#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dyr s THR 2 N 0.00 4.06 0.10 9.51 -4.23 -1.26 -5.12 115.64 118.71 2dyr s THR 2 Ca 0.00 -0.75 -0.07 0.00 -1.18 0.00 0.00 61.69 59.69 2dyr s THR 2 Cb 0.00 -2.85 -0.01 0.00 1.34 0.00 0.00 72.50 70.98 2dyr s THR 2 CO 0.00 0.29 0.17 0.00 -0.54 0.00 0.00 174.62 174.54 2dyr s ALA 3 N -1.16 0.02 0.68 3.99 0.00 -1.26 -5.16 121.76 118.88 2dyr s ALA 3 Ca 0.21 -0.84 -0.11 0.00 0.00 0.00 0.00 51.96 51.23 2dyr s ALA 3 Cb -0.12 0.58 -0.00 0.00 0.00 0.00 0.00 23.12 23.58 2dyr s ALA 3 CO 0.13 -0.52 1.06 0.15 0.00 0.00 0.00 175.76 176.58 2dyr s LYS 4 N -3.91 3.08 0.66 0.00 1.02 -1.26 -5.02 119.74 114.31 2dyr s LYS 4 Ca 0.10 0.67 -0.17 0.00 0.02 0.00 0.00 55.97 56.59 2dyr s LYS 4 Cb 0.05 -2.03 -0.00 0.00 -0.52 0.00 0.00 37.83 35.33 2dyr s LYS 4 CO -0.07 -0.92 1.19 -2.14 -0.92 0.00 0.00 175.35 172.49 2dyr s PRO 5 N -5.22 2.61 0.22 -1.68 0.02 -1.26 -4.88 135.00 124.81 2dyr s PRO 5 Ca 0.57 1.73 -0.31 0.00 0.02 0.00 0.00 61.00 63.01 2dyr s PRO 5 Cb -0.12 -1.89 -0.14 0.00 0.02 0.00 0.00 34.50 32.37 2dyr s PRO 5 CO 0.53 -1.47 1.26 0.00 -0.33 0.00 0.00 177.00 177.00 2dyr n ALA 6 N -2.17 0.23 0.10 -1.55 0.00 -1.26 -4.89 120.51 110.97 2dyr n ALA 6 Ca 0.13 0.43 -0.05 0.00 0.00 0.00 0.00 53.44 53.95 2dyr n ALA 6 Cb 0.50 -2.15 0.07 0.00 0.00 0.00 0.00 19.45 17.87 2dyr n ALA 6 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2dyr h LYS 7 N 3.57 0.10 -2.24 0.00 1.57 -2.05 -3.36 116.57 114.14 2dyr h LYS 7 Ca -0.44 -0.09 -0.58 0.00 -1.87 0.00 0.00 60.65 57.67 2dyr h LYS 7 Cb 1.31 0.02 -0.39 0.00 0.08 0.00 0.00 32.23 33.25 2dyr h LYS 7 CO 0.71 0.80 -0.99 0.25 -0.57 0.00 0.00 179.45 179.65 2dyr n THR 8 N -3.70 -0.65 -1.50 -0.16 -2.24 -1.26 -5.13 114.28 99.64 2dyr n THR 8 Ca -0.02 -3.85 -0.46 0.00 -2.27 0.00 0.00 64.05 57.45 2dyr n THR 8 Cb 0.72 -1.83 -0.02 0.00 -2.10 0.00 0.00 70.33 67.09 2dyr n THR 8 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2dyr n PRO 9 N 2.09 0.71 -3.70 -0.78 -0.02 -1.26 -4.95 135.00 127.08 2dyr n PRO 9 Ca 0.26 0.25 -0.38 0.00 -2.02 0.00 0.00 63.50 61.60 2dyr n PRO 9 Cb 0.49 -1.45 -0.11 0.00 -0.02 0.00 0.00 33.50 32.41 2dyr n PRO 9 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2dyr s THR 10 N -0.99 3.79 0.87 3.45 2.01 -1.26 -5.09 115.64 118.42 2dyr s THR 10 Ca 0.62 -1.53 -0.11 0.00 0.31 0.00 0.00 61.69 60.98 2dyr s THR 10 Cb -0.82 -3.35 0.11 0.00 0.01 0.00 0.00 72.50 68.46 2dyr s THR 10 CO 0.58 -0.47 1.09 -0.94 -0.69 0.00 0.00 174.62 174.20 2dyr s SER 11 N 1.86 3.68 0.38 3.53 1.04 -1.26 -4.72 113.70 118.21 2dyr s SER 11 Ca 0.03 1.58 0.13 0.00 0.48 0.00 0.00 55.95 58.16 2dyr s SER 11 Cb -0.22 -2.26 0.93 0.00 0.10 0.00 0.00 66.02 64.58 2dyr s SER 11 CO 0.00 -2.52 1.85 -0.65 0.98 0.00 0.00 173.24 172.90 2dyr h PRO 12 N -1.47 0.55 -0.31 4.02 0.11 -1.99 0.47 132.00 133.39 2dyr h PRO 12 Ca -0.48 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.55 