#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 5.28 0.57 4.28 2.01 -1.26 -4.23 115.64 122.29 1fcl s THR 2 Ca 0.00 0.46 -0.08 0.00 0.31 0.00 0.00 61.69 62.38 1fcl s THR 2 Cb 0.00 -3.62 -0.02 0.00 0.01 0.00 0.00 72.50 68.87 1fcl s THR 2 CO 0.00 0.30 0.92 -0.36 -0.69 0.00 0.00 174.62 174.79 1fcl s PHE 3 N 1.18 3.50 0.05 4.92 0.08 0.12 -4.86 117.98 122.96 1fcl s PHE 3 Ca 0.14 0.95 0.02 0.00 0.12 0.00 0.00 56.93 58.16 1fcl s PHE 3 Cb -0.14 -2.60 -0.03 0.00 -0.57 0.00 0.00 43.02 39.68 1fcl s PHE 3 CO 0.06 -0.61 -0.08 0.21 -0.10 0.00 0.00 175.22 174.69 1fcl s LYS 4 N -5.00 0.57 -0.07 0.44 2.20 -1.13 -1.91 119.74 114.84 1fcl s LYS 4 Ca 0.52 -0.81 -0.13 0.00 -0.36 0.00 0.00 55.97 55.20 1fcl s LYS 4 Cb -0.11 -0.33 0.03 0.00 -1.51 0.00 0.00 37.83 35.91 1fcl s LYS 4 CO 0.49 0.06 0.32 -1.17 -0.36 0.00 0.00 175.35 174.68 1fcl s LEU 5 N -1.68 0.81 -0.08 5.43 0.20 0.25 0.12 118.68 123.73 1fcl s LEU 5 Ca -0.08 0.39 0.03 0.00 0.69 0.00 0.00 54.13 55.16 1fcl s LEU 5 Cb -0.09 1.18 -0.02 0.00 -0.43 0.00 0.00 46.19 46.83 1fcl s LEU 5 CO 0.00 -0.27 -0.18 -0.63 -0.29 0.00 0.00 176.35 174.98 1fcl s ILE 6 N -0.53 2.64 -0.31 6.68 -1.09 -1.11 0.20 121.20 127.68 1fcl s ILE 6 Ca -0.06 -0.84 -0.25 0.00 -2.23 0.00 0.00 60.65 57.27 1fcl s ILE 6 Cb -0.04 -2.04 0.00 0.00 -1.58 0.00 0.00 42.46 38.81 1fcl s ILE 6 CO 0.02 0.56 0.85 -0.63 -1.23 0.00 0.00 174.94 174.51 1fcl s ILE 7 N -0.10 4.73 -0.68 2.92 1.01 0.16 -2.83 121.20 126.41 1fcl s ILE 7 Ca -0.03 1.27 0.02 0.00 0.00 0.00 0.00 60.65 61.91 1fcl s ILE 7 Cb -0.14 -4.21 0.37 0.00 0.01 0.00 0.00 42.46 38.49 1fcl s ILE 7 CO 0.04 -0.31 1.48 0.59 0.00 0.00 0.00 174.94 176.74 1fcl n ASN 8 N 6.36 5.96 -4.80 3.58 4.13 -0.91 -3.06 115.26 126.52 1fcl n ASN 8 Ca 0.05 -3.75 -0.37 0.00 1.68 0.00 0.00 54.58 52.19 1fcl n ASN 8 Cb 0.48 -0.77 -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 -2.43 2.73 0.33 7.41 0.00 -0.45 -2.24 107.32 112.67 1fcl s GLY 9 Ca 0.48 0.33 0.04 0.00 0.00 0.00 0.00 44.72 45.58 1fcl s GLY 9 CO -0.25 0.75 1.90 0.50 0.00 0.00 0.00 173.10 175.99 1fcl h LYS 10 N 3.45 0.85 0.00 2.90 1.57 -1.96 -3.10 116.57 120.28 1fcl h LYS 10 Ca -0.47 -0.05 -0.19 0.00 -1.87 0.00 0.00 60.65 58.07 1fcl h LYS 10 Cb 1.19 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 33.28 1fcl h LYS 10 CO 0.65 0.56 -1.84 0.25 -0.57 0.00 0.00 179.45 178.50 1fcl n THR 11 N -4.52 0.70 -4.15 -0.16 -2.24 -1.26 -5.01 114.28 