#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fx5 n ASP 2 N 0.00 2.05 -4.30 4.04 8.00 -1.26 -4.50 116.55 120.58 1fx5 n ASP 2 Ca 0.00 0.12 -0.28 0.00 0.71 0.00 0.00 54.79 55.34 1fx5 n ASP 2 Cb 0.00 -0.72 -0.15 0.00 -0.02 0.00 0.00 41.12 40.23 1fx5 n ASP 2 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1fx5 s ASP 3 N -6.88 2.86 -0.22 -2.24 -0.00 -1.26 -3.38 116.67 105.54 1fx5 s ASP 3 Ca -0.28 -0.55 -0.17 0.00 -0.00 0.00 0.00 52.55 51.55 1fx5 s ASP 3 Cb 0.08 -0.26 0.06 0.00 -0.00 0.00 0.00 42.92 42.80 1fx5 s ASP 3 CO 0.68 0.22 0.57 -0.22 -0.00 0.00 0.00 175.17 176.42 1fx5 s LEU 4 N -1.16 -0.36 -0.25 1.23 2.96 -0.74 -5.01 118.68 115.34 1fx5 s LEU 4 Ca 0.10 1.19 -0.18 0.00 -0.22 0.00 0.00 54.13 55.02 1fx5 s LEU 4 Cb -0.09 1.95 0.07 0.00 0.50 0.00 0.00 46.19 48.62 1fx5 s LEU 4 CO 0.02 -0.21 0.64 -0.94 -1.32 0.00 0.00 176.35 174.54 1fx5 s SER 5 N 0.82 -0.79 0.08 3.68 1.04 -1.26 -0.93 113.70 116.34 1fx5 s SER 5 Ca -0.04 1.37 -0.00 0.00 0.48 0.00 0.00 55.95 57.75 1fx5 s SER 5 Cb -0.05 1.29 -0.04 0.00 0.10 0.00 0.00 66.02 67.32 1fx5 s SER 5 CO -0.07 -0.23 -0.03 0.72 0.98 0.00 0.00 173.24 174.62 1fx5 s PHE 6 N 1.11 0.69 -0.08 5.02 -0.12 -0.67 -5.00 117.98 118.93 1fx5 s PHE 6 Ca -0.06 -1.05 -0.04 0.00 -0.05 0.00 0.00 56.93 55.73 1fx5 s PHE 6 Cb -0.05 -0.45 0.04 0.00 -0.63 0.00 0.00 43.02 41.93 1fx5 s PHE 6 CO -0.11 -0.33 0.19 0.21 -0.05 0.00 0.00 175.22 175.13 1fx5 s LYS 7 N -3.91 0.14 -0.30 1.99 2.20 -1.26 -2.03 119.74 116.56 1fx5 s LYS 7 Ca 0.11 0.45 -0.02 0.00 -0.36 0.00 0.00 55.97 56.15 1fx5 s LYS 7 Cb 0.07 -0.16 0.05 0.00 -1.51 0.00 0.00 37.83 36.29 1fx5 s LYS 7 CO -0.07 -0.17 0.01 -0.06 -0.36 0.00 0.00 175.35 174.70 1fx5 s PHE 8 N 1.25 3.28 -0.00 4.03 0.08 0.74 -4.96 117.98 122.39 1fx5 s PHE 8 Ca -0.09 -1.91 0.21 0.00 0.12 0.00 0.00 56.93 55.26 1fx5 s PHE 8 Cb -0.11 -2.16 0.59 0.00 -0.57 0.00 0.00 43.02 40.77 1fx5 s PHE 8 CO -0.07 -0.81 1.68 0.87 -0.10 0.00 0.00 175.22 176.79 1fx5 h LYS 9 N 7.99 0.00 -1.83 0.44 1.57 -1.89 -2.20 116.57 120.65 1fx5 h LYS 9 Ca -0.21 0.00 0.26 0.00 -1.87 0.00 0.00 60.65 58.83 1fx5 h LYS 9 Cb 1.06 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.26 1fx5 h LYS 9 CO 0.54 0.31 0.68 0.54 -0.57 0.00 0.00 179.45 180.94 1fx5 s ASN 10 N -6.29 -0.12 0.20 0.86 2.20 -1.26 -4.67 114.94 105.87 1fx5 s ASN 10 Ca 0.02 -0.24 0.07 0.00 -0.94 0.00 0.00 52.86 51.77 1fx5 s ASN 10 Cb 0.09 0.30 -0.04 0.00 -2.00 0.00 0.00 41.25 39.60 1fx5 s ASN 10 CO 0.68 -0.55 0.08 -0.36 -2.94 0.00 0.00 177.10 174.01 1fx5 s PHE 11 N -2.80 2.97 -0.06 1.54 0.40 -0.99 -5.03 117.98 114.01 1fx5 s PHE 11 Ca 0.13 -0.11 0.05 0.00 -0.60 0.00 0.00 56.93 56.40 1fx5 s PHE 11 Cb 0.02 -1.39 -0.01 0.00 0.51 0.00 0.00 43.02 42.14 1fx5 s PHE 11 CO -0.02 0.53 -0.21 -1.54 0.70 0.00 0.00 175.22 174.68 1fx5 s SER 12 N -3.30 3.37 0.26 1.36 1.04 -1.26 -4.33 113.70 110.84 1fx5 s SER 12 Ca 0.30 -0.43 -0.01 0.00 0.48 0.00 0.00 55.95 56.29 1fx5 s SER 12 Cb -0.09 -0.92 0.52 0.00 0.10 0.00 0.00 66.02 65.63 1fx5 s SER 12 CO 0.22 0.26 1.76 0.06 0.98 0.00 0.00 173.24 176.52 1fx5 h GLN 13 N 5.99 0.61 -0.89 4.02 -0.00 -1.85 -2.28 115.11 120.72 1fx5 h GLN 13 Ca -0.34 -0.04 -0.32 0.00 -0.00 0.00 0.00 58.65 57.96 1fx5 h GLN 13 Cb 1.17 -0.14 -0.19 0.00 -0.00 0.00 0.00 27.48 28.33 1fx5 h GLN 13 CO 0.49 0.40 0.40 0.09 -0.00 0.00 0.00 178.83 180.21 1fx5 n ASN 14 N -4.87 4.14 -4.71 0.06 4.13 -1.26 -4.92 115.26 107.84 1fx5 n ASN 14 Ca 0.17 -3.23 -0.31 0.00 1.68 0.00 0.00 54.58 52.88 1fx5 n ASN 14 Cb 0.42 -0.76 0.14 0.00 -1.54 0.00 0.00 39.78 38.04 1fx5 n ASN 14 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1fx5 s GLY 15 N -0.92 1.68 0.00 7.41 0.00 -0.86 -5.01 107.32 109.63 1fx5 s GLY 15 Ca 0.50 0.46 0.00 0.00 0.00 0.00 0.00 44.72 45.68 1fx5 s GLY 15 CO 0.11 0.85 0.57 0.28 0.00 0.00 0.00 173.10 174.91 1fx5 n LYS 16 N -3.95 0.38 -0.87 2.90 5.02 -1.26 -4.82 118.16 115.56 1fx5 n LYS 16 Ca 0.11 -0.71 -0.06 0.00 -2.02 0.00 0.00 58.31 55.63 1fx5 n LYS 16 Cb 0.52 -0.88 0.24 0.00 -0.02 0.00 0.00 35.03 34.89 1fx5 n LYS 16 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1fx5 n ASP 17 N -0.14 3.65 -4.00 4.39 3.85 -1.26 -4.97 116.55 118.06 1fx5 n ASP 17 Ca 0.00 -3.44 -0.15 0.00 -0.71 0.00 0.00 54.79 50.49 1fx5 n ASP 17 Cb 0.15 -0.69 -0.13 0.00 -1.35 0.00 0.00 41.12 39.10 1fx5 n ASP 17 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1fx5 s LEU 18 N -3.11 2.09 -0.13 -2.12 1.43 -1.26 -1.89 118.68 113.70 1fx5 s LEU 18 Ca 0.49 -0.25 -0.02 0.00 -1.03 0.00 0.00 54.13 53.32 1fx5 s LEU 18 Cb 0.42 -0.25 -0.03 0.00 0.03 0.00 0.00 46.19 46.36 1fx5 s LEU 18 CO 0.07 -0.02 -0.04 -0.44 0.23 0.00 0.00 176.35 176.16 1fx5 s SER 19 N -0.62 4.86 0.02 2.29 0.01 -0.14 -4.84 113.70 115.29 1fx5 s SER 19 Ca -0.02 -0.05 0.09 0.00 1.31 0.00 0.00 55.95 57.27 1fx5 s SER 19 Cb -0.05 -1.60 -0.03 0.00 0.21 0.00 0.00 66.02 64.55 1fx5 s SER 19 CO 0.00 0.25 -0.26 -0.36 0.41 0.00 0.00 173.24 173.28 1fx5 s PHE 20 N -0.10 2.34 0.04 2.43 0.40 -1.26 -1.60 117.98 120.23 1fx5 s PHE 20 Ca 0.02 -0.41 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 1fx5 s PHE 20 Cb -0.13 -1.44 -0.02 0.00 0.51 0.00 0.00 43.02 41.93 1fx5 s PHE 20 CO 0.02 0.06 -0.08 -0.65 0.70 0.00 0.00 175.22 175.28 1fx5 s GLN 21 N -0.99 0.55 5.26 0.44 -0.21 0.87 -4.99 119.66 120.59 1fx5 s GLN 21 Ca 0.11 -0.75 0.00 0.00 0.02 0.00 0.00 55.36 54.74 1fx5 s GLN 21 Cb -0.10 -0.33 0.00 0.00 1.00 0.00 0.00 33.01 33.58 1fx5 s GLN 21 CO 0.01 0.06 0.00 0.41 -2.12 0.00 0.00 175.29 173.65 1fx5 n GLY 22 N 1.50 1.46 1.77 3.09 0.00 -1.26 -0.79 105.19 110.96 1fx5 n GLY 22 Ca -0.22 -0.65 -0.19 0.00 0.00 0.00 0.00 46.02 44.96 1fx5 n GLY 22 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fx5 n ASN 23 N 3.56 4.41 -4.80 1.61 3.02 -0.91 -4.92 115.26 117.23 1fx5 n ASN 23 Ca 0.00 -3.77 -0.38 0.00 -0.03 0.00 0.00 54.58 50.40 1fx5 n ASN 23 Cb 0.00 -0.67 -0.06 0.00 -0.61 0.00 0.00 39.78 38.44 1fx5 n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fx5 s ALA 24 N -3.48 3.51 0.22 5.41 0.00 -1.22 -3.98 121.76 122.21 1fx5 s ALA 24 Ca 0.52 0.17 -0.22 0.00 0.00 0.00 0.00 51.96 52.44 1fx5 s ALA 24 Cb 0.44 -2.78 0.06 0.00 0.00 0.00 0.00 23.12 20.83 1fx5 s ALA 24 CO 0.02 0.35 0.90 -1.54 0.00 0.00 0.00 175.76 175.49 1fx5 s SER 25 N -1.25 -0.13 -0.21 0.00 1.04 -0.50 -4.72 113.70 107.93 1fx5 s SER 25 Ca 0.34 -0.62 -0.07 0.00 0.48 0.00 0.00 55.95 56.08 1fx5 s SER 25 Cb -0.20 0.60 -0.03 0.00 0.10 0.00 0.00 66.02 66.49 1fx5 s SER 25 CO 0.22 -1.14 0.05 -0.69 0.98 0.00 0.00 173.24 172.66 1fx5 s VAL 26 N -3.04 4.46 0.44 5.02 1.01 -1.26 -0.39 120.40 126.65 1fx5 s VAL 26 Ca 0.14 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 61.99 1fx5 s VAL 26 Cb -0.03 -3.04 -0.00 0.00 0.00 0.00 0.00 36.38 33.31 1fx5 s VAL 26 CO 0.05 0.41 0.66 0.27 0.00 0.00 0.00 175.10 176.50 1fx5 s ILE 27 N 0.90 3.96 0.50 2.22 -4.36 -0.79 -4.75 121.20 118.88 1fx5 s ILE 27 Ca 0.03 -0.54 0.37 0.00 -0.26 0.00 0.00 60.65 60.26 1fx5 s ILE 27 Cb -0.14 -3.46 0.57 0.00 1.25 0.00 0.00 42.46 40.69 1fx5 s ILE 27 CO 0.02 -0.31 1.68 1.05 0.24 0.00 0.00 174.94 177.63 1fx5 h GLU 28 N 0.42 0.07 0.00 0.37 4.11 -1.99 0.18 114.58 117.74 1fx5 h GLU 28 Ca -0.46 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1fx5 h GLU 28 Cb 1.25 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1fx5 h GLU 28 CO 0.57 0.04 0.00 0.25 0.07 0.00 0.00 179.01 179.94 1fx5 n THR 29 N -4.29 0.20 -1.93 -1.06 -2.24 -1.26 -4.89 114.28 98.81 1fx5 n THR 29 Ca 0.34 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 62.17 1fx5 n THR 29 Cb 1.48 -0.63 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 1fx5 n THR 29 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fx5 n GLY 30 N 0.86 0.79 3.36 3.38 0.00 0.64 -4.97 105.19 109.25 1fx5 n GLY 30 Ca 0.12 -0.67 -0.31 0.00 0.00 0.00 0.00 46.02 45.15 1fx5 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fx5 s VAL 31 N -2.44 2.37 -0.49 1.61 1.01 -1.24 -2.35 120.40 118.87 1fx5 s VAL 31 Ca 0.00 -1.01 -0.26 0.00 0.00 0.00 0.00 61.98 60.71 1fx5 s VAL 31 Cb 0.00 -1.87 0.03 0.00 0.00 0.00 0.00 