#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yso s SER 2 N 0.00 6.85 -0.29 1.61 0.01 -1.26 -4.97 113.70 115.65 2yso s SER 2 Ca 0.00 0.90 -0.17 0.00 1.31 0.00 0.00 55.95 57.99 2yso s SER 2 Cb 0.00 -2.53 0.17 0.00 0.21 0.00 0.00 66.02 63.87 2yso s SER 2 CO 0.00 -0.93 1.12 -0.94 0.41 0.00 0.00 173.24 172.90 2yso s SER 3 N 1.80 -0.30 -0.28 2.44 1.04 -1.26 -5.11 113.70 112.03 2yso s SER 3 Ca 0.45 0.49 -0.34 0.00 0.48 0.00 0.00 55.95 57.03 2yso s SER 3 Cb -0.11 1.03 -0.10 0.00 0.10 0.00 0.00 66.02 66.94 2yso s SER 3 CO 0.18 -0.08 2.14 0.61 0.98 0.00 0.00 173.24 177.07 2yso n GLY 4 N 3.21 0.77 0.20 7.32 0.00 -1.26 -4.84 105.19 110.59 2yso n GLY 4 Ca -0.17 0.89 -0.03 0.00 0.00 0.00 0.00 46.02 46.71 2yso n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2yso h SER 5 N 12.43 0.15 -3.77 1.61 0.87 -1.99 -3.36 113.55 119.49 2yso h SER 5 Ca -0.34 0.06 -0.68 0.00 -1.23 0.00 0.00 61.79 59.60 2yso h SER 5 Cb 1.29 0.05 -0.34 0.00 -0.44 0.00 0.00 62.40 62.97 2yso h SER 5 CO 0.99 0.12 -0.71 -0.55 -0.53 0.00 0.00 176.83 176.15 2yso s SER 6 N -5.38 4.84 0.00 6.23 0.15 -1.26 -4.81 113.70 113.47 2yso s SER 6 Ca -0.13 -1.37 0.00 0.00 0.70 0.00 0.00 55.95 55.15 2yso s SER 6 Cb 0.15 -1.69 0.00 0.00 -1.71 0.00 0.00 66.02 62.77 2yso s SER 6 CO 0.73 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 175.51 2yso n GLY 7 N 4.58 -0.01 3.93 9.45 0.00 -1.26 -5.09 105.19 116.79 2yso n GLY 7 Ca -0.12 -0.37 -0.25 0.00 0.00 0.00 0.00 46.02 45.29 2yso n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yso s SER 8 N -1.08 6.27 -0.64 1.61 0.15 -1.26 -4.79 113.70 113.97 2yso s SER 8 Ca 0.00 0.56 -0.35 0.00 0.70 0.00 0.00 55.95 56.86 2yso s SER 8 Cb 0.00 -2.07 -0.17 0.00 -1.71 0.00 0.00 66.02 62.07 2yso s SER 8 CO 0.00 -0.37 2.38 0.54 1.20 0.00 0.00 173.24 176.99 2yso n ARG 9 N -1.91 0.39 -2.07 5.44 1.74 -1.26 -4.90 116.66 114.09 2yso n ARG 9 Ca -0.03 0.07 -0.28 0.00 -0.77 0.00 0.00 57.85 56.84 2yso n ARG 9 Cb 0.56 -1.97 0.18 0.00 -1.02 0.00 0.00 32.46 30.21 2yso n ARG 9 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2yso n GLU 10 N 8.20 -0.99 -1.79 5.56 -0.58 -1.26 -5.01 120.64 124.78 2yso n GLU 10 Ca 0.53 -2.23 -0.28 0.00 -0.42 0.00 0.00 57.16 54.77 2yso n GLU 10 Cb 0.12 -1.18 0.04 0.00 -0.57 0.00 0.00 31.44 29.85 2yso n GLU 10 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2yso n LYS 11 N -3.56 3.29 -3.72 3.49 4.76 -1.26 -5.03 118.16 116.14 2yso n LYS 11 Ca 0.17 -3.87 -0.21 0.00 -2.87 0.00 0.00 58.31 51.52 2yso n LYS 11 Cb 0.58 -2.28 -0.01 0.00 -1.84 0.00 0.00 35.03 31.47 2yso n LYS 11 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2yso s SER 12 N -2.97 6.23 -0.20 4.39 0.01 -1.26 -5.11 113.70 114.80 2yso s SER 12 Ca 0.56 0.11 -0.01 0.00 1.31 0.00 0.00 55.95 57.92 2yso s SER 12 Cb 0.44 -1.77 0.05 0.00 0.21 0.00 