#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 0.05 -0.07 1.47 -1.32 -1.10 -2.34 115.64 112.33 2a51 s THR 2 Ca 0.00 -0.42 -0.30 0.00 -1.21 0.00 0.00 61.69 59.76 2a51 s THR 2 Cb 0.00 -0.51 -0.04 0.00 -1.51 0.00 0.00 72.50 70.45 2a51 s THR 2 CO 0.00 -0.23 1.39 0.00 -2.21 0.00 0.00 174.62 173.56 2a51 n PHE 4 N 6.12 1.53 0.07 0.00 3.72 -1.26 -2.49 117.46 125.14 2a51 n PHE 4 Ca 0.14 -1.60 0.00 0.00 -0.05 0.00 0.00 57.45 55.93 2a51 n PHE 4 Cb 0.44 -0.79 0.00 0.00 -0.94 0.00 0.00 39.48 38.19 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 0.05 -0.48 0.04 4.37 5.15 -1.26 -4.90 115.26 118.23 2a51 n ASN 5 Ca 0.30 0.23 0.10 0.00 -0.60 0.00 0.00 54.58 54.61 2a51 n ASN 5 Cb 0.80 0.59 -0.08 0.00 -0.53 0.00 0.00 39.78 40.56 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 1.25 0.36 3.42 0.00 0.00 -1.04 -4.94 105.19 104.23 2a51 n GLY 7 Ca -0.04 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 44.83 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 -4.24 3.24 0.89 1.61 -0.14 -1.26 -4.88 119.74 114.95 2a51 s LYS 8 Ca 0.01 -0.78 -0.12 0.00 -1.36 0.00 0.00 55.97 53.72 2a51 s LYS 8 Cb -0.00 -3.55 0.09 0.00 -1.68 0.00 0.00 37.83 32.68 2a51 s LYS 8 CO 0.01 -0.45 0.92 -2.30 -0.76 0.00 0.00 175.35 172.77 2a51 n PRO 9 N 4.97 -0.20 0.00 -1.68 -0.02 -1.26 -3.20 135.00 133.60 2a51 n PRO 9 Ca -0.14 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 2a51 n PRO 9 Cb 0.49 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 2a51 n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a51 n GLY 10 N 0.76 1.69 0.00 -1.23 0.00 -0.99 -4.90 105.19 100.52 2a51 n GLY 10 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.47 -0.14 -4.15 1.61 1.44 -1.26 -4.98 115.22 106.27 2a51 n HIS 11 Ca 0.00 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.55 2a51 n HIS 11 Cb 0.00 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.00 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 -2.09 0.95 0.53 0.61 2.01 -1.26 -1.60 115.64 114.80 2a51 s THR 12 Ca 0.00 -1.38 0.25 0.00 0.31 0.00 0.00 61.69 60.87 2a51 s THR 12 Cb 0.00 -1.08 0.39 0.00 0.01 0.00 0.00 72.50 71.82 2a51 s THR 12 CO 0.00 -0.37 2.00 0.00 -0.69 0.00 0.00 174.62 175.56 2a51 h ALA 13 N 4.08 2.46 -0.60 7.40 0.00 -1.87 0.06 119.26 130.78 2a51 h ALA 13 Ca -0.39 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.60 2a51 h ALA 13 Cb 1.19 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.95 2a51 h ALA 13 CO 0.45 -0.63 0.23 -0.09 0.00 0.00 0.00 179.25 179.20 2a51 h ARG 14 N 0.00 0.40 0.00 0.00 9.65 -1.98 -2.83 114.38 119.62 2a51 h ARG 14 Ca 0.24 -0.02 -0.23 0.00 -1.10 0.00 0.00 59.98 58.86 2a51 h ARG 14 Cb 0.98 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 