#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 3.57 0.71 12.58 2.01 -1.26 -4.87 115.64 128.37 1fcl s THR 2 Ca 0.00 -0.53 -0.11 0.00 0.31 0.00 0.00 61.69 61.36 1fcl s THR 2 Cb 0.00 -2.45 0.01 0.00 0.01 0.00 0.00 72.50 70.08 1fcl s THR 2 CO 0.00 0.59 1.07 -0.36 -0.69 0.00 0.00 174.62 175.23 1fcl s PHE 3 N -0.76 3.19 0.04 4.92 0.08 -0.97 -4.88 117.98 119.60 1fcl s PHE 3 Ca 0.12 1.27 -0.04 0.00 0.12 0.00 0.00 56.93 58.39 1fcl s PHE 3 Cb -0.11 -2.94 -0.02 0.00 -0.57 0.00 0.00 43.02 39.39 1fcl s PHE 3 CO 0.01 -1.24 0.06 0.21 -0.10 0.00 0.00 175.22 174.16 1fcl s LYS 4 N -5.15 0.57 -0.17 0.44 2.20 -0.94 -2.55 119.74 114.14 1fcl s LYS 4 Ca 0.58 -0.84 -0.11 0.00 -0.36 0.00 0.00 55.97 55.23 1fcl s LYS 4 Cb -0.13 0.22 0.05 0.00 -1.51 0.00 0.00 37.83 36.46 1fcl s LYS 4 CO 0.54 -0.13 0.42 -1.17 -0.36 0.00 0.00 175.35 174.65 1fcl s LEU 5 N -2.24 0.07 -0.22 5.43 0.20 0.31 0.12 118.68 122.35 1fcl s LEU 5 Ca -0.03 0.89 -0.07 0.00 0.69 0.00 0.00 54.13 55.60 1fcl s LEU 5 Cb -0.00 1.41 -0.04 0.00 -0.43 0.00 0.00 46.19 47.13 1fcl s LEU 5 CO -0.06 -0.18 0.07 -0.63 -0.29 0.00 0.00 176.35 175.26 1fcl s ILE 6 N 0.95 4.54 -0.19 6.68 -1.09 -1.10 -0.09 121.20 130.90 1fcl s ILE 6 Ca -0.06 -0.11 -0.29 0.00 -2.23 0.00 0.00 60.65 57.96 1fcl s ILE 6 Cb -0.06 -3.08 -0.01 0.00 -1.58 0.00 0.00 42.46 37.73 1fcl s ILE 6 CO -0.08 0.40 1.21 -0.63 -1.23 0.00 0.00 174.94 174.61 1fcl s ILE 7 N 1.00 4.37 -0.59 2.92 1.01 0.29 -2.92 121.20 127.28 1fcl s ILE 7 Ca 0.04 1.65 0.03 0.00 0.00 0.00 0.00 60.65 62.37 1fcl s ILE 7 Cb -0.14 -4.09 0.38 0.00 0.01 0.00 0.00 42.46 38.63 1fcl s ILE 7 CO 0.03 -0.17 1.29 0.59 0.00 0.00 0.00 174.94 176.68 1fcl n ASN 8 N 6.60 5.37 -4.84 3.58 4.13 -0.80 -3.08 115.26 126.21 1fcl n ASN 8 Ca 0.13 -3.73 -0.34 0.00 1.68 0.00 0.00 54.58 52.32 1fcl n ASN 8 Cb 0.45 -0.65 -0.06 0.00 -1.54 0.00 0.00 39.78 37.99 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 -2.92 2.44 0.45 7.41 0.00 -0.13 -1.93 107.32 112.64 1fcl s GLY 9 Ca 0.48 0.07 0.16 0.00 0.00 0.00 0.00 44.72 45.42 1fcl s GLY 9 CO -0.21 0.33 1.99 0.50 0.00 0.00 0.00 173.10 175.70 1fcl h LYS 10 N 2.75 0.33 0.00 2.90 1.57 -1.96 -3.15 116.57 119.00 1fcl h LYS 10 Ca -0.48 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.17 1fcl h LYS 10 Cb 1.18 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 1fcl h LYS 10 CO 0.65 0.22 -1.43 2.41 -0.57 0.00 0.00 179.45 180.73 1fcl n THR 11 N -4.46 0.42 -4.06 -0.16 -1.04 -1.26 -5.03 114.28 98.69 1fcl n THR 11 Ca 0.09 -0.27 -0.26 0.00 -2.04 0.00 0.00 64.05 61.58 1fcl n THR 11 Cb 0.40 -0.77 -0.05 0.00 -1.82 0.00 0.00 70.33 68.08 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 -4.42 3.87 0.24 -4.42 1.43 -1.19 -5.11 118.68 109.08 1fcl s LEU 12 Ca -0.03 -0.09 -0.20 0.00 -1.03 0.00 0.00 54.13 52.78 1fcl s LEU 12 Cb 0.02 -2.48 0.07 0.00 0.03 0.00 0.00 46.19 43.83 1fcl s LEU 12 CO 0.26 0.07 0.98 -0.75 0.23 0.00 0.00 176.35 177.14 1fcl s LYS 13 N -3.10 1.56 0.00 1.70 2.20 -1.26 -0.96 119.74 119.89 1fcl s LYS 13 Ca 0.31 -1.02 0.00 0.00 -0.36 0.00 0.00 55.97 54.91 1fcl s LYS 13 Cb -0.10 0.43 0.00 0.00 -1.51 0.00 0.00 37.83 36.65 1fcl s LYS 13 CO 0.24 -0.73 0.00 0.41 -0.36 0.00 0.00 175.35 174.91 1fcl n GLY 14 N -0.68 0.78 3.49 5.54 0.00 -1.18 -4.81 105.19 108.33 1fcl n GLY 14 Ca -0.04 -2.15 -0.23 0.00 0.00 0.00 0.00 46.02 43.60 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 -0.95 1.70 -0.13 1.61 -1.05 -1.26 0.10 118.70 118.72 1fcl s GLU 15 Ca 0.00 -1.92 -0.30 0.00 -0.15 0.00 0.00 54.97 52.61 1fcl s GLU 15 Cb 0.00 -1.19 0.09 0.00 -0.44 0.00 0.00 34.13 32.59 1fcl s GLU 15 CO 0.00 -0.06 0.81 -0.08 0.95 0.00 0.00 175.26 176.88 1fcl s THR 16 N -3.03 0.00 0.10 1.83 -1.32 0.86 -4.90 115.64 109.19 1fcl s THR 16 Ca 0.34 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.84 1fcl s THR 16 Cb 0.07 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 70.02 1fcl s THR 16 CO 0.15 0.00 -0.08 0.42 -2.21 0.00 0.00 174.62 172.90 1fcl s THR 17 N -0.86 0.83 0.16 5.08 -4.23 -1.26 0.11 115.64 115.47 1fcl s THR 17 Ca -0.06 -1.80 -0.01 0.00 -1.18 0.00 0.00 61.69 58.64 1fcl s THR 17 Cb -0.01 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.26 1fcl s THR 17 CO 0.05 -0.73 0.08 -0.89 -0.54 0.00 0.00 174.62 172.60 1fcl s THR 18 N -3.07 0.08 -0.19 3.99 2.01 -1.06 -4.95 115.64 112.45 1fcl s THR 18 Ca 0.09 -1.95 0.01 0.00 0.31 0.00 0.00 61.69 60.16 1fcl s THR 18 Cb 0.01 -2.22 0.03 0.00 0.01 0.00 0.00 72.50 70.33 1fcl s THR 18 CO -0.02 -0.29 -0.17 -0.70 -0.69 0.00 0.00 174.62 172.74 1fcl s GLU 19 N -4.09 2.73 0.04 4.92 2.12 -1.26 -2.29 118.70 120.87 1fcl s GLU 19 Ca 0.30 -0.87 -0.01 0.00 0.36 0.00 0.00 54.97 54.75 1fcl s GLU 19 Cb 0.07 -2.54 0.00 0.00 0.26 0.00 0.00 34.13 31.92 1fcl s GLU 19 CO 0.06 -0.28 0.07 0.00 -0.54 0.00 0.00 175.26 174.56 1fcl n ALA 20 N 4.62 -0.11 -0.03 6.30 0.00 -1.26 -4.99 120.51 125.04 1fcl n ALA 20 Ca -0.19 -0.15 -0.14 0.00 0.00 0.00 0.00 53.44 52.96 1fcl n ALA 20 Cb 0.49 0.12 -0.03 0.00 0.00 0.00 0.00 19.45 20.03 1fcl n ALA 20 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1fcl h VAL 21 N 1.10 1.30 -3.33 0.00 3.04 -1.98 -3.47 116.25 112.90 1fcl h VAL 21 Ca -0.03 -1.89 -0.07 0.00 -1.01 0.00 0.00 66.70 63.70 1fcl h VAL 21 Cb 0.12 1.85 -0.15 0.00 -2.01 0.00 0.00 31.29 31.10 1fcl h VAL 21 CO 0.04 0.60 -0.16 -1.81 -1.01 0.00 0.00 177.57 175.23 1fcl s ASP 22 N -7.01 -0.17 0.54 3.17 1.01 -1.26 -5.03 116.67 107.93 1fcl s ASP 22 Ca -0.09 -0.25 0.23 0.00 0.71 0.00 0.00 52.55 53.15 1fcl s ASP 22 Cb 0.10 0.42 1.51 0.00 1.01 0.00 0.00 42.92 45.96 1fcl s ASP 22 CO 0.88 -0.73 2.18 0.00 0.21 0.00 0.00 175.17 177.71 1fcl h ALA 23 N 2.79 1.68 -0.39 5.23 0.00 -1.97 -2.05 119.26 124.55 1fcl h ALA 23 Ca -0.33 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1fcl h ALA 23 Cb 1.22 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1fcl h ALA 23 CO 0.47 0.04 0.24 0.00 0.00 0.00 0.00 179.25 180.00 1fcl h ALA 24 N 1.97 0.49 -0.02 0.00 0.00 -1.98 0.49 119.26 120.20 1fcl h ALA 24 Ca -0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1fcl h ALA 24 Cb 0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1fcl h ALA 24 CO 0.00 -0.03 -0.02 1.15 0.00 0.00 0.00 179.25 180.35 1fcl h THR 25 N 0.51 1.35 0.63 0.00 2.02 -1.80 -3.14 112.91 112.49 1fcl h THR 25 Ca 0.14 -1.07 -0.03 0.00 0.77 0.00 0.00 66.41 66.22 1fcl h THR 25 Cb -0.03 2.02 0.00 0.00 -1.74 0.00 0.00 68.15 68.41 1fcl h THR 25 CO -0.03 0.28 -0.32 0.00 0.37 0.00 0.00 175.52 175.82 1fcl h ALA 26 N 0.57 -0.88 -1.40 6.16 0.00 -1.27 -2.66 119.26 119.78 1fcl h ALA 26 Ca 0.00 -0.19 0.44 0.00 0.00 0.00 0.00 54.91 55.17 1fcl h ALA 26 Cb 0.47 0.36 -0.11 0.00 0.00 0.00 0.00 17.79 18.51 1fcl h ALA 26 CO 0.00 -1.00 0.93 1.49 0.00 0.00 0.00 179.25 180.67 1fcl h GLU 27 N -0.88 0.08 -0.41 0.00 4.81 -0.10 0.98 114.58 119.06 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 0.68 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 1fcl h GLU 27 CO 0.13 0.05 0.15 0.87 -0.73 0.00 0.00 179.01 179.47 1fcl h LYS 28 N 0.08 0.62 -0.37 1.92 1.57 -1.42 0.17 116.57 119.15 1fcl h LYS 28 Ca 0.81 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 59.37 1fcl h LYS 28 Cb 2.69 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 34.89 1fcl h LYS 28 CO -0.33 0.60 -0.19 