#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eoe s SER 2 N 0.00 -0.51 -0.46 1.61 0.01 -1.26 -5.13 113.70 107.97 2eoe s SER 2 Ca 0.00 0.62 -0.18 0.00 1.31 0.00 0.00 55.95 57.70 2eoe s SER 2 Cb 0.00 0.60 0.04 0.00 0.21 0.00 0.00 66.02 66.87 2eoe s SER 2 CO 0.00 -0.48 0.49 -0.44 0.41 0.00 0.00 173.24 173.22 2eoe s SER 3 N -0.93 6.20 0.00 2.44 0.01 -1.26 -4.96 113.70 115.20 2eoe s SER 3 Ca -0.10 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.30 2eoe s SER 3 Cb -0.02 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 63.97 2eoe s SER 3 CO 0.06 -0.69 0.00 0.61 0.41 0.00 0.00 173.24 173.63 2eoe n GLY 4 N 5.14 3.57 3.86 3.44 0.00 -1.26 -5.01 105.19 114.94 2eoe n GLY 4 Ca -0.08 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 2eoe n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2eoe n SER 5 N 0.00 -3.89 -4.78 1.61 2.88 -1.26 -4.97 113.62 103.21 2eoe n SER 5 Ca 0.00 -0.79 -0.30 0.00 -1.33 0.00 0.00 58.87 56.45 2eoe n SER 5 Cb 0.00 -3.92 -0.06 0.00 -0.75 0.00 0.00 64.21 59.47 2eoe n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2eoe s SER 6 N -3.58 5.52 -0.44 -3.46 0.15 -1.26 -5.07 113.70 105.57 2eoe s SER 6 Ca 0.50 -0.04 0.09 0.00 0.70 0.00 0.00 55.95 57.20 2eoe s SER 6 Cb -0.25 -1.47 0.30 0.00 -1.71 0.00 0.00 66.02 62.88 2eoe s SER 6 CO 0.83 0.15 0.68 0.61 1.20 0.00 0.00 173.24 176.70 2eoe n GLY 7 N 0.28 3.71 3.71 9.45 0.00 -1.26 -5.10 105.19 115.99 2eoe n GLY 7 Ca -0.09 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 2eoe n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eoe s THR 8 N -2.18 3.44 0.12 2.61 2.01 -1.26 -4.89 115.64 115.48 2eoe s THR 8 Ca 0.39 1.00 0.00 0.00 0.31 0.00 0.00 61.69 63.39 2eoe s THR 8 Cb 0.24 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 69.11 2eoe s THR 8 CO -0.09 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.51 2eoe n GLY 9 N 3.51 -0.09 2.36 4.40 0.00 -1.26 -5.06 105.19 109.05 2eoe n GLY 9 Ca 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 2eoe n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2eoe n GLU 10 N -3.36 -3.50 -1.12 1.61 4.07 -1.26 -4.96 120.64 112.13 2eoe n GLU 10 Ca 0.00 0.39 -0.37 0.00 -0.06 0.00 0.00 57.16 57.12 2eoe n GLU 10 Cb 0.09 -4.07 0.03 0.00 -0.06 0.00 0.00 31.44 27.43 2eoe n GLU 10 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 2eoe n LYS 11 N -2.54 0.02 -0.00 5.31 5.02 -1.26 -4.90 118.16 119.80 2eoe n LYS 11 Ca -0.04 0.01 -0.13 0.00 -2.02 0.00 0.00 58.31 56.13 2eoe n LYS 11 Cb 0.54 -1.10 -0.10 0.00 -0.02 0.00 0.00 35.03 34.35 2eoe n LYS 11 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2eoe h PRO 12 N -0.56 -0.03 -2.36 1.97 0.13 -1.93 -3.45 132.00 125.77 2eoe h PRO 12 Ca -0.43 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.66 2eoe h PRO 12 Cb 1.36 0.01 -0.25 0.00 0.13 0.00 0.00 31.00 32.25 2eoe