#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fuh h LEU 3 N 0.00 0.12 -0.35 0.00 4.07 -1.98 0.28 115.31 117.45 2fuh h LEU 3 Ca 0.00 0.02 -0.04 0.00 0.08 0.00 0.00 57.88 57.94 2fuh h LEU 3 Cb 0.00 -0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.72 2fuh h LEU 3 CO 0.00 0.03 0.08 0.11 -1.08 0.00 0.00 178.44 177.58 2fuh h LYS 4 N 0.11 0.56 -0.24 1.13 6.56 -2.00 0.43 116.57 123.12 2fuh h LYS 4 Ca 0.48 -0.14 -0.17 0.00 -1.06 0.00 0.00 60.65 59.76 2fuh h LYS 4 Cb 1.73 -0.07 -0.00 0.00 -0.57 0.00 0.00 32.23 33.31 2fuh h LYS 4 CO -0.07 0.62 -0.55 0.00 -2.06 0.00 0.00 179.45 177.40 2fuh h ARG 5 N 0.41 0.72 -0.43 3.15 2.47 -0.99 -3.00 114.38 116.71 2fuh h ARG 5 Ca 0.11 -0.45 -0.13 0.00 -1.26 0.00 0.00 59.98 58.24 2fuh h ARG 5 Cb 0.32 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.68 2fuh h ARG 5 CO 0.00 1.08 -0.26 0.82 0.56 0.00 0.00 179.97 182.17 2fuh h ILE 6 N 0.55 1.27 0.00 2.04 2.04 -0.74 -2.47 117.51 120.20 2fuh h ILE 6 Ca 0.01 -1.41 -0.00 0.00 1.00 0.00 0.00 64.86 64.46 2fuh h ILE 6 Cb 1.12 1.22 -0.00 0.00 -0.74 0.00 0.00 36.82 38.42 2fuh h ILE 6 CO 0.11 0.48 -0.01 -1.13 0.00 0.00 0.00 178.15 177.60 2fuh h ASN 7 N 0.77 0.00 -0.26 1.72 -1.24 -0.08 -2.40 115.58 114.09 2fuh h ASN 7 Ca 0.09 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.10 2fuh h ASN 7 Cb 0.82 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.85 2fuh h ASN 7 CO 0.07 0.01 0.15 0.50 -1.29 0.00 0.00 177.43 176.88 2fuh h LYS 8 N 0.00 0.35 0.18 6.67 3.64 -1.30 -2.34 116.57 123.77 2fuh h LYS 8 Ca -0.00 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2fuh h LYS 8 Cb 0.14 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2fuh h LYS 8 CO 0.00 0.28 -0.10 0.93 -2.27 0.00 0.00 179.45 178.29 2fuh h GLU 9 N 0.32 -0.26 -1.01 1.90 3.07 -1.54 -1.92 114.58 115.14 2fuh h GLU 9 Ca 0.09 0.02 0.26 0.00 -0.50 0.00 0.00 59.36 59.23 2fuh h GLU 9 Cb 0.02 0.06 -0.07 0.00 -0.84 0.00 0.00 28.75 27.92 2fuh h GLU 9 CO -0.02 -0.18 0.68 1.25 -1.40 0.00 0.00 179.01 179.35 2fuh h LEU 10 N -0.27 0.27 -1.03 1.33 6.46 -1.54 0.46 115.31 120.99 2fuh h LEU 10 Ca -0.02 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.77 2fuh h LEU 10 Cb 0.22 -0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.11 2fuh h LEU 10 CO 0.02 0.07 0.47 -1.28 -0.62 0.00 0.00 178.44 177.10 2fuh h SER 11 N 0.25 1.02 0.11 1.25 0.87 -0.79 -2.10 113.55 114.16 2fuh h SER 11 Ca 0.53 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 61.00 2fuh h SER 11 Cb 1.60 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 63.30 2fuh h SER 11 CO -0.16 0.81 -0.05 -0.78 -0.53 0.00 0.00 176.83 176.11 2fuh h ASP 12 N 1.15 -0.12 -0.40 6.23 3.58 0.01 -2.39 116.42 124.48 2fuh h ASP 12 Ca 0.29 -0.18 0.12 0.00 0.42 0.00 0.00 57.03 57.68 2fuh h ASP 12 Cb 0.00 0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.07 2fuh h ASP 12 CO -0.05 0.11 0.34 -0.07 -2.88 0.00 0.00 179.24 176.69 2fuh h LEU 13 N -0.36 0.00 -0.56 2.28 4.07 -1.25 0.95 115.31 120.44 2fuh h LEU 13 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 2fuh h LEU 13 Cb 0.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 2fuh h LEU 13 CO 0.02 0.00 0.00 0.00 -1.08 0.00 0.00 178.44 177.38 2fuh h ALA 14 N 1.69 1.00 0.00 1.53 0.00 -0.87 -3.32 119.26 119.30 2fuh h ALA 14 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 2fuh h ALA 14 Cb 0.87 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2fuh h ALA 14 CO -0.00 0.00 -1.41 0.54 0.00 0.00 0.00 179.25 178.37 2fuh n ARG 15 N -2.59 0.53 -3.12 0.00 1.74 0.30 -4.99 116.66 108.52 2fuh n ARG 15 Ca 0.03 0.22 0.01 0.00 -0.77 0.00 0.00 57.85 57.33 2fuh n ARG 15 Cb 0.36 -1.41 -0.01 0.00 -1.02 0.00 0.00 32.46 30.38 2fuh n ARG 15 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2fuh s ASP 16 N -6.35 -1.40 0.97 0.55 -4.77 0.58 -5.12 116.67 101.13 2fuh s ASP 16 Ca -0.31 -0.79 -0.12 0.00 -3.30 0.00 0.00 52.55 48.03 2fuh s ASP 16 Cb 0.07 1.79 0.09 0.00 -1.09 0.00 0.00 42.92 43.78 2fuh s ASP 16 CO 0.43 -0.15 0.63 -2.65 0.70 0.00 0.00 175.17 174.13 2fuh n PRO 17 N 4.21 -0.60 -1.73 2.11 -0.02 -1.25 -4.71 135.00 133.01 2fuh n PRO 17 Ca 0.11 -0.13 -0.42 0.00 -2.02 0.00 0.00 63.50 61.04 2fuh n PRO 17 Cb 0.58 -2.02 -0.03 0.00 -0.02 0.00 0.00 33.50 32.01 2fuh n PRO 17 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2fuh s PRO 18 N -3.96 4.13 -0.07 0.52 0.04 -1.26 -4.93 135.00 129.46 2fuh s PRO 18 Ca 0.60 2.60 -0.24 0.00 0.04 0.00 0.00 61.00 64.01 2fuh s PRO 18 Cb -0.21 -3.08 -0.19 0.00 0.04 0.00 0.00 34.50 31.06 2fuh s PRO 18 CO 0.64 -0.75 0.93 0.00 0.04 0.00 0.00 177.00 177.86 2fuh h ALA 19 N 6.81 -0.09 0.60 8.56 0.00 -2.01 -3.36 119.26 129.77 2fuh h ALA 19 Ca -0.43 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.15 2fuh h ALA 19 Cb 1.20 0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.03 2fuh h ALA 19 CO 0.96 -0.19 -0.29 1.96 0.00 0.00 0.00 179.25 181.69 2fuh h GLN 20 N -0.79 -0.77 -6.16 0.00 4.20 -2.00 -3.45 115.11 106.14 2fuh h GLN 20 Ca -0.01 0.05 -0.50 0.00 0.06 0.00 0.00 58.65 58.25 2fuh h GLN 20 Cb 0.62 0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.54 2fuh h GLN 20 CO 0.01 -0.50 -0.42 0.00 -0.67 0.00 0.00 178.83 177.25 2fuh s SER 22 N -4.06 3.58 -0.11 0.00 1.04 -0.81 -4.12 113.70 109.21 2fuh s SER 22 Ca 0.45 -1.37 -0.32 0.00 0.48 0.00 0.00 55.95 55.19 2fuh s SER 22 Cb -0.04 -0.34 0.12 0.00 0.10 0.00 0.00 66.02 65.87 2fuh s SER 22 CO 0.27 -0.48 1.07 0.00 0.98 0.00 0.00 173.24 175.08 2fuh s ALA 23 N -2.83 -1.97 0.00 5.32 0.00 -1.26 -3.00 121.76 118.02 2fuh s ALA 23 Ca 0.35 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.68 2fuh s ALA 23 Cb 0.10 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.27 2fuh s ALA 23 CO 0.17 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.73 2fuh n GLY 24 N -0.11 0.68 3.81 0.00 0.00 -1.17 -5.01 105.19 103.39 2fuh n GLY 24 Ca -0.04 0.62 -0.34 0.00 0.00 0.00 0.00 46.02 46.26 2fuh n GLY 24 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fuh s PRO 25 N 0.00 4.32 -0.31 1.61 0.04 -1.26 -3.84 135.00 135.56 2fuh s PRO 25 Ca 0.00 1.14 -0.29 0.00 0.04 0.00 0.00 61.00 61.90 2fuh s PRO 25 Cb 0.00 -2.40 -0.02 0.00 0.04 0.00 0.00 34.50 32.12 2fuh s PRO 25 CO 0.00 0.09 1.70 0.08 0.04 0.00 0.00 177.00 178.91 2fuh s VAL 26 N -1.98 3.59 0.60 -0.36 1.01 -1.16 -4.83 120.40 117.27 2fuh s VAL 26 Ca 0.57 0.62 0.30 0.00 0.00 0.00 0.00 61.98 63.47 2fuh s VAL 26 Cb -0.12 -3.73 0.42 0.00 0.00 0.00 0.00 36.38 32.95 2fuh s VAL 26 CO 0.17 -0.42 1.52 1.23 0.00 0.00 0.00 175.10 177.60 2fuh h GLY 27 N 12.92 0.00 -0.20 4.51 0.00 -1.93 -1.06 103.07 117.30 2fuh h GLY 27 Ca -0.33 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.03 2fuh h GLY 27 CO 1.03 0.00 -0.45 -0.55 0.00 0.00 0.00 176.54 176.57 2fuh h ASP 28 N 0.00 -1.47 -4.93 0.19 5.19 -1.99 -3.44 116.42 109.98 2fuh h ASP 28 Ca 0.45 0.18 -0.16 0.00 -0.62 0.00 0.00 57.03 56.88 2fuh h ASP 28 Cb 2.44 0.58 -0.21 0.00 0.18 0.00 0.00 39.33 42.32 2fuh h ASP 28 CO -0.00 -0.37 -0.59 -1.81 -3.12 0.00 0.00 179.24 173.34 2fuh s ASP 29 N -4.51 0.12 -0.59 6.45 1.01 -0.40 -5.05 116.67 113.70 2fuh s ASP 29 Ca -0.12 -0.33 -0.05 0.00 0.71 0.00 0.00 52.55 52.76 2fuh s ASP 29 Cb 0.06 0.15 0.00 0.00 1.01 0.00 0.00 42.92 44.15 2fuh s ASP 29 CO 0.50 -0.32 2.88 0.23 0.21 0.00 0.00 175.17 178.66 2fuh n MET 30 N 1.58 2.80 0.00 8.23 2.81 -1.26 -3.72 117.12 127.56 2fuh n MET 30 Ca -0.23 -2.29 0.00 0.00 -1.81 0.00 0.00 57.70 53.37 2fuh n MET 30 Cb 0.55 -2.24 0.00 0.00 -0.71 0.00 0.00 33.22 30.82 2fuh n MET 30 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2fuh n PHE 31 N 1.48 0.00 -3.84 2.03 3.72 -1.26 -4.92 117.46 114.68 2fuh n PHE 31 Ca 0.52 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.68 2fuh n PHE 31 Cb 0.55 0.01 -0.17 0.00 -0.94 0.00 0.00 39.48 38.92 2fuh n PHE 31 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 2fuh s HIS 32 N 0.00 0.84 0.03 1.38 2.46 -1.24 -3.31 115.29 115.45 2fuh s HIS 32 Ca 0.00 -0.29 0.07 0.00 0.47 0.00 0.00 55.06 55.31 2fuh s HIS 32 Cb 0.00 -0.88 -0.02 0.00 -0.13 0.00 0.00 32.58 31.55 2fuh s HIS 32 CO 0.00 -0.35 -0.20 -1.58 -2.47 0.00 0.00 174.74 170.13 2fuh s TRP 33 N 1.82 1.80 0.18 3.88 0.52 -1.08 -3.00 118.94 123.06 2fuh s TRP 33 Ca 0.04 -0.36 0.06 0.00 0.02 0.00 0.00 56.10 55.86 2fuh s TRP 33 Cb -0.12 -1.09 -0.05 0.00 -1.15 0.00 0.00 33.47 31.06 2fuh s TRP 33 CO -0.05 0.06 -0.13 -0.65 0.02 0.00 0.00 176.95 176.20 2fuh s GLN 34 N -0.99 1.22 -0.23 4.98 -0.21 -1.25 -0.69 119.66 122.50 2fuh s GLN 34 Ca 0.07 -1.53 -0.24 0.00 0.02 0.00 0.00 55.36 53.68 2fuh s GLN 34 Cb -0.08 -0.93 0.06 0.00 1.00 0.00 0.00 33.01 33.06 2fuh s GLN 34 CO 0.01 0.14 0.67 0.00 -2.12 0.00 0.00 175.29 173.99 2fuh s ALA 35 N -3.09 -1.65 0.16 6.09 0.00 -0.04 -3.04 121.76 120.18 2fuh s ALA 35 Ca 0.20 1.81 0.08 0.00 0.00 0.00 0.00 51.96 54.05 2fuh s ALA 35 Cb 0.00 -0.97 -0.04 0.00 0.00 0.00 0.00 23.12 22.11 2fuh s ALA 35 CO 0.04 -0.32 -0.18 0.99 0.00 0.00 0.00 175.76 176.29 2fuh s THR 36 N 0.17 1.81 -0.03 0.00 2.01 -1.16 0.99 115.64 119.43 2fuh s THR 36 Ca -0.01 -1.89 -0.01 0.00 0.31 0.00 0.00 61.69 60.09 2fuh s THR 36 Cb -0.04 -1.82 0.03 0.00 0.01 0.00 0.00 72.50 70.67 2fuh s THR 36 CO 0.02 -0.29 0.04 0.27 -0.69 0.00 0.00 174.62 173.97 2fuh s ILE 37 N -1.98 -0.08 -0.09 1.82 -4.36 -1.02 -1.93 121.20 113.55 2fuh s ILE 37 Ca 0.15 0.31 -0.18 0.00 -0.26 0.00 0.00 60.65 60.67 2fuh s ILE 37 Cb -0.06 -0.11 -0.04 0.00 1.25 0.00 0.00 42.46 43.49 2fuh s ILE 37 CO 0.06 0.13 0.50 -0.32 0.24 0.00 0.00 174.94 175.55 2fuh s MET 38 N 1.57 4.31 -0.34 0.37 1.75 -1.26 -3.16 119.30 122.54 2fuh s MET 38 Ca -0.03 0.50 -0.44 0.00 -1.25 0.00 0.00 55.69 54.47 2fuh s MET 38 Cb -0.13 -3.41 -0.20 0.00 2.84 0.00 0.00 34.83 33.94 2fuh s MET 38 CO -0.03 0.22 1.46 0.41 -0.65 0.00 0.00 175.02 176.43 2fuh n GLY 39 N 3.04 0.11 3.84 2.11 