#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrh s SER 2 N 0.00 -0.48 0.09 1.61 0.15 -1.26 -5.07 113.70 108.74 2yrh s SER 2 Ca 0.00 0.44 -0.27 0.00 0.70 0.00 0.00 55.95 56.82 2yrh s SER 2 Cb 0.00 0.46 -0.10 0.00 -1.71 0.00 0.00 66.02 64.67 2yrh s SER 2 CO 0.00 -0.57 1.44 0.28 1.20 0.00 0.00 173.24 175.59 2yrh h SER 3 N 3.25 -1.39 0.00 5.45 0.02 -2.13 -3.43 113.55 115.32 2yrh h SER 3 Ca -0.28 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 2yrh h SER 3 Cb 1.16 0.54 0.00 0.00 0.14 0.00 0.00 62.40 64.24 2yrh h SER 3 CO 0.40 -0.39 0.00 0.61 -1.14 0.00 0.00 176.83 176.31 2yrh n GLY 4 N -1.34 0.22 2.98 -3.77 0.00 -1.26 -5.12 105.19 96.89 2yrh n GLY 4 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 2yrh n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yrh s SER 5 N -0.72 -0.03 0.63 1.61 0.01 -1.26 -5.03 113.70 108.90 2yrh s SER 5 Ca 0.00 0.03 -0.11 0.00 1.31 0.00 0.00 55.95 57.18 2yrh s SER 5 Cb 0.00 0.16 -0.03 0.00 0.21 0.00 0.00 66.02 66.36 2yrh s SER 5 CO 0.00 -0.11 1.03 -0.44 0.41 0.00 0.00 173.24 174.14 2yrh s SER 6 N -0.33 6.06 -0.54 2.44 0.01 -1.26 -5.02 113.70 115.07 2yrh s SER 6 Ca -0.04 1.48 0.06 0.00 1.31 0.00 0.00 55.95 58.76 2yrh s SER 6 Cb -0.03 -2.48 0.35 0.00 0.21 0.00 0.00 66.02 64.08 2yrh s SER 6 CO 0.00 -0.98 0.95 0.61 0.41 0.00 0.00 173.24 174.23 2yrh n GLY 7 N -2.45 5.44 0.13 3.44 0.00 -1.26 -4.85 105.19 105.63 2yrh n GLY 7 Ca 0.06 -2.67 -0.14 0.00 0.00 0.00 0.00 46.02 43.28 2yrh n GLY 7 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2yrh h LYS 8 N 2.94 0.33 -6.94 1.61 3.64 -2.06 -3.44 116.57 112.64 2yrh h LYS 8 Ca 0.14 -0.20 -0.53 0.00 -1.27 0.00 0.00 60.65 58.80 2yrh h LYS 8 Cb 0.60 0.02 0.08 0.00 -0.41 0.00 0.00 32.23 32.52 2yrh h LYS 8 CO 0.79 0.77 0.62 0.15 -2.27 0.00 0.00 179.45 179.51 2yrh s LYS 9 N -4.11 3.99 1.00 1.90 1.02 -1.26 -5.01 119.74 117.26 2yrh s LYS 9 Ca -0.14 2.17 -0.12 0.00 0.02 0.00 0.00 55.97 57.89 2yrh s LYS 9 Cb 0.04 -2.77 0.19 0.00 -0.52 0.00 0.00 37.83 34.77 2yrh s LYS 9 CO 0.75 -0.48 1.09 -1.25 -0.92 0.00 0.00 175.35 174.54 2yrh s PRO 10 N -2.22 0.40 -0.43 -1.68 0.04 -1.26 -5.02 135.00 124.83 2yrh s PRO 10 Ca 0.56 0.51 -0.08 0.00 0.04 0.00 0.00 61.00 62.04 2yrh s PRO 10 Cb -0.38 -1.73 0.10 0.00 0.04 0.00 0.00 34.50 32.52 2yrh s PRO 10 CO 0.49 -2.75 0.27 -0.51 0.04 0.00 0.00 177.00 174.54 2yrh s LEU 11 N -6.47 5.32 -0.00 -3.56 1.43 -1.26 -5.00 118.68 109.14 2yrh s LEU 11 Ca 0.65 -1.74 0.08 0.00 -1.03 0.00 0.00 54.13 52.09 2yrh s LEU 11 Cb -0.19 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.06 2yrh s LEU 11 CO 0.58 -0.58 -0.24 0.54 0.23 0.00 0.00 176.35 176.88 2yrh s VAL 