h PRO 12 CO 0.33 0.44 -0.27 0.71 -0.23 0.00 0.00 178.00 178.98 2eoe s TYR 13 N -4.24 -0.94 -0.04 1.56 2.02 -1.25 -4.98 117.35 109.47 2eoe s TYR 13 Ca -0.16 1.75 -0.01 0.00 -0.37 0.00 0.00 57.07 58.28 2eoe s TYR 13 Cb 0.02 0.45 0.03 0.00 -0.40 0.00 0.00 41.96 42.06 2eoe s TYR 13 CO 0.66 -0.52 0.07 0.21 -1.57 0.00 0.00 175.55 174.40 2eoe s LYS 14 N 2.48 -0.01 -0.35 -0.62 2.20 -1.26 -1.39 119.74 120.79 2eoe s LYS 14 Ca -0.04 0.30 -0.28 0.00 -0.36 0.00 0.00 55.97 55.58 2eoe s LYS 14 Cb -0.11 -0.29 -0.02 0.00 -1.51 0.00 0.00 37.83 35.91 2eoe s LYS 14 CO -0.15 -0.21 1.79 0.00 -0.36 0.00 0.00 175.35 176.42 2eoe n ASN 16 N 10.40 2.13 -0.06 0.00 3.02 -1.26 -1.22 115.26 128.27 2eoe n ASN 16 Ca 0.23 -2.21 -0.07 0.00 -0.03 0.00 0.00 54.58 52.50 2eoe n ASN 16 Cb 0.47 -0.54 -0.07 0.00 -0.61 0.00 0.00 39.78 39.03 2eoe n ASN 16 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2eoe n GLU 17 N 0.13 1.49 0.00 3.52 -0.58 -1.26 -4.84 120.64 119.10 2eoe n GLU 17 Ca 0.07 0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 2eoe n GLU 17 Cb 0.48 -1.26 0.00 0.00 -0.57 0.00 0.00 31.44 30.10 2eoe n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2eoe n GLY 19 N 2.72 1.00 3.84 0.00 0.00 -0.36 -5.10 105.19 107.29 2eoe n GLY 19 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2eoe n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eoe s LYS 20 N 0.00 2.49 -0.01 1.61 1.02 -1.18 -4.90 119.74 118.76 2eoe s LYS 20 Ca 0.00 -1.57 0.00 0.00 0.02 0.00 0.00 55.97 54.42 2eoe s LYS 20 Cb 0.00 -2.31 0.01 0.00 -0.52 0.00 0.00 37.83 35.02 2eoe s LYS 20 CO 0.00 -0.14 0.00 0.08 -0.92 0.00 0.00 175.35 174.37 2eoe s VAL 21 N -2.48 0.07 -0.08 3.17 1.01 -1.26 0.59 120.40 121.42 2eoe s VAL 21 Ca 0.46 0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.51 2eoe s VAL 21 Cb -0.02 -0.12 0.01 0.00 0.00 0.00 0.00 36.38 36.25 2eoe s VAL 21 CO 0.27 0.07 -0.15 -0.36 0.00 0.00 0.00 175.10 174.92 2eoe s PHE 22 N 0.46 1.76 0.50 5.22 0.40 -0.49 -4.99 117.98 120.84 2eoe s PHE 22 Ca -0.04 -0.71 0.17 0.00 -0.60 0.00 0.00 56.93 55.75 2eoe s PHE 22 Cb -0.06 -1.26 1.22 0.00 0.51 0.00 0.00 43.02 43.43 2eoe s PHE 22 CO -0.01 -0.34 2.10 1.79 0.70 0.00 0.00 175.22 179.46 2eoe h THR 23 N 5.92 1.00 -3.41 0.64 1.35 -2.00 -3.34 112.91 113.07 2eoe h THR 23 Ca -0.28 -0.22 -0.66 0.00 -0.55 0.00 0.00 66.41 64.69 2eoe h THR 23 Cb 1.19 1.12 -0.14 0.00 -1.73 0.00 0.00 68.15 68.60 2eoe h THR 23 CO 0.47 0.06 -0.66 -1.10 -0.25 0.00 0.00 175.52 174.05 2eoe s GLN 24 N -4.87 2.69 0.03 4.72 -1.52 -1.26 -4.88 119.66 114.57 2eoe s GLN 24 Ca -0.05 -0.68 -0.26 0.00 -1.95 0.00 0.00 55.36 52.43 2eoe s GLN 24 Cb 0.16 -2.61 -0.17 0.00 -0.22 0.00 0.00 33.01 30.17 2eoe s GLN 24 CO 0.67 0.60 1.44 -2.95 -0.25 0.00 0.00 175.29 174.80 2eoe h ASN 25 N 4.22 -0.27 -1.18 5.90 7.08 -1.94 -2.88 115.58 126.51 2eoe h