#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 3.16 3.98 5.14 0.00 -1.26 -5.05 105.19 111.17 3fky n GLY 22 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.42 2.34 0.03 1.61 0.52 -1.26 -4.60 118.95 117.17 3fky s ARG 23 Ca 0.00 -0.95 0.06 0.00 -0.52 0.00 0.00 55.73 54.32 3fky s ARG 23 Cb 0.00 -2.48 -0.02 0.00 0.52 0.00 0.00 34.95 32.97 3fky s ARG 23 CO 0.00 -0.87 -0.17 0.42 0.02 0.00 0.00 175.30 174.70 3fky s ILE 24 N -2.82 1.39 -0.18 1.52 -1.09 -0.41 -4.96 121.20 114.66 3fky s ILE 24 Ca 0.60 -1.05 -0.05 0.00 -2.23 0.00 0.00 60.65 57.92 3fky s ILE 24 Cb -0.09 -1.22 -0.03 0.00 -1.58 0.00 0.00 42.46 39.54 3fky s ILE 24 CO 0.39 0.15 -0.01 -0.63 -1.23 0.00 0.00 174.94 173.61 3fky s ILE 25 N -0.76 3.96 -0.24 2.92 1.01 -1.26 0.37 121.20 127.20 3fky s ILE 25 Ca 0.05 -0.32 -0.03 0.00 0.00 0.00 0.00 60.65 60.34 3fky s ILE 25 Cb -0.08 -2.77 0.01 0.00 0.01 0.00 0.00 42.46 39.63 3fky s ILE 25 CO 0.01 0.46 -0.03 0.00 0.00 0.00 0.00 174.94 175.38 3fky s ALA 26 N 0.70 2.81 -0.29 9.38 0.00 0.00 -1.41 121.76 132.96 3fky s ALA 26 Ca -0.01 -1.33 -0.20 0.00 0.00 0.00 0.00 51.96 50.42 3fky s ALA 26 Cb -0.14 -1.77 -0.01 0.00 0.00 0.00 0.00 23.12 21.20 3fky s ALA 26 CO 0.02 -0.66 0.64 -2.00 0.00 0.00 0.00 175.76 173.76 3fky s GLU 27 N 1.42 3.98 -0.06 0.00 2.56 -0.22 -1.33 118.70 125.04 3fky s GLU 27 Ca 0.03 0.40 -0.24 0.00 0.00 0.00 0.00 54.97 55.17 3fky s GLU 27 Cb -0.16 -3.70 -0.04 0.00 2.00 0.00 0.00 34.13 32.24 3fky s GLU 27 CO -0.03 -0.52 0.72 0.71 -0.56 0.00 0.00 175.26 175.58 3fky s TYR 28 N 2.59 3.58 -0.05 5.30 1.51 0.56 0.35 117.35 131.19 3fky s TYR 28 Ca 0.26 1.28 0.06 0.00 -1.01 0.00 0.00 57.07 57.66 3fky s TYR 28 Cb -0.15 -2.83 -0.01 0.00 -0.11 0.00 0.00 41.96 38.86 3fky s TYR 28 CO 0.11 0.08 -0.24 0.08 -1.11 0.00 0.00 175.55 174.46 3fky s VAL 29 N 0.82 1.98 0.29 0.71 1.01 0.74 -2.21 120.40 123.74 3fky s VAL 29 Ca 0.39 -1.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.31 3fky s VAL 29 Cb -0.18 -1.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 3fky s VAL 29 CO 0.19 0.55 0.36 -1.66 0.00 0.00 0.00 175.10 174.54 3fky s TRP 30 N -0.16 1.04 -0.14 5.22 -2.14 0.11 -0.81 118.94 122.05 3fky s TRP 30 Ca -0.03 -1.25 -0.05 0.00 2.66 0.00 0.00 56.10 57.43 3fky s TRP 30 Cb -0.13 -0.23 -0.04 0.00 -3.10 0.00 0.00 33.47 29.97 3fky s TRP 30 CO 0.03 -0.95 0.04 0.42 -2.66 0.00 0.00 176.95 173.84 3fky s ILE 31 N -3.59 4.65 0.09 0.66 1.01 -1.26 -0.54 121.20 122.21 3fky s ILE 31 Ca 0.32 -0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.89 3fky s ILE 31 Cb 0.02 -3.03 0.01 0.00 0.01 0.00 0.00 42.46 39.47 3fky s ILE 31 CO 0.17 0.53 0.12 -0.90 0.00 0.00 0.00 174.94 174.86 3fky n ASP 32 N 2.85 0.42 -0.32 3.58 5.75 -0.68 -4.92 116.55 123.23 3fky n ASP 32 Ca -0.18 -1.24 0.07 0.00 -0.01 0.00 0.00 54.79 53.43 3fky n ASP 32 Cb 0.53 -0.06 0.29 0.00 -1.03 0.00 0.00 41.12 40.86 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 3.92 -0.22 0.00 6.12 0.00 -0.58 -4.64 105.19 109.80 3fky n GLY 33 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.08 0.00 -1.13 2.61 -2.24 -1.26 -4.89 114.28 107.28 3fky n THR 34 Ca 0.11 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.65 3fky n THR 34 