#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yts s SER 2 N 0.00 6.19 0.27 1.61 0.15 -1.26 -4.92 113.70 115.73 2yts s SER 2 Ca 0.00 -1.28 -0.02 0.00 0.70 0.00 0.00 55.95 55.36 2yts s SER 2 Cb 0.00 -2.33 0.59 0.00 -1.71 0.00 0.00 66.02 62.57 2yts s SER 2 CO 0.00 -1.18 1.64 -1.28 1.20 0.00 0.00 173.24 173.62 2yts h SER 3 N 9.27 -0.14 0.00 5.45 0.87 -2.09 -3.46 113.55 123.45 2yts h SER 3 Ca -0.29 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2yts h SER 3 Cb 1.08 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 63.34 2yts h SER 3 CO 1.11 -0.16 0.00 0.61 -0.53 0.00 0.00 176.83 177.86 2yts n GLY 4 N -1.40 2.65 3.49 5.77 0.00 -1.26 -5.08 105.19 109.36 2yts n GLY 4 Ca 0.18 0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 2yts n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yts s SER 5 N 1.84 6.24 -0.19 1.61 0.15 -1.26 -4.79 113.70 117.30 2yts s SER 5 Ca 0.00 -0.98 -0.12 0.00 0.70 0.00 0.00 55.95 55.54 2yts s SER 5 Cb 0.00 -2.47 -0.08 0.00 -1.71 0.00 0.00 66.02 61.76 2yts s SER 5 CO 0.00 -1.53 -0.29 -1.20 1.20 0.00 0.00 173.24 171.43 2yts n SER 6 N 8.18 1.65 -4.49 5.45 7.64 -1.26 -4.80 113.62 125.98 2yts n SER 6 Ca 0.04 0.28 -0.43 0.00 1.01 0.00 0.00 58.87 59.77 2yts n SER 6 Cb 0.47 -0.66 -0.01 0.00 -1.01 0.00 0.00 64.21 63.00 2yts n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yts s GLY 7 N -5.16 1.97 -0.05 0.23 0.00 -1.26 -4.78 107.32 98.26 2yts s GLY 7 Ca -0.28 -2.94 -0.23 0.00 0.00 0.00 0.00 44.72 41.27 2yts s GLY 7 CO 0.38 2.24 0.94 -0.84 0.00 0.00 0.00 173.10 175.82 2yts h THR 8 N 5.49 1.53 -1.88 0.90 2.02 -2.00 -3.37 112.91 115.60 2yts h THR 8 Ca 0.27 -2.34 -0.78 0.00 0.77 0.00 0.00 66.41 64.34 2yts h THR 8 Cb 0.94 3.04 -0.20 0.00 -1.74 0.00 0.00 68.15 70.19 2yts h THR 8 CO 1.26 0.66 1.63 0.61 0.37 0.00 0.00 175.52 180.05 2yts n GLY 9 N 1.45 5.13 3.59 2.16 0.00 -1.26 -4.98 105.19 111.27 2yts n GLY 9 Ca -0.12 -2.31 -0.41 0.00 0.00 0.00 0.00 46.02 43.17 2yts n GLY 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2yts s GLU 10 N -1.35 3.01 0.52 1.61 -1.05 -1.26 -4.94 118.70 115.24 2yts s GLU 10 Ca 0.40 1.49 -0.22 0.00 -0.15 0.00 0.00 54.97 56.48 2yts s GLU 10 Cb 0.11 -4.33 -0.06 0.00 -0.44 0.00 0.00 34.13 29.42 2yts s GLU 10 CO 0.00 -2.24 1.31 0.15 0.95 0.00 0.00 175.26 175.44 2yts s LYS 11 N 6.39 3.31 0.06 -4.83 3.01 -1.26 -4.95 119.74 121.47 2yts s LYS 11 Ca 0.86 2.13 -0.19 0.00 -1.01 0.00 0.00 55.97 57.76 2yts s LYS 11 Cb -0.23 -2.31 -0.13 0.00 -1.01 0.00 0.00 37.83 34.15 2yts s LYS 11 CO 0.31 -1.02 1.37 -1.00 0.51 0.00 0.00 175.35 175.52 2yts h PRO 12 N 1.63 0.46 -4.98 -1.68 0.13 -1.91 -3.42 132.00 122.23 2yts h PRO 12 Ca -0.50 -0.24 -0.63 0.00 -0.87 0.00 0.00 66.00 63.75 2yts h PRO 12 Cb 1.29 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 32.26 2yts h PRO 12 CO 0.58 0.81 -0.49 