#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 1.92 0.84 12.58 2.01 -1.26 -4.88 115.64 126.84 1fcl s THR 2 Ca 0.00 -1.07 -0.11 0.00 0.31 0.00 0.00 61.69 60.82 1fcl s THR 2 Cb 0.00 -1.60 0.09 0.00 0.01 0.00 0.00 72.50 71.01 1fcl s THR 2 CO 0.00 0.51 1.09 -0.36 -0.69 0.00 0.00 174.62 175.17 1fcl s PHE 3 N -0.59 2.49 0.01 4.92 0.08 -0.62 -4.83 117.98 119.43 1fcl s PHE 3 Ca 0.09 1.35 -0.04 0.00 0.12 0.00 0.00 56.93 58.45 1fcl s PHE 3 Cb -0.09 -3.11 -0.01 0.00 -0.57 0.00 0.00 43.02 39.24 1fcl s PHE 3 CO -0.01 -2.09 0.07 0.21 -0.10 0.00 0.00 175.22 173.31 1fcl s LYS 4 N -4.95 0.41 -0.09 0.44 2.20 -0.78 -2.38 119.74 114.59 1fcl s LYS 4 Ca 0.62 -0.48 -0.08 0.00 -0.36 0.00 0.00 55.97 55.68 1fcl s LYS 4 Cb -0.17 0.17 0.03 0.00 -1.51 0.00 0.00 37.83 36.34 1fcl s LYS 4 CO 0.56 -0.09 0.24 -1.17 -0.36 0.00 0.00 175.35 174.54 1fcl s LEU 5 N -1.41 0.91 -0.16 5.43 0.20 0.33 0.10 118.68 124.09 1fcl s LEU 5 Ca -0.15 0.50 -0.05 0.00 0.69 0.00 0.00 54.13 55.12 1fcl s LEU 5 Cb -0.08 0.80 -0.03 0.00 -0.43 0.00 0.00 46.19 46.45 1fcl s LEU 5 CO 0.01 -0.10 -0.01 -0.63 -0.29 0.00 0.00 176.35 175.32 1fcl s ILE 6 N 0.41 4.17 -0.31 6.68 -1.09 -1.18 0.16 121.20 130.05 1fcl s ILE 6 Ca -0.02 -0.26 -0.26 0.00 -2.23 0.00 0.00 60.65 57.88 1fcl s ILE 6 Cb -0.04 -2.84 0.01 0.00 -1.58 0.00 0.00 42.46 38.01 1fcl s ILE 6 CO -0.02 0.49 0.92 -0.63 -1.23 0.00 0.00 174.94 174.47 1fcl s ILE 7 N 0.30 4.67 -0.69 2.92 1.01 -0.05 -2.93 121.20 126.44 1fcl s ILE 7 Ca -0.01 1.46 0.01 0.00 0.00 0.00 0.00 60.65 62.12 1fcl s ILE 7 Cb -0.13 -4.27 0.37 0.00 0.01 0.00 0.00 42.46 38.44 1fcl s ILE 7 CO 0.02 -0.34 1.55 0.59 0.00 0.00 0.00 174.94 176.76 1fcl n ASN 8 N 6.48 6.14 -4.83 3.58 4.13 -0.50 -2.97 115.26 127.28 1fcl n ASN 8 Ca 0.08 -3.76 -0.34 0.00 1.68 0.00 0.00 54.58 52.24 1fcl n ASN 8 Cb 0.48 -0.80 -0.06 0.00 -1.54 0.00 0.00 39.78 37.86 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 -2.29 2.43 0.46 7.41 0.00 0.23 -2.21 107.32 113.36 1fcl s GLY 9 Ca 0.49 0.15 0.16 0.00 0.00 0.00 0.00 44.72 45.53 1fcl s GLY 9 CO -0.27 0.42 2.00 0.50 0.00 0.00 0.00 173.10 175.74 1fcl h LYS 10 N 2.51 0.28 0.00 2.90 1.57 -1.96 -3.26 116.57 118.62 1fcl h LYS 10 Ca -0.48 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.24 1fcl h LYS 10 Cb 1.18 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 1fcl h LYS 10 CO 0.65 0.19 -1.15 2.41 -0.57 0.00 0.00 179.45 180.97 1fcl n THR 11 