#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 0.13 0.00 -0.89 7.99 -1.26 -4.86 117.00 118.11 2kix n LEU 2 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 56.01 56.03 2kix n LEU 2 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 2kix n LEU 2 CO 0.00 0.00 0.00 -1.84 -1.51 0.00 0.00 177.39 174.04 2kix n GLU 3 N -0.05 0.00 -0.11 3.23 0.28 -1.26 -4.87 120.64 117.86 2kix n GLU 3 Ca 0.00 0.00 -0.18 0.00 -0.16 0.00 0.00 57.16 56.82 2kix n GLU 3 Cb 0.00 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 32.80 2kix n GLU 3 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 2kix n PRO 4 N 0.00 0.55 -0.01 3.44 -0.04 -1.26 -4.74 135.00 132.94 2kix n PRO 4 Ca 0.00 0.33 -0.01 0.00 -0.04 0.00 0.00 63.50 63.77 2kix n PRO 4 Cb 0.00 -1.53 -0.00 0.00 -0.04 0.00 0.00 33.50 31.92 2kix n PRO 4 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2kix n PHE 5 N -4.40 0.00 0.30 0.54 7.35 -1.26 -4.66 117.46 115.33 2kix n PHE 5 Ca -0.31 0.00 0.19 0.00 -0.76 0.00 0.00 57.45 56.57 2kix n PHE 5 Cb 0.64 -0.04 0.99 0.00 0.35 0.00 0.00 39.48 41.42 2kix n PHE 5 CO 0.00 0.00 0.00 1.96 -0.76 0.00 0.00 176.76 177.96 2kix h GLN 6 N -0.03 0.00 0.00 -4.13 1.08 -1.96 0.37 115.11 110.44 2kix h GLN 6 Ca -0.03 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 2kix h GLN 6 Cb 1.03 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.46 2kix h GLN 6 CO -0.01 0.00 -0.07 0.97 -0.95 0.00 0.00 178.83 178.77 2kix h ILE 7 N 0.00 0.15 0.03 2.54 2.10 -1.85 -1.30 117.51 119.19 2kix h ILE 7 Ca 0.02 -0.88 -0.14 0.00 1.08 0.00 0.00 64.86 64.94 2kix h ILE 7 Cb 0.29 1.77 -0.01 0.00 -1.09 0.00 0.00 36.82 37.78 2kix h ILE 7 CO -0.00 0.07 -0.75 0.25 -1.08 0.00 0.00 178.15 176.64 2kix h LEU 8 N 0.00 0.10 -0.34 2.19 6.46 -0.54 -1.93 115.31 121.25 2kix h LEU 8 Ca -0.00 -0.80 0.06 0.00 -0.12 0.00 0.00 57.88 57.02 2kix h LEU 8 Cb 0.77 -0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 40.61 2kix h LEU 8 CO 0.01 1.31 -0.00 0.28 -0.62 0.00 0.00 178.44 179.41 2kix h SER 9 N -0.84 -0.14 0.19 1.25 0.02 -1.52 0.26 113.55 112.78 2kix h SER 9 Ca -0.19 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 2kix h SER 9 Cb 1.28 0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.96 2kix h SER 9 CO -0.05 -0.03 -0.09 0.40 -1.14 0.00 0.00 176.83 175.91 2kix h ILE 10 N 0.09 0.73 -0.85 3.27 2.04 -1.65 -2.25 117.51 118.90 2kix h ILE 10 Ca 0.16 -1.06 0.17 0.00 1.00 0.00 0.00 64.86 65.14 2kix h ILE 10 Cb 0.22 1.23 -0.16 0.00 -0.74 0.00 0.00 36.82 37.37 2kix h ILE 10 CO -0.28 0.19 -0.20 0.28 0.00 0.00 0.00 178.15 178.14 2kix h SER 11 N -0.89 -0.77 -0.53 1.72 0.02 -1.24 0.29 113.55 112.15 2kix h SER 11 Ca -0.03 0.25 -0.04 0.00 -0.84 0.00 0.00 61.79 61.14 2kix h SER 11 Cb 0.51 0.52 -0.02 0.00 0.14 0.00 0.00 62.40 63.54 2kix h SER 11 CO 0.04 -0.28 0.19 -1.28 -1.14 0.00 0.00 176.83 174.37 2kix h SER 12 N 0.00 0.75 -0.25 3.07 0.87 -0.99 -2.55 113.55 114.45 