#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fh3 s ARG 2 N 0.00 0.96 -0.04 7.34 3.03 -0.89 -4.86 118.95 124.50 1fh3 s ARG 2 Ca 0.00 -1.46 0.01 0.00 2.03 0.00 0.00 55.73 56.31 1fh3 s ARG 2 Cb 0.00 0.23 0.02 0.00 -1.03 0.00 0.00 34.95 34.17 1fh3 s ARG 2 CO 0.00 -0.27 -0.05 -0.51 -1.13 0.00 0.00 175.30 173.34 1fh3 s ASP 3 N -3.06 0.95 0.14 -2.89 1.01 -1.26 -1.84 116.67 109.72 1fh3 s ASP 3 Ca 0.26 -0.13 -0.07 0.00 0.71 0.00 0.00 52.55 53.32 1fh3 s ASP 3 Cb 0.07 -0.46 0.03 0.00 1.01 0.00 0.00 42.92 43.57 1fh3 s ASP 3 CO 0.03 -0.04 0.35 0.61 0.21 0.00 0.00 175.17 176.33 1fh3 n GLY 4 N 3.99 1.44 3.73 0.21 0.00 -1.03 -5.00 105.19 108.52 1fh3 n GLY 4 Ca -0.25 -1.09 -0.41 0.00 0.00 0.00 0.00 46.02 44.27 1fh3 n GLY 4 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fh3 s TYR 5 N -5.75 3.71 0.11 1.61 2.02 -1.26 -2.08 117.35 115.71 1fh3 s TYR 5 Ca 0.07 1.70 -0.15 0.00 -0.37 0.00 0.00 57.07 58.32 1fh3 s TYR 5 Cb -0.02 -3.16 -0.07 0.00 -0.40 0.00 0.00 41.96 38.32 1fh3 s TYR 5 CO 0.04 -0.19 0.52 -1.50 -1.57 0.00 0.00 175.55 172.86 1fh3 s ILE 6 N -0.05 4.88 0.00 2.71 2.07 0.60 -3.33 121.20 128.08 1fh3 s ILE 6 Ca 0.48 0.85 0.00 0.00 -1.41 0.00 0.00 60.65 60.58 1fh3 s ILE 6 Cb -0.26 -3.75 0.00 0.00 0.13 0.00 0.00 42.46 38.58 1fh3 s ILE 6 CO 0.32 0.34 0.00 0.00 -1.91 0.00 0.00 174.94 173.69 1fh3 n ALA 7 N 1.08 0.00 -2.55 1.50 0.00 -1.26 -2.90 120.51 116.38 1fh3 n ALA 7 Ca -0.07 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.13 1fh3 n ALA 7 Cb 0.52 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.84 1fh3 n ALA 7 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1fh3 s GLN 8 N 2.91 1.11 0.54 0.00 -2.07 -1.26 -4.20 119.66 116.68 1fh3 s GLN 8 Ca 0.00 -1.14 -0.19 0.00 -1.82 0.00 0.00 55.36 52.21 1fh3 s GLN 8 Cb 0.00 -1.35 -0.06 0.00 -1.09 0.00 0.00 33.01 30.51 1fh3 s GLN 8 CO 0.00 0.31 1.10 -1.25 -1.32 0.00 0.00 175.29 174.14 1fh3 s PRO 9 N -1.87 3.42 -0.02 9.60 0.04 -1.26 -3.43 135.00 141.48 1fh3 s PRO 9 Ca 0.06 1.52 -0.01 0.00 0.04 0.00 0.00 61.00 62.60 1fh3 s PRO 9 Cb -0.10 -2.02 -0.27 0.00 0.04 0.00 0.00 34.50 32.15 1fh3 s PRO 9 CO 0.04 -0.78 0.76 0.93 0.04 0.00 0.00 177.00 177.99 1fh3 h GLU 10 N 1.17 0.22 -2.07 4.56 4.39 -0.69 -3.38 114.58 118.77 1fh3 h GLU 10 Ca -0.50 -0.37 -0.06 0.00 0.34 0.00 0.00 59.36 58.78 1fh3 h GLU 10 Cb 1.25 0.14 -0.20 0.00 -0.10 0.00 0.00 28.75 29.84 1fh3 h GLU 10 CO 0.57 1.04 0.13 1.21 -1.16 0.00 0.00 179.01 180.81 1fh3 s ASN 11 N -6.87 -0.67 0.00 1.42 2.47 -1.16 -4.25 114.94 105.88 1fh3 s ASN 11 