#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 4.33 0.06 1.61 0.01 -1.26 -5.11 113.70 113.34 2el6 s SER 2 Ca 0.00 -0.33 0.03 0.00 1.31 0.00 0.00 55.95 56.96 2el6 s SER 2 Cb 0.00 -1.72 -0.04 0.00 0.21 0.00 0.00 66.02 64.47 2el6 s SER 2 CO 0.00 0.05 0.04 -0.55 0.41 0.00 0.00 173.24 173.19 2el6 s SER 3 N 1.04 5.31 -0.29 2.44 0.15 -1.26 -5.11 113.70 115.97 2el6 s SER 3 Ca 0.00 -0.05 -0.12 0.00 0.70 0.00 0.00 55.95 56.49 2el6 s SER 3 Cb -0.15 -1.38 0.12 0.00 -1.71 0.00 0.00 66.02 62.90 2el6 s SER 3 CO -0.00 0.20 0.66 -0.83 1.20 0.00 0.00 173.24 174.47 2el6 s GLY 4 N -2.14 -0.70 -0.22 9.45 0.00 -1.26 -5.14 107.32 107.31 2el6 s GLY 4 Ca 0.26 2.38 0.01 0.00 0.00 0.00 0.00 44.72 47.37 2el6 s GLY 4 CO 0.18 2.90 -0.10 -0.45 0.00 0.00 0.00 173.10 175.63 2el6 s SER 5 N 2.57 3.69 -0.12 1.64 0.15 -1.26 -4.97 113.70 115.40 2el6 s SER 5 Ca -0.07 -1.04 0.18 0.00 0.70 0.00 0.00 55.95 55.72 2el6 s SER 5 Cb -0.10 -1.31 -0.25 0.00 -1.71 0.00 0.00 66.02 62.66 2el6 s SER 5 CO -0.19 -0.16 0.31 -1.54 1.20 0.00 0.00 173.24 172.85 2el6 n SER 6 N 4.62 0.21 -4.59 5.45 3.41 -1.26 -4.88 113.62 116.59 2el6 n SER 6 Ca -0.14 0.10 -0.41 0.00 -0.26 0.00 0.00 58.87 58.15 2el6 n SER 6 Cb 0.45 0.94 -0.03 0.00 -0.26 0.00 0.00 64.21 65.31 2el6 n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2el6 s GLY 7 N -5.19 0.44 0.03 5.00 0.00 -1.26 -4.89 107.32 101.45 2el6 s GLY 7 Ca -0.08 0.31 -0.39 0.00 0.00 0.00 0.00 44.72 44.57 2el6 s GLY 7 CO 0.84 3.61 1.22 0.00 0.00 0.00 0.00 173.10 178.77 2el6 n ALA 8 N 11.93 -2.31 -2.49 3.20 0.00 -1.26 -4.96 120.51 124.63 2el6 n ALA 8 Ca 0.27 0.56 -0.25 0.00 0.00 0.00 0.00 53.44 54.02 2el6 n ALA 8 Cb 0.48 -1.92 -0.14 0.00 0.00 0.00 0.00 19.45 17.87 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 0.32 1.03 0.08 0.00 0.00 -1.26 -5.13 107.32 102.35 2el6 s GLY 9 Ca 0.88 -0.96 -0.17 0.00 0.00 0.00 0.00 44.72 44.47 2el6 s GLY 9 CO 0.53 -0.87 0.53 0.54 0.00 0.00 0.00 173.10 173.83 2el6 s VAL 10 N -0.69 4.83 -0.27 1.40 0.11 -1.26 -5.08 120.40 119.44 2el6 s VAL 10 Ca 0.07 1.03 -0.23 0.00 -2.93 0.00 0.00 61.98 59.92 2el6 s VAL 10 Cb -0.08 -3.82 0.07 0.00 -1.53 0.00 0.00 36.38 31.02 2el6 s VAL 10 CO 0.01 0.47 0.71 0.54 -3.33 0.00 0.00 175.10 173.51 2el6 s ASN 11 N -1.27 -0.80 0.56 3.54 4.22 -1.26 -5.01 114.94 114.91 2el6 s ASN 11 Ca 0.30 1.46 0.34 0.00 -2.14 0.00 0.00 52.86 52.83 2el6 s ASN 11 Cb -0.18 1.45 1.41 0.00 1.28 0.00 0.00 41.25 45.22 2el6 s ASN 11 CO 0.18 -0.25 2.00 1.55 -2.04 0.00 0.00 177.10 178.55 2el6 h PRO 12 N 5.51 0.00 -3.65 3.55 0.13 -1.87 -3.42 132.00 132.24 2el6 h PRO 12 Ca -0.29 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.48 2el6 h PRO 12 Cb 1.18 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.96 2el6 h PRO 12 CO 0.08 0.00 -0.75 0.71 -0.23 0.00 0.00 178.00 177.82 