#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fky n GLY 22 N 0.00 3.21 3.99 5.14 0.00 -1.26 -5.05 105.19 111.22 3fky n GLY 22 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 3fky n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fky s ARG 23 N -0.51 2.53 0.03 1.61 0.52 -1.26 -4.61 118.95 117.26 3fky s ARG 23 Ca 0.00 -1.02 0.06 0.00 -0.52 0.00 0.00 55.73 54.25 3fky s ARG 23 Cb 0.00 -2.57 -0.02 0.00 0.52 0.00 0.00 34.95 32.88 3fky s ARG 23 CO 0.00 -0.66 -0.18 0.42 0.02 0.00 0.00 175.30 174.89 3fky s ILE 24 N -2.67 1.47 -0.16 1.52 -1.09 -0.50 -4.97 121.20 114.81 3fky s ILE 24 Ca 0.58 -1.05 -0.04 0.00 -2.23 0.00 0.00 60.65 57.91 3fky s ILE 24 Cb -0.09 -1.27 -0.03 0.00 -1.58 0.00 0.00 42.46 39.49 3fky s ILE 24 CO 0.37 0.19 -0.03 -0.63 -1.23 0.00 0.00 174.94 173.61 3fky s ILE 25 N -0.73 3.91 -0.21 2.92 1.01 -1.26 -0.02 121.20 126.82 3fky s ILE 25 Ca 0.06 -0.35 -0.01 0.00 0.00 0.00 0.00 60.65 60.34 3fky s ILE 25 Cb -0.08 -2.72 0.01 0.00 0.01 0.00 0.00 42.46 39.68 3fky s ILE 25 CO 0.01 0.49 -0.11 0.00 0.00 0.00 0.00 174.94 175.33 3fky s ALA 26 N 0.39 2.59 -0.29 9.38 0.00 -0.06 -1.26 121.76 132.52 3fky s ALA 26 Ca -0.04 -1.23 -0.19 0.00 0.00 0.00 0.00 51.96 50.51 3fky s ALA 26 Cb -0.14 -1.48 -0.02 0.00 0.00 0.00 0.00 23.12 21.48 3fky s ALA 26 CO 0.03 -0.44 0.57 -2.00 0.00 0.00 0.00 175.76 173.92 3fky s GLU 27 N 1.38 3.97 -0.13 0.00 2.56 -0.37 -1.22 118.70 124.89 3fky s GLU 27 Ca 0.05 0.29 -0.22 0.00 0.00 0.00 0.00 54.97 55.09 3fky s GLU 27 Cb -0.14 -3.70 -0.03 0.00 2.00 0.00 0.00 34.13 32.26 3fky s GLU 27 CO -0.08 -0.47 0.66 0.71 -0.56 0.00 0.00 175.26 175.52 3fky s TYR 28 N 2.45 3.48 -0.09 5.30 1.51 0.61 0.31 117.35 130.93 3fky s TYR 28 Ca 0.23 1.09 0.04 0.00 -1.01 0.00 0.00 57.07 57.42 3fky s TYR 28 Cb -0.15 -2.79 -0.01 0.00 -0.11 0.00 0.00 41.96 38.90 3fky s TYR 28 CO 0.10 -0.02 -0.22 0.08 -1.11 0.00 0.00 175.55 174.38 3fky s VAL 29 N 1.29 2.27 0.29 0.71 1.01 0.69 -2.17 120.40 124.49 3fky s VAL 29 Ca 0.33 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.37 3fky s VAL 29 Cb -0.17 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 3fky s VAL 29 CO 0.14 0.56 0.29 -1.66 0.00 0.00 0.00 175.10 174.43 3fky s TRP 30 N 0.15 1.37 -0.11 5.22 -2.14 -0.22 -0.83 118.94 122.38 3fky s TRP 30 Ca -0.12 -1.45 -0.04 0.00 2.66 0.00 0.00 56.10 57.15 3fky s TRP 30 Cb -0.16 -0.49 -0.04 0.00 -3.10 0.00 0.00 33.47 29.69 3fky s TRP 30 CO 0.07 -0.87 0.04 0.42 -2.66 0.00 0.00 176.95 173.94 3fky s ILE 31 N -3.59 4.62 0.00 0.66 1.01 -1.26 -0.87 121.20 121.76 3fky s ILE 31 Ca 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.90 3fky s ILE 31 Cb 0.03 -2.98 0.00 0.00 0.01 0.00 0.00 42.46 39.52 3fky s ILE 31 CO 0.21 0.58 0.00 -0.90 0.00 0.00 0.00 174.94 174.83 3fky n ASP 32 N 2.37 0.29 -0.41 3.58 5.75 -0.69 -4.92 116.55 122.53 3fky n ASP 32 Ca -0.19 -1.00 0.08 0.00 -0.01 0.00 0.00 54.79 53.68 3fky n ASP 32 Cb 0.54 0.00 0.33 0.00 -1.03 0.00 0.00 41.12 40.95 3fky n ASP 32 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fky n GLY 33 N 5.00 -0.03 0.00 6.12 0.00 -0.46 -4.66 105.19 111.16 3fky n GLY 33 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 3fky n GLY 33 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fky n THR 34 N 0.06 0.00 -1.10 2.61 -2.24 -1.26 -4.90 114.28 107.45 3fky n THR 34 Ca 0.13 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.68 3fky n THR 34 Cb 0.24 -0.27 0.17 0.00 -2.10 0.00 0.00 70.33 68.36 3fky n THR 34 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fky n GLY 35 N 5.00 4.37 3.61 3.38 0.00 -1.26 -4.99 105.19 115.30 3fky n GLY 35 Ca 0.00 -1.04 -0.25 0.00 0.00 0.00 0.00 46.02 44.72 3fky n GLY 35 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3fky s ASN 36 N -1.17 4.02 0.44 1.61 -0.87 -1.26 -4.97 114.94 112.73 3fky s ASN 36 Ca 0.54 -1.11 -0.13 0.00 -1.57 0.00 0.00 52.86 50.59 3fky s ASN 36 Cb 0.45 -0.45 -0.07 0.00 -0.02 0.00 0.00 41.25 41.16 3fky s ASN 36 CO 0.10 -0.28 0.84 -0.76 -2.57 0.00 0.00 177.10 174.43 3fky s LEU 37 N -3.70 3.78 0.10 0.60 2.01 -1.26 -1.70 118.68 118.51 3fky s LEU 37 Ca 0.35 1.28 0.03 0.00 0.01 0.00 0.00 54.13 55.80 3fky s LEU 37 Cb 0.02 -4.18 -0.04 0.00 0.01 0.00 0.00 46.19 42.01 3fky s LEU 37 CO 0.19 -0.45 -0.09 -0.13 1.01 0.00 0.00 176.35 176.87 3fky s ARG 38 N -3.87 0.87 0.05 1.70 1.81 -0.05 -4.88 118.95 114.57 3fky s ARG 38 Ca 0.54 -1.23 -0.25 0.00 -1.72 0.00 0.00 55.73 53.08 3fky s ARG 38 Cb -0.10 -0.47 0.06 0.00 -0.45 0.00 0.00 34.95 33.99 3fky s ARG 38 CO 0.30 0.06 0.58 -1.54 -0.68 0.00 0.00 175.30 174.02 3fky s SER 39 N -2.65 -0.53 0.16 0.23 1.04 -1.26 -1.05 113.70 109.64 3fky s SER 39 Ca 0.08 0.27 -0.04 0.00 0.48 0.00 0.00 55.95 56.74 3fky s SER 39 Cb -0.01 0.53 -0.03 0.00 0.10 0.00 0.00 66.02 66.62 3fky s SER 39 CO -0.01 -0.76 0.17 -1.59 0.98 0.00 0.00 173.24 172.04 3fky s LYS 40 N -2.45 1.10 0.12 4.02 -2.85 -0.92 -4.99 119.74 113.76 3fky s LYS 40 Ca -0.05 -1.39 0.11 0.00 -1.00 0.00 0.00 55.97 53.63 3fky s LYS 40 Cb -0.01 0.30 -0.04 0.00 -2.06 0.00 0.00 37.83 36.03 3fky s LYS 40 CO -0.02 -0.37 -0.27 0.20 0.10 0.00 0.00 175.35 175.00 3fky s GLY 41 N -3.05 1.54 0.01 0.59 0.00 -1.26 -0.29 107.32 104.87 3fky s GLY 41 Ca 0.25 -1.43 0.01 0.00 0.00 0.00 0.00 44.72 43.55 3fky s GLY 41 CO 0.04 -1.40 -0.05 1.09 0.00 0.00 0.00 173.10 172.79 3fky s ARG 42 N -1.92 0.35 0.33 2.90 1.70 -0.36 -4.98 118.95 116.98 3fky s ARG 42 Ca 0.13 -0.36 -0.26 0.00 -0.47 0.00 0.00 55.73 54.77 3fky s ARG 42 Cb -0.10 -0.23 -0.09 0.00 -0.57 0.00 0.00 34.95 33.96 3fky s ARG 42 CO 0.05 0.05 1.02 0.99 -1.08 0.00 0.00 175.30 176.33 3fky s THR 43 N -0.60 3.86 0.13 4.99 2.01 -1.26 -0.89 115.64 123.88 3fky s THR 43 Ca -0.04 1.60 0.09 0.00 0.31 0.00 0.00 61.69 63.65 3fky s THR 43 Cb -0.05 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 3fky s THR 43 CO -0.00 0.18 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.13 3fky s LEU 44 N -2.04 2.35 0.33 4.42 1.43 0.97 -4.92 118.68 121.22 3fky s LEU 44 Ca 0.51 -0.76 0.13 0.00 -1.03 0.00 0.00 54.13 52.98 3fky s LEU 44 Cb -0.24 -0.95 0.58 0.00 0.03 0.00 0.00 46.19 45.62 3fky s LEU 44 CO 0.30 0.06 1.73 0.11 0.23 0.00 0.00 176.35 178.77 3fky h LYS 45 N 3.75 0.00 -3.53 1.70 1.79 -1.93 -1.32 116.57 117.03 3fky h LYS 45 Ca -0.46 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 57.90 3fky h LYS 45 Cb 1.19 0.00 -0.17 0.00 -1.58 0.00 0.00 32.23 31.67 3fky h LYS 45 CO 0.43 0.47 -0.38 0.21 -1.08 0.00 0.00 179.45 179.10 3fky s LYS 46 N -3.85 0.70 0.30 3.15 2.20 -1.26 -4.51 119.74 116.48 3fky s LYS 46 Ca -0.02 -0.61 -0.28 0.00 -0.36 0.00 0.00 55.97 54.70 3fky s LYS 46 Cb 0.13 0.29 -0.13 0.00 -1.51 0.00 0.00 37.83 36.61 3fky s LYS 46 CO 0.73 -0.20 1.10 -2.13 -0.36 0.00 0.00 175.35 174.49 3fky n ARG 47 N 0.69 1.60 -3.48 4.03 0.63 -1.26 -4.79 116.66 114.08 3fky n ARG 47 Ca -0.19 0.56 -0.38 0.00 -0.92 0.00 0.00 57.85 56.93 3fky n ARG 47 Cb 0.59 -2.00 -0.06 0.00 0.45 0.00 0.00 32.46 31.44 3fky n ARG 47 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 3fky s ILE 48 N -1.06 5.10 0.00 5.15 -1.09 -1.26 -4.97 121.20 123.08 3fky s ILE 48 Ca 0.58 0.81 0.00 0.00 -2.23 0.00 0.00 60.65 59.81 3fky s ILE 48 Cb -0.66 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 36.51 3fky s ILE 48 CO 0.61 0.51 0.24 0.35 -1.23 0.00 0.00 174.94 175.41 3fky n THR 49 N 2.38 0.00 -3.51 2.92 -2.24 -1.26 -5.06 114.28 107.52 3fky n THR 49 Ca -0.13 -0.37 -0.17 0.00 -2.27 0.00 0.00 64.05 61.12 3fky n THR 49 Cb 0.52 1.17 -0.05 0.00 -2.10 0.00 0.00 70.33 69.87 3fky n THR 49 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3fky s SER 50 N -0.27 -0.63 0.55 3.42 1.04 -1.26 -5.02 113.70 111.54 3fky s SER 50 Ca 0.00 0.58 0.30 0.00 0.48 0.00 0.00 55.95 57.31 3fky s SER 50 Cb 0.00 0.54 1.46 0.00 0.10 0.00 0.00 66.02 68.12 3fky s SER 50 CO 0.00 -0.65 1.91 0.40 0.98 0.00 0.00 173.24 175.87 3fky h ILE 51 N 2.81 0.52 0.00 -1.02 2.04 -1.97 0.05 117.51 119.94 3fky h ILE 51 Ca -0.28 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 3fky h ILE 51 Cb 1.17 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 37.85 3fky h ILE 51 CO 0.38 0.00 -0.01 0.44 0.00 0.00 0.00 178.15 178.96 3fky h ASP 52 N 0.00 0.00 1.34 1.72 3.32 -1.98 -1.32 116.42 119.50 3fky h ASP 52 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 3fky h ASP 52 Cb 1.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.98 3fky h ASP 52 CO -0.00 0.01 0.00 1.56 -1.72 0.00 0.00 179.24 179.09 3fky h GLN 53 N 0.00 0.00 -5.97 3.56 4.20 -1.40 -3.44 115.11 112.06 3fky h GLN 53 Ca -0.00 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.13 3fky h GLN 53 Cb 0.03 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.74 3fky h GLN 53 CO 0.00 0.00 0.45 -0.51 -0.67 0.00 0.00 178.83 178.10 3fky s LEU 54 N -4.69 4.17 0.51 1.46 1.43 -0.50 -5.03 118.68 116.03 3fky s LEU 54 Ca 0.09 1.21 -0.20 0.00 -1.03 0.00 0.00 54.13 54.20 3fky s LEU 54 Cb 0.11 -3.29 -0.07 0.00 0.03 0.00 0.00 46.19 42.97 3fky s LEU 54 CO 0.56 -0.44 1.12 -2.16 0.23 0.00 0.00 176.35 175.66 3fky s PRO 55 N 2.30 3.53 1.15 1.29 0.04 -1.26 -4.82 135.00 137.23 3fky s PRO 55 Ca 0.39 1.62 -0.13 0.00 0.04 0.00 0.00 61.00 62.92 3fky s PRO 55 Cb -0.16 -2.12 0.28 0.00 0.04 0.00 0.00 34.50 32.53 3fky s PRO 55 CO 0.12 -0.71 1.04 -1.21 0.04 0.00 0.00 177.00 176.27 3fky s GLU 56 N -3.12 -0.85 0.25 4.56 2.02 -1.26 -4.67 118.70 115.63 3fky s GLU 56 Ca 0.70 0.91 -0.09 0.00 0.02 0.00 0.00 54.97 56.51 3fky s GLU 56 Cb -0.24 -1.56 0.04 0.00 0.10 0.00 0.00 34.13 32.47 3fky s GLU 56 CO 0.28 -3.70 0.49 1.87 0.02 0.00 0.00 175.26 174.22 3fky n TRP 57 N -4.91 -1.82 -3.85 1.61 -0.00 -0.61 -4.95 117.44 102.91 3fky n TRP 57 Ca 0.04 -1.18 -0.08 0.00 -0.00 0.00 0.00 57.50 56.28 3fky n TRP 57 Cb 0.54 0.57 -0.01 0.00 -0.00 0.00 0.00 31.31 32.41 3fky n TRP 57 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 3fky s ASN 58 N -2.30 -0.17 0.34 5.87 4.22 -1.26 0.27 114.94 121.91 3fky s ASN 58 Ca 0.10 -0.78 -0.15 0.00 -2.14 0.00 0.00 52.86 49.89 3fky s ASN 58 Cb -0.03 0.76 0.03 0.00 1.28 0.00 0.00 41.25 43.30 3fky s ASN 58 CO 0.08 -1.45 0.70 0.72 -2.04 0.00 0.00 177.10 175.11 3fky s PHE 59 N -3.44 0.20 -0.78 1.54 -0.12 -0.35 -4.93 117.98 110.10 3fky s PHE 59 Ca 0.13 -0.73 -0.23 0.00 -0.05 0.00 0.00 56.93 56.05 3fky s PHE 59 Cb -0.06 0.61 0.07 0.00 -0.63 0.00 0.00 43.02 43.02 3fky s PHE 59 CO 0.08 -1.37 1.13 0.34 -0.05 0.00 0.00 175.22 175.36 3fky s ASP 60 N -3.05 6.30 0.48 1.98 -1.08 -1.26 -1.68 116.67 118.35 3fky s ASP 60 Ca 0.17 -1.12 0.32 0.00 -0.52 0.00 0.00 52.55 51.41 3fky s ASP 60 Cb -0.04 -2.47 1.74 0.00 -1.46 0.00 0.00 42.92 40.69 3fky s ASP 60 CO 0.11 -1.48 1.99 1.23 0.52 0.00 0.00 175.17 177.55 3fky h GLY 61 N 11.78 0.00 2.00 2.66 0.00 -1.88 -0.88 103.07 116.74 3fky h GLY 61 Ca -0.14 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 3fky h GLY 61 CO 1.23 0.00 -0.03 1.48 0.00 0.00 0.00 176.54 179.21 3fky h SER 62 N 0.00 0.00 0.17 0.19 4.64 -1.90 0.12 113.55 116.77 3fky h SER 62 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fky h SER 62 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3fky h SER 62 CO 0.00 0.03 -0.12 -1.20 -0.87 0.00 0.00 176.83 174.67 3fky n SER 63 N -3.11 1.00 -0.10 4.97 7.64 -0.34 -3.90 113.62 119.78 3fky n SER 63 Ca 0.04 -1.03 0.02 0.00 1.01 0.00 0.00 58.87 58.90 3fky n SER 63 Cb 0.52 0.04 0.03 0.00 -1.01 