#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fku h LEU 2 N 0.00 0.81 0.00 0.99 3.38 -1.94 -3.11 115.31 115.44 3fku h LEU 2 Ca 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3fku h LEU 2 Cb 0.00 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.54 3fku h LEU 2 CO 0.00 0.73 -0.69 0.49 0.09 0.00 0.00 178.44 179.06 3fku n PHE 3 N -4.32 0.23 -2.25 1.13 3.01 -1.26 -4.99 117.46 109.01 3fku n PHE 3 Ca 0.05 0.07 -0.13 0.00 1.01 0.00 0.00 57.45 58.45 3fku n PHE 3 Cb 0.17 -0.41 -0.01 0.00 -0.01 0.00 0.00 39.48 39.23 3fku n PHE 3 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3fku n GLY 4 N 1.42 -0.17 0.07 1.37 0.00 -1.18 -4.94 105.19 101.76 3fku n GLY 4 Ca 0.04 -0.34 -0.06 0.00 0.00 0.00 0.00 46.02 45.66 3fku n GLY 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fku n ALA 5 N -1.64 0.56 -1.84 4.61 0.00 -1.26 -3.69 120.51 117.25 3fku n ALA 5 Ca -0.15 -0.54 -0.41 0.00 0.00 0.00 0.00 53.44 52.34 3fku n ALA 5 Cb 0.62 0.02 -0.03 0.00 0.00 0.00 0.00 19.45 20.06 3fku n ALA 5 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3fku s ILE 6 N -2.38 2.95 -1.54 0.00 1.01 -1.26 -3.18 121.20 116.80 3fku s ILE 6 Ca -0.19 0.89 -0.10 0.00 0.00 0.00 0.00 60.65 61.25 3fku s ILE 6 Cb 0.03 -3.57 0.08 0.00 0.01 0.00 0.00 42.46 39.01 3fku s ILE 6 CO 0.28 0.19 0.72 0.00 0.00 0.00 0.00 174.94 176.12 3fku n ALA 7 N 1.49 -1.56 -2.00 9.38 0.00 -1.24 -3.44 120.51 123.14 3fku n ALA 7 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3fku n ALA 7 Cb 0.42 -3.01 0.00 0.00 0.00 0.00 0.00 19.45 16.86 3fku n ALA 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fku n GLY 8 N -1.67 1.96 0.11 0.00 0.00 -1.19 -4.83 105.19 99.58 3fku n GLY 8 Ca -0.08 -0.23 -0.15 0.00 0.00 0.00 0.00 46.02 45.56 3fku n GLY 8 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3fku n PHE 9 N 0.00 0.44 -2.31 1.61 1.16 -1.24 -4.64 117.46 112.48 3fku n PHE 9 Ca 0.00 0.12 -0.43 0.00 -1.87 0.00 0.00 57.45 55.27 3fku n PHE 9 Cb 0.00 -1.07 -0.02 0.00 -1.61 0.00 0.00 39.48 36.78 3fku n PHE 9 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 3fku s ILE 10 N -2.53 4.00 -0.91 1.97 1.01 -1.24 -4.17 121.20 119.33 3fku s ILE 10 Ca -0.20 1.14 -0.03 0.00 0.00 0.00 0.00 60.65 61.56 3fku s ILE 10 Cb 0.07 -3.98 0.25 0.00 0.01 0.00 0.00 42.46 38.82 3fku s ILE 10 CO 0.74 -0.37 2.16 -0.62 0.00 0.00 0.00 174.94 176.85 3fku n GLU 11 N 7.35 3.82 0.00 2.79 -0.58 -1.26 -3.67 120.64 129.09 3fku n GLU 11 Ca 0.16 -3.65 0.00 0.00 -0.42 0.00 0.00 57.16 53.25 3fku n GLU 11 Cb 0.46 -2.36 0.00 0.00 -0.57 0.00 0.00 31.44 28.96 3fku n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3fku n GLY 12 N 0.22 2.60 3.92 0.62 0.00 -1.26 -5.01 105.19 106.27 3fku n GLY 12 Ca 0.52 -1.81 -0.26 0.00 0.00 0.00 0.00 46.02 44.47 3fku n GLY 12 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3fku s GLY 13 N 0.00 1.58 -0.30 -0.02 0.00 -1.26 -4.97 107.32 102.35 3fku s GLY 13 Ca 0.00 -0.68 -0.15 0.00 0.00 0.00 0.00 44.72 43.89 3fku s GLY 13 CO 0.00 -0.44 0.38 -0.98 0.00 0.00 0.00 173.10 172.06 3fku s TRP 14 N -2.89 3.23 0.20 1.90 0.51 -1.26 -4.96 118.94 115.67 3fku s TRP 14 Ca 0.52 0.27 -0.16 0.00 -2.12 0.00 0.00 56.10 54.61 3fku s TRP 14 Cb -0.10 -2.62 0.20 0.00 -0.81 0.00 0.00 33.47 30.13 3fku s TRP 14 CO 0.44 -0.31 1.61 1.96 -0.51 0.00 0.00 176.95 180.15 3fku h GLN 15 N 8.28 -0.06 0.00 4.98 1.08 -2.04 -2.98 115.11 124.37 3fku h GLN 15 Ca -0.31 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 3fku h GLN 15 Cb 1.16 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.60 3fku h GLN 15 CO 0.66 -0.04 0.05 0.41 -0.95 0.00 0.00 178.83 178.96 3fku n GLY 16 N -1.44 -0.60 3.36 3.46 0.00 -1.26 -4.16 105.19 104.55 3fku n GLY 16 Ca 0.06 0.07 -0.46 0.00 0.00 0.00 0.00 46.02 45.70 3fku n GLY 16 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3fku s MET 17 N -3.15 3.44 0.10 1.61 -2.45 -1.13 -4.87 119.30 112.86 3fku s MET 17 Ca -0.01 -2.03 0.21 0.00 -1.25 0.00 0.00 55.69 52.61 3fku s MET 17 Cb 0.02 -4.50 -0.11 0.00 1.25 0.00 0.00 34.83 31.49 3fku s MET 17 CO 0.07 -1.45 0.83 1.33 1.05 0.00 0.00 175.02 176.86 3fku n VAL 18 N 4.71 0.65 -0.15 10.11 0.24 -1.26 -4.46 118.33 128.17 3fku n VAL 18 Ca 0.09 -0.58 0.10 0.00 -2.04 0.00 0.00 64.34 61.91 3fku n VAL 18 Cb 0.46 -0.36 0.30 0.00 -1.47 0.00 0.00 33.84 32.76 3fku n VAL 18 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3fku n ASP 19 N -2.64 3.69 0.00 -1.34 3.85 -1.26 -4.97 116.55 113.88 3fku n ASP 19 Ca -0.04 -2.09 0.00 0.00 -0.71 0.00 0.00 54.79 51.95 3fku n ASP 19 Cb 0.65 -0.46 0.00 0.00 -1.35 0.00 0.00 41.12 39.95 3fku n ASP 19 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3fku n GLY 20 N 1.44 0.78 0.14 6.12 0.00 -1.26 -4.94 105.19 107.47 3fku n GLY 20 Ca 0.22 -0.83 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 3fku n GLY 20 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3fku h TRP 21 N 0.00 0.83 -3.14 1.61 6.55 -1.91 -3.47 115.95 116.42 3fku h TRP 21 Ca 0.00 -0.61 -0.56 0.00 0.95 0.00 0.00 58.89 58.67 3fku h TRP 21 Cb 0.00 -0.03 -0.17 0.00 -0.86 0.00 0.00 29.16 28.09 3fku h TRP 21 CO 0.00 1.59 -0.79 0.71 -1.05 0.00 0.00 178.44 178.90 3fku s TYR 22 N -2.57 1.99 -1.18 0.49 4.12 -1.26 -5.06 117.35 113.88 3fku s TYR 22 Ca -0.13 -0.43 0.00 0.00 0.02 0.00 0.00 57.07 56.53 3fku s TYR 22 Cb 0.04 -0.97 0.00 0.00 -1.52 0.00 0.00 41.96 39.51 3fku s TYR 22 CO 0.89 0.42 0.00 0.41 0.02 0.00 0.00 175.55 177.29 3fku n GLY 23 N 0.16 -0.63 3.55 0.71 0.00 -1.26 -0.14 105.19 107.57 3fku n GLY 23 Ca -0.12 -0.74 -0.27 0.00 0.00 0.00 0.00 46.02 44.90 3fku n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fku s TYR 24 N -3.00 2.58 0.02 1.61 1.51 -0.50 -4.89 117.35 114.68 3fku s TYR 24 Ca 0.00 -0.25 0.01 0.00 -1.01 0.00 0.00 57.07 55.83 3fku s TYR 24 Cb 0.00 -1.26 -0.02 0.00 -0.11 0.00 0.00 41.96 40.58 3fku s TYR 24 CO 0.00 0.52 -0.05 -1.58 -1.11 0.00 0.00 175.55 173.33 3fku s HIS 25 N -1.72 0.41 0.10 2.71 2.46 -1.26 -1.46 115.29 116.53 3fku s HIS 25 Ca 0.24 -0.39 -0.13 0.00 0.47 0.00 0.00 55.06 55.26 3fku s HIS 25 Cb -0.09 -0.26 0.02 0.00 -0.13 0.00 