#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 3.44 0.05 1.61 0.01 -1.26 -5.01 113.70 112.54 2yrh s SER 2 Ca 0.00 -0.57 -0.19 0.00 1.31 0.00 0.00 55.95 56.50 2yrh s SER 2 Cb 0.00 -1.54 -0.14 0.00 0.21 0.00 0.00 66.02 64.55 2yrh s SER 2 CO 0.00 0.02 1.34 -1.28 0.41 0.00 0.00 173.24 173.73 2yrh h SER 3 N 7.82 0.46 0.00 2.44 0.87 -2.10 -3.46 113.55 119.58 2yrh h SER 3 Ca -0.42 -0.50 0.00 0.00 -1.23 0.00 0.00 61.79 59.64 2yrh h SER 3 Cb 1.16 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 2yrh h SER 3 CO 0.61 0.87 0.00 0.61 -0.53 0.00 0.00 176.83 178.39 2yrh n GLY 4 N 0.25 0.67 3.73 5.77 0.00 -1.26 -5.05 105.19 109.30 2yrh n GLY 4 Ca -0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 2yrh n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yrh s SER 5 N -0.68 7.03 -0.18 1.61 0.15 -1.26 -4.98 113.70 115.39 2yrh s SER 5 Ca 0.00 1.23 -0.21 0.00 0.70 0.00 0.00 55.95 57.67 2yrh s SER 5 Cb 0.00 -2.42 -0.18 0.00 -1.71 0.00 0.00 66.02 61.71 2yrh s SER 5 CO 0.00 -0.06 0.31 0.77 1.20 0.00 0.00 173.24 175.47 2yrh h SER 6 N 6.38 0.00 0.00 5.45 4.64 -1.97 -3.50 113.55 124.55 2yrh h SER 6 Ca -0.42 -0.56 0.00 0.00 -0.47 0.00 0.00 61.79 60.34 2yrh h SER 6 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2yrh h SER 6 CO 0.74 1.22 0.00 0.61 -0.87 0.00 0.00 176.83 178.52 2yrh n GLY 7 N 1.52 -0.37 3.53 -0.77 0.00 -1.26 -5.15 105.19 102.69 2yrh n GLY 7 Ca -0.21 0.34 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 2yrh n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yrh s LYS 8 N 0.00 1.89 0.20 1.61 -2.85 -1.26 -5.14 119.74 114.19 2yrh s LYS 8 Ca 0.00 -1.41 -0.00 0.00 -1.00 0.00 0.00 55.97 53.56 2yrh s LYS 8 Cb 0.00 -2.03 -0.04 0.00 -2.06 0.00 0.00 37.83 33.70 2yrh s LYS 8 CO 0.00 0.41 0.38 -1.59 0.10 0.00 0.00 175.35 174.65 2yrh s LYS 9 N -2.94 3.51 0.72 1.78 -2.85 -1.26 -5.09 119.74 113.61 2yrh s LYS 9 Ca 0.25 -0.38 -0.12 0.00 -1.00 0.00 0.00 55.97 54.72 2yrh s LYS 9 Cb -0.08 -2.85 0.03 0.00 -2.06 0.00 0.00 37.83 32.87 2yrh s LYS 9 CO 0.14 0.41 1.10 -1.25 0.10 0.00 0.00 175.35 175.85 2yrh s PRO 10 N -3.33 2.50 -0.40 1.78 0.04 -1.26 -5.00 135.00 129.33 2yrh s PRO 10 Ca 0.38 1.26 -0.19 0.00 0.04 0.00 0.00 61.00 62.50 2yrh s PRO 10 Cb -0.11 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.52 2yrh s PRO 10 CO 0.29 -1.47 0.53 -0.51 0.04 0.00 0.00 177.00 175.88 2yrh s LEU 11 N -5.46 4.55 -0.04 -3.56 1.43 -1.25 -4.98 118.68 109.37 2yrh s LEU 11 Ca 0.64 -0.33 0.04 0.00 -1.03 0.00 0.00 54.13 53.45 2yrh s LEU 11 Cb -0.19 -2.57 -0.00 0.00 0.03 0.00 0.00 46.19 43.46 2yrh s LEU 11 CO 0.50 -0.61 -0.15 0.54 0.23 0.00 0.00 176.35 176.86 2yrh s VAL 