#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 -0.04 -0.16 3.69 0.04 -1.26 -4.84 135.00 132.43 1den s PRO 2 Ca 0.00 0.82 -0.28 0.00 0.04 0.00 0.00 61.00 61.58 1den s PRO 2 Cb 0.00 -1.66 -0.06 0.00 0.04 0.00 0.00 34.50 32.82 1den s PRO 2 CO 0.00 -3.13 2.14 -1.17 0.04 0.00 0.00 177.00 174.88 1den s LEU 3 N -6.80 3.68 1.04 -3.56 0.20 -1.26 -4.93 118.68 107.05 1den s LEU 3 Ca 0.67 2.05 -0.15 0.00 0.69 0.00 0.00 54.13 57.38 1den s LEU 3 Cb -0.22 -3.52 0.21 0.00 -0.43 0.00 0.00 46.19 42.24 1den s LEU 3 CO 0.61 -1.74 1.14 -0.13 -0.29 0.00 0.00 176.35 175.94 1den s ARG 4 N 5.88 0.04 -0.14 1.98 1.81 -1.26 -5.04 118.95 122.23 1den s ARG 4 Ca 0.97 0.13 -0.09 0.00 -1.72 0.00 0.00 55.73 55.02 1den s ARG 4 Cb -0.35 -1.73 -0.24 0.00 -0.45 0.00 0.00 34.95 32.18 1den s ARG 4 CO 0.36 -2.91 0.30 1.17 -0.68 0.00 0.00 175.30 173.55 1den n LYS 5 N -4.23 0.72 0.01 3.54 4.81 -1.26 -4.13 118.16 117.62 1den n LYS 5 Ca 0.10 0.30 0.03 0.00 -0.87 0.00 0.00 58.31 57.87 1den n LYS 5 Cb 0.59 -1.70 0.14 0.00 0.02 0.00 0.00 35.03 34.08 1den n LYS 5 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 1den n LEU 6 N -3.63 0.03 -0.01 3.14 -0.00 -1.26 -2.43 117.00 112.83 1den n LEU 6 Ca -0.33 0.51 -0.18 0.00 -0.00 0.00 0.00 56.01 56.01 1den n LEU 6 Cb 0.99 -0.51 -0.14 0.00 -0.00 0.00 0.00 43.42 43.76 1den n LEU 6 CO 0.38 -0.42 0.03 0.00 -0.00 0.00 0.00 177.39 177.38 1den n ILE 8 N -4.29 2.05 -0.09 0.00 -5.35 -1.02 -4.34 119.36 106.31 1den n ILE 8 Ca -0.16 -0.97 -0.10 0.00 -0.27 0.00 0.00 62.75 61.24 1den n ILE 8 Cb 0.70 -0.65 -0.04 0.00 -1.74 0.00 0.00 39.64 37.92 1den n ILE 8 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 1den n LEU 9 N -0.24 1.88 0.00 7.28 -0.00 -1.17 -5.08 117.00 119.68 1den n LEU 9 Ca 0.29 0.46 0.00 0.00 -0.00 0.00 0.00 56.01 56.76 1den n LEU 9 Cb 1.06 -0.82 0.00 0.00 -0.00 0.00 0.00 43.42 43.66 1den n LEU 9 CO 0.30 -0.23 0.00 1.41 -0.00 0.00 0.00 177.39 178.86 1den n HIS 10 N -4.50 0.00 -1.49 1.96 8.25 -1.26 -5.09 115.22 113.09 1den n HIS 10 Ca -0.16 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 56.91 1den n HIS 10 Cb 0.46 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.61 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 2.77 0.61 -3.14 -0.41 0.00 -1.26 -4.80 116.66 110.42 1den n ARG 11 Ca 0.00 0.23 -0.20 0.00 -0.00 0.00 0.00 57.85 57.88 1den n ARG 11 Cb 0.00 -1.73 -0.05 0.00 -0.00 0.00 0.00 32.46 30.68 1den n ARG 11 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1den n ASN 12 N 0.52 -0.89 -0.26 2.89 3.02 -1.26 -5.02 115.26 114.26 1den n ASN 12 Ca 0.12 -2.70 -0.12 0.00 -0.03 0.00 0.00 54.58 51.84 1den n ASN 12 Cb 0.46 0.01 -0.10 0.00 -0.61 0.00 0.00 39.78 39.54 1den n ASN 12 