#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 3.20 0.76 12.58 2.01 -1.26 -4.21 115.64 128.72 1fcl s THR 2 Ca 0.00 -0.70 -0.11 0.00 0.31 0.00 0.00 61.69 61.19 1fcl s THR 2 Cb 0.00 -2.52 0.06 0.00 0.01 0.00 0.00 72.50 70.05 1fcl s THR 2 CO 0.00 0.33 1.13 -0.36 -0.69 0.00 0.00 174.62 175.03 1fcl s PHE 3 N 1.42 3.07 0.01 4.92 0.08 0.66 -4.83 117.98 123.31 1fcl s PHE 3 Ca 0.04 0.81 -0.06 0.00 0.12 0.00 0.00 56.93 57.84 1fcl s PHE 3 Cb -0.15 -3.32 -0.00 0.00 -0.57 0.00 0.00 43.02 38.97 1fcl s PHE 3 CO -0.04 -1.54 0.11 0.21 -0.10 0.00 0.00 175.22 173.86 1fcl s LYS 4 N -5.47 0.46 -0.05 0.44 2.20 -0.89 -1.99 119.74 114.44 1fcl s LYS 4 Ca 0.60 -0.46 -0.08 0.00 -0.36 0.00 0.00 55.97 55.67 1fcl s LYS 4 Cb -0.11 0.19 0.02 0.00 -1.51 0.00 0.00 37.83 36.41 1fcl s LYS 4 CO 0.49 -0.11 0.21 -1.17 -0.36 0.00 0.00 175.35 174.41 1fcl s LEU 5 N -1.46 1.24 -0.14 5.43 0.20 0.31 0.11 118.68 124.37 1fcl s LEU 5 Ca -0.14 0.22 -0.01 0.00 0.69 0.00 0.00 54.13 54.89 1fcl s LEU 5 Cb -0.08 0.78 -0.02 0.00 -0.43 0.00 0.00 46.19 46.45 1fcl s LEU 5 CO 0.01 -0.20 -0.11 -0.63 -0.29 0.00 0.00 176.35 175.13 1fcl s ILE 6 N -0.45 3.19 -0.34 6.68 -1.09 -1.18 -0.91 121.20 127.10 1fcl s ILE 6 Ca -0.05 -0.61 -0.28 0.00 -2.23 0.00 0.00 60.65 57.47 1fcl s ILE 6 Cb -0.04 -2.36 0.02 0.00 -1.58 0.00 0.00 42.46 38.50 1fcl s ILE 6 CO 0.01 0.51 1.06 -0.63 -1.23 0.00 0.00 174.94 174.66 1fcl s ILE 7 N 0.45 4.50 -0.65 2.92 1.01 0.25 -2.96 121.20 126.72 1fcl s ILE 7 Ca -0.08 1.63 0.02 0.00 0.00 0.00 0.00 60.65 62.21 1fcl s ILE 7 Cb -0.15 -4.41 0.38 0.00 0.01 0.00 0.00 42.46 38.28 1fcl s ILE 7 CO 0.04 -0.52 1.52 0.59 0.00 0.00 0.00 174.94 176.58 1fcl n ASN 8 N 6.91 6.02 -4.80 3.58 4.13 -0.55 -3.42 115.26 127.13 1fcl n ASN 8 Ca 0.11 -3.77 -0.36 0.00 1.68 0.00 0.00 54.58 52.24 1fcl n ASN 8 Cb 0.47 -0.75 -0.06 0.00 -1.54 0.00 0.00 39.78 37.89 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 2.70 0.47 7.41 0.00 0.20 -2.35 107.32 113.35 1fcl s GLY 9 Ca 0.49 0.40 0.19 0.00 0.00 0.00 0.00 44.72 45.81 1fcl s GLY 9 CO -0.28 0.80 1.96 0.50 0.00 0.00 0.00 173.10 176.08 1fcl h LYS 10 N 3.08 0.25 0.00 2.90 1.57 -1.96 -3.12 116.57 119.29 1fcl h LYS 10 Ca -0.47 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.26 1fcl h LYS 10 Cb 1.19 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1fcl h LYS 10 CO 0.65 0.17 -1.18 2.41 -0.57 0.00 0.00 179.45 180.93 1fcl n THR 11 N -4.44 0.11 -4.19 -0.16 -1.04 -1.26 -5.03 114.28 98.27 1fcl n THR 11 Ca 0.12 -0.10 -0.30 0.00 -2.04 0.00 0.00 64.05 61.73 1fcl n THR 11 Cb 0.53 -0.35 -0.09 0.00 -1.82 0.00 0.00 70.33 68.60 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 -3.79 3.25 0.00 -4.42 1.43 -1.18 -5.12 118.68 108.86 1fcl s LEU 12 Ca -0.01 -0.27 -0.07 0.00 -1.03 0.00 0.00 54.13 52.74 1fcl s LEU 12 Cb 0.01 -2.01 0.03 0.00 0.03 0.00 0.00 46.19 44.26 1fcl s LEU 12 CO 0.12 0.18 0.38 0.29 0.23 0.00 0.00 176.35 177.56 1fcl n LYS 13 N 0.68 0.55 0.00 1.70 5.02 -1.26 -0.63 118.16 124.22 1fcl n LYS 13 Ca -0.12 -1.09 0.00 0.00 -2.02 0.00 0.00 58.31 55.07 1fcl n LYS 13 Cb 0.52 1.36 0.00 0.00 -0.02 0.00 0.00 35.03 36.89 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 -0.26 1.25 3.55 0.72 0.00 -1.22 -4.83 105.19 104.40 1fcl n GLY 14 Ca -0.04 -2.04 -0.24 0.00 0.00 0.00 0.00 46.02 43.69 1fcl n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fcl s GLU 15 N -1.13 1.89 -0.12 1.61 2.02 -1.26 -0.59 118.70 121.12 1fcl s GLU 15 Ca 0.00 -1.76 -0.30 0.00 0.02 0.00 0.00 54.97 52.94 1fcl s GLU 15 Cb 0.00 -1.85 0.09 0.00 0.10 0.00 0.00 34.13 32.47 1fcl s GLU 15 CO 0.00 0.25 0.79 -0.08 0.02 0.00 0.00 175.26 176.24 1fcl s THR 16 N -2.51 0.00 0.05 3.63 -1.32 -0.09 -4.94 115.64 110.46 1fcl s THR 16 Ca 0.32 0.00 -0.00 0.00 -1.21 0.00 0.00 61.69 60.80 1fcl s THR 16 Cb -0.02 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.93 1fcl s THR 16 CO 0.17 0.00 -0.04 0.42 -2.21 0.00 0.00 174.62 172.96 1fcl s THR 17 N -0.89 0.31 0.17 5.08 -4.23 -1.26 0.11 115.64 114.94 1fcl s THR 17 Ca -0.06 -1.65 -0.03 0.00 -1.18 0.00 0.00 61.69 58.77 1fcl s THR 17 Cb -0.01 -1.30 -0.03 0.00 1.34 0.00 0.00 72.50 72.49 1fcl s THR 17 CO 0.06 -0.86 0.14 -0.89 -0.54 0.00 0.00 174.62 172.52 1fcl s THR 18 N -3.34 0.05 -0.18 3.99 2.01 -0.84 -4.92 115.64 112.41 1fcl s THR 18 Ca 0.03 -1.85 0.01 0.00 0.31 0.00 0.00 61.69 60.19 1fcl s THR 18 Cb 0.04 -2.22 0.04 0.00 0.01 0.00 0.00 72.50 70.36 1fcl s THR 18 CO -0.07 -0.22 -0.12 -0.70 -0.69 0.00 0.00 174.62 172.82 1fcl s GLU 19 N -4.08 2.14 0.36 4.92 2.12 -1.26 -0.24 118.70 122.65 1fcl s GLU 19 Ca 0.29 -0.76 -0.08 0.00 0.36 0.00 0.00 54.97 54.79 1fcl s GLU 19 Cb 0.06 -2.33 0.02 0.00 0.26 0.00 0.00 34.13 32.15 1fcl s GLU 19 CO 0.06 -0.36 0.60 0.00 -0.54 0.00 0.00 175.26 175.02 1fcl s ALA 20 N 1.42 0.15 0.25 6.30 0.00 -1.26 -5.00 121.76 123.62 1fcl s