97.64 1fcl n THR 11 Ca 0.15 -0.51 -0.23 0.00 -2.27 0.00 0.00 64.05 61.20 1fcl n THR 11 Cb 0.30 -0.46 -0.06 0.00 -2.10 0.00 0.00 70.33 68.01 1fcl n THR 11 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1fcl s LEU 12 N -4.75 3.38 0.00 3.22 1.43 -1.17 -5.13 118.68 115.66 1fcl s LEU 12 Ca -0.06 -0.60 -0.21 0.00 -1.03 0.00 0.00 54.13 52.22 1fcl s LEU 12 Cb 0.05 -1.89 0.08 0.00 0.03 0.00 0.00 46.19 44.45 1fcl s LEU 12 CO 0.55 -0.15 1.02 1.17 0.23 0.00 0.00 176.35 179.17 1fcl n LYS 13 N -1.09 0.65 0.00 1.70 4.81 -1.26 -1.34 118.16 121.63 1fcl n LYS 13 Ca -0.05 -1.47 0.00 0.00 -0.87 0.00 0.00 58.31 55.92 1fcl n LYS 13 Cb 0.60 2.00 0.00 0.00 0.02 0.00 0.00 35.03 37.64 1fcl n LYS 13 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fcl n GLY 14 N -0.72 0.85 3.19 3.14 0.00 -1.17 -4.83 105.19 105.65 1fcl n GLY 14 Ca -0.02 -1.98 -0.10 0.00 0.00 0.00 0.00 46.02 43.92 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 -1.58 0.98 0.09 1.61 -1.05 -1.26 0.39 118.70 117.88 1fcl s GLU 15 Ca 0.00 -1.39 -0.25 0.00 -0.15 0.00 0.00 54.97 53.17 1fcl s GLU 15 Cb 0.00 0.27 0.07 0.00 -0.44 0.00 0.00 34.13 34.03 1fcl s GLU 15 CO 0.00 -0.30 0.62 -0.08 0.95 0.00 0.00 175.26 176.45 1fcl s THR 16 N -4.04 0.00 0.05 1.83 -1.32 0.13 -4.92 115.64 107.38 1fcl s THR 16 Ca 0.23 -0.01 -0.01 0.00 -1.21 0.00 0.00 61.69 60.68 1fcl s THR 16 Cb 0.07 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 70.02 1fcl s THR 16 CO 0.02 -0.01 -0.01 0.42 -2.21 0.00 0.00 174.62 172.83 1fcl s THR 17 N -2.91 0.19 0.19 5.08 -4.23 -1.26 0.85 115.64 113.56 1fcl s THR 17 Ca -0.03 -1.60 -0.07 0.00 -1.18 0.00 0.00 61.69 58.81 1fcl s THR 17 Cb -0.01 -1.28 -0.02 0.00 1.34 0.00 0.00 72.50 72.53 1fcl s THR 17 CO -0.05 -0.88 0.27 -0.89 -0.54 0.00 0.00 174.62 172.52 1fcl s THR 18 N -3.46 0.03 -0.15 3.99 2.01 -0.80 -4.93 115.64 112.34 1fcl s THR 18 Ca 0.03 -1.63 0.00 0.00 0.31 0.00 0.00 61.69 60.39 1fcl s THR 18 Cb 0.05 -2.16 0.03 0.00 0.01 0.00 0.00 72.50 70.42 1fcl s THR 18 CO -0.08 -0.14 -0.12 -0.70 -0.69 0.00 0.00 174.62 172.89 1fcl s GLU 19 N -4.05 2.03 0.37 4.92 -6.30 -1.26 0.14 118.70 114.56 1fcl s GLU 19 Ca 0.26 -0.51 -0.11 0.00 -2.50 0.00 0.00 54.97 52.11 1fcl s GLU 19 Cb 0.04 -2.00 0.04 0.00 0.00 0.00 0.00 34.13 32.20 1fcl s GLU 19 CO 0.06 -0.27 0.68 0.00 0.02 0.00 0.00 175.26 175.75 1fcl s ALA 20 N 1.54 -0.23 0.25 6.30 0.00 -1.26 -4.99 121.76 123.37 1fcl s ALA 20 Ca 