#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fiv n GLY 5 N 0.00 -0.65 3.08 7.55 0.00 -1.26 -3.79 105.19 110.12 1fiv n GLY 5 Ca 0.00 0.30 -0.12 0.00 0.00 0.00 0.00 46.02 46.20 1fiv n GLY 5 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fiv s THR 6 N -4.11 -0.35 -0.22 2.61 2.01 -1.26 -4.97 115.64 109.35 1fiv s THR 6 Ca -0.02 0.22 -0.04 0.00 0.31 0.00 0.00 61.69 62.16 1fiv s THR 6 Cb 0.12 -0.48 -0.02 0.00 0.01 0.00 0.00 72.50 72.13 1fiv s THR 6 CO 0.39 0.09 -0.02 -0.89 -0.69 0.00 0.00 174.62 173.50 1fiv s THR 7 N 2.16 3.62 -0.25 -0.82 2.01 -1.25 -5.09 115.64 116.02 1fiv s THR 7 Ca -0.02 -0.42 -0.02 0.00 0.31 0.00 0.00 61.69 61.54 1fiv s THR 7 Cb -0.11 -2.65 0.02 0.00 0.01 0.00 0.00 72.50 69.77 1fiv s THR 7 CO -0.10 0.42 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.32 1fiv s THR 8 N 1.33 3.05 0.59 -0.82 2.01 -1.26 -5.10 115.64 115.44 1fiv s THR 8 Ca 0.04 -0.93 -0.12 0.00 0.31 0.00 0.00 61.69 61.00 1fiv s THR 8 Cb -0.14 -2.53 -0.05 0.00 0.01 0.00 0.00 72.50 69.79 1fiv s THR 8 CO -0.01 0.21 1.01 0.42 -0.69 0.00 0.00 174.62 175.56 1fiv s THR 9 N 1.36 4.69 -0.38 -0.82 -4.23 -1.26 -5.00 115.64 110.00 1fiv s THR 9 Ca 0.01 0.91 0.07 0.00 -1.18 0.00 0.00 61.69 61.50 1fiv s THR 9 Cb -0.16 -3.84 0.72 0.00 1.34 0.00 0.00 72.50 70.55 1fiv s THR 9 CO -0.04 -1.05 1.85 0.18 -0.54 0.00 0.00 174.62 175.02 1fiv n LEU 10 N -2.51 6.34 0.17 4.79 4.77 -1.26 -4.42 117.00 124.87 1fiv n LEU 10 Ca 0.06 -3.39 0.13 0.00 -0.03 0.00 0.00 56.01 52.78 1fiv n LEU 10 Cb 0.54 -0.78 0.49 0.00 -2.33 0.00 0.00 43.42 41.34 1fiv n LEU 10 CO 0.56 0.91 0.89 1.05 -1.33 0.00 0.00 177.39 179.47 1fiv h GLU 11 N 1.99 0.00 -5.00 3.23 9.09 -2.06 -3.44 114.58 118.39 1fiv h GLU 11 Ca 0.42 0.00 -0.36 0.00 0.05 0.00 0.00 59.36 59.47 1fiv h GLU 11 Cb 2.55 0.00 -0.14 0.00 -1.65 0.00 0.00 28.75 29.51 1fiv h GLU 11 CO 0.89 0.00 -0.65 -1.59 0.05 0.00 0.00 179.01 177.70 1fiv s LYS 12 N -3.34 1.30 0.24 1.06 -2.85 -1.26 -5.11 119.74 109.79 1fiv s LYS 12 Ca 0.05 -1.66 -0.31 0.00 -1.00 0.00 0.00 55.97 53.05 1fiv s LYS 12 Cb 0.09 -0.50 -0.12 0.00 -2.06 0.00 0.00 37.83 35.25 1fiv s LYS 12 CO 0.50 -0.13 1.63 0.54 0.10 0.00 0.00 175.35 177.98 1fiv n ARG 13 N -0.39 2.61 -2.69 1.78 1.74 -1.26 -4.90 116.66 113.56 1fiv n ARG 13 Ca -0.05 0.94 -0.42 0.00 -0.77 0.00 0.00 57.85 57.55 1fiv n ARG 13 Cb 0.64 -2.73 -0.03 0.00 -1.02 0.00 0.00 32.46 29.32 1fiv n ARG 13 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1fiv s PRO 14 N 0.29 3.26 0.12 5.56 0.04 -1.26 -5.01 135.00 138.00 1fiv s PRO 14 Ca 0.70 -0.30 0.04 0.00 0.04 0.00 0.00 61.00 61.48 1fiv s PRO 14 Cb -0.53 -4.14 -0.04 0.00 0.04 0.00 0.00 34.50 29.83 1fiv s PRO 14 CO 0.41 -1.85 0.14 -1.21 0.04 0.00 0.00 177.00 174.53 1fiv s GLU 15 N 4.83 3.01 -0.06 4.56 2.02 -1.26 -0.19 118.70 131.61 1fiv s GLU 15 Ca 0.32 -0.73 -0.06 0.00 0.02 0.00 0.00 54.97 54.52 1fiv s GLU 15 Cb -0.11 -2.75 0.02 0.00 0.10 0.00 0.00 34.13 31.39 1fiv s GLU 15 CO 0.17 0.53 0.16 -1.50 0.02 0.00 0.00 175.26 174.63 1fiv s ILE 16 N -1.60 0.00 -0.25 -1.63 2.07 0.96 -4.92 121.20 115.83 1fiv s ILE 16 Ca 0.31 -0.01 -0.20 0.00 -1.41 0.00 0.00 60.65 59.34 1fiv s ILE 16 Cb -0.11 -0.23 -0.02 0.00 0.13 0.00 0.00 42.46 42.22 1fiv s ILE 16 CO 0.24 -0.01 0.60 -0.22 -1.91 0.00 0.00 174.94 173.64 1fiv s LEU 17 N 0.06 4.07 -0.01 8.50 1.98 -1.26 0.12 118.68 132.13 1fiv s LEU 17 Ca -0.00 0.67 0.03 0.00 -2.89 0.00 0.00 54.13 51.93 1fiv s LEU 17 Cb -0.01 -2.80 -0.00 0.00 0.66 0.00 0.00 46.19 44.03 1fiv s LEU 17 CO 0.00 -0.33 -0.09 -0.63 -1.89 0.00 0.00 176.35 173.41 1fiv s ILE 18 N 2.38 0.70 -0.32 6.68 1.01 -0.02 -2.58 121.20 129.04 1fiv s ILE 18 Ca 0.25 -0.36 -0.28 0.00 0.00 0.00 0.00 60.65 60.26 