#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 -0.13 1.96 -1.32 -1.02 -3.16 115.64 111.98 2a51 s THR 2 Ca 0.00 -0.07 -0.29 0.00 -1.21 0.00 0.00 61.69 60.12 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 -0.04 1.59 0.00 -2.21 0.00 0.00 174.62 173.97 2a51 n PHE 4 N 7.56 0.62 -0.02 0.00 3.72 -1.26 -0.73 117.46 127.35 2a51 n PHE 4 Ca 0.17 0.22 -0.01 0.00 -0.05 0.00 0.00 57.45 57.78 2a51 n PHE 4 Cb 0.44 -0.85 -0.00 0.00 -0.94 0.00 0.00 39.48 38.12 2a51 n PHE 4 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 2a51 h ASN 5 N 0.00 0.00 0.56 4.37 -1.24 -1.91 -3.42 115.58 113.94 2a51 h ASN 5 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2a51 h ASN 5 Cb 0.45 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.50 2a51 h ASN 5 CO 0.00 0.17 -0.74 0.00 -1.29 0.00 0.00 177.43 175.57 2a51 n GLY 7 N 1.41 0.50 3.64 0.00 0.00 0.09 -4.80 105.19 106.03 2a51 n GLY 7 Ca 0.04 -0.95 -0.35 0.00 0.00 0.00 0.00 46.02 44.76 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 -2.54 3.46 0.98 1.61 -0.14 -1.24 -4.80 119.74 117.07 2a51 s LYS 8 Ca 0.00 -0.40 -0.14 0.00 -1.36 0.00 0.00 55.97 54.07 2a51 s LYS 8 Cb 0.00 -2.97 0.18 0.00 -1.68 0.00 0.00 37.83 33.36 2a51 s LYS 8 CO 0.00 0.47 1.17 -1.25 -0.76 0.00 0.00 175.35 174.98 2a51 s PRO 9 N -0.23 0.58 0.00 -1.68 0.04 -1.26 -1.23 135.00 131.21 2a51 s PRO 9 Ca 0.06 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.20 2a51 s PRO 9 Cb -0.12 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2a51 s PRO 9 CO 0.02 -2.54 0.00 0.41 0.04 0.00 0.00 177.00 174.93 2a51 n GLY 10 N -2.23 0.83 1.25 0.56 0.00 -1.19 -4.82 105.19 99.59 2a51 n GLY 10 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.09 -1.32 -4.32 1.61 1.44 -1.26 -5.03 115.22 104.25 2a51 n HIS 11 Ca 0.00 -0.67 -0.19 0.00 -2.01 0.00 0.00 57.72 54.85 2a51 n HIS 11 Cb 0.00 0.29 -0.11 0.00 0.12 0.00 0.00 29.99 30.29 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 -2.67 1.69 0.53 0.61 2.01 -1.26 -1.26 115.64 115.29 2a51 s THR 12 Ca 0.06 -2.01 0.29 0.00 0.31 0.00 0.00 61.69 60.34 2a51 s THR 12 Cb -0.01 -1.88 0.34 0.00 0.01 0.00 0.00 72.50 70.95 2a51 s THR 12 CO 0.05 -0.46 2.20 0.00 -0.69 0.00 0.00 174.62 175.71 2a51 h ALA 13 N 2.99 1.43 -0.70 7.40 0.00 -1.87 -2.65 119.26 125.86 2a51 h ALA 13 Ca -0.40 -0.04 0.14 0.00 0.00 0.00 0.00 54.91 54.61 2a51 h ALA 13 Cb 1.21 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.86 2a51 h ALA 13 CO 0.56 0.05 -0.15 -0.09 0.00 0.00 0.00 179.25 179.62 2a51 h ARG 14 N 0.00 0.01 0.04 0.00 2.43 -1.98 -2.29 114.38 112.60 2a51 h ARG 14 Ca -0.00 -0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 58.91 2a51 h ARG 14 Cb 0.12 