0.04 -1.01 -0.05 0.00 0.00 0.00 0.00 51.96 50.94 1fcl s ALA 20 Cb -0.13 0.84 0.32 0.00 0.00 0.00 0.00 23.12 24.14 1fcl s ALA 20 CO -0.10 -0.92 1.89 -0.39 0.00 0.00 0.00 175.76 176.25 1fcl h VAL 21 N 2.03 1.15 -3.62 0.00 -1.51 -1.98 -3.42 116.25 108.91 1fcl h VAL 21 Ca -0.31 -0.41 -0.07 0.00 -1.23 0.00 0.00 66.70 64.68 1fcl h VAL 21 Cb 1.25 -0.15 -0.12 0.00 -2.13 0.00 0.00 31.29 30.14 1fcl h VAL 21 CO 0.40 0.22 -0.19 -1.81 -1.23 0.00 0.00 177.57 174.96 1fcl s ASP 22 N -5.95 -0.08 0.50 4.19 1.01 -1.26 -4.94 116.67 110.14 1fcl s ASP 22 Ca -0.13 -0.61 0.21 0.00 0.71 0.00 0.00 52.55 52.74 1fcl s ASP 22 Cb 0.19 0.46 1.29 0.00 1.01 0.00 0.00 42.92 45.86 1fcl s ASP 22 CO 0.81 -0.89 2.07 0.00 0.21 0.00 0.00 175.17 177.37 1fcl h ALA 23 N 2.46 1.57 -0.42 5.23 0.00 -1.98 -2.39 119.26 123.73 1fcl h ALA 23 Ca -0.32 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1fcl h ALA 23 Cb 1.24 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1fcl h ALA 23 CO 0.47 0.15 0.27 0.00 0.00 0.00 0.00 179.25 180.15 1fcl h ALA 24 N 1.88 0.53 -0.03 0.00 0.00 -1.99 0.42 119.26 120.07 1fcl h ALA 24 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1fcl h ALA 24 Cb 0.25 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1fcl h ALA 24 CO 0.02 -0.02 -0.01 1.15 0.00 0.00 0.00 179.25 180.38 1fcl h THR 25 N 0.56 1.33 0.70 0.00 2.02 -1.86 -3.13 112.91 112.53 1fcl h THR 25 Ca 0.15 -1.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.30 1fcl h THR 25 Cb -0.06 1.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 1fcl h THR 25 CO -0.04 0.27 -0.37 0.00 0.37 0.00 0.00 175.52 175.75 1fcl h ALA 26 N 0.60 -0.99 -1.47 6.16 0.00 -1.26 -2.67 119.26 119.63 1fcl h ALA 26 Ca 0.01 -0.21 0.46 0.00 0.00 0.00 0.00 54.91 55.17 1fcl h ALA 26 Cb 0.44 0.42 -0.11 0.00 0.00 0.00 0.00 17.79 18.54 1fcl h ALA 26 CO 0.00 -1.06 0.99 1.49 0.00 0.00 0.00 179.25 180.67 1fcl h GLU 27 N -0.99 0.06 -0.35 0.00 4.81 -0.23 0.96 114.58 118.84 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 0.77 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 1fcl h GLU 27 CO 0.14 0.04 0.12 0.87 -0.73 0.00 0.00 179.01 179.44 1fcl h LYS 28 N 0.06 0.54 -0.38 1.92 1.57 -1.41 0.19 116.57 119.06 1fcl h LYS 28 Ca 0.83 -0.11 -0.11 0.00 -1.87 0.00 0.00 60.65 59.39 1fcl h LYS 28 Cb 2.83 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 35.05 1fcl h LYS 28 CO -0.28 0.56 -0.20 0.28 -0.57 0.00 0.00 