#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fcl s THR 2 N 0.00 5.35 0.77 12.58 2.01 -1.26 -4.85 115.64 130.24 1fcl s THR 2 Ca 0.00 0.16 -0.11 0.00 0.31 0.00 0.00 61.69 62.05 1fcl s THR 2 Cb 0.00 -3.37 0.05 0.00 0.01 0.00 0.00 72.50 69.20 1fcl s THR 2 CO 0.00 0.55 1.08 -0.36 -0.69 0.00 0.00 174.62 175.21 1fcl s PHE 3 N -0.51 2.77 0.03 4.92 0.08 -0.88 -4.86 117.98 119.53 1fcl s PHE 3 Ca 0.12 1.38 0.00 0.00 0.12 0.00 0.00 56.93 58.56 1fcl s PHE 3 Cb -0.12 -3.02 -0.02 0.00 -0.57 0.00 0.00 43.02 39.29 1fcl s PHE 3 CO 0.02 -1.69 -0.04 0.21 -0.10 0.00 0.00 175.22 173.63 1fcl s LYS 4 N -5.01 0.39 -0.14 0.44 2.20 -0.89 -2.62 119.74 114.11 1fcl s LYS 4 Ca 0.60 -0.72 -0.12 0.00 -0.36 0.00 0.00 55.97 55.37 1fcl s LYS 4 Cb -0.16 0.07 0.04 0.00 -1.51 0.00 0.00 37.83 36.27 1fcl s LYS 4 CO 0.55 -0.04 0.37 -1.17 -0.36 0.00 0.00 175.35 174.70 1fcl s LEU 5 N -1.70 0.43 -0.11 5.43 0.20 0.28 0.12 118.68 123.33 1fcl s LEU 5 Ca -0.12 0.77 -0.02 0.00 0.69 0.00 0.00 54.13 55.45 1fcl s LEU 5 Cb -0.07 1.27 -0.03 0.00 -0.43 0.00 0.00 46.19 46.92 1fcl s LEU 5 CO -0.02 -0.14 -0.03 -0.63 -0.29 0.00 0.00 176.35 175.24 1fcl s ILE 6 N 0.49 4.04 -0.35 6.68 -1.09 -1.18 0.12 121.20 129.92 1fcl s ILE 6 Ca -0.02 -0.33 -0.23 0.00 -2.23 0.00 0.00 60.65 57.84 1fcl s ILE 6 Cb -0.04 -2.72 0.01 0.00 -1.58 0.00 0.00 42.46 38.12 1fcl s ILE 6 CO -0.03 0.56 0.76 -0.63 -1.23 0.00 0.00 174.94 174.37 1fcl s ILE 7 N -0.35 4.77 -0.71 2.92 1.01 0.26 -2.89 121.20 126.22 1fcl s ILE 7 Ca 0.06 0.93 0.02 0.00 0.00 0.00 0.00 60.65 61.66 1fcl s ILE 7 Cb -0.12 -4.17 0.36 0.00 0.01 0.00 0.00 42.46 38.54 1fcl s ILE 7 CO 0.02 -0.37 1.48 0.59 0.00 0.00 0.00 174.94 176.66 1fcl n ASN 8 N 6.31 5.99 -4.85 3.58 4.13 -0.61 -3.40 115.26 126.41 1fcl n ASN 8 Ca 0.03 -3.74 -0.31 0.00 1.68 0.00 0.00 54.58 52.23 1fcl n ASN 8 Cb 0.48 -0.80 0.02 0.00 -1.54 0.00 0.00 39.78 37.94 1fcl n ASN 8 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1fcl s GLY 9 N -2.40 1.73 0.57 7.41 0.00 -0.53 -2.16 107.32 111.95 1fcl s GLY 9 Ca 0.47 0.02 0.27 0.00 0.00 0.00 0.00 44.72 45.48 1fcl s GLY 9 CO -0.23 0.30 2.04 0.50 0.00 0.00 0.00 173.10 175.71 1fcl h LYS 10 N -0.25 0.00 0.00 2.90 1.79 -1.96 -3.35 116.57 115.71 1fcl h LYS 10 Ca -0.44 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 1fcl h LYS 10 Cb 1.20 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.85 1fcl h LYS 10 CO 0.60 0.00 -0.28 2.41 -1.08 0.00 0.00 179.45 181.10 1fcl n THR 11 N -3.93 0.00 -2.83 -0.16 -1.04 -1.26 -5.08 114.28 99.98 1fcl n THR 11 Ca 0.04 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.69 1fcl n THR 11 Cb 0.44 -0.38 -0.06 0.00 -1.82 0.00 0.00 70.33 68.51 1fcl n THR 11 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1fcl s LEU 12 N -4.20 4.26 0.00 -4.42 1.43 -1.26 -5.05 118.68 109.45 1fcl s LEU 12 Ca 0.00 1.76 -0.02 0.00 -1.03 0.00 0.00 54.13 54.84 1fcl s LEU 12 Cb 0.00 -4.07 0.01 0.00 0.03 0.00 0.00 46.19 42.16 1fcl s LEU 12 CO 0.00 -0.11 0.11 0.29 0.23 0.00 0.00 176.35 176.87 1fcl n LYS 13 N 0.35 0.16 0.00 1.70 5.02 -1.26 -1.45 118.16 122.68 1fcl n LYS 13 Ca 0.02 -0.41 0.00 0.00 -2.02 0.00 0.00 58.31 55.90 1fcl n LYS 13 Cb 0.51 0.46 0.00 0.00 -0.02 0.00 0.00 35.03 35.98 1fcl n LYS 13 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1fcl n GLY 14 N -0.09 3.13 3.78 0.72 0.00 -1.22 -4.81 105.19 106.69 1fcl n GLY 14 Ca -0.01 -1.92 -0.22 0.00 0.00 0.00 0.00 46.02 43.86 1fcl n GLY 14 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1fcl s GLU 15 N -2.37 2.47 -0.03 1.61 -1.05 -1.26 0.90 118.70 118.97 1fcl s GLU 15 Ca 0.00 -1.50 -0.29 0.00 -0.15 0.00 0.00 54.97 53.03 1fcl s GLU 15 Cb 0.00 -2.26 0.07 0.00 -0.44 0.00 0.00 34.13 31.50 1fcl s GLU 15 CO 0.00 0.07 0.65 -0.08 0.95 0.00 0.00 175.26 176.85 1fcl s THR 16 N -2.41 0.00 0.07 1.83 -1.32 0.12 -4.93 115.64 109.01 1fcl s THR 16 Ca 0.40 -0.02 0.01 0.00 -1.21 0.00 0.00 61.69 60.86 1fcl s THR 16 Cb -0.03 -0.99 -0.04 0.00 -1.51 0.00 0.00 72.50 69.94 1fcl s THR 16 CO 0.24 -0.01 -0.05 0.42 -2.21 0.00 0.00 174.62 173.01 1fcl s THR 17 N -1.47 0.47 0.24 5.08 -4.23 -1.26 0.10 115.64 114.57 1fcl s THR 17 Ca -0.10 -1.76 -0.02 0.00 -1.18 0.00 0.00 61.69 58.62 1fcl s THR 17 Cb -0.00 -1.46 -0.03 0.00 1.34 0.00 0.00 72.50 72.35 1fcl s THR 17 CO 0.07 -0.86 0.24 -0.89 -0.54 0.00 0.00 174.62 172.65 1fcl s THR 18 N -3.43 0.00 -0.13 3.99 2.01 -1.08 -4.95 115.64 112.06 1fcl s THR 18 Ca 0.07 -1.85 0.02 0.00 0.31 0.00 0.00 61.69 60.23 1fcl s THR 18 Cb 0.04 -2.45 0.02 0.00 0.01 0.00 0.00 72.50 70.11 1fcl s THR 18 CO -0.06 0.00 -0.17 -0.70 -0.69 0.00 0.00 174.62 173.00 1fcl s GLU 19 N -3.95 2.46 0.30 4.92 2.12 -1.26 -2.08 118.70 121.20 1fcl s GLU 19 Ca 0.35 -0.64 -0.19 0.00 0.36 0.00 0.00 54.97 54.85 1fcl s GLU 19 Cb 0.04 -2.09 0.05 0.00 0.26 0.00 0.00 34.13 32.39 1fcl s GLU 19 CO 0.14 -0.09 0.83 0.00 -0.54 0.00 0.00 175.26 175.60 1fcl s ALA 20 N 1.05 -1.13 0.26 6.30 0.00 -1.26 -4.95 121.76 122.03 