#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 1.57 -1.88 2.61 -0.02 -1.26 -4.92 135.00 131.10 1den n PRO 2 Ca 0.00 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1den n PRO 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1den n PRO 2 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1den n LEU 3 N 0.00 -3.26 -4.78 2.45 4.77 -0.04 -5.00 117.00 111.15 1den n LEU 3 Ca 0.00 0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.70 1den n LEU 3 Cb 0.00 -1.59 0.12 0.00 -2.33 0.00 0.00 43.42 39.62 1den n LEU 3 CO 0.00 -0.34 0.70 -0.13 -1.33 0.00 0.00 177.39 176.29 1den s ARG 4 N -2.72 1.52 0.27 3.23 0.52 -1.26 -5.00 118.95 115.52 1den s ARG 4 Ca 0.01 0.54 0.19 0.00 -0.52 0.00 0.00 55.73 55.95 1den s ARG 4 Cb -0.00 -1.86 0.09 0.00 0.52 0.00 0.00 34.95 33.70 1den s ARG 4 CO 0.19 -1.99 1.32 -0.22 0.02 0.00 0.00 175.30 174.62 1den h LYS 5 N -1.35 0.00 -0.25 3.54 3.64 -1.98 -3.29 116.57 116.87 1den h LYS 5 Ca -0.49 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 58.96 1den h LYS 5 Cb 1.30 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.11 1den h LYS 5 CO 0.59 0.25 0.29 1.25 -2.27 0.00 0.00 179.45 179.56 1den h LEU 6 N 0.00 0.00 -2.67 5.20 5.85 -2.02 -2.46 115.31 119.21 1den h LEU 6 Ca -0.03 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 1den h LEU 6 Cb 1.25 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 1den h LEU 6 CO 0.03 0.00 -0.01 0.00 -0.34 0.00 0.00 178.44 178.12 1den n ILE 8 N -3.35 0.09 1.07 0.00 -5.35 -0.93 -4.26 119.36 106.63 1den n ILE 8 Ca -0.03 -0.43 0.13 0.00 -0.27 0.00 0.00 62.75 62.15 1den n ILE 8 Cb 0.10 0.97 0.34 0.00 -1.74 0.00 0.00 39.64 39.31 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 0.85 0.53 0.00 7.28 4.77 -0.91 -5.06 117.00 124.47 1den n LEU 9 Ca 0.17 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1den n LEU 9 Cb 0.49 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1den n LEU 9 CO 0.15 0.12 0.00 1.41 -1.33 0.00 0.00 177.39 177.74 1den n HIS 10 N -1.32 -0.57 -0.70 -1.77 8.25 -1.26 -4.81 115.22 113.05 1den n HIS 10 Ca 0.07 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.22 1den n HIS 10 Cb 0.33 0.13 0.16 0.00 1.12 0.00 0.00 29.99 31.74 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 0.00 -0.62 -2.93 -0.41 0.00 -1.26 -4.60 116.66 106.84 1den n ARG 11 Ca 0.00 -0.13 -0.06 0.00 -0.00 0.00 0.00 57.85 57.67 1den n ARG 11 Cb 0.00 -2.15 -0.01 0.00 -0.00 0.00 0.00 32.46 30.30 1den n ARG 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1den s ASN 12 N -2.37 -1.08 -1.13 2.89 2.20 -1.26 -4.94 114.94 109.25 1den s ASN 12 Ca 0.63 -1.67 -0.22 0.00 -0.94 0.00 0.00 52.86 50.66 1den s ASN 12 Cb -0.22 1.64 -0.01 0.00 -2.00 