#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 -0.30 1.11 1.61 0.01 -1.26 -5.17 113.70 109.70 2yts s SER 2 Ca 0.00 -0.29 -0.12 0.00 1.31 0.00 0.00 55.95 56.85 2yts s SER 2 Cb 0.00 0.52 0.25 0.00 0.21 0.00 0.00 66.02 67.00 2yts s SER 2 CO 0.00 -0.91 1.05 -0.94 0.41 0.00 0.00 173.24 172.85 2yts s SER 3 N -2.81 1.41 -0.62 2.44 1.04 -1.26 -4.91 113.70 109.00 2yts s SER 3 Ca 0.04 1.67 -0.02 0.00 0.48 0.00 0.00 55.95 58.11 2yts s SER 3 Cb 0.01 -2.36 0.32 0.00 0.10 0.00 0.00 66.02 64.08 2yts s SER 3 CO -0.10 -3.96 2.15 0.61 0.98 0.00 0.00 173.24 172.92 2yts n GLY 4 N 0.64 5.20 3.64 7.32 0.00 -1.26 -4.87 105.19 115.85 2yts n GLY 4 Ca 0.05 -2.05 -0.10 0.00 0.00 0.00 0.00 46.02 43.92 2yts n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yts s SER 5 N -0.90 -0.73 -0.19 1.61 0.01 -1.26 -5.07 113.70 107.18 2yts s SER 5 Ca 0.54 1.30 -0.05 0.00 1.31 0.00 0.00 55.95 59.05 2yts s SER 5 Cb 0.42 1.31 -0.10 0.00 0.21 0.00 0.00 66.02 67.86 2yts s SER 5 CO -0.15 -0.22 -0.21 -0.24 0.41 0.00 0.00 173.24 172.83 2yts n SER 6 N 3.16 1.93 0.00 2.44 2.88 -1.26 -5.06 113.62 117.71 2yts n SER 6 Ca -0.16 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 2yts n SER 6 Cb 0.57 -0.44 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 2yts n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yts n GLY 7 N 2.16 3.57 3.79 0.46 0.00 -1.26 -5.09 105.19 108.82 2yts n GLY 7 Ca -0.36 -0.95 -0.23 0.00 0.00 0.00 0.00 46.02 44.48 2yts n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2yts s THR 8 N 0.00 4.29 0.36 2.61 -4.23 -1.26 -5.13 115.64 112.28 2yts s THR 8 Ca 0.00 -1.38 0.06 0.00 -1.18 0.00 0.00 61.69 59.19 2yts s THR 8 Cb 0.00 -3.27 -0.00 0.00 1.34 0.00 0.00 72.50 70.56 2yts s THR 8 CO 0.00 -0.27 0.51 -0.83 -0.54 0.00 0.00 174.62 173.49 2yts s GLY 9 N -3.56 1.65 -0.82 3.99 0.00 -1.26 -5.04 107.32 102.28 2yts s GLY 9 Ca 0.32 -1.45 -0.22 0.00 0.00 0.00 0.00 44.72 43.36 2yts s GLY 9 CO 0.23 -1.34 1.15 -1.83 0.00 0.00 0.00 173.10 171.31 2yts s GLU 10 N -4.24 3.35 0.05 2.90 -1.05 -1.26 -5.00 118.70 113.45 2yts s GLU 10 Ca 0.47 -1.08 0.08 0.00 -0.15 0.00 0.00 54.97 54.30 2yts s GLU 10 Cb -0.10 -4.63 -0.03 0.00 -0.44 0.00 0.00 34.13 28.93 2yts s GLU 10 CO 0.32 -1.92 -0.22 0.15 0.95 0.00 0.00 175.26 174.54 2yts s LYS 11 N 4.06 1.90 0.18 -4.83 1.02 -1.26 -5.04 119.74 115.77 2yts s LYS 11 Ca 0.31 -1.07 -0.06 0.00 0.02 0.00 0.00 55.97 55.17 2yts s LYS 11 Cb -0.09 -2.08 0.09 0.00 -0.52 0.00 0.00 37.83 35.23 2yts s LYS 11 CO 0.01 0.52 1.53 -1.00 -0.92 0.00 0.00 175.35 175.49 2yts h PRO 12 N 4.54 0.73 -5.30 -1.68 0.13 -1.95 -3.40 132.00 125.07 2yts h PRO 12 Ca -0.48 -0.39 -0.66 0.00 -0.87 0.00 0.00 66.00 63.61 2yts h PRO 12 Cb 1.15 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 32.14 2yts h PRO 12 CO 0.45 1.01 0.22 0.71 -0.23 0.00 0.00 