#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 1.82 -0.03 7.34 0.52 0.20 -4.90 118.95 123.90 1fh3 s ARG 2 Ca 0.00 -1.40 0.00 0.00 -0.52 0.00 0.00 55.73 53.81 1fh3 s ARG 2 Cb 0.00 -2.01 0.03 0.00 0.52 0.00 0.00 34.95 33.49 1fh3 s ARG 2 CO 0.00 0.41 0.01 -0.51 0.02 0.00 0.00 175.30 175.23 1fh3 s ASP 3 N -2.80 0.52 0.04 0.23 1.11 -1.26 -0.86 116.67 113.65 1fh3 s ASP 3 Ca 0.23 -0.02 -0.02 0.00 0.18 0.00 0.00 52.55 52.93 1fh3 s ASP 3 Cb -0.08 -0.22 0.01 0.00 1.07 0.00 0.00 42.92 43.69 1fh3 s ASP 3 CO 0.13 -0.12 0.09 0.61 1.18 0.00 0.00 175.17 177.06 1fh3 n GLY 4 N 4.28 1.74 3.74 0.21 0.00 -1.19 -5.02 105.19 108.94 1fh3 n GLY 4 Ca -0.24 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 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 -7.70 3.65 0.07 1.61 1.51 -1.26 -2.59 117.35 112.63 1fh3 s TYR 5 Ca 0.02 1.64 -0.17 0.00 -1.01 0.00 0.00 57.07 57.55 1fh3 s TYR 5 Cb -0.00 -3.22 -0.06 0.00 -0.11 0.00 0.00 41.96 38.56 1fh3 s TYR 5 CO 0.01 -0.42 0.52 -1.50 -1.11 0.00 0.00 175.55 173.05 1fh3 s ILE 6 N -0.17 4.84 0.00 2.71 2.07 0.26 -2.99 121.20 127.92 1fh3 s ILE 6 Ca 0.49 1.04 0.00 0.00 -1.41 0.00 0.00 60.65 60.77 1fh3 s ILE 6 Cb -0.28 -3.82 0.00 0.00 0.13 0.00 0.00 42.46 38.49 1fh3 s ILE 6 CO 0.33 0.49 0.00 0.00 -1.91 0.00 0.00 174.94 173.86 1fh3 n ALA 7 N 1.54 0.00 -2.17 1.50 0.00 -1.26 -2.99 120.51 117.13 1fh3 n ALA 7 Ca -0.10 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.26 1fh3 n ALA 7 Cb 0.51 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.87 1fh3 n ALA 7 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1fh3 s GLN 8 N 4.89 0.71 0.44 0.00 -0.21 -1.26 -3.64 119.66 120.59 1fh3 s GLN 8 Ca 0.00 -1.23 -0.24 0.00 0.02 0.00 0.00 55.36 53.90 1fh3 s GLN 8 Cb 0.00 0.23 -0.08 0.00 1.00 0.00 0.00 33.01 34.17 1fh3 s GLN 8 CO 0.00 -0.16 1.24 -2.14 -2.12 0.00 0.00 175.29 172.11 1fh3 s PRO 9 N -3.94 3.82 -0.20 2.91 0.02 -1.26 -3.55 135.00 132.80 1fh3 s PRO 9 Ca 0.10 1.99 -0.06 0.00 0.02 0.00 0.00 61.00 63.04 1fh3 s PRO 9 Cb 0.07 -2.58 -0.21 0.00 0.02 0.00 0.00 34.50 31.81 1fh3 s PRO 9 CO -0.08 -0.56 0.06 0.39 -0.33 0.00 0.00 177.00 176.49 1fh3 n GLU 10 N -0.20 0.68 -3.92 5.54 1.02 0.92 -4.40 120.64 120.27 1fh3 n GLU 10 Ca 0.06 0.26 -0.10 0.00 -0.02 0.00 0.00 57.16 57.36 1fh3 n GLU 10 Cb 0.46 -1.63 -0.12 0.00 -0.02 0.00 0.00 31.44 30.13 1fh3 n GLU 10 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1fh3 s ASN 11 N -6.89 0.12 0.00 1.62 2.47 -1.15 -4.39 114.94 106.71 1fh3 s ASN 11 Ca -0.29 -0.26 0.00 0.00 0.42 0.00 0.00 52.86 52.73 1fh3 s ASN 11 Cb 0.08 0.09 0.00 0.00 -1.45 0.00 0.00 41.25 39.97 1fh3 s ASN 11 CO 0.66 -0.19 0.00 0.00 -3.72 0.00 0.00 177.10 173.85 1fh3 s VAL 13 N -2.11 1.35 0.32 0.00 -7.23 -1.26 -4.41 120.40 107.05 1fh3 s VAL 13 Ca 0.00 -2.09 -0.04 0.00 -1.81 0.00 0.00 61.98 58.04 1fh3 s VAL 13 Cb 0.00 -2.30 0.07 0.00 0.56 0.00 0.00 36.38 34.71 1fh3 s VAL 13 CO 0.00 -0.39 0.43 0.00 -0.31 0.00 0.00 175.10 174.83 1fh3 n TYR 14 N -0.45 -3.74 -4.13 2.82 4.19 -1.17 -4.00 117.16 110.68 1fh3 n TYR 14 Ca -0.06 -0.49 -0.15 0.00 3.31 0.00 0.00 57.90 60.51 1fh3 n TYR 14 Cb 0.63 -0.33 -0.12 0.00 0.49 0.00 0.00 39.34 40.01 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 -1.67 0.72 0.00 2.98 3.76 -1.26 -4.19 115.29 115.64 1fh3 s HIS 15 Ca 0.26 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 54.79 1fh3 s HIS 15 Cb -0.01 -0.43 0.00 0.00 1.11 0.00 0.00 32.58 33.25 1fh3 s HIS 15 CO 0.18 -0.04 0.00 0.00 -0.85 0.00 0.00 174.74 174.02 1fh3 s PHE 17 N -6.36 1.28 -0.65 0.00 0.08 -1.26 -4.88 117.98 106.18 1fh3 s PHE 17 Ca 0.00 -1.42 -0.06 0.00 0.12 0.00 0.00 56.93 55.57 1fh3 s PHE 17 Cb 0.00 -0.53 -0.12 0.00 -0.57 0.00 0.00 43.02 41.80 1fh3 s PHE 17 CO 0.00 -0.76 2.58 -0.35 -0.10 0.00 0.00 175.22 176.60 1fh3 n PRO 18 N -0.40 2.14 -3.65 0.24 -0.04 -1.26 -4.57 135.00 127.46 1fh3 n PRO 18 Ca 0.03 -1.28 -0.02 0.00 -0.04 0.00 0.00 63.50 62.19 1fh3 n PRO 18 Cb 0.64 -2.26 -0.07 0.00 -0.04 0.00 0.00 33.50 31.78 1fh3 n PRO 18 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1fh3 s GLY 19 N 2.64 0.38 -0.02 0.55 0.00 -1.26 -5.03 107.32 104.58 1fh3 s GLY 19 Ca 0.50 3.55 0.01 0.00 0.00 0.00 0.00 44.72 48.77 1fh3 s GLY 19 CO -0.02 1.86 0.81 1.44 0.00 0.00 0.00 173.10 177.19 1fh3 n SER 20 N 1.41 2.15 0.00 1.64 7.64 -1.26 -4.61 113.62 120.60 1fh3 n SER 20 Ca -0.09 -2.08 -0.11 0.00 1.01 0.00 0.00 58.87 57.61 1fh3 n SER 20 Cb 0.57 -0.52 -0.05 0.00 -1.01 0.00 0.00 64.21 63.21 1fh3 n SER 20 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1fh3 h SER 21 N 0.15 0.02 0.72 6.43 0.02 -1.96 -1.39 113.55 117.54 1fh3 h SER 21 Ca 0.02 0.01 -0.17 0.00 -0.84 0.00 0.00 61.79 60.81 1fh3 h SER 21 Cb 0.85 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 1fh3 h SER 21 CO 0.05 0.03 -1.39 1.23 -1.14 0.00 0.00 176.83 175.60 1fh3 h GLY 22 N 0.07 0.00 1.59 -3.77 0.00 -1.99 -3.37 103.07 95.61 1fh3 h GLY 22 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1fh3 h GLY 22 CO -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 176.54 176.37 1fh3 h ASP 24 N 0.07 -1.21 0.14 0.00 3.58 -1.44 0.36 116.42 117.92 1fh3 h ASP 24 Ca 0.00 0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.59 1fh3 h ASP 24 Cb 0.46 0.46 -0.01 0.00 1.72 0.00 0.00 39.33 41.96 1fh3 h ASP 24 CO 0.00 -0.47 -0.12 0.71 -2.88 0.00 0.00 179.24 176.48 1fh3 h THR 25 N -0.61 0.74 -0.47 2.25 1.35 -1.77 -2.79 112.91 111.60 1fh3 h THR 25 Ca 0.03 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 65.84 1fh3 h THR 25 Cb 0.66 0.74 -0.02 0.00 -1.73 0.00 0.00 68.15 67.80 1fh3 h THR 25 CO -0.26 0.00 0.10 -0.07 -0.25 0.00 0.00 175.52 175.04 1fh3 h LEU 26 N -0.27 0.73 -0.57 3.87 3.38 -1.16 -0.35 115.31 120.94 1fh3 h LEU 26 Ca -0.00 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 1fh3 h LEU 26 Cb 0.25 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1fh3 h LEU 