ALA 20 Ca 0.01 -1.20 -0.04 0.00 0.00 0.00 0.00 51.96 50.73 1fcl s ALA 20 Cb -0.15 0.97 0.34 0.00 0.00 0.00 0.00 23.12 24.28 1fcl s ALA 20 CO -0.09 -0.87 1.89 -0.39 0.00 0.00 0.00 175.76 176.30 1fcl h VAL 21 N 2.07 1.13 -3.58 0.00 -1.51 -1.98 -3.43 116.25 108.94 1fcl h VAL 21 Ca -0.29 -0.40 -0.07 0.00 -1.23 0.00 0.00 66.70 64.70 1fcl h VAL 21 Cb 1.24 -0.16 -0.14 0.00 -2.13 0.00 0.00 31.29 30.11 1fcl h VAL 21 CO 0.39 0.22 -0.22 -1.81 -1.23 0.00 0.00 177.57 174.92 1fcl s ASP 22 N -5.93 -0.07 0.53 4.19 1.01 -1.26 -5.01 116.67 110.14 1fcl s ASP 22 Ca -0.13 -0.47 0.21 0.00 0.71 0.00 0.00 52.55 52.88 1fcl s ASP 22 Cb 0.19 0.41 1.41 0.00 1.01 0.00 0.00 42.92 45.94 1fcl s ASP 22 CO 0.81 -0.79 2.14 0.00 0.21 0.00 0.00 175.17 177.54 1fcl h ALA 23 N 2.57 1.69 -0.46 5.23 0.00 -1.97 -2.09 119.26 124.23 1fcl h ALA 23 Ca -0.34 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 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 0.51 0.07 0.28 0.00 0.00 0.00 0.00 179.25 180.11 1fcl h ALA 24 N 1.94 0.58 -0.04 0.00 0.00 -1.99 0.31 119.26 120.07 1fcl h ALA 24 Ca -0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1fcl h ALA 24 Cb 0.12 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1fcl h ALA 24 CO 0.01 0.07 -0.02 1.15 0.00 0.00 0.00 179.25 180.46 1fcl h THR 25 N 0.61 1.32 0.67 0.00 2.02 -1.81 -3.14 112.91 112.58 1fcl h THR 25 Ca 0.16 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.34 1fcl h THR 25 Cb -0.01 1.89 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 1fcl h THR 25 CO -0.03 0.26 -0.36 0.00 0.37 0.00 0.00 175.52 175.77 1fcl h ALA 26 N 0.62 -0.95 -1.41 6.16 0.00 -1.26 -2.68 119.26 119.73 1fcl h ALA 26 Ca 0.01 -0.20 0.45 0.00 0.00 0.00 0.00 54.91 55.17 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 -1.04 0.94 1.49 0.00 0.00 0.00 179.25 180.64 1fcl h GLU 27 N -0.95 0.07 -0.40 0.00 4.81 -0.45 0.98 114.58 118.64 1fcl h GLU 27 Ca -0.09 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 1fcl h GLU 27 Cb 0.74 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.09 1fcl h GLU 27 CO 0.12 0.05 0.13 0.87 -0.73 0.00 0.00 179.01 179.45 1fcl h LYS 28 N 0.07 0.61 -0.36 1.92 1.57 -1.42 0.15 116.57 119.12 1fcl h LYS 28 Ca 0.82 -0.13 -0.11 0.00 -1.87 0.00 0.00 60.65 59.37 1fcl h LYS 28 Cb 2.73 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 34.94 1fcl h LYS 28 CO -0.33 0.61 -0.21 0.28 -0.57 0.00 0.00 179.45 