#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 0.34 -0.50 5.67 4.07 -2.02 0.30 115.31 123.17 1n5g h LEU 2 Ca 0.00 0.17 -0.16 0.00 0.08 0.00 0.00 57.88 57.97 1n5g h LEU 2 Cb 0.00 0.15 -0.02 0.00 1.08 0.00 0.00 40.66 41.87 1n5g h LEU 2 CO 0.00 -0.21 -0.74 -0.29 -1.08 0.00 0.00 178.44 176.12 1n5g h ILE 3 N 0.15 1.48 0.07 1.22 6.09 -2.04 -3.25 117.51 121.22 1n5g h ILE 3 Ca 0.79 -2.40 -0.00 0.00 -1.37 0.00 0.00 64.86 61.88 1n5g h ILE 3 Cb 2.22 2.29 0.00 0.00 0.47 0.00 0.00 36.82 41.81 1n5g h ILE 3 CO -0.53 0.69 -0.03 0.00 -3.07 0.00 0.00 178.15 175.21 1n5g h GLU 5 N -0.73 -1.02 0.27 0.00 4.11 -1.24 -0.32 114.58 115.67 1n5g h GLU 5 Ca -0.01 0.07 -0.01 0.00 0.07 0.00 0.00 59.36 59.48 1n5g h GLU 5 Cb 0.59 0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1n5g h GLU 5 CO 0.02 -0.68 -0.13 1.49 0.07 0.00 0.00 179.01 179.78 1n5g h GLU 6 N -1.05 -0.36 0.21 1.06 4.57 -1.80 -3.16 114.58 114.05 1n5g h GLU 6 Ca -0.07 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1n5g h GLU 6 Cb 0.89 0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.56 1n5g h GLU 6 CO -0.00 -0.06 -0.10 -1.35 -1.18 0.00 0.00 179.01 176.32 1n5g h PRO 7 N -0.99 -0.27 -0.14 0.92 0.10 -1.69 -3.38 132.00 126.56 1n5g h PRO 7 Ca -0.04 0.02 -0.14 0.00 0.10 0.00 0.00 66.00 65.94 1n5g h PRO 7 Cb 0.46 0.06 0.00 0.00 0.10 0.00 0.00 31.00 31.63 1n5g h PRO 7 CO 0.06 -0.18 -0.45 1.15 0.10 0.00 0.00 178.00 178.69 1n5g h THR 8 N -0.65 1.35 -0.33 -1.15 2.02 -1.71 -1.80 112.91 110.65 1n5g h THR 8 Ca -0.03 -1.73 -0.03 0.00 0.77 0.00 0.00 66.41 65.39 1n5g h THR 8 Cb 0.21 2.06 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 1n5g h THR 8 CO 0.05 0.53 0.08 0.00 0.37 0.00 0.00 175.52 176.54 1n5g h ARG 10 N 0.37 0.69 -0.12 0.00 2.43 -1.56 0.17 114.38 116.35 1n5g h ARG 10 Ca 0.10 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.08 1n5g h ARG 10 Cb 0.29 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1n5g h ARG 10 CO 0.00 0.45 -0.56 -0.91 -1.51 0.00 0.00 179.97 177.44 1n5g h ASN 11 N 0.71 0.42 -0.76 -3.80 2.35 -0.24 -2.99 115.58 111.27 1n5g h ASN 11 Ca 0.50 -0.23 0.07 0.00 -0.55 0.00 0.00 56.30 56.08 1n5g h ASN 11 Cb 0.82 -0.12 -0.05 0.00 0.05 0.00 0.00 38.32 39.02 1n5g h ASN 11 CO -0.26 0.90 0.50 0.08 -1.65 0.00 0.00 177.43 177.00 1n5g h ARG 12 N 0.29 0.78 -0.76 0.81 0.11 0.11 0.54 114.38 116.26 1n5g h ARG 12 Ca 0.00 -0.05 0.21 0.00 0.10 0.00 0.00 59.98 60.25 1n5g h ARG 12 Cb 1.08 -0.18 -0.03 0.00 1.11 0.00 0.00 29.97 31.95 1n5g h ARG 12 CO 0.10 0.52 0.54 1.15 0.10 0.00 0.00 179.97 182.37 1n5g h THR 13 N 0.80 0.64 -0.01 0.08 2.02 -0.93 0.10 112.91 115.61 1n5g h THR 13 Ca 0.33 -0.02 -0.14 0.00 0.77 0.00 0.00 66.41 67.35 1n5g h THR 13 Cb 0.26 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 1n5g h THR 13 CO -0.11 0.01 -0.67 0.03 0.37 0.00 0.00 175.52 175.15 1n5g h ARG 14 N 0.05 0.04 0.00 6.66 -0.00 -0.76 -2.83 114.38 117.54 1n5g h ARG 14 Ca 0.36 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.98 