#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a51 s THR 2 N 0.00 0.01 -0.25 1.96 -1.32 -1.18 -3.83 115.64 111.03 2a51 s THR 2 Ca 0.00 -0.08 -0.29 0.00 -1.21 0.00 0.00 61.69 60.11 2a51 s THR 2 Cb 0.00 -0.67 -0.02 0.00 -1.51 0.00 0.00 72.50 70.30 2a51 s THR 2 CO 0.00 -0.04 1.64 0.00 -2.21 0.00 0.00 174.62 174.00 2a51 n PHE 4 N 8.83 0.00 0.00 0.00 3.72 -1.26 -0.82 117.46 127.93 2a51 n PHE 4 Ca 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 2a51 n PHE 4 Cb 0.46 -0.34 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 2a51 n PHE 4 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2a51 n ASN 5 N -1.34 0.00 0.05 4.37 5.15 -1.26 -4.74 115.26 117.49 2a51 n ASN 5 Ca 0.06 0.05 0.12 0.00 -0.60 0.00 0.00 54.58 54.21 2a51 n ASN 5 Cb 0.14 -0.32 0.15 0.00 -0.53 0.00 0.00 39.78 39.22 2a51 n ASN 5 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2a51 n GLY 7 N 1.35 0.75 3.77 0.00 0.00 -0.00 -4.76 105.19 106.30 2a51 n GLY 7 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 2a51 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a51 s LYS 8 N -0.31 4.31 0.98 1.61 1.02 -1.26 -4.68 119.74 121.42 2a51 s LYS 8 Ca 0.00 0.75 -0.14 0.00 0.02 0.00 0.00 55.97 56.60 2a51 s LYS 8 Cb 0.00 -3.33 0.18 0.00 -0.52 0.00 0.00 37.83 34.16 2a51 s LYS 8 CO 0.00 0.39 1.16 -1.25 -0.92 0.00 0.00 175.35 174.73 2a51 s PRO 9 N -0.29 0.56 0.00 -1.68 0.04 -1.26 -1.63 135.00 130.74 2a51 s PRO 9 Ca 0.31 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.49 2a51 s PRO 9 Cb -0.18 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2a51 s PRO 9 CO 0.18 -2.56 0.00 0.41 0.04 0.00 0.00 177.00 175.07 2a51 n GLY 10 N -2.10 0.94 1.57 0.56 0.00 -1.25 -4.85 105.19 100.04 2a51 n GLY 10 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 2a51 n GLY 10 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2a51 n HIS 11 N -2.00 -1.43 -4.31 1.61 1.44 -1.26 -5.05 115.22 104.22 2a51 n HIS 11 Ca 0.00 -0.84 -0.22 0.00 -2.01 0.00 0.00 57.72 54.65 2a51 n HIS 11 Cb 0.00 0.36 -0.12 0.00 0.12 0.00 0.00 29.99 30.35 2a51 n HIS 11 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 2a51 s THR 12 N -2.61 1.72 0.54 0.61 2.01 -1.26 -1.62 115.64 115.03 2a51 s THR 12 Ca 0.08 -1.78 0.25 0.00 0.31 0.00 0.00 61.69 60.55 2a51 s THR 12 Cb -0.02 -1.71 0.37 0.00 0.01 0.00 0.00 72.50 71.15 2a51 s THR 12 CO 0.06 -0.25 2.03 0.00 -0.69 0.00 0.00 174.62 175.76 2a51 h ALA 13 N 3.53 2.28 -0.64 7.40 0.00 -1.87 -0.50 119.26 129.46 2a51 h ALA 13 Ca -0.43 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.58 2a51 h ALA 13 Cb 1.20 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.93 2a51 h ALA 13 CO 0.48 -0.50 0.19 -0.09 0.00 0.00 0.00 179.25 179.32 2a51 h ARG 14 N 0.00 0.32 0.05 0.00 2.43 -1.97 -2.60 114.38 112.61 2a51 h ARG 14 Ca 0.18 -0.02 -0.25 0.00 -0.81 0.00 