#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 0.02 -0.28 1.47 -1.32 -1.20 -2.48 115.64 111.85 2a51 s THR 2 Ca 0.00 -0.18 -0.29 0.00 -1.21 0.00 0.00 61.69 60.00 2a51 s THR 2 Cb 0.00 -0.47 -0.00 0.00 -1.51 0.00 0.00 72.50 70.52 2a51 s THR 2 CO 0.00 -0.10 1.29 0.00 -2.21 0.00 0.00 174.62 173.60 2a51 h PHE 4 N 9.07 0.00 0.00 0.00 0.04 -1.90 0.36 116.94 124.51 2a51 h PHE 4 Ca -0.26 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.51 2a51 h PHE 4 Cb 1.10 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.25 2a51 h PHE 4 CO 0.87 0.00 -0.16 -0.97 -0.60 0.00 0.00 178.31 177.45 2a51 h ASN 5 N 0.00 0.00 0.00 2.17 -1.24 -1.92 -3.43 115.58 111.17 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 0.44 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.49 2a51 h ASN 5 CO 0.00 0.38 -1.40 0.00 -1.29 0.00 0.00 177.43 175.12 2a51 n GLY 7 N 1.40 0.44 3.53 0.00 0.00 0.12 -4.80 105.19 105.89 2a51 n GLY 7 Ca 0.01 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.77 3.57 0.94 1.61 1.02 -1.25 -4.83 119.74 118.03 2a51 s LYS 8 Ca 0.00 -0.59 -0.11 0.00 0.02 0.00 0.00 55.97 55.29 2a51 s LYS 8 Cb 0.00 -3.76 0.14 0.00 -0.52 0.00 0.00 37.83 33.69 2a51 s LYS 8 CO 0.00 -0.39 1.03 -2.30 -0.92 0.00 0.00 175.35 172.77 2a51 n PRO 9 N 5.09 -0.54 -0.01 -1.68 -0.02 -1.26 -2.68 135.00 133.89 2a51 n PRO 9 Ca -0.13 -0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.25 2a51 n PRO 9 Cb 0.50 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 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 0.49 0.30 3.57 -1.23 0.00 -1.04 -4.88 105.19 102.41 2a51 n GLY 10 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 2a51 n GLY 10 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2a51 s HIS 11 N -2.10 0.87 0.13 1.61 -3.43 -1.26 -5.00 115.29 106.12 2a51 s HIS 11 Ca 0.00 -1.21 0.09 0.00 -0.80 0.00 0.00 55.06 53.14 2a51 s HIS 11 Cb 0.00 0.14 -0.04 0.00 -1.43 0.00 0.00 32.58 31.25 2a51 s HIS 11 CO 0.00 -1.26 -0.21 0.99 -2.00 0.00 0.00 174.74 172.26 2a51 s THR 12 N -2.78 1.86 0.55 -5.38 2.01 -1.26 -1.11 115.64 109.52 2a51 s THR 12 Ca 0.27 -1.73 0.25 0.00 0.31 0.00 0.00 61.69 60.79 2a51 s THR 12 Cb -0.02 -1.75 0.36 0.00 0.01 0.00 0.00 72.50 71.11 2a51 s THR 12 CO 0.19 -0.14 2.06 0.00 -0.69 0.00 0.00 174.62 176.04 2a51 h ALA 13 N 3.70 2.15 -0.64 7.40 0.00 -1.88 -0.62 119.26 129.38 2a51 h ALA 13 Ca -0.45 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.49 2a51 h ALA 13 Cb 1.19 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 2a51 h ALA 13 CO 0.44 -0.41 0.38 -0.09 0.00 0.00 0.00 179.25 179.57 2a51 h ARG 14 N 0.00 0.70 0.00 0.00 2.43 -1.98 -2.82 114.38 112.72 2a51 h ARG 14 Ca 0.14 -0.04 -0.25 0.00 -0.81 