179.22 1fcl h VAL 29 N 0.50 1.27 -0.13 0.50 2.07 0.90 -2.27 116.25 119.09 1fcl h VAL 29 Ca 0.13 -1.30 -0.06 0.00 0.82 0.00 0.00 66.70 66.30 1fcl h VAL 29 Cb 0.24 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1fcl h VAL 29 CO -0.01 0.43 -0.19 -0.07 0.02 0.00 0.00 177.57 177.75 1fcl h LEU 30 N 0.61 0.21 -0.45 2.57 -0.00 -0.34 -1.84 115.31 116.08 1fcl h LEU 30 Ca 0.09 -0.05 -0.02 0.00 -0.00 0.00 0.00 57.88 57.89 1fcl h LEU 30 Cb 0.70 -0.05 -0.02 0.00 -0.00 0.00 0.00 40.66 41.28 1fcl h LEU 30 CO 0.05 0.42 0.18 0.50 -0.00 0.00 0.00 178.44 179.59 1fcl h LYS 31 N 0.20 0.66 -1.00 1.13 3.11 -0.15 -1.27 116.57 119.26 1fcl h LYS 31 Ca 0.04 -0.12 0.10 0.00 -2.81 0.00 0.00 60.65 57.86 1fcl h LYS 31 Cb 0.46 -0.11 -0.08 0.00 -1.00 0.00 0.00 32.23 31.50 1fcl h LYS 31 CO 0.03 0.60 0.64 1.96 -2.81 0.00 0.00 179.45 179.87 1fcl h GLN 32 N 0.58 1.04 -0.66 1.90 1.08 -0.98 0.92 115.11 118.98 1fcl h GLN 32 Ca 0.15 -0.06 -0.06 0.00 -1.45 0.00 0.00 58.65 57.23 1fcl h GLN 32 Cb 0.18 -0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 27.35 1fcl h GLN 32 CO -0.01 0.69 0.20 -0.92 -0.95 0.00 0.00 178.83 177.83 1fcl h TYR 33 N 1.07 1.08 0.00 2.96 3.20 -0.82 -1.51 116.97 122.94 1fcl h TYR 33 Ca 0.47 -0.11 -0.02 0.00 3.14 0.00 0.00 58.73 62.20 1fcl h TYR 33 Cb 0.36 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 38.31 1fcl h TYR 33 CO -0.00 0.88 -0.11 0.82 -1.64 0.00 0.00 178.16 178.10 1fcl h ILE 34 N 0.97 0.48 0.18 1.81 1.08 0.22 -3.09 117.51 119.16 1fcl h ILE 34 Ca 0.21 -0.55 0.01 0.00 -0.39 0.00 0.00 64.86 64.14 1fcl h ILE 34 Cb 0.31 1.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.41 1fcl h ILE 34 CO -0.00 0.11 -0.24 -1.13 -0.69 0.00 0.00 178.15 176.19 1fcl h ASN 35 N 0.00 -0.66 0.20 1.72 -1.24 0.11 0.26 115.58 115.97 1fcl h ASN 35 Ca -0.00 0.07 -0.02 0.00 0.71 0.00 0.00 56.30 57.06 1fcl h ASN 35 Cb 0.37 0.24 -0.00 0.00 0.73 0.00 0.00 38.32 39.65 1fcl h ASN 35 CO 0.01 -0.34 -0.07 -2.24 -1.29 0.00 0.00 177.43 173.50 1fcl h ASP 36 N -0.48 0.00 0.94 1.15 3.04 -1.60 -1.98 116.42 117.50 1fcl h ASP 36 Ca 0.01 0.00 -0.21 0.00 -3.24 0.00 0.00 57.03 53.59 1fcl h ASP 36 Cb 0.47 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.73 1fcl h ASP 36 CO -0.10 0.07 -1.10 0.78 -2.04 0.00 0.00 179.24 176.85 1fcl h ASN 37 N 0.00 0.00 -0.81 4.15 4.21 -1.34 -3.48 115.58 118.32 1fcl h ASN 37 Ca -0.00 0.00 -0.09 0.00 1.21 0.00 0.00 56.30 