178.00 180.16 2yts s TYR 13 N -4.28 2.97 -0.12 1.56 2.02 -1.26 -5.01 117.35 113.23 2yts s TYR 13 Ca -0.09 -0.31 -0.02 0.00 -0.37 0.00 0.00 57.07 56.28 2yts s TYR 13 Cb 0.12 -3.69 0.04 0.00 -0.40 0.00 0.00 41.96 38.03 2yts s TYR 13 CO 0.85 -1.11 0.01 0.42 -1.57 0.00 0.00 175.55 174.14 2yts s ILE 14 N 3.07 0.48 -0.60 2.71 -1.09 -1.26 -0.99 121.20 123.53 2yts s ILE 14 Ca 0.21 -0.15 -0.27 0.00 -2.23 0.00 0.00 60.65 58.21 2yts s ILE 14 Cb -0.16 -0.75 -0.01 0.00 -1.58 0.00 0.00 42.46 39.95 2yts s ILE 14 CO 0.15 0.10 1.77 0.00 -1.23 0.00 0.00 174.94 175.74 2yts h ASN 16 N 14.11 0.00 0.21 0.00 4.21 -1.95 1.55 115.58 133.70 2yts h ASN 16 Ca -0.27 0.00 0.01 0.00 1.21 0.00 0.00 56.30 57.25 2yts h ASN 16 Cb 1.15 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.32 2yts h ASN 16 CO 1.21 0.28 -0.33 -0.33 -1.29 0.00 0.00 177.43 176.97 2yts h GLU 17 N 0.00 -0.59 0.00 0.81 5.08 -1.98 -3.36 114.58 114.54 2yts h GLU 17 Ca -0.00 0.04 -0.35 0.00 -1.00 0.00 0.00 59.36 58.04 2yts h GLU 17 Cb 0.54 0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.87 2yts h GLU 17 CO 0.04 -0.39 -2.26 0.00 -1.00 0.00 0.00 179.01 175.39 2yts n GLY 19 N 2.04 1.26 3.88 0.00 0.00 0.53 -5.08 105.19 107.82 2yts n GLY 19 Ca -0.42 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.41 2yts n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yts n LYS 20 N -0.05 0.61 -4.16 1.61 5.02 -1.04 -4.86 118.16 115.29 2yts n LYS 20 Ca 0.00 -3.11 -0.10 0.00 -2.02 0.00 0.00 58.31 53.08 2yts n LYS 20 Cb 0.00 -0.24 -0.10 0.00 -0.02 0.00 0.00 35.03 34.67 2yts n LYS 20 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2yts s SER 21 N -4.57 0.85 0.32 4.39 1.04 -1.26 -0.97 113.70 113.49 2yts s SER 21 Ca 0.60 -1.07 -0.17 0.00 0.48 0.00 0.00 55.95 55.79 2yts s SER 21 Cb -0.05 0.16 0.03 0.00 0.10 0.00 0.00 66.02 66.26 2yts s SER 21 CO 0.38 -0.56 0.71 -0.36 0.98 0.00 0.00 173.24 174.39 2yts s PHE 22 N -3.78 0.05 0.00 5.02 0.40 -0.16 -4.95 117.98 114.57 2yts s PHE 22 Ca 0.15 -0.58 0.00 0.00 -0.60 0.00 0.00 56.93 55.90 2yts s PHE 22 Cb 0.07 0.67 0.00 0.00 0.51 0.00 0.00 43.02 44.27 2yts s PHE 22 CO -0.03 -1.34 0.00 0.44 0.70 0.00 0.00 175.22 174.98 2yts n ILE 23 N -0.49 0.00 -4.09 0.64 -6.64 -1.26 -4.03 119.36 103.49 2yts n ILE 23 Ca -0.05 -0.04 -0.34 0.00 -1.77 0.00 0.00 62.75 60.55 2yts n ILE 23 Cb 0.60 0.47 -0.14 0.00 -1.44 0.00 0.00 39.64 39.12 2yts n ILE 23 CO 0.00 0.00 0.00 -1.10 -1.77 0.00 0.00 176.55 173.68 2yts s GLN 24 N -1.58 3.32 0.65 6.28 -0.21 -1.26 -4.97 119.66 121.89 2yts s GLN 24 Ca 0.00 -0.66 0.20 0.00 0.02 0.00 0.00 55.36 54.91 2yts s GLN 24 Cb 0.00 -2.88 1.00 0.00 1.00 0.00 0.00 33.01 32.14 2yts s GLN 24 CO 0.00 -0.12 1.55 1.57 -2.12 0.00 0.00 175.29 176.17 2yts h LYS 25 N 7.82 0.00 0.09 2.91 -0.00 -2.00 0.33 116.57 125.73 2yts h LYS 25 Ca -0.39 0.00 -0.14 0.00 -0.00 0.00 0.00 60.65 60.12 2yts h LYS 25 Cb 1.17 0.00 0.01 0.00 -0.00 0.00 0.00 32.23 33.41 2yts h LYS 25 CO 0.60 0.00 -0.63 1.03 -0.00 0.00 0.00 179.45 180.45 2yts h SER 26 N 0.00 0.30 -0.93 7.07 0.87 -1.98 -2.53 113.55 116.35 2yts h SER 26 Ca 0.07 -0.95 0.15 0.00 -1.23 0.00 0.00 61.79 59.84 2yts h SER 26 Cb 1.38 -0.10 -0.09 0.00 -0.44 0.00 0.00 62.40 63.15 2yts h SER 26 CO -0.00 1.29 0.54 0.45 -0.53 0.00 0.00 176.83 178.58 2yts h HIS 27 N -0.58 0.95 0.22 2.24 3.86 -0.75 0.15 115.15 121.24 2yts h HIS 27 Ca -0.12 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.11 2yts h HIS 27 Cb 1.44 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 29.63 2yts h HIS 27 CO 0.21 0.28 -0.11 1.25 0.86 0.00 0.00 177.93 180.42 2yts h LEU 28 N 0.77 -0.25 -1.73 2.43 5.85 -1.61 -0.44 115.31 120.33 2yts h LEU 28 Ca 0.50 0.01 0.37 0.00 0.84 0.00 0.00 57.88 59.60 2yts h LEU 28 Cb 0.66 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.68 2yts h LEU 28 CO -0.34 0.12 0.87 0.78 -0.34 0.00 0.00 178.44 179.54 2yts h ASN 29 N -0.89 0.16 0.02 1.25 2.35 -1.31 0.71 115.58 117.88 2yts h ASN 29 Ca -0.03 0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 2yts h ASN 29 Cb 0.23 0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.62 2yts h ASN 29 CO 0.05 -0.01 -0.21 -0.09 -1.65 0.00 0.00 177.43 175.52 2yts h ARG 30 N 0.12 0.05 -0.85 0.81 2.43 -0.75 -3.34 114.38 112.84 2yts h ARG 30 Ca 0.66 -0.08 0.18 0.00 -0.81 0.00 0.00 59.98 59.94 2yts h ARG 30 Cb 2.30 0.03 -0.11 0.00 -0.42 0.00 0.00 29.97 31.77 2yts h ARG 30 CO -0.15 1.04 0.37 1.25 -1.51 0.00 0.00 179.97 180.96 2yts h HIS 31 N -0.90 0.62 -0.01 2.20 2.76 0.84 0.34 115.15 121.00 2yts h HIS 31 Ca -0.05 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2yts h HIS 31 Cb 1.12 -0.14 -0.00 0.00 1.55 0.00 0.00 27.41 29.94 2yts h HIS 31 CO 0.26 0.02 0.64 0.00 -1.30 0.00 0.00 177.93 177.55 2yts h ARG 32 N 0.45 0.00 -0.52 5.26 3.08 -1.30 0.15 114.38 121.49 2yts h ARG 32 Ca 0.50 0.00 0.15 0.00 0.07 0.00 0.00 59.98 60.70 2yts h ARG 32 Cb 0.85 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 2yts h ARG 32 CO -0.47 0.00 0.48 0.07 -1.07 0.00 0.00 179.97 178.99 2yts h ARG 33 N 0.00 0.00 -0.05 0.04 0.11 -0.51 0.36 114.38 114.34 2yts h ARG 33 Ca 0.01 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 60.01 2yts h ARG 33 Cb 1.28 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.35 2yts h ARG 33 CO -0.00 0.00 -0.30 -0.84 0.10 0.00 0.00 179.97 178.93 2yts h ILE 34 N 0.00 1.24 0.00 0.08 3.07 -0.91 -3.27 117.51 117.72 2yts h ILE 34 Ca 0.25 -1.12 -0.08 0.00 1.55 0.00 0.00 64.86 65.46 2yts h ILE 34 Cb 1.21 1.54 -0.01 0.00 -0.27 0.00 0.00 36.82 39.29 2yts h ILE 34 CO -0.00 0.33 -0.59 0.45 -1.05 0.00 0.00 178.15 177.28 2yts h HIS 35 N 0.08 0.00 -2.79 0.16 3.86 -0.52 -3.47 115.15 