#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yso n SER 2 N 0.00 1.92 -4.54 1.61 7.64 -1.26 -4.89 113.62 114.10 2yso n SER 2 Ca 0.00 0.97 -0.41 0.00 1.01 0.00 0.00 58.87 60.44 2yso n SER 2 Cb 0.00 -1.47 -0.03 0.00 -1.01 0.00 0.00 64.21 61.70 2yso n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yso s SER 3 N -0.88 6.28 0.00 6.43 0.15 -1.26 -4.56 113.70 119.87 2yso s SER 3 Ca 0.69 -0.85 0.00 0.00 0.70 0.00 0.00 55.95 56.49 2yso s SER 3 Cb -0.46 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.30 2yso s SER 3 CO 0.52 -1.69 0.00 0.61 1.20 0.00 0.00 173.24 173.88 2yso n GLY 4 N 5.84 -1.47 3.54 9.45 0.00 -1.26 -5.17 105.19 116.12 2yso n GLY 4 Ca 0.12 0.54 -0.15 0.00 0.00 0.00 0.00 46.02 46.53 2yso n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yso s SER 5 N 2.00 -0.57 0.25 1.61 0.01 -1.26 -5.19 113.70 110.56 2yso s SER 5 Ca 0.00 0.64 -0.11 0.00 1.31 0.00 0.00 55.95 57.79 2yso s SER 5 Cb 0.00 0.49 -0.01 0.00 0.21 0.00 0.00 66.02 66.72 2yso s SER 5 CO 0.00 -0.51 0.46 -0.94 0.41 0.00 0.00 173.24 172.66 2yso s SER 6 N -1.11 0.01 0.00 2.44 1.04 -1.26 -5.07 113.70 109.76 2yso s SER 6 Ca -0.08 -1.02 0.00 0.00 0.48 0.00 0.00 55.95 55.34 2yso s SER 6 Cb -0.00 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.70 2yso s SER 6 CO 0.07 -1.14 0.00 0.61 0.98 0.00 0.00 173.24 173.76 2yso n GLY 7 N -0.39 0.84 3.13 7.32 0.00 -1.26 -5.04 105.19 109.78 2yso n GLY 7 Ca -0.01 -0.58 -0.53 0.00 0.00 0.00 0.00 46.02 44.90 2yso n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yso n SER 8 N 0.00 -0.04 -4.39 1.61 7.64 -1.26 -4.91 113.62 112.27 2yso n SER 8 Ca 0.00 1.04 -0.37 0.00 1.01 0.00 0.00 58.87 60.55 2yso n SER 8 Cb 0.00 -0.82 -0.13 0.00 -1.01 0.00 0.00 64.21 62.25 2yso n SER 8 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2yso s ARG 9 N -0.03 3.38 -0.21 1.43 0.52 -1.26 -4.97 118.95 117.80 2yso s ARG 9 Ca 0.81 -0.66 -0.17 0.00 -0.52 0.00 0.00 55.73 55.19 2yso s ARG 9 Cb -1.13 -3.33 -0.18 0.00 0.52 0.00 0.00 34.95 30.83 2yso s ARG 9 CO 0.51 -0.31 0.09 0.39 0.02 0.00 0.00 175.30 176.00 2yso n GLU 10 N 4.89 0.60 -0.32 3.54 1.02 -1.26 -4.38 120.64 124.73 2yso n GLU 10 Ca -0.16 0.44 0.04 0.00 -0.02 0.00 0.00 57.16 57.46 2yso n GLU 10 Cb 0.50 -1.67 0.11 0.00 -0.02 0.00 0.00 31.44 30.35 2yso n GLU 10 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2yso h LYS 11 N -0.79 -0.01 -5.53 3.49 1.79 -2.02 -3.41 116.57 110.08 2yso h LYS 11 Ca -0.45 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.50 2yso h LYS 11 Cb 1.51 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 32.02 2yso h LYS 11 CO -0.21 -0.00 -0.66 -1.12 -1.08 0.00 0.00 179.45 176.38 2yso s SER 12 N -5.26 2.92 -0.05 0.86 0.01 -1.26 -5.15 113.70 105.76 2yso s SER 12 Ca -0.15 -1.23 0.04 0.00 1.31 0.00 0.00 55.95 55.92 2yso s SER 12 Cb 0.24 -0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.28 2yso s SER 12 CO 0.76 -0.37 -0.17 -1.00 0.41 0.00 0.00 173.24 172.87 2yso s HIS 13 N -2.98 1.75 0.06 2.43 3.76 -1.26 -4.72 115.29 114.32 2yso s HIS 13 Ca 0.31 -0.55 0.02 0.00 -0.15 0.00 0.00 55.06 54.69 2yso s HIS 13 Cb 0.05 -1.19 -0.03 0.00 1.11 0.00 0.00 32.58 32.52 2yso s HIS 13 CO 0.13 -0.21 -0.08 -1.14 -0.85 0.00 0.00 174.74 172.60 2yso s GLN 14 N 0.18 0.61 0.04 1.40 0.74 -1.26 -2.65 119.66 118.72 2yso s GLN 14 Ca -0.07 -0.89 -0.01 0.00 0.05 0.00 0.00 55.36 54.43 2yso s GLN 14 Cb -0.13 -0.30 -0.04 0.00 1.10 0.00 0.00 33.01 33.64 2yso s GLN 14 CO 0.03 0.04 0.21 0.00 -0.55 0.00 0.00 175.29 175.03 2yso n ARG 16 N 0.50 0.65 -0.29 0.00 0.63 -1.26 -2.67 116.66 114.21 2yso n ARG 16 Ca -0.07 0.12 0.01 0.00 -0.92 0.00 0.00 57.85 56.99 2yso n ARG 16 Cb 0.52 -1.48 0.08 0.00 0.45 0.00 0.00 32.46 32.03 2yso n ARG 16 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2yso h GLU 17 N 0.00 -0.03 0.00 -0.14 4.39 -1.99 -3.24 114.58 113.58 2yso h GLU 17 Ca -0.53 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 58.90 2yso h GLU 17 Cb 1.87 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 30.48 2yso h GLU 17 CO -0.07 -0.02 -1.97 0.00 -1.16 0.00 0.00 179.01 175.79 2yso n GLY 19 N 2.33 0.82 3.05 0.00 0.00 -1.09 -5.11 105.19 105.19 2yso n GLY 19 Ca -0.32 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 2yso n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yso s GLU 20 N -1.67 0.41 0.09 1.61 2.02 -1.18 -4.95 118.70 115.03 2yso s GLU 20 Ca 0.00 -0.57 0.03 0.00 0.02 0.00 0.00 54.97 54.45 2yso s GLU 20 Cb 0.00 0.16 -0.04 0.00 0.10 0.00 0.00 34.13 34.35 2yso s GLU 20 CO 0.00 -0.09 0.12 0.42 0.02 0.00 0.00 175.26 175.73 2yso s ILE 21 N -1.63 4.74 0.27 -1.63 1.01 -1.26 -0.80 121.20 121.90 2yso s ILE 21 Ca -0.14 -0.72 0.10 0.00 0.00 0.00 0.00 60.65 59.90 2yso s ILE 21 Cb -0.08 -3.31 -0.05 0.00 0.01 0.00 0.00 42.46 39.03 2yso s ILE 21 CO -0.01 0.10 -0.17 -0.36 0.00 0.00 0.00 174.94 174.50 2yso s PHE 22 N -1.47 2.14 -0.22 3.97 0.40 -1.09 -5.01 117.98 116.70 2yso s PHE 22 Ca 0.31 -0.43 -0.20 0.00 -0.60 0.00 0.00 56.93 56.01 2yso s PHE 22 Cb -0.12 -0.98 -0.18 0.00 0.51 0.00 0.00 43.02 42.25 2yso s PHE 22 CO 0.24 0.59 0.11 1.19 0.70 0.00 0.00 175.22 178.06 2yso n PHE 23 N -0.57 0.85 -2.78 0.36 3.72 -1.26 -4.53 117.46 113.25 2yso n PHE 23 Ca -0.06 0.37 -0.22 0.00 -0.05 0.00 0.00 57.45 57.49 2yso n PHE 23 Cb 0.61 -1.08 0.08 0.00 -0.94 0.00 0.00 39.48 38.14 2yso n PHE 23 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2yso s GLN 24 N -2.39 2.04 -0.15 -1.08 -1.52 -1.26 -4.99 119.66 110.31 2yso s GLN 24 Ca -0.30 -1.28 -0.17 0.00 -1.95 0.00 0.00 55.36 51.65 2yso s GLN 24 Cb 0.07 -2.48 -0.24 0.00 -0.22 0.00 0.00 33.01 30.14 2yso s GLN 24 CO 0.57 -1.11 0.39 -0.92 -0.25 0.00 0.00 175.29 173.97 2yso h