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1den h PRO 13 N 4.63 -0.20 0.00 3.52 0.11 -1.89 -2.72 132.00 135.45 1den h PRO 13 Ca 0.10 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1den h PRO 13 Cb 0.94 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1den h PRO 13 CO 0.36 -0.13 0.00 0.41 -0.21 0.00 0.00 178.00 178.43 1den n GLY 14 N -1.30 2.19 3.44 -0.55 0.00 -1.26 -3.25 105.19 104.46 1den n GLY 14 Ca -0.01 -1.92 -0.44 0.00 0.00 0.00 0.00 46.02 43.65 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 -2.88 3.70 0.00 1.61 3.52 -1.26 -4.63 118.95 119.01 1den s ARG 15 Ca 0.00 -2.00 0.00 0.00 -0.13 0.00 0.00 55.73 53.60 1den s ARG 15 Cb 0.00 -4.89 0.00 0.00 -1.56 0.00 0.00 34.95 28.50 1den s ARG 15 CO 0.00 -1.71 0.00 0.00 -0.81 0.00 0.00 175.30 172.78 1den s TYR 17 N -0.69 -0.68 -0.36 0.00 1.13 -1.26 -4.87 117.35 110.62 1den s TYR 17 Ca 0.00 0.29 -0.41 0.00 -1.41 0.00 0.00 57.07 55.54 1den s TYR 17 Cb 0.00 0.12 -0.16 0.00 -1.10 0.00 0.00 41.96 40.82 1den s TYR 17 CO 0.00 -0.42 1.87 0.94 -2.51 0.00 0.00 175.55 175.43 1den n GLN 18 N 4.64 0.79 0.00 -3.49 7.27 -1.26 -1.01 117.38 124.32 1den n GLN 18 Ca 0.08 0.27 0.00 0.00 0.07 0.00 0.00 57.00 57.42 1den n GLN 18 Cb 0.59 -1.99 0.00 0.00 2.41 0.00 0.00 30.24 31.25 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 6.02 0.00 -3.25 3.69 3.00 -0.32 -4.90 118.16 122.39 1den n LYS 19 Ca 0.34 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 58.39 1den n LYS 19 Cb 0.09 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 35.06 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 1.87 -1.92 3.15 2.08 -1.17 -5.00 119.36 118.38 1den n ILE 20 Ca 0.00 -5.07 -0.42 0.00 0.56 0.00 0.00 62.75 57.82 1den n ILE 20 Cb 0.00 -1.79 -0.03 0.00 -0.75 0.00 0.00 39.64 37.08 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 -2.51 4.21 0.00 0.38 0.04 -1.26 -3.40 135.00 132.46 1den s PRO 21 Ca 0.41 2.39 0.00 0.00 0.04 0.00 0.00 61.00 63.84 1den s PRO 21 Cb 0.20 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.61 1den s PRO 21 CO -0.06 -0.58 0.00 0.00 0.04 0.00 0.00 177.00 176.40 1den n ALA 22 N 3.43 0.00 -2.35 8.56 0.00 -0.54 -4.94 120.51 124.66 1den n ALA 22 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.37 1den n ALA 22 Cb 0.38 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.73 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 0.72 1.70 0.00 0.00 0.08 0.16 -1.20 117.98 119.43 1den s PHE 23 Ca 0.00 -0.63 -0.00 0.00 0.12 0.00 0.00 56.93 56.41 1den s PHE 23 Cb 0.00 -0.84 -0.01 0.00 -0.57 0.00 0.00 43.02 41.60 1den s PHE 23 CO 0.00 0.29 0.00 1.52 -0.10 0.00 0.00 175.22 176.93 1den s TYR 24 N -3.04 0.09 -0.39 0.36 -0.85 1.00 -1.59 117.35 