0.00 66.02 64.96 2yso s SER 12 CO 0.01 -0.21 -0.03 -1.00 0.41 0.00 0.00 173.24 172.43 2yso s HIS 13 N -2.11 1.75 -0.01 2.43 3.76 -1.26 -5.13 115.29 114.72 2yso s HIS 13 Ca 0.38 -1.25 -0.00 0.00 -0.15 0.00 0.00 55.06 54.04 2yso s HIS 13 Cb -0.09 -1.32 -0.04 0.00 1.11 0.00 0.00 32.58 32.24 2yso s HIS 13 CO 0.31 -0.67 0.05 -1.14 -0.85 0.00 0.00 174.74 172.45 2yso s GLN 14 N 1.61 2.99 -0.11 1.40 0.74 -1.26 -3.53 119.66 121.50 2yso s GLN 14 Ca -0.02 -0.50 -0.27 0.00 0.05 0.00 0.00 55.36 54.62 2yso s GLN 14 Cb -0.17 -2.81 -0.02 0.00 1.10 0.00 0.00 33.01 31.11 2yso s GLN 14 CO -0.07 0.65 0.87 0.00 -0.55 0.00 0.00 175.29 176.19 2yso n ARG 16 N 4.70 2.46 0.00 0.00 0.63 -1.26 -3.28 116.66 119.90 2yso n ARG 16 Ca 0.05 -3.07 0.00 0.00 -0.92 0.00 0.00 57.85 53.91 2yso n ARG 16 Cb 0.50 -2.20 0.00 0.00 0.45 0.00 0.00 32.46 31.20 2yso n ARG 16 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2yso n GLU 17 N -0.94 0.00 -0.00 -0.14 4.71 -1.26 -4.96 120.64 118.04 2yso n GLU 17 Ca 0.60 0.00 -0.01 0.00 -0.01 0.00 0.00 57.16 57.74 2yso n GLU 17 Cb 1.06 -0.72 -0.00 0.00 -1.01 0.00 0.00 31.44 30.77 2yso n GLU 17 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2yso n GLY 19 N 3.10 0.67 3.26 0.00 0.00 -1.21 -5.11 105.19 105.91 2yso n GLY 19 Ca -0.02 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.09 1.12 0.04 1.61 0.41 -1.26 -4.96 118.70 115.56 2yso s GLU 20 Ca 0.00 -1.51 0.05 0.00 -0.41 0.00 0.00 54.97 53.10 2yso s GLU 20 Cb 0.00 -0.53 -0.02 0.00 -1.78 0.00 0.00 34.13 31.79 2yso s GLU 20 CO 0.00 -0.01 -0.14 0.42 -0.49 0.00 0.00 175.26 175.05 2yso s ILE 21 N -3.42 1.08 0.38 -1.63 1.01 -1.26 -0.86 121.20 116.50 2yso s ILE 21 Ca 0.20 -0.98 0.04 0.00 0.00 0.00 0.00 60.65 59.91 2yso s ILE 21 Cb 0.04 -0.98 -0.06 0.00 0.01 0.00 0.00 42.46 41.47 2yso s ILE 21 CO 0.03 -0.01 0.04 -0.36 0.00 0.00 0.00 174.94 174.65 2yso s PHE 22 N -0.85 2.11 -0.22 3.97 0.40 -1.23 -5.06 117.98 117.09 2yso s PHE 22 Ca 0.01 -0.91 -0.06 0.00 -0.60 0.00 0.00 56.93 55.38 2yso s PHE 22 Cb -0.08 -1.47 -0.12 0.00 0.51 0.00 0.00 43.02 41.87 2yso s PHE 22 CO 0.01 0.14 -0.25 1.19 0.70 0.00 0.00 175.22 177.01 2yso n PHE 23 N -0.87 0.00 -2.59 0.36 3.72 -1.26 -4.55 117.46 112.26 2yso n PHE 23 Ca -0.06 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.11 2yso n PHE 23 Cb 0.67 -0.82 0.09 0.00 -0.94 0.00 0.00 39.48 38.47 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 -2.42 1.94 -0.19 -1.08 -1.52 -1.26 -5.00 119.66 110.13 2yso s GLN 24 Ca -0.31 -1.00 -0.22 0.00 -1.95 0.00 0.00 55.36 51.88 2yso s GLN 24 Cb 0.10 -2.37 -0.21 0.00 -0.22 0.00 0.00 33.01 30.31 2yso s GLN 24 CO 0.44 -1.24 0.34 -0.92 -0.25 0.00 0.00 175.29 173.67 2yso h TYR 25 N -0.36 0.04 -0.03 0.91 3.20 -2.01 -3.35 116.97 115.38 2yso h TYR 25 Ca -0.38 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.47 