#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 -1.33 -1.48 -1.09 -0.02 -1.26 -4.59 135.00 125.22 1den n PRO 2 Ca 0.00 -0.37 -0.42 0.00 -2.02 0.00 0.00 63.50 60.69 1den n PRO 2 Cb 0.00 -1.73 -0.03 0.00 -0.02 0.00 0.00 33.50 31.72 1den n PRO 2 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1den n LEU 3 N -1.59 5.21 -4.63 2.45 -0.00 -1.14 -4.68 117.00 112.61 1den n LEU 3 Ca 0.02 -3.45 -0.29 0.00 -0.00 0.00 0.00 56.01 52.29 1den n LEU 3 Cb 0.61 -1.39 0.21 0.00 -0.00 0.00 0.00 43.42 42.85 1den n LEU 3 CO 0.52 0.19 0.63 0.00 -0.00 0.00 0.00 177.39 178.72 1den s ARG 4 N 4.30 -0.39 0.02 1.47 1.70 -1.26 -4.94 118.95 119.85 1den s ARG 4 Ca 0.54 0.25 0.09 0.00 -0.47 0.00 0.00 55.73 56.14 1den s ARG 4 Cb 0.13 -1.66 0.40 0.00 -0.57 0.00 0.00 34.95 33.25 1den s ARG 4 CO 0.03 -3.22 1.29 1.63 -1.08 0.00 0.00 175.30 173.95 1den n LYS 5 N -4.47 0.01 0.06 3.89 4.01 -1.26 -2.14 118.16 118.26 1den n LYS 5 Ca 0.08 0.37 0.04 0.00 -0.51 0.00 0.00 58.31 58.29 1den n LYS 5 Cb 0.58 -1.53 0.44 0.00 -0.51 0.00 0.00 35.03 34.01 1den n LYS 5 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1den h LEU 6 N 0.00 0.36 -0.16 -0.35 7.12 -1.97 0.12 115.31 120.44 1den h LEU 6 Ca 0.00 -0.03 0.00 0.00 0.13 0.00 0.00 57.88 57.98 1den h LEU 6 Cb 0.15 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 40.19 1den h LEU 6 CO 0.00 0.32 0.00 0.00 -0.13 0.00 0.00 178.44 178.63 1den n ILE 8 N -3.06 1.66 0.08 0.00 2.08 -0.75 -4.24 119.36 115.12 1den n ILE 8 Ca 0.04 -3.51 0.01 0.00 0.56 0.00 0.00 62.75 59.85 1den n ILE 8 Cb 0.50 0.27 0.17 0.00 -0.75 0.00 0.00 39.64 39.83 1den n ILE 8 CO 0.00 0.00 0.00 -0.11 0.56 0.00 0.00 176.55 177.00 1den n LEU 9 N -0.51 3.50 -2.28 1.39 0.00 0.36 -4.93 117.00 114.53 1den n LEU 9 Ca 0.20 -1.79 -0.01 0.00 0.00 0.00 0.00 56.01 54.42 1den n LEU 9 Cb 0.83 -0.60 -0.01 0.00 0.00 0.00 0.00 43.42 43.64 1den n LEU 9 CO 0.22 0.48 -0.48 1.57 0.00 0.00 0.00 177.39 179.18 1den n HIS 10 N 0.20 -4.33 -1.91 1.96 -0.00 -1.26 -4.60 115.22 105.29 1den n HIS 10 Ca 0.16 2.56 -0.41 0.00 -0.00 0.00 0.00 57.72 60.03 1den n HIS 10 Cb 0.76 -3.69 -0.01 0.00 -0.00 0.00 0.00 29.99 27.05 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 -0.75 4.19 -0.19 1.57 3.03 -1.26 -4.56 118.95 120.99 1den s ARG 11 Ca -0.06 2.45 -0.09 0.00 2.03 0.00 0.00 55.73 60.06 1den s ARG 11 Cb 0.00 -3.02 0.07 0.00 -1.03 0.00 0.00 34.95 30.98 1den s ARG 11 CO 0.16 -0.44 0.43 -0.80 -1.13 0.00 0.00 175.30 173.51 1den s ASN 12 N -0.09 -0.45 -1.08 -2.89 0.01 -1.26 -4.99 114.94 104.20 1den s ASN 12 Ca 0.54 0.97 -0.22 0.00 -0.71 0.00 0.00 52.86 53.44 1den s ASN 12 Cb -0.44 1.04 0.01 0.00 0.41 0.00 0.00 41.25 42.27 1den s ASN 12 CO 0.56 -0.21 1.70 -2.16 -1.51 0.00 0.00 177.10 