0.00 -0.96 -4.90 105.19 108.42 2fuh n GLY 39 Ca -0.07 0.93 -0.31 0.00 0.00 0.00 0.00 46.02 46.57 2fuh n GLY 39 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fuh s PRO 40 N 2.15 2.95 -0.13 1.61 0.04 -1.26 -4.66 135.00 135.70 2fuh s PRO 40 Ca 1.00 0.75 -0.04 0.00 0.04 0.00 0.00 61.00 62.76 2fuh s PRO 40 Cb -1.40 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 31.05 2fuh s PRO 40 CO 0.73 -1.04 2.91 0.09 0.04 0.00 0.00 177.00 179.73 2fuh n ASN 41 N -3.06 5.65 -0.63 6.66 3.02 -1.26 -3.26 115.26 122.38 2fuh n ASN 41 Ca 0.07 -2.68 -0.02 0.00 -0.03 0.00 0.00 54.58 51.92 2fuh n ASN 41 Cb 0.55 -1.28 -0.02 0.00 -0.61 0.00 0.00 39.78 38.42 2fuh n ASN 41 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2fuh n ASP 42 N 1.70 -0.31 -3.70 6.41 2.03 -1.26 -5.12 116.55 116.30 2fuh n ASP 42 Ca 0.33 -1.25 -0.14 0.00 0.52 0.00 0.00 54.79 54.26 2fuh n ASP 42 Cb 0.71 0.09 -0.09 0.00 -0.72 0.00 0.00 41.12 41.11 2fuh n ASP 42 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2fuh s SER 43 N -0.31 -0.44 -0.79 1.67 0.15 -1.20 -4.84 113.70 107.94 2fuh s SER 43 Ca 0.00 0.75 -0.12 0.00 0.70 0.00 0.00 55.95 57.27 2fuh s SER 43 Cb 0.00 0.78 -0.10 0.00 -1.71 0.00 0.00 66.02 65.00 2fuh s SER 43 CO 0.00 -0.26 1.97 -0.81 1.20 0.00 0.00 173.24 175.33 2fuh n PRO 44 N 2.33 1.70 0.00 5.44 -0.04 -1.26 -3.18 135.00 139.99 2fuh n PRO 44 Ca -0.16 -1.55 0.00 0.00 -0.04 0.00 0.00 63.50 61.75 2fuh n PRO 44 Cb 0.57 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.41 2fuh n PRO 44 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2fuh n TYR 45 N 5.63 0.00 -1.41 0.54 4.01 -1.26 -4.51 117.16 120.16 2fuh n TYR 45 Ca 0.44 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.79 2fuh n TYR 45 Cb 0.24 0.02 0.03 0.00 -0.31 0.00 0.00 39.34 39.32 2fuh n TYR 45 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2fuh n GLN 46 N 0.00 0.40 -2.60 -0.72 6.02 -1.19 -2.64 117.38 116.66 2fuh n GLN 46 Ca 0.00 0.16 -0.10 0.00 -0.01 0.00 0.00 57.00 57.05 2fuh n GLN 46 Cb 0.22 -1.50 0.02 0.00 1.02 0.00 0.00 30.24 29.99 2fuh n GLN 46 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2fuh n GLY 47 N 1.95 0.17 3.28 1.08 0.00 -1.26 -4.99 105.19 105.42 2fuh n GLY 47 Ca 0.11 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 2fuh n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fuh s GLY 48 N -2.88 -0.29 0.08 -0.02 0.00 -1.08 -4.90 107.32 98.22 2fuh s GLY 48 Ca 0.13 1.16 0.08 0.00 0.00 0.00 0.00 44.72 46.09 2fuh s GLY 48 CO 0.17 1.05 -0.16 -1.34 0.00 0.00 0.00 173.10 172.82 2fuh s VAL 49 N 0.38 2.99 -0.01 1.40 -7.23 -1.25 -2.27 120.40 114.43 2fuh s VAL 49 Ca -0.01 -1.31 0.01 0.00 -1.81 0.00 0.00 61.98 58.85 2fuh s VAL 49 Cb -0.04 -2.34 0.00 0.00 0.56 0.00 0.00 36.38 34.57 2fuh s VAL 49 CO -0.01 0.19 -0.03 -0.36 -0.31 0.00 0.00 175.10 174.58 2fuh s PHE 50 N -1.08 0.30 -0.13 2.82 0.40 -1.19 -4.40 117.98 114.70 2fuh s PHE 50 Ca 0.18 -0.05 -0.07 0.00 -0.60 0.00 0.00 56.93 56.39 2fuh s PHE 50 Cb -0.11 -0.23 -0.04 0.00 0.51 0.00 0.00 43.02 43.16 2fuh s PHE 50 CO 0.09 -0.03 0.11 -0.06 0.70 0.00 0.00 175.22 176.04 2fuh s PHE 51 N 0.11 3.49 -0.21 0.36 0.08 -1.26 -2.45 117.98 118.10 2fuh s PHE 51 Ca -0.01 0.42 0.01 0.00 0.12 0.00 0.00 56.93 57.47 2fuh s PHE 51 Cb -0.03 -1.95 0.05 0.00 -0.57 0.00 0.00 43.02 40.52 2fuh s PHE 51 CO -0.00 0.61 -0.08 -0.51 -0.10 0.00 0.00 175.22 175.14 2fuh s LEU 52 N -0.75 2.41 -0.09 -0.37 1.02 0.28 -2.76 118.68 118.42 2fuh s LEU 52 Ca 0.13 -1.02 -0.19 0.00 0.02 0.00 0.00 54.13 53.07 2fuh s LEU 52 Cb -0.12 -1.20 -0.04 0.00 0.02 0.00 0.00 46.19 44.85 2fuh s LEU 52 CO 0.03 -0.19 0.52 -0.89 0.02 0.00 0.00 176.35 175.84 2fuh s THR 53 N 1.40 5.12 -0.28 5.49 2.01 -1.25 -0.87 115.64 127.26 2fuh s THR 53 Ca -0.03 1.06 -0.03 0.00 0.31 0.00 0.00 61.69 63.00 2fuh s THR 53 Cb -0.17 -3.86 0.03 0.00 0.01 0.00 0.00 72.50 68.51 2fuh s THR 53 CO -0.07 0.34 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.57 2fuh s ILE 54 N 0.43 3.14 0.09 1.82 1.09 0.13 -3.41 121.20 124.49 2fuh s ILE 54 Ca 0.28 -1.12 -0.30 0.00 -1.10 0.00 0.00 60.65 58.41 2fuh s ILE 54 Cb -0.16 -2.69 -0.05 0.00 -1.06 0.00 0.00 42.46 38.49 2fuh s ILE 54 CO 0.13 0.04 1.04 -2.28 -0.10 0.00 0.00 174.94 173.76 2fuh s HIS 55 N 1.33 3.66 -0.39 3.97 2.46 -1.25 -2.62 115.29 122.45 2fuh s HIS 55 Ca -0.02 1.64 -0.07 0.00 0.47 0.00 0.00 55.06 57.09 2fuh s HIS 55 Cb -0.18 -3.18 0.07 0.00 -0.13 0.00 0.00 32.58 29.16 2fuh s HIS 55 CO -0.02 -0.29 0.19 -0.06 -2.47 0.00 0.00 174.74 172.10 2fuh s PHE 56 N 0.40 3.36 0.68 3.88 0.40 -1.21 -3.49 117.98 122.02 2fuh s PHE 56 Ca 0.51 -1.72 -0.08 0.00 -0.60 0.00 0.00 56.93 55.04 2fuh s PHE 56 Cb -0.25 -2.79 0.04 0.00 0.51 0.00 0.00 43.02 40.52 2fuh s PHE 56 CO 0.30 -0.85 1.02 -1.25 0.70 0.00 0.00 175.22 175.15 2fuh s PRO 57 N 1.35 2.54 0.33 0.24 0.04 -1.26 -4.85 135.00 133.38 2fuh s PRO 57 Ca 0.02 0.03 0.04 0.00 0.04 0.00 0.00 61.00 61.13 2fuh