#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2el6 s SER 2 N 0.00 4.53 -0.57 1.61 0.15 -1.26 -4.76 113.70 113.40 2el6 s SER 2 Ca 0.00 2.18 -0.37 0.00 0.70 0.00 0.00 55.95 58.46 2el6 s SER 2 Cb 0.00 -2.57 -0.18 0.00 -1.71 0.00 0.00 66.02 61.56 2el6 s SER 2 CO 0.00 -2.03 2.08 -0.24 1.20 0.00 0.00 173.24 174.25 2el6 n SER 3 N -2.69 0.58 -3.71 5.45 2.88 -1.26 -4.78 113.62 110.09 2el6 n SER 3 Ca 0.12 0.50 -0.41 0.00 -1.33 0.00 0.00 58.87 57.75 2el6 n SER 3 Cb 0.51 -0.82 0.00 0.00 -0.75 0.00 0.00 64.21 63.15 2el6 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2el6 n GLY 4 N 6.59 5.04 3.66 0.46 0.00 -1.26 -4.99 105.19 114.69 2el6 n GLY 4 Ca 0.53 -2.14 -0.51 0.00 0.00 0.00 0.00 46.02 43.90 2el6 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2el6 n SER 5 N 2.65 2.64 -0.32 1.61 7.64 -1.26 -4.82 113.62 121.76 2el6 n SER 5 Ca 0.48 1.06 0.16 0.00 1.01 0.00 0.00 58.87 61.59 2el6 n SER 5 Cb 0.31 -1.29 0.34 0.00 -1.01 0.00 0.00 64.21 62.55 2el6 n SER 5 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2el6 h SER 6 N 6.60 -0.10 -4.93 6.43 4.64 -2.03 -3.42 113.55 120.74 2el6 h SER 6 Ca -0.47 0.23 -0.05 0.00 -0.47 0.00 0.00 61.79 61.04 2el6 h SER 6 Cb 1.29 0.33 -0.19 0.00 -0.31 0.00 0.00 62.40 63.53 2el6 h SER 6 CO 0.89 -0.26 0.22 -0.83 -0.87 0.00 0.00 176.83 175.98 2el6 s GLY 7 N -4.15 -0.56 0.05 -0.77 0.00 -1.26 -5.09 107.32 95.55 2el6 s GLY 7 Ca -0.12 1.32 -0.03 0.00 0.00 0.00 0.00 44.72 45.89 2el6 s GLY 7 CO 0.78 0.91 -0.06 0.00 0.00 0.00 0.00 173.10 174.73 2el6 n ALA 8 N 0.80 2.65 -3.31 3.20 0.00 -1.26 -5.06 120.51 117.54 2el6 n ALA 8 Ca -0.18 -0.13 -0.07 0.00 0.00 0.00 0.00 53.44 53.06 2el6 n ALA 8 Cb 0.58 0.21 -0.06 0.00 0.00 0.00 0.00 19.45 20.17 2el6 n ALA 8 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2el6 s GLY 9 N -4.12 -0.54 0.27 0.00 0.00 -1.26 -5.15 107.32 96.52 2el6 s GLY 9 Ca -0.05 1.02 -0.19 0.00 0.00 0.00 0.00 44.72 45.50 2el6 s GLY 9 CO 0.07 2.84 0.76 0.54 0.00 0.00 0.00 173.10 177.31 2el6 s VAL 10 N 2.61 4.55 0.01 1.40 0.11 -1.26 -5.08 120.40 122.73 2el6 s VAL 10 Ca 0.14 1.27 0.06 0.00 -2.93 0.00 0.00 61.98 60.52 2el6 s VAL 10 Cb -0.15 -3.80 -0.02 0.00 -1.53 0.00 0.00 36.38 30.88 2el6 s VAL 10 CO -0.18 0.07 -0.18 0.20 -3.33 0.00 0.00 175.10 171.67 2el6 s ASN 11 N -1.84 2.17 0.08 3.54 0.01 -1.26 -5.02 114.94 112.63 2el6 s ASN 11 Ca 0.48 -0.40 0.17 0.00 -0.71 0.00 0.00 52.86 52.40 2el6 s ASN 11 Cb -0.15 -0.21 0.72 0.00 0.41 0.00 0.00 41.25 42.02 2el6 s ASN 11 CO 0.20 0.18 1.53 -0.81 -1.51 0.00 0.00 177.10 176.70 2el6 n PRO 12 N 2.33 0.06 -3.63 -0.60 -0.04 -1.26 -4.52 135.00 127.34 2el6 n PRO 12 Ca -0.16 0.31 -0.19 0.00 -0.04 0.00 0.00 63.50 63.43 2el6 n PRO 12 Cb 0.54 -1.62 -0.15 0.00 -0.04 0.00 0.00 33.50 32.23 2el6 n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2el6 s