#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 0.40 -2.00 5.67 4.07 -2.02 -0.53 115.31 120.90 1n5g h LEU 2 Ca 0.00 0.05 0.19 0.00 0.08 0.00 0.00 57.88 58.20 1n5g h LEU 2 Cb 0.00 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 41.69 1n5g h LEU 2 CO 0.00 0.14 0.47 -0.29 -1.08 0.00 0.00 178.44 177.67 1n5g h ILE 3 N 0.39 0.66 0.02 1.22 6.09 -2.04 -3.13 117.51 120.71 1n5g h ILE 3 Ca 0.51 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 64.00 1n5g h ILE 3 Cb 1.31 0.67 0.00 0.00 0.47 0.00 0.00 36.82 39.27 1n5g h ILE 3 CO -0.20 0.00 -0.01 0.00 -3.07 0.00 0.00 178.15 174.87 1n5g h GLU 5 N -0.08 -0.21 0.15 0.00 4.11 -1.55 -2.16 114.58 114.84 1n5g h GLU 5 Ca -0.00 0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.43 1n5g h GLU 5 Cb 0.02 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1n5g h GLU 5 CO 0.00 -0.14 -0.07 1.49 0.07 0.00 0.00 179.01 180.36 1n5g h GLU 6 N -0.22 -0.20 0.22 1.06 4.57 -1.77 -2.97 114.58 115.28 1n5g h GLU 6 Ca 0.19 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.37 1n5g h GLU 6 Cb 0.53 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1n5g h GLU 6 CO -0.56 -0.13 -0.11 -1.35 -1.18 0.00 0.00 179.01 175.68 1n5g h PRO 7 N -0.68 -0.29 0.04 0.92 0.10 -1.69 -3.24 132.00 127.17 1n5g h PRO 7 Ca -0.02 0.02 -0.19 0.00 0.10 0.00 0.00 66.00 65.91 1n5g h PRO 7 Cb 0.16 0.06 0.02 0.00 0.10 0.00 0.00 31.00 31.34 1n5g h PRO 7 CO 0.03 -0.19 -0.76 1.15 0.10 0.00 0.00 178.00 178.33 1n5g h THR 8 N -0.46 1.42 -0.56 -1.15 2.02 -1.52 -2.73 112.91 109.92 1n5g h THR 8 Ca -0.03 -2.24 0.11 0.00 0.77 0.00 0.00 66.41 65.03 1n5g h THR 8 Cb 0.23 2.72 -0.11 0.00 -1.74 0.00 0.00 68.15 69.25 1n5g h THR 8 CO 0.05 0.65 -0.19 0.00 0.37 0.00 0.00 175.52 176.41 1n5g h ARG 10 N -0.05 0.66 -0.24 0.00 2.43 -1.54 -2.01 114.38 113.63 1n5g h ARG 10 Ca 0.26 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.24 1n5g h ARG 10 Cb 0.46 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1n5g h ARG 10 CO -0.60 0.44 -0.48 -0.91 -1.51 0.00 0.00 179.97 176.91 1n5g h ASN 11 N 0.68 0.69 -0.22 -3.80 2.35 -1.01 -2.37 115.58 111.90 1n5g h ASN 11 Ca 0.37 -0.34 0.05 0.00 -0.55 0.00 0.00 56.30 55.83 1n5g h ASN 11 Cb 0.51 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1n5g h ASN 11 CO -0.14 1.06 0.15 0.08 -1.65 0.00 0.00 177.43 176.93 1n5g h ARG 12 N 0.51 0.08 0.00 0.81 0.11 -0.50 0.79 114.38 116.17 1n5g h ARG 12 Ca 0.03 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 60.10 1n5g h ARG 12 Cb 1.02 -0.02 -0.00 0.00 1.11 0.00 0.00 29.97 32.08 1n5g h ARG 12 CO 0.10 0.06 -0.03 1.15 0.10 0.00 0.00 179.97 181.34 1n5g h THR 13 N 0.09 0.75 -0.11 0.08 2.02 -0.83 0.08 112.91 114.99 1n5g h THR 13 Ca 0.10 -0.10 -0.11 0.00 0.77 0.00 0.00 66.41 67.07 1n5g h THR 13 Cb 0.29 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 1n5g h THR 13 CO -0.01 0.03 -0.41 0.03 0.37 0.00 0.00 175.52 175.53 1n5g h ARG 14 N 0.00 0.23 0.00 6.66 -0.00 -0.73 -3.01 114.38 117.54 1n5g h ARG 14 Ca -0.00 -0.11 -0.00 