179.45 179.23 1fcl h VAL 29 N 0.41 1.27 -0.10 0.50 2.07 0.86 -2.25 116.25 119.00 1fcl h VAL 29 Ca 0.11 -1.29 -0.06 0.00 0.82 0.00 0.00 66.70 66.29 1fcl h VAL 29 Cb 0.24 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1fcl h VAL 29 CO -0.00 0.43 -0.20 -0.07 0.02 0.00 0.00 177.57 177.74 1fcl h LEU 30 N 0.64 0.16 -0.47 2.57 -0.00 -0.39 -1.78 115.31 116.04 1fcl h LEU 30 Ca 0.09 -0.04 -0.03 0.00 -0.00 0.00 0.00 57.88 57.91 1fcl h LEU 30 Cb 0.69 -0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 41.29 1fcl h LEU 30 CO 0.05 0.38 0.18 0.50 -0.00 0.00 0.00 178.44 179.55 1fcl h LYS 31 N 0.16 0.71 -1.00 1.13 3.11 -0.07 -1.45 116.57 119.16 1fcl h LYS 31 Ca 0.03 -0.13 0.10 0.00 -2.81 0.00 0.00 60.65 57.84 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 0.65 0.64 1.96 -2.81 0.00 0.00 179.45 179.92 1fcl h GLN 32 N 0.62 1.03 -0.43 1.90 4.20 -0.97 0.28 115.11 121.74 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 0.21 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1fcl h GLN 32 CO -0.01 0.68 0.02 -0.92 -0.67 0.00 0.00 178.83 177.93 1fcl h TYR 33 N 1.06 0.71 0.00 2.96 3.20 -0.87 -0.45 116.97 123.57 1fcl h TYR 33 Ca 0.48 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.27 1fcl h TYR 33 Cb 0.38 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1fcl h TYR 33 CO -0.00 0.65 0.00 -0.89 -1.64 0.00 0.00 178.16 176.28 1fcl n ILE 34 N -4.25 0.45 0.17 1.81 2.08 0.85 -2.90 119.36 117.56 1fcl n ILE 34 Ca 0.02 0.11 0.05 0.00 0.56 0.00 0.00 62.75 63.49 1fcl n ILE 34 Cb 0.26 -0.76 0.22 0.00 -0.75 0.00 0.00 39.64 38.61 1fcl n ILE 34 CO 0.00 0.00 0.00 -1.13 0.56 0.00 0.00 176.55 175.98 1fcl h ASN 35 N 0.00 0.00 0.03 4.38 -1.24 0.30 -2.51 115.58 116.54 1fcl h ASN 35 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.01 1fcl h ASN 35 Cb 0.26 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.31 1fcl h ASN 35 CO 0.00 0.43 -0.01 -0.78 -1.29 0.00 0.00 177.43 175.77 1fcl h ASP 36 N 0.00 -0.03 -0.15 1.15 3.58 -1.63 -3.33 116.42 116.01 1fcl h ASP 36 Ca -0.00 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.49 1fcl h ASP 36 Cb 1.09 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 42.14 1fcl h ASP 36 CO 0.06 0.35 0.13 -0.55 -2.88 0.00 0.00 179.24 176.35 1fcl h ASN 37 N -0.79 0.00 -3.33 2.28 -1.07 -1.70 -3.46 115.58 107.51 1fcl h ASN 37 Ca -0.00 0.00 -0.08 0.00 0.07 0.00 0.00 56.30 56.29 1fcl h ASN 37 Cb 0.03 0.00 