N -4.46 0.15 -4.06 -0.16 -1.04 -1.26 -5.01 114.28 98.44 1fcl n THR 11 Ca 0.09 -0.08 -0.35 0.00 -2.04 0.00 0.00 64.05 61.67 1fcl n THR 11 Cb 0.40 -0.80 -0.09 0.00 -1.82 0.00 0.00 70.33 68.01 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 -4.56 3.84 0.00 -4.42 1.02 -1.23 -5.09 118.68 108.25 1fcl s LEU 12 Ca -0.02 0.15 -0.01 0.00 0.02 0.00 0.00 54.13 54.26 1fcl s LEU 12 Cb 0.01 -1.95 0.01 0.00 0.02 0.00 0.00 46.19 44.27 1fcl s LEU 12 CO 0.08 0.25 0.25 0.29 0.02 0.00 0.00 176.35 177.24 1fcl n LYS 13 N 3.05 0.36 0.00 1.70 5.02 -1.26 -0.60 118.16 126.43 1fcl n LYS 13 Ca -0.17 -1.37 0.00 0.00 -2.02 0.00 0.00 58.31 54.74 1fcl n LYS 13 Cb 0.53 1.34 0.00 0.00 -0.02 0.00 0.00 35.03 36.88 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 -0.29 0.67 3.30 0.72 0.00 -1.16 -4.81 105.19 103.63 1fcl n GLY 14 Ca 0.00 -1.93 -0.10 0.00 0.00 0.00 0.00 46.02 43.99 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 -1.16 1.20 -0.11 1.61 4.04 -1.26 -0.87 118.70 122.15 1fcl s GLU 15 Ca 0.00 -1.40 -0.30 0.00 0.04 0.00 0.00 54.97 53.31 1fcl s GLU 15 Cb 0.00 0.33 0.09 0.00 0.02 0.00 0.00 34.13 34.57 1fcl s GLU 15 CO 0.00 -0.42 0.82 -0.08 -1.84 0.00 0.00 175.26 173.74 1fcl s THR 16 N -4.06 0.00 0.10 1.83 -1.32 0.12 -4.90 115.64 107.41 1fcl s THR 16 Ca 0.27 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.78 1fcl s THR 16 Cb 0.05 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 70.00 1fcl s THR 16 CO 0.06 0.00 -0.08 0.42 -2.21 0.00 0.00 174.62 172.81 1fcl s THR 17 N -1.07 0.79 0.18 5.08 -4.23 -1.26 0.12 115.64 115.26 1fcl s THR 17 Ca -0.07 -1.77 -0.03 0.00 -1.18 0.00 0.00 61.69 58.65 1fcl s THR 17 Cb -0.00 -1.49 -0.03 0.00 1.34 0.00 0.00 72.50 72.32 1fcl s THR 17 CO 0.06 -0.72 0.16 -0.89 -0.54 0.00 0.00 174.62 172.69 1fcl s THR 18 N -3.01 0.03 -0.17 3.99 2.01 -1.00 -4.94 115.64 112.55 1fcl s THR 18 Ca 0.08 -1.86 0.01 0.00 0.31 0.00 0.00 61.69 60.22 1fcl s THR 18 Cb 0.01 -2.28 0.03 0.00 0.01 0.00 0.00 72.50 70.26 1fcl s THR 18 CO -0.02 -0.16 -0.15 -0.70 -0.69 0.00 0.00 174.62 172.90 1fcl s GLU 19 N -4.10 2.41 0.35 4.92 2.12 -1.26 -1.59 118.70 121.56 1fcl s GLU 19 Ca 0.31 -0.74 -0.11 0.00 0.36 0.00 0.00 54.97 54.79 1fcl s GLU 19 Cb 0.06 -2.34 0.03 0.00 0.26 0.00 0.00 34.13 32.13 1fcl s GLU 19 CO 0.08 -0.29 0.64 0.00 -0.54 0.00 0.00 175.26 175.15 1fcl s ALA 20 N 1.39 -0.22 0.26 6.30 0.00 -1.26 -4.98 121.76 123.25 1fcl s ALA 20 Ca 