0.00 32.58 32.12 3fku s HIS 25 CO 0.14 -0.10 0.32 -3.38 -2.47 0.00 0.00 174.74 169.25 3fku s HIS 26 N -1.04 -0.08 -0.04 3.88 -3.43 -0.67 -5.00 115.29 108.91 3fku s HIS 26 Ca -0.09 -0.25 0.02 0.00 -0.80 0.00 0.00 55.06 53.93 3fku s HIS 26 Cb -0.08 0.13 0.01 0.00 -1.43 0.00 0.00 32.58 31.22 3fku s HIS 26 CO -0.00 -0.62 -0.06 -1.12 -2.00 0.00 0.00 174.74 170.93 3fku s SER 27 N -2.72 1.00 0.34 7.38 0.01 -1.26 -1.97 113.70 116.47 3fku s SER 27 Ca 0.03 -0.15 0.06 0.00 1.31 0.00 0.00 55.95 57.20 3fku s SER 27 Cb 0.03 -0.41 -0.02 0.00 0.21 0.00 0.00 66.02 65.82 3fku s SER 27 CO -0.10 -0.01 0.31 0.54 0.41 0.00 0.00 173.24 174.39 3fku s ASN 28 N 0.63 1.58 0.54 2.44 4.22 0.03 -4.99 114.94 119.40 3fku s ASN 28 Ca -0.09 -1.73 0.22 0.00 -2.14 0.00 0.00 52.86 49.12 3fku s ASN 28 Cb -0.12 0.58 1.45 0.00 1.28 0.00 0.00 41.25 44.44 3fku s ASN 28 CO 0.01 -1.11 2.15 -0.33 -2.04 0.00 0.00 177.10 175.78 3fku h GLU 29 N 2.12 0.00 0.05 3.55 4.39 -2.00 -2.55 114.58 120.15 3fku h GLU 29 Ca -0.25 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.44 3fku h GLU 29 Cb 1.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.88 3fku h GLU 29 CO 0.37 0.00 -0.02 1.96 -1.16 0.00 0.00 179.01 180.15 3fku h GLN 30 N 0.00 -0.07 0.00 2.33 4.20 -1.95 -3.50 115.11 116.12 3fku h GLN 30 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 3fku h GLN 30 Cb 0.18 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.97 3fku h GLN 30 CO -0.00 0.43 0.00 0.41 -0.67 0.00 0.00 178.83 178.99 3fku n GLY 31 N 0.31 1.48 3.62 3.46 0.00 -0.96 -5.14 105.19 107.95 3fku n GLY 31 Ca -0.09 -0.32 -0.06 0.00 0.00 0.00 0.00 46.02 45.56 3fku n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3fku s SER 32 N 2.00 -0.19 0.00 1.61 0.15 -1.26 -0.79 113.70 115.22 3fku s SER 32 Ca 0.00 0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.91 3fku s SER 32 Cb 0.00 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.53 3fku s SER 32 CO 0.00 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 174.90 3fku n GLY 33 N 0.93 -0.65 3.59 9.45 0.00 -0.83 -4.98 105.19 112.70 3fku n GLY 33 Ca -0.06 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.31 3fku n GLY 33 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fku s TYR 34 N -1.96 2.81 -0.21 1.61 1.51 -1.26 -1.68 117.35 118.17 3fku s TYR 34 Ca 0.00 -0.11 -0.04 0.00 -1.01 0.00 0.00 57.07 55.91 3fku s TYR 34 Cb 0.00 -1.50 0.11 0.00 -0.11 0.00 0.00 41.96 40.46 3fku s TYR 34 CO 0.00 0.41 0.36 0.00 -1.11 0.00 0.00 175.55 175.21 3fku s ALA 35 N -1.16 -0.95 0.22 3.71 0.00 -0.54 -5.00 121.76 118.04 3fku s ALA 35 Ca 0.21 0.99 -0.30 0.00 0.00 0.00 0.00 51.96 52.85 3fku s ALA 35 Cb -0.11 -1.47 -0.09 0.00 0.00 0.00 0.00 23.12 21.46 3fku s ALA 35 CO 0.12 -1.05 1.16 0.00 0.00 0.00 0.00 175.76 175.99 3fku s ALA 36 N 2.52 3.42 -1.13 0.00 0.00 -1.26 -1.40 121.76 123.91 3fku s ALA 36 Ca 0.07 0.94 -0.22 0.00 0.00 0.00 0.00 51.96 52.75 3fku s ALA 36 Cb -0.14 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.59 3fku s ALA 36 CO -0.14 -0.31 1.76 0.34 0.00 0.00 0.00 175.76 177.42 3fku s ASP 37 N -0.22 5.96 0.10 0.00 3.68 0.80 -4.78 116.67 122.22 3fku s ASP 37 Ca 0.50 -1.68 -0.26 0.00 2.13 0.00 0.00 52.55 53.24 3fku s ASP 37 Cb -0.32 -2.58 -0.11 0.00 -1.45 0.00 0.00 42.92 38.46 3fku s ASP 37 CO 0.39 -2.05 1.68 0.11 0.13 0.00 0.00 175.17 175.42 3fku h LYS 38 N 9.35 -0.34 -0.58 4.34 6.56 -1.91 -0.39 116.57 133.61 3fku h LYS 38 Ca 0.26 0.02 0.07 0.00 -1.06 0.00 0.00 60.65 59.94 3fku h LYS 38 Cb 0.95 0.08 -0.08 0.00 -0.57 0.00 0.00 32.23 32.60 3fku h LYS 38 CO 1.34 -0.23 -0.30 -1.91 -2.06 0.00 0.00 179.45 176.30 3fku n GLU 39 N -5.29 -0.21 0.02 3.15 4.07 -1.26 -0.66 120.64 120.46 3fku n GLU 39 Ca -0.07 0.87 0.11 0.00 -0.06 0.00 0.00 57.16 58.01 3fku n GLU 39 Cb 0.21 -1.29 0.04 0.00 -0.06 0.00 0.00 31.44 30.33 3fku n GLU 39 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 3fku n SER 40 N -4.77 0.65 0.16 4.31 3.41 -0.79 -2.32 113.62 114.27 3fku n SER 40 Ca 0.03 -0.36 0.02 0.00 -0.26 0.00 0.00 58.87 58.29 3fku n SER 40 Cb 0.18 0.75 0.25 0.00 -0.26 0.00 0.00 64.21 65.13 3fku n SER 40 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3fku h THR 41 N 0.00 1.22 0.11 6.66 2.02 -0.59 -2.81 112.91 119.52 3fku h THR 41 Ca 0.00 -1.82 -0.29 0.00 0.77 0.00 0.00 66.41 65.07 3fku h THR 41 Cb 0.64 2.02 0.03 0.00 -1.74 0.00 0.00 68.15 69.10 3fku h THR 41 CO 0.00 0.49 -1.23 -0.61 0.37 0.00 0.00 175.52 174.54 3fku h GLN 42 N 0.00 0.59 0.00 6.66 5.75 -0.60 0.14 115.11 127.65 3fku h GLN 42 Ca -0.01 -0.79 -0.05 0.00 -0.15 0.00 0.00 58.65 57.66 3fku h GLN 42 Cb 0.98 0.26 -0.01 0.00 1.07 0.00 0.00 27.48 29.78 3fku h GLN 42 CO 0.07 1.35 -0.22 -0.22 -2.65 0.00 0.00 178.83 177.16 3fku h LYS 43 N 0.26 0.00 0.34 1.69 3.64 -1.53 -0.73 116.57 120.24 3fku h LYS 43 Ca -0.18 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.18 3fku h LYS 43 Cb 1.90 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.72 3fku h LYS 43 CO 0.23 0.22 -0.16 0.00 -2.27 0.00 0.00 179.45 177.47 3fku h ALA 44 N 1.78 -0.46 -0.74 5.00 0.00 -1.24 -3.05 119.26 120.55 3fku h ALA 44 Ca -0.00 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 54.84 3fku h ALA 44 Cb 0.42 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.30 3fku h ALA 44 CO 0.03 -0.52 0.34 0.82 0.00 0.00 0.00 179.25 179.92 3fku h ILE 45 N -0.93 0.76 -0.51 0.00 2.04 -0.40 -0.66 117.51 117.80 3fku h ILE 45 Ca -0.05 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 3fku h ILE 45 Cb 0.52 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 3fku h ILE 45 CO 0.08 0.10 0.28 0.44 0.00 0.00 0.00 178.15 179.05 3fku h ASP 46 N 0.54 0.62 0.04 1.72 5.19 -1.22 0.17 116.42 123.48 3fku h ASP 46 Ca 0.38 -0.04 -0.22 0.00 -0.62 0.00 0.00 57.03 56.53 3fku h ASP 46 Cb 0.49 -0.16 0.02 0.00 0.18 0.00 0.00 39.33 39.86 3fku h ASP 46 CO -0.33 0.50 -0.88 1.23 -3.12 0.00 0.00 179.24 176.64 3fku h GLY 47 N 0.78 0.60 2.00 2.75 0.00 -1.07 -2.19 103.07 105.94 3fku h GLY 47 Ca 0.18 -1.12 -0.04 0.00 0.00 0.00 0.00 47.33 46.36 3fku h GLY 47 CO -0.03 0.99 -0.18 -2.08 0.00 0.00 