1fcl s ALA 20 Ca -0.04 -0.45 -0.04 0.00 0.00 0.00 0.00 51.96 51.43 1fcl s ALA 20 Cb -0.15 0.73 0.33 0.00 0.00 0.00 0.00 23.12 24.04 1fcl s ALA 20 CO -0.04 -1.02 1.90 -0.39 0.00 0.00 0.00 175.76 176.21 1fcl h VAL 21 N 2.00 1.17 -3.58 0.00 -1.51 -1.99 -3.45 116.25 108.89 1fcl h VAL 21 Ca -0.27 -0.43 -0.07 0.00 -1.23 0.00 0.00 66.70 64.70 1fcl h VAL 21 Cb 1.24 -0.20 -0.13 0.00 -2.13 0.00 0.00 31.29 30.07 1fcl h VAL 21 CO 0.33 0.23 -0.21 -1.81 -1.23 0.00 0.00 177.57 174.88 1fcl s ASP 22 N -6.00 -0.07 0.56 4.19 1.11 -1.26 -5.02 116.67 110.17 1fcl s ASP 22 Ca -0.13 -0.46 0.25 0.00 0.18 0.00 0.00 52.55 52.39 1fcl s ASP 22 Cb 0.19 0.41 1.59 0.00 1.07 0.00 0.00 42.92 46.18 1fcl s ASP 22 CO 0.82 -0.79 2.20 0.00 1.18 0.00 0.00 175.17 178.57 1fcl h ALA 23 N 2.55 1.64 -0.43 5.23 0.00 -1.98 -2.01 119.26 124.27 1fcl h ALA 23 Ca -0.34 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1fcl h ALA 23 Cb 1.23 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1fcl h ALA 23 CO 0.51 0.03 0.26 0.00 0.00 0.00 0.00 179.25 180.05 1fcl h ALA 24 N 1.98 0.54 -0.02 0.00 0.00 -1.99 0.38 119.26 120.15 1fcl h ALA 24 Ca -0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1fcl h ALA 24 Cb 0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1fcl h ALA 24 CO 0.00 0.03 -0.01 1.15 0.00 0.00 0.00 179.25 180.42 1fcl h THR 25 N 0.56 1.33 0.64 0.00 2.02 -1.79 -3.13 112.91 112.54 1fcl h THR 25 Ca 0.15 -0.99 -0.03 0.00 0.77 0.00 0.00 66.41 66.31 1fcl h THR 25 Cb -0.01 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 1fcl h THR 25 CO -0.03 0.26 -0.33 0.00 0.37 0.00 0.00 175.52 175.80 1fcl h ALA 26 N 0.60 -0.89 -1.40 6.16 0.00 -1.30 -2.68 119.26 119.74 1fcl h ALA 26 Ca 0.01 -0.19 0.45 0.00 0.00 0.00 0.00 54.91 55.17 1fcl h ALA 26 Cb 0.43 0.37 -0.12 0.00 0.00 0.00 0.00 17.79 18.48 1fcl h ALA 26 CO 0.00 -1.01 0.93 1.49 0.00 0.00 0.00 179.25 180.67 1fcl h GLU 27 N -0.89 0.07 -0.38 0.00 4.81 -0.30 0.98 114.58 118.87 1fcl h GLU 27 Ca -0.08 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 1fcl h GLU 27 Cb 0.69 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.04 1fcl h GLU 27 CO 0.13 0.05 0.13 0.87 -0.73 0.00 0.00 179.01 179.46 1fcl h LYS 28 N 0.08 0.59 -0.35 1.92 1.57 -1.42 0.16 116.57 119.12 1fcl h LYS 28 Ca 0.82 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 59.38 1fcl h LYS 28 Cb 2.71 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 34.92 1fcl h LYS 28 CO -0.33 0.59 -0.20 0.28 -0.57 