#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 0.00 -0.21 5.67 4.07 -2.03 -1.55 115.31 121.25 1n5g h LEU 2 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1n5g h LEU 2 Cb 0.00 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1n5g h LEU 2 CO 0.00 0.00 0.00 -0.29 -1.08 0.00 0.00 178.44 177.07 1n5g h ILE 3 N 0.00 0.00 0.00 1.22 6.09 -2.05 -3.30 117.51 119.47 1n5g h ILE 3 Ca 0.11 -0.88 0.00 0.00 -1.37 0.00 0.00 64.86 62.73 1n5g h ILE 3 Cb 0.46 1.87 0.00 0.00 0.47 0.00 0.00 36.82 39.62 1n5g h ILE 3 CO -0.00 0.00 -0.06 0.00 -3.07 0.00 0.00 178.15 175.01 1n5g n GLU 5 N -4.08 0.00 0.20 0.00 0.28 -0.60 -2.29 120.64 114.14 1n5g n GLU 5 Ca -0.01 0.67 -0.09 0.00 -0.16 0.00 0.00 57.16 57.57 1n5g n GLU 5 Cb 0.03 -1.28 -0.05 0.00 1.43 0.00 0.00 31.44 31.58 1n5g n GLU 5 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1n5g h GLU 6 N 0.00 -0.54 0.18 3.44 4.57 -1.85 -3.17 114.58 117.21 1n5g h GLU 6 Ca 0.00 0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1n5g h GLU 6 Cb 0.00 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1n5g h GLU 6 CO 0.00 -0.36 -0.08 -1.00 -1.18 0.00 0.00 179.01 176.39 1n5g h PRO 7 N -0.56 -0.23 -0.56 0.92 0.13 -1.79 -3.17 132.00 126.75 1n5g h PRO 7 Ca -0.05 0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.99 1n5g h PRO 7 Cb 0.45 0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.61 1n5g h PRO 7 CO 0.04 -0.01 -0.09 1.15 -0.23 0.00 0.00 178.00 178.86 1n5g h THR 8 N -1.03 1.27 -0.16 1.56 2.02 -1.72 -2.94 112.91 111.91 1n5g h THR 8 Ca -0.02 -1.25 -0.06 0.00 0.77 0.00 0.00 66.41 65.84 1n5g h THR 8 Cb 0.32 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1n5g h THR 8 CO 0.04 0.45 -0.17 0.00 0.37 0.00 0.00 175.52 176.20 1n5g h ARG 10 N 0.25 -0.87 -0.95 0.00 2.43 -1.51 0.11 114.38 113.84 1n5g h ARG 10 Ca 0.05 0.06 0.18 0.00 -0.81 0.00 0.00 59.98 59.46 1n5g h ARG 10 Cb 0.46 0.20 -0.08 0.00 -0.42 0.00 0.00 29.97 30.13 1n5g h ARG 10 CO 0.03 -0.55 0.60 -0.91 -1.51 0.00 0.00 179.97 177.63 1n5g h ASN 11 N -1.17 0.62 -1.00 -3.80 2.35 -1.57 0.12 115.58 111.14 1n5g h ASN 11 Ca -0.09 0.06 0.12 0.00 -0.55 0.00 0.00 56.30 55.83 1n5g h ASN 11 Cb 0.72 -0.06 -0.08 0.00 0.05 0.00 0.00 38.32 38.95 1n5g h ASN 11 CO 0.15 0.26 0.63 -0.09 -1.65 0.00 0.00 177.43 176.72 1n5g h ARG 12 N 0.62 0.97 0.00 0.81 2.43 -1.18 -2.20 114.38 115.84 1n5g h ARG 12 Ca 0.51 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.60 1n5g h ARG 12 Cb 0.95 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 30.28 1n5g h ARG 12 CO -0.26 0.64 -0.10 1.15 -1.51 0.00 0.00 179.97 179.90 1n5g h THR 13 N 1.00 0.59 0.00 0.20 2.02 0.12 -2.17 112.91 114.67 1n5g h THR 13 Ca 0.49 -0.42 -0.07 0.00 0.77 0.00 0.00 66.41 67.19 1n5g h THR 13 Cb 0.46 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1n5g h THR 13 CO -0.26 0.09 -0.31 0.03 0.37 0.00 0.00 175.52 175.44 1n5g h ARG 14 N 0.00 0.00 -0.29 6.66 -0.00 -1.00 -2.46 114.38 