2el6 s TYR 13 N -3.70 0.30 -0.09 1.56 2.02 -1.14 -5.02 117.35 111.29 2el6 s TYR 13 Ca 0.01 0.02 0.01 0.00 -0.37 0.00 0.00 57.07 56.74 2el6 s TYR 13 Cb 0.09 -0.45 0.02 0.00 -0.40 0.00 0.00 41.96 41.22 2el6 s TYR 13 CO 0.54 -0.15 -0.09 0.21 -1.57 0.00 0.00 175.55 174.48 2el6 s LYS 14 N 1.26 1.53 0.05 -0.62 2.36 -1.26 -0.84 119.74 122.22 2el6 s LYS 14 Ca -0.06 -0.31 -0.32 0.00 -2.55 0.00 0.00 55.97 52.73 2el6 s LYS 14 Cb -0.13 -1.44 -0.11 0.00 -1.05 0.00 0.00 37.83 35.10 2el6 s LYS 14 CO -0.02 -0.12 1.83 0.00 1.55 0.00 0.00 175.35 178.59 2el6 h SER 16 N 8.69 0.00 0.76 0.00 0.02 -1.99 -3.31 113.55 117.71 2el6 h SER 16 Ca -0.47 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.44 2el6 h SER 16 Cb 1.25 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.79 2el6 h SER 16 CO 0.94 0.60 -0.36 1.56 -1.14 0.00 0.00 176.83 178.43 2el6 h GLN 17 N 0.00 -0.98 0.00 3.45 1.08 -1.96 -3.47 115.11 113.23 2el6 h GLN 17 Ca -0.01 0.07 -0.36 0.00 -1.45 0.00 0.00 58.65 56.90 2el6 h GLN 17 Cb 1.14 0.22 -0.06 0.00 -0.05 0.00 0.00 27.48 28.72 2el6 h GLN 17 CO 0.08 -0.65 -0.25 0.00 -0.95 0.00 0.00 178.83 177.06 2el6 n GLU 19 N -0.79 1.29 -3.26 0.00 0.28 -1.26 -4.42 120.64 112.47 2el6 n GLU 19 Ca -0.10 -0.61 -0.25 0.00 -0.16 0.00 0.00 57.16 56.04 2el6 n GLU 19 Cb 0.36 -1.24 -0.01 0.00 1.43 0.00 0.00 31.44 31.98 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 -0.69 3.52 0.19 3.44 -0.14 -1.26 -4.96 119.74 119.84 2el6 s LYS 20 Ca 0.12 -0.19 -0.17 0.00 -1.36 0.00 0.00 55.97 54.37 2el6 s LYS 20 Cb 0.09 -2.62 0.03 0.00 -1.68 0.00 0.00 37.83 33.65 2el6 s LYS 20 CO 0.00 0.11 0.50 -1.54 -0.76 0.00 0.00 175.35 173.67 2el6 s SER 21 N -3.87 -0.24 0.11 2.83 1.04 -1.26 0.47 113.70 112.78 2el6 s SER 21 Ca 0.42 -0.49 -0.20 0.00 0.48 0.00 0.00 55.95 56.16 2el6 s SER 21 Cb -0.10 0.56 0.05 0.00 0.10 0.00 0.00 66.02 66.63 2el6 s SER 21 CO 0.36 -1.03 0.49 -0.36 0.98 0.00 0.00 173.24 173.68 2el6 s PHE 22 N -3.87 -0.35 -1.00 5.02 0.40 -0.02 -4.93 117.98 113.23 2el6 s PHE 22 Ca 0.09 0.16 0.27 0.00 -0.60 0.00 0.00 56.93 56.86 2el6 s PHE 22 Cb -0.01 0.36 0.95 0.00 0.51 0.00 0.00 43.02 44.84 2el6 s PHE 22 CO -0.03 -0.73 1.73 -1.13 0.70 0.00 0.00 175.22 175.76 2el6 n SER 23 N -0.10 0.20 -4.34 1.36 3.41 -1.26 -2.87 113.62 110.01 2el6 n SER 23 Ca -0.17 0.21 -0.27 0.00 -0.26 0.00 0.00 58.87 58.38 2el6 n SER 23 Cb 0.63 -0.21 -0.13 0.00 -0.26 0.00 0.00 64.21 64.24 2el6 n SER 23 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2el6 s GLY 24 N -3.01 1.41 0.00 5.00 0.00 -1.26 -4.78 107.32 104.68 2el6 s GLY 24 Ca 0.13 -1.34 0.00 0.00 0.00 0.00 0.00 44.72 43.51 2el6 s GLY 24 CO 0.60 -1.30 0.61 1.17 0.00 0.00 0.00 173.10 174.17 2el6 n LYS 25 N 1.19 0.00 -0.17 2.90 3.00 -1.26 -3.38 118.16 120.43 2el6 n LYS 25 Ca -0.18 0.23 -0.05 0.00 -0.00 0.00 0.00 