#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 -0.15 0.37 3.69 0.04 -1.26 -4.15 135.00 133.54 1den s PRO 2 Ca 0.00 0.22 -0.25 0.00 0.04 0.00 0.00 61.00 61.01 1den s PRO 2 Cb 0.00 -1.70 -0.12 0.00 0.04 0.00 0.00 34.50 32.72 1den s PRO 2 CO 0.00 -3.05 0.91 1.47 0.04 0.00 0.00 177.00 176.37 1den n LEU 3 N -4.35 1.73 -3.83 -3.56 -0.00 -0.07 -4.83 117.00 102.09 1den n LEU 3 Ca 0.09 1.07 -0.08 0.00 -0.00 0.00 0.00 56.01 57.08 1den n LEU 3 Cb 0.58 -1.27 0.01 0.00 -0.00 0.00 0.00 43.42 42.74 1den n LEU 3 CO 0.52 -1.75 0.50 0.00 -0.00 0.00 0.00 177.39 176.66 1den s ARG 4 N -1.74 2.10 0.37 1.47 1.70 -1.26 -5.02 118.95 116.56 1den s ARG 4 Ca 0.62 -1.32 0.24 0.00 -0.47 0.00 0.00 55.73 54.79 1den s ARG 4 Cb -0.63 0.62 1.28 0.00 -0.57 0.00 0.00 34.95 35.65 1den s ARG 4 CO 0.58 -0.97 1.71 0.87 -1.08 0.00 0.00 175.30 176.41 1den h LYS 5 N 2.01 0.00 0.00 3.89 1.57 -2.02 -1.94 116.57 120.07 1den h LYS 5 Ca -0.28 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.46 1den h LYS 5 Cb 1.25 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.56 1den h LYS 5 CO 0.36 0.00 -0.15 1.37 -0.57 0.00 0.00 179.45 180.46 1den h LEU 6 N 0.00 0.00 -1.30 2.94 8.10 -2.00 -2.40 115.31 120.65 1den h LEU 6 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.97 1den h LEU 6 Cb 0.07 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.29 1den h LEU 6 CO 0.00 0.15 -0.11 0.00 -4.11 0.00 0.00 178.44 174.37 1den h ILE 8 N 0.00 0.75 0.00 0.00 1.08 -1.62 -3.29 117.51 114.43 1den h ILE 8 Ca -0.00 -2.04 0.00 0.00 -0.39 0.00 0.00 64.86 62.43 1den h ILE 8 Cb 0.62 2.35 0.00 0.00 -3.07 0.00 0.00 36.82 36.72 1den h ILE 8 CO 0.01 0.42 0.00 0.18 -0.69 0.00 0.00 178.15 178.08 1den n LEU 9 N -3.22 0.00 0.00 1.44 4.77 -1.07 -5.00 117.00 113.92 1den n LEU 9 Ca 0.02 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1den n LEU 9 Cb 0.70 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1den n LEU 9 CO 0.40 -0.18 0.00 1.41 -1.33 0.00 0.00 177.39 177.68 1den n HIS 10 N -1.42 -0.21 -1.53 -1.77 8.25 -1.24 -4.73 115.22 112.57 1den n HIS 10 Ca 0.06 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.16 1den n HIS 10 Cb 0.17 0.11 0.09 0.00 1.12 0.00 0.00 29.99 31.48 1den n HIS 10 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1den s ARG 11 N 0.00 2.24 -0.50 -0.41 3.03 -1.26 -4.65 118.95 117.40 1den s ARG 11 Ca 0.00 1.95 0.08 0.00 2.03 0.00 0.00 55.73 59.79 1den s ARG 11 Cb 0.00 -1.82 0.30 0.00 -1.03 0.00 0.00 34.95 32.40 1den s ARG 11 CO 0.00 -1.81 0.75 0.09 -1.13 0.00 0.00 175.30 173.20 1den n ASN 12 N -2.39 2.44 0.05 -2.89 4.13 -1.26 -4.95 115.26 110.39 1den n ASN 12 Ca 0.15 -3.24 -0.07 0.00 1.68 0.00 0.00 54.58 53.10 1den n ASN 12 Cb 0.49 -0.62 -0.05 0.00 -1.54 0.00 0.00 39.78 38.06 1den n ASN 12 