#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w1n h GLU 2 N 0.00 -0.21 -7.18 3.52 3.07 -2.09 -3.41 114.58 108.27 1w1n h GLU 2 Ca 0.00 0.01 -0.50 0.00 -0.50 0.00 0.00 59.36 58.38 1w1n h GLU 2 Cb 0.00 0.05 0.07 0.00 -0.84 0.00 0.00 28.75 28.03 1w1n h GLU 2 CO 0.00 -0.14 0.38 -0.51 -1.40 0.00 0.00 179.01 177.34 1w1n s LEU 3 N -6.55 3.52 -1.09 1.33 2.01 -1.26 -4.95 118.68 111.69 1w1n s LEU 3 Ca -0.05 1.90 -0.03 0.00 0.01 0.00 0.00 54.13 55.96 1w1n s LEU 3 Cb 0.02 -4.54 0.29 0.00 0.01 0.00 0.00 46.19 41.96 1w1n s LEU 3 CO 0.19 -1.26 1.78 -0.67 1.01 0.00 0.00 176.35 177.39 1w1n n ASP 4 N -1.99 6.98 -4.30 2.29 2.03 -1.26 -4.97 116.55 115.32 1w1n n ASP 4 Ca 0.09 -3.50 -0.26 0.00 0.52 0.00 0.00 54.79 51.64 1w1n n ASP 4 Cb 0.52 -1.24 -0.13 0.00 -0.72 0.00 0.00 41.12 39.55 1w1n n ASP 4 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1w1n s VAL 5 N -3.19 1.84 0.00 5.18 -7.23 -1.26 -5.01 120.40 110.73 1w1n s VAL 5 Ca 0.38 -1.52 -0.00 0.00 -1.81 0.00 0.00 61.98 59.02 1w1n s VAL 5 Cb 0.14 -1.65 -0.01 0.00 0.56 0.00 0.00 36.38 35.42 1w1n s VAL 5 CO -0.04 0.04 1.22 -0.81 -0.31 0.00 0.00 175.10 175.20 1w1n n PRO 6 N 1.22 0.61 -0.08 4.82 -0.04 -1.26 -4.29 135.00 135.98 1w1n n PRO 6 Ca -0.19 -0.04 -0.00 0.00 -0.04 0.00 0.00 63.50 63.23 1w1n n PRO 6 Cb 0.53 -1.25 0.27 0.00 -0.04 0.00 0.00 33.50 33.01 1w1n n PRO 6 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1w1n h GLU 7 N 2.42 0.71 0.57 0.54 4.11 -1.95 -2.43 114.58 118.55 1w1n h GLU 7 Ca 0.01 -0.11 -0.03 0.00 0.07 0.00 0.00 59.36 59.30 1w1n h GLU 7 Cb 0.59 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.72 1w1n h GLU 7 CO 0.02 0.60 -0.28 1.96 0.07 0.00 0.00 179.01 181.39 1w1n h GLN 8 N 0.70 -0.74 -0.27 1.06 4.20 -2.01 -2.61 115.11 115.44 1w1n h GLN 8 Ca 0.17 0.05 0.08 0.00 0.06 0.00 0.00 58.65 59.00 1w1n h GLN 8 Cb 0.18 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1w1n h GLN 8 CO -0.01 -0.46 0.75 0.28 -0.67 0.00 0.00 178.83 178.72 1w1n h VAL 9 N -1.15 0.06 0.26 -0.54 2.07 -1.87 -0.99 116.25 114.09 1w1n h VAL 9 Ca -0.08 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1w1n h VAL 9 Cb 0.63 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1w1n h VAL 9 CO 0.13 0.00 -0.12 -0.78 0.02 0.00 0.00 177.57 176.81 1w1n h ASP 10 N 0.00 -0.30 -1.20 0.57 3.58 -1.03 -3.08 116.42 114.96 1w1n h ASP 10 Ca 0.13 0.01 0.38 0.00 0.42 0.00 0.00 57.03 57.97 1w1n h ASP 10 Cb 1.63 0.08 -0.08 0.00 1.72 0.00 0.00 39.33 42.68 1w1n h ASP 10 CO -0.00 -0.15 0.82 0.29 -2.88 0.00 0.00 179.24 177.32 1w1n n LYS 11 N -3.30 -0.01 0.19 0.28 4.01 -0.38 0.16 118.16 119.11 1w1n n LYS 11 Ca -0.04 0.85 -0.14 0.00 -0.51 0.00 0.00 58.31 58.47 1w1n n LYS 11 Cb 0.14 -1.81 -0.08 0.00 -0.51 0.00 0.00 