#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ytm s SER 2 N 0.00 4.73 0.06 1.61 0.01 -1.26 -5.11 113.70 113.75 2ytm s SER 2 Ca 0.00 -0.20 0.03 0.00 1.31 0.00 0.00 55.95 57.09 2ytm s SER 2 Cb 0.00 -1.79 -0.04 0.00 0.21 0.00 0.00 66.02 64.40 2ytm s SER 2 CO 0.00 0.10 0.03 -0.94 0.41 0.00 0.00 173.24 172.84 2ytm s SER 3 N 0.78 5.27 0.00 2.44 1.04 -1.26 -5.09 113.70 116.89 2ytm s SER 3 Ca -0.01 -0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2ytm s SER 3 Cb -0.14 -1.36 0.00 0.00 0.10 0.00 0.00 66.02 64.62 2ytm s SER 3 CO 0.02 0.20 0.00 0.61 0.98 0.00 0.00 173.24 175.05 2ytm n GLY 4 N 0.73 3.40 3.31 7.32 0.00 -1.26 -5.19 105.19 113.50 2ytm n GLY 4 Ca -0.11 -0.48 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 2ytm n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ytm s SER 5 N 1.98 -0.24 0.26 1.61 0.01 -1.26 -5.04 113.70 111.02 2ytm s SER 5 Ca 0.00 -0.05 0.01 0.00 1.31 0.00 0.00 55.95 57.22 2ytm s SER 5 Cb 0.00 0.41 0.64 0.00 0.21 0.00 0.00 66.02 67.28 2ytm s SER 5 CO 0.00 -0.66 1.32 -1.54 0.41 0.00 0.00 173.24 172.77 2ytm n SER 6 N 0.51 -0.10 -0.54 2.44 3.41 -1.26 -4.83 113.62 113.25 2ytm n SER 6 Ca -0.18 1.43 0.03 0.00 -0.26 0.00 0.00 58.87 59.89 2ytm n SER 6 Cb 0.60 -0.52 -0.01 0.00 -0.26 0.00 0.00 64.21 64.02 2ytm n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ytm n GLY 7 N -1.43 -0.59 3.39 5.00 0.00 -1.26 -4.17 105.19 106.14 2ytm n GLY 7 Ca 0.20 -0.48 -0.45 0.00 0.00 0.00 0.00 46.02 45.28 2ytm n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ytm s THR 8 N -0.57 5.31 -0.31 2.61 2.01 -1.26 -4.96 115.64 118.47 2ytm s THR 8 Ca 0.00 -2.37 -0.01 0.00 0.31 0.00 0.00 61.69 59.63 2ytm s THR 8 Cb 0.00 -4.66 0.10 0.00 0.01 0.00 0.00 72.50 67.95 2ytm s THR 8 CO 0.00 -1.30 0.10 -0.83 -0.69 0.00 0.00 174.62 171.91 2ytm s GLY 9 N 2.60 1.05 0.36 4.40 0.00 -1.26 -4.97 107.32 109.50 2ytm s GLY 9 Ca 0.28 -1.67 0.08 0.00 0.00 0.00 0.00 44.72 43.42 2ytm s GLY 9 CO -0.08 1.64 1.87 1.05 0.00 0.00 0.00 173.10 177.58 2ytm h GLU 10 N 8.06 0.26 -1.49 2.90 9.09 -1.93 -3.45 114.58 128.02 2ytm h GLU 10 Ca -0.13 -0.07 0.10 0.00 0.05 0.00 0.00 59.36 59.30 2ytm h GLU 10 Cb 1.01 -0.03 -0.26 0.00 -1.65 0.00 0.00 28.75 27.83 2ytm h GLU 10 CO 0.47 0.44 0.57 -1.59 0.05 0.00 0.00 179.01 178.95 2ytm s LYS 11 N -4.62 0.47 -0.02 1.06 0.00 -1.26 -5.07 119.74 110.29 2ytm s LYS 11 Ca -0.05 0.30 -0.26 0.00 0.00 0.00 0.00 55.97 55.96 2ytm s LYS 11 Cb 0.15 0.22 -0.20 0.00 0.00 0.00 0.00 37.83 38.00 2ytm s LYS 11 CO 0.74 -0.11 1.26 -1.00 0.00 0.00 0.00 175.35 176.25 2ytm h PRO 12 N 3.21 -0.00 -5.33 1.78 0.13 -2.03 -3.39 132.00 126.36 2ytm h PRO 12 Ca -0.22 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.84 2ytm h PRO 12 