36.38 34.54 1fx5 s VAL 31 CO 0.00 0.57 0.97 -0.22 0.00 0.00 0.00 175.10 176.42 1fx5 s LEU 32 N -0.70 3.94 -0.42 3.92 0.20 -0.39 -1.89 118.68 123.35 1fx5 s LEU 32 Ca 0.11 0.05 -0.16 0.00 0.69 0.00 0.00 54.13 54.81 1fx5 s LEU 32 Cb -0.10 -3.15 0.02 0.00 -0.43 0.00 0.00 46.19 42.53 1fx5 s LEU 32 CO -0.00 -1.15 0.38 -1.58 -0.29 0.00 0.00 176.35 173.71 1fx5 s GLN 33 N 3.97 3.04 0.48 1.98 0.74 0.47 -0.45 119.66 129.88 1fx5 s GLN 33 Ca 0.37 -0.89 0.24 0.00 0.05 0.00 0.00 55.36 55.13 1fx5 s GLN 33 Cb -0.10 -3.98 1.21 0.00 1.10 0.00 0.00 33.01 31.24 1fx5 s GLN 33 CO 0.25 -0.82 1.98 -0.07 -0.55 0.00 0.00 175.29 176.09 1fx5 h LEU 34 N 8.87 0.00 -7.23 3.68 3.38 -1.35 -1.33 115.31 121.32 1fx5 h LEU 34 Ca -0.27 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 1fx5 h LEU 34 Cb 1.11 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.71 1fx5 h LEU 34 CO 0.77 0.19 0.01 0.54 0.09 0.00 0.00 178.44 180.04 1fx5 s ASN 35 N -6.33 -0.41 0.41 -0.43 4.22 -1.26 -2.48 114.94 108.67 1fx5 s ASN 35 Ca -0.02 0.11 0.05 0.00 -2.14 0.00 0.00 52.86 50.85 1fx5 s ASN 35 Cb 0.13 0.48 0.00 0.00 1.28 0.00 0.00 41.25 43.14 1fx5 s ASN 35 CO 0.62 -0.73 0.58 -0.54 -2.04 0.00 0.00 177.10 174.99 1fx5 s LYS 36 N -2.59 2.98 -0.02 3.55 1.02 -1.26 -4.57 119.74 118.85 1fx5 s LYS 36 Ca -0.04 -0.89 0.00 0.00 0.02 0.00 0.00 55.97 55.06 1fx5 s LYS 36 Cb -0.01 -2.70 0.02 0.00 -0.52 0.00 0.00 37.83 34.63 1fx5 s LYS 36 CO -0.03 -0.18 -0.00 0.14 -0.92 0.00 0.00 175.35 174.35 1fx5 s VAL 37 N -2.38 0.15 0.00 3.17 -7.23 -1.26 -4.92 120.40 107.94 1fx5 s VAL 37 Ca 0.49 0.06 0.00 0.00 -1.81 0.00 0.00 61.98 60.72 1fx5 s VAL 37 Cb -0.10 -0.23 0.00 0.00 0.56 0.00 0.00 36.38 36.61 1fx5 s VAL 37 CO 0.34 0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.86 1fx5 n GLY 38 N 3.90 2.35 0.00 2.32 0.00 -1.26 -5.00 105.19 107.50 1fx5 n GLY 38 Ca -0.24 -0.88 0.13 0.00 0.00 0.00 0.00 46.02 45.03 1fx5 n GLY 38 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fx5 n ASN 39 N 0.00 0.00 -1.00 1.61 3.02 -1.26 -3.31 115.26 114.33 1fx5 n ASN 39 Ca 0.00 0.24 -0.01 0.00 -0.03 0.00 0.00 54.58 54.78 1fx5 n ASN 39 Cb 0.00 -0.41 0.08 0.00 -0.61 0.00 0.00 39.78 38.84 1fx5 n ASN 39 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1fx5 n ASN 40 N -1.41 2.50 -4.44 6.41 0.23 -1.26 -4.85 115.26 112.45 1fx5 n ASN 40 Ca 0.09 -2.28 -0.25 0.00 -0.53 0.00 0.00 54.58 51.61 1fx5 n ASN 40 Cb 0.26 -0.56 -0.11 0.00 -2.08 0.00 0.00 39.78 37.30 1fx5 n ASN 40 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1fx5 s LEU 41 N -0.70 2.51 0.92 -4.53 1.43 -1.21 -5.15 118.68 111.95 1fx5 s LEU 41 Ca 0.13 -0.95 -0.12 0.00 -1.03 0.00 0.00 54.13 52.17 1fx5 s LEU 41 Cb 0.10 -1.11 0.14 0.00 0.03 0.00 0.00 46.19 45.36 1fx5 s LEU 41 CO 0.03 0.07 1.09 -2.16 0.23 0.00 0.00 176.35 175.62 1fx5 s PRO 42 N -3.09 1.05 0.18 1.29 0.04 -1.26 -4.94 135.00 128.27 1fx5 s PRO 42 Ca 0.25 0.74 -0.13 0.00 0.04 0.00 0.00 61.00 61.90 1fx5 s PRO 42 Cb -0.06 -1.79 0.14 0.00 0.04 0.00 0.00 34.50 32.83 1fx5 s PRO 42 CO 0.12 -2.36 1.76 -0.44 0.04 0.00 0.00 177.00 176.12 1fx5 h ASP 43 N -1.63 0.22 -3.66 6.66 3.45 -1.98 -3.35 116.42 116.12 1fx5 h ASP 43 Ca -0.51 0.05 -0.67 0.00 0.43 0.00 0.00 57.03 56.33 1fx5 h ASP 43 Cb 1.30 0.02 -0.22 0.00 -0.56 0.00 0.00 39.33 39.86 1fx5 h ASP 43 CO 0.55 0.16 -0.55 -1.61 -1.57 0.00 0.00 179.24 176.22 1fx5 s GLU 44 N -6.14 3.34 0.06 3.56 2.02 -1.26 -0.56 118.70 119.73 1fx5 s GLU 44 Ca -0.13 -0.72 0.02 0.00 0.02 0.00 0.00 54.97 54.16 1fx5 s GLU 44 Cb 0.14 -3.58 -0.03 0.00 0.10 0.00 0.00 34.13 30.76 1fx5 s GLU 44 CO 0.73 -0.42 -0.07 -0.08 0.02 0.00 0.00 175.26 175.44 1fx5 s THR 45 N 1.62 0.57 -0.00 3.63 -1.32 -0.96 -4.71 115.64 114.46 1fx5 s THR 45 Ca 0.05 -1.39 -0.06 0.00 -1.21 0.00 0.00 61.69 59.08 1fx5 s THR 45 Cb -0.17 -0.99 0.02 0.00 -1.51 0.00 0.00 72.50 69.85 1fx5 s THR 45 CO 0.06 -0.57 0.26 0.61 -2.21 0.00 0.00 174.62 172.77 1fx5 n GLY 46 N 0.91 0.59 3.51 6.08 0.00 -1.26 -1.22 105.19 113.80 1fx5 n GLY 46 Ca -0.19 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 44.85 1fx5 n GLY 46 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fx5 s GLY 47 N -2.87 0.07 -0.01 -0.02 0.00 0.69 -2.13 107.32 103.05 1fx5 s GLY 47 Ca 0.06 -0.41 -0.00 0.00 0.00 0.00 0.00 44.72 44.36 1fx5 s GLY 47 CO -0.00 -0.40 0.01 -0.42 0.00 0.00 0.00 173.10 172.30 1fx5 s ILE 48 N -3.91 -0.01 -0.08 0.90 1.01 0.03 -1.49 121.20 117.66 1fx5 s ILE 48 Ca 0.12 0.03 -0.03 0.00 0.00 0.00 0.00 60.65 60.77 1fx5 s ILE 48 Cb -0.00 -0.03 0.04 0.00 0.01 0.00 0.00 42.46 42.48 1fx5 s ILE 48 CO -0.01 0.01 0.16 0.00 0.00 0.00 0.00 174.94 175.10 1fx5 s ALA 49 N 0.18 -0.23 0.07 9.38 0.00 -0.51 -0.09 121.76 130.56 1fx5 s ALA 49 Ca -0.01 0.64 0.02 0.00 0.00 0.00 0.00 51.96 52.60 1fx5 s ALA 49 Cb -0.02 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.42 1fx5 s ALA 49 CO -0.01 -0.37 -0.08 -0.98 0.00 0.00 0.00 175.76 174.33 1fx5 s ARG 50 N 1.75 0.67 0.32 0.00 1.70 -0.63 -0.29 118.95 122.47 1fx5 s ARG 50 Ca -0.03 -1.02 -0.29 0.00 -0.47 0.00 0.00 55.73 53.92 1fx5 s ARG 50 Cb -0.12 -0.28 -0.11 0.00 -0.57 0.00 0.00 34.95 33.88 1fx5 s ARG 50 CO -0.06 0.03 1.45 -0.47 -1.08 0.00 0.00 175.30 175.17 1fx5 s TYR 51 N -2.35 2.84 0.60 5.89 6.14 -0.84 -0.96 117.35 128.66 1fx5 s TYR 51 Ca -0.00 1.11 0.30 0.00 0.64 0.00 0.00 57.07 59.13 1fx5 s TYR 51 Cb -0.03 -3.90 1.82 0.00 0.42 0.00 0.00 41.96 40.27 1fx5 s TYR 51 CO -0.02 -2.76 2.22 0.97 0.64 0.00 0.00 175.55 176.60 1fx5 h ILE 52 N 3.22 0.47 -3.08 3.14 2.10 -1.70 -3.43 117.51 118.23 1fx5 h ILE 52 Ca -0.48 0.00 -0.62 0.00 1.08 0.00 0.00 64.86 64.84 1fx5 h ILE 52 Cb 1.23 0.96 -0.10 0.00 -1.09 0.00 0.00 36.82 37.81 1fx5 h ILE 52 CO 0.71 0.00 -0.43 0.00 -1.08 0.00 0.00 178.15 177.35 1fx5 s ALA 53 N -4.60 3.72 0.56 0.18 0.00 -1.26 -5.03 121.76 115.33 1fx5 s ALA 53 Ca -0.05 -0.59 -0.20 0.00 0.00 0.00 0.00 51.96 51.12 1fx5 s ALA 53 Cb 0.15 -2.17 -0.05 0.00 0.00 0.00 0.00 23.12 21.05 1fx5 s ALA 53 CO 0.53 0.30 1.21 -2.14 0.00 0.00 0.00 175.76 175.67 1fx5 s PRO 54 N -0.11 3.19 -0.16 0.00 0.02 -1.26 -4.77 135.00 131.91 1fx5 s PRO 54 Ca 0.13 1.85 -0.06 0.00 0.02 0.00 0.00 61.00 62.94 1fx5 s PRO 54 Cb -0.12 -2.07 -0.04 0.00 0.02 0.00 0.00 34.50 32.29 1fx5 s PRO 54 CO 0.02 -1.04 0.04 0.42 -0.33 0.00 0.00 177.00 176.11 1fx5 s ILE 55 N -1.56 4.60 -0.72 2.83 -1.09 0.72 -4.85 121.20 121.13 1fx5 s ILE 55 Ca 0.73 -0.11 -0.27 0.00 -2.23 0.00 0.00 60.65 58.78 1fx5 s ILE 55 Cb -0.31 -3.04 0.03 0.00 -1.58 0.00 0.00 42.46 37.56 1fx5 s ILE 55 CO 0.35 0.49 1.24 -2.28 -1.23 0.00 0.00 174.94 173.51 1fx5 s HIS 56 N 0.14 2.34 0.00 3.97 2.46 -1.26 -2.31 115.29 120.64 1fx5 s HIS 56 Ca 0.03 -0.09 -0.13 0.00 0.47 0.00 0.00 55.06 55.34 1fx5 s HIS 56 Cb -0.13 -4.58 -0.34 0.00 -0.13 0.00 0.00 32.58 27.41 1fx5 s HIS 56 CO 0.01 -2.00 0.87 0.97 -2.47 0.00 0.00 174.74 172.12 1fx5 h ILE 57 N 6.03 1.15 -3.20 0.89 6.09 -1.43 -3.46 117.51 123.58 1fx5 h ILE 57 Ca -0.28 -2.64 -0.15 0.00 -1.37 0.00 0.00 64.86 60.42 1fx5 h ILE 57 Cb 1.05 2.93 -0.23 0.00 0.47 0.00 0.00 36.82 41.04 1fx5 h ILE 57 CO 1.26 0.83 -0.40 -1.66 -3.07 0.00 0.00 178.15 175.11 1fx5 s TRP 58 N -2.59 -0.17 -0.26 2.19 1.48 -1.22 -0.68 118.94 117.69 1fx5 s TRP 58 Ca -0.12 0.38 -0.06 0.00 -1.06 0.00 0.00 56.10 55.24 1fx5 s TRP 58 Cb 0.05 0.06 -0.01 0.00 -1.16 0.00 0.00 33.47 32.40 1fx5 s TRP 58 CO 0.91 -0.23 0.05 1.21 -4.06 0.00 0.00 176.95 174.83 1fx5 s ASN 59 N -0.59 4.96 0.19 -2.66 3.84 0.35 -4.57 114.94 116.47 1fx5 s ASN 59 Ca -0.07 -0.41 -0.06 0.00 0.21 0.00 0.00 52.86 52.53 1fx5 s ASN 59 Cb -0.04 -1.87 0.12 0.00 -0.55 0.00 0.00 41.25 38.91 1fx5 s ASN 59 CO 0.02 -0.08 1.59 0.00 -2.79 0.00 0.00 177.10 175.83 1fx5 h ASN 61 N 0.73 0.70 -0.00 0.00 2.35 -1.97 -2.96 115.58 114.42 1fx5 h ASN 61 Ca 0.09 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1fx5 h ASN 61 Cb 0.78 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.97 1fx5 h ASN 61 CO 0.06 0.63 -0.79 0.35 -1.65 0.00 0.00 177.43 176.04 1fx5 n THR 62 N -4.34 0.00 -1.04 2.81 -2.24 -1.22 -4.98 114.28 103.26 1fx5 n THR 62 Ca 0.04 -0.11 -0.01 0.00 -2.27 0.00 0.00 64.05 61.70 1fx5 n THR 62 Cb 0.16 1.01 -0.01 0.00 -2.10 0.00 0.00 70.33 69.39 1fx5 n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fx5 n GLY 63 N 1.40 0.46 3.86 3.38 0.00 -0.13 -5.01 105.19 109.16 1fx5 n GLY 63 Ca 0.03 -0.17 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 1fx5 n GLY 63 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fx5 s GLU 64 N -1.05 3.85 -0.02 1.61 2.02 -0.99 -4.90 118.70 119.23 1fx5 s GLU 64 Ca 0.00 0.60 0.06 0.00 0.02 0.00 0.00 54.97 55.65 1fx5 s GLU 64 Cb 0.00 -2.35 -0.01 0.00 0.10 0.00 0.00 34.13 31.87 1fx5 s GLU 64 CO 0.00 -0.05 -0.19 -1.17 0.02 0.00 0.00 175.26 173.86 1fx5 s LEU 65 N -3.75 2.03 0.38 1.80 0.20 -1.26 -0.49 118.68 117.59 1fx5 s LEU 65 Ca 0.53 -0.35 -0.09 0.00 0.69 0.00 0.00 54.13 54.90 1fx5 s LEU 65 Cb -0.10 -1.01 -0.06 0.00 -0.43 0.00 0.00 46.19 44.59 1fx5 s LEU 65 CO 0.29 0.24 0.72 0.00 -0.29 0.00 0.00 176.35 177.31 1fx5 s ALA 66 N -0.43 3.40 -0.09 5.97 0.00 0.15 -4.86 121.76 125.91 1fx5 s ALA 66 Ca 0.07 -0.27 -0.01 0.00 0.00 0.00 0.00 51.96 51.75 1fx5 s ALA 66 Cb -0.08 -2.62 -0.03 0.00 0.00 0.00 0.00 23.12 20.39 1fx5 s ALA 66 CO -0.01 0.06 -0.03 -1.12 0.00 0.00 0.00 175.76 174.66 1fx5 s SER 67 N -3.12 4.92 0.23 0.00 0.01 -0.71 -4.43 113.70 110.61 1fx5 s SER 67 Ca 0.50 0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.79 1fx5 s SER 67 Cb -0.10 -1.40 -0.04 0.00 0.21 0.00 0.00 66.02 64.68 1fx5 s SER 67 CO 0.30 0.34 0.12 0.72 0.41 0.00 0.00 173.24 175.13 1fx5 s PHE 68 N -0.64 1.34 -0.24 2.43 -0.71 -0.95 -1.99 117.98 117.22 1fx5 s PHE 68 Ca 0.10 -1.32 -0.18 0.00 -1.04 0.00 0.00 56.93 54.49 1fx5 s PHE 68 Cb -0.12 -0.70 0.07 0.00 -1.21 0.00 0.00 43.02 41.06 1fx5 s PHE 68 CO 0.02 -0.53 0.61 -1.50 -1.34 0.00 0.00 175.22 172.48 1fx5 s ILE 69 N -3.96 -0.00 0.05 -4.49 2.07 -0.69 -1.83 121.20 112.35 1fx5 s ILE 69 Ca 0.38 0.01 -0.00 0.00 -1.41 0.00 0.00 60.65 59.64 1fx5 s ILE 69 Cb 0.07 -0.87 -0.04 0.00 0.13 0.00 0.00 42.46 41.76 1fx5 s ILE 69 CO 0.13 0.01 -0.04 0.28 -1.91 0.00 0.00 174.94 173.41 1fx5 s THR 70 N 0.91 0.29 -0.20 4.00 -1.32 -0.11 -2.07 115.64 117.14 1fx5 s THR 70 Ca -0.05 -1.71 -0.22 0.00 -1.21 0.00 0.00 61.69 58.50 1fx5 s THR 70 Cb -0.05 -1.38 0.06 0.00 -1.51 0.00 0.00 72.50 69.62 1fx5 s THR 70 CO -0.08 -0.91 0.61 -0.94 -2.21 0.00 0.00 174.62 171.09 1fx5 s SER 71 N -2.74 -0.62 0.24 8.08 1.04 -0.95 -1.18 113.70 117.57 1fx5 s SER 71 Ca 0.05 1.12 -0.17 0.00 0.48 0.00 0.00 55.95 57.42 1fx5 s SER 71 Cb 0.05 1.12 0.02 0.00 0.10 0.00 0.00 66.02 67.30 1fx5 s SER 71 CO -0.08 -0.28 0.58 0.72 0.98 0.00 0.00 173.24 175.16 1fx5 s PHE 72 N 0.04 -0.01 -0.02 5.02 -0.12 -0.82 -1.52 117.98 120.55 1fx5 s PHE 72 Ca -0.02 -0.38 0.06 0.00 -0.05 0.00 0.00 56.93 56.54 1fx5 s PHE 72 Cb -0.04 0.45 -0.02 0.00 -0.63 0.00 0.00 43.02 42.79 1fx5 s PHE 72 CO 0.02 -1.06 -0.21 -1.12 -0.05 0.00 0.00 175.22 172.81 1fx5 s SER 73 N -2.93 2.46 0.17 1.98 0.01 -1.25 -0.71 113.70 113.42 1fx5 s SER 73 Ca 0.14 -0.38 -0.06 0.00 1.31 0.00 0.00 55.95 56.96 1fx5 s SER 73 Cb -0.03 -0.27 -0.02 0.00 0.21 0.00 0.00 66.02 65.91 1fx5 s SER 73 CO 0.04 0.26 0.22 0.72 0.41 0.00 0.00 173.24 174.89 1fx5 s PHE 74 N -0.50 0.62 0.10 2.43 -0.12 -0.76 -1.40 117.98 118.36 1fx5 s PHE 74 Ca 0.08 -0.97 -0.15 0.00 -0.05 0.00 0.00 56.93 55.84 1fx5 s PHE 74 Cb -0.08 -0.22 0.03 0.00 -0.63 0.00 0.00 43.02 42.12 1fx5 s PHE 74 CO -0.01 -0.68 0.36 -0.59 -0.05 0.00 0.00 175.22 174.25 1fx5 s PHE 75 N -4.02 -0.14 0.06 3.49 -0.71 -0.63 -0.68 117.98 115.35 1fx5 s PHE 75 Ca 0.22 -0.15 0.03 0.00 -1.04 0.00 0.00 56.93 55.99 1fx5 s PHE 75 Cb 0.05 0.18 -0.03 0.00 -1.21 0.00 0.00 43.02 42.01 1fx5 s PHE 75 CO 0.03 -0.64 -0.09 0.00 -1.34 0.00 0.00 175.22 173.18 1fx5 s MET 76 N -3.55 0.65 -0.01 1.99 0.23 -1.26 -1.59 119.30 115.76 1fx5 s MET 76 Ca 0.02 -0.91 0.02 0.00 -1.03 0.00 0.00 55.69 53.79 1fx5 s MET 76 Cb 0.02 -0.38 -0.00 0.00 -1.53 0.00 0.00 34.83 32.94 1fx5 s MET 76 CO -0.10 0.06 -0.07 -1.21 -2.03 0.00 0.00 175.02 171.67 1fx5 s GLU 77 N -2.06 0.62 -0.01 3.16 2.02 -0.78 -0.81 118.70 120.84 1fx5 s GLU 77 Ca -0.04 -0.23 -0.02 0.00 0.02 0.00 0.00 54.97 54.70 1fx5 s GLU 77 Cb -0.07 -0.61 0.00 0.00 0.10 0.00 0.00 34.13 33.55 1fx5 s GLU 77 CO -0.00 0.11 0.04 -0.08 0.02 0.00 0.00 175.26 175.35 1fx5 s THR 78 N 0.01 0.02 -0.22 3.63 -1.32 -1.26 -0.59 115.64 115.91 1fx5 s THR 78 Ca 0.00 -0.15 0.22 0.00 -1.21 0.00 0.00 61.69 60.55 1fx5 s THR 78 Cb -0.05 -0.11 -0.02 0.00 -1.51 0.00 0.00 72.50 70.81 1fx5 s THR 78 CO -0.00 -0.08 1.02 -1.54 -2.21 0.00 0.00 174.62 171.80 1fx5 n SER 79 N 2.79 0.83 -2.99 8.08 3.41 -1.26 -4.92 113.62 119.56 1fx5 n SER 79 Ca -0.14 0.32 -0.12 0.00 -0.26 0.00 0.00 58.87 58.67 1fx5 n SER 79 Cb 0.59 0.47 0.07 0.00 -0.26 0.00 0.00 64.21 65.08 1fx5 n SER 79 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fx5 n ALA 80 N -2.20 -0.29 -2.41 7.33 0.00 -1.26 -5.02 120.51 116.66 1fx5 n ALA 80 Ca -0.01 -0.82 -0.43 0.00 0.00 0.00 0.00 53.44 52.18 1fx5 n ALA 80 Cb 0.57 0.05 -0.02 0.00 0.00 0.00 0.00 19.45 20.05 1fx5 n ALA 80 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1fx5 s ASN 81 N -2.99 6.98 0.29 0.00 3.84 -1.26 -4.94 114.94 116.87 1fx5 s ASN 81 Ca 0.32 1.81 -0.04 0.00 0.21 0.00 0.00 52.86 55.15 1fx5 s ASN 81 Cb -0.01 -2.55 0.58 0.00 -0.55 0.00 0.00 41.25 38.71 1fx5 s ASN 81 CO 0.22 -0.67 1.56 -2.65 -2.79 0.00 0.00 177.10 172.76 1fx5 n PRO 82 N 5.78 -0.09 0.27 0.43 -0.02 -1.26 0.23 135.00 140.34 1fx5 n PRO 82 Ca 0.12 1.53 0.12 0.00 -2.02 0.00 0.00 63.50 63.26 1fx5 n PRO 82 Cb 0.45 -2.34 0.75 0.00 -0.02 0.00 0.00 33.50 32.34 1fx5 n PRO 82 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1fx5 h LYS 83 N 0.00 0.00 -0.25 -0.52 6.56 -1.97 -3.07 116.57 117.31 1fx5 h LYS 83 Ca 0.53 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.12 1fx5 h LYS 83 Cb 0.93 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.59 1fx5 h LYS 83 CO -0.99 0.09 0.00 0.00 -2.06 0.00 0.00 179.45 176.48 1fx5 n ALA 84 N -2.34 2.33 -1.85 3.86 0.00 0.14 -5.00 120.51 117.64 1fx5 n ALA 84 Ca -0.02 -0.93 -0.40 0.00 0.00 0.00 0.00 53.44 52.08 1fx5 n ALA 84 Cb 0.18 -0.50 -0.05 0.00 0.00 0.00 0.00 19.45 19.08 1fx5 n ALA 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fx5 s ALA 85 N -1.06 3.34 0.35 0.00 0.00 -0.85 -4.74 121.76 118.80 1fx5 s ALA 85 Ca 0.23 0.68 0.09 0.00 0.00 0.00 0.00 51.96 52.96 1fx5 s ALA 85 Cb 0.13 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.95 1fx5 s ALA 85 CO 0.18 0.07 0.05 0.95 0.00 0.00 0.00 175.76 177.01 1fx5 s THR 86 N -0.94 2.64 0.00 0.00 -4.23 -0.73 -4.49 115.64 107.89 1fx5 s THR 86 Ca 0.43 -1.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 1fx5 s THR 86 Cb -0.27 -2.85 0.00 0.00 1.34 0.00 0.00 72.50 70.72 1fx5 s THR 86 CO 0.34 -0.17 0.00 0.47 -0.54 0.00 0.00 174.62 174.71 1fx5 n ASP 87 N -1.01 4.19 0.00 3.99 9.92 -0.20 -3.82 116.55 129.62 1fx5 n ASP 87 Ca -0.04 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.22 1fx5 n ASP 87 Cb 0.62 0.68 0.00 0.00 -0.64 0.00 0.00 41.12 41.78 1fx5 n ASP 87 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1fx5 n GLY 88 N 2.28 0.64 3.24 0.44 0.00 -1.21 -0.95 105.19 109.63 1fx5 n GLY 88 Ca 0.00 -2.14 -0.09 0.00 0.00 0.00 0.00 46.02 43.78 1fx5 n GLY 88 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1fx5 s LEU 89 N 0.00 1.41 0.07 0.99 2.34 -0.81 -2.71 118.68 119.97 1fx5 s LEU 89 Ca 0.00 -0.90 -0.02 0.00 0.06 0.00 0.00 54.13 53.27 1fx5 s LEU 89 Cb 0.00 0.86 -0.03 0.00 -0.56 0.00 0.00 46.19 46.46 1fx5 s LEU 89 CO 0.00 -0.79 0.02 0.42 -1.06 0.00 0.00 176.35 174.95 1fx5 s THR 90 N -3.95 0.18 -0.12 5.48 -4.23 -0.87 -0.33 115.64 111.80 1fx5 s THR 90 Ca 0.14 -1.73 0.03 0.00 -1.18 0.00 0.00 61.69 58.95 1fx5 s THR 90 Cb 0.05 -1.60 0.00 0.00 1.34 0.00 0.00 72.50 72.29 1fx5 s THR 90 CO -0.03 -0.84 -0.23 0.12 -0.54 0.00 0.00 174.62 173.10 1fx5 s PHE 91 N -3.94 2.61 0.15 3.99 2.19 -0.39 -2.46 117.98 120.13 1fx5 s PHE 91 Ca 0.10 -1.19 -0.05 0.00 0.33 0.00 0.00 56.93 56.12 1fx5 s PHE 91 Cb 0.07 -1.76 -0.02 0.00 -1.31 0.00 0.00 43.02 40.00 1fx5 s PHE 91 CO -0.08 -0.51 