60 0.13 -1.89 -2.05 132.00 136.72 1den h PRO 13 Ca -0.28 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1den h PRO 13 Cb 1.11 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1den h PRO 13 CO 0.84 0.81 0.00 0.41 -0.23 0.00 0.00 178.00 179.83 1den n GLY 14 N 0.33 2.39 3.44 1.56 0.00 -1.26 -3.06 105.19 108.58 1den n GLY 14 Ca -0.06 -2.11 -0.44 0.00 0.00 0.00 0.00 46.02 43.40 1den n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1den s ARG 15 N -2.08 4.05 0.00 1.61 0.52 -1.26 -4.58 118.95 117.21 1den s ARG 15 Ca 0.00 -2.60 0.00 0.00 -0.52 0.00 0.00 55.73 52.61 1den s ARG 15 Cb 0.00 -4.96 0.00 0.00 0.52 0.00 0.00 34.95 30.51 1den s ARG 15 CO 0.00 -1.67 0.00 0.00 0.02 0.00 0.00 175.30 173.65 1den n TYR 17 N 0.00 -2.82 0.00 0.00 4.01 -1.25 -4.38 117.16 112.72 1den n TYR 17 Ca 0.00 1.68 0.00 0.00 -0.16 0.00 0.00 57.90 59.42 1den n TYR 17 Cb 0.16 -3.06 0.00 0.00 -0.31 0.00 0.00 39.34 36.13 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 1.07 0.00 0.00 -0.72 0.00 -0.57 -4.39 117.38 112.76 1den n GLN 18 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1den n GLN 18 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1den n GLN 18 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 1den n LYS 19 N 0.23 0.00 -3.16 3.69 3.00 0.23 -4.81 118.16 117.34 1den n LYS 19 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.09 1den n LYS 19 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 34.97 1den n LYS 19 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1den n ILE 20 N -0.01 -0.60 -2.10 3.15 5.41 -1.16 -5.01 119.36 119.04 1den n ILE 20 Ca 0.00 -3.91 -0.41 0.00 1.00 0.00 0.00 62.75 59.43 1den n ILE 20 Cb 0.00 -1.55 -0.03 0.00 -0.71 0.00 0.00 39.64 37.36 1den n ILE 20 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1den s PRO 21 N -1.19 4.32 0.00 0.38 0.02 -1.26 -3.16 135.00 134.10 1den s PRO 21 Ca 0.35 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.56 1den s PRO 21 Cb 0.19 -3.16 0.00 0.00 0.02 0.00 0.00 34.50 31.56 1den s PRO 21 CO -0.11 -0.36 0.00 0.00 -0.33 0.00 0.00 177.00 176.19 1den n ALA 22 N 2.68 0.00 -2.19 -1.55 0.00 -0.53 -4.92 120.51 114.00 1den n ALA 22 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.40 1den n ALA 22 Cb 0.41 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.76 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 1.10 1.03 0.03 0.00 0.40 0.34 -1.13 117.98 119.75 1den s PHE 23 Ca 0.00 -1.24 -0.07 0.00 -0.60 0.00 0.00 56.93 55.03 1den s PHE 23 Cb 0.00 -0.56 -0.00 0.00 0.51 0.00 0.00 43.02 42.96 1den s PHE 23 CO 0.00 -0.49 0.13 1.52 0.70 0.00 0.00 175.22 177.07 1den s TYR 24 N -4.00 0.13 -0.41 0.36 1.13 0.57 -1.37 117.35 113.76 1den s TYR 24 Ca 0.29 -0.36 -0.29 0.00 -1.41 0.00 0.00 57.07 55.30 1den s