#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2el6 n SER 2 N 0.00 -4.96 -4.38 1.61 7.64 -1.26 -4.92 113.62 107.35 2el6 n SER 2 Ca 0.00 -0.64 -0.45 0.00 1.01 0.00 0.00 58.87 58.79 2el6 n SER 2 Cb 0.00 -4.66 -0.01 0.00 -1.01 0.00 0.00 64.21 58.54 2el6 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2el6 s SER 3 N -3.54 7.12 -0.06 6.43 0.15 -1.26 -4.82 113.70 117.71 2el6 s SER 3 Ca 0.48 -3.17 -0.05 0.00 0.70 0.00 0.00 55.95 53.91 2el6 s SER 3 Cb -0.22 -2.28 0.02 0.00 -1.71 0.00 0.00 66.02 61.83 2el6 s SER 3 CO 0.76 -0.52 0.10 0.61 1.20 0.00 0.00 173.24 175.39 2el6 n GLY 4 N 3.51 -5.25 2.93 9.45 0.00 -1.26 -5.05 105.19 109.51 2el6 n GLY 4 Ca 0.26 0.78 -0.15 0.00 0.00 0.00 0.00 46.02 46.91 2el6 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2el6 s SER 5 N -0.59 0.37 -0.14 1.61 1.04 -1.26 -5.13 113.70 109.60 2el6 s SER 5 Ca -0.12 0.43 -0.02 0.00 0.48 0.00 0.00 55.95 56.72 2el6 s SER 5 Cb 0.01 0.41 0.05 0.00 0.10 0.00 0.00 66.02 66.58 2el6 s SER 5 CO 0.31 -0.22 0.02 -0.94 0.98 0.00 0.00 173.24 173.40 2el6 s SER 6 N 2.03 2.29 0.00 7.02 1.04 -1.26 -5.08 113.70 119.74 2el6 s SER 6 Ca -0.01 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 55.94 2el6 s SER 6 Cb -0.12 -0.52 0.00 0.00 0.10 0.00 0.00 66.02 65.49 2el6 s SER 6 CO -0.07 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.50 2el6 n GLY 7 N 5.10 2.23 3.07 7.32 0.00 -1.26 -5.06 105.19 116.59 2el6 n GLY 7 Ca -0.08 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.00 2el6 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2el6 s ALA 8 N -1.53 1.71 0.15 4.61 0.00 -1.26 -5.13 121.76 120.32 2el6 s ALA 8 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.23 2el6 s ALA 8 Cb 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 23.12 22.31 2el6 s ALA 8 CO 0.00 -0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.14 2el6 n GLY 9 N 4.10 1.74 2.86 0.00 0.00 -1.26 -5.13 105.19 107.51 2el6 n GLY 9 Ca -0.19 -1.84 -0.18 0.00 0.00 0.00 0.00 46.02 43.80 2el6 n GLY 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2el6 s VAL 10 N 2.50 0.37 0.02 1.61 0.11 -1.26 -5.15 120.40 118.61 2el6 s VAL 10 Ca 0.00 -0.03 0.03 0.00 -2.93 0.00 0.00 61.98 59.05 2el6 s VAL 10 Cb 0.00 -0.42 -0.02 0.00 -1.53 0.00 0.00 36.38 34.41 2el6 s VAL 10 CO 0.00 0.18 -0.10 0.20 -3.33 0.00 0.00 175.10 172.05 2el6 s ASN 11 N 0.92 1.17 0.55 3.54 -0.87 -1.26 -5.03 114.94 113.96 2el6 s ASN 11 Ca -0.11 -0.36 0.34 0.00 -1.57 0.00 0.00 52.86 51.16 2el6 s ASN 11 Cb -0.14 -0.07 1.41 0.00 -0.02 0.00 0.00 41.25 42.44 2el6 s ASN 11 CO -0.01 -0.00 2.00 1.55 -2.57 0.00 0.00 177.10 178.07 2el6 h PRO 12 N 5.20 0.00 -3.44 -0.60 0.13 -1.93 -3.42 132.00 127.94 2el6 h PRO 12 Ca -0.34 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.43 2el6 h PRO 12 Cb 1.19 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.95 2el6 h PRO 12 