0.19 -0.59 1.83 0.00 0.00 175.22 176.06 1fx5 s PHE 92 N 0.57 0.61 -0.10 10.12 -0.71 -0.82 -0.48 117.98 127.16 1fx5 s PHE 92 Ca -0.13 -0.98 0.02 0.00 -1.04 0.00 0.00 56.93 54.80 1fx5 s PHE 92 Cb -0.17 -0.24 0.01 0.00 -1.21 0.00 0.00 43.02 41.41 1fx5 s PHE 92 CO 0.04 -0.64 -0.16 -0.51 -1.34 0.00 0.00 175.22 172.60 1fx5 s LEU 93 N -3.01 1.78 0.28 -1.99 1.43 -0.18 -2.74 118.68 114.26 1fx5 s LEU 93 Ca 0.21 -0.44 -0.17 0.00 -1.03 0.00 0.00 54.13 52.70 1fx5 s LEU 93 Cb 0.05 -1.11 0.01 0.00 0.03 0.00 0.00 46.19 45.17 1fx5 s LEU 93 CO 0.01 0.04 0.63 0.00 0.23 0.00 0.00 176.35 177.27 1fx5 s ALA 94 N 0.84 -0.77 0.40 4.21 0.00 -1.22 -1.32 121.76 123.90 1fx5 s ALA 94 Ca -0.10 -0.59 -0.27 0.00 0.00 0.00 0.00 51.96 51.00 1fx5 s ALA 94 Cb -0.15 0.92 -0.10 0.00 0.00 0.00 0.00 23.12 23.78 1fx5 s ALA 94 CO 0.01 -0.96 1.46 -1.25 0.00 0.00 0.00 175.76 175.01 1fx5 s PRO 95 N -3.77 4.00 0.46 0.00 0.04 -1.26 -1.75 135.00 132.72 1fx5 s PRO 95 Ca 0.16 2.51 0.24 0.00 0.04 0.00 0.00 61.00 63.94 1fx5 s PRO 95 Cb -0.04 -2.88 1.25 0.00 0.04 0.00 0.00 34.50 32.86 1fx5 s PRO 95 CO 0.09 -0.60 1.84 -1.35 0.04 0.00 0.00 177.00 177.02 1fx5 h PRO 96 N 2.82 0.24 -0.54 0.56 0.11 -1.86 -1.34 132.00 132.00 1fx5 h PRO 96 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1fx5 h PRO 96 Cb 1.25 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1fx5 h PRO 96 CO 0.63 0.16 0.00 -0.40 -0.21 0.00 0.00 178.00 178.18 1fx5 n ASP 97 N -4.44 2.91 -4.78 -2.05 5.75 -1.26 -4.96 116.55 107.72 1fx5 n ASP 97 Ca 0.21 -2.04 -0.41 0.00 -0.01 0.00 0.00 54.79 52.55 1fx5 n ASP 97 Cb 0.88 -0.37 -0.01 0.00 -1.03 0.00 0.00 41.12 40.59 1fx5 n ASP 97 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1fx5 s SER 98 N -0.97 6.45 0.54 -1.12 1.04 -0.51 -5.00 113.70 114.12 1fx5 s SER 98 Ca 0.35 2.96 -0.02 0.00 0.48 0.00 0.00 55.95 59.72 1fx5 s SER 98 Cb 0.19 -2.66 0.02 0.00 0.10 0.00 0.00 66.02 63.66 1fx5 s SER 98 CO 0.23 -0.79 0.80 -2.16 0.98 0.00 0.00 173.24 172.30 1fx5 s PRO 99 N -2.02 2.80 0.02 4.02 0.04 -1.26 -5.03 135.00 133.56 1fx5 s PRO 99 Ca 0.52 -0.39 -0.30 0.00 0.04 0.00 0.00 61.00 60.86 1fx5 s PRO 99 Cb -0.45 -2.41 -0.06 0.00 0.04 0.00 0.00 34.50 31.62 1fx5 s PRO 99 CO 0.61 -0.61 1.45 -1.17 0.04 0.00 0.00 177.00 177.32 1fx5 s LEU 100 N -4.81 4.33 0.00 -3.56 2.96 -1.26 -4.93 118.68 111.40 1fx5 s LEU 100 Ca 0.53 2.19 0.00 0.00 -0.22 0.00 0.00 54.13 56.64 1fx5 s LEU 100 Cb -0.10 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.03 1fx5 s LEU 100 CO 0.41 -0.75 0.00 -1.14 -1.32 0.00 0.00 176.35 173.55 1fx5 n ARG 101 N 5.40 2.89 -3.53 1.98 3.00 0.13 -5.03 116.66 121.51 1fx5 n ARG 101 Ca 0.14 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.61 1fx5 n ARG 101 Cb 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.83 1fx5 n ARG 101 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1fx5 s ARG 102 N 2.76 3.92 0.00 -0.14 3.52 -1.06 -4.77 118.95 123.19 1fx5 s ARG 102 Ca 0.00 0.34 0.00 0.00 -0.13 0.00 0.00 55.73 55.94 1fx5 s ARG 102 Cb 0.00 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 30.14 1fx5 s ARG 102 CO 0.00 0.63 0.00 0.00 -0.81 0.00 0.00 175.30 175.12 1fx5 n ALA 103 N 2.09 0.00 -0.58 6.12 0.00 -1.26 -0.17 120.51 126.70 1fx5 n ALA 103 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1fx5 n ALA 103 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1fx5 n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fx5 n GLY 104 N 5.00 2.20 0.00 0.00 0.00 -1.26 -2.11 105.19 109.02 1fx5 n GLY 104 Ca 0.00 -0.37 0.11 0.00 0.00 0.00 0.00 46.02 45.76 1fx5 n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fx5 n GLY 105 N 0.00 -0.81 0.78 -0.02 0.00 -1.26 -3.10 105.19 100.78 1fx5 n GLY 105 Ca 0.00 -0.13 0.12 0.00 0.00 0.00 0.00 46.02 46.02 1fx5 n GLY 105 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1fx5 n TYR 106 N -1.11 0.10 -1.66 1.61 4.02 -0.90 -4.97 117.16 114.25 1fx5 n TYR 106 Ca 0.14 -0.05 -0.11 0.00 -0.01 0.00 0.00 57.90 57.87 1fx5 n TYR 106 Cb 0.11 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.40 1fx5 n TYR 106 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1fx5 n PHE 107 N 0.87 -0.75 -0.83 -0.72 3.01 -1.18 -1.60 117.46 116.25 1fx5 n PHE 107 Ca 0.17 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.63 1fx5 n PHE 107 Cb 0.49 -2.44 0.00 0.00 -0.01 0.00 0.00 39.48 37.52 1fx5 n PHE 107 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1fx5 n GLY 108 N -0.38 0.31 0.09 1.37 0.00 0.76 -4.65 105.19 102.68 1fx5 n GLY 108 Ca -0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.81 1fx5 n GLY 108 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fx5 n LEU 109 N 0.00 0.00 -4.44 0.99 4.77 -0.63 0.21 117.00 117.90 1fx5 n LEU 109 Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.73 1fx5 n LEU 109 Cb 0.14 0.45 -0.11 0.00 -2.33 0.00 0.00 43.42 41.57 1fx5 n LEU 109 CO 0.00 0.45 -0.50 -0.36 -1.33 0.00 0.00 177.39 175.66 1fx5 s PHE 110 N -2.46 2.26 -0.06 -1.77 0.08 -1.12 -4.77 117.98 110.14 1fx5 s PHE 110 Ca -0.09 -0.35 -0.16 0.00 0.12 0.00 0.00 56.93 56.44 1fx5 s PHE 110 Cb 0.06 -1.04 -0.30 0.00 -0.57 0.00 0.00 43.02 41.17 1fx5 s PHE 110 CO 0.76 0.61 0.73 -0.91 -0.10 0.00 0.00 175.22 176.32 1fx5 h ASN 111 N 2.66 0.54 -0.46 1.36 2.35 -1.91 -2.80 115.58 117.32 1fx5 h ASN 111 Ca -0.42 -0.91 0.00 0.00 -0.55 0.00 0.00 56.30 54.42 1fx5 h ASN 111 Cb 1.24 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.43 1fx5 h ASN 111 CO 0.55 1.62 0.00 -0.90 -1.65 0.00 0.00 177.43 177.06 1fx5 n ASP 112 N -3.86 0.00 0.11 5.81 5.68 -1.26 -4.84 116.55 118.19 1fx5 n ASP 112 Ca -0.21 -0.40 0.13 0.00 -0.50 0.00 0.00 54.79 53.81 1fx5 n ASP 112 Cb 0.96 0.00 0.40 0.00 -1.14 0.00 0.00 41.12 41.34 1fx5 n ASP 112 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1fx5 h THR 113 N 0.40 0.00 -3.30 2.12 1.35 -2.01 -3.43 112.91 108.04 1fx5 h THR 113 Ca 0.00 -0.49 -0.52 0.00 -0.55 0.00 0.00 66.41 64.84 1fx5 h THR 113 Cb 0.00 1.48 0.04 0.00 -1.73 0.00 0.00 68.15 67.94 1fx5 h THR 113 CO 0.00 0.00 0.69 -0.54 -0.25 0.00 0.00 175.52 175.42 1fx5 s LYS 114 N -3.12 4.35 0.33 4.72 3.01 -1.26 -4.68 119.74 123.09 1fx5 s LYS 114 Ca 0.10 2.11 -0.25 0.00 -1.01 0.00 0.00 55.97 56.92 1fx5 s LYS 114 Cb 0.12 -3.19 -0.10 0.00 -1.01 0.00 0.00 37.83 33.65 1fx5 s LYS 114 CO 0.59 -0.32 0.94 0.00 0.51 0.00 0.00 175.35 177.06 1fx5 s ASP 117 N -1.67 -0.55 0.00 0.00 3.68 -1.09 -5.03 116.67 112.01 1fx5 s ASP 117 Ca 0.51 1.10 0.09 0.00 2.13 0.00 0.00 52.55 56.38 1fx5 s ASP 117 Cb -0.18 1.25 0.40 0.00 -1.45 0.00 0.00 42.92 42.95 1fx5 s ASP 117 CO 0.23 -0.22 1.28 -1.54 0.13 0.00 0.00 175.17 175.05 1fx5 n SER 118 N 4.84 0.00 0.09 -0.34 3.41 -1.26 -2.39 113.62 117.97 1fx5 n SER 118 Ca -0.16 0.45 0.12 0.00 -0.26 0.00 0.00 58.87 59.03 1fx5 n SER 118 Cb 0.53 -0.47 0.45 0.00 -0.26 0.00 0.00 64.21 64.46 1fx5 n SER 118 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1fx5 n SER 119 N -1.47 0.60 -0.10 4.04 2.88 -1.26 -3.39 113.62 114.93 1fx5 n SER 119 Ca 0.03 0.59 -0.12 0.00 -1.33 0.00 0.00 58.87 58.03 1fx5 n SER 119 Cb 0.10 -0.74 -0.04 0.00 -0.75 0.00 0.00 64.21 62.78 1fx5 n SER 119 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 1fx5 h TYR 120 N 0.00 0.69 -6.06 0.66 0.05 -1.80 -3.47 116.97 107.04 1fx5 h TYR 120 Ca 0.00 -0.17 -0.42 0.00 0.05 0.00 0.00 58.73 58.19 1fx5 h TYR 120 Cb 0.55 -0.16 0.06 0.00 1.01 0.00 0.00 36.73 38.19 1fx5 h TYR 120 CO 0.00 0.83 -0.78 1.04 -1.05 0.00 0.00 178.16 178.20 1fx5 n GLN 121 N -4.42 -5.73 -5.14 4.88 6.02 -1.22 -4.71 117.38 107.06 1fx5 n GLN 121 Ca -0.03 0.67 -0.29 0.00 -0.01 0.00 0.00 57.00 57.34 1fx5 n GLN 121 Cb 0.37 -5.46 -0.16 0.00 1.02 0.00 0.00 30.24 26.01 1fx5 n GLN 121 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1fx5 s THR 122 N -3.48 1.83 -0.22 5.09 2.01 -1.26 -4.11 115.64 115.51 1fx5 s THR 122 Ca 0.26 -0.97 -0.02 0.00 0.31 0.00 0.00 61.69 61.28 1fx5 s THR 122 Cb -0.13 -1.54 0.06 0.00 0.01 0.00 0.00 72.50 70.91 1fx5 s THR 122 CO 0.80 0.52 0.02 -0.69 -0.69 0.00 0.00 174.62 174.57 1fx5 s VAL 123 N -0.34 0.84 0.19 3.82 1.01 -0.43 -1.64 120.40 123.84 1fx5 