#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n5g n LEU 2 N 0.00 2.65 0.27 5.67 4.32 -1.26 -1.88 117.00 126.77 1n5g n LEU 2 Ca 0.00 0.09 0.15 0.00 -0.02 0.00 0.00 56.01 56.23 1n5g n LEU 2 Cb 0.00 -0.97 0.86 0.00 -1.62 0.00 0.00 43.42 41.69 1n5g n LEU 2 CO 0.00 0.86 1.13 -0.29 -1.22 0.00 0.00 177.39 177.87 1n5g h ILE 3 N 0.04 0.57 0.26 -0.08 6.09 -2.05 -2.91 117.51 119.43 1n5g h ILE 3 Ca -0.48 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.00 1n5g h ILE 3 Cb 1.99 0.96 0.00 0.00 0.47 0.00 0.00 36.82 40.24 1n5g h ILE 3 CO 0.03 0.00 -0.12 0.00 -3.07 0.00 0.00 178.15 174.98 1n5g h GLU 5 N -0.41 -0.66 0.49 0.00 4.11 -1.16 -1.15 114.58 115.81 1n5g h GLU 5 Ca -0.04 0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.42 1n5g h GLU 5 Cb 0.26 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1n5g h GLU 5 CO 0.06 -0.44 -0.24 1.49 0.07 0.00 0.00 179.01 179.95 1n5g h GLU 6 N -0.68 -0.64 0.00 1.06 4.57 -1.82 -3.33 114.58 113.74 1n5g h GLU 6 Ca -0.02 0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1n5g h GLU 6 Cb 0.65 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.38 1n5g h GLU 6 CO -0.17 -0.36 -0.00 -1.00 -1.18 0.00 0.00 179.01 176.30 1n5g h PRO 7 N -0.83 -0.01 0.77 0.92 0.13 -1.75 -3.36 132.00 127.86 1n5g h PRO 7 Ca -0.07 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.02 1n5g h PRO 7 Cb 0.58 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.72 1n5g h PRO 7 CO 0.11 0.56 -0.37 1.15 -0.23 0.00 0.00 178.00 179.22 1n5g h THR 8 N -1.00 0.07 -0.61 1.56 2.02 -1.40 -3.25 112.91 110.30 1n5g h THR 8 Ca -0.00 -0.22 -0.06 0.00 0.77 0.00 0.00 66.41 66.90 1n5g h THR 8 Cb 0.57 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 67.04 1n5g h THR 8 CO 0.00 0.01 0.15 0.00 0.37 0.00 0.00 175.52 176.04 1n5g h ARG 10 N 0.92 0.25 -0.18 0.00 2.43 -1.68 0.36 114.38 116.47 1n5g h ARG 10 Ca 0.20 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.34 1n5g h ARG 10 Cb 0.33 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1n5g h ARG 10 CO 0.00 0.17 0.05 -0.91 -1.51 0.00 0.00 179.97 177.76 1n5g h ASN 11 N 0.26 0.27 -0.05 -3.80 2.35 -1.52 -3.23 115.58 109.86 1n5g h ASN 11 Ca 0.40 -0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 55.91 1n5g h ASN 11 Cb 1.17 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.46 1n5g h ASN 11 CO -0.10 0.42 -0.02 0.08 -1.65 0.00 0.00 177.43 176.16 1n5g h ARG 12 N 0.11 0.20 -0.79 0.81 0.11 -0.75 -3.03 114.38 111.04 1n5g h ARG 12 Ca 0.06 -0.03 0.11 0.00 0.10 0.00 0.00 59.98 60.21 1n5g h ARG 12 Cb 0.25 -0.04 -0.05 0.00 1.11 0.00 0.00 29.97 31.24 1n5g h ARG 12 CO -0.00 0.24 0.51 1.15 0.10 0.00 0.00 179.97 181.98 1n5g h THR 13 N 0.20 0.92 0.00 0.08 2.02 -1.01 -0.86 112.91 114.26 1n5g h THR 13 Ca 0.05 -0.23 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 1n5g h THR 13 Cb 0.18 0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1n5g h THR 13 CO 0.01 0.12 -0.16 0.03 0.37 0.00 0.00 175.52 175.89 1n5g h ARG 14 N 0.68 