#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yth s SER 2 N 0.00 0.49 0.01 1.61 1.04 -1.26 -5.15 113.70 110.44 2yth s SER 2 Ca 0.00 0.48 0.05 0.00 0.48 0.00 0.00 55.95 56.96 2yth s SER 2 Cb 0.00 0.50 -0.02 0.00 0.10 0.00 0.00 66.02 66.60 2yth s SER 2 CO 0.00 -0.24 -0.15 -0.44 0.98 0.00 0.00 173.24 173.39 2yth s SER 3 N 2.30 1.77 0.00 7.02 0.01 -1.26 -5.12 113.70 118.41 2yth s SER 3 Ca 0.01 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 56.92 2yth s SER 3 Cb -0.12 -0.16 0.00 0.00 0.21 0.00 0.00 66.02 65.95 2yth s SER 3 CO -0.07 0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.31 2yth n GLY 4 N 2.34 -2.10 3.67 3.44 0.00 -1.26 -5.13 105.19 106.16 2yth n GLY 4 Ca -0.16 -1.24 -0.41 0.00 0.00 0.00 0.00 46.02 44.21 2yth n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yth n SER 5 N 2.68 2.00 -3.58 1.61 2.88 -1.26 -5.01 113.62 112.94 2yth n SER 5 Ca 0.00 1.04 -0.17 0.00 -1.33 0.00 0.00 58.87 58.42 2yth n SER 5 Cb 0.00 -1.45 -0.07 0.00 -0.75 0.00 0.00 64.21 61.94 2yth n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2yth s SER 6 N -0.70 -0.53 0.00 -3.46 1.04 -1.26 -5.07 113.70 103.72 2yth s SER 6 Ca 0.64 0.52 0.00 0.00 0.48 0.00 0.00 55.95 57.59 2yth s SER 6 Cb -0.50 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.10 2yth s SER 6 CO 0.56 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.80 2yth n GLY 7 N 0.95 -0.43 3.67 7.32 0.00 -1.26 -5.05 105.19 110.39 2yth n GLY 7 Ca -0.20 -0.50 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 2yth n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yth s SER 8 N -0.20 6.82 -0.16 1.61 0.01 -1.26 -5.05 113.70 115.48 2yth s SER 8 Ca 0.00 1.00 -0.01 0.00 1.31 0.00 0.00 55.95 58.25 2yth s SER 8 Cb 0.00 -2.40 -0.01 0.00 0.21 0.00 0.00 66.02 63.82 2yth s SER 8 CO 0.00 -0.31 -0.11 -0.83 0.41 0.00 0.00 173.24 172.40 2yth s GLY 9 N 1.15 1.55 -0.08 3.44 0.00 -1.26 -5.10 107.32 107.02 2yth s GLY 9 Ca 0.33 -0.98 -0.12 0.00 0.00 0.00 0.00 44.72 43.96 2yth s GLY 9 CO 0.12 0.01 0.29 1.85 0.00 0.00 0.00 173.10 175.37 2yth s GLU 10 N 0.71 0.45 0.11 2.90 2.12 -1.26 -5.13 118.70 118.61 2yth s GLU 10 Ca -0.05 0.18 0.05 0.00 0.36 0.00 0.00 54.97 55.51 2yth s GLU 10 Cb -0.15 0.21 -0.04 0.00 0.26 0.00 0.00 34.13 34.41 2yth s GLU 10 CO 0.02 -0.09 -0.12 0.15 -0.54 0.00 0.00 175.26 174.68 2yth s LYS 11 N -0.39 0.95 0.18 4.30 1.02 -1.26 -5.06 119.74 119.49 2yth s LYS 11 Ca -0.05 -1.22 -0.06 0.00 0.02 0.00 0.00 55.97 54.66 2yth s LYS 11 Cb -0.03 -0.72 0.09 0.00 -0.52 0.00 0.00 37.83 36.64 2yth s LYS 11 CO 0.02 0.13 1.53 -1.00 -0.92 0.00 0.00 175.35 175.10 2yth h PRO 12 N 3.49 0.74 -5.34 -1.68 0.13 -1.94 -3.40 132.00 124.00 2yth h PRO 12 Ca -0.38 -0.39 -0.65 0.00 -0.87 0.00 0.00 66.00 63.71 2yth h PRO 12 Cb 1.19 0.01 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 