#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kix n LEU 2 N 0.00 0.00 -0.03 3.17 0.00 -1.26 -4.57 117.00 114.31 2kix n LEU 2 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 56.01 55.88 2kix n LEU 2 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 43.42 43.34 2kix n LEU 2 CO 0.00 0.00 0.69 -0.08 0.00 0.00 0.00 177.39 178.00 2kix h GLU 3 N 0.00 0.15 0.00 1.96 4.81 -2.05 -2.17 114.58 117.28 2kix h GLU 3 Ca 0.00 -0.06 -0.21 0.00 -0.13 0.00 0.00 59.36 58.96 2kix h GLU 3 Cb 0.00 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 2kix h GLU 3 CO 0.00 0.49 -1.86 -0.35 -0.73 0.00 0.00 179.01 176.56 2kix n PRO 4 N -4.79 0.65 -0.04 0.92 -0.04 -1.26 -4.43 135.00 126.01 2kix n PRO 4 Ca -0.07 0.08 -0.20 0.00 -0.04 0.00 0.00 63.50 63.27 2kix n PRO 4 Cb 0.24 -1.66 -0.13 0.00 -0.04 0.00 0.00 33.50 31.90 2kix n PRO 4 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2kix h PHE 5 N 0.00 0.24 -0.46 0.54 3.04 -1.85 -3.35 116.94 115.09 2kix h PHE 5 Ca -0.27 -0.17 0.05 0.00 3.98 0.00 0.00 57.97 61.56 2kix h PHE 5 Cb 1.73 -0.01 -0.09 0.00 2.56 0.00 0.00 35.95 40.14 2kix h PHE 5 CO 0.00 1.43 -0.56 0.37 -2.02 0.00 0.00 178.31 177.53 2kix h GLN 6 N -0.63 -0.35 -0.07 1.11 5.75 -1.62 0.91 115.11 120.22 2kix h GLN 6 Ca -0.26 0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.28 2kix h GLN 6 Cb 1.49 0.08 -0.00 0.00 1.07 0.00 0.00 27.48 30.12 2kix h GLN 6 CO -0.03 -0.23 0.43 0.97 -2.65 0.00 0.00 178.83 177.32 2kix h ILE 7 N -0.36 0.05 -0.04 2.39 2.10 -1.75 0.12 117.51 120.02 2kix h ILE 7 Ca 0.08 0.00 -0.06 0.00 1.08 0.00 0.00 64.86 65.96 2kix h ILE 7 Cb 0.58 0.58 0.00 0.00 -1.09 0.00 0.00 36.82 36.90 2kix h ILE 7 CO -0.63 0.00 -0.20 0.25 -1.08 0.00 0.00 178.15 176.49 2kix h LEU 8 N 0.00 0.25 -1.28 2.19 6.46 0.73 -2.82 115.31 120.84 2kix h LEU 8 Ca 0.03 -0.66 0.02 0.00 -0.12 0.00 0.00 57.88 57.15 2kix h LEU 8 Cb 0.89 -0.07 -0.04 0.00 -0.73 0.00 0.00 40.66 40.71 2kix h LEU 8 CO -0.00 0.87 0.50 0.77 -0.62 0.00 0.00 178.44 179.96 2kix h SER 9 N -0.35 0.83 0.73 1.25 4.64 -0.40 -2.52 113.55 117.73 2kix h SER 9 Ca -0.01 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 61.26 2kix h SER 9 Cb 0.86 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 2kix h SER 9 CO 0.04 0.59 -0.39 0.40 -0.87 0.00 0.00 176.83 176.60 2kix h ILE 10 N 0.97 0.00 -0.92 0.95 1.08 -1.40 -1.04 117.51 117.16 2kix h ILE 10 Ca 0.29 0.00 0.26 0.00 -0.39 0.00 0.00 64.86 65.02 2kix h ILE 10 Cb -0.04 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 33.55 2kix h ILE 10 CO -0.07 0.00 0.17 0.28 -0.69 0.00 0.00 178.15 177.84 2kix h SER 11 N -1.03 -0.17 -0.64 1.72 0.02 -1.33 0.81 113.55 112.94 2kix h SER 11 Ca -0.10 0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 2kix h SER 11 Cb 0.80 0.35 -0.03 0.00 0.14 0.00 0.00 62.40 63.66 2kix h SER 11 CO 0.14 -0.25 0.32 -1.28 -1.14 0.00 0.00 176.83 174.62 2kix h SER 12 N 0.11 0.85 -0.24 3.07 0.87 -1.07 -0.02 113.55 117.12 2kix h SER 