0.00 0.00 41.25 40.66 1den s ASN 12 CO 0.62 -0.09 1.80 -2.16 -2.94 0.00 0.00 177.10 174.32 1den s PRO 13 N 1.01 3.12 -0.23 3.55 0.04 -1.26 -4.50 135.00 136.73 1den s PRO 13 Ca 0.27 -1.21 -0.34 0.00 0.04 0.00 0.00 61.00 59.76 1den s PRO 13 Cb -0.01 -5.31 -0.11 0.00 0.04 0.00 0.00 34.50 29.11 1den s PRO 13 CO -0.07 -3.06 2.05 0.41 0.04 0.00 0.00 177.00 176.38 1den n GLY 14 N 6.10 0.95 3.49 0.56 0.00 -1.25 -4.57 105.19 110.47 1den n GLY 14 Ca 0.43 0.88 -0.43 0.00 0.00 0.00 0.00 46.02 46.90 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 7.54 0.71 -0.15 1.61 0.63 -1.26 -1.12 116.66 124.63 1den n ARG 15 Ca 0.32 0.10 0.00 0.00 -0.92 0.00 0.00 57.85 57.34 1den n ARG 15 Cb 0.28 -2.47 0.00 0.00 0.45 0.00 0.00 32.46 30.72 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 -1.90 -3.94 0.00 4.11 -1.26 -4.85 117.16 109.32 1den n TYR 17 Ca 0.00 0.46 -0.12 0.00 -0.00 0.00 0.00 57.90 58.24 1den n TYR 17 Cb 0.51 -3.31 -0.01 0.00 -0.00 0.00 0.00 39.34 36.53 1den n TYR 17 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.86 177.80 1den n GLN 18 N -4.05 0.87 -3.65 -3.48 -0.06 -1.26 -5.05 117.38 100.70 1den n GLN 18 Ca -0.11 -2.54 -0.09 0.00 -2.00 0.00 0.00 57.00 52.26 1den n GLN 18 Cb 0.59 2.70 -0.08 0.00 -4.06 0.00 0.00 30.24 29.39 1den n GLN 18 CO 0.00 0.00 0.00 0.21 -0.20 0.00 0.00 177.06 177.07 1den s LYS 19 N -2.50 0.68 -0.21 3.69 2.20 -1.10 -4.36 119.74 118.13 1den s LYS 19 Ca 0.23 1.07 -0.10 0.00 -0.36 0.00 0.00 55.97 56.82 1den s LYS 19 Cb -0.03 0.18 0.08 0.00 -1.51 0.00 0.00 37.83 36.55 1den s LYS 19 CO 0.17 -0.13 0.49 0.42 -0.36 0.00 0.00 175.35 175.93 1den s ILE 20 N 1.25 -0.33 0.29 5.43 -1.09 0.11 -4.96 121.20 121.89 1den s ILE 20 Ca -0.07 0.09 -0.29 0.00 -2.23 0.00 0.00 60.65 58.15 1den s ILE 20 Cb -0.05 -0.74 -0.09 0.00 -1.58 0.00 0.00 42.46 40.00 1den s ILE 20 CO -0.13 0.04 1.06 -2.84 -1.23 0.00 0.00 174.94 171.84 1den s PRO 21 N 2.00 4.61 0.00 2.79 0.02 -1.26 -0.64 135.00 142.51 1den s PRO 21 Ca -0.07 1.69 0.00 0.00 0.02 0.00 0.00 61.00 62.64 1den s PRO 21 Cb -0.09 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.33 1den s PRO 21 CO -0.15 0.22 0.00 0.00 -0.33 0.00 0.00 177.00 176.74 1den n ALA 22 N 1.04 0.00 -2.71 -1.55 0.00 -0.48 -4.85 120.51 111.96 1den n ALA 22 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 1den n ALA 22 Cb 0.46 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.82 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 -3.06 0.21 0.03 0.00 0.40 0.23 -0.81 117.98 114.98 1den s PHE 23 Ca 0.00 -0.52 0.01 0.00 -0.60 0.00 0.00 56.93 55.82 1den s PHE 23 Cb 0.00 -0.15 -0.02 0.00 0.51 0.00 0.00 43.02 43.36 1den s PHE 23 CO 0.00 -0.36 -0.05 1.52 0.70 0.00 0.00 