0.00 -0.50 0.00 0.00 59.98 59.37 1n5g h ARG 14 Cb 0.06 -0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.02 1n5g h ARG 14 CO 0.00 0.61 -0.01 0.45 0.00 0.00 0.00 179.97 181.03 1n5g h HIS 15 N 0.20 0.00 -0.36 3.04 3.86 -0.51 -3.37 115.15 118.01 1n5g h HIS 15 Ca 0.02 0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.33 1n5g h HIS 15 Cb 0.81 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.27 1n5g h HIS 15 CO 0.01 0.01 0.27 1.25 0.86 0.00 0.00 177.93 180.33 1n5g h LEU 16 N 0.00 0.00 -1.71 2.43 6.46 -1.21 0.66 115.31 121.94 1n5g h LEU 16 Ca -0.00 0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.77 1n5g h LEU 16 Cb 0.01 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 1n5g h LEU 16 CO 0.00 0.00 0.20 -0.65 -0.62 0.00 0.00 178.44 177.37 1n5g h PRO 17 N 0.00 0.38 0.05 5.25 0.11 -1.75 -3.35 132.00 132.70 1n5g h PRO 17 Ca 0.17 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 66.03 1n5g h PRO 17 Cb 0.70 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.71 1n5g h PRO 17 CO -0.00 0.25 -1.20 1.37 -0.21 0.00 0.00 178.00 178.22 1n5g h LEU 18 N 0.39 0.17 0.00 2.35 8.10 -1.62 -3.50 115.31 121.20 1n5g h LEU 18 Ca 0.11 -0.74 0.00 0.00 0.11 0.00 0.00 57.88 57.36 1n5g h LEU 18 Cb -0.03 -0.06 0.00 0.00 -0.44 0.00 0.00 40.66 40.13 1n5g h LEU 18 CO -0.02 1.50 0.00 1.67 -4.11 0.00 0.00 178.44 177.47 1n5g n GLN 19 N -4.20 -0.80 0.13 0.17 7.27 0.16 -4.95 117.38 115.16 1n5g n GLN 19 Ca -0.26 0.20 0.01 0.00 0.07 0.00 0.00 57.00 57.02 1n5g n GLN 19 Cb 0.76 -3.94 0.05 0.00 2.41 0.00 0.00 30.24 29.52 1n5g n GLN 19 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 177.06 177.40 1n5g h PHE 20 N 0.00 0.00 -1.04 3.69 -5.15 -1.95 -3.31 116.94 109.17 1n5g h PHE 20 Ca 0.00 0.00 -0.50 0.00 -0.20 0.00 0.00 57.97 57.27 1n5g h PHE 20 Cb 0.40 0.00 -0.18 0.00 0.22 0.00 0.00 35.95 36.39 1n5g h PHE 20 CO 0.25 0.56 0.47 0.45 -2.00 0.00 0.00 178.31 178.05 1n5g n SER 21 N -3.30 6.62 0.05 -0.68 2.88 -1.26 -4.78 113.62 113.14 1n5g n SER 21 Ca 0.01 -3.26 0.11 0.00 -1.33 0.00 0.00 58.87 54.40 1n5g n SER 21 Cb 0.73 -1.18 0.01 0.00 -0.75 0.00 0.00 64.21 63.03 1n5g n SER 21 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1n5g n ARG 22 N 0.58 0.42 0.05 -1.46 0.00 -1.25 -3.36 116.66 111.63 1n5g n ARG 22 Ca 0.47 0.02 -0.17 0.00 -0.00 0.00 0.00 57.85 58.16 1n5g n ARG 22 Cb 0.53 -1.66 -0.14 0.00 -0.00 0.00 0.00 32.46 31.19 1n5g n ARG 22 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 1n5g h THR 23 N 0.00 1.00 -5.45 8.89 1.35 -1.91 -3.52 112.91 113.27 1n5g h THR 23 Ca 0.00 -2.67 -0.29 0.00 -0.55 0.00 0.00 66.41 62.90 1n5g h THR 23 Cb 0.84 2.68 0.01 0.00 -1.73 0.00 0.00 68.15 69.95 1n5g h THR 23 CO 0.00 0.80 -0.81 0.61 -0.25 0.00 0.00 175.52 175.87 1n5g n GLY 24 N 1.74 -0.20 3.54 5.82 0.00 -1.21 -4.74 105.19 110.14 1n5g n GLY 24 Ca -0.20 0.67 -0.15 0.00 0.00 0.00 0.00 46.02 46.34 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 -0.71 0.08 0.00 1.61 -0.04 -1.26 -4.25 135.00 130.43 1n5g n PRO 