0.71 -0.23 0.00 0.00 178.00 179.38 2yts s TYR 13 N -4.32 3.25 -0.06 1.56 2.02 -1.26 -5.06 117.35 113.48 2yts s TYR 13 Ca -0.14 0.18 -0.02 0.00 -0.37 0.00 0.00 57.07 56.72 2yts s TYR 13 Cb 0.06 -2.36 0.04 0.00 -0.40 0.00 0.00 41.96 39.30 2yts s TYR 13 CO 0.78 -0.10 0.12 0.42 -1.57 0.00 0.00 175.55 175.20 2yts s ILE 14 N 1.57 -0.11 0.54 2.71 1.01 -1.26 -0.93 121.20 124.72 2yts s ILE 14 Ca 0.08 0.25 -0.19 0.00 0.00 0.00 0.00 60.65 60.79 2yts s ILE 14 Cb -0.15 -0.22 -0.06 0.00 0.01 0.00 0.00 42.46 42.04 2yts s ILE 14 CO 0.09 0.10 1.12 0.00 0.00 0.00 0.00 174.94 176.25 2yts n ASN 16 N -1.29 2.36 0.07 0.00 2.85 -1.26 -3.33 115.26 114.66 2yts n ASN 16 Ca 0.11 0.00 -0.12 0.00 -0.11 0.00 0.00 54.58 54.46 2yts n ASN 16 Cb 0.51 0.92 -0.07 0.00 1.24 0.00 0.00 39.78 42.38 2yts n ASN 16 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 2yts h GLU 17 N 0.00 -0.11 0.00 1.20 5.08 -1.99 -3.36 114.58 115.40 2yts h GLU 17 Ca -0.23 0.01 -0.30 0.00 -1.00 0.00 0.00 59.36 57.83 2yts h GLU 17 Cb 1.43 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.66 2yts h GLU 17 CO 0.01 -0.07 -2.08 0.00 -1.00 0.00 0.00 179.01 175.87 2yts n GLY 19 N 2.27 0.84 3.82 0.00 0.00 -1.21 -5.10 105.19 105.81 2yts n GLY 19 Ca -0.35 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.45 2yts n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yts s LYS 20 N 0.32 2.61 0.13 1.61 2.20 -1.23 -4.89 119.74 120.48 2yts s LYS 20 Ca 0.00 -1.38 0.10 0.00 -0.36 0.00 0.00 55.97 54.32 2yts s LYS 20 Cb 0.00 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.90 2yts s LYS 20 CO 0.00 0.08 -0.24 -1.12 -0.36 0.00 0.00 175.35 173.71 2yts s SER 21 N -3.96 3.00 0.26 1.43 0.01 -1.26 0.15 113.70 113.33 2yts s SER 21 Ca 0.40 -0.74 0.00 0.00 1.31 0.00 0.00 55.95 56.92 2yts s SER 21 Cb -0.05 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.97 2yts s SER 21 CO 0.25 0.12 0.26 -0.36 0.41 0.00 0.00 173.24 173.92 2yts s PHE 22 N -1.20 1.25 -0.17 2.43 0.08 -0.11 -4.98 117.98 115.27 2yts s PHE 22 Ca 0.12 -1.39 -0.05 0.00 0.12 0.00 0.00 56.93 55.73 2yts s PHE 22 Cb -0.10 -0.47 -0.09 0.00 -0.57 0.00 0.00 43.02 41.80 2yts s PHE 22 CO 0.06 -0.81 -0.20 -0.89 -0.10 0.00 0.00 175.22 173.28 2yts n ILE 23 N -0.43 0.95 -3.28 0.64 5.41 -1.26 -4.00 119.36 117.39 2yts n ILE 23 Ca 0.03 -0.28 -0.26 0.00 1.00 0.00 0.00 62.75 63.24 2yts n ILE 23 Cb 0.64 -1.51 -0.02 0.00 -0.71 0.00 0.00 39.64 38.04 2yts n ILE 23 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 2yts s GLN 24 N -2.32 3.55 -0.02 0.38 0.74 -1.26 -4.77 119.66 115.96 2yts s GLN 24 Ca -0.24 -0.13 -0.23 0.00 0.05 0.00 0.00 55.36 54.81 2yts s GLN 24 Cb 0.08 -2.63 -0.21 0.00 1.10 0.00 0.00 33.01 31.36 2yts s GLN 24 CO 0.33 0.14 1.14 -0.22 -0.55 0.00 0.00 175.29 176.13 2yts h LYS 25 N 1.10 0.25 -1.00 1.67 1.63 -2.00 -3.22 116.57 115.00 2yts h LYS 