175.22 177.03 1den s TYR 24 N -2.61 0.45 -0.28 0.36 1.13 0.30 -1.07 117.35 115.63 1den s TYR 24 Ca -0.05 -0.59 -0.29 0.00 -1.41 0.00 0.00 57.07 54.73 1den s TYR 24 Cb -0.01 -0.29 0.01 0.00 -1.10 0.00 0.00 41.96 40.56 1den s TYR 24 CO -0.05 -0.17 1.17 -0.47 -2.51 0.00 0.00 175.55 173.52 1den s TYR 25 N -1.78 2.99 -0.55 -3.49 5.04 -1.26 -0.34 117.35 117.96 1den s TYR 25 Ca -0.10 1.10 -0.20 0.00 -2.44 0.00 0.00 57.07 55.43 1den s TYR 25 Cb -0.08 -3.68 0.07 0.00 0.35 0.00 0.00 41.96 38.62 1den s TYR 25 CO -0.02 -1.15 0.71 -0.80 -1.34 0.00 0.00 175.55 172.95 1den s ASN 26 N 1.99 6.22 -0.09 4.32 -0.87 -0.62 -4.72 114.94 121.18 1den s ASN 26 Ca 0.50 -0.99 -0.02 0.00 -1.57 0.00 0.00 52.86 50.78 1den s ASN 26 Cb -0.15 -2.32 -0.02 0.00 -0.02 0.00 0.00 41.25 38.74 1den s ASN 26 CO 0.17 -1.04 2.43 0.00 -2.57 0.00 0.00 177.10 176.08 1den n GLN 27 N 6.51 1.46 0.00 -0.60 6.02 -1.26 -2.45 117.38 127.06 1den n GLN 27 Ca -0.06 -0.66 0.00 0.00 -0.01 0.00 0.00 57.00 56.27 1den n GLN 27 Cb 0.45 -1.41 0.00 0.00 1.02 0.00 0.00 30.24 30.30 1den n GLN 27 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 1den n LYS 28 N 1.49 2.72 0.00 -1.09 -0.00 -1.26 -5.00 118.16 115.02 1den n LYS 28 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.49 1den n LYS 28 Cb 0.61 -0.88 0.00 0.00 -0.00 0.00 0.00 35.03 34.76 1den n LYS 28 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1den n LYS 29 N -1.54 0.00 0.00 -1.58 3.00 -1.03 -5.11 118.16 111.90 1den n LYS 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1den n LYS 29 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.33 1den n LYS 29 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1den n LYS 30 N 0.00 0.00 -3.53 1.64 2.85 -1.20 -5.04 118.16 112.88 1den n LYS 30 Ca 0.00 0.00 -0.08 0.00 -1.05 0.00 0.00 58.31 57.18 1den n LYS 30 Cb 0.00 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.35 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 -0.59 -1.58 0.74 -1.26 -5.06 119.66 112.60 1den s GLN 31 Ca 0.00 -0.18 -0.25 0.00 0.05 0.00 0.00 55.36 54.98 1den s GLN 31 Cb 0.00 0.32 0.04 0.00 1.10 0.00 0.00 33.01 34.47 1den s GLN 31 CO 0.00 -0.29 1.00 0.00 -0.55 0.00 0.00 175.29 175.46 1den s GLU 33 N 4.24 4.21 0.33 0.00 -6.30 0.54 -4.68 118.70 117.04 1den s GLU 33 Ca 0.31 1.11 -0.26 0.00 -2.50 0.00 0.00 54.97 53.63 1den s GLU 33 Cb -0.12 -2.18 -0.10 0.00 0.00 0.00 0.00 34.13 31.73 1den s GLU 33 CO 0.18 -0.05 0.98 0.20 0.02 0.00 0.00 175.26 176.59 1den s GLY 34 N -2.24 2.82 0.07 -1.50 0.00 -1.26 -0.54 107.32 104.67 1den s GLY 34 Ca 0.62 0.59 -0.07 0.00 0.00 0.00 0.00 44.72 45.86 1den s GLY 34 CO 0.14 1.05 0.14 -0.11 0.00 0.00 0.00 173.10 174.32 1den s PHE 35 N -1.57 0.21 -0.42 1.90 -0.71 0.01 -4.87 117.98 112.53 1den s PHE 35 Ca 0.51 -0.62 -0.26 0.00 -1.04 0.00 0.00 56.93 55.52 1den s PHE 35 Cb -0.21 -0.13 0.02 0.00 -1.21 0.00 0.00 43.02 41.50 1den s PHE 35 CO 0.26 -0.47 0.94 0.99 -1.34 0.00 0.00 175.22 175.60 1den s THR 36 N -3.51 4.50 -0.24 -4.49 2.01 -1.26 -1.38 115.64 111.28 1den s THR 36 Ca 0.02 0.97 -0.12 0.00 0.31 0.00 0.00 61.69 62.87 1den s THR 36 Cb 0.04 -4.40 -0.05 0.00 0.01 0.00 0.00 72.50 68.10 1den s THR 36 CO -0.09 -0.72 0.22 0.86 -0.69 0.00 0.00 174.62 174.20 1den s TRP 37 N 3.68 3.31 0.00 4.92 -0.00 0.18 -4.61 118.94 126.42 1den s TRP 37 Ca 0.38 0.29 0.00 0.00 -0.00 0.00 0.00 56.10 56.77 1den s TRP 37 Cb -0.11 -2.34 0.00 0.00 -0.00 0.00 0.00 33.47 31.02 1den s TRP 37 CO 0.23 0.01 0.21 0.45 -0.00 0.00 0.00 176.95 177.85 1den n SER 38 N 4.46 0.00 0.00 5.86 2.88 -1.26 0.04 113.62 125.60 1den n SER 38 Ca -0.13 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 1den n SER 38 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1den n SER 38 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1den n GLY 39 N 0.93 1.93 3.48 0.46 0.00 -0.28 -2.72 105.19 108.99 1den n GLY 39 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 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 6.45 0.86 7.00 0.00 0.00 -1.26 -4.01 105.19 114.23 1den n GLY 41 Ca 0.49 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.70 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 2.28 0.00 -0.02 0.00 -1.26 -4.19 105.19 102.00 1den n GLY 42 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 9.05 0.00 0.00 1.61 4.13 -1.26 -4.99 115.26 123.79 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 -1.14 6.41 7.64 -1.26 -4.93 113.62 120.34 1den n SER 44 Ca 0.00 -0.31 0.00 0.00 1.01 0.00 0.00 58.87 59.57 1den n SER 44 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 2.54 -4.42 6.43 5.15 -1.26 -4.68 115.26 119.02 1den n ASN 45 Ca 0.00 -1.57 -0.44 0.00 -0.60 0.00 0.00 54.58 51.97 1den n ASN 45 Cb 0.08 -0.46 -0.03 0.00 -0.53 0.00 0.00 39.78 38.84 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 0.34 3.42 0.07 1.20 3.52 -1.26 -4.07 118.95 122.16 1den s ARG 46 Ca 0.00 -1.63 0.04 0.00 -0.13 0.00 0.00 55.73 54.01 1den s ARG 46 Cb 0.00 -4.62 -0.04 0.00 -1.56 0.00 0.00 34.95 28.73 1den s ARG 46 CO 0.00 -1.67 0.02 -0.06 -0.81 0.00 0.00 175.30 172.78 1den s PHE 47 N 2.55 3.05 -0.15 5.12 0.08 -0.23 -4.93 117.98 123.47 1den s PHE 47 Ca 0.25 0.02 -0.12 0.00 0.12 0.00 0.00 56.93 57.20 1den s PHE 47 Cb -0.11 -1.59 -0.24 0.00 -0.57 0.00 0.00 43.02 40.51 1den s PHE 47 CO -0.03 0.49 0.32 1.63 -0.10 0.00 0.00 175.22 177.52 1den n LYS 48 N 0.73 0.69 -4.28 0.44 4.01 -1.26 -0.60 118.16 117.90 