0.28 -0.57 0.00 0.00 179.45 179.24 1fcl h VAL 29 N 0.51 1.26 -0.15 0.50 2.07 0.89 -2.25 116.25 119.09 1fcl h VAL 29 Ca 0.13 -1.26 -0.07 0.00 0.82 0.00 0.00 66.70 66.33 1fcl h VAL 29 Cb 0.22 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1fcl h VAL 29 CO -0.01 0.42 -0.20 -0.07 0.02 0.00 0.00 177.57 177.73 1fcl h LEU 30 N 0.62 0.25 -0.46 2.57 -0.00 -0.31 -1.91 115.31 116.07 1fcl h LEU 30 Ca 0.09 -0.06 -0.03 0.00 -0.00 0.00 0.00 57.88 57.88 1fcl h LEU 30 Cb 0.67 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 41.24 1fcl h LEU 30 CO 0.05 0.47 0.18 0.50 -0.00 0.00 0.00 178.44 179.64 1fcl h LYS 31 N 0.24 0.69 -0.99 1.13 3.11 -0.10 -1.33 116.57 119.32 1fcl h LYS 31 Ca 0.04 -0.13 0.10 0.00 -2.81 0.00 0.00 60.65 57.86 1fcl h LYS 31 Cb 0.49 -0.11 -0.08 0.00 -1.00 0.00 0.00 32.23 31.53 1fcl h LYS 31 CO 0.03 0.62 0.63 1.96 -2.81 0.00 0.00 179.45 179.89 1fcl h GLN 32 N 0.60 1.00 -0.66 1.90 4.20 -0.92 0.25 115.11 121.47 1fcl h GLN 32 Ca 0.15 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.74 1fcl h GLN 32 Cb 0.19 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 1fcl h GLN 32 CO -0.01 0.66 0.17 -0.92 -0.67 0.00 0.00 178.83 178.06 1fcl h TYR 33 N 1.03 1.10 0.00 2.96 3.20 -0.84 -1.84 116.97 122.58 1fcl h TYR 33 Ca 0.47 -0.13 -0.06 0.00 3.14 0.00 0.00 58.73 62.16 1fcl h TYR 33 Cb 0.41 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1fcl h TYR 33 CO -0.00 0.91 -0.27 0.82 -1.64 0.00 0.00 178.16 177.98 1fcl h ILE 34 N 0.98 1.06 -0.15 1.81 1.08 0.26 -2.42 117.51 120.13 1fcl h ILE 34 Ca 0.21 -0.95 0.03 0.00 -0.39 0.00 0.00 64.86 63.76 1fcl h ILE 34 Cb 0.35 1.53 -0.01 0.00 -3.07 0.00 0.00 36.82 35.62 1fcl h ILE 34 CO 0.00 0.26 0.11 -1.13 -0.69 0.00 0.00 178.15 176.70 1fcl h ASN 35 N 0.00 0.07 0.10 1.72 -0.73 0.25 0.14 115.58 117.13 1fcl h ASN 35 Ca -0.00 -0.00 -0.17 0.00 1.87 0.00 0.00 56.30 58.00 1fcl h ASN 35 Cb 0.51 -0.02 0.02 0.00 0.27 0.00 0.00 38.32 39.10 1fcl h ASN 35 CO 0.03 0.05 -0.71 -0.78 -0.37 0.00 0.00 177.43 175.65 1fcl h ASP 36 N 0.08 0.46 0.45 1.15 3.58 -1.43 -3.28 116.42 117.42 1fcl h ASP 36 Ca 0.07 -0.90 -0.08 0.00 0.42 0.00 0.00 57.03 56.53 1fcl h ASP 36 Cb 0.17 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.06 1fcl h ASP 36 CO -0.01 1.32 -0.37 0.78 -2.88 0.00 0.00 179.24 178.08 1fcl h ASN 37 N -0.34 0.00 -0.28 2.28 4.21 -1.42 -3.47 115.58 116.57 1fcl h ASN 37 Ca -0.12 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.39 