117.30 1n5g h ARG 14 Ca -0.00 0.00 0.08 0.00 -0.50 0.00 0.00 59.98 59.56 1n5g h ARG 14 Cb 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.22 1n5g h ARG 14 CO 0.01 0.31 0.35 0.45 0.00 0.00 0.00 179.97 181.10 1n5g h HIS 15 N 0.00 0.00 0.13 3.04 3.86 -0.77 -3.36 115.15 118.04 1n5g h HIS 15 Ca -0.00 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.23 1n5g h HIS 15 Cb 0.87 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.30 1n5g h HIS 15 CO 0.00 0.00 -0.38 1.25 0.86 0.00 0.00 177.93 179.66 1n5g h LEU 16 N 0.00 -1.10 0.17 2.43 5.85 -1.43 -0.36 115.31 120.87 1n5g h LEU 16 Ca 0.14 0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.99 1n5g h LEU 16 Cb 0.84 0.41 -0.04 0.00 0.37 0.00 0.00 40.66 42.24 1n5g h LEU 16 CO -0.00 -0.46 -0.34 -0.65 -0.34 0.00 0.00 178.44 176.65 1n5g h PRO 17 N -0.61 -0.58 -0.90 5.25 0.10 -1.78 -3.05 132.00 130.43 1n5g h PRO 17 Ca 0.03 0.04 0.25 0.00 0.10 0.00 0.00 66.00 66.41 1n5g h PRO 17 Cb 0.64 0.13 -0.15 0.00 0.10 0.00 0.00 31.00 31.72 1n5g h PRO 17 CO -0.22 -0.39 0.21 1.37 0.10 0.00 0.00 178.00 179.08 1n5g h LEU 18 N -0.60 -0.07 0.00 2.35 8.10 -1.76 -3.47 115.31 119.86 1n5g h LEU 18 Ca 0.02 0.21 0.00 0.00 0.11 0.00 0.00 57.88 58.22 1n5g h LEU 18 Cb 0.61 0.30 0.00 0.00 -0.44 0.00 0.00 40.66 41.13 1n5g h LEU 18 CO -0.17 -0.20 0.00 1.67 -4.11 0.00 0.00 178.44 175.63 1n5g n GLN 19 N -5.27 -0.50 0.11 0.17 7.27 -0.16 -4.89 117.38 114.11 1n5g n GLN 19 Ca 0.22 0.13 0.13 0.00 0.07 0.00 0.00 57.00 57.55 1n5g n GLN 19 Cb 0.72 -4.27 0.40 0.00 2.41 0.00 0.00 30.24 29.50 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 -2.06 0.95 -1.82 3.69 1.16 -1.26 -3.98 117.46 114.14 1n5g n PHE 20 Ca 0.00 0.28 -0.36 0.00 -1.87 0.00 0.00 57.45 55.50 1n5g n PHE 20 Cb 0.13 -0.96 0.05 0.00 -1.61 0.00 0.00 39.48 37.08 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 -2.28 7.03 -0.13 5.98 2.88 -1.26 -4.80 113.62 121.04 1n5g n SER 21 Ca 0.05 -3.80 0.10 0.00 -1.33 0.00 0.00 58.87 53.89 1n5g n SER 21 Cb 0.43 -0.91 0.44 0.00 -0.75 0.00 0.00 64.21 63.41 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 2.59 0.54 0.00 -1.46 -0.00 -1.94 -3.29 114.38 110.80 1n5g h ARG 22 Ca 0.53 -0.03 0.00 0.00 -0.00 0.00 0.00 59.98 60.48 1n5g h ARG 22 Cb 0.49 -0.12 0.00 0.00 -0.00 0.00 0.00 29.97 30.34 1n5g h ARG 22 CO 1.36 0.35 -0.18 0.25 -0.00 0.00 0.00 179.97 181.75 1n5g n THR 23 N -4.48 0.48 -2.06 0.08 -2.24 -1.26 -5.09 114.28 99.71 1n5g n THR 23 Ca 0.11 0.26 -0.02 0.00 -2.27 0.00 0.00 64.05 62.13 1n5g n THR 23 Cb 0.32 -1.52 -0.02 0.00 -2.10 0.00 0.00 70.33 67.02 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 2.44 -4.51 3.40 3.38 0.00 -1.24 -4.89 105.19 103.77 1n5g n GLY 24 Ca -0.03 0.61 -0.45 0.00 0.00 0.00 0.00 46.02 46.16 1n5g n GLY 24 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n5g s PRO 25 N -0.91 3.91 0.00 1.61 0.04 -1.26 -4.02 135.00 134.36 1n5g s PRO 25 Ca -0.12 -2.55 0.00 0.00 0.04 0.00 