#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 -0.56 0.26 1.61 1.04 -1.26 -5.04 113.70 109.75 2yso s SER 2 Ca 0.00 0.60 -0.09 0.00 0.48 0.00 0.00 55.95 56.94 2yso s SER 2 Cb 0.00 0.46 0.40 0.00 0.10 0.00 0.00 66.02 66.98 2yso s SER 2 CO 0.00 -0.52 1.49 -0.24 0.98 0.00 0.00 173.24 174.95 2yso n SER 3 N 0.83 -0.39 0.00 7.02 2.88 -1.26 -4.88 113.62 117.82 2yso n SER 3 Ca -0.16 1.65 0.00 0.00 -1.33 0.00 0.00 58.87 59.03 2yso n SER 3 Cb 0.57 -0.48 0.00 0.00 -0.75 0.00 0.00 64.21 63.56 2yso n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yso n GLY 4 N -1.57 -1.54 3.48 0.46 0.00 -1.26 -5.05 105.19 99.71 2yso n GLY 4 Ca 0.14 0.60 -0.43 0.00 0.00 0.00 0.00 46.02 46.33 2yso n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yso s SER 5 N -4.00 6.70 0.59 1.61 0.15 -1.26 -5.00 113.70 112.49 2yso s SER 5 Ca 0.00 -2.13 -0.03 0.00 0.70 0.00 0.00 55.95 54.49 2yso s SER 5 Cb 0.00 -2.44 0.03 0.00 -1.71 0.00 0.00 66.02 61.90 2yso s SER 5 CO 0.00 -1.09 0.86 -0.44 1.20 0.00 0.00 173.24 173.77 2yso s SER 6 N 3.77 5.28 0.00 5.45 0.01 -1.26 -5.08 113.70 121.88 2yso s SER 6 Ca 0.38 0.33 0.00 0.00 1.31 0.00 0.00 55.95 57.97 2yso s SER 6 Cb -0.03 -1.22 0.00 0.00 0.21 0.00 0.00 66.02 64.98 2yso s SER 6 CO -0.07 -1.20 0.00 0.61 0.41 0.00 0.00 173.24 172.99 2yso n GLY 7 N -2.54 4.73 3.15 3.44 0.00 -1.26 -5.15 105.19 107.56 2yso n GLY 7 Ca 0.06 -0.98 -0.23 0.00 0.00 0.00 0.00 46.02 44.87 2yso n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yso s SER 8 N 0.00 1.84 0.49 1.61 0.01 -1.26 -5.13 113.70 111.26 2yso s SER 8 Ca 0.00 -0.35 -0.22 0.00 1.31 0.00 0.00 55.95 56.70 2yso s SER 8 Cb 0.00 -0.18 -0.07 0.00 0.21 0.00 0.00 66.02 65.98 2yso s SER 8 CO 0.00 0.15 1.15 -0.13 0.41 0.00 0.00 173.24 174.82 2yso s ARG 9 N -0.63 3.64 0.19 12.44 3.00 -1.26 -5.05 118.95 131.27 2yso s ARG 9 Ca 0.05 1.71 0.06 0.00 0.00 0.00 0.00 55.73 57.55 2yso s ARG 9 Cb -0.07 -2.27 -0.05 0.00 0.00 0.00 0.00 34.95 32.57 2yso s ARG 9 CO 0.00 -0.64 -0.11 -2.00 0.00 0.00 0.00 175.30 172.56 2yso s GLU 10 N -2.90 1.24 -0.05 3.54 -6.30 -1.26 -5.15 118.70 107.82 2yso s GLU 10 Ca 0.67 -1.56 -0.02 0.00 -2.50 0.00 0.00 54.97 51.56 2yso s GLU 10 Cb -0.27 -0.87 0.03 0.00 0.00 0.00 0.00 34.13 33.03 2yso s GLU 10 CO 0.32 0.10 0.03 -1.59 0.02 0.00 0.00 175.26 174.14 2yso s LYS 11 N -3.72 0.21 0.52 4.30 -2.85 -1.26 -5.15 119.74 111.80 2yso s LYS 11 Ca 0.21 0.25 -0.13 0.00 -1.00 0.00 0.00 55.97 55.30 2yso s LYS 11 Cb 0.02 -0.68 -0.06 0.00 -2.06 0.00 0.00 37.83 35.04 2yso s LYS 11 CO 0.05 -0.30 0.95 -1.12 0.10 0.00 0.00 175.35 175.03 2yso s SER 12 N 2.00 6.48 -0.51 0.03 0.01 -1.26 -5.05 113.70 115.40 2yso s SER 12 Ca 0.04 1.42 0.03 0.00 1.31 0.00 0.00 55.95 58.75 2yso s SER 12 Cb -0.12 -2.45 0.15 0.00 0.21 0.00 0.00 66.02 63.81 2yso