s PRO 57 Cb -0.22 -2.14 0.58 0.00 0.04 0.00 0.00 34.50 32.76 2fuh s PRO 57 CO 0.01 -1.07 1.87 1.79 0.04 0.00 0.00 177.00 179.63 2fuh h THR 58 N -0.54 1.20 -0.17 1.26 1.35 -1.99 -1.68 112.91 112.34 2fuh h THR 58 Ca -0.45 -0.79 -0.05 0.00 -0.55 0.00 0.00 66.41 64.58 2fuh h THR 58 Cb 1.29 0.91 -0.03 0.00 -1.73 0.00 0.00 68.15 68.59 2fuh h THR 58 CO 0.62 0.27 0.06 -0.67 -0.25 0.00 0.00 175.52 175.55 2fuh n ASP 59 N -4.28 2.50 -0.28 5.36 2.03 -1.26 -4.37 116.55 116.25 2fuh n ASP 59 Ca 0.02 -2.27 0.10 0.00 0.52 0.00 0.00 54.79 53.16 2fuh n ASP 59 Cb 0.24 -0.56 0.35 0.00 -0.72 0.00 0.00 41.12 40.44 2fuh n ASP 59 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 2fuh h TYR 60 N 0.66 0.87 0.00 -0.67 3.20 -1.41 1.58 116.97 121.20 2fuh h TYR 60 Ca 0.06 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2fuh h TYR 60 Cb 1.07 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.06 2fuh h TYR 60 CO 0.30 0.34 0.00 -2.30 -1.64 0.00 0.00 178.16 174.86 2fuh n PRO 61 N -4.56 0.17 0.00 1.82 -0.02 -1.26 -3.80 135.00 127.34 2fuh n PRO 61 Ca 0.17 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2fuh n PRO 61 Cb 0.42 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2fuh n PRO 61 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2fuh n PHE 62 N -2.25 0.00 -3.51 6.00 3.01 -0.15 -4.52 117.46 116.03 2fuh n PHE 62 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.09 2fuh n PHE 62 Cb 0.12 0.08 -0.06 0.00 -0.01 0.00 0.00 39.48 39.60 2fuh n PHE 62 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 2fuh s LYS 63 N -1.99 4.12 0.80 -1.08 2.36 0.52 -4.96 119.74 119.51 2fuh s LYS 63 Ca 0.00 0.24 -0.11 0.00 -2.55 0.00 0.00 55.97 53.55 2fuh s LYS 63 Cb 0.00 -3.35 0.07 0.00 -1.05 0.00 0.00 37.83 33.50 2fuh s LYS 63 CO 0.00 0.39 1.09 -1.25 1.55 0.00 0.00 175.35 177.13 2fuh s PRO 64 N -0.04 2.00 0.86 4.03 0.04 -1.26 -3.85 135.00 136.77 2fuh s PRO 64 Ca 0.20 1.07 -0.12 0.00 0.04 0.00 0.00 61.00 62.20 2fuh s PRO 64 Cb -0.14 -1.88 0.11 0.00 0.04 0.00 0.00 34.50 32.63 2fuh s PRO 64 CO 0.08 -1.79 1.10 -1.25 0.04 0.00 0.00 177.00 175.18 2fuh s PRO 65 N -4.92 1.57 -0.84 0.56 0.04 -1.26 -4.93 135.00 125.22 2fuh s PRO 65 Ca 0.62 0.62 -0.04 0.00 0.04 0.00 0.00 61.00 62.23 2fuh s PRO 65 Cb -0.17 -1.86 0.21 0.00 0.04 0.00 0.00 34.50 32.72 2fuh s PRO 65 CO 0.56 -1.97 0.73 0.21 0.04 0.00 0.00 177.00 176.57 2fuh s LYS 66 N -5.10 3.23 0.38 4.56 2.20 -1.23 -4.95 119.74 118.82 2fuh s LYS 66 Ca 0.62 -2.99 -0.22 0.00 -0.36 0.00 0.00 55.97 53.02 2fuh s LYS 66 Cb -0.16 -4.01 -0.10 0.00 -1.51 0.00 0.00 37.83 32.05 2fuh s LYS 66 CO 0.55 -1.24 0.91 0.54 -0.36 0.00 0.00 175.35 175.75 2fuh s VAL 67 N -0.85 4.38 -0.07 4.02 0.11 -1.26 -3.92 120.40 122.81 2fuh s VAL 67 Ca 0.24 1.51 -0.16 0.00 -2.93 0.00 0.00 61.98 60.64 2fuh s VAL 67 Cb -0.11 -3.73 0.03 0.00 -1.53 0.00 0.00 36.38 31.04 2fuh s VAL 67 CO -0.09 -0.14 0.38 0.00 -3.33 0.00 0.00 175.10 171.91 2fuh s ALA 68 N -1.96 -0.95 -0.25 1.54 0.00 -1.22 -4.58 121.76 114.33 2fuh s ALA 68 Ca 0.57 0.74 -0.29 0.00 0.00 0.00 0.00 51.96 52.98 2fuh s ALA 68 Cb -0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 2fuh s ALA 68 CO 0.17 -0.24 1.57 -0.06 0.00 0.00 0.00 175.76 177.20 2fuh s PHE 69 N -0.69 2.18 0.40 0.00 0.40 -0.41 -3.85 117.98 116.01 2fuh s PHE 69 Ca -0.08 0.61 0.40 0.00 -0.60 0.00 0.00 56.93 57.26 2fuh s PHE 69 Cb -0.04 -4.01 1.95 0.00 0.51 0.00 0.00 43.02 41.43 2fuh s PHE 69 CO 0.03 -2.70 2.19 1.79 0.70 0.00 0.00 175.22 177.24 2fuh h THR 70 N 6.20 0.00 -3.99 0.64 1.35 -1.87 -3.43 112.91 111.81 2fuh h THR 70 Ca -0.32 -0.24 -0.61 0.00 -0.55 0.00 0.00 66.41 64.69 2fuh h THR 70 Cb 1.14 1.23 -0.23 0.00 -1.73 0.00 0.00 68.15 68.57 2fuh h THR 70 CO 1.01 0.00 -0.84 0.42 -0.25 0.00 0.00 175.52 175.86 2fuh s THR 71 N -3.92 1.89 -0.15 6.82 -4.23 -1.26 -5.02 115.64 109.76 2fuh s THR 71 Ca -0.02 -1.54 -0.29 0.00 -1.18 0.00 0.00 61.69 58.66 2fuh s THR 71 Cb 0.11 -1.68 -0.01 0.00 1.34 0.00 0.00 72.50 72.26 2fuh s THR 71 CO 0.47 0.05 1.04 -0.13 -0.54 0.00 0.00 174.62 175.52 2fuh s ARG 72 N -1.79 4.35 -0.07 3.99 0.52 -1.26 -4.95 118.95 119.74 2fuh s ARG 72 Ca 0.09 1.41 -0.01 0.00 -0.52 0.00 0.00 55.73 56.70 2fuh s ARG 72 Cb -0.10 -3.59 0.03 0.00 0.52 0.00 0.00 34.95 31.81 2fuh s ARG 72 CO 0.04 -0.46 -0.01 -1.50 0.02 0.00 0.00 175.30 173.39 2fuh s ILE 73 N 2.53 0.48 -0.58 1.52 2.07 -1.26 -4.73 121.20 121.23 2fuh s ILE 73 Ca 0.47 0.04 -0.26 0.00 -1.41 0.00 0.00 60.65 59.50 2fuh s ILE 73 Cb -0.18 -0.61 -0.06 0.00 0.13 0.00 0.00 42.46 41.75 2fuh s ILE 73 CO 0.14 0.27 2.18 -0.47 -1.91 0.00 0.00 174.94 175.15 2fuh s TYR 74 N 1.84 1.33 -0.20 3.50 5.04 -1.26 -4.87 117.35 122.74 2fuh s TYR 74 Ca 0.04 1.27 -0.07 0.00 -2.44 0.00 0.00 57.07 55.86 2fuh s TYR 74 Cb -0.12 -3.78 0.09 0.00 0.35 0.00 0.00 41.96 38.49 2fuh s TYR 74 CO -0.05 -2.34 0.42 -1.58 -1.34 0.00 0.00 175.55 170.66 2fuh s HIS 75 N 11.16 -0.78 0.23 4.97 2.46 -1.25 -4.72 115.29 127.36 2fuh s HIS 75 Ca 0.85 1.50 -0.14 0.00 0.47 0.00 0.00 55.06 57.74 2fuh s HIS 75 Cb -0.14 0.30 0.28 0.00 -0.13 0.00 0.00 32.58 32.89 2fuh s HIS 75 CO 0.21 -0.47 1.58 -1.35 -2.47 0.00 0.00 174.74 172.25 2fuh h PRO 76 N 8.07 -0.04 0.00 2.88 0.11 -1.89 1.35 132.00 142.48 2fuh h PRO 76 Ca -0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2fuh h PRO 76 Cb 1.12 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2fuh h PRO 76 CO 0.14 -0.02 0.00 0.27 -0.21 0.00 0.00 178.00 178.17 2fuh n ASN 77 N -5.50 0.00 -3.56 -2.05 0.23 -1.26 -1.99 115.26 101.12 2fuh n ASN 77 Ca 0.10 -0.46 -0.13 0.00 -0.53 0.00 0.00 54.58 53.56 2fuh n ASN 77 Cb 0.40 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 37.99 2fuh n ASN 77 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 2fuh s ILE 78 N -2.00 -0.47 0.00 1.53 1.01 0.46 -3.38 121.20 118.35 2fuh s ILE 78 Ca 0.05 0.11 0.00 0.00 0.00 0.00 0.00 60.65 60.81 2fuh s ILE 78 Cb 0.02 -0.60 0.00 0.00 0.01 0.00 0.00 42.46 41.89 2fuh s ILE 78 CO 0.04 -0.01 0.00 -3.20 0.00 0.00 0.00 174.94 171.77 2fuh n ASN 79 N 5.35 0.00 0.04 3.58 2.85 -1.23 -3.83 115.26 122.03 2fuh n ASN 79 Ca -0.06 0.00 -0.01 0.00 -0.11 0.00 0.00 54.58 54.40 2fuh n ASN 79 Cb 0.50 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.44 2fuh n ASN 79 CO 0.00 0.00 0.00 -1.28 -2.11 0.00 0.00 177.26 173.87 2fuh h SER 80 N 0.00 0.00 0.00 1.20 0.87 -1.93 -3.30 113.55 110.39 2fuh h SER 80 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2fuh h SER 80 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2fuh h SER 80 CO 0.00 0.62 0.00 0.59 -0.53 0.00 0.00 176.83 177.51 2fuh n ASN 81 N -2.95 0.00 0.00 6.23 4.13 -1.26 -4.79 115.26 116.61 2fuh n ASN 81 Ca -0.09 -0.89 0.00 0.00 1.68 0.00 0.00 54.58 55.28 2fuh n ASN 81 Cb 0.85 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 39.09 2fuh n ASN 81 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2fuh n GLY 82 N 0.25 0.67 3.69 7.41 0.00 -1.24 -4.73 105.19 111.23 2fuh n GLY 82 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 2fuh n GLY 82 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2fuh n SER 83 N -0.05 2.25 -3.97 1.61 7.64 -1.26 -1.29 113.62 118.56 2fuh n SER 83 Ca 0.00 1.06 -0.22 0.00 1.01 0.00 0.00 58.87 60.72 2fuh n SER 83 Cb 0.02 -1.48 -0.16 0.00 -1.01 0.00 0.00 64.21 61.58 2fuh n SER 83 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2fuh s ILE 84 N -1.24 0.87 -0.38 0.44 1.01 -1.26 -3.54 121.20 117.09 2fuh s ILE 84 Ca 0.64 -0.32 -0.18 0.00 0.00 0.00 0.00 60.65 60.78 2fuh s ILE 84 Cb -0.50 -0.82 0.01 0.00 0.01 0.00 0.00 42.46 41.16 2fuh s ILE 84 CO 0.56 0.30 0.49 0.00 0.00 0.00 0.00 174.94 176.29 2fuh s LEU 86 N 2.35 2.17 0.02 0.00 1.43 -1.26 -5.05 118.68 118.33 2fuh s LEU 86 Ca 0.17 -0.45 -0.25 0.00 -1.03 0.00 0.00 54.13 52.57 2fuh s LEU 86 Cb -0.16 -0.57 -0.17 0.00 0.03 0.00 0.00 46.19 45.31 2fuh s LEU 86 CO 0.14 0.03 1.39 -2.24 0.23 0.00 0.00 176.35 175.90 2fuh h ASP 87 N 4.96 -0.17 -0.00 2.29 2.03 -1.96 -2.89 116.42 120.67 2fuh h ASP 87 Ca -0.38 -0.22 0.00 0.00 -0.73 0.00 0.00 57.03 55.70 2fuh h ASP 87 Cb 1.18 0.04 -0.00 0.00 -0.83 0.00 0.00 39.33 39.72 2fuh h ASP 87 CO 0.44 0.13 0.05 0.16 -1.03 0.00 0.00 179.24 179.00 2fuh h ILE 88 N -0.49 0.04 -0.49 4.15 -2.65 -1.97 -0.41 117.51 115.70 2fuh h ILE 88 Ca -0.02 0.00 -0.22 0.00 1.03 0.00 0.00 64.86 65.65 2fuh h ILE 88 Cb 0.38 0.95 -0.13 0.00 -2.05 0.00 0.00 36.82 35.97 2fuh h ILE 88 CO 0.03 0.00 0.28 -0.11 0.03 0.00 0.00 178.15 178.38 2fuh n LEU 89 N -3.11 4.70 0.00 0.16 7.94 -1.09 -2.36 117.00 123.24 2fuh n LEU 89 Ca -0.03 -2.45 0.00 0.00 -1.11 0.00 0.00 56.01 52.42 2fuh n LEU 89 Cb 0.12 -0.66 0.00 0.00 0.53 0.00 0.00 43.42 43.41 2fuh n LEU 89 CO 0.20 0.72 0.00 0.54 -1.11 0.00 0.00 177.39 177.74 2fuh n ARG 90 N -0.23 0.00 0.01 1.96 1.74 -0.17 -4.89 116.66 115.08 2fuh n ARG 90 Ca 0.28 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.47 2fuh n ARG 90 Cb 1.05 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 32.38 2fuh n ARG 90 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2fuh n SER 91 N 0.00 0.38 -0.97 0.55 3.41 -1.23 -4.12 113.62 111.64 2fuh n SER 91 Ca 0.00 -0.19 0.03 0.00 -0.26 0.00 0.00 58.87 58.45 2fuh n SER 91 Cb 0.00 1.44 0.15 0.00 -0.26 0.00 0.00 64.21 65.54 2fuh n SER 91 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fuh n GLN 92 N -2.11 2.40 -2.45 4.33 6.02 -1.15 -4.91 117.38 119.52 2fuh n GLN 92 Ca -0.01 -1.20 -0.33 0.00 -0.01 0.00 0.00 57.00 55.44 2fuh n GLN 92 Cb 0.50 -1.72 -0.03 0.00 1.02 0.00 0.00 30.24 30.01 2fuh n GLN 92 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2fuh s TRP 93 N -1.68 3.09 -0.06 1.08 -0.11 -1.00 -4.46 118.94 115.80 2fuh s TRP 93 Ca 0.21 1.55 -0.02 0.00 1.22 0.00 0.00 56.10 59.06 2fuh s TRP 93 Cb 0.15 -2.99 0.04 0.00 -1.50 0.00 0.00 33.47 29.17 2fuh s TRP 93 CO 0.07 -0.75 0.13 -1.12 -4.62 0.00 0.00 176.95 