CO 0.45 0.01 -0.74 0.71 -0.23 0.00 0.00 178.00 178.20 2el6 s TYR 13 N -3.70 0.13 -0.10 1.56 2.02 -1.16 -4.98 117.35 111.12 2el6 s TYR 13 Ca 0.01 0.17 0.02 0.00 -0.37 0.00 0.00 57.07 56.89 2el6 s TYR 13 Cb 0.09 -0.44 0.02 0.00 -0.40 0.00 0.00 41.96 41.23 2el6 s TYR 13 CO 0.54 -0.17 -0.14 0.21 -1.57 0.00 0.00 175.55 174.42 2el6 s LYS 14 N 1.77 2.04 -0.07 -0.62 2.36 -1.26 -0.71 119.74 123.25 2el6 s LYS 14 Ca 0.00 -0.50 -0.31 0.00 -2.55 0.00 0.00 55.97 52.61 2el6 s LYS 14 Cb -0.12 -1.76 -0.09 0.00 -1.05 0.00 0.00 37.83 34.80 2el6 s LYS 14 CO -0.03 -0.07 2.00 0.00 1.55 0.00 0.00 175.35 178.80 2el6 h SER 16 N 10.95 0.00 0.45 0.00 0.02 -1.99 -3.27 113.55 119.71 2el6 h SER 16 Ca -0.47 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.46 2el6 h SER 16 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 2el6 h SER 16 CO 0.95 0.38 -0.21 1.56 -1.14 0.00 0.00 176.83 178.36 2el6 h GLN 17 N 0.00 -0.58 0.00 3.45 1.08 -1.96 -3.47 115.11 113.64 2el6 h GLN 17 Ca -0.00 0.04 -0.25 0.00 -1.45 0.00 0.00 58.65 56.98 2el6 h GLN 17 Cb 0.71 0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 28.24 2el6 h GLN 17 CO 0.05 -0.39 -0.15 0.00 -0.95 0.00 0.00 178.83 177.40 2el6 n GLU 19 N -0.84 1.21 -2.53 0.00 0.28 -1.26 -4.50 120.64 112.99 2el6 n GLU 19 Ca -0.04 -0.49 -0.26 0.00 -0.16 0.00 0.00 57.16 56.21 2el6 n GLU 19 Cb 0.26 -1.19 0.02 0.00 1.43 0.00 0.00 31.44 31.97 2el6 n GLU 19 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2el6 s LYS 20 N -0.54 3.00 0.16 3.44 -0.14 -1.26 -4.96 119.74 119.44 2el6 s LYS 20 Ca 0.09 -0.08 -0.23 0.00 -1.36 0.00 0.00 55.97 54.39 2el6 s LYS 20 Cb 0.08 -2.34 0.07 0.00 -1.68 0.00 0.00 37.83 33.96 2el6 s LYS 20 CO 0.02 -0.57 0.60 -1.54 -0.76 0.00 0.00 175.35 173.09 2el6 s SER 21 N -4.27 -0.57 -0.01 2.83 1.04 -1.26 -0.79 113.70 110.67 2el6 s SER 21 Ca 0.52 0.01 -0.18 0.00 0.48 0.00 0.00 55.95 56.78 2el6 s SER 21 Cb -0.10 0.60 0.03 0.00 0.10 0.00 0.00 66.02 66.65 2el6 s SER 21 CO 0.44 -0.96 0.39 -0.36 0.98 0.00 0.00 173.24 173.73 2el6 s PHE 22 N -3.71 -0.28 -0.28 5.02 0.40 0.11 -4.93 117.98 114.31 2el6 s PHE 22 Ca 0.01 0.42 0.00 0.00 -0.60 0.00 0.00 56.93 56.76 2el6 s PHE 22 Cb -0.01 0.17 0.27 0.00 0.51 0.00 0.00 43.02 43.96 2el6 s PHE 22 CO -0.13 -0.46 1.76 0.43 0.70 0.00 0.00 175.22 177.53 2el6 n SER 23 N 1.08 5.08 -3.57 1.36 7.64 -1.26 -2.99 113.62 120.96 2el6 n SER 23 Ca -0.21 -2.95 -0.02 0.00 1.01 0.00 0.00 58.87 56.70 2el6 n SER 23 Cb 0.57 -0.88 -0.05 0.00 -1.01 0.00 0.00 64.21 62.84 2el6 n SER 23 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2el6 s GLY 24 N 0.00 -0.43 0.23 0.23 0.00 -1.26 -4.95 107.32 101.15 2el6 s GLY 24 Ca 0.30 2.71 -0.15 0.00 0.00 0.00 0.00 44.72 47.58 2el6 s GLY 24 CO 0.02 2.92 1.57 1.70 0.00 0.00 0.00 173.10 179.31 2el6 h LYS 25 N 7.34 -0.03 0.08 2.90 1.63 -1.94 -1.97 116.57 124.59 2el6 h LYS 25 Ca -0.21 