TYR 13 N -3.10 -0.13 -0.19 0.54 2.02 -1.16 -5.00 117.35 110.32 2el6 s TYR 13 Ca 0.06 0.39 0.01 0.00 -0.37 0.00 0.00 57.07 57.16 2el6 s TYR 13 Cb 0.09 -0.35 0.02 0.00 -0.40 0.00 0.00 41.96 41.32 2el6 s TYR 13 CO 0.30 -0.36 -0.18 0.21 -1.57 0.00 0.00 175.55 173.94 2el6 s LYS 14 N 2.27 2.90 -0.22 -0.62 2.36 -1.26 -0.28 119.74 124.89 2el6 s LYS 14 Ca 0.04 -0.90 -0.39 0.00 -2.55 0.00 0.00 55.97 52.17 2el6 s LYS 14 Cb -0.13 -2.62 -0.15 0.00 -1.05 0.00 0.00 37.83 33.88 2el6 s LYS 14 CO -0.07 -0.26 1.74 0.00 1.55 0.00 0.00 175.35 178.31 2el6 h SER 16 N 7.38 0.12 0.65 0.00 0.02 -1.98 -3.31 113.55 116.42 2el6 h SER 16 Ca -0.47 -0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 60.38 2el6 h SER 16 Cb 1.31 -0.03 0.01 0.00 0.14 0.00 0.00 62.40 63.82 2el6 h SER 16 CO 0.95 0.69 -0.31 1.56 -1.14 0.00 0.00 176.83 178.57 2el6 h GLN 17 N 0.08 -0.84 0.00 3.45 1.08 -1.95 -3.47 115.11 113.46 2el6 h GLN 17 Ca -0.01 0.06 -0.32 0.00 -1.45 0.00 0.00 58.65 56.93 2el6 h GLN 17 Cb 1.07 0.19 -0.05 0.00 -0.05 0.00 0.00 27.48 28.64 2el6 h GLN 17 CO 0.08 -0.56 -0.21 0.00 -0.95 0.00 0.00 178.83 177.20 2el6 n GLU 19 N -0.80 1.19 -3.70 0.00 0.28 -1.26 -4.46 120.64 111.88 2el6 n GLU 19 Ca -0.07 -0.38 -0.23 0.00 -0.16 0.00 0.00 57.16 56.31 2el6 n GLU 19 Cb 0.32 -1.15 -0.02 0.00 1.43 0.00 0.00 31.44 32.02 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 -0.44 3.47 0.11 3.44 -0.14 -1.26 -4.96 119.74 119.95 2el6 s LYS 20 Ca 0.08 -0.54 -0.21 0.00 -1.36 0.00 0.00 55.97 53.94 2el6 s LYS 20 Cb 0.06 -2.80 0.05 0.00 -1.68 0.00 0.00 37.83 33.47 2el6 s LYS 20 CO 0.00 0.32 0.51 -1.54 -0.76 0.00 0.00 175.35 173.88 2el6 s SER 21 N -3.88 -0.42 0.02 2.83 1.04 -1.26 0.12 113.70 112.15 2el6 s SER 21 Ca 0.37 -0.05 -0.13 0.00 0.48 0.00 0.00 55.95 56.63 2el6 s SER 21 Cb -0.10 0.52 0.02 0.00 0.10 0.00 0.00 66.02 66.56 2el6 s SER 21 CO 0.32 -0.85 0.27 -0.36 0.98 0.00 0.00 173.24 173.60 2el6 s PHE 22 N -3.34 -0.08 -0.24 5.02 0.40 0.62 -4.92 117.98 115.44 2el6 s PHE 22 Ca -0.00 -0.01 0.27 0.00 -0.60 0.00 0.00 56.93 56.59 2el6 s PHE 22 Cb 0.00 0.06 0.71 0.00 0.51 0.00 0.00 43.02 44.30 2el6 s PHE 22 CO -0.09 -0.44 1.74 0.77 0.70 0.00 0.00 175.22 177.91 2el6 h SER 23 N 3.53 0.00 -3.62 1.36 0.02 -1.96 -3.08 113.55 109.80 2el6 h SER 23 Ca -0.31 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 59.96 2el6 h SER 23 Cb 1.19 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 63.55 2el6 h SER 23 CO 0.44 0.01 -0.70 -0.83 -1.14 0.00 0.00 176.83 174.61 2el6 s GLY 24 N -4.20 1.74 0.08 -3.77 0.00 -1.26 -4.69 107.32 95.21 2el6 s GLY 24 Ca 0.05 -0.98 -0.29 0.00 0.00 0.00 0.00 44.72 43.50 2el6 s GLY 24 CO 0.63 -0.82 1.68 1.70 0.00 0.00 0.00 173.10 176.28 2el6 h LYS 25 N 4.73 -0.50 -0.03 2.90 1.63 -1.95 -3.13 116.57 120.23 2el6 h LYS 25 Ca -0.48 0.03 0.01 0.00 -0.85 0.00 0.00 