#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 -1.07 -2.76 115.64 112.43 2a51 s THR 2 Ca 0.00 -0.25 -0.30 0.00 -1.21 0.00 0.00 61.69 59.93 2a51 s THR 2 Cb 0.00 -0.60 -0.05 0.00 -1.51 0.00 0.00 72.50 70.34 2a51 s THR 2 CO 0.00 -0.14 1.45 0.00 -2.21 0.00 0.00 174.62 173.73 2a51 n PHE 4 N 6.23 1.35 0.00 0.00 3.72 -1.26 -2.57 117.46 124.93 2a51 n PHE 4 Ca 0.15 -1.18 0.00 0.00 -0.05 0.00 0.00 57.45 56.36 2a51 n PHE 4 Cb 0.44 -0.60 0.00 0.00 -0.94 0.00 0.00 39.48 38.38 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 -0.14 0.00 0.12 4.37 5.15 -1.26 -4.90 115.26 118.61 2a51 n ASN 5 Ca 0.26 0.00 0.08 0.00 -0.60 0.00 0.00 54.58 54.32 2a51 n ASN 5 Cb 0.96 0.00 0.03 0.00 -0.53 0.00 0.00 39.78 40.24 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 1.21 0.54 3.83 0.00 0.00 -1.06 -4.79 105.19 104.92 2a51 n GLY 7 Ca -0.01 -0.78 -0.37 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.43 3.79 0.94 1.61 1.02 -1.26 -4.83 119.74 119.58 2a51 s LYS 8 Ca 0.00 0.08 -0.14 0.00 0.02 0.00 0.00 55.97 55.94 2a51 s LYS 8 Cb 0.00 -3.26 0.16 0.00 -0.52 0.00 0.00 37.83 34.21 2a51 s LYS 8 CO 0.00 0.62 1.16 -1.25 -0.92 0.00 0.00 175.35 174.97 2a51 s PRO 9 N -0.69 0.89 0.00 -1.68 0.04 -1.26 -1.57 135.00 130.73 2a51 s PRO 9 Ca 0.18 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.35 2a51 s PRO 9 Cb -0.14 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.58 2a51 s PRO 9 CO 0.07 -2.34 0.00 0.41 0.04 0.00 0.00 177.00 175.18 2a51 n GLY 10 N -2.40 0.79 0.52 0.56 0.00 -1.11 -4.84 105.19 98.71 2a51 n GLY 10 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.08 -1.03 -4.21 1.61 1.44 -1.26 -5.01 115.22 104.68 2a51 n HIS 11 Ca 0.00 -0.28 -0.18 0.00 -2.01 0.00 0.00 57.72 55.25 2a51 n HIS 11 Cb 0.00 0.12 -0.11 0.00 0.12 0.00 0.00 29.99 30.11 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 -2.77 1.19 0.53 0.61 2.01 -1.26 -1.64 115.64 114.31 2a51 s THR 12 Ca 0.03 -1.55 0.25 0.00 0.31 0.00 0.00 61.69 60.72 2a51 s THR 12 Cb -0.01 -1.34 0.39 0.00 0.01 0.00 0.00 72.50 71.56 2a51 s THR 12 CO 0.02 -0.36 2.00 0.00 -0.69 0.00 0.00 174.62 175.59 2a51 h ALA 13 N 3.82 2.47 -0.62 7.40 0.00 -1.87 -0.38 119.26 130.08 2a51 h ALA 13 Ca -0.40 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 54.60 2a51 h ALA 13 Cb 1.19 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 2a51 h ALA 13 CO 0.47 -0.61 0.20 -0.09 0.00 0.00 0.00 179.25 179.22 2a51 h ARG 14 N 0.01 0.35 0.03 0.00 9.65 -1.98 -2.70 114.38 119.74 2a51 h ARG 14 Ca 0.24 -0.02 -0.24 0.00 -1.10 0.00 0.00 59.98 58.86 2a51 h ARG 14 Cb 0.95 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 29.43 2a51 h ARG 14 CO -0.00 0.23 -1.22 0.52 2.80 0.00 0.00 179.97 