#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 0.54 -0.67 1.08 2.07 -2.05 0.91 116.25 118.13 2koe h VAL 2 Ca 0.00 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.50 2koe h VAL 2 Cb 0.00 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 2koe h VAL 2 CO 0.00 0.01 0.41 0.15 0.02 0.00 0.00 177.57 178.16 2koe h PHE 3 N 0.00 0.77 -0.60 1.57 3.57 -2.04 0.36 116.94 120.57 2koe h PHE 3 Ca -0.00 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 2koe h PHE 3 Cb 0.03 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 2koe h PHE 3 CO 0.00 0.43 0.16 0.00 -2.23 0.00 0.00 178.31 176.67 2koe h ALA 4 N 1.30 1.16 0.78 2.41 0.00 -1.26 0.34 119.26 123.99 2koe h ALA 4 Ca 0.28 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2koe h ALA 4 Cb 0.05 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.60 2koe h ALA 4 CO -0.12 0.58 -0.37 0.35 0.00 0.00 0.00 179.25 179.69 2koe h PHE 5 N 0.89 -0.97 -0.95 0.00 3.57 -0.62 0.21 116.94 119.07 2koe h PHE 5 Ca 0.20 -0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.81 2koe h PHE 5 Cb 0.29 0.32 -0.09 0.00 2.79 0.00 0.00 35.95 39.26 2koe h PHE 5 CO 0.02 -0.60 0.57 0.00 -2.23 0.00 0.00 178.31 176.07 2koe h ALA 6 N -0.86 1.47 0.66 2.41 0.00 -0.08 0.93 119.26 123.79 2koe h ALA 6 Ca -0.11 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2koe h ALA 6 Cb 0.81 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 2koe h ALA 6 CO 0.18 0.08 -0.40 0.77 0.00 0.00 0.00 179.25 179.87 2koe h SER 7 N 0.84 -1.02 -0.94 0.00 0.02 0.28 0.34 113.55 113.08 2koe h SER 7 Ca 0.50 0.06 0.07 0.00 -0.84 0.00 0.00 61.79 61.57 2koe h SER 7 Cb 0.62 0.29 -0.06 0.00 0.14 0.00 0.00 62.40 63.39 2koe h SER 7 CO -0.31 -0.62 0.61 0.24 -1.14 0.00 0.00 176.83 175.60 2koe h MET 8 N -1.00 1.04 0.33 3.45 2.07 0.02 0.25 114.93 121.09 2koe h MET 8 Ca -0.09 -0.06 -0.01 0.00 -2.07 0.00 0.00 59.70 57.47 2koe h MET 8 Cb 0.80 -0.23 -0.02 0.00 -1.87 0.00 0.00 31.60 30.28 2koe h MET 8 CO 0.09 0.69 -0.35 1.25 1.07 0.00 0.00 176.91 179.66 2koe h LEU 9 N 1.07 -0.96 -0.16 1.22 6.46 0.14 0.62 115.31 123.71 2koe h LEU 9 Ca 0.41 0.08 0.04 0.00 -0.12 0.00 0.00 57.88 58.28 2koe h LEU 9 Cb 0.20 0.32 -0.04 0.00 -0.73 0.00 0.00 40.66 40.42 2koe h LEU 9 CO -0.16 -0.45 -0.07 0.00 -0.62 0.00 0.00 178.44 177.14 2koe h LEU 11 N -0.06 -1.15 -1.36 0.00 4.07 -0.28 0.40 115.31 116.93 2koe h LEU 11 Ca 0.09 0.09 0.05 0.00 0.08 0.00 0.00 57.88 58.18 2koe h LEU 11 Cb 0.19 0.37 -0.04 0.00 1.08 0.00 0.00 40.66 42.25 2koe h LEU 11 CO -0.20 -0.62 0.47 -0.07 -1.08 0.00 0.00 178.44 176.95 2koe h LEU 12 N -0.95 0.70 -0.44 1.67 4.07 0.41 -2.34 115.31 118.43 2koe h LEU 12 Ca -0.06 -0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.82 2koe h LEU 12 Cb 0.81 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 42.38 2koe h LEU 12 CO -0.01 0.47 -0.03 0.78 -1.08 0.00 0.00 178.44 178.56 2koe h ASN 13 N 0.80 0.80 -0.15 -0.43 -0.26 0.17 0.13 115.58 116.63 2koe h ASN 13 Ca 0.30 -0.33 0.00 0.00 -0.56 0.00 0.00 56.30 55.71 2koe h ASN 13 Cb 0.16 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 37.20 2koe h ASN 13 CO -0.09 0.93 0.00 -1.20 -1.06 0.00 0.00 177.43 176.01 2koe n SER 14 N -4.35 1.42 0.08 5.81 7.64 0.13 -4.07 113.62 120.28 2koe n SER 14 Ca -0.00 -2.09 0.00 0.00 1.01 0.00 0.00 58.87 57.79 2koe n SER 14 Cb 0.33 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 2koe n SER 14 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2koe