#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k0p n GLU 3 N -2.84 -3.98 0.00 0.00 1.02 -1.26 -4.50 120.64 109.08 1k0p n GLU 3 Ca 0.00 3.10 0.12 0.00 -0.02 0.00 0.00 57.16 60.36 1k0p n GLU 3 Cb 0.00 -3.92 0.24 0.00 -0.02 0.00 0.00 31.44 27.75 1k0p n GLU 3 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1k0p n GLU 4 N -2.72 0.01 -0.03 3.49 0.28 -1.26 -1.36 120.64 119.05 1k0p n GLU 4 Ca -0.01 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.01 1k0p n GLU 4 Cb 0.49 -1.51 0.03 0.00 1.43 0.00 0.00 31.44 31.88 1k0p n GLU 4 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 1k0p n PRO 5 N -1.53 1.15 -0.11 3.44 -0.04 -1.26 -2.26 135.00 134.40 1k0p n PRO 5 Ca 0.05 -0.23 -0.19 0.00 -0.04 0.00 0.00 63.50 63.10 1k0p n PRO 5 Cb 0.34 -1.05 -0.08 0.00 -0.04 0.00 0.00 33.50 32.67 1k0p n PRO 5 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1k0p n THR 6 N -0.31 1.50 -0.35 0.52 -1.04 -0.46 -4.20 114.28 109.94 1k0p n THR 6 Ca 0.02 -0.05 0.09 0.00 -2.04 0.00 0.00 64.05 62.07 1k0p n THR 6 Cb 0.06 -2.12 0.28 0.00 -1.82 0.00 0.00 70.33 66.73 1k0p n THR 6 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1k0p h ARG 8 N 0.90 -0.06 -0.97 0.00 2.43 -1.74 5.01 114.38 119.95 1k0p h ARG 8 Ca 0.51 0.00 0.28 0.00 -0.81 0.00 0.00 59.98 59.96 1k0p h ARG 8 Cb 0.62 0.01 -0.14 0.00 -0.42 0.00 0.00 29.97 30.04 1k0p h ARG 8 CO -0.28 0.05 0.50 -0.91 -1.51 0.00 0.00 179.97 177.82 1k0p h ASN 9 N -0.15 0.45 0.97 -3.80 4.21 -1.70 -1.89 115.58 113.68 1k0p h ASN 9 Ca -0.01 0.17 -0.08 0.00 1.21 0.00 0.00 56.30 57.59 1k0p h ASN 9 Cb 0.13 0.13 -0.01 0.00 -1.12 0.00 0.00 38.32 37.45 1k0p h ASN 9 CO 0.01 -0.06 -1.08 0.03 -1.29 0.00 0.00 177.43 175.04 1k0p h ARG 10 N 0.38 0.00 -0.36 0.81 3.08 0.21 -1.02 114.38 117.48 1k0p h ARG 10 Ca 0.66 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.69 1k0p h ARG 10 Cb 1.40 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.44 1k0p h ARG 10 CO -0.57 0.17 0.12 1.15 -1.07 0.00 0.00 179.97 179.77 1k0p h THR 11 N 0.00 1.20 0.66 2.04 2.02 1.00 19.85 112.91 139.68 1k0p h THR 11 Ca -0.07 -0.66 -0.02 0.00 0.77 0.00 0.00 66.41 66.43 1k0p h THR 11 Cb 1.29 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.65 1k0p h THR 11 CO 0.03 0.23 -0.48 -0.09 0.37 0.00 0.00 175.52 175.57 1k0p h ARG 12 N 0.43 -1.05 -0.93 6.66 2.43 -1.44 -1.81 114.38 118.66 1k0p h ARG 12 Ca 0.12 0.07 0.27 0.00 -0.81 0.00 0.00 59.98 59.63 1k0p h ARG 12 Cb 0.23 0.24 -0.04 0.00 -0.42 0.00 0.00 29.97 29.99 1k0p h ARG 12 CO -0.01 -0.70 0.73 0.45 -1.51 0.00 0.00 179.97 178.93 1k0p h HIS 13 N -1.09 0.00 0.23 2.20 3.86 -1.24 -2.58 115.15 116.53 1k0p h HIS 13 Ca -0.08 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.13 1k0p h HIS 13 Cb 0.90 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.34 1k0p h HIS 13 CO -0.16 0.00 -0.44 1.25 0.86 0.00 0.00 177.93 179.43 1k0p h LEU 14 N 0.00 -1.28 0.00 2.43 5.85 4.69 0.61 115.31 127.61 1k0p h LEU 14 Ca 0.44 0.13 0.00 0.00 0.84 0.00 0.00 57.88 59.29 1k0p h LEU 14 Cb 1.89 0.46 0.00 0.00 0.37 0.00 0.00 40.66 43.38 1k0p h LEU 14 CO -0.00 -0.54 0.00 -2.65 -0.34 0.00 0.00 178.44 174.91 1k0p n PRO 15 N -5.49 0.00 -0.31 5.25 -0.02 -0.74 -1.62 135.00 132.06 1k0p n PRO 15 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1k0p n PRO 15 Cb 0.40 -1.31 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 1k0p n PRO 15 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1k0p n LEU 16 N -0.80 3.89 -4.50 