#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fvu s PRO 3 N -2.64 1.98 0.15 0.00 0.04 -1.26 -4.90 135.00 128.37 1fvu s PRO 3 Ca -0.04 1.01 -0.34 0.00 0.04 0.00 0.00 61.00 61.66 1fvu s PRO 3 Cb -0.01 -1.88 -0.14 0.00 0.04 0.00 0.00 34.50 32.51 1fvu s PRO 3 CO -0.04 -1.79 1.53 0.45 0.04 0.00 0.00 177.00 177.19 1fvu n SER 4 N -3.60 2.82 0.00 6.66 2.88 -1.26 -1.71 113.62 119.40 1fvu n SER 4 Ca 0.08 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 1fvu n SER 4 Cb 0.54 -1.38 0.00 0.00 -0.75 0.00 0.00 64.21 62.62 1fvu n SER 4 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1fvu n GLY 5 N 3.24 3.38 3.88 0.46 0.00 -1.26 -5.05 105.19 109.84 1fvu n GLY 5 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1fvu n GLY 5 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1fvu s TRP 6 N -2.96 3.60 -0.16 1.61 0.52 -0.69 -4.82 118.94 116.05 1fvu s TRP 6 Ca 0.00 0.53 -0.07 0.00 0.02 0.00 0.00 56.10 56.58 1fvu s TRP 6 Cb 0.00 -1.95 -0.04 0.00 -1.15 0.00 0.00 33.47 30.33 1fvu s TRP 6 CO 0.00 0.71 0.09 -1.12 0.02 0.00 0.00 176.95 176.65 1fvu s SER 7 N -1.26 5.95 0.10 2.95 0.01 0.19 -4.68 113.70 116.97 1fvu s SER 7 Ca 0.19 0.24 -0.18 0.00 1.31 0.00 0.00 55.95 57.51 1fvu s SER 7 Cb -0.13 -1.96 -0.07 0.00 0.21 0.00 0.00 66.02 64.07 1fvu s SER 7 CO 0.08 0.27 0.58 -0.55 0.41 0.00 0.00 173.24 174.03 1fvu s SER 8 N -0.22 7.02 -0.26 2.44 0.15 -1.26 -0.05 113.70 121.52 1fvu s SER 8 Ca 0.09 1.24 -0.11 0.00 0.70 0.00 0.00 55.95 57.87 1fvu s SER 8 Cb -0.12 -2.35 0.10 0.00 -1.71 0.00 0.00 66.02 61.95 1fvu s SER 8 CO 0.01 0.22 0.59 -0.47 1.20 0.00 0.00 173.24 174.79 1fvu s TYR 9 N -1.21 -1.09 -1.59 3.44 6.14 -0.54 -4.94 117.35 117.55 1fvu s TYR 9 Ca 0.32 2.02 -0.16 0.00 0.64 0.00 0.00 57.07 59.89 1fvu s TYR 9 Cb -0.18 0.61 0.12 0.00 0.42 0.00 0.00 41.96 42.93 1fvu s TYR 9 CO 0.19 -0.56 0.84 0.39 0.64 0.00 0.00 175.55 177.05 1fvu n GLU 10 N 5.03 -4.15 -0.55 4.97 -0.58 -1.26 -1.47 120.64 122.63 1fvu n GLU 10 Ca -0.14 0.48 0.00 0.00 -0.42 0.00 0.00 57.16 57.07 1fvu n GLU 10 Cb 0.52 -5.28 0.00 0.00 -0.57 0.00 0.00 31.44 26.12 1fvu n GLU 10 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1fvu n GLY 11 N -1.48 1.30 3.68 0.62 0.00 -1.26 -5.03 105.19 103.02 1fvu n GLY 11 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1fvu n GLY 11 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fvu s ASN 12 N -3.16 4.19 -0.09 1.61 0.01 -0.54 -3.81 114.94 113.15 1fvu s ASN 12 Ca 0.00 -1.18 0.03 0.00 -0.71 0.00 0.00 52.86 51.00 1fvu s ASN 12 Cb 0.00 -0.45 -0.01 0.00 0.41 0.00 0.00 41.25 41.19 1fvu s ASN 12 CO 0.00 -0.48 -0.19 0.00 -1.51 0.00 0.00 177.10 174.92 1fvu s TYR 14 N 0.05 2.15 -0.21 0.00 2.02 0.93 -1.02 117.35 121.26 1fvu s TYR 14 Ca -0.08 -0.40 -0.11 0.00 -0.37 0.00 0.00 57.07 56.12 1fvu s TYR 14 Cb -0.15 -1.23 0.07 0.00 -0.40 0.00 0.00 41.96 40.25 1fvu s TYR 14 CO 0.05 0.20 0.51 0.21 -1.57 0.00 0.00 175.55 174.96 1fvu s LYS 15 N -1.60 0.49 -0.02 -0.62 2.20 -0.84 0.57 119.74 119.92 1fvu s LYS 15 Ca 0.11 0.99 -0.24 0.00 -0.36 0.00 0.00 55.97 56.48 1fvu s LYS 15 Cb -0.10 0.12 -0.04 0.00 -1.51 0.00 0.00 37.83 36.30 1fvu s LYS 15 CO 0.04 -0.17 0.71 0.12 -0.36 0.00 0.00 175.35 175.69 1fvu s PHE 16 N 1.71 3.64 -0.10 4.03 5.36 -1.26 -1.21 117.98 130.15 1fvu s PHE 16 Ca -0.09 1.32 0.01 0.00 -0.96 0.00 0.00 56.93 57.22 1fvu s PHE 16 Cb -0.08 -2.79 -0.02 0.00 -0.34 0.00 0.00 43.02 39.79 1fvu s PHE 16 CO -0.15 0.18 -0.13 -0.06 -1.46 0.00 0.00 175.22 173.59 1fvu s PHE 17 N 0.41 2.78 -0.63 10.12 0.40 0.14 -4.99 117.98 126.20 1fvu s PHE 17 Ca 0.37 -0.46 0.24 0.00 -0.60 0.00 0.00 56.93 56.49 1fvu s PHE 17 Cb -0.19 -1.77 0.40 0.00 0.51 0.00 0.00 43.02 41.97 1fvu s PHE 17 CO 0.20 -0.06 1.38 1.96 0.70 0.00 0.00 175.22 179.39 1fvu h GLN 18 N 6.22 0.00 -6.62 0.44 1.08 -1.95 -1.88 115.11 112.40 1fvu h GLN 18 Ca -0.33 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.34 1fvu h GLN 18 Cb 1.19 0.00 0.04 0.00 -0.05 0.00 0.00 27.48 28.66 1fvu h GLN 18 CO 0.54 0.00 0.84 -1.14 -0.95 0.00 0.00 178.83 178.12 1fvu s GLN 19 N -3.17 4.24 -0.14 1.46 0.74 -1.26 -4.66 119.66 116.87 1fvu s GLN 19 Ca 0.07 2.32 -0.23 0.00 0.05 0.00 0.00 55.36 57.56 1fvu s GLN 19 Cb 0.13 -3.16 -0.02 0.00 1.10 0.00 0.00 33.01 31.06 1fvu s GLN 19 CO 0.70 -0.56 