0.05 0.00 -2.07 0.00 0.00 38.32 36.33 1fcl h ASN 37 CO 0.01 0.00 -0.22 0.61 0.07 0.00 0.00 177.43 177.90 1fcl n GLY 38 N -1.47 0.30 2.55 9.14 0.00 -0.95 -4.99 105.19 109.77 1fcl n GLY 38 Ca 0.01 -0.18 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 1fcl n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fcl s ILE 39 N -3.10 0.84 -0.04 -0.61 -1.09 -1.18 -5.04 121.20 110.97 1fcl s ILE 39 Ca 0.07 -2.57 0.04 0.00 -2.23 0.00 0.00 60.65 55.96 1fcl s ILE 39 Cb -0.01 -1.58 -0.00 0.00 -1.58 0.00 0.00 42.46 39.28 1fcl s ILE 39 CO 0.19 -1.06 -0.17 -0.62 -1.23 0.00 0.00 174.94 172.05 1fcl s ASP 40 N 0.22 2.10 0.00 3.58 2.15 -1.26 -4.70 116.67 118.76 1fcl s ASP 40 Ca 0.24 -0.34 0.00 0.00 0.43 0.00 0.00 52.55 52.88 1fcl s ASP 40 Cb -0.11 -0.56 0.00 0.00 -0.30 0.00 0.00 42.92 41.95 1fcl s ASP 40 CO -0.09 0.15 0.00 0.61 -0.17 0.00 0.00 175.17 175.67 1fcl n GLY 41 N 3.12 -1.80 3.03 2.66 0.00 -1.07 -4.63 105.19 106.51 1fcl n GLY 41 Ca -0.18 0.64 -0.30 0.00 0.00 0.00 0.00 46.02 46.18 1fcl n GLY 41 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1fcl s GLU 42 N 0.00 2.32 -1.07 1.61 -6.30 -0.92 -4.91 118.70 109.43 1fcl s GLU 42 Ca 0.00 -0.57 -0.08 0.00 -2.50 0.00 0.00 54.97 51.82 1fcl s GLU 42 Cb 0.00 -2.09 0.27 0.00 0.00 0.00 0.00 34.13 32.31 1fcl s GLU 42 CO 0.00 -0.21 1.05 -1.58 0.02 0.00 0.00 175.26 174.54 1fcl s TRP 43 N 1.39 4.21 0.20 5.30 0.52 -1.26 -1.80 118.94 127.50 1fcl s TRP 43 Ca 0.03 -2.77 -0.31 0.00 0.02 0.00 0.00 56.10 53.07 1fcl s TRP 43 Cb -0.13 -3.72 -0.10 0.00 -1.15 0.00 0.00 33.47 28.37 1fcl s TRP 43 CO -0.09 -0.91 1.56 0.95 0.02 0.00 0.00 176.95 178.49 1fcl s THR 44 N -1.30 2.50 0.44 2.01 -4.23 -1.26 -4.52 115.64 109.28 1fcl s THR 44 Ca 0.30 0.37 0.02 0.00 -1.18 0.00 0.00 61.69 61.21 1fcl s THR 44 Cb -0.09 -3.24 0.00 0.00 1.34 0.00 0.00 72.50 70.51 1fcl s THR 44 CO -0.09 0.04 0.64 -0.47 -0.54 0.00 0.00 174.62 174.20 1fcl s TYR 45 N 0.80 3.13 -0.03 3.99 5.04 -1.26 -2.26 117.35 126.76 1fcl s TYR 45 Ca 0.68 0.08 -0.00 0.00 -2.44 0.00 0.00 57.07 55.39 1fcl s TYR 45 Cb -0.45 -2.32 0.03 0.00 0.35 0.00 0.00 41.96 39.58 1fcl s TYR 45 CO 0.35 -0.37 0.02 -0.51 -1.34 0.00 0.00 175.55 173.70 1fcl s ASP 46 N -4.24 0.39 0.00 4.32 1.01 -0.93 -4.96 116.67 112.25 1fcl s ASP 46 Ca 0.49 0.01 0.24 0.00 0.71 0.00 0.00 52.55 54.00 1fcl s ASP 46 Cb -0.10 -0.16 1.29 0.00 1.01 0.00 0.00 42.92 44.96 1fcl s ASP 46 CO 0.36 -0.13 1.80 -0.90 0.21 0.00 0.00 175.17 176.51 1fcl n ASP 47 N 4.31 0.00 0.00 0.27 5.68 -1.26 -2.80 116.55 122.75 1fcl n ASP 47 Ca -0.24 -0.28 0.00 0.00 -0.50 0.00 0.00 54.79 53.77 1fcl n ASP 47 Cb 0.50 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 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 -1.19 -0.33 -2.51 2.12 0.00 -1.26 -4.36 120.51 112.98 1fcl n ALA 48 Ca 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.51 1fcl n ALA 48 Cb 0.16 0.07 0.05 0.00 0.00 0.00 0.00 19.45 19.72 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 -1.79 1.58 -3.64 0.00 5.66 -1.26 -4.95 114.28 109.89 1fcl n THR 49 Ca 0.00 -3.16 -0.24 0.00 -3.05 0.00 0.00 64.05 57.60 1fcl n THR 49 Cb 0.00 0.48 0.07 0.00 -1.55 0.00 0.00 70.33 69.33 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 -0.56 -7.32 -2.12 1.09 5.02 -1.12 -4.64 118.16 108.51 1fcl n LYS 50 Ca 0.19 0.79 -0.27 0.00 -2.02 0.00 0.00 58.31 56.99 1fcl n LYS 50 Cb 0.88 -5.80 0.06 0.00 -0.02 0.00 0.00 35.03 30.15 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 -3.33 2.73 0.08 -0.18 2.01 -1.18 -2.83 115.64 112.93 1fcl s THR 51 Ca 0.51 -0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.51 1fcl s THR 51 Cb -0.23 -3.18 -0.00 0.00 0.01 0.00 0.00 72.50 69.09 1fcl s THR 51 CO 0.75 -0.21 0.05 0.79 -0.69 0.00 0.00 174.62 175.30 1fcl n TRP 52 N -2.96 -0.09 -3.85 4.92 7.02 0.31 -2.19 117.44 120.60 1fcl n TRP 52 Ca 0.07 -0.58 -0.10 0.00 -1.02 0.00 0.00 57.50 55.87 1fcl n TRP 52 Cb 0.59 0.04 0.01 0.00 -2.42 0.00 0.00 31.31 29.53 1fcl n TRP 52 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 1fcl n THR 53 N -0.16 0.00 -2.66 -0.99 -1.04 -0.96 -2.74 114.28 105.73 1fcl n THR 53 Ca 0.00 -1.21 -0.03 0.00 -2.04 0.00 0.00 64.05 60.77 1fcl n THR 53 Cb 0.13 0.98 0.04 0.00 -1.82 0.00 0.00 70.33 69.66 1fcl n THR 53 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1fcl n VAL 54 N -0.53 0.00 -2.94 12.58 3.14 -1.13 -4.12 118.33 125.34 1fcl n VAL 54 Ca -0.05 -0.18 -0.40 0.00 -2.96 0.00 0.00 64.34 60.75 1fcl n VAL 54 Cb 0.57 0.62 -0.05 0.00 -1.06 0.00 0.00 33.84 33.92 1fcl n VAL 54 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1fcl s THR 55 N 0.86 4.59 -2.00 1.55 2.01 -0.75 -2.15 115.64 119.75 1fcl s THR 55 Ca 0.23 1.73 0.10 0.00 0.31 0.00 0.00 61.69 64.06 1fcl s THR 55 Cb 0.15 -4.16 0.29 0.00 0.01 0.00 0.00 72.50 68.79 1fcl s THR 55 CO -0.11 0.40 1.04 1.21 -0.69 0.00 0.00 174.62 176.48