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.59 2el6 h LYS 25 Cb 1.14 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.77 2el6 h LYS 25 CO 0.12 -0.02 -0.12 1.25 -3.45 0.00 0.00 179.45 177.24 2el6 h LEU 26 N -0.03 -0.33 -0.55 5.20 7.12 -1.98 -2.40 115.31 122.34 2el6 h LEU 26 Ca 0.36 0.03 0.15 0.00 0.13 0.00 0.00 57.88 58.55 2el6 h LEU 26 Cb 0.61 0.11 -0.10 0.00 -0.53 0.00 0.00 40.66 40.75 2el6 h LEU 26 CO -0.91 -0.14 0.01 0.54 -0.13 0.00 0.00 178.44 177.81 2el6 n ARG 27 N -3.03 -0.04 0.42 1.25 5.12 -0.78 0.64 116.66 120.23 2el6 n ARG 27 Ca -0.02 0.83 -0.17 0.00 -1.93 0.00 0.00 57.85 56.56 2el6 n ARG 27 Cb 0.10 -1.31 -0.08 0.00 -1.16 0.00 0.00 32.46 30.01 2el6 n ARG 27 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2el6 h LEU 28 N 0.00 -0.94 -0.36 0.55 5.85 -1.03 -1.24 115.31 118.12 2el6 h LEU 28 Ca 0.33 0.04 0.05 0.00 0.84 0.00 0.00 57.88 59.13 2el6 h LEU 28 Cb 0.68 0.25 -0.08 0.00 0.37 0.00 0.00 40.66 41.88 2el6 h LEU 28 CO -0.52 -0.65 -0.54 -0.07 -0.34 0.00 0.00 178.44 176.31 2el6 h LEU 29 N -1.07 -1.80 -1.75 2.25 -0.00 0.61 0.70 115.31 114.26 2el6 h LEU 29 Ca -0.11 0.23 0.25 0.00 -0.00 0.00 0.00 57.88 58.26 2el6 h LEU 29 Cb 0.83 0.73 -0.06 0.00 -0.00 0.00 0.00 40.66 42.17 2el6 h LEU 29 CO 0.17 -0.40 0.65 1.62 -0.00 0.00 0.00 178.44 180.48 2el6 h VAL 30 N -0.41 0.57 0.06 1.22 3.04 -1.29 0.33 116.25 119.77 2el6 h VAL 30 Ca 0.07 -0.06 -0.24 0.00 -1.01 0.00 0.00 66.70 65.45 2el6 h VAL 30 Cb 0.59 0.37 -0.01 0.00 -2.01 0.00 0.00 31.29 30.22 2el6 h VAL 30 CO -0.56 0.03 -1.09 -0.74 -1.01 0.00 0.00 177.57 174.20 2el6 h HIS 31 N 0.19 0.27 0.00 3.17 -0.00 0.86 -3.21 115.15 116.43 2el6 h HIS 31 Ca 0.48 -0.19 -0.01 0.00 -0.00 0.00 0.00 60.37 60.65 2el6 h HIS 31 Cb 1.56 -0.01 -0.00 0.00 -0.00 0.00 0.00 27.41 28.96 2el6 h HIS 31 CO -0.00 1.13 -0.05 1.96 -0.00 0.00 0.00 177.93 180.97 2el6 h GLN 32 N 0.05 0.00 -0.27 5.26 4.20 0.41 -2.83 115.11 121.93 2el6 h GLN 32 Ca -0.07 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 2el6 h GLN 32 Cb 1.83 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.59 2el6 h GLN 32 CO 0.16 0.05 -0.04 0.07 -0.67 0.00 0.00 178.83 178.40 2el6 h ARG 33 N 0.00 0.41 -0.37 1.46 0.11 -1.28 -2.25 114.38 112.47 2el6 h ARG 33 Ca -0.00 -0.09 0.05 0.00 0.10 0.00 0.00 59.98 60.05 2el6 h ARG 33 Cb 0.53 -0.06 -0.02 0.00 1.11 0.00 0.00 29.97 31.53 2el6 h ARG 33 CO 0.01 0.47 0.25 0.52 0.10 0.00 0.00 179.97 181.32 2el6 h MET 34 N 0.40 0.25 -1.97 0.08 2.86 -1.66 -2.38 114.93 112.51 2el6 h MET 34 Ca 0.09 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.64 2el6 h MET 34 Cb 0.33 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.90 2el6 h MET 34 CO 0.01 0.17 -0.07 0.72 1.06 0.00 0.00 176.91 178.80 2el6 n HIS 35 N -4.48 0.11 -4.06 -0.22 8.25 -0.85 -4.87 115.22 109.11 2el6 n HIS 35 Ca 0.04 -1.19 -0.24 0.00 -0.26 0.00 0.00 57.72 