#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 0.03 -0.06 1.96 -1.32 -1.20 -2.62 115.64 112.44 2a51 s THR 2 Ca 0.00 -0.26 -0.30 0.00 -1.21 0.00 0.00 61.69 59.92 2a51 s THR 2 Cb 0.00 -0.62 -0.04 0.00 -1.51 0.00 0.00 72.50 70.33 2a51 s THR 2 CO 0.00 -0.15 1.37 0.00 -2.21 0.00 0.00 174.62 173.63 2a51 n PHE 4 N 5.91 1.54 0.00 0.00 3.72 -1.26 -2.48 117.46 124.89 2a51 n PHE 4 Ca 0.14 -1.32 0.00 0.00 -0.05 0.00 0.00 57.45 56.22 2a51 n PHE 4 Cb 0.44 -0.66 0.00 0.00 -0.94 0.00 0.00 39.48 38.32 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 -0.21 0.00 0.04 4.37 5.15 -1.26 -4.90 115.26 118.45 2a51 n ASN 5 Ca 0.30 0.00 0.12 0.00 -0.60 0.00 0.00 54.58 54.40 2a51 n ASN 5 Cb 0.99 0.00 0.27 0.00 -0.53 0.00 0.00 39.78 40.51 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 1.40 0.41 3.54 0.00 0.00 -1.03 -4.87 105.19 104.64 2a51 n GLY 7 Ca 0.05 -0.89 -0.37 0.00 0.00 0.00 0.00 46.02 44.81 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 -1.65 3.85 1.00 1.61 -0.14 -1.26 -4.80 119.74 118.35 2a51 s LYS 8 Ca 0.00 -0.38 -0.11 0.00 -1.36 0.00 0.00 55.97 54.12 2a51 s LYS 8 Cb 0.00 -3.50 0.17 0.00 -1.68 0.00 0.00 37.83 32.82 2a51 s LYS 8 CO 0.00 -0.14 0.95 -2.30 -0.76 0.00 0.00 175.35 173.11 2a51 n PRO 9 N 4.85 -0.99 -0.04 -1.68 -0.02 -1.26 -2.45 135.00 133.41 2a51 n PRO 9 Ca -0.15 -0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.09 2a51 n PRO 9 Cb 0.52 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 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 0.71 0.49 3.37 -1.23 0.00 -1.08 -4.86 105.19 102.60 2a51 n GLY 10 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.85 -4.38 1.61 1.44 -1.26 -5.01 115.22 103.78 2a51 n HIS 11 Ca 0.00 -2.00 -0.25 0.00 -2.01 0.00 0.00 57.72 53.46 2a51 n HIS 11 Cb 0.00 0.70 -0.12 0.00 0.12 0.00 0.00 29.99 30.69 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 -2.48 2.11 0.50 0.61 2.01 -1.26 -0.96 115.64 116.18 2a51 s THR 12 Ca 0.21 -1.94 0.22 0.00 0.31 0.00 0.00 61.69 60.49 2a51 s THR 12 Cb -0.03 -1.97 0.37 0.00 0.01 0.00 0.00 72.50 70.88 2a51 s THR 12 CO 0.16 -0.17 2.00 0.00 -0.69 0.00 0.00 174.62 175.92 2a51 h ALA 13 N 3.33 2.34 -0.67 7.40 0.00 -1.87 -0.28 119.26 129.51 2a51 h ALA 13 Ca -0.45 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.55 2a51 h ALA 13 Cb 1.20 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.92 2a51 h ALA 13 CO 0.48 -0.48 0.27 -0.09 0.00 0.00 0.00 179.25 179.42 2a51 h ARG 14 N 0.10 0.44 0.01 0.00 2.43 -1.97 -2.59 114.38 112.80 2a51 h ARG 14 Ca 0.24 -0.03 -0.24 0.00 -0.81 0.00 0.00 59.98 59.15 2a51 h ARG 14 Cb 0.83 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.25 2a51 h ARG 14 CO -0.03 0.29 -1.23 0.52 -1.51 0.00 0.00 179.97 178.02 2a51 h MET 15 N 0.45 0.02 -6.39 0.20 2.86 -1.53 -3.46 114.93 107.08 2a51 h MET 15 Ca 0.35 -0.04 -0.54 0.00 -2.06 0.00 0.00 59.70 57.41 2a51 h MET 15 Cb 0.45 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.13 2a51 h MET 15 CO -0.33 0.88 0.87 0.00 1.06 0.00 0.00 176.91 179.38 2a51 h ARG 17 N 7.94 0.33 -6.73 0.00 1.12 -1.90 -3.47 114.38 111.67 2a51 h ARG 17 Ca -0.39 -0.57 -0.56 0.00 -1.11 0.00 0.00 59.98 57.35 2a51 h ARG 17 Cb 1.18 0.21 0.18 0.00 -0.01 0.00 0.00 29.97 31.53 2a51 h ARG 17 CO 0.91 1.22 -0.21 1.04 -3.11 0.00 0.00 179.97 179.82 2a51 n GLN 18 N -3.53 0.45 -0.65 0.20 6.02 -1.26 -4.98 117.38 113.63 2a51 n GLN 18 Ca -0.21 0.19 -0.31 0.00 -0.01 0.00 0.00 57.00 56.67 2a51 n GLN 18 Cb 1.06 -1.95 0.18 0.00 1.02 0.00 0.00 30.24 30.56 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 -0.95 -0.98 -1.90 -1.09 -0.02 -1.26 -4.83 135.00 123.96 2a51 n PRO 19 Ca 0.11 -0.24 -0.30 0.00 -2.02 0.00 0.00 63.50 61.06 2a51 n PRO 19 Cb 0.49 -2.17 0.20 0.00 -0.02 0.00 0.00 33.50 32.00 2a51 n PRO 19 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2a51 s ARG 20 N -4.29 0.40 -0.08 -0.52 1.70 -1.26 -4.31 118.95 110.59 2a51 s ARG 20 Ca 0.64 -0.46 -0.02 0.00 -0.47 0.00 0.00 55.73 55.43 2a51 s ARG 20 Cb -0.22 -1.82 -0.03 0.00 -0.57 0.00 0.00 34.95 32.30 2a51 s ARG 20 CO 0.62 -2.57 0.01 -1.14 -1.08 0.00 0.00 175.30 171.14 2a51 s GLN 21 N -5.91 2.99 0.02 3.89 2.00 -0.81 -4.88 119.66 116.95 2a51 s GLN 21 Ca 0.75 -0.41 -0.07 0.00 -2.00 0.00 0.00 55.36 53.64 2a51 s GLN 21 Cb -0.03 -2.80 -0.03 0.00 0.80 0.00 0.00 33.01 30.95 2a51 s GLN 21 CO 0.54 0.70 1.10 0.93 -0.50 0.00 0.00 175.29 178.06 2a51 h GLU 22 N 5.10 -0.17 0.00 1.67 3.07 -1.98 -3.46 114.58 118.82 2a51 h GLU 22 Ca -0.51 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.36 2a51 h GLU 22 Cb 1.19 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 2a51 h GLU 22 CO 0.55 -0.11 0.00 0.41 -1.40 0.00 0.00 179.01 178.45 2a51 n GLY 23 N -1.10 1.75 3.50 -3.84 0.00 -1.26 -4.87 105.19 99.37 2a51 n GLY 23 Ca -0.02 -1.73 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 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 9.57 0.00 0.18 0.00 5.08 -1.90 0.16 115.95 129.05 2a51 h TRP 25 Ca -0.28 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.69 2a51 h TRP 25 Cb 1.07 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.23 2a51 h TRP 25 CO 0.99 0.34 -0.09 -0.97 -1.28 0.00 0.00 178.44 177.43 2a51 h ASN 26 N 0.00 -0.21 0.00 0.11 -1.24 -1.91 -3.37 115.58 108.96 2a51 h ASN 26 Ca -0.00 -0.32 0.00 0.00 0.71 0.00 0.00 56.30 56.69 2a51 h ASN 26 Cb 0.67 0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.78 2a51 h ASN 26 CO 