0.00 176.54 175.24 3fku h VAL 48 N 0.10 0.73 -0.03 4.60 2.07 -0.82 -2.25 116.25 120.65 3fku h VAL 48 Ca -0.12 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.61 3fku h VAL 48 Cb 1.58 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.80 3fku h VAL 48 CO 0.17 0.17 -0.24 0.74 0.02 0.00 0.00 177.57 178.43 3fku h THR 49 N 0.00 1.48 -0.71 2.57 2.02 -0.67 -2.97 112.91 114.63 3fku h THR 49 Ca -0.00 -1.77 0.08 0.00 0.77 0.00 0.00 66.41 65.49 3fku h THR 49 Cb 0.43 2.52 -0.05 0.00 -1.74 0.00 0.00 68.15 69.32 3fku h THR 49 CO 0.02 0.49 0.47 0.78 0.37 0.00 0.00 175.52 177.65 3fku h ASN 50 N -0.36 0.59 -0.01 4.18 2.35 -1.25 -1.33 115.58 119.75 3fku h ASN 50 Ca -0.02 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.76 3fku h ASN 50 Cb 0.93 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 39.16 3fku h ASN 50 CO 0.05 0.37 -0.10 0.50 -1.65 0.00 0.00 177.43 176.60 3fku h LYS 51 N 0.67 -0.16 -0.05 0.81 3.64 -1.36 1.41 116.57 121.53 3fku h LYS 51 Ca 0.32 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.59 3fku h LYS 51 Cb 0.37 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 3fku h LYS 51 CO -0.11 -0.11 -0.53 -0.39 -2.27 0.00 0.00 179.45 176.04 3fku h VAL 52 N -0.16 1.37 -0.01 2.00 -1.51 -1.21 -1.44 116.25 115.29 3fku h VAL 52 Ca 0.04 -1.82 -0.19 0.00 -1.23 0.00 0.00 66.70 63.49 3fku h VAL 52 Cb 0.21 1.93 -0.01 0.00 -2.13 0.00 0.00 31.29 31.29 3fku h VAL 52 CO -0.10 0.53 -0.84 0.78 -1.23 0.00 0.00 177.57 176.70 3fku h ASN 53 N 0.11 0.32 -0.33 4.19 4.21 -1.02 -2.43 115.58 120.63 3fku h ASN 53 Ca 0.00 -0.25 0.05 0.00 1.21 0.00 0.00 56.30 57.31 3fku h ASN 53 Cb 0.97 -0.10 -0.05 0.00 -1.12 0.00 0.00 38.32 38.03 3fku h ASN 53 CO 0.08 1.03 0.05 0.28 -1.29 0.00 0.00 177.43 177.57 3fku h SER 54 N 0.15 -0.02 0.39 5.81 0.02 0.24 -2.30 113.55 117.84 3fku h SER 54 Ca -0.04 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 3fku h SER 54 Cb 1.46 0.09 -0.00 0.00 0.14 0.00 0.00 62.40 64.08 3fku h SER 54 CO 0.13 0.03 -0.26 0.40 -1.14 0.00 0.00 176.83 175.98 3fku h ILE 55 N 0.16 0.00 -0.82 3.27 2.04 -1.22 -2.66 117.51 118.29 3fku h ILE 55 Ca 0.16 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.14 3fku h ILE 55 Cb 0.18 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.13 3fku h ILE 55 CO -0.22 0.00 -0.42 0.40 0.00 0.00 0.00 178.15 177.91 3fku h ILE 56 N -0.62 0.05 -0.07 -0.67 2.04 -1.37 0.42 117.51 117.29 3fku h ILE 56 Ca -0.05 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.83 3fku h ILE 56 Cb 0.51 0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 3fku h ILE 56 CO 0.04 0.00 0.06 0.44 0.00 0.00 0.00 178.15 178.69 3fku h ASP 57 N -0.09 0.00 0.23 1.72 3.45 -1.40 0.18 116.42 120.52 3fku h ASP 57 Ca 0.26 0.00 -0.18 0.00 0.43 0.00 0.00 57.03 57.54 3fku h ASP 57 Cb 0.56 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.32 3fku h ASP 57 CO -0.85 0.00 -0.69 0.11 -1.57 0.00 0.00 179.24 176.23 3fku h LYS 58 N 0.00 0.41 -2.28 3.56 1.57 0.17 -3.36 116.57 116.65 3fku h LYS 58 Ca 0.03 -0.32 -0.65 0.00 -1.87 0.00 0.00 60.65 57.84 3fku h LYS 58 Cb 0.15 0.06 -0.17 0.00 0.08 0.00 0.00 32.23 32.35 3fku h LYS 58 CO -0.00 0.95 1.35 -1.33 -0.57 0.00 0.00 179.45 179.85 3fku n MET 59 N -3.86 3.66 -0.01 3.15 2.81 0.62 -3.27 117.12 120.23 3fku n MET 59 Ca -0.04 -3.15 0.00 0.00 -1.81 0.00 0.00 57.70 52.70 3fku n MET 59 Cb 0.68 -2.39 0.00 0.00 -0.71 0.00 0.00 33.22 30.81 3fku n MET 59 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 3fku n ASN 60 N 1.00 0.23 -1.95 7.83 0.23 -1.24 -4.67 115.26 116.70 3fku n ASN 60 Ca 0.55 -1.13 -0.14 0.00 -0.53 0.00 0.00 54.58 53.33 3fku n ASN 60 Cb 0.37 -0.00 0.20 0.00 -2.08 0.00 0.00 39.78 38.26 3fku n ASN 60 CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 3fku n THR 61 N -0.06 2.73 -2.76 5.53 -1.04 -1.20 -4.99 114.28 112.49 3fku n THR 61 Ca 0.00 -1.51 -0.35 0.00 -2.04 0.00 0.00 64.05 60.15 3fku n THR 61 Cb 0.48 -0.49 -0.06 0.00 -1.82 0.00 0.00 70.33 68.43 3fku n THR 61 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 3fku s GLN 62 N -2.71 4.38 -0.26 -2.82 -0.21 -1.26 -4.95 119.66 111.83 3fku s GLN 62 Ca 0.48 1.28 -0.32 0.00 0.02 0.00 0.00 55.36 56.81 3fku s GLN 62 Cb 0.39 -2.52 -0.09 0.00 1.00 0.00 0.00 33.01 31.80 3fku s GLN 62 CO 0.10 0.09 2.16 0.34 -2.12 0.00 0.00 175.29 175.87 3fku n PHE 63 N -0.01 1.85 -2.41 0.91 7.35 -1.26 -4.90 117.46 118.98 3fku n PHE 63 Ca 0.04 0.07 -0.43 0.00 -0.76 0.00 0.00 57.45 56.38 3fku n PHE 63 Cb 0.52 -2.63 -0.02 0.00 0.35 0.00 0.00 39.48 37.69 3fku n PHE 63 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 3fku s GLU 64 N 5.99 4.28 -0.37 -4.13 0.41 -1.26 -5.01 118.70 118.60 3fku s GLU 64 Ca 1.04 1.70 -0.12 0.00 -0.41 0.00 0.00 54.97 57.18 3fku s GLU 64 Cb -0.63 -3.68 0.02 0.00 -1.78 0.00 0.00 34.13 28.06 3fku s GLU 64 CO 0.44 -0.60 0.23 0.00 -0.49 0.00 0.00 175.26 174.84 3fku s ALA 65 N 2.96 3.37 0.26 5.21 0.00 -1.26 -5.08 121.76 127.22 3fku s ALA 65 Ca 0.56 -1.64 0.12 0.00 0.00 0.00 0.00 51.96 51.00 3fku s ALA 65 Cb -0.24 -2.67 -0.05 0.00 0.00 0.00 0.00 23.12 20.16 3fku s ALA 65 CO 0.19 -1.30 -0.20 0.14 0.00 0.00 0.00 175.76 174.58 3fku s VAL 66 N 1.62 2.47 0.08 0.00 -7.23 -1.26 -5.16 120.40 110.93 3fku s VAL 66 Ca 0.04 -2.34 0.05 0.00 -1.81 0.00 0.00 61.98 57.92 3fku s VAL 66 Cb -0.19 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.44 3fku s VAL 66 CO 0.08 -0.35 -0.01 -0.83 -0.31 0.00 0.00 175.10 173.68 3fku s GLY 67 N -3.37 1.90 0.24 2.32 0.00 -1.26 -5.13 107.32 102.03 3fku s GLY 67 Ca 0.28 -1.11 0.04 0.00 0.00 0.00 0.00 44.72 43.93 3fku s GLY 67 CO 0.14 -1.08 -0.02 0.50 0.00 0.00 0.00 173.10 172.64 3fku s ARG 68 N -2.23 1.38 -0.02 2.90 0.52 -1.26 -5.16 118.95 115.08 3fku s ARG 68 Ca 0.25 -1.70 0.06 0.00 -0.52 0.00 0.00 55.73 53.82 3fku s ARG 68 Cb -0.12 -0.76 -0.01 0.00 0.52 0.00 0.00 34.95 34.58 3fku s ARG 68 CO 0.17 -0.06 -0.19 -2.00 0.02 0.00 0.00 175.30 173.25 3fku s GLU 69 N -3.82 1.64 -0.04 3.54 2.56 -1.26 -5.13 118.70 116.18 3fku s GLU 69 Ca 0.28 -0.67 -0.06 0.00 0.00 0.00 0.00 54.97 54.52 3fku s GLU 69 Cb 0.05 -1.53 0.01 0.00 