2yso h TYR 25 Cb 1.28 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.54 2yso h TYR 25 CO -0.01 1.42 0.03 0.28 -1.64 0.00 0.00 178.16 178.23 2yso h VAL 26 N -0.92 0.78 -0.17 1.81 2.07 -1.99 -0.92 116.25 116.91 2yso h VAL 26 Ca -0.29 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 2yso h VAL 26 Cb 1.30 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 2yso h VAL 26 CO -0.15 0.00 -0.23 0.77 0.02 0.00 0.00 177.57 177.98 2yso h SER 27 N 0.00 0.29 0.00 0.57 4.64 -1.99 -2.89 113.55 114.18 2yso h SER 27 Ca 0.02 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2yso h SER 27 Cb 0.07 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2yso h SER 27 CO -0.00 0.53 -0.01 0.25 -0.87 0.00 0.00 176.83 176.73 2yso h LEU 28 N 0.27 0.00 -0.92 5.97 5.85 -1.31 -3.19 115.31 121.97 2yso h LEU 28 Ca 0.04 0.00 0.33 0.00 0.84 0.00 0.00 57.88 59.10 2yso h LEU 28 Cb 0.56 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 41.48 2yso h LEU 28 CO 0.04 0.06 0.57 0.00 -0.34 0.00 0.00 178.44 178.76 2yso n ILE 29 N -2.33 -0.21 0.10 4.05 3.06 -0.90 0.15 119.36 123.28 2yso n ILE 29 Ca -0.00 1.34 -0.13 0.00 -2.50 0.00 0.00 62.75 61.46 2yso n ILE 29 Cb 0.01 -2.19 -0.08 0.00 0.54 0.00 0.00 39.64 37.91 2yso n ILE 29 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 2yso h GLU 30 N 0.00 -0.26 -0.79 9.51 5.08 -1.65 -3.20 114.58 123.27 2yso h GLU 30 Ca 0.63 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 59.07 2yso h GLU 30 Cb 1.92 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 31.17 2yso h GLU 30 CO -0.39 0.09 0.47 1.25 -1.00 0.00 0.00 179.01 179.42 2yso h HIS 31 N -0.65 0.86 -0.93 4.33 2.76 0.14 -2.10 115.15 119.57 2yso h HIS 31 Ca -0.03 0.03 0.27 0.00 -2.20 0.00 0.00 60.37 58.44 2yso h HIS 31 Cb 0.47 -0.27 -0.15 0.00 1.55 0.00 0.00 27.41 29.00 2yso h HIS 31 CO 0.04 0.42 0.29 1.96 -1.30 0.00 0.00 177.93 179.34 2yso h GLN 32 N 0.85 0.17 -1.11 5.26 4.20 -1.14 0.34 115.11 123.67 2yso h GLN 32 Ca 0.35 -0.01 0.41 0.00 0.06 0.00 0.00 58.65 59.46 2yso h GLN 32 Cb 0.20 -0.04 -0.16 0.00 0.30 0.00 0.00 27.48 27.78 2yso h GLN 32 CO -0.18 0.11 0.65 0.28 -0.67 0.00 0.00 178.83 179.02 2yso h VAL 33 N 0.17 0.08 -0.84 -0.54 2.07 -1.42 0.89 116.25 116.67 2yso h VAL 33 Ca 0.62 -0.03 0.12 0.00 0.82 0.00 0.00 66.70 68.23 2yso h VAL 33 Cb 1.34 -0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 31.02 2yso h VAL 33 CO -0.70 0.01 0.46 -0.07 0.02 0.00 0.00 177.57 177.29 2yso h LEU 34 N 0.08 0.60 -3.05 2.57 3.38 -0.49 0.14 115.31 118.54 2yso h LEU 34 Ca 0.83 0.07 -0.23 0.00 0.09 0.00 0.00 57.88 58.63 2yso h LEU 34 Cb 2.29 -0.04 -0.14 0.00 0.09 0.00 0.00 40.66 42.86 2yso h LEU 34 CO -0.63 0.31 0.30 1.41 0.09 0.00 0.00 178.44 179.91 2yso n HIS 35 N -4.80 1.73 -2.31 1.13 8.25 0.31 -4.25 115.22 115.27 2yso n HIS 35 Ca 