112.92 1den s TYR 24 Ca 0.23 -0.19 -0.29 0.00 -0.52 0.00 0.00 57.07 56.31 1den s TYR 24 Cb 0.01 -0.07 0.02 0.00 0.38 0.00 0.00 41.96 42.30 1den s TYR 24 CO 0.07 -0.09 1.14 -0.47 -1.52 0.00 0.00 175.55 174.69 1den s TYR 25 N -0.60 2.91 -0.76 -3.49 6.14 -1.26 -0.24 117.35 120.06 1den s TYR 25 Ca -0.07 0.92 -0.27 0.00 0.64 0.00 0.00 57.07 58.30 1den s TYR 25 Cb -0.04 -4.08 0.03 0.00 0.42 0.00 0.00 41.96 38.29 1den s TYR 25 CO -0.00 -1.15 1.32 -0.80 0.64 0.00 0.00 175.55 175.56 1den s ASN 26 N 2.25 6.15 0.00 4.32 -0.87 -0.56 -4.87 114.94 121.35 1den s ASN 26 Ca 0.48 -0.50 -0.01 0.00 -1.57 0.00 0.00 52.86 51.26 1den s ASN 26 Cb -0.10 -2.56 -0.07 0.00 -0.02 0.00 0.00 41.25 38.50 1den s ASN 26 CO 0.24 -1.84 2.36 0.00 -2.57 0.00 0.00 177.10 175.30 1den n GLN 27 N 9.33 1.22 0.00 -0.60 6.02 -1.26 -1.97 117.38 130.12 1den n GLN 27 Ca 0.06 -0.24 0.00 0.00 -0.01 0.00 0.00 57.00 56.81 1den n GLN 27 Cb 0.49 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.50 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 1.76 0.34 0.00 -1.09 4.01 -1.26 -5.02 118.16 116.90 1den n LYS 28 Ca 0.10 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.90 1den n LYS 28 Cb 0.59 -0.85 0.00 0.00 -0.51 0.00 0.00 35.03 34.27 1den n LYS 28 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1den n LYS 29 N -2.11 0.00 0.00 1.97 4.81 -0.83 -5.11 118.16 116.89 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 0.35 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.40 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 -3.73 1.64 2.85 -1.16 -5.01 118.16 112.75 1den n LYS 30 Ca 0.00 0.00 -0.14 0.00 -1.05 0.00 0.00 58.31 57.12 1den n LYS 30 Cb 0.00 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.30 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 0.69 -0.68 -1.58 0.74 -1.26 -5.04 119.66 112.52 1den s GLN 31 Ca 0.00 -0.05 -0.19 0.00 0.05 0.00 0.00 55.36 55.17 1den s GLN 31 Cb 0.00 0.31 0.11 0.00 1.10 0.00 0.00 33.01 34.54 1den s GLN 31 CO 0.00 -0.19 0.82 0.00 -0.55 0.00 0.00 175.29 175.38 1den s GLU 33 N 2.66 3.56 0.38 0.00 2.56 0.66 -4.63 118.70 123.88 1den s GLU 33 Ca 0.17 0.75 -0.24 0.00 0.00 0.00 0.00 54.97 55.65 1den s GLU 33 Cb -0.18 -2.08 -0.10 0.00 2.00 0.00 0.00 34.13 33.77 1den s GLU 33 CO 0.03 -0.60 0.99 0.20 -0.56 0.00 0.00 175.26 175.32 1den s GLY 34 N -4.18 2.69 0.03 -1.50 0.00 -1.26 -0.00 107.32 103.11 1den s GLY 34 Ca 0.55 0.58 -0.09 0.00 0.00 0.00 0.00 44.72 45.76 1den s GLY 34 CO 0.54 0.98 0.18 -0.11 0.00 0.00 0.00 173.10 174.69 1den s PHE 35 N -1.74 0.07 -0.32 1.90 -0.71 -0.34 -4.78 117.98 112.06 1den s PHE 35 Ca 0.56 -0.28 -0.09 0.00 -1.04 0.00 0.00 56.93 56.07 1den s PHE 35 Cb -0.18 -0.05 0.00 