2dyr h PRO 12 Cb 1.27 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2dyr h PRO 12 CO 0.54 0.36 0.02 -0.22 -0.21 0.00 0.00 178.00 178.49 2dyr h LYS 13 N 0.57 0.52 -0.72 1.05 3.11 -1.99 -1.10 116.57 118.01 2dyr h LYS 13 Ca 0.48 -0.16 -0.02 0.00 -2.81 0.00 0.00 60.65 58.14 2dyr h LYS 13 Cb 0.96 -0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 32.10 2dyr h LYS 13 CO -0.22 0.65 0.37 0.93 -2.81 0.00 0.00 179.45 178.37 2dyr h GLU 14 N 0.33 1.01 -0.55 1.90 5.08 -1.35 -1.95 114.58 119.06 2dyr h GLU 14 Ca 0.09 -0.13 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 2dyr h GLU 14 Cb 0.40 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2dyr h GLU 14 CO 0.01 0.78 0.06 1.96 -1.00 0.00 0.00 179.01 180.82 2dyr h GLN 15 N 0.99 0.89 -0.83 2.33 4.20 -0.76 -0.78 115.11 121.15 2dyr h GLN 15 Ca 0.25 -0.23 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 2dyr h GLN 15 Cb 0.08 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.71 2dyr h GLN 15 CO -0.04 0.85 0.38 0.00 -0.67 0.00 0.00 178.83 179.35 2dyr h ALA 16 N 1.22 1.11 -0.22 3.87 0.00 -0.83 0.16 119.26 124.57 2dyr h ALA 16 Ca 0.17 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2dyr h ALA 16 Cb 0.42 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2dyr h ALA 16 CO 0.01 0.66 0.05 0.82 0.00 0.00 0.00 179.25 180.79 2dyr h ILE 17 N 1.18 1.21 -0.68 0.00 2.04 -0.70 -0.84 117.51 119.73 2dyr h ILE 17 Ca 0.28 -0.68 -0.06 0.00 1.00 0.00 0.00 64.86 65.40 2dyr h ILE 17 Cb 0.14 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 2dyr h ILE 17 CO -0.03 0.21 0.18 1.23 0.00 0.00 0.00 178.15 179.74 2dyr h GLY 18 N 0.17 1.15 0.85 5.37 0.00 -0.75 -0.89 103.07 108.98 2dyr h GLY 18 Ca 0.07 -0.71 -0.00 0.00 0.00 0.00 0.00 47.33 46.68 2dyr h GLY 18 CO 0.00 0.66 -0.05 -2.00 0.00 0.00 0.00 176.54 175.16 2dyr h LEU 19 N 1.00 -0.11 -0.42 3.11 5.85 -0.61 -0.12 115.31 124.01 2dyr h LEU 19 Ca 0.21 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 2dyr h LEU 19 Cb 0.34 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 2dyr h LEU 19 CO -0.00 0.06 0.26 0.28 -0.34 0.00 0.00 178.44 178.70 2dyr h SER 20 N -0.28 0.50 -0.63 1.25 0.02 -1.08 0.61 113.55 113.93 2dyr h SER 20 Ca -0.01 -0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.85 2dyr h SER 20 Cb 0.23 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 2dyr h SER 20 CO 0.02 0.40 0.23 0.58 -1.14 0.00 0.00 176.83 176.92 2dyr h VAL 21 N 0.56 1.24 0.21 2.27 2.07 -1.12 -0.37 116.25 121.10 2dyr h VAL 21 Ca 0.15 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 2dyr h VAL 21 Cb -0.02 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 2dyr h VAL 21 CO -0.03 0.30 -0.10 0.74 0.02 0.00 0.00 177.57 178.51 2dyr h THR 22 N 0.90 0.84 -0.73 2.57 2.02 -0.65 -1.26 112.91 116.59 2dyr h THR 22 Ca 0.21 -0.19 0.03 0.00 0.77 0.00 0.00 66.41 67.22 2dyr h THR 22 Cb 0.25 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 