#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 0.21 -1.91 5.67 4.07 -2.03 -0.63 115.31 120.69 1n5g h LEU 2 Ca 0.00 -0.73 0.03 0.00 0.08 0.00 0.00 57.88 57.26 1n5g h LEU 2 Cb 0.00 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 41.67 1n5g h LEU 2 CO 0.00 1.67 0.39 -0.29 -1.08 0.00 0.00 178.44 179.13 1n5g h ILE 3 N -0.47 0.09 0.10 1.22 6.09 -2.06 -3.06 117.51 119.42 1n5g h ILE 3 Ca -0.38 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.10 1n5g h ILE 3 Cb 1.67 0.63 0.00 0.00 0.47 0.00 0.00 36.82 39.59 1n5g h ILE 3 CO -0.06 0.00 -0.05 0.00 -3.07 0.00 0.00 178.15 174.97 1n5g h GLU 5 N -1.03 -0.43 0.32 0.00 4.11 -1.00 -2.71 114.58 113.83 1n5g h GLU 5 Ca -0.01 0.03 -0.02 0.00 0.07 0.00 0.00 59.36 59.43 1n5g h GLU 5 Cb 0.15 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1n5g h GLU 5 CO 0.02 -0.29 -0.15 1.49 0.07 0.00 0.00 179.01 180.15 1n5g h GLU 6 N -0.44 -0.41 0.31 1.06 4.57 -1.85 -3.21 114.58 114.60 1n5g h GLU 6 Ca -0.00 0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.19 1n5g h GLU 6 Cb 0.45 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1n5g h GLU 6 CO -0.19 -0.08 -0.15 -1.00 -1.18 0.00 0.00 179.01 176.42 1n5g h PRO 7 N -0.88 -0.40 -0.16 0.92 0.13 -1.81 -3.23 132.00 126.58 1n5g h PRO 7 Ca -0.04 0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 65.05 1n5g h PRO 7 Cb 0.52 0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.74 1n5g h PRO 7 CO 0.07 -0.09 -0.16 1.15 -0.23 0.00 0.00 178.00 178.74 1n5g h THR 8 N -0.97 1.34 -0.14 1.56 2.02 -1.68 -2.75 112.91 112.29 1n5g h THR 8 Ca -0.04 -1.33 -0.20 0.00 0.77 0.00 0.00 66.41 65.61 1n5g h THR 8 Cb 0.49 1.85 0.00 0.00 -1.74 0.00 0.00 68.15 68.76 1n5g h THR 8 CO 0.07 0.39 -0.71 0.00 0.37 0.00 0.00 175.52 175.64 1n5g h ARG 10 N 0.43 -0.24 -0.82 0.00 2.43 -1.55 -0.26 114.38 114.37 1n5g h ARG 10 Ca -0.03 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.26 1n5g h ARG 10 Cb 1.31 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 30.85 1n5g h ARG 10 CO 0.14 -0.16 0.54 -0.91 -1.51 0.00 0.00 179.97 178.06 1n5g h ASN 11 N -0.25 0.68 -0.50 -3.80 2.35 -1.50 -3.12 115.58 109.44 1n5g h ASN 11 Ca 0.06 0.02 0.06 0.00 -0.55 0.00 0.00 56.30 55.88 1n5g h ASN 11 Cb 0.32 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1n5g h ASN 11 CO -0.16 0.39 0.33 0.08 -1.65 0.00 0.00 177.43 176.42 1n5g h ARG 12 N 0.75 0.44 -0.34 0.81 0.11 0.57 -2.55 114.38 114.16 1n5g h ARG 12 Ca 0.38 -0.03 -0.04 0.00 0.10 0.00 0.00 59.98 60.40 1n5g h ARG 12 Cb 0.48 -0.10 -0.02 0.00 1.11 0.00 0.00 29.97 31.45 1n5g h ARG 12 CO -0.15 0.29 0.05 1.15 0.10 0.00 0.00 179.97 181.41 1n5g h THR 13 N 0.46 1.18 -0.41 0.08 2.02 -1.07 -0.12 112.91 115.04 1n5g h THR 13 Ca 0.21 -0.66 0.12 0.00 0.77 0.00 0.00 66.41 66.85 1n5g h THR 13 Cb 0.27 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 1n5g h THR 13 CO -0.06 0.23 0.31 0.03 0.37 0.00 0.00 175.52 176.41 1n5g h ARG 14 N 0.50 0.00 0.00 6.66 3.08 -1.44 -1.60 114.38 121.58 1n5g