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1den h PRO 13 N 3.51 -0.21 0.00 3.52 0.13 -1.85 -3.28 132.00 133.81 1den h PRO 13 Ca 0.13 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1den h PRO 13 Cb 0.74 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1den h PRO 13 CO 0.66 0.09 0.00 0.41 -0.23 0.00 0.00 178.00 178.94 1den n GLY 14 N 0.99 -1.03 3.43 1.56 0.00 -1.26 -2.51 105.19 106.37 1den n GLY 14 Ca -0.06 -1.64 -0.44 0.00 0.00 0.00 0.00 46.02 43.88 1den n GLY 14 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1den s ARG 15 N -1.77 3.72 0.00 1.61 1.70 -1.26 -4.57 118.95 118.37 1den s ARG 15 Ca 0.00 -2.06 0.00 0.00 -0.47 0.00 0.00 55.73 53.20 1den s ARG 15 Cb 0.00 -4.87 0.00 0.00 -0.57 0.00 0.00 34.95 29.51 1den s ARG 15 CO 0.00 -1.69 0.00 0.00 -1.08 0.00 0.00 175.30 172.53 1den s TYR 17 N 0.00 -0.27 -0.82 0.00 2.02 -1.25 -4.84 117.35 112.19 1den s TYR 17 Ca 0.00 -0.89 -0.36 0.00 -0.37 0.00 0.00 57.07 55.45 1den s TYR 17 Cb 0.00 -0.41 -0.21 0.00 -0.40 0.00 0.00 41.96 40.94 1den s TYR 17 CO 0.00 -0.97 2.49 0.94 -1.57 0.00 0.00 175.55 176.44 1den n GLN 18 N 4.13 0.00 0.00 -0.62 7.27 -1.26 -0.75 117.38 126.15 1den n GLN 18 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.19 1den n GLN 18 Cb 0.45 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.61 1den n GLN 18 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1den n LYS 19 N 8.12 0.09 -3.62 3.69 4.81 -0.28 -4.91 118.16 126.06 1den n LYS 19 Ca 0.62 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.79 1den n LYS 19 Cb 0.00 -0.01 -0.10 0.00 0.02 0.00 0.00 35.03 34.94 1den n LYS 19 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1den n ILE 20 N 0.00 0.64 -1.72 3.15 2.08 -1.21 -4.99 119.36 117.30 1den n ILE 20 Ca 0.00 -4.39 -0.42 0.00 0.56 0.00 0.00 62.75 58.50 1den n ILE 20 Cb 0.00 -1.99 -0.03 0.00 -0.75 0.00 0.00 39.64 36.87 1den n ILE 20 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1den n PRO 21 N 2.06 2.76 0.00 0.38 -0.04 -1.26 -3.41 135.00 135.49 1den n PRO 21 Ca 0.24 0.99 0.00 0.00 -0.04 0.00 0.00 63.50 64.70 1den n PRO 21 Cb 0.41 -2.83 0.00 0.00 -0.04 0.00 0.00 33.50 31.04 1den n PRO 21 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1den n ALA 22 N 3.62 0.00 -2.38 0.55 0.00 -0.48 -4.92 120.51 116.89 1den n ALA 22 Ca 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.51 1den n ALA 22 Cb 0.35 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.71 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 1.21 0.35 0.03 0.00 0.40 0.44 -1.17 117.98 119.25 1den s PHE 23 Ca 0.00 -0.81 -0.03 0.00 -0.60 0.00 0.00 56.93 55.49 1den s PHE 23 Cb 0.00 -0.25 -0.02 0.00 0.51 0.00 0.00 43.02 43.26 1den s PHE 23 CO 0.00 -0.40 0.03 1.52 0.70 0.00 0.00 175.22 177.06 1den s TYR 24 N -3.49 0.28 -0.34 0.36 