#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 0.20 -6.93 -1.09 0.11 -2.02 -3.43 132.00 118.85 1den h PRO 2 Ca 0.00 -0.01 -0.56 0.00 0.11 0.00 0.00 66.00 65.54 1den h PRO 2 Cb 0.00 -0.05 0.13 0.00 0.11 0.00 0.00 31.00 31.20 1den h PRO 2 CO 0.00 0.13 0.54 1.47 -0.21 0.00 0.00 178.00 179.93 1den n LEU 3 N -5.16 4.69 -4.78 2.35 -0.00 -1.26 -4.99 117.00 107.86 1den n LEU 3 Ca 0.07 1.04 -0.30 0.00 -0.00 0.00 0.00 56.01 56.82 1den n LEU 3 Cb 0.28 -1.54 0.10 0.00 -0.00 0.00 0.00 43.42 42.26 1den n LEU 3 CO 0.18 -0.63 0.70 -0.13 -0.00 0.00 0.00 177.39 177.50 1den s ARG 4 N -2.52 2.02 0.24 1.47 0.52 -1.24 -4.99 118.95 114.46 1den s ARG 4 Ca 0.66 0.81 0.25 0.00 -0.52 0.00 0.00 55.73 56.93 1den s ARG 4 Cb -0.46 -1.90 0.66 0.00 0.52 0.00 0.00 34.95 33.77 1den s ARG 4 CO 0.54 -1.71 1.68 1.57 0.02 0.00 0.00 175.30 177.41 1den h LYS 5 N -1.16 0.00 0.00 3.54 2.10 -1.94 -3.21 116.57 115.90 1den h LYS 5 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1den h LYS 5 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1den h LYS 5 CO 0.57 0.00 0.00 1.25 -2.00 0.00 0.00 179.45 179.27 1den h LEU 6 N 0.00 0.00 -3.91 7.07 5.85 -1.99 -2.20 115.31 120.12 1den h LEU 6 Ca 0.00 0.00 -0.49 0.00 0.84 0.00 0.00 57.88 58.23 1den h LEU 6 Cb 0.79 0.00 -0.29 0.00 0.37 0.00 0.00 40.66 41.53 1den h LEU 6 CO 0.00 0.00 0.62 0.00 -0.34 0.00 0.00 178.44 178.72 1den n ILE 8 N -1.06 0.00 0.00 0.00 5.41 -0.83 -5.00 119.36 117.89 1den n ILE 8 Ca 0.57 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.32 1den n ILE 8 Cb 1.63 0.87 0.00 0.00 -0.71 0.00 0.00 39.64 41.42 1den n ILE 8 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1den n LEU 9 N 0.00 0.00 -3.56 1.39 4.77 -1.21 -5.11 117.00 113.28 1den n LEU 9 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 1den n LEU 9 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 1den n LEU 9 CO 0.00 0.00 0.66 -1.00 -1.33 0.00 0.00 177.39 175.72 1den s HIS 10 N 0.00 -0.48 -0.59 -1.77 3.76 -1.26 -5.11 115.29 109.85 1den s HIS 10 Ca 0.00 0.85 -0.27 0.00 -0.15 0.00 0.00 55.06 55.49 1den s HIS 10 Cb 0.00 0.43 0.00 0.00 1.11 0.00 0.00 32.58 34.12 1den s HIS 10 CO 0.00 -0.42 1.57 -0.98 -0.85 0.00 0.00 174.74 174.06 1den s ARG 11 N -1.01 3.07 -0.67 1.40 3.03 -1.26 -4.61 118.95 118.90 1den s ARG 11 Ca -0.04 0.47 -0.05 0.00 2.03 0.00 0.00 55.73 58.13 1den s ARG 11 Cb -0.01 -4.22 0.17 0.00 -1.03 0.00 0.00 34.95 29.86 1den s ARG 11 CO 0.04 -2.22 0.51 -0.80 -1.13 0.00 0.00 175.30 171.69 1den s ASN 12 N 5.63 5.57 0.29 -2.89 0.01 -1.26 -4.95 114.94 117.35 1den s ASN 12 Ca 0.56 -2.80 -0.01 0.00 -0.71 0.00 0.00 52.86 49.90 1den s ASN 12 Cb -0.12 -1.93 0.44 0.00 0.41 0.00 0.00 41.25 40.05 1den s