1den n LYS 48 Ca -0.11 0.37 -0.21 0.00 -0.51 0.00 0.00 58.31 57.85 1den n LYS 48 Cb 0.52 -1.72 -0.12 0.00 -0.51 0.00 0.00 35.03 33.20 1den n LYS 48 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1den s THR 49 N -2.49 1.60 0.40 -0.18 -4.23 -1.26 -4.81 115.64 104.66 1den s THR 49 Ca -0.25 -1.69 0.15 0.00 -1.18 0.00 0.00 61.69 58.72 1den s THR 49 Cb 0.06 -1.60 0.15 0.00 1.34 0.00 0.00 72.50 72.45 1den s THR 49 CO 0.71 -0.25 1.92 0.40 -0.54 0.00 0.00 174.62 176.85 1den h ILE 50 N 3.67 1.12 0.27 2.99 2.04 -1.93 -2.84 117.51 122.83 1den h ILE 50 Ca -0.43 -0.94 -0.01 0.00 1.00 0.00 0.00 64.86 64.48 1den h ILE 50 Cb 1.19 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 38.79 1den h ILE 50 CO 0.46 0.26 -0.13 -0.33 0.00 0.00 0.00 178.15 178.42 1den h GLU 51 N 0.00 -0.34 -1.12 2.37 5.08 -1.97 -1.88 114.58 116.72 1den h GLU 51 Ca -0.00 0.02 0.31 0.00 -1.00 0.00 0.00 59.36 58.69 1den h GLU 51 Cb 0.50 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.74 1den h GLU 51 CO 0.03 0.01 0.75 0.93 -1.00 0.00 0.00 179.01 179.73 1den h GLU 52 N -0.87 0.22 0.26 2.33 3.07 -1.98 0.54 114.58 118.15 1den h GLU 52 Ca -0.04 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.80 1den h GLU 52 Cb 0.51 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 1den h GLU 52 CO 0.06 0.15 -0.13 0.00 -1.40 0.00 0.00 179.01 177.69 1den h ARG 54 N -1.01 0.00 -0.92 0.00 2.47 -0.20 -1.67 114.38 113.05 1den h ARG 54 Ca -0.04 0.00 0.15 0.00 -1.26 0.00 0.00 59.98 58.83 1den h ARG 54 Cb 0.43 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.68 1den h ARG 54 CO 0.06 0.16 0.59 0.00 0.56 0.00 0.00 179.97 181.33 1den h ARG 55 N 0.00 0.71 0.00 0.04 2.47 -0.09 0.11 114.38 117.63 1den h ARG 55 Ca -0.00 -0.04 -0.28 0.00 -1.26 0.00 0.00 59.98 58.40 1den h ARG 55 Cb 0.30 -0.16 -0.05 0.00 -1.65 0.00 0.00 29.97 28.41 1den h ARG 55 CO 0.02 0.47 -2.05 -2.37 0.56 0.00 0.00 179.97 176.60 1den n THR 56 N -4.58 1.06 0.25 2.04 5.66 -1.18 -3.38 114.28 114.14 1den n THR 56 Ca 0.18 -0.42 0.12 0.00 -3.05 0.00 0.00 64.05 60.88 1den n THR 56 Cb 0.47 -1.13 0.16 0.00 -1.55 0.00 0.00 70.33 68.28 1den n THR 56 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1den n ILE 58 N -2.91 0.00 -1.44 0.00 2.08 0.36 -4.73 119.36 112.72 1den n ILE 58 Ca 0.03 -0.29 0.00 0.00 0.56 0.00 0.00 62.75 63.05 1den n ILE 58 Cb 0.52 0.86 0.00 0.00 -0.75 0.00 0.00 39.64 40.27 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 -1.30 0.00 0.00 0.38 0.63 -1.05 -4.98 116.66 110.34 1den n ARG 59 Ca 0.01 0.00 0.16 0.00 -0.92 0.00 0.00 57.85 57.10 1den n ARG 59 Cb 0.13 0.00 0.94 0.00 0.45 0.00 0.00 32.46 33.98 1den n ARG 59 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29