0.73 0.15 -0.55 0.00 0.00 175.29 175.77 1fvu s LYS 20 N 0.89 4.32 0.05 1.67 1.02 -1.26 -4.29 119.74 122.13 1fvu s LYS 20 Ca 0.68 0.87 -0.03 0.00 0.02 0.00 0.00 55.97 57.50 1fvu s LYS 20 Cb -0.43 -3.53 -0.03 0.00 -0.52 0.00 0.00 37.83 33.33 1fvu s LYS 20 CO 0.33 -0.17 0.02 -1.64 -0.92 0.00 0.00 175.35 172.97 1fvu s MET 21 N 1.63 0.58 0.84 1.68 -1.94 -0.96 -4.74 119.30 116.39 1fvu s MET 21 Ca 0.36 -1.00 -0.12 0.00 -1.71 0.00 0.00 55.69 53.22 1fvu s MET 21 Cb -0.17 0.21 0.10 0.00 2.01 0.00 0.00 34.83 36.98 1fvu s MET 21 CO 0.14 -0.13 1.10 0.54 -0.01 0.00 0.00 175.02 176.66 1fvu s ASN 22 N -2.52 4.05 0.16 3.03 2.20 -1.25 -1.82 114.94 118.81 1fvu s ASN 22 Ca 0.01 1.30 -0.23 0.00 -0.94 0.00 0.00 52.86 53.00 1fvu s ASN 22 Cb 0.03 -2.00 0.06 0.00 -2.00 0.00 0.00 41.25 37.34 1fvu s ASN 22 CO -0.08 -2.25 1.60 -0.25 -2.94 0.00 0.00 177.10 173.19 1fvu h TRP 23 N -1.28 -0.88 -0.69 1.54 7.01 -1.65 -1.43 115.95 118.56 1fvu h TRP 23 Ca -0.48 0.06 -0.01 0.00 2.11 0.00 0.00 58.89 60.56 1fvu h TRP 23 Cb 1.28 0.44 -0.03 0.00 -2.10 0.00 0.00 29.16 28.75 1fvu h TRP 23 CO 0.43 -0.38 0.39 0.00 -2.79 0.00 0.00 178.44 176.09 1fvu h ALA 24 N 0.78 0.88 -0.26 2.65 0.00 -1.93 -1.76 119.26 119.63 1fvu h ALA 24 Ca 0.17 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1fvu h ALA 24 Cb 0.53 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1fvu h ALA 24 CO -0.53 0.39 -0.18 -0.44 0.00 0.00 0.00 179.25 178.48 1fvu h ASP 25 N 0.95 0.45 -0.47 0.00 3.32 -1.85 -1.09 116.42 117.73 1fvu h ASP 25 Ca 0.24 -0.13 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 1fvu h ASP 25 Cb 0.02 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1fvu h ASP 25 CO -0.04 0.65 -0.01 0.00 -1.72 0.00 0.00 179.24 178.12 1fvu h ALA 26 N 1.40 0.63 -0.23 3.45 0.00 -0.86 0.28 119.26 123.93 1fvu h ALA 26 Ca 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1fvu h ALA 26 Cb 0.55 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1fvu h ALA 26 CO 0.04 0.43 0.09 1.49 0.00 0.00 0.00 179.25 181.30 1fvu h GLU 27 N 0.68 0.34 -0.48 0.00 4.57 -1.02 0.82 114.58 119.49 1fvu h GLU 27 Ca 0.13 -0.06 0.02 0.00 -1.18 0.00 0.00 59.36 58.27 1fvu h GLU 27 Cb 0.51 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.02 1fvu h GLU 27 CO 0.03 0.39 0.29 -0.09 -1.18 0.00 0.00 179.01 178.44 1fvu h ARG 28 N 0.21 0.56 0.08 1.92 2.43 -1.03 -1.37 114.38 117.18 1fvu h ARG 28 Ca 0.08 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1fvu h ARG 28 Cb 0.18 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1fvu h ARG 28 CO -0.01 0.37 -0.11 0.35 -1.51 0.00 0.00 179.97 179.06 1fvu h PHE 29 N 0.57 -0.28 -0.88 2.20 3.04 -0.10 -2.19 116.94 119.30 1fvu h PHE 29 Ca 0.19 0.00 0.14 0.00 3.98 0.00 0.00 57.97 62.29 1fvu h PHE 29 Cb 0.02 0.11 -0.07 0.00 2.56 0.00 0.00 35.95 38.57 1fvu h PHE 29 CO -0.07 -0.17 0.57 0.00 -2.02 0.00 0.00 178.31 176.62 1fvu h SER 31 N 0.69 0.00 0.45 0.00 4.64 -0.63 -3.01 113.55 115.69 1fvu h SER 31 Ca 0.44 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.60 1fvu h SER 31 Cb 0.71 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.77 1fvu h SER 31 CO -0.20 0.00 -1.68 -0.62 -0.87 0.00 0.00 176.83 173.46 1fvu n GLU 32 N -3.09 0.64 0.27 4.77 1.02 -0.12 -4.20 120.64 119.92 1fvu n GLU 32 Ca 0.00 0.08 0.14 0.00 -0.02 0.00 0.00 57.16 57.37 1fvu n GLU 32 Cb 0.28 -1.70 0.73 0.00 -0.02 0.00 0.00 31.44 30.73 1fvu n GLU 32 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1fvu h GLN 33 N 0.00 0.00 -1.57 3.49 1.08 -1.27 -3.45 115.11 113.39 1fvu h GLN 33 Ca -0.19 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.09 1fvu h GLN 33 Cb 1.54 0.00 -0.24 0.00 -0.05 0.00 0.00 27.48 28.73 1fvu h GLN 33 CO 0.03 0.10 0.52 0.00 -0.95 0.00 0.00 178.83 178.54 1fvu s ALA 34 N -3.99 -1.95 0.29 3.87 0.00 -1.25 -5.06 121.76 113.67 1fvu s ALA 34 Ca -0.02 1.67 -0.30 0.00 0.00 0.00 0.00 51.96 53.32 1fvu s ALA 34 Cb 0.12 -0.94 -0.11 0.00 0.00 0.00 0.00 23.12 22.19 1fvu s ALA 34 CO 0.57 -0.28 1.59 0.15 0.00 0.00 0.00 175.76 177.78 1fvu s LYS 35 N -0.70 4.13 0.00 0.00 1.02 -1.26 -0.77 119.74 122.16 1fvu s LYS 35 Ca -0.00 2.57 0.00 0.00 0.02 0.00 0.00 55.97 58.55 1fvu s LYS 35 Cb -0.02 -3.03 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 1fvu s LYS 35 CO -0.01 -0.62 0.00 