175.48 1den s PRO 13 N 1.89 3.28 -0.71 -0.60 0.04 -1.26 -4.58 135.00 133.06 1den s PRO 13 Ca -0.07 -1.13 -0.34 0.00 0.04 0.00 0.00 61.00 59.50 1den s PRO 13 Cb -0.10 -5.32 -0.19 0.00 0.04 0.00 0.00 34.50 28.94 1den s PRO 13 CO -0.13 -2.75 2.25 0.41 0.04 0.00 0.00 177.00 176.82 1den n GLY 14 N 6.39 -0.31 3.52 0.56 0.00 -1.26 -4.41 105.19 109.68 1den n GLY 14 Ca 0.40 1.05 -0.39 0.00 0.00 0.00 0.00 46.02 47.08 1den n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1den n ARG 15 N 7.38 0.46 0.00 1.61 5.12 -1.25 -1.04 116.66 128.95 1den n ARG 15 Ca 0.56 -0.01 0.00 0.00 -1.93 0.00 0.00 57.85 56.47 1den n ARG 15 Cb -0.00 -2.37 0.00 0.00 -1.16 0.00 0.00 32.46 28.93 1den n ARG 15 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1den n TYR 17 N 0.00 -2.43 -3.82 0.00 4.01 -1.26 -4.89 117.16 108.77 1den n TYR 17 Ca 0.00 0.87 -0.07 0.00 -0.16 0.00 0.00 57.90 58.53 1den n TYR 17 Cb 0.39 -4.01 0.02 0.00 -0.31 0.00 0.00 39.34 35.42 1den n TYR 17 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1den s GLN 18 N -4.01 1.99 -0.19 -0.72 2.00 -1.26 -5.06 119.66 112.41 1den s GLN 18 Ca 0.33 -1.26 -0.10 0.00 -2.00 0.00 0.00 55.36 52.34 1den s GLN 18 Cb -0.04 0.57 0.06 0.00 0.80 0.00 0.00 33.01 34.40 1den s GLN 18 CO 0.70 -0.93 0.45 0.21 -0.50 0.00 0.00 175.29 175.22 1den s LYS 19 N -2.53 0.44 -0.40 1.67 2.20 -1.23 -4.36 119.74 115.53 1den s LYS 19 Ca 0.16 0.87 0.04 0.00 -0.36 0.00 0.00 55.97 56.68 1den s LYS 19 Cb -0.05 0.02 0.16 0.00 -1.51 0.00 0.00 37.83 36.46 1den s LYS 19 CO 0.10 -0.16 0.42 0.42 -0.36 0.00 0.00 175.35 175.77 1den s ILE 20 N 1.50 -0.30 0.25 5.43 -1.09 0.13 -4.95 121.20 122.16 1den s ILE 20 Ca -0.09 -1.32 -0.30 0.00 -2.23 0.00 0.00 60.65 56.71 1den s ILE 20 Cb -0.08 -0.68 -0.10 0.00 -1.58 0.00 0.00 42.46 40.02 1den s ILE 20 CO -0.14 -0.63 1.42 -2.84 -1.23 0.00 0.00 174.94 171.53 1den s PRO 21 N 1.07 4.28 0.00 2.79 0.02 -1.26 -2.64 135.00 139.26 1den s PRO 21 Ca 0.22 2.27 0.00 0.00 0.02 0.00 0.00 61.00 63.51 1den s PRO 21 Cb -0.09 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.31 1den s PRO 21 CO -0.06 -0.40 0.00 0.00 -0.33 0.00 0.00 177.00 176.21 1den n ALA 22 N 2.32 0.00 -2.13 -1.55 0.00 -0.53 -4.89 120.51 113.72 1den n ALA 22 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.42 1den n ALA 22 Cb 0.41 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 1.38 0.74 0.01 0.00 0.40 0.36 -1.20 117.98 119.67 1den s PHE 23 Ca 0.00 -1.07 0.00 0.00 -0.60 0.00 0.00 56.93 55.26 1den s PHE 23 Cb 0.00 -0.47 -0.01 0.00 0.51 0.00 0.00 43.02 43.06 1den s PHE 23 CO 0.00 -0.34 -0.01 1.52 0.70 0.00 0.00 175.22 177.09 1den s TYR 24 N -3.86 0.09 -0.34 0.36 1.13 0.71 -1.83 117.35 113.62 1den s TYR 24 Ca 0.13 -0.17 -0.29 0.00 -1.41 