182.29 2a51 h MET 15 N 0.36 0.06 -6.48 0.20 2.86 -1.53 -3.47 114.93 106.92 2a51 h MET 15 Ca 0.32 -0.10 -0.53 0.00 -2.06 0.00 0.00 59.70 57.33 2a51 h MET 15 Cb 0.44 0.04 0.02 0.00 0.06 0.00 0.00 31.60 32.15 2a51 h MET 15 CO -0.35 0.94 0.89 0.00 1.06 0.00 0.00 176.91 179.45 2a51 h ARG 17 N 7.63 0.00 -7.16 0.00 9.65 -1.90 -3.48 114.38 119.12 2a51 h ARG 17 Ca -0.42 0.00 -0.54 0.00 -1.10 0.00 0.00 59.98 57.93 2a51 h ARG 17 Cb 1.20 0.00 0.19 0.00 -1.39 0.00 0.00 29.97 29.96 2a51 h ARG 17 CO 0.91 0.80 0.26 1.04 2.80 0.00 0.00 179.97 185.77 2a51 n GLN 18 N -3.23 0.14 -2.08 0.20 6.02 -1.26 -5.03 117.38 112.14 2a51 n GLN 18 Ca -0.06 0.12 -0.29 0.00 -0.01 0.00 0.00 57.00 56.76 2a51 n GLN 18 Cb 0.97 -2.38 0.04 0.00 1.02 0.00 0.00 30.24 29.90 2a51 n GLN 18 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2a51 s PRO 19 N -4.05 2.79 0.85 -1.09 0.04 -1.26 -4.85 135.00 127.44 2a51 s PRO 19 Ca 0.72 0.25 -0.10 0.00 0.04 0.00 0.00 61.00 61.90 2a51 s PRO 19 Cb -0.29 -2.11 0.11 0.00 0.04 0.00 0.00 34.50 32.25 2a51 s PRO 19 CO 0.52 -0.96 1.13 0.50 0.04 0.00 0.00 177.00 178.22 2a51 s ARG 20 N -5.24 1.54 0.71 4.56 3.52 -1.26 -4.40 118.95 118.38 2a51 s ARG 20 Ca 0.57 1.40 -0.11 0.00 -0.13 0.00 0.00 55.73 57.45 2a51 s ARG 20 Cb -0.11 -1.80 0.02 0.00 -1.56 0.00 0.00 34.95 31.50 2a51 s ARG 20 CO 0.49 -2.22 1.10 -1.14 -0.81 0.00 0.00 175.30 172.72 2a51 s GLN 21 N -4.75 2.81 0.10 5.12 -0.44 -0.80 -4.92 119.66 116.78 2a51 s GLN 21 Ca 0.65 0.45 -0.33 0.00 -2.50 0.00 0.00 55.36 53.62 2a51 s GLN 21 Cb -0.21 -2.02 -0.14 0.00 -1.64 0.00 0.00 33.01 29.01 2a51 s GLN 21 CO 0.57 -1.07 1.59 0.93 0.50 0.00 0.00 175.29 177.81 2a51 h GLU 22 N -0.68 -0.79 0.00 1.67 5.08 -1.95 -3.48 114.58 114.43 2a51 h GLU 22 Ca -0.45 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 2a51 h GLU 22 Cb 1.26 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.69 2a51 h GLU 22 CO 0.64 -0.53 0.00 0.41 -1.00 0.00 0.00 179.01 178.53 2a51 n GLY 23 N -1.50 4.92 3.56 -3.84 0.00 -1.26 -4.85 105.19 102.21 2a51 n GLY 23 Ca -0.10 -0.73 -0.39 0.00 0.00 0.00 0.00 46.02 44.80 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 15.58 0.00 0.02 0.00 5.08 -1.90 0.41 115.95 135.14 2a51 h TRP 25 Ca -0.28 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.69 2a51 h TRP 25 Cb 1.19 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.35 2a51 h TRP 25 CO 1.00 0.13 -0.01 -0.97 -1.28 0.00 0.00 178.44 177.31 2a51 h ASN 26 N 0.00 -0.02 0.00 0.11 -1.24 -1.93 -3.40 115.58 109.10 2a51 h ASN 26 Ca -0.00 -0.69 -0.11 0.00 0.71 0.00 0.00 56.30 56.21 2a51 h ASN 26 Cb 0.83 0.01 -0.02 0.00 0.73 0.00 0.00 38.32 39.87 2a51 h ASN 26 CO 0.02 0.71 -1.47 0.00 -1.29 0.00 0.00 177.43 