1fiv s ILE 18 Cb -0.16 -0.60 0.01 0.00 0.01 0.00 0.00 42.46 41.73 1fiv s ILE 18 CO 0.09 0.20 1.03 -0.36 0.00 0.00 0.00 174.94 175.90 1fiv s PHE 19 N -0.08 3.16 -0.52 3.97 0.08 0.77 -0.40 117.98 124.96 1fiv s PHE 19 Ca 0.01 1.14 -0.14 0.00 0.12 0.00 0.00 56.93 58.06 1fiv s PHE 19 Cb -0.05 -3.62 0.12 0.00 -0.57 0.00 0.00 43.02 38.91 1fiv s PHE 19 CO -0.00 -0.74 0.46 0.08 -0.10 0.00 0.00 175.22 174.92 1fiv s VAL 20 N 3.55 4.96 -1.32 -0.44 1.01 0.18 -1.90 120.40 126.44 1fiv s VAL 20 Ca 0.43 -1.55 -0.06 0.00 0.00 0.00 0.00 61.98 60.81 1fiv s VAL 20 Cb -0.12 -4.19 0.02 0.00 0.00 0.00 0.00 36.38 32.08 1fiv s VAL 20 CO 0.15 -0.83 1.05 0.59 0.00 0.00 0.00 175.10 176.06 1fiv n ASN 21 N 5.16 -4.28 0.00 3.32 3.02 0.11 -2.29 115.26 120.31 1fiv n ASN 21 Ca -0.12 -0.62 0.00 0.00 -0.03 0.00 0.00 54.58 53.80 1fiv n ASN 21 Cb 0.40 -4.83 0.00 0.00 -0.61 0.00 0.00 39.78 34.75 1fiv n ASN 21 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fiv n GLY 22 N -1.65 0.82 3.31 7.41 0.00 -1.26 -4.92 105.19 108.90 1fiv n GLY 22 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 1fiv n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fiv s TYR 23 N -2.95 2.46 -0.01 1.61 1.51 -0.97 -5.06 117.35 113.94 1fiv s TYR 23 Ca 0.00 -0.56 -0.30 0.00 -1.01 0.00 0.00 57.07 55.20 1fiv s TYR 23 Cb 0.00 -1.58 -0.04 0.00 -0.11 0.00 0.00 41.96 40.23 1fiv s TYR 23 CO 0.00 -0.11 1.18 -1.25 -1.11 0.00 0.00 175.55 174.27 1fiv s PRO 24 N -0.35 4.39 -0.04 -1.71 0.04 -1.26 0.50 135.00 136.57 1fiv s PRO 24 Ca 0.02 1.69 0.03 0.00 0.04 0.00 0.00 61.00 62.78 1fiv s PRO 24 Cb -0.12 -3.48 0.01 0.00 0.04 0.00 0.00 34.50 30.94 1fiv s PRO 24 CO 0.02 -0.36 -0.11 0.42 0.04 0.00 0.00 177.00 177.01 1fiv s ILE 25 N 1.75 0.98 -0.37 0.56 1.01 0.47 -4.93 121.20 120.65 1fiv s ILE 25 Ca 0.57 -0.44 -0.17 0.00 0.00 0.00 0.00 60.65 60.61 1fiv s ILE 25 Cb -0.26 -0.88 0.00 0.00 0.01 0.00 0.00 42.46 41.34 1fiv s ILE 25 CO 0.25 0.30 0.44 -0.75 0.00 0.00 0.00 174.94 175.18 1fiv s LYS 26 N 0.36 3.42 0.26 2.79 2.20 -1.26 -0.84 119.74 126.66 1fiv s LYS 26 Ca -0.07 -0.45 0.03 0.00 -0.36 0.00 0.00 55.97 55.11 1fiv s LYS 26 Cb -0.12 -3.86 -0.03 0.00 -1.51 0.00 0.00 37.83 32.31 1fiv s LYS 26 CO 0.02 -0.69 0.41 -0.06 -0.36 0.00 0.00 175.35 174.67 1fiv s PHE 27 N 2.20 3.47 -0.24 4.03 0.08 0.31 -4.45 117.98 123.39 1fiv s PHE 27 Ca 0.14 0.15 -0.14 0.00 0.12 0.00 0.00 56.93 57.20 1fiv s PHE 27 Cb -0.16 -1.71 -0.04 0.00 -0.57 0.00 0.00 43.02 40.53 1fiv s PHE 27 CO 0.13 0.34 0.34 -1.17 -0.10 0.00 0.00 175.22 174.77 1fiv s LEU 28 N -3.92 4.09 -0.39 -0.37 2.96 -0.52 -0.03 118.68 120.50 1fiv s LEU 28 Ca 0.36 0.34 -0.29 0.00 -0.22 0.00 0.00 54.13 54.32 1fiv s LEU 28 Cb -0.10 -2.40 0.01 0.00 0.50 0.00 0.00 46.19 44.21 1fiv s LEU 28 CO 0.31 -0.10 1.29 -0.76 -1.32 0.00 0.00 176.35 175.77 1fiv s LEU 29 N 1.61 3.71 -0.48 -0.68 1.43 0.73 -1.23 118.68 123.77 1fiv s LEU 29 Ca 0.15 0.87 0.04 0.00 -1.03 0.00 0.00 54.13 54.16 1fiv s LEU 29 Cb -0.15 -3.54 0.13 0.00 0.03 0.00 0.00 46.19 42.65 1fiv s LEU 29 CO 0.08 -1.25 0.22 -0.62 0.23 0.00 0.00 176.35 175.02 1fiv s ASP 30 N 3.08 4.32 0.03 2.29 2.15 -0.12 -4.76 116.67 123.66 1fiv s ASP 30 Ca 0.55 -2.84 0.04 0.00 0.43 0.00 0.00 52.55 50.74 1fiv s ASP 30 Cb -0.13 -1.57 0.18 0.00 -0.30 0.00 0.00 42.92 41.10 1fiv s ASP 30 CO 0.28 -0.26 1.12 0.35 -0.17 0.00 0.00 175.17 176.49 1fiv n THR 31 N 3.34 1.79 1.07 1.71 -2.24 -1.26 -1.31 114.28 117.37 1fiv n THR 31 Ca 0.05 0.49 0.12 0.00 -2.27 0.00 0.00 64.05 62.44 1fiv n THR 31 Cb 0.34 -1.45 0.32 0.00 -2.10 0.00 0.00 70.33 67.44 1fiv n THR 31 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fiv n GLY 32 N -1.28 0.66 3.46 3.38 0.00 -1.26 -4.84 105.19 105.30 1fiv n