TYR 25 N -0.15 0.25 -0.79 0.91 3.20 -2.01 -3.37 116.97 115.01 2yso h TYR 25 Ca -0.35 -0.18 0.13 0.00 3.14 0.00 0.00 58.73 61.47 2yso h TYR 25 Cb 1.28 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 39.48 2yso h TYR 25 CO 0.11 1.55 0.52 0.28 -1.64 0.00 0.00 178.16 178.98 2yso h VAL 26 N -0.54 0.86 0.00 1.81 2.07 -1.99 0.25 116.25 118.71 2yso h VAL 26 Ca -0.33 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2yso h VAL 26 Cb 1.60 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 2yso h VAL 26 CO -0.05 0.11 0.00 -1.28 0.02 0.00 0.00 177.57 176.37 2yso h SER 27 N 0.59 0.00 0.00 0.57 0.87 -1.99 -1.84 113.55 111.75 2yso h SER 27 Ca 0.38 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.94 2yso h SER 27 Cb 0.65 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2yso h SER 27 CO -0.15 0.00 -0.23 -0.11 -0.53 0.00 0.00 176.83 175.82 2yso n LEU 28 N -2.89 0.71 -0.41 2.23 7.94 0.83 -2.81 117.00 122.59 2yso n LEU 28 Ca -0.02 0.36 0.40 0.00 -1.11 0.00 0.00 56.01 55.64 2yso n LEU 28 Cb 0.12 -0.64 0.77 0.00 0.53 0.00 0.00 43.42 44.20 2yso n LEU 28 CO 0.20 -0.48 1.36 -0.29 -1.11 0.00 0.00 177.39 177.07 2yso h ILE 29 N -0.39 0.31 0.11 1.96 2.10 -1.46 0.25 117.51 120.40 2yso h ILE 29 Ca 0.00 0.00 -0.20 0.00 1.08 0.00 0.00 64.86 65.74 2yso h ILE 29 Cb 0.23 0.31 0.01 0.00 -1.09 0.00 0.00 36.82 36.28 2yso h ILE 29 CO 0.00 0.00 -0.94 -0.33 -1.08 0.00 0.00 178.15 175.80 2yso h GLU 30 N 0.00 0.24 -0.55 2.19 4.39 -1.52 -3.36 114.58 115.97 2yso h GLU 30 Ca 0.65 -0.40 0.06 0.00 0.34 0.00 0.00 59.36 60.01 2yso h GLU 30 Cb 2.62 0.15 -0.05 0.00 -0.10 0.00 0.00 28.75 31.37 2yso h GLU 30 CO -0.01 1.19 0.26 1.25 -1.16 0.00 0.00 179.01 180.54 2yso h HIS 31 N -0.45 0.46 -0.95 4.33 -0.00 -0.41 -1.93 115.15 116.21 2yso h HIS 31 Ca -0.19 0.02 0.29 0.00 -0.00 0.00 0.00 60.37 60.49 2yso h HIS 31 Cb 1.60 -0.13 -0.15 0.00 -0.00 0.00 0.00 27.41 28.73 2yso h HIS 31 CO 0.18 0.20 0.38 1.96 -0.00 0.00 0.00 177.93 180.65 2yso h GLN 32 N 0.49 0.22 -0.60 5.26 4.20 -1.23 0.12 115.11 123.57 2yso h GLN 32 Ca 0.26 -0.01 0.12 0.00 0.06 0.00 0.00 58.65 59.07 2yso h GLN 32 Cb 0.21 -0.05 -0.12 0.00 0.30 0.00 0.00 27.48 27.83 2yso h GLN 32 CO -0.20 0.15 -0.20 0.28 -0.67 0.00 0.00 178.83 178.18 2yso h VAL 33 N 0.23 0.32 -0.76 -0.54 2.07 -1.50 -1.29 116.25 114.78 2yso h VAL 33 Ca 0.65 0.00 0.11 0.00 0.82 0.00 0.00 66.70 68.29 2yso h VAL 33 Cb 1.43 0.32 -0.13 0.00 -1.52 0.00 0.00 31.29 31.40 2yso h VAL 33 CO -0.66 0.00 -0.42 -0.07 0.02 0.00 0.00 177.57 176.44 2yso h LEU 34 N -0.05 -1.49 -0.12 2.57 3.38 -0.87 -0.02 115.31 118.70 2yso h LEU 34 Ca 0.28 0.27 0.04 0.00 0.09 0.00 0.00 57.88 58.56 2yso h LEU 34 Cb 0.49 0.72 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 2yso h LEU 34 CO -0.64 -0.30 -0.13 0.45 0.09 0.00 0.00 178.44 177.91 2yso h HIS 35 N -0.12 -0.32 -1.42 