ASN 12 CO 0.23 -0.42 1.90 1.55 -1.51 0.00 0.00 177.10 178.85 1den h PRO 13 N 7.22 0.94 0.00 -0.60 0.13 -1.85 -3.34 132.00 134.50 1den h PRO 13 Ca 0.01 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1den h PRO 13 Cb 0.97 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1den h PRO 13 CO 0.73 0.72 0.00 0.41 -0.23 0.00 0.00 178.00 179.63 1den n GLY 14 N -1.15 2.99 3.02 1.56 0.00 -1.22 -2.43 105.19 107.97 1den n GLY 14 Ca 0.06 -1.98 -0.43 0.00 0.00 0.00 0.00 46.02 43.68 1den n GLY 14 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1den n ARG 15 N -0.42 3.65 0.00 1.61 1.85 -1.26 -4.65 116.66 117.44 1den n ARG 15 Ca 0.00 -3.72 0.00 0.00 -1.00 0.00 0.00 57.85 53.13 1den n ARG 15 Cb 0.00 -2.90 0.00 0.00 -1.05 0.00 0.00 32.46 28.51 1den n ARG 15 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1den n TYR 17 N 0.00 0.00 -3.30 0.00 4.01 -1.26 -4.91 117.16 111.70 1den n TYR 17 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.77 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 1.85 0.23 0.00 -0.72 0.74 -0.01 -4.58 119.66 117.17 1den s GLN 18 Ca 0.00 0.54 0.00 0.00 0.05 0.00 0.00 55.36 55.95 1den s GLN 18 Cb 0.00 0.32 0.00 0.00 1.10 0.00 0.00 33.01 34.43 1den s GLN 18 CO 0.00 -0.13 0.00 1.17 -0.55 0.00 0.00 175.29 175.78 1den n LYS 19 N 5.04 0.00 -3.48 1.67 3.00 -0.31 -4.93 118.16 119.15 1den n LYS 19 Ca -0.08 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 57.96 1den n LYS 19 Cb 0.53 0.00 -0.10 0.00 0.00 0.00 0.00 35.03 35.47 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 -0.03 -2.05 3.15 2.08 -1.23 -5.01 119.36 116.27 1den n ILE 20 Ca 0.00 -4.09 -0.41 0.00 0.56 0.00 0.00 62.75 58.81 1den n ILE 20 Cb 0.00 -1.89 -0.02 0.00 -0.75 0.00 0.00 39.64 36.97 1den n ILE 20 CO 0.00 0.00 0.00 -2.84 0.56 0.00 0.00 176.55 174.27 1den s PRO 21 N -0.84 4.29 0.00 0.38 0.02 -1.26 -2.92 135.00 134.67 1den s PRO 21 Ca 0.32 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.60 1den s PRO 21 Cb 0.06 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.46 1den s PRO 21 CO -0.15 -0.38 0.00 0.00 -0.33 0.00 0.00 177.00 176.13 1den n ALA 22 N 2.29 0.00 -2.19 -1.55 0.00 -0.50 -4.92 120.51 113.65 1den n ALA 22 Ca 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.39 1den n ALA 22 Cb 0.41 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.76 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 0.50 1.01 -0.02 0.00 0.40 0.30 -1.12 117.98 119.06 1den s PHE 23 Ca 0.00 -1.19 -0.06 0.00 -0.60 0.00 0.00 56.93 55.08 1den s PHE 23 Cb 0.00 -0.57 0.01 0.00 0.51 0.00 0.00 43.02 42.97 1den s PHE 23 CO 0.00 -0.44 0.14 1.52 0.70 0.00 0.00 175.22 177.14 1den s TYR 24 N -3.94 -0.04 -0.55 0.36 1.13 0.35 -1.19 