GLY 32 Ca 0.00 -0.55 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 1fiv n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fiv s ALA 33 N -1.84 3.01 0.29 4.61 0.00 -0.43 -4.99 121.76 122.41 1fiv s ALA 33 Ca 0.34 -0.94 0.14 0.00 0.00 0.00 0.00 51.96 51.50 1fiv s ALA 33 Cb 0.20 -1.69 0.60 0.00 0.00 0.00 0.00 23.12 22.24 1fiv s ALA 33 CO 0.30 -0.03 1.73 -0.44 0.00 0.00 0.00 175.76 177.33 1fiv h ASP 34 N 7.23 0.00 -3.55 0.00 3.32 -1.88 -1.26 116.42 120.28 1fiv h ASP 34 Ca -0.34 0.00 -0.44 0.00 0.02 0.00 0.00 57.03 56.26 1fiv h ASP 34 Cb 1.18 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.57 1fiv h ASP 34 CO 0.62 0.46 -0.75 0.27 -1.72 0.00 0.00 179.24 178.12 1fiv s ILE 35 N -3.84 1.60 -0.15 0.35 -4.36 -1.26 -2.11 121.20 111.44 1fiv s ILE 35 Ca -0.02 -2.02 -0.29 0.00 -0.26 0.00 0.00 60.65 58.06 1fiv s ILE 35 Cb 0.13 -1.87 -0.00 0.00 1.25 0.00 0.00 42.46 41.97 1fiv s ILE 35 CO 0.73 -0.51 1.03 -0.89 0.24 0.00 0.00 174.94 175.53 1fiv s THR 36 N -2.63 4.72 0.05 8.37 2.01 -1.26 -3.77 115.64 123.12 1fiv s THR 36 Ca 0.17 2.02 0.06 0.00 0.31 0.00 0.00 61.69 64.25 1fiv s THR 36 Cb -0.02 -4.30 -0.02 0.00 0.01 0.00 0.00 72.50 68.16 1fiv s THR 36 CO 0.05 -0.07 -0.16 0.27 -0.69 0.00 0.00 174.62 174.02 1fiv s ILE 37 N 2.51 1.28 0.11 1.82 -4.36 -0.57 -0.83 121.20 121.16 1fiv s ILE 37 Ca 0.47 -1.14 -0.13 0.00 -0.26 0.00 0.00 60.65 59.59 1fiv s ILE 37 Cb -0.17 -1.16 0.02 0.00 1.25 0.00 0.00 42.46 42.40 1fiv s ILE 37 CO 0.13 0.00 0.31 -1.48 0.24 0.00 0.00 174.94 174.15 1fiv s LEU 38 N -1.31 0.83 0.47 0.37 2.34 -0.68 -1.75 118.68 118.94 1fiv s LEU 38 Ca 0.03 -0.44 -0.21 0.00 0.06 0.00 0.00 54.13 53.57 1fiv s LEU 38 Cb -0.09 1.50 -0.08 0.00 -0.56 0.00 0.00 46.19 46.96 1fiv s LEU 38 CO 0.02 -0.79 1.06 0.20 -1.06 0.00 0.00 176.35 175.78 1fiv s ASN 39 N -2.78 6.37 0.35 1.48 0.01 -1.26 -1.53 114.94 117.58 1fiv s ASN 39 Ca 0.03 2.02 0.10 0.00 -0.71 0.00 0.00 52.86 54.30 1fiv s ASN 39 Cb 0.03 -2.57 0.87 0.00 0.41 0.00 0.00 41.25 39.98 1fiv s ASN 39 CO -0.11 -0.77 1.83 -0.09 -1.51 0.00 0.00 177.10 176.45 1fiv h ARG 40 N 1.81 0.62 0.00 -0.60 9.65 -1.27 -1.21 114.38 123.38 1fiv h ARG 40 Ca -0.49 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.35 1fiv h ARG 40 Cb 1.23 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 29.67 1fiv h ARG 40 CO 0.60 0.41 0.14 0.07 2.80 0.00 0.00 179.97 183.99 1fiv h ARG 41 N 0.64 0.00 -0.01 0.20 0.11 -1.92 -1.81 114.38 111.60 1fiv h ARG 41 Ca 0.51 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.59 1fiv h ARG 41 Cb 0.93 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.01 1fiv h ARG 41 CO -0.26 0.00 -0.67 -0.25 0.10 0.00 0.00 179.97 178.89 1fiv n ASP 42 N -2.97 1.27 -4.65 0.08 8.00 -0.46 -4.96 116.55 112.86 1fiv n ASP 42 Ca -0.03 -1.13 -0.38 0.00 0.71 0.00 0.00 54.79 53.96 1fiv n ASP 42 Cb 0.20 0.78 -0.08 0.00 -0.02 0.00 0.00 41.12 42.00 1fiv n ASP 42 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1fiv s PHE 43 N -2.50 3.32 -0.34 1.24 5.36 -0.68 -5.03 117.98 119.35 1fiv s PHE 43 Ca 0.11 0.47 -0.11 0.00 -0.96 0.00 0.00 56.93 56.43 1fiv s PHE 43 Cb 0.14 -2.49 -0.00 0.00 -0.34 0.00 0.00 43.02 40.33 1fiv s PHE 43 CO 0.64 -0.07 0.21 -0.65 -1.46 0.00 0.00 175.22 173.89 1fiv s GLN 44 N 1.51 3.24 0.19 10.12 -1.52 -1.26 -4.98 119.66 126.95 1fiv s GLN 44 Ca 0.15 -0.80 -0.13 0.00 -1.95 0.00 0.00 55.36 52.63 1fiv s GLN 44 Cb -0.15 -3.72 0.11 0.00 -0.22 0.00 0.00 33.01 29.03 1fiv s GLN 44 CO 0.08 -0.52 1.84 0.28 -0.25 0.00 0.00 175.29 176.72 1fiv h VAL 45 N 5.65 1.11 0.00 1.09 2.07 -1.96 -3.46 116.25 120.76 1fiv h VAL 45 Ca -0.30 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1fiv h VAL 45 Cb 1.14 