0.00 0.00 57.07 55.34 1den s TYR 24 Cb 0.07 -0.07 0.01 0.00 -1.10 0.00 0.00 41.96 40.88 1den s TYR 24 CO -0.05 -0.06 1.15 -0.47 -2.51 0.00 0.00 175.55 173.61 1den s TYR 25 N -0.46 2.97 -0.24 -3.49 5.04 -1.26 -0.37 117.35 119.54 1den s TYR 25 Ca -0.05 1.03 -0.15 0.00 -2.44 0.00 0.00 57.07 55.46 1den s TYR 25 Cb -0.03 -3.87 -0.04 0.00 0.35 0.00 0.00 41.96 38.37 1den s TYR 25 CO -0.00 -1.11 0.37 1.21 -1.34 0.00 0.00 175.55 174.67 1den s ASN 26 N 2.10 6.33 -0.42 4.32 3.04 -0.63 -4.84 114.94 124.84 1den s ASN 26 Ca 0.49 0.38 -0.04 0.00 0.04 0.00 0.00 52.86 53.73 1den s ASN 26 Cb -0.13 -2.21 0.06 0.00 -1.54 0.00 0.00 41.25 37.43 1den s ASN 26 CO 0.20 -0.12 2.73 0.00 -3.04 0.00 0.00 177.10 176.87 1den n GLN 27 N 4.90 2.32 0.00 0.43 6.02 -1.26 -0.61 117.38 129.17 1den n GLN 27 Ca -0.09 -2.20 0.00 0.00 -0.01 0.00 0.00 57.00 54.70 1den n GLN 27 Cb 0.51 -2.08 0.00 0.00 1.02 0.00 0.00 30.24 29.69 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 0.89 0.00 -0.07 -1.09 4.76 -1.26 -4.85 118.16 116.54 1den n LYS 28 Ca 0.47 0.00 -0.19 0.00 -2.87 0.00 0.00 58.31 55.71 1den n LYS 28 Cb 0.57 -0.36 -0.13 0.00 -1.84 0.00 0.00 35.03 33.28 1den n LYS 28 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1den h LYS 29 N 0.00 0.06 -4.26 1.97 3.64 -2.00 -3.50 116.57 112.49 1den h LYS 29 Ca 0.00 -0.10 -0.09 0.00 -1.27 0.00 0.00 60.65 59.18 1den h LYS 29 Cb 0.14 0.04 0.08 0.00 -0.41 0.00 0.00 32.23 32.07 1den h LYS 29 CO 0.00 1.05 -0.33 1.63 -2.27 0.00 0.00 179.45 179.53 1den n LYS 30 N -4.36 -1.04 -3.60 1.90 5.02 0.22 -5.05 118.16 111.25 1den n LYS 30 Ca -0.24 0.60 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 1den n LYS 30 Cb 0.68 -3.74 -0.01 0.00 -0.02 0.00 0.00 35.03 31.94 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 -3.53 0.22 -0.55 1.97 0.74 -1.24 -5.03 119.66 112.24 1den s GLN 31 Ca 0.17 -0.11 -0.25 0.00 0.05 0.00 0.00 55.36 55.22 1den s GLN 31 Cb -0.02 0.08 0.04 0.00 1.10 0.00 0.00 33.01 34.21 1den s GLN 31 CO 0.38 -0.10 0.99 0.00 -0.55 0.00 0.00 175.29 176.02 1den s GLU 33 N 4.15 3.91 0.25 0.00 -6.30 0.51 -4.71 118.70 116.51 1den s GLU 33 Ca 0.33 0.78 -0.30 0.00 -2.50 0.00 0.00 54.97 53.29 1den s GLU 33 Cb -0.11 -2.25 -0.09 0.00 0.00 0.00 0.00 34.13 31.68 1den s GLU 33 CO 0.21 -0.15 1.09 0.20 0.02 0.00 0.00 175.26 176.63 1den s GLY 34 N -3.00 3.02 0.03 -1.50 0.00 -1.26 -0.21 107.32 104.40 1den s GLY 34 Ca 0.56 0.86 0.01 0.00 0.00 0.00 0.00 44.72 46.15 1den s GLY 34 CO 0.29 1.51 -0.05 -0.11 0.00 0.00 0.00 173.10 174.75 1den s PHE 35 N -0.95 0.43 -0.08 1.90 -0.71 -0.34 -4.81 117.98 113.42 1den s PHE 35 Ca 0.45 -0.43 -0.30 0.00 -1.04 0.00 0.00 56.93 55.61 1den s PHE 35 Cb -0.31 -0.28 -0.02 0.00 -1.21 0.00 0.00 43.02 41.21 