117.35 113.47 1den s TYR 24 Ca 0.26 0.08 -0.28 0.00 -1.41 0.00 0.00 57.07 55.72 1den s TYR 24 Cb 0.07 -0.01 0.02 0.00 -1.10 0.00 0.00 41.96 40.95 1den s TYR 24 CO 0.04 -0.20 1.27 -0.47 -2.51 0.00 0.00 175.55 173.68 1den s TYR 25 N -0.79 2.51 -0.45 -3.49 5.04 -1.26 -0.71 117.35 118.19 1den s TYR 25 Ca -0.09 0.49 -0.29 0.00 -2.44 0.00 0.00 57.07 54.74 1den s TYR 25 Cb -0.05 -4.45 0.03 0.00 0.35 0.00 0.00 41.96 37.83 1den s TYR 25 CO 0.01 -1.71 1.14 1.21 -1.34 0.00 0.00 175.55 174.86 1den s ASN 26 N 3.43 6.67 -0.25 4.32 3.04 -0.30 -4.90 114.94 126.95 1den s ASN 26 Ca 0.48 0.56 -0.04 0.00 0.04 0.00 0.00 52.86 53.91 1den s ASN 26 Cb -0.09 -2.55 -0.03 0.00 -1.54 0.00 0.00 41.25 37.04 1den s ASN 26 CO 0.27 -1.20 2.88 0.00 -3.04 0.00 0.00 177.10 176.01 1den n GLN 27 N 7.70 2.07 0.00 0.43 6.02 -1.26 -2.46 117.38 129.89 1den n GLN 27 Ca 0.12 -1.61 0.00 0.00 -0.01 0.00 0.00 57.00 55.50 1den n GLN 27 Cb 0.49 -1.93 0.00 0.00 1.02 0.00 0.00 30.24 29.82 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 1.37 0.11 0.00 -1.09 4.81 -1.26 -5.02 118.16 117.08 1den n LYS 28 Ca 0.40 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.84 1den n LYS 28 Cb 0.67 -0.65 0.00 0.00 0.02 0.00 0.00 35.03 35.07 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 -1.73 0.00 0.00 1.64 3.00 -1.03 -5.10 118.16 114.93 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 0.15 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.18 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 -1.22 1.64 2.85 -1.17 -5.03 118.16 115.23 1den n LYS 30 Ca 0.00 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.26 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 0.00 -0.05 0.00 0.00 177.40 177.35 1den n GLN 31 N 0.00 0.02 -2.74 -1.58 0.00 -1.26 -5.00 117.38 106.82 1den n GLN 31 Ca 0.00 -0.04 -0.43 0.00 0.00 0.00 0.00 57.00 56.53 1den n GLN 31 Cb 0.32 0.05 -0.03 0.00 0.00 0.00 0.00 30.24 30.57 1den n GLN 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1den s GLU 33 N 4.02 3.33 0.39 0.00 0.41 0.11 -4.81 118.70 122.14 1den s GLU 33 Ca 0.40 -0.18 -0.18 0.00 -0.41 0.00 0.00 54.97 54.61 1den s GLU 33 Cb -0.09 -2.51 -0.10 0.00 -1.78 0.00 0.00 34.13 29.65 1den s GLU 33 CO 0.28 -0.16 0.85 0.20 -0.49 0.00 0.00 175.26 175.94 1den s GLY 34 N -4.13 2.32 -0.04 -1.39 0.00 -1.26 -0.49 107.32 102.32 1den s GLY 34 Ca 0.46 0.20 -0.07 0.00 0.00 0.00 0.00 44.72 45.31 1den s GLY 34 CO 0.40 0.44 0.16 -0.11 0.00 0.00 0.00 173.10 174.00 1den s PHE 35 N -2.14 -0.10 -0.28 1.90 -0.71 -0.27 -4.74 117.98 111.64 1den s PHE 35 Ca 0.58 0.23 -0.12 0.00 -1.04 0.00 0.00 56.93 56.58 1den s PHE 35 Cb -0.10 0.02 -0.05 0.00 -1.21 0.00 0.00 43.02 41.69 1den s PHE 35 CO 