58.31 58.31 2el6 n LYS 25 Cb 0.53 -1.14 -0.04 0.00 0.00 0.00 0.00 35.03 34.37 2el6 n LYS 25 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2el6 n LEU 26 N -1.18 -0.44 -0.23 3.14 -0.00 -1.26 0.15 117.00 117.18 2el6 n LEU 26 Ca 0.00 0.91 0.10 0.00 -0.00 0.00 0.00 56.01 57.02 2el6 n LEU 26 Cb 0.00 -0.18 0.20 0.00 -0.00 0.00 0.00 43.42 43.43 2el6 n LEU 26 CO 0.00 -0.69 0.53 -1.14 -0.00 0.00 0.00 177.39 176.09 2el6 n ARG 27 N -4.10 -0.05 0.26 1.96 3.00 -1.25 -0.18 116.66 116.30 2el6 n ARG 27 Ca 0.01 0.99 -0.10 0.00 -0.00 0.00 0.00 57.85 58.75 2el6 n ARG 27 Cb 0.11 -1.58 -0.05 0.00 0.00 0.00 0.00 32.46 30.94 2el6 n ARG 27 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2el6 h LEU 28 N 0.00 -0.56 -0.52 6.15 5.85 0.13 -1.89 115.31 124.48 2el6 h LEU 28 Ca 0.40 0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.19 2el6 h LEU 28 Cb 0.83 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.94 2el6 h LEU 28 CO -0.62 -0.37 -0.36 -0.07 -0.34 0.00 0.00 178.44 176.68 2el6 h LEU 29 N -0.71 -1.28 -1.41 2.25 -0.00 -0.41 0.79 115.31 114.54 2el6 h LEU 29 Ca -0.07 0.19 0.29 0.00 -0.00 0.00 0.00 57.88 58.29 2el6 h LEU 29 Cb 0.50 0.56 -0.09 0.00 -0.00 0.00 0.00 40.66 41.63 2el6 h LEU 29 CO 0.11 -0.17 0.70 1.62 -0.00 0.00 0.00 178.44 180.70 2el6 h VAL 30 N -0.06 0.48 -0.00 1.22 3.04 -1.33 0.57 116.25 120.16 2el6 h VAL 30 Ca 0.08 -0.12 -0.19 0.00 -1.01 0.00 0.00 66.70 65.47 2el6 h VAL 30 Cb 0.28 0.11 -0.01 0.00 -2.01 0.00 0.00 31.29 29.66 2el6 h VAL 30 CO -0.52 0.06 -0.83 -0.74 -1.01 0.00 0.00 177.57 174.53 2el6 h HIS 31 N 0.34 0.24 0.00 3.17 -0.00 0.10 -3.07 115.15 115.94 2el6 h HIS 31 Ca 0.61 -0.13 0.00 0.00 -0.00 0.00 0.00 60.37 60.85 2el6 h HIS 31 Cb 1.65 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 29.03 2el6 h HIS 31 CO -0.00 0.92 0.00 1.96 -0.00 0.00 0.00 177.93 180.81 2el6 h GLN 32 N 0.10 0.00 -0.15 5.26 4.20 0.57 -2.71 115.11 122.37 2el6 h GLN 32 Ca -0.03 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 2el6 h GLN 32 Cb 1.44 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.21 2el6 h GLN 32 CO 0.12 0.00 -0.28 0.07 -0.67 0.00 0.00 178.83 178.08 2el6 h ARG 33 N 0.00 0.27 -0.63 1.46 0.11 -1.23 -2.68 114.38 111.68 2el6 h ARG 33 Ca 0.00 -0.10 0.15 0.00 0.10 0.00 0.00 59.98 60.13 2el6 h ARG 33 Cb 0.46 -0.02 -0.03 0.00 1.11 0.00 0.00 29.97 31.49 2el6 h ARG 33 CO 0.00 0.53 0.44 0.52 0.10 0.00 0.00 179.97 181.56 2el6 h MET 34 N 0.24 0.19 -1.96 0.08 2.86 -1.62 -2.08 114.93 112.65 2el6 h MET 34 Ca 0.04 -0.01 -0.16 0.00 -2.06 0.00 0.00 59.70 57.50 2el6 h MET 34 Cb 0.62 -0.04 -0.06 0.00 0.06 0.00 0.00 31.60 32.18 2el6 h MET 34 CO 0.04 0.13 -0.10 0.72 1.06 0.00 0.00 176.91 178.76 2el6 n HIS 35 N -4.42 0.29 -4.24 -0.22 8.25 -1.01 -4.86 115.22 109.01 2el6 n HIS 35 Ca 0.12 -1.40 -0.29 0.00 -0.26 