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1fiv h VAL 45 CO 0.64 0.14 0.00 1.17 0.02 0.00 0.00 177.57 179.54 1fiv n LYS 46 N -4.71 0.00 -0.39 1.57 4.81 -1.26 -1.46 118.16 116.72 1fiv n LYS 46 Ca 0.05 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.57 1fiv n LYS 46 Cb 0.05 0.00 0.27 0.00 0.02 0.00 0.00 35.03 35.37 1fiv n LYS 46 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1fiv n ASN 47 N 3.77 3.50 -4.82 3.14 3.02 -1.26 -4.94 115.26 117.66 1fiv n ASN 47 Ca 0.00 -2.16 -0.32 0.00 -0.03 0.00 0.00 54.58 52.07 1fiv n ASN 47 Cb 0.00 -0.45 0.02 0.00 -0.61 0.00 0.00 39.78 38.74 1fiv n ASN 47 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1fiv s SER 48 N -0.91 5.80 -0.06 6.41 0.01 -0.54 -4.95 113.70 119.46 1fiv s SER 48 Ca 0.40 1.66 0.05 0.00 1.31 0.00 0.00 55.95 59.37 1fiv s SER 48 Cb 0.23 -2.51 -0.00 0.00 0.21 0.00 0.00 66.02 63.95 1fiv s SER 48 CO 0.24 -1.16 -0.21 0.27 0.41 0.00 0.00 173.24 172.79 1fiv s ILE 49 N -2.79 1.72 0.30 1.44 -0.00 -0.93 -4.95 121.20 115.98 1fiv s ILE 49 Ca 0.60 -0.87 -0.29 0.00 -0.00 0.00 0.00 60.65 60.08 1fiv s ILE 49 Cb -0.14 -1.47 -0.11 0.00 -0.00 0.00 0.00 42.46 40.74 1fiv s ILE 49 CO 0.45 0.49 1.49 -0.70 -0.00 0.00 0.00 174.94 176.67 1fiv s GLU 50 N 0.04 4.19 -0.22 0.37 -6.30 -1.26 -0.96 118.70 114.56 1fiv s GLU 50 Ca -0.06 2.44 0.23 0.00 -2.50 0.00 0.00 54.97 55.09 1fiv s GLU 50 Cb -0.13 -3.05 0.50 0.00 0.00 0.00 0.00 34.13 31.45 1fiv s GLU 50 CO 0.04 -0.49 1.12 -1.71 0.02 0.00 0.00 175.26 174.23 1fiv n ASN 51 N 1.75 1.48 0.00 -1.70 4.05 0.11 -4.86 115.26 116.11 1fiv n ASN 51 Ca 0.05 -2.02 0.00 0.00 0.45 0.00 0.00 54.58 53.07 1fiv n ASN 51 Cb 0.39 -0.45 0.00 0.00 1.23 0.00 0.00 39.78 40.95 1fiv n ASN 51 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1fiv n GLY 52 N -0.44 -0.25 3.91 8.20 0.00 -1.26 -4.75 105.19 110.59 1fiv n GLY 52 Ca 0.07 -1.88 -0.28 0.00 0.00 0.00 0.00 46.02 43.93 1fiv n GLY 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fiv s ARG 53 N -1.06 3.62 -0.02 1.61 0.52 -1.26 -0.19 118.95 122.16 1fiv s ARG 53 Ca 0.00 0.09 0.01 0.00 -0.52 0.00 0.00 55.73 55.31 1fiv s ARG 53 Cb 0.00 -2.54 0.01 0.00 0.52 0.00 0.00 34.95 32.94 1fiv s ARG 53 CO 0.00 0.06 -0.05 -1.14 0.02 0.00 0.00 175.30 174.19 1fiv s GLN 54 N -4.00 0.64 -0.03 3.54 2.00 -0.48 -4.85 119.66 116.48 1fiv s GLN 54 Ca 0.45 -0.14 -0.04 0.00 -2.00 0.00 0.00 55.36 53.63 1fiv s GLN 54 Cb -0.10 -0.65 -0.04 0.00 0.80 0.00 0.00 33.01 33.02 1fiv s GLN 54 CO 0.35 0.01 0.19 -0.80 -0.50 0.00 0.00 175.29 174.54 1fiv s ASN 55 N 0.43 6.40 0.07 6.67 -0.87 -1.26 -0.76 114.94 125.61 1fiv s ASN 55 Ca -0.05 0.41 0.04 0.00 -1.57 0.00 0.00 52.86 51.69 1fiv s ASN 55 Cb -0.09 -2.03 -0.03 0.00 -0.02 0.00 0.00 41.25 39.08 1fiv s ASN 55 CO -0.00 0.29 -0.12 -0.04 -2.57 0.00 0.00 177.10 174.66 1fiv s MET 56 N -1.74 0.75 -0.05 -0.60 -1.94 0.01 -4.97 119.30 110.76 1fiv s MET 56 Ca 0.25 -0.93 0.03 0.00 -1.71 0.00 0.00 55.69 53.32 1fiv s MET 56 Cb -0.13 -0.66 0.01 0.00 2.01 0.00 0.00 34.83 36.06 1fiv s MET 56 CO 0.16 0.14 -0.11 0.42 -0.01 0.00 0.00 175.02 175.61 1fiv s ILE 57 N -1.44 1.03 0.09 2.53 -1.09 -1.26 -1.39 121.20 119.67 1fiv s ILE 57 Ca -0.03 -0.45 0.01 0.00 -2.23 0.00 0.00 60.65 57.95 1fiv s ILE 57 Cb -0.09 -0.94 -0.00 0.00 -1.58 0.00 0.00 42.46 39.85 1fiv s ILE 57 CO 0.02 0.32 0.04 0.61 -1.23 0.00 0.00 174.94 174.70 1fiv n GLY 58 N 3.60 3.87 0.27 6.18 0.00 1.00 -5.00 105.19 115.12 1fiv n GLY 58 Ca -0.21 -1.89 0.15 0.00 0.00 0.00 0.00 46.02 44.06 1fiv n GLY 58 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fiv h VAL 59 N 1.18 0.41 -0.00 1.61 2.07 -2.02 -3.17 116.25 116.32 1fiv h VAL 59 Ca -0.07 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 66.97 1fiv