#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 0.00 -0.00 0.00 3.38 -1.99 0.32 115.31 117.02 2fuh h LEU 3 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2fuh h LEU 3 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2fuh h LEU 3 CO 0.00 0.00 -0.10 0.11 0.09 0.00 0.00 178.44 178.54 2fuh h LYS 4 N 0.00 0.07 -0.03 1.13 1.79 -2.05 -1.04 116.57 116.43 2fuh h LYS 4 Ca 0.00 -0.07 -0.21 0.00 -2.18 0.00 0.00 60.65 58.19 2fuh h LYS 4 Cb 1.00 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.67 2fuh h LYS 4 CO 0.00 0.84 -0.87 -0.09 -1.08 0.00 0.00 179.45 178.25 2fuh h ARG 5 N -0.68 0.44 -0.04 3.15 9.65 -1.10 -3.25 114.38 122.55 2fuh h ARG 5 Ca -0.01 -0.43 -0.02 0.00 -1.10 0.00 0.00 59.98 58.43 2fuh h ARG 5 Cb 0.88 0.11 -0.00 0.00 -1.39 0.00 0.00 29.97 29.57 2fuh h ARG 5 CO 0.02 1.08 -0.04 0.82 2.80 0.00 0.00 179.97 184.65 2fuh h ILE 6 N 0.26 1.39 0.00 1.20 2.04 -0.65 -2.94 117.51 118.81 2fuh h ILE 6 Ca -0.06 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 64.57 2fuh h ILE 6 Cb 1.49 2.14 0.00 0.00 -0.74 0.00 0.00 36.82 39.70 2fuh h ILE 6 CO 0.15 0.33 0.35 -1.13 0.00 0.00 0.00 178.15 177.86 2fuh h ASN 7 N -0.38 0.00 -0.28 1.72 -1.24 -1.27 0.33 115.58 114.45 2fuh h ASN 7 Ca 0.01 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 56.95 2fuh h ASN 7 Cb 0.56 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.60 2fuh h ASN 7 CO 0.01 0.00 -0.06 0.50 -1.29 0.00 0.00 177.43 176.59 2fuh h LYS 8 N 0.00 0.54 -0.65 6.67 3.64 -1.54 -2.87 116.57 122.36 2fuh h LYS 8 Ca 0.00 -0.20 0.10 0.00 -1.27 0.00 0.00 60.65 59.28 2fuh h LYS 8 Cb 0.71 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.46 2fuh h LYS 8 CO 0.00 0.74 0.43 1.49 -2.27 0.00 0.00 179.45 179.84 2fuh h GLU 9 N 0.30 0.45 -0.98 1.90 4.81 -1.03 -1.03 114.58 119.00 2fuh h GLU 9 Ca 0.07 -0.03 0.21 0.00 -0.13 0.00 0.00 59.36 59.48 2fuh h GLU 9 Cb 0.53 -0.10 -0.11 0.00 0.63 0.00 0.00 28.75 29.70 2fuh h GLU 9 CO 0.03 0.30 0.57 1.25 -0.73 0.00 0.00 179.01 180.43 2fuh h LEU 10 N 0.46 0.69 -1.62 1.64 5.85 -1.54 0.43 115.31 121.23 2fuh h LEU 10 Ca 0.30 0.11 0.01 0.00 0.84 0.00 0.00 57.88 59.14 2fuh h LEU 10 Cb 0.56 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 2fuh h LEU 10 CO -0.09 0.19 0.26 -1.28 -0.34 0.00 0.00 178.44 177.18 2fuh h SER 11 N 0.66 0.45 -0.26 1.25 0.87 -1.28 -1.11 113.55 114.13 2fuh h SER 11 Ca 0.59 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 61.14 2fuh h SER 11 Cb 0.99 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.83 2fuh h SER 11 CO -0.42 0.32 0.16 -0.78 -0.53 0.00 0.00 176.83 175.58 2fuh h ASP 12 N 0.53 0.32 0.92 6.23 1.82 -0.22 -0.16 116.42 125.87 2fuh h ASP 12 Ca 0.15 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.77 2fuh h ASP 12 Cb -0.05 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 39.88 2fuh h ASP 12 CO -0.03 0.25 -0.37 0.18 -1.61 0.00 0.00 179.24 177.65 2fuh n LEU 13 N -4.48 0.57 -0.01 2.28 4.77 -0.46 -3.98 117.00 115.69 2fuh n LEU 13 Ca 0.01 0.29 -0.06 0.00 -0.03 0.00 0.00 56.01 56.22 2fuh n LEU 13 Cb 0.08 -0.28 -0.05 0.00 -2.33 0.00 0.00 43.42 40.85 2fuh n LEU 13 CO 0.35 -0.03 0.18 0.00 -1.33 0.00 0.00 177.39 176.56 2fuh h ALA 14 N 2.70 -0.10 -0.76 -1.18 0.00 -0.55 -3.02 119.26 116.35 2fuh h ALA 14 Ca 0.00 -0.16 0.17 0.00 0.00 0.00 0.00 54.91 54.91 2fuh h ALA 14 Cb 0.65 0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.34 2fuh h ALA 14 CO 0.00 -0.11 -0.08 0.07 0.00 0.00 0.00 179.25 179.13 2fuh h ARG 15 N -0.99 0.05 -0.18 0.00 0.11 -1.60 -3.41 114.38 108.36 2fuh h ARG 15 Ca -0.01 -0.00 0.24 0.00 0.10 0.00 0.00 59.98 60.30 2fuh h ARG 15 Cb 0.35 -0.01 -0.19 0.00 1.11 0.00 0.00 29.97 31.24 2fuh h ARG 15 CO 0.02 0.03 0.03 0.34 0.10 0.00 0.00 179.97 180.49 2fuh s ASP 16 N -5.20 -0.29 0.42 0.08 2.15 -1.25 -5.16 116.67 107.41 2fuh s ASP 16 Ca -0.14 0.04 -0.19 0.00 0.43 0.00 0.00 52.55 52.69 2fuh s ASP 16 Cb 0.22 1.19 -0.10 0.00 -0.30 0.00 0.00 42.92 43.93 2fuh s ASP 16 CO 0.75 -0.05 0.92 -2.16 -0.17 0.00 0.00 175.17 174.46 2fuh s PRO 17 N 2.97 4.15 0.06 4.34 0.04 -1.14 -4.81 135.00 140.61 2fuh s PRO 17 Ca 0.28 1.02 -0.36 0.00 0.04 0.00 0.00 61.00 61.98 2fuh s PRO 17 Cb -0.01 -2.21 -0.15 0.00 0.04 0.00 0.00 34.50 32.16 2fuh s PRO 17 CO -0.22 -0.03 1.53 -2.30 0.04 0.00 0.00 177.00 176.02 2fuh n PRO 18 N -0.73 1.64 0.05 0.56 -0.02 -1.26 -4.88 135.00 130.35 2fuh n PRO 18 Ca 0.06 0.59 -0.13 0.00 -2.02 0.00 0.00 63.50 62.00 2fuh n PRO 18 Cb 0.54 -2.31 -0.04 0.00 -0.02 0.00 0.00 33.50 31.67 2fuh n PRO 18 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fuh h ALA 19 N 5.85 0.39 -0.01 3.55 0.00 -1.99 -2.05 119.26 125.00 2fuh h ALA 19 Ca -0.47 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 53.76 2fuh h ALA 19 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2fuh h ALA 19 CO 0.86 0.78 -0.16 0.94 0.00 0.00 0.00 