0.04 0.33 -1.53 0.00 -1.29 0.00 0.00 177.43 174.98 2a51 n GLY 28 N 1.41 0.65 3.89 0.00 0.00 0.56 -5.07 105.19 106.63 2a51 n GLY 28 Ca -0.01 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.72 6.49 -0.14 1.61 0.15 -1.16 -4.92 113.70 113.01 2a51 s SER 29 Ca 0.00 0.93 0.17 0.00 0.70 0.00 0.00 55.95 57.74 2a51 s SER 29 Cb 0.00 -2.23 -0.24 0.00 -1.71 0.00 0.00 66.02 61.84 2a51 s SER 29 CO 0.00 -0.29 0.14 2.29 1.20 0.00 0.00 173.24 176.58 2a51 n LYS 30 N -1.06 0.98 -0.06 5.44 2.85 -1.26 -0.50 118.16 124.55 2a51 n LYS 30 Ca 0.00 -0.04 -0.11 0.00 -1.05 0.00 0.00 58.31 57.11 2a51 n LYS 30 Cb 0.54 -1.46 -0.05 0.00 -0.65 0.00 0.00 35.03 33.41 2a51 n LYS 30 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2a51 h GLU 31 N 0.00 0.33 -5.09 -1.58 5.08 -1.99 -3.43 114.58 107.90 2a51 h GLU 31 Ca -0.38 -0.10 -0.65 0.00 -1.00 0.00 0.00 59.36 57.23 2a51 h GLU 31 Cb 1.85 -0.03 -0.13 0.00 0.50 0.00 0.00 28.75 30.93 2a51 h GLU 31 CO 0.02 0.51 -0.50 -3.38 -1.00 0.00 0.00 179.01 174.66 2a51 s HIS 32 N -5.06 1.76 0.44 4.33 -3.43 -1.26 -5.05 115.29 107.02 2a51 s HIS 32 Ca -0.14 -1.12 0.05 0.00 -0.80 0.00 0.00 55.06 53.05 2a51 s HIS 32 Cb 0.07 -1.44 -0.06 0.00 -1.43 0.00 0.00 32.58 29.72 2a51 s HIS 32 CO 0.72 0.01 0.01 1.03 -2.00 0.00 0.00 174.74 174.51 2a51 s ARG 33 N -3.82 2.02 0.20 -0.38 0.52 -1.26 -1.04 118.95 115.19 2a51 s ARG 33 Ca 0.08 -2.19 -0.11 0.00 -0.52 0.00 0.00 55.73 52.99 2a51 s ARG 33 Cb 0.01 -1.60 0.12 0.00 0.52 0.00 0.00 34.95 34.00 2a51 s ARG 33 CO 0.05 -0.14 1.82 0.35 0.02 0.00 0.00 175.30 177.41 2a51 h PHE 34 N 1.66 0.93 -0.97 -0.53 3.57 -1.90 0.12 116.94 119.82 2a51 h PHE 34 Ca -0.44 -0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.19 2a51 h PHE 34 Cb 1.26 -0.30 -0.09 0.00 2.79 0.00 0.00 35.95 39.61 2a51 h PHE 34 CO 0.94 0.65 0.61 0.00 -2.23 0.00 0.00 178.31 178.28 2a51 h ALA 35 N 1.20 1.67 0.09 2.41 0.00 -1.96 -2.29 119.26 120.37 2a51 h ALA 35 Ca 0.25 0.03 -0.28 0.00 0.00 0.00 0.00 54.91 54.91 2a51 h ALA 35 Cb 0.00 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 17.66 2a51 h ALA 35 CO -0.04 0.06 -1.17 1.96 0.00 0.00 0.00 179.25 180.05 2a51 h GLN 36 N 0.84 0.55 -6.92 0.00 4.20 -1.69 -3.46 115.11 108.63 2a51 h GLN 36 Ca 0.50 -0.71 -0.52 0.00 0.06 0.00 0.00 58.65 57.98 2a51 h GLN 36 Cb 0.67 0.23 0.07 0.00 0.30 0.00 0.00 27.48 28.75 2a51 h GLN 36 CO -0.27 1.30 0.59 0.00 -0.67 0.00 0.00 178.83 179.78 2a51 h PRO 38 N 2.87 0.46 0.00 0.00 0.13 -1.89 -3.47 132.00 130.10 2a51 h PRO 38 Ca -0.49 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 2a51 h PRO 38 Cb 1.24 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2a51 h PRO 38 CO 0.63 0.62 0.00 1.63 -0.23 0.00 0.00 178.00 180.65