1.13 3.86 -1.33 -3.40 115.15 113.56 2yso h HIS 35 Ca 0.24 0.02 -0.60 0.00 -1.16 0.00 0.00 60.37 58.87 2yso h HIS 35 Cb 0.56 0.16 -0.01 0.00 1.06 0.00 0.00 27.41 29.17 2yso h HIS 35 CO -0.79 -0.19 1.50 -0.12 0.86 0.00 0.00 177.93 179.19 2yso n MET 36 N -5.27 1.32 -1.28 2.45 0.00 -0.02 -4.94 117.12 109.38 2yso n MET 36 Ca -0.03 0.31 -0.08 0.00 -0.00 0.00 0.00 57.70 57.90 2yso n MET 36 Cb 0.19 -2.83 0.04 0.00 0.00 0.00 0.00 33.22 30.62 2yso n MET 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2yso n GLY 37 N 6.20 0.62 3.39 -5.12 0.00 -1.26 -4.93 105.19 104.09 2yso n GLY 37 Ca 0.38 -1.97 -0.45 0.00 0.00 0.00 0.00 46.02 43.98 2yso n GLY 37 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yso s GLN 38 N -3.39 3.90 -0.21 1.61 1.11 -1.26 -5.00 119.66 116.42 2yso s GLN 38 Ca 0.24 -2.58 -0.03 0.00 0.01 0.00 0.00 55.36 53.00 2yso s GLN 38 Cb -0.01 -4.71 -0.00 0.00 -1.01 0.00 0.00 33.01 27.27 2yso s GLN 38 CO 0.16 -1.48 -0.07 0.21 0.01 0.00 0.00 175.29 174.12 2yso s LYS 39 N 0.57 3.32 0.07 2.91 2.36 -1.26 -5.08 119.74 122.63 2yso s LYS 39 Ca 0.31 -0.65 -0.31 0.00 -2.55 0.00 0.00 55.97 52.76 2yso s LYS 39 Cb -0.07 -2.95 -0.08 0.00 -1.05 0.00 0.00 37.83 33.68 2yso s LYS 39 CO -0.07 -0.20 1.67 0.54 1.55 0.00 0.00 175.35 178.85 2yso s ASN 40 N 1.45 6.59 0.47 1.43 4.22 -1.26 -5.00 114.94 122.84 2yso s ASN 40 Ca 0.06 2.50 0.08 0.00 -2.14 0.00 0.00 52.86 53.36 2yso s ASN 40 Cb -0.14 -2.56 0.03 0.00 1.28 0.00 0.00 41.25 39.86 2yso s ASN 40 CO -0.05 -0.90 0.60 -0.94 -2.04 0.00 0.00 177.10 173.77 2yso s SER 41 N 2.49 5.34 1.05 3.54 1.04 -1.26 -5.10 113.70 120.81 2yso s SER 41 Ca 0.75 -0.64 -0.11 0.00 0.48 0.00 0.00 55.95 56.42 2yso s SER 41 Cb -0.40 -0.30 0.22 0.00 0.10 0.00 0.00 66.02 65.63 2yso s SER 41 CO 0.33 -0.93 1.08 -0.83 0.98 0.00 0.00 173.24 173.87 2yso s GLY 42 N -4.40 1.61 0.36 7.32 0.00 -1.26 -4.96 107.32 105.99 2yso s GLY 42 Ca 0.55 0.21 -0.27 0.00 0.00 0.00 0.00 44.72 45.20 2yso s GLY 42 CO 0.33 0.79 1.21 2.56 0.00 0.00 0.00 173.10 177.99 2yso s PRO 43 N -4.55 4.23 0.21 2.90 0.04 -1.26 -5.05 135.00 131.52 2yso s PRO 43 Ca 0.68 1.97 0.11 0.00 0.04 0.00 0.00 61.00 63.79 2yso s PRO 43 Cb -0.24 -2.88 -0.05 0.00 0.04 0.00 0.00 34.50 31.38 2yso s PRO 43 CO 0.61 -0.21 -0.22 -1.12 0.04 0.00 0.00 177.00 176.10 2yso s SER 44 N -0.88 3.41 -0.54 6.66 0.01 -1.26 -5.10 113.70 116.01 2yso s SER 44 Ca 0.53 -0.91 -0.19 0.00 1.31 0.00 0.00 55.95 56.68 2yso s SER 44 Cb -0.34 -0.26 0.07 0.00 0.21 0.00 0.00 66.02 65.70 2yso s SER 44 CO 0.44 0.09 0.66 -0.55 0.41 0.00 0.00 173.24 174.29 2yso s SER 45 N -2.90 6.21 0.00 2.44 0.15 -1.26 -5.31 113.70 113.03 2yso s SER 45 Ca 0.23 -1.05 0.00 0.00 0.70 0.00 0.00 55.95 55.83 2yso s SER 45 Cb -0.07 -2.30 0.00 0.00 -1.71 0.00 0.00 66.02 61.94 2yso s SER 45 CO 0.11 -0.98 0.00 0.61 1.20 0.00 0.00 173.24 174.18