0.03 -0.99 -0.04 0.00 0.00 0.00 0.00 51.96 50.96 1fcl s ALA 20 Cb -0.14 0.89 0.34 0.00 0.00 0.00 0.00 23.12 24.21 1fcl s ALA 20 CO -0.10 -0.91 1.90 -0.39 0.00 0.00 0.00 175.76 176.25 1fcl h VAL 21 N 2.06 1.16 -3.61 0.00 -1.51 -1.99 -3.45 116.25 108.91 1fcl h VAL 21 Ca -0.29 -0.42 -0.07 0.00 -1.23 0.00 0.00 66.70 64.69 1fcl h VAL 21 Cb 1.25 -0.19 -0.13 0.00 -2.13 0.00 0.00 31.29 30.09 1fcl h VAL 21 CO 0.38 0.23 -0.21 -1.81 -1.23 0.00 0.00 177.57 174.92 1fcl s ASP 22 N -5.98 -0.06 0.52 4.19 1.01 -1.26 -5.03 116.67 110.07 1fcl s ASP 22 Ca -0.13 -0.53 0.22 0.00 0.71 0.00 0.00 52.55 52.82 1fcl s ASP 22 Cb 0.19 0.42 1.39 0.00 1.01 0.00 0.00 42.92 45.93 1fcl s ASP 22 CO 0.81 -0.82 2.13 0.00 0.21 0.00 0.00 175.17 177.50 1fcl h ALA 23 N 2.53 1.66 -0.43 5.23 0.00 -1.98 -2.19 119.26 124.08 1fcl h ALA 23 Ca -0.33 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1fcl h ALA 23 Cb 1.23 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1fcl h ALA 23 CO 0.50 0.09 0.27 0.00 0.00 0.00 0.00 179.25 180.11 1fcl h ALA 24 N 1.93 0.55 -0.06 0.00 0.00 -1.99 0.28 119.26 119.97 1fcl h ALA 24 Ca -0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1fcl h ALA 24 Cb 0.15 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1fcl h ALA 24 CO 0.01 0.03 -0.02 1.15 0.00 0.00 0.00 179.25 180.42 1fcl h THR 25 N 0.58 1.30 0.67 0.00 2.02 -1.82 -3.13 112.91 112.53 1fcl h THR 25 Ca 0.16 -0.96 -0.03 0.00 0.77 0.00 0.00 66.41 66.34 1fcl h THR 25 Cb -0.02 1.82 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1fcl h THR 25 CO -0.03 0.26 -0.36 0.00 0.37 0.00 0.00 175.52 175.76 1fcl h ALA 26 N 0.65 -0.96 -1.33 6.16 0.00 -1.26 -2.71 119.26 119.81 1fcl h ALA 26 Ca 0.02 -0.20 0.43 0.00 0.00 0.00 0.00 54.91 55.16 1fcl h ALA 26 Cb 0.43 0.41 -0.12 0.00 0.00 0.00 0.00 17.79 18.51 1fcl h ALA 26 CO 0.01 -1.05 0.86 1.49 0.00 0.00 0.00 179.25 180.56 1fcl h GLU 27 N -0.95 0.09 -0.52 0.00 4.81 -0.51 1.00 114.58 118.50 1fcl h GLU 27 Ca -0.09 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 1fcl h GLU 27 Cb 0.75 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.08 1fcl h GLU 27 CO 0.12 0.06 0.22 0.87 -0.73 0.00 0.00 179.01 179.55 1fcl h LYS 28 N 0.09 0.77 -0.31 1.92 1.57 -1.42 0.25 116.57 119.43 1fcl h LYS 28 Ca 0.82 -0.13 -0.13 0.00 -1.87 0.00 0.00 60.65 59.34 1fcl h LYS 28 Cb 2.58 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 34.75 1fcl h LYS 28 CO -0.40 