#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n5g h LEU 2 N 0.00 -1.23 -0.42 5.67 4.07 -2.02 0.30 115.31 121.67 1n5g h LEU 2 Ca 0.00 0.12 0.07 0.00 0.08 0.00 0.00 57.88 58.15 1n5g h LEU 2 Cb 0.00 0.43 -0.06 0.00 1.08 0.00 0.00 40.66 42.11 1n5g h LEU 2 CO 0.00 -0.55 0.06 -0.29 -1.08 0.00 0.00 178.44 176.58 1n5g h ILE 3 N -0.79 0.74 0.06 1.22 6.09 -2.05 -3.38 117.51 119.39 1n5g h ILE 3 Ca -0.02 -0.06 -0.00 0.00 -1.37 0.00 0.00 64.86 63.41 1n5g h ILE 3 Cb 0.74 0.55 0.00 0.00 0.47 0.00 0.00 36.82 38.58 1n5g h ILE 3 CO -0.14 0.03 -0.03 0.00 -3.07 0.00 0.00 178.15 174.94 1n5g h GLU 5 N -0.21 -0.07 0.26 0.00 4.11 -1.16 -3.25 114.58 114.25 1n5g h GLU 5 Ca -0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.41 1n5g h GLU 5 Cb 0.18 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1n5g h GLU 5 CO 0.01 -0.05 -0.13 1.49 0.07 0.00 0.00 179.01 180.41 1n5g h GLU 6 N -0.08 -0.34 0.11 1.06 4.57 -1.84 -3.26 114.58 114.79 1n5g h GLU 6 Ca 0.09 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 1n5g h GLU 6 Cb 0.30 0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 1n5g h GLU 6 CO -0.55 -0.12 -0.05 -1.00 -1.18 0.00 0.00 179.01 176.10 1n5g h PRO 7 N -0.50 -0.14 0.22 0.92 0.13 -1.78 -3.40 132.00 127.45 1n5g h PRO 7 Ca -0.04 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1n5g h PRO 7 Cb 0.38 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.54 1n5g h PRO 7 CO 0.06 0.30 -0.11 1.15 -0.23 0.00 0.00 178.00 179.18 1n5g h THR 8 N -0.65 0.00 -1.22 1.56 2.02 -1.73 -3.38 112.91 109.51 1n5g h THR 8 Ca -0.01 -0.41 0.36 0.00 0.77 0.00 0.00 66.41 67.12 1n5g h THR 8 Cb 0.51 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.81 1n5g h THR 8 CO 0.02 0.00 0.80 0.00 0.37 0.00 0.00 175.52 176.71 1n5g h ARG 10 N 0.20 -0.24 -0.30 0.00 2.43 -1.78 -0.42 114.38 114.27 1n5g h ARG 10 Ca 0.71 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.95 1n5g h ARG 10 Cb 2.15 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 31.70 1n5g h ARG 10 CO -0.32 0.10 -0.07 -0.91 -1.51 0.00 0.00 179.97 177.26 1n5g h ASN 11 N -0.63 -0.27 -0.86 -3.80 2.35 -1.45 -1.62 115.58 109.30 1n5g h ASN 11 Ca -0.03 0.09 0.09 0.00 -0.55 0.00 0.00 56.30 55.90 1n5g h ASN 11 Cb 0.46 0.18 -0.06 0.00 0.05 0.00 0.00 38.32 38.95 1n5g h ASN 11 CO 0.04 -0.09 0.56 0.08 -1.65 0.00 0.00 177.43 176.37 1n5g h ARG 12 N 0.00 0.84 -1.59 0.81 0.11 -1.21 -2.63 114.38 110.71 1n5g h ARG 12 Ca 0.14 -0.05 0.50 0.00 0.10 0.00 0.00 59.98 60.67 1n5g h ARG 12 Cb 0.22 -0.19 -0.11 0.00 1.11 0.00 0.00 29.97 31.00 1n5g h ARG 12 CO -0.30 0.56 1.08 1.15 0.10 0.00 0.00 179.97 182.55 1n5g h THR 13 N 0.86 0.05 0.00 0.08 2.02 -0.03 0.15 112.91 116.04 1n5g h THR 13 Ca 0.39 -0.01 -0.03 0.00 0.77 0.00 0.00 66.41 67.53 1n5g h THR 13 Cb 0.37 0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1n5g h THR 13 CO -0.16 0.00 -0.15 0.03 0.37 0.00 0.00 175.52 175.61 1n5g h ARG 14 N 0.02 0.00 -0.30 6.66 -0.00 -1.56 -2.49 114.38 116.71 1n5g h ARG 14 Ca 0.88 0.00 -0.06 