#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 -0.07 -1.72 5.67 4.07 -2.03 -0.99 115.31 120.24 1n5g h LEU 2 Ca 0.00 -0.57 0.00 0.00 0.08 0.00 0.00 57.88 57.39 1n5g h LEU 2 Cb 0.00 0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.76 1n5g h LEU 2 CO 0.00 0.62 0.31 -0.29 -1.08 0.00 0.00 178.44 178.00 1n5g h ILE 3 N -0.86 0.00 0.00 1.22 6.09 -2.06 -3.11 117.51 118.79 1n5g h ILE 3 Ca -0.01 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.48 1n5g h ILE 3 Cb 0.63 0.57 0.00 0.00 0.47 0.00 0.00 36.82 38.50 1n5g h ILE 3 CO 0.01 0.00 0.00 0.00 -3.07 0.00 0.00 178.15 175.09 1n5g h GLU 5 N 0.00 -0.56 0.74 0.00 4.11 -1.10 -2.70 114.58 115.07 1n5g h GLU 5 Ca 0.00 0.04 -0.04 0.00 0.07 0.00 0.00 59.36 59.43 1n5g h GLU 5 Cb 0.00 0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.38 1n5g h GLU 5 CO 0.00 -0.37 -0.35 1.49 0.07 0.00 0.00 179.01 179.84 1n5g h GLU 6 N -0.58 -0.95 0.09 1.06 4.57 -1.86 -3.26 114.58 113.64 1n5g h GLU 6 Ca 0.03 0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1n5g h GLU 6 Cb 0.67 0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.48 1n5g h GLU 6 CO -0.42 -0.63 -0.04 -1.00 -1.18 0.00 0.00 179.01 175.74 1n5g h PRO 7 N -1.24 -0.11 -0.25 0.92 0.13 -1.83 -2.94 132.00 126.67 1n5g h PRO 7 Ca -0.10 0.01 0.04 0.00 -0.87 0.00 0.00 66.00 65.07 1n5g h PRO 7 Cb 0.77 0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.89 1n5g h PRO 7 CO 0.17 -0.07 0.03 1.15 -0.23 0.00 0.00 178.00 179.04 1n5g h THR 8 N -0.63 0.86 -0.51 1.56 2.02 -1.69 -2.50 112.91 112.03 1n5g h THR 8 Ca -0.01 -0.04 -0.13 0.00 0.77 0.00 0.00 66.41 67.00 1n5g h THR 8 Cb 0.09 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1n5g h THR 8 CO 0.02 0.02 -0.18 0.00 0.37 0.00 0.00 175.52 175.75 1n5g h ARG 10 N 0.88 0.58 -0.78 0.00 2.43 -1.39 -1.43 114.38 114.67 1n5g h ARG 10 Ca 0.12 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 1n5g h ARG 10 Cb 0.76 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.14 1n5g h ARG 10 CO 0.06 0.39 0.45 -0.91 -1.51 0.00 0.00 179.97 178.46 1n5g h ASN 11 N 0.59 0.95 -0.92 -3.80 2.35 -1.39 -2.94 115.58 110.41 1n5g h ASN 11 Ca 0.16 -0.07 0.14 0.00 -0.55 0.00 0.00 56.30 55.98 1n5g h ASN 11 Cb -0.06 -0.24 -0.08 0.00 0.05 0.00 0.00 38.32 38.00 1n5g h ASN 11 CO -0.03 0.75 0.59 0.08 -1.65 0.00 0.00 177.43 177.17 1n5g h ARG 12 N 1.09 0.75 -0.76 0.81 0.11 -0.43 -2.35 114.38 113.60 1n5g h ARG 12 Ca 0.28 -0.05 0.06 0.00 0.10 0.00 0.00 59.98 60.37 1n5g h ARG 12 Cb -0.01 -0.17 -0.06 0.00 1.11 0.00 0.00 29.97 30.84 1n5g h ARG 12 CO -0.05 0.50 0.45 1.15 0.10 0.00 0.00 179.97 182.12 1n5g h THR 13 N 0.77 1.00 -0.99 0.08 2.02 -1.12 0.11 112.91 114.79 1n5g h THR 13 Ca 0.47 -0.28 0.29 0.00 0.77 0.00 0.00 66.41 67.66 1n5g h THR 13 Cb 0.66 0.11 -0.14 0.00 -1.74 0.00 0.00 68.15 67.04 1n5g h THR 13 CO -0.23 0.15 0.54 0.03 0.37 0.00 0.00 175.52 176.38 1n5g h ARG 14 N 0.82 0.37 0.00 6.66 3.08 -1.31 -1.32 114.38 122.67 1n5g