#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 0.90 -1.47 5.67 4.07 -2.04 -2.19 115.31 120.25 1n5g h LEU 2 Ca 0.00 -0.45 0.00 0.00 0.08 0.00 0.00 57.88 57.51 1n5g h LEU 2 Cb 0.00 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.49 1n5g h LEU 2 CO 0.00 1.16 0.00 -0.29 -1.08 0.00 0.00 178.44 178.23 1n5g h ILE 3 N 0.64 0.00 0.21 1.22 6.09 -2.06 -3.20 117.51 120.42 1n5g h ILE 3 Ca 0.06 -0.24 -0.01 0.00 -1.37 0.00 0.00 64.86 63.30 1n5g h ILE 3 Cb 0.88 1.06 0.00 0.00 0.47 0.00 0.00 36.82 39.24 1n5g h ILE 3 CO 0.08 0.00 -0.10 0.00 -3.07 0.00 0.00 178.15 175.06 1n5g h GLU 5 N -0.42 -0.69 0.16 0.00 4.11 -1.40 -2.40 114.58 113.94 1n5g h GLU 5 Ca -0.03 0.05 -0.01 0.00 0.07 0.00 0.00 59.36 59.44 1n5g h GLU 5 Cb 0.22 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1n5g h GLU 5 CO 0.05 -0.46 -0.08 1.49 0.07 0.00 0.00 179.01 180.08 1n5g h GLU 6 N -0.72 -0.21 0.62 1.06 4.57 -1.87 -3.20 114.58 114.83 1n5g h GLU 6 Ca -0.03 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.14 1n5g h GLU 6 Cb 0.64 0.05 0.01 0.00 -0.16 0.00 0.00 28.75 29.28 1n5g h GLU 6 CO -0.04 -0.14 -0.30 -1.00 -1.18 0.00 0.00 179.01 176.35 1n5g h PRO 7 N -0.54 -0.80 0.10 0.92 0.13 -1.85 -2.47 132.00 127.49 1n5g h PRO 7 Ca -0.02 0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.16 1n5g h PRO 7 Cb 0.17 0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.48 1n5g h PRO 7 CO 0.04 -0.53 -0.05 1.15 -0.23 0.00 0.00 178.00 178.37 1n5g h THR 8 N -0.83 1.03 -0.28 1.56 2.02 -1.73 -2.03 112.91 112.64 1n5g h THR 8 Ca -0.08 -0.49 -0.11 0.00 0.77 0.00 0.00 66.41 66.50 1n5g h THR 8 Cb 0.64 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 1n5g h THR 8 CO 0.14 0.12 -0.27 0.00 0.37 0.00 0.00 175.52 175.88 1n5g h ARG 10 N 0.49 1.08 -0.55 0.00 2.43 -1.25 -1.25 114.38 115.33 1n5g h ARG 10 Ca 0.07 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 1n5g h ARG 10 Cb 0.73 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 1n5g h ARG 10 CO 0.06 0.72 0.12 -0.91 -1.51 0.00 0.00 179.97 178.44 1n5g h ASN 11 N 1.11 0.80 -0.83 -3.80 2.35 -1.26 -1.20 115.58 112.76 1n5g h ASN 11 Ca 0.36 -0.15 0.11 0.00 -0.55 0.00 0.00 56.30 56.07 1n5g h ASN 11 Cb 0.03 -0.21 -0.06 0.00 0.05 0.00 0.00 38.32 38.14 1n5g h ASN 11 CO -0.11 0.79 0.54 0.08 -1.65 0.00 0.00 177.43 177.08 1n5g h ARG 12 N 0.82 0.70 -0.74 0.81 0.11 -1.20 -1.70 114.38 113.19 1n5g h ARG 12 Ca 0.18 -0.04 0.13 0.00 0.10 0.00 0.00 59.98 60.35 1n5g h ARG 12 Cb 0.32 -0.16 -0.05 0.00 1.11 0.00 0.00 29.97 31.19 1n5g h ARG 12 CO 0.00 0.46 0.49 1.15 0.10 0.00 0.00 179.97 182.17 1n5g h THR 13 N 0.72 0.83 -0.16 0.08 2.02 0.03 -0.42 112.91 116.02 1n5g h THR 13 Ca 0.39 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.39 1n5g h THR 13 Cb 0.53 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 1n5g h THR 13 CO -0.16 0.09 -0.01 0.03 0.37 0.00 0.00 175.52 175.83 1n5g h ARG 14 N 0.47 0.23 0.00 6.66 3.08 -1.25 -2.29 