#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1den h PRO 2 N 0.00 0.00 -3.37 2.61 0.13 -1.96 -3.45 132.00 125.96 1den h PRO 2 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 1den h PRO 2 Cb 0.00 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.02 1den h PRO 2 CO 0.00 0.00 -0.02 -0.48 -0.23 0.00 0.00 178.00 177.27 1den s LEU 3 N -5.87 0.21 0.17 1.56 2.34 -1.26 -4.38 118.68 111.46 1den s LEU 3 Ca -0.00 -0.47 -0.15 0.00 0.06 0.00 0.00 54.13 53.57 1den s LEU 3 Cb 0.10 2.00 0.02 0.00 -0.56 0.00 0.00 46.19 47.75 1den s LEU 3 CO 0.47 -0.99 0.43 0.00 -1.06 0.00 0.00 176.35 175.20 1den s ARG 4 N -3.86 1.23 0.25 1.48 3.03 -1.26 -5.05 118.95 114.77 1den s ARG 4 Ca 0.08 -0.88 0.17 0.00 2.03 0.00 0.00 55.73 57.13 1den s ARG 4 Cb 0.00 0.47 0.93 0.00 -1.03 0.00 0.00 34.95 35.32 1den s ARG 4 CO -0.05 -0.49 1.53 1.17 -1.13 0.00 0.00 175.30 176.33 1den n LYS 5 N -0.27 0.11 0.28 3.89 3.00 -1.26 -1.96 118.16 121.95 1den n LYS 5 Ca -0.11 0.60 0.13 0.00 -0.00 0.00 0.00 58.31 58.92 1den n LYS 5 Cb 0.63 -1.86 0.82 0.00 0.00 0.00 0.00 35.03 34.61 1den n LYS 5 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 1den h LEU 6 N 0.00 0.00 -1.43 3.14 5.85 -2.00 -0.88 115.31 119.99 1den h LEU 6 Ca 0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1den h LEU 6 Cb 0.02 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1den h LEU 6 CO 0.00 0.03 -0.24 0.00 -0.34 0.00 0.00 178.44 177.89 1den n ILE 8 N -3.66 2.00 1.33 0.00 5.41 -0.37 -4.74 119.36 119.33 1den n ILE 8 Ca -0.01 -3.69 0.12 0.00 1.00 0.00 0.00 62.75 60.17 1den n ILE 8 Cb 0.36 -0.13 0.44 0.00 -0.71 0.00 0.00 39.64 39.60 1den n ILE 8 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 1den n LEU 9 N -0.66 1.65 -2.72 1.39 0.00 -1.01 -5.00 117.00 110.65 1den n LEU 9 Ca 0.29 -0.63 -0.01 0.00 0.00 0.00 0.00 56.01 55.66 1den n LEU 9 Cb 0.90 -0.06 -0.01 0.00 0.00 0.00 0.00 43.42 44.25 1den n LEU 9 CO 0.26 0.31 -0.53 1.41 0.00 0.00 0.00 177.39 178.85 1den n HIS 10 N 0.29 -3.95 -1.43 1.96 8.25 -1.26 -4.86 115.22 114.23 1den n HIS 10 Ca 0.17 1.85 -0.56 0.00 -0.26 0.00 0.00 57.72 58.93 1den n HIS 10 Cb 0.35 -3.90 -0.07 0.00 1.12 0.00 0.00 29.99 27.48 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 0.89 0.00 -3.34 -0.41 0.00 -1.26 -4.92 116.66 107.63 1den n ARG 11 Ca -0.07 0.00 -0.26 0.00 -0.00 0.00 0.00 57.85 57.52 1den n ARG 11 Cb 0.12 -1.40 -0.08 0.00 -0.00 0.00 0.00 32.46 31.10 1den n ARG 11 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1den n ASN 12 N 1.46 2.70 -0.15 2.89 2.85 -1.26 -4.92 115.26 118.82 1den n ASN 12 Ca 0.19 -3.23 -0.05 0.00 -0.11 0.00 0.00 54.58 51.39 1den n ASN 12 Cb 0.09 -0.66 0.14 0.00 1.24 0.00 0.00 39.78 40.59 1den n ASN 12 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1den