Ca -0.10 1.01 0.00 0.00 0.42 0.00 0.00 52.86 54.19 1fh3 s ASN 11 Cb 0.07 0.94 0.00 0.00 -1.45 0.00 0.00 41.25 40.81 1fh3 s ASN 11 CO 0.84 -0.43 0.00 0.00 -3.72 0.00 0.00 177.10 173.78 1fh3 s VAL 13 N -3.47 1.47 0.00 0.00 -7.23 -1.26 -4.40 120.40 105.51 1fh3 s VAL 13 Ca 0.00 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.08 1fh3 s VAL 13 Cb 0.00 -2.45 0.00 0.00 0.56 0.00 0.00 36.38 34.49 1fh3 s VAL 13 CO 0.00 -0.28 0.00 0.00 -0.31 0.00 0.00 175.10 174.51 1fh3 n TYR 14 N -0.56 -2.25 -4.08 2.82 4.19 -1.20 -4.16 117.16 111.92 1fh3 n TYR 14 Ca -0.05 0.00 -0.13 0.00 3.31 0.00 0.00 57.90 61.03 1fh3 n TYR 14 Cb 0.64 0.00 -0.11 0.00 0.49 0.00 0.00 39.34 40.35 1fh3 n TYR 14 CO 0.00 0.00 0.00 -1.01 0.91 0.00 0.00 176.86 176.76 1fh3 s HIS 15 N 0.79 0.72 0.19 2.98 3.76 -1.26 -4.10 115.29 118.37 1fh3 s HIS 15 Ca 0.00 -0.55 0.09 0.00 -0.15 0.00 0.00 55.06 54.45 1fh3 s HIS 15 Cb 0.00 -0.43 -0.04 0.00 1.11 0.00 0.00 32.58 33.22 1fh3 s HIS 15 CO 0.00 -0.08 -0.18 0.00 -0.85 0.00 0.00 174.74 173.62 1fh3 s PHE 17 N -2.30 3.02 -0.27 0.00 0.08 -1.26 -4.96 117.98 112.28 1fh3 s PHE 17 Ca 0.20 -1.00 -0.28 0.00 0.12 0.00 0.00 56.93 55.96 1fh3 s PHE 17 Cb -0.05 -2.14 -0.06 0.00 -0.57 0.00 0.00 43.02 40.21 1fh3 s PHE 17 CO 0.08 -0.57 2.26 -2.30 -0.10 0.00 0.00 175.22 174.59 1fh3 n PRO 18 N 4.80 1.76 0.00 0.24 -0.02 -1.26 -0.62 135.00 139.90 1fh3 n PRO 18 Ca -0.17 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1fh3 n PRO 18 Cb 0.50 -3.25 0.00 0.00 -0.02 0.00 0.00 33.50 30.73 1fh3 n PRO 18 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fh3 n GLY 19 N 5.85 2.32 0.00 -1.23 0.00 -1.26 -4.96 105.19 105.91 1fh3 n GLY 19 Ca 0.32 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1fh3 n GLY 19 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1fh3 n SER 20 N 0.00 0.00 -0.36 1.61 7.64 0.20 -4.96 113.62 117.75 1fh3 n SER 20 Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.90 1fh3 n SER 20 Cb 0.00 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.29 1fh3 n SER 20 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1fh3 n SER 21 N 0.16 -0.49 -0.11 6.43 7.64 -1.26 -0.05 113.62 125.94 1fh3 n SER 21 Ca 0.00 1.69 -0.13 0.00 1.01 0.00 0.00 58.87 61.43 1fh3 n SER 21 Cb 0.00 -0.45 -0.03 0.00 -1.01 0.00 0.00 64.21 62.72 1fh3 n SER 21 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1fh3 h GLY 22 N 0.00 0.88 0.99 0.23 0.00 -1.95 -1.42 103.07 101.80 1fh3 h GLY 22 Ca 0.40 -0.89 -0.05 0.00 0.00 0.00 0.00 47.33 46.79 1fh3 h GLY 22 CO -0.98 0.80 -1.14 0.00 0.00 0.00 0.00 176.54 175.23 1fh3 h ASP 24 N 0.00 0.79 -0.27 0.00 1.82 -0.48 0.32 116.42 118.59 1fh3 h ASP 24 Ca -0.05 -0.01 -0.00 0.00 -0.39 0.00 0.00 57.03 56.58 1fh3 h ASP 24 Cb 1.18 -0.19 -0.01 0.00 0.68 0.00 0.00 39.33 40.99 1fh3 h ASP 24 CO 0.01 0.56 0.17 0.74 -1.61 0.00 0.00 179.24 179.11 1fh3 h THR 25 N 0.93 1.09 -0.63 2.25 2.02 -1.08 -1.21 112.91 116.28 1fh3 h THR 25 Ca 0.27 -0.20 0.02 0.00 0.77 0.00 0.00 66.41 67.27 1fh3 h THR 25 Cb -0.07 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.03 1fh3 h THR 25 CO -0.07 0.09 0.39 -0.07 0.37 0.00 0.00 175.52 176.23 1fh3 h LEU 26 N 0.35 0.65 -0.47 2.58 3.38 -0.93 -1.12 115.31 119.75 1fh3 h LEU 26 Ca 0.10 -0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.14 1fh3 h LEU 26 Cb -0.00 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.54 1fh3 h LEU 26 CO -0.02 0.46 0.10 0.00 0.09 0.00 0.00 178.44 179.07 1fh3 h LYS 28 N 0.24 0.91 0.00 0.00 1.79 -0.39 0.34 116.57 119.46 1fh3 h LYS 28 Ca 0.23 -0.45 -0.10 0.00 -2.18 0.00 0.00 60.65 58.16 1fh3 h LYS 28 Cb 0.30 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.94 1fh3 h LYS 28 CO -0.30 1.10 -0.47 1.05 -1.08 0.00 0.00 179.45 179.75 1fh3 h GLU 29 N 0.73 0.00 0.16 3.15 4.11 -1.04 -3.07 114.58 118.62 1fh3 h GLU 29 Ca 0.07 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.50 1fh3 h GLU 29 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1fh3 h GLU 29 CO 0.08 0.47 -0.08 0.87 0.07 0.00 0.00 179.01 180.43 1fh3 h LYS 30 N 0.00 -0.21 0.00 1.06 6.56 -1.03 -3.49 116.57 119.46 1fh3 h LYS 30 Ca -0.00 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 1fh3 h LYS 30 Cb 1.26 0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.96 1fh3 h LYS 30 CO 0.06 0.22 0.00 0.41 -2.06 0.00 0.00 179.45 178.08 1fh3 n GLY 31 N 0.59 0.26 3.54 3.86 0.00 0.59 -5.01 105.19 109.02 1fh3 n GLY 31 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1fh3 n GLY 31 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fh3 s GLY 32 N -0.05 1.68 -0.03 -0.02 0.00 0.87 -4.23 107.32 105.54 1fh3 s GLY 32 Ca 0.00 -0.88 0.20 0.00 0.00 0.00 0.00 44.72 44.05 1fh3 s GLY 32 CO 0.00 -0.49 1.53 -1.30 0.00 0.00 0.00 173.10 172.84 1fh3 n THR 33 N 2.65 1.19 -3.42 0.90 -2.24 -0.53 -3.53 114.28 109.29 1fh3 n THR 33 Ca -0.18 -1.05 -0.12 0.00 -2.27 0.00 0.00 64.05 60.43 1fh3 n THR 33 Cb 0.53 0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 69.15 1fh3 n THR 33 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1fh3 s SER 34 N -0.99 -0.57 0.06 3.42 0.01 -1.23 -4.97 113.70 109.42 1fh3 s SER 34 Ca 0.47 0.00 -0.28 0.00 1.31 0.00 0.00 55.95 57.45 1fh3 s SER 34 Cb 0.26 0.60 0.09 0.00 0.21 0.00 0.00 66.02 67.18 1fh3 s SER 34 CO 0.30 -0.97 1.12 -0.83 0.41 0.00 0.00 173.24 173.26 1fh3 s GLY 35 N -2.74 -0.32 0.00 3.44 0.00 -1.26 -1.04 107.32 105.39 1fh3 s GLY 35 Ca 0.01 0.43 0.00 0.00 0.00 0.00 0.00 44.72 45.16 1fh3 s GLY 35 CO -0.13 0.07 0.00 1.42 0.00 0.00 0.00 173.10 174.46 1fh3 n HIS 36 N -0.47 -0.46 -2.99 1.90 8.25 -1.08 -4.93 115.22 115.44 1fh3 n HIS 36 Ca -0.07 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.19 1fh3 n HIS 36 Cb 0.62 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.79 1fh3 n HIS 36 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fh3 s GLY 38 N -4.63 0.05 -0.00 0.00 0.00 -1.12 -4.23 107.32 97.39 1fh3 s GLY 38 Ca 0.61 -0.25 -0.06 0.00 0.00 0.00 0.00 44.72 45.03 1fh3 s GLY 38 CO 0.39 3.76 0.11 -0.12 0.00 0.00 0.00 173.10 177.25 1fh3 s PHE 39 N -2.06 0.04 -0.17 1.90 2.19 -1.26 -1.05 117.98 117.57 1fh3 s PHE 39 Ca 0.25 -0.12 -0.02 0.00 0.33 0.00 0.00 56.93 57.38 1fh3 s PHE 39 Cb -0.02 -0.05 0.05 0.00 -1.31 0.00 0.00 43.02 41.69 1fh3 s PHE 39 CO 0.03 -0.24 0.01 0.21 1.83 0.00 0.00 175.22 177.06 1fh3 s LYS 40 N -1.19 0.82 -0.08 10.12 2.36 0.82 -4.72 119.74 127.87 1fh3 s LYS 40 Ca -0.13 -0.37 -0.30 0.00 -2.55 0.00 0.00 55.97 52.63 1fh3 s LYS 40 Cb -0.07 -1.90 -0.03 0.00 -1.05 0.00 0.00 37.83 34.78 1fh3 s LYS 40 CO 0.01 -0.54 1.21 0.08 1.55 0.00 0.00 175.35 177.66 1fh3 s VAL 41 N 1.82 4.25 0.00 4.02 1.01 -1.26 -1.00 120.40 129.24 1fh3 s VAL 41 Ca 0.00 1.57 0.00 0.00 0.00 0.00 0.00 61.98 63.55 1fh3 s VAL 41 Cb -0.16 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1fh3 s VAL 41 CO -0.07 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.61 1fh3 n GLY 42 N 3.41 1.23 0.61 4.51 0.00 -1.26 -4.90 105.19 108.80 1fh3 n GLY 42 Ca 0.12 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1fh3 n GLY 42 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fh3 n HIS 43 N 0.00 0.00 -1.15 1.61 8.25 -0.57 -5.09 115.22 118.27 1fh3 n HIS 43 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1fh3 n HIS 43 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1fh3 n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fh3 n GLY 44 N 2.90 -0.38 3.77 -1.41 0.00 -0.17 -5.02 105.19 104.89 1fh3 n GLY 44 Ca 0.00 -0.95 -0.38 0.00 0.00 0.00 0.00 46.02 44.69 1fh3 n GLY 44 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fh3 s LEU 45 N 0.00 4.20 0.00 0.99 0.20 -1.26 -0.13 118.68 122.68 