60.65 59.36 2el6 h LYS 25 Cb 1.17 0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.88 2el6 h LYS 25 CO 0.53 -0.33 -0.34 1.25 -3.45 0.00 0.00 179.45 177.12 2el6 h LEU 26 N -0.52 -1.04 -0.66 5.20 7.12 -1.99 -1.53 115.31 121.90 2el6 h LEU 26 Ca -0.05 0.12 0.18 0.00 0.13 0.00 0.00 57.88 58.25 2el6 h LEU 26 Cb 0.40 0.40 -0.12 0.00 -0.53 0.00 0.00 40.66 40.80 2el6 h LEU 26 CO 0.09 -0.32 -0.01 0.54 -0.13 0.00 0.00 178.44 178.61 2el6 n ARG 27 N -4.33 -0.05 0.43 1.25 5.12 -1.22 0.25 116.66 118.11 2el6 n ARG 27 Ca -0.04 0.99 -0.17 0.00 -1.93 0.00 0.00 57.85 56.70 2el6 n ARG 27 Cb 0.24 -1.56 -0.08 0.00 -1.16 0.00 0.00 32.46 29.90 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 -0.93 -0.41 0.55 5.85 -1.24 -1.50 115.31 117.63 2el6 h LEU 28 Ca 0.39 0.03 0.05 0.00 0.84 0.00 0.00 57.88 59.19 2el6 h LEU 28 Cb 0.78 0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.98 2el6 h LEU 28 CO -0.62 -0.66 -0.45 -0.07 -0.34 0.00 0.00 178.44 176.30 2el6 h LEU 29 N -1.12 -1.53 -1.85 2.25 -0.00 0.20 0.79 115.31 114.04 2el6 h LEU 29 Ca -0.11 0.21 0.26 0.00 -0.00 0.00 0.00 57.88 58.24 2el6 h LEU 29 Cb 0.84 0.64 -0.05 0.00 -0.00 0.00 0.00 40.66 42.09 2el6 h LEU 29 CO 0.19 -0.30 0.66 1.62 -0.00 0.00 0.00 178.44 180.61 2el6 h VAL 30 N -0.26 0.55 0.00 1.22 3.04 -1.28 0.47 116.25 119.99 2el6 h VAL 30 Ca 0.07 -0.04 -0.21 0.00 -1.01 0.00 0.00 66.70 65.51 2el6 h VAL 30 Cb 0.45 0.43 -0.03 0.00 -2.01 0.00 0.00 31.29 30.13 2el6 h VAL 30 CO -0.53 0.02 -1.01 -0.74 -1.01 0.00 0.00 177.57 174.31 2el6 h HIS 31 N 0.11 0.00 0.00 3.17 -0.00 0.96 -3.22 115.15 116.17 2el6 h HIS 31 Ca 0.47 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.80 2el6 h HIS 31 Cb 1.66 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 29.07 2el6 h HIS 31 CO -0.00 0.98 -0.16 1.96 -0.00 0.00 0.00 177.93 180.72 2el6 h GLN 32 N 0.00 0.00 -0.32 5.26 4.20 0.51 -3.01 115.11 121.76 2el6 h GLN 32 Ca -0.02 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 2el6 h GLN 32 Cb 1.76 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.53 2el6 h GLN 32 CO 0.13 0.16 0.08 0.07 -0.67 0.00 0.00 178.83 178.60 2el6 h ARG 33 N 0.00 0.46 -0.78 1.46 0.11 -1.31 -2.20 114.38 112.12 2el6 h ARG 33 Ca -0.00 -0.07 0.11 0.00 0.10 0.00 0.00 59.98 60.12 2el6 h ARG 33 Cb 0.74 -0.08 -0.05 0.00 1.11 0.00 0.00 29.97 31.69 2el6 h ARG 33 CO 0.02 0.42 0.51 0.52 0.10 0.00 0.00 179.97 181.54 2el6 h MET 34 N 0.45 0.63 -2.00 0.08 2.86 -1.69 -2.21 114.93 113.05 2el6 h MET 34 Ca 0.11 -0.04 -0.10 0.00 -2.06 0.00 0.00 59.70 57.61 2el6 h MET 34 Cb 0.17 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.65 2el6 h MET 34 CO -0.01 0.41 -0.19 0.72 1.06 0.00 0.00 176.91 178.91 2el6 n HIS 35 N -4.51 0.02 -4.07 -0.22 8.25 -0.83 -4.85 115.22 109.01 2el6 n HIS 35 Ca 0.14 -1.26 -0.26 0.00 -0.26 0.00 0.00 57.72 