25 Ca -0.48 -0.21 0.07 0.00 -0.85 0.00 0.00 60.65 59.17 2yts h LYS 25 Cb 1.20 0.05 -0.07 0.00 -0.60 0.00 0.00 32.23 32.81 2yts h LYS 25 CO 0.63 0.87 0.64 0.66 -3.45 0.00 0.00 179.45 178.81 2yts h SER 26 N -0.31 1.02 -0.44 4.20 4.64 -1.97 -0.22 113.55 120.47 2yts h SER 26 Ca -0.02 0.01 0.07 0.00 -0.47 0.00 0.00 61.79 61.38 2yts h SER 26 Cb 0.93 -0.20 -0.06 0.00 -0.31 0.00 0.00 62.40 62.76 2yts h SER 26 CO 0.05 0.64 0.11 0.45 -0.87 0.00 0.00 176.83 177.21 2yts h HIS 27 N 1.15 0.18 0.32 4.77 3.86 -1.97 0.28 115.15 123.74 2yts h HIS 27 Ca 0.44 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.66 2yts h HIS 27 Cb 0.20 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.66 2yts h HIS 27 CO -0.00 0.03 -0.15 1.25 0.86 0.00 0.00 177.93 179.91 2yts h LEU 28 N 0.25 -0.36 -1.97 2.43 5.85 -1.40 -1.05 115.31 119.05 2yts h LEU 28 Ca 0.21 -0.17 0.16 0.00 0.84 0.00 0.00 57.88 58.93 2yts h LEU 28 Cb 0.26 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2yts h LEU 28 CO -0.27 0.09 0.50 0.78 -0.34 0.00 0.00 178.44 179.21 2yts h ASN 29 N -0.95 0.00 0.90 1.25 2.35 -0.95 0.81 115.58 118.98 2yts h ASN 29 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 2yts h ASN 29 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 2yts h ASN 29 CO 0.07 0.00 -0.81 -0.09 -1.65 0.00 0.00 177.43 174.95 2yts h ARG 30 N 0.00 0.00 0.00 0.81 2.43 -0.38 -3.37 114.38 113.88 2yts h ARG 30 Ca 0.27 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 59.23 2yts h ARG 30 Cb 1.26 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.78 2yts h ARG 30 CO -0.00 0.00 -1.12 1.25 -1.51 0.00 0.00 179.97 178.59 2yts h HIS 31 N 0.00 0.01 -1.28 2.20 2.76 0.18 -3.36 115.15 115.66 2yts h HIS 31 Ca 0.00 -0.01 0.38 0.00 -2.20 0.00 0.00 60.37 58.55 2yts h HIS 31 Cb 0.85 -0.00 -0.10 0.00 1.55 0.00 0.00 27.41 29.71 2yts h HIS 31 CO 0.00 1.44 0.85 0.00 -1.30 0.00 0.00 177.93 178.92 2yts h ARG 32 N -0.98 0.15 -0.68 5.26 3.08 -0.79 0.27 114.38 120.68 2yts h ARG 32 Ca -0.31 -0.01 0.14 0.00 0.07 0.00 0.00 59.98 59.87 2yts h ARG 32 Cb 1.28 -0.03 -0.10 0.00 0.08 0.00 0.00 29.97 31.20 2yts h ARG 32 CO -0.18 0.10 0.16 0.00 -1.07 0.00 0.00 179.97 178.98 2yts h ARG 33 N 0.15 0.27 -0.72 0.04 3.08 -1.72 -1.25 114.38 114.23 2yts h ARG 33 Ca 0.72 -0.02 0.25 0.00 0.07 0.00 0.00 59.98 61.01 2yts h ARG 33 Cb 2.32 -0.06 -0.13 0.00 0.08 0.00 0.00 29.97 32.18 2yts h ARG 33 CO -0.28 0.18 0.22 0.44 -1.07 0.00 0.00 179.97 179.45 2yts n ILE 34 N -5.14 -0.30 0.15 2.04 -5.35 0.95 -0.41 119.36 111.30 2yts n ILE 34 Ca 0.12 1.52 -0.07 0.00 -0.27 0.00 0.00 62.75 64.06 2yts n ILE 34 Cb 0.40 -2.35 -0.03 0.00 -1.74 0.00 0.00 39.64 35.92 2yts n ILE 34 CO 0.00 0.00 0.00 0.45 -1.76 0.00 0.00 176.55 175.24 2yts h HIS 35 N 0.00 -0.40 -3.48 4.28 3.86 -1.40 -3.43 115.15 114.58 2yts h HIS 35 Ca 0.53 -0.01 -0.60 0.00 -1.16 