0.00 0.00 64.21 63.78 3fky n SER 63 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3fky n THR 64 N -0.46 0.71 -3.22 0.44 -2.24 -1.12 -5.03 114.28 103.35 3fky n THR 64 Ca 0.16 -0.78 -0.15 0.00 -2.27 0.00 0.00 64.05 61.01 3fky n THR 64 Cb 0.32 0.51 0.08 0.00 -2.10 0.00 0.00 70.33 69.13 3fky n THR 64 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3fky n ASN 65 N -0.45 -2.13 0.00 3.42 2.85 -0.97 -1.36 115.26 116.62 3fky n ASN 65 Ca 0.03 -0.53 0.00 0.00 -0.11 0.00 0.00 54.58 53.97 3fky n ASN 65 Cb 0.47 -4.47 0.00 0.00 1.24 0.00 0.00 39.78 37.03 3fky n ASN 65 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3fky n GLN 66 N -3.66 2.68 -4.10 1.20 6.02 0.36 -3.77 117.38 116.10 3fky n GLN 66 Ca -0.24 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.64 3fky n GLN 66 Cb 0.64 -0.29 -0.09 0.00 1.02 0.00 0.00 30.24 31.52 3fky n GLN 66 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3fky s ALA 67 N -0.34 0.61 -0.21 -1.58 0.00 -0.74 -4.79 121.76 114.71 3fky s ALA 67 Ca 0.00 -1.33 0.22 0.00 0.00 0.00 0.00 51.96 50.85 3fky s ALA 67 Cb 0.00 1.08 -0.13 0.00 0.00 0.00 0.00 23.12 24.07 3fky s ALA 67 CO 0.00 -0.62 0.81 -2.30 0.00 0.00 0.00 175.76 173.66 3fky n PRO 68 N -0.23 0.58 0.00 0.00 -0.02 -1.26 -4.05 135.00 130.02 3fky n PRO 68 Ca -0.03 -0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 3fky n PRO 68 Cb 0.64 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 3fky n PRO 68 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fky n GLY 69 N 1.24 1.87 2.23 -1.23 0.00 -1.26 -5.00 105.19 103.04 3fky n GLY 69 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 3fky n GLY 69 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3fky n HIS 70 N -0.67 -0.46 0.00 1.61 -0.00 -1.26 -5.14 115.22 109.30 3fky n HIS 70 Ca 0.00 -0.58 0.00 0.00 -0.00 0.00 0.00 57.72 57.14 3fky n HIS 70 Cb 0.00 1.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.99 3fky n HIS 70 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 3fky n ASP 73 N -0.42 0.00 -4.66 4.39 2.03 -1.26 -5.08 116.55 111.54 3fky n ASP 73 Ca -0.16 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 54.89 3fky n ASP 73 Cb 0.62 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.94 3fky n ASP 73 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3fky s ILE 74 N 0.00 3.73 0.05 5.18 1.09 -0.68 -4.48 121.20 126.09 3fky s ILE 74 Ca 0.00 -1.43 0.03 0.00 -1.10 0.00 0.00 60.65 58.15 3fky s ILE 74 Cb 0.00 -2.88 -0.04 0.00 -1.06 0.00 0.00 42.46 38.49 3fky s ILE 74 CO 0.00 -0.11 0.05 -0.31 -0.10 0.00 0.00 174.94 174.47 3fky s TYR 75 N -1.74 3.15 -0.28 3.97 1.51 -0.17 -1.21 117.35 122.58 3fky s TYR 75 Ca 0.28 0.08 -0.02 0.00 -1.01 0.00 0.00 57.07 56.39 3fky s TYR 75 Cb -0.09 -1.63 0.04 0.00 -0.11 0.00 0.00 41.96 40.16 3fky s TYR 75 CO 0.19 0.51 -0.02 -0.51 -1.11 0.00 0.00 175.55 174.61 3fky s LEU 76 N -2.13 3.61 -0.40 -1.29 1.43 0.78 -1.35 118.68 119.32 3fky s LEU 76 Ca 0.26 -1.06 -0.14 0.00 -1.03 0.00 0.00 54.13 52.15 3fky s LEU 76 Cb -0.12 -1.71 0.02 0.00 0.03 0.00 0.00 46.19 44.41 3fky s LEU 76 CO 0.18 -0.20 0.28 -0.54 0.23 0.00 0.00 176.35 176.30 3fky s LYS 77 N 1.30 3.01 0.21 1.70 1.02 -0.15 -1.57 119.74 125.27 3fky s LYS 77 Ca -0.02 -0.98 -0.32 0.00 0.02 0.00 0.00 55.97 54.66 3fky s LYS 77 Cb -0.18 -3.93 -0.14 0.00 -0.52 0.00 0.00 37.83 33.06 3fky s LYS 77 CO -0.02 -0.71 1.30 -2.30 -0.92 0.00 0.00 175.35 172.70 3fky n PRO 78 N 5.13 1.67 0.00 -1.68 -0.02 -1.26 -0.92 135.00 137.93 3fky n PRO 78 Ca -0.11 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 3fky n PRO 78 Cb 0.47 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 3fky n PRO 78 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3fky n VAL 79 N 1.70 0.00 -3.74 -1.45 0.31 0.43 -4.85 118.33 110.73 3fky n VAL 79 Ca 0.13 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.35 3fky n VAL 79 Cb 0.29 -0.43 -0.07 0.00 -0.91 0.00 0.00 33.84 32.72 3fky n VAL 79 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3fky s ALA 80 N -1.73 -0.68 0.02 3.52 0.00 -1.07 -5.01 121.76 116.80 3fky s ALA 80 Ca 0.00 -0.07 -0.10 0.00 0.00 0.00 0.00 51.96 51.79 3fky s ALA 80 Cb 0.00 0.41 0.01 0.00 0.00 0.00 0.00 23.12 23.53 3fky s ALA 80 CO 0.00 -0.47 0.20 1.52 0.00 0.00 0.00 175.76 177.01 3fky s TYR 81 N -2.94 0.01 0.12 0.00 1.13 -1.26 -0.46 117.35 113.95 3fky s TYR 81 Ca -0.02 -0.15 -0.09 0.00 -1.41 0.00 0.00 57.07 55.39 3fky s TYR 81 Cb 0.00 -0.01 -0.00 0.00 -1.10 0.00 0.00 41.96 40.85 3fky s TYR 81 CO -0.06 -0.39 0.24 0.71 -2.51 0.00 0.00 175.55 173.55 3fky s TYR 82 N -2.08 0.22 0.33 -3.49 2.02 -0.11 -4.97 117.35 109.27 3fky s TYR 82 Ca -0.09 -0.62 -0.29 0.00 -0.37 0.00 0.00 57.07 55.70 3fky s TYR 82 Cb -0.03 -0.03 -0.11 0.00 -0.40 0.00 0.00 41.96 41.38 3fky s TYR 82 CO -0.01 -0.63 1.48 -2.14 -1.57 0.00 0.00 175.55 172.68 3fky s PRO 83 N -3.90 4.17 -0.45 -1.71 0.02 -1.26 0.60 135.00 132.48 3fky s PRO 83 Ca 0.10 2.48 -0.29 0.00 0.02 0.00 0.00 61.00 63.31 3fky s PRO 83 Cb 0.04 -3.02 0.03 0.00 0.02 0.00 0.00 34.50 31.57 3fky s PRO 83 CO -0.07 -0.49 1.13 0.34 -0.33 0.00 0.00 177.00 177.58 3fky s ASP 84 N 0.02 6.69 0.53 2.53 -1.08 -0.67 -4.36 116.67 120.34 3fky s ASP 84 Ca 0.56 0.58 0.34 0.00 -0.52 0.00 0.00 52.55 53.51 3fky s ASP 84 Cb -0.45 -2.55 1.50 0.00 -1.46 0.00 0.00 42.92 39.96 3fky s ASP 84 CO 0.55 -1.18 2.01 -0.65 0.52 0.00 0.00 175.17 176.42 3fky h PRO 85 N 9.00 0.00 0.00 4.34 0.11 -1.90 0.38 132.00 143.93 3fky h PRO 85 Ca -0.22 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.81 3fky h PRO 85 Cb 1.06 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3fky h PRO 85 CO 1.11 0.00 -0.78 1.19 -0.21 0.00 0.00 178.00 179.31 3fky n PHE 86 N -2.96 0.90 0.24 0.65 3.72 -1.26 -4.34 117.46 114.42 3fky n PHE 86 Ca 0.00 0.39 0.13 0.00 -0.05 0.00 0.00 57.45 57.92 3fky n PHE 86 Cb 0.25 -0.86 0.51 0.00 -0.94 0.00 0.00 39.48 38.44 3fky n PHE 86 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fky h ARG 87 N -1.00 0.00 0.00 -1.08 3.08 -1.93 -3.48 114.38 109.96 3fky h ARG 87 Ca -0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.94 3fky h ARG 87 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.81 3fky h ARG 87 CO -0.07 0.11 0.00 0.54 -1.07 0.00 0.00 179.97 179.49 3fky n ARG 88 N -3.23 0.00 0.00 0.04 1.74 0.13 -4.83 116.66 110.52 3fky n ARG 88 Ca 0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 3fky n ARG 88 Cb 0.40 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.84 3fky n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fky n GLY 89 N 0.00 1.08 0.96 -0.13 0.00 -1.26 -2.30 105.19 103.53 3fky n GLY 89 Ca 0.00 -0.66 0.05 0.00 0.00 0.00 0.00 46.02 45.42 3fky n GLY 89 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fky n ASP 90 N -1.56 2.75 -4.80 1.61 8.00 -1.26 -4.82 116.55 116.46 3fky n ASP 90 Ca 0.00 -2.21 -0.34 0.00 0.71 0.00 0.00 54.79 52.95 3fky n ASP 90 Cb 0.00 -0.41 -0.03 0.00 -0.02 0.00 0.00 41.12 40.67 3fky n ASP 90 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3fky s ASN 91 N -0.76 6.25 0.04 -2.24 0.01 -0.98 -4.74 114.94 112.52 3fky s ASN 91 Ca 0.28 1.88 0.01 0.00 -0.71 0.00 0.00 52.86 54.32 3fky s ASN 91 Cb 0.18 -2.55 -0.03 0.00 0.41 0.00 0.00 41.25 39.26 3fky s ASN 91 CO 0.14 -0.85 -0.05 -0.51 -1.51 0.00 0.00 177.10 174.33 3fky s ILE 92 N -2.12 0.29 -0.15 0.60 2.07 -0.39 -1.67 121.20 119.82 3fky s ILE 92 Ca 0.66 -1.21 -0.04 0.00 -1.41 0.00 0.00 60.65 58.66 3fky s ILE 92 Cb -0.16 -0.70 -0.03 0.00 0.13 0.00 0.00 42.46 41.70 3fky s ILE 92 CO 0.24 -0.59 -0.04 -0.69 -1.91 0.00 0.00 174.94 171.95 3fky s VAL 93 N -2.08 3.88 -0.25 4.00 1.01 0.20 -1.23 120.40 125.93 3fky s VAL 93 Ca -0.08 -0.36 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 3fky s VAL 93 Cb -0.05 -2.70 0.03 0.00 0.00 0.00 0.00 36.38 33.66 3fky s VAL 93 CO -0.03 0.49 -0.06 -0.69 0.00 0.00 0.00 175.10 174.82 3fky s VAL 94 N 0.36 2.85 -0.27 2.92 1.01 0.15 -0.94 120.40 126.48 3fky s VAL 94 Ca -0.04 -1.08 -0.29 0.00 0.00 0.00 0.00 61.98 60.57 3fky s VAL 94 Cb -0.14 -2.47 0.01 0.00 0.00 0.00 0.00 36.38 33.78 3fky s VAL 94 CO 0.03 0.16 1.05 -0.22 0.00 0.00 0.00 175.10 176.12 3fky s LEU 95 N 1.31 4.02 0.01 3.92 2.96 0.39 -0.22 118.68 131.07 3fky s LEU 95 Ca -0.01 1.21 0.06 0.00 -0.22 0.00 0.00 54.13 55.17 3fky s LEU 95 Cb -0.17 -3.52 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 3fky s LEU 95 CO -0.04 -0.76 -0.17 0.00 -1.32 0.00 0.00 176.35 174.06 3fky s ALA 96 N 3.39 2.62 0.11 5.97 0.00 -0.01 -0.43 121.76 133.40 3fky s ALA 96 Ca 0.44 -1.11 -0.05 0.00 0.00 0.00 0.00 51.96 51.23 3fky s ALA 96 Cb -0.14 -0.82 -0.05 0.00 0.00 0.00 0.00 23.12 22.11 3fky s ALA 96 CO 0.10 0.57 0.35 0.00 0.00 0.00 0.00 175.76 176.79 3fky s ALA 97 N -0.85 3.80 -0.28 0.00 0.00 -0.09 -4.46 121.76 119.87 3fky s ALA 97 Ca 0.14 -0.55 -0.15 0.00 0.00 0.00 0.00 51.96 51.39 3fky s ALA 97 Cb -0.11 -2.12 -0.03 0.00 0.00 0.00 0.00 23.12 20.86 3fky s ALA 97 CO 0.04 0.66 0.37 0.00 0.00 0.00 0.00 175.76 176.83 3fky s TYR 99 N 2.07 2.52 1.06 0.00 2.02 -0.46 -1.28 117.35 123.28 3fky s TYR 99 Ca 0.15 -0.69 -0.13 0.00 -0.37 0.00 0.00 57.07 56.03 3fky s TYR 99 Cb -0.16 -1.64 0.22 0.00 -0.40 0.00 0.00 41.96 39.99 3fky s TYR 99 CO 0.10 -0.19 1.07 -0.80 -1.57 0.00 0.00 175.55 174.16 3fky s ASN 100 N -0.12 2.02 0.23 2.29 0.01 0.12 -1.00 114.94 118.49 3fky s ASN 100 Ca -0.04 1.31 0.20 0.00 -0.71 0.00 0.00 52.86 53.62 3fky s ASN 100 Cb -0.14 -2.02 0.92 0.00 0.41 0.00 0.00 41.25 40.42 3fky s ASN 100 CO 0.04 -3.53 1.60 -0.46 -1.51 0.00 0.00 177.10 173.24 3fky n ASN 101 N -4.45 0.50 -0.02 -1.22 6.94 -1.26 -1.35 115.26 114.39 3fky n ASN 101 Ca 0.04 0.67 0.02 0.00 -0.02 0.00 0.00 54.58 55.29 3fky n ASN 101 Cb 0.56 -0.76 0.34 0.00 -2.36 0.00 0.00 39.78 37.56 3fky n ASN 101 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 3fky h ASP 102 N 0.00 0.53 0.00 0.53 3.32 -1.98 -3.46 116.42 115.37 3fky h ASP 102 Ca 0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 3fky h ASP 102 Cb 0.18 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3fky h ASP 102 CO 0.00 0.48 0.00 0.61 -1.72 0.00 0.00 179.24 178.61 3fky n GLY 103 N -1.17 1.29 3.78 2.75 0.00 -0.46 -5.09 105.19 106.29 3fky n GLY 103 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 3fky n GLY 103 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fky s THR 104 N -2.20 3.60 0.02 2.61 -4.23 -1.26 -4.79 115.64 109.39 3fky s THR 104 Ca 0.00 1.25 -0.30 0.00 -1.18 0.00 0.00 61.69 61.46 3fky s THR 104 Cb 0.00 -3.66 -0.07 0.00 1.34 0.00 0.00 72.50 70.12 3fky s THR 104 CO 0.00 0.03 1.55 -2.84 -0.54 0.00 0.00 174.62 172.82 3fky s PRO 105 N -2.45 4.23 0.88 3.99 0.02 -1.26 0.11 135.00 140.51 3fky s PRO 105 Ca 0.58 2.15 -0.16 0.00 0.02 0.00 0.00 61.00 63.59 3fky s PRO 105 Cb -0.24 -3.66 -0.10 0.00 0.02 0.00 0.00 34.50 30.52 3fky s PRO 105 CO 0.30 -0.69 -0.33 -1.71 -0.33 0.00 0.00 177.00 174.23 3fky n ASN 106 N 5.80 -4.42 -0.34 2.53 5.15 -0.40 -4.68 115.26 118.91 3fky n ASN 106 Ca 0.15 0.33 0.22 0.00 -0.60 0.00 0.00 54.58 54.68 3fky n ASN 106 Cb 0.42 -0.91 0.42 0.00 -0.53 0.00 0.00 39.78 39.18 3fky n ASN 106 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 3fky h LYS 107 N -0.88 0.00 -0.59 1.20 1.57 -1.90 -0.31 116.57 115.66 3fky h LYS 107 Ca -0.44 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3fky h LYS 107 Cb 1.33 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.64 