2dyr h THR 22 CO -0.01 0.05 0.47 -0.26 0.37 0.00 0.00 175.52 176.13 2dyr h PHE 23 N -0.37 0.88 -0.35 3.16 0.05 -0.74 -2.37 116.94 117.20 2dyr h PHE 23 Ca -0.03 0.02 -0.07 0.00 3.82 0.00 0.00 57.97 61.72 2dyr h PHE 23 Cb 0.29 -0.29 -0.02 0.00 2.00 0.00 0.00 35.95 37.93 2dyr h PHE 23 CO -0.04 0.51 -0.06 -0.07 -0.18 0.00 0.00 178.31 178.48 2dyr h LEU 24 N 0.92 0.55 -2.02 1.54 3.38 -0.89 -1.12 115.31 117.67 2dyr h LEU 24 Ca 0.29 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 2dyr h LEU 24 Cb -0.01 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 2dyr h LEU 24 CO -0.10 0.66 -0.09 0.77 0.09 0.00 0.00 178.44 179.77 2dyr h SER 25 N 0.54 0.00 0.04 -0.43 4.64 -0.68 -0.57 113.55 117.09 2dyr h SER 25 Ca 0.11 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.18 2dyr h SER 25 Cb 0.43 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.50 2dyr h SER 25 CO 0.02 0.09 -1.32 -0.26 -0.87 0.00 0.00 176.83 174.49 2dyr h PHE 26 N 0.00 0.15 -0.22 4.77 -1.00 -1.40 -3.42 116.94 115.82 2dyr h PHE 26 Ca -0.00 -0.11 -0.20 0.00 2.81 0.00 0.00 57.97 60.47 2dyr h PHE 26 Cb 0.23 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 39.79 2dyr h PHE 26 CO 0.00 1.52 -0.64 -0.07 -1.61 0.00 0.00 178.31 177.51 2dyr h LEU 27 N -0.71 0.91 0.57 1.54 3.38 -1.04 -3.33 115.31 116.63 2dyr h LEU 27 Ca -0.33 -0.53 -0.03 0.00 0.09 0.00 0.00 57.88 57.08 2dyr h LEU 27 Cb 1.48 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.97 2dyr h LEU 27 CO -0.10 1.32 -0.27 -0.07 0.09 0.00 0.00 178.44 179.40 2dyr h LEU 28 N 0.58 -0.64 -0.50 1.67 3.38 -1.35 0.40 115.31 118.85 2dyr h LEU 28 Ca -0.01 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.95 2dyr h LEU 28 Cb 1.25 0.17 -0.03 0.00 0.09 0.00 0.00 40.66 42.13 2dyr h LEU 28 CO 0.13 -0.37 0.30 -0.65 0.09 0.00 0.00 178.44 177.95 2dyr h PRO 29 N -0.90 0.59 -0.40 1.13 0.11 -1.80 0.73 132.00 131.47 2dyr h PRO 29 Ca -0.08 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.95 2dyr h PRO 29 Cb 0.63 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.59 2dyr h PRO 29 CO 0.13 0.39 0.07 0.00 -0.21 0.00 0.00 178.00 178.38 2dyr h ALA 30 N 1.21 0.53 -1.01 -0.75 0.00 -1.67 -2.33 119.26 115.24 2dyr h ALA 30 Ca 0.20 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2dyr h ALA 30 Cb -0.00 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.58 2dyr h ALA 30 CO -0.08 0.23 0.66 0.78 0.00 0.00 0.00 179.25 180.85 2dyr h GLY 31 N 0.50 1.46 0.94 0.00 0.00 -0.50 0.03 103.07 105.50 2dyr h GLY 31 Ca 0.12 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 2dyr h GLY 31 CO 0.01 0.45 0.01 -0.25 0.00 0.00 0.00 176.54 176.75 2dyr h TRP 32 N 1.29 0.02 -0.06 5.60 7.01 -0.57 -0.07 115.95 129.18 2dyr h TRP 32 Ca 0.39 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.39 2dyr h TRP 32 Cb -0.03 -0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 27.02 2dyr h TRP 32 CO -0.00 0.08 0.03 0.28 -2.79 