0.41 -0.92 0.00 0.00 175.35 174.21 1fvu n GLY 36 N 2.16 0.87 3.77 -3.33 0.00 -1.26 -4.26 105.19 103.14 1fvu n GLY 36 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1fvu n GLY 36 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fvu s GLY 37 N -2.00 2.91 0.28 -0.02 0.00 0.05 -4.50 107.32 104.04 1fvu s GLY 37 Ca 0.00 1.03 -0.09 0.00 0.00 0.00 0.00 44.72 45.66 1fvu s GLY 37 CO 0.00 1.58 0.46 0.30 0.00 0.00 0.00 173.10 175.44 1fvu s HIS 38 N -1.33 0.62 0.43 1.90 3.76 -0.15 -3.24 115.29 117.28 1fvu s HIS 38 Ca 0.55 -0.95 -0.24 0.00 -0.15 0.00 0.00 55.06 54.27 1fvu s HIS 38 Cb -0.33 0.08 -0.08 0.00 1.11 0.00 0.00 32.58 33.37 1fvu s HIS 38 CO 0.42 -1.04 1.18 -0.51 -0.85 0.00 0.00 174.74 173.95 1fvu s LEU 39 N -3.09 4.09 0.36 0.89 1.43 -1.26 -0.52 118.68 120.58 1fvu s LEU 39 Ca 0.26 2.36 -0.28 0.00 -1.03 0.00 0.00 54.13 55.44 1fvu s LEU 39 Cb -0.00 -4.13 -0.12 0.00 0.03 0.00 0.00 46.19 41.97 1fvu s LEU 39 CO 0.13 -0.84 1.34 0.55 0.23 0.00 0.00 176.35 177.76 1fvu n VAL 40 N -0.24 2.08 -4.20 -1.59 3.14 -0.23 -4.04 118.33 113.24 1fvu n VAL 40 Ca 0.06 -0.50 -0.26 0.00 -2.96 0.00 0.00 64.34 60.68 1fvu n VAL 40 Cb 0.47 -1.69 -0.07 0.00 -1.06 0.00 0.00 33.84 31.49 1fvu n VAL 40 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1fvu s SER 41 N -0.29 4.83 -0.07 6.55 1.04 -1.26 0.18 113.70 124.68 1fvu s SER 41 Ca 0.56 -0.40 -0.01 0.00 0.48 0.00 0.00 55.95 56.58 1fvu s SER 41 Cb -0.53 -1.05 0.03 0.00 0.10 0.00 0.00 66.02 64.57 1fvu s SER 41 CO 0.62 0.07 0.00 -0.63 0.98 0.00 0.00 173.24 174.29 1fvu s ILE 42 N -1.81 0.36 -1.20 -1.02 1.01 -1.26 -5.01 121.20 112.27 1fvu s ILE 42 Ca 0.28 0.13 -0.16 0.00 0.00 0.00 0.00 60.65 60.90 1fvu s ILE 42 Cb -0.09 -0.52 0.12 0.00 0.01 0.00 0.00 42.46 41.98 1fvu s ILE 42 CO 0.19 0.26 1.51 -0.54 0.00 0.00 0.00 174.94 176.36 1fvu s LYS 43 N 1.96 3.97 0.00 2.79 1.02 -1.26 -4.83 119.74 123.39 1fvu s LYS 43 Ca 0.05 -2.18 0.00 0.00 0.02 0.00 0.00 55.97 53.86 1fvu s LYS 43 Cb -0.12 -5.24 0.00 0.00 -0.52 0.00 0.00 37.83 31.95 1fvu s LYS 43 CO -0.05 -1.98 0.37 1.51 -0.92 0.00 0.00 175.35 174.28 1fvu n ILE 44 N 5.51 0.08 0.06 2.17 3.06 -1.26 -0.61 119.36 128.38 1fvu n ILE 44 Ca 0.39 0.03 0.09 0.00 -2.50 0.00 0.00 62.75 60.76 1fvu n ILE 44 Cb 0.45 -1.03 0.18 0.00 0.54 0.00 0.00 39.64 39.79 1fvu n ILE 44 CO 0.00 0.00 0.00 -1.22 -2.50 0.00 0.00 176.55 172.83 1fvu n TYR 45 N -0.87 0.48 -4.59 9.51 0.53 -1.26 -4.94 117.16 116.03 1fvu n TYR 45 Ca 0.00 -0.33 -0.28 0.00 -1.02 0.00 0.00 57.90 56.27 1fvu n TYR 45 Cb 0.01 -0.01 -0.08 0.00 -1.03 0.00 0.00 39.34 38.23 1fvu n TYR 45 CO 0.00 0.00 0.00 -1.54 -1.02 0.00 0.00 176.86 174.30 1fvu s SER 46 N -1.15 3.23 0.00 7.72 1.04 0.22 -5.02 113.70 119.73 1fvu s SER 46 Ca 0.31 -1.66 0.08 0.00 0.48 0.00 0.00 55.95 55.15 1fvu s SER 46 Cb 0.17 0.50 0.46 0.00 0.10 0.00 0.00 66.02 67.25 1fvu s SER 46 CO 0.24 -0.90 1.09 0.29 0.98 0.00 0.00 173.24 174.94 1fvu n LYS 47 N -1.02 0.76 -0.24 4.02 5.02 -1.26 -3.55 118.16 121.89 1fvu n LYS 47 Ca -0.10 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.11 1fvu n LYS 47 Cb 0.66 -1.16 0.04 0.00 -0.02 0.00 0.00 35.03 34.55 1fvu n LYS 47 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1fvu h GLU 48 N 0.00 1.10 -0.46 1.97 4.81 -1.96 -1.16 114.58 118.89 1fvu h GLU 48 Ca 0.00 -0.29 -0.10 0.00 -0.13 0.00 0.00 59.36 58.84 1fvu h GLU 48 Cb 0.00 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 1fvu h GLU 48 CO 0.00 1.01 -0.12 1.57 -0.73 0.00 0.00 179.01 180.74 1fvu h LYS 49 N 1.02 0.84 -0.54 1.92 2.10 -1.79 0.42 116.57 120.54 1fvu h LYS 49 Ca 0.20 -0.29 -0.04 0.00 -2.00 0.00 0.00 60.65 58.53 1fvu h LYS 49 Cb 0.44 -0.06 -0.02 0.00 -0.90 0.00 0.00 32.23 31.68 1fvu h LYS 49 CO 0.01 0.92 0.20 -0.44 -2.00 0.00 0.00 179.45 178.14 1fvu h ASP 50 N 0.76 0.77 -0.18 7.07 3.32 -1.73 0.25 116.42 126.67 1fvu h ASP 50 Ca 0.12 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1fvu h ASP 50 Cb 0.62 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1fvu h ASP 50 CO 0.04 0.74 0.07 0.15 -1.72 0.00 0.00 179.24 178.53 1fvu h PHE 51 N 0.74 0.27 -0.50 4.55 3.57 -0.86 -0.88 116.94 123.83 1fvu h PHE 51 Ca 0.18 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 1fvu h PHE 51 Cb 0.23 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 