h VAL 59 Cb 0.27 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1fiv h VAL 59 CO 0.10 0.09 -0.87 0.61 0.02 0.00 0.00 177.57 177.52 1fiv n GLY 60 N -0.61 -0.75 0.00 2.17 0.00 -1.26 -5.09 105.19 99.66 1fiv n GLY 60 Ca -0.02 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1fiv n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fiv n GLY 61 N 1.44 0.18 3.79 -0.02 0.00 -1.20 -5.14 105.19 104.23 1fiv n GLY 61 Ca 0.04 -1.29 -0.22 0.00 0.00 0.00 0.00 46.02 44.55 1fiv n GLY 61 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fiv s GLY 62 N 0.00 1.58 0.05 -0.02 0.00 -1.26 -0.00 107.32 107.67 1fiv s GLY 62 Ca 0.00 -1.55 -0.09 0.00 0.00 0.00 0.00 44.72 43.08 1fiv s GLY 62 CO 0.00 -1.56 0.18 0.54 0.00 0.00 0.00 173.10 172.26 1fiv s LYS 63 N -3.84 0.70 -0.06 2.90 -0.14 -0.49 -4.95 119.74 113.86 1fiv s LYS 63 Ca 0.35 -0.70 0.04 0.00 -1.36 0.00 0.00 55.97 54.30 1fiv s LYS 63 Cb -0.07 0.29 -0.02 0.00 -1.68 0.00 0.00 37.83 36.35 1fiv s LYS 63 CO 0.24 -0.20 -0.18 1.03 -0.76 0.00 0.00 175.35 175.48 1fiv s ARG 64 N -2.77 2.58 0.33 1.68 0.52 -1.26 -0.81 118.95 119.22 1fiv s ARG 64 Ca -0.03 -0.77 0.03 0.00 -0.52 0.00 0.00 55.73 54.44 1fiv s ARG 64 Cb -0.00 -2.32 -0.05 0.00 0.52 0.00 0.00 34.95 33.10 1fiv s ARG 64 CO -0.05 0.51 0.10 0.20 0.02 0.00 0.00 175.30 176.08 1fiv s GLY 65 N -0.45 2.16 -0.20 -3.53 0.00 0.06 -4.55 107.32 100.81 1fiv s GLY 65 Ca 0.05 -1.75 -0.05 0.00 0.00 0.00 0.00 44.72 42.97 1fiv s GLY 65 CO 0.02 -1.76 0.01 -1.59 0.00 0.00 0.00 173.10 169.78 1fiv s THR 66 N -3.39 4.08 0.35 0.90 2.01 0.03 -1.38 115.64 118.23 1fiv s THR 66 Ca 0.33 -0.27 -0.22 0.00 0.31 0.00 0.00 61.69 61.84 1fiv s THR 66 Cb 0.06 -2.84 -0.10 0.00 0.01 0.00 0.00 72.50 69.64 1fiv s THR 66 CO 0.15 0.43 0.89 0.20 -0.69 0.00 0.00 174.62 175.60 1fiv s ASN 67 N 0.88 7.07 0.03 3.53 0.02 0.73 -0.94 114.94 126.26 1fiv s ASN 67 Ca 0.01 1.64 0.03 0.00 -1.02 0.00 0.00 52.86 53.53 1fiv s ASN 67 Cb -0.14 -2.51 -0.02 0.00 0.02 0.00 0.00 41.25 38.60 1fiv s ASN 67 CO 0.02 -0.18 -0.10 -0.31 0.02 0.00 0.00 177.10 176.55 1fiv s TYR 68 N -1.87 0.89 0.28 2.20 1.51 0.16 0.09 117.35 120.62 1fiv s TYR 68 Ca 0.54 -0.35 0.07 0.00 -1.01 0.00 0.00 57.07 56.32 1fiv s TYR 68 Cb -0.14 -0.53 -0.06 0.00 -0.11 0.00 0.00 41.96 41.12 1fiv s TYR 68 CO 0.18 -0.01 -0.06 0.96 -1.11 0.00 0.00 175.55 175.51 1fiv s ILE 69 N -0.88 1.69 -0.84 2.71 -4.36 -0.13 -1.83 121.20 117.55 1fiv s ILE 69 Ca -0.02 -2.13 -0.03 0.00 -0.26 0.00 0.00 60.65 58.21 1fiv s ILE 69 Cb -0.07 -2.47 0.00 0.00 1.25 0.00 0.00 42.46 41.17 1fiv s ILE 69 CO 0.01 -0.29 0.34 -3.20 0.24 0.00 0.00 174.94 172.03 1fiv n ASN 70 N -0.60 -4.03 -4.66 4.36 5.15 -0.89 -2.20 115.26 112.39 1fiv n ASN 70 Ca -0.05 -0.16 -0.40 0.00 -0.60 0.00 0.00 54.58 53.37 1fiv n ASN 70 Cb 0.63 -2.92 -0.06 0.00 -0.53 0.00 0.00 39.78 36.91 1fiv n ASN 70 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1fiv s VAL 71 N -2.88 5.04 -0.10 3.44 1.01 -0.47 -4.01 120.40 122.43 1fiv s VAL 71 Ca 0.17 1.13 -0.30 0.00 0.00 0.00 0.00 61.98 62.98 1fiv s VAL 71 Cb -0.07 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 1fiv s VAL 71 CO 0.21 0.12 1.11 -2.28 0.00 0.00 0.00 175.10 174.26 1fiv s HIS 72 N 1.86 3.33 -0.17 5.22 2.46 -1.26 -0.60 115.29 126.13 1fiv s HIS 72 Ca 0.27 1.39 0.01 0.00 0.47 0.00 0.00 55.06 57.20 1fiv s HIS 72 Cb -0.16 -3.31 0.03 0.00 -0.13 0.00 0.00 32.58 29.01 1fiv s HIS 72 CO 0.10 -0.79 -0.15 -0.51 -2.47 0.00 0.00 174.74 170.92 1fiv s LEU 73 N 2.26 2.01 -0.09 8.88 1.43 -0.18 -0.71 118.68 132.29 1fiv s LEU 73 Ca 0.52 -0.65 0.02 0.00 -1.03 0.00 0.00 54.13 52.98 1fiv s LEU 73 Cb -0.21 -1.29 0.01 0.00 0.03 0.00 0.00 46.19 44.73 1fiv s LEU 73 CO 0.19 -0.06 -0.14 -1.83 