#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrj s SER 2 N 0.00 4.43 0.60 1.61 0.15 -1.26 -5.14 113.70 114.10 2yrj s SER 2 Ca 0.00 -0.60 -0.04 0.00 0.70 0.00 0.00 55.95 56.02 2yrj s SER 2 Cb 0.00 -0.80 0.03 0.00 -1.71 0.00 0.00 66.02 63.53 2yrj s SER 2 CO 0.00 0.05 0.88 -0.44 1.20 0.00 0.00 173.24 174.94 2yrj s SER 3 N -3.23 5.31 0.00 5.45 0.01 -1.26 -4.57 113.70 115.41 2yrj s SER 3 Ca 0.28 0.43 0.00 0.00 1.31 0.00 0.00 55.95 57.97 2yrj s SER 3 Cb -0.08 -1.32 0.00 0.00 0.21 0.00 0.00 66.02 64.83 2yrj s SER 3 CO 0.18 -1.20 0.00 0.61 0.41 0.00 0.00 173.24 173.23 2yrj n GLY 4 N -2.58 1.86 3.57 3.44 0.00 -1.26 -4.92 105.19 105.31 2yrj n GLY 4 Ca 0.06 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 45.19 2yrj n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yrj s SER 5 N -0.33 5.26 0.06 1.61 0.15 -1.26 -4.91 113.70 114.28 2yrj s SER 5 Ca 0.00 -1.44 -0.27 0.00 0.70 0.00 0.00 55.95 54.94 2yrj s SER 5 Cb 0.00 -2.58 -0.14 0.00 -1.71 0.00 0.00 66.02 61.59 2yrj s SER 5 CO 0.00 -2.77 0.65 -0.24 1.20 0.00 0.00 173.24 172.08 2yrj n SER 6 N 13.57 -0.37 0.00 5.45 2.88 -1.26 -4.95 113.62 128.95 2yrj n SER 6 Ca 0.43 0.87 0.00 0.00 -1.33 0.00 0.00 58.87 58.84 2yrj n SER 6 Cb 0.47 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 63.22 2yrj n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yrj n GLY 7 N 1.28 2.24 3.91 0.46 0.00 -1.26 -5.13 105.19 106.69 2yrj n GLY 7 Ca 0.15 -0.29 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 2yrj n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2yrj s THR 8 N 4.04 5.05 0.00 2.61 -4.23 -1.26 -4.94 115.64 116.90 2yrj s THR 8 Ca 0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.50 2yrj s THR 8 Cb 0.00 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 70.11 2yrj s THR 8 CO 0.00 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.39 2yrj n GLY 9 N -0.90 -2.26 3.94 3.99 0.00 -1.26 -5.06 105.19 103.64 2yrj n GLY 9 Ca -0.02 -1.02 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 2yrj n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yrj s GLU 10 N -3.91 3.16 -0.26 1.61 0.41 -1.26 -5.05 118.70 113.41 2yrj s GLU 10 Ca 0.00 -0.31 -0.02 0.00 -0.41 0.00 0.00 54.97 54.23 2yrj s GLU 10 Cb 0.00 -2.51 0.03 0.00 -1.78 0.00 0.00 34.13 29.87 2yrj s GLU 10 CO 0.00 -0.26 -0.05 0.15 -0.49 0.00 0.00 175.26 174.61 2yrj s LYS 11 N -4.61 2.77 0.22 1.61 1.02 -1.26 -4.78 119.74 114.72 2yrj s LYS 11 Ca 0.48 -1.02 -0.01 0.00 0.02 0.00 0.00 55.97 55.44 2yrj s LYS 11 Cb -0.10 -3.02 0.22 0.00 -0.52 0.00 0.00 37.83 34.41 2yrj s LYS 11 CO 0.39 -0.43 1.59 -1.00 -0.92 0.00 0.00 175.35 174.98 2yrj h PRO 12 N 8.01 0.53 -6.13 -1.68 0.13 -1.88 -3.43 132.00 127.55 2yrj h PRO 12 Ca -0.31 -0.28 -0.57 0.00 -0.87 0.00 0.00 66.00 63.98 2yrj h PRO 12 Cb 1.10 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.19 