3fky h LYS 107 CO 0.30 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.37 3fky n PHE 108 N -5.40 1.10 -3.08 -1.35 3.72 -1.26 -4.51 117.46 106.68 3fky n PHE 108 Ca 0.29 -0.58 -0.44 0.00 -0.05 0.00 0.00 57.45 56.68 3fky n PHE 108 Cb 0.98 -0.14 -0.05 0.00 -0.94 0.00 0.00 39.48 39.33 3fky n PHE 108 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3fky s ASN 109 N -1.03 6.23 0.00 4.37 3.84 -0.13 -4.83 114.94 123.38 3fky s ASN 109 Ca 0.45 -0.95 0.13 0.00 0.21 0.00 0.00 52.86 52.69 3fky s ASN 109 Cb 0.27 -2.32 0.27 0.00 -0.55 0.00 0.00 41.25 38.91 3fky s ASN 109 CO 0.24 -1.03 1.16 1.41 -2.79 0.00 0.00 177.10 176.09 3fky n HIS 110 N 6.52 0.35 -0.11 0.43 8.25 -1.26 -4.46 115.22 124.93 3fky n HIS 110 Ca -0.06 -0.33 -0.13 0.00 -0.26 0.00 0.00 57.72 56.94 3fky n HIS 110 Cb 0.45 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.52 3fky n HIS 110 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 3fky h ARG 111 N 2.40 0.92 0.20 -0.41 2.43 -1.93 -2.94 114.38 115.05 3fky h ARG 111 Ca 0.00 -0.50 -0.01 0.00 -0.81 0.00 0.00 59.98 58.66 3fky h ARG 111 Cb 0.69 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 3fky h ARG 111 CO 0.00 1.15 -0.10 1.25 -1.51 0.00 0.00 179.97 180.76 3fky h HIS 112 N 0.73 -0.25 -0.19 2.20 2.76 -2.00 -0.59 115.15 117.82 3fky h HIS 112 Ca 0.05 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.27 3fky h HIS 112 Cb 1.00 0.08 -0.06 0.00 1.55 0.00 0.00 27.41 29.98 3fky h HIS 112 CO 0.07 -0.01 -0.22 1.49 -1.30 0.00 0.00 177.93 177.96 3fky h GLU 113 N -0.46 -0.24 -0.52 5.26 4.57 -1.82 -2.00 114.58 119.36 3fky h GLU 113 Ca -0.03 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.23 3fky h GLU 113 Cb 0.35 0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.95 3fky h GLU 113 CO 0.05 -0.16 0.22 0.00 -1.18 0.00 0.00 179.01 177.94 3fky h ALA 114 N 0.78 0.65 -0.76 2.92 0.00 -1.45 -2.32 119.26 119.07 3fky h ALA 114 Ca 0.12 0.05 0.18 0.00 0.00 0.00 0.00 54.91 55.25 3fky h ALA 114 Cb 0.43 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.08 3fky h ALA 114 CO -0.33 -0.15 0.11 0.00 0.00 0.00 0.00 179.25 178.88 3fky h ALA 115 N 1.32 0.93 -0.46 0.00 0.00 -0.37 0.19 119.26 120.86 3fky h ALA 115 Ca 0.24 0.21 0.09 0.00 0.00 0.00 0.00 54.91 55.45 3fky h ALA 115 Cb 0.21 0.32 -0.10 0.00 0.00 0.00 0.00 17.79 18.23 3fky h ALA 115 CO -0.21 -0.40 -0.31 0.87 0.00 0.00 0.00 179.25 179.20 3fky h LYS 116 N 0.18 -0.20 -0.66 0.00 1.57 -0.98 0.17 116.57 116.65 3fky h LYS 116 Ca 0.43 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.22 3fky h LYS 116 Cb 0.78 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.10 3fky h LYS 116 CO -0.60 -0.13 0.38 -0.07 -0.57 0.00 0.00 179.45 178.46 3fky h LEU 117 N -0.21 0.82 -1.01 2.94 3.38 -1.03 -0.45 115.31 119.75 3fky h LEU 117 Ca 0.20 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3fky h LEU 117 Cb 0.53 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 3fky h LEU 117 CO -0.58 0.66 -0.06 -0.26 0.09 0.00 0.00 178.44 178.29 3fky h PHE 118 N 0.90 0.69 -0.36 1.13 0.04 -0.38 -1.37 116.94 117.60 3fky h PHE 118 Ca 0.24 -0.10 -0.14 0.00 2.80 0.00 0.00 57.97 60.77 3fky h PHE 118 Cb 0.01 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 37.97 3fky h PHE 118 CO -0.01 0.69 -0.32 0.00 -0.60 0.00 0.00 178.31 178.07 3fky h ALA 119 N 1.33 0.52 0.14 2.45 0.00 -0.28 -1.68 119.26 121.74 3fky h ALA 119 Ca 0.11 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3fky h ALA 119 Cb 0.47 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3fky h ALA 119 CO 0.02 0.57 -0.14 0.00 0.00 0.00 0.00 179.25 179.71 3fky h ALA 120 N 0.76 -0.27 -0.73 0.00 0.00 -0.80 -2.93 119.26 115.29 3fky h ALA 120 Ca 0.06 -0.04 -0.37 0.00 0.00 0.00 0.00 54.91 54.57 3fky h ALA 120 Cb 0.90 0.20 -0.22 0.00 0.00 0.00 0.00 17.79 18.67 3fky h ALA 120 CO 0.08 -0.67 0.46 0.72 0.00 0.00 0.00 179.25 179.84 3fky n HIS 121 N -5.26 2.25 -0.31 0.00 8.25 -0.54 -4.51 115.22 115.09 3fky n HIS 121 Ca -0.08 -1.45 0.20 0.00 -0.26 0.00 0.00 57.72 56.13 3fky n HIS 121 Cb 0.18 -0.75 0.38 0.00 1.12 0.00 0.00 29.99 30.92 3fky n HIS 121 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3fky n LYS 122 N -0.66 -0.07 0.02 -0.41 5.02 -0.64 -0.88 118.16 120.54 3fky n LYS 122 Ca 0.43 1.35 0.02 0.00 -2.02 0.00 0.00 58.31 58.09 3fky n LYS 122 Cb 1.35 -2.25 0.36 0.00 -0.02 0.00 0.00 35.03 34.48 3fky n LYS 122 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3fky h ASP 123 N 0.00 0.44 0.90 4.39 3.32 -1.87 -2.03 116.42 121.56 3fky h ASP 123 Ca 0.65 -0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.59 3fky h ASP 123 Cb 1.52 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.95 3fky h ASP 123 CO -0.81 0.45 -0.28 -0.33 -1.72 0.00 0.00 179.24 176.54 3fky h GLU 124 N 0.48 0.00 -5.86 3.56 3.07 -1.38 -3.47 114.58 110.98 3fky h GLU 124 Ca 0.11 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.72 3fky h GLU 124 Cb 0.19 0.00 0.07 0.00 -0.84 0.00 0.00 28.75 28.16 3fky h GLU 124 CO -0.00 0.28 -0.63 0.39 -1.40 0.00 0.00 179.01 177.66 3fky n GLU 125 N -3.45 -1.50 -2.08 2.33 1.02 -0.77 -0.70 120.64 115.49 3fky n GLU 125 Ca -0.00 0.94 -0.41 0.00 -0.02 0.00 0.00 57.16 57.68 3fky n GLU 125 Cb 0.46 -4.73 -0.02 0.00 -0.02 0.00 0.00 31.44 27.13 3fky n GLU 125 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3fky s ILE 126 N -3.21 2.66 -0.03 -3.67 1.01 -1.26 -3.81 121.20 112.88 3fky s ILE 126 Ca 0.23 0.66 0.07 0.00 0.00 0.00 0.00 60.65 61.61 3fky s ILE 126 Cb -0.06 -3.42 -0.02 0.00 0.01 0.00 0.00 42.46 38.97 3fky s ILE 126 CO 0.81 0.15 -0.24 0.26 0.00 0.00 0.00 174.94 175.92 3fky s TRP 127 N -1.05 2.40 0.16 3.97 0.52 0.98 -3.18 118.94 122.75 3fky s TRP 127 Ca 0.50 -0.42 0.10 0.00 0.02 0.00 0.00 56.10 56.30 3fky s TRP 127 Cb -0.40 -1.53 -0.04 0.00 -1.15 0.00 0.00 33.47 30.34 3fky s TRP 127 CO 0.53 -0.02 -0.21 -0.06 0.02 0.00 0.00 176.95 177.21 3fky s PHE 128 N -0.59 2.00 -0.14 -1.98 0.08 -0.50 -1.89 117.98 114.97 3fky s PHE 128 Ca 0.09 -0.42 -0.04 0.00 0.12 0.00 0.00 56.93 56.68 3fky s PHE 128 Cb -0.10 -1.02 0.07 0.00 -0.57 0.00 0.00 43.02 41.39 3fky s PHE 128 CO -0.00 0.36 0.17 0.20 -0.10 0.00 0.00 175.22 175.85 3fky s GLY 129 N -2.47 0.08 -0.06 4.36 0.00 -0.42 -0.86 107.32 107.94 3fky s GLY 129 Ca 0.15 0.32 -0.05 0.00 0.00 0.00 0.00 44.72 45.15 3fky s GLY 129 CO 0.07 1.86 0.16 1.08 0.00 0.00 0.00 173.10 176.27 3fky s LEU 130 N 2.28 4.37 -0.56 0.66 1.43 -0.22 -0.41 118.68 126.23 3fky s LEU 130 Ca 0.04 0.41 -0.04 0.00 -1.03 0.00 0.00 54.13 53.50 3fky s LEU 130 Cb -0.14 -2.34 0.15 0.00 0.03 0.00 0.00 46.19 43.88 3fky s LEU 130 CO -0.09 0.34 0.39 -1.61 0.23 0.00 0.00 176.35 175.61 3fky s GLU 131 N -1.49 2.47 -0.43 1.70 2.02 -0.55 -1.39 118.70 121.03 3fky s GLU 131 Ca 0.21 -2.23 -0.26 0.00 0.02 0.00 0.00 54.97 52.71 3fky s GLU 131 Cb -0.12 -3.77 0.02 0.00 0.10 0.00 0.00 34.13 30.36 3fky s GLU 131 CO 0.11 -1.16 0.94 -1.14 0.02 0.00 0.00 175.26 174.04 3fky s GLN 132 N 0.47 3.65 -0.04 1.61 2.00 0.39 -3.17 119.66 124.57 3fky s GLN 132 Ca 0.13 0.33 -0.06 0.00 -2.00 0.00 0.00 55.36 53.76 3fky s GLN 132 Cb -0.21 -3.88 -0.04 0.00 0.80 0.00 0.00 33.01 29.67 3fky s GLN 132 CO -0.04 -1.14 0.21 -1.21 -0.50 0.00 0.00 175.29 172.61 3fky s GLU 133 N 3.71 3.51 0.19 1.67 2.02 -0.85 -0.91 118.70 128.03 3fky s GLU 133 Ca 0.38 -0.14 -0.08 0.00 0.02 0.00 0.00 54.97 55.15 3fky s GLU 133 Cb -0.10 -3.13 -0.02 0.00 0.10 0.00 0.00 34.13 30.98 3fky s GLU 133 CO 0.24 0.70 0.29 1.52 0.02 0.00 0.00 175.26 178.03 3fky s TYR 134 N -1.21 0.55 -0.01 1.61 -0.85 0.02 -4.65 117.35 112.81 3fky s TYR 134 Ca 0.23 -0.89 0.03 0.00 -0.52 0.00 0.00 57.07 55.92 3fky s TYR 134 Cb -0.13 -0.11 -0.01 0.00 0.38 0.00 0.00 41.96 42.09 3fky s TYR 134 CO 0.13 -0.76 -0.10 0.99 -1.52 0.00 0.00 175.55 174.29 3fky s THR 135 N -4.02 0.81 0.25 -3.49 2.01 -0.73 -0.88 115.64 109.60 3fky s THR 135 Ca 0.23 -0.43 -0.10 0.00 0.31 0.00 0.00 61.69 61.70 3fky s THR 135 Cb 0.03 -0.68 -0.07 0.00 0.01 0.00 0.00 72.50 71.79 3fky s THR 135 CO 0.04 0.23 0.57 -0.76 -0.69 0.00 0.00 174.62 174.02 3fky s LEU 136 N -0.20 4.13 -0.01 4.42 1.43 -0.12 -1.21 118.68 127.12 3fky s LEU 136 Ca 0.03 0.93 -0.06 0.00 -1.03 0.00 0.00 54.13 54.01 3fky s LEU 136 Cb -0.04 -3.71 0.00 0.00 0.03 0.00 0.00 46.19 42.47 3fky s LEU 136 CO -0.00 -0.11 0.13 -0.36 0.23 0.00 0.00 176.35 176.24 3fky s PHE 137 N -1.88 -0.00 0.98 0.29 0.08 -0.54 -1.68 117.98 115.23 3fky s PHE 137 Ca 0.48 -0.00 -0.14 0.00 0.12 0.00 0.00 56.93 57.39 3fky s PHE 137 Cb -0.11 -0.03 0.04 0.00 -0.57 0.00 0.00 43.02 42.36 3fky s PHE 137 CO 0.22 -0.22 0.32 -0.25 -0.10 0.00 0.00 175.22 175.20 3fky n ASP 138 N 1.92 -2.21 0.26 1.36 9.92 0.26 -1.32 116.55 126.74 3fky n ASP 138 Ca -0.20 0.26 0.17 0.00 -0.53 0.00 0.00 54.79 54.49 3fky n ASP 138 Cb 0.56 -1.16 0.90 0.00 -0.64 0.00 0.00 41.12 40.79 3fky n ASP 138 CO 0.00 0.00 0.00 0.24 0.13 0.00 0.00 177.20 177.57 3fky h MET 139 N -1.63 0.00 -0.53 -1.24 2.86 -1.89 -2.13 114.93 110.38 3fky h MET 139 Ca -0.45 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.19 3fky h MET 139 Cb 1.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.95 3fky h MET 139 CO 0.35 0.00 0.00 0.66 1.06 0.00 0.00 176.91 178.98 3fky n TYR 140 N -2.71 1.24 -2.53 -0.22 4.01 -1.26 -4.94 117.16 110.75 3fky n TYR 140 Ca -0.02 -0.65 -0.17 0.00 -0.16 0.00 0.00 57.90 56.90 3fky n TYR 140 Cb 0.08 -0.23 0.01 0.00 -0.31 0.00 0.00 39.34 38.88 3fky n TYR 140 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3fky n ASP 141 N 0.71 -5.06 -4.63 7.72 8.00 -0.80 -5.00 116.55 117.49 3fky n ASP 141 Ca 0.23 -0.10 -0.28 0.00 0.71 0.00 0.00 54.79 55.34 3fky n ASP 141 Cb 0.83 -4.06 -0.09 0.00 -0.02 0.00 0.00 41.12 37.78 3fky n ASP 141 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3fky s ASP 142 N -2.45 4.65 0.17 -2.24 1.01 -1.26 -4.86 116.67 111.68 3fky s ASP 142 Ca 0.09 -0.36 -0.34 0.00 0.71 0.00 0.00 52.55 52.66 3fky s ASP 142 Cb -0.04 -0.97 -0.14 0.00 1.01 0.00 0.00 42.92 42.78 3fky s ASP 142 CO 0.12 0.14 1.47 0.52 0.21 0.00 0.00 175.17 177.63 3fky n VAL 143 N 0.34 0.28 -1.73 -1.27 0.31 -1.26 0.93 118.33 115.93 3fky n VAL 143 Ca -0.11 -0.07 -0.42 0.00 -0.01 0.00 0.00 64.34 63.72 3fky n VAL 143 Cb 0.53 -1.37 -0.03 0.00 -0.91 0.00 0.00 33.84 32.07 3fky n VAL 143 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 3fky s TYR 144 N 0.54 1.40 0.00 3.52 6.14 -0.67 -2.45 117.35 125.83 3fky s TYR 144 Ca 0.77 -0.27 0.00 0.00 0.64 0.00 0.00 57.07 58.20 3fky s TYR 144 Cb -0.73 -4.17 0.00 0.00 0.42 0.00 0.00 41.96 37.49 3fky s TYR 144 CO 0.43 -5.15 0.00 0.41 0.64 0.00 0.00 175.55 171.88 3fky n GLY 145 N 4.55 1.40 3.77 8.97 0.00 -1.26 -4.76 105.19 117.86 3fky n GLY 145 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 3fky n GLY 145 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3fky s TRP 146 N -2.90 3.26 0.09 1.61 0.52 -1.02 -4.93 118.94 115.56 3fky s TRP 146 Ca 0.00 1.57 -0.21 0.00 0.02 0.00 0.00 56.10 57.48 3fky s TRP 146 Cb 0.00 -3.44 -0.12 0.00 -1.15 0.00 0.00 33.47 28.77 3fky s TRP 146 CO 0.00 -1.18 0.46 -2.30 0.02 0.00 0.00 176.95 173.95 3fky n PRO 147 N 0.73 0.00 -1.96 4.98 -0.02 -1.26 -4.76 135.00 132.71 3fky n PRO 147 Ca 0.01 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.06 3fky n PRO 147 Cb 0.44 -0.76 -0.03 0.00 -0.02 0.00 0.00 33.50 33.14 3fky n PRO 147 