0.00 0.00 57.72 55.89 2el6 n HIS 35 Cb 0.57 -1.11 -0.10 0.00 1.12 0.00 0.00 29.99 30.47 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 3.33 0.17 1.59 -1.32 -0.78 -5.12 115.64 113.53 2el6 s THR 36 Ca 0.38 -1.37 0.09 0.00 -1.21 0.00 0.00 61.69 59.58 2el6 s THR 36 Cb 0.20 -2.58 -0.04 0.00 -1.51 0.00 0.00 72.50 68.57 2el6 s THR 36 CO -0.02 0.05 -0.10 -0.13 -2.21 0.00 0.00 174.62 172.21 2el6 s ARG 37 N -2.38 2.04 -0.89 7.08 0.52 -1.26 -5.07 118.95 118.99 2el6 s ARG 37 Ca 0.22 -1.26 -0.22 0.00 -0.52 0.00 0.00 55.73 53.95 2el6 s ARG 37 Cb -0.10 -2.16 0.07 0.00 0.52 0.00 0.00 34.95 33.28 2el6 s ARG 37 CO 0.14 0.44 1.25 -2.00 0.02 0.00 0.00 175.30 175.15 2el6 s GLU 38 N -2.76 3.45 -0.06 3.54 2.12 -1.26 -4.97 118.70 118.75 2el6 s GLU 38 Ca 0.24 -1.11 0.02 0.00 0.36 0.00 0.00 54.97 54.48 2el6 s GLU 38 Cb -0.09 -4.85 0.01 0.00 0.26 0.00 0.00 34.13 29.46 2el6 s GLU 38 CO 0.15 -2.01 -0.11 0.15 -0.54 0.00 0.00 175.26 172.90 2el6 s LYS 39 N 4.30 1.49 -1.02 4.30 1.02 -1.26 -5.07 119.74 123.50 2el6 s LYS 39 Ca 0.36 -0.35 -0.24 0.00 0.02 0.00 0.00 55.97 55.77 2el6 s LYS 39 Cb -0.05 -1.27 -0.06 0.00 -0.52 0.00 0.00 37.83 35.92 2el6 s LYS 39 CO -0.02 0.01 1.94 -1.25 -0.92 0.00 0.00 175.35 175.11 2el6 s PRO 40 N 0.68 2.53 -0.05 -1.68 0.04 -1.26 -4.93 135.00 130.34 2el6 s PRO 40 Ca -0.13 -0.64 -0.29 0.00 0.04 0.00 0.00 61.00 59.97 2el6 s PRO 40 Cb -0.15 -5.13 -0.07 0.00 0.04 0.00 0.00 34.50 29.18 2el6 s PRO 40 CO 0.03 -3.63 1.98 0.45 0.04 0.00 0.00 177.00 175.87 2el6 s SER 41 N 7.42 6.23 0.00 6.66 0.15 -1.26 -4.91 113.70 127.99 2el6 s SER 41 Ca 0.69 2.39 0.00 0.00 0.70 0.00 0.00 55.95 59.73 2el6 s SER 41 Cb -0.04 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 2el6 s SER 41 CO 0.05 -1.27 0.00 0.61 1.20 0.00 0.00 173.24 173.83 2el6 n GLY 42 N 4.80 -0.13 3.56 9.45 0.00 -1.26 -4.88 105.19 116.73 2el6 n GLY 42 Ca 0.22 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.97 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 0.32 2.56 -0.05 1.61 0.04 -1.26 -4.93 135.00 133.29 2el6 s PRO 43 Ca 0.00 -0.26 0.02 0.00 0.04 0.00 0.00 61.00 60.81 2el6 s PRO 43 Cb 0.00 -5.04 0.01 0.00 0.04 0.00 0.00 34.50 29.51 2el6 s PRO 43 CO 0.00 -3.36 -0.11 -1.54 0.04 0.00 0.00 177.00 172.04 2el6 s SER 44 N 8.04 1.51 -0.69 6.66 1.04 -1.26 -5.04 113.70 123.96 2el6 s SER 44 Ca 0.70 -0.24 -0.05 0.00 0.48 0.00 0.00 55.95 56.84 2el6 s SER 44 Cb -0.07 -0.59 0.05 0.00 0.10 0.00 0.00 66.02 65.51 2el6 s SER 44 CO -0.00 0.04 2.73 -1.54 0.98 0.00 0.00 173.24 175.45 2el6 n SER 45 N 3.63 6.88 0.00 7.02 3.41 -1.26 -5.25 113.62 128.05 2el6 n SER 45 Ca -0.22 -3.12 0.00 0.00 -0.26 0.00 0.00 58.87 55.27 2el6 n SER 45 Cb 0.52 -1.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.18 2el6 n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49