2kix h SER 12 Ca 0.41 -0.19 0.02 0.00 -1.23 0.00 0.00 61.79 60.81 2kix h SER 12 Cb 0.64 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.37 2kix h SER 12 CO -0.87 0.73 0.09 0.15 -0.53 0.00 0.00 176.83 176.41 2kix h PHE 13 N 0.72 0.17 -0.84 2.24 3.57 0.11 0.43 116.94 123.34 2kix h PHE 13 Ca 0.17 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.76 2kix h PHE 13 Cb 0.23 -0.04 -0.07 0.00 2.79 0.00 0.00 35.95 38.87 2kix h PHE 13 CO 0.01 0.08 0.51 0.82 -2.23 0.00 0.00 178.31 177.50 2kix h ILE 14 N 0.21 0.99 -0.23 1.41 2.04 -0.85 -1.44 117.51 119.64 2kix h ILE 14 Ca 0.11 -0.31 -0.18 0.00 1.00 0.00 0.00 64.86 65.48 2kix h ILE 14 Cb 0.07 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.17 2kix h ILE 14 CO -0.11 0.16 -0.57 0.25 0.00 0.00 0.00 178.15 177.88 2kix h LEU 15 N 0.90 0.81 -0.84 1.44 6.46 -0.94 -2.76 115.31 120.37 2kix h LEU 15 Ca 0.38 -0.44 0.16 0.00 -0.12 0.00 0.00 57.88 57.86 2kix h LEU 15 Cb 0.24 -0.23 -0.10 0.00 -0.73 0.00 0.00 40.66 39.84 2kix h LEU 15 CO -0.20 1.21 0.40 0.28 -0.62 0.00 0.00 178.44 179.51 2kix h SER 16 N 0.55 0.44 -0.10 1.25 0.02 0.91 0.19 113.55 116.81 2kix h SER 16 Ca 0.00 0.11 -0.09 0.00 -0.84 0.00 0.00 61.79 60.97 2kix h SER 16 Cb 1.16 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2kix h SER 16 CO 0.12 0.15 -0.29 0.00 -1.14 0.00 0.00 176.83 175.67 2kix h ALA 17 N 1.59 0.17 -0.82 3.77 0.00 -1.38 -2.28 119.26 120.30 2kix h ALA 17 Ca 0.47 -0.42 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2kix h ALA 17 Cb 0.73 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 2kix h ALA 17 CO -0.40 0.19 0.50 1.25 0.00 0.00 0.00 179.25 180.78 2kix h LEU 18 N -0.08 0.76 -0.76 0.00 5.85 -0.98 -1.23 115.31 118.87 2kix h LEU 18 Ca -0.01 0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.63 2kix h LEU 18 Cb 0.90 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 2kix h LEU 18 CO 0.06 0.47 -0.25 -0.74 -0.34 0.00 0.00 178.44 177.64 2kix h HIS 19 N 0.89 0.75 -0.12 1.25 2.76 -0.66 0.13 115.15 120.16 2kix h HIS 19 Ca 0.37 -0.17 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 2kix h HIS 19 Cb 0.22 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 2kix h HIS 19 CO -0.04 0.85 0.07 0.35 -1.30 0.00 0.00 177.93 177.86 2kix h PHE 20 N 0.58 0.15 -0.05 5.26 3.57 -0.64 0.41 116.94 126.22 2kix h PHE 20 Ca 0.08 0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.36 2kix h PHE 20 Cb 0.73 -0.05 0.02 0.00 2.79 0.00 0.00 35.95 39.44 2kix h PHE 20 CO 0.03 0.12 -0.85 0.82 -2.23 0.00 0.00 178.31 176.20 2kix h ILE 21 N 0.14 1.31 -0.37 1.41 2.04 -1.31 -2.06 117.51 118.67 2kix h ILE 21 Ca 0.04 -2.11 -0.05 0.00 1.00 0.00 0.00 64.86 63.74 2kix h ILE 21 Cb 0.01 2.31 -0.02 0.00 -0.74 0.00 0.00 36.82 38.38 2kix h ILE 21 CO -0.01 0.65 0.00 0.00 0.00 0.00 0.00 178.15 178.79 2kix h ALA 22 N 0.43 1.32 -0.07 1.87 0.00 -0.63 -1.09 119.26 121.09 2kix h ALA 22 Ca -0.09 