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3fky s LYS 148 N -0.44 3.44 0.00 -0.52 1.02 -1.26 -1.80 119.74 120.17 3fky s LYS 148 Ca 0.48 1.60 0.00 0.00 0.02 0.00 0.00 55.97 58.07 3fky s LYS 148 Cb -0.68 -4.19 0.00 0.00 -0.52 0.00 0.00 37.83 32.44 3fky s LYS 148 CO 0.37 -1.74 0.00 0.41 -0.92 0.00 0.00 175.35 173.47 3fky n GLY 149 N 5.28 2.90 0.00 -3.33 0.00 -1.26 -4.94 105.19 103.84 3fky n GLY 149 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3fky n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fky n GLY 150 N -2.00 5.18 3.05 -0.02 0.00 -0.75 -5.18 105.19 105.47 3fky n GLY 150 Ca 0.00 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.29 3fky n GLY 150 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fky s TYR 151 N 3.17 0.17 1.21 1.61 2.02 -1.26 -4.58 117.35 119.69 3fky s TYR 151 Ca 0.00 -0.37 -0.20 0.00 -0.37 0.00 0.00 57.07 56.14 3fky s TYR 151 Cb 0.00 -0.13 0.29 0.00 -0.40 0.00 0.00 41.96 41.72 3fky s TYR 151 CO 0.00 -0.25 1.12 -1.25 -1.57 0.00 0.00 175.55 173.60 3fky s PRO 152 N -1.54 -1.32 1.12 -1.71 0.04 -1.26 -4.73 135.00 125.60 3fky s PRO 152 Ca -0.14 -0.12 -0.13 0.00 0.04 0.00 0.00 61.00 60.64 3fky s PRO 152 Cb -0.08 -1.59 0.23 0.00 0.04 0.00 0.00 34.50 33.10 3fky s PRO 152 CO -0.00 -3.77 0.84 0.00 0.04 0.00 0.00 177.00 174.11 3fky n ALA 153 N -4.79 -2.81 -1.41 8.56 0.00 -1.26 -4.96 120.51 113.85 3fky n ALA 153 Ca 0.14 -1.09 -0.31 0.00 0.00 0.00 0.00 53.44 52.18 3fky n ALA 153 Cb 0.60 -1.94 0.07 0.00 0.00 0.00 0.00 19.45 18.18 3fky n ALA 153 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3fky s PRO 154 N -4.24 2.59 0.82 0.00 0.02 -1.26 -4.97 135.00 127.96 3fky s PRO 154 Ca 0.66 1.12 -0.14 0.00 0.02 0.00 0.00 61.00 62.66 3fky s PRO 154 Cb -0.23 -1.94 0.04 0.00 0.02 0.00 0.00 34.50 32.39 3fky s PRO 154 CO 0.64 -1.38 0.82 1.04 -0.33 0.00 0.00 177.00 177.79 3fky n GLN 155 N -3.21 0.09 0.00 5.54 6.02 -1.26 -4.50 117.38 120.05 3fky n GLN 155 Ca 0.09 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.17 3fky n GLN 155 Cb 0.53 -2.12 0.00 0.00 1.02 0.00 0.00 30.24 29.67 3fky n GLN 155 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3fky n GLY 156 N 1.08 3.19 0.30 1.08 0.00 -1.26 -4.94 105.19 104.64 3fky n GLY 156 Ca 0.11 -0.49 0.13 0.00 0.00 0.00 0.00 46.02 45.77 3fky n GLY 156 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3fky n PRO 157 N 0.00 1.41 -0.08 1.61 -0.04 -1.26 -4.25 135.00 132.38 3fky n PRO 157 Ca 0.00 -0.61 -0.16 0.00 -0.04 0.00 0.00 63.50 62.69 3fky n PRO 157 Cb 0.00 -1.43 -0.14 0.00 -0.04 0.00 0.00 33.50 31.89 3fky n PRO 157 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3fky n TYR 158 N -0.23 0.38 -1.68 0.54 4.01 -1.26 -4.48 117.16 114.44 3fky n TYR 158 Ca 0.19 0.10 -0.50 0.00 -0.16 0.00 0.00 57.90 57.52 3fky n TYR 158 Cb 0.24 -1.06 -0.05 0.00 -0.31 0.00 0.00 39.34 38.16 3fky n TYR 158 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 3fky n TYR 159 N -3.17 2.26 -2.62 -0.72 9.36 -1.15 -0.31 117.16 120.81 3fky n TYR 159 Ca -0.37 0.12 -0.18 0.00 3.32 0.00 0.00 57.90 60.78 3fky n TYR 159 Cb 1.05 -2.62 0.00 0.00 -0.63 0.00 0.00 39.34 37.14 3fky n TYR 159 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3fky s GLY 161 N -2.22 1.68 -0.18 0.00 0.00 0.58 -4.94 107.32 102.23 3fky s GLY 161 Ca 0.09 0.39 -0.13 0.00 0.00 0.00 0.00 44.72 45.08 3fky s GLY 161 CO 0.11 0.78 0.45 0.54 0.00 0.00 0.00 173.10 174.98 3fky s VAL 162 N -2.79 -0.01 0.00 1.40 0.11 -1.26 -4.88 120.40 112.96 3fky s VAL 162 Ca 0.64 0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.73 3fky s VAL 162 Cb -0.20 -0.65 0.00 0.00 -1.53 0.00 0.00 36.38 34.00 3fky s VAL 162 CO 0.57 0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.97 3fky n GLY 163 N 3.66 3.57 0.26 6.54 0.00 -1.26 -4.83 105.19 113.13 3fky n GLY 163 Ca -0.19 -1.71 0.05 0.00 0.00 0.00 0.00 46.02 44.17 3fky n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fky h ALA 164 N 0.00 0.90 -0.01 4.61 0.00 -2.01 -0.85 119.26 121.91 3fky h ALA 164 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3fky h ALA 164 Cb 0.00 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3fky h ALA 164 CO 0.00 -0.33 -0.25 0.41 0.00 0.00 0.00 179.25 179.08 3fky n GLY 165 N -1.35 -0.69 0.03 0.00 0.00 -1.26 -4.26 105.19 97.65 3fky n GLY 165 Ca 0.13 -0.38 0.12 0.00 0.00 0.00 0.00 46.02 45.90 3fky n GLY 165 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fky n LYS 166 N -0.74 0.10 -3.67 1.61 4.76 -0.32 -4.88 118.16 115.02 3fky n LYS 166 Ca 0.12 -0.05 -0.15 0.00 -2.87 0.00 0.00 58.31 55.36 3fky n LYS 166 Cb 0.34 -1.50 -0.08 0.00 -1.84 0.00 0.00 35.03 31.95 3fky n LYS 166 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3fky s VAL 167 N -2.94 0.02 -0.10 -0.18 0.11 -1.24 -4.41 120.40 111.67 3fky s VAL 167 Ca 0.13 -0.20 0.02 0.00 -2.93 0.00 0.00 61.98 59.00 3fky s VAL 167 Cb 0.18 -0.76 0.01 0.00 -1.53 0.00 0.00 36.38 34.29 3fky s VAL 167 CO 0.65 -0.11 -0.16 -0.31 -3.33 0.00 0.00 175.10 171.84 3fky s TYR 168 N -0.87 1.98 -1.08 1.54 2.02 -1.26 -4.80 117.35 114.88 3fky s TYR 168 Ca -0.09 -0.87 -0.03 0.00 -0.37 0.00 0.00 57.07 55.71 3fky s TYR 168 Cb -0.03 -1.40 0.00 0.00 -0.40 0.00 0.00 41.96 40.13 3fky s TYR 168 CO 0.05 -0.42 0.41 0.00 -1.57 0.00 0.00 175.55 174.02 3fky n ALA 169 N 3.98 -0.66 -0.19 3.71 0.00 -1.26 -4.81 120.51 121.27 3fky n ALA 169 Ca -0.20 0.20 0.12 0.00 0.00 0.00 0.00 53.44 53.56 3fky n ALA 169 Cb 0.52 -2.82 0.43 0.00 0.00 0.00 0.00 19.45 17.58 3fky n ALA 169 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3fky h ARG 170 N -0.94 0.56 -0.93 0.00 2.43 -1.99 -0.70 114.38 112.80 3fky h ARG 170 Ca -0.37 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 3fky h ARG 170 Cb 1.25 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.63 3fky h ARG 170 CO 0.39 0.37 0.58 0.38 -1.51 0.00 0.00 179.97 180.19 3fky h ASP 171 N 0.57 1.10 -0.19 -3.80 2.03 -1.99 0.47 116.42 114.61 3fky h ASP 171 Ca 0.36 -0.05 -0.03 0.00 -0.73 0.00 0.00 57.03 56.58 3fky h ASP 171 Cb 0.63 -0.28 -0.01 0.00 -0.83 0.00 0.00 39.33 38.84 3fky h ASP 171 CO -0.13 0.83 0.00 -0.03 -1.03 0.00 0.00 179.24 178.87 3fky h MET 172 N 1.28 0.34 -0.92 4.15 4.05 -1.53 -1.20 114.93 121.10 3fky h MET 172 Ca 0.34 -0.11 0.11 0.00 -0.28 0.00 0.00 59.70 59.76 3fky h MET 172 Cb -0.09 -0.03 -0.08 0.00 -0.80 0.00 0.00 31.60 30.60 3fky h MET 172 CO -0.07 0.54 0.55 0.82 0.23 0.00 0.00 176.91 178.99 3fky h ILE 173 N 0.10 0.91 -0.34 1.77 5.03 -0.90 -1.62 117.51 122.47 3fky h ILE 173 Ca 0.06 -0.31 -0.14 0.00 -0.12 0.00 0.00 64.86 64.35 3fky h ILE 173 Cb 0.39 -0.06 -0.01 0.00 -3.03 0.00 0.00 36.82 34.11 3fky h ILE 173 CO 0.01 0.16 -0.33 -0.33 -0.68 0.00 0.00 178.15 176.99 3fky h GLU 174 N 0.90 0.82 -0.94 2.37 4.39 -0.79 -2.23 114.58 119.10 3fky h GLU 174 Ca 0.45 -0.43 0.08 0.00 0.34 0.00 0.00 59.36 59.79 3fky h GLU 174 Cb 0.42 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 29.02 3fky h GLU 174 CO -0.26 1.07 0.59 0.00 -1.16 0.00 0.00 179.01 179.25 3fky h ALA 175 N 0.74 1.31 0.07 3.43 0.00 -0.63 -0.58 119.26 123.60 3fky h ALA 175 Ca 0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3fky h ALA 175 Cb 0.91 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3fky h ALA 175 CO 0.08 0.32 -0.03 1.25 0.00 0.00 0.00 179.25 180.87 3fky h HIS 176 N 1.04 -0.08 -0.49 0.00 -0.00 -1.19 -0.27 115.15 114.15 3fky h HIS 176 Ca 0.42 -0.00 0.10 0.00 -0.00 0.00 0.00 60.37 60.88 3fky h HIS 176 Cb 0.23 0.03 -0.10 0.00 -0.00 0.00 0.00 27.41 27.57 3fky h HIS 176 CO -0.02 0.13 -0.27 -0.92 -0.00 0.00 0.00 177.93 176.84 3fky h TYR 177 N -0.28 -0.73 -0.40 5.26 -0.00 -0.77 0.87 116.97 120.91 3fky h TYR 177 Ca -0.01 0.06 0.05 0.00 -0.00 0.00 0.00 58.73 58.83 3fky h TYR 177 Cb 0.25 0.39 -0.04 0.00 -0.00 0.00 0.00 36.73 37.32 3fky h TYR 177 CO -0.01 -0.35 0.13 0.00 -0.00 0.00 0.00 178.16 177.94 3fky h ARG 178 N -0.16 0.28 0.06 1.82 -0.00 -0.97 -1.68 114.38 113.73 3fky h ARG 178 Ca 0.22 -0.02 0.02 0.00 -0.50 0.00 0.00 59.98 59.70 3fky h ARG 178 Cb 0.51 -0.06 -0.03 0.00 0.00 0.00 0.00 29.97 30.39 3fky h ARG 178 CO -0.58 0.19 -0.21 0.00 0.00 0.00 0.00 179.97 179.36 3fky h ALA 179 N 1.26 -0.32 -0.56 0.04 0.00 0.46 0.13 119.26 120.28 3fky h ALA 179 Ca 0.18 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.15 3fky h ALA 179 Cb 0.17 0.35 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 3fky h ALA 179 CO -0.19 -0.72 0.23 0.00 0.00 0.00 0.00 179.25 178.57 3fky h LEU 181 N 0.44 0.69 -0.75 0.00 3.38 -0.83 -1.81 115.31 116.43 3fky h LEU 181 Ca 0.27 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.18 3fky h LEU 181 Cb 0.28 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 3fky h LEU 181 CO -0.25 0.57 0.48 0.22 0.09 0.00 0.00 178.44 179.56 3fky h TYR 182 N 0.75 0.90 0.00 1.13 3.20 -0.03 0.93 116.97 123.84 3fky h TYR 182 Ca 0.20 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.09 3fky h TYR 182 Cb 0.03 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.01 3fky h TYR 182 CO -0.02 0.52 0.00 0.00 -1.64 0.00 0.00 178.16 177.02 3fky n ALA 183 N -2.32 1.70 -1.01 1.82 0.00 -0.45 -4.74 120.51 115.52 3fky n ALA 183 Ca 0.08 -0.03 -0.00 0.00 0.00 0.00 0.00 53.44 53.49 3fky n ALA 183 Cb 0.08 -1.28 -0.00 0.00 0.00 0.00 0.00 19.45 18.25 3fky n ALA 183 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fky n GLY 184 N 0.08 0.47 3.67 0.00 0.00 0.32 -4.40 105.19 105.33 3fky n GLY 184 Ca 0.03 -0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 3fky n GLY 184 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fky n LEU 185 N -0.03 4.22 -3.52 0.99 4.77 -0.74 -4.89 117.00 117.81 3fky n LEU 185 Ca -0.00 0.62 -0.40 0.00 -0.03 0.00 0.00 56.01 56.19 3fky n LEU 185 Cb 0.02 -1.48 -0.01 0.00 -2.33 0.00 0.00 43.42 39.62 3fky n LEU 185 CO 0.00 -1.77 2.49 1.21 -1.33 0.00 0.00 177.39 178.00 3fky n GLU 186 N -2.78 4.28 -2.82 3.23 4.07 -1.26 -4.66 120.64 120.70 3fky n GLU 186 Ca 0.13 -3.26 -0.43 0.00 -0.06 0.00 0.00 57.16 53.54 3fky n GLU 186 Cb 0.50 -2.72 -0.04 0.00 -0.06 0.00 0.00 31.44 29.12 3fky n GLU 186 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 3fky s ILE 187 N -0.32 4.46 -0.04 6.31 2.07 -1.26 -0.38 121.20 132.03 3fky s ILE 187 Ca 0.54 0.70 0.12 0.00 -1.41 0.00 0.00 60.65 60.60 3fky s ILE 187 Cb 0.17 -4.45 -0.07 0.00 0.13 0.00 0.00 42.46 38.24 3fky s ILE 187 CO -0.07 -0.87 1.28 0.77 -1.91 0.00 0.00 174.94 174.14 3fky h SER 188 N 9.11 0.00 0.00 4.50 4.64 -0.77 -3.48 113.55 127.55 3fky h SER 188 Ca -0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 3fky h SER 188 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 3fky h SER 188 CO 1.03 0.72 0.00 0.61 -0.87 0.00 0.00 176.83 178.33 3fky n GLY 189 N 1.31 0.29 3.09 -0.77 0.00 -1.22 -4.98 105.19 102.92 3fky n GLY 189 Ca -0.01 -0.95 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 3fky n GLY 189 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3fky s ILE 190 N -2.00 0.19 -0.15 -0.61 2.07 -1.26 -0.86 121.20 118.58 3fky s ILE 190 Ca 0.00 -1.56 -0.29 0.00 -1.41 0.00 0.00 60.65 57.39 3fky s ILE 190 Cb 0.00 -1.29 0.10 0.00 0.13 0.00 0.00 42.46 41.40 3fky s ILE 190 CO 0.00 -0.86 0.84 0.54 -1.91 0.00 0.00 174.94 173.54 3fky s ASN 191 N -2.66 -0.55 0.16 4.50 4.22 -0.90 -5.00 114.94 114.71 3fky s ASN 191 Ca 0.03 0.73 -0.30 0.00 -2.14 0.00 0.00 52.86 51.18 3fky s ASN 191 Cb 0.05 0.63 -0.07 0.00 1.28 0.00 0.00 