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 2a51 h ARG 14 CO 0.01 0.01 -1.31 0.00 -1.51 0.00 0.00 179.97 177.16 2a51 h MET 15 N 0.01 0.09 -6.22 0.20 -0.00 -1.91 -3.46 114.93 103.65 2a51 h MET 15 Ca 0.34 -0.16 -0.57 0.00 -0.00 0.00 0.00 59.70 59.31 2a51 h MET 15 Cb 0.53 0.06 -0.02 0.00 -0.00 0.00 0.00 31.60 32.17 2a51 h MET 15 CO -0.71 0.95 1.29 0.00 -0.00 0.00 0.00 176.91 178.44 2a51 h ARG 17 N 12.65 0.00 -6.81 0.00 2.43 -1.89 -3.48 114.38 117.28 2a51 h ARG 17 Ca -0.37 0.00 -0.54 0.00 -0.81 0.00 0.00 59.98 58.26 2a51 h ARG 17 Cb 1.19 0.00 0.20 0.00 -0.42 0.00 0.00 29.97 30.94 2a51 h ARG 17 CO 1.00 0.24 -0.42 1.04 -1.51 0.00 0.00 179.97 180.32 2a51 n GLN 18 N -2.92 -0.10 -0.69 0.20 6.02 -1.26 -4.98 117.38 113.65 2a51 n GLN 18 Ca -0.04 0.02 -0.31 0.00 -0.01 0.00 0.00 57.00 56.66 2a51 n GLN 18 Cb 0.72 -1.92 0.17 0.00 1.02 0.00 0.00 30.24 30.23 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 -1.68 -0.43 -0.90 -1.09 -0.02 -1.26 -4.88 135.00 124.74 2a51 n PRO 19 Ca 0.08 -0.06 -0.17 0.00 -2.02 0.00 0.00 63.50 61.34 2a51 n PRO 19 Cb 0.52 -2.37 0.13 0.00 -0.02 0.00 0.00 33.50 31.75 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 -4.18 -1.30 -3.21 -0.52 1.85 -1.26 -4.40 116.66 103.64 2a51 n ARG 20 Ca 0.12 -1.10 -0.20 0.00 -1.00 0.00 0.00 57.85 55.66 2a51 n ARG 20 Cb 0.52 -0.83 0.01 0.00 -1.05 0.00 0.00 32.46 31.10 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 -4.56 3.04 0.17 2.89 2.00 -1.20 -4.88 119.66 117.12 2a51 s GLN 21 Ca 0.42 -0.81 -0.24 0.00 -2.00 0.00 0.00 55.36 52.73 2a51 s GLN 21 Cb -0.02 -2.70 0.07 0.00 0.80 0.00 0.00 33.01 31.16 2a51 s GLN 21 CO 0.30 -0.13 1.58 0.93 -0.50 0.00 0.00 175.29 177.47 2a51 h GLU 22 N 0.64 -0.21 0.00 1.67 3.07 -1.94 -3.46 114.58 114.35 2a51 h GLU 22 Ca -0.45 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.42 2a51 h GLU 22 Cb 1.26 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.22 2a51 h GLU 22 CO 0.54 -0.14 0.00 0.41 -1.40 0.00 0.00 179.01 178.42 2a51 n GLY 23 N -1.42 0.38 3.52 -3.84 0.00 -1.25 -4.89 105.19 97.70 2a51 n GLY 23 Ca 0.02 0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 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 8.93 0.00 0.02 0.00 5.08 -1.90 -0.56 115.95 127.52 2a51 h TRP 25 Ca -0.25 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.71 2a51 h TRP 25 Cb 1.09 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.25 2a51 h TRP 25 CO 0.75 0.33 -0.01 -0.97 -1.28 0.00 0.00 178.44 177.26 2a51 h ASN 26 N 0.00 -0.02 0.02 0.11 -1.24 -1.94 -3.36 115.58 109.16 2a51 h ASN 26 Ca -0.00 -0.64 -0.08 0.00 0.71 0.00 0.00 56.30 56.28 2a51 h ASN 26 Cb 1.21 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.25 2a51 h