0.00 -1.21 0.00 0.00 43.02 41.58 1den s PHE 35 CO 0.23 -0.40 0.14 0.99 -1.34 0.00 0.00 175.22 174.84 1den s THR 36 N -2.41 4.44 0.62 -4.49 2.01 -1.26 -1.47 115.64 113.08 1den s THR 36 Ca -0.06 -0.56 -0.12 0.00 0.31 0.00 0.00 61.69 61.27 1den s THR 36 Cb -0.02 -3.30 -0.04 0.00 0.01 0.00 0.00 72.50 69.15 1den s THR 36 CO -0.03 0.02 1.03 0.86 -0.69 0.00 0.00 174.62 175.81 1den s TRP 37 N 1.58 3.54 0.07 4.92 -0.00 -1.22 -4.75 118.94 123.08 1den s TRP 37 Ca 0.04 1.32 0.05 0.00 -0.00 0.00 0.00 56.10 57.51 1den s TRP 37 Cb -0.17 -2.75 -0.03 0.00 -0.00 0.00 0.00 33.47 30.52 1den s TRP 37 CO 0.05 -0.73 -0.14 0.45 -0.00 0.00 0.00 176.95 176.58 1den s SER 38 N -4.02 1.69 0.03 5.86 0.15 -1.20 -1.18 113.70 115.04 1den s SER 38 Ca 0.56 -0.63 -0.01 0.00 0.70 0.00 0.00 55.95 56.57 1den s SER 38 Cb -0.11 -0.05 0.05 0.00 -1.71 0.00 0.00 66.02 64.20 1den s SER 38 CO 0.52 -0.08 0.20 0.61 1.20 0.00 0.00 173.24 175.69 1den n GLY 39 N 1.23 -0.22 3.38 9.45 0.00 -0.18 -4.34 105.19 114.51 1den n GLY 39 Ca -0.21 0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 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 4.76 4.71 0.00 0.00 0.00 -1.20 -4.09 105.19 109.38 1den n GLY 41 Ca -0.17 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 0.94 0.00 -0.02 0.00 -1.02 -4.98 105.19 100.11 1den n GLY 42 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 4.13 -1.26 -5.01 115.26 114.72 1den n ASN 43 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1den n ASN 43 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 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 -1.84 6.41 7.64 -1.26 -4.86 113.62 119.70 1den n SER 44 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 1den n SER 44 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 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 -0.41 -4.02 -4.67 6.43 2.85 -1.06 -4.29 115.26 110.10 1den n ASN 45 Ca 0.00 0.27 -0.39 0.00 -0.11 0.00 0.00 54.58 54.35 1den n ASN 45 Cb 0.00 -3.57 -0.07 0.00 1.24 0.00 0.00 39.78 37.39 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 -3.98 4.20 -0.04 1.20 3.52 -1.26 -4.11 118.95 118.49 1den s ARG 46 Ca 0.00 0.41 -0.02 0.00 -0.13 0.00 0.00 55.73 55.99 1den s ARG 46 Cb 0.00 -3.55 0.02 0.00 -1.56 0.00 0.00 34.95 29.86 1den s ARG 46 CO 0.00 -0.12 0.10 -0.06 -0.81 0.00 0.00 175.30 174.41 1den s PHE 47 N 1.53 -0.10 0.01 5.12 0.08 -0.62 -4.99 117.98 119.01 1den s PHE 47 Ca 0.24 0.29 -0.20 0.00 0.12 0.00 0.00 56.93 57.38 1den s PHE 47 Cb -0.15 -0.05 -0.21 0.00 -0.57 0.00 0.00 43.02 42.04 1den s PHE 47 CO 0.10 -0.09 1.16 0.87 -0.10 0.00 0.00 175.22 177.15 1den h LYS 48 N 6.61 0.40 -6.34 0.44 6.56 -1.96 0.47 116.57 122.75 1den h LYS 48 