1fvu h PHE 51 CO 0.01 0.33 -0.03 0.28 -2.23 0.00 0.00 178.31 176.67 1fvu h VAL 52 N 0.14 1.25 -0.21 1.41 2.07 -0.71 0.65 116.25 120.86 1fvu h VAL 52 Ca 0.06 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.48 1fvu h VAL 52 Cb 0.17 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1fvu h VAL 52 CO -0.01 0.38 0.08 1.23 0.02 0.00 0.00 177.57 179.28 1fvu h GLY 53 N 0.98 0.35 1.01 2.17 0.00 -0.36 -1.69 103.07 105.52 1fvu h GLY 53 Ca 0.15 -0.20 0.01 0.00 0.00 0.00 0.00 47.33 47.29 1fvu h GLY 53 CO 0.03 0.18 0.44 -0.55 0.00 0.00 0.00 176.54 176.64 1fvu h ASP 54 N 0.18 0.76 -0.60 0.19 3.45 -0.92 -1.03 116.42 118.45 1fvu h ASP 54 Ca 0.07 -0.02 0.03 0.00 0.43 0.00 0.00 57.03 57.54 1fvu h ASP 54 Cb 0.20 -0.19 -0.04 0.00 -0.56 0.00 0.00 39.33 38.74 1fvu h ASP 54 CO -0.00 0.55 0.36 0.25 -1.57 0.00 0.00 179.24 178.83 1fvu h LEU 55 N 0.90 0.58 -0.09 1.55 5.85 -0.66 -0.58 115.31 122.87 1fvu h LEU 55 Ca 0.24 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 1fvu h LEU 55 Cb -0.10 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 40.81 1fvu h LEU 55 CO -0.05 0.40 -0.04 0.58 -0.34 0.00 0.00 178.44 178.99 1fvu h VAL 56 N 0.71 1.32 -0.36 1.05 2.07 -0.96 -1.95 116.25 118.13 1fvu h VAL 56 Ca 0.25 -1.05 0.06 0.00 0.82 0.00 0.00 66.70 66.77 1fvu h VAL 56 Cb 0.04 1.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.60 1fvu h VAL 56 CO -0.11 0.30 0.04 0.74 0.02 0.00 0.00 177.57 178.56 1fvu h THR 57 N -0.19 0.78 -0.29 2.57 2.02 -1.00 0.39 112.91 117.20 1fvu h THR 57 Ca 0.02 -0.05 -0.13 0.00 0.77 0.00 0.00 66.41 67.01 1fvu h THR 57 Cb 0.49 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1fvu h THR 57 CO 0.01 0.03 -0.36 0.11 0.37 0.00 0.00 175.52 175.68 1fvu h LYS 58 N 0.15 0.66 -0.00 6.66 1.57 -1.12 -3.31 116.57 121.17 1fvu h LYS 58 Ca 0.17 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1fvu h LYS 58 Cb 0.22 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1fvu h LYS 58 CO -0.25 0.92 -0.83 0.09 -0.57 0.00 0.00 179.45 178.81 1fvu n ASN 59 N -4.05 1.14 -4.79 0.86 4.13 -0.74 -4.97 115.26 106.85 1fvu n ASN 59 Ca -0.01 -1.07 -0.35 0.00 1.68 0.00 0.00 54.58 54.83 1fvu n ASN 59 Cb 0.50 0.89 -0.03 0.00 -1.54 0.00 0.00 39.78 39.60 1fvu n ASN 59 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 1fvu s ILE 60 N -2.75 3.72 -0.28 2.41 2.07 0.14 -5.00 121.20 121.50 1fvu s ILE 60 Ca 0.09 1.14 -0.02 0.00 -1.41 0.00 0.00 60.65 60.46 1fvu s ILE 60 Cb 0.15 -3.50 0.12 0.00 0.13 0.00 0.00 42.46 39.37 1fvu s ILE 60 CO 0.75 -0.16 0.25 0.00 -1.91 0.00 0.00 174.94 173.87 1fvu s GLN 61 N -3.03 0.28 0.00 3.50 -2.07 -1.26 -4.98 119.66 112.11 1fvu s GLN 61 Ca 0.65 -0.21 0.00 0.00 -1.82 0.00 0.00 55.36 53.98 1fvu s GLN 61 Cb -0.18 -0.82 0.00 0.00 -1.09 0.00 0.00 33.01 30.92 1fvu s GLN 61 CO 0.23 -1.00 0.00 -1.13 -1.32 0.00 0.00 175.29 172.06 1fvu n SER 62 N 5.30 0.00 -0.66 12.60 3.41 -1.26 -4.90 113.62 128.11 1fvu n SER 62 Ca -0.03 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.70 1fvu n SER 62 Cb 0.45 0.00 0.37 0.00 -0.26 0.00 0.00 64.21 64.77 1fvu n SER 62 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1fvu n SER 63 N 0.00 1.99 -4.52 4.04 3.41 -1.26 -4.96 113.62 112.33 1fvu n SER 63 Ca 0.00 -1.72 -0.59 0.00 -0.26 0.00 0.00 58.87 56.30 1fvu n SER 63 Cb 0.00 -0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 63.78 1fvu n SER 63 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1fvu n ASP 64 N 0.54 0.21 0.07 4.04 10.43 -1.26 -4.88 116.55 125.70 1fvu n ASP 64 Ca 0.17 1.16 0.11 0.00 2.57 0.00 0.00 54.79 58.80 1fvu n ASP 64 Cb 0.40 -0.94 -0.02 0.00 1.84 0.00 0.00 41.12 42.39 1fvu n ASP 64 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1fvu n LEU 65 N 1.74 0.62 -4.23 0.64 4.77 -1.26 -4.80 117.00 114.48 1fvu n LEU 65 Ca 0.20 0.20 -0.20 0.00 -0.03 0.00 0.00 56.01 56.18 1fvu n LEU 65 Cb 0.08 -0.06 -0.12 0.00 -2.33 0.00 0.00 43.42 41.00 1fvu n LEU 65 CO 0.63 -0.10 -0.47 -0.31 -1.33 0.00 0.00 177.39 175.80 1fvu s TYR 66 N -3.36 1.45 -0.08 -1.77 1.51 -1.26 -0.30 117.35 113.54 1fvu s TYR 66 Ca -0.01 -0.48 -0.03 0.00 -1.01 0.00 0.00 57.07 55.54 1fvu s TYR 66 Cb 0.11 -0.79 0.04 0.00 -0.11 0.00 0.00 41.96 41.22 1fvu s TYR 66 CO 0.81 0.14 0.10 0.00 -1.11 0.00 0.00 175.55 175.49 1fvu s ALA 