0.00 59.98 59.09 2a51 h ARG 14 Cb 0.79 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.25 2a51 h ARG 14 CO -0.00 0.21 -1.18 0.52 -1.51 0.00 0.00 179.97 178.01 2a51 h MET 15 N 0.33 0.11 -6.36 0.20 2.86 -1.53 -3.46 114.93 107.08 2a51 h MET 15 Ca 0.34 -0.18 -0.55 0.00 -2.06 0.00 0.00 59.70 57.24 2a51 h MET 15 Cb 0.48 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 2a51 h MET 15 CO -0.38 1.04 0.72 0.00 1.06 0.00 0.00 176.91 179.35 2a51 h ARG 17 N 7.45 0.00 -6.99 0.00 9.65 -1.90 -3.47 114.38 119.12 2a51 h ARG 17 Ca -0.37 0.00 -0.56 0.00 -1.10 0.00 0.00 59.98 57.96 2a51 h ARG 17 Cb 1.18 0.00 0.17 0.00 -1.39 0.00 0.00 29.97 29.93 2a51 h ARG 17 CO 0.88 0.48 0.21 1.04 2.80 0.00 0.00 179.97 185.37 2a51 n GLN 18 N -3.04 0.64 -0.64 0.20 6.02 -1.26 -4.99 117.38 114.31 2a51 n GLN 18 Ca -0.10 0.27 -0.31 0.00 -0.01 0.00 0.00 57.00 56.86 2a51 n GLN 18 Cb 0.92 -2.30 0.18 0.00 1.02 0.00 0.00 30.24 30.06 2a51 n GLN 18 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2a51 n PRO 19 N -1.90 -0.85 -1.58 -1.09 -0.02 -1.26 -4.83 135.00 123.47 2a51 n PRO 19 Ca 0.14 -0.19 -0.22 0.00 -2.02 0.00 0.00 63.50 61.21 2a51 n PRO 19 Cb 0.49 -2.32 0.15 0.00 -0.02 0.00 0.00 33.50 31.80 2a51 n PRO 19 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2a51 n ARG 20 N -4.29 -0.82 -2.85 -0.52 1.85 -1.26 -4.32 116.66 104.45 2a51 n ARG 20 Ca 0.10 -1.67 -0.36 0.00 -1.00 0.00 0.00 57.85 54.92 2a51 n ARG 20 Cb 0.52 -0.96 -0.07 0.00 -1.05 0.00 0.00 32.46 30.91 2a51 n ARG 20 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 2a51 s GLN 21 N -5.11 4.43 0.12 2.89 2.00 -0.90 -4.86 119.66 118.21 2a51 s GLN 21 Ca 0.57 1.18 -0.29 0.00 -2.00 0.00 0.00 55.36 54.82 2a51 s GLN 21 Cb -0.02 -2.65 -0.09 0.00 0.80 0.00 0.00 33.01 31.05 2a51 s GLN 21 CO 0.40 0.22 1.48 0.93 -0.50 0.00 0.00 175.29 177.81 2a51 h GLU 22 N 2.86 -0.32 0.00 1.67 5.08 -1.93 -3.45 114.58 118.50 2a51 h GLU 22 Ca -0.47 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2a51 h GLU 22 Cb 1.19 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2a51 h GLU 22 CO 0.64 -0.21 0.00 0.41 -1.00 0.00 0.00 179.01 178.85 2a51 n GLY 23 N -1.32 1.81 3.54 -3.84 0.00 -1.26 -4.96 105.19 99.16 2a51 n GLY 23 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 2a51 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a51 h TRP 25 N 8.52 0.00 -0.11 0.00 5.08 -1.91 0.39 115.95 127.92 2a51 h TRP 25 Ca -0.28 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.61 2a51 h TRP 25 Cb 1.13 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.29 2a51 h TRP 25 CO 0.70 0.35 -0.24 -0.97 -1.28 0.00 0.00 178.44 177.00 2a51 h ASN 26 N 0.00 0.40 0.00 0.11 -1.24 -1.94 -3.36 115.58 109.55 2a51 h ASN 26 Ca -0.00 -0.57 0.00 0.00 0.71 0.00 0.00 56.30 56.44 2a51 h ASN 26 Cb 1.14 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 