41.25 43.13 3fky s ASN 191 CO -0.09 -0.41 1.00 0.00 -2.04 0.00 0.00 177.10 175.57 3fky s ALA 192 N -0.77 3.30 0.68 3.54 0.00 -1.26 -1.57 121.76 125.68 3fky s ALA 192 Ca -0.05 0.66 -0.01 0.00 0.00 0.00 0.00 51.96 52.57 3fky s ALA 192 Cb -0.01 -3.29 0.12 0.00 0.00 0.00 0.00 23.12 19.93 3fky s ALA 192 CO 0.04 -0.04 0.81 0.39 0.00 0.00 0.00 175.76 176.95 3fky n GLU 193 N 2.40 -0.00 -0.05 0.00 -0.58 0.65 -0.44 120.64 122.62 3fky n GLU 193 Ca 0.02 -2.15 -0.12 0.00 -0.42 0.00 0.00 57.16 54.49 3fky n GLU 193 Cb 0.48 -0.55 -0.06 0.00 -0.57 0.00 0.00 31.44 30.74 3fky n GLU 193 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3fky h VAL 194 N -0.60 1.24 -3.68 2.62 2.07 -1.86 -3.04 116.25 113.00 3fky h VAL 194 Ca -0.27 -0.79 -0.51 0.00 0.82 0.00 0.00 66.70 65.95 3fky h VAL 194 Cb 0.97 1.46 0.01 0.00 -1.52 0.00 0.00 31.29 32.21 3fky h VAL 194 CO 0.28 0.24 0.46 -0.32 0.02 0.00 0.00 177.57 178.24 3fky s MET 195 N -5.05 4.65 0.34 1.57 -2.45 -1.26 -4.06 119.30 113.04 3fky s MET 195 Ca -0.14 1.72 -0.29 0.00 -1.25 0.00 0.00 55.69 55.73 3fky s MET 195 Cb 0.06 -3.25 -0.12 0.00 1.25 0.00 0.00 34.83 32.78 3fky s MET 195 CO 0.71 0.18 1.46 -2.30 1.05 0.00 0.00 175.02 176.13 3fky n PRO 196 N 1.83 2.52 -2.74 4.11 -0.02 -1.26 -1.96 135.00 137.49 3fky n PRO 196 Ca 0.01 0.89 -0.22 0.00 -2.02 0.00 0.00 63.50 62.16 3fky n PRO 196 Cb 0.46 -2.59 0.01 0.00 -0.02 0.00 0.00 33.50 31.36 3fky n PRO 196 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3fky n SER 197 N 0.98 -5.99 -4.20 2.55 3.41 -1.26 -4.93 113.62 104.19 3fky n SER 197 Ca 0.04 -0.16 -0.30 0.00 -0.26 0.00 0.00 58.87 58.19 3fky n SER 197 Cb 0.37 -4.91 -0.17 0.00 -0.26 0.00 0.00 64.21 59.25 3fky n SER 197 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3fky s GLN 198 N -5.40 2.60 0.35 4.33 0.74 -0.83 -0.94 119.66 120.51 3fky s GLN 198 Ca 0.16 -0.80 0.04 0.00 0.05 0.00 0.00 55.36 54.82 3fky s GLN 198 Cb -0.07 -2.06 -0.05 0.00 1.10 0.00 0.00 33.01 31.92 3fky s GLN 198 CO 0.20 0.22 0.07 -1.58 -0.55 0.00 0.00 175.29 173.65 3fky s TRP 199 N 0.21 1.95 0.02 1.67 0.52 -0.06 -0.25 118.94 123.00 3fky s TRP 199 Ca -0.13 -1.00 0.01 0.00 0.02 0.00 0.00 56.10 55.00 3fky s TRP 199 Cb -0.16 -1.30 -0.01 0.00 -1.15 0.00 0.00 33.47 30.85 3fky s TRP 199 CO 0.06 -0.02 -0.04 -2.00 0.02 0.00 0.00 176.95 174.97 3fky s GLU 200 N -3.85 0.31 0.05 4.98 2.12 -0.61 -0.80 118.70 120.90 3fky s GLU 200 Ca 0.33 -0.40 0.04 0.00 0.36 0.00 0.00 54.97 55.29 3fky s GLU 200 Cb 0.07 -0.12 -0.02 0.00 0.26 0.00 0.00 34.13 34.32 3fky s GLU 200 CO 0.15 0.02 -0.12 -0.59 -0.54 0.00 0.00 175.26 174.18 3fky s PHE 201 N -0.79 1.00 -0.05 5.30 -0.12 -0.09 -2.12 117.98 121.11 3fky s PHE 201 Ca -0.07 -0.42 0.04 0.00 -0.05 0.00 0.00 56.93 56.43 3fky s PHE 201 Cb -0.06 -0.58 -0.02 0.00 -0.63 0.00 0.00 43.02 41.73 3fky s PHE 201 CO -0.00 0.00 -0.16 -0.65 -0.05 0.00 0.00 175.22 174.36 3fky s GLN 202 N -1.44 2.47 -0.13 1.99 1.11 -0.04 -0.46 119.66 123.16 3fky s GLN 202 Ca -0.03 -0.73 0.01 0.00 0.01 0.00 0.00 55.36 54.62 3fky s GLN 202 Cb -0.09 -2.34 0.02 0.00 -1.01 0.00 0.00 33.01 29.59 3fky s GLN 202 CO 0.01 0.61 -0.15 0.08 0.01 0.00 0.00 175.29 175.85 3fky s VAL 203 N -0.69 1.56 0.00 1.09 1.01 -0.49 -0.18 120.40 122.70 3fky s VAL 203 Ca 0.11 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.44 3fky s VAL 203 Cb -0.11 -1.44 0.00 0.00 0.00 0.00 0.00 36.38 34.83 3fky s VAL 203 CO 0.00 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.17 3fky n GLY 204 N 4.46 2.11 3.83 4.51 0.00 0.49 -1.06 105.19 119.54 3fky n GLY 204 Ca -0.18 -1.08 -0.35 0.00 0.00 0.00 0.00 46.02 44.41 3fky n GLY 204 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3fky s PRO 205 N -2.00 4.14 0.18 1.61 0.05 -1.26 -4.40 135.00 133.32 3fky s PRO 205 Ca 0.00 0.75 0.09 0.00 0.05 0.00 0.00 61.00 61.89 3fky s PRO 205 Cb 0.00 -2.77 -0.04 0.00 0.05 0.00 0.00 34.50 31.74 3fky s PRO 205 CO 0.00 0.35 -0.19 0.00 0.05 0.00 0.00 177.00 177.20 3fky s THR 207 N -2.04 4.97 0.00 0.00 2.01 -1.26 -1.40 115.64 117.91 3fky s THR 207 Ca 0.18 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.22 3fky s THR 207 Cb -0.06 -3.29 0.00 0.00 0.01 0.00 0.00 72.50 69.17 3fky s THR 207 CO 0.08 0.39 0.00 0.61 -0.69 0.00 0.00 174.62 175.01 3fky n GLY 208 N 4.06 1.65 0.19 4.40 0.00 -1.19 -1.44 105.19 112.86 3fky n GLY 208 Ca -0.16 0.51 0.04 0.00 0.00 0.00 0.00 46.02 46.41 3fky n GLY 208 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3fky h ILE 209 N 0.00 1.13 -0.87 -0.61 1.08 -1.94 -2.99 117.51 113.31 3fky h ILE 209 Ca 0.00 -1.27 0.13 0.00 -0.39 0.00 0.00 64.86 63.33 3fky h ILE 209 Cb 0.00 1.71 -0.07 0.00 -3.07 0.00 0.00 36.82 35.39 3fky h ILE 209 CO 0.00 0.35 0.56 0.44 -0.69 0.00 0.00 178.15 178.81 3fky h ASP 210 N 0.00 0.67 0.38 1.72 3.32 -1.61 -1.82 116.42 119.08 3fky h ASP 210 Ca -0.00 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 3fky h ASP 210 Cb 0.68 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.10 3fky h ASP 210 CO 0.05 0.35 -0.48 -0.03 -1.72 0.00 0.00 179.24 177.41 3fky h MET 211 N 0.71 -0.86 -0.26 3.56 4.05 -1.69 0.58 114.93 121.02 3fky h MET 211 Ca 0.43 0.06 0.06 0.00 -0.28 0.00 0.00 59.70 59.97 3fky h MET 211 Cb 0.64 0.20 -0.07 0.00 -0.80 0.00 0.00 31.60 31.57 3fky h MET 211 CO -0.19 -0.57 -0.19 0.78 0.23 0.00 0.00 176.91 176.97 3fky h GLY 212 N -0.89 -0.03 0.58 1.39 0.00 -1.58 -0.91 103.07 101.63 3fky h GLY 212 Ca -0.04 0.23 0.03 0.00 0.00 0.00 0.00 47.33 47.55 3fky h GLY 212 CO -0.12 -0.18 -0.15 -0.55 0.00 0.00 0.00 176.54 175.55 3fky h ASP 213 N -0.17 -0.44 -0.44 0.19 3.32 -1.03 -1.54 116.42 116.32 3fky h ASP 213 Ca 0.14 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 3fky h ASP 213 Cb 0.39 0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 3fky h ASP 213 CO -0.36 -0.20 -0.01 1.56 -1.72 0.00 0.00 179.24 178.51 3fky h GLN 214 N -0.22 0.78 -0.51 3.56 4.20 -0.66 -1.95 115.11 120.31 3fky h GLN 214 Ca 0.07 -0.25 0.00 0.00 0.06 0.00 0.00 58.65 58.52 3fky h GLN 214 Cb 0.31 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 3fky h GLN 214 CO -0.18 0.85 0.33 1.25 -0.67 0.00 0.00 178.83 180.41 3fky h LEU 215 N 0.62 0.59 -0.92 1.46 5.85 -1.02 0.90 115.31 122.79 3fky h LEU 215 Ca 0.12 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.83 3fky h LEU 215 Cb 0.51 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 3fky h LEU 215 CO 0.02 0.45 0.60 -0.50 -0.34 0.00 0.00 178.44 178.67 3fky h TRP 216 N 0.69 1.13 -0.38 1.25 4.06 -1.11 0.49 115.95 122.08 3fky h TRP 216 Ca 0.18 0.03 -0.07 0.00 2.06 0.00 0.00 58.89 61.09 3fky h TRP 216 Cb -0.06 -0.38 -0.01 0.00 -1.00 0.00 0.00 29.16 27.71 3fky h TRP 216 CO -0.04 0.68 -0.04 0.52 -3.56 0.00 0.00 178.44 176.01 3fky h MET 217 N 1.20 0.71 -0.83 0.49 2.86 -0.81 -1.06 114.93 117.48 3fky h MET 217 Ca 0.35 -0.25 0.09 0.00 -2.06 0.00 0.00 59.70 57.83 3fky h MET 217 Cb -0.07 -0.05 -0.07 0.00 0.06 0.00 0.00 31.60 31.46 3fky h MET 217 CO -0.10 0.83 0.48 0.00 1.06 0.00 0.00 176.91 179.19 3fky h ALA 218 N 0.86 1.19 -0.59 6.32 0.00 -0.17 0.84 119.26 127.70 3fky h ALA 218 Ca 0.10 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3fky h ALA 218 Cb 0.54 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3fky h ALA 218 CO 0.03 0.12 0.18 0.00 0.00 0.00 0.00 179.25 179.57 3fky h ARG 219 N 0.81 0.92 0.12 0.00 3.08 -0.59 0.10 114.38 118.83 3fky h ARG 219 Ca 0.40 -0.20 0.02 0.00 0.07 0.00 0.00 59.98 60.26 3fky h ARG 219 Cb 0.35 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.24 3fky h ARG 219 CO -0.24 0.83 -0.28 -0.92 -1.07 0.00 0.00 179.97 178.29 3fky h TYR 220 N 0.84 -0.75 -0.90 3.04 5.03 0.04 -1.49 116.97 122.78 3fky h TYR 220 Ca 0.19 0.02 0.14 0.00 2.58 0.00 0.00 58.73 61.65 3fky h TYR 220 Cb 0.30 0.31 -0.09 0.00 1.55 0.00 0.00 36.73 38.81 3fky h TYR 220 CO 0.02 -0.38 0.51 0.74 -1.32 0.00 0.00 178.16 177.73 3fky h PHE 221 N -0.50 0.91 0.92 -3.82 0.04 -0.51 0.14 116.94 114.12 3fky h PHE 221 Ca 0.03 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.79 3fky h PHE 221 Cb 0.52 -0.27 0.01 0.00 2.20 0.00 0.00 35.95 38.41 3fky h PHE 221 CO -0.25 0.28 -0.44 1.25 -0.60 0.00 0.00 178.31 178.54 3fky h LEU 222 N 0.75 -1.04 -0.54 1.54 5.85 -0.37 0.19 115.31 121.69 3fky h LEU 222 Ca 0.48 0.04 0.11 0.00 0.84 0.00 0.00 57.88 59.34 3fky h LEU 222 Cb 0.61 0.27 -0.10 0.00 0.37 0.00 0.00 40.66 41.81 3fky h LEU 222 CO -0.33 -0.70 -0.14 0.45 -0.34 0.00 0.00 178.44 177.38 3fky h HIS 223 N -1.33 -0.31 -0.27 1.25 3.86 -1.00 -0.92 115.15 116.44 3fky h HIS 223 Ca -0.13 0.05 -0.03 0.00 -1.16 0.00 0.00 60.37 59.11 3fky h HIS 223 Cb 0.94 0.22 -0.01 0.00 1.06 0.00 0.00 27.41 29.63 3fky h HIS 223 CO 0.00 -0.24 0.06 -0.09 0.86 0.00 0.00 177.93 178.52 3fky h ARG 224 N -0.01 0.43 -0.32 2.45 9.65 -0.86 -2.00 114.38 123.73 3fky h ARG 224 Ca 0.26 -0.11 -0.15 0.00 -1.10 0.00 0.00 59.98 58.88 3fky h ARG 224 Cb 0.41 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.93 3fky h ARG 224 CO -0.57 0.54 -0.40 -0.24 2.80 0.00 0.00 179.97 182.10 3fky h VAL 225 N 0.26 1.28 0.00 0.20 3.04 -0.39 -2.89 116.25 117.75 3fky h VAL 225 Ca 0.08 -1.58 -0.02 0.00 -1.01 0.00 0.00 66.70 64.17 3fky h VAL 225 Cb 0.30 1.46 -0.00 0.00 -2.01 0.00 0.00 31.29 31.04 3fky h VAL 225 CO 0.00 0.52 -0.10 0.00 -1.01 0.00 0.00 177.57 176.97 3fky h ALA 226 N 0.90 1.74 -0.89 3.17 0.00 -1.04 -0.70 119.26 122.44 3fky h ALA 226 Ca 0.05 -0.09 0.21 0.00 0.00 0.00 0.00 54.91 55.08 3fky h ALA 226 Cb 0.96 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.61 3fky h ALA 226 CO 0.09 0.13 0.40 0.93 0.00 0.00 0.00 179.25 180.80 3fky h GLU 227 N 0.00 0.41 0.00 0.00 5.08 -1.13 0.17 114.58 119.10 3fky h GLU 227 Ca -0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3fky h GLU 227 Cb 0.19 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3fky h GLU 227 CO 0.01 0.27 0.00 0.39 -1.00 0.00 0.00 179.01 178.68 3fky n GLU 228 N -5.03 0.15 -0.11 2.33 1.02 -0.27 -1.28 120.64 117.45 3fky n GLU 228 Ca 0.22 0.47 0.04 0.00 -0.02 0.00 0.00 57.16 57.87 3fky n GLU 228 Cb 0.64 -1.84 0.10 0.00 -0.02 0.00 0.00 31.44 30.32 3fky n GLU 228 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3fky n PHE 229 N -2.12 0.29 -2.36 -0.32 3.72 0.50 -4.97 117.46 112.20 3fky n PHE 229 Ca 0.01 -0.43 -0.21 0.00 -0.05 0.00 0.00 57.45 56.77 3fky n PHE 229 Cb 0.15 -0.03 -0.01 0.00 -0.94 0.00 0.00 39.48 38.65 3fky n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fky n GLY 230 N 0.26 -0.38 3.54 1.37 0.00 -0.41 -4.98 105.19 104.60 3fky n GLY 230 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 3fky n GLY 230 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fky s ILE 231 N -3.03 4.17 0.14 -0.61 1.01 -0.69 -3.71 121.20 118.48 3fky s ILE 231 Ca 0.00 -0.26 -0.18 0.00 0.00 0.00 0.00 60.65 60.21 3fky s ILE 231 Cb 0.00 -2.84 -0.07 0.00 0.01 0.00 0.00 42.46 39.55 3fky s ILE 231 CO 0.00 0.49 0.62 -0.54 0.00 0.00 0.00 174.94 175.50 3fky s LYS 232 N 0.34 4.16 -0.15 2.79 1.02 -0.43 -4.07 119.74 123.40 3fky s LYS 232 Ca -0.02 0.72 -0.05 0.00 0.02 0.00 0.00 55.97 56.64 3fky s LYS 232 Cb -0.14 -3.04 -0.04 0.00 -0.52 0.00 0.00 37.83 34.10 3fky s LYS 232 CO 0.02 0.52 0.03 0.42 -0.92 0.00 0.00 175.35 175.41 3fky s ILE 233 N -1.34 4.48 -0.21 2.17 1.01 -1.26 -1.46 121.20 124.59 3fky s ILE 233 Ca 0.36 -0.16 -0.00 0.00 0.00 0.00 0.00 60.65 60.85 3fky s ILE 233 Cb -0.17 -2.97 0.02 0.00 0.01 0.00 