0.00 0.00 179.45 179.21 1fcl h VAL 29 N 0.47 1.26 -0.18 0.50 2.07 0.89 -2.24 116.25 119.03 1fcl h VAL 29 Ca 0.13 -1.26 -0.07 0.00 0.82 0.00 0.00 66.70 66.32 1fcl h VAL 29 Cb 0.23 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1fcl h VAL 29 CO -0.01 0.41 -0.18 -0.07 0.02 0.00 0.00 177.57 177.75 1fcl h LEU 30 N 0.59 0.29 -0.47 2.57 -0.00 -0.30 -1.91 115.31 116.07 1fcl h LEU 30 Ca 0.09 -0.07 -0.02 0.00 -0.00 0.00 0.00 57.88 57.87 1fcl h LEU 30 Cb 0.66 -0.08 -0.02 0.00 -0.00 0.00 0.00 40.66 41.23 1fcl h LEU 30 CO 0.05 0.49 0.21 0.50 -0.00 0.00 0.00 178.44 179.69 1fcl h LYS 31 N 0.28 0.69 -0.99 1.13 3.11 -0.12 -1.29 116.57 119.38 1fcl h LYS 31 Ca 0.05 -0.11 0.10 0.00 -2.81 0.00 0.00 60.65 57.88 1fcl h LYS 31 Cb 0.49 -0.12 -0.08 0.00 -1.00 0.00 0.00 32.23 31.52 1fcl h LYS 31 CO 0.03 0.60 0.62 1.96 -2.81 0.00 0.00 179.45 179.85 1fcl h GLN 32 N 0.62 0.99 -0.72 1.90 4.20 -0.95 0.32 115.11 121.46 1fcl h GLN 32 Ca 0.16 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.75 1fcl h GLN 32 Cb 0.15 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 1fcl h GLN 32 CO -0.02 0.66 0.22 -0.92 -0.67 0.00 0.00 178.83 178.10 1fcl h TYR 33 N 1.02 1.17 0.00 2.96 3.20 -0.85 -1.83 116.97 122.64 1fcl h TYR 33 Ca 0.47 -0.12 -0.07 0.00 3.14 0.00 0.00 58.73 62.15 1fcl h TYR 33 Cb 0.39 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 1fcl h TYR 33 CO -0.01 0.93 -0.33 0.82 -1.64 0.00 0.00 178.16 177.93 1fcl h ILE 34 N 1.07 1.16 -0.06 1.81 1.08 0.29 -2.51 117.51 120.36 1fcl h ILE 34 Ca 0.23 -1.17 0.02 0.00 -0.39 0.00 0.00 64.86 63.55 1fcl h ILE 34 Cb 0.32 1.64 -0.00 0.00 -3.07 0.00 0.00 36.82 35.71 1fcl h ILE 34 CO -0.01 0.33 0.05 -1.13 -0.69 0.00 0.00 178.15 176.70 1fcl h ASN 35 N 0.00 0.00 0.07 1.72 -0.73 0.39 0.55 115.58 117.58 1fcl h ASN 35 Ca -0.00 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.16 1fcl h ASN 35 Cb 0.62 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.21 1fcl h ASN 35 CO 0.04 0.00 -0.03 -0.78 -0.37 0.00 0.00 177.43 176.29 1fcl h ASP 36 N 0.00 -0.08 -0.38 1.15 1.82 -1.43 -3.30 116.42 114.19 1fcl h ASP 36 Ca 0.03 -0.48 -0.02 0.00 -0.39 0.00 0.00 57.03 56.16 1fcl h ASP 36 Cb 0.12 0.02 -0.02 0.00 0.68 0.00 0.00 39.33 40.13 1fcl h ASP 36 CO -0.00 0.60 0.18 0.78 -1.61 0.00 0.00 179.24 179.19 1fcl h ASN 37 N -0.93 0.55 -0.11 2.28 4.21 -1.54 -3.46 115.58 116.59 1fcl h ASN 37 Ca -0.01 -0.05 0.00 0.00 1.21 0.00 0.00 56.30 57.45 1fcl h ASN 37 Cb 0.56 -0.14 0.00 0.00 -1.12 0.00 0.00 38.32 37.62 1fcl h ASN 37 CO 0.02 0.49 0.00 0.61 -1.29 0.00 0.00 177.43 177.26 1fcl n GLY 38 N -1.19 1.10 2.68 2.83 0.00 0.16 -5.03 105.19 105.75 1fcl n GLY 38 Ca 0.03 -0.45 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 1fcl n GLY 38 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1fcl n ILE 39 N -2.36 2.75 -4.03 -0.61 2.08 -1.18 -5.01 119.36 111.00 1fcl n ILE 39 Ca 0.00 -5.25 -0.32 0.00 0.56 0.00 0.00 62.75 57.73 1fcl n ILE 39 Cb 0.27 -2.15 -0.15 0.00 -0.75 0.00 0.00 39.64 36.86 1fcl n ILE 39 CO 0.00 0.00 0.00 -1.81 0.56 0.00 0.00 176.55 175.30 1fcl s ASP 40 N -1.89 4.60 0.00 4.38 1.01 -1.26 -4.67 116.67 118.83 1fcl s ASP 40 Ca 0.34 -1.52 0.00 0.00 0.71 0.00 0.00 52.55 52.08 1fcl s ASP 40 Cb 0.07 -1.60 0.00 0.00 1.01 0.00 0.00 42.92 42.40 1fcl s ASP 40 CO -0.04 -0.24 0.00 0.61 0.21 0.00 0.00 175.17 175.71 1fcl n GLY 41 N 4.44 0.23 2.90 0.21 0.00 -1.11 -4.86 105.19 106.99 1fcl n GLY 41 Ca -0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.65 1fcl n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fcl s GLU 42 N 0.00 1.48 0.38 1.61 2.02 -0.55 -4.92 118.70 118.73 1fcl s GLU 42 Ca 0.00 -0.24 0.05 0.00 0.02 0.00 0.00 54.97 54.81 1fcl s GLU 42 Cb 0.00 -1.55 -0.00 0.00 0.10 0.00 0.00 34.13 32.68 1fcl s GLU 42 CO 0.00 -0.27 0.55 -1.58 0.02 0.00 0.00 175.26 173.98 1fcl s TRP 43 N 1.71 3.08 -0.14 1.61 0.52 -1.26 -1.81 118.94 122.64 1fcl s TRP 43 Ca 0.05 -0.14 -0.08 0.00 0.02 0.00 0.00 56.10 55.95 1fcl s TRP 43 Cb -0.13 -2.16 0.05 0.00 -1.15 0.00 0.00 33.47 30.08 1fcl s TRP 43 CO -0.08 -0.19 0.34 0.95 0.02 0.00 0.00 176.95 177.99 1fcl s THR 44 N -2.32 -0.03 0.34 2.01 -4.23 -1.23 -4.88 115.64 105.31 1fcl s THR 44 Ca 0.48 0.11 0.01 0.00 -1.18 0.00 0.00 61.69 61.11 1fcl s THR 44 Cb -0.10 -0.52 -0.03 0.00 1.34 0.00 0.00 72.50 73.20 1fcl s THR 44 CO 0.33 0.04 0.54 -0.47 -0.54 0.00 0.00 174.62 174.53 1fcl s TYR 45 N 1.28 3.47 -0.03 3.99 5.04 -1.26 -2.06 117.35 127.77 1fcl s TYR 45 Ca -0.09 0.30 -0.01 0.00 -2.44 0.00 0.00 57.07 54.84 1fcl s TYR 45 Cb -0.09 -1.89 0.03 0.00 0.35 0.00 0.00 41.96 40.36 1fcl s TYR 45 CO -0.10 0.12 0.02 -0.51 -1.34 0.00 0.00 175.55 173.74 1fcl s ASP 46 N -4.05 0.64 0.00 4.32 1.11 -0.75 -4.96 116.67 112.99 1fcl s ASP 46 Ca 0.40 0.01 0.16 0.00 0.18 0.00 0.00 52.55 53.31 1fcl s ASP 46 Cb -0.10 -0.18 0.74 0.00 1.07 0.00 0.00 42.92 44.45 1fcl s ASP 46 CO 0.35 -0.16 1.51 -0.90 1.18 0.00 0.00 175.17 177.16 1fcl n ASP 47 N 4.56 