0.23 0.00 0.00 176.35 174.74 1fiv s GLU 74 N 1.39 1.97 -0.08 1.70 -1.05 -0.80 -1.56 118.70 120.27 1fiv s GLU 74 Ca 0.03 -0.49 -0.30 0.00 -0.15 0.00 0.00 54.97 54.07 1fiv s GLU 74 Cb -0.14 -1.66 -0.02 0.00 -0.44 0.00 0.00 34.13 31.87 1fiv s GLU 74 CO -0.11 -0.02 1.04 0.42 0.95 0.00 0.00 175.26 177.54 1fiv s ILE 75 N 0.85 4.70 -0.47 1.83 1.01 0.16 -0.16 121.20 129.11 1fiv s ILE 75 Ca -0.10 1.97 0.08 0.00 0.00 0.00 0.00 60.65 62.59 1fiv s ILE 75 Cb -0.15 -4.26 0.27 0.00 0.01 0.00 0.00 42.46 38.32 1fiv s ILE 75 CO 0.01 0.02 0.63 0.54 0.00 0.00 0.00 174.94 176.15 1fiv n ARG 76 N 4.89 1.42 -4.67 2.79 5.12 -1.06 -3.87 116.66 121.28 1fiv n ARG 76 Ca 0.09 -3.76 -0.25 0.00 -1.93 0.00 0.00 57.85 51.99 1fiv n ARG 76 Cb 0.49 -1.63 -0.17 0.00 -1.16 0.00 0.00 32.46 29.99 1fiv n ARG 76 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1fiv s ASP 77 N -1.83 1.94 0.57 0.55 -1.08 -1.25 -4.73 116.67 110.85 1fiv s ASP 77 Ca 0.38 -0.33 0.27 0.00 -0.52 0.00 0.00 52.55 52.35 1fiv s ASP 77 Cb 0.19 -0.86 1.57 0.00 -1.46 0.00 0.00 42.92 42.35 1fiv s ASP 77 CO -0.08 0.06 2.06 -0.08 0.52 0.00 0.00 175.17 177.65 1fiv h GLU 78 N 6.87 0.00 -0.07 4.34 4.81 -1.98 -2.00 114.58 126.56 1fiv h GLU 78 Ca -0.30 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1fiv h GLU 78 Cb 1.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.57 1fiv h GLU 78 CO 0.47 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.84 1fiv n ASN 79 N -3.94 1.70 -4.21 1.04 4.13 -1.26 -4.93 115.26 107.80 1fiv n ASN 79 Ca 0.03 -1.61 -0.18 0.00 1.68 0.00 0.00 54.58 54.50 1fiv n ASN 79 Cb 0.39 -0.04 -0.12 0.00 -1.54 0.00 0.00 39.78 38.48 1fiv n ASN 79 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1fiv s TYR 80 N -1.92 1.32 0.59 3.10 2.02 -0.75 -4.84 117.35 116.87 1fiv s TYR 80 Ca 0.36 -0.52 -0.17 0.00 -0.37 0.00 0.00 57.07 56.37 1fiv s TYR 80 Cb 0.20 -0.71 -0.04 0.00 -0.40 0.00 0.00 41.96 41.01 1fiv s TYR 80 CO 0.31 0.10 1.08 -1.59 -1.57 0.00 0.00 175.55 173.88 1fiv s LYS 81 N -2.24 3.24 0.16 -0.62 -2.85 -1.26 -4.61 119.74 111.55 1fiv s LYS 81 Ca 0.04 1.35 -0.27 0.00 -1.00 0.00 0.00 55.97 56.09 1fiv s LYS 81 Cb -0.07 -2.01 -0.08 0.00 -2.06 0.00 0.00 37.83 33.61 1fiv s LYS 81 CO 0.03 -0.90 0.83 0.95 0.10 0.00 0.00 175.35 176.36 1fiv s THR 82 N -2.23 4.37 -0.09 3.79 -4.23 -1.26 -4.81 115.64 111.17 1fiv s THR 82 Ca 0.67 1.81 -0.30 0.00 -1.18 0.00 0.00 61.69 62.69 1fiv s THR 82 Cb -0.19 -4.19 0.10 0.00 1.34 0.00 0.00 72.50 69.56 1fiv s THR 82 CO 0.34 0.48 0.86 0.00 -0.54 0.00 0.00 174.62 175.76 1fiv s GLN 83 N -0.89 0.81 -0.02 3.99 -2.07 -1.25 -4.98 119.66 115.25 1fiv s GLN 83 Ca 0.38 0.10 0.08 0.00 -1.82 0.00 0.00 55.36 54.10 1fiv s GLN 83 Cb -0.23 0.38 -0.02 0.00 -1.09 0.00 0.00 33.01 32.05 1fiv s GLN 83 CO 0.27 -0.27 -0.26 0.00 -1.32 0.00 0.00 175.29 173.71 1fiv s ILE 85 N -0.60 0.12 -0.31 0.00 -4.36 -0.60 -4.99 121.20 110.45 1fiv s ILE 85 Ca 0.10 -1.62 -0.06 0.00 -0.26 0.00 0.00 60.65 58.80 1fiv s ILE 85 Cb -0.10 -1.78 0.03 0.00 1.25 0.00 0.00 42.46 41.86 1fiv s ILE 85 CO -0.01 -0.54 0.08 -0.36 0.24 0.00 0.00 174.94 174.34 1fiv s PHE 86 N -3.97 3.20 0.00 1.37 0.40 -1.26 -1.01 117.98 116.71 1fiv s PHE 86 Ca 0.16 -1.28 0.00 0.00 -0.60 0.00 0.00 56.93 55.21 1fiv s PHE 86 Cb 0.06 -2.24 0.00 0.00 0.51 0.00 0.00 43.02 41.35 1fiv s PHE 86 CO -0.03 -0.67 0.00 0.41 0.70 0.00 0.00 175.22 175.63 1fiv n GLY 87 N 4.81 6.23 3.42 4.36 0.00 0.24 -4.83 105.19 119.42 1fiv n GLY 87 Ca -0.14 -2.01 -0.27 0.00 0.00 0.00 0.00 46.02 43.60 1fiv n GLY 87 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fiv s ASN 88 N 0.25 3.39 0.05 1.61 0.01 -1.26 -1.37 114.94 117.62 1fiv s ASN 88 Ca 0.00 -0.86 -0.07 0.00 -0.71 0.00 0.00 52.86 