25 Ca -0.11 -1.58 0.00 0.00 -0.04 0.00 0.00 63.50 61.77 1n5g n PRO 25 Cb 0.47 -3.72 0.00 0.00 -0.04 0.00 0.00 33.50 30.21 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 18.73 0.00 -4.05 1.53 4.32 -1.26 -5.14 117.00 131.14 1n5g n LEU 26 Ca 0.39 0.00 -0.11 0.00 -0.02 0.00 0.00 56.01 56.26 1n5g n LEU 26 Cb 0.47 0.01 -0.11 0.00 -1.62 0.00 0.00 43.42 42.17 1n5g n LEU 26 CO 0.61 -0.04 -0.39 0.00 -1.22 0.00 0.00 177.39 176.35 1n5g s PRO 28 N -1.87 3.39 -1.22 0.00 0.04 -1.26 -4.45 135.00 129.63 1n5g s PRO 28 Ca -0.09 -0.94 -0.01 0.00 0.04 0.00 0.00 61.00 60.00 1n5g s PRO 28 Cb -0.08 -5.27 0.00 0.00 0.04 0.00 0.00 34.50 29.19 1n5g s PRO 28 CO -0.01 -2.42 0.19 0.00 0.04 0.00 0.00 177.00 174.80 1n5g n ALA 29 N 9.83 -0.56 1.35 8.56 0.00 -1.26 -4.92 120.51 133.52 1n5g n ALA 29 Ca 0.33 0.16 0.15 0.00 0.00 0.00 0.00 53.44 54.08 1n5g n ALA 29 Cb 0.50 -2.27 0.71 0.00 0.00 0.00 0.00 19.45 18.39 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 0.06 -0.39 -0.98 0.00 4.05 -1.91 -3.35 114.93 112.41 1n5g h MET 31 Ca 0.00 0.03 0.34 0.00 -0.28 0.00 0.00 59.70 59.79 1n5g h MET 31 Cb 0.33 0.09 -0.17 0.00 -0.80 0.00 0.00 31.60 31.05 1n5g h MET 31 CO 0.00 -0.16 0.41 1.57 0.23 0.00 0.00 176.91 178.96 1n5g h LYS 32 N -1.06 0.11 -0.13 0.39 2.10 -1.98 -3.21 116.57 112.79 1n5g h LYS 32 Ca -0.04 -0.01 0.04 0.00 -2.00 0.00 0.00 60.65 58.64 1n5g h LYS 32 Cb 0.41 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.71 1n5g h LYS 32 CO 0.07 0.07 0.11 0.00 -2.00 0.00 0.00 179.45 177.70 1n5g h ALA 33 N 1.93 1.99 -0.70 0.07 0.00 -1.79 -1.96 119.26 118.80 1n5g h ALA 33 Ca 0.73 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.62 1n5g h ALA 33 Cb 1.76 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.53 1n5g h ALA 33 CO -0.74 -0.17 0.35 1.15 0.00 0.00 0.00 179.25 179.84 1n5g h THR 34 N 0.00 1.23 -0.03 0.00 2.02 -1.68 -3.20 112.91 111.25 1n5g h THR 34 Ca 0.06 -0.62 0.01 0.00 0.77 0.00 0.00 66.41 66.63 1n5g h THR 34 Cb 0.27 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1n5g h THR 34 CO -0.00 0.26 0.10 -0.07 0.37 0.00 0.00 175.52 176.18 1n5g h LEU 35 N 0.98 0.00 0.01 2.58 4.07 -1.46 0.75 115.31 122.24 1n5g h LEU 35 Ca 0.24 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.21 1n5g h LEU 35 Cb 0.09 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.83 1n5g h LEU 35 CO -0.03 0.00 -0.02 1.56 -1.08 0.00 0.00 178.44 178.87 1n5g h GLN 36 N 0.00 -0.03 0.36 1.13 4.20 -1.53 -3.09 115.11 116.14 1n5g h GLN 36 Ca 0.02 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 1n5g h GLN 36 Cb 0.22 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1n5g h GLN 36 CO -0.00 -0.02 -0.17 -1.35 -0.67 0.00 0.00 178.83 176.61 1n5g h PRO 37 N -0.04 -0.47 0.00 1.46 0.11 -1.69 -3.52 132.00 127.86 1n5g h PRO 37 Ca 0.00 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1n5g h PRO 37 Cb 0.04 0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.25 1n5g h PRO 37 CO -0.01 -0.15 0.00 -1.91 -0.21 0.00 0.00 178.00 175.73