12 N 1.34 2.29 -0.30 -1.59 0.11 -1.26 0.10 120.40 121.09 2yrh s VAL 12 Ca 0.05 -1.14 -0.29 0.00 -2.93 0.00 0.00 61.98 57.67 2yrh s VAL 12 Cb -0.24 -1.85 -0.01 0.00 -1.53 0.00 0.00 36.38 32.75 2yrh s VAL 12 CO -0.00 0.50 1.58 0.00 -3.33 0.00 0.00 175.10 173.85 2yrh n ASN 14 N 8.93 0.00 -0.04 0.00 3.02 -1.26 0.24 115.26 126.14 2yrh n ASN 14 Ca 0.19 -0.07 -0.22 0.00 -0.03 0.00 0.00 54.58 54.45 2yrh n ASN 14 Cb 0.46 -0.17 -0.13 0.00 -0.61 0.00 0.00 39.78 39.34 2yrh n ASN 14 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2yrh n GLU 15 N -1.17 0.69 -0.02 3.52 -0.58 -1.26 -4.73 120.64 117.09 2yrh n GLU 15 Ca 0.07 0.36 -0.02 0.00 -0.42 0.00 0.00 57.16 57.15 2yrh n GLU 15 Cb 0.07 -1.71 -0.02 0.00 -0.57 0.00 0.00 31.44 29.22 2yrh n GLU 15 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2yrh n GLY 17 N 3.17 0.89 3.40 0.00 0.00 0.65 -5.00 105.19 108.31 2yrh n GLY 17 Ca -0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 2yrh n GLY 17 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yrh s LYS 18 N 0.21 3.42 0.42 1.61 2.20 -1.24 -4.74 119.74 121.62 2yrh s LYS 18 Ca 0.00 -0.63 -0.22 0.00 -0.36 0.00 0.00 55.97 54.75 2yrh s LYS 18 Cb 0.00 -3.34 -0.10 0.00 -1.51 0.00 0.00 37.83 32.88 2yrh s LYS 18 CO 0.00 -0.29 0.99 0.95 -0.36 0.00 0.00 175.35 176.64 2yrh s THR 19 N 1.57 4.06 0.27 3.43 -4.23 -1.26 -1.22 115.64 118.26 2yrh s THR 19 Ca 0.05 1.40 0.02 0.00 -1.18 0.00 0.00 61.69 61.98 2yrh s THR 19 Cb -0.16 -3.63 -0.05 0.00 1.34 0.00 0.00 72.50 69.99 2yrh s THR 19 CO 0.03 -0.16 0.09 -0.36 -0.54 0.00 0.00 174.62 173.67 2yrh s PHE 20 N -1.93 1.62 -0.17 3.99 0.40 0.29 -4.93 117.98 117.25 2yrh s PHE 20 Ca 0.61 -1.14 -0.18 0.00 -0.60 0.00 0.00 56.93 55.62 2yrh s PHE 20 Cb -0.15 -0.98 -0.22 0.00 0.51 0.00 0.00 43.02 42.18 2yrh s PHE 20 CO 0.19 -0.27 0.33 -0.09 0.70 0.00 0.00 175.22 176.08 2yrh h ARG 21 N 2.33 0.10 -5.97 0.44 9.65 -1.98 -3.34 114.38 115.61 2yrh h ARG 21 Ca -0.39 -0.16 -0.55 0.00 -1.10 0.00 0.00 59.98 57.78 2yrh h ARG 21 Cb 1.25 0.06 -0.07 0.00 -1.39 0.00 0.00 29.97 29.82 2yrh h ARG 21 CO 0.63 1.08 -0.45 -0.65 2.80 0.00 0.00 179.97 183.37 2yrh s GLN 22 N -2.42 2.31 -0.08 0.20 -1.52 -1.26 -4.91 119.66 111.99 2yrh s GLN 22 Ca -0.26 -1.78 -0.25 0.00 -1.95 0.00 0.00 55.36 51.13 2yrh s GLN 22 Cb 0.05 -2.09 -0.27 0.00 -0.22 0.00 0.00 33.01 30.48 2yrh s GLN 22 CO 0.66 -0.17 0.90 0.77 -0.25 0.00 0.00 175.29 177.21 2yrh h SER 23 N 1.28 0.24 -0.97 5.90 0.02 -1.98 -3.20 113.55 114.84 2yrh h SER 23 Ca -0.42 -0.91 0.19 0.00 -0.84 0.00 0.00 61.79 59.81 2yrh h SER 23 Cb 1.26 -0.08 -0.11 0.00 0.14 0.00 0.00 62.40 63.62 2yrh h SER 23 CO 0.66 1.12 0.57 0.28 -1.14 