67 N -1.54 0.12 0.53 3.71 0.00 -0.95 -3.84 121.76 119.77 1fvu s ALA 67 Ca 0.04 0.25 -0.23 0.00 0.00 0.00 0.00 51.96 52.02 1fvu s ALA 67 Cb -0.08 -0.76 -0.06 0.00 0.00 0.00 0.00 23.12 22.23 1fvu s ALA 67 CO 0.03 -0.62 1.37 0.91 0.00 0.00 0.00 175.76 177.45 1fvu n TRP 68 N 5.31 2.38 -4.42 0.00 5.03 -0.53 0.19 117.44 125.39 1fvu n TRP 68 Ca -0.04 0.43 -0.20 0.00 3.03 0.00 0.00 57.50 60.72 1fvu n TRP 68 Cb 0.50 -2.38 -0.11 0.00 -1.03 0.00 0.00 31.31 28.29 1fvu n TRP 68 CO 0.00 0.00 0.00 0.96 -0.03 0.00 0.00 177.69 178.62 1fvu s ILE 69 N -1.27 1.07 -0.66 -0.99 -4.36 -0.83 -3.00 121.20 111.16 1fvu s ILE 69 Ca 0.69 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 59.08 1fvu s ILE 69 Cb -0.42 -2.76 0.00 0.00 1.25 0.00 0.00 42.46 40.52 1fvu s ILE 69 CO 0.51 -0.00 0.61 0.61 0.24 0.00 0.00 174.94 176.90 1fvu n GLY 70 N -0.64 1.51 3.69 6.27 0.00 0.13 -4.63 105.19 111.51 1fvu n GLY 70 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1fvu n GLY 70 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fvu s LEU 71 N 0.00 3.82 0.07 0.99 2.96 -1.26 -4.96 118.68 120.29 1fvu s LEU 71 Ca 0.00 0.16 -0.08 0.00 -0.22 0.00 0.00 54.13 53.99 1fvu s LEU 71 Cb 0.00 -1.93 -0.00 0.00 0.50 0.00 0.00 46.19 44.76 1fvu s LEU 71 CO 0.00 0.28 0.16 -0.60 -1.32 0.00 0.00 176.35 174.87 1fvu s ARG 72 N -0.26 0.76 0.10 1.98 3.52 -1.26 -1.43 118.95 122.35 1fvu s ARG 72 Ca 0.08 -0.88 -0.30 0.00 -0.13 0.00 0.00 55.73 54.50 1fvu s ARG 72 Cb -0.12 0.30 -0.06 0.00 -1.56 0.00 0.00 34.95 33.51 1fvu s ARG 72 CO 0.02 -0.22 1.17 0.08 -0.81 0.00 0.00 175.30 175.53 1fvu s VAL 73 N -3.40 3.98 0.05 7.11 1.01 0.96 -4.93 120.40 125.17 1fvu s VAL 73 Ca 0.02 1.50 0.08 0.00 0.00 0.00 0.00 61.98 63.57 1fvu s VAL 73 Cb 0.03 -3.96 -0.23 0.00 0.00 0.00 0.00 36.38 32.23 1fvu s VAL 73 CO -0.08 0.16 1.02 -0.08 0.00 0.00 0.00 175.10 176.11 1fvu h GLU 74 N 6.28 0.03 -6.46 2.72 4.22 -2.00 -3.47 114.58 115.90 1fvu h GLU 74 Ca -0.42 -0.05 -0.61 0.00 0.08 0.00 0.00 59.36 58.36 1fvu h GLU 74 Cb 1.21 0.02 0.12 0.00 0.50 0.00 0.00 28.75 30.60 1fvu h GLU 74 CO 0.78 0.84 0.05 0.09 -2.18 0.00 0.00 179.01 178.59 1fvu n ASN 75 N -3.26 0.95 0.03 1.04 3.02 -1.26 -4.91 115.26 110.87 1fvu n ASN 75 Ca -0.08 1.13 -0.06 0.00 -0.03 0.00 0.00 54.58 55.55 1fvu n ASN 75 Cb 0.99 -1.26 -0.11 0.00 -0.61 0.00 0.00 39.78 38.79 1fvu n ASN 75 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1fvu h LYS 76 N 1.76 0.00 -7.23 3.52 6.56 -1.97 -3.47 116.57 115.74 1fvu h LYS 76 Ca -0.40 0.00 -0.53 0.00 -1.06 0.00 0.00 60.65 58.67 1fvu h LYS 76 Cb 1.35 0.00 0.17 0.00 -0.57 0.00 0.00 32.23 33.18 1fvu h LYS 76 CO 0.59 0.67 0.32 -1.21 -2.06 0.00 0.00 179.45 177.76 1fvu s GLU 77 N -2.72 1.66 0.23 3.15 8.01 -1.26 -4.93 118.70 122.85 1fvu s GLU 77 Ca -0.01 1.64 -0.08 0.00 0.01 0.00 0.00 54.97 56.53 1fvu s GLU 77 Cb 0.09 -1.79 0.21 0.00 -4.31 0.00 0.00 34.13 28.33 1fvu s GLU 77 CO 0.81 -2.17 1.90 0.87 0.01 0.00 0.00 175.26 176.68 1fvu h LYS 78 N -1.03 1.19 -4.16 1.61 1.57 -2.01 -3.44 116.57 110.30 1fvu h LYS 78 Ca -0.45 -0.08 -0.12 0.00 -1.87 0.00 0.00 60.65 58.12 1fvu h LYS 78 Cb 1.28 -0.26 -0.16 0.00 0.08 0.00 0.00 32.23 33.17 1fvu h LYS 78 CO 0.46 0.80 -0.66 1.14 -0.57 0.00 0.00 179.45 180.63 1fvu s GLN 79 N -6.08 0.59 0.00 3.15 1.03 -1.26 -4.81 119.66 112.28 1fvu s GLN 79 Ca -0.13 -1.11 0.24 0.00 0.04 0.00 0.00 55.36 54.40 1fvu s GLN 79 Cb 0.17 0.21 0.85 0.00 0.03 0.00 0.00 33.01 34.26 1fvu s GLN 79 CO 0.81 -0.11 1.62 0.00 -2.54 0.00 0.00 175.29 175.06 1fvu s SER 81 N -1.76 6.65 0.06 0.00 0.15 -1.26 -4.88 113.70 112.66 1fvu s SER 81 Ca 0.35 0.48 0.25 0.00 0.70 0.00 0.00 55.95 57.73 1fvu s SER 81 Cb 0.19 -2.49 0.51 0.00 -1.71 0.00 0.00 66.02 62.52 1fvu s SER 81 CO 0.30 -1.01 1.43 -1.54 1.20 0.00 0.00 173.24 173.61 1fvu n SER 82 N 7.17 0.56 -4.15 5.45 3.41 -1.26 -4.82 113.62 119.98 1fvu n SER 82 Ca 0.09 0.03 -0.22 0.00 -0.26 0.00 0.00 58.87 58.51 1fvu n SER 82 Cb 0.48 0.10 -0.14 0.00 -0.26 0.00 0.00 64.21 64.40 1fvu n SER 82 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1fvu s GLU 83 N -3.08 1.06 0.80 4.33 2.02 -1.26 -0.34 118.70 122.22 1fvu s GLU 83 Ca 0.09 -0.72 -0.12 0.00 0.02 0.00 0.00 54.97 54.24 1fvu s GLU 83 Cb 0.15 -1.08 0.07 0.00 0.10 0.00 0.00 34.13 33.38 1fvu s GLU 83 CO 