h ARG 14 Ca 0.11 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.11 1n5g h ARG 14 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1n5g h ARG 14 CO 0.00 0.00 -0.24 0.45 -1.07 0.00 0.00 179.97 179.11 1n5g h HIS 15 N 0.00 0.00 -1.05 3.04 3.86 -0.89 -3.35 115.15 116.75 1n5g h HIS 15 Ca 0.19 0.00 0.27 0.00 -1.16 0.00 0.00 60.37 59.68 1n5g h HIS 15 Cb 0.82 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.20 1n5g h HIS 15 CO 0.00 0.24 0.69 1.25 0.86 0.00 0.00 177.93 180.97 1n5g h LEU 16 N 0.00 0.38 -0.73 2.43 6.46 -1.02 0.78 115.31 123.61 1n5g h LEU 16 Ca -0.00 0.07 -0.13 0.00 -0.12 0.00 0.00 57.88 57.69 1n5g h LEU 16 Cb 0.50 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.42 1n5g h LEU 16 CO 0.03 0.07 -0.51 1.55 -0.62 0.00 0.00 178.44 178.97 1n5g h PRO 17 N 0.33 0.33 -0.51 5.25 0.13 -1.77 -3.20 132.00 132.56 1n5g h PRO 17 Ca 0.58 -0.19 -0.12 0.00 -0.87 0.00 0.00 66.00 65.40 1n5g h PRO 17 Cb 1.60 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.73 1n5g h PRO 17 CO -0.25 0.76 -0.14 1.37 -0.23 0.00 0.00 178.00 179.51 1n5g h LEU 18 N 0.26 1.01 -1.32 1.56 8.10 -1.58 -3.49 115.31 119.85 1n5g h LEU 18 Ca 0.01 -0.37 -0.60 0.00 0.11 0.00 0.00 57.88 57.03 1n5g h LEU 18 Cb 0.99 -0.28 -0.31 0.00 -0.44 0.00 0.00 40.66 40.63 1n5g h LEU 18 CO 0.08 1.14 -0.90 1.67 -4.11 0.00 0.00 178.44 176.33 1n5g n GLN 19 N -4.16 -1.50 -0.00 0.17 -0.06 0.19 -4.93 117.38 107.09 1n5g n GLN 19 Ca 0.01 0.21 0.05 0.00 -2.00 0.00 0.00 57.00 55.26 1n5g n GLN 19 Cb 0.42 -4.67 -0.07 0.00 -4.06 0.00 0.00 30.24 21.85 1n5g n GLN 19 CO 0.00 0.00 0.00 1.97 -0.20 0.00 0.00 177.06 178.83 1n5g n PHE 20 N -4.23 0.00 -2.56 3.69 1.16 -1.26 -4.61 117.46 109.65 1n5g n PHE 20 Ca 0.03 0.00 -0.32 0.00 -1.87 0.00 0.00 57.45 55.30 1n5g n PHE 20 Cb 0.50 -0.18 -0.00 0.00 -1.61 0.00 0.00 39.48 38.19 1n5g n PHE 20 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1n5g n SER 21 N -1.72 5.62 0.12 5.98 2.88 -1.26 -4.84 113.62 120.41 1n5g n SER 21 Ca -0.01 -3.73 -0.06 0.00 -1.33 0.00 0.00 58.87 53.74 1n5g n SER 21 Cb 0.23 -0.73 -0.03 0.00 -0.75 0.00 0.00 64.21 62.93 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 3.08 -0.35 0.53 -1.46 -0.00 -1.96 -3.20 114.38 111.01 1n5g h ARG 22 Ca 0.34 0.02 -0.02 0.00 -0.00 0.00 0.00 59.98 60.32 1n5g h ARG 22 Cb 0.52 0.08 -0.00 0.00 -0.00 0.00 0.00 29.97 30.56 1n5g h ARG 22 CO 1.00 -0.24 -0.33 1.79 -0.00 0.00 0.00 179.97 182.20 1n5g h THR 23 N -0.37 0.00 -3.55 0.08 1.35 -1.98 -3.50 112.91 104.94 1n5g h THR 23 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 1n5g h THR 23 Cb 0.30 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.72 1n5g h THR 23 CO 0.01 0.00 -0.71 0.61 -0.25 0.00 0.00 175.52 175.19 1n5g n GLY 24 N -1.42 -4.95 2.86 5.82 0.00 -1.21 -4.80 105.19 101.49 1n5g n GLY 24 Ca -0.10 -0.32 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 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 1.40 3.23 0.00 1.61 -0.04 -1.26 -4.54 135.00 135.40 