#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k0p s GLU 3 N 2.91 1.11 0.02 0.00 2.12 -1.26 -4.75 118.70 118.86 1k0p s GLU 3 Ca 0.15 1.22 0.25 0.00 0.36 0.00 0.00 54.97 56.95 1k0p s GLU 3 Cb -0.08 -1.76 0.50 0.00 0.26 0.00 0.00 34.13 33.05 1k0p s GLU 3 CO -0.20 -2.46 1.41 -1.91 -0.54 0.00 0.00 175.26 171.56 1k0p n GLU 4 N -4.08 0.07 0.00 4.30 2.13 -1.26 -1.19 120.64 120.61 1k0p n GLU 4 Ca 0.09 0.02 0.01 0.00 0.66 0.00 0.00 57.16 57.94 1k0p n GLU 4 Cb 0.53 -1.54 0.09 0.00 0.27 0.00 0.00 31.44 30.79 1k0p n GLU 4 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1k0p n PRO 5 N -1.63 0.99 -0.10 5.31 -0.04 -1.26 -2.05 135.00 136.22 1k0p n PRO 5 Ca 0.05 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.34 1k0p n PRO 5 Cb 0.36 -1.05 -0.07 0.00 -0.04 0.00 0.00 33.50 32.71 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 -0.55 1.50 -0.32 0.52 -1.04 -0.35 -4.08 114.28 109.96 1k0p n THR 6 Ca 0.02 -0.03 0.23 0.00 -2.04 0.00 0.00 64.05 62.23 1k0p n THR 6 Cb 0.01 -2.16 0.52 0.00 -1.82 0.00 0.00 70.33 66.88 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 0.38 0.23 -0.92 0.00 2.43 -1.66 5.70 114.38 120.54 1k0p h ARG 8 Ca 0.59 -0.02 0.23 0.00 -0.81 0.00 0.00 59.98 59.97 1k0p h ARG 8 Cb 1.51 -0.05 -0.13 0.00 -0.42 0.00 0.00 29.97 30.88 1k0p h ARG 8 CO -0.28 0.16 0.44 -0.97 -1.51 0.00 0.00 179.97 177.81 1k0p h ASN 9 N 0.23 0.40 1.09 -3.80 -1.24 -1.57 -1.77 115.58 108.91 1k0p h ASN 9 Ca 0.06 0.16 -0.15 0.00 0.71 0.00 0.00 56.30 57.08 1k0p h ASN 9 Cb -0.02 0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.13 1k0p h ASN 9 CO -0.01 0.00 -0.96 0.03 -1.29 0.00 0.00 177.43 175.20 1k0p h ARG 10 N 0.42 0.00 -0.65 6.67 3.08 0.13 -1.05 114.38 122.98 1k0p h ARG 10 Ca 0.59 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.73 1k0p h ARG 10 Cb 1.14 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.12 1k0p h ARG 10 CO -0.53 0.46 0.29 1.15 -1.07 0.00 0.00 179.97 180.27 1k0p h THR 11 N 0.00 0.82 0.61 2.04 2.02 1.16 13.52 112.91 133.07 1k0p h THR 11 Ca -0.08 -0.17 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 1k0p h THR 11 Cb 1.52 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1k0p h THR 11 CO 0.06 0.09 -0.33 -0.09 0.37 0.00 0.00 175.52 175.62 1k0p h ARG 12 N 0.50 -0.84 -0.78 6.66 1.12 -1.37 -1.83 114.38 117.84 1k0p h ARG 12 Ca 0.32 0.06 0.23 0.00 -1.11 0.00 0.00 59.98 59.48 1k0p h ARG 12 Cb 0.36 0.19 -0.03 0.00 -0.01 0.00 0.00 29.97 30.48 1k0p h ARG 12 CO -0.28 -0.56 0.64 0.45 -3.11 0.00 0.00 179.97 177.11 1k0p h HIS 13 N -0.87 0.00 0.37 2.20 3.86 -1.19 -2.31 115.15 117.21 1k0p h HIS 13 Ca -0.08 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1k0p h HIS 13 Cb 0.69 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.14 1k0p h HIS 13 CO -0.06 0.00 -0.38 1.25 0.86 0.00 0.00 177.93 179.59 1k0p h LEU 14 N 0.00 -1.04 0.00 2.43 5.85 3.09 0.54 115.31 126.18 1k0p h LEU 14 Ca 0.37 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.18 1k0p h LEU 14 Cb 1.64 0.35 0.00 0.00 0.37 0.00 0.00 40.66 43.02 1k0p h LEU 14 CO -0.00 -0.53 0.00 -2.65 -0.34 0.00 0.00 178.44 174.92 1k0p n PRO 15 N -5.48 0.00 -0.38 5.25 -0.02 -0.73 -0.88 135.00 132.75 1k0p n PRO 15 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 1k0p n PRO 15 Cb 0.38 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 