Ca -0.34 -0.36 -0.60 0.00 -1.06 0.00 0.00 60.65 58.29 1den h LYS 48 Cb 1.17 0.09 -0.20 0.00 -0.57 0.00 0.00 32.23 32.72 1den h LYS 48 CO 0.45 1.01 -0.82 0.95 -2.06 0.00 0.00 179.45 178.99 1den s THR 49 N -3.47 2.02 0.36 -0.16 -4.23 -1.26 -4.70 115.64 104.21 1den s THR 49 Ca -0.14 -1.84 0.25 0.00 -1.18 0.00 0.00 61.69 58.79 1den s THR 49 Cb 0.04 -1.88 0.26 0.00 1.34 0.00 0.00 72.50 72.26 1den s THR 49 CO 0.80 -0.13 2.01 0.40 -0.54 0.00 0.00 174.62 177.16 1den h ILE 50 N 3.53 0.64 0.12 2.99 2.04 -1.88 -1.72 117.51 123.23 1den h ILE 50 Ca -0.46 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 64.70 1den h ILE 50 Cb 1.19 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 1den h ILE 50 CO 0.45 0.16 -0.06 -0.33 0.00 0.00 0.00 178.15 178.38 1den h GLU 51 N 0.00 -0.15 -0.99 2.37 5.08 -1.97 -1.69 114.58 117.23 1den h GLU 51 Ca -0.00 0.01 0.20 0.00 -1.00 0.00 0.00 59.36 58.57 1den h GLU 51 Cb 0.43 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.62 1den h GLU 51 CO 0.02 0.33 0.62 0.93 -1.00 0.00 0.00 179.01 179.91 1den h GLU 52 N -0.86 0.64 0.49 2.33 5.08 -1.96 0.46 114.58 120.75 1den h GLU 52 Ca -0.02 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1den h GLU 52 Cb 0.55 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1den h GLU 52 CO 0.03 0.42 -0.23 0.00 -1.00 0.00 0.00 179.01 178.23 1den h ARG 54 N -0.97 0.00 -0.17 0.00 2.47 -0.32 -0.66 114.38 114.72 1den h ARG 54 Ca -0.07 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.60 1den h ARG 54 Cb 0.60 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.90 1den h ARG 54 CO 0.11 0.09 -0.14 0.00 0.56 0.00 0.00 179.97 180.59 1den h ARG 55 N 0.00 0.28 0.00 0.04 2.47 -0.12 -0.91 114.38 116.14 1den h ARG 55 Ca -0.00 -0.07 -0.25 0.00 -1.26 0.00 0.00 59.98 58.40 1den h ARG 55 Cb 0.51 -0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 28.76 1den h ARG 55 CO 0.01 0.43 -1.77 2.41 0.56 0.00 0.00 179.97 181.62 1den n THR 56 N -4.25 1.40 0.05 2.04 -1.04 -1.14 -3.45 114.28 107.90 1den n THR 56 Ca -0.00 -0.13 -0.06 0.00 -2.04 0.00 0.00 64.05 61.81 1den n THR 56 Cb 0.29 -2.01 0.11 0.00 -1.82 0.00 0.00 70.33 66.89 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 -3.92 0.73 -2.45 0.00 2.08 -0.45 -4.89 119.36 110.46 1den n ILE 58 Ca -0.03 -0.68 -0.06 0.00 0.56 0.00 0.00 62.75 62.54 1den n ILE 58 Cb 0.60 -0.26 0.03 0.00 -0.75 0.00 0.00 39.64 39.25 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 -2.53 -1.13 0.00 0.38 0.00 -0.60 -5.00 116.66 107.78 1den n ARG 59 Ca -0.18 0.62 0.00 0.00 -0.00 0.00 0.00 57.85 58.29 1den n ARG 59 Cb 0.87 -3.90 0.00 0.00 0.00 0.00 0.00 32.46 29.43 1den n ARG 59 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26