#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v47 s LYS 2 N 0.00 2.69 1.13 0.03 1.02 -1.26 -5.08 119.74 118.27 2v47 s LYS 2 Ca 0.00 -2.84 -0.13 0.00 0.02 0.00 0.00 55.97 53.02 2v47 s LYS 2 Cb 0.00 -3.72 0.26 0.00 -0.52 0.00 0.00 37.83 33.86 2v47 s LYS 2 CO 0.00 -1.20 1.04 1.03 -0.92 0.00 0.00 175.35 175.30 2v47 s ARG 3 N -0.60 -0.65 0.22 1.68 1.81 -1.26 -4.96 118.95 115.19 2v47 s ARG 3 Ca 0.21 0.84 -0.12 0.00 -1.72 0.00 0.00 55.73 54.94 2v47 s ARG 3 Cb -0.16 -1.58 0.29 0.00 -0.45 0.00 0.00 34.95 33.04 2v47 s ARG 3 CO -0.07 -3.54 1.64 0.00 -0.68 0.00 0.00 175.30 172.65 2v47 h THR 4 N -2.49 0.41 -3.64 0.02 1.03 -2.10 -3.42 112.91 102.71 2v47 h THR 4 Ca -0.60 -0.02 -0.61 0.00 -0.01 0.00 0.00 66.41 65.18 2v47 h THR 4 Cb 1.33 0.35 -0.11 0.00 -1.07 0.00 0.00 68.15 68.65 2v47 h THR 4 CO 0.51 0.01 0.50 0.86 -0.01 0.00 0.00 175.52 177.39 2v47 s TRP 5 N -6.19 2.95 -0.57 0.00 -0.11 -1.26 -4.99 118.94 108.78 2v47 s TRP 5 Ca -0.14 0.32 0.04 0.00 1.22 0.00 0.00 56.10 57.54 2v47 s TRP 5 Cb 0.19 -3.85 0.14 0.00 -1.50 0.00 0.00 33.47 28.46 2v47 s TRP 5 CO 0.74 -1.05 0.32 -0.65 -4.62 0.00 0.00 176.95 171.69 2v47 s GLN 6 N 3.57 2.11 0.06 5.86 -1.52 -1.26 -5.10 119.66 123.39 2v47 s GLN 6 Ca 0.34 -2.79 -0.20 0.00 -1.95 0.00 0.00 55.36 50.76 2v47 s GLN 6 Cb -0.11 -3.36 -0.11 0.00 -0.22 0.00 0.00 33.01 29.21 2v47 s GLN 6 CO 0.25 -1.15 0.47 -2.30 -0.25 0.00 0.00 175.29 172.31 2v47 n PRO 7 N 2.85 0.00 -3.59 2.91 -0.02 -1.26 -5.03 135.00 130.86 2v47 n PRO 7 Ca 0.08 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.56 2v47 n PRO 7 Cb 0.33 -0.75 -0.04 0.00 -0.02 0.00 0.00 33.50 33.02 2v47 n PRO 7 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2v47 s ASN 8 N -0.32 -1.00 0.00 2.55 3.04 -1.26 -5.09 114.94 112.87 2v47 s ASN 8 Ca 0.47 1.38 -0.11 0.00 0.04 0.00 0.00 52.86 54.64 2v47 s ASN 8 Cb -0.66 2.11 -0.06 0.00 -1.54 0.00 0.00 41.25 41.09 2v47 s ASN 8 CO 0.34 -0.19 0.84 0.03 -3.04 0.00 0.00 177.10 175.08 2v47 h ARG 9 N 7.82 -0.40 -1.04 0.43 3.08 -1.98 -1.49 114.38 120.80 2v47 h ARG 9 Ca -0.18 0.03 0.27 0.00 0.07 0.00 0.00 59.98 60.17 2v47 h ARG 9 Cb 1.11 0.09 -0.11 0.00 0.08 0.00 0.00 29.97 31.14 2v47 h ARG 9 CO 0.10 -0.26 0.65 -0.09 -1.07 0.00 0.00 179.97 179.30 2v47 h ARG 10 N -0.56 0.42 0.00 0.04 2.43 -1.98 0.71 114.38 115.44 2v47 h ARG 10 Ca -0.04 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2v47 h ARG 10 Cb 0.31 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 2v47 h ARG 10 CO 0.07 0.28 0.00 1.17 -1.51 0.00 0.00 179.97 179.98 2v47 n LYS 11 N -4.73 0.00 -0.35 0.20 3.00 -1.20 0.31 118.16 115.39 2v47 n LYS 11 Ca 0.27 0.02 0.07 0.00 -0.00 0.00 0.00 58.31 58.66 2v47 n LYS 11 Cb 0.87 -1.02 0.15 0.00 0.00 0.00 0.00 35.03 35.03 2v47 n LYS 11 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2v47 n ARG 12 N -0.56 -0.09 -0.05 1.64 0.63 -0.57 0.27 116.66 117.94 2v47 n ARG 12 Ca 0.00 1.52 0.12 0.00 -0.92 0.00 0.00 57.85 58.56 2v47 n ARG 12 Cb 0.00 -2.28 0.51 0.00 0.45 0.00 0.00 32.46 31.15 2v47 n ARG 12 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2v47 h ALA 13 N 1.95 2.02 0.11 5.13 0.00 0.44 -1.41 119.26 127.51 2v47 h ALA 13 Ca 0.48 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 55.02 2v47 h ALA 13 Cb 0.76 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2v47 h ALA 13 CO -1.00 -0.14 -2.00 1.63 0.00 0.00 0.00 179.25 177.75 2v47 n LYS 14 N -4.47 0.75 0.22 0.00 5.02 0.78 -1.88 118.16 118.58 2v47 n LYS 14 Ca 0.08 0.26 0.09 0.00 -2.02 0.00 0.00 58.31 56.72 2v47 n LYS 14 Cb 0.34 -1.71 0.50 0.00 -0.02 0.00 0.00 35.03 34.14 2v47 n LYS 14 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2v47 h THR 15 N 0.06 0.72 0.00 -0.18 2.02 0.15 -3.34 112.91 112.34 2v47 h THR 15 Ca -0.42 -1.06 0.00 0.00 0.77 0.00 0.00 66.41 65.69 2v47 h THR 15 Cb 2.03 1.67 0.00 0.00 -1.74 0.00 0.00 68.15 70.11 2v47 h THR 15 CO 0.08 0.24 0.00 1.41 0.37 0.00 0.00 175.52 177.63 2v47 n HIS 16 N -3.58 0.00 -1.41 3.16 8.25 -0.56 -4.94 115.22 116.15 2v47 n HIS 16 Ca -0.01 0.00 -0.50 0.00 -0.26 0.00 0.00 57.72 56.95 2v47 n HIS 16 Cb 0.39 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.40 2v47 n HIS 16 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2v47 n GLY 17 N 0.10 0.11 0.00 -1.41 0.00 -0.79 -4.50 105.19 98.70 2v47 n GLY 17 Ca 0.00 1.00 0.00 0.00 0.00 0.00 0.00 46.02 47.02 2v47 n GLY 17 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2v47 n PHE 18 N 9.81 0.00 -0.08 1.61 7.35 -1.26 0.16 117.46 135.05 2v47 n PHE 18 Ca 0.49 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 57.20 2v47 n PHE 18 Cb 0.14 0.00 0.04 0.00 0.35 0.00 0.00 39.48 40.01 2v47 n PHE 18 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2v47 n ARG 19 N 0.00 -0.02 -0.25 -4.13 1.74 -1.26 0.23 116.66 112.97 2v47 n ARG 19 Ca 0.00 0.35 -0.10 0.00 -0.77 0.00 0.00 57.85 57.34 2v47 n ARG 19 Cb 0.00 -0.53 -0.06 0.00 -1.02 0.00 0.00 32.46 30.85 2v47 n ARG 19 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2v47 h ALA 20 N 0.45 -0.43 -0.83 7.54 0.00 0.13 0.43 119.26 126.55 2v47 h ALA 20 Ca 0.11 0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.22 2v47 h ALA 20 Cb 0.18 1.