#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oco s THR 2 N 0.00 4.40 -0.06 9.51 -4.23 -1.26 -5.13 115.64 118.87 1oco s THR 2 Ca 0.00 -1.40 -0.28 0.00 -1.18 0.00 0.00 61.69 58.83 1oco s THR 2 Cb 0.00 -3.36 0.06 0.00 1.34 0.00 0.00 72.50 70.54 1oco s THR 2 CO 0.00 -0.33 0.63 0.00 -0.54 0.00 0.00 174.62 174.38 1oco s ALA 3 N -2.10 -1.62 0.84 3.99 0.00 -1.26 -5.15 121.76 116.45 1oco s ALA 3 Ca 0.33 1.22 -0.12 0.00 0.00 0.00 0.00 51.96 53.38 1oco s ALA 3 Cb -0.08 -0.06 0.10 0.00 0.00 0.00 0.00 23.12 23.08 1oco s ALA 3 CO 0.24 -0.35 1.18 1.63 0.00 0.00 0.00 175.76 178.47 1oco n LYS 4 N 1.08 0.02 -1.74 0.00 5.02 -1.26 -4.97 118.16 116.31 1oco n LYS 4 Ca -0.19 0.09 -0.32 0.00 -2.02 0.00 0.00 58.31 55.87 1oco n LYS 4 Cb 0.57 -2.42 0.04 0.00 -0.02 0.00 0.00 35.03 33.20 1oco n LYS 4 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1oco s PRO 5 N -4.23 2.99 0.01 1.97 0.04 -1.26 -4.92 135.00 129.59 1oco s PRO 5 Ca 0.72 1.13 -0.38 0.00 0.04 0.00 0.00 61.00 62.51 1oco s PRO 5 Cb -0.28 -1.99 -0.17 0.00 0.04 0.00 0.00 34.50 32.10 1oco s PRO 5 CO 0.53 -1.07 1.38 0.00 0.04 0.00 0.00 177.00 177.88 1oco n ALA 6 N -2.66 -1.15 0.09 8.56 0.00 -1.26 -4.89 120.51 119.20 1oco n ALA 6 Ca 0.08 0.51 -0.04 0.00 0.00 0.00 0.00 53.44 53.99 1oco n ALA 6 Cb 0.53 -2.06 0.17 0.00 0.00 0.00 0.00 19.45 18.09 1oco n ALA 6 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1oco h LYS 7 N 4.82 0.23 -1.98 0.00 1.57 -2.04 -3.32 116.57 115.84 1oco h LYS 7 Ca -0.48 -0.14 -0.48 0.00 -1.87 0.00 0.00 60.65 57.69 1oco h LYS 7 Cb 1.34 0.01 -0.40 0.00 0.08 0.00 0.00 32.23 33.27 1oco h LYS 7 CO 0.80 0.70 -1.19 0.25 -0.57 0.00 0.00 179.45 179.43 1oco n THR 8 N -3.94 -0.09 -1.15 -0.16 -2.24 -1.26 -5.12 114.28 100.32 1oco n THR 8 Ca -0.02 -4.56 -0.37 0.00 -2.27 0.00 0.00 64.05 56.83 1oco n THR 8 Cb 0.56 -0.25 -0.00 0.00 -2.10 0.00 0.00 70.33 68.53 1oco n THR 8 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1oco n PRO 9 N 0.26 0.00 -3.67 -0.78 -0.04 -1.25 -4.92 135.00 124.60 1oco n PRO 9 Ca 0.25 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.33 1oco n PRO 9 Cb 0.66 -0.89 -0.09 0.00 -0.04 0.00 0.00 33.50 33.14 1oco n PRO 9 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1oco s THR 10 N -1.51 3.89 0.70 0.52 2.01 -1.26 -5.09 115.64 114.90 1oco s THR 10 Ca 0.52 -2.63 -0.16 0.00 0.31 0.00 0.00 61.69 59.73 1oco s THR 10 Cb -0.55 -3.54 -0.02 0.00 0.01 0.00 0.00 72.50 68.40 1oco s THR 10 CO 0.56 -0.85 0.81 -1.54 -0.69 0.00 0.00 174.62 172.91 1oco n SER 11 N 3.88 -0.08 -0.29 3.53 3.41 -1.26 -4.55 113.62 118.25 1oco n SER 11 Ca 0.05 0.66 0.04 0.00 -0.26 0.00 0.00 58.87 59.36 1oco n SER 11 Cb 0.40 -1.34 0.13 0.00 -0.26 0.00 0.00 64.21 63.14 1oco n SER 11 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1oco h PRO 12 N -0.20 0.02 -0.45 4.33 0.11 -1.99 0.42 132.00 134.25 1oco h PRO 12 Ca -0.47 -0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.72 1oco h PRO 12 Cb 1.34 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.38 1oco h PRO 12 CO 0.46 0.01 0.05 0.87 -0.21 0.00 0.00 178.00 179.19 1oco h LYS 13 N 0.02 0.17 -0.32 1.05 6.56 -2.00 0.73 116.57 122.79 1oco h LYS 13 Ca 0.42 -0.01 0.03 0.00 -1.06 0.00 0.00 60.65 60.02 1oco h LYS 13 Cb 0.69 -0.04 -0.03 0.00 -0.57 0.00 0.00 32.23 32.28 1oco h LYS 13 CO -0.81 0.11 0.14 0.93 -2.06 0.00 0.00 179.45 177.76 1oco h GLU 14 N 0.18 0.29 -0.31 3.15 5.08 -0.51 -2.20 114.58 120.25 1oco h GLU 14 Ca 0.22 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.60 1oco h GLU 14 Cb 0.30 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1oco h GLU 14 CO -0.32 0.19 0.11 1.96 -1.00 0.00 0.00 179.01 179.95 1oco h GLN 15 N 0.30 0.24 -0.95 2.33 4.20 -0.29 -1.61 115.11 119.33 1oco h GLN 15 Ca 0.14 -0.01 0.15 0.00 0.06 0.00 0.00 58.65 58.98 1oco h GLN 15 Cb 0.08 -0.05 -0.09 0.00 0.30 0.00 0.00 27.48 27.71 1oco h GLN 15 CO -0.12 0.16 0.56 0.00 -0.67 0.00 0.00 178.83 178.76 1oco h ALA 16 N 1.20 1.48 0.37 3.87 0.00 -0.56 0.26 119.26 125.88 1oco h ALA 16 Ca 0.14 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1oco h ALA 16 Cb 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1oco h ALA 16 CO -0.14 0.04 -0.18 0.82 0.00 0.00 0.00 179.25 179.80 1oco h ILE 17 N 0.81 0.65 -0.54 0.00 2.04 -0.71 -2.03 117.51 117.74 1oco h ILE 17 Ca 0.51 -0.29 0.01 0.00 1.00 0.00 0.00 64.86 66.09 1oco h ILE 17 Cb 0.66 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 1oco h ILE 17 CO -0.33 0.06 0.35 1.23 0.00 0.00 0.00 178.15 179.46 1oco h GLY 18 N -0.66 0.74 1.65 5.37 0.00 -0.47 0.52 103.07 110.23 1oco h GLY 18 Ca -0.05 -0.27 -0.12 0.00 0.00 0.00 0.00 47.33 46.89 1oco h GLY 18 CO 0.08 0.26 -0.43 -2.00 0.00 0.00 0.00 176.54 174.45 1oco h LEU 19 N 0.70 0.40 -0.19 3.11 6.46 -0.46 -1.92 115.31 123.41 1oco h LEU 19 Ca 0.20 -0.18 -0.14 0.00 -0.12 0.00 0.00 57.88 57.64 1oco h LEU 19 Cb -0.04 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 39.78 1oco h LEU 19 CO -0.05 0.79 -0.43 0.28 -0.62 0.00 0.00 178.44 178.41 1oco h SER 20 N 0.31 0.71 -0.50 1.25 0.02 -0.30 -2.18 113.55 112.88 1oco h SER 20 Ca 0.02 -0.56 -0.09 0.00 -0.84 0.00 0.00 61.79 60.33 1oco h SER 20 Cb 0.89 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.21 1oco h SER 20 CO 0.07 1.14 -0.03 0.58 -1.14 0.00 0.00 176.83 177.46 1oco h VAL 21 N 0.31 1.27 -0.12 2.27 2.07 -0.93 -2.09 116.25 119.04 1oco h VAL 21 Ca 0.00 -1.12 -0.00 0.00 0.82 0.00 0.00 66.70 66.40 1oco h VAL 21 Cb 1.04 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1oco h VAL 21 CO 0.09 0.39 0.06 0.74 0.02 0.00 0.00 177.57 178.88 1oco h THR 22 N 0.76 1.09 -0.40 2.57 2.02 -1.36 -1.40 112.91 116.19 1oco h THR 22 Ca 0.14 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 1oco h THR 22 Cb 0.55 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 1oco h THR 22 CO 