1.13 0.17 -1.04 117.35 114.43 1den s TYR 24 Ca 0.03 -0.62 -0.29 0.00 -1.41 0.00 0.00 57.07 54.78 1den s TYR 24 Cb 0.04 -0.21 0.01 0.00 -1.10 0.00 0.00 41.96 40.71 1den s TYR 24 CO -0.09 -0.31 1.20 -0.47 -2.51 0.00 0.00 175.55 173.38 1den s TYR 25 N -2.45 2.86 -0.56 -3.49 5.04 -1.26 -0.58 117.35 116.91 1den s TYR 25 Ca -0.06 0.95 -0.26 0.00 -2.44 0.00 0.00 57.07 55.25 1den s TYR 25 Cb -0.02 -3.94 0.03 0.00 0.35 0.00 0.00 41.96 38.38 1den s TYR 25 CO -0.04 -1.32 1.06 1.21 -1.34 0.00 0.00 175.55 175.12 1den s ASN 26 N 2.39 6.41 -0.28 4.32 3.04 -0.62 -4.77 114.94 125.43 1den s ASN 26 Ca 0.51 -0.09 -0.05 0.00 0.04 0.00 0.00 52.86 53.27 1den s ASN 26 Cb -0.13 -2.49 -0.11 0.00 -1.54 0.00 0.00 41.25 36.98 1den s ASN 26 CO 0.22 -1.33 3.21 0.00 -3.04 0.00 0.00 177.10 176.16 1den n GLN 27 N 7.89 2.29 0.00 0.43 6.02 -1.26 -2.49 117.38 130.25 1den n GLN 27 Ca 0.05 -1.68 0.00 0.00 -0.01 0.00 0.00 57.00 55.36 1den n GLN 27 Cb 0.48 -2.10 0.00 0.00 1.02 0.00 0.00 30.24 29.64 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 1.80 0.00 0.00 -1.09 4.81 -1.26 -5.02 118.16 117.39 1den n LYS 28 Ca 0.47 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 1den n LYS 28 Cb 0.72 -0.54 0.00 0.00 0.02 0.00 0.00 35.03 35.23 1den n LYS 28 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1den n LYS 29 N -1.76 0.00 0.00 1.64 4.81 -1.04 -5.10 118.16 116.71 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 0.09 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.14 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 -3.82 1.64 2.85 -1.18 -5.05 118.16 112.61 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 -0.00 0.00 -0.65 0.00 0.00 35.03 34.38 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 1.54 -0.48 -1.58 0.74 -1.26 -5.03 119.66 113.59 1den s GLN 31 Ca 0.00 -0.92 -0.29 0.00 0.05 0.00 0.00 55.36 54.20 1den s GLN 31 Cb 0.00 0.48 0.03 0.00 1.10 0.00 0.00 33.01 34.62 1den s GLN 31 CO 0.00 -0.71 1.15 0.00 -0.55 0.00 0.00 175.29 175.17 1den s GLU 33 N 4.49 3.36 0.24 0.00 2.56 0.26 -4.78 118.70 124.82 1den s GLU 33 Ca 0.48 0.22 -0.15 0.00 0.00 0.00 0.00 54.97 55.52 1den s GLU 33 Cb -0.07 -2.30 -0.08 0.00 2.00 0.00 0.00 34.13 33.68 1den s GLU 33 CO 0.32 -0.41 0.66 0.20 -0.56 0.00 0.00 175.26 175.47 1den s GLY 34 N -4.18 2.43 0.04 -1.50 0.00 -1.26 -0.65 107.32 102.20 1den s GLY 34 Ca 0.50 -0.02 -0.04 0.00 0.00 0.00 0.00 44.72 45.16 1den s GLY 34 CO 0.46 0.23 0.05 -0.11 0.00 0.00 0.00 173.10 173.73 1den s PHE 35 N -1.71 0.28 -0.36 1.90 -0.71 -0.32 -4.85 117.98 112.20 1den s PHE 35 Ca 0.46 -0.64 -0.15 0.00 -1.04 0.00 0.00 56.93 55.56 1den s PHE 35 Cb -0.13 -0.20 -0.00 0.00 -1.21 0.00 0.00 43.02 41.47 1den s PHE 35 CO 0.19 -0.35 0.34 0.99 -1.34 0.00 0.00 175.22 175.06 1den s THR 36 N -2.79 