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 2kix h ALA 22 Cb 1.50 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.14 2kix h ALA 22 CO 0.17 0.47 -0.51 2.35 0.00 0.00 0.00 179.25 181.72 2kix h TRP 23 N 0.55 0.66 -0.48 0.00 2.91 -0.17 -1.10 115.95 118.31 2kix h TRP 23 Ca 0.12 -0.31 -0.06 0.00 1.13 0.00 0.00 58.89 59.77 2kix h TRP 23 Cb 0.35 -0.09 -0.02 0.00 -0.51 0.00 0.00 29.16 28.88 2kix h TRP 23 CO 0.01 1.09 0.06 1.15 -1.03 0.00 0.00 178.44 179.72 2kix h THR 24 N 0.04 1.23 0.09 2.65 2.02 -1.17 0.35 112.91 118.12 2kix h THR 24 Ca -0.04 -0.88 -0.00 0.00 0.77 0.00 0.00 66.41 66.25 2kix h THR 24 Cb 1.18 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 2kix h THR 24 CO 0.10 0.32 -0.04 0.40 0.37 0.00 0.00 175.52 176.67 2kix h ILE 25 N 0.73 0.72 -0.43 3.11 2.04 -1.22 -1.47 117.51 120.98 2kix h ILE 25 Ca 0.15 -1.34 -0.01 0.00 1.00 0.00 0.00 64.86 64.67 2kix h ILE 25 Cb 0.36 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 2kix h ILE 25 CO 0.01 0.22 0.24 1.23 0.00 0.00 0.00 178.15 179.85 2kix h GLY 26 N -0.97 0.62 0.73 5.37 0.00 -1.22 -1.90 103.07 105.71 2kix h GLY 26 Ca -0.01 -0.25 -0.10 0.00 0.00 0.00 0.00 47.33 46.97 2kix h GLY 26 CO 0.02 0.24 -0.32 0.84 0.00 0.00 0.00 176.54 177.32 2kix h HIS 27 N 0.59 0.50 -0.45 5.60 -0.00 -0.38 -3.06 115.15 117.94 2kix h HIS 27 Ca 0.15 -0.21 0.09 0.00 -0.00 0.00 0.00 60.37 60.41 2kix h HIS 27 Cb 0.00 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 27.31 2kix h HIS 27 CO 0.00 0.93 0.31 1.25 -0.00 0.00 0.00 177.93 180.43 2kix h LEU 28 N -0.08 0.20 -0.91 0.26 6.46 -0.89 -0.61 115.31 119.76 2kix h LEU 28 Ca -0.01 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.72 2kix h LEU 28 Cb 0.95 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.80 2kix h LEU 28 CO 0.07 0.13 0.41 0.78 -0.62 0.00 0.00 178.44 179.21 2kix h ASN 29 N 0.23 1.09 -0.57 1.25 2.35 -1.25 -2.56 115.58 116.12 2kix h ASN 29 Ca 0.21 -0.12 0.07 0.00 -0.55 0.00 0.00 56.30 55.90 2kix h ASN 29 Cb 0.53 -0.28 -0.06 0.00 0.05 0.00 0.00 38.32 38.57 2kix h ASN 29 CO -0.04 0.91 0.26 1.56 -1.65 0.00 0.00 177.43 178.47 2kix h GLN 30 N 1.19 0.48 -2.29 0.81 1.08 -1.11 -2.22 115.11 113.05 2kix h GLN 30 Ca 0.29 -0.03 -0.69 0.00 -1.45 0.00 0.00 58.65 56.77 2kix h GLN 30 Cb 0.10 -0.11 -0.19 0.00 -0.05 0.00 0.00 27.48 27.23 2kix h GLN 30 CO -0.04 0.32 1.40 1.51 -0.95 0.00 0.00 178.83 181.06 2kix n ILE 31 N -4.91 4.68 0.00 2.54 3.06 -0.97 -4.45 119.36 119.31 2kix n ILE 31 Ca 0.07 -4.29 0.00 0.00 -2.50 0.00 0.00 62.75 56.02 2kix n ILE 31 Cb 0.19 -1.72 0.00 0.00 0.54 0.00 0.00 39.64 38.65 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 0.83 0.00 -0.23 9.51 4.81 -0.86 -5.00 118.16 127.22 2kix n LYS 32 Ca 0.54 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.98 2kix n LYS 32 Cb 0.33 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.38 2kix n LYS 32 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44