179.25 181.68 2fuh n GLN 20 N -3.79 0.93 -2.94 0.00 7.27 -1.26 -4.32 117.38 113.26 2fuh n GLN 20 Ca -0.07 -0.46 -0.14 0.00 0.07 0.00 0.00 57.00 56.41 2fuh n GLN 20 Cb 0.81 -1.49 0.03 0.00 2.41 0.00 0.00 30.24 31.99 2fuh n GLN 20 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2fuh s SER 22 N -1.71 5.42 0.07 0.00 1.04 -0.78 -4.38 113.70 113.36 2fuh s SER 22 Ca 0.31 2.27 -0.23 0.00 0.48 0.00 0.00 55.95 58.78 2fuh s SER 22 Cb 0.29 -2.59 0.06 0.00 0.10 0.00 0.00 66.02 63.88 2fuh s SER 22 CO -0.10 -1.43 0.55 0.00 0.98 0.00 0.00 173.24 173.24 2fuh s ALA 23 N -1.72 -1.41 0.16 5.32 0.00 -1.26 -2.91 121.76 119.94 2fuh s ALA 23 Ca 0.75 0.60 -0.20 0.00 0.00 0.00 0.00 51.96 53.11 2fuh s ALA 23 Cb -0.27 0.49 0.05 0.00 0.00 0.00 0.00 23.12 23.39 2fuh s ALA 23 CO 0.31 -0.57 0.53 0.20 0.00 0.00 0.00 175.76 176.23 2fuh s GLY 24 N -2.14 -0.37 0.45 0.00 0.00 -1.24 -5.02 107.32 99.00 2fuh s GLY 24 Ca -0.04 0.12 -0.22 0.00 0.00 0.00 0.00 44.72 44.59 2fuh s GLY 24 CO -0.04 -0.09 1.05 2.56 0.00 0.00 0.00 173.10 176.58 2fuh s PRO 25 N -3.80 3.95 -0.13 2.90 0.04 -1.26 -2.50 135.00 134.20 2fuh s PRO 25 Ca 0.04 1.44 0.01 0.00 0.04 0.00 0.00 61.00 62.53 2fuh s PRO 25 Cb -0.00 -2.30 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 2fuh s PRO 25 CO -0.09 -0.31 -0.17 0.54 0.04 0.00 0.00 177.00 177.01 2fuh s VAL 26 N -1.82 2.66 0.00 -0.36 0.11 -1.11 -4.88 120.40 115.00 2fuh s VAL 26 Ca 0.63 -0.79 0.00 0.00 -2.93 0.00 0.00 61.98 58.89 2fuh s VAL 26 Cb -0.19 -2.10 0.00 0.00 -1.53 0.00 0.00 36.38 32.56 2fuh s VAL 26 CO 0.24 0.53 0.00 0.61 -3.33 0.00 0.00 175.10 173.15 2fuh n GLY 27 N 3.72 -2.60 0.43 6.54 0.00 -1.26 -4.52 105.19 107.51 2fuh n GLY 27 Ca -0.19 -1.32 0.25 0.00 0.00 0.00 0.00 46.02 44.76 2fuh n GLY 27 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2fuh h ASP 28 N 0.00 0.00 -3.80 1.61 3.58 -1.97 -3.40 116.42 112.44 2fuh h ASP 28 Ca 0.00 0.00 -0.48 0.00 0.42 0.00 0.00 57.03 56.97 2fuh h ASP 28 Cb 0.00 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.03 2fuh h ASP 28 CO 0.00 0.00 0.35 1.51 -2.88 0.00 0.00 179.24 178.22 2fuh s ASP 29 N -5.82 7.51 0.00 2.28 1.47 -1.26 -4.95 116.67 115.90 2fuh s ASP 29 Ca -0.05 1.92 0.25 0.00 1.18 0.00 0.00 52.55 55.85 2fuh s ASP 29 Cb 0.21 -2.60 0.50 0.00 -0.34 0.00 0.00 42.92 40.69 2fuh s ASP 29 CO 0.75 0.06 1.41 0.23 0.68 0.00 0.00 175.17 178.30 2fuh n MET 30 N 1.13 0.15 0.00 2.11 2.81 -1.26 -3.90 117.12 118.16 2fuh n MET 30 Ca -0.00 -0.09 0.02 0.00 -1.81 0.00 0.00 57.70 55.82 2fuh n MET 30 Cb 0.48 -1.50 0.12 0.00 -0.71 0.00 0.00 33.22 31.61 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 -1.35 0.00 -3.78 2.03 3.72 -1.26 -4.33 117.46 112.49 2fuh n PHE 31 Ca 0.07 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.25 2fuh n PHE 31 Cb 0.34 -0.18 -0.17 0.00 -0.94 0.00 0.00 39.48 38.52 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 -2.37 0.56 0.51 1.38 2.46 -1.25 -4.56 115.29 112.02 2fuh s HIS 32 Ca 0.05 -0.09 0.04 0.00 0.47 0.00 0.00 55.06 55.52 2fuh s HIS 32 Cb 0.03 -0.72 0.00 0.00 -0.13 0.00 0.00 32.58 31.76 2fuh s HIS 32 CO 0.06 -0.29 0.19 -1.58 -2.47 0.00 0.00 174.74 170.65 2fuh s TRP 33 N 1.91 1.87 0.21 3.88 0.52 -1.24 -2.77 118.94 123.33 2fuh s TRP 33 Ca 0.03 -0.86 -0.07 0.00 0.02 0.00 0.00 56.10 55.23 2fuh s TRP 33 Cb -0.12 -1.78 -0.02 0.00 -1.15 0.00 0.00 33.47 30.39 2fuh s TRP 33 CO -0.04 -0.06 0.29 -0.65 0.02 0.00 0.00 176.95 176.51 2fuh s GLN 34 N -4.04 1.33 -0.20 4.98 -1.52 -1.04 -3.92 119.66 115.25 2fuh s GLN 34 Ca 0.22 -1.41 -0.28 0.00 -1.95 0.00 0.00 55.36 51.94 2fuh s GLN 34 Cb 0.01 0.37 0.12 0.00 -0.22 0.00 0.00 33.01 33.28 2fuh s GLN 34 CO 0.13 -0.49 0.96 0.00 -0.25 0.00 0.00 175.29 175.63 2fuh s ALA 35 N -4.07 -1.92 0.04 6.09 0.00 -1.18 -3.66 121.76 117.05 2fuh s ALA 35 Ca 0.29 1.68 0.02 0.00 0.00 0.00 0.00 51.96 53.95 2fuh s ALA 35 Cb 0.03 -0.91 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 2fuh s ALA 35 CO 0.09 -0.29 -0.08 0.99 0.00 0.00 0.00 175.76 176.46 2fuh s THR 36 N -0.57 0.59 0.30 0.00 2.01 -1.15 -3.43 115.64 113.38 2fuh s THR 36 Ca -0.01 -0.97 -0.09 0.00 0.31 0.00 0.00 61.69 60.93 2fuh s THR 36 Cb -0.02 -0.62 0.00 0.00 0.01 0.00 0.00 72.50 71.87 2fuh s THR 36 CO -0.00 -0.29 0.50 0.27 -0.69 0.00 0.00 174.62 174.41 2fuh s ILE 37 N -1.17 0.00 0.13 1.82 -4.36 -1.24 -4.02 121.20 112.36 2fuh s ILE 37 Ca -0.07 -1.46 0.06 0.00 -0.26 0.00 0.00 60.65 58.92 2fuh s ILE 37 Cb -0.09 -2.45 -0.04 0.00 1.25 0.00 0.00 42.46 41.14 2fuh s ILE 37 CO 0.00 0.00 -0.13 -0.32 0.24 0.00 0.00 174.94 174.74 2fuh s MET 38 N -3.49 1.05 -0.36 0.37 1.75 -1.26 -3.27 119.30 114.09 2fuh s MET 38 Ca 0.25 -1.31 -0.25 0.00 -1.25 0.00 0.00 55.69 53.12 2fuh s MET 38 Cb -0.01 -0.83 0.01 0.00 2.84 0.00 0.00 34.83 36.85 2fuh s MET 38 CO 0.14 0.14 0.90 0.20 -0.65 0.00 0.00 175.02 175.75 2fuh s GLY 39 N -2.70 1.59 0.83 2.11 0.00 -1.26 -5.00 107.32 102.90 2fuh s GLY 39 Ca 0.12 -0.47 -0.09 0.00 0.00 0.00 0.00 44.72 44.28 2fuh s GLY 39 CO 0.03 1.96 0.19 -1.05 0.00 0.00 0.00 173.10 174.23 2fuh n PRO 40 N 6.68 -1.48 0.11 2.90 -0.02 -1.26 -4.26 135.00 137.68 2fuh n PRO 40 Ca 0.06 -0.44 -0.02 0.00 -2.02 0.00 0.00 63.50 61.08 2fuh n PRO 40 Cb 0.48 -1.29 0.18 0.00 -0.02 0.00 0.00 33.50 32.85 2fuh n PRO 40 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2fuh h ASN 41 N -2.45 0.14 0.51 2.55 4.21 -2.00 -2.73 115.58 115.83 2fuh h ASN 41 Ca -0.15 -0.08 -0.02 0.00 1.21 0.00 0.00 56.30 57.26 2fuh h ASN 41 Cb 0.49 -0.04 -0.00 0.00 -1.12 0.00 0.00 38.32 37.64 2fuh h ASN 41 CO 0.09 0.67 -0.10 0.44 -1.29 0.00 0.00 177.43 177.24 2fuh h ASP 42 N 0.10 0.00 -3.56 5.81 5.19 -2.00 -3.39 116.42 118.57 2fuh h ASP 42 Ca -0.00 0.00 -0.69 0.00 -0.62 0.00 0.00 57.03 55.72 2fuh h ASP 42 Cb 1.01 0.00 -0.18 0.00 0.18 0.00 0.00 39.33 40.33 2fuh h ASP 42 CO 0.08 0.10 -0.21 -0.94 -3.12 0.00 0.00 179.24 175.14 2fuh s SER 43 N -5.94 6.20 0.00 6.45 1.04 -1.03 -4.92 113.70 115.50 2fuh s SER 43 Ca -0.02 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.81 2fuh s SER 43 Cb 0.12 -2.22 0.00 0.00 0.10 0.00 0.00 66.02 64.02 2fuh s SER 43 CO 0.56 -0.55 0.63 -2.65 0.98 0.00 0.00 173.24 172.21 2fuh n PRO 44 N 5.58 0.00 0.00 4.02 -0.02 -1.26 -1.39 135.00 141.92 2fuh n PRO 44 Ca -0.07 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 2fuh n PRO 44 Cb 0.48 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 2fuh n PRO 44 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2fuh n TYR 45 N -1.13 0.00 -1.70 6.00 4.01 -1.26 -4.71 117.16 118.37 2fuh n TYR 45 Ca 0.00 0.00 -0.59 0.00 -0.16 0.00 0.00 57.90 57.15 2fuh n TYR 45 Cb 0.35 -0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.30 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 -0.45 0.85 0.00 -0.72 6.02 -0.49 0.85 117.38 123.44 2fuh n GLN 46 Ca 0.00 0.31 0.00 0.00 -0.01 0.00 0.00 57.00 57.30 2fuh n GLN 46 Cb 0.01 -1.94 0.00 0.00 1.02 0.00 0.00 30.24 29.33 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 3.86 2.93 3.82 1.08 0.00 -1.26 -5.05 105.19 110.57 2fuh n GLY 47 Ca 0.26 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.99 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 1.62 -0.04 -0.02 0.00 0.25 -5.03 107.32 101.22 2fuh s GLY 48 Ca 0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 44.72 44.42 2fuh s GLY 48 CO 0.00 0.15 0.08 -1.34 0.00 0.00 0.00 173.10 171.98 2fuh s VAL 49 N -3.23 -0.04 0.27 1.40 -7.23 -1.25 -3.99 120.40 106.33 2fuh s VAL 49 Ca 0.60 0.14 0.06 0.00 -1.81 0.00 0.00 61.98 60.97 2fuh s VAL 49 Cb -0.14 -0.14 -0.03 0.00 0.56 0.00 0.00 36.38 36.64 2fuh s VAL 49 CO 0.53 0.06 0.34 -0.36 -0.31 0.00 0.00 175.10 175.36 2fuh s PHE 50 N 0.78 3.28 -0.02 2.82 0.08 -1.20 -4.86 117.98 118.87 2fuh s PHE 50 Ca -0.06 -0.09 -0.00 0.00 0.12 0.00 0.00 56.93 56.89 2fuh s PHE 50 Cb -0.09 -1.63 0.02 0.00 -0.57 0.00 0.00 43.02 40.76 2fuh s PHE 50 CO -0.03 0.35 0.03 -0.06 -0.10 0.00 0.00 175.22 175.41 2fuh s PHE 51 N -2.07 0.02 -0.01 0.36 0.08 -1.26 -3.68 117.98 111.42 2fuh s PHE 51 Ca 0.36 0.11 0.01 0.00 0.12 0.00 0.00 56.93 57.53 2fuh s PHE 51 Cb -0.09 -0.19 0.01 0.00 -0.57 0.00 0.00 43.02 42.18 2fuh s PHE 51 CO 0.28 -0.07 -0.02 -0.48 -0.10 0.00 0.00 175.22 174.83 2fuh s LEU 52 N 0.86 1.71 -0.08 -0.37 2.34 -1.22 0.24 118.68 122.16 2fuh s LEU 52 Ca -0.07 -0.05 -0.01 0.00 0.06 0.00 0.00 54.13 54.06 2fuh s LEU 52 Cb -0.10 -0.20 -0.03 0.00 -0.56 0.00 0.00 46.19 45.30 2fuh s LEU 52 CO -0.02 -0.01 -0.02 -0.89 -1.06 0.00 0.00 176.35 174.35 2fuh s THR 53 N 0.31 4.12 0.15 5.48 2.01 -1.12 -3.11 115.64 123.48 2fuh s THR 53 Ca -0.03 -0.32 0.04 0.00 0.31 0.00 0.00 61.69 61.69 2fuh s THR 53 Cb -0.06 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.70 2fuh s THR 53 CO -0.01 0.60 0.14 -0.63 -0.69 0.00 0.00 174.62 174.03 2fuh s ILE 54 N -0.85 4.57 -0.12 1.82 1.09 -1.25 -3.51 121.20 122.95 2fuh s ILE 54 Ca 0.13 -0.98 -0.04 0.00 -1.10 0.00 0.00 60.65 58.66 2fuh s ILE 54 Cb -0.11 -3.31 0.06 0.00 -1.06 0.00 0.00 42.46 38.04 2fuh s ILE 54 CO 0.02 -0.06 0.16 -2.28 -0.10 0.00 0.00 174.94 172.68 2fuh s HIS 55 N -1.68 -0.15 0.21 3.97 2.46 -0.80 -3.60 115.29 115.71 2fuh s HIS 55 Ca 0.31 0.41 -0.13 0.00 0.47 0.00 0.00 55.06 56.11 2fuh s HIS 55 Cb -0.11 -0.34 -0.08 0.00 -0.13 0.00 0.00 32.58 31.93 2fuh s HIS 55 CO 0.24 -0.37 0.60 -0.06 -2.47 0.00 0.00 174.74 172.67 2fuh s PHE 56 N 2.28 3.51 0.58 3.88 0.40 -1.26 -1.79 117.98 125.57 2fuh s PHE 56 Ca 0.04 1.06 -0.16 0.00 -0.60 0.00 0.00 56.93 57.27 2fuh s PHE 56 Cb -0.13 -2.39 -0.05 0.00 0.51 0.00 0.00 43.02 40.96 2fuh s PHE 56 CO -0.07 0.30 1.04 -1.25 0.70 0.00 0.00 175.22 175.94 2fuh s PRO 57 N -2.44 3.45 0.00 0.24 0.04 -1.26 -4.92 135.00 130.10 2fuh s PRO 57 Ca 0.45 1.17 