114.38 121.28 1n5g h ARG 14 Ca 0.36 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.36 1n5g h ARG 14 Cb 0.73 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.74 1n5g h ARG 14 CO -0.12 0.26 -0.07 0.45 -1.07 0.00 0.00 179.97 179.42 1n5g h HIS 15 N 0.23 0.00 -0.93 3.04 3.86 -0.83 -3.37 115.15 117.15 1n5g h HIS 15 Ca 0.05 0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.34 1n5g h HIS 15 Cb 0.18 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.59 1n5g h HIS 15 CO 0.00 0.07 0.60 1.25 0.86 0.00 0.00 177.93 180.72 1n5g h LEU 16 N 0.00 0.90 -1.11 2.43 6.46 -1.31 -0.26 115.31 122.41 1n5g h LEU 16 Ca -0.00 0.02 -0.07 0.00 -0.12 0.00 0.00 57.88 57.70 1n5g h LEU 16 Cb 0.38 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.12 1n5g h LEU 16 CO 0.01 0.55 -0.35 1.55 -0.62 0.00 0.00 178.44 179.58 1n5g h PRO 17 N 1.01 0.00 -0.33 5.25 0.13 -1.79 -3.34 132.00 132.94 1n5g h PRO 17 Ca 0.42 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.37 1n5g h PRO 17 Cb 0.29 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.42 1n5g h PRO 17 CO -0.17 0.35 -0.48 1.37 -0.23 0.00 0.00 178.00 178.84 1n5g h LEU 18 N 0.00 0.99 0.26 1.56 8.10 -1.34 -3.49 115.31 121.39 1n5g h LEU 18 Ca -0.00 -0.51 -0.11 0.00 0.11 0.00 0.00 57.88 57.37 1n5g h LEU 18 Cb 0.79 -0.28 -0.04 0.00 -0.44 0.00 0.00 40.66 40.69 1n5g h LEU 18 CO 0.05 1.31 -0.10 1.67 -4.11 0.00 0.00 178.44 177.25 1n5g n GLN 19 N -4.03 -0.88 0.00 0.17 7.27 -0.31 -4.92 117.38 114.68 1n5g n GLN 19 Ca -0.04 0.57 0.11 0.00 0.07 0.00 0.00 57.00 57.72 1n5g n GLN 19 Cb 0.60 -4.42 0.05 0.00 2.41 0.00 0.00 30.24 28.88 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 -2.59 0.00 -2.67 3.69 1.16 -1.26 -4.46 117.46 111.32 1n5g n PHE 20 Ca -0.05 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.23 1n5g n PHE 20 Cb 0.30 0.00 -0.01 0.00 -1.61 0.00 0.00 39.48 38.16 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 0.75 5.05 -0.15 5.98 2.88 -1.26 -4.82 113.62 122.04 1n5g n SER 21 Ca 0.12 -3.71 -0.06 0.00 -1.33 0.00 0.00 58.87 53.88 1n5g n SER 21 Cb 0.54 -0.61 -0.00 0.00 -0.75 0.00 0.00 64.21 63.38 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 2.94 -0.20 0.00 -1.46 -0.00 -1.96 -3.23 114.38 110.48 1n5g h ARG 22 Ca 0.26 0.01 0.00 0.00 -0.00 0.00 0.00 59.98 60.25 1n5g h ARG 22 Cb 0.60 0.05 0.00 0.00 -0.00 0.00 0.00 29.97 30.62 1n5g h ARG 22 CO 0.91 -0.13 0.00 0.25 -0.00 0.00 0.00 179.97 180.99 1n5g n THR 23 N -5.42 0.00 -1.90 0.08 -2.24 -1.26 -5.03 114.28 98.51 1n5g n THR 23 Ca 0.02 0.26 -0.00 0.00 -2.27 0.00 0.00 64.05 62.06 1n5g n THR 23 Cb 0.34 -0.85 -0.00 0.00 -2.10 0.00 0.00 70.33 67.72 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 2.20 -4.85 2.57 3.38 0.00 -1.22 -4.84 105.19 102.43 1n5g n GLY 24 Ca 0.00 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 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 1.22 4.47 0.00 1.61 -0.04 -1.26 -4.58 135.00 136.43 