0.00 0.00 59.98 59.03 2a51 h ARG 14 Cb 0.64 -0.16 0.02 0.00 -0.42 0.00 0.00 29.97 30.05 2a51 h ARG 14 CO -0.00 0.47 -0.97 0.52 -1.51 0.00 0.00 179.97 178.48 2a51 h MET 15 N 0.73 0.65 -6.56 0.20 2.86 -1.58 -3.46 114.93 107.75 2a51 h MET 15 Ca 0.27 -0.70 -0.56 0.00 -2.06 0.00 0.00 59.70 56.65 2a51 h MET 15 Cb 0.09 0.20 0.06 0.00 0.06 0.00 0.00 31.60 32.01 2a51 h MET 15 CO -0.14 1.29 0.86 0.00 1.06 0.00 0.00 176.91 179.99 2a51 n ARG 17 N 3.53 0.67 -1.05 0.00 3.00 -1.26 -4.94 116.66 116.60 2a51 n ARG 17 Ca 0.16 0.04 -0.34 0.00 -0.00 0.00 0.00 57.85 57.71 2a51 n ARG 17 Cb 0.31 -1.59 0.11 0.00 0.00 0.00 0.00 32.46 31.28 2a51 n ARG 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 2a51 n GLN 18 N -2.76 0.06 -1.39 -0.14 6.02 -1.26 -5.00 117.38 112.92 2a51 n GLN 18 Ca -0.25 0.08 -0.30 0.00 -0.01 0.00 0.00 57.00 56.52 2a51 n GLN 18 Cb 1.05 -2.03 0.10 0.00 1.02 0.00 0.00 30.24 30.37 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 -3.48 2.02 0.91 -1.09 0.04 -1.26 -4.89 135.00 127.26 2a51 s PRO 19 Ca 0.65 0.87 -0.13 0.00 0.04 0.00 0.00 61.00 62.42 2a51 s PRO 19 Cb -0.29 -1.89 0.14 0.00 0.04 0.00 0.00 34.50 32.51 2a51 s PRO 19 CO 0.59 -1.72 1.18 -0.98 0.04 0.00 0.00 177.00 176.11 2a51 s ARG 20 N -5.01 1.11 1.01 4.56 3.03 -1.26 -4.47 118.95 117.91 2a51 s ARG 20 Ca 0.61 0.07 -0.11 0.00 2.03 0.00 0.00 55.73 58.33 2a51 s ARG 20 Cb -0.16 -1.86 0.20 0.00 -1.03 0.00 0.00 34.95 32.10 2a51 s ARG 20 CO 0.56 -2.18 1.09 1.14 -1.13 0.00 0.00 175.30 174.78 2a51 s GLN 21 N -5.50 0.26 -0.10 3.89 -2.07 -0.48 -4.90 119.66 110.76 2a51 s GLN 21 Ca 0.66 1.20 -0.04 0.00 -1.82 0.00 0.00 55.36 55.35 2a51 s GLN 21 Cb -0.11 -1.66 -0.03 0.00 -1.09 0.00 0.00 33.01 30.11 2a51 s GLN 21 CO 0.52 -3.03 0.12 0.93 -1.32 0.00 0.00 175.29 172.51 2a51 h GLU 22 N -2.14 -0.03 0.00 9.60 5.08 -1.95 -3.50 114.58 121.63 2a51 h GLU 22 Ca -0.51 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 2a51 h GLU 22 Cb 1.29 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.55 2a51 h GLU 22 CO 0.46 0.09 0.00 0.41 -1.00 0.00 0.00 179.01 178.97 2a51 n GLY 23 N 1.67 5.56 3.58 -3.84 0.00 -1.26 -4.94 105.19 105.97 2a51 n GLY 23 Ca -0.01 -1.06 -0.41 0.00 0.00 0.00 0.00 46.02 44.53 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 11.87 0.08 0.35 0.00 5.08 -1.90 0.75 115.95 132.18 2a51 h TRP 25 Ca -0.28 -0.03 -0.02 0.00 1.08 0.00 0.00 58.89 59.65 2a51 h TRP 25 Cb 1.11 -0.02 0.00 0.00 -3.00 0.00 0.00 29.16 27.26 2a51 h TRP 25 CO 1.02 0.59 -0.17 -0.97 -1.28 0.00 0.00 178.44 177.63 2a51 h ASN 26 N 0.05 -0.39 0.67 0.11 -1.24 -1.92 -3.36 115.58 109.50 2a51 h ASN 26 Ca -0.00 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.02 2a51 h ASN 26 Cb 