h ARG 14 Ca 0.34 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.36 1n5g h ARG 14 Cb 0.18 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 1n5g h ARG 14 CO -0.18 0.24 -0.03 0.45 -1.07 0.00 0.00 179.97 179.38 1n5g h HIS 15 N 0.38 0.00 -1.06 3.04 3.86 -0.56 -3.35 115.15 117.46 1n5g h HIS 15 Ca 0.69 0.00 0.29 0.00 -1.16 0.00 0.00 60.37 60.19 1n5g h HIS 15 Cb 1.50 0.00 -0.12 0.00 1.06 0.00 0.00 27.41 29.85 1n5g h HIS 15 CO -0.04 0.03 0.65 1.25 0.86 0.00 0.00 177.93 180.69 1n5g h LEU 16 N 0.00 0.50 -0.70 2.43 6.46 -1.09 0.51 115.31 123.42 1n5g h LEU 16 Ca -0.00 0.13 -0.08 0.00 -0.12 0.00 0.00 57.88 57.80 1n5g h LEU 16 Cb 0.10 0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.06 1n5g h LEU 16 CO 0.00 0.02 0.09 1.55 -0.62 0.00 0.00 178.44 179.48 1n5g h PRO 17 N 0.40 1.09 -0.51 5.25 0.13 -1.76 -3.26 132.00 133.34 1n5g h PRO 17 Ca 0.66 -0.30 -0.04 0.00 -0.87 0.00 0.00 66.00 65.46 1n5g h PRO 17 Cb 1.58 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.57 1n5g h PRO 17 CO -0.42 1.01 0.14 1.37 -0.23 0.00 0.00 178.00 179.86 1n5g h LEU 18 N 1.02 0.70 -0.37 1.56 8.10 -1.61 -3.49 115.31 121.22 1n5g h LEU 18 Ca 0.20 -0.11 -0.47 0.00 0.11 0.00 0.00 57.88 57.61 1n5g h LEU 18 Cb 0.46 -0.18 -0.17 0.00 -0.44 0.00 0.00 40.66 40.32 1n5g h LEU 18 CO 0.02 0.68 -0.70 1.67 -4.11 0.00 0.00 178.44 176.00 1n5g n GLN 19 N -4.30 -2.96 -0.03 0.17 7.27 0.10 -4.93 117.38 112.70 1n5g n GLN 19 Ca 0.04 0.36 0.04 0.00 0.07 0.00 0.00 57.00 57.51 1n5g n GLN 19 Cb 0.20 -5.05 -0.13 0.00 2.41 0.00 0.00 30.24 27.67 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 -4.08 0.00 -1.55 3.69 1.16 -1.26 -4.57 117.46 110.85 1n5g n PHE 20 Ca 0.05 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.26 1n5g n PHE 20 Cb 0.50 -0.48 0.06 0.00 -1.61 0.00 0.00 39.48 37.95 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 -2.21 7.63 0.13 5.98 2.88 -1.26 -4.84 113.62 121.93 1n5g n SER 21 Ca -0.09 -3.81 -0.15 0.00 -1.33 0.00 0.00 58.87 53.50 1n5g n SER 21 Cb 0.58 -1.01 -0.09 0.00 -0.75 0.00 0.00 64.21 62.95 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 2.37 -0.68 0.65 -1.46 -0.00 -1.96 -3.18 114.38 110.11 1n5g h ARG 22 Ca 0.59 0.05 -0.03 0.00 -0.00 0.00 0.00 59.98 60.59 1n5g h ARG 22 Cb 0.52 0.16 0.01 0.00 -0.00 0.00 0.00 29.97 30.65 1n5g h ARG 22 CO 1.54 -0.46 -0.31 1.79 -0.00 0.00 0.00 179.97 182.53 1n5g h THR 23 N -0.71 0.00 -3.10 0.08 1.35 -1.98 -3.50 112.91 105.05 1n5g h THR 23 Ca -0.01 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1n5g h THR 23 Cb 0.69 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.11 1n5g h THR 23 CO -0.23 0.00 -0.70 0.61 -0.25 0.00 0.00 175.52 174.95 1n5g n GLY 24 N -0.84 -4.67 2.78 5.82 0.00 -1.21 -4.79 105.19 102.29 1n5g n GLY 24 Ca -0.11 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 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 0.47 3.80 0.01 1.61 -0.04 -1.26 -4.53 135.00 135.06 1n5g n PRO 25 Ca 