0.00 0.00 0.27 5.68 -1.26 -2.31 116.55 123.49 1fcl n ASP 47 Ca -0.19 0.35 0.00 0.00 -0.50 0.00 0.00 54.79 54.46 1fcl n ASP 47 Cb 0.50 -0.43 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 1fcl n ASP 47 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1fcl n ALA 48 N -1.43 -0.34 -2.31 2.12 0.00 -1.26 -4.27 120.51 113.01 1fcl n ALA 48 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.47 1fcl n ALA 48 Cb 0.17 0.12 0.07 0.00 0.00 0.00 0.00 19.45 19.81 1fcl n ALA 48 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1fcl n THR 49 N -2.10 1.34 -3.62 0.00 5.66 -1.25 -4.98 114.28 109.34 1fcl n THR 49 Ca 0.00 -2.68 -0.21 0.00 -3.05 0.00 0.00 64.05 58.11 1fcl n THR 49 Cb 0.00 0.39 0.06 0.00 -1.55 0.00 0.00 70.33 69.23 1fcl n THR 49 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1fcl n LYS 50 N -0.40 -5.88 -2.93 1.09 4.76 -0.98 -4.67 118.16 109.15 1fcl n LYS 50 Ca 0.17 0.72 -0.21 0.00 -2.87 0.00 0.00 58.31 56.12 1fcl n LYS 50 Cb 0.92 -5.52 0.02 0.00 -1.84 0.00 0.00 35.03 28.60 1fcl n LYS 50 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1fcl s THR 51 N -3.49 3.32 0.02 -0.18 2.01 -1.18 -2.09 115.64 114.05 1fcl s THR 51 Ca 0.13 -0.73 0.00 0.00 0.31 0.00 0.00 61.69 61.40 1fcl s THR 51 Cb -0.06 -3.20 -0.00 0.00 0.01 0.00 0.00 72.50 69.25 1fcl s THR 51 CO 0.78 -0.12 0.01 0.79 -0.69 0.00 0.00 174.62 175.39 1fcl n TRP 52 N -2.07 -0.01 -3.88 4.92 7.02 0.32 -1.81 117.44 121.93 1fcl n TRP 52 Ca 0.05 -0.11 -0.08 0.00 -1.02 0.00 0.00 57.50 56.34 1fcl n TRP 52 Cb 0.59 0.01 -0.02 0.00 -2.42 0.00 0.00 31.31 29.46 1fcl n TRP 52 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 1fcl s THR 53 N -1.84 0.00 -0.37 -0.99 2.01 -0.87 -3.11 115.64 110.46 1fcl s THR 53 Ca 0.01 -1.07 -0.03 0.00 0.31 0.00 0.00 61.69 60.91 1fcl s THR 53 Cb 0.00 -2.17 0.19 0.00 0.01 0.00 0.00 72.50 70.54 1fcl s THR 53 CO 0.01 0.00 0.93 0.54 -0.69 0.00 0.00 174.62 175.41 1fcl s VAL 54 N -3.69 -0.47 -0.05 3.82 0.11 -1.14 -3.57 120.40 115.41 1fcl s VAL 54 Ca 0.14 -0.14 -0.17 0.00 -2.93 0.00 0.00 61.98 58.87 1fcl s VAL 54 Cb -0.05 0.00 -0.05 0.00 -1.53 0.00 0.00 36.38 34.75 1fcl s VAL 54 CO 0.08 0.00 0.48 -0.89 -3.33 0.00 0.00 175.10 171.44 1fcl s THR 55 N 1.63 5.06 -2.00 5.04 2.01 -0.75 -1.57 115.64 125.05 1fcl s THR 55 Ca 0.18 0.98 0.12 0.00 0.31 0.00 0.00 61.69 63.28 1fcl s THR 55 Cb 0.03 -3.80 0.35 0.00 0.01 0.00 0.00 72.50 69.09 1fcl s THR 55 CO -0.11 0.44 1.16 1.21 -0.69 0.00 0.00 174.62 176.63