0.00 0.00 176.83 178.32 2yrh h SER 24 N -0.61 0.71 0.65 3.07 0.02 -1.98 0.74 113.55 116.14 2yrh h SER 24 Ca -0.06 0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 2yrh h SER 24 Cb 1.22 -0.02 0.01 0.00 0.14 0.00 0.00 62.40 63.75 2yrh h SER 24 CO 0.07 0.23 -0.31 0.00 -1.14 0.00 0.00 176.83 175.68 2yrh h LEU 26 N -0.94 -0.73 0.21 0.00 5.85 -1.45 -1.39 115.31 116.86 2yrh h LEU 26 Ca -0.09 0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.78 2yrh h LEU 26 Cb 0.67 0.36 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 2yrh h LEU 26 CO 0.15 -0.26 -0.28 0.28 -0.34 0.00 0.00 178.44 177.99 2yrh h SER 27 N -0.20 -0.77 0.00 1.25 0.02 -0.89 0.12 113.55 113.08 2yrh h SER 27 Ca 0.15 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 2yrh h SER 27 Cb 0.44 0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2yrh h SER 27 CO -0.41 -0.39 0.13 0.29 -1.14 0.00 0.00 176.83 175.32 2yrh n LYS 28 N -5.40 0.07 -0.08 3.45 5.02 0.55 -0.81 118.16 120.97 2yrh n LYS 28 Ca -0.08 0.52 -0.17 0.00 -2.02 0.00 0.00 58.31 56.56 2yrh n LYS 28 Cb 0.30 -1.86 -0.13 0.00 -0.02 0.00 0.00 35.03 33.32 2yrh n LYS 28 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2yrh n HIS 29 N -1.86 0.44 -0.19 2.13 -0.00 0.06 -4.29 115.22 111.50 2yrh n HIS 29 Ca -0.01 0.10 0.15 0.00 0.46 0.00 0.00 57.72 58.43 2yrh n HIS 29 Cb 0.15 -1.06 0.49 0.00 -0.12 0.00 0.00 29.99 29.45 2yrh n HIS 29 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 2yrh h GLN 30 N 0.02 0.44 -0.62 1.57 4.20 0.12 0.20 115.11 121.04 2yrh h GLN 30 Ca -0.51 -0.03 0.18 0.00 0.06 0.00 0.00 58.65 58.35 2yrh h GLN 30 Cb 1.99 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 29.65 2yrh h GLN 30 CO -0.01 0.29 0.70 0.07 -0.67 0.00 0.00 178.83 179.21 2yrh h ARG 31 N 0.46 0.00 -0.43 1.46 0.11 -1.71 0.52 114.38 114.79 2yrh h ARG 31 Ca 0.39 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.43 2yrh h ARG 31 Cb 0.87 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.93 2yrh h ARG 31 CO -0.14 0.00 0.10 -0.84 0.10 0.00 0.00 179.97 179.19 2yrh h ILE 32 N 0.00 1.19 0.00 0.08 3.07 -1.22 -2.77 117.51 117.86 2yrh h ILE 32 Ca 0.30 -0.70 -0.25 0.00 1.55 0.00 0.00 64.86 65.76 2yrh h ILE 32 Cb 1.69 0.77 -0.04 0.00 -0.27 0.00 0.00 36.82 38.96 2yrh h ILE 32 CO -0.00 0.25 -1.45 0.45 -1.05 0.00 0.00 178.15 176.35 2yrh h HIS 33 N 0.62 0.00 -0.88 0.16 3.86 -0.15 -3.24 115.15 115.52 2yrh h HIS 33 Ca 0.14 0.00 0.34 0.00 -1.16 0.00 0.00 60.37 59.69 2yrh h HIS 33 Cb 0.25 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 28.56 2yrh h HIS 33 CO 0.01 0.91 0.38 -1.13 0.86 0.00 0.00 177.93 178.97 2yrh n SER 34 N -3.10 0.22 0.00 2.45 3.41 -0.84 -4.50 113.62 111.27 2yrh n SER 34 Ca -0.11 1.