12 Ca 0.58 -0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 61.01 2kix h SER 12 Cb 1.22 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.96 2kix h SER 12 CO -0.76 0.72 -0.02 0.15 -0.53 0.00 0.00 176.83 176.39 2kix h PHE 13 N 0.94 0.48 -0.22 2.24 3.57 0.19 0.22 116.94 124.37 2kix h PHE 13 Ca 0.23 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.58 2kix h PHE 13 Cb 0.10 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 2kix h PHE 13 CO 0.01 0.63 -0.10 0.82 -2.23 0.00 0.00 178.31 177.45 2kix h ILE 14 N 0.19 1.19 0.08 1.41 2.04 -0.81 -2.50 117.51 119.12 2kix h ILE 14 Ca 0.06 -0.82 -0.28 0.00 1.00 0.00 0.00 64.86 64.82 2kix h ILE 14 Cb 0.46 1.14 0.02 0.00 -0.74 0.00 0.00 36.82 37.70 2kix h ILE 14 CO 0.02 0.26 -1.15 0.25 0.00 0.00 0.00 178.15 177.53 2kix h LEU 15 N 0.33 0.77 -0.00 1.44 6.46 -0.73 -2.21 115.31 121.37 2kix h LEU 15 Ca 0.07 -0.69 0.00 0.00 -0.12 0.00 0.00 57.88 57.14 2kix h LEU 15 Cb 0.38 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.07 2kix h LEU 15 CO 0.02 1.50 0.00 0.28 -0.62 0.00 0.00 178.44 179.62 2kix h SER 16 N 0.27 0.00 0.03 1.25 0.02 -0.26 0.42 113.55 115.28 2kix h SER 16 Ca -0.15 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2kix h SER 16 Cb 1.82 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.36 2kix h SER 16 CO 0.21 0.00 -0.01 0.00 -1.14 0.00 0.00 176.83 175.89 2kix h ALA 17 N 1.00 -0.04 -0.29 3.77 0.00 -1.55 0.12 119.26 122.28 2kix h ALA 17 Ca 0.00 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.77 2kix h ALA 17 Cb 0.00 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2kix h ALA 17 CO -0.00 -0.32 -0.06 1.25 0.00 0.00 0.00 179.25 180.12 2kix h LEU 18 N -0.44 -0.24 -0.87 0.00 5.85 -1.31 -0.97 115.31 117.31 2kix h LEU 18 Ca -0.00 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2kix h LEU 18 Cb 0.42 0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 2kix h LEU 18 CO 0.01 -0.08 0.46 -0.74 -0.34 0.00 0.00 178.44 177.74 2kix h HIS 19 N 0.01 1.22 0.04 1.25 2.76 -0.14 0.40 115.15 120.69 2kix h HIS 19 Ca 0.14 -0.04 0.02 0.00 -2.20 0.00 0.00 60.37 58.28 2kix h HIS 19 Cb 0.21 -0.39 -0.02 0.00 1.55 0.00 0.00 27.41 28.75 2kix h HIS 19 CO -0.27 0.86 -0.14 0.35 -1.30 0.00 0.00 177.93 177.43 2kix h PHE 20 N 1.23 -0.37 -0.23 5.26 3.57 0.22 0.47 116.94 127.10 2kix h PHE 20 Ca 0.31 0.01 -0.19 0.00 3.53 0.00 0.00 57.97 61.63 2kix h PHE 20 Cb 0.06 0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.96 2kix h PHE 20 CO 0.01 -0.21 -0.61 0.82 -2.23 0.00 0.00 178.31 176.09 2kix h ILE 21 N -0.26 1.29 0.00 1.41 2.04 -0.98 -2.71 117.51 118.30 2kix h ILE 21 Ca 0.04 -1.82 -0.05 0.00 1.00 0.00 0.00 64.86 64.03 2kix h ILE 21 Cb 0.30 1.76 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 2kix h ILE 21 CO -0.11 0.58 -0.24 0.00 0.00 0.00 0.00 178.15 178.38 2kix h ALA 22 N 0.74 1.43 -0.05 1.87 0.00 0.11 -1.75 119.26 121.61 2kix h ALA 22 Ca -0.00 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.54 