1fh3 s LEU 45 Ca 0.00 2.24 0.00 0.00 0.69 0.00 0.00 54.13 57.06 1fh3 s LEU 45 Cb 0.00 -4.04 0.00 0.00 -0.43 0.00 0.00 46.19 41.72 1fh3 s LEU 45 CO 0.00 -0.57 0.00 0.00 -0.29 0.00 0.00 176.35 175.49 1fh3 n ALA 46 N 0.12 0.00 -4.69 5.97 0.00 -0.22 -4.56 120.51 117.13 1fh3 n ALA 46 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.16 1fh3 n ALA 46 Cb 0.47 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.85 1fh3 n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fh3 s TRP 48 N -2.97 1.24 0.00 0.00 -0.11 -0.97 -0.29 118.94 115.84 1fh3 s TRP 48 Ca 0.07 -0.54 -0.13 0.00 1.22 0.00 0.00 56.10 56.73 1fh3 s TRP 48 Cb 0.00 -0.68 0.02 0.00 -1.50 0.00 0.00 33.47 31.31 1fh3 s TRP 48 CO 0.05 0.08 0.26 0.00 -4.62 0.00 0.00 176.95 172.72 1fh3 s ASN 50 N -1.48 3.51 -0.78 0.00 -0.87 -0.21 -2.47 114.94 112.64 1fh3 s ASN 50 Ca -0.12 -0.36 -0.04 0.00 -1.57 0.00 0.00 52.86 50.77 1fh3 s ASN 50 Cb -0.05 -0.56 -0.04 0.00 -0.02 0.00 0.00 41.25 40.57 1fh3 s ASN 50 CO 0.02 0.32 0.67 0.00 -2.57 0.00 0.00 177.10 175.55 1fh3 n ALA 51 N 2.29 -1.87 -2.42 0.60 0.00 -0.76 -1.45 120.51 116.90 1fh3 n ALA 51 Ca -0.17 0.08 -0.34 0.00 0.00 0.00 0.00 53.44 53.01 1fh3 n ALA 51 Cb 0.52 -3.99 -0.06 0.00 0.00 0.00 0.00 19.45 15.92 1fh3 n ALA 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fh3 s LEU 52 N -4.79 4.29 0.89 0.00 1.43 -0.98 -4.19 118.68 115.33 1fh3 s LEU 52 Ca 0.28 0.98 -0.11 0.00 -1.03 0.00 0.00 54.13 54.25 1fh3 s LEU 52 Cb -0.04 -3.34 0.13 0.00 0.03 0.00 0.00 46.19 42.97 1fh3 s LEU 52 CO 0.53 0.06 1.10 -2.84 0.23 0.00 0.00 176.35 175.44 1fh3 s PRO 53 N -2.21 1.24 0.49 1.29 0.02 -1.26 -2.08 135.00 132.48 1fh3 s PRO 53 Ca 0.40 1.10 0.31 0.00 0.02 0.00 0.00 61.00 62.83 1fh3 s PRO 53 Cb -0.14 -1.79 1.18 0.00 0.02 0.00 0.00 34.50 33.77 1fh3 s PRO 53 CO 0.20 -2.33 1.90 -0.44 -0.33 0.00 0.00 177.00 175.99 1fh3 h ASP 54 N -1.63 0.00 0.11 2.53 3.32 -1.97 -2.18 116.42 116.60 1fh3 h ASP 54 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1fh3 h ASP 54 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1fh3 h ASP 54 CO 0.50 0.00 -0.01 -0.46 -1.72 0.00 0.00 179.24 177.55 1fh3 n ASN 55 N -2.95 0.30 -4.72 6.45 6.94 -1.26 -4.72 115.26 115.31 1fh3 n ASN 55 Ca 0.01 -0.93 -0.37 0.00 -0.02 0.00 0.00 54.58 53.28 1fh3 n ASN 55 Cb 0.33 -0.04 -0.07 0.00 -2.36 0.00 0.00 39.78 37.63 1fh3 n ASN 55 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1fh3 s VAL 56 N -2.13 5.28 0.22 3.53 1.01 -0.82 -5.07 120.40 122.42 1fh3 s VAL 56 Ca 0.42 0.60 -0.01 0.00 0.00 0.00 0.00 