0.69 0.28 1.12 -1.58 0.02 0.00 0.00 175.26 175.78 1fvu s TRP 84 N -0.71 2.92 -0.19 1.61 0.52 0.14 -4.90 118.94 118.34 1fvu s TRP 84 Ca 0.04 1.00 0.25 0.00 0.02 0.00 0.00 56.10 57.40 1fvu s TRP 84 Cb -0.07 -3.22 1.24 0.00 -1.15 0.00 0.00 33.47 30.26 1fvu s TRP 84 CO 0.01 -1.73 1.75 0.66 0.02 0.00 0.00 176.95 177.66 1fvu h SER 85 N -1.04 0.00 -0.47 2.95 4.64 -2.01 -0.22 113.55 117.39 1fvu h SER 85 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1fvu h SER 85 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1fvu h SER 85 CO 0.62 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.68 1fvu n ASP 86 N -2.36 2.75 0.00 4.97 5.75 -1.26 -4.92 116.55 121.48 1fvu n ASP 86 Ca -0.01 -1.97 0.00 0.00 -0.01 0.00 0.00 54.79 52.81 1fvu n ASP 86 Cb 0.10 -0.31 0.00 0.00 -1.03 0.00 0.00 41.12 39.88 1fvu n ASP 86 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fvu n GLY 87 N 1.33 1.93 3.75 6.12 0.00 -0.09 -5.04 105.19 113.19 1fvu n GLY 87 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1fvu n GLY 87 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fvu s SER 88 N -2.43 5.44 0.33 1.61 0.01 -1.26 -4.66 113.70 112.74 1fvu s SER 88 Ca 0.00 2.65 -0.25 0.00 1.31 0.00 0.00 55.95 59.66 1fvu s SER 88 Cb 0.00 -2.63 -0.10 0.00 0.21 0.00 0.00 66.02 63.50 1fvu s SER 88 CO 0.00 -1.45 0.92 -0.44 0.41 0.00 0.00 173.24 172.69 1fvu s SER 89 N -1.07 7.26 -0.19 2.44 0.01 -1.26 0.24 113.70 121.12 1fvu s SER 89 Ca 0.70 1.78 -0.23 0.00 1.31 0.00 0.00 55.95 59.51 1fvu s SER 89 Cb -0.37 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.28 1fvu s SER 89 CO 0.44 -0.10 0.73 -0.69 0.41 0.00 0.00 173.24 174.03 1fvu s VAL 90 N -1.68 4.95 0.01 3.43 1.01 0.53 -4.80 120.40 123.85 1fvu s VAL 90 Ca 0.51 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.88 1fvu s VAL 90 Cb -0.17 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.17 1fvu s VAL 90 CO 0.22 0.06 0.00 -0.24 0.00 0.00 0.00 175.10 175.14 1fvu n SER 91 N 5.19 0.01 -4.72 3.32 2.88 -1.26 -4.97 113.62 114.07 1fvu n SER 91 Ca 0.01 0.01 -0.42 0.00 -1.33 0.00 0.00 58.87 57.15 1fvu n SER 91 Cb 0.49 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.92 1fvu n SER 91 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1fvu s TYR 92 N -1.03 3.12 -0.05 0.66 5.04 -1.26 -5.00 117.35 118.83 1fvu s TYR 92 Ca 0.00 0.81 -0.25 0.00 -2.44 0.00 0.00 57.07 55.19 1fvu s TYR 92 Cb 0.00 -3.82 0.05 0.00 0.35 0.00 0.00 41.96 38.54 1fvu s TYR 92 CO 0.00 -2.93 0.55 -1.83 -1.34 0.00 0.00 175.55 170.00 1fvu s GLU 93 N 0.84 0.90 -0.38 4.97 4.04 -1.26 -5.08 118.70 122.74 1fvu s GLU 93 Ca 0.66 0.14 0.12 0.00 0.04 0.00 0.00 54.97 55.93 1fvu s GLU 93 Cb -0.41 0.42 0.36 0.00 0.02 0.00 0.00 34.13 34.52 1fvu s GLU 93 CO 0.33 -0.26 0.80 -1.71 -1.84 0.00 0.00 175.26 172.58 1fvu n ASN 94 N 1.15 0.49 -4.73 0.83 4.05 -1.26 -5.11 115.26 110.68 1fvu n ASN 94 Ca -0.20 -3.05 -0.41 0.00 0.45 0.00 0.00 54.58 51.37 1fvu n ASN 94 Cb 0.57 -0.30 -0.04 0.00 1.23 0.00 0.00 39.78 41.23 1fvu n ASN 94 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1fvu s VAL 95 N -2.16 4.07 -0.04 3.44 1.01 -1.26 -5.00 120.40 120.46 1fvu s VAL 95 Ca 0.37 1.73 -0.30 0.00 0.00 0.00 0.00 61.98 63.78 1fvu s VAL 95 Cb 0.35 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 1fvu s VAL 95 CO -0.07 0.27 1.40 -0.69 0.00 0.00 0.00 175.10 176.02 1fvu s VAL 96 N -0.05 3.84 0.32 2.92 1.01 -1.26 -4.94 120.40 122.24 1fvu s VAL 96 Ca 0.49 1.15 0.04 0.00 0.00 0.00 0.00 61.98 63.66 1fvu s VAL 96 Cb -0.28 -3.74 0.30 0.00 0.00 0.00 0.00 36.38 32.66 1fvu s VAL 96 CO 0.33 -0.04 1.88 -0.33 0.00 0.00 0.00 175.10 176.94 1fvu h GLU 97 N 8.15 0.87 0.00 2.72 5.08 -1.98 -1.81 114.58 127.62 1fvu h GLU 97 Ca -0.36 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1fvu h GLU 97 Cb 1.16 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.22 1fvu h GLU 97 CO 0.92 0.58 0.00 2.89 -1.00 0.00 0.00 179.01 182.40 1fvu n ARG 98 N -4.55 0.06 0.00 2.33 1.85 -1.26 -1.96 116.66 113.13 1fvu n ARG 98 Ca 0.16 0.28 0.13 0.00 -1.00 0.00 0.00 57.85 57.42 1fvu n ARG 98 Cb 0.33 -1.61 0.34 0.00 -1.05 0.00 0.00 32.46 30.47 1fvu n ARG 98 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1fvu n THR 99 N -1.73 0.00 -2.64 8.89 -2.24 -0.68 -4.78 114.28 111.09 1fvu n THR 99 