2yth h PRO 12 CO 0.52 1.01 0.36 -0.06 -0.23 0.00 0.00 178.00 179.61 2yth s PHE 13 N -4.30 2.85 0.05 1.56 0.08 -1.26 -5.02 117.98 111.93 2yth s PHE 13 Ca -0.09 -0.44 0.06 0.00 0.12 0.00 0.00 56.93 56.58 2yth s PHE 13 Cb 0.12 -3.99 -0.02 0.00 -0.57 0.00 0.00 43.02 38.55 2yth s PHE 13 CO 0.85 -1.35 -0.17 -0.65 -0.10 0.00 0.00 175.22 173.80 2yth s GLN 14 N 3.47 1.12 1.31 0.44 -0.21 -1.26 -2.39 119.66 122.13 2yth s GLN 14 Ca 0.21 -0.86 -0.20 0.00 0.02 0.00 0.00 55.36 54.53 2yth s GLN 14 Cb -0.17 -1.18 0.33 0.00 1.00 0.00 0.00 33.01 32.98 2yth s GLN 14 CO 0.13 0.29 1.01 0.00 -2.12 0.00 0.00 175.29 174.60 2yth n GLU 16 N -5.22 1.82 -0.01 0.00 0.00 -1.26 -3.40 120.64 112.58 2yth n GLU 16 Ca 0.12 -0.01 0.02 0.00 0.00 0.00 0.00 57.16 57.29 2yth n GLU 16 Cb 0.59 -1.07 -0.12 0.00 0.00 0.00 0.00 31.44 30.84 2yth n GLU 16 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2yth n GLU 17 N -1.85 0.65 0.00 5.31 1.02 -1.26 -4.50 120.64 120.01 2yth n GLU 17 Ca -0.02 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2yth n GLU 17 Cb 0.33 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 2yth n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2yth n GLY 19 N 0.15 -0.86 1.77 0.00 0.00 -1.22 -4.88 105.19 100.15 2yth n GLY 19 Ca 0.00 0.35 -0.11 0.00 0.00 0.00 0.00 46.02 46.26 2yth n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yth n LYS 20 N -4.96 0.15 -5.18 1.61 5.02 -1.26 -4.64 118.16 108.90 2yth n LYS 20 Ca -0.12 -1.19 -0.32 0.00 -2.02 0.00 0.00 58.31 54.66 2yth n LYS 20 Cb 0.57 -0.35 -0.16 0.00 -0.02 0.00 0.00 35.03 35.07 2yth n LYS 20 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2yth s ARG 21 N -3.73 2.50 -0.09 1.97 0.52 -1.26 -3.19 118.95 115.67 2yth s ARG 21 Ca 0.31 -0.86 -0.04 0.00 -0.52 0.00 0.00 55.73 54.62 2yth s ARG 21 Cb -0.02 -2.20 0.05 0.00 0.52 0.00 0.00 34.95 33.30 2yth s ARG 21 CO 0.21 0.45 0.20 -0.06 0.02 0.00 0.00 175.30 176.11 2yth s PHE 22 N -0.32 -0.26 0.11 -0.53 0.40 -1.01 -5.04 117.98 111.34 2yth s PHE 22 Ca 0.01 0.68 -0.22 0.00 -0.60 0.00 0.00 56.93 56.80 2yth s PHE 22 Cb -0.13 -0.09 -0.07 0.00 0.51 0.00 0.00 43.02 43.24 2yth s PHE 22 CO 0.02 -0.25 1.70 1.15 0.70 0.00 0.00 175.22 178.54 2yth h THR 23 N 6.14 0.76 -2.46 0.64 2.02 -2.00 -3.38 112.91 114.63 2yth h THR 23 Ca -0.29 0.00 -0.52 0.00 0.77 0.00 0.00 66.41 66.36 2yth h THR 23 Cb 1.13 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 68.28 2yth h THR 23 CO 0.28 0.00 -0.48 -1.10 0.37 0.00 0.00 175.52 174.59 2yth s GLN 24 N -6.17 3.30 0.04 6.66 -1.52 -1.26 -4.90 119.66 115.81 2yth s GLN 24 Ca -0.14 -0.73 -0.18 0.00 -1.95 0.00 0.00 55.36 52.36 2yth s GLN 24 Cb 0.09 -2.85 -0.17 0.00 -0.22 0.00 0.00 33.01 29.85 2yth s GLN 24 CO 0.67 0.48 1.25 -0.97 -0.25 0.00 0.00 175.29 176.47 2yth h ASN 25 N 1.89 0.57 -0.63 5.90 -1.24 -1.97 -3.26 115.58 116.83 2yth h ASN 25 Ca -0.49 -0.61 0.13 0.00 0.71 0.00 0.00 56.30 56.04 2yth h ASN 25 Cb 1.21 -0.17 -0.10 0.00 0.73 0.00 0.00 38.32 40.00 2yth h ASN 25 CO 0.65 1.08 0.09 -1.28 -1.29 0.00 0.00 177.43 176.67 2yth h SER 26 N 0.09 -0.10 -0.95 1.15 0.87 -1.98 0.13 113.55 112.75 2yth h SER 26 Ca -0.02 0.14 0.18 0.00 -1.23 0.00 0.00 61.79 60.86 2yth h SER 26 Cb 1.03 0.21 -0.08 0.00 -0.44 0.00 0.00 62.40 63.11 2yth h SER 26 CO 0.09 -0.05 0.61 0.45 -0.53 0.00 0.00 176.83 177.39 2yth h HIS 27 N 0.20 0.86 0.49 2.24 3.86 -1.97 -1.81 115.15 119.02 2yth h HIS 27 Ca 0.34 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.55 2yth h HIS 27 Cb 0.54 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.75 2yth h HIS 27 CO -0.30 0.24 -0.24 1.25 0.86 0.00 0.00 177.93 179.75 2yth h LEU 28 N 0.66 -0.56 -0.93 2.43 5.85 -0.84 0.34 115.31 122.26 2yth h LEU 28 Ca 0.51 0.02 0.21 0.00 0.84 0.00 0.00 57.88 59.46 2yth h LEU 28 Cb 0.91 0.14 -0.18 0.00 0.37 0.00 0.00 40.66 41.91 2yth h LEU 28 CO -0.27 -0.19 -0.15 0.45 -0.34 0.00 0.00 178.44 177.94 2yth h HIS 29 N -1.08 -0.34 -0.32 1.25 3.86 -1.01 0.51 115.15 118.03 2yth h HIS 29 Ca -0.07 0.08 -0.18 0.00 -1.16 0.00 0.00 60.37 59.04 2yth h HIS 29 Cb 0.50 0.30 -0.00 0.00 1.06 0.00 0.00 27.41 29.27 2yth h HIS 29 CO 0.01 -0.40 -0.49 1.03 0.86 0.00 0.00 177.93 178.94 2yth h SER 30 N 0.01 0.99 -0.11 2.45 0.87 -1.39 -3.00 113.55 113.37 2yth h SER 30 Ca 0.48 -0.51 0.03 0.00 -1.23 0.00 0.00 61.79 60.56 2yth h SER 30 Cb 0.83 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2yth h SER 30 CO -0.93 1.31 0.08 -0.74 -0.53 0.00 0.00 176.83 176.02 2yth h HIS 31 N 0.70 0.03 0.00 2.24 -0.00 0.21 -0.54 115.15 117.79 2yth h HIS 31 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 2yth h HIS 31 Cb 1.10 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.50 2yth h HIS 31 CO 0.07 0.01 0.12 1.96 -0.00 0.00 0.00 177.93 180.09 2yth h GLN 32 N 0.03 0.00 0.00 5.26 4.20 -0.52 0.59 115.11 124.67 2yth h GLN 32 Ca 0.05 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 2yth h GLN 32 Cb 0.17 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 2yth h GLN 32 CO -0.00 0.00 -0.04 0.00 -0.67 0.00 0.00 178.83 178.12 2yth h ARG 33 N 0.00 0.00 0.00 1.46 3.08 -1.24 -2.09 114.38 115.58 2yth h ARG 33 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2yth h ARG 33 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2yth h ARG 33 CO 0.00 0.04 0.00 1.33 -1.07 0.00 0.00 179.97 180.27 2yth n VAL 34 N -3.22 1.17 0.01 2.04 0.24 0.20 -1.15 118.33 117.62 2yth n VAL 34 Ca -0.01 0.29 0.02 0.00 -2.04 0.00 0.00 64.34 62.60 2yth n VAL 34 Cb 0.23 -1.15 0.04 0.00 -1.47 0.00 0.00 33.84 31.49 2yth n VAL 34 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2yth n HIS 35 N -1.41 0.10 -1.13 6.34 8.25 -0.79 -5.01 115.22 