59.79 1n5g h ARG 14 Cb 1.39 0.01 -0.00 0.00 0.00 0.00 0.00 29.97 31.36 1n5g h ARG 14 CO -0.02 0.69 -0.10 0.45 0.00 0.00 0.00 179.97 180.99 1n5g h HIS 15 N 0.03 0.00 -0.90 3.04 3.86 -0.37 -3.32 115.15 117.49 1n5g h HIS 15 Ca -0.01 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1n5g h HIS 15 Cb 1.18 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.61 1n5g h HIS 15 CO 0.00 0.10 0.59 1.25 0.86 0.00 0.00 177.93 180.74 1n5g h LEU 16 N 0.00 1.03 -1.54 2.43 5.85 -1.20 0.33 115.31 122.21 1n5g h LEU 16 Ca -0.00 -0.03 0.16 0.00 0.84 0.00 0.00 57.88 58.85 1n5g h LEU 16 Cb 0.24 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1n5g h LEU 16 CO 0.01 0.74 0.53 -0.65 -0.34 0.00 0.00 178.44 178.73 1n5g h PRO 17 N 1.21 0.42 0.07 5.25 0.11 -1.75 -3.29 132.00 134.01 1n5g h PRO 17 Ca 0.33 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.41 1n5g h PRO 17 Cb -0.13 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 30.89 1n5g h PRO 17 CO -0.07 0.28 -0.03 1.37 -0.21 0.00 0.00 178.00 179.33 1n5g h LEU 18 N 0.44 -0.08 0.10 2.35 8.10 -1.27 -3.50 115.31 121.45 1n5g h LEU 18 Ca 0.40 0.00 -0.04 0.00 0.11 0.00 0.00 57.88 58.35 1n5g h LEU 18 Cb 0.90 0.02 -0.02 0.00 -0.44 0.00 0.00 40.66 41.13 1n5g h LEU 18 CO -0.14 0.37 -0.04 1.67 -4.11 0.00 0.00 178.44 176.19 1n5g n GLN 19 N -4.61 -0.35 0.11 0.17 7.27 0.10 -4.92 117.38 115.15 1n5g n GLN 19 Ca -0.01 0.36 -0.01 0.00 0.07 0.00 0.00 57.00 57.41 1n5g n GLN 19 Cb 0.04 -3.85 0.02 0.00 2.41 0.00 0.00 30.24 28.86 1n5g n GLN 19 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 177.06 177.40 1n5g h PHE 20 N 0.00 0.00 -1.90 3.69 -0.00 -1.93 -3.14 116.94 113.66 1n5g h PHE 20 Ca -0.04 0.00 -0.74 0.00 -0.00 0.00 0.00 57.97 57.19 1n5g h PHE 20 Cb 0.24 0.00 -0.30 0.00 -0.00 0.00 0.00 35.95 35.89 1n5g h PHE 20 CO 0.12 0.69 0.76 0.45 -0.00 0.00 0.00 178.31 180.33 1n5g n SER 21 N -3.36 7.06 0.18 -0.68 2.88 -1.26 -4.78 113.62 113.66 1n5g n SER 21 Ca 0.01 -3.82 0.13 0.00 -1.33 0.00 0.00 58.87 53.86 1n5g n SER 21 Cb 0.77 -0.96 0.60 0.00 -0.75 0.00 0.00 64.21 63.87 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 2.91 0.00 0.00 -1.46 -0.00 -1.92 -3.31 114.38 110.59 1n5g h ARG 22 Ca 0.53 0.00 -0.45 0.00 -0.00 0.00 0.00 59.98 60.06 1n5g h ARG 22 Cb 0.19 0.00 -0.07 0.00 -0.00 0.00 0.00 29.97 30.09 1n5g h ARG 22 CO 1.34 0.00 -2.47 0.25 -0.00 0.00 0.00 179.97 179.09 1n5g n THR 23 N -2.46 1.53 -3.27 0.08 -2.24 -1.26 -5.11 114.28 101.55 1n5g n THR 23 Ca 0.01 -0.38 -0.14 0.00 -2.27 0.00 0.00 64.05 61.27 1n5g n THR 23 Cb 0.19 -1.86 0.01 0.00 -2.10 0.00 0.00 70.33 66.57 1n5g n THR 23 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n5g n GLY 24 N 1.33 -0.14 3.15 3.38 0.00 -1.25 -4.77 105.19 106.89 1n5g n GLY 24 Ca -0.53 0.44 -0.18 0.00 0.00 0.00 0.00 46.02 45.76 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 0.73 0.00 0.00 1.61 -0.04 -1.26 -4.35 135.00 131.69 1n5g n PRO 25 Ca -0.03 -0.44 0.00 0.00 -0.04 0.00 