170.66 2fuh s SER 94 N -2.32 0.26 0.42 5.86 0.01 -1.26 -5.02 113.70 111.66 2fuh s SER 94 Ca 0.65 0.25 0.25 0.00 1.31 0.00 0.00 55.95 58.41 2fuh s SER 94 Cb -0.15 0.15 1.27 0.00 0.21 0.00 0.00 66.02 67.50 2fuh s SER 94 CO 0.24 -0.18 1.71 -0.65 0.41 0.00 0.00 173.24 174.77 2fuh h PRO 95 N 7.67 0.23 -0.30 12.44 0.11 -1.93 1.47 132.00 151.68 2fuh h PRO 95 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2fuh h PRO 95 Cb 1.13 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2fuh h PRO 95 CO 0.33 0.15 0.00 0.00 -0.21 0.00 0.00 178.00 178.27 2fuh n ALA 96 N -2.51 2.47 -1.35 -0.75 0.00 -1.26 -4.86 120.51 112.25 2fuh n ALA 96 Ca 0.31 -0.74 -0.39 0.00 0.00 0.00 0.00 53.44 52.62 2fuh n ALA 96 Cb 1.15 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 19.63 2fuh n ALA 96 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2fuh n LEU 97 N 0.84 -1.70 -4.60 0.00 0.00 0.50 -4.94 117.00 107.10 2fuh n LEU 97 Ca 0.17 0.71 -0.34 0.00 0.00 0.00 0.00 56.01 56.55 2fuh n LEU 97 Cb 0.44 -0.99 -0.10 0.00 0.00 0.00 0.00 43.42 42.77 2fuh n LEU 97 CO 0.14 -3.99 -0.29 0.42 0.00 0.00 0.00 177.39 173.67 2fuh s THR 98 N -1.85 4.43 0.32 1.96 -4.23 -1.26 -4.98 115.64 110.02 2fuh s THR 98 Ca 0.62 -0.17 0.09 0.00 -1.18 0.00 0.00 61.69 61.05 2fuh s THR 98 Cb -0.49 -2.95 0.31 0.00 1.34 0.00 0.00 72.50 70.71 2fuh s THR 98 CO 0.61 0.50 1.73 -0.29 -0.54 0.00 0.00 174.62 176.63 2fuh h ILE 99 N 4.81 0.56 0.00 2.99 6.09 -1.96 1.31 117.51 131.31 2fuh h ILE 99 Ca -0.38 -0.21 0.00 0.00 -1.37 0.00 0.00 64.86 62.91 2fuh h ILE 99 Cb 1.18 -0.10 0.00 0.00 0.47 0.00 0.00 36.82 38.37 2fuh h ILE 99 CO 0.65 0.11 0.01 -1.28 -3.07 0.00 0.00 178.15 174.57 2fuh h SER 100 N 0.60 0.00 0.56 2.19 0.87 -1.96 -0.97 113.55 114.85 2fuh h SER 100 Ca 0.64 0.00 -0.29 0.00 -1.23 0.00 0.00 61.79 60.91 2fuh h SER 100 Cb 1.19 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.14 2fuh h SER 100 CO -0.47 0.00 -1.39 0.50 -0.53 0.00 0.00 176.83 174.95 2fuh h LYS 101 N 0.00 0.24 0.25 2.24 3.64 0.13 -3.14 116.57 119.93 2fuh h LYS 101 Ca 0.00 -0.41 -0.01 0.00 -1.27 0.00 0.00 60.65 58.96 2fuh h LYS 101 Cb 0.02 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2fuh h LYS 101 CO 0.00 1.13 -0.12 0.28 -2.27 0.00 0.00 179.45 178.47 2fuh h VAL 102 N 0.07 0.76 -0.75 2.00 2.07 -1.15 -2.83 116.25 116.41 2fuh h VAL 102 Ca -0.19 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.56 2fuh h VAL 102 Cb 1.99 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 32.87 2fuh h VAL 102 CO 0.18 0.15 0.49 0.17 0.02 0.00 0.00 177.57 178.57 2fuh h LEU 103 N -0.78 0.87 -0.88 2.57 8.10 -1.71 -2.16 115.31 121.32 2fuh h LEU 103 Ca -0.03 -0.03 0.01 0.00 0.11 0.00 0.00 57.88 57.94 2fuh h LEU 103 Cb 0.51 -0.22 -0.04 0.00 -0.44 0.00 0.00 40.66 40.46 2fuh h LEU 103 CO 0.06 0.64 0.58 0.25 -4.11 0.00 0.00 178.44 175.86 2fuh h LEU 104 N 1.02 1.00 -2.10 0.17 5.85 -1.57 -0.77 115.31 118.91 2fuh h LEU 104 Ca 0.27 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 59.00 2fuh h LEU 104 Cb -0.10 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.68 2fuh h LEU 104 CO -0.06 0.72 0.32 0.28 -0.34 0.00 0.00 178.44 179.36 2fuh h SER 105 N 1.18 0.00 0.30 1.25 0.02 -1.12 -1.61 113.55 113.57 2fuh h SER 105 Ca 0.33 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.26 2fuh h SER 105 Cb -0.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.42 2fuh h SER 105 CO -0.08 0.00 -0.15 0.40 -1.14 0.00 0.00 176.83 175.87 2fuh h ILE 106 N 0.00 0.62 -0.44 3.27 1.08 -1.17 -2.75 117.51 118.12 2fuh h ILE 106 Ca 0.06 -0.74 0.09 0.00 -0.39 0.00 0.00 64.86 63.88 2fuh h ILE 106 Cb 0.69 0.95 -0.09 0.00 -3.07 0.00 0.00 36.82 35.31 2fuh h ILE 106 CO -0.00 0.13 -0.12 0.00 -0.69 0.00 0.00 178.15 177.47 2fuh h SER 108 N -0.01 0.35 -0.01 0.00 0.02 -1.56 0.99 113.55 113.33 2fuh h SER 108 Ca 0.21 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.18 2fuh h SER 108 Cb 0.34 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2fuh h SER 108 CO -0.46 0.18 -0.03 0.25 -1.14 0.00 0.00 176.83 175.63 2fuh h LEU 109 N 0.37 0.04 -1.16 5.07 7.12 -0.33 -3.15 115.31 123.28 2fuh h LEU 109 Ca 0.38 -0.62 -0.08 0.00 0.13 0.00 0.00 57.88 57.69 2fuh h LEU 109 Cb 0.93 -0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 41.04 2fuh h LEU 109 CO -0.12 0.65 -0.39 -0.07 -0.13 0.00 0.00 178.44 178.38 2fuh h LEU 110 N -0.57 0.00 0.00 2.25 3.38 -0.12 -2.15 115.31 118.11 2fuh h LEU 110 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2fuh h LEU 110 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2fuh h LEU 110 CO 0.01 0.39 0.00 0.00 0.09 0.00 0.00 178.44 178.92 2fuh s ASP 112 N -2.84 -0.14 -1.27 0.00 1.01 -0.81 -5.02 116.67 107.61 2fuh s ASP 112 Ca 0.09 -1.19 -0.19 0.00 0.71 0.00 0.00 52.55 51.98 2fuh s ASP 112 Cb 0.09 1.24 0.06 0.00 1.01 0.00 0.00 42.92 45.32 2fuh s ASP 112 CO 0.25 -0.22 1.73 -2.16 0.21 0.00 0.00 175.17 174.98 2fuh s PRO 113 N 