s VAL 123 Ca 0.03 -0.82 0.09 0.00 0.00 0.00 0.00 61.98 61.28 1fx5 s VAL 123 Cb -0.11 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 1fx5 s VAL 123 CO 0.01 -0.22 -0.17 0.00 0.00 0.00 0.00 175.10 174.71 1fx5 s ALA 124 N 1.71 2.10 -0.27 5.51 0.00 -0.84 -1.01 121.76 128.96 1fx5 s ALA 124 Ca -0.01 -1.59 0.02 0.00 0.00 0.00 0.00 51.96 50.38 1fx5 s ALA 124 Cb -0.18 -0.17 0.06 0.00 0.00 0.00 0.00 23.12 22.83 1fx5 s ALA 124 CO -0.09 0.20 -0.08 0.08 0.00 0.00 0.00 175.76 175.87 1fx5 s VAL 125 N -2.35 2.37 0.14 0.00 1.01 0.36 -0.72 120.40 121.22 1fx5 s VAL 125 Ca 0.19 -1.60 -0.05 0.00 0.00 0.00 0.00 61.98 60.53 1fx5 s VAL 125 Cb -0.04 -2.40 -0.06 0.00 0.00 0.00 0.00 36.38 33.88 1fx5 s VAL 125 CO 0.08 -0.06 0.39 -1.83 0.00 0.00 0.00 175.10 173.67 1fx5 s GLU 126 N 1.13 3.63 -0.63 2.72 -1.05 -0.49 -1.27 118.70 122.75 1fx5 s GLU 126 Ca -0.08 -0.06 0.05 0.00 -0.15 0.00 0.00 54.97 54.73 1fx5 s GLU 126 Cb -0.20 -2.84 0.18 0.00 -0.44 0.00 0.00 34.13 30.83 1fx5 s GLU 126 CO -0.04 0.46 0.49 1.19 0.95 0.00 0.00 175.26 178.31 1fx5 n PHE 127 N 0.11 2.26 -2.43 4.83 3.01 0.55 -2.38 117.46 123.39 1fx5 n PHE 127 Ca -0.02 -4.05 -0.43 0.00 1.01 0.00 0.00 57.45 53.95 1fx5 n PHE 127 Cb 0.52 -0.41 -0.02 0.00 -0.01 0.00 0.00 39.48 39.55 1fx5 n PHE 127 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1fx5 s ASP 128 N -1.24 6.47 0.30 4.37 -1.08 -0.50 -1.92 116.67 123.08 1fx5 s ASP 128 Ca 0.29 0.78 0.20 0.00 -0.52 0.00 0.00 52.55 53.29 1fx5 s ASP 128 Cb 0.00 -2.54 0.14 0.00 -1.46 0.00 0.00 42.92 39.06 1fx5 s ASP 128 CO -0.16 -1.33 1.37 0.71 0.52 0.00 0.00 175.17 176.28 1fx5 h THR 129 N 6.33 0.32 -3.64 1.71 1.35 -1.31 -0.95 112.91 116.72 1fx5 h THR 129 Ca -0.26 -1.48 -0.50 0.00 -0.55 0.00 0.00 66.41 63.62 1fx5 h THR 129 Cb 1.09 2.04 -0.32 0.00 -1.73 0.00 0.00 68.15 69.23 1fx5 h THR 129 CO 1.09 0.18 -0.81 -0.51 -0.25 0.00 0.00 175.52 175.22 1fx5 s ILE 130 N -3.13 1.11 0.00 6.82 1.10 -1.26 -4.37 121.20 121.47 1fx5 s ILE 130 Ca 0.04 -0.50 0.00 0.00 -0.51 0.00 0.00 60.65 59.67 1fx5 s ILE 130 Cb 0.07 -0.99 0.00 0.00 0.15 0.00 0.00 42.46 41.69 1fx5 s ILE 130 CO 0.73 0.34 0.00 0.61 -2.11 0.00 0.00 174.94 174.51 1fx5 n GLY 131 N 3.52 4.79 3.82 1.50 0.00 -1.26 -4.74 105.19 112.82 1fx5 n GLY 131 Ca -0.21 -1.92 -0.32 0.00 0.00 0.00 0.00 46.02 43.57 1fx5 n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fx5 s SER 132 N 0.32 5.96 0.08 1.61 1.04 -0.33 -1.24 113.70 121.14 1fx5 s SER 132 Ca 0.00 1.69 0.20 0.00 0.48 0.00 0.00 55.95 58.31 1fx5 s SER 132 Cb 0.00 -2.52 0.81 0.00 0.10 0.00 0.00 66.02 64.42 1fx5 s SER 132 CO 0.00 -1.04 1.61 -0.81 0.98 0.00 0.00 173.24 173.98 1fx5 n PRO 133 N -2.16 0.06 0.08 4.02 -0.04 -1.26 -4.40 135.00 131.30 1fx5 n PRO 133 Ca 0.08 0.25 -0.12 0.00 -0.04 0.00 0.00 63.50 63.67 1fx5 n PRO 133 Cb 0.53 -1.61 -0.06 0.00 -0.04 0.00 0.00 33.50 32.32 1fx5 n PRO 133 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1fx5 h VAL 134 N 0.00 0.85 -3.50 0.52 2.07 -1.86 -3.33 116.25 111.00 1fx5 h VAL 134 Ca 0.00 0.00 -0.69 0.00 0.82 0.00 0.00 66.70 66.83 1fx5 h VAL 134 Cb 0.35 0.85 -0.35 0.00 -1.52 0.00 0.00 31.29 30.62 1fx5 h VAL 134 CO 0.00 0.00 -0.56 0.20 0.02 0.00 0.00 177.57 177.23 1fx5 s ASN 135 N -5.07 5.23 0.54 0.57 0.02 -0.37 -4.98 114.94 110.88 1fx5 s ASN 135 Ca -0.14 -2.04 0.23 0.00 -1.02 0.00 0.00 52.86 49.89 1fx5 s ASN 135 Cb 0.06 -1.82 1.40 0.00 0.02 0.00 0.00 41.25 40.91 1fx5 s ASN 135 CO 0.66 -0.53 2.05 2.19 0.02 0.00 0.00 177.10 181.48 1fx5 h PHE 136 N 8.02 0.00 0.00 2.20 -0.00 -1.85 -1.77 116.94 123.54 1fx5 h PHE 136 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.85 1fx5 h PHE 136 Cb 1.05 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.00 1fx5 h PHE 136 CO 0.55 0.00 0.00 -2.67 -0.00 0.00 0.00 178.31 176.19 1fx5 n TRP 137 N -4.34 0.00 -3.53 6.09 2.14 -1.26 -4.85 117.44 111.68 1fx5 n TRP 137 Ca 0.05 0.00 -0.20 0.00 2.07 0.00 0.00 57.50 59.42 1fx5 n TRP 137 Cb 0.43 -0.46 -0.01 0.00 -0.81 0.00 0.00 31.31 30.47 1fx5 n TRP 137 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1fx5 s ASP 138 N -2.93 6.06 0.91 -0.67 -0.00 -0.70 -4.91 116.67 114.43 1fx5 s ASP 138 Ca 0.13 -0.04 -0.12 0.00 -0.00 0.00 0.00 52.55 52.52 1fx5 s ASP 138 Cb 0.15 -1.46 0.13 0.00 -0.00 0.00 0.00 42.92 41.75 1fx5 s ASP 138 CO 0.40 -0.37 1.10 -2.84 -0.00 0.00 0.00 175.17 173.47 1fx5 s PRO 139 N -4.18 1.18 -0.88 8.23 0.02 -1.26 -3.63 135.00 134.48 1fx5 s PRO 139 Ca 0.42 0.57 -0.07 0.00 0.02 0.00 0.00 61.00 61.94 1fx5 s PRO 139 Cb -0.09 -1.82 -0.12 0.00 0.02 0.00 0.00 34.50 32.48 1fx5 s PRO 139 CO 0.32 -2.23 3.14 0.41 -0.33 0.00 0.00 177.00 178.30 1fx5 n GLY 140 N -1.59 3.89 0.00 0.52 0.00 -1.26 -1.19 105.19 105.56 1fx5 n GLY 140 Ca 0.06 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1fx5 n GLY 140 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1fx5 n PHE 141 N 2.74 0.00 -2.07 1.61 -1.74 -1.26 -4.90 117.46 111.84 1fx5 n PHE 141 Ca 0.61 0.00 -0.39 0.00 -0.56 0.00 0.00 57.45 57.12 1fx5 n PHE 141 Cb 0.52 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.52 1fx5 n PHE 141 CO 0.00 0.00 0.00 -2.14 -0.56 0.00 0.00 176.76 174.06 1fx5 s PRO 142 N -2.00 3.76 0.28 3.97 0.02 -1.26 -4.18 135.00 135.59 1fx5 s PRO 142 Ca 0.00 2.05 -0.17 0.00 0.02 0.00 0.00 61.00 62.90 1fx5 s PRO 142 Cb 0.00 -2.56 0.01 0.00 0.02 0.00 0.00 34.50 31.97 1fx5 s PRO 142 CO 0.00 -0.63 0.63 -3.38 -0.33 0.00 0.00 177.00 173.29 1fx5 s HIS 143 N -1.35 0.09 -0.08 6.54 -3.43 -0.36 -0.47 115.29 116.22 1fx5 s HIS 143 Ca 0.62 -0.54 0.04 0.00 -0.80 0.00 0.00 55.06 54.38 1fx5 s HIS 143 Cb -0.36 0.51 -0.01 0.00 -1.43 0.00 0.00 32.58 31.30 1fx5 s HIS 143 CO 0.44 -1.19 -0.23 0.96 -2.00 0.00 0.00 174.74 172.73 1fx5 s ILE 144 N -3.73 2.24 0.18 -5.38 -4.36 -0.81 -1.41 121.20 107.93 1fx5 s ILE 144 Ca 0.16 -0.98 -0.15 0.00 -0.26 0.00 0.00 60.65 59.42 1fx5 s ILE 144 Cb -0.04 -1.85 0.02 0.00 1.25 0.00 0.00 42.46 41.84 1fx5 s ILE 144 CO 0.09 0.56 0.44 -0.83 0.24 0.00 0.00 174.94 175.44 1fx5 s GLY 145 N 0.05 0.04 -0.21 6.27 0.00 -1.00 -1.02 107.32 111.44 1fx5 s GLY 145 Ca -0.09 -0.39 -0.12 0.00 0.00 0.00 0.00 44.72 44.12 1fx5 s GLY 145 CO 0.06 -0.43 0.23 -0.42 0.00 0.00 0.00 173.10 172.54 1fx5 s ILE 146 N -3.89 5.32 -0.07 0.90 1.01 -0.55 -1.40 121.20 122.53 1fx5 s ILE 146 Ca 0.10 0.36 0.02 0.00 0.00 0.00 0.00 60.65 61.14 1fx5 s ILE 146 Cb 0.01 -3.57 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 1fx5 s ILE 146 CO -0.03 0.35 -0.12 -1.81 0.00 0.00 0.00 174.94 173.32 1fx5 s ASP 147 N 0.83 4.17 -0.24 3.58 1.11 0.11 -1.33 116.67 124.89 1fx5 s ASP 147 Ca 0.12 -0.17 -0.02 0.00 0.18 0.00 0.00 52.55 52.66 1fx5 s ASP 147 Cb -0.13 -1.03 0.08 0.00 1.07 0.00 0.00 42.92 42.91 1fx5 s ASP 147 CO 0.04 0.32 0.05 -0.69 1.18 0.00 0.00 175.17 176.07 1fx5 s VAL 148 N -0.59 0.78 -0.89 -1.27 1.01 -1.26 -1.99 120.40 116.18 1fx5 s VAL 148 Ca 0.09 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1fx5 s VAL 148 Cb -0.11 -1.37 0.00 0.00 0.00 0.00 0.00 36.38 34.90 1fx5 s VAL 148 CO 0.01 -0.37 0.00 0.59 0.00 0.00 0.00 175.10 175.33 1fx5 n ASN 149 N 4.93 -4.08 -3.59 3.32 3.02 -0.65 -4.88 115.26 113.33 1fx5 n ASN 149 Ca -0.07 0.21 -0.13 0.00 -0.03 0.00 0.00 54.58 54.56 1fx5 n ASN 149 Cb 0.45 -3.18 -0.05 0.00 -0.61 0.00 0.00 39.78 36.38 1fx5 n ASN 149 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fx5 n VAL 151 N 0.30 0.49 -3.17 0.00 3.14 -1.26 -4.53 118.33 113.30 1fx5 n VAL 151 Ca -0.18 0.12 -0.43 0.00 -2.96 0.00 0.00 64.34 60.90 1fx5 n VAL 151 Cb 0.61 -0.75 -0.07 0.00 -1.06 0.00 0.00 33.84 32.57 1fx5 n VAL 151 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1fx5 s LYS 152 N -2.97 3.30 0.29 1.45 1.02 -1.26 -4.99 119.74 116.58 1fx5 s LYS 152 Ca 0.11 -0.41 -0.29 0.00 0.02 0.00 0.00 55.97 55.40 1fx5 s LYS 152 Cb 0.14 -3.93 -0.10 0.00 -0.52 0.00 0.00 37.83 33.42 1fx5 s LYS 152 CO 0.39 -0.92 1.40 -1.12 -0.92 0.00 0.00 175.35 174.18 1fx5 s SER 153 N 1.93 6.65 0.00 2.83 0.01 -1.26 -4.63 113.70 119.23 1fx5 s SER 153 Ca 0.20 2.72 0.24 0.00 1.31 0.00 0.00 55.95 60.42 1fx5 s SER 153 Cb -0.15 -2.64 1.27 0.00 0.21 0.00 