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.00 2v47 h ALA 20 CO -0.23 -0.89 0.54 0.00 0.00 0.00 0.00 179.25 178.67 2v47 h ARG 21 N -0.20 0.77 0.18 0.00 2.47 0.28 -2.49 114.38 115.38 2v47 h ARG 21 Ca 0.17 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.83 2v47 h ARG 21 Cb 0.54 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 28.69 2v47 h ARG 21 CO -0.74 0.51 -0.09 0.52 0.56 0.00 0.00 179.97 180.73 2v47 h MET 22 N 0.80 -0.23 -0.34 0.04 2.86 -0.06 -1.62 114.93 116.38 2v47 h MET 22 Ca 0.38 0.02 0.07 0.00 -2.06 0.00 0.00 59.70 58.11 2v47 h MET 22 Cb 0.42 0.05 -0.09 0.00 0.06 0.00 0.00 31.60 32.04 2v47 h MET 22 CO -0.15 -0.03 -0.36 0.00 1.06 0.00 0.00 176.91 177.43 2v47 h ARG 23 N -0.39 -0.30 -7.03 1.72 3.08 -0.58 -3.42 114.38 107.46 2v47 h ARG 23 Ca -0.02 0.02 -0.49 0.00 0.07 0.00 0.00 59.98 59.55 2v47 h ARG 23 Cb 0.30 0.07 0.05 0.00 0.08 0.00 0.00 29.97 30.47 2v47 h ARG 23 CO 0.04 -0.20 0.43 -0.08 -1.07 0.00 0.00 179.97 179.09 2v47 s THR 24 N -5.95 3.38 0.05 2.04 -1.32 -1.19 -4.98 115.64 107.66 2v47 s THR 24 Ca -0.15 0.95 -0.25 0.00 -1.21 0.00 0.00 61.69 61.03 2v47 s THR 24 Cb 0.12 -3.44 -0.13 0.00 -1.51 0.00 0.00 72.50 67.54 2v47 s THR 24 CO 0.67 -0.10 1.38 1.55 -2.21 0.00 0.00 174.62 175.91 2v47 h PRO 25 N 1.78 -0.81 0.00 7.08 0.13 -1.86 -1.72 132.00 136.60 2v47 h PRO 25 Ca -0.49 0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2v47 h PRO 25 Cb 1.24 0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.55 2v47 h PRO 25 CO 0.59 -0.54 0.00 0.41 -0.23 0.00 0.00 178.00 178.23 2v47 n GLY 26 N -1.43 -1.40 0.22 1.56 0.00 -1.26 -1.80 105.19 101.08 2v47 n GLY 26 Ca -0.10 0.06 0.05 0.00 0.00 0.00 0.00 46.02 46.02 2v47 n GLY 26 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2v47 h GLY 27 N 2.88 0.03 0.30 -0.02 0.00 -1.55 -2.10 103.07 102.62 2v47 h GLY 27 Ca 0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 2v47 h GLY 27 CO 0.00 0.02 -0.34 3.21 0.00 0.00 0.00 176.54 179.42 2v47 h ARG 28 N 0.03 0.13 -0.79 4.80 3.08 -0.42 -3.32 114.38 117.89 2v47 h ARG 28 Ca 0.00 -0.22 0.11 0.00 0.07 0.00 0.00 59.98 59.95 2v47 h ARG 28 Cb 0.34 0.08 -0.12 0.00 0.08 0.00 0.00 29.97 30.35 2v47 h ARG 28 CO 0.02 1.10 -0.33 1.63 -1.07 0.00 0.00 179.97 181.32 2v47 n LYS 29 N -4.41 -0.21 0.16 0.04 4.76 -0.82 0.18 118.16 117.87 2v47 n LYS 29 Ca -0.12 1.21 -0.15 0.00 -2.87 0.00 0.00 58.31 56.39 2v47 n LYS 29 Cb 0.62 -1.80 -0.07 0.00 -1.84 0.00 0.00 35.03 31.94 2v47 n LYS 29 CO 0.00 0.00 0.00 -0.39 -1.37 0.00 0.00 177.40 175.64 2v47 h VAL 30 N 0.00 0.24 -0.73 -0.18 -1.51 -1.60 1.93 116.25 114.40 