#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 0.90 -0.43 12.58 2.07 -2.05 -0.36 116.25 128.95 2koe h VAL 2 Ca 0.00 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.33 2koe h VAL 2 Cb 0.00 0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 29.85 2koe h VAL 2 CO 0.00 0.13 0.15 0.15 0.02 0.00 0.00 177.57 178.02 2koe h PHE 3 N 0.70 0.26 -0.96 1.57 3.57 -2.05 0.54 116.94 120.58 2koe h PHE 3 Ca 0.36 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.98 2koe h PHE 3 Cb 0.33 -0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.94 2koe h PHE 3 CO -0.08 0.09 0.62 0.00 -2.23 0.00 0.00 178.31 176.71 2koe h ALA 4 N 1.29 1.53 0.24 2.41 0.00 -1.57 0.14 119.26 123.29 2koe h ALA 4 Ca 0.20 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2koe h ALA 4 Cb 0.20 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2koe h ALA 4 CO -0.21 0.28 -0.12 0.35 0.00 0.00 0.00 179.25 179.56 2koe h PHE 5 N 1.01 -0.30 -1.03 0.00 3.57 0.87 0.23 116.94 121.29 2koe h PHE 5 Ca 0.44 -0.01 0.26 0.00 3.53 0.00 0.00 57.97 62.19 2koe h PHE 5 Cb 0.35 0.10 -0.10 0.00 2.79 0.00 0.00 35.95 39.09 2koe h PHE 5 CO -0.00 -0.08 0.65 0.00 -2.23 0.00 0.00 178.31 176.64 2koe h ALA 6 N 0.24 2.10 0.40 2.41 0.00 0.15 0.96 119.26 125.52 2koe h ALA 6 Ca -0.03 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2koe h ALA 6 Cb 0.36 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2koe h ALA 6 CO 0.06 -0.52 -0.19 0.77 0.00 0.00 0.00 179.25 179.36 2koe h SER 7 N 0.46 -0.46 -0.53 0.00 0.02 0.02 -2.96 113.55 110.09 2koe h SER 7 Ca 0.61 -0.06 0.10 0.00 -0.84 0.00 0.00 61.79 61.59 2koe h SER 7 Cb 1.41 0.12 -0.08 0.00 0.14 0.00 0.00 62.40 63.99 2koe h SER 7 CO -0.35 -0.02 0.07 0.24 -1.14 0.00 0.00 176.83 175.63 2koe h MET 8 N -1.08 0.19 -0.98 3.45 2.07 0.54 0.18 114.93 119.30 2koe h MET 8 Ca -0.06 -0.01 0.12 0.00 -2.07 0.00 0.00 59.70 57.68 2koe h MET 8 Cb 0.50 -0.04 -0.14 0.00 -1.87 0.00 0.00 31.60 30.05 2koe h MET 8 CO 0.09 0.13 -0.50 1.25 1.07 0.00 0.00 176.91 178.94 2koe h LEU 9 N 0.19 -1.85 0.41 1.22 6.46 0.89 0.78 115.31 123.41 2koe h LEU 9 Ca 0.27 0.32 -0.02 0.00 -0.12 0.00 0.00 57.88 58.33 2koe h LEU 9 Cb 0.40 0.87 0.00 0.00 -0.73 0.00 0.00 40.66 41.20 2koe h LEU 9 CO -0.39 -0.26 -0.20 0.00 -0.62 0.00 0.00 178.44 176.98 2koe h LEU 11 N -1.03 -0.36 -0.25 0.00 3.38 -0.32 0.51 115.31 117.25 2koe h LEU 11 Ca -0.06 0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 2koe h LEU 11 Cb 0.53 0.30 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 2koe h LEU 11 CO 0.09 -0.14 -0.19 -0.07 0.09 0.00 0.00 178.44 178.22 2koe h LEU 12 N 0.08 0.60 -0.64 1.67 -0.00 0.49 -3.13 115.31 114.40 2koe h LEU 12 Ca 0.31 -0.45 -0.03 0.00 -0.00 0.00 0.00 57.88 57.71 2koe h LEU 12 Cb 0.50 -0.17 -0.03 0.00 -0.00 0.00 0.00 40.66 40.97 2koe h LEU 12 CO -0.55 0.92 0.27 0.78 -0.00 0.00 0.00 178.44 179.86 2koe h ASN 13 N 0.29 0.86 0.44 -0.43 -0.26 0.19 -0.03 115.58 116.64 2koe h ASN 13 Ca 0.05 -0.16 -0.02 0.00 -0.56 0.00 0.00 56.30 55.61 2koe h ASN 13 Cb 0.73 -0.22 -0.00 0.00 -1.06 0.00 0.00 38.32 37.76 2koe h ASN 13 CO 0.05 0.78 -0.10 0.28 -1.06 0.00 0.00 177.43 177.38 2koe h SER 14 N 0.89 0.00 0.02 5.81 0.02 0.01 -3.10 113.55 117.19 2koe h SER 14 Ca 0.21 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.83 2koe h SER 14 Cb 0.18 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.67 2koe h SER 14 CO -0.02 0.10 -1.84 1.07 -1.14 0.00 0.00 176.83 175.00 2koe n