0.00 42.46 39.35 3fky s ILE 233 CO 0.20 0.52 -0.14 -0.55 0.00 0.00 0.00 174.94 174.97 3fky s SER 234 N -0.05 3.71 -0.03 3.58 0.15 -0.35 -4.95 113.70 115.75 3fky s SER 234 Ca 0.05 -0.75 0.17 0.00 0.70 0.00 0.00 55.95 56.12 3fky s SER 234 Cb -0.12 -1.56 0.53 0.00 -1.71 0.00 0.00 66.02 63.15 3fky s SER 234 CO 0.02 -0.05 1.43 0.49 1.20 0.00 0.00 173.24 176.33 3fky n PHE 235 N 4.63 0.91 -1.73 3.44 3.72 -1.26 -1.77 117.46 125.40 3fky n PHE 235 Ca -0.19 -0.41 -0.42 0.00 -0.05 0.00 0.00 57.45 56.38 3fky n PHE 235 Cb 0.49 -0.07 -0.01 0.00 -0.94 0.00 0.00 39.48 38.95 3fky n PHE 235 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 3fky n HIS 236 N 1.08 2.65 0.26 1.38 -0.00 -1.26 -2.23 115.22 117.10 3fky n HIS 236 Ca 0.20 0.45 0.14 0.00 0.46 0.00 0.00 57.72 58.97 3fky n HIS 236 Cb 0.57 -2.50 0.69 0.00 -0.12 0.00 0.00 29.99 28.64 3fky n HIS 236 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3fky h PRO 237 N 3.20 0.00 -1.59 1.57 0.11 -1.85 -3.36 132.00 130.09 3fky h PRO 237 Ca -0.48 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 65.23 3fky h PRO 237 Cb 1.26 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 32.09 3fky h PRO 237 CO 0.67 0.11 -0.78 1.17 -0.21 0.00 0.00 178.00 178.96 3fky n LYS 238 N -3.38 0.44 0.09 1.05 3.00 -1.26 0.21 118.16 118.31 3fky n LYS 238 Ca -0.01 -2.63 0.01 0.00 -0.00 0.00 0.00 58.31 55.68 3fky n LYS 238 Cb 0.29 -1.52 0.36 0.00 0.00 0.00 0.00 35.03 34.16 3fky n LYS 238 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 3fky h PRO 239 N 5.00 0.30 -4.76 1.64 0.11 -1.84 -3.39 132.00 129.06 3fky h PRO 239 Ca 0.12 -0.07 -0.58 0.00 0.11 0.00 0.00 66.00 65.59 3fky h PRO 239 Cb 0.99 -0.04 -0.34 0.00 0.11 0.00 0.00 31.00 31.72 3fky h PRO 239 CO 0.26 0.43 -0.83 -0.51 -0.21 0.00 0.00 178.00 177.14 3fky s LEU 240 N -8.79 1.74 0.56 2.35 1.43 -1.26 -5.10 118.68 109.61 3fky s LEU 240 Ca -0.06 -0.40 -0.19 0.00 -1.03 0.00 0.00 54.13 52.45 3fky s LEU 240 Cb 0.15 -1.05 -0.05 0.00 0.03 0.00 0.00 46.19 45.27 3fky s LEU 240 CO 0.74 0.04 1.13 -0.54 0.23 0.00 0.00 176.35 177.95 3fky s LYS 241 N 0.81 3.26 0.00 1.70 1.02 -1.26 -4.57 119.74 120.70 3fky s LYS 241 Ca -0.11 1.57 0.00 0.00 0.02 0.00 0.00 55.97 57.45 3fky s LYS 241 Cb -0.16 -2.00 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 3fky s LYS 241 CO 0.02 -0.92 0.00 0.41 -0.92 0.00 0.00 175.35 173.94 3fky n GLY 242 N 0.03 0.12 0.15 -3.33 0.00 -1.26 -4.61 105.19 96.29 3fky n GLY 242 Ca 0.11 -1.94 0.12 0.00 0.00 0.00 0.00 46.02 44.31 3fky n GLY 242 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fky n ASP 243 N 0.00 0.99 -4.71 1.61 9.92 -1.26 -4.91 116.55 118.19 3fky n ASP 243 Ca 0.00 -0.79 -0.43 0.00 -0.53 0.00 0.00 54.79 53.04 3fky n ASP 243 Cb 0.00 0.42 -0.03 0.00 -0.64 0.00 0.00 41.12 40.87 3fky n ASP 243 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 3fky n TRP 244 N -1.03 2.66 -1.57 1.24 7.02 -1.26 -4.89 117.44 119.62 3fky n TRP 244 Ca 0.08 0.16 -0.39 0.00 -1.02 0.00 0.00 57.50 56.32 3fky n TRP 244 Cb 0.36 -2.62 0.03 0.00 -2.42 0.00 0.00 31.31 26.66 3fky n TRP 244 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 3fky n ASN 245 N 3.28 0.38 -2.36 -0.99 4.13 -1.26 -4.85 115.26 113.59 3fky n ASN 245 Ca 0.14 0.87 -0.05 0.00 1.68 0.00 0.00 54.58 57.22 3fky n ASN 245 Cb 0.34 -1.31 0.03 0.00 -1.54 0.00 0.00 39.78 37.31 3fky n ASN 245 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3fky n GLY 246 N 1.41 -0.82 2.89 7.41 0.00 -1.26 -4.70 105.19 110.13 3fky n GLY 246 Ca 0.12 -1.73 -0.26 0.00 0.00 0.00 0.00 46.02 44.14 3fky n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fky s ALA 247 N -3.77 1.27 0.46 4.61 0.00 0.13 -4.93 121.76 119.53 3fky s ALA 247 Ca 0.13 -0.51 0.06 0.00 0.00 0.00 0.00 51.96 51.64 3fky s ALA 247 Cb -0.00 -0.90 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 3fky s ALA 247 CO 0.09 -0.42 0.20 0.20 0.00 0.00 0.00 175.76 175.83 3fky s GLY 248 N 1.73 2.47 -0.45 0.00 0.00 -1.26 -0.94 107.32 108.87 3fky s GLY 248 Ca 0.05 -1.62 0.08 0.00 0.00 0.00 0.00 44.72 43.23 3fky s GLY 248 CO -0.08 -1.97 0.67 0.00 0.00 0.00 0.00 173.10 171.72 3fky n HIS 250 N 0.81 1.40 -3.14 0.00 8.25 -1.19 -4.56 115.22 116.78 3fky n HIS 250 Ca 0.25 0.75 -0.41 0.00 -0.26 0.00 0.00 57.72 58.05 3fky n HIS 250 Cb 0.53 -2.33 -0.07 0.00 1.12 0.00 0.00 29.99 29.24 3fky n HIS 250 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3fky s ALA 251 N 5.49 3.57 -0.09 -1.41 0.00 -0.80 -1.48 121.76 127.04 3fky s ALA 251 Ca 1.14 -0.57 -0.16 0.00 0.00 0.00 0.00 51.96 52.38 3fky s ALA 251 Cb -1.37 -3.02 -0.05 0.00 0.00 0.00 0.00 23.12 18.68 3fky s ALA 251 CO 0.66 -0.90 0.42 -0.80 0.00 0.00 0.00 175.76 175.14 3fky s ASN 252 N 1.56 6.68 0.04 0.00 0.01 0.45 -0.62 114.94 123.05 3fky s ASN 252 Ca 0.24 0.80 0.05 0.00 -0.71 0.00 0.00 52.86 53.25 3fky s ASN 252 Cb -0.15 -2.25 -0.02 0.00 0.41 0.00 0.00 41.25 39.23 3fky s ASN 252 CO 0.10 0.13 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.98 3fky s VAL 253 N 0.02 1.18 -0.20 1.60 1.01 -0.27 -1.31 120.40 122.44 3fky s VAL 253 Ca 0.23 -1.05 -0.28 0.00 0.00 0.00 0.00 61.98 60.89 3fky s VAL 253 Cb -0.15 -1.06 0.09 0.00 0.00 0.00 0.00 36.38 35.26 3fky s VAL 253 CO 0.10 0.01 0.84 -0.94 0.00 0.00 0.00 175.10 175.11 3fky s SER 254 N -1.19 -0.58 0.38 3.32 1.04 -0.79 -1.66 113.70 114.22 3fky s SER 254 Ca 0.02 0.92 0.08 0.00 0.48 0.00 0.00 55.95 57.44 3fky s SER 254 Cb -0.08 0.86 -0.04 0.00 0.10 0.00 0.00 66.02 66.86 3fky s SER 254 CO 0.01 -0.33 0.24 0.42 0.98 0.00 0.00 173.24 174.56 3fky s THR 255 N -0.34 2.80 0.23 2.02 -4.23 -1.26 -0.01 115.64 114.85 3fky s THR 255 Ca -0.02 -1.56 -0.06 0.00 -1.18 0.00 0.00 61.69 58.87 3fky s THR 255 Cb -0.03 -3.01 0.19 0.00 1.34 0.00 0.00 72.50 70.99 3fky s THR 255 CO 0.02 -0.08 1.74 0.50 -0.54 0.00 0.00 174.62 176.25 3fky h LYS 256 N 1.34 0.43 -0.57 3.99 3.64 -1.01 -1.23 116.57 123.16 3fky h LYS 256 Ca -0.43 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 58.96 3fky h LYS 256 Cb 1.26 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.94 3fky h LYS 256 CO 0.63 0.29 0.32 0.93 -2.27 0.00 0.00 179.45 179.35 3fky h GLU 257 N 0.45 0.60 0.00 1.90 5.08 -1.93 -2.07 114.58 118.61 3fky h GLU 257 Ca 0.38 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.67 3fky h GLU 257 Cb 0.53 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 3fky h GLU 257 CO -0.36 0.40 -0.12 0.52 -1.00 0.00 0.00 179.01 178.44 3fky h MET 258 N 0.62 0.00 0.00 2.33 2.86 -1.50 -2.82 114.93 116.41 3fky h MET 258 Ca 0.24 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.86 3fky h MET 258 Cb 0.09 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 3fky h MET 258 CO -0.14 0.12 -0.58 0.00 1.06 0.00 0.00 176.91 177.37 3fky h ARG 259 N 0.00 0.00 -6.25 1.72 3.08 -0.98 0.18 114.38 112.13 3fky h ARG 259 Ca -0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.48 3fky h ARG 259 Cb 0.30 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 3fky h ARG 259 CO 0.02 0.06 -0.22 -0.65 -1.07 0.00 0.00 179.97 178.11 3fky s GLN 260 N -3.23 3.73 0.40 0.04 -0.21 -1.07 -4.59 119.66 114.73 3fky s GLN 260 Ca 0.03 0.12 -0.22 0.00 0.02 0.00 0.00 55.36 55.30 3fky s GLN 260 Cb 0.07 -2.82 -0.14 0.00 1.00 0.00 0.00 33.01 31.13 3fky s GLN 260 CO 0.74 0.44 0.40 -2.30 -2.12 0.00 0.00 175.29 172.44 3fky n PRO 261 N 0.22 0.35 -1.37 2.91 -0.02 -1.26 -2.29 135.00 133.54 3fky n PRO 261 Ca -0.03 0.13 -0.02 0.00 -2.02 0.00 0.00 63.50 61.56 3fky n PRO 261 Cb 0.52 -1.31 -0.01 0.00 -0.02 0.00 0.00 33.50 32.69 3fky n PRO 261 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fky n GLY 262 N 1.98 0.44 0.18 -1.23 0.00 -1.20 -4.98 105.19 100.39 3fky n GLY 262 Ca 0.12 -0.95 -0.15 0.00 0.00 0.00 0.00 46.02 45.04 3fky n GLY 262 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3fky h GLY 263 N 0.00 0.64 1.65 -0.02 0.00 -0.42 -3.25 103.07 101.67 3fky h GLY 263 Ca -0.04 -0.84 0.00 0.00 0.00 0.00 0.00 47.33 46.46 3fky h GLY 263 CO 0.05 0.75 0.10 2.41 0.00 0.00 0.00 176.54 179.84 3fky n THR 264 N -4.22 1.51 0.38 4.70 -1.04 -0.65 0.11 114.28 115.06 3fky n THR 264 Ca -0.07 0.54 -0.15 0.00 -2.04 0.00 0.00 64.05 62.33 3fky n THR 264 Cb 0.58 -1.54 -0.07 0.00 -1.82 0.00 0.00 70.33 67.48 3fky n THR 264 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 3fky h LYS 265 N 0.00 -0.93 0.00 -2.82 3.64 -1.84 0.32 116.57 114.94 3fky h LYS 265 Ca 0.00 0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.35 3fky h LYS 265 Cb 0.19 0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 3fky h LYS 265 CO 0.00 -0.62 -0.46 1.88 -2.27 0.00 0.00 179.45 177.98 3fky h TYR 266 N -0.97 0.00 -0.12 1.91 0.05 0.52 -1.28 116.97 117.08 3fky h TYR 266 Ca -0.10 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.69 3fky h TYR 266 Cb 0.74 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.47 3fky h TYR 266 CO 0.07 0.46 0.06 0.82 -1.05 0.00 0.00 178.16 178.52 3fky h ILE 267 N 0.00 1.00 -0.70 -2.88 2.04 -1.25 0.50 117.51 116.23 3fky h ILE 267 Ca -0.00 -0.05 -0.05 0.00 1.00 0.00 0.00 64.86 65.76 3fky h ILE 267 Cb 0.85 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 3fky h ILE 267 CO 0.06 0.02 0.22 -0.33 0.00 0.00 0.00 178.15 178.13 3fky h GLU 268 N 0.13 1.07 -0.06 2.37 5.08 -0.53 -0.65 114.58 122.00 3fky h GLU 268 Ca 0.05 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.20 3fky h GLU 268 Cb 0.00 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 3fky h GLU 268 CO -0.03 0.91 -0.02 1.96 -1.00 0.00 0.00 179.01 180.83 3fky h GLN 269 N 1.03 -0.02 -0.27 2.33 4.20 -0.99 -1.91 115.11 119.49 3fky h GLN 269 Ca 0.23 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.97 3fky h GLN 269 Cb 0.28 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 3fky h GLN 269 CO -0.01 -0.01 0.07 0.00 -0.67 0.00 0.00 178.83 178.21 3fky h ALA 270 N 1.05 0.29 -0.74 3.87 0.00 -0.53 -1.85 119.26 121.34 3fky h ALA 270 Ca 0.03 0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.09 3fky h ALA 270 Cb 0.07 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 3fky h ALA 270 CO -0.07 -0.34 0.49 0.82 0.00 0.00 0.00 179.25 180.14 3fky h ILE 271 N 0.19 0.90 -0.10 0.00 2.04 -0.87 -0.11 117.51 119.56 3fky h ILE 271 Ca 0.12 -0.20 -0.11 0.00 1.00 0.00 0.00 64.86 65.67 3fky h ILE 271 Cb 0.10 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 3fky h ILE 271 CO -0.14 0.11 -0.39 -0.08 0.00 0.00 0.00 178.15 177.65 3fky h GLU 272 N 0.58 0.43 -0.75 2.37 4.81 -0.70 -1.69 114.58 119.64 3fky h GLU 272 Ca 0.35 -0.34 0.09 0.00 -0.13 0.00 0.00 59.36 59.33 3fky h GLU 272 Cb 0.55 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.93 3fky h GLU 272 CO -0.12 0.97 0.40 0.87 -0.73 0.00 0.00 179.01 180.40 3fky h LYS 273 N -0.01 0.66 -0.56 1.92 1.57 -0.57 -0.55 116.57 119.04 3fky h LYS 273 Ca -0.02 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3fky h LYS 273 Cb 1.03 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.16 3fky h LYS 273 CO 0.08 0.44 0.37 -0.07 -0.57 0.00 0.00 179.45 179.70 3fky h LEU 274 N 0.68 0.60 -1.35 2.94 3.38 -0.91 -1.56 115.31 119.09 3fky h LEU 274 Ca 0.36 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.26 3fky h LEU 274 Cb 0.34 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3fky h LEU 274 CO -0.25 0.43 -0.30 0.77 0.09 0.00 0.00 178.44 179.17 3fky h SER 275 N 0.71 0.00 1.92 -0.43 4.64 -0.13 -2.17 113.55 118.08 3fky h SER 