0.00 61.00 58.37 1n5g s PRO 25 Cb 0.01 -4.76 0.00 0.00 0.04 0.00 0.00 34.50 29.79 1n5g s PRO 25 CO 0.33 -1.53 0.00 1.28 0.04 0.00 0.00 177.00 177.12 1n5g n LEU 26 N 4.71 0.00 -4.56 -3.56 4.32 -1.26 -5.16 117.00 111.49 1n5g n LEU 26 Ca 0.26 0.00 -0.25 0.00 -0.02 0.00 0.00 56.01 56.00 1n5g n LEU 26 Cb 0.44 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.15 1n5g n LEU 26 CO 0.49 -0.25 -0.38 0.00 -1.22 0.00 0.00 177.39 176.03 1n5g n PRO 28 N -0.80 3.19 -3.50 0.00 -0.04 -1.26 -4.31 135.00 128.28 1n5g n PRO 28 Ca -0.05 -3.22 -0.23 0.00 -0.04 0.00 0.00 63.50 59.96 1n5g n PRO 28 Cb 0.62 -3.29 0.07 0.00 -0.04 0.00 0.00 33.50 30.86 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 6.71 -1.23 1.63 0.55 0.00 -1.26 -4.87 120.51 122.04 1n5g n ALA 29 Ca 0.47 0.38 0.15 0.00 0.00 0.00 0.00 53.44 54.44 1n5g n ALA 29 Cb 0.42 -5.20 0.82 0.00 0.00 0.00 0.00 19.45 15.49 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 -0.27 -0.23 0.00 -1.53 -1.89 -3.11 114.93 107.90 1n5g h MET 31 Ca 0.00 0.02 0.07 0.00 -3.44 0.00 0.00 59.70 56.35 1n5g h MET 31 Cb 0.15 0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 31.25 1n5g h MET 31 CO 0.00 0.11 0.27 1.57 0.14 0.00 0.00 176.91 178.99 1n5g h LYS 32 N -0.74 0.00 -0.35 0.39 2.10 -1.97 -2.64 116.57 113.35 1n5g h LYS 32 Ca -0.03 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.60 1n5g h LYS 32 Cb 0.50 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.82 1n5g h LYS 32 CO 0.05 0.00 0.14 0.00 -2.00 0.00 0.00 179.45 177.64 1n5g h ALA 33 N 1.69 0.46 -1.01 0.07 0.00 -1.72 -3.31 119.26 115.44 1n5g h ALA 33 Ca 0.11 -0.13 0.24 0.00 0.00 0.00 0.00 54.91 55.13 1n5g h ALA 33 Cb 0.64 -0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.18 1n5g h ALA 33 CO -0.00 0.06 0.62 1.15 0.00 0.00 0.00 179.25 181.08 1n5g h THR 34 N 0.42 0.57 -0.70 0.00 2.02 -1.40 -2.26 112.91 111.56 1n5g h THR 34 Ca 0.12 -0.20 0.07 0.00 0.77 0.00 0.00 66.41 67.17 1n5g h THR 34 Cb 0.19 -0.05 -0.06 0.00 -1.74 0.00 0.00 68.15 66.49 1n5g h THR 34 CO -0.01 0.10 0.39 -0.07 0.37 0.00 0.00 175.52 176.31 1n5g h LEU 35 N 0.57 0.57 0.20 2.58 4.07 -1.64 -2.51 115.31 119.15 1n5g h LEU 35 Ca 0.62 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 58.60 1n5g h LEU 35 Cb 1.23 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.89 1n5g h LEU 35 CO -0.41 0.36 -0.10 1.56 -1.08 0.00 0.00 178.44 178.78 1n5g h GLN 36 N 0.71 -0.26 -0.29 1.13 4.20 -1.52 0.16 115.11 119.24 1n5g h GLN 36 Ca 0.32 0.02 0.08 0.00 0.06 0.00 0.00 58.65 59.13 1n5g h GLN 36 Cb 0.22 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 1n5g h GLN 36 CO -0.20 0.06 0.45 -1.00 -0.67 0.00 0.00 178.83 177.48 1n5g h PRO 37 N -0.60 0.00 -0.03 1.46 0.13 -1.71 -3.54 132.00 127.71 1n5g h PRO 37 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 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 0.04 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 176.96