35.03 32.77 1w1n n LYS 11 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1w1n h LEU 12 N 0.00 -0.39 -0.34 -0.35 -0.00 -1.58 1.14 115.31 113.78 1w1n h LEU 12 Ca 0.66 -0.09 0.07 0.00 -0.00 0.00 0.00 57.88 58.52 1w1n h LEU 12 Cb 2.38 0.10 -0.06 0.00 -0.00 0.00 0.00 40.66 43.07 1w1n h LEU 12 CO -0.19 -0.14 -0.07 0.40 -0.00 0.00 0.00 178.44 178.44 1w1n h ILE 13 N -0.63 0.67 0.20 1.22 2.04 0.15 1.09 117.51 122.26 1w1n h ILE 13 Ca -0.05 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 1w1n h ILE 13 Cb 0.45 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1w1n h ILE 13 CO 0.08 0.00 -0.16 1.56 0.00 0.00 0.00 178.15 179.63 1w1n h GLN 14 N 0.02 -0.37 0.62 2.37 1.08 -1.19 1.50 115.11 119.14 1w1n h GLN 14 Ca 0.17 0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.37 1w1n h GLN 14 Cb 0.25 0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.75 1w1n h GLN 14 CO -0.34 -0.24 -0.45 1.96 -0.95 0.00 0.00 178.83 178.81 1w1n h GLN 15 N -0.38 -0.99 -0.69 1.46 1.08 0.23 0.99 115.11 116.81 1w1n h GLN 15 Ca -0.01 0.07 0.03 0.00 -1.45 0.00 0.00 58.65 57.29 1w1n h GLN 15 Cb 0.34 0.23 -0.04 0.00 -0.05 0.00 0.00 27.48 27.96 1w1n h GLN 15 CO -0.02 -0.66 0.46 0.00 -0.95 0.00 0.00 178.83 177.66 1w1n h ALA 16 N -0.83 1.59 0.39 3.87 0.00 0.13 -2.51 119.26 121.91 1w1n h ALA 16 Ca -0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1w1n h ALA 16 Cb 0.85 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1w1n h ALA 16 CO 0.03 0.34 -0.19 1.15 0.00 0.00 0.00 179.25 180.58 1w1n h THR 17 N 0.85 0.55 0.00 0.00 2.02 0.28 -2.96 112.91 113.65 1w1n h THR 17 Ca 0.27 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1w1n h THR 17 Cb 0.04 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 67.22 1w1n h THR 17 CO -0.08 0.08 0.00 -1.54 0.37 0.00 0.00 175.52 174.36 1w1n n SER 18 N -5.20 0.00 -0.34 4.18 3.41 0.34 -1.59 113.62 114.42 1w1n n SER 18 Ca -0.10 0.88 0.11 0.00 -0.26 0.00 0.00 58.87 59.50 1w1n n SER 18 Cb 0.28 -0.38 0.23 0.00 -0.26 0.00 0.00 64.21 64.08 1w1n n SER 18 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1w1n n ILE 19 N -2.36 -0.41 -0.15 -1.33 -0.00 -0.99 -0.10 119.36 114.02 1w1n n ILE 19 Ca 0.00 2.17 -0.08 0.00 -0.00 0.00 0.00 62.75 64.84 1w1n n ILE 19 Cb 0.00 -3.10 -0.03 0.00 -0.00 0.00 0.00 39.64 36.51 1w1n n ILE 19 CO 0.00 0.00 0.00 -0.33 -0.00 0.00 0.00 176.55 176.22 1w1n h GLU 20 N 0.00 -0.26 0.00 0.38 5.08 -1.11 1.28 114.58 119.95 1w1n h GLU 20 Ca 0.54 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.89 1w1n h GLU 20 Cb 1.01 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1w1n h GLU 20 CO -0.95 -0.17 -0.63 0.00 -1.00 0.00 0.00 179.01 176.26 1w1n h ARG 21 N -0.27 0.00 0.06 2.33 2.47 -1.09 -2.78 114.38 115.10 