26 CO -0.02 0.79 0.25 0.00 0.09 0.00 0.00 178.44 179.56 1fh3 h LYS 28 N 0.78 0.00 0.00 0.00 1.57 -1.15 0.40 116.57 118.18 1fh3 h LYS 28 Ca 0.19 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1fh3 h LYS 28 Cb 0.16 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 1fh3 h LYS 28 CO -0.02 0.69 -0.01 1.05 -0.57 0.00 0.00 179.45 180.59 1fh3 h GLU 29 N 0.00 0.00 0.00 3.15 4.11 -0.98 -2.81 114.58 118.05 1fh3 h GLU 29 Ca -0.01 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.35 1fh3 h GLU 29 Cb 1.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 1fh3 h GLU 29 CO 0.09 0.01 -0.99 0.87 0.07 0.00 0.00 179.01 179.06 1fh3 h LYS 30 N 0.00 0.00 0.00 1.06 1.79 -1.16 -3.48 116.57 114.78 1fh3 h LYS 30 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1fh3 h LYS 30 Cb 0.90 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.55 1fh3 h LYS 30 CO 0.00 0.15 0.00 0.41 -1.08 0.00 0.00 179.45 178.93 1fh3 n GLY 31 N 1.25 1.65 3.91 3.86 0.00 0.17 -4.77 105.19 111.26 1fh3 n GLY 31 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.00 2.15 0.03 -0.02 0.00 0.12 -4.36 107.32 103.24 1fh3 s GLY 32 Ca 0.00 -0.64 0.22 0.00 0.00 0.00 0.00 44.72 44.30 1fh3 s GLY 32 CO 0.00 -0.57 0.74 -1.30 0.00 0.00 0.00 173.10 171.96 1fh3 n THR 33 N -0.03 0.15 -3.78 0.90 -2.24 0.23 -3.97 114.28 105.54 1fh3 n THR 33 Ca -0.03 -0.41 -0.07 0.00 -2.27 0.00 0.00 64.05 61.27 1fh3 n THR 33 Cb 0.52 0.08 -0.02 0.00 -2.10 0.00 0.00 70.33 68.81 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 -4.41 -0.30 0.10 3.42 0.01 -1.25 -4.99 113.70 106.28 1fh3 s SER 34 Ca -0.03 -0.49 -0.25 0.00 1.31 0.00 0.00 55.95 56.49 1fh3 s SER 34 Cb 0.13 0.68 0.09 0.00 0.21 0.00 0.00 66.02 67.13 1fh3 s SER 34 CO 0.86 -1.24 1.13 -0.83 0.41 0.00 0.00 173.24 173.58 1fh3 s GLY 35 N -2.89 -0.07 0.00 3.44 0.00 -1.26 -0.57 107.32 105.98 1fh3 s GLY 35 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 44.72 44.78 1fh3 s GLY 35 CO 0.03 2.64 0.00 -2.39 0.00 0.00 0.00 173.10 173.38 1fh3 n HIS 36 N -0.70 -0.49 -4.10 1.90 1.44 -1.03 -4.95 115.22 107.30 1fh3 n HIS 36 Ca -0.02 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.59 1fh3 n HIS 36 Cb 0.60 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.62 1fh3 n HIS 36 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1fh3 n GLY 38 N -0.16 -1.69 2.89 0.00 0.00 -1.17 -4.86 105.19 100.21 1fh3 n GLY 38 Ca -0.05 -1.09 -0.25 0.00 0.00 0.00 0.00 46.02 44.63 1fh3 n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1fh3 s PHE 39 N -2.34 1.27 -0.38 1.61 5.36 -1.26 -1.55 117.98 120.69 1fh3 s PHE 39 Ca 0.00 -0.56 0.12 0.00 -0.96 0.00 0.00 56.93 55.52 1fh3 s PHE 39 Cb 0.00 -1.09 0.35 0.00 -0.34 0.00 0.00 43.02 41.94 1fh3 s PHE 39 CO 0.00 -0.43 0.74 1.63 -1.46 0.00 0.00 175.22 175.71 1fh3 n LYS 40 N 4.78 1.05 0.00 10.12 4.76 -1.26 -5.05 118.16 132.56 1fh3 n LYS 40 Ca -0.14 -3.43 0.00 0.00 -2.87 0.00 0.00 58.31 51.88 1fh3 n LYS 40 