THR 15 N -3.50 1.58 -3.18 -2.27 5.66 -1.01 -4.99 114.28 106.57 2koe n THR 15 Ca -0.02 -0.29 0.05 0.00 -3.05 0.00 0.00 64.05 60.74 2koe n THR 15 Cb 0.24 -1.89 -0.03 0.00 -1.55 0.00 0.00 70.33 67.11 2koe n THR 15 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 2koe s VAL 16 N -2.45 -0.14 0.04 1.08 -7.23 -0.06 -5.08 120.40 106.56 2koe s VAL 16 Ca -0.31 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 59.86 2koe s VAL 16 Cb 0.09 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 36.03 2koe s VAL 16 CO 0.60 0.00 0.00 -3.20 -0.31 0.00 0.00 175.10 172.19 2koe n ASN 17 N 5.11 -0.37 0.00 4.85 4.05 -1.25 -4.59 115.26 123.06 2koe n ASN 17 Ca -0.08 0.10 0.00 0.00 0.45 0.00 0.00 54.58 55.05 2koe n ASN 17 Cb 0.55 0.64 0.00 0.00 1.23 0.00 0.00 39.78 42.20 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 -2.45 0.00 0.00 1.20 -0.02 -1.26 -2.15 135.00 130.32 2koe n PRO 18 Ca 0.00 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 2koe n PRO 18 Cb 0.00 -1.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 2koe n PRO 18 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 2koe n ILE 19 N -1.13 0.00 0.08 4.25 -0.00 -1.26 -4.87 119.36 116.43 2koe n ILE 19 Ca 0.00 0.38 0.00 0.00 -0.00 0.00 0.00 62.75 63.13 2koe n ILE 19 Cb 0.04 -1.06 0.00 0.00 -0.00 0.00 0.00 39.64 38.61 2koe n ILE 19 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 2koe n ILE 20 N -1.51 0.76 0.12 7.28 -0.00 -1.15 -4.79 119.36 120.07 2koe n ILE 20 Ca 0.00 0.25 0.00 0.00 -0.00 0.00 0.00 62.75 63.00 2koe n ILE 20 Cb 0.00 -1.18 0.00 0.00 -0.00 0.00 0.00 39.64 38.46 2koe n ILE 20 CO 0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 176.55 175.33 2koe n TYR 21 N -3.44 0.00 0.00 1.39 4.01 -1.24 -4.73 117.16 113.14 2koe n TYR 21 Ca 0.00 -0.37 0.00 0.00 -0.16 0.00 0.00 57.90 57.37 2koe n TYR 21 Cb 0.00 -0.28 0.00 0.00 -0.31 0.00 0.00 39.34 38.75 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 1.25 0.00 0.10 -0.72 0.00 -0.92 -2.74 120.51 117.49 2koe n ALA 22 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2koe n ALA 22 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.70 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 -0.11 -1.84 -2.17 0.00 4.77 -1.26 -4.53 117.00 111.85 2koe n LEU 23 Ca 0.00 0.65 -0.06 0.00 -0.03 0.00 0.00 56.01 56.57 2koe n LEU 23 Cb 0.00 1.97 -0.09 0.00 -2.33 0.00 0.00 43.42 42.98 2koe n LEU 23 CO 0.00 0.13 1.09 -2.11 -1.33 0.00 0.00 177.39 175.17 2koe n ARG 24 N -3.15 1.09 0.00 3.23 1.85 -1.26 -2.04 116.66 116.38 2koe n ARG 24 Ca 0.00 -0.52 0.00 0.00 -1.00 0.00 0.00 57.85 56.33 2koe n ARG 24 Cb 0.00 -1.74 0.00 0.00 -1.05 0.00 0.00 32.46 29.67 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 2.63 0.00 -0.44 2.89 3.41 -1.26 -4.90 113.62 115.95 2koe n SER 25 Ca 0.22 0.00 0.36 0.00 -0.26 0.00 0.00 58.87 59.20 2koe n SER 25 Cb 0.50 0.00 0.65 0.00 -0.26 0.00 0.00 64.21 65.11 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 0.00 0.11 -0.42 4.33 1.79 -1.21 0.85 116.57 122.02 2koe h LYS 26 Ca 0.00 -0.01 0.08 0.00 -2.18 0.00 0.00 60.65 58.55 2koe h LYS 26 Cb 0.00 -0.03 -0.08 0.00 -1.58 0.00 0.00 32.23 30.54 2koe h LYS 26 CO 0.00 0.07 -0.12 0.22 -1.08 0.00 0.00 179.45 178.55 2koe h ASP 27 N 0.12 -0.43 0.55 0.86 3.58 -1.90 0.73 116.42 119.93 2koe h ASP 27 Ca 0.78 0.13 0.00 0.00 0.42 0.00 0.00 57.03 58.36 2koe h ASP 27 Cb 2.51 0.28 0.00 0.00 1.72 0.00 0.00 39.33 43.84 2koe h ASP 27 CO -0.33 -0.15 0.00 -0.11 -2.88 0.00 0.00 179.24 175.77 2koe n LEU 28 N -5.33 0.67 -0.03 2.28 7.94 0.29 -2.04 117.00 120.78 2koe n LEU 28 Ca 0.03 0.70 -0.01 0.00 -1.11 0.00 0.00 56.01 55.61 2koe n LEU 28 Cb 0.24 -0.65 -0.00 0.00 0.53 0.00 0.00 43.42 43.54 2koe n LEU 28 CO 0.14 -0.67 -0.10 -0.09 -1.11 0.00 0.00 177.39 175.55 2koe h ARG 29 N 0.00 0.00 0.21 1.96 9.65 0.72 -3.21 114.38 123.71 2koe h ARG 29 Ca 0.00 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 2koe h ARG 29 Cb 0.28 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.86 2koe h ARG 29 CO 0.00 0.00 -0.10 1.12 2.80 0.00 0.00 179.97 183.79 2koe h HIS 30 N -0.56 -0.26 -0.96 2.20 2.07 -1.22 0.72 115.15 117.15 2koe h HIS 30 Ca 0.00 -0.01 0.30 0.00 -2.85 0.00 0.00 60.37 57.81 2koe h HIS 30 Cb 0.15 0.08 -0.17 0.00 2.57 0.00 0.00 27.41 30.05 2koe h HIS 30 CO -0.07 0.10 0.26 0.00 -3.07 0.00 0.00 177.93 175.15 2koe h ALA 31 N -0.56 1.50 0.25 6.11 0.00 -1.60 0.34 119.26 125.30 2koe h ALA 31 Ca -0.03 0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2koe h ALA 31 Cb 0.47 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2koe h ALA 31 CO 0.05 -0.63 -0.12 0.35 0.00 0.00 0.00 179.25 178.89 2koe h PHE 32 N 0.09 -0.32 0.00 0.00 3.57 -1.54 1.73 116.94 120.48 2koe h PHE 32 Ca 0.65 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 62.06 2koe h PHE 32 Cb 1.47 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 40.28 2koe h PHE 32 CO -0.27 -0.20 0.17 0.54 -2.23 0.00 0.00 178.31 176.32 2koe n ARG 33 N -3.19 0.89 0.00 1.11 5.12 0.25 -1.59 116.66 119.25 2koe n ARG 33 Ca -0.04 -0.46 0.00 0.00 -1.93 0.00 0.00 57.85 55.42 2koe n ARG 33 Cb 0.13 -1.73 0.00 0.00 -1.16 0.00 0.00 32.46 29.70 2koe n ARG 33 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 2koe n SER 34 N 2.83 0.00 0.02 0.55 7.64 0.13 -4.80 113.62 119.99 2koe n SER 34 Ca 0.19 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 60.06 2koe n SER 34 Cb 0.39 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.59 2koe n SER 34 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2koe n MET 35 N -0.18 0.02 -1.98 1.43 2.81 0.58 -4.99 117.12 114.81 2koe n MET 35 Ca 0.00 0.01 -0.42 0.00 -1.81 0.00 0.00 57.70 55.48 2koe n MET 35 Cb 0.00 -0.54 -0.03 0.00 -0.71 0.00 0.00 33.22 31.95 2koe n MET 35 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 2koe s PHE 36 N -2.03 2.00 -0.03 2.03 5.36 -0.62 -4.85 117.98 119.85 2koe s PHE 36 Ca -0.01 0.17 0.12 0.00 -0.96 0.00 0.00 56.93 56.25 2koe s PHE 36 Cb 0.00 -3.94 -0.23 0.00 -0.34 0.00 0.00 43.02 38.51 2koe s PHE 36 CO 0.02 -3.95 0.71 -1.00 -1.46 0.00 0.00 175.22 169.54 2koe h PRO 37 N 9.41 0.01 -2.81 10.12 0.13 -1.93 -3.42 132.00 143.51 2koe h PRO 37 Ca -0.40 -0.01 -0.34 0.00 -0.87 0.00 0.00 66.00 64.37 2koe h PRO 37 Cb 1.19 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 2koe h PRO 37 CO 0.95 0.55 -0.41 0.43 -0.23 0.00 0.00 178.00 179.29 2koe n SER 38 N -3.08 -4.90 -0.27 1.44 7.64 -1.26 -4.93 113.62 108.26 2koe n SER 38 Ca -0.16 0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.89 2koe n SER 38 Cb 1.04 -4.18 0.00 0.00 -1.01 0.00 0.00 64.21 60.06 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 -1.32 0.00 1.55 -0.43 0.00 -1.26 -5.33 120.51 113.72 2koe n ALA 39 Ca -0.20 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.39 2koe n ALA 39 Cb 0.63 0.00 0.56 0.00 0.00 0.00 0.00 19.45 20.65 2koe n ALA 39 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59