#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 4.46 0.56 -0.60 0.00 1.02 -1.26 -4.36 120.64 120.47 1k0p n GLU 3 Ca 0.07 -2.29 -0.26 0.00 -0.02 0.00 0.00 57.16 54.66 1k0p n GLU 3 Cb 0.45 -0.25 0.16 0.00 -0.02 0.00 0.00 31.44 31.78 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 -2.05 -2.00 -0.69 3.49 0.28 -1.26 -1.82 120.64 116.59 1k0p n GLU 4 Ca 0.12 -0.58 0.00 0.00 -0.16 0.00 0.00 57.16 56.54 1k0p n GLU 4 Cb 0.45 -1.56 0.00 0.00 1.43 0.00 0.00 31.44 31.76 1k0p n GLU 4 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67 1k0p n PRO 5 N -1.83 -0.39 -0.01 3.44 -0.02 -1.26 -4.29 135.00 130.64 1k0p n PRO 5 Ca 0.03 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.49 1k0p n PRO 5 Cb 0.50 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.97 1k0p n PRO 5 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1k0p n THR 6 N -0.25 0.13 0.08 3.45 -1.04 -0.76 -4.79 114.28 111.11 1k0p n THR 6 Ca 0.00 -0.04 -0.13 0.00 -2.04 0.00 0.00 64.05 61.85 1k0p n THR 6 Cb 0.00 -1.39 -0.07 0.00 -1.82 0.00 0.00 70.33 67.05 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 -0.13 0.40 -0.97 0.00 2.43 -1.91 0.82 114.38 115.01 1k0p h ARG 8 Ca -0.01 -0.05 0.29 0.00 -0.81 0.00 0.00 59.98 59.39 1k0p h ARG 8 Cb 0.10 -0.07 -0.14 0.00 -0.42 0.00 0.00 29.97 29.44 1k0p h ARG 8 CO 0.02 0.37 0.49 -0.97 -1.51 0.00 0.00 179.97 178.37 1k0p h ASN 9 N 0.32 0.41 0.77 -3.80 -0.00 -1.86 -1.81 115.58 109.62 1k0p h ASN 9 Ca 0.10 0.18 -0.17 0.00 -0.00 0.00 0.00 56.30 56.42 1k0p h ASN 9 Cb 0.10 0.15 -0.03 0.00 -0.00 0.00 0.00 38.32 38.54 1k0p h ASN 9 CO -0.01 -0.10 -1.33 -0.09 -0.00 0.00 0.00 177.43 175.89 1k0p h ARG 10 N 0.34 0.00 -0.74 6.67 2.43 0.66 -0.85 114.38 122.88 1k0p h ARG 10 Ca 0.68 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.79 1k0p h ARG 10 Cb 1.47 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.98 1k0p h ARG 10 CO -0.60 0.32 0.26 1.15 -1.51 0.00 0.00 179.97 179.59 1k0p h THR 11 N 0.00 1.26 0.37 0.20 2.02 0.57 17.37 112.91 134.71 1k0p h THR 11 Ca -0.15 -0.86 -0.00 0.00 0.77 0.00 0.00 66.41 66.16 1k0p h THR 11 Cb 1.58 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 1k0p h THR 11 CO 0.05 0.34 -0.40 -0.09 0.37 0.00 0.00 175.52 175.80 1k0p h ARG 12 N 1.09 -0.77 -0.80 6.66 1.12 -1.39 -0.71 114.38 119.57 1k0p h ARG 12 Ca 0.24 0.05 0.23 0.00 -1.11 0.00 0.00 59.98 59.40 1k0p h ARG 12 Cb 0.27 0.17 -0.03 0.00 -0.01 0.00 0.00 29.97 30.37 1k0p h ARG 12 CO -0.01 -0.51 0.58 0.45 -3.11 0.00 0.00 179.97 177.37 1k0p h HIS 13 N -0.80 0.00 0.14 2.20 3.86 -1.15 -3.08 115.15 116.33 1k0p h HIS 13 Ca -0.03 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 1k0p h HIS 13 Cb 0.72 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.18 1k0p h HIS 13 CO -0.23 0.00 -0.17 1.25 0.86 0.00 0.00 177.93 179.65 1k0p h LEU 14 N 0.00 -0.46 0.00 2.43 5.85 4.08 0.68 115.31 127.89 1k0p h LEU 14 Ca 0.38 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.14 1k0p h LEU 14 Cb 1.54 0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.73 1k0p h LEU 14 CO -0.00 -0.21 0.34 -2.65 -0.34 0.00 0.00 178.44 175.58 1k0p n PRO 15 N -3.33 0.00 -0.24 5.25 -0.02 -0.35 0.46 135.00 136.76 1k0p n PRO 15 Ca -0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 1k0p n PRO 15 Cb 0.15 -1.45 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 1k0p n PRO 15 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1k0p