0.66 -0.33 0.28 -0.57 0.00 0.00 179.45 179.09 1fcl h VAL 29 N 0.70 1.28 -0.18 0.50 2.07 0.94 -2.51 116.25 119.05 1fcl h VAL 29 Ca 0.18 -1.47 -0.06 0.00 0.82 0.00 0.00 66.70 66.16 1fcl h VAL 29 Cb 0.17 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1fcl h VAL 29 CO -0.02 0.48 -0.17 -0.07 0.02 0.00 0.00 177.57 177.81 1fcl h LEU 30 N 0.57 0.30 -0.48 2.57 -0.00 -0.23 -1.88 115.31 116.16 1fcl h LEU 30 Ca 0.06 -0.07 -0.02 0.00 -0.00 0.00 0.00 57.88 57.85 1fcl h LEU 30 Cb 0.84 -0.08 -0.02 0.00 -0.00 0.00 0.00 40.66 41.40 1fcl h LEU 30 CO 0.07 0.49 0.22 0.50 -0.00 0.00 0.00 178.44 179.73 1fcl h LYS 31 N 0.29 0.70 -0.99 1.13 3.11 -0.12 -1.34 116.57 119.35 1fcl h LYS 31 Ca 0.05 -0.11 0.09 0.00 -2.81 0.00 0.00 60.65 57.88 1fcl h LYS 31 Cb 0.48 -0.12 -0.08 0.00 -1.00 0.00 0.00 32.23 31.51 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 0.64 1.03 -0.78 1.90 4.20 -0.98 0.22 115.11 121.34 1fcl h GLN 32 Ca 0.17 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 1fcl h GLN 32 Cb 0.13 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 27.65 1fcl h GLN 32 CO -0.02 0.68 0.28 -0.92 -0.67 0.00 0.00 178.83 178.18 1fcl h TYR 33 N 1.06 1.22 0.00 2.96 3.20 -0.81 -1.68 116.97 122.92 1fcl h TYR 33 Ca 0.46 -0.11 -0.07 0.00 3.14 0.00 0.00 58.73 62.15 1fcl h TYR 33 Cb 0.32 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 1fcl h TYR 33 CO -0.01 0.94 -0.33 0.82 -1.64 0.00 0.00 178.16 177.94 1fcl h ILE 34 N 1.14 1.13 -0.03 1.81 1.08 0.19 -2.53 117.51 120.31 1fcl h ILE 34 Ca 0.25 -1.18 0.01 0.00 -0.39 0.00 0.00 64.86 63.56 1fcl h ILE 34 Cb 0.26 1.65 -0.00 0.00 -3.07 0.00 0.00 36.82 35.66 1fcl h ILE 34 CO -0.01 0.32 0.02 -1.13 -0.69 0.00 0.00 178.15 176.66 1fcl h ASN 35 N 0.00 0.00 0.18 1.72 -1.24 0.30 0.22 115.58 116.76 1fcl h ASN 35 Ca -0.00 0.00 -0.31 0.00 0.71 0.00 0.00 56.30 56.70 1fcl h ASN 35 Cb 0.63 0.00 0.03 0.00 0.73 0.00 0.00 38.32 39.71 1fcl h ASN 35 CO 0.04 0.00 -1.33 0.44 -1.29 0.00 0.00 177.43 175.30 1fcl h ASP 36 N 0.00 0.85 0.90 1.15 3.32 -1.43 -3.29 116.42 117.92 1fcl h ASP 36 Ca 0.01 -0.87 -0.15 0.00 0.02 0.00 0.00 57.03 56.04 1fcl h ASP 36 Cb 0.05 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 1fcl h ASP 36 CO -0.00 1.65 -0.72 0.78 -1.72 0.00 0.00 179.24 179.22 1fcl h ASN 37 N 0.19 0.00 -0.18 6.45 4.21 -1.41 -3.47 115.58 121.36 1fcl h ASN 37 Ca -0.22 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.29 