1fcl h ASN 37 Cb 1.52 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.72 1fcl h ASN 37 CO 0.13 0.37 0.00 0.61 -1.29 0.00 0.00 177.43 177.26 1fcl n GLY 38 N -0.34 0.59 2.71 2.83 0.00 0.44 -4.98 105.19 106.44 1fcl n GLY 38 Ca -0.02 -0.80 -0.29 0.00 0.00 0.00 0.00 46.02 44.91 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 -3.45 2.38 -4.00 -0.61 2.08 -1.18 -5.02 119.36 109.56 1fcl n ILE 39 Ca 0.00 -5.14 -0.32 0.00 0.56 0.00 0.00 62.75 57.85 1fcl n ILE 39 Cb 0.48 -2.16 -0.15 0.00 -0.75 0.00 0.00 39.64 37.06 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 -1.82 4.70 0.00 4.38 2.15 -1.26 -4.72 116.67 120.10 1fcl s ASP 40 Ca 0.33 -1.72 0.00 0.00 0.43 0.00 0.00 52.55 51.59 1fcl s ASP 40 Cb 0.05 -1.63 0.00 0.00 -0.30 0.00 0.00 42.92 41.04 1fcl s ASP 40 CO -0.07 -0.30 0.00 0.61 -0.17 0.00 0.00 175.17 175.24 1fcl n GLY 41 N 4.40 0.27 2.91 2.66 0.00 -1.12 -4.88 105.19 109.43 1fcl n GLY 41 Ca -0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 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 1.46 0.33 1.61 8.01 -0.20 -4.92 118.70 124.99 1fcl s GLU 42 Ca 0.00 -0.24 0.05 0.00 0.01 0.00 0.00 54.97 54.79 1fcl s GLU 42 Cb 0.00 -1.51 -0.01 0.00 -4.31 0.00 0.00 34.13 28.30 1fcl s GLU 42 CO 0.00 -0.24 0.48 -1.58 0.01 0.00 0.00 175.26 173.94 1fcl s TRP 43 N 1.60 3.22 -0.13 1.61 0.52 -1.26 -1.45 118.94 123.05 1fcl s TRP 43 Ca 0.03 -0.08 -0.07 0.00 0.02 0.00 0.00 56.10 55.99 1fcl s TRP 43 Cb -0.13 -1.95 0.05 0.00 -1.15 0.00 0.00 33.47 30.29 1fcl s TRP 43 CO -0.07 0.03 0.32 0.95 0.02 0.00 0.00 176.95 178.21 1fcl s THR 44 N -2.20 -0.03 0.39 2.01 -4.23 -1.23 -4.88 115.64 105.46 1fcl s THR 44 Ca 0.43 0.12 0.00 0.00 -1.18 0.00 0.00 61.69 61.06 1fcl s THR 44 Cb -0.09 -0.48 -0.02 0.00 1.34 0.00 0.00 72.50 73.24 1fcl s THR 44 CO 0.32 0.05 0.60 -0.47 -0.54 0.00 0.00 174.62 174.58 1fcl s TYR 45 N 1.29 3.41 -0.03 3.99 5.04 -1.26 -1.98 117.35 127.81 1fcl s TYR 45 Ca -0.09 0.33 -0.01 0.00 -2.44 0.00 0.00 57.07 54.86 1fcl s TYR 45 Cb -0.09 -2.05 0.03 0.00 0.35 0.00 0.00 41.96 40.20 1fcl s TYR 45 CO -0.10 -0.05 0.03 -0.51 -1.34 0.00 0.00 175.55 173.57 1fcl s ASP 46 N -4.10 0.61 0.00 4.32 1.01 -0.76 -4.96 116.67 112.80 1fcl s ASP 46 Ca 0.43 0.02 0.17 0.00 0.71 0.00 0.00 52.55 53.88 1fcl s ASP 46 Cb -0.10 -0.17 0.77 0.00 1.01 0.00 0.00 42.92 44.43 1fcl s ASP 46 CO 0.37 -0.16 1.53 -0.67 0.21 0.00 0.00 175.17 176.45 