51.21 1fiv s ASN 88 Cb 0.00 -0.25 -0.01 0.00 0.41 0.00 0.00 41.25 41.41 1fiv s ASN 88 CO 0.00 0.12 0.14 0.68 -1.51 0.00 0.00 177.10 176.53 1fiv s VAL 89 N -1.67 0.14 -0.11 1.60 -7.23 -0.76 -4.69 120.40 107.67 1fiv s VAL 89 Ca 0.20 -1.12 0.02 0.00 -1.81 0.00 0.00 61.98 59.28 1fiv s VAL 89 Cb -0.08 -1.08 0.01 0.00 0.56 0.00 0.00 36.38 35.79 1fiv s VAL 89 CO 0.10 -0.62 -0.17 0.00 -0.31 0.00 0.00 175.10 174.09 1fiv s VAL 91 N 0.83 4.36 -0.52 0.00 1.01 -0.12 -1.69 120.40 124.28 1fiv s VAL 91 Ca -0.09 -0.19 -0.21 0.00 0.00 0.00 0.00 61.98 61.49 1fiv s VAL 91 Cb -0.16 -2.94 0.05 0.00 0.00 0.00 0.00 36.38 33.33 1fiv s VAL 91 CO 0.00 0.48 0.73 -0.76 0.00 0.00 0.00 175.10 175.55 1fiv s LEU 92 N 0.36 4.66 0.62 3.92 1.43 -0.58 -0.79 118.68 128.30 1fiv s LEU 92 Ca -0.00 -0.69 0.37 0.00 -1.03 0.00 0.00 54.13 52.77 1fiv s LEU 92 Cb -0.13 -2.59 2.07 0.00 0.03 0.00 0.00 46.19 45.57 1fiv s LEU 92 CO 0.01 -0.99 2.29 -0.33 0.23 0.00 0.00 176.35 177.57 1fiv h GLU 93 N 9.09 0.00 -0.02 1.70 4.39 -1.89 0.58 114.58 128.44 1fiv h GLU 93 Ca -0.27 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.43 1fiv h GLU 93 Cb 1.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 1fiv h GLU 93 CO 1.00 0.01 -0.03 -0.40 -1.16 0.00 0.00 179.01 178.43 1fiv n ASP 94 N -3.45 1.58 -2.58 1.42 5.68 -1.26 -4.76 116.55 113.18 1fiv n ASP 94 Ca -0.03 -1.48 -0.15 0.00 -0.50 0.00 0.00 54.79 52.63 1fiv n ASP 94 Cb 0.10 0.02 -0.00 0.00 -1.14 0.00 0.00 41.12 40.09 1fiv n ASP 94 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1fiv n ASN 95 N 0.19 -4.29 -0.64 -1.12 3.02 -0.17 -4.84 115.26 107.40 1fiv n ASN 95 Ca 0.18 0.07 0.12 0.00 -0.03 0.00 0.00 54.58 54.92 1fiv n ASN 95 Cb 0.37 -3.61 0.38 0.00 -0.61 0.00 0.00 39.78 36.32 1fiv n ASN 95 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1fiv n SER 96 N -1.93 1.96 -4.73 6.41 3.41 -1.26 -4.92 113.62 112.56 1fiv n SER 96 Ca -0.14 -1.69 -0.41 0.00 -0.26 0.00 0.00 58.87 56.37 1fiv n SER 96 Cb 0.61 -0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.47 1fiv n SER 96 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1fiv s LEU 97 N -1.81 4.45 0.10 1.04 2.96 -1.26 -4.96 118.68 119.19 1fiv s LEU 97 Ca 0.35 1.97 -0.17 0.00 -0.22 0.00 0.00 54.13 56.06 1fiv s LEU 97 Cb 0.20 -3.59 -0.07 0.00 0.50 0.00 0.00 46.19 43.23 1fiv s LEU 97 CO 0.30 -0.24 1.50 0.40 -1.32 0.00 0.00 176.35 176.99 1fiv h ILE 98 N 4.06 1.28 -2.66 6.68 2.04 -2.02 -3.46 117.51 123.44 1fiv h ILE 98 Ca -0.43 -1.09 -0.11 0.00 1.00 0.00 0.00 64.86 64.23 1fiv h ILE 98 Cb 1.21 1.38 -0.22 0.00 -0.74 0.00 0.00 36.82 38.45 1fiv h ILE 98 CO 0.74 0.35 -0.17 -1.58 0.00 0.00 0.00 178.15 177.50 1fiv s GLN 99 N -4.79 0.61 0.41 2.37 0.74 -1.26 -5.15 119.66 112.59 1fiv s GLN 99 Ca -0.13 0.43 -0.27 0.00 0.05 0.00 0.00 55.36 55.44 1fiv s GLN 99 Cb 0.08 0.29 -0.10 0.00 1.10 0.00 0.00 33.01 34.38 1fiv s GLN 99 CO 0.78 -0.11 1.39 -2.30 -0.55 0.00 0.00 175.29 174.50 1fiv n PRO 100 N 2.33 2.29 -4.68 1.67 -0.02 -1.26 -4.89 135.00 130.44 1fiv n PRO 100 Ca -0.16 0.81 -0.33 0.00 -2.02 0.00 0.00 63.50 61.81 1fiv n PRO 100 Cb 0.57 -2.54 -0.15 0.00 -0.02 0.00 0.00 33.50 31.35 1fiv n PRO 100 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1fiv s LEU 101 N -2.00 2.42 -0.40 2.45 1.43 -0.72 -1.44 118.68 120.42 1fiv s LEU 101 Ca 0.58 -0.47 -0.18 0.00 -1.03 0.00 0.00 54.13 53.02 1fiv s LEU 101 Cb -0.49 -1.54 0.01 0.00 0.03 0.00 0.00 46.19 44.21 1fiv s LEU 101 CO 0.60 0.11 0.50 -0.22 0.23 0.00 0.00 176.35 177.57 1fiv s LEU 102 N 0.67 4.61 0.75 1.79 2.96 -0.36 -1.51 118.68 127.58 1fiv s LEU 102 Ca -0.08 -0.39 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 1fiv s LEU 102 Cb -0.16 -2.52 0.14 0.00 0.50 0.00 0.00 