h PRO 13 N 4.09 0.89 -0.25 1.20 0.13 -1.88 -0.95 132.00 135.23 1den h PRO 13 Ca 0.16 -0.22 0.01 0.00 -0.87 0.00 0.00 66.00 65.08 1den h PRO 13 Cb 0.72 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.74 1den h PRO 13 CO 0.72 0.84 -0.07 0.41 -0.23 0.00 0.00 178.00 179.67 1den n GLY 14 N -0.70 -2.83 3.04 1.56 0.00 -1.26 -3.10 105.19 101.91 1den n GLY 14 Ca 0.04 -1.31 -0.43 0.00 0.00 0.00 0.00 46.02 44.32 1den n GLY 14 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1den n ARG 15 N -1.71 3.62 0.00 1.61 0.63 -1.26 -4.36 116.66 115.20 1den n ARG 15 Ca -0.00 -3.72 0.00 0.00 -0.92 0.00 0.00 57.85 53.21 1den n ARG 15 Cb 0.04 -2.91 0.00 0.00 0.45 0.00 0.00 32.46 30.03 1den n ARG 15 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1den n TYR 17 N 0.00 0.00 -3.25 0.00 4.01 -1.26 -4.86 117.16 111.80 1den n TYR 17 Ca 0.00 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.78 1den n TYR 17 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.00 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 1.60 0.27 0.00 -0.72 0.74 -1.26 -4.53 119.66 115.76 1den s GLN 18 Ca 0.00 0.57 0.00 0.00 0.05 0.00 0.00 55.36 55.98 1den s GLN 18 Cb 0.00 0.33 0.00 0.00 1.10 0.00 0.00 33.01 34.44 1den s GLN 18 CO 0.00 -0.21 0.00 1.17 -0.55 0.00 0.00 175.29 175.70 1den n LYS 19 N 5.24 2.25 -3.15 1.67 3.00 -1.22 -4.55 118.16 121.40 1den n LYS 19 Ca -0.07 0.00 -0.19 0.00 -0.00 0.00 0.00 58.31 58.05 1den n LYS 19 Cb 0.53 -0.19 -0.03 0.00 0.00 0.00 0.00 35.03 35.34 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 -0.00 0.32 -2.22 3.15 2.08 0.20 -4.98 119.36 117.91 1den n ILE 20 Ca 0.00 -4.72 -0.42 0.00 0.56 0.00 0.00 62.75 58.17 1den n ILE 20 Cb 0.00 -0.42 -0.03 0.00 -0.75 0.00 0.00 39.64 38.44 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 -2.59 4.35 0.00 0.38 0.05 -1.26 -2.72 135.00 133.22 1den s PRO 21 Ca 0.41 2.03 0.00 0.00 0.05 0.00 0.00 61.00 63.49 1den s PRO 21 Cb 0.34 -3.25 0.00 0.00 0.05 0.00 0.00 34.50 31.64 1den s PRO 21 CO -0.09 -0.36 0.00 0.00 0.05 0.00 0.00 177.00 176.60 1den n ALA 22 N 3.60 0.00 -2.18 8.56 0.00 -0.54 -4.92 120.51 125.02 1den n ALA 22 Ca 0.10 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.43 1den n ALA 22 Cb 0.43 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.78 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 0.33 0.96 0.04 0.00 0.40 0.39 -0.92 117.98 119.18 1den s PHE 23 Ca 0.00 -1.02 -0.04 0.00 -0.60 0.00 0.00 56.93 55.27 1den s PHE 23 Cb 0.00 -0.56 -0.02 0.00 0.51 0.00 0.00 43.02 42.95 1den s PHE 23 CO 0.00 -0.26 0.06 1.52 0.70 0.00 0.00 175.22 177.25 1den s TYR 24 N -3.74 0.26 -0.44 0.36 1.13 0.41 -1.51 117.35 113.83 1den s TYR 24 Ca 0.18 -0.59 -0.29 0.00 -1.41 0.00 0.00 57.07 54.95 1den s TYR 24 Cb 