#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 2.79 -4.66 1.61 3.41 -1.26 -4.95 113.62 110.57 2el6 n SER 2 Ca 0.00 0.02 -0.31 0.00 -0.26 0.00 0.00 58.87 58.33 2el6 n SER 2 Cb 0.00 -1.52 -0.09 0.00 -0.26 0.00 0.00 64.21 62.35 2el6 n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2el6 s SER 3 N 9.33 4.93 0.00 4.04 0.01 -1.26 -5.06 113.70 125.70 2el6 s SER 3 Ca 1.02 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 58.13 2el6 s SER 3 Cb -0.37 -1.18 0.00 0.00 0.21 0.00 0.00 66.02 64.68 2el6 s SER 3 CO 0.35 0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.82 2el6 n GLY 4 N 0.89 0.01 0.12 3.44 0.00 -1.26 -4.78 105.19 103.61 2el6 n GLY 4 Ca -0.12 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 2el6 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2el6 h SER 5 N 0.00 -0.18 -2.84 1.61 0.02 -1.98 -3.36 113.55 106.82 2el6 h SER 5 Ca 0.00 -0.15 -0.56 0.00 -0.84 0.00 0.00 61.79 60.24 2el6 h SER 5 Cb 0.00 0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 2el6 h SER 5 CO 0.00 0.05 0.94 -0.55 -1.14 0.00 0.00 176.83 176.13 2el6 s SER 6 N -5.18 6.87 0.00 3.07 0.15 -1.26 -4.27 113.70 113.08 2el6 s SER 6 Ca -0.15 1.88 0.00 0.00 0.70 0.00 0.00 55.95 58.38 2el6 s SER 6 Cb 0.04 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.81 2el6 s SER 6 CO 0.63 -0.79 0.00 0.61 1.20 0.00 0.00 173.24 174.89 2el6 n GLY 7 N 3.74 0.98 3.55 9.45 0.00 -1.26 -4.81 105.19 116.84 2el6 n GLY 7 Ca 0.15 -0.69 -0.25 0.00 0.00 0.00 0.00 46.02 45.23 2el6 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2el6 n ALA 8 N 1.28 1.25 -3.00 4.61 0.00 -1.26 -4.72 120.51 118.68 2el6 n ALA 8 Ca 0.00 -2.73 0.00 0.00 0.00 0.00 0.00 53.44 50.71 2el6 n ALA 8 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 19.45 16.00 2el6 n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2el6 n GLY 9 N 5.81 2.37 3.73 0.00 0.00 -1.26 -4.64 105.19 111.19 2el6 n GLY 9 Ca 0.44 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.76 2.46 -0.14 1.61 0.11 -1.26 -5.00 120.40 115.42 2el6 s VAL 10 Ca 0.00 0.35 -0.29 0.00 -2.93 0.00 0.00 61.98 59.11 2el6 s VAL 10 Cb 0.00 -3.23 0.09 0.00 -1.53 0.00 0.00 36.38 31.71 2el6 s VAL 10 CO 0.00 0.04 0.79 0.20 -3.33 0.00 0.00 175.10 172.80 2el6 s ASN 11 N 0.84 -0.59 0.49 3.54 0.01 -1.26 -5.02 114.94 112.95 2el6 s ASN 11 Ca 0.67 0.79 0.27 0.00 -0.71 0.00 0.00 52.86 53.88 2el6 s ASN 11 Cb -0.45 0.68 1.15 0.00 0.41 0.00 0.00 41.25 43.05 2el6 s ASN 11 CO 0.37 -0.44 1.92 1.55 -1.51 0.00 0.00 177.10 178.99 2el6 h PRO 12 N 3.37 0.00 -3.65 -0.60 0.13 -1.84 -3.42 132.00 125.99 2el6 h PRO 12 Ca -0.25 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.48 2el6 h PRO 12 Cb 1.15 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.91 2el6 h PRO 12 CO 0.28 0.15 -0.76 0.71 -0.23 0.00 0.00 178.00 178.16 2el6 