2.45 4.32 0.21 -4.97 117.00 117.61 1k0p n LEU 16 Ca 0.00 -1.78 -0.43 0.00 -0.02 0.00 0.00 56.01 53.78 1k0p n LEU 16 Cb 0.00 -0.80 -0.01 0.00 -1.62 0.00 0.00 43.42 40.99 1k0p n LEU 16 CO 0.00 0.72 1.40 0.00 -1.22 0.00 0.00 177.39 178.29 1k0p s GLN 17 N 0.33 3.83 0.67 3.23 -2.07 -0.64 -4.62 119.66 120.39 1k0p s GLN 17 Ca 0.00 -1.96 0.40 0.00 -1.82 0.00 0.00 55.36 51.97 1k0p s GLN 17 Cb 0.00 -5.16 2.16 0.00 -1.09 0.00 0.00 33.01 28.92 1k0p s GLN 17 CO 0.00 -1.94 2.23 0.74 -1.32 0.00 0.00 175.29 174.99 1k0p h PHE 18 N 8.21 0.00 -3.20 9.60 -1.00 -1.92 -3.45 116.94 125.18 1k0p h PHE 18 Ca 0.27 0.00 -0.60 0.00 2.81 0.00 0.00 57.97 60.45 1k0p h PHE 18 Cb 0.94 0.00 -0.35 0.00 3.61 0.00 0.00 35.95 40.15 1k0p h PHE 18 CO 1.22 0.00 -0.84 -1.12 -1.61 0.00 0.00 178.31 175.96 1k0p s SER 19 N -4.96 2.59 -1.19 2.17 0.01 -1.26 -4.90 113.70 106.16 1k0p s SER 19 Ca -0.04 -0.47 -0.08 0.00 1.31 0.00 0.00 55.95 56.67 1k0p s SER 19 Cb 0.12 -1.16 0.23 0.00 0.21 0.00 0.00 66.02 65.42 1k0p s SER 19 CO 0.37 -0.01 1.64 0.54 0.41 0.00 0.00 173.24 176.19 1k0p n ARG 20 N 4.42 3.93 -2.84 12.44 5.12 -1.26 -4.37 116.66 134.10 1k0p n ARG 20 Ca -0.18 -4.01 -0.10 0.00 -1.93 0.00 0.00 57.85 51.62 1k0p n ARG 20 Cb 0.51 -2.75 0.05 0.00 -1.16 0.00 0.00 32.46 29.10 1k0p n ARG 20 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1k0p n THR 21 N 2.62 -2.76 -0.94 0.55 -2.24 -1.26 -4.94 114.28 105.31 1k0p n THR 21 Ca 0.33 -0.19 0.08 0.00 -2.27 0.00 0.00 64.05 62.00 1k0p n THR 21 Cb 0.36 -3.56 0.24 0.00 -2.10 0.00 0.00 70.33 65.27 1k0p n THR 21 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k0p n GLY 22 N -1.13 4.04 3.18 3.38 0.00 -1.26 -4.67 105.19 108.72 1k0p n GLY 22 Ca -0.11 -1.00 -0.29 0.00 0.00 0.00 0.00 46.02 44.62 1k0p n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1k0p s PRO 23 N -2.69 2.40 -0.18 1.61 0.04 -1.26 -4.79 135.00 130.12 1k0p s PRO 23 Ca 0.39 -0.74 -0.08 0.00 0.04 0.00 0.00 61.00 60.61 1k0p s PRO 23 Cb 0.32 -1.93 0.07 0.00 0.04 0.00 0.00 34.50 32.99 1k0p s PRO 23 CO 0.09 0.21 0.41 -0.48 0.04 0.00 0.00 177.00 177.27 1k0p s LEU 24 N 0.21 -0.31 0.00 -3.56 -0.00 -1.26 -4.39 118.68 109.37 1k0p s LEU 24 Ca -0.11 0.91 0.20 0.00 -0.00 0.00 0.00 54.13 55.13 1k0p s LEU 24 Cb -0.15 1.31 0.45 0.00 -0.00 0.00 0.00 46.19 47.80 1k0p s LEU 24 CO 0.05 -0.21 1.37 0.00 -0.00 0.00 0.00 176.35 177.57 1k0p n PRO 26 N 1.28 1.20 0.00 0.00 -0.04 -1.26 -1.57 135.00 134.61 1k0p n PRO 26 Ca 0.18 -0.18 0.14 0.00 -0.04 0.00 0.00 63.50 63.61 1k0p n PRO 26 Cb 0.55 -1.41 0.85 0.00 -0.04 0.00 0.00 33.50 33.45 1k0p n PRO 26 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1k0p n ALA 27 N -0.07 2.63 -2.41 0.55 0.00 -1.26 -4.99 120.51 114.96 1k0p n ALA 27 Ca 0.02 -0.18 -0.41 0.00 0.00 0.00 0.00 53.44 52.87 1k0p n ALA 27 Cb 0.24 -1.47 -0.03 0.00 0.00 0.00 0.00 19.45 18.19 1k0p n ALA 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k0p n MET 29 N 9.06 3.31 0.00 0.00 2.81 -1.26 -4.68 117.12 126.36 1k0p n MET 29 Ca 0.09 -3.35 -0.01 0.00 -1.81 0.00 0.00 57.70 52.63 1k0p n MET 29 Cb 0.50 -3.13 -0.00 0.00 -0.71 0.00 0.00 33.22 29.87 1k0p n MET 29 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1k0p n LYS 30 N 5.55 0.02 0.00 0.03 4.01 -1.26 -5.04 118.16 121.48 1k0p n LYS 30 Ca 0.43 0.01 0.00 0.00 -0.51 0.00 0.00 58.31 58.24 1k0p n LYS 30 Cb 0.40 -0.54 0.00 0.00 -0.51 0.00 0.00 35.03 34.38 1k0p n LYS 30 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29