56.07 2el6 n HIS 35 Cb 0.25 -0.81 -0.04 0.00 1.12 0.00 0.00 29.99 30.51 2el6 n HIS 35 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2el6 s THR 36 N 0.08 4.68 -0.31 1.59 -1.32 -0.90 -5.04 115.64 114.42 2el6 s THR 36 Ca 0.19 -1.16 0.10 0.00 -1.21 0.00 0.00 61.69 59.62 2el6 s THR 36 Cb 0.10 -3.47 0.46 0.00 -1.51 0.00 0.00 72.50 68.08 2el6 s THR 36 CO -0.00 -0.24 1.15 0.54 -2.21 0.00 0.00 174.62 173.86 2el6 n ARG 37 N -0.87 3.16 -0.76 7.08 1.74 -1.26 -4.84 116.66 120.91 2el6 n ARG 37 Ca -0.08 -4.07 -0.13 0.00 -0.77 0.00 0.00 57.85 52.79 2el6 n ARG 37 Cb 0.56 -2.12 0.04 0.00 -1.02 0.00 0.00 32.46 29.93 2el6 n ARG 37 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 2el6 n GLU 38 N -0.62 1.64 -3.79 5.56 0.28 -1.26 -4.83 120.64 117.62 2el6 n GLU 38 Ca 0.35 -1.30 -0.13 0.00 -0.16 0.00 0.00 57.16 55.92 2el6 n GLU 38 Cb 0.88 -1.51 -0.10 0.00 1.43 0.00 0.00 31.44 32.14 2el6 n GLU 38 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2el6 s LYS 39 N -1.50 0.51 0.10 3.44 1.02 -1.26 -5.14 119.74 116.90 2el6 s LYS 39 Ca 0.26 -0.01 -0.31 0.00 0.02 0.00 0.00 55.97 55.93 2el6 s LYS 39 Cb 0.20 0.23 -0.07 0.00 -0.52 0.00 0.00 37.83 37.67 2el6 s LYS 39 CO 0.01 -0.12 1.37 -1.25 -0.92 0.00 0.00 175.35 174.44 2el6 s PRO 40 N -0.78 4.33 1.22 -1.68 0.04 -1.26 -5.01 135.00 131.85 2el6 s PRO 40 Ca -0.09 2.03 -0.20 0.00 0.04 0.00 0.00 61.00 62.79 2el6 s PRO 40 Cb -0.04 -3.29 0.30 0.00 0.04 0.00 0.00 34.50 31.51 2el6 s PRO 40 CO 0.02 -0.43 0.69 -1.13 0.04 0.00 0.00 177.00 176.19 2el6 n SER 41 N 4.10 -3.73 -4.22 6.66 3.41 -1.26 -5.06 113.62 113.52 2el6 n SER 41 Ca 0.11 -0.70 -0.13 0.00 -0.26 0.00 0.00 58.87 57.90 2el6 n SER 41 Cb 0.43 -0.84 -0.10 0.00 -0.26 0.00 0.00 64.21 63.44 2el6 n SER 41 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2el6 s GLY 42 N -2.75 1.10 0.00 5.00 0.00 -1.26 -5.02 107.32 104.40 2el6 s GLY 42 Ca 0.53 -1.53 0.09 0.00 0.00 0.00 0.00 44.72 43.81 2el6 s GLY 42 CO 0.45 -1.50 0.96 -1.55 0.00 0.00 0.00 173.10 171.46 2el6 n PRO 43 N -0.19 0.49 -1.14 2.90 -0.04 -1.26 -3.97 135.00 131.80 2el6 n PRO 43 Ca -0.08 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.02 2el6 n PRO 43 Cb 0.63 -1.28 -0.03 0.00 -0.04 0.00 0.00 33.50 32.78 2el6 n PRO 43 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2el6 n SER 44 N -0.78 4.04 -3.85 3.54 2.88 -1.26 -4.52 113.62 113.66 2el6 n SER 44 Ca 0.07 -2.59 -0.26 0.00 -1.33 0.00 0.00 58.87 54.76 2el6 n SER 44 Cb 0.03 -1.24 -0.04 0.00 -0.75 0.00 0.00 64.21 62.21 2el6 n SER 44 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2el6 n SER 45 N 5.90 -0.55 0.00 -3.46 7.64 -1.26 -5.26 113.62 116.63 2el6 n SER 45 Ca 0.51 -0.91 0.00 0.00 1.01 0.00 0.00 58.87 59.48 2el6 n SER 45 Cb 0.30 -1.12 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 2el6 n SER 45 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64