Cb 0.50 -1.72 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 1fh3 n LYS 40 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1fh3 n VAL 41 N 0.26 0.00 0.00 -0.18 0.31 -1.26 -5.04 118.33 112.42 1fh3 n VAL 41 Ca 0.25 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.58 1fh3 n VAL 41 Cb 0.65 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.58 1fh3 n VAL 41 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fh3 n GLY 42 N 0.00 0.10 0.00 2.92 0.00 -1.26 -4.58 105.19 102.37 1fh3 n GLY 42 Ca 0.00 -1.50 0.01 0.00 0.00 0.00 0.00 46.02 44.53 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 -1.82 1.61 8.25 -1.26 -4.70 115.22 117.30 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 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.08 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 2.36 -1.27 3.73 -1.41 0.00 -1.26 -5.07 105.19 102.27 1fh3 n GLY 44 Ca -0.00 -0.93 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 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 4.40 0.00 0.99 0.20 -1.26 -4.87 118.68 118.13 1fh3 s LEU 45 Ca 0.00 2.39 0.00 0.00 0.69 0.00 0.00 54.13 57.21 1fh3 s LEU 45 Cb 0.00 -3.60 0.00 0.00 -0.43 0.00 0.00 46.19 42.16 1fh3 s LEU 45 CO 0.00 -0.59 0.00 0.00 -0.29 0.00 0.00 176.35 175.47 1fh3 n ALA 46 N 3.13 0.00 -2.41 5.97 0.00 -0.60 -4.14 120.51 122.46 1fh3 n ALA 46 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.31 1fh3 n ALA 46 Cb 0.42 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.77 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 -2.66 2.70 0.01 0.00 -0.11 0.12 0.93 118.94 119.93 1fh3 s TRP 48 Ca 0.25 -0.18 -0.07 0.00 1.22 0.00 0.00 56.10 57.33 1fh3 s TRP 48 Cb -0.03 -1.38 -0.00 0.00 -1.50 0.00 0.00 33.47 30.55 1fh3 s TRP 48 CO 0.11 0.45 0.13 0.00 -4.62 0.00 0.00 176.95 173.02 1fh3 s ASN 50 N -1.53 4.68 -1.14 0.00 -0.87 0.27 -3.20 114.94 113.15 1fh3 s ASN 50 Ca -0.13 -0.13 -0.04 0.00 -1.57 0.00 0.00 52.86 50.99 1fh3 s ASN 50 Cb -0.07 -1.11 -0.03 0.00 -0.02 0.00 0.00 41.25 40.02 1fh3 s ASN 50 CO 0.00 0.28 0.92 0.00 -2.57 0.00 0.00 177.10 175.74 1fh3 n ALA 51 N 1.56 -2.26 -2.13 0.60 0.00 -0.97 -0.60 120.51 116.70 1fh3 n ALA 51 Ca -0.15 0.01 -0.36 0.00 0.00 0.00 0.00 53.44 52.93 1fh3 n ALA 51 Cb 0.53 -3.96 -0.06 0.00 0.00 0.00 0.00 19.45 15.95 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 -5.97 4.34 0.92 0.00 1.43 -0.04 -4.39 118.68 114.97 1fh3 s LEU 52 Ca 0.23 1.38 -0.11 0.00 -1.03 0.00 0.00 54.13 54.60 1fh3 s LEU 52 Cb -0.04 -3.56 0.15 0.00 0.03 0.00 0.00 46.19 42.77 1fh3 s LEU 52 CO 0.75 0.04 1.10 -2.84 0.23 0.00 0.00 176.35 175.63 1fh3 s PRO 53 N -1.98 1.02 0.55 1.29 0.02 -1.26 -0.63 135.00 134.01 1fh3 s PRO 53 Ca 0.43 1.17 0.24 0.00 0.02 0.00 0.00 61.00 62.85 1fh3 s PRO 53 Cb -0.16 -1.75 1.49 0.00 0.02 0.00 0.00 34.50 34.09 1fh3 s PRO 53 CO 0.21 -2.51 2.12 -0.44 -0.33 0.00 0.00 177.00 176.05 1fh3 h ASP 54 N -1.76 0.00 -0.59 2.53 