s TYR 13 N -3.76 0.46 -0.15 1.56 2.02 -1.15 -5.03 117.35 111.30 2el6 s TYR 13 Ca -0.00 -0.04 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 2el6 s TYR 13 Cb 0.10 -0.62 0.03 0.00 -0.40 0.00 0.00 41.96 41.07 2el6 s TYR 13 CO 0.60 -0.24 -0.12 0.21 -1.57 0.00 0.00 175.55 174.43 2el6 s LYS 14 N 1.69 2.07 -0.20 -0.62 2.36 -1.26 -0.53 119.74 123.25 2el6 s LYS 14 Ca 0.00 -0.52 -0.39 0.00 -2.55 0.00 0.00 55.97 52.51 2el6 s LYS 14 Cb -0.13 -2.02 -0.15 0.00 -1.05 0.00 0.00 37.83 34.48 2el6 s LYS 14 CO -0.03 -0.27 1.71 0.00 1.55 0.00 0.00 175.35 178.30 2el6 h SER 16 N 7.09 0.00 0.40 0.00 0.02 -1.99 -3.31 113.55 115.77 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 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 2el6 h SER 16 CO 0.93 0.27 -0.19 1.56 -1.14 0.00 0.00 176.83 178.26 2el6 h GLN 17 N 0.00 -0.52 0.00 3.45 1.08 -1.95 -3.48 115.11 113.69 2el6 h GLN 17 Ca -0.00 0.04 -0.32 0.00 -1.45 0.00 0.00 58.65 56.92 2el6 h GLN 17 Cb 0.87 0.12 -0.05 0.00 -0.05 0.00 0.00 27.48 28.36 2el6 h GLN 17 CO 0.03 -0.34 -0.21 0.00 -0.95 0.00 0.00 178.83 177.36 2el6 n GLU 19 N -0.73 1.17 -3.58 0.00 0.28 -1.26 -4.42 120.64 112.09 2el6 n GLU 19 Ca -0.08 -0.33 -0.25 0.00 -0.16 0.00 0.00 57.16 56.34 2el6 n GLU 19 Cb 0.31 -1.13 -0.02 0.00 1.43 0.00 0.00 31.44 32.03 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 -0.38 3.50 0.17 3.44 -0.14 -1.26 -4.75 119.74 120.33 2el6 s LYS 20 Ca 0.06 -0.38 -0.18 0.00 -1.36 0.00 0.00 55.97 54.11 2el6 s LYS 20 Cb 0.05 -2.76 0.04 0.00 -1.68 0.00 0.00 37.83 33.48 2el6 s LYS 20 CO -0.00 0.29 0.50 -1.54 -0.76 0.00 0.00 175.35 173.84 2el6 s SER 21 N -3.65 -0.31 0.08 2.83 1.04 -1.26 0.10 113.70 112.54 2el6 s SER 21 Ca 0.39 -0.35 -0.16 0.00 0.48 0.00 0.00 55.95 56.30 2el6 s SER 21 Cb -0.10 0.55 0.03 0.00 0.10 0.00 0.00 66.02 66.61 2el6 s SER 21 CO 0.32 -0.99 0.39 -0.36 0.98 0.00 0.00 173.24 173.58 2el6 s PHE 22 N -3.83 -0.20 -0.34 5.02 0.40 0.31 -4.93 117.98 114.42 2el6 s PHE 22 Ca 0.06 -0.00 0.23 0.00 -0.60 0.00 0.00 56.93 56.62 2el6 s PHE 22 Cb -0.00 0.21 0.40 0.00 0.51 0.00 0.00 43.02 44.14 2el6 s PHE 22 CO -0.07 -0.63 1.62 0.66 0.70 0.00 0.00 175.22 177.51 2el6 h SER 23 N 2.70 0.00 -2.37 1.36 4.64 -1.96 -3.05 113.55 114.87 2el6 h SER 23 Ca -0.33 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.41 2el6 h SER 23 Cb 1.23 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.21 2el6 h SER 23 CO 0.46 0.08 -0.68 -0.83 -0.87 0.00 0.00 176.83 174.99 2el6 s GLY 24 N -4.25 1.71 -0.00 -0.77 0.00 -1.26 -4.71 107.32 98.05 2el6 s GLY 24 Ca 0.06 -1.66 -0.20 0.00 0.00 0.00 0.00 44.72 42.92 2el6 s GLY 24 CO 0.67 -1.72 0.91 1.70 0.00 0.00 0.00 173.10 174.66 2el6 h LYS 25 N 2.17 -0.70 -0.45 2.90 1.63 -1.96 -3.27 116.57 116.90 2el6 h LYS 25 Ca -0.44 0.05 0.05 0.00 -0.85 0.00 0.00 60.65 59.45 