0.17 -0.17 0.25 0.99 -1.34 0.00 0.00 175.22 175.12 1den s THR 36 N -0.51 5.26 0.43 -4.49 2.01 -1.26 -1.41 115.64 115.68 1den s THR 36 Ca -0.06 0.30 -0.24 0.00 0.31 0.00 0.00 61.69 62.01 1den s THR 36 Cb -0.04 -3.59 -0.08 0.00 0.01 0.00 0.00 72.50 68.80 1den s THR 36 CO 0.01 0.22 1.13 0.86 -0.69 0.00 0.00 174.62 176.15 1den s TRP 37 N 1.87 3.02 0.00 4.92 -0.00 -1.15 -4.75 118.94 122.84 1den s TRP 37 Ca 0.10 1.57 0.00 0.00 -0.00 0.00 0.00 56.10 57.77 1den s TRP 37 Cb -0.16 -3.31 0.00 0.00 -0.00 0.00 0.00 33.47 30.00 1den s TRP 37 CO 0.11 -1.23 0.00 0.45 -0.00 0.00 0.00 176.95 176.28 1den n SER 38 N -0.28 0.00 0.00 5.86 2.88 -1.02 -1.69 113.62 119.37 1den n SER 38 Ca 0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.60 1den n SER 38 Cb 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 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 2.82 0.08 2.97 0.46 0.00 -1.26 -0.83 105.19 109.43 1den n GLY 39 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 46.02 45.97 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 3.71 2.23 0.32 0.00 0.00 -1.26 -4.27 105.19 105.92 1den n GLY 41 Ca 0.12 -1.09 0.04 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.03 -1.79 0.00 -0.02 0.00 -1.26 -3.40 105.19 97.69 1den n GLY 42 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.59 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 -2.38 0.00 0.00 1.61 3.02 -1.25 -4.95 115.26 111.31 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 0.15 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 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 -2.35 6.41 7.64 -1.26 -4.93 113.62 119.13 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 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 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 -4.32 -4.70 6.43 4.05 -1.25 -4.17 115.26 111.30 1den n ASN 45 Ca 0.00 0.16 -0.38 0.00 0.45 0.00 0.00 54.58 54.81 1den n ASN 45 Cb 0.00 -3.67 -0.06 0.00 1.23 0.00 0.00 39.78 37.28 1den n ASN 45 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 177.26 173.61 1den s ARG 46 N -4.88 4.29 -0.10 1.20 3.52 -1.26 -4.15 118.95 117.56 1den s ARG 46 Ca 0.00 0.45 -0.07 0.00 -0.13 0.00 0.00 55.73 55.97 1den s ARG 46 Cb 0.00 -3.48 0.03 0.00 -1.56 0.00 0.00 34.95 29.94 1den s ARG 46 CO 0.00 0.04 0.25 -0.06 -0.81 0.00 0.00 175.30 174.73 1den s PHE 47 N 1.00 -0.31 -0.03 5.12 0.08 -0.34 -4.99 117.98 118.50 1den s PHE 47 Ca 0.26 0.74 -0.20 0.00 0.12 0.00 0.00 56.93 57.85 1den s PHE 47 Cb -0.15 0.08 -0.13 0.00 -0.57 0.00 0.00 43.02 42.25 1den s PHE 47 CO 0.10 -0.18 0.84 -0.22 -0.10 0.00 0.00 175.22 175.66 1den h LYS 48 N 6.36 -0.39 -6.47 0.44 1.63 -1.95 0.88 116.57 117.07 