#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 -0.27 -1.23 1.61 0.15 -1.26 -3.99 113.70 108.71 2yso s SER 2 Ca 0.00 1.22 -0.07 0.00 0.70 0.00 0.00 55.95 57.81 2yso s SER 2 Cb 0.00 -1.84 0.01 0.00 -1.71 0.00 0.00 66.02 62.48 2yso s SER 2 CO 0.00 -4.93 1.07 -1.20 1.20 0.00 0.00 173.24 169.38 2yso n SER 3 N -5.38 -5.22 -3.21 5.45 7.64 -1.26 -4.99 113.62 106.64 2yso n SER 3 Ca 0.07 -0.52 -0.00 0.00 1.01 0.00 0.00 58.87 59.43 2yso n SER 3 Cb 0.57 -4.74 -0.03 0.00 -1.01 0.00 0.00 64.21 59.00 2yso n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yso s GLY 4 N -3.51 -0.87 -0.04 0.23 0.00 -1.26 -5.15 107.32 96.73 2yso s GLY 4 Ca 0.43 1.36 0.04 0.00 0.00 0.00 0.00 44.72 46.55 2yso s GLY 4 CO 0.68 3.23 -0.17 -0.56 0.00 0.00 0.00 173.10 176.28 2yso s SER 5 N 2.75 2.12 -0.02 1.64 0.01 -1.26 -5.02 113.70 113.92 2yso s SER 5 Ca 0.16 -0.35 -0.01 0.00 1.31 0.00 0.00 55.95 57.07 2yso s SER 5 Cb -0.14 -0.58 -0.01 0.00 0.21 0.00 0.00 66.02 65.51 2yso s SER 5 CO -0.21 0.15 -0.02 -1.20 0.41 0.00 0.00 173.24 172.37 2yso n SER 6 N 3.13 0.41 -4.67 2.44 7.64 -1.26 -5.08 113.62 116.23 2yso n SER 6 Ca -0.18 0.02 -0.23 0.00 1.01 0.00 0.00 58.87 59.49 2yso n SER 6 Cb 0.53 -0.05 -0.07 0.00 -1.01 0.00 0.00 64.21 63.61 2yso n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yso s GLY 7 N -4.97 1.74 -0.89 0.23 0.00 -1.26 -5.07 107.32 97.11 2yso s GLY 7 Ca -0.03 -1.71 -0.16 0.00 0.00 0.00 0.00 44.72 42.82 2yso s GLY 7 CO 0.03 -1.73 0.95 -0.45 0.00 0.00 0.00 173.10 171.90 2yso s SER 8 N -3.73 6.72 -1.69 1.64 0.15 -1.26 -4.53 113.70 111.00 2yso s SER 8 Ca 0.33 -2.41 -0.18 0.00 0.70 0.00 0.00 55.95 54.39 2yso s SER 8 Cb -0.05 -2.30 0.15 0.00 -1.71 0.00 0.00 66.02 62.11 2yso s SER 8 CO 0.21 -0.80 0.80 0.54 1.20 0.00 0.00 173.24 175.19 2yso n ARG 9 N 5.17 -3.37 -1.23 5.44 1.74 -1.26 -4.93 116.66 118.22 2yso n ARG 9 Ca 0.19 0.39 -0.30 0.00 -0.77 0.00 0.00 57.85 57.36 2yso n ARG 9 Cb 0.48 -5.12 0.24 0.00 -1.02 0.00 0.00 32.46 27.03 2yso n ARG 9 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2yso s GLU 10 N -6.90 -1.05 -0.84 5.56 2.02 -1.26 -5.00 118.70 111.24 2yso s GLU 10 Ca 0.72 -0.19 -0.03 0.00 0.02 0.00 0.00 54.97 55.49 2yso s GLU 10 Cb -0.39 -1.63 0.21 0.00 0.10 0.00 0.00 34.13 32.42 2yso s GLU 10 CO 0.92 -3.57 0.72 0.21 0.02 0.00 0.00 175.26 173.55 2yso s LYS 11 N -5.54 3.18 0.40 1.61 2.20 -1.26 -5.04 119.74 115.29 2yso s LYS 11 Ca 0.72 -3.04 0.04 0.00 -0.36 0.00 0.00 55.97 53.33 2yso s LYS 11 Cb -0.08 -3.97 -0.04 0.00 -1.51 0.00 0.00 37.83 32.23 2yso s LYS 11 CO 0.55 -1.24 0.06 -1.12 -0.36 0.00 0.00 175.35 173.24 2yso s SER 12 N 0.29 3.10 0.09 1.43 0.01 -1.26 -5.14 113.70 112.23 2yso s SER 12 Ca 0.24 -1.52 0.09 0.00 1.31 0.00 0.00 55.95 56.08 2yso s SER 12 Cb -0.11 0.16 -0.03 0.00 0.21 0.00 0.00 66.02 66.25 2yso s SER 12 CO -0.10 -0.72 -0.24 -1.00 0.41 0.00 0.00 173.24 171.59 2yso s HIS 13 N -3.09 2.04 0.01 2.43 3.76 -1.26 -5.11 115.29 114.07 2yso s HIS 13 Ca 0.26 -0.40 -0.03 0.00 -0.15 0.00 0.00 55.06 54.74 2yso s HIS 13 Cb 0.06 -1.15 -0.01 0.00 1.11 0.00 0.00 32.58 32.59 2yso s HIS 13 CO 0.13 0.21 0.05 -1.14 -0.85 0.00 0.00 174.74 173.14 2yso s GLN 14 N -1.68 0.35 0.25 1.40 0.74 -1.26 -3.55 119.66 115.91 2yso s GLN 14 Ca 0.10 -0.43 0.03 0.00 0.05 0.00 0.00 55.36 55.11 2yso s GLN 14 Cb -0.10 0.14 -0.03 0.00 1.10 0.00 0.00 33.01 34.12 2yso s GLN 14 CO 0.04 -0.07 0.39 0.00 -0.55 0.00 0.00 175.29 175.10 2yso n ARG 16 N -1.35 0.67 0.00 0.00 0.63 -1.26 -3.70 116.66 111.65 2yso n ARG 16 Ca -0.08 0.10 0.00 0.00 -0.92 0.00 0.00 57.85 56.95 2yso n ARG 16 Cb 0.56 -1.42 0.00 0.00 0.45 0.00 0.00 32.46 32.05 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 -3.03 0.00 -0.05 -0.14 -0.58 -1.26 -4.25 120.64 111.33 2yso n GLU 17 Ca -0.36 0.48 -0.22 0.00 -0.42 0.00 0.00 57.16 56.65 2yso n GLU 17 Cb 0.92 -1.29 -0.13 0.00 -0.57 0.00 0.00 31.44 30.37 2yso n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2yso n GLY 19 N 1.66 0.56 3.37 0.00 0.00 -1.24 -5.07 105.19 104.46 2yso n GLY 19 Ca -0.31 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.30 2yso n GLY 19 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yso s GLU 20 N 0.65 3.09 0.02 1.61 2.12 -1.26 -4.85 118.70 120.08 2yso s GLU 20 Ca 0.00 -0.73 -0.13 0.00 0.36 0.00 0.00 54.97 54.47 2yso s GLU 20 Cb 0.00 -2.50 -0.06 0.00 0.26 0.00 0.00 34.13 31.83 2yso s GLU 20 CO 0.00 0.31 0.40 0.42 -0.54 0.00 0.00 175.26 175.85 2yso s ILE 21 N 0.07 5.06 0.06 -3.70 1.01 -1.26 -3.29 121.20 119.14 2yso s ILE 21 Ca -0.06 0.73 0.04 0.00 0.00 0.00 0.00 60.65 61.35 2yso s ILE 21 Cb -0.15 -3.68 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 2yso s ILE 21 CO 0.05 0.51 -0.11 -0.36 0.00 0.00 0.00 174.94 175.03 2yso s PHE 22 N -1.16 0.93 -0.50 3.97 0.08 -1.23 -5.05 117.98 115.02 2yso s PHE 22 Ca 0.26 -0.48 0.02 0.00 0.12 0.00 0.00 56.93 56.85 2yso s PHE 22 Cb -0.16 -0.54 0.47 0.00 -0.57 0.00 0.00 43.02 42.22 2yso s PHE 22 CO 0.14 -0.02 1.70 1.19 -0.10 0.00 0.00 175.22 178.14 2yso n PHE 23 N 1.37 2.91 -3.65 0.36 3.72 -1.26 -4.20 117.46 116.70 2yso n PHE 23 Ca -0.22 -2.60 -0.07 0.00 -0.05 0.00 0.00 57.45 54.51 2yso n PHE 23 Cb 0.54 -0.98 -0.08 0.00 -0.94 0.00 0.00 39.48 38.02 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 -3.68 0.61 0.19 -1.08 -1.52 -1.26 -5.05 119.66 107.87 2yso s GLN 24 Ca 0.58 1.14 -0.12 0.00 -1.95 0.00 0.00 55.36 55.02 2yso s GLN 24 Cb 0.47 0.18 0.20 0.00 -0.22 0.00 0.00 33.01 33.63 2yso s GLN 24 CO 0.01 -0.16 1.75 -0.92 -0.25 0.00 0.00 175.29 175.72 2yso h TYR 25 N 7.17 0.35 -0.93 0.91 3.20 -2.00 -1.31 116.97 124.36 2yso h TYR 25 Ca -0.30 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.66 