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.97 2yrh n SER 34 Cb 0.98 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 2yrh n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yrh n GLY 35 N -1.27 0.00 0.64 5.00 0.00 -1.25 -5.02 105.19 103.29 2yrh n GLY 35 Ca 0.31 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.34 2yrh n GLY 35 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2yrh n GLU 36 N 0.00 1.60 -3.58 1.61 1.02 -1.22 -4.84 120.64 115.24 2yrh n GLU 36 Ca 0.00 -0.53 -0.37 0.00 -0.02 0.00 0.00 57.16 56.24 2yrh n GLU 36 Cb 0.00 -1.53 -0.06 0.00 -0.02 0.00 0.00 31.44 29.83 2yrh n GLU 36 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2yrh s LYS 37 N -1.41 3.90 -0.81 3.49 -2.85 -1.26 -5.01 119.74 115.78 2yrh s LYS 37 Ca 0.09 0.25 -0.25 0.00 -1.00 0.00 0.00 55.97 55.06 2yrh s LYS 37 Cb 0.07 -3.26 -0.04 0.00 -2.06 0.00 0.00 37.83 32.53 2yrh s LYS 37 CO 0.03 0.60 1.92 -1.25 0.10 0.00 0.00 175.35 176.76 2yrh s PRO 38 N -0.70 2.57 0.11 1.78 0.04 -1.26 -4.84 135.00 132.70 2yrh s PRO 38 Ca 0.21 -0.02 -0.22 0.00 0.04 0.00 0.00 61.00 61.02 2yrh s PRO 38 Cb -0.15 -4.86 -0.09 0.00 0.04 0.00 0.00 34.50 29.44 2yrh s PRO 38 CO 0.10 -3.19 1.72 1.03 0.04 0.00 0.00 177.00 176.70 2yrh h SER 39 N 12.41 -0.09 -2.39 6.66 0.87 -1.95 -3.48 113.55 125.59 2yrh h SER 39 Ca -0.01 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2yrh h SER 39 Cb 1.05 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 2yrh h SER 39 CO 1.21 -0.03 0.00 0.61 -0.53 0.00 0.00 176.83 178.09 2yrh n GLY 40 N -1.14 4.14 3.77 5.77 0.00 -1.26 -5.14 105.19 111.32 2yrh n GLY 40 Ca -0.05 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.59 2yrh n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yrh s PRO 41 N -2.99 2.72 -0.06 1.61 0.04 -1.26 -5.06 135.00 129.99 2yrh s PRO 41 Ca 0.00 1.36 -0.01 0.00 0.04 0.00 0.00 61.00 62.39 2yrh s PRO 41 Cb 0.00 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.63 2yrh s PRO 41 CO 0.00 -1.31 0.01 -1.12 0.04 0.00 0.00 177.00 174.62 2yrh s SER 42 N -2.70 1.34 0.09 6.66 0.01 -1.26 -5.04 113.70 112.80 2yrh s SER 42 Ca 0.66 -0.05 -0.26 0.00 1.31 0.00 0.00 55.95 57.61 2yrh s SER 42 Cb -0.20 -0.36 -0.14 0.00 0.21 0.00 0.00 66.02 65.53 2yrh s SER 42 CO 0.44 -0.19 1.68 0.28 0.41 0.00 0.00 173.24 175.86 2yrh h SER 43 N 8.17 -0.38 -0.03 2.44 0.02 -2.09 -3.57 113.55 118.10 2yrh h SER 43 Ca -0.22 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 2yrh h SER 43 Cb 1.13 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2yrh h SER 43 CO 0.27 -0.24 0.00 0.61 -1.14 0.00 0.00 176.83 176.34