1.64 3.85 -0.41 8.23 0.04 -1.23 -4.80 135.00 142.33 2fuh s PRO 113 Ca 0.16 -1.86 -0.17 0.00 0.04 0.00 0.00 61.00 59.17 2fuh s PRO 113 Cb -0.10 -5.50 0.02 0.00 0.04 0.00 0.00 34.50 28.95 2fuh s PRO 113 CO -0.05 -2.37 0.46 -0.80 0.04 0.00 0.00 177.00 174.27 2fuh s ASN 114 N 4.46 6.22 0.00 6.66 0.01 -1.26 -4.96 114.94 126.07 2fuh s ASN 114 Ca 0.54 -0.52 -0.04 0.00 -0.71 0.00 0.00 52.86 52.14 2fuh s ASN 114 Cb 0.03 -2.23 -0.16 0.00 0.41 0.00 0.00 41.25 39.30 2fuh s ASN 114 CO 0.07 -0.56 2.91 -0.81 -1.51 0.00 0.00 177.10 177.19 2fuh n PRO 115 N 5.66 1.56 0.01 -0.60 -0.04 -1.26 -4.14 135.00 136.19 2fuh n PRO 115 Ca -0.07 -0.60 -0.21 0.00 -0.04 0.00 0.00 63.50 62.58 2fuh n PRO 115 Cb 0.48 -1.62 -0.14 0.00 -0.04 0.00 0.00 33.50 32.17 2fuh n PRO 115 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2fuh h ASP 116 N 2.39 0.42 -1.86 3.54 5.19 -2.00 -3.42 116.42 120.68 2fuh h ASP 116 Ca 0.11 -0.89 -0.48 0.00 -0.62 0.00 0.00 57.03 55.15 2fuh h ASP 116 Cb 1.27 -0.14 -0.38 0.00 0.18 0.00 0.00 39.33 40.26 2fuh h ASP 116 CO 0.15 1.80 -1.13 0.47 -3.12 0.00 0.00 179.24 177.41 2fuh n ASP 117 N -3.47 0.45 -3.38 6.45 9.92 -1.26 -5.13 116.55 120.13 2fuh n ASP 117 Ca -0.30 -2.98 -0.21 0.00 -0.53 0.00 0.00 54.79 50.77 2fuh n ASP 117 Cb 1.05 -0.44 0.15 0.00 -0.64 0.00 0.00 41.12 41.24 2fuh n ASP 117 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2fuh n PRO 118 N 0.56 -0.95 -0.12 -0.24 -0.04 -1.26 -4.95 135.00 128.00 2fuh n PRO 118 Ca 0.23 -1.49 -0.16 0.00 -0.04 0.00 0.00 63.50 62.04 2fuh n PRO 118 Cb 0.63 -0.99 -0.12 0.00 -0.04 0.00 0.00 33.50 32.98 2fuh n PRO 118 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2fuh n LEU 119 N 0.00 2.43 -3.99 1.53 4.77 -0.84 -4.77 117.00 116.12 2fuh n LEU 119 Ca 0.12 -0.11 -0.32 0.00 -0.03 0.00 0.00 56.01 55.67 2fuh n LEU 119 Cb 0.42 -0.61 -0.11 0.00 -2.33 0.00 0.00 43.42 40.79 2fuh n LEU 119 CO 0.31 0.83 0.04 -0.69 -1.33 0.00 0.00 177.39 176.54 2fuh s VAL 120 N -2.49 3.32 0.46 4.08 1.01 -1.22 -4.93 120.40 120.63 2fuh s VAL 120 Ca -0.29 -3.75 0.13 0.00 0.00 0.00 0.00 61.98 58.08 2fuh s VAL 120 Cb 0.08 -3.16 0.13 0.00 0.00 0.00 0.00 36.38 33.43 2fuh s VAL 120 CO 0.61 -0.96 1.35 -0.65 0.00 0.00 0.00 175.10 175.45 2fuh h PRO 121 N 6.06 0.00 -0.63 2.72 0.11 -1.92 0.17 132.00 138.51 2fuh h PRO 121 Ca 0.07 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.13 2fuh h PRO 121 Cb 0.83 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.91 2fuh h PRO 121 CO 0.74 0.00 0.21 1.49 -0.21 0.00 0.00 178.00 180.23 2fuh h GLU 122 N 0.00 0.97 -0.01 1.05 4.57 -2.00 -2.38 114.58 116.79 2fuh h GLU 122 Ca 0.00 -0.20 -0.18 0.00 -1.18 0.00 0.00 59.36 57.79 2fuh h GLU 122 Cb 1.13 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.57 2fuh h GLU 122 CO 0.00 0.85 -0.81 0.82 -1.18 0.00 0.00 179.01 178.69 2fuh h ILE 123 N 0.90 1.47 -0.48 2.32 2.04 -1.08 -3.24 117.51 119.45 2fuh h ILE 123 Ca 0.21 -2.49 0.03 0.00 1.00 0.00 0.00 64.86 63.61 2fuh h ILE 123 Cb 0.27 2.37 -0.04 0.00 -0.74 0.00 0.00 36.82 38.68 2fuh h ILE 123 CO -0.01 0.73 0.26 0.00 0.00 0.00 0.00 178.15 179.13 2fuh h ALA 124 N 1.03 0.61 -0.78 1.87 0.00 -1.45 -1.34 119.26 119.20 2fuh h ALA 124 Ca -0.03 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.01 2fuh h ALA 124 Cb 1.41 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 19.05 2fuh h ALA 124 CO 0.12 -0.06 0.51 -0.09 0.00 0.00 0.00 179.25 179.73 2fuh h ARG 125 N 0.52 0.55 0.32 0.00 2.43 -1.46 0.85 114.38 117.58 2fuh h ARG 125 Ca 0.20 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.32 2fuh h ARG 125 Cb 0.06 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2fuh h ARG 125 CO -0.11 0.36 -0.15 0.82 -1.51 0.00 0.00 179.97 179.37 2fuh h ILE 126 N 0.56 0.55 -0.14 1.20 2.04 -1.37 -3.20 117.51 117.15 2fuh h ILE 126 Ca 0.38 -0.75 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 2fuh h ILE 126 Cb 0.68 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 2fuh h ILE 126 CO -0.14 0.12 -0.05 0.22 0.00 0.00 0.00 178.15 178.30 2fuh h TYR 127 N -0.91 0.20 -0.42 1.37 3.20 -0.84 1.45 116.97 121.02 2fuh h TYR 127 Ca -0.04 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.90 2fuh h TYR 127 Cb 0.52 -0.06 -0.08 0.00 1.54 0.00 0.00 36.73 38.64 2fuh h TYR 127 CO 0.04 0.25 -0.15 -0.22 -1.64 0.00 0.00 178.16 176.44 2fuh h LYS 128 N 0.20 -0.05 0.00 1.82 3.64 0.72 -3.39 116.57 119.50 2fuh h LYS 128 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2fuh h LYS 128 Cb 0.22 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2fuh h LYS 128 CO 0.01 -0.04 -0.62 0.25 -2.27 0.00 0.00 179.45 176.78 2fuh n THR 129 N -5.35 0.00 -2.55 1.00 -2.24 -1.11 -4.97 114.28 99.06 2fuh n THR 129 Ca 0.03 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.40 2fuh n THR 129 Cb 0.26 -0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 68.14 2fuh n THR 129 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2fuh s