ASN 25 Ca -0.49 -0.15 0.38 0.00 -3.08 0.00 0.00 56.30 52.97 2eoe h ASN 25 Cb 1.17 0.07 -0.13 0.00 -2.08 0.00 0.00 38.32 37.35 2eoe h ASN 25 CO 0.57 -0.00 0.74 -1.28 -2.08 0.00 0.00 177.43 175.38 2eoe h SER 26 N -0.54 0.34 -0.05 6.14 0.87 -1.97 0.40 113.55 118.75 2eoe h SER 26 Ca -0.03 0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.67 2eoe h SER 26 Cb 0.40 0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2eoe h SER 26 CO 0.05 -0.14 0.02 0.45 -0.53 0.00 0.00 176.83 176.69 2eoe h HIS 27 N 0.19 0.08 -0.89 2.24 3.86 -1.90 0.19 115.15 118.92 2eoe h HIS 27 Ca 0.76 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.95 2eoe h HIS 27 Cb 2.16 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 30.57 2eoe h HIS 27 CO -0.01 0.19 0.50 1.25 0.86 0.00 0.00 177.93 180.72 2eoe h LEU 28 N -0.06 1.10 -0.20 2.43 5.85 -0.22 -1.07 115.31 123.14 2eoe h LEU 28 Ca 0.02 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.58 2eoe h LEU 28 Cb 0.14 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 2eoe h LEU 28 CO -0.00 0.87 -0.14 0.00 -0.34 0.00 0.00 178.44 178.83 2eoe h ALA 29 N 1.31 0.29 0.00 1.25 0.00 -1.02 0.27 119.26 121.36 2eoe h ALA 29 Ca 0.31 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2eoe h ALA 29 Cb 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2eoe h ALA 29 CO -0.05 0.17 0.00 -1.71 0.00 0.00 0.00 179.25 177.66 2eoe n ASN 30 N -4.51 0.00 -0.05 0.00 5.15 0.65 -3.41 115.26 113.10 2eoe n ASN 30 Ca -0.05 0.16 -0.06 0.00 -0.60 0.00 0.00 54.58 54.03 2eoe n ASN 30 Cb 0.36 -0.34 -0.02 0.00 -0.53 0.00 0.00 39.78 39.25 2eoe n ASN 30 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 2eoe n HIS 31 N -1.34 0.00 -0.37 1.20 -0.00 -0.43 -4.55 115.22 109.74 2eoe n HIS 31 Ca 0.07 0.00 0.32 0.00 0.46 0.00 0.00 57.72 58.57 2eoe n HIS 31 Cb 0.14 -0.32 0.54 0.00 -0.12 0.00 0.00 29.99 30.23 2eoe n HIS 31 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2eoe n GLN 32 N -3.95 -0.03 -0.23 1.57 6.02 0.92 0.98 117.38 122.66 2eoe n GLN 32 Ca -0.09 1.02 0.02 0.00 -0.01 0.00 0.00 57.00 57.95 2eoe n GLN 32 Cb 0.33 -1.99 0.11 0.00 1.02 0.00 0.00 30.24 29.72 2eoe n GLN 32 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 2eoe h ARG 33 N 0.00 0.07 -1.48 -1.09 0.11 -1.79 0.40 114.38 110.60 2eoe h ARG 33 Ca 0.71 -0.00 0.43 0.00 0.10 0.00 0.00 59.98 61.21 2eoe h ARG 33 Cb 2.24 -0.02 -0.06 0.00 1.11 0.00 0.00 29.97 33.24 2eoe h ARG 33 CO -0.40 0.05 1.06 -0.84 0.10 0.00 0.00 179.97 179.93 2eoe h ILE 34 N 0.07 0.25 -1.00 0.08 3.07 0.34 0.14 117.51 120.46 2eoe h ILE 34 Ca 0.36 -0.01 -0.49 0.00 1.55 0.00 0.00 64.86 66.28 2eoe h ILE 34 Cb 0.60 0.23 -0.18 0.00 -0.27 0.00 0.00 36.82 37.20 2eoe h ILE 34 CO -0.64 0.00 0.45 1.41 -1.05 0.00 0.00 178.15 178.32 2eoe n HIS 35 N -4.13 1.72 0.00 0.16 8.25 0.14 -4.06 115.22 117.31 2eoe n HIS 35 Ca 