0.03 0.08 0.22 -0.26 0.37 0.00 0.00 175.52 175.96 1oco h PHE 23 N 0.09 0.55 -0.70 3.16 -1.00 -1.34 -2.77 116.94 114.92 1oco h PHE 23 Ca 0.04 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.78 1oco h PHE 23 Cb 0.08 -0.17 -0.03 0.00 3.61 0.00 0.00 35.95 39.43 1oco h PHE 23 CO -0.04 0.42 0.32 -0.07 -1.61 0.00 0.00 178.31 177.33 1oco h LEU 24 N 0.51 0.93 -2.66 1.54 4.07 -1.28 0.52 115.31 118.94 1oco h LEU 24 Ca 0.14 -0.14 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 1oco h LEU 24 Cb 0.05 -0.24 -0.00 0.00 1.08 0.00 0.00 40.66 41.55 1oco h LEU 24 CO -0.02 0.82 -0.01 0.77 -1.08 0.00 0.00 178.44 178.91 1oco h SER 25 N 0.98 0.00 0.00 -0.43 4.64 -0.98 0.18 113.55 117.94 1oco h SER 25 Ca 0.24 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.38 1oco h SER 25 Cb 0.14 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.21 1oco h SER 25 CO -0.03 0.01 -1.03 -0.26 -0.87 0.00 0.00 176.83 174.65 1oco h PHE 26 N 0.00 0.00 -0.18 4.77 -1.00 -1.14 -3.43 116.94 115.96 1oco h PHE 26 Ca -0.00 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.61 1oco h PHE 26 Cb 0.07 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.63 1oco h PHE 26 CO 0.00 1.21 -0.60 -0.07 -1.61 0.00 0.00 178.31 177.24 1oco h LEU 27 N -1.00 0.67 0.47 1.54 3.38 -0.37 -3.35 115.31 116.66 1oco h LEU 27 Ca -0.27 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.30 1oco h LEU 27 Cb 1.14 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1oco h LEU 27 CO -0.16 1.12 -0.23 -0.07 0.09 0.00 0.00 178.44 179.19 1oco h LEU 28 N 0.45 -0.54 -1.02 1.67 3.38 -0.90 0.17 115.31 118.53 1oco h LEU 28 Ca -0.00 0.02 0.25 0.00 0.09 0.00 0.00 57.88 58.24 1oco h LEU 28 Cb 1.17 0.14 -0.13 0.00 0.09 0.00 0.00 40.66 41.93 1oco h LEU 28 CO 0.12 -0.35 0.60 -0.65 0.09 0.00 0.00 178.44 178.24 1oco h PRO 29 N -0.70 0.54 -0.14 1.13 0.11 -1.78 0.33 132.00 131.48 1oco h PRO 29 Ca -0.06 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 65.80 1oco h PRO 29 Cb 0.49 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.49 1oco h PRO 29 CO 0.11 0.35 -0.73 0.00 -0.21 0.00 0.00 178.00 177.52 1oco h ALA 30 N 1.74 0.28 -0.58 -0.75 0.00 -1.69 -2.87 119.26 115.39 1oco h ALA 30 Ca 0.65 -0.59 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1oco h ALA 30 Cb 1.28 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1oco h ALA 30 CO -0.48 0.62 0.36 0.78 0.00 0.00 0.00 179.25 180.53 1oco h GLY 31 N 0.46 0.82 0.69 0.00 0.00 0.16 -0.31 103.07 104.89 1oco h GLY 31 Ca -0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 1oco h GLY 31 CO 0.15 0.25 -0.49 -0.25 0.00 0.00 0.00 176.54 176.20 1oco h TRP 32 N 0.72 -1.32 -0.10 5.60 7.01 -0.57 0.39 115.95 127.69 1oco h TRP 32 Ca 0.23 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.27 1oco h TRP 32 Cb -0.01 0.49 -0.06 0.00 -2.10 0.00 0.00 29.16 27.48 1oco h TRP 32 CO -0.05 -0.70 -0.31 0.28 -2.79 0.00 0.00 178.44 