0.96 0.10 0.00 0.00 0.73 0.00 0.00 38.32 40.11 2a51 h ASN 26 CO 0.07 -0.08 -0.77 0.00 -1.29 0.00 0.00 177.43 175.36 2a51 n GLY 28 N 1.36 0.69 3.68 0.00 0.00 0.23 -5.07 105.19 106.08 2a51 n GLY 28 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.81 2.99 -0.02 1.61 0.15 -1.06 -4.81 113.70 109.74 2a51 s SER 29 Ca 0.00 1.55 0.01 0.00 0.70 0.00 0.00 55.95 58.21 2a51 s SER 29 Cb 0.00 -2.21 -0.02 0.00 -1.71 0.00 0.00 66.02 62.08 2a51 s SER 29 CO 0.00 -2.95 -0.01 1.17 1.20 0.00 0.00 173.24 172.65 2a51 n LYS 30 N -4.09 1.56 -0.11 5.44 3.00 -1.26 -0.49 118.16 122.20 2a51 n LYS 30 Ca 0.07 0.01 -0.11 0.00 -0.00 0.00 0.00 58.31 58.28 2a51 n LYS 30 Cb 0.55 -1.05 -0.03 0.00 0.00 0.00 0.00 35.03 34.50 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 0.00 0.57 -5.21 1.64 4.39 -1.94 -3.39 114.58 110.63 2a51 h GLU 31 Ca -0.05 -0.18 -0.65 0.00 0.34 0.00 0.00 59.36 58.82 2a51 h GLU 31 Cb 1.09 -0.05 -0.13 0.00 -0.10 0.00 0.00 28.75 29.56 2a51 h GLU 31 CO -0.00 0.70 -0.52 -3.38 -1.16 0.00 0.00 179.01 174.64 2a51 s HIS 32 N -5.01 1.91 0.33 4.33 -3.43 -1.26 -5.03 115.29 107.13 2a51 s HIS 32 Ca -0.13 -0.99 0.09 0.00 -0.80 0.00 0.00 55.06 53.24 2a51 s HIS 32 Cb 0.09 -1.55 -0.06 0.00 -1.43 0.00 0.00 32.58 29.63 2a51 s HIS 32 CO 0.77 0.16 -0.04 1.03 -2.00 0.00 0.00 174.74 174.66 2a51 s ARG 33 N -3.84 1.99 0.21 -0.38 0.52 -1.26 -0.15 118.95 116.04 2a51 s ARG 33 Ca 0.12 -1.77 -0.09 0.00 -0.52 0.00 0.00 55.73 53.46 2a51 s ARG 33 Cb 0.03 -1.87 0.27 0.00 0.52 0.00 0.00 34.95 33.90 2a51 s ARG 33 CO 0.06 0.17 1.79 0.35 0.02 0.00 0.00 175.30 177.69 2a51 h PHE 34 N 1.91 0.63 -0.92 -0.53 3.57 -1.90 0.01 116.94 119.72 2a51 h PHE 34 Ca -0.42 0.03 0.17 0.00 3.53 0.00 0.00 57.97 61.27 2a51 h PHE 34 Cb 1.25 -0.18 -0.10 0.00 2.79 0.00 0.00 35.95 39.71 2a51 h PHE 34 CO 0.73 0.27 0.50 0.00 -2.23 0.00 0.00 178.31 177.58 2a51 h ALA 35 N 1.38 1.45 -0.11 2.41 0.00 -1.88 -1.93 119.26 120.58 2a51 h ALA 35 Ca 0.32 0.09 -0.23 0.00 0.00 0.00 0.00 54.91 55.08 2a51 h ALA 35 Cb 0.27 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.04 2a51 h ALA 35 CO -0.22 -0.09 -0.84 1.96 0.00 0.00 0.00 179.25 180.05 2a51 h GLN 36 N 0.66 0.76 -6.72 0.00 4.20 -1.57 -3.46 115.11 108.98 2a51 h GLN 36 Ca 0.52 -0.68 -0.53 0.00 0.06 0.00 0.00 58.65 58.03 2a51 h GLN 36 Cb 0.79 0.16 0.05 0.00 0.30 0.00 0.00 27.48 28.77 2a51 h GLN 36 CO -0.39 1.27 0.75 0.00 -0.67 0.00 0.00 178.83 179.79 2a51 h PRO 38 N 5.22 0.71 -0.00 0.00 0.11 -1.89 -3.47 132.00 132.67 2a51 h PRO 38 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2a51 h PRO 38 Cb 1.22 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2a51 h PRO 38 CO 0.78 0.47 0.00 1.63 -0.21 0.00 0.00 178.00 180.67