0.00 0.00 60.37 59.13 2yts h HIS 35 Cb 1.29 0.13 -0.11 0.00 1.06 0.00 0.00 27.41 29.78 2yts h HIS 35 CO -0.17 -0.25 0.05 -0.08 0.86 0.00 0.00 177.93 178.33 2yts s THR 36 N -3.10 5.05 0.00 2.45 -1.32 0.45 -4.94 115.64 114.23 2yts s THR 36 Ca -0.06 1.04 0.00 0.00 -1.21 0.00 0.00 61.69 61.45 2yts s THR 36 Cb 0.01 -3.88 0.00 0.00 -1.51 0.00 0.00 72.50 67.11 2yts s THR 36 CO 0.19 0.11 0.00 0.61 -2.21 0.00 0.00 174.62 173.32 2yts n GLY 37 N 4.01 1.06 2.62 6.08 0.00 -1.25 -4.58 105.19 113.13 2yts n GLY 37 Ca -0.03 0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 2yts n GLY 37 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yts s GLU 38 N 4.66 1.03 -0.02 1.61 2.12 -1.26 -5.12 118.70 121.72 2yts s GLU 38 Ca 0.00 -1.77 -0.07 0.00 0.36 0.00 0.00 54.97 53.49 2yts s GLU 38 Cb 0.00 -1.97 -0.05 0.00 0.26 0.00 0.00 34.13 32.37 2yts s GLU 38 CO 0.00 -1.18 0.25 -1.59 -0.54 0.00 0.00 175.26 172.20 2yts s LYS 39 N 0.60 3.57 -0.02 4.30 -2.85 -1.26 -5.03 119.74 119.05 2yts s LYS 39 Ca 0.18 -0.07 -0.25 0.00 -1.00 0.00 0.00 55.97 54.83 2yts s LYS 39 Cb -0.24 -3.11 -0.20 0.00 -2.06 0.00 0.00 37.83 32.23 2yts s LYS 39 CO 0.00 0.68 1.23 -1.00 0.10 0.00 0.00 175.35 176.36 2yts h PRO 40 N 4.21 -0.05 -3.22 1.78 0.13 -2.06 -3.46 132.00 129.33 2yts h PRO 40 Ca -0.51 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.43 2yts h PRO 40 Cb 1.20 0.01 -0.28 0.00 0.13 0.00 0.00 31.00 32.07 2yts h PRO 40 CO 0.64 0.41 -0.51 0.45 -0.23 0.00 0.00 178.00 178.77 2yts s SER 41 N -5.62 -0.20 -0.14 1.44 0.15 -1.26 -5.16 113.70 102.91 2yts s SER 41 Ca -0.15 0.40 -0.28 0.00 0.70 0.00 0.00 55.95 56.62 2yts s SER 41 Cb 0.02 0.37 0.07 0.00 -1.71 0.00 0.00 66.02 64.76 2yts s SER 41 CO 0.65 -0.10 0.68 -0.83 1.20 0.00 0.00 173.24 174.84 2yts s GLY 42 N 0.45 -0.54 0.47 9.45 0.00 -1.26 -5.03 107.32 110.85 2yts s GLY 42 Ca -0.03 1.56 0.25 0.00 0.00 0.00 0.00 44.72 46.51 2yts s GLY 42 CO -0.02 1.25 1.89 -0.56 0.00 0.00 0.00 173.10 175.66 2yts h PRO 43 N 3.88 0.00 -6.21 2.90 0.13 -2.04 -3.46 132.00 127.20 2yts h PRO 43 Ca -0.28 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.43 2yts h PRO 43 Cb 1.15 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.02 2yts h PRO 43 CO 0.25 0.19 -0.61 0.45 -0.23 0.00 0.00 178.00 178.05 2yts n SER 44 N -3.43 -1.45 -4.22 1.44 2.88 -1.26 -4.87 113.62 102.71 2yts n SER 44 Ca -0.00 -0.73 -0.18 0.00 -1.33 0.00 0.00 58.87 56.63 2yts n SER 44 Cb 0.38 -1.29 -0.11 0.00 -0.75 0.00 0.00 64.21 62.43 2yts n SER 44 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yts s SER 45 N -2.70 1.86 0.00 -3.46 0.15 -1.26 -5.35 113.70 102.93 2yts s SER 45 Ca 0.56 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 56.46 2yts s SER 45 Cb -0.33 -0.06 0.00 0.00 -1.71 0.00 0.00 66.02 63.92 2yts s SER 45 CO 0.69 -0.14 0.14 0.61 1.20 0.00 0.00 173.24 175.75