1fcl n ASP 47 N 4.58 0.00 0.01 0.27 -0.08 -1.26 -2.29 116.55 117.78 1fcl n ASP 47 Ca -0.19 0.34 -0.01 0.00 -1.51 0.00 0.00 54.79 53.43 1fcl n ASP 47 Cb 0.50 -0.43 -0.01 0.00 2.34 0.00 0.00 41.12 43.53 1fcl n ASP 47 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1fcl h ALA 48 N 2.66 -0.76 -0.32 -1.67 0.00 -1.96 -3.38 119.26 113.84 1fcl h ALA 48 Ca 0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.65 1fcl h ALA 48 Cb 0.24 0.29 -0.36 0.00 0.00 0.00 0.00 17.79 17.97 1fcl h ALA 48 CO 0.00 -0.76 -0.97 -2.37 0.00 0.00 0.00 179.25 175.15 1fcl n THR 49 N -2.44 1.24 -3.67 0.00 5.66 -1.25 -4.98 114.28 108.85 1fcl n THR 49 Ca -0.01 -2.65 -0.22 0.00 -3.05 0.00 0.00 64.05 58.12 1fcl n THR 49 Cb 0.02 0.62 0.05 0.00 -1.55 0.00 0.00 70.33 69.47 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 -0.37 -5.62 -2.86 1.09 5.02 -0.97 -4.67 118.16 109.79 1fcl n LYS 50 Ca 0.15 0.68 -0.20 0.00 -2.02 0.00 0.00 58.31 56.91 1fcl n LYS 50 Cb 0.92 -5.43 0.02 0.00 -0.02 0.00 0.00 35.03 30.52 1fcl n LYS 50 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1fcl s THR 51 N -3.52 3.14 0.03 -0.18 2.01 -1.19 -2.21 115.64 113.73 1fcl s THR 51 Ca 0.14 -0.72 0.01 0.00 0.31 0.00 0.00 61.69 61.43 1fcl s THR 51 Cb -0.07 -3.14 -0.00 0.00 0.01 0.00 0.00 72.50 69.30 1fcl s THR 51 CO 0.79 -0.08 0.02 0.79 -0.69 0.00 0.00 174.62 175.45 1fcl n TRP 52 N -2.13 -0.03 -3.88 4.92 7.02 0.32 -1.82 117.44 121.83 1fcl n TRP 52 Ca 0.06 -0.26 -0.08 0.00 -1.02 0.00 0.00 57.50 56.20 1fcl n TRP 52 Cb 0.59 0.01 -0.02 0.00 -2.42 0.00 0.00 31.31 29.48 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 -1.91 0.00 -0.39 -0.99 2.01 -0.84 -2.71 115.64 110.81 1fcl s THR 53 Ca 0.03 -1.10 -0.03 0.00 0.31 0.00 0.00 61.69 60.90 1fcl s THR 53 Cb 0.00 -2.26 0.20 0.00 0.01 0.00 0.00 72.50 70.45 1fcl s THR 53 CO 0.02 0.00 0.97 0.54 -0.69 0.00 0.00 174.62 175.46 1fcl s VAL 54 N -3.54 -0.45 0.05 3.82 0.11 -1.15 -3.53 120.40 115.71 1fcl s VAL 54 Ca 0.15 -0.37 -0.23 0.00 -2.93 0.00 0.00 61.98 58.60 1fcl s VAL 54 Cb -0.05 0.00 -0.06 0.00 -1.53 0.00 0.00 36.38 34.74 1fcl s VAL 54 CO 0.09 0.00 0.70 -0.89 -3.33 0.00 0.00 175.10 171.67 1fcl s THR 55 N 1.13 4.72 -2.00 5.04 2.01 -0.53 -1.91 115.64 124.10 1fcl s THR 55 Ca 0.24 1.49 0.02 0.00 0.31 0.00 0.00 61.69 63.75 1fcl s THR 55 Cb 0.07 -4.05 0.05 0.00 0.01 0.00 0.00 72.50 68.59 1fcl s THR 55 CO -0.10 0.42 0.59 1.21 -0.69 0.00 0.00 174.62 176.06