2.00 0.00 0.00 34.13 34.66 3fku s GLU 69 CO 0.09 0.37 0.15 -0.06 -0.56 0.00 0.00 175.26 175.25 3fku s PHE 70 N -0.32 -0.11 0.00 5.30 0.40 -1.26 -5.10 117.98 116.89 3fku s PHE 70 Ca 0.04 0.26 0.00 0.00 -0.60 0.00 0.00 56.93 56.64 3fku s PHE 70 Cb -0.09 0.03 0.00 0.00 0.51 0.00 0.00 43.02 43.47 3fku s PHE 70 CO 0.00 -0.13 0.00 0.27 0.70 0.00 0.00 175.22 176.06 3fku n ASN 71 N 2.60 0.00 0.11 1.36 0.23 -1.26 -4.98 115.26 113.32 3fku n ASN 71 Ca -0.15 -0.59 0.12 0.00 -0.53 0.00 0.00 54.58 53.43 3fku n ASN 71 Cb 0.58 0.00 0.23 0.00 -2.08 0.00 0.00 39.78 38.51 3fku n ASN 71 CO 0.00 0.00 0.00 -1.13 -0.93 0.00 0.00 177.26 175.20 3fku h ASN 72 N 0.00 0.00 -0.18 0.53 -0.73 -2.01 -3.29 115.58 109.90 3fku h ASN 72 Ca 0.00 -0.08 0.00 0.00 1.87 0.00 0.00 56.30 58.09 3fku h ASN 72 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.59 3fku h ASN 72 CO 0.00 0.04 0.00 0.18 -0.37 0.00 0.00 177.43 177.28 3fku n LEU 73 N -2.38 2.58 -0.89 0.34 4.77 -1.26 -4.09 117.00 116.07 3fku n LEU 73 Ca 0.04 -2.13 0.07 0.00 -0.03 0.00 0.00 56.01 53.96 3fku n LEU 73 Cb 0.46 -0.17 0.22 0.00 -2.33 0.00 0.00 43.42 41.60 3fku n LEU 73 CO 0.34 0.63 0.68 -0.62 -1.33 0.00 0.00 177.39 177.10 3fku n GLU 74 N -0.08 2.99 -0.17 3.23 1.02 -1.24 -4.82 120.64 121.57 3fku n GLU 74 Ca 0.08 -2.38 0.02 0.00 -0.02 0.00 0.00 57.16 54.86 3fku n GLU 74 Cb 0.40 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.37 3fku n GLU 74 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 3fku n ARG 75 N 0.52 -0.07 0.17 3.49 3.00 -1.25 -1.20 116.66 121.33 3fku n ARG 75 Ca 0.17 0.71 0.06 0.00 -0.00 0.00 0.00 57.85 58.79 3fku n ARG 75 Cb 0.60 -1.06 0.12 0.00 0.00 0.00 0.00 32.46 32.11 3fku n ARG 75 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.63 177.70 3fku h ARG 76 N 0.00 0.00 -0.00 -0.14 0.11 -1.94 -1.60 114.38 110.81 3fku h ARG 76 Ca 0.20 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.28 3fku h ARG 76 Cb 0.31 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.39 3fku h ARG 76 CO -0.47 0.34 -0.22 0.44 0.10 0.00 0.00 179.97 180.16 3fku n ILE 77 N -3.22 0.00 -0.05 0.08 -5.35 -0.34 -2.43 119.36 108.05 3fku n ILE 77 Ca 0.02 -0.03 -0.13 0.00 -0.27 0.00 0.00 62.75 62.34 3fku n ILE 77 Cb 0.64 -0.04 -0.01 0.00 -1.74 0.00 0.00 39.64 38.49 3fku n ILE 77 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3fku h GLU 78 N 0.29 0.77 -0.29 6.28 4.81 -0.39 -2.85 114.58 123.20 3fku h GLU 78 Ca 0.00 -0.49 -0.03 0.00 -0.13 0.00 0.00 59.36 58.71 3fku h GLU 78 Cb 0.45 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 3fku h GLU 78 CO 0.00 1.12 0.07 -0.97 -0.73 0.00 0.00 179.01 178.50 3fku h ASN 79 N 0.59 0.45 -0.67 1.04 -1.24 -1.25 -2.14 115.58 112.36 3fku h ASN 79 Ca 0.01 -0.23 0.06 0.00 0.71 0.00 0.00 56.30 56.84 3fku h ASN 79 Cb 1.14 -0.12 -0.05 0.00 0.73 0.00 0.00 38.32 40.02 3fku h ASN 79 CO 0.12 0.56 0.37 0.25 -1.29 0.00 0.00 177.43 177.44 3fku h LEU 80 N 0.31 0.55 -1.69 0.34 6.46 -1.56 0.68 115.31 120.40 3fku h LEU 80 Ca 0.09 0.03 0.08 0.00 -0.12 0.00 0.00 57.88 57.96 3fku h LEU 80 Cb 0.30 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.12 3fku h LEU 80 CO 0.00 0.36 0.34 -1.13 -0.62 0.00 0.00 178.44 177.39 3fku h ASN 81 N 0.69 0.32 0.05 1.25 -1.24 -1.29 -1.56 115.58 113.80 3fku h ASN 81 Ca 0.30 0.00 -0.20 0.00 0.71 0.00 0.00 56.30 57.11 3fku h ASN 81 Cb 0.18 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.16 3fku h ASN 81 CO -0.18 0.21 -1.03 0.50 -1.29 0.00 0.00 177.43 175.63 3fku h LYS 82 N 0.37 0.11 -0.57 6.67 1.63 -0.12 -2.94 116.57 121.73 3fku h LYS 82 Ca 0.23 -0.19 0.17 0.00 -0.85 0.00 0.00 60.65 60.00 3fku h LYS 82 Cb 0.42 0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.10 3fku h LYS 82 CO -0.06 1.09 0.45 0.87 -3.45 0.00 0.00 179.45 178.36 3fku h LYS 83 N -0.68 0.00 0.24 1.90 1.79 0.28 0.29 116.57 120.39 3fku h LYS 83 Ca -0.25 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.21 3fku h LYS 83 Cb 1.44 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.10 3fku h LYS 83 CO -0.04 0.00 -0.11 1.98 -1.08 0.00 0.00 179.45 180.20 3fku h MET 84 N 0.00 -0.30 -0.37 3.15 1.85 -1.37 -2.45 114.93 115.43 3fku h MET 84 Ca 0.27 0.02 -0.11 0.00 -0.61 0.00 0.00 59.70 59.27 3fku h MET 84 Cb 1.18 0.07 -0.01 0.00 0.43 0.00 0.00 31.60 33.26 3fku h MET 84 CO -0.00 0.04 -0.23 0.93 -0.40 0.00 0.00 176.91 177.25 3fku h GLU 85 N -0.93 0.74 0.30 0.39 5.08 -1.10 -0.85 114.58 118.20 3fku h GLU 85 Ca -0.03 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.02 3fku h GLU 85 Cb 0.49 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3fku h GLU 85 CO 0.05 0.90 -0.15 -0.44 -1.00 0.00 0.00 179.01 178.37 3fku h ASP 86 N 0.64 -0.36 -0.25 1.42 3.45 -1.15 -2.61 116.42 117.56 3fku h ASP 86 Ca 0.09 0.01 0.06 0.00 0.43 0.00 0.00 57.03 57.62 3fku h ASP 86 Cb 0.73 0.10 -0.05 0.00 -0.56 0.00 0.00 39.33 39.55 3fku h ASP 86 CO 0.06 -0.25 -0.04 0.61 -1.57 0.00 0.00 179.24 178.05 3fku n GLY 87 N -1.21 -0.39 0.19 2.75 0.00 -0.92 0.99 105.19 106.60 3fku n GLY 87 Ca -0.05 0.26 -0.19 0.00 0.00 0.00 0.00 46.02 46.03 3fku n GLY 87 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3fku h PHE 88 N 0.00 0.96 0.00 1.61 -1.00 -1.12 -2.66 116.94 114.73 3fku h PHE 88 Ca 0.13 -0.51 -0.02 0.00 2.81 0.00 0.00 57.97 60.38 3fku h PHE 88 Cb 0.23 -0.11 -0.00 0.00 3.61 0.00 0.00 35.95 39.67 3fku h PHE 88 CO -0.17 1.34 -0.09 -0.07 -1.61 0.00 0.00 178.31 177.71 3fku h LEU 89 N 0.30 0.00 -0.13 1.54 3.38 0.10 0.24 115.31 120.74 3fku h LEU 89 Ca -0.11 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 3fku h LEU 89 Cb 1.