ASP 130 N -3.60 6.22 -0.20 3.42 -1.08 0.50 -4.78 116.67 117.15 2fuh s ASP 130 Ca 0.00 -0.62 -0.03 0.00 -0.52 0.00 0.00 52.55 51.38 2fuh s ASP 130 Cb 0.00 -2.56 -0.21 0.00 -1.46 0.00 0.00 42.92 38.69 2fuh s ASP 130 CO 0.00 -1.78 0.05 0.54 0.52 0.00 0.00 175.17 174.49 2fuh n ARG 131 N 9.29 0.70 -0.18 4.34 3.00 -1.25 -3.54 116.66 129.02 2fuh n ARG 131 Ca 0.08 0.22 -0.01 0.00 -0.01 0.00 0.00 57.85 58.13 2fuh n ARG 131 Cb 0.49 -1.61 0.07 0.00 0.00 0.00 0.00 32.46 31.41 2fuh n ARG 131 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 2fuh h ASP 132 N -0.03 -0.34 0.15 0.55 5.19 -1.93 0.10 116.42 120.11 2fuh h ASP 132 Ca -0.51 0.15 -0.01 0.00 -0.62 0.00 0.00 57.03 56.04 2fuh h ASP 132 Cb 1.94 0.28 0.00 0.00 0.18 0.00 0.00 39.33 41.73 2fuh h ASP 132 CO -0.02 -0.13 -0.07 0.50 -3.12 0.00 0.00 179.24 176.40 2fuh h LYS 133 N 0.07 -0.19 -0.89 3.56 3.64 -1.95 -2.96 116.57 117.84 2fuh h LYS 133 Ca 0.28 0.01 0.26 0.00 -1.27 0.00 0.00 60.65 59.93 2fuh h LYS 133 Cb 0.43 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.26 2fuh h LYS 133 CO -0.51 0.22 0.78 -0.92 -2.27 0.00 0.00 179.45 176.75 2fuh h TYR 134 N -0.69 0.00 0.00 1.91 5.03 -1.49 1.40 116.97 123.13 2fuh h TYR 134 Ca -0.02 0.00 -0.15 0.00 2.58 0.00 0.00 58.73 61.14 2fuh h TYR 134 Cb 0.50 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.76 2fuh h TYR 134 CO 0.07 0.00 -0.73 -0.97 -1.32 0.00 0.00 178.16 175.21 2fuh h ASN 135 N 0.00 0.00 0.01 -2.11 -1.24 -0.64 -2.30 115.58 109.30 2fuh h ASN 135 Ca 0.42 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.43 2fuh h ASN 135 Cb 1.97 0.00 0.00 0.00 0.73 0.00 0.00 38.32 41.02 2fuh h ASN 135 CO -0.00 0.73 -0.00 -0.09 -1.29 0.00 0.00 177.43 176.78 2fuh h ARG 136 N 0.00 -0.01 -0.07 6.67 2.43 0.20 -3.10 114.38 120.50 2fuh h ARG 136 Ca -0.01 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2fuh h ARG 136 Cb 1.31 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.86 2fuh h ARG 136 CO 0.10 0.62 0.03 -0.84 -1.51 0.00 0.00 179.97 178.36 2fuh h ILE 137 N -0.64 1.13 -0.76 1.20 3.07 -1.48 0.36 117.51 120.38 2fuh h ILE 137 Ca -0.00 -0.38 0.17 0.00 1.55 0.00 0.00 64.86 66.20 2fuh h ILE 137 Cb 0.63 1.26 -0.13 0.00 -0.27 0.00 0.00 36.82 38.31 2fuh h ILE 137 CO 0.00 0.11 -0.03 0.28 -1.05 0.00 0.00 178.15 177.46 2fuh h SER 138 N -0.03 -0.42 0.19 2.16 0.02 -1.51 -0.08 113.55 113.87 2fuh h SER 138 Ca 0.02 0.20 -0.31 0.00 -0.84 0.00 0.00 61.79 60.87 2fuh h SER 138 Cb 0.15 0.37 0.03 0.00 0.14 0.00 0.00 62.40 63.10 2fuh h SER 138 CO -0.00 -0.20 -1.32 0.03 -1.14 0.00 0.00 176.83 174.20 2fuh h ARG 139 N 0.08 0.55 -0.95 3.45 3.08 -1.44 -3.10 114.38 116.06 2fuh h ARG 139 Ca 0.41 -0.85 0.18 0.00 0.07 0.00 0.00 59.98 59.79 2fuh h ARG 139 Cb 0.70 0.30 -0.11 0.00 0.08 0.00 0.00 29.97 30.95 2fuh h ARG 139 CO -0.69 1.40 0.54 1.49 -1.07 0.00 0.00 179.97 181.63 2fuh h GLU 140 N 0.14 0.66 -0.00 0.04 4.81 0.93 0.63 114.58 121.78 2fuh h GLU 140 Ca -0.22 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 2fuh h GLU 140 Cb 2.01 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 31.25 2fuh h GLU 140 CO 0.25 0.43 -0.14 0.91 -0.73 0.00 0.00 179.01 179.74 2fuh n TRP 141 N -4.83 0.00 -0.05 0.92 7.02 -0.16 -3.17 117.44 117.16 2fuh n TRP 141 Ca 0.22 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.68 2fuh n TRP 141 Cb 0.55 -0.22 -0.00 0.00 -2.42 0.00 0.00 31.31 29.22 2fuh n TRP 141 CO 0.00 0.00 0.00 1.15 -2.02 0.00 0.00 177.69 176.82 2fuh h THR 142 N 0.49 0.00 -0.12 -0.99 2.02 0.33 -3.35 112.91 111.29 2fuh h THR 142 Ca 0.00 -0.97 -0.02 0.00 0.77 0.00 0.00 66.41 66.19 2fuh h THR 142 Cb 0.39 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 2fuh h THR 142 CO 0.00 0.00 -0.03 -0.61 0.37 0.00 0.00 175.52 175.25 2fuh h GLN 143 N -0.97 0.17 -0.48 6.66 4.15 -1.53 1.37 115.11 124.47 2fuh h GLN 143 Ca 0.00 -0.02 0.10 0.00 0.77 0.00 0.00 58.65 59.49 2fuh h GLN 143 Cb 0.12 -0.03 -0.10 0.00 0.21 0.00 0.00 27.48 27.68 2fuh h GLN 143 CO 0.00 0.22 -0.23 -0.22 -1.93 0.00 0.00 178.83 176.67 2fuh h LYS 144 N 0.17 -0.12 0.00 1.69 3.64 -1.69 -3.39 116.57 116.86 2fuh h LYS 144 Ca 0.04 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2fuh h LYS 144 Cb 0.17 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 2fuh h LYS 144 CO 0.01 -0.08 -0.35 0.66 -2.27 0.00 0.00 179.45 177.42 2fuh n TYR 145 N -5.41 0.00 -0.74 1.91 4.01 -1.11 -4.87 117.16 110.96 2fuh n TYR 145 Ca 0.04 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.58 2fuh n TYR 145 Cb 0.32 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.31 2fuh n TYR 145 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2fuh n ALA 146 N -1.28 4.73 0.00 -0.72 0.00 0.47 -4.95 120.51 118.76 2fuh n ALA 146 Ca 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 53.44 51.55 2fuh n ALA 146 Cb 0.17 -2.89 0.00 0.00 0.00 0.00 0.00 19.45 16.74 2fuh n ALA 146 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17