n THR 15 N 0.06 0.36 -3.35 0.44 -2.24 -1.00 -5.00 114.28 103.55 2koe n THR 15 Ca 0.06 0.12 -0.26 0.00 -2.27 0.00 0.00 64.05 61.70 2koe n THR 15 Cb 0.28 -0.91 -0.09 0.00 -2.10 0.00 0.00 70.33 67.51 2koe n THR 15 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2koe n VAL 16 N -3.31 -1.12 0.00 2.28 0.31 0.43 -4.91 118.33 112.01 2koe n VAL 16 Ca 0.00 -3.44 0.00 0.00 -0.01 0.00 0.00 64.34 60.89 2koe n VAL 16 Cb 0.05 -1.62 0.00 0.00 -0.91 0.00 0.00 33.84 31.35 2koe n VAL 16 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2koe n ASN 17 N 2.64 0.00 -0.06 4.52 4.05 -1.22 -4.53 115.26 120.66 2koe n ASN 17 Ca 0.28 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.31 2koe n ASN 17 Cb 0.49 0.03 0.00 0.00 1.23 0.00 0.00 39.78 41.53 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 -1.56 0.28 0.00 1.20 -0.02 -1.26 -4.02 135.00 129.63 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 -1.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.46 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 -0.40 0.00 0.39 4.25 -0.00 -1.26 -5.00 119.36 117.34 2koe n ILE 19 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 62.75 62.87 2koe n ILE 19 Cb 0.01 0.00 0.06 0.00 -0.00 0.00 0.00 39.64 39.71 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 0.00 0.38 -0.08 1.39 -6.64 -1.26 -4.16 119.36 108.99 2koe n ILE 20 Ca 0.00 -0.37 0.00 0.00 -1.77 0.00 0.00 62.75 60.61 2koe n ILE 20 Cb 0.00 -0.10 0.00 0.00 -1.44 0.00 0.00 39.64 38.10 2koe n ILE 20 CO 0.00 0.00 0.00 -1.22 -1.77 0.00 0.00 176.55 173.56 2koe n TYR 21 N -2.27 0.00 -0.37 4.28 4.02 -1.26 -4.48 117.16 117.08 2koe n TYR 21 Ca 0.01 -0.43 -0.07 0.00 -0.01 0.00 0.00 57.90 57.40 2koe n TYR 21 Cb 0.48 -0.33 -0.05 0.00 -0.02 0.00 0.00 39.34 39.42 2koe n TYR 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2koe n ALA 22 N 1.53 -0.44 0.00 -0.72 0.00 -1.26 -4.27 120.51 115.35 2koe n ALA 22 Ca 0.00 0.80 0.00 0.00 0.00 0.00 0.00 53.44 54.24 2koe n ALA 22 Cb 0.24 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.49 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 -5.18 0.00 0.00 0.00 4.77 -1.26 -4.93 117.00 110.40 2koe n LEU 23 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2koe n LEU 23 Cb 0.27 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2koe n LEU 23 CO -0.14 0.00 0.00 -1.14 -1.33 0.00 0.00 177.39 174.78 2koe n ARG 24 N 0.00 0.00 -0.11 3.23 3.00 -1.26 0.26 116.66 121.78 2koe n ARG 24 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.85 57.93 2koe n ARG 24 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 32.46 32.60 2koe n ARG 24 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2koe n SER 25 N 0.00 2.51 0.25 6.15 3.41 -1.26 -4.70 113.62 119.98 2koe n SER 25 Ca 0.00 -2.91 0.08 0.00 -0.26 0.00 0.00 58.87 55.78 2koe n SER 25 Cb 0.00 -0.38 0.64 0.00 -0.26 0.00 0.00 64.21 64.20 2koe n SER 25 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 2koe h LYS 26 N 0.27 0.00 -0.85 4.33 5.09 0.33 0.49 116.57 126.22 2koe h LYS 26 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 60.65 60.75 2koe h LYS 26 Cb 0.98 0.00 -0.04 0.00 0.10 0.00 0.00 32.23 33.27 2koe h LYS 26 CO 0.03 0.07 0.56 0.22 -2.09 0.00 0.00 179.45 178.24 2koe h ASP 27 N 0.00 0.97 0.50 7.07 3.58 -1.84 0.54 116.42 127.23 2koe h ASP 27 Ca -0.00 -0.02 -0.30 0.00 0.42 0.00 0.00 57.03 57.13 2koe h ASP 27 Cb 0.14 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 