2yrj h PRO 12 CO 0.57 0.86 0.57 0.71 -0.23 0.00 0.00 178.00 180.47 2yrj s TYR 13 N -4.19 3.45 -0.11 1.56 1.51 -1.25 -5.00 117.35 113.32 2yrj s TYR 13 Ca -0.07 1.47 -0.00 0.00 -1.01 0.00 0.00 57.07 57.46 2yrj s TYR 13 Cb 0.12 -3.16 0.02 0.00 -0.11 0.00 0.00 41.96 38.84 2yrj s TYR 13 CO 0.82 -0.28 -0.07 0.50 -1.11 0.00 0.00 175.55 175.41 2yrj s ARG 14 N 2.30 1.51 0.67 -0.62 3.52 -1.26 -1.43 118.95 123.64 2yrj s ARG 14 Ca 0.45 -0.25 -0.17 0.00 -0.13 0.00 0.00 55.73 55.63 2yrj s ARG 14 Cb -0.17 -1.58 -0.08 0.00 -1.56 0.00 0.00 34.95 31.56 2yrj s ARG 14 CO 0.14 -0.27 0.29 0.00 -0.81 0.00 0.00 175.30 174.65 2yrj n GLY 16 N 2.00 -0.91 0.10 0.00 0.00 -1.26 -3.23 105.19 101.89 2yrj n GLY 16 Ca 0.09 -0.29 -0.04 0.00 0.00 0.00 0.00 46.02 45.78 2yrj n GLY 16 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2yrj h GLU 17 N 0.00 -0.23 0.06 1.61 4.57 -1.99 -3.39 114.58 115.22 2yrj h GLU 17 Ca -0.53 0.02 -0.34 0.00 -1.18 0.00 0.00 59.36 57.33 2yrj h GLU 17 Cb 2.18 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 30.79 2yrj h GLU 17 CO 0.02 -0.15 -1.87 0.00 -1.18 0.00 0.00 179.01 175.83 2yrj n GLY 19 N 1.79 1.81 1.65 0.00 0.00 -1.20 -4.57 105.19 104.67 2yrj n GLY 19 Ca -0.35 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.51 2yrj n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yrj n LYS 20 N -0.19 -3.01 -3.76 1.61 5.02 -1.26 -4.47 118.16 112.10 2yrj n LYS 20 Ca 0.00 -0.78 -0.10 0.00 -2.02 0.00 0.00 58.31 55.41 2yrj n LYS 20 Cb 0.00 -0.91 -0.07 0.00 -0.02 0.00 0.00 35.03 34.03 2yrj n LYS 20 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2yrj s ALA 21 N -2.37 -0.56 -0.23 7.82 0.00 -1.26 0.01 121.76 125.17 2yrj s ALA 21 Ca 0.34 -0.27 -0.22 0.00 0.00 0.00 0.00 51.96 51.82 2yrj s ALA 21 Cb -0.05 0.49 0.06 0.00 0.00 0.00 0.00 23.12 23.62 2yrj s ALA 21 CO 0.28 -0.52 0.63 -0.06 0.00 0.00 0.00 175.76 176.09 2yrj s PHE 22 N -3.44 -0.69 0.31 0.00 0.40 -0.51 -4.95 117.98 109.10 2yrj s PHE 22 Ca 0.01 1.68 0.05 0.00 -0.60 0.00 0.00 56.93 58.07 2yrj s PHE 22 Cb 0.02 0.24 0.50 0.00 0.51 0.00 0.00 43.02 44.30 2yrj s PHE 22 CO -0.09 -0.33 1.76 0.00 0.70 0.00 0.00 175.22 177.26 2yrj h ALA 23 N 5.19 1.19 -4.06 5.36 0.00 -1.87 -3.31 119.26 121.77 2yrj h ALA 23 Ca -0.28 -0.33 -0.63 0.00 0.00 0.00 0.00 54.91 53.67 2yrj h ALA 23 Cb 1.17 -0.11 -0.25 0.00 0.00 0.00 0.00 17.79 18.60 2yrj h ALA 23 CO 0.11 0.52 -0.86 -0.65 0.00 0.00 0.00 179.25 178.38 2yrj s GLN 24 N -4.48 1.48 0.08 0.00 -0.21 -1.26 -4.81 119.66 110.47 2yrj s GLN 24 Ca -0.06 -1.10 -0.27 0.00 0.02 0.00 0.00 55.36 53.96 2yrj s GLN 24 Cb 0.14 -1.71 -0.17 0.00 1.00 0.00 0.00 33.01 32.28 2yrj s GLN 24 CO 0.77 0.43 1.69 0.87 -2.12 0.00 0.00 175.29 176.93 2yrj h LYS 25 N 4.56 -0.33 -1.50 2.91 1.79 -1.99 -2.08 116.57 119.93 2yrj h LYS 25 Ca -0.46 0.02 0.43 0.00 -2.18 0.00 