40.07 2a51 h ASN 26 CO 0.05 0.90 -1.13 0.00 -1.29 0.00 0.00 177.43 175.96 2a51 n GLY 28 N 1.72 0.96 3.92 0.00 0.00 0.10 -5.08 105.19 106.81 2a51 n GLY 28 Ca -0.01 -0.54 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 2a51 n GLY 28 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2a51 s SER 29 N -2.56 5.82 -0.01 1.61 0.15 -1.07 -4.90 113.70 112.73 2a51 s SER 29 Ca 0.00 0.66 0.09 0.00 0.70 0.00 0.00 55.95 57.40 2a51 s SER 29 Cb 0.00 -1.80 -0.13 0.00 -1.71 0.00 0.00 66.02 62.38 2a51 s SER 29 CO 0.00 -0.85 0.20 0.29 1.20 0.00 0.00 173.24 174.08 2a51 n LYS 30 N -2.38 0.48 -0.04 5.44 4.76 -1.26 -0.58 118.16 124.58 2a51 n LYS 30 Ca 0.03 -0.07 -0.13 0.00 -2.87 0.00 0.00 58.31 55.26 2a51 n LYS 30 Cb 0.57 -1.19 -0.08 0.00 -1.84 0.00 0.00 35.03 32.49 2a51 n LYS 30 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2a51 h GLU 31 N 0.00 0.27 0.00 1.97 4.39 -1.95 -3.41 114.58 115.85 2a51 h GLU 31 Ca 0.00 -0.14 -0.21 0.00 0.34 0.00 0.00 59.36 59.35 2a51 h GLU 31 Cb 0.38 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.00 2a51 h GLU 31 CO 0.00 0.69 -0.16 -2.39 -1.16 0.00 0.00 179.01 175.98 2a51 n HIS 32 N -4.62 0.25 -4.53 4.33 1.44 -1.26 -5.05 115.22 105.78 2a51 n HIS 32 Ca -0.07 -0.87 -0.25 0.00 -2.01 0.00 0.00 57.72 54.53 2a51 n HIS 32 Cb 0.34 -0.07 -0.11 0.00 0.12 0.00 0.00 29.99 30.27 2a51 n HIS 32 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2a51 s ARG 33 N -2.58 1.79 0.26 -1.40 0.52 -1.26 -0.84 118.95 115.43 2a51 s ARG 33 Ca 0.03 -1.99 -0.02 0.00 -0.52 0.00 0.00 55.73 53.22 2a51 s ARG 33 Cb 0.00 -1.30 0.44 0.00 0.52 0.00 0.00 34.95 34.61 2a51 s ARG 33 CO 0.02 -0.08 1.83 0.35 0.02 0.00 0.00 175.30 177.44 2a51 h PHE 34 N 1.97 1.00 -0.87 -0.53 3.57 -1.90 -0.51 116.94 119.67 2a51 h PHE 34 Ca -0.42 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.19 2a51 h PHE 34 Cb 1.24 -0.31 -0.07 0.00 2.79 0.00 0.00 35.95 39.60 2a51 h PHE 34 CO 0.67 0.43 0.53 0.00 -2.23 0.00 0.00 178.31 177.70 2a51 h ALA 35 N 1.48 1.22 0.05 2.41 0.00 -1.95 -2.68 119.26 119.78 2a51 h ALA 35 Ca 0.43 0.01 -0.23 0.00 0.00 0.00 0.00 54.91 55.11 2a51 h ALA 35 Cb 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2a51 h ALA 35 CO -0.24 0.23 -1.04 1.96 0.00 0.00 0.00 179.25 180.16 2a51 h GLN 36 N 0.93 0.23 -6.73 0.00 1.08 -1.64 -3.46 115.11 105.51 2a51 h GLN 36 Ca 0.40 -0.31 -0.53 0.00 -1.45 0.00 0.00 58.65 56.76 2a51 h GLN 36 Cb 0.25 0.10 0.07 0.00 -0.05 0.00 0.00 27.48 27.85 2a51 h GLN 36 CO -0.20 1.08 0.87 0.00 -0.95 0.00 0.00 178.83 179.62 2a51 h PRO 38 N 5.50 0.00 0.00 0.00 0.13 -1.90 -3.48 132.00 132.25 2a51 h PRO 38 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2a51 h PRO 38 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2a51 h PRO 38 CO 0.83 0.62 0.00 1.17 -0.23 0.00 0.00 178.00 180.40