174.88 1oco h VAL 33 N -1.10 0.31 -0.97 2.65 2.07 -1.37 -2.19 116.25 115.66 1oco h VAL 33 Ca -0.08 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.50 1oco h VAL 33 Cb 0.91 0.31 -0.07 0.00 -1.52 0.00 0.00 31.29 30.93 1oco h VAL 33 CO 0.03 0.00 0.62 -0.07 0.02 0.00 0.00 177.57 178.17 1oco h LEU 34 N -0.40 0.98 -1.91 2.57 3.38 -0.84 -1.68 115.31 117.41 1oco h LEU 34 Ca 0.09 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1oco h LEU 34 Cb 0.53 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 1oco h LEU 34 CO -0.32 0.62 -0.04 0.22 0.09 0.00 0.00 178.44 179.01 1oco h TYR 35 N 1.12 0.01 -0.22 1.13 3.20 0.39 -2.63 116.97 119.96 1oco h TYR 35 Ca 0.42 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.29 1oco h TYR 35 Cb 0.19 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1oco h TYR 35 CO -0.01 0.05 0.00 0.72 -1.64 0.00 0.00 178.16 177.28 1oco n HIS 36 N -4.49 0.27 -0.32 -3.82 8.25 -0.67 -4.68 115.22 109.75 1oco n HIS 36 Ca -0.03 -0.14 0.23 0.00 -0.26 0.00 0.00 57.72 57.52 1oco n HIS 36 Cb 0.13 -0.00 0.45 0.00 1.12 0.00 0.00 29.99 31.69 1oco n HIS 36 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1oco h LEU 37 N 4.46 0.24 -1.02 2.41 3.38 -1.06 0.55 115.31 124.28 1oco h LEU 37 Ca 0.00 0.22 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 1oco h LEU 37 Cb 0.97 0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 1oco h LEU 37 CO 0.00 -0.25 0.11 -0.78 0.09 0.00 0.00 178.44 177.61 1oco h ASP 38 N 0.17 0.76 -0.25 -0.43 3.58 -1.84 -1.46 116.42 116.95 1oco h ASP 38 Ca 0.72 -0.14 -0.01 0.00 0.42 0.00 0.00 57.03 58.02 1oco h ASP 38 Cb 1.68 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 42.52 1oco h ASP 38 CO -0.70 0.76 0.12 0.78 -2.88 0.00 0.00 179.24 177.32 1oco h ASN 39 N 0.78 0.32 -0.45 2.28 -0.26 -1.24 -1.30 115.58 115.71 1oco h ASN 39 Ca 0.17 -0.11 0.02 0.00 -0.56 0.00 0.00 56.30 55.82 1oco h ASN 39 Cb 0.32 -0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 37.46 1oco h ASN 39 CO 0.00 0.34 0.26 1.88 -1.06 0.00 0.00 177.43 178.86 1oco h TYR 40 N 0.28 0.49 0.00 1.19 0.05 -1.33 0.41 116.97 118.06 1oco h TYR 40 Ca 0.09 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.88 1oco h TYR 40 Cb 0.10 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 37.68 1oco h TYR 40 CO -0.03 0.28 0.00 1.63 -1.05 0.00 0.00 178.16 179.00 1oco n LYS 41 N -4.84 0.25 0.00 4.88 5.02 -0.58 -1.16 118.16 121.73 1oco n LYS 41 Ca 0.02 0.12 0.09 0.00 -2.02 0.00 0.00 58.31 56.51 1oco n LYS 41 Cb 0.07 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.51 1oco n LYS 41 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1oco n LYS 42 N -1.20 1.31 -0.77 1.97 4.01 0.10 -5.05 118.16 118.53 1oco n LYS 42 Ca 0.07 -0.32 0.00 0.00 -0.51 0.00 0.00 58.31 57.55 1oco n LYS 42 Cb 0.08 -1.34 0.00 0.00 -0.51 0.00 0.00 35.03 33.26 1oco n LYS 42 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74