TYR 24 Cb 0.07 -0.10 0.02 0.00 -1.10 0.00 0.00 41.96 40.86 1den s TYR 24 CO 0.05 -0.36 1.17 -0.47 -2.51 0.00 0.00 175.55 173.44 1den s TYR 25 N -2.26 2.83 -0.42 -3.49 5.04 -1.26 -0.44 117.35 117.35 1den s TYR 25 Ca -0.08 0.84 -0.25 0.00 -2.44 0.00 0.00 57.07 55.14 1den s TYR 25 Cb -0.03 -4.19 0.02 0.00 0.35 0.00 0.00 41.96 38.11 1den s TYR 25 CO -0.03 -1.28 0.92 1.21 -1.34 0.00 0.00 175.55 175.03 1den s ASN 26 N 2.47 6.56 -0.05 4.32 3.84 -0.63 -4.92 114.94 126.54 1den s ASN 26 Ca 0.50 0.29 -0.02 0.00 0.21 0.00 0.00 52.86 53.84 1den s ASN 26 Cb -0.10 -2.45 -0.07 0.00 -0.55 0.00 0.00 41.25 38.08 1den s ASN 26 CO 0.27 -0.97 2.58 0.00 -2.79 0.00 0.00 177.10 176.19 1den n GLN 27 N 7.00 1.46 0.00 0.43 6.02 -1.26 -0.85 117.38 130.17 1den n GLN 27 Ca 0.06 -0.56 0.00 0.00 -0.01 0.00 0.00 57.00 56.49 1den n GLN 27 Cb 0.48 -1.43 0.00 0.00 1.02 0.00 0.00 30.24 30.31 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 1.71 0.00 0.08 -1.09 5.02 -1.26 -4.88 118.16 117.74 1den n LYS 28 Ca 0.19 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.26 1den n LYS 28 Cb 0.65 -0.16 -0.14 0.00 -0.02 0.00 0.00 35.03 35.35 1den n LYS 28 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1den h LYS 29 N 0.00 0.46 -4.34 1.97 3.64 -1.97 -3.49 116.57 112.84 1den h LYS 29 Ca 0.00 -0.68 -0.10 0.00 -1.27 0.00 0.00 60.65 58.60 1den h LYS 29 Cb 0.00 0.24 0.08 0.00 -0.41 0.00 0.00 32.23 32.14 1den h LYS 29 CO 0.00 1.31 -0.34 1.63 -2.27 0.00 0.00 179.45 179.77 1den n LYS 30 N -3.96 -1.10 0.00 1.90 5.02 -0.03 -5.05 118.16 114.94 1den n LYS 30 Ca -0.14 0.64 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 1den n LYS 30 Cb 0.91 -3.88 0.00 0.00 -0.02 0.00 0.00 35.03 32.04 1den n LYS 30 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1den n GLN 31 N -2.17 0.00 -2.66 1.97 7.27 -1.25 -5.04 117.38 115.50 1den n GLN 31 Ca -0.03 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 56.61 1den n GLN 31 Cb 0.55 0.00 -0.02 0.00 2.41 0.00 0.00 30.24 33.17 1den n GLN 31 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1den s GLU 33 N 3.92 3.54 0.44 0.00 -6.30 0.42 -4.80 118.70 115.92 1den s GLU 33 Ca 0.45 -0.13 -0.22 0.00 -2.50 0.00 0.00 54.97 52.57 1den s GLU 33 Cb -0.10 -2.60 -0.09 0.00 0.00 0.00 0.00 34.13 31.34 1den s GLU 33 CO 0.22 0.10 1.03 0.20 0.02 0.00 0.00 175.26 176.83 1den s GLY 34 N -3.78 2.60 -0.01 -1.50 0.00 -1.26 -0.32 107.32 103.04 1den s GLY 34 Ca 0.43 0.62 -0.09 0.00 0.00 0.00 0.00 44.72 45.67 1den s GLY 34 CO 0.36 0.98 0.19 -0.11 0.00 0.00 0.00 173.10 174.52 1den s PHE 35 N -1.86 -0.06 -0.29 1.90 -0.71 -0.28 -4.75 117.98 111.92 1den s PHE 35 Ca 0.62 0.08 -0.11 0.00 -1.04 0.00 0.00 56.93 56.48 1den s PHE 35 Cb -0.18 0.01 -0.04 0.00 -1.21 0.00 0.00 43.02 41.60 1den s PHE 35 CO 0.22 -0.29 0.18 0.99 -1.34 0.00 0.00 175.22 174.98 1den s THR 36 N -1.14 5.08 0.34 -4.49 2.01 -1.26 -1.45 115.64 114.73 1den s THR 36 Ca -0.12 -0.02 -0.26 0.00 0.31 0.00 0.00 61.69 61.60 1den s THR 36 Cb -0.06 -3.47 -0.09 0.00 0.01 0.00 0.00 72.50 68.88 1den s THR 36 CO 0.02 0.19 1.01 0.86 -0.69 0.00 0.00 174.62 176.01 1den s TRP 37 N 1.72 3.53 0.00 4.92 -0.00 -1.19 -4.74 118.94 123.18 1den s TRP 37 Ca 0.06 1.73 0.00 0.00 -0.00 0.00 0.00 56.10 57.89 1den s TRP 37 Cb -0.16 -3.07 0.00 0.00 -0.00 0.00 0.00 33.47 30.24 1den s TRP 37 CO 0.09 -0.22 0.12 -1.13 -0.00 0.00 0.00 176.95 175.81 1den n SER 38 N 0.50 0.00 0.00 5.86 3.41 -1.22 -1.07 113.62 121.11 1den n SER 38 Ca 0.02 0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1den n SER 38 Cb 0.49 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1den n SER 38 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1den n GLY 39 N 1.12 0.03 2.73 5.00 0.00 -1.26 -0.60 105.19 112.21 1den n GLY 39 Ca 0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 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 1.29 -1.03 0.00 0.00 0.00 -1.26 -4.75 105.19 99.44 1den n GLY 41 Ca 0.07 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.18 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 0.00 0.05 0.00 -0.02 0.00 -1.17 -4.43 105.19 99.61 1den n GLY 42 Ca 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.12 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 -0.49 0.00 0.00 1.61 5.03 -0.77 -4.94 115.26 115.70 1den n ASN 43 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 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 -1.54 -1.83 0.00 0.00 177.26 173.89 1den n SER 44 N 0.00 0.00 -2.96 6.41 3.41 -1.26 -5.00 113.62 114.22 1den n SER 44 Ca 0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.43 1den n SER 44 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1den n SER 44 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1den n ASN 45 N 0.00 -1.08 -4.56 4.04 5.15 -1.21 -4.71 115.26 112.88 1den n ASN 45 Ca 0.00 -0.35 -0.42 0.00 -0.60 0.00 0.00 54.58 53.21 1den n ASN 45 Cb 0.00 -0.98 -0.07 0.00 -0.53 0.00 0.00 39.78 38.20 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 -4.75 3.65 -0.05 1.20 3.00 -1.26 -4.04 118.95 116.70 1den s ARG 46 Ca 0.35 -0.02 -0.01 0.00 -1.00 0.00 0.00 55.73 55.04 1den s ARG 46 Cb -0.20 -3.81 0.03 0.00 0.00 0.00 0.00 34.95 30.96 1den s ARG 46 CO 0.42 -0.72 0.02 -0.06 0.00 0.00 0.00 175.30 174.96 1den s PHE 47 N 2.62 0.38 -0.01 5.12 0.08 -0.47 -4.98 117.98 120.72 1den s PHE 47 Ca 0.23 0.01 -0.25 0.00 0.12 0.00 0.00 56.93 57.04 1den s PHE 47 Cb -0.15 -0.59 -0.19 0.00 -0.57 0.00 0.00 43.02 41.53 1den s PHE 47 CO 0.15 -0.23 1.25 0.87 -0.10 0.00 0.00 175.22 177.16 1den h LYS 48 N 8.03 -0.10 -6.55 0.44 1.57 -1.95 0.98 116.57 118.99 1den h LYS 48 Ca -0.24 0.01 -0.67 0.00 -1.87 0.00 0.00 60.65 57.87 1den h LYS 48 Cb 1.13 0.02 -0.18 0.00 0.08 0.00 0.00 32.23 33.28 1den h LYS 48 CO 0.29 0.31 -0.76 0.95 -0.57 0.00 0.00 179.45 179.67 1den s THR 49 N -4.37 3.19 0.41 -0.16 -4.23 -1.26 -4.67 115.64 104.55 1den s THR 49 Ca -0.15 -1.22 0.19 0.00 -1.18 0.00 0.00 61.69 59.33 1den s THR 49 Cb 0.02 -2.44 0.21 0.00 1.34 0.00 0.00 72.50 71.63 1den s THR 49 CO 0.62 0.20 1.99 0.40 -0.54 0.00 0.00 174.62 177.30 1den h ILE 50 N 3.53 0.93 0.10 2.99 2.04 -1.90 -1.68 117.51 123.52 1den h ILE 50 Ca -0.49 -0.72 -0.01 0.00 1.00 0.00 0.00 64.86 64.64 1den h ILE 50 Cb 1.16 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 1den h ILE 50 CO 0.50 0.19 -0.05 -0.33 0.00 0.00 0.00 178.15 178.46 1den h GLU 51 N 0.00 -0.14 -0.99 2.37 5.08 -1.98 -1.62 114.58 117.31 1den h GLU 51 Ca -0.00 0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.56 1den h GLU 51 Cb 0.40 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.58 1den h GLU 51 CO 0.03 0.37 0.61 0.93 -1.00 0.00 0.00 179.01 179.95 1den h GLU 52 N -0.82 0.66 0.46 2.33 3.07 -1.98 0.27 114.58 118.58 1den h GLU 52 Ca -0.01 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 1den h GLU 52 Cb 0.57 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.33 1den h GLU 52 CO 0.02 0.44 -0.22 0.00 -1.40 0.00 0.00 179.01 177.85 1den h ARG 54 N -0.98 0.00 -0.95 0.00 3.08 -0.18 -0.44 114.38 114.90 1den h ARG 54 Ca -0.06 0.00 0.16 0.00 0.07 0.00 0.00 59.98 60.15 1den h ARG 54 Cb 0.58 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.55 1den h ARG 54 CO 0.10 0.00 0.60 0.00 -1.07 0.00 0.00 179.97 179.61 1den h ARG 55 N 0.00 0.71 0.00 0.04 3.08 -0.55 0.20 114.38 117.87 1den h ARG 55 Ca 0.01 -0.04 -0.42 0.00 0.07 0.00 0.00 59.98 59.60 1den h ARG 55 Cb 0.02 -0.16 -0.07 0.00 0.08 0.00 0.00 29.97 29.84 1den h ARG 55 CO -0.00 0.47 -2.50 2.41 -1.07 0.00 0.00 179.97 179.28 1den n THR 56 N -4.63 1.50 1.13 2.04 -1.04 -1.05 -3.26 114.28 108.98 1den n THR 56 Ca 0.20 -0.51 0.13 0.00 -2.04 0.00 0.00 64.05 61.83 1den n THR 56 Cb 0.51 -1.57 0.44 0.00 -1.82 0.00 0.00 70.33 67.89 1den n THR 56 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1den n ILE 58 N -1.25 0.00 0.00 0.00 2.08 0.71 -4.93 119.36 115.96 1den n ILE 58 Ca 0.09 -0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.37 1den n ILE 58 Cb 0.32 0.52 0.00 0.00 -0.75 0.00 0.00 39.64 39.73 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 -1.42 0.00 0.00 0.38 0.63 -1.14 -5.01 116.66 110.10 1den n ARG 59 Ca 0.00 0.00 0.16 0.00 -0.92 0.00 0.00 57.85 57.09 1den n ARG 59 Cb 0.00 0.00 0.94 0.00 0.45 0.00 0.00 32.46 33.85 1den n ARG 59 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75