0.00 0.00 6.66 3.08 -1.55 -2.38 114.38 120.87 1n5g h ARG 14 Ca 0.37 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.34 1n5g h ARG 14 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 1n5g h ARG 14 CO -0.14 0.16 -0.36 0.45 -1.07 0.00 0.00 179.97 179.01 1n5g h HIS 15 N 0.00 0.00 -0.99 3.04 3.86 -1.12 -3.37 115.15 116.56 1n5g h HIS 15 Ca -0.00 0.00 0.20 0.00 -1.16 0.00 0.00 60.37 59.41 1n5g h HIS 15 Cb 0.42 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 28.79 1n5g h HIS 15 CO 0.00 0.36 0.62 1.25 0.86 0.00 0.00 177.93 181.01 1n5g h LEU 16 N 0.00 0.68 -0.84 2.43 6.46 -1.12 0.40 115.31 123.33 1n5g h LEU 16 Ca -0.00 0.09 0.20 0.00 -0.12 0.00 0.00 57.88 58.04 1n5g h LEU 16 Cb 0.74 -0.03 -0.12 0.00 -0.73 0.00 0.00 40.66 40.51 1n5g h LEU 16 CO 0.05 0.23 0.28 1.55 -0.62 0.00 0.00 178.44 179.93 1n5g h PRO 17 N 0.66 0.31 0.04 5.25 0.13 -1.80 -2.73 132.00 133.85 1n5g h PRO 17 Ca 0.56 -0.02 -0.22 0.00 -0.87 0.00 0.00 66.00 65.46 1n5g h PRO 17 Cb 1.02 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.07 1n5g h PRO 17 CO -0.34 0.20 -1.01 1.37 -0.23 0.00 0.00 178.00 178.00 1n5g h LEU 18 N 0.32 0.20 0.28 1.56 8.10 -0.48 -3.49 115.31 121.80 1n5g h LEU 18 Ca 0.50 -0.19 -0.41 0.00 0.11 0.00 0.00 57.88 57.89 1n5g h LEU 18 Cb 0.93 -0.06 0.01 0.00 -0.44 0.00 0.00 40.66 41.10 1n5g h LEU 18 CO -0.55 1.08 -0.63 1.67 -4.11 0.00 0.00 178.44 175.91 1n5g n GLN 19 N -3.52 -5.00 -0.04 0.17 7.27 -0.69 -4.92 117.38 110.64 1n5g n GLN 19 Ca -0.04 0.72 -0.05 0.00 0.07 0.00 0.00 57.00 57.71 1n5g n GLN 19 Cb 0.90 -5.58 -0.07 0.00 2.41 0.00 0.00 30.24 27.91 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 -4.45 0.00 -2.47 3.69 1.16 -1.26 -4.59 117.46 109.54 1n5g n PHE 20 Ca -0.04 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.13 1n5g n PHE 20 Cb 0.57 -0.43 0.01 0.00 -1.61 0.00 0.00 39.48 38.02 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 -2.37 7.40 -0.21 5.98 2.88 -1.26 -4.71 113.62 121.33 1n5g n SER 21 Ca -0.15 -3.48 -0.04 0.00 -1.33 0.00 0.00 58.87 53.88 1n5g n SER 21 Cb 0.78 -1.25 0.15 0.00 -0.75 0.00 0.00 64.21 63.14 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 4.50 1.01 0.00 -1.46 -0.00 -1.98 -3.38 114.38 113.07 1n5g h ARG 22 Ca 0.55 -0.17 0.00 0.00 -0.00 0.00 0.00 59.98 60.36 1n5g h ARG 22 Cb 0.35 -0.17 0.00 0.00 -0.00 0.00 0.00 29.97 30.15 1n5g h ARG 22 CO 1.30 0.83 0.00 0.25 -0.00 0.00 0.00 179.97 182.35 1n5g n THR 23 N -4.29 0.00 -0.95 0.08 -2.24 -1.26 -5.02 114.28 100.59 1n5g n THR 23 Ca 0.06 0.47 0.00 0.00 -2.27 0.00 0.00 64.05 62.31 1n5g n THR 23 Cb 0.18 -1.40 0.00 0.00 -2.10 0.00 0.00 70.33 67.01 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 2.00 -4.20 1.02 3.38 0.00 -1.26 -4.63 105.19 101.50 1n5g n GLY 24 Ca 0.00 -0.66 -0.02 0.00 0.00 0.00 0.00 46.02 45.34 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 0.29 1.40 0.00 1.61 -0.04 -1.26 -4.42 135.00 132.58 1n5g n PRO 25 Ca 0.00 -0.52 0.00 0.00 -0.04 0.00 0.00 63.50 62.94 