40.94 2koe h ASP 27 CO 0.01 0.69 -1.45 0.25 -2.88 0.00 0.00 179.24 175.86 2koe h LEU 28 N 1.14 0.41 -0.17 2.28 6.46 -1.58 -3.12 115.31 120.72 2koe h LEU 28 Ca 0.31 -0.52 0.02 0.00 -0.12 0.00 0.00 57.88 57.58 2koe h LEU 28 Cb -0.11 -0.13 -0.05 0.00 -0.73 0.00 0.00 40.66 39.64 2koe h LEU 28 CO -0.07 1.42 -0.35 -0.09 -0.62 0.00 0.00 178.44 178.73 2koe h ARG 29 N 0.07 -0.31 -0.66 1.25 2.43 0.13 1.48 114.38 118.77 2koe h ARG 29 Ca -0.21 0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 58.95 2koe h ARG 29 Cb 2.01 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 31.60 2koe h ARG 29 CO 0.18 -0.20 0.30 1.12 -1.51 0.00 0.00 179.97 179.85 2koe h HIS 30 N -0.32 0.94 0.00 2.20 2.07 -1.09 2.88 115.15 121.83 2koe h HIS 30 Ca 0.03 -0.04 0.00 0.00 -2.85 0.00 0.00 60.37 57.51 2koe h HIS 30 Cb 0.41 -0.29 0.00 0.00 2.57 0.00 0.00 27.41 30.10 2koe h HIS 30 CO -0.60 0.69 0.00 0.00 -3.07 0.00 0.00 177.93 174.95 2koe n ALA 31 N -2.44 1.78 -0.28 6.11 0.00 -0.34 -1.06 120.51 124.29 2koe n ALA 31 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2koe n ALA 31 Cb 0.14 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.41 2koe n ALA 31 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2koe n PHE 32 N -1.18 0.00 0.00 0.00 7.35 0.49 0.15 117.46 124.28 2koe n PHE 32 Ca 0.07 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.76 2koe n PHE 32 Cb 0.07 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.90 2koe n PHE 32 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2koe n ARG 33 N -2.11 0.00 0.00 -4.13 5.12 0.86 -1.25 116.66 115.16 2koe n ARG 33 Ca 0.00 0.08 0.00 0.00 -1.93 0.00 0.00 57.85 56.00 2koe n ARG 33 Cb 0.00 -1.56 0.00 0.00 -1.16 0.00 0.00 32.46 29.74 2koe n ARG 33 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2koe n SER 34 N -0.93 0.00 0.10 0.55 2.88 -0.22 -4.97 113.62 111.02 2koe n SER 34 Ca 0.00 -0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2koe n SER 34 Cb 0.06 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 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 0.00 0.00 -1.96 -1.46 2.81 -0.38 -4.94 117.12 111.19 2koe n MET 35 Ca 0.00 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.47 2koe n MET 35 Cb 0.01 -0.07 -0.03 0.00 -0.71 0.00 0.00 33.22 32.42 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 -1.73 1.88 0.09 2.03 2.19 0.40 -4.85 117.98 117.98 2koe s PHE 36 Ca 0.00 0.15 0.07 0.00 0.33 0.00 0.00 56.93 57.48 2koe s PHE 36 Cb 0.00 -3.96 -0.22 0.00 -1.31 0.00 0.00 43.02 37.53 2koe s PHE 36 CO 0.00 -3.99 1.16 -1.00 1.83 0.00 0.00 175.22 173.22 2koe h PRO 37 N 9.94 0.02 -3.96 10.12 0.13 -1.89 -3.38 132.00 142.99 2koe h PRO 37 Ca -0.40 -0.04 -0.21 0.00 -0.87 0.00 0.00 66.00 64.48 2koe h PRO 37 Cb 1.18 0.01 0.09 0.00 0.13 0.00 0.00 31.00 32.42 2koe h PRO 37 CO 0.96 0.94 -0.42 0.45 -0.23 0.00 0.00 178.00 179.69 2koe n SER 38 N -3.32 -3.43 -0.41 1.44 2.88 -1.26 -4.90 113.62 104.62 2koe n SER 38 Ca -0.04 -0.34 0.00 0.00 -1.33 0.00 0.00 58.87 57.17 2koe n SER 38 Cb 0.97 -3.17 0.00 0.00 -0.75 0.00 0.00 64.21 61.26 2koe n SER 38 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2koe n ALA 39 N -3.46 1.82 0.75 -1.46 0.00 -1.26 -5.28 120.51 111.63 2koe n ALA 39 Ca -0.07 -0.61 0.06 0.00 0.00 0.00 0.00 53.44 52.81 2koe n ALA 39 Cb 0.56 -0.28 0.36 0.00 0.00 0.00 0.00 19.45 20.09 2koe n ALA 39 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65