121.57 2yth n HIS 35 Ca 0.03 -0.33 -0.26 0.00 -0.26 0.00 0.00 57.72 56.90 2yth n HIS 35 Cb 0.08 -0.03 -0.13 0.00 1.12 0.00 0.00 29.99 31.03 2yth n HIS 35 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2yth n THR 36 N -0.04 0.00 0.00 1.59 -2.24 -0.30 -4.00 114.28 109.28 2yth n THR 36 Ca 0.03 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2yth n THR 36 Cb 0.24 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2yth n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yth n GLY 37 N 4.62 1.16 3.95 3.38 0.00 -1.26 -5.12 105.19 111.93 2yth n GLY 37 Ca 0.50 -0.98 -0.23 0.00 0.00 0.00 0.00 46.02 45.31 2yth n GLY 37 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2yth s GLU 38 N -1.45 3.37 -0.04 1.61 -1.05 -1.26 -5.11 118.70 114.77 2yth s GLU 38 Ca 0.00 -0.48 0.03 0.00 -0.15 0.00 0.00 54.97 54.37 2yth s GLU 38 Cb 0.00 -2.69 0.00 0.00 -0.44 0.00 0.00 34.13 31.00 2yth s GLU 38 CO 0.00 0.10 -0.13 -1.59 0.95 0.00 0.00 175.26 174.59 2yth s LYS 39 N -4.30 1.40 -0.02 -4.83 0.00 -1.26 -5.06 119.74 105.67 2yth s LYS 39 Ca 0.41 -0.45 -0.25 0.00 0.00 0.00 0.00 55.97 55.68 2yth s LYS 39 Cb -0.10 -1.24 -0.19 0.00 0.00 0.00 0.00 37.83 36.30 2yth s LYS 39 CO 0.35 0.17 1.21 -1.00 0.00 0.00 0.00 175.35 176.07 2yth h PRO 40 N 6.38 -0.08 -0.44 1.78 0.13 -2.06 -3.38 132.00 134.33 2yth h PRO 40 Ca -0.33 0.01 -0.29 0.00 -0.87 0.00 0.00 66.00 64.51 2yth h PRO 40 Cb 1.17 0.02 -0.39 0.00 0.13 0.00 0.00 31.00 31.93 2yth h PRO 40 CO 0.48 0.38 -1.02 0.43 -0.23 0.00 0.00 178.00 178.04 2yth n SER 41 N -4.90 2.28 0.00 1.44 7.64 -1.26 -5.12 113.62 113.69 2yth n SER 41 Ca -0.08 -2.49 0.00 0.00 1.01 0.00 0.00 58.87 57.31 2yth n SER 41 Cb 0.25 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 2yth n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yth n GLY 42 N -0.52 0.67 3.56 0.23 0.00 -1.26 -3.89 105.19 103.97 2yth n GLY 42 Ca 0.16 -0.79 -0.32 0.00 0.00 0.00 0.00 46.02 45.07 2yth n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yth s PRO 43 N 0.00 2.58 0.33 1.61 0.04 -1.26 -4.91 135.00 133.40 2yth s PRO 43 Ca 0.00 0.08 0.06 0.00 0.04 0.00 0.00 61.00 61.18 2yth s PRO 43 Cb 0.00 -4.79 -0.03 0.00 0.04 0.00 0.00 34.50 29.72 2yth s PRO 43 CO 0.00 -3.11 0.25 -1.54 0.04 0.00 0.00 177.00 172.63 2yth s SER 44 N 8.07 1.73 -0.02 6.66 1.04 -1.25 -5.11 113.70 124.82 2yth s SER 44 Ca 0.69 -1.73 -0.07 0.00 0.48 0.00 0.00 55.95 55.32 2yth s SER 44 Cb -0.09 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.55 2yth s SER 44 CO 0.08 -1.03 -0.14 -0.24 0.98 0.00 0.00 173.24 172.89 2yth n SER 45 N -1.43 1.38 0.00 7.02 2.88 -1.26 -5.15 113.62 117.06 2yth n SER 45 Ca 0.05 0.21 0.08 0.00 -1.33 0.00 0.00 58.87 57.88 2yth n SER 45 Cb 0.63 -0.48 0.48 0.00 -0.75 0.00 0.00 64.21 64.09 2yth n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42