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.33 3fku h LEU 89 CO 0.18 0.09 -0.25 0.44 0.09 0.00 0.00 178.44 179.00 3fku h ASP 90 N 0.00 0.45 -0.58 -0.43 3.32 -1.24 -1.16 116.42 116.78 3fku h ASP 90 Ca -0.00 -0.55 -0.02 0.00 0.02 0.00 0.00 57.03 56.49 3fku h ASP 90 Cb 0.37 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 3fku h ASP 90 CO 0.01 0.91 0.30 0.58 -1.72 0.00 0.00 179.24 179.33 3fku h VAL 91 N 0.00 1.20 0.00 -1.35 2.07 -0.44 0.51 116.25 118.24 3fku h VAL 91 Ca 0.01 -0.52 -0.15 0.00 0.82 0.00 0.00 66.70 66.86 3fku h VAL 91 Cb 0.83 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 3fku h VAL 91 CO 0.06 0.22 -0.71 -0.50 0.02 0.00 0.00 177.57 176.65 3fku h TRP 92 N 0.78 0.00 -0.04 1.57 4.06 -0.77 -2.64 115.95 118.92 3fku h TRP 92 Ca 0.20 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.14 3fku h TRP 92 Cb 0.07 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.23 3fku h TRP 92 CO -0.01 0.71 -0.03 1.15 -3.56 0.00 0.00 178.44 176.70 3fku h THR 93 N 0.00 1.36 -0.91 1.49 2.02 -0.92 -1.38 112.91 114.56 3fku h THR 93 Ca -0.01 -1.13 0.18 0.00 0.77 0.00 0.00 66.41 66.22 3fku h THR 93 Cb 1.49 2.05 -0.11 0.00 -1.74 0.00 0.00 68.15 69.84 3fku h THR 93 CO 0.09 0.30 0.49 0.22 0.37 0.00 0.00 175.52 176.99 3fku h TYR 94 N -0.36 0.85 -0.15 3.16 3.20 -0.96 0.54 116.97 123.24 3fku h TYR 94 Ca 0.01 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.87 3fku h TYR 94 Cb 0.50 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.54 3fku h TYR 94 CO 0.09 0.14 -0.09 -0.91 -1.64 0.00 0.00 178.16 175.75 3fku h ASN 95 N 0.62 0.33 -0.68 -2.11 2.35 -1.31 -0.17 115.58 114.60 3fku h ASN 95 Ca 0.53 -0.43 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 3fku h ASN 95 Cb 0.84 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 39.09 3fku h ASN 95 CO -0.41 0.69 0.29 0.00 -1.65 0.00 0.00 177.43 176.35 3fku h ALA 96 N 0.65 0.89 -0.45 -0.83 0.00 -0.98 -1.48 119.26 117.06 3fku h ALA 96 Ca 0.03 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 3fku h ALA 96 Cb 0.57 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3fku h ALA 96 CO 0.02 0.49 -0.16 1.49 0.00 0.00 0.00 179.25 181.09 3fku h GLU 97 N 0.96 0.90 0.06 0.00 4.81 -0.68 -1.88 114.58 118.76 3fku h GLU 97 Ca 0.23 -0.37 -0.16 0.00 -0.13 0.00 0.00 59.36 58.93 3fku h GLU 97 Cb 0.18 -0.04 0.02 0.00 0.63 0.00 0.00 28.75 29.53 3fku h GLU 97 CO -0.02 1.02 -0.66 1.25 -0.73 0.00 0.00 179.01 179.87 3fku h LEU 98 N 0.73 0.47 -1.07 1.64 6.46 -1.08 -2.93 115.31 119.54 3fku h LEU 98 Ca 0.11 -0.85 0.08 0.00 -0.12 0.00 0.00 57.88 57.09 3fku h LEU 98 Cb 0.72 -0.15 -0.07 0.00 -0.73 0.00 0.00 40.66 40.43 3fku h LEU 98 CO 0.05 1.27 0.62 0.25 -0.62 0.00 0.00 178.44 180.02 3fku h LEU 99 N -0.26 0.96 -0.37 2.25 5.85 -1.17 0.27 115.31 122.85 3fku h LEU 99 Ca -0.10 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 3fku h LEU 99 Cb 1.43 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 3fku h LEU 99 CO 0.13 0.60 0.21 0.58 -0.34 0.00 0.00 178.44 179.62 3fku h VAL 100 N 1.08 1.13 -0.44 1.05 2.07 -1.44 -2.11 116.25 117.59 3fku h VAL 100 Ca 0.43 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.64 3fku h VAL 100 Cb 0.24 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 3fku h VAL 100 CO -0.18 0.13 0.29 0.25 0.02 0.00 0.00 177.57 178.09 3fku h LEU 101 N 0.47 0.47 0.00 2.57 5.85 -0.55 -0.71 115.31 123.42 3fku h LEU 101 Ca 0.13 -0.01 -0.23 0.00 0.84 0.00 0.00 57.88 58.61 3fku h LEU 101 Cb 0.03 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 3fku h LEU 101 CO -0.02 0.34 -1.40 0.24 -0.34 0.00 0.00 178.44 177.26 3fku h MET 102 N 0.56 0.00 -0.00 1.25 2.86 -0.46 -3.11 114.93 116.02 3fku h MET 102 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 3fku h MET 102 Cb -0.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.65 3fku h MET 102 CO -0.04 0.52 -0.38 0.39 1.06 0.00 0.00 176.91 178.47 3fku n GLU 103 N -3.07 0.51 -0.03 1.72 -0.58 -0.81 -2.65 120.64 115.72 3fku n GLU 103 Ca -0.10 -0.31 -0.14 0.00 -0.42 0.00 0.00 57.16 56.19 3fku n GLU 103 Cb 0.94 -1.49 -0.11 0.00 -0.57 0.00 0.00 31.44 30.22 3fku n GLU 103 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 3fku h ASN 104 N 0.74 0.17 -0.33 1.62 4.21 -1.18 -2.64 115.58 118.17 3fku h ASN 104 Ca 0.00 -0.68 0.04 0.00 1.21 0.00 0.00 56.30 56.86 3fku h ASN 104 Cb 0.51 -0.05 -0.04 0.00 -1.12 0.00 0.00 38.32 37.62 3fku h ASN 104 CO 0.00 0.83 0.12 -0.08 -1.29 0.00 0.00 177.43 177.01 3fku h GLU 105 N -0.47 0.26 0.21 0.81 4.81 -1.51 -2.47 114.58 116.21 3fku h GLU 105 Ca -0.01 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 3fku h GLU 105 Cb 0.83 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.15 3fku h GLU 105 CO 0.03 0.17 -0.10 0.00 -0.73 0.00 0.00 179.01 178.38 3fku h ARG 106 N 0.27 -0.27 -0.27 1.92 3.08 -1.63 -2.49 114.38 114.98 3fku h ARG 106 Ca 0.15 0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.26 3fku h ARG 106 Cb 0.12 0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.15 3fku h ARG 106 CO -0.15 -0.11 -0.55 1.15 -1.07 0.00 0.00 179.97 179.24 3fku h THR 107 N -0.38 0.00 -0.77 2.04 2.02 -1.31 0.32 112.91 114.83 3fku h THR 107 Ca -0.03 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.28 3fku h THR 107 Cb 0.29 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.65 3fku h THR 107 CO 0.05 0.00 0.51 -0.07 0.37 0.00 0.00 175.52 176.38 3fku h LEU 108 N -0.49 0.51 -0.21 2.58 3.38 -1.37 0.13 115.31 119.84 3fku h LEU 108 Ca 0.05 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 3fku h LEU 108 Cb 0.64 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 3fku h LEU 108 CO -0.52 0.28 -0.49 0.44 0.09 0.00 0.00 178.44 178.24 3fku h ASP 109 N 0.55 0.00 -0.40 -0.43 3.32 -0.82 -2.30 116.42 116.34 3fku h ASP 109 Ca 0.37 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.39 3fku h ASP 109 Cb 0.68 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 3fku h ASP 109 CO -0.14 0.49 0.10 0.15 -1.72 0.00 0.00 179.24 178.13 3fku h PHE 110 N 0.00 0.66 -0.02 4.55 3.57 0.22 -1.71 116.94 124.21 3fku h PHE 110 Ca -0.00 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.42 3fku h PHE 110 Cb 1.29 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.84 3fku h PHE 110 CO 0.00 0.63 0.01 0.45 -2.23 0.00 0.00 178.31 177.17 3fku h HIS 111 N 0.50 0.02 -0.50 0.41 3.86 -1.20 -0.97 115.15 117.28 3fku h HIS 111 Ca 0.13 -0.00 0.15 0.00 -1.16 0.00 0.00 60.37 59.48 3fku h HIS 111 Cb 0.30 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.74 3fku h HIS 111 CO 0.02 0.11 0.46 0.22 0.86 0.00 0.00 177.93 179.59 3fku h ASP 112 N -0.07 0.00 0.13 2.45 3.58 -1.31 -0.73 116.42 120.48 3fku h ASP 112 Ca 0.01 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 3fku h ASP 112 Cb 0.09 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.15 3fku h ASP 112 CO -0.00 0.00 -0.06 -1.28 -2.88 0.00 0.00 179.24 175.01 3fku h SER 113 N 0.00 -0.15 -0.84 2.28 0.87 -0.75 -3.23 113.55 111.73 3fku h SER 113 Ca 0.24 0.01 0.27 0.00 -1.23 0.00 0.00 61.79 61.07 3fku h SER 113 Cb 1.16 0.04 -0.15 0.00 -0.44 0.00 0.00 62.40 63.00 3fku h SER 113 CO -0.00 0.14 0.15 0.59 -0.53 0.00 0.00 176.83 177.19 3fku n ASN 114 N -3.89 0.02 0.40 6.23 3.02 -0.33 -0.14 115.26 120.58 3fku n ASN 114 Ca -0.02 1.42 -0.16 0.00 -0.03 0.00 0.00 54.58 55.79 3fku n ASN 114 Cb 0.07 -0.57 -0.08 0.00 -0.61 0.00 0.00 39.78 38.60 3fku n ASN 114 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3fku h VAL 115 N 0.00 0.00 -0.78 2.41 2.07 -1.60 -2.39 116.25 115.95 3fku h VAL 115 Ca 0.57 -0.07 0.17 0.00 0.82 0.00 0.00 66.70 68.20 3fku h VAL 115 Cb 1.31 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.94 3fku h VAL 115 CO -0.75 0.00 -0.07 0.50 0.02 0.00 0.00 177.57 177.27 3fku h LYS 116 N -1.10 0.05 0.00 1.57 3.11 -0.55 0.54 116.57 120.19 3fku h LYS 116 Ca -0.11 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.73 3fku h LYS 116 Cb 0.79 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.01 3fku h LYS 116 CO 0.17 0.03 0.00 0.09 -2.81 0.00 0.00 179.45 176.94 3fku n ASN 117 N -5.42 0.00 -0.12 4.20 3.02 -0.08 -1.13 115.26 115.73 3fku n ASN 117 Ca 0.13 -0.49 -0.24 0.00 -0.03 0.00 0.00 54.58 53.96 3fku n ASN 117 Cb 0.47 -0.07 -0.11 0.00 -0.61 0.00 0.00 39.78 39.46 3fku n ASN 117 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3fku n LEU 118 N -1.07 2.45 -0.13 3.41 7.94 0.17 -3.59 117.00 126.18 3fku n LEU 118 Ca 0.14 0.12 -0.05 0.00 -1.11 0.00 0.00 56.01 55.12 3fku n LEU 118 Cb 0.09 -0.89 0.02 0.00 0.53 0.00 0.00 43.42 43.17 3fku n LEU 118 CO 0.12 0.74 0.77 0.22 -1.11 0.00 0.00 177.39 178.13 3fku h TYR 119 N -0.49 -0.27 -0.38 1.96 3.20 -0.67 -2.65 116.97 117.67 3fku h TYR 119 Ca -0.61 0.04 -0.13 0.00 3.14 0.00 0.00 58.73 61.17 3fku h TYR 119 Cb 1.75 0.18 -0.01 0.00 1.54 0.00 0.00 36.73 40.19 3fku h TYR 119 CO -0.02 -0.20 -0.28 -0.44 -1.64 0.00 0.00 178.16 175.59 3fku h ASP 120 N -0.02 0.83 -0.35 -2.11 3.32 -1.32 -1.48 116.42 115.29 3fku h ASP 120 Ca 0.20 -0.33 0.08 0.00 0.02 0.00 0.00 57.03 57.00 3fku h ASP 120 Cb 0.33 -0.23 -0.08 0.00 0.22 0.00 0.00 39.33 39.57 3fku h ASP 120 CO -0.44 1.06 -0.17 0.50 -1.72 0.00 0.00 179.24 178.46 3fku h LYS 121 N 0.68 -0.11 -0.28 3.56 3.64 -1.55 -1.39 116.57 121.13 3fku h LYS 121 Ca 0.08 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3fku h LYS 121 Cb 0.81 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.64 3fku h LYS 121 CO 0.07 -0.07 0.17 0.28 -2.27 0.00 0.00 179.45 177.62 3fku h VAL 122 N -0.11 1.11 -0.96 2.00 2.07 -1.16 -2.91 116.25 116.29 3fku h VAL 122 Ca 0.18 -0.26 0.15 0.00 0.82 0.00 0.00 66.70 67.58 3fku h VAL 122 Cb 0.38 0.77 -0.09 0.00 -1.52 0.00 0.00 31.29 30.83 3fku h VAL 122 CO -0.42 0.11 0.57 -0.09 0.02 0.00 0.00 177.57 177.76 3fku h ARG 123 N 0.36 0.80 0.00 1.57 2.43 -0.60 -0.59 114.38 118.35 3fku h ARG 123 Ca 0.10 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 3fku h ARG 123 Cb 0.03 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 3fku h ARG 123 CO -0.02 0.53 -0.41 -0.07 -1.51 0.00 0.00 179.97 178.49 3fku h LEU 124 N 0.82 0.00 0.00 3.80 3.38 -1.12 -3.36 115.31 118.83 3fku h LEU 124 Ca 0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.48 3fku h LEU 124 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3fku h LEU 124 CO -0.33 0.41 0.00 0.00 0.09 0.00 0.00 178.44 178.62 3fku n GLN 125 N -3.53 0.00 -1.78 1.13 6.02 -0.26 -4.47 117.38 114.50 3fku n GLN 125 Ca -0.00 0.34 -0.42 0.00 -0.01 0.00 0.00 57.00 56.91 3fku n GLN 125 Cb 0.54 -1.05 -0.03 0.00 1.02 0.00 0.00 30.24 30.72 3fku n GLN 125 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3fku s LEU 126 N -3.05 4.38 0.00 1.08 1.43 -1.03 -4.59 118.68 116.90 3fku s LEU 126 Ca 0.00 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 55.82 3fku s LEU 126 Cb 0.00 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.64 3fku s LEU 126 CO 0.00 -0.96 0.00 0.54 0.23 0.00 0.00 176.35 176.16 3fku n ARG 127 N 5.12 0.00 -0.08 1.70 1.74 -1.26 -4.50 116.66 119.38 3fku n ARG 127 Ca 0.17 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.25 3fku n ARG 127 Cb 0.38 0.00 0.04 0.00 -1.02 0.00 0.00 32.46 31.86 3fku n ARG 127 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3fku n ASP 128 N 0.00 1.34 -0.20 0.55 5.68 -1.26 -2.57 116.55 120.09 3fku n ASP 128 Ca 0.00 -2.08 0.14 0.00 -0.50 0.00 0.00 54.79 52.35 3fku n ASP 128 Cb 0.00 -0.46 0.54 0.00 -1.14 0.00 0.00 41.12 40.06 3fku n ASP 128 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3fku n ASN 129 N 0.02 0.75 -4.08 -1.12 3.02 -1.26 -4.92 115.26 107.67 3fku n ASN 129 Ca 0.03 -0.81 -0.13 0.00 -0.03 0.00 0.00 54.58 53.64 3fku n ASN 129 Cb 0.31 0.01 -0.10 0.00 -0.61 0.00 0.00 39.78 39.39 3fku n ASN 129 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3fku s ALA 130 N -2.40 1.28 -0.15 5.41 0.00 -1.06 -1.31 121.76 123.53 3fku s ALA 130 Ca 0.29 -1.76 -0.08 0.00 0.00 0.00 0.00 51.96 50.42 3fku s ALA 130 Cb 0.20 1.40 -0.04 0.00 0.00 0.00 0.00 23.12 24.67 3fku s ALA 130 CO 0.47 -0.60 0.13 0.15 0.00 0.00 0.00 175.76 175.91 3fku s LYS 131 N -4.05 3.71 -0.63 0.00 1.02 0.67 -4.90 119.74 115.56 3fku s LYS 131 Ca 0.39 -0.17 -0.28 0.00 0.02 0.00 0.00 55.97 55.93 3fku s LYS 131 Cb 0.06 -3.27 0.03 0.00 -0.52 0.00 0.00 37.83 34.14 3fku s LYS 131 CO 0.14 0.60 1.24 -2.00 -0.92 0.00 0.00 175.35 174.40 3fku s GLU 132 N -0.50 3.40 0.45 1.68 2.12 -1.26 -2.17 118.70 122.41 3fku s GLU 132 Ca 0.12 0.12 0.25 0.00 0.36 0.00 0.00 54.97 55.82 3fku s GLU 132 Cb -0.12 -4.07 0.81 0.00 0.26 0.00 0.00 34.13 31.01 3fku s GLU 132 CO 0.02 -1.84 1.78 -0.07 -0.54 0.00 0.00 175.26 174.60 3fku h LEU 133 N 12.35 0.00 0.00 2.70 4.07 -1.81 -3.47 115.31 129.15 3fku h LEU 133 Ca -0.26 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.70 3fku h LEU 133 Cb 1.