2v47 h VAL 30 Ca 0.25 0.00 0.10 0.00 -1.23 0.00 0.00 66.70 65.82 2v47 h VAL 30 Cb 0.45 0.24 -0.12 0.00 -2.13 0.00 0.00 31.29 29.73 2v47 h VAL 30 CO -0.78 0.00 -0.46 -0.07 -1.23 0.00 0.00 177.57 175.03 2v47 h LEU 31 N -0.66 -1.62 0.00 4.19 3.38 -0.36 2.69 115.31 122.92 2v47 h LEU 31 Ca 0.00 0.27 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2v47 h LEU 31 Cb 0.65 0.75 0.00 0.00 0.09 0.00 0.00 40.66 42.15 2v47 h LEU 31 CO -0.15 -0.31 0.00 1.17 0.09 0.00 0.00 178.44 179.24 2v47 n LYS 32 N -5.39 0.00 -0.60 1.13 4.81 0.67 -1.14 118.16 117.64 2v47 n LYS 32 Ca 0.03 0.40 0.46 0.00 -0.87 0.00 0.00 58.31 58.34 2v47 n LYS 32 Cb 0.34 -1.11 0.71 0.00 0.02 0.00 0.00 35.03 34.99 2v47 n LYS 32 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2v47 n ARG 33 N -1.18 0.00 0.00 1.64 1.74 0.63 -1.53 116.66 117.96 2v47 n ARG 33 Ca 0.00 0.97 0.00 0.00 -0.77 0.00 0.00 57.85 58.05 2v47 n ARG 33 Cb 0.00 -2.26 0.00 0.00 -1.02 0.00 0.00 32.46 29.18 2v47 n ARG 33 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2v47 n ARG 34 N -3.66 0.00 -0.16 5.56 0.63 0.89 -2.44 116.66 117.48 2v47 n ARG 34 Ca 0.38 0.21 0.11 0.00 -0.92 0.00 0.00 57.85 57.64 2v47 n ARG 34 Cb 1.78 -0.83 0.22 0.00 0.45 0.00 0.00 32.46 34.08 2v47 n ARG 34 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2v47 n ARG 35 N -1.14 -0.03 0.00 -0.14 1.74 -0.50 0.14 116.66 116.72 2v47 n ARG 35 Ca 0.00 0.71 0.00 0.00 -0.77 0.00 0.00 57.85 57.79 2v47 n ARG 35 Cb 0.00 -1.20 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 2v47 n ARG 35 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 2v47 n GLN 36 N -4.35 0.00 0.06 5.56 0.00 -0.58 0.33 117.38 118.40 2v47 n GLN 36 Ca 0.15 0.43 0.21 0.00 -0.00 0.00 0.00 57.00 57.79 2v47 n GLN 36 Cb 0.50 -1.00 0.74 0.00 0.00 0.00 0.00 30.24 30.48 2v47 n GLN 36 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 2v47 h LYS 37 N 0.00 0.00 -2.32 3.69 3.64 0.15 -3.46 116.57 118.28 2v47 h LYS 37 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2v47 h LYS 37 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2v47 h LYS 37 CO 0.00 0.00 -0.02 0.41 -2.27 0.00 0.00 179.45 177.57 2v47 n GLY 38 N -1.53 0.53 3.02 5.01 0.00 0.16 -5.06 105.19 107.32 2v47 n GLY 38 Ca 0.08 -0.42 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 2v47 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2v47 n ARG 39 N -1.19 -3.06 0.00 1.61 1.74 -1.26 -4.94 116.66 109.57 2v47 n ARG 39 Ca -0.01 -1.50 0.09 0.00 -0.77 0.00 0.00 57.85 55.67 2v47 n ARG 39 Cb 0.50 -1.45 -0.09 0.00 -1.02 0.00 0.00 32.46 30.40 2v47 n ARG 39 