0.16 0.00 0.04 0.00 0.00 61.00 62.82 2fuh s PRO 57 Cb -0.13 -2.05 0.71 0.00 0.04 0.00 0.00 34.50 33.07 2fuh s PRO 57 CO 0.20 -0.70 1.51 0.25 0.04 0.00 0.00 177.00 178.29 2fuh n THR 58 N -1.91 0.84 -0.74 1.26 -2.24 -1.26 -2.15 114.28 108.08 2fuh n THR 58 Ca 0.08 0.21 -0.01 0.00 -2.27 0.00 0.00 64.05 62.07 2fuh n THR 58 Cb 0.53 -0.93 0.31 0.00 -2.10 0.00 0.00 70.33 68.13 2fuh n THR 58 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2fuh n ASP 59 N -1.47 4.80 -0.64 3.42 -0.08 -1.26 -4.96 116.55 116.35 2fuh n ASP 59 Ca 0.04 -2.97 0.00 0.00 -1.51 0.00 0.00 54.79 50.36 2fuh n ASP 59 Cb 0.18 -0.70 0.00 0.00 2.34 0.00 0.00 41.12 42.94 2fuh n ASP 59 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 2fuh n TYR 60 N 0.18 -1.76 -0.10 -0.67 4.01 -0.91 -4.19 117.16 113.71 2fuh n TYR 60 Ca 0.31 0.96 0.20 0.00 -0.16 0.00 0.00 57.90 59.21 2fuh n TYR 60 Cb 1.20 -1.78 0.30 0.00 -0.31 0.00 0.00 39.34 38.75 2fuh n TYR 60 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2fuh n PRO 61 N -1.93 0.01 0.17 -0.72 -0.02 -1.26 -0.73 135.00 130.52 2fuh n PRO 61 Ca 0.00 0.87 0.03 0.00 -2.02 0.00 0.00 63.50 62.38 2fuh n PRO 61 Cb 0.19 -2.20 0.18 0.00 -0.02 0.00 0.00 33.50 31.65 2fuh n PRO 61 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2fuh h PHE 62 N 0.00 0.00 -3.67 6.00 -1.00 -1.93 -3.38 116.94 112.97 2fuh h PHE 62 Ca 0.35 0.00 -0.67 0.00 2.81 0.00 0.00 57.97 60.46 2fuh h PHE 62 Cb 2.39 0.00 -0.18 0.00 3.61 0.00 0.00 35.95 41.78 2fuh h PHE 62 CO 0.00 0.00 -0.74 0.15 -1.61 0.00 0.00 178.31 176.11 2fuh s LYS 63 N -3.16 2.23 -0.11 1.51 3.01 0.09 -5.02 119.74 118.29 2fuh s LYS 63 Ca -0.01 -0.93 -0.33 0.00 -1.01 0.00 0.00 55.97 53.69 2fuh s LYS 63 Cb 0.02 -2.33 -0.11 0.00 -1.01 0.00 0.00 37.83 34.40 2fuh s LYS 63 CO 0.06 0.54 1.94 -2.30 0.51 0.00 0.00 175.35 176.10 2fuh n PRO 64 N 1.13 2.13 -1.90 -1.68 -0.02 -1.26 -4.70 135.00 128.70 2fuh n PRO 64 Ca -0.15 0.76 -0.31 0.00 -2.02 0.00 0.00 63.50 61.78 2fuh n PRO 64 Cb 0.52 -2.71 0.01 0.00 -0.02 0.00 0.00 33.50 31.30 2fuh n PRO 64 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2fuh s PRO 65 N 4.49 3.57 -0.09 0.52 0.04 -1.26 -4.80 135.00 137.46 2fuh s PRO 65 Ca 0.95 0.80 -0.12 0.00 0.04 0.00 0.00 61.00 62.67 2fuh s PRO 65 Cb -0.66 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 31.76 2fuh s PRO 65 CO 0.50 -0.59 0.27 0.15 0.04 0.00 0.00 177.00 177.36 2fuh s LYS 66 N -5.02 3.85 0.03 4.56 -0.14 -0.74 -4.98 119.74 117.29 2fuh s LYS 66 Ca 0.56 0.11 0.01 0.00 -1.36 0.00 0.00 55.97 55.29 2fuh s LYS 66 Cb -0.11 -3.27 -0.02 0.00 -1.68 0.00 0.00 37.83 32.75 2fuh s LYS 66 CO 0.51 0.59 -0.06 0.54 -0.76 0.00 0.00 175.35 176.17 2fuh s VAL 67 N -0.60 0.39 -0.13 3.17 0.11 -1.26 -1.89 120.40 120.18 2fuh s VAL 67 Ca 0.18 -0.85 -0.27 0.00 -2.93 0.00 0.00 61.98 58.11 2fuh s VAL 67 Cb -0.14 -0.45 0.06 0.00 -1.53 0.00 0.00 36.38 34.32 2fuh s VAL 67 CO 0.07 -0.32 0.65 0.00 -3.33 0.00 0.00 175.10 172.17 2fuh s ALA 68 N -1.14 -1.64 -0.37 1.54 0.00 -1.23 -4.60 121.76 114.32 2fuh s ALA 68 Ca -0.09 1.47 -0.26 0.00 0.00 0.00 0.00 51.96 53.07 2fuh s ALA 68 Cb -0.08 -0.43 0.02 0.00 0.00 0.00 0.00 23.12 22.62 2fuh s ALA 68 CO -0.00 -0.34 0.95 -0.06 0.00 0.00 0.00 175.76 176.31 2fuh s PHE 69 N -0.58 3.06 0.12 0.00 0.08 -1.21 -2.78 117.98 116.67 2fuh s PHE 69 Ca -0.07 0.79 -0.17 0.00 0.12 0.00 0.00 56.93 57.60 2fuh s PHE 69 Cb -0.02 -3.71 -0.03 0.00 -0.57 0.00 0.00 43.02 38.69 2fuh s PHE 69 CO 0.06 -0.86 1.69 1.15 -0.10 0.00 0.00 175.22 177.16 2fuh h THR 70 N 5.85 1.17 -3.35 0.64 2.02 0.28 -3.42 112.91 116.09 2fuh h THR 70 Ca -0.23 -0.48 -0.56 0.00 0.77 0.00 0.00 66.41 65.91 2fuh h THR 70 Cb 1.08 0.86 -0.05 0.00 -1.74 0.00 0.00 68.15 68.30 2fuh h THR 70 CO 1.00 0.17 0.05 -0.89 0.37 0.00 0.00 175.52 176.22 2fuh s THR 71 N -5.68 4.90 0.54 3.16 2.01 -0.67 -4.94 115.64 114.96 2fuh s THR 71 Ca -0.13 1.38 -0.21 0.00 0.31 0.00 0.00 61.69 63.04 2fuh s THR 71 Cb 0.09 -4.00 -0.05 0.00 0.01 0.00 0.00 72.50 68.55 2fuh s THR 71 CO 0.73 0.37 1.22 -0.60 -0.69 0.00 0.00 174.62 175.65 2fuh s ARG 72 N 0.08 3.24 -0.19 4.92 6.06 -1.26 -4.73 118.95 127.07 2fuh s ARG 72 Ca 0.34 1.89 -0.16 0.00 -2.50 0.00 0.00 55.73 55.30 2fuh s ARG 72 Cb -0.19 -2.13 0.05 0.00 0.06 0.00 0.00 34.95 32.75 2fuh s ARG 72 CO 0.19 -1.00 0.50 -1.50 -2.50 0.00 0.00 175.30 170.98 2fuh s ILE 73 N -1.53 -0.00 -0.36 4.11 2.07 -1.26 -4.86 121.20 119.37 2fuh s ILE 73 Ca 0.72 0.01 0.02 0.00 -1.41 0.00 0.00 60.65 60.00 2fuh s ILE 73 Cb -0.32 -0.70 0.47 0.00 0.13 0.00 0.00 42.46 42.04 2fuh s ILE 73 CO 0.36 0.01 1.74 0.00 -1.91 0.00 0.00 174.94 175.14 2fuh n TYR 74 N 3.12 2.30 -3.49 3.50 9.36 -1.26 -4.87 117.16 125.81 2fuh n TYR 74 Ca -0.15 -1.68 -0.37 0.00 3.32 0.00 0.00 57.90 59.01 2fuh n TYR 74 Cb 0.56 -0.85 -0.06 0.00 -0.63 0.00 0.00 39.34 38.36 2fuh n TYR 74 