0.00 63.50 62.99 1n5g n PRO 25 Cb 0.54 -1.69 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 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 5.72 0.44 -3.69 1.53 4.32 -1.26 -5.15 117.00 118.91 1n5g n LEU 26 Ca 0.19 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 56.05 1n5g n LEU 26 Cb 0.27 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 41.98 1n5g n LEU 26 CO 0.63 0.07 0.22 0.00 -1.22 0.00 0.00 177.39 177.09 1n5g s PRO 28 N 0.55 3.37 -1.58 0.00 0.04 -1.26 -4.47 135.00 131.65 1n5g s PRO 28 Ca -0.02 -0.13 -0.12 0.00 0.04 0.00 0.00 61.00 60.76 1n5g s PRO 28 Cb -0.04 -4.05 0.12 0.00 0.04 0.00 0.00 34.50 30.57 1n5g s PRO 28 CO -0.03 -1.56 0.31 0.00 0.04 0.00 0.00 177.00 175.76 1n5g n ALA 29 N 7.78 -1.45 1.21 8.56 0.00 -1.26 -4.85 120.51 130.50 1n5g n ALA 29 Ca 0.04 -0.27 0.14 0.00 0.00 0.00 0.00 53.44 53.34 1n5g n ALA 29 Cb 0.48 -1.62 0.68 0.00 0.00 0.00 0.00 19.45 18.99 1n5g n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n5g h MET 31 N 0.00 0.46 -0.26 0.00 4.05 -1.91 -3.38 114.93 113.89 1n5g h MET 31 Ca 0.00 -0.52 0.04 0.00 -0.28 0.00 0.00 59.70 58.93 1n5g h MET 31 Cb 0.36 0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 31.28 1n5g h MET 31 CO 0.00 1.17 0.05 1.57 0.23 0.00 0.00 176.91 179.93 1n5g h LYS 32 N 0.24 0.14 -0.92 0.39 2.10 -1.98 -2.69 116.57 113.85 1n5g h LYS 32 Ca -0.10 -0.01 0.27 0.00 -2.00 0.00 0.00 60.65 58.81 1n5g h LYS 32 Cb 1.66 -0.03 -0.04 0.00 -0.90 0.00 0.00 32.23 32.92 1n5g h LYS 32 CO 0.18 0.09 0.77 0.00 -2.00 0.00 0.00 179.45 178.49 1n5g h ALA 33 N 1.19 2.79 -0.28 0.07 0.00 -1.73 -2.26 119.26 119.04 1n5g h ALA 33 Ca 0.12 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 1n5g h ALA 33 Cb 0.13 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1n5g h ALA 33 CO -0.16 -1.24 -0.50 1.15 0.00 0.00 0.00 179.25 178.49 1n5g h THR 34 N 0.00 1.28 0.00 0.00 2.02 -1.65 -3.09 112.91 111.47 1n5g h THR 34 Ca 0.44 -1.70 -0.01 0.00 0.77 0.00 0.00 66.41 65.91 1n5g h THR 34 Cb 1.97 1.60 -0.00 0.00 -1.74 0.00 0.00 68.15 69.97 1n5g h THR 34 CO -0.00 0.55 -0.02 -0.07 0.37 0.00 0.00 175.52 176.34 1n5g h LEU 35 N 0.63 0.00 -0.53 2.58 4.07 -1.45 -0.82 115.31 119.80 1n5g h LEU 35 Ca 0.03 0.00 0.11 0.00 0.08 0.00 0.00 57.88 58.09 1n5g h LEU 35 Cb 1.09 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 42.74 1n5g h LEU 35 CO 0.11 0.02 -0.06 1.56 -1.08 0.00 0.00 178.44 178.99 1n5g h GLN 36 N 0.00 0.06 -0.08 1.13 4.20 -1.53 -3.04 115.11 115.85 1n5g h GLN 36 Ca -0.00 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 1n5g h GLN 36 Cb 0.05 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 1n5g h GLN 36 CO 0.00 0.04 -0.08 -1.35 -0.67 0.00 0.00 178.83 176.77 1n5g h PRO 37 N 0.06 0.19 0.00 1.46 0.10 -1.62 -3.53 132.00 128.66 1n5g h PRO 37 Ca 0.26 -0.10 0.00 0.00 0.10 0.00 0.00 66.00 66.26 1n5g h PRO 37 Cb 0.41 0.01 0.00 0.00 0.10 0.00 0.00 31.00 31.51 1n5g h PRO 37 CO -0.49 0.63 0.00 -1.91 0.10 0.00 0.00 178.00 176.33