0.00 66.02 64.72 1fx5 s SER 153 CO 0.17 -0.67 1.80 2.30 0.41 0.00 0.00 173.24 177.26 1fx5 n ILE 154 N 1.62 0.19 -3.65 1.44 -5.35 -0.44 -4.73 119.36 108.44 1fx5 n ILE 154 Ca 0.04 0.05 -0.04 0.00 -0.27 0.00 0.00 62.75 62.52 1fx5 n ILE 154 Cb 0.41 -0.65 -0.07 0.00 -1.74 0.00 0.00 39.64 37.58 1fx5 n ILE 154 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1fx5 s ASN 155 N -2.44 -0.17 0.24 7.28 2.47 -1.25 -5.02 114.94 116.06 1fx5 s ASN 155 Ca 0.26 0.32 -0.05 0.00 0.42 0.00 0.00 52.86 53.81 1fx5 s ASN 155 Cb 0.16 0.34 -0.02 0.00 -1.45 0.00 0.00 41.25 40.29 1fx5 s ASN 155 CO 0.35 -0.05 0.31 0.00 -3.72 0.00 0.00 177.10 173.98 1fx5 s ALA 156 N 0.11 0.64 -0.00 1.71 0.00 -1.26 -1.48 121.76 121.49 1fx5 s ALA 156 Ca 0.06 -1.40 -0.15 0.00 0.00 0.00 0.00 51.96 50.47 1fx5 s ALA 156 Cb -0.05 1.25 0.02 0.00 0.00 0.00 0.00 23.12 24.34 1fx5 s ALA 156 CO -0.13 -0.72 0.31 -2.00 0.00 0.00 0.00 175.76 173.22 1fx5 s GLU 157 N -3.91 0.70 0.21 0.00 2.12 -0.19 -4.97 118.70 112.65 1fx5 s GLU 157 Ca 0.32 -0.26 -0.31 0.00 0.36 0.00 0.00 54.97 55.08 1fx5 s GLU 157 Cb 0.03 0.31 -0.11 0.00 0.26 0.00 0.00 34.13 34.62 1fx5 s GLU 157 CO 0.13 -0.20 1.61 0.50 -0.54 0.00 0.00 175.26 176.76 1fx5 s ARG 158 N -1.60 4.18 -0.11 4.30 3.52 -1.26 -1.93 118.95 126.05 1fx5 s ARG 158 Ca -0.12 2.47 0.01 0.00 -0.13 0.00 0.00 55.73 57.96 1fx5 s ARG 158 Cb -0.04 -3.10 0.02 0.00 -1.56 0.00 0.00 34.95 30.26 1fx5 s ARG 158 CO 0.03 -0.64 -0.13 -0.46 -0.81 0.00 0.00 175.30 173.29 1fx5 s TRP 159 N 0.84 1.83 -1.17 5.12 -0.00 0.38 -4.83 118.94 121.11 1fx5 s TRP 159 Ca 0.69 -0.87 -0.10 0.00 -0.00 0.00 0.00 56.10 55.82 1fx5 s TRP 159 Cb -0.46 -1.36 0.23 0.00 -0.00 0.00 0.00 33.47 31.88 1fx5 s TRP 159 CO 0.35 -0.48 1.40 0.09 -0.00 0.00 0.00 176.95 178.31 1fx5 n ASN 160 N 4.36 5.47 -4.58 5.86 3.02 -1.26 -4.21 115.26 123.92 1fx5 n ASN 160 Ca -0.18 -3.08 -0.44 0.00 -0.03 0.00 0.00 54.58 50.85 1fx5 n ASN 160 Cb 0.51 -1.45 -0.01 0.00 -0.61 0.00 0.00 39.78 38.21 1fx5 n ASN 160 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1fx5 n LYS 161 N 3.79 1.26 -4.24 3.52 2.85 -1.26 -5.04 118.16 119.04 1fx5 n LYS 161 Ca 0.31 0.44 -0.20 0.00 -1.05 0.00 0.00 58.31 57.82 1fx5 n LYS 161 Cb 0.39 -1.81 -0.12 0.00 -0.65 0.00 0.00 35.03 32.84 1fx5 n LYS 161 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1fx5 s ARG 162 N -1.58 0.90 0.32 -1.58 0.52 -1.26 -5.07 118.95 111.20 1fx5 s ARG 162 Ca 0.59 -0.95 0.11 0.00 -0.52 0.00 0.00 55.73 54.96 1fx5 s ARG 162 Cb -0.69 -0.95 -0.06 0.00 0.52 0.00 0.00 34.95 33.77 1fx5 s ARG 162 CO 0.59 0.22 -0.13 0.71 0.02 0.00 0.00 175.30 176.71 1fx5 s TYR 163 N -1.16 2.37 0.00 -0.53 1.51 -1.26 -4.76 117.35 113.52 1fx5 s TYR 163 Ca 0.00 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.64 1fx5 s TYR 163 Cb -0.10 -1.22 0.00 0.00 -0.11 0.00 0.00 41.96 40.53 1fx5 s TYR 163 CO 0.02 0.64 0.00 0.41 -1.11 0.00 0.00 175.55 175.51 1fx5 n GLY 164 N -0.73 1.62 0.30 0.71 0.00 0.01 -4.44 105.19 102.65 1fx5 n GLY 164 Ca -0.05 -1.72 0.14 0.00 0.00 0.00 0.00 46.02 44.39 1fx5 n GLY 164 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1fx5 h LEU 165 N 0.00 0.00 0.00 0.99 6.46 -1.98 0.83 115.31 121.62 1fx5 h LEU 165 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1fx5 h LEU 165 Cb 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.93 1fx5 h LEU 165 CO 0.00 0.00 0.00 -0.46 -0.62 0.00 0.00 178.44 177.36 1fx5 n ASN 166 N -3.99 0.00 -2.68 1.25 6.94 -1.26 -3.54 115.26 111.98 1fx5 n ASN 166 Ca -0.02 -0.02 -0.29 0.00 -0.02 0.00 0.00 54.58 54.23 1fx5 n ASN 166 Cb 0.12 -0.31 -0.01 0.00 -2.36 0.00 0.00 39.78 37.22 1fx5 n ASN 166 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1fx5 n ASN 167 N -1.31 5.02 -4.77 0.53 5.03 0.29 -4.96 115.26 115.09 1fx5 n ASN 167 Ca 0.12 -3.72 -0.41 0.00 0.87 0.00 0.00 54.58 51.44 1fx5 n ASN 167 Cb 0.22 -0.57 -0.02 0.00 -1.02 0.00 0.00 39.78 38.39 1fx5 n ASN 167 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1fx5 s VAL 168 N -5.18 2.64 -0.06 2.41 0.11 -1.23 -4.83 120.40 114.26 1fx5 s VAL 168 Ca 0.48 0.64 -0.00 0.00 -2.93 0.00 0.00 61.98 60.17 1fx5 s VAL 168 Cb 0.36 -3.41 -0.03 0.00 -1.53 0.00 0.00 36.38 31.78 1fx5 s VAL 168 CO -0.20 0.15 -0.02 0.00 -3.33 0.00 0.00 175.10 171.70 1fx5 s ALA 169 N -1.10 3.18 -0.27 1.54 0.00 0.14 -4.43 121.76 120.83 1fx5 s ALA 169 Ca 0.50 -0.86 -0.08 0.00 0.00 0.00 0.00 51.96 51.52 1fx5 s ALA 169 Cb -0.41 -1.37 -0.02 0.00 0.00 0.00 0.00 23.12 21.33 1fx5 s ALA 169 CO 0.54 0.59 0.09 -0.80 0.00 0.00 0.00 175.76 176.18 1fx5 s ASN 170 N -1.00 5.23 0.04 0.00 0.02 0.45 -1.83 114.94 117.86 1fx5 s ASN 170 Ca 0.14 -0.36 0.06 0.00 -1.02 0.00 0.00 52.86 51.68 1fx5 s ASN 170 Cb -0.11 -1.93 -0.03 0.00 0.02 0.00 0.00 41.25 39.19 1fx5 s ASN 170 CO 0.04 -0.10 -0.13 -0.69 0.02 0.00 0.00 177.10 176.24 1fx5 s VAL 171 N 1.60 3.16 -0.10 1.60 1.01 0.11 -0.69 120.40 127.10 1fx5 s VAL 171 Ca 0.05 -1.07 -0.04 0.00 0.00 0.00 0.00 61.98 60.93 1fx5 s VAL 171 Cb -0.16 -2.38 0.05 0.00 0.00 0.00 0.00 36.38 33.90 1fx5 s VAL 171 CO 0.04 0.32 0.19 -0.70 0.00 0.00 0.00 175.10 174.94 1fx5 s GLU 172 N -1.57 0.06 -0.05 2.72 2.12 -0.71 -1.95 118.70 119.32 1fx5 s GLU 172 Ca 0.17 0.61 0.06 0.00 0.36 0.00 0.00 54.97 56.17 1fx5 s GLU 172 Cb -0.11 -0.21 -0.01 0.00 0.26 0.00 0.00 34.13 34.06 1fx5 s GLU 172 CO 0.07 -0.30 -0.24 0.42 -0.54 0.00 0.00 175.26 174.67 1fx5 s ILE 173 N 2.31 2.14 -0.03 -3.70 1.01 -0.32 -1.39 121.20 121.21 1fx5 s ILE 173 Ca 0.02 -1.05 -0.04 0.00 0.00 0.00 0.00 60.65 59.59 1fx5 s ILE 173 Cb -0.12 -1.77 0.01 0.00 0.01 0.00 0.00 42.46 40.59 1fx5 s ILE 173 CO -0.06 0.57 0.10 -0.51 0.00 0.00 0.00 174.94 175.04 1fx5 s ILE 174 N -0.32 0.02 -0.20 2.92 2.07 0.19 -0.93 121.20 124.94 1fx5 s ILE 174 Ca 0.01 -0.16 -0.00 0.00 -1.41 0.00 0.00 60.65 59.09 1fx5 s ILE 174 Cb -0.12 -0.20 0.05 0.00 0.13 0.00 0.00 42.46 42.32 1fx5 s ILE 174 CO 0.02 -0.09 -0.04 -0.47 -1.91 0.00 0.00 174.94 172.45 1fx5 s TYR 175 N -0.25 1.96 -0.42 3.50 5.04 -0.76 -0.85 117.35 125.56 1fx5 s TYR 175 Ca -0.03 -1.38 -0.16 0.00 -2.44 0.00 0.00 57.07 53.06 1fx5 s TYR 175 Cb -0.02 -1.41 0.03 0.00 0.35 0.00 0.00 41.96 40.90 1fx5 s TYR 175 CO 0.00 -0.69 0.35 -2.00 -1.34 0.00 0.00 175.55 171.87 1fx5 s GLU 176 N 1.55 3.00 0.30 4.97 2.12 -0.83 -2.25 118.70 127.56 1fx5 s GLU 176 Ca -0.03 -1.01 0.02 0.00 0.36 0.00 0.00 54.97 54.32 1fx5 s GLU 176 Cb -0.17 -4.00 0.59 0.00 0.26 0.00 0.00 34.13 30.80 1fx5 s GLU 176 CO -0.07 -0.82 1.88 0.00 -0.54 0.00 0.00 175.26 175.70 1fx5 h ALA 177 N 8.68 1.57 -0.91 6.30 0.00 -1.88 -1.45 119.26 131.56 1fx5 h ALA 177 Ca -0.27 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.65 1fx5 h ALA 177 Cb 1.12 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 1fx5 h ALA 177 CO 0.77 0.23 0.60 0.66 0.00 0.00 0.00 179.25 181.52 1fx5 h SER 178 N 0.96 1.05 -0.57 0.00 4.64 -1.92 -2.77 113.55 114.94 1fx5 h SER 178 Ca 0.44 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1fx5 h SER 178 Cb 0.40 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1fx5 h SER 178 CO -0.20 0.76 0.00 -1.54 -0.87 0.00 0.00 176.83 174.98 1fx5 n SER 179 N -4.40 3.53 -2.66 4.97 3.41 -1.13 -4.97 113.62 112.38 1fx5 n SER 179 Ca 0.11 -2.00 -0.09 0.00 -0.26 0.00 0.00 58.87 56.62 1fx5 n SER 179 Cb 0.02 -0.38 -0.01 0.00 -0.26 0.00 0.00 64.21 63.58 1fx5 n SER 179 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1fx5 n LYS 180 N 1.18 -2.64 -3.39 4.33 4.76 -0.57 -4.89 118.16 116.94 1fx5 n LYS 180 Ca 0.19 0.30 -0.39 0.00 -2.87 0.00 0.00 58.31 55.54 1fx5 n LYS 180 Cb 0.54 -4.87 -0.09 0.00 -1.84 0.00 0.00 35.03 28.78 1fx5 n LYS 180 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1fx5 s THR 181 N -2.41 5.18 -0.40 -0.18 2.01 -1.07 -0.91 115.64 117.86 1fx5 s THR 181 Ca 0.08 0.60 -0.09 0.00 0.31 0.00 0.00 61.69 62.59 1fx5 s THR 181 Cb -0.04 -3.71 0.06 0.00 0.01 0.00 0.00 72.50 68.82 1fx5 s THR 181 CO 0.10 0.17 0.22 -0.22 -0.69 0.00 0.00 174.62 174.20 1fx5 s LEU 182 N 1.95 4.92 -0.08 4.42 2.96 -0.51 -1.96 118.68 130.37 1fx5 s LEU 182 Ca 0.16 -1.33 0.01 0.00 -0.22 0.00 0.00 54.13 52.75 1fx5 s LEU 182 