0.33 -2.01 0.00 0.00 -0.26 0.00 0.00 57.72 55.78 2eoe n HIS 35 Cb 1.53 -1.29 0.00 0.00 1.12 0.00 0.00 29.99 31.35 2eoe n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2eoe n THR 36 N 0.63 0.00 -0.02 1.59 -2.24 0.50 -4.84 114.28 109.89 2eoe n THR 36 Ca 0.46 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 62.09 2eoe n THR 36 Cb 0.54 -0.53 -0.10 0.00 -2.10 0.00 0.00 70.33 68.13 2eoe n THR 36 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2eoe h GLY 37 N 0.00 0.30 -5.06 3.38 0.00 -1.75 -3.45 103.07 96.49 2eoe h GLY 37 Ca 0.00 -0.47 -0.61 0.00 0.00 0.00 0.00 47.33 46.24 2eoe h GLY 37 CO 0.00 0.42 0.63 -0.62 0.00 0.00 0.00 176.54 176.97 2eoe n VAL 38 N -4.44 0.20 -2.60 4.60 0.31 -1.26 -4.93 118.33 110.21 2eoe n VAL 38 Ca -0.09 -0.05 -0.38 0.00 -0.01 0.00 0.00 64.34 63.81 2eoe n VAL 38 Cb 0.52 -1.27 -0.05 0.00 -0.91 0.00 0.00 33.84 32.13 2eoe n VAL 38 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2eoe s LYS 39 N 0.50 4.43 0.21 5.55 -0.14 -1.26 -4.97 119.74 124.06 2eoe s LYS 39 Ca 0.78 1.53 -0.02 0.00 -1.36 0.00 0.00 55.97 56.90 2eoe s LYS 39 Cb -0.77 -2.80 0.18 0.00 -1.68 0.00 0.00 37.83 32.76 2eoe s LYS 39 CO 0.43 0.09 1.57 -1.00 -0.76 0.00 0.00 175.35 175.69 2eoe h PRO 40 N 3.08 0.60 -6.30 -1.68 0.13 -1.97 -3.44 132.00 122.42 2eoe h PRO 40 Ca -0.47 -0.31 -0.64 0.00 -0.87 0.00 0.00 66.00 63.71 2eoe h PRO 40 Cb 1.21 0.01 -0.28 0.00 0.13 0.00 0.00 31.00 32.06 2eoe h PRO 40 CO 0.64 0.91 -0.87 0.45 -0.23 0.00 0.00 178.00 178.90 2eoe s SER 41 N -6.86 2.72 0.59 1.44 0.15 -1.26 -5.12 113.70 105.36 2eoe s SER 41 Ca -0.08 -0.47 -0.20 0.00 0.70 0.00 0.00 55.95 55.91 2eoe s SER 41 Cb 0.12 -0.28 -0.03 0.00 -1.71 0.00 0.00 66.02 64.12 2eoe s SER 41 CO 0.83 0.25 1.29 -0.83 1.20 0.00 0.00 173.24 175.98 2eoe s GLY 42 N -0.80 2.84 -0.92 9.45 0.00 -1.26 -4.87 107.32 111.76 2eoe s GLY 42 Ca 0.09 1.19 -0.24 0.00 0.00 0.00 0.00 44.72 45.76 2eoe s GLY 42 CO 0.00 1.65 1.95 2.56 0.00 0.00 0.00 173.10 179.25 2eoe s PRO 43 N -3.16 2.55 0.00 2.90 0.04 -1.26 -4.54 135.00 131.52 2eoe s PRO 43 Ca 0.77 -0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.47 2eoe s PRO 43 Cb -0.36 -5.07 0.00 0.00 0.04 0.00 0.00 34.50 29.11 2eoe s PRO 43 CO 0.41 -3.41 0.00 0.43 0.04 0.00 0.00 177.00 174.47 2eoe n SER 44 N 14.00 0.12 -4.17 6.66 7.64 -1.26 -5.10 113.62 131.51 2eoe n SER 44 Ca 0.40 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 60.15 2eoe n SER 44 Cb 0.47 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.56 2eoe n SER 44 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2eoe s SER 45 N -4.96 1.36 0.00 6.43 0.01 -1.26 -5.33 113.70 109.95 2eoe s SER 45 Ca 0.00 -0.87 0.09 0.00 1.31 0.00 0.00 55.95 56.48 2eoe s SER 45 Cb 0.00 0.03 0.07 0.00 0.21 0.00 0.00 66.02 66.33 2eoe s SER 45 CO 0.00 -0.32 0.78 0.61 0.41 0.00 0.00 173.24 174.72