57.42 1fcl h ASN 37 Cb 0.19 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.39 1fcl h ASN 37 CO 0.01 0.92 -0.12 0.61 -1.29 0.00 0.00 177.43 177.55 1fcl n GLY 38 N 1.38 0.22 2.60 2.83 0.00 0.81 -4.97 105.19 108.06 1fcl n GLY 38 Ca -0.04 -0.67 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 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 -3.91 3.17 -3.93 -0.61 2.08 -1.18 -5.02 119.36 109.96 1fcl n ILE 39 Ca -0.05 -5.44 -0.35 0.00 0.56 0.00 0.00 62.75 57.48 1fcl n ILE 39 Cb 0.54 -1.99 -0.14 0.00 -0.75 0.00 0.00 39.64 37.29 1fcl n ILE 39 CO 0.00 0.00 0.00 1.51 0.56 0.00 0.00 176.55 178.62 1fcl s ASP 40 N -2.44 4.45 0.00 4.38 -4.77 -1.26 -4.60 116.67 112.43 1fcl s ASP 40 Ca 0.39 -0.83 0.00 0.00 -3.30 0.00 0.00 52.55 48.81 1fcl s ASP 40 Cb 0.15 -1.70 0.00 0.00 -1.09 0.00 0.00 42.92 40.28 1fcl s ASP 40 CO -0.01 -0.13 0.00 0.61 0.70 0.00 0.00 175.17 176.34 1fcl n GLY 41 N 4.70 -0.35 2.81 2.12 0.00 -1.18 -4.80 105.19 108.49 1fcl n GLY 41 Ca -0.16 0.18 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 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 0.85 0.38 1.61 2.02 -0.69 -4.93 118.70 117.95 1fcl s GLU 42 Ca 0.00 0.00 0.05 0.00 0.02 0.00 0.00 54.97 55.04 1fcl s GLU 42 Cb 0.00 -1.16 -0.00 0.00 0.10 0.00 0.00 34.13 33.07 1fcl s GLU 42 CO 0.00 -0.30 0.55 -1.58 0.02 0.00 0.00 175.26 173.94 1fcl s TRP 43 N 1.90 3.12 -0.16 1.61 0.52 -1.26 -1.83 118.94 122.84 1fcl s TRP 43 Ca 0.05 -0.09 -0.09 0.00 0.02 0.00 0.00 56.10 55.99 1fcl s TRP 43 Cb -0.12 -2.14 0.05 0.00 -1.15 0.00 0.00 33.47 30.11 1fcl s TRP 43 CO -0.06 -0.17 0.38 0.95 0.02 0.00 0.00 176.95 178.07 1fcl s THR 44 N -2.32 -0.02 0.53 2.01 -4.23 -1.24 -4.87 115.64 105.50 1fcl s THR 44 Ca 0.47 0.09 -0.05 0.00 -1.18 0.00 0.00 61.69 61.02 1fcl s THR 44 Cb -0.10 -0.57 -0.01 0.00 1.34 0.00 0.00 72.50 73.16 1fcl s THR 44 CO 0.33 0.04 0.82 -0.47 -0.54 0.00 0.00 174.62 174.80 1fcl s TYR 45 N 1.25 3.37 -0.03 3.99 5.04 -1.26 -1.92 117.35 127.79 1fcl s TYR 45 Ca -0.08 0.65 0.00 0.00 -2.44 0.00 0.00 57.07 55.20 1fcl s TYR 45 Cb -0.08 -2.50 0.03 0.00 0.35 0.00 0.00 41.96 39.75 1fcl s TYR 45 CO -0.11 -0.54 0.01 -0.51 -1.34 0.00 0.00 175.55 173.06 1fcl s ASP 46 N -4.21 0.43 0.00 4.32 1.11 -1.18 -4.92 116.67 112.22 1fcl s ASP 46 Ca 0.50 -0.02 0.21 0.00 0.18 0.00 0.00 52.55 53.43 1fcl s ASP 46 Cb -0.10 -0.21 1.08 0.00 1.07 0.00 0.00 42.92 44.76 1fcl s ASP 46 CO 0.44 -0.11 1.68 -0.67 1.18 0.00 0.00 175.17 177.69 1fcl n ASP 47 N 4.20 0.00 0.00 0.27 -0.08 -1.26 -2.65 116.55 117.03 1fcl n ASP 47 Ca -0.26 -0.05 0.00 0.00 -1.51 0.00 0.00 54.79 52.98 1fcl n ASP 47 Cb 0.50 -0.27 0.00 0.00 2.34 0.00 0.00 41.12 43.69 1fcl n ASP 47 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1fcl n ALA 48 N -1.27 -0.37 -2.55 -1.67 0.00 -1.26 -4.37 120.51 109.02 1fcl n ALA 48 Ca 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.49 1fcl n ALA 48 Cb 0.17 0.07 0.05 0.00 0.00 0.00 0.00 19.45 19.73 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 -1.95 1.50 -3.61 0.00 5.66 -1.26 -4.97 114.28 109.66 1fcl n THR 49 Ca 0.00 -3.08 -0.20 0.00 -3.05 0.00 0.00 64.05 57.72 1fcl n THR 49 Cb 0.00 0.60 0.05 0.00 -1.55 0.00 0.00 70.33 69.44 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 -0.54 -5.46 -0.60 1.09 5.02 -1.08 -4.63 118.16 111.95 1fcl n LYS 50 Ca 0.17 0.70 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 1fcl n LYS 50 Cb 0.87 -5.41 0.00 0.00 -0.02 0.00 0.00 35.03 30.47 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 -4.22 0.00 -3.30 -0.18 -1.04 -1.19 -2.11 114.28 102.25 1fcl n THR 51 Ca -0.30 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 61.70 1fcl n THR 51 Cb 0.68 -1.37 0.00 0.00 -1.82 0.00 0.00 70.33 67.81 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 -1.32 -0.94 -3.89 -1.42 7.02 0.30 -3.11 117.44 114.06 1fcl n TRP 52 Ca 0.00 -0.26 -0.08 0.00 -1.02 0.00 0.00 57.50 56.14 1fcl n TRP 52 Cb 0.00 0.10 -0.02 0.00 -2.42 0.00 0.00 31.31 28.97 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 -2.74 0.00 -0.36 -0.99 2.01 -0.81 -3.11 115.64 109.65 1fcl s THR 53 Ca 0.03 -1.12 -0.04 0.00 0.31 0.00 0.00 61.69 60.86 1fcl s THR 53 Cb -0.00 -2.27 0.19 0.00 0.01 0.00 0.00 72.50 70.42 1fcl s THR 53 CO 0.02 0.00 0.95 0.54 -0.69 0.00 0.00 174.62 175.44 1fcl s VAL 54 N -3.54 -0.43 -0.16 3.82 0.11 -1.16 -3.59 120.40 115.46 1fcl s VAL 54 Ca 0.16 -0.10 -0.18 0.00 -2.93 0.00 0.00 61.98 58.93 1fcl s VAL 54 Cb -0.04 0.00 -0.04 0.00 -1.53 0.00 0.00 36.38 34.77 1fcl s VAL 54 CO 0.09 0.00 0.46 -0.89 -3.33 0.00 0.00 175.10 171.43 1fcl s THR 55 N 1.70 5.18 -2.00 5.04 2.01 -0.76 -1.48 115.64 125.32 1fcl s THR 55 Ca 0.17 0.89 0.01 0.00 0.31 0.00 0.00 61.69 63.07 1fcl s THR 55 Cb 0.03 -3.80 0.03 0.00 0.01 0.00 0.00 72.50 68.77 1fcl s THR 55 CO -0.12 0.28 0.56 1.21 -0.69 0.00 0.00 174.62 175.85