2el6 h LYS 25 Cb 1.24 0.16 -0.07 0.00 -0.60 0.00 0.00 32.23 32.96 2el6 h LYS 25 CO 0.59 -0.47 -0.40 1.25 -3.45 0.00 0.00 179.45 176.97 2el6 h LEU 26 N -1.07 -1.40 -0.62 5.20 7.12 -1.99 0.34 115.31 122.89 2el6 h LEU 26 Ca -0.07 0.20 0.15 0.00 0.13 0.00 0.00 57.88 58.28 2el6 h LEU 26 Cb 0.56 0.59 -0.12 0.00 -0.53 0.00 0.00 40.66 41.16 2el6 h LEU 26 CO 0.12 -0.24 -0.05 0.54 -0.13 0.00 0.00 178.44 178.68 2el6 n ARG 27 N -4.59 -0.05 0.38 1.25 5.12 -1.25 0.22 116.66 117.74 2el6 n ARG 27 Ca -0.01 0.94 -0.15 0.00 -1.93 0.00 0.00 57.85 56.70 2el6 n ARG 27 Cb 0.22 -1.46 -0.07 0.00 -1.16 0.00 0.00 32.46 29.99 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 -0.82 -0.27 0.55 5.85 -0.98 -2.03 115.31 117.61 2el6 h LEU 28 Ca 0.35 0.03 0.03 0.00 0.84 0.00 0.00 57.88 59.12 2el6 h LEU 28 Cb 0.66 0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 2el6 h LEU 28 CO -0.60 -0.56 -0.29 -0.07 -0.34 0.00 0.00 178.44 176.57 2el6 h LEU 29 N -1.03 -1.00 -1.83 2.25 -0.00 0.11 0.67 115.31 114.50 2el6 h LEU 29 Ca -0.10 0.13 0.37 0.00 -0.00 0.00 0.00 57.88 58.28 2el6 h LEU 29 Cb 0.75 0.41 -0.07 0.00 -0.00 0.00 0.00 40.66 41.75 2el6 h LEU 29 CO 0.16 -0.19 0.89 1.62 -0.00 0.00 0.00 178.44 180.92 2el6 h VAL 30 N -0.17 0.35 0.06 1.22 3.04 -1.26 0.89 116.25 120.38 2el6 h VAL 30 Ca 0.05 -0.03 -0.24 0.00 -1.01 0.00 0.00 66.70 65.47 2el6 h VAL 30 Cb 0.29 0.27 -0.02 0.00 -2.01 0.00 0.00 31.29 29.82 2el6 h VAL 30 CO -0.34 0.01 -1.13 -0.74 -1.01 0.00 0.00 177.57 174.36 2el6 h HIS 31 N 0.08 0.22 0.00 3.17 -0.00 0.49 -3.23 115.15 115.88 2el6 h HIS 31 Ca 0.64 -0.16 -0.01 0.00 -0.00 0.00 0.00 60.37 60.84 2el6 h HIS 31 Cb 2.34 -0.01 -0.00 0.00 -0.00 0.00 0.00 27.41 29.74 2el6 h HIS 31 CO -0.00 1.13 -0.06 1.96 -0.00 0.00 0.00 177.93 180.95 2el6 h GLN 32 N 0.03 0.00 -0.40 5.26 4.20 0.62 -2.85 115.11 121.97 2el6 h GLN 32 Ca -0.07 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 2el6 h GLN 32 Cb 1.87 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.63 2el6 h GLN 32 CO 0.16 0.06 0.13 0.07 -0.67 0.00 0.00 178.83 178.58 2el6 h ARG 33 N 0.00 0.58 -0.66 1.46 0.11 -1.31 -2.12 114.38 112.44 2el6 h ARG 33 Ca -0.00 -0.09 0.14 0.00 0.10 0.00 0.00 59.98 60.13 2el6 h ARG 33 Cb 0.53 -0.10 -0.04 0.00 1.11 0.00 0.00 29.97 31.47 2el6 h ARG 33 CO 0.01 0.51 0.45 0.52 0.10 0.00 0.00 179.97 181.55 2el6 h MET 34 N 0.57 0.30 -1.95 0.08 2.86 -1.67 -2.07 114.93 113.05 2el6 h MET 34 Ca 0.14 -0.02 -0.15 0.00 -2.06 0.00 0.00 59.70 57.61 2el6 h MET 34 Cb 0.17 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 31.70 2el6 h MET 34 CO -0.01 0.20 -0.08 0.72 1.06 0.00 0.00 176.91 178.80 2el6 n HIS 35 N -4.45 0.29 -4.51 -0.22 8.25 -0.80 -4.86 115.22 108.92 2el6 n HIS 35 Ca 0.12 -1.38 -0.34 0.00 -0.26 0.00 0.00 57.72 55.86 2el6 n HIS 35 Cb 0.51 -1.07 -0.11 0.00 