0.00 -0.50 0.00 0.00 59.98 60.30 1n5g h ARG 14 Cb 3.12 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 33.07 1n5g h ARG 14 CO -0.27 0.15 -0.09 0.45 0.00 0.00 0.00 179.97 180.21 1n5g h HIS 15 N 0.00 0.52 -0.91 3.04 3.86 -0.80 -3.41 115.15 117.44 1n5g h HIS 15 Ca -0.00 -0.07 0.23 0.00 -1.16 0.00 0.00 60.37 59.37 1n5g h HIS 15 Cb 0.32 -0.14 -0.13 0.00 1.06 0.00 0.00 27.41 28.52 1n5g h HIS 15 CO 0.00 0.57 0.41 1.25 0.86 0.00 0.00 177.93 181.02 1n5g h LEU 16 N 0.46 0.35 -0.85 2.43 6.46 -1.48 -1.18 115.31 121.49 1n5g h LEU 16 Ca 0.09 0.16 0.22 0.00 -0.12 0.00 0.00 57.88 58.22 1n5g h LEU 16 Cb 0.44 0.14 -0.14 0.00 -0.73 0.00 0.00 40.66 40.37 1n5g h LEU 16 CO 0.02 -0.01 0.18 -0.65 -0.62 0.00 0.00 178.44 177.35 1n5g h PRO 17 N 0.39 0.18 -0.07 5.25 0.11 -1.83 -3.03 132.00 133.01 1n5g h PRO 17 Ca 0.58 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.55 1n5g h PRO 17 Cb 1.12 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1n5g h PRO 17 CO -0.54 0.12 -0.54 1.37 -0.21 0.00 0.00 178.00 178.20 1n5g h LEU 18 N 0.19 0.21 -2.48 2.35 8.10 -1.50 -3.49 115.31 118.69 1n5g h LEU 18 Ca 0.51 -0.11 -0.18 0.00 0.11 0.00 0.00 57.88 58.21 1n5g h LEU 18 Cb 1.00 -0.06 0.14 0.00 -0.44 0.00 0.00 40.66 41.30 1n5g h LEU 18 CO -0.65 0.71 -0.61 1.67 -4.11 0.00 0.00 178.44 175.45 1n5g n GLN 19 N -3.91 -1.87 0.00 0.17 7.27 -1.15 -5.01 117.38 112.88 1n5g n GLN 19 Ca -0.02 0.93 0.00 0.00 0.07 0.00 0.00 57.00 57.98 1n5g n GLN 19 Cb 0.57 -5.46 0.00 0.00 2.41 0.00 0.00 30.24 27.76 1n5g n GLN 19 CO 0.00 0.00 0.00 1.97 0.07 0.00 0.00 177.06 179.10 1n5g n PHE 20 N -2.78 0.00 -2.99 3.69 -1.74 -1.26 -4.89 117.46 107.49 1n5g n PHE 20 Ca -0.05 0.00 -0.36 0.00 -0.56 0.00 0.00 57.45 56.48 1n5g n PHE 20 Cb 0.59 0.04 -0.02 0.00 1.52 0.00 0.00 39.48 41.61 1n5g n PHE 20 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 1n5g n SER 21 N -2.28 5.73 0.07 5.98 2.88 -1.26 -4.82 113.62 119.93 1n5g n SER 21 Ca 0.00 -3.55 -0.11 0.00 -1.33 0.00 0.00 58.87 53.89 1n5g n SER 21 Cb 0.31 -0.98 -0.07 0.00 -0.75 0.00 0.00 64.21 62.72 1n5g n SER 21 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 1n5g h ARG 22 N 4.38 -0.25 0.00 -1.46 -0.00 -1.96 -3.34 114.38 111.75 1n5g h ARG 22 Ca 0.28 0.02 -0.12 0.00 -0.00 0.00 0.00 59.98 60.15 1n5g h ARG 22 Cb 0.53 0.06 -0.02 0.00 -0.00 0.00 0.00 29.97 30.54 1n5g h ARG 22 CO 1.09 0.14 -0.59 1.79 -0.00 0.00 0.00 179.97 182.40 1n5g h THR 23 N -0.88 1.09 -3.94 0.08 1.35 -1.94 -3.48 112.91 105.19 1n5g h THR 23 Ca -0.03 -2.33 0.00 0.00 -0.55 0.00 0.00 66.41 63.50 1n5g h THR 23 Cb 0.51 2.40 -0.06 0.00 -1.73 0.00 0.00 68.15 69.26 1n5g h THR 23 CO 0.04 0.58 -0.79 0.61 -0.25 0.00 0.00 175.52 175.71 1n5g n GLY 24 N 0.98 -4.18 0.00 5.82 0.00 -1.26 -3.43 105.19 103.11 1n5g n GLY 24 Ca 0.01 0.65 0.02 0.00 0.00 0.00 0.00 46.02 46.70 1n5g n GLY 24 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1n5g n PRO 25 N 0.88 0.06 -0.09 1.61 -0.04 -1.26 -3.34 135.00 132.82 1n5g n PRO 25 Ca -0.20 0.23 -0.11 0.00 -0.04 0.00 0.00 63.50 63.38 1n5g n PRO 25 Cb 0.31 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.16 1n5g n PRO 25 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1n5g n LEU 26 N -1.27 1.64 -3.97 1.53 4.32 -1.26 -4.83 117.00 113.16 1n5g n LEU 26 Ca 0.02 -0.06 -0.31 0.00 -0.02 0.00 0.00 56.01 55.64 1n5g n LEU 26 Cb 0.03 -0.21 -0.15 0.00 -1.62 0.00 0.00 43.42 41.47 1n5g n LEU 26 CO 0.03 0.63 -0.38 0.00 -1.22 0.00 0.00 177.39 176.45 1n5g s PRO 28 N 1.16 3.59 0.00 0.00 0.02 -1.25 -3.28 135.00 135.24 1n5g s PRO 28 Ca 0.02 -1.93 0.00 0.00 0.02 0.00 0.00 61.00 59.11 1n5g s PRO 28 Cb -0.19 -4.77 0.00 0.00 0.02 0.00 0.00 34.50 29.56 1n5g s PRO 28 CO -0.09 -1.64 0.00 0.00 -0.33 0.00 0.00 177.00 174.94 1n5g n ALA 29 N 5.86 -0.16 0.85 -1.55 0.00 -1.22 -5.06 120.51 119.23 1n5g n ALA 29 Ca 0.20 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.75 1n5g n ALA 29 Cb 0.48 -0.31 -0.05 0.00 0.00 0.00 0.00 19.45 19.57 1n5g n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n5g n MET 31 N -1.63 0.23 0.10 0.00 1.56 -1.26 -3.51 117.12 112.61 1n5g n MET 31 Ca 0.03 0.29 -0.15 0.00 -0.27 0.00 0.00 57.70 57.60 1n5g n MET 31 Cb 0.37 -1.82 -0.12 0.00 2.15 0.00 0.00 33.22 33.80 1n5g n MET 31 CO 0.00 0.00 0.00 1.57 -0.73 0.00 0.00 175.97 176.81 1n5g h LYS 32 N 0.00 0.30 -0.27 2.12 2.10 -1.98 -3.38 116.57 115.47 1n5g h LYS 32 Ca 0.00 -0.46 -0.14 0.00 -2.00 0.00 0.00 60.65 58.05 1n5g h LYS 32 Cb 0.58 0.16 -0.01 0.00 -0.90 0.00 0.00 32.23 32.07 1n5g h LYS 32 CO 0.00 1.19 -0.41 0.00 -2.00 0.00 0.00 179.45 178.23 1n5g h ALA 33 N 0.62 0.78 -1.03 0.07 0.00 -1.87 -3.36 119.26 114.47 1n5g h ALA 33 Ca -0.12 -0.45 0.36 0.00 0.00 0.00 0.00 54.91 54.70 1n5g h ALA 33 Cb 1.88 -0.11 -0.15 0.00 0.00 0.00 0.00 17.79 19.41 1n5g h ALA 33 CO 0.19 0.66 0.58 1.15 0.00 0.00 0.00 179.25 181.83 1n5g h THR 34 N 0.53 0.21 -0.52 0.00 2.02 -1.73 -1.44 112.91 111.97 1n5g h THR 34 Ca 0.04 -0.08 -0.11 0.00 0.77 0.00 0.00 66.41 67.03 1n5g h THR 34 Cb 0.93 -0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1n5g h THR 34 CO 0.08 0.04 -0.12 -0.07 0.37 0.00 0.00 175.52 175.83 1n5g h LEU 35 N 0.22 0.99 0.44 2.58 4.07 -1.79 -0.80 115.31 121.02 1n5g h LEU 35 Ca 0.77 -0.33 -0.02 0.00 0.08 0.00 0.00 57.88 58.38 1n5g h LEU 35 Cb 1.89 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 43.37 1n5g h LEU 35 CO -0.63 1.10 -0.21 1.56 -1.08 0.00 0.00 178.44 179.18 1n5g h GLN 36 N 0.88 -0.57 0.00 1.13 4.20 -1.49 -3.19 115.11 116.06 1n5g h GLN 36 Ca 0.14 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1n5g h GLN 36 Cb 0.67 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.58 1n5g h GLN 36 CO 0.05 -0.38 0.00 -1.00 -0.67 0.00 0.00 178.83 176.83 1n5g h PRO 37 N -0.70 0.00 0.00 1.46 0.13 -1.72 -3.54 132.00 127.63 1n5g h PRO 37 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1n5g h PRO 37 Cb 0.46 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.59 1n5g h PRO 37 CO 0.10 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.02