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 2fuh s HIS 75 N -2.51 3.55 0.75 2.98 5.65 -1.26 -5.03 115.29 119.41 2fuh s HIS 75 Ca 0.43 0.76 -0.08 0.00 0.25 0.00 0.00 55.06 56.42 2fuh s HIS 75 Cb 0.36 -2.36 0.04 0.00 -1.18 0.00 0.00 32.58 29.45 2fuh s HIS 75 CO 0.07 0.35 -0.05 -2.30 -0.65 0.00 0.00 174.74 172.15 2fuh n PRO 76 N 3.08 -0.87 -0.38 2.88 -0.02 -1.26 -2.66 135.00 135.76 2fuh n PRO 76 Ca -0.12 -0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.11 2fuh n PRO 76 Cb 0.52 -1.18 0.00 0.00 -0.02 0.00 0.00 33.50 32.82 2fuh n PRO 76 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2fuh n ASN 77 N 1.41 0.00 -3.73 2.55 4.13 0.15 -4.86 115.26 114.91 2fuh n ASN 77 Ca 0.02 0.00 -0.20 0.00 1.68 0.00 0.00 54.58 56.08 2fuh n ASN 77 Cb 0.22 -1.96 -0.17 0.00 -1.54 0.00 0.00 39.78 36.33 2fuh n ASN 77 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2fuh s ILE 78 N -1.28 0.07 0.00 2.41 1.01 -1.09 -2.84 121.20 119.48 2fuh s ILE 78 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.93 2fuh s ILE 78 Cb 0.00 -0.27 0.00 0.00 0.01 0.00 0.00 42.46 42.20 2fuh s ILE 78 CO 0.00 0.19 0.00 0.59 0.00 0.00 0.00 174.94 175.72 2fuh n ASN 79 N 5.01 0.00 0.20 3.58 4.13 -1.26 -4.64 115.26 122.28 2fuh n ASN 79 Ca -0.09 0.00 0.13 0.00 1.68 0.00 0.00 54.58 56.30 2fuh n ASN 79 Cb 0.50 0.00 0.35 0.00 -1.54 0.00 0.00 39.78 39.09 2fuh n ASN 79 CO 0.00 0.00 0.00 -1.28 0.28 0.00 0.00 177.26 176.26 2fuh h SER 80 N 0.00 0.00 1.18 6.41 0.87 -1.97 -2.92 113.55 117.12 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 0.00 -0.13 0.59 -0.53 0.00 0.00 176.83 176.76 2fuh n ASN 81 N -2.86 0.55 0.00 6.23 3.02 -1.26 -4.91 115.26 116.04 2fuh n ASN 81 Ca 0.03 0.43 0.00 0.00 -0.03 0.00 0.00 54.58 55.01 2fuh n ASN 81 Cb 0.44 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 39.11 2fuh n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fuh n GLY 82 N 1.38 0.55 3.61 7.41 0.00 -1.10 -4.77 105.19 112.26 2fuh n GLY 82 Ca 0.06 -0.22 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 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 0.40 3.40 -4.61 1.61 7.64 -1.26 -3.28 113.62 117.51 2fuh n SER 83 Ca 0.00 0.33 -0.40 0.00 1.01 0.00 0.00 58.87 59.80 2fuh n SER 83 Cb 0.00 -1.55 -0.07 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 7.64 5.05 -0.40 0.44 1.01 -1.26 -4.06 121.20 129.62 2fuh s ILE 84 Ca 0.99 0.87 -0.27 0.00 0.00 0.00 0.00 60.65 62.23 2fuh s ILE 84 Cb -0.36 -3.86 0.02 0.00 0.01 0.00 0.00 42.46 38.27 2fuh s ILE 84 CO 0.37 0.04 1.02 0.00 0.00 0.00 0.00 174.94 176.37 2fuh s LEU 86 N 3.84 0.88 -0.01 0.00 1.43 -1.26 -5.07 118.68 118.49 2fuh s LEU 86 Ca 0.42 0.52 -0.25 0.00 -1.03 0.00 0.00 54.13 53.79 2fuh s LEU 86 Cb -0.10 0.84 -0.18 0.00 0.03 0.00 0.00 46.19 46.77 2fuh s LEU 86 CO 0.23 -0.11 1.21 0.44 0.23 0.00 0.00 176.35 178.35 2fuh h ASP 87 N 6.10 -0.13 -0.96 2.29 3.32 -1.95 -3.07 116.42 122.01 2fuh h ASP 87 Ca -0.29 -0.36 0.20 0.00 0.02 0.00 0.00 57.03 56.60 2fuh h ASP 87 Cb 1.18 0.03 -0.09 0.00 0.22 0.00 0.00 39.33 40.68 2fuh h ASP 87 CO 0.35 0.32 0.61 0.40 -1.72 0.00 0.00 179.24 179.21 2fuh h ILE 88 N -0.61 0.68 -0.51 0.35 5.03 -1.98 0.39 117.51 120.87 2fuh h ILE 88 Ca -0.02 -0.20 -0.02 0.00 -0.12 0.00 0.00 64.86 64.51 2fuh h ILE 88 Cb 0.48 0.06 -0.03 0.00 -3.03 0.00 0.00 36.82 34.30 2fuh h ILE 88 CO 0.03 0.11 0.25 0.25 -0.68 0.00 0.00 178.15 178.10 2fuh h LEU 89 N 0.58 0.63 0.00 1.44 7.12 -1.80 -2.01 115.31 121.27 2fuh h LEU 89 Ca 0.53 -0.05 0.00 0.00 0.13 0.00 0.00 57.88 58.49 2fuh h LEU 89 Cb 1.07 -0.16 0.00 0.00 -0.53 0.00 0.00 40.66 41.04 2fuh h LEU 89 CO -0.27 0.54 0.00 0.54 -0.13 0.00 0.00 178.44 179.11 2fuh n ARG 90 N -4.39 0.21 -0.61 1.25 1.74 0.14 -4.59 116.66 110.41 2fuh n ARG 90 Ca 0.04 0.00 0.46 0.00 -0.77 0.00 0.00 57.85 57.58 2fuh n ARG 90 Cb 0.12 0.00 0.71 0.00 -1.02 0.00 0.00 32.46 32.27 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 -1.56 0.01 -0.95 0.55 3.41 -1.26 0.49 113.62 114.31 2fuh n SER 91 Ca 0.00 0.89 0.00 0.00 -0.26 0.00 0.00 58.87 59.50 2fuh n SER 91 Cb 0.00 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 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 -3.72 0.60 -3.30 4.33 1.13 -1.24 -4.65 117.38 110.52 2fuh n GLN 92 Ca 0.39 0.00 -0.45 0.00 -1.94 0.00 0.00 57.00 55.00 2fuh n GLN 92 Cb 1.74 -1.21 -0.06 0.00 0.11 0.00 0.00 30.24 30.82 2fuh n GLN 92 CO 0.00 0.00 0.00 -0.46 -1.44 0.00 0.00 177.06 175.16 2fuh s TRP 93 N 0.27 3.19 0.08 1.08 -0.11 0.18 -4.44 118.94 119.19 2fuh s TRP 93 Ca 0.00 -1.00 -0.17 0.00 1.22 0.00 0.00 56.10 56.14 2fuh s TRP 93 Cb 0.00 -3.52 -0.07 0.00 -1.50 0.00 0.00 33.47 28.38 2fuh s TRP 93 CO 0.00 -0.96 0.54 -1.12 -4.62 0.00 0.00 176.95 170.79 2fuh s SER 94 N 3.06 6.97 0.00 5.86 0.01 -1.26 -4.96 113.70 123.38 2fuh s SER 94 Ca 0.06 1.17 0.21 0.00 1.31 0.00 0.00 55.95 58.71 2fuh s SER 94 Cb -0.26 -2.33 1.28 0.00 0.21 0.00 0.00 66.02 64.93 2fuh s SER 94 CO 0.06 0.24 1.67 -0.81 0.41 0.00 0.00 173.24 174.81 2fuh n PRO 95 N 1.51 0.70 -0.05 12.44 -0.04 -1.26 -2.59 135.00 145.71 2fuh n PRO 95 Ca -0.10 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.44 2fuh n PRO 95 Cb 0.51 -1.48 0.10 0.00 -0.04 0.00 0.00 33.50 32.60 2fuh n PRO 95 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fuh n ALA 96 N -0.98 2.19 -2.20 0.55 0.00 -1.26 -4.95 120.51 113.86 2fuh n ALA 96 Ca 0.16 -2.17 -0.31 0.00 0.00 0.00 0.00 53.44 51.12 2fuh n ALA 96 Cb 0.07 -0.27 -0.05 0.00 0.00 0.00 0.00 19.45 19.20 2fuh n ALA 96 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2fuh s LEU 97 N -2.35 3.98 -0.19 0.00 0.05 -1.07 -5.05 118.68 114.04 2fuh s LEU 97 Ca 0.23 1.16 -0.16 0.00 0.05 0.00 0.00 54.13 55.41 2fuh s LEU 97 Cb 0.20 -3.99 -0.04 0.00 -2.05 0.00 0.00 46.19 40.31 2fuh s LEU 97 CO 0.02 -0.27 0.39 0.42 -0.55 0.00 0.00 176.35 176.37 2fuh s THR 98 N -2.12 5.21 -1.29 5.48 -4.23 -1.26 -4.92 115.64 112.51 2fuh s THR 98 Ca 0.52 0.71 0.00 0.00 -1.18 0.00 0.00 61.69 61.73 2fuh s THR 98 Cb -0.10 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 70.01 2fuh s THR 98 CO 0.24 0.26 0.55 0.00 -0.54 0.00 0.00 174.62 175.13 2fuh n ILE 99 N 4.25 0.50 0.18 2.99 3.06 -1.26 -2.13 119.36 126.96 2fuh n ILE 99 Ca -0.09 0.16 -0.08 0.00 -2.50 0.00 0.00 62.75 60.25 2fuh n ILE 99 Cb 0.51 -1.16 -0.04 0.00 0.54 0.00 0.00 39.64 39.49 2fuh n ILE 99 CO 0.00 0.00 0.00 -1.28 -2.50 0.00 0.00 176.55 172.77 2fuh h SER 100 N 0.00 -0.45 -0.84 9.51 0.87 -1.99 -3.01 113.55 117.65 2fuh h SER 100 Ca 0.00 0.02 0.15 0.00 -1.23 0.00 0.00 61.79 60.73 2fuh h SER 100 Cb 0.08 0.12 -0.06 0.00 -0.44 0.00 0.00 62.40 62.09 2fuh h SER 100 CO 0.00 -0.07 0.55 0.07 -0.53 0.00 0.00 176.83 176.85 2fuh h LYS 101 N -1.04 0.53 -1.01 2.24 2.10 -1.86 0.50 116.57 118.04 2fuh h LYS 101 Ca -0.05 -0.03 0.06 0.00 -2.00 0.00 0.00 60.65 58.63 2fuh h LYS 101 Cb 0.41 -0.12 -0.07 0.00 -0.90 0.00 0.00 32.23 31.55 2fuh h LYS 101 CO 0.09 0.35 0.65 0.28 -2.00 0.00 0.00 179.45 178.82 2fuh h VAL 102 N 0.54 1.09 -0.32 0.07 2.07 -1.61 -1.36 116.25 116.73 2fuh h VAL 102 Ca 0.42 -0.41 -0.08 0.00 0.82 0.00 0.00 66.70 67.45 2fuh h VAL 102 Cb 0.83 -0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 2fuh h VAL 102 CO -0.17 0.22 -0.13 -0.07 0.02 0.00 0.00 177.57 177.44 2fuh h LEU 103 N 1.18 0.67 -2.05 2.57 3.38 -0.76 -2.77 115.31 117.53 2fuh h LEU 103 Ca 0.43 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2fuh h LEU 103 Cb 0.16 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2fuh h LEU 103 CO -0.17 0.91 0.00 -0.07 0.09 0.00 0.00 178.44 179.20 2fuh h LEU 104 N 0.43 0.00 -1.36 1.67 -0.00 -1.01 0.01 115.31 115.05 2fuh h LEU 104 Ca 0.08 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.89 2fuh h LEU 104 Cb 0.64 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.29 2fuh h LEU 104 CO 0.04 0.00 -0.31 -1.28 -0.00 0.00 0.00 178.44 176.89 2fuh h SER 105 N 0.00 0.00 0.28 -0.43 0.87 -0.98 -2.50 113.55 110.78 2fuh h SER 105 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2fuh h SER 105 Cb 0.01 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2fuh h SER 105 CO -0.00 0.31 -0.13 0.40 -0.53 0.00 0.00 176.83 176.88 2fuh h ILE 106 N 0.00 0.56 -0.08 2.23 1.08 -0.94 -2.42 117.51 117.94 2fuh h ILE 106 Ca -0.00 -0.85 0.04 0.00 -0.39 0.00 0.00 64.86 63.66 2fuh h ILE 106 Cb 0.60 0.91 -0.06 0.00 -3.07 0.00 0.00 36.82 35.20 2fuh h ILE 106 CO 0.04 0.13 -0.37 0.00 -0.69 0.00 0.00 178.15 177.27 2fuh h SER 108 N -0.47 0.27 -0.42 0.00 0.87 -1.55 -1.36 113.55 110.88 2fuh h SER 108 Ca 0.07 0.11 0.09 0.00 -1.23 0.00 0.00 61.79 60.83 2fuh h SER 108 Cb 0.59 0.09 -0.09 0.00 -0.44 0.00 0.00 62.40 62.55 2fuh h SER 108 CO -0.34 0.10 -0.20 0.25 -0.53 0.00 0.00 176.83 176.11 2fuh h LEU 109 N 0.44 -0.70 -0.49 2.23 5.85 -0.73 0.51 115.31 122.41 2fuh h LEU 109 Ca 0.41 0.16 0.10 0.00 0.84 0.00 0.00 57.88 59.39 2fuh h LEU 109 Cb 0.61 0.38 -0.10 0.00 0.37 0.00 0.00 40.66 41.92 2fuh h LEU 109 CO -0.40 -0.23 -0.16 -0.07 -0.34 0.00 0.00 178.44 177.24 2fuh h LEU 110 N -0.13 -0.56 -0.33 2.25 3.38 -0.79 0.62 115.31 119.75 2fuh h LEU 110 Ca 0.20 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2fuh h LEU 110 Cb 0.44 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2fuh h LEU 110 CO -0.50 -0.20 0.00 0.00 0.09 0.00 0.00 178.44 177.84 2fuh n ASP 112 N -0.42 -0.64 -2.95 0.00 8.00 0.21 -5.06 116.55 115.69 2fuh n ASP 112 Ca 0.13 -2.66 0.00 0.00 0.71 0.00 0.00 54.79 52.97 2fuh n ASP 112 Cb 0.13 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 2fuh n ASP 112 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 2fuh n PRO 113 N 2.04 1.96 -2.72 -0.24 -0.02 -0.99 -4.54 135.00 130.49 2fuh n PRO 113 Ca 0.23 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.65 