112.47 2yts h HIS 35 Ca 0.01 0.00 -0.58 0.00 -1.16 0.00 0.00 60.37 58.64 2yts h HIS 35 Cb 0.58 0.00 0.18 0.00 1.06 0.00 0.00 27.41 29.23 2yts h HIS 35 CO 0.00 0.73 -0.64 0.25 0.86 0.00 0.00 177.93 179.14 2yts n THR 36 N -4.58 1.51 -2.73 2.45 -2.24 -0.73 -4.99 114.28 102.97 2yts n THR 36 Ca -0.15 -0.47 -0.03 0.00 -2.27 0.00 0.00 64.05 61.13 2yts n THR 36 Cb 0.41 -0.52 0.02 0.00 -2.10 0.00 0.00 70.33 68.14 2yts n THR 36 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2yts s GLY 37 N -1.22 -1.62 0.31 3.38 0.00 -1.26 -4.93 107.32 101.98 2yts s GLY 37 Ca 0.64 0.21 -0.27 0.00 0.00 0.00 0.00 44.72 45.30 2yts s GLY 37 CO 0.60 4.03 1.00 1.85 0.00 0.00 0.00 173.10 180.57 2yts s GLU 38 N 1.02 4.58 0.38 2.90 2.12 -1.26 -4.99 118.70 123.44 2yts s GLU 38 Ca 0.25 1.50 -0.28 0.00 0.36 0.00 0.00 54.97 56.81 2yts s GLU 38 Cb 0.07 -2.94 -0.11 0.00 0.26 0.00 0.00 34.13 31.41 2yts s GLU 38 CO -0.09 0.24 1.43 1.17 -0.54 0.00 0.00 175.26 177.47 2yts n LYS 39 N 0.78 2.47 -2.20 4.30 4.81 -1.26 -4.93 118.16 122.13 2yts n LYS 39 Ca 0.01 0.87 -0.42 0.00 -0.87 0.00 0.00 58.31 57.90 2yts n LYS 39 Cb 0.48 -2.57 -0.03 0.00 0.02 0.00 0.00 35.03 32.93 2yts n LYS 39 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2yts s PRO 40 N -2.09 4.33 -0.39 1.64 0.04 -1.26 -4.89 135.00 132.38 2yts s PRO 40 Ca 0.55 2.03 -0.39 0.00 0.04 0.00 0.00 61.00 63.23 2yts s PRO 40 Cb -0.50 -3.28 -0.15 0.00 0.04 0.00 0.00 34.50 30.62 2yts s PRO 40 CO 0.63 -0.42 2.09 0.43 0.04 0.00 0.00 177.00 179.76 2yts n SER 41 N 4.01 1.74 0.00 6.66 7.64 -1.26 -4.63 113.62 127.79 2yts n SER 41 Ca 0.11 0.62 0.00 0.00 1.01 0.00 0.00 58.87 60.61 2yts n SER 41 Cb 0.43 -1.13 0.00 0.00 -1.01 0.00 0.00 64.21 62.50 2yts n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yts n GLY 42 N 6.39 2.75 3.77 0.23 0.00 -1.26 -5.05 105.19 112.02 2yts n GLY 42 Ca 0.43 -2.08 -0.37 0.00 0.00 0.00 0.00 46.02 44.00 2yts n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yts s PRO 43 N -2.38 3.65 0.25 1.61 0.04 -1.26 -4.88 135.00 132.04 2yts s PRO 43 Ca 0.00 1.73 -0.02 0.00 0.04 0.00 0.00 61.00 62.76 2yts s PRO 43 Cb 0.00 -2.30 0.54 0.00 0.04 0.00 0.00 34.50 32.77 2yts s PRO 43 CO 0.00 -0.63 1.31 -1.13 0.04 0.00 0.00 177.00 176.59 2yts n SER 44 N -0.70 -0.18 -0.04 6.66 3.41 -1.26 0.11 113.62 121.63 2yts n SER 44 Ca 0.08 1.43 -0.08 0.00 -0.26 0.00 0.00 58.87 60.04 2yts n SER 44 Cb 0.49 -0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 63.93 2yts n SER 44 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2yts h SER 45 N 0.00 -0.24 0.00 4.04 0.02 -2.01 -3.53 113.55 111.82 2yts h SER 45 Ca 0.46 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.48 2yts h SER 45 Cb 0.87 0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2yts h SER 45 CO -0.82 -0.09 0.00 0.61 -1.14 0.00 0.00 176.83 175.39