2yso h TYR 25 Cb 1.20 -0.08 -0.06 0.00 1.54 0.00 0.00 36.73 39.34 2yso h TYR 25 CO 0.11 0.11 0.60 0.28 -1.64 0.00 0.00 178.16 177.63 2yso h VAL 26 N 0.38 1.08 -0.19 1.81 2.07 -1.98 -0.46 116.25 118.96 2yso h VAL 26 Ca 0.26 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.44 2yso h VAL 26 Cb 0.28 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.94 2yso h VAL 26 CO -0.25 0.19 0.01 0.28 0.02 0.00 0.00 177.57 177.82 2yso h SER 27 N 1.07 -0.04 0.10 0.57 0.02 -1.66 -0.93 113.55 112.68 2yso h SER 27 Ca 0.40 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.38 2yso h SER 27 Cb 0.18 0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2yso h SER 27 CO -0.15 0.00 -0.05 0.25 -1.14 0.00 0.00 176.83 175.75 2yso h LEU 28 N 0.08 -0.11 -0.84 5.07 5.85 -1.15 0.25 115.31 124.46 2yso h LEU 28 Ca 0.09 0.00 0.21 0.00 0.84 0.00 0.00 57.88 59.02 2yso h LEU 28 Cb 0.10 0.03 -0.16 0.00 0.37 0.00 0.00 40.66 41.00 2yso h LEU 28 CO -0.14 -0.03 -0.05 0.00 -0.34 0.00 0.00 178.44 177.88 2yso n ILE 29 N -2.61 -0.35 0.07 4.05 3.06 -0.23 0.20 119.36 123.55 2yso n ILE 29 Ca -0.02 1.88 -0.11 0.00 -2.50 0.00 0.00 62.75 62.00 2yso n ILE 29 Cb 0.05 -2.70 -0.02 0.00 0.54 0.00 0.00 39.64 37.51 2yso n ILE 29 CO 0.00 0.00 0.00 -0.08 -2.50 0.00 0.00 176.55 173.97 2yso h GLU 30 N 0.00 0.31 -0.56 9.51 4.57 -1.24 -3.20 114.58 123.97 2yso h GLU 30 Ca 0.48 -0.33 0.03 0.00 -1.18 0.00 0.00 59.36 58.36 2yso h GLU 30 Cb 0.93 0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 29.58 2yso h GLU 30 CO -0.81 1.02 0.37 1.25 -1.18 0.00 0.00 179.01 179.66 2yso h HIS 31 N 0.18 0.63 -0.67 0.92 2.76 0.59 -1.28 115.15 118.29 2yso h HIS 31 Ca -0.06 0.02 0.18 0.00 -2.20 0.00 0.00 60.37 58.30 2yso h HIS 31 Cb 1.52 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 30.23 2yso h HIS 31 CO 0.04 0.37 0.47 1.96 -1.30 0.00 0.00 177.93 179.47 2yso h GLN 32 N 0.65 0.10 -0.76 5.26 4.20 -0.93 0.42 115.11 124.06 2yso h GLN 32 Ca 0.23 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 2yso h GLN 32 Cb 0.09 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 2yso h GLN 32 CO -0.06 0.07 0.42 0.28 -0.67 0.00 0.00 178.83 178.87 2yso h VAL 33 N 0.11 1.22 0.00 -0.54 2.07 -1.40 -1.12 116.25 116.60 2yso h VAL 33 Ca 0.32 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.29 2yso h VAL 33 Cb 1.12 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 2yso h VAL 33 CO -0.04 0.25 0.00 -0.07 0.02 0.00 0.00 177.57 177.73 2yso h LEU 34 N 1.05 0.00 -3.82 2.57 3.38 -1.03 -1.62 115.31 115.85 2yso h LEU 34 Ca 0.27 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.70 2yso h LEU 34 Cb 0.02 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 40.48 2yso h LEU 34 CO -0.04 0.00 0.25 1.41 0.09 0.00 0.00 178.44 180.14 2yso n HIS 35 N -2.76 2.70 -4.57 1.13 8.25 -0.42 -4.98 115.22 114.57 2yso