29.43 2a51 h ARG 14 CO -0.00 0.26 -1.24 0.52 2.80 0.00 0.00 179.97 182.31 2a51 h MET 15 N 0.41 0.00 -6.80 0.20 2.86 -1.46 -3.47 114.93 106.67 2a51 h MET 15 Ca 0.30 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.41 2a51 h MET 15 Cb 0.36 0.00 0.08 0.00 0.06 0.00 0.00 31.60 32.10 2a51 h MET 15 CO -0.30 0.78 0.85 0.00 1.06 0.00 0.00 176.91 179.31 2a51 h ARG 17 N 4.73 0.31 -6.82 0.00 9.65 -1.92 -3.48 114.38 116.85 2a51 h ARG 17 Ca -0.47 -0.53 -0.56 0.00 -1.10 0.00 0.00 59.98 57.32 2a51 h ARG 17 Cb 1.22 0.20 0.13 0.00 -1.39 0.00 0.00 29.97 30.12 2a51 h ARG 17 CO 0.78 1.25 0.45 0.94 2.80 0.00 0.00 179.97 186.19 2a51 n GLN 18 N -3.73 1.84 -2.01 0.20 7.27 -1.26 -5.02 117.38 114.67 2a51 n GLN 18 Ca -0.26 0.65 -0.29 0.00 0.07 0.00 0.00 57.00 57.18 2a51 n GLN 18 Cb 0.99 -2.35 0.15 0.00 2.41 0.00 0.00 30.24 31.44 2a51 n GLN 18 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2a51 s PRO 19 N -2.23 1.17 0.93 3.69 0.04 -1.26 -4.82 135.00 132.52 2a51 s PRO 19 Ca 0.62 -0.34 -0.11 0.00 0.04 0.00 0.00 61.00 61.21 2a51 s PRO 19 Cb -0.51 -1.94 0.11 0.00 0.04 0.00 0.00 34.50 32.20 2a51 s PRO 19 CO 0.57 -2.04 0.89 0.54 0.04 0.00 0.00 177.00 177.01 2a51 n ARG 20 N -3.51 -0.43 -1.70 4.56 1.74 -1.26 -4.61 116.66 111.45 2a51 n ARG 20 Ca 0.13 -0.07 -0.29 0.00 -0.77 0.00 0.00 57.85 56.85 2a51 n ARG 20 Cb 0.60 -2.20 0.13 0.00 -1.02 0.00 0.00 32.46 29.97 2a51 n ARG 20 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2a51 s GLN 21 N -4.29 1.33 0.19 5.56 2.00 -1.19 -4.98 119.66 118.28 2a51 s GLN 21 Ca 0.64 0.14 -0.14 0.00 -2.00 0.00 0.00 55.36 53.99 2a51 s GLN 21 Cb -0.22 -1.88 0.18 0.00 0.80 0.00 0.00 33.01 31.89 2a51 s GLN 21 CO 0.61 -2.03 1.66 0.93 -0.50 0.00 0.00 175.29 175.96 2a51 h GLU 22 N -1.38 0.05 0.00 1.67 4.39 -1.93 -3.46 114.58 113.92 2a51 h GLU 22 Ca -0.48 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.22 2a51 h GLU 22 Cb 1.32 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 2a51 h GLU 22 CO 0.60 0.03 0.00 0.41 -1.16 0.00 0.00 179.01 178.90 2a51 n GLY 23 N -1.34 0.58 3.47 -3.84 0.00 -1.22 -4.79 105.19 98.06 2a51 n GLY 23 Ca 0.05 0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 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 8.95 0.00 0.12 0.00 5.08 -1.88 0.74 115.95 128.96 2a51 h TRP 25 Ca -0.27 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.70 2a51 h TRP 25 Cb 1.10 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.26 2a51 h TRP 25 CO 0.74 0.39 -0.06 -0.97 -1.28 0.00 0.00 178.44 177.26 2a51 h ASN 26 N 0.00 -0.13 0.67 0.11 -1.24 -1.93 -3.38 115.58 109.67 2a51 h ASN 26 Ca -0.00 -0.31 0.00 0.00 0.71 0.00 0.00 56.30 56.70 2a51 h ASN 26 Cb 0.84 0.03 0.00 0.00 0.73 