0.06 -0.18 0.02 0.00 -1.10 0.00 0.00 41.96 40.76 1den s TYR 24 CO -0.01 -0.35 1.17 -0.47 -2.51 0.00 0.00 175.55 173.38 1den s TYR 25 N -2.68 2.81 -0.38 -3.49 5.04 -1.26 -0.69 117.35 116.69 1den s TYR 25 Ca -0.04 0.79 -0.29 0.00 -2.44 0.00 0.00 57.07 55.08 1den s TYR 25 Cb -0.01 -4.30 0.02 0.00 0.35 0.00 0.00 41.96 38.03 1den s TYR 25 CO -0.05 -1.30 1.10 1.21 -1.34 0.00 0.00 175.55 175.17 1den s ASN 26 N 2.53 6.82 -0.03 4.32 3.04 -0.53 -4.92 114.94 126.17 1den s ASN 26 Ca 0.49 0.84 -0.02 0.00 0.04 0.00 0.00 52.86 54.21 1den s ASN 26 Cb -0.09 -2.55 -0.09 0.00 -1.54 0.00 0.00 41.25 36.98 1den s ASN 26 CO 0.29 -1.02 2.66 0.00 -3.04 0.00 0.00 177.10 175.99 1den n GLN 27 N 7.23 1.47 0.00 0.43 6.02 -1.26 -0.98 117.38 130.29 1den n GLN 27 Ca 0.12 -0.53 0.00 0.00 -0.01 0.00 0.00 57.00 56.58 1den n GLN 27 Cb 0.48 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.29 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 1.82 0.00 0.09 -1.09 4.81 -1.26 -4.87 118.16 117.66 1den n LYS 28 Ca 0.20 0.00 -0.23 0.00 -0.87 0.00 0.00 58.31 57.41 1den n LYS 28 Cb 0.67 -0.21 -0.15 0.00 0.02 0.00 0.00 35.03 35.36 1den n LYS 28 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1den h LYS 29 N 0.00 0.42 -4.05 1.64 3.64 -1.97 -3.49 116.57 112.76 1den h LYS 29 Ca 0.00 -0.72 -0.10 0.00 -1.27 0.00 0.00 60.65 58.56 1den h LYS 29 Cb 0.00 0.27 0.08 0.00 -0.41 0.00 0.00 32.23 32.17 1den h LYS 29 CO 0.00 1.34 -0.34 1.63 -2.27 0.00 0.00 179.45 179.81 1den n LYS 30 N -3.87 -0.94 0.00 1.90 5.02 -0.15 -5.05 118.16 115.08 1den n LYS 30 Ca -0.17 0.42 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 1den n LYS 30 Cb 0.99 -3.37 0.00 0.00 -0.02 0.00 0.00 35.03 32.63 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 -2.93 1.97 7.27 -1.25 -5.04 117.38 115.24 1den n GLN 31 Ca -0.03 0.00 -0.41 0.00 0.07 0.00 0.00 57.00 56.63 1den n GLN 31 Cb 0.55 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 33.15 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 1.80 3.27 0.32 0.00 2.56 0.13 -4.84 118.70 121.93 1den s GLU 33 Ca 0.38 -0.80 -0.18 0.00 0.00 0.00 0.00 54.97 54.37 1den s GLU 33 Cb -0.17 -2.81 -0.09 0.00 2.00 0.00 0.00 34.13 33.06 1den s GLU 33 CO 0.14 0.17 0.79 0.20 -0.56 0.00 0.00 175.26 176.01 1den s GLY 34 N -4.09 2.45 -0.15 -1.50 0.00 -1.26 -0.44 107.32 102.33 1den s GLY 34 Ca 0.41 0.18 -0.15 0.00 0.00 0.00 0.00 44.72 45.16 1den s GLY 34 CO 0.31 0.46 0.42 -0.11 0.00 0.00 0.00 173.10 174.19 1den s PHE 35 N -1.88 -0.45 -0.41 1.90 -0.71 -0.10 -4.78 117.98 111.55 1den s PHE 35 Ca 0.53 1.07 -0.20 0.00 -1.04 0.00 0.00 56.93 57.28 1den s PHE 35 Cb -0.12 0.16 0.02 0.00 -1.21 0.00 0.00 43.02 41.86 1den s PHE 35 CO 0.18 -0.24 0.62 0.99 -1.34 0.00 0.00 175.22 175.43 1den s THR 36 N 