ASN 26 CO 0.04 0.64 -2.06 0.00 -1.29 0.00 0.00 177.43 174.76 2a51 n GLY 28 N 1.37 0.95 3.92 0.00 0.00 -0.26 -5.10 105.19 106.08 2a51 n GLY 28 Ca -0.10 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.04 4.21 0.00 1.61 0.15 -0.95 -4.88 113.70 111.81 2a51 s SER 29 Ca 0.00 0.46 0.00 0.00 0.70 0.00 0.00 55.95 57.11 2a51 s SER 29 Cb 0.00 -0.87 0.00 0.00 -1.71 0.00 0.00 66.02 63.44 2a51 s SER 29 CO 0.00 -2.03 0.00 0.29 1.20 0.00 0.00 173.24 172.70 2a51 n LYS 30 N -3.28 2.49 0.15 5.44 5.02 -1.26 -0.32 118.16 126.39 2a51 n LYS 30 Ca 0.10 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.26 2a51 n LYS 30 Cb 0.60 -0.74 -0.08 0.00 -0.02 0.00 0.00 35.03 34.79 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 -0.36 0.00 1.97 5.08 -1.96 -3.37 114.58 115.95 2a51 h GLU 31 Ca 0.00 0.02 -0.29 0.00 -1.00 0.00 0.00 59.36 58.09 2a51 h GLU 31 Cb 0.00 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.28 2a51 h GLU 31 CO 0.00 -0.09 -0.21 -2.39 -1.00 0.00 0.00 179.01 175.32 2a51 n HIS 32 N -5.15 0.49 -4.37 4.33 1.44 -1.26 -5.02 115.22 105.68 2a51 n HIS 32 Ca -0.10 -1.10 -0.24 0.00 -2.01 0.00 0.00 57.72 54.27 2a51 n HIS 32 Cb 0.23 -0.15 -0.09 0.00 0.12 0.00 0.00 29.99 30.11 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 -2.81 2.03 0.25 -1.40 0.52 -1.26 -0.65 118.95 115.62 2a51 s ARG 33 Ca 0.00 -1.68 -0.05 0.00 -0.52 0.00 0.00 55.73 53.49 2a51 s ARG 33 Cb -0.00 -1.94 0.48 0.00 0.52 0.00 0.00 34.95 34.01 2a51 s ARG 33 CO 0.00 0.24 1.67 0.35 0.02 0.00 0.00 175.30 177.59 2a51 h PHE 34 N 1.95 0.23 -0.90 -0.53 3.57 -1.90 -0.57 116.94 118.79 2a51 h PHE 34 Ca -0.42 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.17 2a51 h PHE 34 Cb 1.25 0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.95 2a51 h PHE 34 CO 0.73 -0.13 0.57 0.00 -2.23 0.00 0.00 178.31 177.26 2a51 h ALA 35 N 1.64 1.20 -0.02 2.41 0.00 -1.95 -2.20 119.26 120.35 2a51 h ALA 35 Ca 0.43 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.17 2a51 h ALA 35 Cb 0.75 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2a51 h ALA 35 CO -0.55 0.39 -0.64 1.96 0.00 0.00 0.00 179.25 180.42 2a51 h GLN 36 N 1.09 0.09 -6.89 0.00 1.08 -1.56 -3.46 115.11 105.46 2a51 h GLN 36 Ca 0.37 -0.07 -0.53 0.00 -1.45 0.00 0.00 58.65 56.97 2a51 h GLN 36 Cb 0.07 0.01 0.09 0.00 -0.05 0.00 0.00 27.48 27.59 2a51 h GLN 36 CO -0.14 0.70 0.75 0.00 -0.95 0.00 0.00 178.83 179.19 2a51 h PRO 38 N 3.56 0.07 0.00 0.00 0.13 -1.89 -3.49 132.00 130.38 2a51 h PRO 38 Ca -0.49 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2a51 h PRO 38 Cb 1.23 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2a51 h PRO 38 CO 0.68 0.69 0.00 1.17 -0.23 0.00 0.00 178.00 180.31