12 N 2.45 1.24 -0.04 -1.59 0.11 -1.26 0.50 120.40 121.82 2yrh s VAL 12 Ca 0.18 -0.61 -0.30 0.00 -2.93 0.00 0.00 61.98 58.33 2yrh s VAL 12 Cb -0.15 -1.07 -0.07 0.00 -1.53 0.00 0.00 36.38 33.56 2yrh s VAL 12 CO 0.15 0.36 1.79 0.00 -3.33 0.00 0.00 175.10 174.08 2yrh n ASN 14 N 7.56 0.00 0.05 0.00 5.15 -1.26 0.20 115.26 126.96 2yrh n ASN 14 Ca 0.19 0.45 -0.21 0.00 -0.60 0.00 0.00 54.58 54.41 2yrh n ASN 14 Cb 0.42 -0.48 -0.14 0.00 -0.53 0.00 0.00 39.78 39.05 2yrh n ASN 14 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 2yrh h GLU 15 N 0.00 0.31 0.00 1.20 5.08 -2.00 -3.42 114.58 115.76 2yrh h GLU 15 Ca 0.00 -0.53 -0.08 0.00 -1.00 0.00 0.00 59.36 57.75 2yrh h GLU 15 Cb 0.34 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2yrh h GLU 15 CO 0.00 1.25 -1.30 0.00 -1.00 0.00 0.00 179.01 177.96 2yrh n GLY 17 N 3.14 0.92 3.42 0.00 0.00 0.53 -5.02 105.19 108.18 2yrh n GLY 17 Ca -0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 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 0.16 3.60 0.46 1.61 2.20 -1.22 -4.78 119.74 121.77 2yrh s LYS 18 Ca 0.00 -0.51 -0.19 0.00 -0.36 0.00 0.00 55.97 54.92 2yrh s LYS 18 Cb 0.00 -3.28 -0.09 0.00 -1.51 0.00 0.00 37.83 32.95 2yrh s LYS 18 CO 0.00 -0.20 0.96 0.95 -0.36 0.00 0.00 175.35 176.70 2yrh s THR 19 N 1.59 4.47 0.04 3.43 -4.23 -1.26 -0.98 115.64 118.71 2yrh s THR 19 Ca 0.06 1.33 -0.00 0.00 -1.18 0.00 0.00 61.69 61.90 2yrh s THR 19 Cb -0.15 -3.66 -0.03 0.00 1.34 0.00 0.00 72.50 70.00 2yrh s THR 19 CO 0.02 -0.49 -0.03 -0.36 -0.54 0.00 0.00 174.62 173.22 2yrh s PHE 20 N -2.38 0.47 -0.17 3.99 0.08 0.18 -4.94 117.98 115.22 2yrh s PHE 20 Ca 0.60 -0.87 -0.21 0.00 0.12 0.00 0.00 56.93 56.57 2yrh s PHE 20 Cb -0.09 -0.34 -0.23 0.00 -0.57 0.00 0.00 43.02 41.79 2yrh s PHE 20 CO 0.22 -0.29 0.41 0.00 -0.10 0.00 0.00 175.22 175.46 2yrh h ARG 21 N 3.66 0.06 -6.29 0.44 2.47 -1.98 -3.32 114.38 109.41 2yrh h ARG 21 Ca -0.34 -0.10 -0.54 0.00 -1.26 0.00 0.00 59.98 57.75 2yrh h ARG 21 Cb 1.17 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 29.51 2yrh h ARG 21 CO 0.57 1.05 -0.28 -0.65 0.56 0.00 0.00 179.97 181.22 2yrh s GLN 22 N -2.36 3.56 0.28 0.04 -0.21 -1.26 -4.93 119.66 114.78 2yrh s GLN 22 Ca -0.25 -0.21 0.02 0.00 0.02 0.00 0.00 55.36 54.94 2yrh s GLN 22 Cb 0.04 -2.78 0.41 0.00 1.00 0.00 0.00 33.01 31.67 2yrh s GLN 22 CO 0.66 0.36 1.73 0.77 -2.12 0.00 0.00 175.29 176.68 2yrh h SER 23 N 2.01 0.50 0.36 5.90 0.02 -1.99 -2.70 113.55 117.65 2yrh h SER 23 Ca -0.48 -0.16 -0.10 0.00 -0.84 0.00 0.00 61.79 60.21 2yrh h SER 23 Cb 1.19 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.58 2yrh h SER 23 CO 0.68 0.73 -0.44 -1.28 -1.14 0.00 0.00 176.83 175.39 2yrh h SER 24 N 0.45 0.10 -0.02 3.07 0.87 -1.98 -2.43 113.55 113.61 2yrh h SER 24 Ca 0.07 -0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.59 2yrh h SER 24 Cb 0.65 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.57 2yrh h SER 24 CO 0.05 0.53 -0.03 0.00 -0.53 0.00 0.00 176.83 176.85 2yrh h LEU 26 N -0.03 -0.34 0.33 0.00 5.85 -1.55 -2.52 115.31 117.05 2yrh h LEU 26 Ca 0.02 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.55 2yrh h LEU 26 Cb 0.06 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 2yrh h LEU 26 CO -0.04 0.06 -0.44 -1.28 -0.34 0.00 0.00 178.44 176.39 2yrh h SER 27 N -0.79 -1.24 0.00 1.25 0.87 -1.42 0.41 113.55 112.62 2yrh h SER 27 Ca -0.04 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2yrh h SER 27 Cb 0.51 0.43 0.00 0.00 -0.44 0.00 0.00 62.40 62.90 2yrh h SER 27 CO 0.07 -0.56 0.08 1.17 -0.53 0.00 0.00 176.83 177.05 2yrh n LYS 28 N -5.51 0.05 -0.08 2.24 0.00 0.13 -0.91 118.16 114.09 2yrh n LYS 28 Ca -0.10 0.51 -0.16 0.00 0.00 0.00 0.00 58.31 58.56 2yrh n LYS 28 Cb 0.41 -1.74 -0.14 0.00 0.00 0.00 0.00 35.03 33.56 2yrh n LYS 28 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.40 178.98 2yrh n HIS 29 N -1.74 0.40 -0.13 5.64 -0.00 0.23 -4.29 115.22 115.33 2yrh n HIS 29 Ca -0.01 0.10 0.11 0.00 0.46 0.00 0.00 57.72 58.38 2yrh n HIS 29 Cb 0.09 -1.06 0.45 0.00 -0.12 0.00 0.00 29.99 29.35 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 0.52 -0.23 1.57 1.08 0.16 -0.54 115.11 117.68 2yrh h GLN 30 Ca -0.50 -0.03 0.07 0.00 -1.45 0.00 0.00 58.65 56.73 2yrh h GLN 30 Cb 2.02 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 29.33 2yrh h GLN 30 CO -0.00 0.34 0.58 0.07 -0.95 0.00 0.00 178.83 178.87 2yrh h ARG 31 N 0.53 0.00 -0.21 1.46 0.11 -1.71 0.60 114.38 115.15 2yrh h ARG 31 Ca 0.31 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 60.28 2yrh h ARG 31 Cb 0.49 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.56 2yrh h ARG 31 CO -0.10 0.00 -0.33 -0.84 0.10 0.00 0.00 179.97 178.80 2yrh h ILE 32 N 0.00 1.28 0.00 0.08 3.07 -1.36 -0.90 117.51 119.68 2yrh h ILE 32 Ca 0.11 -1.41 -0.15 0.00 1.55 0.00 0.00 64.86 64.96 2yrh h ILE 32 Cb 1.27 1.48 -0.02 0.00 -0.27 0.00 0.00 36.82 39.28 2yrh h ILE 32 CO -0.00 0.44 -0.92 0.45 -1.05 0.00 0.00 178.15 177.06 2yrh h HIS 33 N 0.38 0.00 -0.51 0.16 3.86 -0.01 -3.38 115.15 115.65 2yrh h HIS 33 Ca 0.05 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.32 2yrh h HIS 33 Cb 0.77 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 29.18 2yrh h HIS 33 CO 0.02 1.06 0.20 0.66 0.86 0.00 0.00 177.93 180.74 2yrh h SER 34 N -1.00 0.23 -2.10 2.45 