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 -0.89 4.71 -4.57 2.45 7.94 0.19 -4.98 117.00 121.86 1k0p n LEU 16 Ca 0.00 -2.15 -0.42 0.00 -1.11 0.00 0.00 56.01 52.33 1k0p n LEU 16 Cb 0.00 -0.97 -0.01 0.00 0.53 0.00 0.00 43.42 42.97 1k0p n LEU 16 CO 0.00 0.88 1.79 0.00 -1.11 0.00 0.00 177.39 178.95 1k0p s GLN 17 N 0.06 3.81 0.66 1.96 1.03 -0.06 -4.59 119.66 122.53 1k0p s GLN 17 Ca 0.00 -1.67 0.39 0.00 0.04 0.00 0.00 55.36 54.12 1k0p s GLN 17 Cb 0.00 -5.47 2.13 0.00 0.03 0.00 0.00 33.01 29.70 1k0p s GLN 17 CO 0.00 -2.28 2.21 0.74 -2.54 0.00 0.00 175.29 173.42 1k0p h PHE 18 N 8.40 0.00 -3.25 9.60 0.04 -1.90 -3.45 116.94 126.38 1k0p h PHE 18 Ca 0.36 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 60.56 1k0p h PHE 18 Cb 0.92 0.00 -0.35 0.00 2.20 0.00 0.00 35.95 38.72 1k0p h PHE 18 CO 1.37 0.00 -0.83 -1.12 -0.60 0.00 0.00 178.31 177.14 1k0p s SER 19 N -4.95 2.35 -1.18 2.17 0.01 -1.26 -4.90 113.70 105.94 1k0p s SER 19 Ca -0.04 -0.40 -0.07 0.00 1.31 0.00 0.00 55.95 56.75 1k0p s SER 19 Cb 0.12 -1.03 0.24 0.00 0.21 0.00 0.00 66.02 65.55 1k0p s SER 19 CO 0.37 -0.01 1.67 -1.14 0.41 0.00 0.00 173.24 174.54 1k0p n ARG 20 N 4.35 4.05 -2.82 12.44 3.00 -1.26 -4.45 116.66 131.97 1k0p n ARG 20 Ca -0.18 -4.05 -0.09 0.00 -0.00 0.00 0.00 57.85 53.52 1k0p n ARG 20 Cb 0.51 -2.72 0.04 0.00 0.00 0.00 0.00 32.46 30.29 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 2.33 -2.12 -1.14 5.15 -2.24 -1.26 -4.95 114.28 110.05 1k0p n THR 21 Ca 0.33 -0.12 0.07 0.00 -2.27 0.00 0.00 64.05 62.06 1k0p n THR 21 Cb 0.35 -3.19 0.20 0.00 -2.10 0.00 0.00 70.33 65.59 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 4.61 2.97 3.38 0.00 -1.26 -4.62 105.19 109.14 1k0p n GLY 22 Ca -0.07 -1.13 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.94 1.89 -0.04 1.61 0.04 -1.26 -4.72 135.00 129.57 1k0p s PRO 23 Ca 0.38 -0.77 -0.02 0.00 0.04 0.00 0.00 61.00 60.63 1k0p s PRO 23 Cb 0.33 -2.32 0.03 0.00 0.04 0.00 0.00 34.50 32.57 1k0p s PRO 23 CO 0.04 -0.43 0.09 -0.51 0.04 0.00 0.00 177.00 176.23 1k0p s LEU 24 N 1.45 1.08 0.00 -3.56 1.02 -1.26 -3.90 118.68 113.50 1k0p s LEU 24 Ca -0.01 0.18 0.16 0.00 0.02 0.00 0.00 54.13 54.49 1k0p s LEU 24 Cb -0.16 0.21 0.26 0.00 0.02 0.00 0.00 46.19 46.51 1k0p s LEU 24 CO -0.08 -0.11 1.16 0.00 0.02 0.00 0.00 176.35 177.34 1k0p n PRO 26 N 0.95 1.31 0.00 0.00 -0.04 -1.26 -1.80 135.00 134.16 1k0p n PRO 26 Ca 0.13 -0.26 0.15 0.00 -0.04 0.00 0.00 63.50 63.47 1k0p n PRO 26 Cb 0.45 -1.51 0.84 0.00 -0.04 0.00 0.00 33.50 33.24 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 0.01 2.56 -2.07 0.55 0.00 -1.26 -5.02 120.51 115.28 1k0p n ALA 27 Ca 0.02 -0.17 -0.43 0.00 0.00 0.00 0.00 53.44 52.87 1k0p n ALA 27 Cb 0.30 -1.49 -0.03 0.00 0.00 0.00 0.00 19.45 18.24 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 7.88 4.05 0.00 0.00 2.81 -1.26 -5.01 117.12 125.58 1k0p n MET 29 Ca 0.20 -4.22 0.00 0.00 -1.81 0.00 0.00 57.70 51.87 1k0p n MET 29 Cb 0.45 -2.67 0.00 0.00 -0.71 0.00 0.00 33.22 30.30 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 2.50 3.94 0.00 0.03 4.01 -1.26 -5.11 118.16 122.27 1k0p n LYS 30 Ca 0.30 0.00 0.13 0.00 -0.51 0.00 0.00 58.31 58.23 1k0p n LYS 30 Cb 0.35 0.00 0.31 0.00 -0.51 0.00 0.00 35.03 35.18 1k0p n LYS 30 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29