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.80 3fku h LEU 133 CO 1.21 0.17 0.00 0.61 -1.08 0.00 0.00 178.44 179.36 3fku n GLY 134 N 0.43 0.50 0.45 0.83 0.00 -1.26 -4.90 105.19 101.25 3fku n GLY 134 Ca 0.01 -0.80 0.06 0.00 0.00 0.00 0.00 46.02 45.29 3fku n GLY 134 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3fku n ASN 135 N 1.46 1.51 0.00 1.61 6.94 -1.26 -4.93 115.26 120.58 3fku n ASN 135 Ca 0.00 -2.89 0.00 0.00 -0.02 0.00 0.00 54.58 51.67 3fku n ASN 135 Cb 0.00 -0.38 0.00 0.00 -2.36 0.00 0.00 39.78 37.04 3fku n ASN 135 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3fku n GLY 136 N -0.81 0.57 3.17 4.83 0.00 -1.26 -4.29 105.19 107.40 3fku n GLY 136 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 3fku n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fku s PHE 138 N 0.46 3.45 -0.09 0.00 0.40 -1.26 -2.27 117.98 118.67 3fku s PHE 138 Ca -0.17 0.28 -0.04 0.00 -0.60 0.00 0.00 56.93 56.40 3fku s PHE 138 Cb -0.17 -1.91 0.04 0.00 0.51 0.00 0.00 43.02 41.49 3fku s PHE 138 CO 0.07 0.10 0.20 -2.00 0.70 0.00 0.00 175.22 174.29 3fku s GLU 139 N -4.31 0.15 0.19 0.44 2.12 -0.92 -4.92 118.70 111.44 3fku s GLU 139 Ca 0.40 0.48 -0.28 0.00 0.36 0.00 0.00 54.97 55.93 3fku s GLU 139 Cb -0.10 -0.15 -0.08 0.00 0.26 0.00 0.00 34.13 34.06 3fku s GLU 139 CO 0.35 -0.18 0.88 -0.06 -0.54 0.00 0.00 175.26 175.71 3fku s PHE 140 N 1.36 3.92 -0.01 5.30 0.40 -1.26 -0.24 117.98 127.45 3fku s PHE 140 Ca -0.08 1.78 -0.11 0.00 -0.60 0.00 0.00 56.93 57.92 3fku s PHE 140 Cb -0.11 -2.91 -0.06 0.00 0.51 0.00 0.00 43.02 40.45 3fku s PHE 140 CO -0.07 0.43 0.70 1.88 0.70 0.00 0.00 175.22 178.86 3fku h TYR 141 N 4.49 -0.38 -4.06 0.36 -1.99 -1.55 -3.44 116.97 110.40 3fku h TYR 141 Ca -0.45 -0.01 -0.53 0.00 2.00 0.00 0.00 58.73 59.74 3fku h TYR 141 Cb 1.20 0.13 0.11 0.00 2.00 0.00 0.00 36.73 40.17 3fku h TYR 141 CO 0.63 -0.24 0.52 -3.38 -0.00 0.00 0.00 178.16 175.69 3fku s HIS 142 N -3.10 2.46 0.32 4.88 -3.43 -1.26 -4.90 115.29 110.26 3fku s HIS 142 Ca -0.06 1.47 -0.29 0.00 -0.80 0.00 0.00 55.06 55.38 3fku s HIS 142 Cb 0.01 -3.57 -0.10 0.00 -1.43 0.00 0.00 32.58 27.48 3fku s HIS 142 CO 0.18 -2.29 1.29 0.15 -2.00 0.00 0.00 174.74 172.06 3fku s LYS 143 N -3.03 4.39 -0.28 -0.38 1.02 -1.26 -5.00 119.74 115.19 3fku s LYS 143 Ca 0.72 2.16 0.01 0.00 0.02 0.00 0.00 55.97 58.88 3fku s LYS 143 Cb -0.34 -3.09 0.08 0.00 -0.52 0.00 0.00 37.83 33.96 3fku s LYS 143 CO 0.38 -0.15 0.03 0.00 -0.92 0.00 0.00 175.35 174.69 3fku s ASP 145 N 1.41 2.68 0.55 0.00 1.47 -1.26 -4.77 116.67 116.74 3fku s ASP 145 Ca 0.03 0.17 0.23 0.00 1.18 0.00 0.00 52.55 54.16 3fku s ASP 145 Cb -0.18 -0.12 1.51 0.00 -0.34 0.00 0.00 42.92 43.79 3fku s ASP 145 CO -0.13 -3.00 2.18 0.78 0.68 0.00 0.00 175.17 175.68 3fku h ASN 146 N -1.83 0.00 0.05 2.11 -0.26 -2.00 -1.48 115.58 112.17 3fku h ASN 146 Ca -0.44 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.30 3fku h ASN 146 Cb 1.22 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.48 3fku h ASN 146 CO 0.31 0.02 -0.02 -0.08 -1.06 0.00 0.00 177.43 176.60 3fku h GLU 147 N 0.00 -0.06 -0.94 0.81 4.81 -2.00 -2.89 114.58 114.31 3fku h GLU 147 Ca -0.00 0.00 0.27 0.00 -0.13 0.00 0.00 59.36 59.51 3fku h GLU 147 Cb 0.05 0.01 -0.16 0.00 0.63 0.00 0.00 28.75 29.28 3fku h GLU 147 CO 0.00 0.57 0.20 0.00 -0.73 0.00 0.00 179.01 179.05 3fku h MET 149 N 0.10 -0.59 -0.94 0.00 2.86 -1.21 -1.97 114.93 113.17 3fku h MET 149 Ca 0.61 0.04 0.27 0.00 -2.06 0.00 0.00 59.70 58.56 3fku h MET 149 Cb 1.32 0.13 -0.14 0.00 0.06 0.00 0.00 31.60 32.97 3fku h MET 149 CO -0.77 -0.37 0.41 0.93 1.06 0.00 0.00 176.91 178.17 3fku h GLU 150 N -0.67 0.29 0.06 1.72 4.39 -1.22 0.57 114.58 119.72 3fku h GLU 150 Ca -0.06 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.63 3fku h GLU 150 Cb 0.50 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 3fku h GLU 150 CO 0.10 0.19 -0.12 0.66 -1.16 0.00 0.00 179.01 178.68 3fku h SER 151 N 0.30 -0.34 -0.60 1.42 4.64 -0.82 0.74 113.55 118.88 3fku h SER 151 Ca 0.63 0.04 -0.05 0.00 -0.47 0.00 0.00 61.79 61.94 3fku h SER 151 Cb 1.34 0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 63.54 3fku h SER 151 CO -0.61 -0.18 0.18 0.58 -0.87 0.00 0.00 176.83 175.92 3fku h VAL 152 N -0.24 1.24 0.74 0.95 2.07 -0.26 0.67 116.25 121.42 3fku h VAL 152 Ca 0.03 -0.86 -0.04 0.00 0.82 0.00 0.00 66.70 66.65 3fku h VAL 152 Cb 0.26 0.57 0.01 0.00 -1.52 0.00 0.00 31.29 30.61 3fku h VAL 152 CO -0.08 0.33 -0.35 -0.09 0.02 0.00 0.00 177.57 177.40 3fku h ARG 153 N 0.94 -0.95 -0.00 1.57 2.43 0.66 -3.11 114.38 115.92 3fku h ARG 153 Ca 0.21 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 3fku h ARG 153 Cb 0.30 0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 3fku h ARG 153 CO -0.00 -0.62 -0.00 0.27 -1.51 0.00 0.00 179.97 178.11 3fku n ASN 154 N -5.45 0.00 0.00 -3.80 2.04 0.25 -4.90 115.26 103.41 3fku n ASN 154 Ca -0.13 -0.10 0.00 0.00 -0.44 0.00 0.00 54.58 53.91 3fku n ASN 154 Cb 0.40 -0.30 0.00 0.00 -2.53 0.00 0.00 39.78 37.35 3fku n ASN 154 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3fku n GLY 155 N 1.30 1.12 2.31 4.83 0.00 0.20 -4.99 105.19 109.96 3fku n GLY 155 Ca 0.14 -0.35 -0.18 0.00 0.00 0.00 0.00 46.02 45.63 3fku n GLY 155 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fku n THR 156 N -2.20 2.13 -1.99 2.61 -2.24 0.79 -4.98 114.28 108.39 3fku n THR 156 Ca 0.00 -3.96 -0.37 0.00 -2.27 0.00 0.00 64.05 57.46 3fku n THR 156 Cb 0.09 -0.49 0.03 0.00 -2.10 0.00 0.00 70.33 67.86 3fku n THR 156 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3fku s TYR 157 N -3.61 2.44 -0.30 4.78 5.04 -1.15 -4.79 117.35 119.75 3fku s TYR 157 Ca 0.44 1.48 0.00 0.00 -2.44 0.00 0.00 57.07 56.55 3fku s TYR 157 Cb 0.39 -3.55 0.09 0.00 0.35 0.00 0.00 41.96 39.25 3fku s TYR 157 CO -0.01 -2.28 0.07 0.16 -1.34 0.00 0.00 175.55 172.15 3fku s ASP 158 N -1.39 4.07 0.03 4.32 -4.77 -1.26 -5.00 116.67 112.66 3fku s ASP 158 Ca 0.74 -1.63 -0.06 0.00 -3.30 0.00 0.00 52.55 48.31 