1fcl h ASN 37 Cb 2.01 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 39.21 1fcl h ASN 37 CO 0.25 0.72 0.00 0.61 -1.29 0.00 0.00 177.43 177.73 1fcl n GLY 38 N 0.79 0.63 2.69 2.83 0.00 0.71 -4.97 105.19 107.87 1fcl n GLY 38 Ca -0.00 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 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 -3.39 2.81 -4.30 -0.61 2.08 -1.19 -5.02 119.36 109.74 1fcl n ILE 39 Ca 0.00 -5.27 -0.33 0.00 0.56 0.00 0.00 62.75 57.72 1fcl n ILE 39 Cb 0.45 -2.15 -0.16 0.00 -0.75 0.00 0.00 39.64 37.03 1fcl n ILE 39 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1fcl s ASP 40 N -1.89 3.13 0.00 4.38 2.15 -1.26 -4.64 116.67 118.53 1fcl s ASP 40 Ca 0.34 -0.63 0.00 0.00 0.43 0.00 0.00 52.55 52.69 1fcl s ASP 40 Cb 0.07 -1.47 0.00 0.00 -0.30 0.00 0.00 42.92 41.22 1fcl s ASP 40 CO -0.04 0.03 0.00 0.61 -0.17 0.00 0.00 175.17 175.60 1fcl n GLY 41 N 4.44 -0.78 2.85 2.66 0.00 -1.11 -4.77 105.19 108.48 1fcl n GLY 41 Ca -0.21 0.31 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 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 1.19 0.38 1.61 2.02 -0.89 -4.92 118.70 118.08 1fcl s GLU 42 Ca 0.00 -0.18 0.05 0.00 0.02 0.00 0.00 54.97 54.86 1fcl s GLU 42 Cb 0.00 -1.48 -0.00 0.00 0.10 0.00 0.00 34.13 32.75 1fcl s GLU 42 CO 0.00 -0.32 0.54 -1.58 0.02 0.00 0.00 175.26 173.93 1fcl s TRP 43 N 1.79 3.10 -0.16 1.61 0.52 -1.26 -2.17 118.94 122.38 1fcl s TRP 43 Ca 0.04 -0.11 -0.09 0.00 0.02 0.00 0.00 56.10 55.96 1fcl s TRP 43 Cb -0.13 -2.14 0.05 0.00 -1.15 0.00 0.00 33.47 30.10 1fcl s TRP 43 CO -0.07 -0.18 0.38 0.95 0.02 0.00 0.00 176.95 178.06 1fcl s THR 44 N -2.31 -0.02 0.47 2.01 -4.23 -1.24 -4.87 115.64 105.45 1fcl s THR 44 Ca 0.47 0.09 -0.03 0.00 -1.18 0.00 0.00 61.69 61.04 1fcl s THR 44 Cb -0.10 -0.57 -0.02 0.00 1.34 0.00 0.00 72.50 73.15 1fcl s THR 44 CO 0.33 0.04 0.75 -0.47 -0.54 0.00 0.00 174.62 174.72 1fcl s TYR 45 N 1.21 3.43 -0.03 3.99 5.04 -1.26 -2.02 117.35 127.70 1fcl s TYR 45 Ca -0.08 0.59 0.00 0.00 -2.44 0.00 0.00 57.07 55.14 1fcl s TYR 45 Cb -0.08 -2.32 0.03 0.00 0.35 0.00 0.00 41.96 39.94 1fcl s TYR 45 CO -0.10 -0.33 0.00 -0.51 -1.34 0.00 0.00 175.55 173.27 1fcl s ASP 46 N -4.15 0.58 0.00 4.32 1.01 -1.18 -4.92 116.67 112.32 1fcl s ASP 46 Ca 0.48 -0.03 0.20 0.00 0.71 0.00 0.00 52.55 53.91 1fcl s ASP 46 Cb -0.10 -0.24 1.00 0.00 1.01 0.00 0.00 42.92 44.59 1fcl s ASP 46 CO 0.42 -0.11 1.64 -0.67 