n LEU 16 N -0.71 3.44 -4.56 2.45 7.94 0.24 -4.96 117.00 120.82 1k0p n LEU 16 Ca 0.00 -1.59 -0.43 0.00 -1.11 0.00 0.00 56.01 52.88 1k0p n LEU 16 Cb 0.34 -0.69 -0.00 0.00 0.53 0.00 0.00 43.42 43.60 1k0p n LEU 16 CO 0.00 0.63 1.87 0.00 -1.11 0.00 0.00 177.39 178.78 1k0p s GLN 17 N 0.38 3.98 0.67 1.96 -2.07 0.17 -4.51 119.66 120.24 1k0p s GLN 17 Ca 0.00 -2.02 0.44 0.00 -1.82 0.00 0.00 55.36 51.96 1k0p s GLN 17 Cb 0.00 -5.46 2.38 0.00 -1.09 0.00 0.00 33.01 28.84 1k0p s GLN 17 CO 0.00 -2.19 2.35 0.74 -1.32 0.00 0.00 175.29 174.87 1k0p h PHE 18 N 7.66 0.00 -3.14 9.60 -1.00 -1.93 -3.45 116.94 124.68 1k0p h PHE 18 Ca 0.42 0.00 -0.60 0.00 2.81 0.00 0.00 57.97 60.59 1k0p h PHE 18 Cb 0.88 0.00 -0.36 0.00 3.61 0.00 0.00 35.95 40.08 1k0p h PHE 18 CO 1.38 0.00 -0.84 -1.12 -1.61 0.00 0.00 178.31 176.12 1k0p s SER 19 N -5.13 2.67 -1.12 2.17 0.01 -1.26 -4.89 113.70 106.14 1k0p s SER 19 Ca -0.05 -0.48 -0.07 0.00 1.31 0.00 0.00 55.95 56.66 1k0p s SER 19 Cb 0.13 -1.18 0.28 0.00 0.21 0.00 0.00 66.02 65.45 1k0p s SER 19 CO 0.40 -0.04 1.43 -1.14 0.41 0.00 0.00 173.24 174.30 1k0p n ARG 20 N 4.66 4.05 -2.81 12.44 3.00 -1.26 -4.39 116.66 132.35 1k0p n ARG 20 Ca -0.17 -4.36 -0.09 0.00 -0.00 0.00 0.00 57.85 53.22 1k0p n ARG 20 Cb 0.50 -2.61 0.04 0.00 0.00 0.00 0.00 32.46 30.40 1k0p n ARG 20 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1k0p n THR 21 N 2.15 -2.14 -1.25 5.15 -2.24 -1.26 -4.95 114.28 109.73 1k0p n THR 21 Ca 0.28 -0.13 0.07 0.00 -2.27 0.00 0.00 64.05 62.00 1k0p n THR 21 Cb 0.36 -3.20 0.19 0.00 -2.10 0.00 0.00 70.33 65.57 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 -1.12 4.82 2.87 3.38 0.00 -1.26 -4.65 105.19 109.23 1k0p n GLY 22 Ca -0.07 -1.18 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 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 -3.02 1.18 -0.10 1.61 0.04 -1.26 -4.70 135.00 128.76 1k0p s PRO 23 Ca 0.37 -1.24 -0.06 0.00 0.04 0.00 0.00 61.00 60.11 1k0p s PRO 23 Cb 0.33 -2.51 0.04 0.00 0.04 0.00 0.00 34.50 32.41 1k0p s PRO 23 CO 0.01 -0.85 0.24 -0.51 0.04 0.00 0.00 177.00 175.93 1k0p s LEU 24 N 1.37 0.58 0.00 -3.56 1.02 -1.26 -3.07 118.68 113.76 1k0p s LEU 24 Ca 0.05 0.50 -0.00 0.00 0.02 0.00 0.00 54.13 54.70 1k0p s LEU 24 Cb -0.18 0.73 0.01 0.00 0.02 0.00 0.00 46.19 46.77 1k0p s LEU 24 CO -0.14 -0.15 0.05 0.00 0.02 0.00 0.00 176.35 176.13 1k0p n PRO 26 N -1.09 -0.99 -0.16 0.00 -0.02 -1.26 -4.50 135.00 126.99 1k0p n PRO 26 Ca 0.01 0.01 0.08 0.00 -2.02 0.00 0.00 63.50 61.58 1k0p n PRO 26 Cb 0.02 -0.37 0.25 0.00 -0.02 0.00 0.00 33.50 33.38 1k0p n PRO 26 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k0p n ALA 27 N -1.27 2.46 -2.11 3.55 0.00 -1.26 -5.08 120.51 116.82 1k0p n ALA 27 Ca -0.02 -0.67 -0.43 0.00 0.00 0.00 0.00 53.44 52.32 1k0p n ALA 27 Cb 0.06 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 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 7.81 4.12 0.02 0.00 2.81 -1.26 -4.84 117.12 125.78 1k0p n MET 29 Ca 0.19 -4.42 0.00 0.00 -1.81 0.00 0.00 57.70 51.66 1k0p n MET 29 Cb 0.46 -2.35 0.00 0.00 -0.71 0.00 0.00 33.22 30.62 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 -0.26 0.00 0.00 0.03 4.01 -1.26 -5.00 118.16 115.67 1k0p n LYS 30 Ca 0.44 0.00 0.08 0.00 -0.51 0.00 0.00 58.31 58.32 1k0p n LYS 30 Cb 0.33 -0.48 0.07 0.00 -0.51 0.00 0.00 35.03 34.44 1k0p n LYS 30 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29