61.98 62.99 1fh3 s VAL 56 Cb 0.21 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1fh3 s VAL 56 CO 0.39 0.36 0.41 -0.83 0.00 0.00 0.00 175.10 175.43 1fh3 s GLY 57 N 0.59 1.75 0.00 4.51 0.00 -1.26 -4.93 107.32 107.98 1fh3 s GLY 57 Ca 0.18 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 44.07 1fh3 s GLY 57 CO 0.05 -0.78 0.00 0.29 0.00 0.00 0.00 173.10 172.66 1fh3 n ILE 58 N -0.76 0.00 -2.62 0.90 -5.35 -1.26 -4.47 119.36 105.79 1fh3 n ILE 58 Ca -0.05 0.00 -0.40 0.00 -0.27 0.00 0.00 62.75 62.03 1fh3 n ILE 58 Cb 0.54 0.00 -0.05 0.00 -1.74 0.00 0.00 39.64 38.39 1fh3 n ILE 58 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1fh3 s ILE 59 N 0.09 3.82 0.16 7.28 -1.09 -1.21 -4.38 121.20 125.88 1fh3 s ILE 59 Ca 0.00 1.82 -0.09 0.00 -2.23 0.00 0.00 60.65 60.15 1fh3 s ILE 59 Cb 0.00 -4.16 -0.01 0.00 -1.58 0.00 0.00 42.46 36.72 1fh3 s ILE 59 CO 0.00 0.43 0.28 -0.69 -1.23 0.00 0.00 174.94 173.73 1fh3 s VAL 60 N -1.10 0.07 0.10 2.92 1.01 -1.26 -4.98 120.40 117.16 1fh3 s VAL 60 Ca 0.43 -1.36 -0.23 0.00 0.00 0.00 0.00 61.98 60.82 1fh3 s VAL 60 Cb -0.29 -1.79 0.06 0.00 0.00 0.00 0.00 36.38 34.36 1fh3 s VAL 60 CO 0.36 -0.32 0.57 -0.70 0.00 0.00 0.00 175.10 175.00 1fh3 s GLU 61 N -3.96 1.17 0.00 2.72 2.12 -1.26 -4.74 118.70 114.75 1fh3 s GLU 61 Ca 0.16 -0.35 0.00 0.00 0.36 0.00 0.00 54.97 55.14 1fh3 s GLU 61 Cb 0.03 0.54 0.00 0.00 0.26 0.00 0.00 34.13 34.96 1fh3 s GLU 61 CO -0.01 -0.47 0.00 0.41 -0.54 0.00 0.00 175.26 174.65 1fh3 n GLY 62 N -0.01 3.44 0.00 -1.50 0.00 -1.26 -4.93 105.19 100.94 1fh3 n GLY 62 Ca -0.17 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1fh3 n GLY 62 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1fh3 n GLU 63 N 0.00 3.68 -0.38 1.61 4.07 -1.26 -5.16 120.64 123.19 1fh3 n GLU 63 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1fh3 n GLU 63 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1fh3 n GLU 63 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1fh3 n LYS 64 N 0.00 0.00 -1.79 5.31 4.81 -1.26 -5.06 118.16 120.16 1fh3 n LYS 64 Ca 0.00 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 1fh3 n LYS 64 Cb 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.02 1fh3 n LYS 64 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fh3 s HIS 66 N 1.97 -0.62 -2.00 0.00 5.04 0.14 -4.92 115.29 114.91 1fh3 s HIS 66 Ca 0.76 -0.37 0.29 0.00 -1.54 0.00 0.00 55.06 54.20 1fh3 s HIS 66 Cb -0.46 -0.29 1.76 0.00 0.04 0.00 0.00 32.58 33.63 1fh3 s HIS 66 CO 0.33 -0.99 2.09 0.43 -2.34 0.00 0.00 174.74 174.27