5.19 0.68 -4.49 2.01 -1.26 -1.39 115.64 113.58 1den s THR 36 Ca -0.03 -0.14 -0.13 0.00 0.31 0.00 0.00 61.69 61.70 1den s THR 36 Cb -0.00 -3.85 0.00 0.00 0.01 0.00 0.00 72.50 68.66 1den s THR 36 CO -0.06 -0.15 1.07 0.86 -0.69 0.00 0.00 174.62 175.65 1den s TRP 37 N 1.95 2.89 -0.26 4.92 -0.00 -1.22 -4.75 118.94 122.47 1den s TRP 37 Ca 0.10 1.50 -0.03 0.00 -0.00 0.00 0.00 56.10 57.66 1den s TRP 37 Cb -0.17 -3.00 0.09 0.00 -0.00 0.00 0.00 33.47 30.39 1den s TRP 37 CO 0.12 -1.39 0.10 -1.12 -0.00 0.00 0.00 176.95 174.66 1den s SER 38 N -3.24 3.33 0.00 5.86 0.01 -1.04 -1.12 113.70 117.50 1den s SER 38 Ca 0.62 -1.17 0.00 0.00 1.31 0.00 0.00 55.95 56.70 1den s SER 38 Cb -0.16 -0.46 0.00 0.00 0.21 0.00 0.00 66.02 65.61 1den s SER 38 CO 0.48 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 174.34 1den n GLY 39 N 5.15 1.40 3.57 3.44 0.00 0.07 -3.77 105.19 115.06 1den n GLY 39 Ca -0.06 -0.03 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 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 6.32 0.57 3.65 0.00 0.00 -1.25 -4.60 105.19 109.88 1den n GLY 41 Ca 0.43 0.64 -0.02 0.00 0.00 0.00 0.00 46.02 47.07 1den n GLY 41 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1den s GLY 42 N 0.00 -0.17 0.00 -0.02 0.00 -1.24 -4.46 107.32 101.43 1den s GLY 42 Ca 0.00 2.02 0.00 0.00 0.00 0.00 0.00 44.72 46.74 1den s GLY 42 CO 0.00 0.69 0.00 0.70 0.00 0.00 0.00 173.10 174.49 1den n ASN 43 N 0.04 0.00 0.00 1.64 4.13 -1.26 -5.08 115.26 114.73 1den n ASN 43 Ca 0.06 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.32 1den n ASN 43 Cb 0.56 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.80 1den n ASN 43 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1den n SER 44 N 0.00 0.00 -0.85 6.41 7.64 -1.26 -4.87 113.62 120.68 1den n SER 44 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 1den n SER 44 Cb 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 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 -0.06 2.22 -4.15 6.43 5.15 -1.26 -4.54 115.26 119.04 1den n ASN 45 Ca 0.00 -2.10 -0.43 0.00 -0.60 0.00 0.00 54.58 51.44 1den n ASN 45 Cb 0.00 -0.52 0.00 0.00 -0.53 0.00 0.00 39.78 38.73 1den n ASN 45 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1den n ARG 46 N 0.21 3.60 -3.40 1.20 0.00 -1.26 -4.13 116.66 112.88 1den n ARG 46 Ca 0.04 -3.83 -0.38 0.00 -0.00 0.00 0.00 57.85 53.68 1den n ARG 46 Cb 0.46 -2.90 -0.06 0.00 0.00 0.00 0.00 32.46 29.96 1den n ARG 46 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 1den s PHE 47 N 0.39 3.60 -0.05 -0.14 0.08 -0.20 -4.90 117.98 116.75 1den s PHE 47 Ca 0.39 0.92 -0.25 0.00 0.12 0.00 0.00 56.93 58.11 1den s PHE 47 Cb 0.03 -2.44 -0.23 0.00 -0.57 0.00 0.00 43.02 39.82 1den s PHE 47 CO 0.01 0.37 1.06 0.87 -0.10 0.00 0.00 175.22 177.42 