46.19 44.16 1fiv s LEU 102 CO 0.02 -0.59 1.03 -0.83 -1.32 0.00 0.00 176.35 174.66 1fiv s GLY 103 N 1.84 1.75 0.39 7.98 0.00 -1.25 -0.94 107.32 117.09 1fiv s GLY 103 Ca 0.16 -1.81 0.08 0.00 0.00 0.00 0.00 44.72 43.16 1fiv s GLY 103 CO 0.15 -1.19 1.96 3.21 0.00 0.00 0.00 173.10 177.22 1fiv h ARG 104 N -0.63 0.37 -0.75 2.90 3.08 -1.24 -1.83 114.38 116.30 1fiv h ARG 104 Ca -0.35 -0.06 0.17 0.00 0.07 0.00 0.00 59.98 59.80 1fiv h ARG 104 Cb 1.26 -0.06 -0.12 0.00 0.08 0.00 0.00 29.97 31.13 1fiv h ARG 104 CO 0.38 0.39 0.10 0.38 -1.07 0.00 0.00 179.97 180.16 1fiv h ASP 105 N 0.37 -0.15 0.32 7.04 2.03 -1.70 -1.83 116.42 122.50 1fiv h ASP 105 Ca 0.09 0.17 -0.27 0.00 -0.73 0.00 0.00 57.03 56.29 1fiv h ASP 105 Cb 0.23 0.27 -0.05 0.00 -0.83 0.00 0.00 39.33 38.95 1fiv h ASP 105 CO 0.00 -0.11 -1.92 0.59 -1.03 0.00 0.00 179.24 176.77 1fiv n ASN 106 N -5.25 0.47 0.27 4.15 5.03 -1.11 -4.13 115.26 114.70 1fiv n ASN 106 Ca 0.14 0.22 0.10 0.00 0.87 0.00 0.00 54.58 55.91 1fiv n ASN 106 Cb 0.48 0.55 0.71 0.00 -1.02 0.00 0.00 39.78 40.50 1fiv n ASN 106 CO 0.00 0.00 0.00 0.24 -1.83 0.00 0.00 177.26 175.67 1fiv h MET 107 N 0.00 0.00 -0.21 3.52 2.86 -0.86 -2.63 114.93 117.62 1fiv h MET 107 Ca -0.33 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.25 1fiv h MET 107 Cb 1.92 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.57 1fiv h MET 107 CO 0.05 0.04 -0.09 -0.84 1.06 0.00 0.00 176.91 177.13 1fiv h ILE 108 N 0.00 1.30 -0.18 -1.22 3.07 -1.50 -1.69 117.51 117.29 1fiv h ILE 108 Ca -0.00 -1.13 0.05 0.00 1.55 0.00 0.00 64.86 65.33 1fiv h ILE 108 Cb 0.08 1.60 -0.01 0.00 -0.27 0.00 0.00 36.82 38.23 1fiv h ILE 108 CO 0.01 0.34 0.14 0.11 -1.05 0.00 0.00 178.15 177.70 1fiv h LYS 109 N 0.14 0.00 -0.01 0.16 1.57 -1.66 -0.37 116.57 116.40 1fiv h LYS 109 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1fiv h LYS 109 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1fiv h LYS 109 CO 0.03 0.00 -0.41 1.19 -0.57 0.00 0.00 179.45 179.68 1fiv n PHE 110 N -4.32 0.00 -3.53 -1.35 3.72 -1.09 -4.96 117.46 105.94 1fiv n PHE 110 Ca 0.01 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.23 1fiv n PHE 110 Cb 0.28 -0.13 0.07 0.00 -0.94 0.00 0.00 39.48 38.75 1fiv n PHE 110 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1fiv n ASN 111 N -0.89 -1.81 -4.79 4.37 4.05 -0.15 -4.99 115.26 111.06 1fiv n ASN 111 Ca 0.09 -0.70 -0.39 0.00 0.45 0.00 0.00 54.58 54.04 1fiv n ASN 111 Cb 0.36 -4.73 -0.06 0.00 1.23 0.00 0.00 39.78 36.58 1fiv n ASN 111 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1fiv s ILE 112 N -3.48 4.82 0.18 -1.44 1.01 -0.86 -5.01 121.20 116.42 1fiv s ILE 112 Ca 0.01 1.22 0.02 0.00 0.00 0.00 0.00 60.65 61.90 1fiv s ILE 112 Cb -0.00 -3.91 -0.05 0.00 0.01 0.00 0.00 42.46 38.51 1fiv s ILE 112 CO 0.76 0.49 0.01 -0.13 0.00 0.00 0.00 174.94 176.08 1fiv s ARG 113 N -0.70 1.12 -0.15 2.79 0.52 -1.26 -4.72 118.95 116.55 1fiv s ARG 113 Ca 0.30 -1.55 -0.07 0.00 -0.52 0.00 0.00 55.73 53.89 1fiv s ARG 113 Cb -0.19 -0.23 -0.04 0.00 0.52 0.00 0.00 34.95 35.01 1fiv s ARG 113 CO 0.18 -0.15 0.08 -0.51 0.02 0.00 0.00 175.30 174.92 1fiv s LEU 114 N -3.18 4.00 -0.04 2.53 1.43 -1.26 -5.08 118.68 117.09 1fiv s LEU 114 Ca 0.25 0.23 0.05 0.00 -1.03 0.00 0.00 54.13 53.63 1fiv s LEU 114 Cb 0.06 -1.99 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 1fiv s LEU 114 CO 0.05 0.28 -0.17 -0.69 0.23 0.00 0.00 176.35 176.04 1fiv s VAL 115 N -0.25 1.44 0.00 -1.59 1.01 -1.26 -5.27 120.40 114.48 1fiv s VAL 115 Ca 0.09 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1fiv s VAL 115 Cb -0.12 -1.23 0.00 0.00 0.00 0.00 0.00 36.38 35.03 1fiv s VAL 115 CO 0.01 0.41 0.37 0.80 0.00 0.00 0.00 175.10 176.69