0.00 0.00 178.44 176.04 2dyr h VAL 33 N -0.04 1.10 -0.51 2.65 2.07 -1.08 -2.11 116.25 118.33 2dyr h VAL 33 Ca 0.01 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.24 2dyr h VAL 33 Cb 0.06 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 2dyr h VAL 33 CO -0.00 0.08 0.34 -0.07 0.02 0.00 0.00 177.57 177.94 2dyr h LEU 34 N -0.02 0.58 -0.36 2.57 4.07 -0.91 -2.05 115.31 119.20 2dyr h LEU 34 Ca 0.02 -0.01 -0.11 0.00 0.08 0.00 0.00 57.88 57.85 2dyr h LEU 34 Cb 0.11 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.70 2dyr h LEU 34 CO -0.00 0.42 -0.22 0.22 -1.08 0.00 0.00 178.44 177.78 2dyr h TYR 35 N 0.69 0.92 -0.27 1.13 3.20 -0.80 -2.97 116.97 118.87 2dyr h TYR 35 Ca 0.19 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.82 2dyr h TYR 35 Cb -0.07 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 37.99 2dyr h TYR 35 CO -0.00 1.00 0.00 0.72 -1.64 0.00 0.00 178.16 178.24 2dyr n HIS 36 N -4.25 0.69 -0.14 -3.82 8.25 -0.81 -4.45 115.22 110.70 2dyr n HIS 36 Ca -0.02 -0.27 -0.03 0.00 -0.26 0.00 0.00 57.72 57.14 2dyr n HIS 36 Cb 0.44 -0.16 0.04 0.00 1.12 0.00 0.00 29.99 31.42 2dyr n HIS 36 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2dyr h LEU 37 N 1.76 -0.25 -1.10 2.41 3.38 -1.22 -1.69 115.31 118.61 2dyr h LEU 37 Ca 0.00 0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 2dyr h LEU 37 Cb 0.83 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 2dyr h LEU 37 CO 0.12 -0.09 0.06 0.44 0.09 0.00 0.00 178.44 179.06 2dyr h ASP 38 N 0.08 0.65 0.12 -0.43 5.19 -1.84 0.27 116.42 120.45 2dyr h ASP 38 Ca 0.22 -0.12 -0.01 0.00 -0.62 0.00 0.00 57.03 56.49 2dyr h ASP 38 Cb 0.33 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 39.67 2dyr h ASP 38 CO -0.40 0.68 -0.07 0.78 -3.12 0.00 0.00 179.24 177.12 2dyr h ASN 39 N 0.67 0.00 0.00 6.45 4.21 -1.65 -2.78 115.58 122.48 2dyr h ASN 39 Ca 0.14 0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.57 2dyr h ASN 39 Cb 0.33 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.52 2dyr h ASN 39 CO 0.01 0.07 -0.52 1.88 -1.29 0.00 0.00 177.43 177.57 2dyr h TYR 40 N 0.00 0.00 -0.92 1.19 0.99 -0.66 -3.37 116.97 114.20 2dyr h TYR 40 Ca -0.00 0.00 0.24 0.00 2.00 0.00 0.00 58.73 60.97 2dyr h TYR 40 Cb 0.14 0.00 -0.16 0.00 1.00 0.00 0.00 36.73 37.71 2dyr h TYR 40 CO 0.00 0.85 0.06 0.87 -0.00 0.00 0.00 178.16 179.94 2dyr h LYS 41 N -1.00 0.06 -3.13 4.88 1.57 -0.76 -3.23 116.57 114.95 2dyr h LYS 41 Ca -0.12 -0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.05 2dyr h LYS 41 Cb 0.87 -0.01 -0.40 0.00 0.08 0.00 0.00 32.23 32.76 2dyr h LYS 41 CO -0.07 0.04 -0.76 0.21 -0.57 0.00 0.00 179.45 178.30 2dyr s LYS 42 N -6.01 1.03 0.00 3.15 2.47 -1.07 -5.11 119.74 114.20 2dyr s LYS 42 Ca -0.13 -1.65 0.00 0.00 -1.56 0.00 0.00 55.97 52.64 2dyr s LYS 42 Cb 0.27 -2.12 0.00 0.00 -1.46 0.00 0.00 37.83 34.52 2dyr s LYS 42 CO 0.77 -1.11 0.00 0.43 0.16 0.00 0.00 175.35 175.60