1n5g n PRO 25 Ca -0.00 -3.56 0.00 0.00 -0.04 0.00 0.00 63.50 59.90 1n5g n PRO 25 Cb 0.00 -2.67 0.00 0.00 -0.04 0.00 0.00 33.50 30.79 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 1.99 0.00 -4.47 1.53 4.32 -1.26 -5.12 117.00 114.00 1n5g n LEU 26 Ca 0.57 0.00 -0.31 0.00 -0.02 0.00 0.00 56.01 56.25 1n5g n LEU 26 Cb 0.27 0.00 -0.12 0.00 -1.62 0.00 0.00 43.42 41.94 1n5g n LEU 26 CO 0.70 -0.42 -0.49 0.00 -1.22 0.00 0.00 177.39 175.97 1n5g n PRO 28 N 1.52 3.31 -2.51 0.00 -0.04 -1.26 -4.23 135.00 131.79 1n5g n PRO 28 Ca -0.16 -3.24 -0.08 0.00 -0.04 0.00 0.00 63.50 59.97 1n5g n PRO 28 Cb 0.52 -3.10 0.04 0.00 -0.04 0.00 0.00 33.50 30.92 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 5.16 -1.39 1.15 0.55 0.00 -1.26 -4.98 120.51 119.75 1n5g n ALA 29 Ca 0.44 0.04 0.12 0.00 0.00 0.00 0.00 53.44 54.05 1n5g n ALA 29 Cb 0.39 -2.72 0.30 0.00 0.00 0.00 0.00 19.45 17.42 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 0.89 0.73 -0.84 0.00 4.05 -1.92 -2.86 114.93 114.98 1n5g h MET 31 Ca 0.00 -0.15 0.13 0.00 -0.28 0.00 0.00 59.70 59.40 1n5g h MET 31 Cb 0.52 -0.11 -0.09 0.00 -0.80 0.00 0.00 31.60 31.12 1n5g h MET 31 CO 0.00 0.68 0.45 1.57 0.23 0.00 0.00 176.91 179.84 1n5g h LYS 32 N 0.63 0.66 -0.76 0.39 2.10 -1.99 -2.89 116.57 114.71 1n5g h LYS 32 Ca 0.16 -0.04 0.11 0.00 -2.00 0.00 0.00 60.65 58.88 1n5g h LYS 32 Cb 0.24 -0.15 -0.05 0.00 -0.90 0.00 0.00 32.23 31.37 1n5g h LYS 32 CO -0.01 0.44 0.50 0.00 -2.00 0.00 0.00 179.45 178.38 1n5g h ALA 33 N 1.53 1.87 -0.75 0.07 0.00 -1.75 -3.27 119.26 116.95 1n5g h ALA 33 Ca 0.44 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.30 1n5g h ALA 33 Cb 0.57 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1n5g h ALA 33 CO -0.33 -0.05 0.28 1.15 0.00 0.00 0.00 179.25 180.31 1n5g h THR 34 N 0.62 1.25 -0.61 0.00 2.02 -1.29 -3.31 112.91 111.59 1n5g h THR 34 Ca 0.36 -0.83 0.01 0.00 0.77 0.00 0.00 66.41 66.72 1n5g h THR 34 Cb 0.56 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 67.32 1n5g h THR 34 CO -0.13 0.33 0.40 -0.07 0.37 0.00 0.00 175.52 176.42 1n5g h LEU 35 N 1.10 0.69 -0.33 2.58 4.07 -1.60 -2.28 115.31 119.54 1n5g h LEU 35 Ca 0.25 -0.01 -0.12 0.00 0.08 0.00 0.00 57.88 58.07 1n5g h LEU 35 Cb 0.24 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 41.80 1n5g h LEU 35 CO -0.02 0.50 -0.28 1.56 -1.08 0.00 0.00 178.44 179.12 1n5g h GLN 36 N 0.82 0.76 0.00 1.13 4.20 -1.67 -3.26 115.11 117.10 1n5g h GLN 36 Ca 0.23 -0.39 0.00 0.00 0.06 0.00 0.00 58.65 58.55 1n5g h GLN 36 Cb -0.08 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.71 1n5g h GLN 36 CO -0.06 1.01 0.00 -0.35 -0.67 0.00 0.00 178.83 178.76 1n5g n PRO 37 N -4.23 0.04 0.00 1.46 -0.04 -1.24 -5.17 135.00 125.82 1n5g n PRO 37 Ca -0.03 0.26 0.12 0.00 -0.04 0.00 0.00 63.50 63.82 1n5g n PRO 37 Cb 0.47 -1.57 0.17 0.00 -0.04 0.00 0.00 33.50 32.54 1n5g n PRO 37 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61