0.15 -1.09 -0.24 0.00 -0.26 0.00 0.00 57.72 56.28 2yso n HIS 35 Cb 0.35 -0.59 0.01 0.00 1.12 0.00 0.00 29.99 30.88 2yso n HIS 35 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2yso n MET 36 N -0.27 3.34 -1.24 -0.41 2.81 0.50 -5.08 117.12 116.76 2yso n MET 36 Ca 0.31 -4.27 0.00 0.00 -1.81 0.00 0.00 57.70 51.94 2yso n MET 36 Cb 1.12 -2.19 0.00 0.00 -0.71 0.00 0.00 33.22 31.44 2yso n MET 36 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2yso n GLY 37 N -0.56 -3.83 3.62 3.03 0.00 -1.26 -4.69 105.19 101.50 2yso n GLY 37 Ca 0.38 -0.94 -0.53 0.00 0.00 0.00 0.00 46.02 44.93 2yso n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yso n GLN 38 N -2.32 1.34 -1.03 1.61 10.64 -1.26 -4.83 117.38 121.54 2yso n GLN 38 Ca 0.00 0.46 -0.33 0.00 -1.83 0.00 0.00 57.00 55.30 2yso n GLN 38 Cb 0.37 -2.33 0.01 0.00 -0.86 0.00 0.00 30.24 27.43 2yso n GLN 38 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 2yso n LYS 39 N 6.60 0.00 -1.88 2.61 0.00 -1.26 -4.74 118.16 119.49 2yso n LYS 39 Ca 0.31 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 58.20 2yso n LYS 39 Cb 0.19 -0.85 -0.03 0.00 -0.00 0.00 0.00 35.03 34.35 2yso n LYS 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2yso s ASN 40 N -0.85 6.56 0.24 -5.58 2.20 -1.26 -5.00 114.94 111.26 2yso s ASN 40 Ca 0.46 2.53 0.10 0.00 -0.94 0.00 0.00 52.86 55.01 2yso s ASN 40 Cb -0.38 -2.56 -0.04 0.00 -2.00 0.00 0.00 41.25 36.26 2yso s ASN 40 CO 0.58 -0.92 -0.10 -0.55 -2.94 0.00 0.00 177.10 173.17 2yso s SER 41 N 2.68 4.13 0.00 3.54 0.15 -1.26 -5.10 113.70 117.84 2yso s SER 41 Ca 0.76 -0.75 0.00 0.00 0.70 0.00 0.00 55.95 56.67 2yso s SER 41 Cb -0.41 -0.62 0.00 0.00 -1.71 0.00 0.00 66.02 63.28 2yso s SER 41 CO 0.33 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.43 2yso n GLY 42 N -0.48 0.99 3.70 9.45 0.00 -1.26 -5.13 105.19 112.47 2yso n GLY 42 Ca -0.08 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 2yso n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yso s PRO 43 N 0.47 0.95 0.10 1.61 0.04 -1.26 -4.97 135.00 131.94 2yso s PRO 43 Ca 0.00 0.71 -0.17 0.00 0.04 0.00 0.00 61.00 61.58 2yso s PRO 43 Cb 0.00 -1.78 -0.05 0.00 0.04 0.00 0.00 34.50 32.71 2yso s PRO 43 CO 0.00 -2.42 1.55 1.03 0.04 0.00 0.00 177.00 177.19 2yso h SER 44 N -1.68 0.56 -0.57 6.66 0.87 -2.07 -3.12 113.55 114.21 2yso h SER 44 Ca -0.51 -0.30 0.11 0.00 -1.23 0.00 0.00 61.79 59.86 2yso h SER 44 Cb 1.30 -0.15 -0.11 0.00 -0.44 0.00 0.00 62.40 63.00 2yso h SER 44 CO 0.56 0.73 -0.16 0.28 -0.53 0.00 0.00 176.83 177.71 2yso h SER 45 N 0.38 -0.57 0.00 6.23 0.02 -2.06 -3.55 113.55 113.99 2yso h SER 45 Ca 0.09 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2yso h SER 45 Cb 0.44 0.37 0.00 0.00 0.14 0.00 0.00 62.40 63.35 2yso h SER 45 CO 0.02 -0.20 0.00 0.61 -1.14 0.00 0.00 176.83 176.12