275 Ca 0.21 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 3fky h SER 275 Cb -0.01 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3fky h SER 275 CO -0.05 0.30 -0.08 0.11 -0.87 0.00 0.00 176.83 176.25 3fky h LYS 276 N 0.00 0.00 -0.36 4.77 6.56 -1.00 -3.32 116.57 123.23 3fky h LYS 276 Ca -0.00 0.00 -0.23 0.00 -1.06 0.00 0.00 60.65 59.36 3fky h LYS 276 Cb 0.63 0.00 -0.15 0.00 -0.57 0.00 0.00 32.23 32.14 3fky h LYS 276 CO 0.04 0.06 -0.32 0.54 -2.06 0.00 0.00 179.45 177.72 3fky n ARG 277 N -3.11 2.16 -0.25 3.15 1.74 -0.85 -4.76 116.66 114.74 3fky n ARG 277 Ca 0.04 -3.44 -0.03 0.00 -0.77 0.00 0.00 57.85 53.65 3fky n ARG 277 Cb 0.56 -1.87 0.09 0.00 -1.02 0.00 0.00 32.46 30.21 3fky n ARG 277 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3fky h HIS 278 N 1.29 0.82 -0.38 -1.55 2.76 -1.58 -2.06 115.15 114.44 3fky h HIS 278 Ca 0.20 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.32 3fky h HIS 278 Cb 1.39 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 30.07 3fky h HIS 278 CO 0.94 0.45 -0.08 0.00 -1.30 0.00 0.00 177.93 177.94 3fky h ALA 279 N 1.32 0.52 -0.46 5.26 0.00 -1.90 -0.84 119.26 123.16 3fky h ALA 279 Ca 0.30 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3fky h ALA 279 Cb 0.07 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3fky h ALA 279 CO -0.13 0.37 0.04 0.93 0.00 0.00 0.00 179.25 180.46 3fky h GLU 280 N 0.53 0.73 0.42 0.00 3.07 -1.88 -1.47 114.58 115.99 3fky h GLU 280 Ca 0.10 -0.17 -0.02 0.00 -0.50 0.00 0.00 59.36 58.76 3fky h GLU 280 Cb 0.59 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 3fky h GLU 280 CO 0.04 0.72 -0.20 0.45 -1.40 0.00 0.00 179.01 178.61 3fky h HIS 281 N 0.70 -0.52 -0.96 4.33 3.86 -1.25 -3.20 115.15 118.10 3fky h HIS 281 Ca 0.14 -0.01 0.31 0.00 -1.16 0.00 0.00 60.37 59.65 3fky h HIS 281 Cb 0.37 0.17 -0.16 0.00 1.06 0.00 0.00 27.41 28.86 3fky h HIS 281 CO 0.02 -0.21 0.39 0.82 0.86 0.00 0.00 177.93 179.81 3fky h ILE 282 N -1.00 0.21 -0.88 2.45 1.08 -1.04 0.39 117.51 118.73 3fky h ILE 282 Ca -0.06 -0.06 0.09 0.00 -0.39 0.00 0.00 64.86 64.44 3fky h ILE 282 Cb 0.55 0.01 -0.06 0.00 -3.07 0.00 0.00 36.82 34.25 3fky h ILE 282 CO 0.09 0.03 0.57 0.50 -0.69 0.00 0.00 178.15 178.66 3fky h LYS 283 N 0.18 0.88 0.00 2.37 3.64 -1.27 -3.34 116.57 119.03 3fky h LYS 283 Ca 0.68 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 60.01 3fky h LYS 283 Cb 1.55 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 33.17 3fky h LYS 283 CO -0.70 0.58 0.00 1.28 -2.27 0.00 0.00 179.45 178.34 3fky n LEU 284 N -4.52 0.00 0.00 5.20 4.77 0.13 -4.63 117.00 117.96 3fky n LEU 284 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3fky n LEU 284 Cb 0.28 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 3fky n LEU 284 CO 0.32 0.00 0.00 -1.22 -1.33 0.00 0.00 177.39 175.16 3fky n TYR 285 N 0.00 0.00 0.00 -1.77 0.53 -1.10 -4.60 117.16 110.23 3fky n TYR 285 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 3fky n TYR 285 Cb 0.00 -0.41 0.00 0.00 -1.03 0.00 0.00 39.34 37.90 3fky n TYR 285 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 3fky n GLY 286 N 0.60 3.03 3.86 2.72 0.00 -1.26 -1.17 105.19 112.97 3fky n GLY 286 Ca 0.00 -1.52 -0.31 0.00 0.00 0.00 0.00 46.02 44.19 3fky n GLY 286 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fky s SER 287 N 0.00 6.55 -1.01 1.61 1.04 -1.26 -3.37 113.70 117.26 3fky s SER 287 Ca 0.00 1.30 -0.12 0.00 0.48 0.00 0.00 55.95 57.61 3fky s SER 287 Cb 0.00 -2.40 0.12 0.00 0.10 0.00 0.00 66.02 63.84 3fky s SER 287 CO 0.00 -0.49 0.30 -0.90 0.98 0.00 0.00 173.24 173.13 3fky n ASP 288 N -1.46 -0.88 0.22 7.02 5.68 -1.26 -4.72 116.55 121.15 3fky n ASP 288 Ca 0.04 -0.68 0.15 0.00 -0.50 0.00 0.00 54.79 53.81 3fky n ASP 288 Cb 0.54 -0.86 0.66 0.00 -1.14 0.00 0.00 41.12 40.31 3fky n ASP 288 CO 0.00 0.00 0.00 -1.13 -1.33 0.00 0.00 177.20 174.74 3fky h ASN 289 N -0.47 0.00 -0.02 -1.12 -1.24 -1.90 -2.76 115.58 108.06 3fky h ASN 289 Ca -0.33 0.00 0.01 0.00 0.71 0.00 0.00 56.30 56.69 3fky h ASN 289 Cb 0.75 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.80 3fky h ASN 289 CO 0.48 0.00 0.03 -2.24 -1.29 0.00 0.00 177.43 174.41 3fky h ASP 290 N 0.00 0.00 -0.25 1.15 -0.00 -1.86 0.11 116.42 115.58 3fky h ASP 290 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3fky h ASP 290 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.69 3fky h ASP 290 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 179.24 180.39 3fky n MET 291 N -3.72 2.37 0.00 4.15 0.00 -1.04 -5.01 117.12 113.86 3fky n MET 291 Ca -0.02 -1.22 0.00 0.00 0.00 0.00 0.00 57.70 56.45 3fky n MET 291 Cb 0.11 -1.68 0.00 0.00 0.00 0.00 0.00 33.22 31.66 3fky n MET 291 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 3fky n ARG 292 N 0.28 0.77 -3.11 3.17 0.63 0.39 -4.75 116.66 114.03 3fky n ARG 292 Ca 0.11 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.65 3fky n ARG 292 Cb 0.54 -0.63 -0.06 0.00 0.45 0.00 0.00 32.46 32.77 3fky n ARG 292 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3fky s SER 301 N -1.99 7.13 0.36 6.15 0.15 -1.26 -5.02 113.70 119.23 3fky s SER 301 Ca 0.00 1.35 0.18 0.00 0.70 0.00 0.00 55.95 58.18 3fky s SER 301 Cb 0.00 -2.42 0.65 0.00 -1.71 0.00 0.00 66.02 62.54 3fky s SER 301 CO 0.00 0.12 1.72 0.24 1.20 0.00 0.00 173.24 176.52 3fky h MET 302 N 5.24 0.00 0.00 5.44 2.86 -1.95 -3.21 114.93 123.31 3fky h MET 302 Ca -0.46 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.06 3fky h MET 302 Cb 1.21 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.84 3fky h MET 302 CO 0.68 0.40 -1.77 0.25 1.06 0.00 0.00 176.91 177.53 3fky n THR 303 N -3.58 0.45 -3.32 2.22 -2.24 -1.26 -4.97 114.28 101.58 3fky n THR 303 Ca -0.00 -0.44 -0.38 0.00 -2.27 0.00 0.00 64.05 60.96 3fky n THR 303 Cb 0.52 -0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.45 3fky n THR 303 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fky s ALA 304 N -2.65 3.60 -0.13 6.98 0.00 -1.21 -5.02 121.76 123.32 3fky s ALA 304 Ca -0.06 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 51.88 3fky s ALA 304 Cb 0.06 -2.58 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 3fky s ALA 304 CO 0.56 0.42 -0.17 0.12 0.00 0.00 0.00 175.76 176.70 3fky s PHE 305 N -1.18 2.73 0.13 0.00 5.36 -1.26 -4.64 117.98 119.12 3fky s PHE 305 Ca 0.30 -0.93 -0.05 0.00 -0.96 0.00 0.00 56.93 55.29 3fky s PHE 305 Cb -0.18 -1.83 -0.02 0.00 -0.34 0.00 0.00 43.02 40.65 3fky s PHE 305 CO 0.18 -0.38 0.16 -1.54 -1.46 0.00 0.00 175.22 172.18 3fky s SER 306 N 0.55 0.19 0.04 6.13 1.04 -1.26 -4.97 113.70 115.42 3fky s SER 306 Ca -0.10 -0.95 -0.16 0.00 0.48 0.00 0.00 55.95 55.21 3fky s SER 306 Cb -0.16 0.35 0.03 0.00 0.10 0.00 0.00 66.02 66.33 3fky s SER 306 CO 0.04 -0.78 0.35 -0.94 0.98 0.00 0.00 173.24 172.89 3fky s SER 307 N -2.97 -0.20 0.00 7.02 1.04 -1.26 -0.51 113.70 116.82 3fky s SER 307 Ca 0.16 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.51 3fky s SER 307 Cb 0.05 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.56 3fky s SER 307 CO -0.03 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.18 3fky n GLY 308 N 0.62 0.77 3.76 7.32 0.00 -1.11 -5.00 105.19 111.55 3fky n GLY 308 Ca -0.19 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 3fky n GLY 308 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fky s VAL 309 N -2.00 2.90 -0.32 1.61 1.01 -1.26 -2.11 120.40 120.22 3fky s VAL 309 Ca 0.00 0.57 -0.09 0.00 0.00 0.00 0.00 61.98 62.46 3fky s VAL 309 Cb 0.00 -3.23 0.01 0.00 0.00 0.00 0.00 36.38 33.16 3fky s VAL 309 CO 0.00 -0.11 0.31 0.00 0.00 0.00 0.00 175.10 175.30 3fky n ALA 310 N -1.38 -1.77 -3.37 5.51 0.00 0.35 -4.83 120.51 115.02 3fky n ALA 310 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.39 3fky n ALA 310 Cb 0.50 -0.69 -0.08 0.00 0.00 0.00 0.00 19.45 19.18 3fky n ALA 310 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3fky s ASN 311 N -1.67 1.33 0.00 0.00 3.84 -1.26 -4.96 114.94 112.23 3fky s ASN 311 Ca 0.09 -1.53 0.11 0.00 0.21 0.00 0.00 52.86 51.74 3fky s ASN 311 Cb -0.01 0.50 0.63 0.00 -0.55 0.00 0.00 41.25 41.82 3fky s ASN 311 CO 0.44 -0.28 1.20 0.54 -2.79 0.00 0.00 177.10 176.21 3fky n ARG 312 N 4.35 0.74 -0.01 0.43 1.74 -1.26 -2.49 116.66 120.15 3fky n ARG 312 Ca 0.10 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.28 3fky n ARG 312 Cb 0.45 -1.22 -0.16 0.00 -1.02 0.00 0.00 32.46 30.51 3fky n ARG 312 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fky n GLY 313 N 0.34 -0.95 3.93 -0.13 0.00 -1.26 -5.01 105.19 102.10 3fky n GLY 313 Ca 0.08 -0.50 -0.27 0.00 0.00 0.00 0.00 46.02 45.33 3fky n GLY 313 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fky s SER 314 N -4.27 4.42 0.05 1.61 1.04 -1.04 -4.75 113.70 110.75 3fky s SER 314 Ca -0.06 0.42 -0.17 0.00 0.48 0.00 0.00 55.95 56.62 3fky s SER 314 Cb 0.14 -0.91 -0.19 0.00 0.10 0.00 0.00 66.02 65.15 3fky s SER 314 CO 0.87 -1.88 1.21 0.28 0.98 0.00 0.00 173.24 174.69 3fky h SER 315 N -0.87 0.67 -3.92 7.02 0.02 -1.13 -3.44 113.55 111.90 3fky h SER 315 Ca -0.44 -0.68 -0.62 0.00 -0.84 0.00 0.00 61.79 59.21 3fky h SER 315 Cb 1.30 -0.20 -0.31 0.00 0.14 0.00 0.00 62.40 63.33 3fky h SER 315 CO 0.56 1.25 -0.86 -0.63 -1.14 0.00 0.00 176.83 176.01 3fky s ILE 316 N -3.55 1.71 -0.11 3.27 -1.09 -0.87 -0.90 121.20 119.67 3fky s ILE 316 Ca -0.12 -0.87 0.03 0.00 -2.23 0.00 0.00 60.65 57.45 3fky s ILE 316 Cb 0.06 -1.46 0.01 0.00 -1.58 0.00 0.00 42.46 39.48 3fky s ILE 316 CO 0.85 0.48 -0.20 -0.60 -1.23 0.00 0.00 174.94 174.24 3fky s ARG 317 N -0.03 2.69 -0.31 2.79 3.52 0.90 -2.75 118.95 125.76 3fky s ARG 317 Ca -0.04 -0.75 -0.16 0.00 -0.13 0.00 0.00 55.73 54.65 3fky s ARG 317 Cb -0.13 -2.13 -0.02 0.00 -1.56 0.00 0.00 34.95 31.11 3fky s ARG 317 CO 0.03 0.06 0.41 0.42 -0.81 0.00 0.00 175.30 175.41 3fky s ILE 318 N 0.65 5.13 0.24 4.11 1.01 -0.90 -0.99 121.20 130.45 3fky s ILE 318 Ca -0.13 0.37 -0.31 0.00 0.00 0.00 0.00 60.65 60.58 3fky s ILE 318 Cb -0.16 -3.81 -0.13 0.00 0.01 0.00 0.00 42.46 38.37 3fky s ILE 318 CO 0.03 -0.01 1.44 -2.65 0.00 0.00 0.00 174.94 173.75 3fky n PRO 319 N 5.46 2.11 -0.33 2.79 -0.02 -1.26 -0.49 135.00 143.25 3fky n PRO 319 Ca -0.08 0.75 0.10 0.00 -2.02 0.00 0.00 63.50 62.25 3fky n PRO 319 Cb 0.50 -2.43 0.27 0.00 -0.02 0.00 0.00 33.50 31.82 3fky n PRO 319 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3fky h ARG 320 N 4.40 0.71 -0.24 -0.52 2.43 -1.95 -0.03 114.38 119.18 3fky h ARG 320 Ca -0.45 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 58.74 3fky h ARG 320 Cb 1.27 -0.16 -0.07 0.00 -0.42 0.00 0.00 29.97 30.58 3fky h ARG 320 CO 0.77 0.47 -0.30 0.77 -1.51 0.00 0.00 179.97 180.17 3fky h SER 321 N 0.74 -0.96 -0.08 -3.80 0.02 -1.99 0.13 113.55 107.60 3fky h SER 321 Ca 0.52 0.16 0.03 0.00 -0.84 0.00 0.00 61.79 61.66 3fky h SER 321 Cb 0.76 0.43 -0.03 0.00 0.14 0.00 0.00 62.40 63.69 3fky h SER 321 CO -0.36 -0.32 -0.11 0.58 -1.14 0.00 0.00 176.83 175.47 3fky h VAL 322 N -0.31 0.71 -0.12 2.27 2.07 -1.31 -2.13 116.25 117.43 3fky h VAL 322 Ca 0.13 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.69 3fky h VAL 322 Cb 0.52 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.94 3fky h VAL 322 CO -0.42 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 176.95 3fky h ALA 323 N 0.90 -0.19 -0.41 1.67 0.00 -0.80 0.62 119.26 121.05 3fky h ALA 323 Ca 0.07 