1n5g n PRO 25 Cb 0.00 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 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 0.17 0.00 -4.58 1.53 4.32 -1.26 -5.05 117.00 112.14 1n5g n LEU 26 Ca 0.08 0.00 -0.34 0.00 -0.02 0.00 0.00 56.01 55.73 1n5g n LEU 26 Cb 0.58 -0.38 -0.11 0.00 -1.62 0.00 0.00 43.42 41.90 1n5g n LEU 26 CO 0.08 -0.43 -0.31 0.00 -1.22 0.00 0.00 177.39 175.52 1n5g s PRO 28 N 0.20 3.85 -1.09 0.00 0.04 -1.26 -4.42 135.00 132.32 1n5g s PRO 28 Ca 0.01 -2.60 -0.05 0.00 0.04 0.00 0.00 61.00 58.40 1n5g s PRO 28 Cb -0.13 -4.63 -0.05 0.00 0.04 0.00 0.00 34.50 29.73 1n5g s PRO 28 CO 0.02 -1.41 0.92 0.00 0.04 0.00 0.00 177.00 176.57 1n5g n ALA 29 N 4.22 -2.38 1.40 8.56 0.00 -1.26 -5.01 120.51 126.03 1n5g n ALA 29 Ca 0.21 0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.81 1n5g n ALA 29 Cb 0.44 -4.92 0.37 0.00 0.00 0.00 0.00 19.45 15.34 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 1.55 0.31 -0.40 0.00 4.05 -1.92 -3.24 114.93 115.28 1n5g h MET 31 Ca 0.00 -0.39 -0.13 0.00 -0.28 0.00 0.00 59.70 58.90 1n5g h MET 31 Cb 0.34 0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 31.25 1n5g h MET 31 CO 0.00 1.10 -0.26 1.57 0.23 0.00 0.00 176.91 179.55 1n5g h LYS 32 N 0.15 0.84 -0.53 0.39 2.10 -2.00 -3.20 116.57 114.32 1n5g h LYS 32 Ca -0.09 -0.37 0.15 0.00 -2.00 0.00 0.00 60.65 58.34 1n5g h LYS 32 Cb 1.69 -0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 32.97 1n5g h LYS 32 CO 0.17 1.01 0.38 0.00 -2.00 0.00 0.00 179.45 179.01 1n5g h ALA 33 N 0.97 2.43 -0.40 0.07 0.00 -1.80 -1.75 119.26 118.79 1n5g h ALA 33 Ca 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1n5g h ALA 33 Cb 0.81 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1n5g h ALA 33 CO 0.07 -0.58 0.21 1.15 0.00 0.00 0.00 179.25 180.09 1n5g h THR 34 N 0.05 1.16 -0.91 0.00 2.02 -1.58 -3.36 112.91 110.30 1n5g h THR 34 Ca 0.25 -0.45 0.23 0.00 0.77 0.00 0.00 66.41 67.21 1n5g h THR 34 Cb 0.95 0.72 -0.06 0.00 -1.74 0.00 0.00 68.15 68.02 1n5g h THR 34 CO -0.02 0.17 0.61 -0.07 0.37 0.00 0.00 175.52 176.59 1n5g h LEU 35 N 0.51 0.29 0.27 2.58 4.07 -1.31 -2.36 115.31 119.36 1n5g h LEU 35 Ca 0.14 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 58.12 1n5g h LEU 35 Cb 0.09 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.82 1n5g h LEU 35 CO -0.02 0.10 -0.13 1.56 -1.08 0.00 0.00 178.44 178.88 1n5g h GLN 36 N 0.28 -0.34 0.00 1.13 4.20 -1.71 -3.39 115.11 115.28 1n5g h GLN 36 Ca 0.47 0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.20 1n5g h GLN 36 Cb 1.36 0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.22 1n5g h GLN 36 CO -0.14 -0.06 0.00 -1.00 -0.67 0.00 0.00 178.83 176.96 1n5g h PRO 37 N -1.01 0.00 -0.02 1.46 0.13 -1.62 -3.53 132.00 127.42 1n5g h PRO 37 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1n5g h PRO 37 Cb 0.44 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.57 1n5g h PRO 37 CO 0.06 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 176.98