1den h LYS 48 N 5.89 0.13 -6.50 0.44 1.57 -1.95 0.13 116.57 116.27 1den h LYS 48 Ca -0.45 -0.13 -0.64 0.00 -1.87 0.00 0.00 60.65 57.56 1den h LYS 48 Cb 1.19 0.03 -0.16 0.00 0.08 0.00 0.00 32.23 33.37 1den h LYS 48 CO 0.70 0.84 -0.78 0.95 -0.57 0.00 0.00 179.45 180.60 1den s THR 49 N -3.29 2.70 0.32 -0.16 -4.23 -1.26 -4.69 115.64 105.03 1den s THR 49 Ca -0.16 -1.93 0.07 0.00 -1.18 0.00 0.00 61.69 58.49 1den s THR 49 Cb 0.01 -2.33 0.08 0.00 1.34 0.00 0.00 72.50 71.59 1den s THR 49 CO 0.72 -0.15 1.77 0.40 -0.54 0.00 0.00 174.62 176.82 1den h ILE 50 N 2.91 1.27 0.24 2.99 2.04 -1.89 -2.89 117.51 122.18 1den h ILE 50 Ca -0.46 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.11 1den h ILE 50 Cb 1.21 1.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.80 1den h ILE 50 CO 0.52 0.39 -0.12 -0.33 0.00 0.00 0.00 178.15 178.61 1den h GLU 51 N 0.23 -0.31 -1.02 2.37 3.07 -1.97 -1.71 114.58 115.24 1den h GLU 51 Ca 0.03 0.02 0.25 0.00 -0.50 0.00 0.00 59.36 59.17 1den h GLU 51 Cb 0.67 0.07 -0.11 0.00 -0.84 0.00 0.00 28.75 28.54 1den h GLU 51 CO 0.05 0.02 0.63 0.93 -1.40 0.00 0.00 179.01 179.24 1den h GLU 52 N -0.69 0.49 0.18 2.33 3.07 -1.97 0.41 114.58 118.40 1den h GLU 52 Ca -0.03 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 1den h GLU 52 Cb 0.48 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 1den h GLU 52 CO 0.05 0.33 -0.09 0.00 -1.40 0.00 0.00 179.01 177.90 1den h ARG 54 N -0.74 0.13 -0.91 0.00 3.08 -0.08 -1.45 114.38 114.41 1den h ARG 54 Ca -0.02 -0.03 0.18 0.00 0.07 0.00 0.00 59.98 60.18 1den h ARG 54 Cb 0.51 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.46 1den h ARG 54 CO 0.04 0.28 0.59 0.00 -1.07 0.00 0.00 179.97 179.81 1den h ARG 55 N 0.12 0.55 0.00 0.04 3.08 -0.31 -0.23 114.38 117.64 1den h ARG 55 Ca 0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1den h ARG 55 Cb 0.34 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1den h ARG 55 CO 0.02 0.37 -0.08 2.41 -1.07 0.00 0.00 179.97 181.62 1den n THR 56 N -4.57 0.15 0.32 2.04 -1.04 -1.10 -3.68 114.28 106.41 1den n THR 56 Ca 0.19 0.47 0.16 0.00 -2.04 0.00 0.00 64.05 62.82 1den n THR 56 Cb 0.59 -1.59 0.63 0.00 -1.82 0.00 0.00 70.33 68.13 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 -2.81 0.00 0.00 0.00 2.08 -0.26 -4.91 119.36 113.46 1den n ILE 58 Ca 0.01 -0.48 0.00 0.00 0.56 0.00 0.00 62.75 62.84 1den n ILE 58 Cb 0.28 1.01 0.00 0.00 -0.75 0.00 0.00 39.64 40.18 1den n ILE 58 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 1den n ARG 59 N -0.56 0.00 0.00 0.38 1.74 -0.26 -4.95 116.66 113.01 1den n ARG 59 Ca 0.01 0.00 0.16 0.00 -0.77 0.00 0.00 57.85 57.24 1den n ARG 59 Cb 0.03 0.00 0.94 0.00 -1.02 0.00 0.00 32.46 32.40 1den n ARG 59 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28