1den s PHE 35 CO 0.39 -0.11 1.03 0.99 -1.34 0.00 0.00 175.22 176.18 1den s THR 36 N -1.19 4.71 -0.14 -4.49 2.01 -1.26 -1.45 115.64 113.83 1den s THR 36 Ca -0.11 1.98 0.02 0.00 0.31 0.00 0.00 61.69 63.89 1den s THR 36 Cb -0.08 -4.27 0.02 0.00 0.01 0.00 0.00 72.50 68.17 1den s THR 36 CO -0.00 0.03 -0.18 0.86 -0.69 0.00 0.00 174.62 174.63 1den s TRP 37 N 1.89 2.40 0.00 4.92 -0.00 -1.08 -4.39 118.94 122.69 1den s TRP 37 Ca 0.50 -1.27 0.00 0.00 -0.00 0.00 0.00 56.10 55.32 1den s TRP 37 Cb -0.20 -1.69 0.00 0.00 -0.00 0.00 0.00 33.47 31.59 1den s TRP 37 CO 0.20 -0.63 0.17 0.43 -0.00 0.00 0.00 176.95 177.12 1den n SER 38 N 4.37 0.00 0.00 5.86 7.64 -1.26 0.21 113.62 130.44 1den n SER 38 Ca -0.19 0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1den n SER 38 Cb 0.51 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 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 1.50 1.36 3.55 0.23 0.00 -0.20 -3.58 105.19 108.05 1den n GLY 39 Ca 0.00 0.23 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 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 6.01 0.28 6.57 0.00 0.00 -1.26 -3.88 105.19 112.91 1den n GLY 41 Ca 0.37 -1.79 0.01 0.00 0.00 0.00 0.00 46.02 44.61 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 -1.02 -1.44 0.00 -0.02 0.00 -1.26 -4.07 105.19 97.38 1den n GLY 42 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.51 0.00 0.00 1.61 3.02 -1.26 -4.98 115.26 112.14 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 0.03 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 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 0.00 -0.94 6.41 7.64 -1.26 -4.80 113.62 120.67 1den n SER 44 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 1den n SER 44 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 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 -1.69 -4.47 6.43 2.85 -1.16 -4.77 115.26 112.45 1den n ASN 45 Ca 0.00 0.12 -0.43 0.00 -0.11 0.00 0.00 54.58 54.16 1den n ASN 45 Cb 0.00 -1.73 -0.06 0.00 1.24 0.00 0.00 39.78 39.23 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 -2.14 3.18 -0.15 1.20 3.52 -1.26 -4.25 118.95 119.05 1den s ARG 46 Ca 0.00 -0.71 0.00 0.00 -0.13 0.00 0.00 55.73 54.90 1den s ARG 46 Cb 0.00 -4.07 0.02 0.00 -1.56 0.00 0.00 34.95 29.34 1den s ARG 46 CO 0.00 -1.25 -0.15 -0.06 -0.81 0.00 0.00 175.30 173.04 1den s PHE 47 N 2.91 2.22 -0.16 5.12 0.08 -0.76 -5.00 117.98 122.39 1den s PHE 47 Ca 0.19 -1.25 -0.17 0.00 0.12 0.00 0.00 56.93 55.83 1den s PHE 47 Cb -0.17 -1.62 -0.14 0.00 -0.57 0.00 0.00 43.02 40.52 1den s PHE 47 CO 0.14 -0.67 0.23 0.87 -0.10 0.00 0.00 175.22 175.69 1den h LYS 48 N 8.01 0.00 0.00 0.44 1.57 -1.95 0.10 116.57 124.74 1den h LYS 48 Ca -0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 1den h LYS 48 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1den h LYS 48 CO 0.54 0.59 -0.05 0.25 -0.57 0.00 0.00 179.45 180.21 1den n THR 49 N -4.59 0.58 0.00 -0.16 -2.24 -1.26 -4.76 114.28 101.85 1den n THR 49 Ca -0.15 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1den n THR 49 Cb 0.41 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 1den n THR 49 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1den n ILE 50 N -2.25 0.00 -0.05 2.28 3.06 -1.26 -4.68 119.36 116.46 1den n ILE 50 Ca 0.05 0.00 -0.14 0.00 -2.50 0.00 0.00 62.75 60.16 1den n ILE 50 Cb 0.43 0.00 -0.08 0.00 0.54 0.00 0.00 39.64 40.53 1den n ILE 50 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 1den h GLU 51 N 0.00 0.41 -0.57 9.51 4.39 -1.97 -1.88 114.58 124.48 1den h GLU 51 Ca 0.00 -0.28 0.15 0.00 0.34 0.00 0.00 59.36 59.58 1den h GLU 51 Cb 0.00 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 1den h GLU 51 CO 0.00 0.88 0.40 1.49 -1.16 0.00 0.00 179.01 180.63 1den h GLU 52 N 0.00 0.07 0.12 2.33 4.57 -1.98 0.52 114.58 120.21 1den h GLU 52 Ca 0.00 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1den h GLU 52 Cb 0.88 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.46 1den h GLU 52 CO 0.06 0.05 -0.06 0.00 -1.18 0.00 0.00 179.01 177.88 1den h ARG 54 N -1.04 0.00 -0.80 0.00 3.08 -0.51 -1.38 114.38 113.73 1den h ARG 54 Ca -0.02 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.17 1den h ARG 54 Cb 0.15 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.14 1den h ARG 54 CO 0.03 0.00 0.52 0.00 -1.07 0.00 0.00 179.97 179.45 1den h ARG 55 N 0.00 0.56 0.00 0.04 2.47 -0.11 -3.03 114.38 114.31 1den h ARG 55 Ca 0.00 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1den h ARG 55 Cb 0.05 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.24 1den h ARG 55 CO -0.00 0.37 -0.50 -2.37 0.56 0.00 0.00 179.97 178.03 1den n THR 56 N -4.51 0.00 0.55 2.04 5.66 -1.14 -4.84 114.28 112.03 1den n THR 56 Ca 0.15 -0.01 0.11 0.00 -3.05 0.00 0.00 64.05 61.25 1den n THR 56 Cb 0.46 0.28 0.03 0.00 -1.55 0.00 0.00 70.33 69.55 1den n THR 56 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1den h ILE 58 N 0.00 1.22 0.00 0.00 1.08 -1.71 -3.45 117.51 114.66 1den h ILE 58 Ca 0.00 -1.85 0.00 0.00 -0.39 0.00 0.00 64.86 62.62 1den h ILE 58 Cb 0.74 2.29 0.00 0.00 -3.07 0.00 0.00 36.82 36.78 1den h ILE 58 CO 0.00 0.41 0.00 0.54 -0.69 0.00 0.00 178.15 178.41 1den n ARG 59 N -4.69 0.00 0.00 2.37 5.12 -1.26 -4.96 116.66 113.24 1den n ARG 59 Ca -0.07 0.00 0.04 0.00 -1.93 0.00 0.00 57.85 55.89 1den n ARG 59 Cb 0.33 0.00 0.03 0.00 -1.16 0.00 0.00 32.46 31.66 1den n ARG 59 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33