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2v47 n TRP 40 N -4.66 0.00 -3.39 -1.55 7.02 -1.26 -4.78 117.44 108.82 2v47 n TRP 40 Ca 0.13 0.00 -0.27 0.00 -1.02 0.00 0.00 57.50 56.34 2v47 n TRP 40 Cb 0.51 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.30 2v47 n TRP 40 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2v47 s ARG 41 N -2.67 0.90 0.00 -0.99 0.52 -1.26 -4.99 118.95 110.46 2v47 s ARG 41 Ca 0.09 -2.11 0.00 0.00 -0.52 0.00 0.00 55.73 53.19 2v47 s ARG 41 Cb 0.14 -1.41 0.00 0.00 0.52 0.00 0.00 34.95 34.20 2v47 s ARG 41 CO 0.72 -1.39 0.98 1.28 0.02 0.00 0.00 175.30 176.92 2v47 n LEU 42 N 2.85 0.00 -4.68 2.53 4.77 -1.26 -4.14 117.00 117.06 2v47 n LEU 42 Ca 0.30 0.98 -0.42 0.00 -0.03 0.00 0.00 56.01 56.84 2v47 n LEU 42 Cb 0.48 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2v47 n LEU 42 CO 0.08 -0.48 1.30 0.28 -1.33 0.00 0.00 177.39 177.24 2v47 s THR 43 N -2.93 3.34 0.35 -5.08 -1.32 -1.26 -4.92 115.64 103.81 2v47 s THR 43 Ca 0.00 0.67 -0.28 0.00 -1.21 0.00 0.00 61.69 60.87 2v47 s THR 43 Cb 0.00 -3.43 -0.12 0.00 -1.51 0.00 0.00 72.50 67.44 2v47 s THR 43 CO 0.00 -0.02 1.34 -2.65 -2.21 0.00 0.00 174.62 171.08 2v47 n PRO 44 N 6.04 2.28 -1.40 7.08 -0.02 -1.26 -4.89 135.00 142.82 2v47 n PRO 44 Ca 0.16 0.80 -0.35 0.00 -2.02 0.00 0.00 63.50 62.08 2v47 n PRO 44 Cb 0.42 -2.42 0.10 0.00 -0.02 0.00 0.00 33.50 31.57 2v47 n PRO 44 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2v47 n ALA 45 N 0.36 0.35 0.00 3.55 0.00 -1.26 -4.98 120.51 118.53 2v47 n ALA 45 Ca 0.04 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2v47 n ALA 45 Cb 0.37 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.58 2v47 n ALA 45 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2v47 n VAL 46 N -2.58 0.00 -3.86 0.00 3.14 -1.26 -5.07 118.33 108.70 2v47 n VAL 46 Ca 0.14 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.41 2v47 n VAL 46 Cb 0.49 0.00 -0.10 0.00 -1.06 0.00 0.00 33.84 33.18 2v47 n VAL 46 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2v47 s ARG 47 N -3.31 0.52 0.35 1.45 1.70 -1.26 -5.11 118.95 113.28 2v47 s ARG 47 Ca 0.00 -0.39 0.03 0.00 -0.47 0.00 0.00 55.73 54.91 2v47 s ARG 47 Cb 0.00 0.22 -0.04 0.00 -0.57 0.00 0.00 34.95 34.56 2v47 s ARG 47 CO 0.00 -0.13 0.12 -1.59 -1.08 0.00 0.00 175.30 172.62 2v47 s LYS 48 N -1.43 1.74 0.00 3.89 0.00 -1.26 -5.13 119.74 117.55 2v47 s LYS 48 Ca -0.14 -2.02 0.00 0.00 0.00 0.00 0.00 55.97 53.81 2v47 s LYS 48 Cb -0.07 -0.52 0.00 0.00 0.00 0.00 0.00 37.83 37.24 2v47 s LYS 48 CO 0.02 -0.39 0.00 2.89 0.00 0.00 0.00 175.35 177.87