0.00 0.00 38.32 39.92 2a51 h ASN 26 CO 0.05 0.47 -1.26 0.00 -1.29 0.00 0.00 177.43 175.40 2a51 n GLY 28 N 1.23 0.81 3.88 0.00 0.00 0.23 -5.08 105.19 106.26 2a51 n GLY 28 Ca -0.01 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.21 5.70 -0.03 1.61 0.15 -1.09 -4.88 113.70 112.95 2a51 s SER 29 Ca 0.00 1.16 0.05 0.00 0.70 0.00 0.00 55.95 57.85 2a51 s SER 29 Cb 0.00 -2.06 -0.07 0.00 -1.71 0.00 0.00 66.02 62.18 2a51 s SER 29 CO 0.00 -1.16 0.05 0.29 1.20 0.00 0.00 173.24 173.62 2a51 n LYS 30 N -2.87 2.22 -0.08 5.44 5.02 -1.26 -0.22 118.16 126.42 2a51 n LYS 30 Ca 0.06 -0.02 -0.11 0.00 -2.02 0.00 0.00 58.31 56.22 2a51 n LYS 30 Cb 0.56 -1.12 -0.05 0.00 -0.02 0.00 0.00 35.03 34.40 2a51 n LYS 30 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2a51 h GLU 31 N 0.00 0.41 -5.14 1.97 3.07 -1.95 -3.35 114.58 109.59 2a51 h GLU 31 Ca -0.09 -0.13 -0.60 0.00 -0.50 0.00 0.00 59.36 58.04 2a51 h GLU 31 Cb 0.95 -0.04 -0.13 0.00 -0.84 0.00 0.00 28.75 28.69 2a51 h GLU 31 CO 0.00 0.60 -0.52 -3.38 -1.40 0.00 0.00 179.01 174.31 2a51 s HIS 32 N -4.96 1.86 0.32 4.33 -3.43 -1.26 -5.05 115.29 107.10 2a51 s HIS 32 Ca -0.14 -1.11 0.10 0.00 -0.80 0.00 0.00 55.06 53.11 2a51 s HIS 32 Cb 0.07 -1.37 -0.05 0.00 -1.43 0.00 0.00 32.58 29.80 2a51 s HIS 32 CO 0.74 -0.05 -0.05 1.03 -2.00 0.00 0.00 174.74 174.42 2a51 s ARG 33 N -3.78 1.99 0.24 -0.38 0.52 -1.26 -0.76 118.95 115.52 2a51 s ARG 33 Ca 0.18 -1.73 -0.04 0.00 -0.52 0.00 0.00 55.73 53.62 2a51 s ARG 33 Cb 0.03 -1.90 0.41 0.00 0.52 0.00 0.00 34.95 34.01 2a51 s ARG 33 CO 0.10 0.22 1.80 0.35 0.02 0.00 0.00 175.30 177.79 2a51 h PHE 34 N 1.95 0.83 -0.98 -0.53 3.57 -1.90 0.21 116.94 120.09 2a51 h PHE 34 Ca -0.42 0.03 0.18 0.00 3.53 0.00 0.00 57.97 61.29 2a51 h PHE 34 Cb 1.25 -0.25 -0.10 0.00 2.79 0.00 0.00 35.95 39.64 2a51 h PHE 34 CO 0.73 0.32 0.59 0.00 -2.23 0.00 0.00 178.31 177.72 2a51 h ALA 35 N 1.46 1.60 0.03 2.41 0.00 -1.92 -1.80 119.26 121.04 2a51 h ALA 35 Ca 0.40 0.08 -0.27 0.00 0.00 0.00 0.00 54.91 55.12 2a51 h ALA 35 Cb 0.40 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.12 2a51 h ALA 35 CO -0.26 -0.04 -1.07 1.96 0.00 0.00 0.00 179.25 179.84 2a51 h GLN 36 N 0.76 0.62 -6.91 0.00 4.20 -1.43 -3.46 115.11 108.88 2a51 h GLN 36 Ca 0.56 -0.71 -0.53 0.00 0.06 0.00 0.00 58.65 58.03 2a51 h GLN 36 Cb 0.84 0.21 0.09 0.00 0.30 0.00 0.00 27.48 28.92 2a51 h GLN 36 CO -0.37 1.29 0.73 0.00 -0.67 0.00 0.00 178.83 179.81 2a51 h PRO 38 N 3.24 0.44 -0.01 0.00 0.13 -1.90 -3.47 132.00 130.43 2a51 h PRO 38 Ca -0.50 -0.16 0.00 0.00 -0.87 0.00 0.00 66.00 64.47 2a51 h PRO 38 Cb 1.23 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2a51 h PRO 38 CO 0.65 0.67 0.00 1.63 -0.23 0.00 0.00 178.00 180.72