0.09 4.87 -0.68 -4.49 2.01 -1.26 -1.47 115.64 114.70 1den s THR 36 Ca -0.01 0.19 -0.18 0.00 0.31 0.00 0.00 61.69 62.00 1den s THR 36 Cb -0.03 -4.15 0.13 0.00 0.01 0.00 0.00 72.50 68.46 1den s THR 36 CO 0.01 -0.50 0.76 0.86 -0.69 0.00 0.00 174.62 175.05 1den s TRP 37 N 2.73 3.20 0.06 4.92 -0.00 -1.10 -4.80 118.94 123.94 1den s TRP 37 Ca 0.22 -1.27 -0.01 0.00 -0.00 0.00 0.00 56.10 55.04 1den s TRP 37 Cb -0.14 -3.99 0.01 0.00 -0.00 0.00 0.00 33.47 29.34 1den s TRP 37 CO 0.17 -1.23 0.03 0.43 -0.00 0.00 0.00 176.95 176.35 1den n SER 38 N 5.77 -1.19 0.24 5.86 7.64 -1.18 0.62 113.62 131.38 1den n SER 38 Ca -0.00 -0.03 0.08 0.00 1.01 0.00 0.00 58.87 59.93 1den n SER 38 Cb 0.44 -0.04 0.60 0.00 -1.01 0.00 0.00 64.21 64.20 1den n SER 38 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1den h GLY 39 N -0.67 0.00 -3.47 0.23 0.00 -1.80 -3.33 103.07 94.03 1den h GLY 39 Ca -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.27 1den h GLY 39 CO 0.01 0.00 0.13 0.00 0.00 0.00 0.00 176.54 176.67 1den n GLY 41 N 0.21 -2.35 0.00 0.00 0.00 -1.25 -4.08 105.19 97.72 1den n GLY 41 Ca -0.18 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.59 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 0.06 3.32 -0.02 0.00 -0.36 -4.86 105.19 103.32 1den n GLY 42 Ca 0.00 0.52 -0.29 0.00 0.00 0.00 0.00 46.02 46.25 1den n GLY 42 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1den n ASN 43 N 0.00 -2.70 0.00 1.61 0.23 -1.26 -4.92 115.26 108.23 1den n ASN 43 Ca 0.00 -0.39 0.00 0.00 -0.53 0.00 0.00 54.58 53.66 1den n ASN 43 Cb 0.00 -1.08 0.00 0.00 -2.08 0.00 0.00 39.78 36.62 1den n ASN 43 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1den n SER 44 N -4.24 0.00 -2.74 0.53 7.64 -1.26 -4.22 113.62 109.33 1den n SER 44 Ca 0.05 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.74 1den n SER 44 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 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 -4.86 -4.59 6.43 5.15 -1.26 -4.61 115.26 111.52 1den n ASN 45 Ca 0.00 -0.08 -0.41 0.00 -0.60 0.00 0.00 54.58 53.49 1den n ASN 45 Cb 0.00 -4.03 -0.07 0.00 -0.53 0.00 0.00 39.78 35.15 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 -5.37 3.81 -0.04 1.20 3.00 -1.26 -4.03 118.95 116.26 1den s ARG 46 Ca 0.15 0.15 0.00 0.00 -1.00 0.00 0.00 55.73 55.03 1den s ARG 46 Cb -0.07 -3.75 0.03 0.00 0.00 0.00 0.00 34.95 31.15 1den s ARG 46 CO 0.18 -0.60 -0.01 -0.06 0.00 0.00 0.00 175.30 174.81 1den s PHE 47 N 2.56 0.52 0.10 5.12 0.08 -0.57 -4.97 117.98 120.82 1den s PHE 47 Ca 0.23 -0.09 -0.22 0.00 0.12 0.00 0.00 56.93 56.97 1den s PHE 47 Cb -0.15 -0.56 -0.12 0.00 -0.57 0.00 0.00 43.02 41.62 1den s PHE 47 CO 0.12 -0.18 1.75 0.87 -0.10 0.00 0.00 175.22 177.68 1den h LYS 48 N 7.44 0.10 -5.09 0.44 1.57 -1.93 0.11 116.57 119.21 1den h LYS 48 Ca -0.36 -0.01 -0.33 0.00 -1.87 0.00 0.00 60.65 58.08 1den h LYS 48 Cb 1.14 -0.02 -0.16 0.00 0.08 0.00 0.00 32.23 33.27 1den h LYS 48 CO 0.43 0.08 -0.72 0.95 -0.57 0.00 0.00 179.45 179.61 1den s THR 49 N -6.15 1.15 0.55 -0.16 -4.23 -1.26 -4.60 115.64 100.93 1den s THR 49 Ca -0.13 -1.95 0.26 0.00 -1.18 0.00 0.00 61.69 58.69 1den s THR 49 Cb 0.07 -1.72 0.32 0.00 1.34 0.00 0.00 72.50 72.51 1den s THR 49 CO 0.67 -0.68 2.20 -0.29 -0.54 0.00 0.00 174.62 175.99 1den h ILE 50 N 3.01 0.67 0.02 2.99 2.10 -1.88 0.97 117.51 125.39 1den h ILE 50 Ca -0.37 -0.09 -0.00 0.00 1.08 0.00 0.00 64.86 65.48 1den h ILE 50 Cb 1.19 1.06 0.00 0.00 -1.09 0.00 0.00 36.82 37.98 1den h ILE 50 CO 0.60 0.02 -0.01 -0.33 -1.08 0.00 0.00 178.15 177.36 1den h GLU 51 N 0.00 -0.02 -0.72 2.19 5.08 -1.97 -1.86 114.58 117.29 1den h GLU 51 Ca -0.00 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.50 1den h GLU 51 Cb 0.05 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 1den h GLU 51 CO 0.00 0.52 0.48 0.93 -1.00 0.00 0.00 179.01 179.94 1den h GLU 52 N -0.99 0.38 0.51 2.33 5.08 -1.96 0.30 114.58 120.24 1den h GLU 52 Ca -0.00 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1den h GLU 52 Cb 0.55 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.72 1den h GLU 52 CO 0.00 0.25 -0.25 0.00 -1.00 0.00 0.00 179.01 178.02 1den h ARG 54 N -0.97 0.00 -0.74 0.00 3.08 -0.54 -0.10 114.38 115.11 1den h ARG 54 Ca -0.07 0.00 0.15 0.00 0.07 0.00 0.00 59.98 60.13 1den h ARG 54 Cb 0.53 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.53 1den h ARG 54 CO 0.12 0.07 0.49 0.00 -1.07 0.00 0.00 179.97 179.58 1den h ARG 55 N 0.00 0.38 0.00 0.04 2.47 -0.48 -0.99 114.38 115.80 1den h ARG 55 Ca -0.00 -0.02 -0.13 0.00 -1.26 0.00 0.00 59.98 58.57 1den h ARG 55 Cb 0.22 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.43 1den h ARG 55 CO 0.01 0.25 -1.48 2.41 0.56 0.00 0.00 179.97 181.72 1den n THR 56 N -4.47 0.48 -0.04 2.04 -1.04 -1.10 -3.98 114.28 106.17 1den n THR 56 Ca 0.14 -0.20 -0.14 0.00 -2.04 0.00 0.00 64.05 61.81 1den n THR 56 Cb 0.53 -0.80 -0.09 0.00 -1.82 0.00 0.00 70.33 68.15 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 -4.49 0.45 -1.16 0.00 2.08 -0.44 -4.90 119.36 110.90 1den n ILE 58 Ca -0.08 -0.54 0.11 0.00 0.56 0.00 0.00 62.75 62.80 1den n ILE 58 Cb 0.44 -0.24 -0.06 0.00 -0.75 0.00 0.00 39.64 39.03 1den n ILE 58 CO 0.00 0.00 0.00 -2.11 0.56 0.00 0.00 176.55 175.00 1den n ARG 59 N -2.55 -2.77 0.00 0.38 -4.01 -0.83 -5.02 116.66 101.86 1den n ARG 59 Ca -0.02 2.25 0.00 0.00 -1.04 0.00 0.00 57.85 59.04 1den n ARG 59 Cb 0.57 -3.10 0.00 0.00 -3.04 0.00 0.00 32.46 26.89 1den n ARG 59 CO 0.00 0.00 0.00 1.63 -3.04 0.00 0.00 177.63 176.22