175.40 2a51 n GLY 28 N 2.47 0.82 3.76 0.00 0.00 0.15 -5.06 105.19 107.33 2a51 n GLY 28 Ca -0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.93 5.70 -0.15 1.61 0.15 -1.25 -4.73 113.70 113.11 2a51 s SER 29 Ca 0.00 2.77 0.06 0.00 0.70 0.00 0.00 55.95 59.48 2a51 s SER 29 Cb 0.00 -2.64 -0.23 0.00 -1.71 0.00 0.00 66.02 61.44 2a51 s SER 29 CO 0.00 -1.28 0.25 1.17 1.20 0.00 0.00 173.24 174.58 2a51 n LYS 30 N -0.53 0.68 -0.07 5.44 3.00 -1.26 0.23 118.16 125.65 2a51 n LYS 30 Ca 0.07 0.18 -0.10 0.00 -0.00 0.00 0.00 58.31 58.47 2a51 n LYS 30 Cb 0.44 -1.65 -0.03 0.00 0.00 0.00 0.00 35.03 33.79 2a51 n LYS 30 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2a51 h GLU 31 N 0.02 0.37 -6.16 1.64 4.39 -1.92 -3.39 114.58 109.52 2a51 h GLU 31 Ca -0.45 -0.06 -0.51 0.00 0.34 0.00 0.00 59.36 58.68 2a51 h GLU 31 Cb 2.05 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 30.59 2a51 h GLU 31 CO 0.03 0.37 -0.47 -3.38 -1.16 0.00 0.00 179.01 174.40 2a51 s HIS 32 N -5.69 2.84 0.43 4.33 -3.43 -1.26 -5.02 115.29 107.49 2a51 s HIS 32 Ca -0.13 -0.33 0.08 0.00 -0.80 0.00 0.00 55.06 53.87 2a51 s HIS 32 Cb 0.08 -1.76 -0.00 0.00 -1.43 0.00 0.00 32.58 29.47 2a51 s HIS 32 CO 0.72 0.22 0.47 1.03 -2.00 0.00 0.00 174.74 175.18 2a51 s ARG 33 N -3.95 2.61 0.14 -0.38 0.52 -1.26 -0.20 118.95 116.42 2a51 s ARG 33 Ca 0.40 -1.46 -0.18 0.00 -0.52 0.00 0.00 55.73 53.97 2a51 s ARG 33 Cb -0.05 -2.51 -0.02 0.00 0.52 0.00 0.00 34.95 32.89 2a51 s ARG 33 CO 0.25 -0.28 1.79 0.35 0.02 0.00 0.00 175.30 177.44 2a51 h PHE 34 N 0.83 0.36 -0.20 -0.53 3.57 -1.90 0.13 116.94 119.21 2a51 h PHE 34 Ca -0.40 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.14 2a51 h PHE 34 Cb 1.27 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.88 2a51 h PHE 34 CO 0.49 0.22 0.14 0.00 -2.23 0.00 0.00 178.31 176.93 2a51 h ALA 35 N 1.12 2.03 0.18 2.41 0.00 -1.93 -2.48 119.26 120.59 2a51 h ALA 35 Ca 0.11 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.71 2a51 h ALA 35 Cb -0.03 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 17.77 2a51 h ALA 35 CO -0.04 -0.07 -1.31 1.96 0.00 0.00 0.00 179.25 179.79 2a51 h GLN 36 N 0.12 0.58 -6.86 0.00 1.08 -1.77 -3.47 115.11 104.79 2a51 h GLN 36 Ca 0.09 -0.86 -0.54 0.00 -1.45 0.00 0.00 58.65 55.89 2a51 h GLN 36 Cb 0.19 0.30 0.10 0.00 -0.05 0.00 0.00 27.48 28.02 2a51 h GLN 36 CO -0.01 1.40 0.80 0.00 -0.95 0.00 0.00 178.83 180.06 2a51 h PRO 38 N 3.65 0.84 0.00 0.00 0.11 -1.91 -3.48 132.00 131.21 2a51 h PRO 38 Ca -0.49 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.57 2a51 h PRO 38 Cb 1.24 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2a51 h PRO 38 CO 0.70 0.55 0.00 1.63 -0.21 0.00 0.00 178.00 180.67