0.00 -4.62 -0.02 0.00 -0.04 0.00 0.00 63.50 58.83 1n5g n PRO 25 Cb 0.00 -2.30 -0.01 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 -0.27 1.08 -4.16 1.53 4.32 -1.26 -5.08 117.00 113.15 1n5g n LEU 26 Ca 0.39 0.15 -0.34 0.00 -0.02 0.00 0.00 56.01 56.19 1n5g n LEU 26 Cb 0.39 -0.38 -0.14 0.00 -1.62 0.00 0.00 43.42 41.67 1n5g n LEU 26 CO 0.40 -0.61 -0.38 0.00 -1.22 0.00 0.00 177.39 175.59 1n5g n PRO 28 N 4.60 0.19 -3.58 0.00 -0.04 -1.26 -4.37 135.00 130.54 1n5g n PRO 28 Ca -0.14 -1.22 -0.22 0.00 -0.04 0.00 0.00 63.50 61.88 1n5g n PRO 28 Cb 0.44 -3.40 0.02 0.00 -0.04 0.00 0.00 33.50 30.51 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 17.25 -2.63 0.86 0.55 0.00 -1.26 -5.01 120.51 130.27 1n5g n ALA 29 Ca 0.39 -0.21 0.13 0.00 0.00 0.00 0.00 53.44 53.75 1n5g n ALA 29 Cb 0.45 -2.23 0.33 0.00 0.00 0.00 0.00 19.45 18.00 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 0.00 0.00 0.00 -1.53 -1.92 -2.70 114.93 108.78 1n5g h MET 31 Ca 0.00 0.00 -0.03 0.00 -3.44 0.00 0.00 59.70 56.23 1n5g h MET 31 Cb 0.58 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.63 1n5g h MET 31 CO 0.00 0.82 -0.12 1.57 0.14 0.00 0.00 176.91 179.32 1n5g h LYS 32 N 0.00 0.00 -0.07 0.39 2.10 -1.99 -3.10 116.57 113.90 1n5g h LYS 32 Ca -0.01 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.47 1n5g h LYS 32 Cb 1.62 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.94 1n5g h LYS 32 CO 0.11 0.12 -0.70 0.00 -2.00 0.00 0.00 179.45 176.97 1n5g h ALA 33 N 1.88 0.66 -0.42 0.07 0.00 -1.71 -3.20 119.26 116.55 1n5g h ALA 33 Ca -0.00 -0.60 0.01 0.00 0.00 0.00 0.00 54.91 54.33 1n5g h ALA 33 Cb 0.22 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1n5g h ALA 33 CO 0.02 0.77 0.26 1.15 0.00 0.00 0.00 179.25 181.44 1n5g h THR 34 N 0.23 1.06 -0.88 0.00 2.02 -1.44 -3.34 112.91 110.56 1n5g h THR 34 Ca -0.02 -0.18 0.11 0.00 0.77 0.00 0.00 66.41 67.09 1n5g h THR 34 Cb 1.26 0.49 -0.07 0.00 -1.74 0.00 0.00 68.15 68.10 1n5g h THR 34 CO 0.12 0.10 0.57 -0.07 0.37 0.00 0.00 175.52 176.60 1n5g h LEU 35 N 0.52 0.75 0.14 2.58 4.07 -1.54 -2.34 115.31 119.48 1n5g h LEU 35 Ca 0.16 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 58.15 1n5g h LEU 35 Cb -0.01 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 41.61 1n5g h LEU 35 CO -0.07 0.42 -0.07 1.56 -1.08 0.00 0.00 178.44 179.21 1n5g h GLN 36 N 0.81 -0.18 0.00 1.13 4.20 -1.67 -3.36 115.11 116.04 1n5g h GLN 36 Ca 0.42 0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.14 1n5g h GLN 36 Cb 0.51 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.33 1n5g h GLN 36 CO -0.18 -0.12 0.44 -1.00 -0.67 0.00 0.00 178.83 177.30 1n5g h PRO 37 N -0.23 0.00 -0.02 1.46 0.13 -1.74 -3.53 132.00 128.07 1n5g h PRO 37 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1n5g h PRO 37 Cb 0.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.27 1n5g h PRO 37 CO 0.03 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 176.95