#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2koe h VAL 2 N 0.00 0.21 -1.10 12.58 -1.51 -2.04 1.00 116.25 125.39 2koe h VAL 2 Ca 0.00 -0.06 0.31 0.00 -1.23 0.00 0.00 66.70 65.72 2koe h VAL 2 Cb 0.00 0.03 -0.11 0.00 -2.13 0.00 0.00 31.29 29.08 2koe h VAL 2 CO 0.00 0.03 0.70 -0.26 -1.23 0.00 0.00 177.57 176.81 2koe h PHE 3 N 0.16 0.66 -0.04 5.19 0.04 -2.03 1.89 116.94 122.81 2koe h PHE 3 Ca 0.77 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 61.56 2koe h PHE 3 Cb 2.26 -0.19 -0.00 0.00 2.20 0.00 0.00 35.95 40.23 2koe h PHE 3 CO -0.01 -0.01 0.01 0.00 -0.60 0.00 0.00 178.31 177.70 2koe h ALA 4 N 1.64 0.06 0.49 2.45 0.00 0.63 0.44 119.26 124.97 2koe h ALA 4 Ca 0.66 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.43 2koe h ALA 4 Cb 1.73 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.51 2koe h ALA 4 CO -0.35 -0.33 -0.23 0.35 0.00 0.00 0.00 179.25 178.68 2koe h PHE 5 N -0.13 -0.61 -1.06 0.00 3.57 0.14 -1.73 116.94 117.12 2koe h PHE 5 Ca 0.01 -0.01 0.35 0.00 3.53 0.00 0.00 57.97 61.85 2koe h PHE 5 Cb 0.21 0.20 -0.14 0.00 2.79 0.00 0.00 35.95 39.01 2koe h PHE 5 CO -0.00 -0.38 0.62 0.00 -2.23 0.00 0.00 178.31 176.32 2koe h ALA 6 N -1.68 2.13 0.86 2.41 0.00 0.23 0.79 119.26 124.01 2koe h ALA 6 Ca -0.07 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2koe h ALA 6 Cb 0.50 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.47 2koe h ALA 6 CO 0.11 -0.75 -0.41 0.77 0.00 0.00 0.00 179.25 178.96 2koe h SER 7 N 0.26 -0.98 -0.55 0.00 0.02 0.26 0.86 113.55 113.42 2koe h SER 7 Ca 0.75 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.74 2koe h SER 7 Cb 1.87 0.25 -0.03 0.00 0.14 0.00 0.00 62.40 64.64 2koe h SER 7 CO -0.57 -0.68 0.35 0.24 -1.14 0.00 0.00 176.83 175.04 2koe h MET 8 N -1.20 0.69 0.52 3.45 2.07 0.03 0.37 114.93 120.86 2koe h MET 8 Ca -0.12 -0.04 -0.02 0.00 -2.07 0.00 0.00 59.70 57.45 2koe h MET 8 Cb 0.89 -0.16 -0.00 0.00 -1.87 0.00 0.00 31.60 30.46 2koe h MET 8 CO 0.19 0.46 -0.33 -0.07 1.07 0.00 0.00 176.91 178.23 2koe h LEU 9 N 0.71 -0.84 -0.68 1.22 -0.00 0.68 1.27 115.31 117.68 2koe h LEU 9 Ca 0.21 0.05 0.14 0.00 -0.00 0.00 0.00 57.88 58.27 2koe h LEU 9 Cb -0.04 0.25 -0.10 0.00 -0.00 0.00 0.00 40.66 40.77 2koe h LEU 9 CO -0.07 -0.50 0.17 0.00 -0.00 0.00 0.00 178.44 178.04 2koe h LEU 11 N 0.29 -0.52 -2.31 0.00 3.38 0.13 0.86 115.31 117.13 2koe h LEU 11 Ca 0.37 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 2koe h LEU 11 Cb 0.59 0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 2koe h LEU 11 CO -0.45 -0.24 -0.04 -0.07 0.09 0.00 0.00 178.44 177.72 2koe h LEU 12 N -0.79 0.00 0.00 1.67 4.07 0.23 -2.87 115.31 117.62 2koe h LEU 12 Ca -0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.90 2koe h LEU 12 Cb 0.55 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.29 2koe h LEU 12 CO 0.10 0.04 -0.36 0.78 -1.08 0.00 0.00 178.44 177.92 2koe h ASN 13 N 0.00 0.00 -0.32 -0.43 -0.26 0.27 -3.14 115.58 111.70 2koe h ASN 13 Ca -0.00 0.00 0.09 0.00 -0.56 0.00 0.00 56.30 55.83 2koe h ASN 13 Cb 0.18 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.43 2koe h ASN 13 CO 0.01 0.58 0.28 0.77 -1.06 0.00 0.00 177.43 178.01 2koe h SER 14 N -0.80 0.00 0.00 5.81 4.64 0.69 -3.06 113.55 120.83 2koe h SER 14 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2koe h SER 14 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2koe h SER 14 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 2koe n THR 15 N -4.05 0.00 -3.45 2.95 -2.24 -1.08 -4.84 114.28 101.57 2koe n THR 15 Ca 0.05 0.39 -0.28 0.00 -2.27 0.00 0.00 64.05 61.93 2koe n THR 15 Cb 0.44 -0.91 -0.11 0.00 -2.10 0.00 0.00 70.33 67.65 2koe n THR 15 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2koe s VAL 16 N -0.67 0.35 0.00 2.28 1.01 -1.18 -4.94 120.40 117.25 2koe s VAL 16 Ca 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 61.98 59.72 2koe s VAL 16 Cb 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 35.12 2koe s VAL 16 CO 0.00 -1.11 0.00 -3.20 0.00 0.00 0.00 175.10 170.79 2koe n ASN 17 N 3.39 0.00 -1.24 3.32 4.05 -1.16 -4.75 115.26 118.86 2koe n ASN 17 Ca 0.21 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.24 2koe n ASN 17 Cb 0.42 0.28 0.00 0.00 1.23 0.00 0.00 39.78 41.71 2koe n ASN 17 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 2koe n PRO 18 N -2.09 0.21 0.06 1.20 -0.02 -1.26 -2.95 135.00 130.15 2koe n PRO 18 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2koe n PRO 18 Cb 0.00 -1.40 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 2koe n PRO 18 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2koe n ILE 19 N 1.16 0.16 0.08 4.25 -0.00 -1.26 -5.07 119.36 118.69 2koe n ILE 19 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 62.75 62.80 2koe n ILE 19 Cb 0.10 -0.76 0.00 0.00 -0.00 0.00 0.00 39.64 38.98 2koe n ILE 19 CO 0.00 0.00 0.00 2.30 -0.00 0.00 0.00 176.55 178.85 2koe n ILE 20 N -3.07 0.04 0.17 1.39 -5.35 -1.15 -4.85 119.36 106.53 2koe n ILE 20 Ca 0.00 0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.49 2koe n ILE 20 Cb 0.06 -0.35 0.00 0.00 -1.74 0.00 0.00 39.64 37.61 2koe n ILE 20 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2koe n TYR 21 N -3.08 0.00 -1.28 4.28 4.01 -1.26 -4.74 117.16 115.09 2koe n TYR 21 Ca 0.00 -0.38 -0.08 0.00 -0.16 0.00 0.00 57.90 57.28 2koe n TYR 21 Cb 0.00 -0.27 -0.07 0.00 -0.31 0.00 0.00 39.34 38.69 2koe n TYR 21 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2koe n ALA 22 N 1.19 0.49 0.00 -0.72 0.00 -1.22 -2.49 120.51 117.75 2koe n ALA 22 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.09 2koe n ALA 22 Cb 0.26 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 17.94 2koe n ALA 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2koe n LEU 23 N 10.09 0.00 -0.38 0.00 4.32 -1.26 -4.30 117.00 125.47 2koe n LEU 23 Ca 0.25 0.00 -0.05 0.00 -0.02 0.00 0.00 56.01 56.19 2koe n LEU 23 Cb 0.44 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.22 2koe n LEU 23 CO 0.61 0.00 0.51 -2.11 -1.22 0.00 0.00 177.39 175.18 2koe n ARG 24 N 0.00 -0.30 -0.30 3.23 1.85 -1.26 -0.35 116.66 119.53 2koe n ARG 24 Ca 0.00 1.43 0.10 0.00 -1.00 0.00 0.00 57.85 58.39 2koe n ARG 24 Cb 0.00 -2.12 0.27 0.00 -1.05 0.00 0.00 32.46 29.56 2koe n ARG 24 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2koe n SER 25 N -5.29 3.63 -0.17 2.89 3.41 -1.26 -4.41 113.62 112.42 2koe n SER 25 Ca 0.06 -1.99 -0.02 0.00 -0.26 0.00 0.00 58.87 56.66 2koe n SER 25 Cb 0.32 -0.39 0.07 0.00 -0.26 0.00 0.00 64.21 63.95 2koe n SER 25 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2koe h LYS 26 N 3.82 0.37 0.12 4.33 1.79 -0.38 0.28 116.57 126.91 2koe h LYS 26 Ca 0.00 -0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2koe h LYS 26 Cb 0.93 -0.08 -0.04 0.00 -1.58 0.00 0.00 32.23 31.45 2koe h LYS 26 CO 0.00 0.24 -0.46 0.22 -1.08 0.00 0.00 179.45 178.37 2koe h ASP 27 N 0.38 -1.39 0.00 0.86 3.58 -1.77 0.67 116.42 118.75 2koe h ASP 27 Ca 0.26 0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.85 