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2ytm h PRO 12 CO 0.21 0.49 0.19 1.52 -0.23 0.00 0.00 178.00 180.17 2ytm s TYR 13 N -4.24 1.29 0.20 1.56 1.13 -1.26 -4.90 117.35 111.14 2ytm s TYR 13 Ca -0.16 1.83 0.07 0.00 -1.41 0.00 0.00 57.07 57.40 2ytm s TYR 13 Cb 0.02 -3.51 -0.04 0.00 -1.10 0.00 0.00 41.96 37.32 2ytm s TYR 13 CO 0.67 -1.30 0.06 0.21 -2.51 0.00 0.00 175.55 172.68 2ytm s LYS 14 N 8.38 2.55 -0.43 -3.49 2.20 -1.26 -5.03 119.74 122.67 2ytm s LYS 14 Ca 0.85 -1.12 -0.35 0.00 -0.36 0.00 0.00 55.97 54.99 2ytm s LYS 14 Cb -0.09 -2.40 -0.12 0.00 -1.51 0.00 0.00 37.83 33.70 2ytm s LYS 14 CO 0.10 0.43 2.25 0.00 -0.36 0.00 0.00 175.35 177.78 2ytm n MET 16 N 8.25 1.80 -0.09 0.00 1.56 -1.26 -2.54 117.12 124.84 2ytm n MET 16 Ca 0.44 -1.22 -0.17 0.00 -0.27 0.00 0.00 57.70 56.47 2ytm n MET 16 Cb 0.22 -1.33 -0.11 0.00 2.15 0.00 0.00 33.22 34.15 2ytm n MET 16 CO 0.00 0.00 0.00 1.49 -0.73 0.00 0.00 175.97 176.73 2ytm h GLU 17 N 2.18 0.00 0.00 2.12 4.57 -2.00 -3.45 114.58 118.00 2ytm h GLU 17 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2ytm h GLU 17 Cb 0.49 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.08 2ytm h GLU 17 CO 0.00 0.89 -0.82 0.00 -1.18 0.00 0.00 179.01 177.89 2ytm n GLY 19 N 3.03 0.69 3.34 0.00 0.00 -1.05 -5.12 105.19 106.08 2ytm n GLY 19 Ca 0.00 -0.41 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 2ytm n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ytm s LYS 20 N -0.18 3.37 0.28 1.61 2.36 -1.26 -5.01 119.74 120.92 2ytm s LYS 20 Ca 0.00 -0.66 -0.21 0.00 -2.55 0.00 0.00 55.97 52.55 2ytm s LYS 20 Cb 0.00 -2.79 -0.09 0.00 -1.05 0.00 0.00 37.83 33.90 2ytm s LYS 20 CO 0.00 0.03 0.81 0.00 1.55 0.00 0.00 175.35 177.74 2ytm s ALA 21 N 0.86 3.31 0.41 3.13 0.00 -1.26 -4.10 121.76 124.10 2ytm s ALA 21 Ca -0.03 0.28 0.04 0.00 0.00 0.00 0.00 51.96 52.25 2ytm s ALA 21 Cb -0.15 -2.95 -0.03 0.00 0.00 0.00 0.00 23.12 19.99 2ytm s ALA 21 CO 0.01 0.26 0.12 -0.06 0.00 0.00 0.00 175.76 176.09 2ytm s PHE 22 N -1.66 1.80 -0.18 0.00 0.08 -1.26 -5.07 117.98 111.69 2ytm s PHE 22 Ca 0.48 -1.25 -0.02 0.00 0.12 0.00 0.00 56.93 56.26 2ytm s PHE 22 Cb -0.16 -1.18 -0.11 0.00 -0.57 0.00 0.00 43.02 41.00 2ytm s PHE 22 CO 0.21 -0.26 -0.19 0.41 -0.10 0.00 0.00 175.22 175.29 2ytm n GLY 23 N -0.91 -0.27 3.21 4.36 0.00 -1.26 -4.96 105.19 105.36 2ytm n GLY 23 Ca -0.06 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 2ytm n GLY 23 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ytm s ASP 24 N -6.03 -0.01 0.27 1.61 2.15 -1.26 -5.03 116.67 108.37 2ytm s ASP 24 Ca -0.25 -0.35 0.04 0.00 0.43 0.00 0.00 52.55 52.41 2ytm s ASP 24 Cb 0.07 0.32 0.72 0.00 -0.30 0.00 0.00 42.92 43.74 2ytm s ASP 24 CO 0.40 -0.61 1.35 -0.46 -0.17 0.00 0.00 175.17 175.68 2ytm n ASN 25 N 0.51 -0.05 -0.35 -0.34 6.94 -1.26 -0.11 115.26 120.61 2ytm n ASN 25 Ca -0.18 1.46 -0.02 0.00 -0.02 0.00 0.00 54.58 55.81 2ytm n ASN 25 Cb 0.60 -0.55 0.01 0.00 -2.36 0.00 0.00 39.78 37.48 2ytm n ASN 25 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 2ytm n SER 26 N -5.21 -0.64 0.01 0.53 2.88 -1.26 -0.07 113.62 109.85 2ytm n SER 26 Ca 0.22 1.55 -0.13 0.00 -1.33 0.00 0.00 58.87 59.18 2ytm n SER 26 Cb 0.72 -0.33 -0.09 0.00 -0.75 0.00 0.00 64.21 63.76 2ytm n SER 26 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2ytm h SER 27 N 0.00 -0.02 -0.28 -3.46 0.02 -0.93 -3.16 113.55 105.71 2ytm h SER 27 Ca 0.28 -0.40 0.04 0.00 -0.84 0.00 0.00 61.79 60.87 2ytm h SER 27 Cb 0.50 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.98 2ytm h SER 27 CO -0.87 0.39 -0.47 0.00 -1.14 0.00 0.00 176.83 174.74 2ytm h THR 29 N -0.38 0.17 0.29 0.00 1.35 -0.56 0.04 112.91 113.82 2ytm h THR 29 Ca 0.05 -0.02 -0.01 0.00 -0.55 0.00 0.00 66.41 65.87 2ytm h THR 29 Cb 0.52 0.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.04 2ytm h THR 29 CO -0.47 0.01 -0.14 1.56 -0.25 0.00 0.00 175.52 176.24 2ytm h GLN 30 N 0.07 -0.37 -1.54 4.72 1.08 -1.09 -2.80 115.11 115.17 2ytm h GLN 30 Ca 0.52 0.03 0.47 0.00 -1.45 0.00 0.00 58.65 58.22 2ytm h GLN 30 Cb 1.02 0.09 -0.10 0.00 -0.05 0.00 0.00 27.48 28.43 2ytm h GLN 30 CO -0.81 -0.11 1.05 1.25 -0.95 0.00 0.00 178.83 179.27 2ytm h HIS 31 N -0.61 0.28 -0.35 2.96 2.76 0.12 1.38 115.15 121.70 2ytm h HIS 31 Ca -0.04 0.01 -0.15 0.00 -2.20 0.00 0.00 60.37 57.99 2ytm h HIS 31 Cb 0.44 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.32 2ytm h HIS 31 CO -0.00 -0.11 -0.39 0.37 -1.30 0.00 0.00 177.93 176.50 2ytm h GLN 32 N 0.05 0.86 -0.59 5.26 4.15 -1.14 -3.19 115.11 120.51 2ytm h GLN 32 Ca 0.83 -0.45 0.05 0.00 0.77 0.00 0.00 58.65 59.86 2ytm h GLN 32 Cb 2.96 0.01 -0.07 0.00 0.21 0.00 0.00 27.48 30.59 2ytm h GLN 32 CO -0.23 1.09 -0.36 0.00 -1.93 0.00 0.00 178.83 177.41 2ytm h ARG 33 N 0.70 -0.01 -0.91 1.69 2.47 0.19 0.47 114.38 118.98 2ytm h ARG 33 Ca 0.06 0.00 0.08 0.00 -1.26 0.00 0.00 59.98 58.86 2ytm h ARG 33 Cb 0.97 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 29.23 2ytm h ARG 33 CO 0.09 -0.01 0.59 1.37 0.56 0.00 0.00 179.97 182.57 2ytm h LEU 34 N -0.01 0.88 -0.92 3.04 8.10 -1.64 -1.48 115.31 123.27 2ytm h LEU 34 Ca 0.09 0.01 0.02 0.00 0.11 0.00 0.00 57.88 58.11 2ytm h LEU 34 Cb 0.26 -0.17 -0.05 0.00 -0.44 0.00 0.00 40.66 40.26 2ytm h LEU 34 CO -0.56 0.54 0.61 0.45 -4.11 0.00 0.00 178.44 175.37 2ytm h HIS 35 N 0.99 1.15 -0.80 0.17 3.86 -0.28 -2.68 115.15 117.56 2ytm h HIS 35 Ca 0.41 0.03 0.31 0.00 -1.16 0.00 0.00 60.37 59.95 2ytm h HIS 35 Cb 0.28 -0.39 -0.15 0.00 1.06 0.00 0.00 27.41 28.22 2ytm h HIS 35 CO -0.00 0.71 0.32 2.41 0.86 0.00 0.00 177.93 182.23 2ytm n THR 36 N -4.46 -0.34 0.00 2.45 -1.04 0.12 -4.86 114.28 106.16 2ytm n THR 36 Ca 0.11 1.66 0.00 0.00 -2.04 0.00 0.00 64.05 63.78 2ytm n THR 36 Cb 0.03 -2.62 0.00 0.00 -1.82 0.00 0.00 70.33 65.92 2ytm n THR 36 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ytm n GLY 37 N -1.26 1.48 2.56 3.41 0.00 -1.01 -5.03 105.19 105.34 2ytm n GLY 37 Ca 0.27 -0.84 -0.35 0.00 0.00 0.00 0.00 46.02 45.11 2ytm n GLY 37 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ytm n GLN 38 N 0.00 0.00 -2.06 1.61 1.13 -1.26 -4.82 117.38 111.98 2ytm n GLN 38 Ca 0.00 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 54.71 2ytm n GLN 38 Cb 0.00 -1.12 0.02 0.00 0.11 0.00 0.00 30.24 29.25 2ytm n GLN 38 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2ytm s ARG 39 N 6.05 3.08 -0.66 -1.09 3.00 -1.26 -4.91 118.95 123.16 2ytm s ARG 39 Ca 0.98 1.65 -0.26 0.00 0.00 0.00 0.00 55.73 58.10 2ytm s ARG 39 Cb -1.00 -1.96 -0.03 0.00 0.00 0.00 0.00 34.95 31.96 2ytm s ARG 39 CO 0.41 -1.08 1.88 -1.25 0.00 0.00 0.00 175.30 175.26 2ytm s PRO 40 N -3.46 2.61 -1.09 3.54 0.04 -1.26 -4.90 135.00 130.48 2ytm s PRO 40 Ca 0.73 0.46 -0.24 0.00 0.04 0.00 0.00 61.00 61.99 2ytm s PRO 40 Cb -0.26 -4.50 -0.10 0.00 0.04 0.00 0.00 34.50 29.68 2ytm s PRO 40 CO 0.32 -2.85 1.99 0.45 0.04 0.00 0.00 177.00 176.95 2ytm s SER 41 N 8.12 4.76 0.20 6.66 0.15 -1.26 -4.67 113.70 127.66 2ytm s SER 41 Ca 0.68 -1.27 0.00 0.00 0.70 0.00 0.00 55.95 56.06 2ytm s SER 41 Cb -0.12 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 2ytm s SER 41 CO 0.17 -3.29 0.00 0.61 1.20 0.00 0.00 173.24 171.93 2ytm n GLY 42 N 6.13 -3.38 0.17 9.45 0.00 -1.26 -4.70 105.19 111.60 2ytm n GLY 42 Ca 0.43 -1.09 -0.13 0.00 0.00 0.00 0.00 46.02 45.24 2ytm n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ytm h PRO 43 N 0.28 0.50 -3.89 1.61 0.13 -2.04 -3.40 132.00 125.18 2ytm h PRO 43 Ca 0.00 -0.26 -0.61 0.00 -0.87 0.00 0.00 66.00 64.26 2ytm h PRO 43 Cb 0.20 0.01 -0.40 0.00 0.13 0.00 0.00 31.00 30.93 2ytm h PRO 43 CO 0.00 0.84 -0.74 0.45 -0.23 0.00 0.00 178.00 178.32 2ytm s SER 44 N -6.29 4.26 -0.11 1.44 0.15 -1.26 -5.09 113.70 106.79 2ytm s SER 44 Ca -0.13 -1.92 -0.13 0.00 0.70 0.00 0.00 55.95 54.47 2ytm s SER 44 Cb 0.07 -1.15 0.03 0.00 -1.71 0.00 0.00 66.02 63.26 2ytm s SER 44 CO 0.78 -0.39 0.36 -0.44 1.20 0.00 0.00 173.24 174.75 2ytm s SER 45 N 1.24 -0.34 0.00 5.45 0.01 -1.26 -5.22 113.70 113.58 2ytm s SER 45 Ca 0.11 0.59 0.30 0.00 1.31 0.00 0.00 55.95 58.26 2ytm s SER 45 Cb -0.19 0.65 1.80 0.00 0.21 0.00 0.00 66.02 68.50 2ytm s SER 45 CO -0.17 -0.20 2.13 0.61 0.41 0.00 0.00 173.24 176.02