s SER 12 CO -0.04 -0.63 0.33 -1.00 0.41 0.00 0.00 173.24 172.31 2yso s HIS 13 N -2.74 2.33 0.68 2.43 3.76 -1.26 -5.11 115.29 115.38 2yso s HIS 13 Ca 0.56 -2.71 -0.11 0.00 -0.15 0.00 0.00 55.06 52.65 2yso s HIS 13 Cb -0.10 -1.98 -0.00 0.00 1.11 0.00 0.00 32.58 31.60 2yso s HIS 13 CO 0.38 -0.72 1.06 -1.14 -0.85 0.00 0.00 174.74 173.46 2yso s GLN 14 N -0.25 3.05 -0.92 1.40 0.74 -1.26 -4.09 119.66 118.33 2yso s GLN 14 Ca 0.23 0.85 -0.02 0.00 0.05 0.00 0.00 55.36 56.46 2yso s GLN 14 Cb -0.13 -2.01 0.23 0.00 1.10 0.00 0.00 33.01 32.20 2yso s GLN 14 CO -0.08 -0.99 0.87 0.00 -0.55 0.00 0.00 175.29 174.53 2yso h ARG 16 N 5.89 0.29 -0.73 0.00 0.11 -1.95 1.79 114.38 119.78 2yso h ARG 16 Ca 0.17 -0.02 0.23 0.00 0.10 0.00 0.00 59.98 60.47 2yso h ARG 16 Cb 0.79 -0.07 -0.13 0.00 1.11 0.00 0.00 29.97 31.67 2yso h ARG 16 CO 0.91 0.19 0.14 0.39 0.10 0.00 0.00 179.97 181.70 2yso n GLU 17 N -5.13 -0.05 0.00 0.08 -0.58 -1.26 -3.64 120.64 110.06 2yso n GLU 17 Ca 0.24 1.06 0.00 0.00 -0.42 0.00 0.00 57.16 58.04 2yso n GLU 17 Cb 0.74 -1.76 0.00 0.00 -0.57 0.00 0.00 31.44 29.85 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 2.27 0.47 3.08 0.00 0.00 0.59 -5.06 105.19 106.54 2yso n GLY 19 Ca 0.00 -0.69 -0.11 0.00 0.00 0.00 0.00 46.02 45.22 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 0.00 0.59 -0.02 1.61 2.56 -1.21 -4.90 118.70 117.33 2yso s GLU 20 Ca 0.00 -0.98 0.07 0.00 0.00 0.00 0.00 54.97 54.07 2yso s GLU 20 Cb 0.00 -0.11 -0.02 0.00 2.00 0.00 0.00 34.13 35.99 2yso s GLU 20 CO 0.00 -0.01 -0.24 0.42 -0.56 0.00 0.00 175.26 174.87 2yso s ILE 21 N -2.47 2.27 0.08 -3.70 1.01 -1.26 0.02 121.20 117.16 2yso s ILE 21 Ca -0.02 -1.06 0.06 0.00 0.00 0.00 0.00 60.65 59.64 2yso s ILE 21 Cb -0.03 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.60 2yso s ILE 21 CO -0.03 0.56 -0.16 -0.36 0.00 0.00 0.00 174.94 174.96 2yso s PHE 22 N -0.65 1.37 -0.08 3.97 0.40 -1.26 -5.05 117.98 116.67 2yso s PHE 22 Ca 0.11 -0.46 -0.10 0.00 -0.60 0.00 0.00 56.93 55.88 2yso s PHE 22 Cb -0.10 -0.76 -0.07 0.00 0.51 0.00 0.00 43.02 42.60 2yso s PHE 22 CO -0.00 0.10 0.36 0.74 0.70 0.00 0.00 175.22 177.12 2yso h PHE 23 N 4.15 -0.17 -3.19 0.36 0.04 -1.97 -3.42 116.94 112.73 2yso h PHE 23 Ca -0.42 -0.00 -0.58 0.00 2.80 0.00 0.00 57.97 59.77 2yso h PHE 23 Cb 1.19 0.06 -0.04 0.00 2.20 0.00 0.00 35.95 39.35 2yso h PHE 23 CO 0.63 0.03 -0.12 -1.14 -0.60 0.00 0.00 178.31 177.10 2yso s GLN 24 N -2.37 3.99 0.44 1.51 0.74 -1.26 -4.98 119.66 117.73 2yso s GLN 24 Ca -0.06 0.49 0.10 0.00 0.05 0.00 0.00 55.36 55.94 2yso s GLN 24 Cb 0.00 -3.09 0.96 0.00 1.10 0.00 0.00 33.01 31.98 2yso s GLN 24 CO 0.19 0.59 2.07 -0.92 -0.55 0.00 0.00 175.29 176.67 2yso h TYR 25 N 4.12 0.34 0.00 1.67 3.20 -1.99 -0.45 116.97 123.86 2yso h TYR 25 Ca -0.50 