4.64 -1.44 -3.48 113.55 112.85 2yrh h SER 34 Ca -0.23 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2yrh h SER 34 Cb 1.05 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2yrh h SER 34 CO -0.14 0.16 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 2yrh n GLY 35 N -1.26 -1.92 1.40 -0.77 0.00 -0.34 -4.93 105.19 97.37 2yrh n GLY 35 Ca 0.05 -0.80 0.10 0.00 0.00 0.00 0.00 46.02 45.37 2yrh n GLY 35 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2yrh n GLU 36 N 0.90 3.09 -2.46 1.61 2.13 -1.26 -4.96 120.64 119.69 2yrh n GLU 36 Ca 0.00 -2.61 -0.41 0.00 0.66 0.00 0.00 57.16 54.80 2yrh n GLU 36 Cb 0.00 -1.70 -0.04 0.00 0.27 0.00 0.00 31.44 29.97 2yrh n GLU 36 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2yrh s LYS 37 N -1.44 4.57 1.11 5.31 2.20 -1.26 -5.03 119.74 125.19 2yrh s LYS 37 Ca 0.48 1.78 -0.16 0.00 -0.36 0.00 0.00 55.97 57.71 2yrh s LYS 37 Cb 0.28 -3.25 0.24 0.00 -1.51 0.00 0.00 37.83 33.58 2yrh s LYS 37 CO 0.28 0.04 1.10 -1.25 -0.36 0.00 0.00 175.35 175.16 2yrh s PRO 38 N -0.47 -0.46 0.15 4.03 0.04 -1.26 -5.08 135.00 131.95 2yrh s PRO 38 Ca 0.50 0.20 0.09 0.00 0.04 0.00 0.00 61.00 61.83 2yrh s PRO 38 Cb -0.31 -1.66 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2yrh s PRO 38 CO 0.36 -3.26 -0.21 -1.54 0.04 0.00 0.00 177.00 172.40 2yrh s SER 39 N -3.68 2.82 0.00 6.66 1.04 -1.26 -5.13 113.70 114.14 2yrh s SER 39 Ca 0.68 -0.81 0.00 0.00 0.48 0.00 0.00 55.95 56.31 2yrh s SER 39 Cb -0.14 -0.17 0.00 0.00 0.10 0.00 0.00 66.02 65.81 2yrh s SER 39 CO 0.57 0.03 0.00 0.61 0.98 0.00 0.00 173.24 175.43 2yrh n GLY 40 N 0.55 1.73 0.00 7.32 0.00 -1.26 -4.92 105.19 108.60 2yrh n GLY 40 Ca -0.15 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.94 2yrh n GLY 40 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2yrh n PRO 41 N 0.00 0.49 -2.37 1.61 -0.04 -1.26 -4.71 135.00 128.72 2yrh n PRO 41 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 2yrh n PRO 41 Cb 0.00 -1.46 -0.02 0.00 -0.04 0.00 0.00 33.50 31.98 2yrh n PRO 41 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2yrh s SER 42 N -1.96 6.55 0.12 3.54 0.15 -1.26 -4.97 113.70 115.87 2yrh s SER 42 Ca 0.22 1.15 -0.25 0.00 0.70 0.00 0.00 55.95 57.77 2yrh s SER 42 Cb 0.10 -2.54 0.07 0.00 -1.71 0.00 0.00 66.02 61.95 2yrh s SER 42 CO 0.17 -1.20 0.65 -0.94 1.20 0.00 0.00 173.24 173.12 2yrh s SER 43 N 3.26 -0.55 0.00 5.45 1.04 -1.26 -5.05 113.70 116.59 2yrh s SER 43 Ca 0.59 0.07 0.00 0.00 0.48 0.00 0.00 55.95 57.09 2yrh s SER 43 Cb -0.17 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.52 2yrh s SER 43 CO 0.26 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 174.21