56.08 2el6 n HIS 35 Cb 0.38 -1.05 -0.05 0.00 1.12 0.00 0.00 29.99 30.39 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 0.47 2.04 -0.96 1.59 -1.32 -0.83 -5.07 115.64 111.55 2el6 s THR 36 Ca 0.33 -1.64 -0.15 0.00 -1.21 0.00 0.00 61.69 59.03 2el6 s THR 36 Cb 0.16 -2.68 0.19 0.00 -1.51 0.00 0.00 72.50 68.66 2el6 s THR 36 CO -0.00 0.00 1.04 -0.13 -2.21 0.00 0.00 174.62 173.32 2el6 s ARG 37 N -4.03 3.78 -0.15 7.08 1.81 -1.26 -4.72 118.95 121.45 2el6 s ARG 37 Ca 0.36 -2.39 0.00 0.00 -1.72 0.00 0.00 55.73 51.99 2el6 s ARG 37 Cb 0.01 -4.70 -0.10 0.00 -0.45 0.00 0.00 34.95 29.72 2el6 s ARG 37 CO 0.21 -1.51 -0.14 -1.91 -0.68 0.00 0.00 175.30 171.27 2el6 n GLU 38 N 4.82 0.38 -4.71 3.54 2.13 -1.26 -4.98 120.64 120.55 2el6 n GLU 38 Ca 0.22 0.09 -0.33 0.00 0.66 0.00 0.00 57.16 57.81 2el6 n GLU 38 Cb 0.46 -1.28 -0.14 0.00 0.27 0.00 0.00 31.44 30.75 2el6 n GLU 38 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2el6 s LYS 39 N -2.30 3.36 0.52 5.31 2.20 -1.26 -5.11 119.74 122.46 2el6 s LYS 39 Ca -0.21 -0.65 -0.20 0.00 -0.36 0.00 0.00 55.97 54.55 2el6 s LYS 39 Cb 0.06 -2.66 -0.06 0.00 -1.51 0.00 0.00 37.83 33.65 2el6 s LYS 39 CO 0.34 0.26 1.14 -1.25 -0.36 0.00 0.00 175.35 175.48 2el6 s PRO 40 N 0.25 3.46 0.09 4.03 0.04 -1.26 -4.97 135.00 136.63 2el6 s PRO 40 Ca -0.08 1.65 -0.35 0.00 0.04 0.00 0.00 61.00 62.26 2el6 s PRO 40 Cb -0.15 -2.11 -0.16 0.00 0.04 0.00 0.00 34.50 32.12 2el6 s PRO 40 CO 0.05 -0.77 1.57 1.03 0.04 0.00 0.00 177.00 178.92 2el6 h SER 41 N 1.42 -1.34 -1.89 6.66 0.87 -2.04 -3.49 113.55 113.74 2el6 h SER 41 Ca -0.50 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 2el6 h SER 41 Cb 1.26 0.44 0.00 0.00 -0.44 0.00 0.00 62.40 63.66 2el6 h SER 41 CO 0.58 -0.64 0.00 0.61 -0.53 0.00 0.00 176.83 176.84 2el6 n GLY 42 N -1.55 3.64 0.06 5.77 0.00 -1.26 -4.88 105.19 106.97 2el6 n GLY 42 Ca -0.12 -1.55 0.09 0.00 0.00 0.00 0.00 46.02 44.44 2el6 n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2el6 n PRO 43 N -0.57 0.09 -0.30 1.61 -0.04 -1.26 -3.92 135.00 130.61 2el6 n PRO 43 Ca 0.00 0.33 -0.06 0.00 -0.04 0.00 0.00 63.50 63.73 2el6 n PRO 43 Cb 0.00 -1.67 -0.05 0.00 -0.04 0.00 0.00 33.50 31.74 2el6 n PRO 43 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2el6 n SER 44 N -1.83 -0.70 -4.55 3.54 7.64 -1.26 -3.61 113.62 112.85 2el6 n SER 44 Ca 0.03 1.28 -0.36 0.00 1.01 0.00 0.00 58.87 60.83 2el6 n SER 44 Cb 0.19 -0.19 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 2el6 n SER 44 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2el6 s SER 45 N -5.34 4.94 0.00 6.43 0.15 -1.25 -5.32 113.70 113.31 2el6 s SER 45 Ca -0.09 0.51 0.00 0.00 0.70 0.00 0.00 55.95 57.07 2el6 s SER 45 Cb 0.09 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.88 2el6 s SER 45 CO 0.46 -2.62 0.00 0.61 1.20 0.00 0.00 173.24 172.89