1n5g n PRO 25 Ca 0.00 -3.71 0.00 0.00 -0.04 0.00 0.00 63.50 59.75 1n5g n PRO 25 Cb 0.00 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.15 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 -0.43 0.00 -4.45 1.53 4.32 -1.26 -5.08 117.00 111.62 1n5g n LEU 26 Ca 0.53 0.00 -0.33 0.00 -0.02 0.00 0.00 56.01 56.18 1n5g n LEU 26 Cb 0.24 -0.12 -0.13 0.00 -1.62 0.00 0.00 43.42 41.79 1n5g n LEU 26 CO 0.51 -0.19 -0.40 0.00 -1.22 0.00 0.00 177.39 176.09 1n5g n PRO 28 N 3.34 3.20 -3.43 0.00 -0.04 -1.26 -4.32 135.00 132.49 1n5g n PRO 28 Ca -0.18 -3.28 -0.22 0.00 -0.04 0.00 0.00 63.50 59.78 1n5g n PRO 28 Cb 0.53 -3.48 0.05 0.00 -0.04 0.00 0.00 33.50 30.56 1n5g n PRO 28 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n5g n ALA 29 N 8.28 -2.52 1.33 0.55 0.00 -1.26 -5.02 120.51 121.86 1n5g n ALA 29 Ca 0.49 -0.04 0.14 0.00 0.00 0.00 0.00 53.44 54.03 1n5g n ALA 29 Cb 0.46 -4.80 0.71 0.00 0.00 0.00 0.00 19.45 15.81 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 0.50 -0.94 0.00 -1.53 -1.91 -2.98 114.93 108.06 1n5g h MET 31 Ca 0.00 -0.62 0.11 0.00 -3.44 0.00 0.00 59.70 55.75 1n5g h MET 31 Cb 0.27 0.19 -0.07 0.00 -0.55 0.00 0.00 31.60 31.44 1n5g h MET 31 CO 0.00 1.24 0.60 1.57 0.14 0.00 0.00 176.91 180.47 1n5g h LYS 32 N 0.24 0.91 -0.62 0.39 2.10 -2.00 -3.14 116.57 114.45 1n5g h LYS 32 Ca -0.13 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.47 1n5g h LYS 32 Cb 1.77 -0.20 -0.03 0.00 -0.90 0.00 0.00 32.23 32.86 1n5g h LYS 32 CO 0.20 0.60 0.39 0.00 -2.00 0.00 0.00 179.45 178.64 1n5g h ALA 33 N 1.54 1.51 -0.77 0.07 0.00 -1.76 -3.16 119.26 116.70 1n5g h ALA 33 Ca 0.45 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.25 1n5g h ALA 33 Cb 0.45 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1n5g h ALA 33 CO -0.21 0.44 0.28 1.15 0.00 0.00 0.00 179.25 180.91 1n5g h THR 34 N 0.85 1.26 -0.98 0.00 2.02 -1.51 -3.36 112.91 111.20 1n5g h THR 34 Ca 0.23 -0.85 0.26 0.00 0.77 0.00 0.00 66.41 66.82 1n5g h THR 34 Cb -0.06 0.37 -0.13 0.00 -1.74 0.00 0.00 68.15 66.59 1n5g h THR 34 CO -0.05 0.34 0.53 -0.07 0.37 0.00 0.00 175.52 176.65 1n5g h LEU 35 N 1.12 0.54 0.28 2.58 4.07 -1.51 -1.95 115.31 120.45 1n5g h LEU 35 Ca 0.25 0.16 -0.01 0.00 0.08 0.00 0.00 57.88 58.36 1n5g h LEU 35 Cb 0.25 0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.08 1n5g h LEU 35 CO -0.02 0.01 -0.13 1.56 -1.08 0.00 0.00 178.44 178.78 1n5g h GLN 36 N 0.47 -0.36 0.00 1.13 4.20 -1.70 -3.37 115.11 115.48 1n5g h GLN 36 Ca 0.65 0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.38 1n5g h GLN 36 Cb 1.30 0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.16 1n5g h GLN 36 CO -0.53 -0.09 0.03 -0.35 -0.67 0.00 0.00 178.83 177.22 1n5g n PRO 37 N -5.02 0.09 0.00 1.46 -0.04 -1.21 -5.19 135.00 125.08 1n5g n PRO 37 Ca -0.07 0.58 0.11 0.00 -0.04 0.00 0.00 63.50 64.08 1n5g n PRO 37 Cb 0.22 -1.82 0.09 0.00 -0.04 0.00 0.00 33.50 31.95 1n5g n PRO 37 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61