Ca 0.03 -0.25 -0.43 0.00 -2.27 0.00 0.00 64.05 61.14 1fvu n THR 99 Cb 0.21 0.72 -0.02 0.00 -2.10 0.00 0.00 70.33 69.14 1fvu n THR 99 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1fvu s VAL 100 N -2.22 4.68 -0.50 2.28 1.01 -0.83 -4.97 120.40 119.85 1fvu s VAL 100 Ca 0.29 1.97 0.03 0.00 0.00 0.00 0.00 61.98 64.27 1fvu s VAL 100 Cb 0.20 -4.26 0.14 0.00 0.00 0.00 0.00 36.38 32.45 1fvu s VAL 100 CO 0.42 -0.03 0.27 -0.54 0.00 0.00 0.00 175.10 175.22 1fvu s LYS 101 N 2.27 1.71 0.00 2.72 1.02 -1.26 -3.99 119.74 122.22 1fvu s LYS 101 Ca 0.49 -2.42 0.17 0.00 0.02 0.00 0.00 55.97 54.23 1fvu s LYS 101 Cb -0.19 -2.90 -0.01 0.00 -0.52 0.00 0.00 37.83 34.22 1fvu s LYS 101 CO 0.16 -1.15 0.87 1.63 -0.92 0.00 0.00 175.35 175.94 1fvu n LYS 102 N 3.20 1.65 -4.49 1.68 5.02 -1.08 -4.38 118.16 119.75 1fvu n LYS 102 Ca 0.08 -0.81 -0.33 0.00 -2.02 0.00 0.00 58.31 55.23 1fvu n LYS 102 Cb 0.33 -1.29 -0.13 0.00 -0.02 0.00 0.00 35.03 33.93 1fvu n LYS 102 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fvu s PHE 104 N 0.34 3.49 0.11 0.00 0.40 -0.51 0.78 117.98 122.58 1fvu s PHE 104 Ca -0.06 0.72 -0.06 0.00 -0.60 0.00 0.00 56.93 56.94 1fvu s PHE 104 Cb -0.15 -2.13 -0.02 0.00 0.51 0.00 0.00 43.02 41.24 1fvu s PHE 104 CO 0.04 0.40 0.14 0.00 0.70 0.00 0.00 175.22 176.50 1fvu s ALA 105 N -1.64 0.21 0.14 5.36 0.00 -0.34 -1.96 121.76 123.54 1fvu s ALA 105 Ca 0.41 -0.98 -0.25 0.00 0.00 0.00 0.00 51.96 51.14 1fvu s ALA 105 Cb -0.12 0.61 -0.08 0.00 0.00 0.00 0.00 23.12 23.53 1fvu s ALA 105 CO 0.22 -0.51 0.75 -0.51 0.00 0.00 0.00 175.76 175.71 1fvu s LEU 106 N -2.94 4.58 -0.12 0.00 1.43 0.13 -1.34 118.68 120.42 1fvu s LEU 106 Ca 0.12 1.58 -0.06 0.00 -1.03 0.00 0.00 54.13 54.74 1fvu s LEU 106 Cb 0.06 -3.24 -0.04 0.00 0.03 0.00 0.00 46.19 43.00 1fvu s LEU 106 CO -0.06 0.20 0.12 -0.70 0.23 0.00 0.00 176.35 176.15 1fvu s GLU 107 N -1.04 3.40 0.19 1.70 2.12 -0.36 -2.25 118.70 122.45 1fvu s GLU 107 Ca 0.35 -0.17 -0.13 0.00 0.36 0.00 0.00 54.97 55.38 1fvu s GLU 107 Cb -0.22 -3.14 0.19 0.00 0.26 0.00 0.00 34.13 31.22 1fvu s GLU 107 CO 0.25 0.76 1.72 -0.22 -0.54 0.00 0.00 175.26 177.23 1fvu h LYS 108 N 5.05 0.26 -6.76 4.30 3.64 -0.97 -1.08 116.57 121.01 1fvu h LYS 108 Ca -0.54 -0.02 -0.56 0.00 -1.27 0.00 0.00 60.65 58.27 1fvu h LYS 108 Cb 1.22 -0.06 0.10 0.00 -0.41 0.00 0.00 32.23 33.08 1fvu h LYS 108 CO 0.58 0.17 0.68 -0.25 -2.27 0.00 0.00 179.45 178.36 1fvu n ASP 109 N -5.08 3.23 0.00 4.20 9.92 -1.26 -1.48 116.55 126.08 1fvu n ASP 109 Ca 0.06 1.18 0.00 0.00 -0.53 0.00 0.00 54.79 55.50 1fvu n ASP 109 Cb 0.24 -1.52 0.00 0.00 -0.64 0.00 0.00 41.12 39.19 1fvu n ASP 109 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1fvu n LEU 110 N 1.38 0.25 -0.05 0.64 -0.00 -1.26 -3.99 117.00 113.97 1fvu n LEU 110 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.08 1fvu n LEU 110 Cb 0.36 -0.75 0.00 0.00 -0.00 0.00 0.00 43.42 43.02 1fvu n LEU 110 CO 0.63 -0.20 0.00 0.61 -0.00 0.00 0.00 177.39 178.43 1fvu n GLY 111 N -2.00 1.18 3.80 -3.96 0.00 -0.55 -4.41 105.19 99.25 1fvu n GLY 111 Ca 0.00 -0.40 -0.27 0.00 0.00 0.00 0.00 46.02 45.35 1fvu n GLY 111 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1fvu n PHE 112 N -2.18 -2.37 0.00 1.61 3.72 -0.41 -4.54 117.46 113.28 1fvu n PHE 112 Ca 0.00 0.92 0.00 0.00 -0.05 0.00 0.00 57.45 58.32 1fvu n PHE 112 Cb 0.24 -4.32 0.00 0.00 -0.94 0.00 0.00 39.48 34.46 1fvu n PHE 112 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 1fvu n VAL 113 N -4.68 0.00 -4.03 -4.37 3.14 -1.26 -3.80 118.33 103.33 1fvu n VAL 113 Ca -0.03 -0.07 -0.33 0.00 -2.96 0.00 0.00 64.34 60.95 1fvu n VAL 113 Cb 0.56 0.56 -0.06 0.00 -1.06 0.00 0.00 33.84 33.84 1fvu n VAL 113 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 1fvu s LEU 114 N -2.81 4.07 0.33 6.55 2.01 -1.26 -5.01 118.68 122.55 1fvu s LEU 114 Ca 0.00 0.22 0.07 0.00 0.01 0.00 0.00 54.13 54.43 1fvu s LEU 114 Cb 0.00 -2.38 -0.02 0.00 0.01 0.00 0.00 46.19 43.80 1fvu s LEU 114 CO 0.00 0.27 0.41 0.26 1.01 0.00 0.00 176.35 178.31 1fvu s TRP 115 N -1.23 3.09 -0.18 0.29 0.51 -1.26 -1.23 118.94 118.93 1fvu s TRP 115 Ca 0.24 -0.22 -0.16 0.00 -2.12 0.00 0.00 56.10 53.84 1fvu s TRP 115 Cb -0.12 -1.90 0.05 0.00 -0.81 0.00 0.00 33.47 30.68 1fvu s TRP 115 CO 0.15 0.08 0.48 -1.50 -0.51 0.00 0.00 176.95 175.66 1fvu s ILE 116 N -2.19 -0.00 0.01 2.03 2.07 -0.45 -4.85 121.20 117.82 1fvu s ILE 116 Ca 0.43 0.01 -0.17 0.00 -1.41 0.00 0.00 60.65 59.50 1fvu s ILE 116 Cb -0.09 -0.68 -0.06 0.00 0.13 0.00 0.00 42.46 41.77 1fvu s ILE 116 CO 0.30 0.00 0.48 0.54 -1.91 0.00 0.00 174.94 174.35 1fvu s ASN 117 N 0.36 6.89 0.25 4.50 4.22 -1.26 -1.20 114.94 128.70 1fvu s ASN 117 Ca -0.01 1.05 0.02 0.00 -2.14 0.00 0.00 52.86 51.78 1fvu s ASN 117 Cb -0.04 -2.30 -0.05 0.00 1.28 0.00 0.00 41.25 40.14 1fvu s ASN 117 CO -0.01 0.25 0.07 -0.76 -2.04 0.00 0.00 177.10 174.61 1fvu s LEU 118 N -0.79 1.82 -0.02 3.54 1.43 0.23 -4.90 118.68 120.00 1fvu s LEU 118 Ca 0.26 -1.34 -0.30 0.00 -1.03 0.00 0.00 54.13 51.73 1fvu s LEU 118 Cb -0.17 -0.06 -0.07 0.00 0.03 0.00 0.00 46.19 45.91 1fvu s LEU 118 CO 0.15 -0.67 1.84 -0.47 0.23 0.00 0.00 176.35 177.43 1fvu s TYR 119 N -3.66 1.58 0.65 0.29 5.04 -1.26 -2.20 117.35 117.79 1fvu s TYR 119 Ca 0.35 -0.14 0.33 0.00 -2.44 0.00 0.00 57.07 55.17 1fvu s TYR 119 Cb 0.07 -4.10 1.83 0.00 0.35 0.00 0.00 41.96 40.12 1fvu s TYR 119 CO 0.12 -4.76 2.06 0.00 -1.34 0.00 0.00 175.55 171.63 1fvu n ALA 121 N -2.05 2.62 -1.67 0.00 0.00 -1.26 -2.76 120.51 115.40 1fvu n ALA 121 Ca -0.01 -0.20 -0.35 0.00 0.00 0.00 0.00 53.44 52.88 1fvu n ALA 121 Cb 0.31 -1.42 0.04 0.00 0.00 0.00 0.00 19.45 18.38 1fvu n ALA 121 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1fvu s GLN 122 N -2.53 2.88 -0.25 0.00 -0.21 -0.59 -4.76 119.66 114.21 1fvu s GLN 122 Ca 0.29 1.74 -0.06 0.00 0.02 0.00 0.00 55.36 57.35 1fvu s GLN 122 Cb 0.20 -1.93 -0.02 0.00 1.00 0.00 0.00 33.01 32.27 1fvu s GLN 122 CO 0.47 -1.26 0.04 0.15 -2.12 0.00 0.00 175.29 172.57 1fvu s LYS 123 N -3.49 3.50 0.08 2.91 1.02 -1.26 -3.75 119.74 118.74 1fvu s LYS 123 Ca 0.75 -0.57 -0.00 0.00 0.02 0.00 0.00 55.97 56.17 1fvu s LYS 123 Cb -0.28 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 33.74 1fvu s LYS 123 CO 0.35 -0.23 -0.02 -0.80 -0.92 0.00 0.00 175.35 173.73 1fvu s ASN 124 N 1.56 0.60 1.03 2.83 0.01 -0.75 -4.69 114.94 115.53 1fvu s ASN 124 Ca 0.06 -1.04 -0.15 0.00 -0.71 0.00 0.00 52.86 51.02 1fvu s ASN 124 Cb -0.15 0.19 0.20 0.00 0.41 0.00 0.00 41.25 41.90 1fvu s ASN 124 CO 0.01 -0.60 1.13 -2.16 -1.51 0.00 0.00 177.10 173.98 1fvu s PRO 125 N -3.92 0.19 0.32 -0.60 0.04 -1.25 -2.25 135.00 127.52 1fvu s PRO 125 Ca 0.11 0.20 -0.11 0.00 0.04 0.00 0.00 61.00 61.24 1fvu s PRO 125 Cb 0.07 -1.74 0.02 0.00 0.04 0.00 0.00 34.50 32.89 1fvu s PRO 125 CO -0.07 -2.82 0.58 -0.59 0.04 0.00 0.00 177.00 174.14 1fvu s PHE 126 N -3.15 0.47 -0.09 0.56 -0.71 -0.71 -1.45 117.98 112.90 1fvu s PHE 126 Ca 0.67 -0.89 0.03 0.00 -1.04 0.00 0.00 56.93 55.71 1fvu s PHE 126 Cb -0.14 0.33 0.00 0.00 -1.21 0.00 0.00 43.02 42.00 1fvu s PHE 126 CO 0.55 -1.22 -0.20 0.08 -1.34 0.00 0.00 175.22 173.10 1fvu s VAL 127 N -3.23 1.72 0.16 -2.49 1.01 -1.16 0.23 120.40 116.63 1fvu s VAL 127 Ca 0.22 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.44 1fvu s VAL 127 Cb -0.02 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 1fvu s VAL 127 CO 0.13 0.48 0.09 0.00 0.00 0.00 0.00 175.10 175.81 1fvu s LYS 129 N -3.02 0.41 0.07 0.00 2.20 0.32 -2.00 119.74 117.73 1fvu s LYS 129 Ca 0.30 -0.03 -0.05 0.00 -0.36 0.00 0.00 55.97 55.82 1fvu s LYS 129 Cb -0.10 -0.50 -0.02 0.00 -1.51 0.00 0.00 37.83 35.71 1fvu s LYS 129 CO 0.22 -0.05 0.09 -1.54 -0.36 0.00 0.00 175.35 173.70 1fvu s SER 130 N 0.63 0.28 0.83 1.43 1.04 -0.19 -0.98 113.70 116.74 1fvu s SER 130 Ca -0.07 -0.77 -0.11 0.00 0.48 0.00 0.00 55.95 55.48 1fvu s SER 130 Cb -0.10 0.27 0.09 0.00 0.10 0.00 0.00 66.02 66.37 1fvu s SER 130 CO -0.01 -0.64 1.09 -2.16 0.98 0.00 0.00 173.24 172.50 1fvu s PRO 131 N -3.68 1.82 0.93 4.02 0.04 -1.26 -0.83 135.00 136.03 1fvu s PRO 131 Ca 0.04 1.00 -0.10 0.00 0.04 0.00 0.00 61.00 61.98 1fvu s PRO 131 Cb 0.05 -1.86 0.15 0.00 0.04 0.00 0.00 34.50 32.88 1fvu s PRO 131 CO -0.10 -1.90 1.12 -0.35 0.04 0.00 0.00 177.00 175.81 1fvu n PRO 132 N -3.67 -0.51 0.00 0.56 -0.04 -1.25 -4.60 135.00 125.49 1fvu n PRO 132 Ca 0.08 -0.08 0.08 0.00 -0.04 0.00 0.00 63.50 63.54 1fvu n PRO 132 Cb 0.54 -2.36 0.48 0.00 -0.04 0.00 0.00 33.50 32.12 1fvu n PRO 132 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11