n HIS 35 Ca -0.02 -2.41 -0.31 0.00 -0.26 0.00 0.00 57.72 54.73 2yso n HIS 35 Cb 0.10 -0.93 -0.12 0.00 1.12 0.00 0.00 29.99 30.16 2yso n HIS 35 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2yso s MET 36 N -3.59 2.09 0.00 -0.41 -1.94 -0.61 -5.06 119.30 109.77 2yso s MET 36 Ca 0.57 -0.98 0.00 0.00 -1.71 0.00 0.00 55.69 53.57 2yso s MET 36 Cb 0.46 -2.22 0.00 0.00 2.01 0.00 0.00 34.83 35.09 2yso s MET 36 CO 0.02 0.54 0.00 0.41 -0.01 0.00 0.00 175.02 175.98 2yso n GLY 37 N 1.41 5.50 3.73 -0.03 0.00 -1.26 -5.09 105.19 109.45 2yso n GLY 37 Ca -0.16 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 2yso n GLY 37 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2yso s GLN 38 N 1.84 4.65 -0.16 1.61 0.74 -1.26 -4.99 119.66 122.09 2yso s GLN 38 Ca 0.00 1.36 -0.29 0.00 0.05 0.00 0.00 55.36 56.48 2yso s GLN 38 Cb 0.00 -3.38 -0.04 0.00 1.10 0.00 0.00 33.01 30.69 2yso s GLN 38 CO 0.00 0.22 1.70 0.15 -0.55 0.00 0.00 175.29 176.81 2yso s LYS 39 N 0.01 3.85 0.03 1.67 -0.14 -1.26 -4.98 119.74 118.92 2yso s LYS 39 Ca 0.45 1.89 0.01 0.00 -1.36 0.00 0.00 55.97 56.96 2yso s LYS 39 Cb -0.23 -4.06 -0.02 0.00 -1.68 0.00 0.00 37.83 31.84 2yso s LYS 39 CO 0.28 -1.23 -0.05 -0.80 -0.76 0.00 0.00 175.35 172.79 2yso s ASN 40 N 4.39 0.55 -0.08 2.83 0.01 -1.26 -5.11 114.94 116.27 2yso s ASN 40 Ca 0.76 -0.45 -0.36 0.00 -0.71 0.00 0.00 52.86 52.09 2yso s ASN 40 Cb -0.29 0.05 -0.14 0.00 0.41 0.00 0.00 41.25 41.28 2yso s ASN 40 CO 0.31 -0.20 1.73 -1.20 -1.51 0.00 0.00 177.10 176.22 2yso n SER 41 N 1.76 2.89 0.00 -1.22 7.64 -1.26 -4.93 113.62 118.49 2yso n SER 41 Ca -0.22 1.04 0.00 0.00 1.01 0.00 0.00 58.87 60.70 2yso n SER 41 Cb 0.55 -1.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.46 2yso n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yso n GLY 42 N 3.96 5.70 3.55 0.23 0.00 -1.26 -5.07 105.19 112.30 2yso n GLY 42 Ca 0.22 -1.51 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 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 1.18 2.60 -0.82 1.61 0.04 -1.26 -4.89 135.00 133.46 2yso s PRO 43 Ca 0.00 0.24 -0.24 0.00 0.04 0.00 0.00 61.00 61.04 2yso s PRO 43 Cb 0.00 -4.67 -0.17 0.00 0.04 0.00 0.00 34.50 29.71 2yso s PRO 43 CO 0.00 -3.00 2.37 0.45 0.04 0.00 0.00 177.00 176.86 2yso n SER 44 N 13.25 1.41 -4.61 6.66 2.88 -1.26 -4.89 113.62 127.06 2yso n SER 44 Ca 0.28 -1.44 -0.29 0.00 -1.33 0.00 0.00 58.87 56.10 2yso n SER 44 Cb 0.50 -1.54 -0.09 0.00 -0.75 0.00 0.00 64.21 62.33 2yso n SER 44 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yso s SER 45 N 9.57 4.58 0.00 -3.46 0.01 -1.26 -5.34 113.70 117.80 2yso s SER 45 Ca 0.96 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.87 2yso s SER 45 Cb -0.21 -0.93 0.00 0.00 0.21 0.00 0.00 66.02 65.09 2yso s SER 45 CO 0.14 0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.56