3.32 -1.97 -2.44 116.42 115.51 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 0.48 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.54 1fh3 n ASN 55 N -4.19 4.65 -4.85 6.45 6.94 -1.26 -4.82 115.26 118.18 1fh3 n ASN 55 Ca 0.01 -2.50 -0.37 0.00 -0.02 0.00 0.00 54.58 51.70 1fh3 n ASN 55 Cb 0.26 -0.58 -0.06 0.00 -2.36 0.00 0.00 39.78 37.04 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 -1.98 5.41 0.10 3.53 1.01 -0.92 -5.09 120.40 122.45 1fh3 s VAL 56 Ca 0.48 0.34 0.02 0.00 0.00 0.00 0.00 61.98 62.82 1fh3 s VAL 56 Cb 0.32 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 1fh3 s VAL 56 CO 0.21 0.59 0.17 -0.83 0.00 0.00 0.00 175.10 175.24 1fh3 s GLY 57 N -0.87 1.99 0.00 4.51 0.00 -1.26 -4.96 107.32 106.73 1fh3 s GLY 57 Ca 0.16 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 43.90 1fh3 s GLY 57 CO 0.05 -0.97 0.00 0.29 0.00 0.00 0.00 173.10 172.48 1fh3 n ILE 58 N 0.11 0.00 -2.34 0.90 -5.35 -1.26 -4.25 119.36 107.17 1fh3 n ILE 58 Ca -0.07 0.00 -0.42 0.00 -0.27 0.00 0.00 62.75 61.99 1fh3 n ILE 58 Cb 0.52 0.00 -0.03 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 -0.40 3.76 -0.07 7.28 -1.09 -1.16 -4.33 121.20 125.19 1fh3 s ILE 59 Ca 0.00 1.29 0.05 0.00 -2.23 0.00 0.00 60.65 59.76 1fh3 s ILE 59 Cb 0.00 -3.83 -0.01 0.00 -1.58 0.00 0.00 42.46 37.04 1fh3 s ILE 59 CO 0.00 0.12 -0.21 -0.69 -1.23 0.00 0.00 174.94 172.92 1fh3 s VAL 60 N 0.90 2.37 0.00 2.92 1.01 -1.26 -4.97 120.40 121.37 1fh3 s VAL 60 Ca 0.59 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1fh3 s VAL 60 Cb -0.32 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.16 1fh3 s VAL 60 CO 0.31 0.57 0.00 1.21 0.00 0.00 0.00 175.10 177.18 1fh3 n GLU 61 N 2.97 0.00 -2.74 2.72 4.07 -1.26 -3.59 120.64 122.81 1fh3 n GLU 61 Ca -0.18 0.00 -0.09 0.00 -0.06 0.00 0.00 57.16 56.84 1fh3 n GLU 61 Cb 0.52 0.00 0.09 0.00 -0.06 0.00 0.00 31.44 31.99 1fh3 n GLU 61 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1fh3 n GLY 62 N 0.00 1.10 0.00 8.31 0.00 -1.26 -4.93 105.19 108.41 1fh3 n GLY 62 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.04 0.00 -3.94 1.61 2.13 -1.24 -4.90 120.64 114.26 1fh3 n GLU 63 Ca 0.04 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.77 1fh3 n GLU 63 Cb 0.76 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.44 1fh3 n GLU 63 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1fh3 s LYS 64 N 1.29 1.67 0.14 5.31 2.47 -1.26 -4.87 119.74 124.48 1fh3 s LYS 64 Ca 0.00 -1.15 -0.04 0.00 -1.56 0.00 0.00 55.97 53.22 1fh3 s LYS 64 Cb 0.00 0.53 -0.05 0.00 -1.46 0.00 0.00 37.83 36.85 1fh3 s LYS 64 CO 0.00 -0.73 0.35 0.00 0.16 0.00 0.00 175.35 175.13 1fh3 s HIS 66 N -1.66 -0.35 0.00 0.00 -3.43 -0.50 -4.95 115.29 104.40 1fh3 s HIS 66 Ca 0.40 0.44 0.00 0.00 -0.80 0.00 0.00 55.06 55.10 1fh3 s HIS 66 Cb -0.12 0.26 0.00 0.00 -1.43 0.00 0.00 32.58 31.29 1fh3 s HIS 66 CO 0.26 -0.57 0.00 0.43 -2.00 0.00 0.00 174.74 172.86