0.21 0.00 0.00 175.17 176.66 1fcl n ASP 47 N 4.27 0.00 0.00 0.27 2.03 -1.26 -2.54 116.55 119.32 1fcl n ASP 47 Ca -0.24 0.07 0.00 0.00 0.52 0.00 0.00 54.79 55.14 1fcl n ASP 47 Cb 0.50 -0.32 0.00 0.00 -0.72 0.00 0.00 41.12 40.59 1fcl n ASP 47 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fcl n ALA 48 N -1.32 -0.32 -2.39 -1.67 0.00 -1.26 -4.34 120.51 109.21 1fcl n ALA 48 Ca 0.09 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.47 1fcl n ALA 48 Cb 0.17 0.07 0.06 0.00 0.00 0.00 0.00 19.45 19.75 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 -1.77 1.54 -3.57 0.00 5.66 -1.26 -4.97 114.28 109.91 1fcl n THR 49 Ca 0.00 -3.02 -0.20 0.00 -3.05 0.00 0.00 64.05 57.78 1fcl n THR 49 Cb 0.00 0.35 0.05 0.00 -1.55 0.00 0.00 70.33 69.18 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 -0.51 -4.71 -0.68 1.09 5.02 -1.05 -4.62 118.16 112.70 1fcl n LYS 50 Ca 0.19 0.70 0.00 0.00 -2.02 0.00 0.00 58.31 57.18 1fcl n LYS 50 Cb 0.90 -5.35 0.00 0.00 -0.02 0.00 0.00 35.03 30.55 1fcl n LYS 50 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1fcl n THR 51 N -4.10 0.00 -3.25 -0.18 -1.04 -1.18 -1.87 114.28 102.66 1fcl n THR 51 Ca -0.25 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 61.75 1fcl n THR 51 Cb 0.66 -1.29 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 1fcl n THR 51 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 1fcl n TRP 52 N -1.24 -0.91 -3.88 -1.42 7.02 0.29 -3.12 117.44 114.17 1fcl n TRP 52 Ca 0.00 -0.18 -0.08 0.00 -1.02 0.00 0.00 57.50 56.23 1fcl n TRP 52 Cb 0.00 0.07 -0.02 0.00 -2.42 0.00 0.00 31.31 28.94 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 -2.77 0.00 -0.35 -0.99 2.01 -0.86 -3.11 115.64 109.57 1fcl s THR 53 Ca 0.02 -1.07 -0.04 0.00 0.31 0.00 0.00 61.69 60.90 1fcl s THR 53 Cb -0.00 -2.12 0.19 0.00 0.01 0.00 0.00 72.50 70.57 1fcl s THR 53 CO 0.01 0.00 0.95 0.54 -0.69 0.00 0.00 174.62 175.43 1fcl s VAL 54 N -3.77 -0.42 -0.06 3.82 0.11 -1.15 -3.59 120.40 115.35 1fcl s VAL 54 Ca 0.13 -0.08 -0.18 0.00 -2.93 0.00 0.00 61.98 58.93 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 0.50 -0.89 -3.33 0.00 0.00 175.10 171.45 1fcl s THR 55 N 1.75 5.07 -2.00 5.04 2.01 -0.92 -1.41 115.64 125.18 1fcl s THR 55 Ca 0.17 1.01 0.08 0.00 0.31 0.00 0.00 61.69 63.26 1fcl s THR 55 Cb 0.03 -3.83 0.22 0.00 0.01 0.00 0.00 72.50 68.93 1fcl s THR 55 CO -0.12 0.41 0.93 1.21 -0.69 0.00 0.00 174.62 176.35