1w1n h ARG 21 Ca 0.17 0.00 -0.28 0.00 -1.26 0.00 0.00 59.98 58.60 1w1n h ARG 21 Cb 0.57 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.87 1w1n h ARG 21 CO -0.61 0.08 -1.47 -0.07 0.56 0.00 0.00 179.97 178.46 1w1n h LEU 22 N 0.00 0.21 0.00 3.04 4.07 0.43 -3.36 115.31 119.70 1w1n h LEU 22 Ca -0.02 -0.31 0.00 0.00 0.08 0.00 0.00 57.88 57.63 1w1n h LEU 22 Cb 1.10 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.77 1w1n h LEU 22 CO 0.01 1.26 -1.23 0.00 -1.08 0.00 0.00 178.44 177.40 1w1n h GLN 24 N 0.00 0.00 0.21 0.00 4.20 -1.56 -3.25 115.11 114.71 1w1n h GLN 24 Ca 0.00 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.43 1w1n h GLN 24 Cb 0.78 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.60 1w1n h GLN 24 CO 0.00 0.00 -1.20 0.45 -0.67 0.00 0.00 178.83 177.41 1w1n h HIS 25 N 0.00 0.81 -0.82 2.96 3.86 -1.71 -3.47 115.15 116.79 1w1n h HIS 25 Ca 0.00 -0.59 0.00 0.00 -1.16 0.00 0.00 60.37 58.62 1w1n h HIS 25 Cb 0.76 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.20 1w1n h HIS 25 CO 0.00 1.46 0.00 0.66 0.86 0.00 0.00 177.93 180.91 1w1n n TYR 26 N -3.89 0.00 -3.31 2.45 4.01 -1.23 -5.09 117.16 110.10 1w1n n TYR 26 Ca -0.16 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.25 1w1n n TYR 26 Cb 0.99 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.96 1w1n n TYR 26 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1w1n s ILE 27 N 3.09 4.82 0.40 -0.72 1.09 -1.26 -4.91 121.20 123.71 1w1n s ILE 27 Ca 0.00 0.77 0.36 0.00 -1.10 0.00 0.00 60.65 60.68 1w1n s ILE 27 Cb 0.00 -3.68 0.53 0.00 -1.06 0.00 0.00 42.46 38.24 1w1n s ILE 27 CO 0.00 0.05 1.15 0.61 -0.10 0.00 0.00 174.94 176.66 1w1n n GLY 28 N 0.26 -0.72 3.63 6.18 0.00 -1.26 -3.85 105.19 109.42 1w1n n GLY 28 Ca -0.01 0.52 -0.42 0.00 0.00 0.00 0.00 46.02 46.11 1w1n n GLY 28 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1w1n s TRP 29 N -4.42 3.23 0.02 1.61 -0.00 -1.26 -5.03 118.94 113.09 1w1n s TRP 29 Ca -0.04 0.97 0.01 0.00 -0.00 0.00 0.00 56.10 57.04 1w1n s TRP 29 Cb 0.20 -3.24 -0.02 0.00 -0.00 0.00 0.00 33.47 30.41 1w1n s TRP 29 CO 0.65 -0.55 -0.04 0.00 -0.00 0.00 0.00 176.95 177.01 1w1n n PRO 31 N 1.80 0.52 0.00 0.00 -0.04 -1.26 -2.50 135.00 133.52 1w1n n PRO 31 Ca -0.22 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.35 1w1n n PRO 31 Cb 0.56 -1.03 -0.04 0.00 -0.04 0.00 0.00 33.50 32.94 1w1n n PRO 31 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1w1n n PHE 32 N -0.40 0.00 1.97 0.54 3.72 -1.26 -5.22 117.46 116.81 1w1n n PHE 32 Ca 0.00 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.56 1w1n n PHE 32 Cb 0.02 -0.03 0.93 0.00 -0.94 0.00 0.00 39.48 39.46 1w1n n PHE 32 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 176.76 177.62