0.00 60.65 58.47 2yrj h LYS 25 Cb 1.16 0.07 -0.06 0.00 -1.58 0.00 0.00 32.23 31.82 2yrj h LYS 25 CO 0.42 -0.22 1.07 0.00 -1.08 0.00 0.00 179.45 179.65 2yrj h ALA 26 N 0.41 3.39 0.00 3.86 0.00 -1.99 1.62 119.26 126.54 2yrj h ALA 26 Ca -0.03 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.61 2yrj h ALA 26 Cb 0.26 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2yrj h ALA 26 CO 0.06 -1.82 -1.09 -0.97 0.00 0.00 0.00 179.25 175.42 2yrj h ASN 27 N 0.01 0.00 0.00 0.00 -0.00 -1.80 -3.24 115.58 110.55 2yrj h ASN 27 Ca 0.72 0.00 -0.02 0.00 -0.00 0.00 0.00 56.30 57.00 2yrj h ASN 27 Cb 2.85 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 41.17 2yrj h ASN 27 CO -0.03 0.96 -0.17 0.25 -0.00 0.00 0.00 177.43 178.45 2yrj h LEU 28 N 0.00 0.00 -0.93 0.34 5.85 0.25 -3.20 115.31 117.62 2yrj h LEU 28 Ca -0.06 -0.51 0.25 0.00 0.84 0.00 0.00 57.88 58.40 2yrj h LEU 28 Cb 1.78 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 42.68 2yrj h LEU 28 CO 0.12 0.85 0.41 0.74 -0.34 0.00 0.00 178.44 180.22 2yrj h THR 29 N -1.00 0.39 -0.10 1.05 2.02 -0.47 0.79 112.91 115.58 2yrj h THR 29 Ca -0.04 -0.12 -0.08 0.00 0.77 0.00 0.00 66.41 66.95 2yrj h THR 29 Cb 0.64 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 2yrj h THR 29 CO -0.02 0.06 -0.28 0.06 0.37 0.00 0.00 175.52 175.71 2yrj h GLN 30 N 0.34 0.18 -0.38 6.66 3.07 -1.69 -2.92 115.11 120.38 2yrj h GLN 30 Ca 0.61 -0.06 -0.11 0.00 0.09 0.00 0.00 58.65 59.18 2yrj h GLN 30 Cb 1.25 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 28.79 2yrj h GLN 30 CO -0.58 0.46 -0.18 1.25 0.09 0.00 0.00 178.83 179.86 2yrj h HIS 31 N 0.16 0.91 0.00 0.06 2.76 0.56 -2.70 115.15 116.90 2yrj h HIS 31 Ca 0.02 -0.23 0.00 0.00 -2.20 0.00 0.00 60.37 57.97 2yrj h HIS 31 Cb 0.59 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.34 2yrj h HIS 31 CO 0.01 0.97 0.22 1.96 -1.30 0.00 0.00 177.93 179.79 2yrj h GLN 32 N 0.58 0.00 0.00 5.26 4.20 -1.08 0.69 115.11 124.77 2yrj h GLN 32 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 2yrj h GLN 32 Cb 0.73 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.51 2yrj h GLN 32 CO 0.06 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.22 2yrj h ARG 33 N 0.00 0.00 0.04 1.46 2.47 -1.52 -1.28 114.38 115.55 2yrj h ARG 33 Ca 0.00 0.00 -0.22 0.00 -1.26 0.00 0.00 59.98 58.50 2yrj h ARG 33 Cb 0.45 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.76 2yrj h ARG 33 CO 0.00 0.00 -1.00 -0.84 0.56 0.00 0.00 179.97 178.69 2yrj h ILE 34 N 0.00 1.52 -0.21 2.04 3.07 -1.05 -3.18 117.51 119.70 2yrj h ILE 34 Ca 0.00 -2.85 -0.07 0.00 1.55 0.00 0.00 64.86 63.48 2yrj h ILE 34 Cb 0.08 2.65 -0.04 0.00 -0.27 0.00 0.00 36.82 39.24 2yrj h ILE 34 CO 0.00 0.83 0.09 1.41 -1.05 0.00 0.00 178.15 179.43 2yrj n HIS 35 N -3.58 0.69 -4.37 0.16 8.25 -0.48 -4.74 115.22 111.14 2yrj n HIS 35 Ca -0.05 -0.55 -0.20 0.00 -0.26 0.00 0.00 57.72 56.66 2yrj n HIS 35 Cb 0.89 -0.33 -0.13 0.00 1.12 0.00 0.00 29.99 31.53 2yrj n HIS 35 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2yrj s THR 36 N -1.13 1.06 0.00 1.59 -4.23 -1.20 -5.05 115.64 106.68 2yrj s THR 36 Ca 0.15 -0.92 0.00 0.00 -1.18 0.00 0.00 61.69 59.74 2yrj s THR 36 Cb 0.12 -0.95 0.00 0.00 1.34 0.00 0.00 72.50 73.00 2yrj s THR 36 CO 0.03 0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.76 2yrj n GLY 37 N 2.04 2.65 3.54 3.99 0.00 -1.26 -4.58 105.19 111.57 2yrj n GLY 37 Ca -0.17 -0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.01 2yrj n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2yrj n GLU 38 N 13.65 1.42 -4.95 1.61 -0.58 -1.26 -4.94 120.64 125.58 2yrj n GLU 38 Ca 0.00 0.31 -0.27 0.00 -0.42 0.00 0.00 57.16 56.78 2yrj n GLU 38 Cb 0.00 -3.03 -0.16 0.00 -0.57 0.00 0.00 31.44 27.68 2yrj n GLU 38 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2yrj s LYS 39 N 6.97 1.84 -0.04 3.49 2.36 -1.26 -4.98 119.74 128.12 2yrj s LYS 39 Ca 1.04 -0.69 -0.30 0.00 -2.55 0.00 0.00 55.97 53.47 2yrj s LYS 39 Cb -0.46 -1.65 -0.05 0.00 -1.05 0.00 0.00 37.83 34.62 2yrj s LYS 39 CO 0.37 0.33 1.48 -1.25 1.55 0.00 0.00 175.35 177.83 2yrj s PRO 40 N -0.18 4.23 0.28 4.03 0.04 -1.26 -4.97 135.00 137.19 2yrj s PRO 40 Ca 0.00 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.76 2yrj s PRO 40 Cb -0.10 -3.74 -0.11 0.00 0.04 0.00 0.00 34.50 30.59 2yrj s PRO 40 CO 0.01 -0.70 1.54 0.45 0.04 0.00 0.00 177.00 178.35 2yrj s SER 41 N 2.41 6.45 0.00 6.66 0.15 -1.26 -4.93 113.70 123.19 2yrj s SER 41 Ca 0.66 2.87 0.00 0.00 0.70 0.00 0.00 55.95 60.19 2yrj s SER 41 Cb -0.31 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.37 2yrj s SER 41 CO 0.26 -0.85 0.00 0.61 1.20 0.00 0.00 173.24 174.46 2yrj n GLY 42 N 2.07 2.06 3.59 9.45 0.00 -1.26 -5.16 105.19 115.94 2yrj n GLY 42 Ca 0.07 -1.13 -0.30 0.00 0.00 0.00 0.00 46.02 44.66 2yrj n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yrj s PRO 43 N -2.00 -1.31 1.16 1.61 0.04 -1.26 -5.04 135.00 128.20 2yrj s PRO 43 Ca 0.00 -0.09 -0.18 0.00 0.04 0.00 0.00 61.00 60.76 2yrj s PRO 43 Cb 0.00 -1.59 0.27 0.00 0.04 0.00 0.00 34.50 33.22 2yrj s PRO 43 CO 0.00 -3.76 1.14 -1.12 0.04 0.00 0.00 177.00 173.29 2yrj s SER 44 N -3.91 1.33 0.13 6.66 0.01 -1.26 -5.09 113.70 111.56 2yrj s SER 44 Ca 0.71 0.62 -0.10 0.00 1.31 0.00 0.00 55.95 58.49 2yrj s SER 44 Cb -0.09 -0.86 0.00 0.00 0.21 0.00 0.00 66.02 65.28 2yrj s SER 44 CO 0.56 -3.87 0.27 -0.55 0.41 0.00 0.00 173.24 170.07 2yrj s SER 45 N -4.00 0.02 0.00 2.44 0.15 -1.26 -5.16 113.70 105.88 2yrj s SER 45 Ca 0.71 -0.67 0.00 0.00 0.70 0.00 0.00 55.95 56.69 2yrj s SER 45 Cb -0.09 0.41 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 2yrj s SER 45 CO 0.56 -0.82 0.00 0.61 1.20 0.00 0.00 173.24 174.78