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.37 2yso h TYR 25 Cb 1.21 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.36 2yso h TYR 25 CO 0.68 0.24 -0.01 0.28 -1.64 0.00 0.00 178.16 177.71 2yso h VAL 26 N 0.36 0.02 0.00 1.81 2.07 -2.00 -1.95 116.25 116.57 2yso h VAL 26 Ca 0.10 -0.37 -0.09 0.00 0.82 0.00 0.00 66.70 67.16 2yso h VAL 26 Cb 0.01 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2yso h VAL 26 CO -0.02 0.01 -0.41 0.28 0.02 0.00 0.00 177.57 177.45 2yso h SER 27 N 0.00 0.00 0.00 0.57 0.02 -1.47 -3.20 113.55 109.47 2yso h SER 27 Ca -0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 2yso h SER 27 Cb 0.36 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 2yso h SER 27 CO 0.00 0.41 -0.63 0.25 -1.14 0.00 0.00 176.83 175.72 2yso h LEU 28 N 0.00 0.00 -0.97 5.07 5.85 -1.37 -3.10 115.31 120.79 2yso h LEU 28 Ca -0.00 -0.20 0.30 0.00 0.84 0.00 0.00 57.88 58.81 2yso h LEU 28 Cb 1.28 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 42.16 2yso h LEU 28 CO 0.05 0.94 0.45 -0.29 -0.34 0.00 0.00 178.44 179.26 2yso h ILE 29 N -1.00 0.28 -0.13 4.05 2.10 -1.54 0.25 117.51 121.53 2yso h ILE 29 Ca -0.10 -0.09 -0.11 0.00 1.08 0.00 0.00 64.86 65.64 2yso h ILE 29 Cb 0.70 -0.01 0.00 0.00 -1.09 0.00 0.00 36.82 36.42 2yso h ILE 29 CO -0.06 0.05 -0.37 -0.33 -1.08 0.00 0.00 178.15 176.36 2yso h GLU 30 N 0.27 0.47 -0.87 2.19 4.39 -1.73 -3.22 114.58 116.08 2yso h GLU 30 Ca 0.68 -0.34 0.11 0.00 0.34 0.00 0.00 59.36 60.15 2yso h GLU 30 Cb 1.52 0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 30.15 2yso h GLU 30 CO -0.64 0.96 0.50 1.25 -1.16 0.00 0.00 179.01 179.92 2yso h HIS 31 N 0.07 0.91 -0.96 4.33 2.76 -0.51 -2.12 115.15 119.64 2yso h HIS 31 Ca -0.01 0.03 0.26 0.00 -2.20 0.00 0.00 60.37 58.45 2yso h HIS 31 Cb 0.98 -0.28 -0.18 0.00 1.55 0.00 0.00 27.41 29.49 2yso h HIS 31 CO 0.11 0.35 0.01 1.04 -1.30 0.00 0.00 177.93 178.14 2yso n GLN 32 N -4.73 -0.08 -0.28 5.26 6.02 -0.09 0.29 117.38 123.78 2yso n GLN 32 Ca 0.15 1.44 0.17 0.00 -0.01 0.00 0.00 57.00 58.75 2yso n GLN 32 Cb 0.31 -2.28 0.33 0.00 1.02 0.00 0.00 30.24 29.63 2yso n GLN 32 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2yso n VAL 33 N -5.43 -0.35 -0.33 5.09 0.31 -0.80 0.65 118.33 117.48 2yso n VAL 33 Ca 0.22 1.78 0.06 0.00 -0.01 0.00 0.00 64.34 66.39 2yso n VAL 33 Cb 0.73 -2.70 0.14 0.00 -0.91 0.00 0.00 33.84 31.10 2yso n VAL 33 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2yso h LEU 34 N 0.00 -0.80 -2.77 7.52 3.38 -0.36 1.35 115.31 123.63 2yso h LEU 34 Ca 0.58 0.27 -0.15 0.00 0.09 0.00 0.00 57.88 58.67 2yso h LEU 34 Cb 1.34 0.55 -0.08 0.00 0.09 0.00 0.00 40.66 42.56 2yso h LEU 34 CO -0.73 -0.30 0.19 1.41 0.09 0.00 0.00 178.44 179.09 2yso n HIS 35 N -5.57 0.80 -3.60 1.13 8.25 0.21 -4.69 115.22 