Cb -0.16 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 1fx5 s LEU 182 CO 0.09 -0.47 -0.10 -0.89 -1.32 0.00 0.00 176.35 173.67 1fx5 s THR 183 N 1.45 3.40 -0.04 3.68 2.01 -0.03 -2.73 115.64 123.38 1fx5 s THR 183 Ca 0.02 -0.58 0.02 0.00 0.31 0.00 0.00 61.69 61.47 1fx5 s THR 183 Cb -0.22 -2.39 0.01 0.00 0.01 0.00 0.00 72.50 69.91 1fx5 s THR 183 CO 0.03 0.57 -0.10 0.00 -0.69 0.00 0.00 174.62 174.44 1fx5 s ALA 184 N -0.44 0.97 -0.02 7.40 0.00 -0.99 -0.64 121.76 128.04 1fx5 s ALA 184 Ca 0.06 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 51.71 1fx5 s ALA 184 Cb -0.12 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.59 1fx5 s ALA 184 CO 0.02 0.11 -0.03 -1.54 0.00 0.00 0.00 175.76 174.33 1fx5 s SER 185 N 0.45 0.51 -0.09 0.00 1.04 -0.48 -2.24 113.70 112.88 1fx5 s SER 185 Ca -0.08 -0.06 0.02 0.00 0.48 0.00 0.00 55.95 56.30 1fx5 s SER 185 Cb -0.12 -0.17 -0.02 0.00 0.10 0.00 0.00 66.02 65.82 1fx5 s SER 185 CO 0.01 -0.02 -0.14 -0.22 0.98 0.00 0.00 173.24 173.86 1fx5 s LEU 186 N 0.43 2.73 -0.02 2.42 0.20 -0.63 -1.74 118.68 122.07 1fx5 s LEU 186 Ca -0.04 -0.26 0.01 0.00 0.69 0.00 0.00 54.13 54.52 1fx5 s LEU 186 Cb -0.08 -1.58 0.01 0.00 -0.43 0.00 0.00 46.19 44.11 1fx5 s LEU 186 CO -0.01 0.25 -0.03 -0.89 -0.29 0.00 0.00 176.35 175.39 1fx5 s THR 187 N -0.16 0.29 -0.44 3.68 2.01 0.14 -1.44 115.64 119.72 1fx5 s THR 187 Ca -0.00 -0.07 -0.13 0.00 0.31 0.00 0.00 61.69 61.79 1fx5 s THR 187 Cb -0.13 -0.30 0.06 0.00 0.01 0.00 0.00 72.50 72.14 1fx5 s THR 187 CO 0.03 0.12 0.32 -0.31 -0.69 0.00 0.00 174.62 174.10 1fx5 s TYR 188 N 0.41 3.27 0.51 4.92 2.02 -0.43 -0.41 117.35 127.65 1fx5 s TYR 188 Ca -0.04 -1.04 0.34 0.00 -0.37 0.00 0.00 57.07 55.97 1fx5 s TYR 188 Cb -0.07 -2.95 1.87 0.00 -0.40 0.00 0.00 41.96 40.42 1fx5 s TYR 188 CO -0.01 -0.76 2.22 -1.00 -1.57 0.00 0.00 175.55 174.43 1fx5 h PRO 189 N 8.61 0.00 0.31 -1.71 0.13 -1.87 0.23 132.00 137.70 1fx5 h PRO 189 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1fx5 h PRO 189 Cb 1.10 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 1fx5 h PRO 189 CO 0.80 0.04 -0.35 0.66 -0.23 0.00 0.00 178.00 178.91 1fx5 h SER 190 N 0.00 -0.97 -0.01 1.44 4.64 -1.93 -3.29 113.55 113.43 1fx5 h SER 190 Ca -0.00 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1fx5 h SER 190 Cb 0.15 0.33 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1fx5 h SER 190 CO 0.00 -0.48 -0.11 -0.90 -0.87 0.00 0.00 176.83 174.47 1fx5 n ASP 191 N -5.46 1.36 -1.29 4.97 5.68 -1.23 -5.02 116.55 115.56 1fx5 n ASP 191 Ca -0.09 -1.18 -0.08 0.00 -0.50 0.00 0.00 54.79 52.94 1fx5 n ASP 191 Cb 0.36 0.29 0.02 0.00 -1.14 0.00 0.00 41.12 40.65 1fx5 n ASP 191 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1fx5 n GLN 192 N 0.01 -1.94 -2.71 0.11 6.02 0.78 -5.02 117.38 114.63 1fx5 n GLN 192 Ca 0.04 0.31 -0.41 0.00 -0.01 0.00 0.00 57.00 56.93 1fx5 n GLN 192 Cb 0.20 -3.87 -0.05 0.00 1.02 0.00 0.00 30.24 27.54 1fx5 n GLN 192 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1fx5 s THR 193 N -2.83 4.34 -0.01 5.09 2.01 -1.13 -4.85 115.64 118.26 1fx5 s THR 193 Ca 0.13 2.03 0.00 0.00 0.31 0.00 0.00 61.69 64.16 1fx5 s THR 193 Cb -0.06 -4.30 0.02 0.00 0.01 0.00 0.00 72.50 68.18 1fx5 s THR 193 CO 0.16 0.35 0.01 -0.55 -0.69 0.00 0.00 174.62 173.90 1fx5 s SER 194 N -0.27 0.11 0.14 3.53 0.15 -1.26 -1.31 113.70 114.79 1fx5 s SER 194 Ca 0.46 0.01 0.06 0.00 0.70 0.00 0.00 55.95 57.18 1fx5 s SER 194 Cb -0.25 -0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 63.96 1fx5 s SER 194 CO 0.31 -0.08 -0.13 0.27 1.20 0.00 0.00 173.24 174.81 1fx5 s ILE 195 N 0.69 1.30 0.15 6.45 -4.36 -0.52 -5.00 121.20 119.91 1fx5 s ILE 195 Ca -0.06 -1.86 -0.08 0.00 -0.26 0.00 0.00 60.65 58.39 1fx5 s ILE 195 Cb -0.09 -1.66 -0.01 0.00 1.25 0.00 0.00 42.46 41.96 1fx5 s ILE 195 CO -0.02 -0.54 0.25 -0.44 0.24 0.00 0.00 174.94 174.43 1fx5 s SER 196 N -2.74 0.08 0.01 4.36 0.01 -1.26 -1.60 113.70 112.56 1fx5 s SER 196 Ca 0.12 -0.89 -0.11 0.00 1.31 0.00 0.00 55.95 56.38 1fx5 s SER 196 Cb -0.02 0.41 0.01 0.00 0.21 0.00 0.00 66.02 66.63 1fx5 s SER 196 CO 0.03 -0.86 0.24 0.68 0.41 0.00 0.00 173.24 173.74 1fx5 s VAL 197 N -3.97 0.08 -0.12 3.43 -7.23 -0.95 -4.81 120.40 106.83 1fx5 s VAL 197 Ca 0.17 -0.66 -0.22 0.00 -1.81 0.00 0.00 61.98 59.45 1fx5 s VAL 197 Cb 0.04 -0.69 0.05 0.00 0.56 0.00 0.00 36.38 36.35 1fx5 s VAL 197 CO -0.01 -0.36 0.55 -0.89 -0.31 0.00 0.00 175.10 174.08 1fx5 s THR 198 N -1.82 0.01 0.07 5.32 2.01 -1.26 -2.35 115.64 117.63 1fx5 s THR 198 Ca -0.11 -0.09 -0.16 0.00 0.31 0.00 0.00 61.69 61.64 1fx5 s THR 198 Cb -0.04 -0.82 0.03 0.00 0.01 0.00 0.00 72.50 71.68 1fx5 s THR 198 CO 0.01 -0.05 0.37 -0.44 -0.69 0.00 0.00 174.62 173.81 1fx5 s SER 199 N -0.47 -0.20 -0.36 3.53 0.01 -1.11 -5.01 113.70 110.09 1fx5 s SER 199 Ca -0.06 -0.19 -0.12 0.00 1.31 0.00 0.00 55.95 56.89 1fx5 s SER 199 Cb -0.03 0.42 0.01 0.00 0.21 0.00 0.00 66.02 66.62 1fx5 s SER 199 CO 0.04 -0.71 0.23 -0.63 0.41 0.00 0.00 173.24 172.58 1fx5 s ILE 200 N -2.98 4.95 -0.03 1.44 1.01 -1.26 -1.42 121.20 122.90 1fx5 s ILE 200 Ca -0.02 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.10 1fx5 s ILE 200 Cb 0.00 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.83 1fx5 s ILE 200 CO -0.06 -0.13 -0.07 0.54 0.00 0.00 0.00 174.94 175.22 1fx5 s VAL 201 N 1.64 0.67 -0.67 2.92 0.11 -0.09 -5.01 120.40 119.97 1fx5 s VAL 201 Ca 0.04 -0.27 -0.17 0.00 -2.93 0.00 0.00 61.98 58.65 1fx5 s VAL 201 Cb -0.18 -0.62 0.14 0.00 -1.53 0.00 0.00 36.38 34.19 1fx5 s VAL 201 CO 0.08 0.22 0.73 -0.62 -3.33 0.00 0.00 175.10 172.19 1fx5 s ASP 202 N 0.39 6.35 0.51 3.54 2.15 -1.26 -4.65 116.67 123.70 1fx5 s ASP 202 Ca -0.06 -1.83 0.16 0.00 0.43 0.00 0.00 52.55 51.26 1fx5 s ASP 202 Cb -0.10 -2.28 1.24 0.00 -0.30 0.00 0.00 42.92 41.48 1fx5 s ASP 202 CO 0.00 -0.95 2.12 -0.07 -0.17 0.00 0.00 175.17 176.10 1fx5 h LEU 203 N 9.39 0.06 -2.00 -1.34 4.07 -1.99 -2.76 115.31 120.74 1fx5 h LEU 203 Ca -0.16 -0.00 0.07 0.00 0.08 0.00 0.00 57.88 57.87 1fx5 h LEU 203 Cb 1.07 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.79 1fx5 h LEU 203 CO 1.02 0.04 0.18 0.50 -1.08 0.00 0.00 178.44 179.10 1fx5 h LYS 204 N 0.07 0.00 -0.46 1.13 3.64 -1.91 -1.79 116.57 117.25 1fx5 h LYS 204 Ca 0.06 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.31 1fx5 h LYS 204 Cb 0.14 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.89 1fx5 h LYS 204 CO -0.01 0.00 0.09 -0.85 -2.27 0.00 0.00 179.45 176.41 1fx5 n GLU 205 N -4.46 2.96 0.00 1.90 0.28 -1.04 -4.55 120.64 115.73 1fx5 n GLU 205 Ca 0.03 -3.02 0.00 0.00 -0.16 0.00 0.00 57.16 54.01 1fx5 n GLU 205 Cb 0.33 -1.98 0.00 0.00 1.43 0.00 0.00 31.44 31.23 1fx5 n GLU 205 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 1fx5 n ILE 206 N -0.54 0.00 -3.95 3.84 5.41 -0.81 -5.11 119.36 118.20 1fx5 n ILE 206 Ca 0.32 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.79 1fx5 n ILE 206 Cb 1.11 -0.85 -0.03 0.00 -0.71 0.00 0.00 39.64 39.16 1fx5 n ILE 206 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1fx5 s LEU 207 N -5.18 4.29 0.88 1.39 1.43 -0.74 -4.45 118.68 116.30 1fx5 s LEU 207 Ca 0.00 0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 53.14 1fx5 s LEU 207 Cb 0.00 -2.87 0.12 0.00 0.03 0.00 0.00 46.19 43.46 1fx5 s LEU 207 CO 0.00 0.08 1.16 -2.16 0.23 0.00 0.00 176.35 175.66 1fx5 s PRO 208 N -3.05 1.43 0.42 1.29 0.04 -1.26 -4.81 135.00 129.05 1fx5 s PRO 208 Ca 0.34 0.20 0.08 0.00 0.04 0.00 0.00 61.00 61.67 1fx5 s PRO 208 Cb -0.11 -1.88 0.90 0.00 0.04 0.00 0.00 34.50 33.45 1fx5 s PRO 208 CO 0.28 -1.98 2.06 0.93 0.04 0.00 0.00 177.00 178.32 1fx5 h GLU 209 N -1.34 0.49 -5.16 4.56 5.08 -1.96 -3.41 114.58 112.85 1fx5 h GLU 209 Ca -0.49 -0.03 -0.66 0.00 -1.00 0.00 0.00 59.36 57.18 1fx5 h GLU 209 Cb 1.33 -0.11 -0.29 0.00 0.50 0.00 0.00 28.75 30.17 1fx5 h GLU 209 CO 0.63 0.33 -0.78 -1.58 -1.00 0.00 0.00 179.01 176.60 1fx5 s TRP 210 N -5.46 2.83 0.33 4.33 0.52 -1.26 -1.11 118.94 119.12 1fx5 s TRP 210 Ca -0.08 -0.99 0.03 0.00 0.02 0.00 0.00 56.10 55.09 1fx5 s TRP 210 Cb 0.18 -1.93 -0.04 0.00 -1.15 0.00 0.00 