2fuh n PRO 113 Cb 0.52 0.00 0.05 0.00 -0.02 0.00 0.00 33.50 34.06 2fuh n PRO 113 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2fuh n ASN 114 N 0.00 -2.38 -0.14 2.55 5.15 -1.26 -5.01 115.26 114.17 2fuh n ASN 114 Ca 0.00 -2.61 0.26 0.00 -0.60 0.00 0.00 54.58 51.64 2fuh n ASN 114 Cb 0.00 1.40 0.71 0.00 -0.53 0.00 0.00 39.78 41.36 2fuh n ASN 114 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 2fuh h PRO 115 N 3.90 0.01 -0.49 1.20 0.11 -1.98 0.04 132.00 134.78 2fuh h PRO 115 Ca -0.14 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.90 2fuh h PRO 115 Cb 1.10 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2fuh h PRO 115 CO 0.10 0.00 0.03 -0.44 -0.21 0.00 0.00 178.00 177.48 2fuh h ASP 116 N 0.01 0.83 -2.03 -2.05 3.32 -2.03 -3.38 116.42 111.08 2fuh h ASP 116 Ca 0.38 -0.29 -0.54 0.00 0.02 0.00 0.00 57.03 56.60 2fuh h ASP 116 Cb 1.54 -0.22 -0.37 0.00 0.22 0.00 0.00 39.33 40.50 2fuh h ASP 116 CO -0.01 0.91 -1.00 0.47 -1.72 0.00 0.00 179.24 177.89 2fuh n ASP 117 N -4.36 -0.40 0.04 6.45 8.00 -0.13 -4.94 116.55 121.19 2fuh n ASP 117 Ca 0.01 -2.58 0.13 0.00 0.71 0.00 0.00 54.79 53.06 2fuh n ASP 117 Cb 0.29 -0.40 0.54 0.00 -0.02 0.00 0.00 41.12 41.53 2fuh n ASP 117 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2fuh n PRO 118 N 2.11 0.09 -0.04 -0.24 -0.04 -0.42 -4.77 135.00 131.68 2fuh n PRO 118 Ca 0.24 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.79 2fuh n PRO 118 Cb 0.51 -1.61 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 2fuh n PRO 118 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2fuh n LEU 119 N -1.76 0.04 -3.14 1.53 7.94 -1.26 0.32 117.00 120.67 2fuh n LEU 119 Ca 0.06 0.00 -0.21 0.00 -1.11 0.00 0.00 56.01 54.75 2fuh n LEU 119 Cb 0.36 -0.34 -0.05 0.00 0.53 0.00 0.00 43.42 43.92 2fuh n LEU 119 CO 0.28 -0.02 -0.23 0.55 -1.11 0.00 0.00 177.39 176.86 2fuh n VAL 120 N -2.00 -0.53 -0.08 1.96 3.14 -1.26 -4.92 118.33 114.65 2fuh n VAL 120 Ca 0.00 -3.84 0.24 0.00 -2.96 0.00 0.00 64.34 57.78 2fuh n VAL 120 Cb 0.00 -1.28 0.50 0.00 -1.06 0.00 0.00 33.84 32.01 2fuh n VAL 120 CO 0.00 0.00 0.00 -0.65 -6.46 0.00 0.00 176.83 169.72 2fuh h PRO 121 N 3.80 0.00 -0.00 1.45 0.11 -1.98 0.16 132.00 135.54 2fuh h PRO 121 Ca 0.05 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.16 2fuh h PRO 121 Cb 0.91 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 2fuh h PRO 121 CO 0.45 0.00 0.00 1.49 -0.21 0.00 0.00 178.00 179.73 2fuh h GLU 122 N 0.00 0.00 0.04 1.05 4.57 -1.98 0.16 114.58 118.42 2fuh h GLU 122 Ca 0.36 -0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 58.32 2fuh h GLU 122 Cb 2.30 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.88 2fuh h GLU 122 CO -0.00 0.12 -1.00 0.82 -1.18 0.00 0.00 179.01 177.77 2fuh h ILE 123 N -0.12 1.56 -0.52 2.32 2.04 -1.13 -3.29 117.51 118.38 2fuh h ILE 123 Ca 0.00 -2.95 -0.10 0.00 1.00 0.00 0.00 64.86 62.80 2fuh h ILE 123 Cb 0.12 2.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.88 2fuh h ILE 123 CO -0.00 0.86 -0.08 0.00 0.00 0.00 0.00 178.15 178.92 2fuh h ALA 124 N 0.89 0.71 -0.64 1.87 0.00 -1.27 -2.44 119.26 118.37 2fuh h ALA 124 Ca -0.06 -0.34 0.14 0.00 0.00 0.00 0.00 54.91 54.66 2fuh h ALA 124 Cb 1.69 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 19.26 2fuh h ALA 124 CO 0.15 0.60 0.44 0.00 0.00 0.00 0.00 179.25 180.44 2fuh h ARG 125 N 0.84 0.24 0.09 0.00 3.08 -0.74 0.39 114.38 118.29 2fuh h ARG 125 Ca 0.14 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 2fuh h ARG 125 Cb 0.64 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.64 2fuh h ARG 125 CO 0.04 0.16 -0.04 0.82 -1.07 0.00 0.00 179.97 179.88 2fuh h ILE 126 N 0.25 0.66 -0.50 2.04 2.04 -1.59 -3.28 117.51 117.13 2fuh h ILE 126 Ca 0.31 -1.31 0.11 0.00 1.00 0.00 0.00 64.86 64.97 2fuh h ILE 126 Cb 0.86 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 2fuh h ILE 126 CO -0.07 0.20 0.35 0.22 0.00 0.00 0.00 178.15 178.85 2fuh h TYR 127 N -0.98 0.22 0.07 1.37 3.20 -1.02 1.63 116.97 121.47 2fuh h TYR 127 Ca -0.01 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 2fuh h TYR 127 Cb 0.43 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 2fuh h TYR 127 CO 0.09 0.10 -0.10 -0.22 -1.64 0.00 0.00 178.16 176.39 2fuh h LYS 128 N 0.20 -0.17 0.01 1.82 3.64 -0.30 -3.36 116.57 118.41 2fuh h LYS 128 Ca 0.24 0.01 -0.40 0.00 -1.27 0.00 0.00 60.65 59.23 2fuh h LYS 128 Cb 0.66 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.45 2fuh h LYS 128 CO -0.04 -0.12 -2.44 0.25 -2.27 0.00 0.00 179.45 174.83 2fuh n THR 129 N -2.96 1.52 -2.63 1.00 -2.24 -1.11 -4.69 114.28 103.17 2fuh n THR 129 Ca -0.02 -0.53 -0.43 0.00 -2.27 0.00 0.00 64.05 60.80 2fuh n THR 129 Cb 0.09 -1.54 0.00 0.00 -2.10 0.00 0.00 70.33 66.77 2fuh n THR 129 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2fuh n ASP 130 N -3.49 4.98 