111.75 2yso n HIS 35 Ca 0.15 -1.08 -0.23 0.00 -0.26 0.00 0.00 57.72 56.31 2yso n HIS 35 Cb 0.49 -0.54 -0.16 0.00 1.12 0.00 0.00 29.99 30.91 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 -0.89 0.07 0.00 -0.41 -1.94 0.46 -5.11 119.30 111.48 2yso s MET 36 Ca 0.15 0.11 0.00 0.00 -1.71 0.00 0.00 55.69 54.24 2yso s MET 36 Cb 0.12 -1.36 0.00 0.00 2.01 0.00 0.00 34.83 35.61 2yso s MET 36 CO 0.02 -0.58 0.00 0.41 -0.01 0.00 0.00 175.02 174.85 2yso n GLY 37 N 5.30 4.14 3.31 -0.03 0.00 -1.26 -4.93 105.19 111.72 2yso n GLY 37 Ca -0.06 -0.32 -0.45 0.00 0.00 0.00 0.00 46.02 45.19 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 4.75 3.86 -0.00 1.61 -1.52 -1.26 -4.72 119.66 122.37 2yso s GLN 38 Ca 0.00 -2.94 -0.02 0.00 -1.95 0.00 0.00 55.36 50.45 2yso s GLN 38 Cb 0.00 -4.43 -0.01 0.00 -0.22 0.00 0.00 33.01 28.35 2yso s GLN 38 CO 0.00 -1.26 -0.04 1.17 -0.25 0.00 0.00 175.29 174.91 2yso n LYS 39 N 3.14 0.07 -3.15 2.91 4.81 -1.26 -5.01 118.16 119.67 2yso n LYS 39 Ca 0.20 0.03 -0.40 0.00 -0.87 0.00 0.00 58.31 57.27 2yso n LYS 39 Cb 0.42 -0.62 -0.06 0.00 0.02 0.00 0.00 35.03 34.79 2yso n LYS 39 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2yso s ASN 40 N -5.54 6.71 -1.05 3.14 2.20 -1.26 -5.01 114.94 114.13 2yso s ASN 40 Ca -0.04 0.86 -0.15 0.00 -0.94 0.00 0.00 52.86 52.59 2yso s ASN 40 Cb 0.01 -2.34 0.18 0.00 -2.00 0.00 0.00 41.25 37.10 2yso s ASN 40 CO 0.06 -0.20 1.20 -0.44 -2.94 0.00 0.00 177.10 174.77 2yso s SER 41 N 1.05 6.93 0.00 3.54 0.01 -1.26 -4.82 113.70 119.15 2yso s SER 41 Ca 0.29 -2.74 0.00 0.00 1.31 0.00 0.00 55.95 54.80 2yso s SER 41 Cb -0.16 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2yso s SER 41 CO 0.11 -0.75 0.00 0.61 0.41 0.00 0.00 173.24 173.62 2yso n GLY 42 N 4.32 0.55 0.00 3.44 0.00 -1.26 -4.84 105.19 107.41 2yso n GLY 42 Ca 0.28 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.37 2yso n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2yso n PRO 43 N 0.00 0.28 -1.10 1.61 -0.04 -1.26 -4.83 135.00 129.65 2yso n PRO 43 Ca 0.00 0.11 -0.31 0.00 -0.04 0.00 0.00 63.50 63.26 2yso n PRO 43 Cb 0.00 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 31.85 2yso n PRO 43 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2yso n SER 44 N -1.22 0.24 -4.18 3.54 3.41 -1.26 -4.85 113.62 109.30 2yso n SER 44 Ca 0.08 0.16 -0.11 0.00 -0.26 0.00 0.00 58.87 58.74 2yso n SER 44 Cb 0.10 -0.68 -0.10 0.00 -0.26 0.00 0.00 64.21 63.27 2yso n SER 44 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2yso s SER 45 N 6.54 0.98 0.00 4.04 1.04 -1.26 -5.16 113.70 119.88 2yso s SER 45 Ca 1.00 -1.09 0.05 0.00 0.48 0.00 0.00 55.95 56.39 2yso s SER 45 Cb -0.95 0.14 0.04 0.00 0.10 0.00 0.00 66.02 65.35 2yso s SER 45 CO 0.37 -0.55 0.65 0.61 0.98 0.00 0.00 173.24 175.31