2kix h ALA 22 Cb 1.20 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.97 2kix h ALA 22 CO 0.13 0.29 -0.55 2.35 0.00 0.00 0.00 179.25 181.47 2kix h TRP 23 N 0.00 0.65 -0.20 0.00 2.91 0.08 -1.42 115.95 117.97 2kix h TRP 23 Ca -0.00 -0.32 -0.10 0.00 1.13 0.00 0.00 58.89 59.60 2kix h TRP 23 Cb 0.47 -0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 29.02 2kix h TRP 23 CO 0.00 1.12 -0.29 1.15 -1.03 0.00 0.00 178.44 179.39 2kix h THR 24 N -0.00 1.27 0.06 2.65 2.02 -1.24 0.17 112.91 117.83 2kix h THR 24 Ca -0.06 -1.30 -0.00 0.00 0.77 0.00 0.00 66.41 65.83 2kix h THR 24 Cb 1.23 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 69.07 2kix h THR 24 CO 0.11 0.40 -0.03 0.40 0.37 0.00 0.00 175.52 176.78 2kix h ILE 25 N 0.35 0.97 -0.25 3.11 2.04 -1.35 -1.68 117.51 120.69 2kix h ILE 25 Ca 0.05 -1.53 -0.07 0.00 1.00 0.00 0.00 64.86 64.30 2kix h ILE 25 Cb 0.69 1.76 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 2kix h ILE 25 CO 0.05 0.30 -0.15 1.23 0.00 0.00 0.00 178.15 179.58 2kix h GLY 26 N -0.94 0.47 0.49 5.37 0.00 -1.30 0.30 103.07 107.46 2kix h GLY 26 Ca -0.01 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 2kix h GLY 26 CO 0.01 0.30 -0.13 0.84 0.00 0.00 0.00 176.54 177.57 2kix h HIS 27 N 0.40 0.19 -0.86 5.60 -0.00 -0.77 -2.90 115.15 116.81 2kix h HIS 27 Ca 0.07 -0.08 -0.02 0.00 -0.00 0.00 0.00 60.37 60.34 2kix h HIS 27 Cb 0.50 -0.03 -0.04 0.00 -0.00 0.00 0.00 27.41 27.84 2kix h HIS 27 CO 0.01 0.76 0.44 1.25 -0.00 0.00 0.00 177.93 180.40 2kix h LEU 28 N -0.44 1.10 -1.63 0.26 6.46 -1.21 -1.77 115.31 118.08 2kix h LEU 28 Ca -0.01 -0.12 0.05 0.00 -0.12 0.00 0.00 57.88 57.69 2kix h LEU 28 Cb 0.77 -0.28 -0.03 0.00 -0.73 0.00 0.00 40.66 40.39 2kix h LEU 28 CO 0.03 0.90 0.33 0.78 -0.62 0.00 0.00 178.44 179.85 2kix h ASN 29 N 1.21 0.40 -0.25 1.25 -0.26 -0.95 -1.83 115.58 115.15 2kix h ASN 29 Ca 0.30 -0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.04 2kix h ASN 29 Cb 0.07 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.23 2kix h ASN 29 CO -0.04 0.27 0.16 -0.61 -1.06 0.00 0.00 177.43 176.15 2kix h GLN 30 N 0.46 0.33 -2.39 0.81 5.75 -1.10 -2.74 115.11 116.23 2kix h GLN 30 Ca 0.21 -0.02 -0.71 0.00 -0.15 0.00 0.00 58.65 57.98 2kix h GLN 30 Cb 0.23 -0.07 -0.17 0.00 1.07 0.00 0.00 27.48 28.54 2kix h GLN 30 CO -0.05 0.22 1.69 1.51 -2.65 0.00 0.00 178.83 179.55 2kix n ILE 31 N -4.91 4.97 0.08 2.39 3.06 -0.69 -4.23 119.36 120.02 2kix n ILE 31 Ca -0.02 -4.40 0.00 0.00 -2.50 0.00 0.00 62.75 55.83 2kix n ILE 31 Cb 0.03 -1.83 0.00 0.00 0.54 0.00 0.00 39.64 38.37 2kix n ILE 31 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22 2kix n LYS 32 N 1.08 0.00 -0.29 9.51 4.81 -1.09 -5.00 118.16 127.19 2kix n LYS 32 Ca 0.56 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 58.00 2kix n LYS 32 Cb 0.31 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.36 2kix n LYS 32 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44