1.12 0.00 0.00 29.99 30.44 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 -0.02 3.95 -0.10 1.59 -1.32 -0.78 -5.11 115.64 113.85 2el6 s THR 36 Ca 0.35 -0.38 -0.05 0.00 -1.21 0.00 0.00 61.69 60.40 2el6 s THR 36 Cb 0.19 -2.64 0.05 0.00 -1.51 0.00 0.00 72.50 68.58 2el6 s THR 36 CO -0.02 0.59 0.23 -0.13 -2.21 0.00 0.00 174.62 173.08 2el6 s ARG 37 N -0.70 0.19 -0.13 7.08 1.81 -1.26 -5.04 118.95 120.89 2el6 s ARG 37 Ca 0.11 0.51 -0.02 0.00 -1.72 0.00 0.00 55.73 54.61 2el6 s ARG 37 Cb -0.11 -0.13 -0.07 0.00 -0.45 0.00 0.00 34.95 34.18 2el6 s ARG 37 CO 0.02 -0.17 -0.14 0.39 -0.68 0.00 0.00 175.30 174.73 2el6 n GLU 38 N 4.26 0.31 -3.59 3.54 -0.58 -1.26 -5.07 120.64 118.24 2el6 n GLU 38 Ca -0.25 0.09 -0.15 0.00 -0.42 0.00 0.00 57.16 56.43 2el6 n GLU 38 Cb 0.53 -1.15 -0.07 0.00 -0.57 0.00 0.00 31.44 30.18 2el6 n GLU 38 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2el6 s LYS 39 N -2.25 0.91 -0.15 3.49 1.02 -1.26 -5.13 119.74 116.36 2el6 s LYS 39 Ca -0.18 0.69 -0.29 0.00 0.02 0.00 0.00 55.97 56.21 2el6 s LYS 39 Cb 0.06 0.44 -0.03 0.00 -0.52 0.00 0.00 37.83 37.77 2el6 s LYS 39 CO 0.27 -0.19 1.57 -1.25 -0.92 0.00 0.00 175.35 174.83 2el6 s PRO 40 N -0.26 4.01 -0.02 -1.68 0.04 -1.26 -4.92 135.00 130.91 2el6 s PRO 40 Ca -0.04 1.85 -0.25 0.00 0.04 0.00 0.00 61.00 62.60 2el6 s PRO 40 Cb -0.03 -3.97 -0.19 0.00 0.04 0.00 0.00 34.50 30.35 2el6 s PRO 40 CO 0.04 -1.03 1.19 0.66 0.04 0.00 0.00 177.00 177.90 2el6 h SER 41 N 9.86 -0.10 -2.97 6.66 4.64 -2.04 -3.47 113.55 126.12 2el6 h SER 41 Ca -0.34 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.58 2el6 h SER 41 Cb 1.15 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2el6 h SER 41 CO 0.98 0.37 0.00 0.61 -0.87 0.00 0.00 176.83 177.92 2el6 n GLY 42 N 0.19 4.25 3.58 -0.77 0.00 -1.26 -5.07 105.19 106.11 2el6 n GLY 42 Ca -0.09 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.32 2el6 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2el6 s PRO 43 N -1.92 3.14 -0.22 1.61 0.04 -1.26 -4.98 135.00 131.41 2el6 s PRO 43 Ca 0.00 1.08 -0.09 0.00 0.04 0.00 0.00 61.00 62.03 2el6 s PRO 43 Cb 0.00 -4.23 -0.04 0.00 0.04 0.00 0.00 34.50 30.26 2el6 s PRO 43 CO 0.00 -2.10 0.11 0.45 0.04 0.00 0.00 177.00 175.50 2el6 s SER 44 N 6.39 5.78 0.69 6.66 0.15 -1.26 -5.07 113.70 127.05 2el6 s SER 44 Ca 0.73 0.05 -0.17 0.00 0.70 0.00 0.00 55.95 57.26 2el6 s SER 44 Cb -0.18 -2.02 -0.10 0.00 -1.71 0.00 0.00 66.02 62.01 2el6 s SER 44 CO 0.29 0.09 0.02 -1.20 1.20 0.00 0.00 173.24 173.64 2el6 n SER 45 N 4.09 -3.09 0.00 5.45 7.64 -1.26 -5.22 113.62 121.22 2el6 n SER 45 Ca -0.16 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.26 2el6 n SER 45 Cb 0.52 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 62.73 2el6 n SER 45 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64