1den h LYS 48 Ca -0.32 0.03 -0.63 0.00 -0.85 0.00 0.00 60.65 58.88 1den h LYS 48 Cb 1.18 0.09 -0.15 0.00 -0.60 0.00 0.00 32.23 32.75 1den h LYS 48 CO 0.36 -0.08 -0.75 0.95 -3.45 0.00 0.00 179.45 176.48 1den s THR 49 N -3.61 2.97 0.36 1.00 -4.23 -1.26 -4.62 115.64 106.25 1den s THR 49 Ca -0.11 -1.79 0.31 0.00 -1.18 0.00 0.00 61.69 58.93 1den s THR 49 Cb 0.01 -2.47 0.34 0.00 1.34 0.00 0.00 72.50 71.72 1den s THR 49 CO 0.39 -0.13 2.08 0.40 -0.54 0.00 0.00 174.62 176.82 1den h ILE 50 N 2.81 0.34 0.07 2.99 2.04 -1.89 -1.52 117.51 122.34 1den h ILE 50 Ca -0.46 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 1den h ILE 50 Cb 1.21 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 1den h ILE 50 CO 0.53 0.08 -0.03 -0.33 0.00 0.00 0.00 178.15 178.40 1den h GLU 51 N 0.00 -0.09 -0.97 2.37 5.08 -1.97 -1.67 114.58 117.34 1den h GLU 51 Ca -0.00 0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.55 1den h GLU 51 Cb 0.36 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.54 1den h GLU 51 CO 0.01 0.42 0.61 0.93 -1.00 0.00 0.00 179.01 179.98 1den h GLU 52 N -0.94 0.65 0.54 2.33 5.08 -1.97 0.40 114.58 120.67 1den h GLU 52 Ca -0.01 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1den h GLU 52 Cb 0.55 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.66 1den h GLU 52 CO 0.02 0.43 -0.26 0.00 -1.00 0.00 0.00 179.01 178.20 1den h ARG 54 N -1.09 0.00 -0.33 0.00 3.08 -0.40 -0.31 114.38 115.33 1den h ARG 54 Ca -0.07 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 1den h ARG 54 Cb 0.61 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 1den h ARG 54 CO 0.12 0.09 0.19 0.00 -1.07 0.00 0.00 179.97 179.30 1den h ARG 55 N 0.00 0.44 0.00 0.04 2.47 -0.25 0.12 114.38 117.20 1den h ARG 55 Ca -0.00 -0.03 -0.38 0.00 -1.26 0.00 0.00 59.98 58.30 1den h ARG 55 Cb 0.22 -0.10 -0.06 0.00 -1.65 0.00 0.00 29.97 28.38 1den h ARG 55 CO 0.01 0.31 -2.35 2.41 0.56 0.00 0.00 179.97 180.92 1den n THR 56 N -4.47 1.34 0.12 2.04 -1.04 -1.05 -3.39 114.28 107.83 1den n THR 56 Ca 0.02 -0.42 -0.22 0.00 -2.04 0.00 0.00 64.05 61.39 1den n THR 56 Cb 0.08 -1.59 -0.15 0.00 -1.82 0.00 0.00 70.33 66.85 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 -3.64 0.00 0.00 0.00 2.08 -0.06 -4.90 119.36 112.84 1den n ILE 58 Ca -0.16 -0.12 0.00 0.00 0.56 0.00 0.00 62.75 63.03 1den n ILE 58 Cb 1.08 0.98 0.00 0.00 -0.75 0.00 0.00 39.64 40.95 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 -1.40 0.00 0.00 0.38 0.63 0.21 -4.96 116.66 111.52 1den n ARG 59 Ca 0.03 0.00 0.16 0.00 -0.92 0.00 0.00 57.85 57.12 1den n ARG 59 Cb 0.26 0.00 0.93 0.00 0.45 0.00 0.00 32.46 34.10 1den n ARG 59 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29