3fku s ASP 158 Cb -0.33 -1.01 -0.01 0.00 -1.09 0.00 0.00 42.92 40.48 3fku s ASP 158 CO 0.37 -0.38 0.34 0.00 0.70 0.00 0.00 175.17 176.19 3fku n TYR 159 N 4.74 -0.08 0.30 2.11 4.19 -1.26 -2.22 117.16 124.95 3fku n TYR 159 Ca -0.02 0.22 0.19 0.00 3.31 0.00 0.00 57.90 61.60 3fku n TYR 159 Cb 0.43 -0.42 0.89 0.00 0.49 0.00 0.00 39.34 40.73 3fku n TYR 159 CO 0.00 0.00 0.00 -1.35 0.91 0.00 0.00 176.86 176.42 3fku h PRO 160 N 0.00 0.00 -0.03 2.98 0.11 -1.97 0.97 132.00 134.06 3fku h PRO 160 Ca 0.03 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.08 3fku h PRO 160 Cb 0.07 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.17 3fku h PRO 160 CO -0.17 0.00 -0.24 0.37 -0.21 0.00 0.00 178.00 177.75 3fku h GLN 161 N 0.00 0.05 -0.08 1.05 4.15 -1.90 -3.24 115.11 115.14 3fku h GLN 161 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 3fku h GLN 161 Cb 0.31 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.99 3fku h GLN 161 CO 0.00 0.29 0.00 0.66 -1.93 0.00 0.00 178.83 177.85 3fku n TYR 162 N -4.24 0.11 0.33 3.99 4.01 0.32 -4.78 117.16 116.91 3fku n TYR 162 Ca -0.02 -0.27 -0.15 0.00 -0.16 0.00 0.00 57.90 57.31 3fku n TYR 162 Cb 0.31 -0.02 -0.07 0.00 -0.31 0.00 0.00 39.34 39.24 3fku n TYR 162 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3fku h SER 163 N 0.93 -0.92 -0.85 7.72 4.64 -1.55 -0.00 113.55 123.53 3fku h SER 163 Ca 0.00 0.05 0.17 0.00 -0.47 0.00 0.00 61.79 61.53 3fku h SER 163 Cb 0.42 0.26 -0.16 0.00 -0.31 0.00 0.00 62.40 62.61 3fku h SER 163 CO 0.00 -0.56 -0.23 1.05 -0.87 0.00 0.00 176.83 176.21 3fku h GLU 164 N -0.91 -0.01 -0.73 4.77 -0.00 -1.86 0.80 114.58 116.65 3fku h GLU 164 Ca -0.08 0.00 0.09 0.00 -0.00 0.00 0.00 59.36 59.37 3fku h GLU 164 Cb 0.72 0.00 -0.07 0.00 -0.00 0.00 0.00 28.75 29.41 3fku h GLU 164 CO 0.09 -0.01 0.38 1.49 -0.00 0.00 0.00 179.01 180.96 3fku h GLU 165 N -0.01 0.64 0.02 1.06 4.81 -1.86 -1.97 114.58 117.27 3fku h GLU 165 Ca 0.39 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.58 3fku h GLU 165 Cb 0.62 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.85 3fku h GLU 165 CO -0.87 0.42 -0.01 0.00 -0.73 0.00 0.00 179.01 177.82 3fku h ALA 166 N 1.42 -0.03 -0.08 2.92 0.00 0.20 -3.17 119.26 120.52 3fku h ALA 166 Ca 0.35 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3fku h ALA 166 Cb 0.34 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3fku h ALA 166 CO -0.25 -0.20 0.00 2.89 0.00 0.00 0.00 179.25 181.69 3fku n ARG 167 N -4.81 1.46 -0.03 0.00 -4.01 0.23 -0.69 116.66 108.81 3fku n ARG 167 Ca -0.09 -0.39 -0.22 0.00 -1.04 0.00 0.00 57.85 56.12 3fku n ARG 167 Cb 0.31 -1.53 -0.13 0.00 -3.04 0.00 0.00 32.46 28.07 3fku n ARG 167 CO 0.00 0.00 0.00 1.28 -3.04 0.00 0.00 177.63 175.87 3fku n LEU 168 N 0.04 2.39 0.08 2.89 4.32 -0.75 -3.38 117.00 122.59 3fku n LEU 168 Ca 0.03 0.28 -0.13 0.00 -0.02 0.00 0.00 56.01 56.17 3fku n LEU 168 Cb 0.33 -1.07 -0.08 0.00 -1.62 0.00 0.00 43.42 40.98 3fku n LEU 168 CO 0.04 0.68 0.72 0.50 -1.22 0.00 0.00 177.39 178.11 3fku h LYS 169 N -0.27 -0.15 -0.54 3.23 3.11 -1.16 -1.18 116.57 119.61 3fku h LYS 169 Ca -0.40 0.01 0.08 0.00 -2.81 0.00 0.00 60.65 57.53 3fku h LYS 169 Cb 1.81 0.03 -0.07 0.00 -1.00 0.00 0.00 32.23 33.00 3fku h LYS 169 CO -0.01 0.07 0.17 0.00 -2.81 0.00 0.00 179.45 176.87 3fku h ARG 170 N -0.36 0.32 -0.93 1.90 3.08 -1.13 -0.18 114.38 117.08 3fku h ARG 170 Ca -0.02 -0.02 0.14 0.00 0.07 0.00 0.00 59.98 60.16 3fku h ARG 170 Cb 0.29 -0.07 -0.09 0.00 0.08 0.00 0.00 29.97 30.18 3fku h ARG 170 CO 0.03 0.21 0.54 1.49 -1.07 0.00 0.00 179.97 181.17 3fku h GLU 171 N 0.33 0.77 0.00 0.04 4.81 -1.52 -3.18 114.58 115.83 3fku h GLU 171 Ca 0.27 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 3fku h GLU 171 Cb 0.33 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 3fku h GLU 171 CO -0.30 0.51 -1.60 -0.85 -0.73 0.00 0.00 179.01 176.04 3fku n GLU 172 N -4.75 0.64 0.22 1.92 -0.00 -0.47 -3.49 120.64 114.71 3fku n GLU 172 Ca 0.19 -0.06 0.06 0.00 -0.00 0.00 0.00 57.16 57.35 3fku n GLU 172 Cb 0.42 -1.65 0.51 0.00 -0.00 0.00 0.00 31.44 30.72 3fku n GLU 172 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.13 176.29 3fku h ILE 173 N 0.00 1.08 -0.07 3.84 -0.00 -1.06 -1.61 117.51 119.69 3fku h ILE 173 Ca -0.01 -0.72 0.00 0.00 -0.00 0.00 0.00 64.86 64.12 3fku h ILE 173 Cb 1.04 1.40 0.00 0.00 -0.00 0.00 0.00 36.82 39.26 3fku h ILE 173 CO 0.00 0.20 0.00 -1.20 -0.00 0.00 0.00 178.15 177.15 3fku n SER 174 N -4.19 0.92 -3.73 2.16 7.64 -1.21 -4.87 113.62 110.34 3fku n SER 174 Ca -0.02 -2.05 -0.27 0.00 1.01 0.00 0.00 58.87 57.54 3fku n SER 174 Cb 0.27 -0.28 -0.05 0.00 -1.01 0.00 0.00 64.21 63.14 3fku n SER 174 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fku n GLY 175 N 0.35 -0.41 0.06 0.23 0.00 -0.61 -4.74 105.19 100.07 3fku n GLY 175 Ca 0.03 0.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 3fku n GLY 175 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3fku h VAL 176 N -0.55 1.51 -1.28 1.61 2.07 -1.82 -3.01 116.25 114.78 3fku h VAL 176 Ca -0.38 -1.56 0.37 0.00 0.82 0.00 0.00 66.70 65.96 3fku h VAL 176 Cb 1.20 2.56 -0.06 0.00 -1.52 0.00 0.00 31.29 33.47 3fku h VAL 176 CO 0.57 0.40 0.91 -0.09 0.02 0.00 0.00 177.57 179.38 3fku h ARG 177 N -0.68 0.03 -2.25 1.57 2.43 -1.85 -3.07 114.38 110.56 3fku h ARG 177 Ca -0.00 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 3fku h ARG 177 Cb 0.66 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 3fku h ARG 177 CO 0.00 0.02 0.02 0.43 -1.51 0.00 0.00 179.97 178.93 3fku n SER 178 N -4.20 2.76 -3.15 -3.80 7.64 -1.14 -3.89 113.62 107.84 3fku n SER 178 Ca 0.28 -1.88 -0.17 0.00 1.01 0.00 0.00 58.87 58.11 3fku n SER 178 Cb 1.33 -0.67 -0.02 0.00 -1.01 0.00 0.00 64.21 63.84 3fku n SER 178 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3fku n LEU 179 N 2.27 0.54 -0.54 -3.43 4.77 -1.16 -5.09 117.00 114.37 3fku n LEU 179 Ca 0.12 -4.89 0.07 0.00 -0.03 0.00 0.00 56.01 51.27 3fku n LEU 179 Cb 0.38 0.74 0.06 0.00 -2.33 0.00 0.00 43.42 42.26 3fku n LEU 179 CO 0.10 2.27 0.46 0.52 -1.33 0.00 0.00 177.39 179.41