33.47 30.52 1fx5 s TRP 210 CO 0.73 -0.46 0.12 0.14 0.02 0.00 0.00 176.95 177.50 1fx5 s VAL 211 N 0.92 0.60 0.10 4.03 -7.23 -0.98 -4.42 120.40 113.42 1fx5 s VAL 211 Ca -0.03 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.24 1fx5 s VAL 211 Cb -0.15 -2.55 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 1fx5 s VAL 211 CO -0.01 0.00 -0.23 -0.94 -0.31 0.00 0.00 175.10 173.61 1fx5 s SER 212 N -3.44 3.50 0.02 4.85 1.04 -0.72 -0.20 113.70 118.76 1fx5 s SER 212 Ca 0.33 -0.63 0.03 0.00 0.48 0.00 0.00 55.95 56.16 1fx5 s SER 212 Cb 0.06 -0.37 -0.04 0.00 0.10 0.00 0.00 66.02 65.77 1fx5 s SER 212 CO 0.16 0.20 -0.02 0.68 0.98 0.00 0.00 173.24 175.24 1fx5 s VAL 213 N -1.02 3.97 -0.12 5.02 -7.23 -1.26 -3.43 120.40 116.33 1fx5 s VAL 213 Ca 0.15 -0.75 0.00 0.00 -1.81 0.00 0.00 61.98 59.57 1fx5 s VAL 213 Cb -0.10 -2.79 0.00 0.00 0.56 0.00 0.00 36.38 34.05 1fx5 s VAL 213 CO 0.06 0.32 0.00 0.61 -0.31 0.00 0.00 175.10 175.78 1fx5 n GLY 214 N 1.24 -1.01 3.32 2.32 0.00 -1.11 -1.98 105.19 107.97 1fx5 n GLY 214 Ca -0.14 -0.74 -0.17 0.00 0.00 0.00 0.00 46.02 44.97 1fx5 n GLY 214 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fx5 s PHE 215 N -3.00 1.54 0.01 1.61 0.40 0.60 -1.95 117.98 117.19 1fx5 s PHE 215 Ca 0.00 -0.77 -0.08 0.00 -0.60 0.00 0.00 56.93 55.48 1fx5 s PHE 215 Cb 0.00 -0.82 0.00 0.00 0.51 0.00 0.00 43.02 42.71 1fx5 s PHE 215 CO 0.00 0.12 0.15 -1.54 0.70 0.00 0.00 175.22 174.65 1fx5 s SER 216 N -3.28 0.04 -0.13 1.36 1.04 -1.03 -1.43 113.70 110.27 1fx5 s SER 216 Ca 0.23 -0.27 -0.10 0.00 0.48 0.00 0.00 55.95 56.30 1fx5 s SER 216 Cb 0.03 0.23 0.04 0.00 0.10 0.00 0.00 66.02 66.42 1fx5 s SER 216 CO 0.06 -0.42 0.33 -0.83 0.98 0.00 0.00 173.24 173.36 1fx5 s GLY 217 N -1.60 -0.25 0.12 7.32 0.00 -0.56 -2.05 107.32 110.31 1fx5 s GLY 217 Ca -0.12 1.09 -0.05 0.00 0.00 0.00 0.00 44.72 45.64 1fx5 s GLY 217 CO 0.00 1.09 0.14 -1.35 0.00 0.00 0.00 173.10 172.98 1fx5 s SER 218 N 0.66 0.22 0.25 1.64 1.04 -1.10 -0.22 113.70 116.19 1fx5 s SER 218 Ca -0.04 -0.98 -0.17 0.00 0.48 0.00 0.00 55.95 55.24 1fx5 s SER 218 Cb -0.05 0.33 0.01 0.00 0.10 0.00 0.00 66.02 66.41 1fx5 s SER 218 CO -0.04 -0.76 0.59 0.28 0.98 0.00 0.00 173.24 174.28 1fx5 s THR 219 N -3.97 0.00 0.07 2.02 -1.32 -0.36 -1.03 115.64 111.05 1fx5 s THR 219 Ca 0.16 -1.12 0.09 0.00 -1.21 0.00 0.00 61.69 59.61 1fx5 s THR 219 Cb 0.06 -2.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.02 1fx5 s THR 219 CO -0.03 -0.02 -0.23 -0.47 -2.21 0.00 0.00 174.62 171.66 1fx5 s TYR 220 N -3.95 2.02 0.27 9.09 6.04 -1.26 -2.27 117.35 127.29 1fx5 s TYR 220 Ca 0.15 -0.39 -0.30 0.00 0.04 0.00 0.00 57.07 56.56 1fx5 s TYR 220 Cb -0.03 -1.16 -0.13 0.00 -1.04 0.00 0.00 41.96 39.60 1fx5 s TYR 220 CO 0.06 0.17 1.40 1.51 -1.54 0.00 0.00 175.55 177.16 1fx5 n ILE 221 N 1.48 1.19 0.00 3.14 0.13 0.28 -1.96 119.36 123.62 1fx5 n ILE 221 Ca -0.18 -0.30 0.00 0.00 -1.10 0.00 0.00 62.75 61.18 1fx5 n ILE 221 Cb 0.53 -1.55 0.00 0.00 -0.84 0.00 0.00 39.64 37.78 1fx5 n ILE 221 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1fx5 n GLY 222 N 1.86 2.71 0.63 4.50 0.00 -1.26 -4.70 105.19 108.92 1fx5 n GLY 222 Ca 0.10 -0.62 0.05 0.00 0.00 0.00 0.00 46.02 45.54 1fx5 n GLY 222 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1fx5 n ARG 223 N 0.00 1.67 -1.61 1.61 1.85 -0.92 -4.86 116.66 114.39 1fx5 n ARG 223 Ca 0.00 -3.09 -0.49 0.00 -1.00 0.00 0.00 57.85 53.27 1fx5 n ARG 223 Cb 0.00 -1.65 -0.04 0.00 -1.05 0.00 0.00 32.46 29.71 1fx5 n ARG 223 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1fx5 n GLN 224 N -1.15 1.48 -3.83 2.89 6.02 -0.83 -1.76 117.38 120.20 1fx5 n GLN 224 Ca 0.22 0.53 -0.12 0.00 -0.01 0.00 0.00 57.00 57.62 1fx5 n GLN 224 Cb 0.77 -2.15 -0.10 0.00 1.02 0.00 0.00 30.24 29.78 1fx5 n GLN 224 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fx5 s ALA 225 N 0.24 -0.46 -0.08 -1.58 0.00 -1.25 -4.00 121.76 114.63 1fx5 s ALA 225 Ca 0.77 0.15 -0.01 0.00 0.00 0.00 0.00 51.96 52.87 1fx5 s ALA 225 Cb -0.82 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 1fx5 s ALA 225 CO 0.47 -0.18 -0.01 -0.08 0.00 0.00 0.00 175.76 175.96 1fx5 s THR 226 N -0.93 4.18 -0.14 0.00 -1.32 0.25 -4.71 115.64 112.97 1fx5 s THR 226 Ca -0.10 -0.29 0.00 0.00 -1.21 0.00 0.00 61.69 60.09 1fx5 s THR 226 Cb -0.05 -2.75 -0.01 0.00 -1.51 0.00 0.00 72.50 68.18 1fx5 s THR 226 CO 0.02 0.60 -0.15 -1.00 -2.21 0.00 0.00 174.62 171.88 1fx5 s HIS 227 N -0.84 2.78 0.03 9.09 3.76 -1.26 -1.86 115.29 127.00 1fx5 s HIS 227 Ca 0.13 -0.85 0.03 0.00 -0.15 0.00 0.00 55.06 54.22 1fx5 s HIS 227 Cb -0.11 -1.86 -0.02 0.00 1.11 0.00 0.00 32.58 31.70 1fx5 s HIS 227 CO 0.02 -0.35 -0.10 -1.21 -0.85 0.00 0.00 174.74 172.26 1fx5 s GLU 228 N 0.58 0.67 -0.10 1.40 2.02 -0.62 -1.05 118.70 121.58 1fx5 s GLU 228 Ca -0.09 -0.63 -0.01 0.00 0.02 0.00 0.00 54.97 54.26 1fx5 s GLU 228 Cb -0.16 -0.58 -0.03 0.00 0.10 0.00 0.00 34.13 33.46 1fx5 s GLU 228 CO 0.03 0.14 -0.07 0.08 0.02 0.00 0.00 175.26 175.47 1fx5 s VAL 229 N -0.89 3.69 -0.15 2.63 1.01 0.40 -1.60 120.40 125.49 1fx5 s VAL 229 Ca -0.03 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 1fx5 s VAL 229 Cb -0.07 -2.55 -0.24 0.00 0.00 0.00 0.00 36.38 33.52 1fx5 s VAL 229 CO 0.01 0.56 0.23 0.18 0.00 0.00 0.00 175.10 176.07 1fx5 n LEU 230 N 2.79 2.49 -3.95 3.92 4.77 -0.49 -1.26 117.00 125.27 1fx5 n LEU 230 Ca -0.18 0.13 -0.09 0.00 -0.03 0.00 0.00 56.01 55.84 1fx5 n LEU 230 Cb 0.53 -0.90 -0.03 0.00 -2.33 0.00 0.00 43.42 40.68 1fx5 n LEU 230 CO 0.29 0.83 0.30 0.54 -1.33 0.00 0.00 177.39 178.02 1fx5 s ASN 231 N -6.77 -0.01 -0.27 -1.43 2.20 -1.26 -4.13 114.94 103.28 1fx5 s ASN 231 Ca -0.24 -0.94 -0.19 0.00 -0.94 0.00 0.00 52.86 50.56 1fx5 s ASN 231 Cb 0.07 0.67 0.07 0.00 -2.00 0.00 0.00 41.25 40.07 1fx5 s ASN 231 CO 0.73 -1.29 0.67 0.86 -2.94 0.00 0.00 177.10 175.14 1fx5 s TRP 232 N -3.66 -0.92 -0.00 1.54 -0.00 -0.83 -3.79 118.94 111.29 1fx5 s TRP 232 Ca 0.19 1.97 0.05 0.00 -0.00 0.00 0.00 56.10 58.32 1fx5 s TRP 232 Cb -0.03 0.47 -0.01 0.00 -0.00 0.00 0.00 33.47 33.90 1fx5 s TRP 232 CO 0.10 -0.45 -0.16 -0.47 -0.00 0.00 0.00 176.95 175.97 1fx5 s TYR 233 N 1.12 1.42 -0.14 5.86 5.04 -0.58 -0.19 117.35 129.88 1fx5 s TYR 233 Ca -0.06 -0.28 -0.15 0.00 -2.44 0.00 0.00 57.07 54.14 1fx5 s TYR 233 Cb -0.05 -0.90 0.04 0.00 0.35 0.00 0.00 41.96 41.39 1fx5 s TYR 233 CO -0.11 -0.01 0.41 0.12 -1.34 0.00 0.00 175.55 174.62 1fx5 s PHE 234 N -0.44 -0.43 -0.23 4.97 5.36 -0.86 -2.24 117.98 124.10 1fx5 s PHE 234 Ca 0.06 1.02 -0.12 0.00 -0.96 0.00 0.00 56.93 56.92 1fx5 s PHE 234 Cb -0.06 0.16 0.08 0.00 -0.34 0.00 0.00 43.02 42.85 1fx5 s PHE 234 CO -0.00 -0.25 0.56 -0.08 -1.46 0.00 0.00 175.22 173.99 1fx5 s THR 235 N 0.01 -0.16 0.05 0.12 -1.32 -0.88 -1.66 115.64 111.79 1fx5 s THR 235 Ca -0.02 0.05 0.04 0.00 -1.21 0.00 0.00 61.69 60.55 1fx5 s THR 235 Cb -0.03 -0.83 -0.02 0.00 -1.51 0.00 0.00 72.50 70.11 1fx5 s THR 235 CO 0.01 0.02 -0.12 -0.94 -2.21 0.00 0.00 174.62 171.39 1fx5 s SER 236 N 1.75 1.37 0.03 8.08 1.04 -0.10 -1.70 113.70 124.17 1fx5 s SER 236 Ca -0.09 -0.50 -0.21 0.00 0.48 0.00 0.00 55.95 55.63 1fx5 s SER 236 Cb -0.07 -0.05 0.05 0.00 0.10 0.00 0.00 66.02 66.04 1fx5 s SER 236 CO -0.17 -0.06 0.48 0.28 0.98 0.00 0.00 173.24 174.76 1fx5 s THR 237 N -1.05 0.04 -0.13 2.02 -1.32 -0.84 -1.79 115.64 112.57 1fx5 s THR 237 Ca -0.02 -0.31 0.22 0.00 -1.21 0.00 0.00 61.69 60.37 1fx5 s THR 237 Cb -0.09 -0.94 -0.19 0.00 -1.51 0.00 0.00 72.50 69.78 1fx5 s THR 237 CO 0.01 -0.17 0.73 0.49 -2.21 0.00 0.00 174.62 173.48 1fx5 n PHE 238 N 0.56 0.43 -3.44 9.09 3.72 -1.22 -1.73 117.46 124.88 1fx5 n PHE 238 Ca -0.19 0.13 -0.42 0.00 -0.05 0.00 0.00 57.45 56.92 1fx5 n PHE 238 Cb 0.59 -0.70 -0.02 0.00 -0.94 0.00 0.00 39.48 38.41 1fx5 n PHE 238 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1fx5 s ILE 239 N -3.45 5.47 0.00 4.37 -1.09 -1.26 -4.89 121.20 120.35 1fx5 s ILE 239 Ca -0.05 -3.55 0.00 0.00 -2.23 0.00 0.00 60.65 54.82 1fx5 s ILE 239 Cb 0.12 -4.31 0.00 0.00 -1.58 0.00 0.00 42.46 36.69 1fx5 s ILE 239 CO 0.86 -1.15 0.00 0.59 -1.23 0.00 0.00 174.94 174.01