2koe h ASP 27 Cb 0.28 0.51 0.00 0.00 1.72 0.00 0.00 39.33 41.84 2koe h ASP 27 CO -0.25 -0.49 0.00 -0.11 -2.88 0.00 0.00 179.24 175.50 2koe n LEU 28 N -5.09 0.12 -0.06 2.28 7.94 -0.47 -0.25 117.00 121.46 2koe n LEU 28 Ca -0.08 -0.06 -0.06 0.00 -1.11 0.00 0.00 56.01 54.70 2koe n LEU 28 Cb 0.36 -0.06 -0.02 0.00 0.53 0.00 0.00 43.42 44.23 2koe n LEU 28 CO 0.14 0.03 -0.43 -1.14 -1.11 0.00 0.00 177.39 174.88 2koe n ARG 29 N -0.20 0.38 0.11 1.96 0.00 0.23 -3.25 116.66 115.88 2koe n ARG 29 Ca 0.00 0.25 -0.18 0.00 -0.00 0.00 0.00 57.85 57.91 2koe n ARG 29 Cb 0.03 -1.28 -0.14 0.00 0.00 0.00 0.00 32.46 31.08 2koe n ARG 29 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.63 178.75 2koe h HIS 30 N -0.75 0.67 -0.01 -0.14 2.07 -1.32 0.36 115.15 116.03 2koe h HIS 30 Ca 0.00 -0.47 -0.01 0.00 -2.85 0.00 0.00 60.37 57.03 2koe h HIS 30 Cb 0.64 -0.03 -0.00 0.00 2.57 0.00 0.00 27.41 30.58 2koe h HIS 30 CO -0.27 1.36 -0.06 0.00 -3.07 0.00 0.00 177.93 175.89 2koe h ALA 31 N 0.46 1.89 0.07 6.11 0.00 -0.84 0.73 119.26 127.69 2koe h ALA 31 Ca -0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 2koe h ALA 31 Cb 1.99 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.77 2koe h ALA 31 CO 0.22 0.08 -0.03 0.35 0.00 0.00 0.00 179.25 179.87 2koe h PHE 32 N 0.01 -0.09 -0.93 0.00 3.57 -1.46 -1.89 116.94 116.14 2koe h PHE 32 Ca 0.00 -0.00 0.27 0.00 3.53 0.00 0.00 57.97 61.77 2koe h PHE 32 Cb 0.11 0.03 -0.16 0.00 2.79 0.00 0.00 35.95 38.72 2koe h PHE 32 CO 0.00 -0.05 0.19 0.00 -2.23 0.00 0.00 178.31 176.22 2koe h ARG 33 N -0.27 0.10 -0.03 1.11 3.08 -0.06 1.03 114.38 119.33 2koe h ARG 33 Ca -0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2koe h ARG 33 Cb 0.07 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2koe h ARG 33 CO 0.02 0.06 0.00 0.45 -1.07 0.00 0.00 179.97 179.43 2koe n SER 34 N -5.34 1.96 0.14 7.04 2.88 0.25 -4.63 113.62 115.93 2koe n SER 34 Ca 0.24 -1.66 0.00 0.00 -1.33 0.00 0.00 58.87 56.12 2koe n SER 34 Cb 0.79 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 64.24 2koe n SER 34 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2koe n MET 35 N 0.53 0.00 -1.64 -1.46 2.81 0.35 -5.00 117.12 112.71 2koe n MET 35 Ca 0.17 0.00 -0.50 0.00 -1.81 0.00 0.00 57.70 55.57 2koe n MET 35 Cb 0.43 -0.04 -0.05 0.00 -0.71 0.00 0.00 33.22 32.85 2koe n MET 35 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2koe n PHE 36 N -3.49 2.14 0.01 2.03 3.72 0.33 -4.83 117.46 117.38 2koe n PHE 36 Ca 0.00 0.10 -0.15 0.00 -0.05 0.00 0.00 57.45 57.35 2koe n PHE 36 Cb 0.00 -2.62 -0.14 0.00 -0.94 0.00 0.00 39.48 35.78 2koe n PHE 36 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2koe h PRO 37 N 9.97 0.15 -6.24 -1.08 0.13 -1.91 -3.41 132.00 129.61 2koe h PRO 37 Ca -0.44 -0.26 -0.48 0.00 -0.87 0.00 0.00 66.00 63.95 2koe h PRO 37 Cb 1.28 0.10 -0.10 0.00 0.13 0.00 0.00 31.00 32.41 2koe h PRO 37 CO 0.96 0.91 -0.74 0.43 -0.23 0.00 0.00 178.00 179.33 2koe n SER 38 N -3.30 -4.19 -0.58 1.44 7.64 -1.26 -4.77 113.62 108.60 2koe n SER 38 Ca -0.22 -0.77 0.03 0.00 1.01 0.00 0.00 58.87 58.92 2koe n SER 38 Cb 1.05 -3.39 0.10 0.00 -1.01 0.00 0.00 64.21 60.96 2koe n SER 38 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2koe n ALA 39 N -4.34 2.62 0.50 -0.43 0.00 -1.26 -5.30 120.51 112.30 2koe n ALA 39 Ca 0.04 -0.44 0.04 0.00 0.00 0.00 0.00 53.44 53.08 2koe n ALA 39 Cb 0.52 -1.00 0.24 0.00 0.00 0.00 0.00 19.45 19.20 2koe n ALA 39 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89