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.09 3fky h ALA 323 Cb 0.24 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3fky h ALA 323 CO -0.17 -0.68 0.28 1.57 0.00 0.00 0.00 179.25 180.26 3fky h LYS 324 N -0.28 0.25 0.00 0.00 2.10 -0.58 -2.77 116.57 115.29 3fky h LYS 324 Ca 0.10 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.73 3fky h LYS 324 Cb 0.42 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 3fky h LYS 324 CO -0.28 0.16 -0.96 0.39 -2.00 0.00 0.00 179.45 176.77 3fky n GLU 325 N -4.47 0.06 -0.82 0.07 1.02 -0.75 -4.98 120.64 110.79 3fky n GLU 325 Ca 0.06 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 3fky n GLU 325 Cb 0.30 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 3fky n GLU 325 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3fky n GLY 326 N 1.47 0.80 3.51 0.62 0.00 0.14 -4.86 105.19 106.87 3fky n GLY 326 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 3fky n GLY 326 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3fky s TYR 327 N -3.06 -0.45 0.00 1.61 1.13 -1.20 -0.59 117.35 114.79 3fky s TYR 327 Ca 0.00 0.18 0.00 0.00 -1.41 0.00 0.00 57.07 55.84 3fky s TYR 327 Cb 0.00 0.58 0.00 0.00 -1.10 0.00 0.00 41.96 41.44 3fky s TYR 327 CO 0.00 -0.92 0.00 0.41 -2.51 0.00 0.00 175.55 172.53 3fky n GLY 328 N -0.39 0.26 3.39 5.49 0.00 0.64 -4.60 105.19 109.97 3fky n GLY 328 Ca -0.14 -0.51 -0.11 0.00 0.00 0.00 0.00 46.02 45.25 3fky n GLY 328 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3fky s TYR 329 N 0.00 0.87 0.25 1.61 -0.85 -1.26 -3.99 117.35 113.97 3fky s TYR 329 Ca 0.00 -1.13 0.10 0.00 -0.52 0.00 0.00 57.07 55.52 3fky s TYR 329 Cb 0.00 -0.22 -0.05 0.00 0.38 0.00 0.00 41.96 42.07 3fky s TYR 329 CO 0.00 -0.84 -0.16 -0.59 -1.52 0.00 0.00 175.55 172.44 3fky s PHE 330 N -3.95 2.02 -0.27 -3.49 -0.12 -0.66 -4.54 117.98 106.97 3fky s PHE 330 Ca 0.32 -0.47 -0.04 0.00 -0.05 0.00 0.00 56.93 56.69 3fky s PHE 330 Cb 0.03 -0.93 0.01 0.00 -0.63 0.00 0.00 43.02 41.51 3fky s PHE 330 CO 0.12 0.53 0.01 -2.00 -0.05 0.00 0.00 175.22 173.83 3fky s GLU 331 N -3.59 3.02 -0.45 1.99 2.12 -0.16 -1.11 118.70 120.52 3fky s GLU 331 Ca 0.27 -0.88 -0.23 0.00 0.36 0.00 0.00 54.97 54.48 3fky s GLU 331 Cb -0.02 -3.18 0.03 0.00 0.26 0.00 0.00 34.13 31.22 3fky s GLU 331 CO 0.11 -0.40 0.81 0.34 -0.54 0.00 0.00 175.26 175.58 3fky s ASP 332 N 1.43 6.42 0.00 -1.70 -1.08 0.20 -0.07 116.67 121.87 3fky s ASP 332 Ca 0.02 -0.09 0.20 0.00 -0.52 0.00 0.00 52.55 52.15 3fky s ASP 332 Cb -0.17 -2.40 0.59 0.00 -1.46 0.00 0.00 42.92 39.49 3fky s ASP 332 CO -0.01 -0.94 1.46 0.54 0.52 0.00 0.00 175.17 176.74 3fky n ARG 333 N 6.80 1.97 0.05 4.34 1.74 -0.08 -1.91 116.66 129.58 3fky n ARG 333 Ca 0.03 -1.48 -0.21 0.00 -0.77 0.00 0.00 57.85 55.42 3fky n ARG 333 Cb 0.48 -1.41 -0.11 0.00 -1.02 0.00 0.00 32.46 30.40 3fky n ARG 333 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3fky h ARG 334 N 2.80 0.69 -6.87 5.56 3.08 -1.90 -3.45 114.38 114.29 3fky h ARG 334 Ca 0.00 -0.78 -0.53 0.00 0.07 0.00 0.00 59.98 58.74 3fky h ARG 334 Cb 0.62 0.23 0.09 0.00 0.08 0.00 0.00 29.97 30.99 3fky h ARG 334 CO 0.00 1.35 0.79 -2.14 -1.07 0.00 0.00 179.97 178.89 3fky s PRO 335 N -3.23 4.17 0.63 0.04 0.02 -1.26 -4.93 135.00 130.43 3fky s PRO 335 Ca -0.10 2.49 -0.08 0.00 0.02 0.00 0.00 61.00 63.33 3fky s PRO 335 Cb 0.07 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.57 3fky s PRO 335 CO 0.93 -0.50 0.97 0.00 -0.33 0.00 0.00 177.00 178.07 3fky s ALA 336 N -0.64 3.15 0.40 -1.55 0.00 -0.32 -1.13 121.76 121.67 3fky s ALA 336 Ca 0.56 -0.52 0.15 0.00 0.00 0.00 0.00 51.96 52.15 3fky s ALA 336 Cb -0.45 -2.78 1.01 0.00 0.00 0.00 0.00 23.12 20.90 3fky s ALA 336 CO 0.54 -0.89 1.87 1.03 0.00 0.00 0.00 175.76 178.32 3fky h SER 337 N -0.33 0.47 -0.23 0.00 0.87 -1.17 -2.34 113.55 110.81 3fky h SER 337 Ca -0.45 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 3fky h SER 337 Cb 1.25 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 3fky h SER 337 CO 0.62 0.21 0.00 -0.46 -0.53 0.00 0.00 176.83 176.67 3fky n ASN 338 N -4.53 2.11 -4.76 6.23 6.94 -0.94 -4.79 115.26 115.52 3fky n ASN 338 Ca 0.18 -2.18 -0.34 0.00 -0.02 0.00 0.00 54.58 52.22 3fky n ASN 338 Cb 0.62 -0.39 0.04 0.00 -2.36 0.00 0.00 39.78 37.68 3fky n ASN 338 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 3fky s ILE 339 N -1.64 3.05 -0.40 1.53 1.10 -0.88 -4.84 121.20 119.12 3fky s ILE 339 Ca 0.19 0.56 -0.22 0.00 -0.51 0.00 0.00 60.65 60.67 3fky s ILE 339 Cb 0.12 -3.13 0.01 0.00 0.15 0.00 0.00 42.46 39.62 3fky s ILE 339 CO 0.09 -0.23 0.70 -0.62 -2.11 0.00 0.00 174.94 172.77 3fky s ASP 340 N -2.14 6.42 0.36 4.50 -1.08 -1.26 -4.96 116.67 118.51 3fky s ASP 340 Ca 0.71 0.01 0.13 0.00 -0.52 0.00 0.00 52.55 52.88 3fky s ASP 340 Cb -0.24 -2.35 0.94 0.00 -1.46 0.00 0.00 42.92 39.81 3fky s ASP 340 CO 0.36 -0.74 1.80 1.55 0.52 0.00 0.00 175.17 178.65 3fky h PRO 341 N 8.69 0.55 -0.52 4.34 0.13 -1.94 0.10 132.00 143.35 3fky h PRO 341 Ca -0.25 -0.03 0.06 0.00 -0.87 0.00 0.00 66.00 64.90 3fky h PRO 341 Cb 1.10 -0.12 -0.05 0.00 0.13 0.00 0.00 31.00 32.05 3fky h PRO 341 CO 0.89 0.36 0.23 1.88 -0.23 0.00 0.00 178.00 181.13 3fky h TYR 342 N 0.56 0.41 -0.27 1.56 0.05 -1.90 0.26 116.97 117.64 3fky h TYR 342 Ca 0.56 0.02 -0.07 0.00 0.05 0.00 0.00 58.73 59.29 3fky h TYR 342 Cb 1.15 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 38.77 3fky h TYR 342 CO -0.00 0.17 -0.11 -0.07 -1.05 0.00 0.00 178.16 177.10 3fky h LEU 343 N 0.44 0.57 0.39 3.88 3.38 -1.11 -0.02 115.31 122.83 3fky h LEU 343 Ca 0.24 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 3fky h LEU 343 Cb 0.20 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3fky h LEU 343 CO -0.20 0.84 -0.19 0.58 0.09 0.00 0.00 178.44 179.56 3fky h VAL 344 N 0.30 0.57 -0.54 1.22 2.07 -1.10 -1.13 116.25 117.64 3fky h VAL 344 Ca 0.06 -0.48 -0.05 0.00 0.82 0.00 0.00 66.70 67.05 3fky h VAL 344 Cb 0.61 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3fky h VAL 344 CO 0.04 0.08 0.15 0.71 0.02 0.00 0.00 177.57 178.57 3fky h THR 345 N -0.82 1.22 0.49 2.57 1.35 -0.57 -0.61 112.91 116.54 3fky h THR 345 Ca -0.05 -0.77 -0.02 0.00 -0.55 0.00 0.00 66.41 65.02 3fky h THR 345 Cb 0.54 0.64 -0.01 0.00 -1.73 0.00 0.00 68.15 67.58 3fky h THR 345 CO 0.09 0.29 -0.38 1.23 -0.25 0.00 0.00 175.52 176.49 3fky h GLY 346 N 0.96 -1.12 2.00 5.82 0.00 -0.98 -1.79 103.07 107.95 3fky h GLY 346 Ca 0.18 0.49 -0.04 0.00 0.00 0.00 0.00 47.33 47.97 3fky h GLY 346 CO -0.01 -0.36 -0.18 1.19 0.00 0.00 0.00 176.54 177.19 3fky h ILE 347 N -0.84 0.73 -0.23 2.60 2.10 -1.09 -0.88 117.51 119.89 3fky h ILE 347 Ca -0.06 -0.72 -0.02 0.00 1.08 0.00 0.00 64.86 65.14 3fky h ILE 347 Cb 0.70 1.44 -0.01 0.00 -1.09 0.00 0.00 36.82 37.86 3fky h ILE 347 CO 0.01 0.17 0.08 -0.03 -1.08 0.00 0.00 178.15 177.30 3fky h MET 348 N 0.00 0.36 -0.24 2.19 4.05 -0.96 -1.56 114.93 118.77 3fky h MET 348 Ca -0.00 -0.08 -0.01 0.00 -0.28 0.00 0.00 59.70 59.33 3fky h MET 348 Cb 0.43 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.16 3fky h MET 348 CO 0.02 0.44 0.12 0.00 0.23 0.00 0.00 176.91 177.72 3fky h GLU 350 N 0.26 0.16 0.00 0.00 4.81 -0.92 0.35 114.58 119.24 3fky h GLU 350 Ca 0.08 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.22 3fky h GLU 350 Cb 0.12 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 3fky h GLU 350 CO -0.01 0.11 -1.28 0.25 -0.73 0.00 0.00 179.01 177.34 3fky n THR 351 N -5.24 0.83 0.05 0.32 -2.24 -0.61 -1.48 114.28 105.92 3fky n THR 351 Ca 0.11 -0.61 -0.23 0.00 -2.27 0.00 0.00 64.05 61.05 3fky n THR 351 Cb 0.39 -0.48 -0.15 0.00 -2.10 0.00 0.00 70.33 67.99 3fky n THR 351 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 3fky h VAL 352 N 0.00 0.88 0.00 2.28 2.07 -0.73 -3.40 116.25 117.36 3fky h VAL 352 Ca -0.08 -2.47 -0.24 0.00 0.82 0.00 0.00 66.70 64.73 3fky h VAL 352 Cb 1.27 2.71 -0.05 0.00 -1.52 0.00 0.00 31.29 33.71 3fky h VAL 352 CO 0.02 0.85 -2.18 0.00 0.02 0.00 0.00 177.57 176.28 3fky n GLY 354 N 1.57 4.06 3.50 0.00 0.00 -0.55 -5.03 105.19 108.74 3fky n GLY 354 Ca -0.22 -1.28 -0.28 0.00 0.00 0.00 0.00 46.02 44.24 3fky n GLY 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fky s ALA 355 N -0.82 -0.38 0.01 4.61 0.00 -0.92 -4.61 121.76 119.65 3fky s ALA 355 Ca 0.00 -0.25 0.01 0.00 0.00 0.00 0.00 51.96 51.72 3fky s ALA 355 Cb 0.00 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 3fky s ALA 355 CO 0.00 -3.80 -0.03 0.42 0.00 0.00 0.00 175.76 172.35 3fky s ILE 356 N -2.53 0.17 -0.50 0.00 1.01 -1.26 -5.00 121.20 113.09 3fky s ILE 356 Ca 0.68 -0.40 0.26 0.00 0.00 0.00 0.00 60.65 61.19 3fky s ILE 356 Cb -0.23 -0.21 0.30 0.00 0.01 0.00 0.00 42.46 42.32 3fky s ILE 356 CO 0.63 -0.15 1.76 -2.24 0.00 0.00 0.00 174.94 174.95 3fky h ASP 357 N 5.55 0.00 1.66 3.58 2.03 -2.04 -2.87 116.42 124.33 3fky h ASP 357 Ca -0.28 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.01 3fky h ASP 357 Cb 1.21 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.70 3fky h ASP 357 CO 0.47 0.00 -0.05 -1.13 -1.03 0.00 0.00 179.24 177.50 3fky h ASN 358 N 0.00 0.00 -4.55 4.15 -1.24 -2.02 -3.46 115.58 108.46 3fky h ASN 358 Ca 0.00 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.93 3fky h ASN 358 Cb 0.64 0.00 -0.21 0.00 0.73 0.00 0.00 38.32 39.48 3fky h ASN 358 CO 0.00 0.05 -0.02 0.00 -1.29 0.00 0.00 177.43 176.17 3fky s ALA 359 N -3.33 -1.38 -0.25 1.57 0.00 -1.08 -5.09 121.76 112.21 3fky s ALA 359 Ca 0.05 1.20 -0.01 0.00 0.00 0.00 0.00 51.96 53.20 3fky s ALA 359 Cb 0.06 -0.37 0.07 0.00 0.00 0.00 0.00 23.12 22.89 3fky s ALA 359 CO 0.64 -0.30 0.02 0.34 0.00 0.00 0.00 175.76 176.47 3fky s ASP 360 N -0.60 3.62 0.10 0.00 -1.08 -1.26 -3.99 116.67 113.47 3fky s ASP 360 Ca -0.07 -1.23 -0.23 0.00 -0.52 0.00 0.00 52.55 50.51 3fky s ASP 360 Cb -0.03 -0.91 -0.10 0.00 -1.46 0.00 0.00 42.92 40.42 3fky s ASP 360 CO 0.05 -0.32 1.71 0.24 0.52 0.00 0.00 175.17 177.37 3fky h MET 361 N 8.08 -0.09 -0.25 4.34 2.86 -1.94 -1.27 114.93 126.66 3fky h MET 361 Ca -0.15 0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.44 3fky h MET 361 Cb 1.07 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.74 3fky h MET 361 CO 0.41 -0.06 -0.07 0.00 1.06 0.00 0.00 176.91 178.25 3fky h THR 362 N -0.09 1.19 -0.59 2.22 1.03 -1.96 -0.75 112.91 113.97 3fky h THR 362 Ca 0.03 -0.79 -0.09 0.00 -0.01 0.00 0.00 66.41 65.55 3fky h THR 362 Cb 0.14 1.08 -0.02 0.00 -1.07 0.00 0.00 68.15 68.27 3fky h THR 362 CO -0.08 0.26 0.02 0.11 -0.01 0.00 0.00 175.52 175.82 3fky h LYS 363 N 0.38 1.01 -5.10 0.00 1.57 -1.87 -3.36 116.57 109.19 3fky h LYS 363 Ca 0.08 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.54 3fky h LYS 363 Cb 0.36 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 3fky h LYS 363 CO 0.02 0.97 0.33 -1.91 -0.57 0.00 0.00 179.45 178.29 3fky n GLU 364 N -4.19 0.14 -2.71 3.15 4.07 -0.29 -4.21 120.64 116.60 3fky n GLU 364 Ca 0.03 -1.12 -0.05 0.00 -0.06 0.00 0.00 57.16 55.97 3fky n GLU 364 Cb 0.32 -3.11 0.04 0.00 -0.06 0.00 0.00 31.44 28.63 3fky n GLU 364 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 3fky n PHE 365 N 15.73 -1.96 -0.03 4.31 3.01 -1.26 -4.99 117.46 132.28 3fky n PHE 365 Ca 0.35 -1.08 0.00 0.00 1.01 0.00 0.00 57.45 57.73 3fky n PHE 365 Cb 0.45 1.29 0.00 0.00 -0.01 0.00 0.00 39.48 41.21 3fky n PHE 365 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92