0.03 3.42 8.00 0.56 -4.66 116.55 125.38 2fuh n ASP 130 Ca -0.47 -2.96 -0.21 0.00 0.71 0.00 0.00 54.79 51.86 2fuh n ASP 130 Cb 0.97 -1.63 -0.14 0.00 -0.02 0.00 0.00 41.12 40.30 2fuh n ASP 130 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2fuh h ARG 131 N 7.00 0.30 -0.08 -1.24 9.65 -1.71 -3.06 114.38 125.25 2fuh h ARG 131 Ca 0.40 -0.51 -0.01 0.00 -1.10 0.00 0.00 59.98 58.77 2fuh h ARG 131 Cb 0.82 0.19 -0.00 0.00 -1.39 0.00 0.00 29.97 29.58 2fuh h ARG 131 CO 1.43 1.22 0.03 0.22 2.80 0.00 0.00 179.97 185.66 2fuh h ASP 132 N 0.08 0.11 -0.43 -3.80 1.82 -1.93 -2.80 116.42 109.47 2fuh h ASP 132 Ca -0.39 -0.19 -0.05 0.00 -0.39 0.00 0.00 57.03 56.01 2fuh h ASP 132 Cb 2.05 -0.03 -0.02 0.00 0.68 0.00 0.00 39.33 42.02 2fuh h ASP 132 CO 0.12 0.27 0.08 0.50 -1.61 0.00 0.00 179.24 178.61 2fuh h LYS 133 N -0.06 0.71 -0.84 0.28 3.64 -1.95 -2.91 116.57 115.43 2fuh h LYS 133 Ca 0.02 -0.18 0.20 0.00 -1.27 0.00 0.00 60.65 59.42 2fuh h LYS 133 Cb 0.20 -0.09 -0.12 0.00 -0.41 0.00 0.00 32.23 31.82 2fuh h LYS 133 CO -0.00 0.73 0.30 -0.92 -2.27 0.00 0.00 179.45 177.29 2fuh h TYR 134 N 0.57 0.49 -0.61 1.91 3.20 -1.45 0.11 116.97 121.19 2fuh h TYR 134 Ca 0.13 0.04 0.10 0.00 3.14 0.00 0.00 58.73 62.15 2fuh h TYR 134 Cb 0.35 -0.09 -0.08 0.00 1.54 0.00 0.00 36.73 38.46 2fuh h TYR 134 CO 0.02 -0.07 0.20 -0.91 -1.64 0.00 0.00 178.16 175.76 2fuh h ASN 135 N 0.34 0.15 -0.98 -2.11 4.21 -1.29 -0.38 115.58 115.52 2fuh h ASN 135 Ca 0.51 0.09 0.07 0.00 1.21 0.00 0.00 56.30 58.18 2fuh h ASN 135 Cb 0.93 0.09 -0.07 0.00 -1.12 0.00 0.00 38.32 38.16 2fuh h ASN 135 CO -0.53 0.09 0.62 -0.09 -1.29 0.00 0.00 177.43 176.23 2fuh h ARG 136 N 0.35 1.09 -0.42 0.81 2.43 -0.84 -0.84 114.38 116.96 2fuh h ARG 136 Ca 0.31 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.37 2fuh h ARG 136 Cb 0.42 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2fuh h ARG 136 CO -0.34 0.72 0.05 0.82 -1.51 0.00 0.00 179.97 179.71 2fuh h ILE 137 N 1.12 1.21 0.59 1.20 1.08 -0.79 -0.76 117.51 121.16 2fuh h ILE 137 Ca 0.43 -0.80 -0.03 0.00 -0.39 0.00 0.00 64.86 64.07 2fuh h ILE 137 Cb 0.20 0.83 0.01 0.00 -3.07 0.00 0.00 36.82 34.79 2fuh h ILE 137 CO -0.18 0.28 -0.29 0.28 -0.69 0.00 0.00 178.15 177.55 2fuh h SER 138 N 0.63 -0.67 -0.09 1.72 0.02 -0.38 -1.97 113.55 112.80 2fuh h SER 138 Ca 0.14 -0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.11 2fuh h SER 138 Cb 0.32 0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 2fuh h SER 138 CO 0.01 -0.29 -0.17 0.03 -1.14 0.00 0.00 176.83 175.27 2fuh h ARG 139 N -1.15 -0.22 -0.71 3.45 3.08 -1.30 0.90 114.38 118.44 2fuh h ARG 139 Ca -0.08 0.02 0.14 0.00 0.07 0.00 0.00 59.98 60.12 2fuh h ARG 139 Cb 0.65 0.05 -0.10 0.00 0.08 0.00 0.00 29.97 30.65 2fuh h ARG 139 CO 0.13 -0.15 0.22 0.93 -1.07 0.00 0.00 179.97 180.04 2fuh h GLU 140 N -0.23 0.34 0.00 0.04 5.08 -1.21 0.11 114.58 118.71 2fuh h GLU 140 Ca 0.08 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.28 2fuh h GLU 140 Cb 0.35 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2fuh h GLU 140 CO -0.22 0.22 -0.66 -1.49 -1.00 0.00 0.00 179.01 175.87 2fuh h TRP 141 N 0.35 0.00 0.00 4.33 4.06 -0.61 -3.02 115.95 121.06 2fuh h TRP 141 Ca 0.39 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.34 2fuh h TRP 141 Cb 0.60 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.76 2fuh h TRP 141 CO -0.21 0.66 0.00 1.15 -3.56 0.00 0.00 178.44 176.47 2fuh h THR 142 N 0.00 0.00 0.01 1.49 2.02 0.34 0.68 112.91 117.45 2fuh h THR 142 Ca -0.01 -0.20 -0.15 0.00 0.77 0.00 0.00 66.41 66.82 2fuh h THR 142 Cb 1.30 1.14 0.01 0.00 -1.74 0.00 0.00 68.15 68.86 2fuh h THR 142 CO 0.09 0.00 -0.61 -0.61 0.37 0.00 0.00 175.52 174.75 2fuh h GLN 143 N 0.00 0.39 0.00 6.66 4.15 -1.24 -2.86 115.11 122.22 2fuh h GLN 143 Ca 0.00 -0.44 -0.29 0.00 0.77 0.00 0.00 58.65 58.69 2fuh h GLN 143 Cb 0.21 0.13 -0.04 0.00 0.21 0.00 0.00 27.48 27.99 2fuh h GLN 143 CO 0.00 1.11 -1.94 1.63 -1.93 0.00 0.00 178.83 177.71 2fuh n LYS 144 N -4.22 0.53 0.00 1.69 4.01 -1.01 -2.86 118.16 116.30 2fuh n LYS 144 Ca -0.11 0.23 0.00 0.00 -0.51 0.00 0.00 58.31 57.92 2fuh n LYS 144 Cb 0.68 -1.40 0.00 0.00 -0.51 0.00 0.00 35.03 33.80 2fuh n LYS 144 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 2fuh n TYR 145 N -4.24 0.00 -1.37 2.13 4.02 0.24 -3.18 117.16 114.76 2fuh n TYR 145 Ca -0.38 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.51 2fuh n TYR 145 Cb 0.73 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.98 2fuh n TYR 145 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2fuh n ALA 146 N 0.09 0.00 -1.59 -0.72 0.00 -1.20 -4.41 120.51 112.67 2fuh n ALA 146 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2fuh n ALA 146 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.62 2fuh n ALA 146 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17