Cb 0.19 -0.25 0.15 0.00 -2.10 0.00 0.00 70.33 68.32 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 4.63 3.56 3.38 0.00 -1.26 -4.99 105.19 115.51 3fky n GLY 35 Ca 0.00 -1.27 -0.26 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.25 3.51 0.32 1.61 -0.87 -1.26 -4.99 114.94 112.01 3fky s ASN 36 Ca 0.55 -1.33 -0.06 0.00 -1.57 0.00 0.00 52.86 50.46 3fky s ASN 36 Cb 0.46 -0.32 -0.05 0.00 -0.02 0.00 0.00 41.25 41.32 3fky s ASN 36 CO 0.08 -0.42 0.61 -0.76 -2.57 0.00 0.00 177.10 174.04 3fky s LEU 37 N -3.63 3.99 0.09 0.60 2.01 -1.26 -1.69 118.68 118.79 3fky s LEU 37 Ca 0.34 0.80 0.03 0.00 0.01 0.00 0.00 54.13 55.31 3fky s LEU 37 Cb 0.08 -3.64 -0.03 0.00 0.01 0.00 0.00 46.19 42.61 3fky s LEU 37 CO 0.17 -0.26 -0.09 -0.13 1.01 0.00 0.00 176.35 177.05 3fky s ARG 38 N -3.70 0.78 0.07 1.70 1.81 0.30 -4.88 118.95 115.02 3fky s ARG 38 Ca 0.45 -1.10 -0.19 0.00 -1.72 0.00 0.00 55.73 53.17 3fky s ARG 38 Cb -0.11 -0.43 0.04 0.00 -0.45 0.00 0.00 34.95 34.00 3fky s ARG 38 CO 0.31 0.06 0.45 -1.54 -0.68 0.00 0.00 175.30 173.90 3fky s SER 39 N -2.36 -0.33 0.12 0.23 1.04 -1.26 -0.71 113.70 110.43 3fky s SER 39 Ca 0.03 -0.02 -0.07 0.00 0.48 0.00 0.00 55.95 56.37 3fky s SER 39 Cb -0.03 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.54 3fky s SER 39 CO -0.01 -0.73 0.20 -1.59 0.98 0.00 0.00 173.24 172.09 3fky s LYS 40 N -2.82 0.97 0.12 4.02 -2.85 -0.94 -5.00 119.74 113.24 3fky s LYS 40 Ca -0.03 -1.12 0.10 0.00 -1.00 0.00 0.00 55.97 53.92 3fky s LYS 40 Cb -0.00 0.34 -0.04 0.00 -2.06 0.00 0.00 37.83 36.07 3fky s LYS 40 CO -0.05 -0.32 -0.22 0.20 0.10 0.00 0.00 175.35 175.06 3fky s GLY 41 N -2.93 1.63 0.01 0.59 0.00 -1.26 -0.32 107.32 105.03 3fky s GLY 41 Ca 0.12 -1.39 0.02 0.00 0.00 0.00 0.00 44.72 43.47 3fky s GLY 41 CO -0.05 -1.36 -0.07 1.09 0.00 0.00 0.00 173.10 172.71 3fky s ARG 42 N -2.03 0.51 0.31 2.90 1.70 -0.44 -4.98 118.95 116.91 3fky s ARG 42 Ca 0.16 -0.43 -0.28 0.00 -0.47 0.00 0.00 55.73 54.70 3fky s ARG 42 Cb -0.10 -0.41 -0.09 0.00 -0.57 0.00 0.00 34.95 33.77 3fky s ARG 42 CO 0.08 0.10 1.10 0.99 -1.08 0.00 0.00 175.30 176.49 3fky s THR 43 N -0.62 3.48 0.09 4.99 2.01 -1.26 -0.82 115.64 123.51 3fky s THR 43 Ca -0.02 1.41 0.08 0.00 0.31 0.00 0.00 61.69 63.48 3fky s THR 43 Cb -0.05 -3.87 -0.03 0.00 0.01 0.00 0.00 72.50 68.56 3fky s THR 43 CO 0.00 0.28 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.23 3fky s LEU 44 N -1.73 2.26 0.40 4.42 1.43 0.16 -4.93 118.68 120.69 3fky s LEU 44 Ca 0.48 -0.64 0.12 0.00 -1.03 0.00 0.00 54.13 53.06 3fky s LEU 44 Cb -0.30 -0.99 0.83 0.00 0.03 0.00 0.00 46.19 45.75 3fky s LEU 44 CO 0.39 0.12 1.90 0.11 0.23 0.00 0.00 176.35 179.10 3fky h LYS 45 N 4.32 0.07 -3.53 1.70 1.79 -1.93 -1.07 116.57 117.91 3fky h LYS 45 Ca -0.46 -0.02 -0.11 0.00 -2.18 0.00 0.00 60.65 57.88 3fky h LYS 45 Cb 1.17 -0.01 -0.17 0.00 -1.58 0.00 0.00 32.23 31.64 3fky h LYS 45 CO 0.41 0.31 -0.39 0.21 -1.08 0.00 0.00 179.45 178.92 3fky s LYS 46 N -4.48 0.69 0.31 3.15 2.20 -1.26 -4.47 119.74 115.88 3fky s LYS 46 Ca -0.04 -0.60 -0.27 0.00 -0.36 0.00 0.00 55.97 54.69 3fky s LYS 46 Cb 0.15 0.29 -0.14 0.00 -1.51 0.00 0.00 37.83 36.62 3fky s LYS 46 CO 0.72 -0.20 0.99 -2.13 -0.36 0.00 0.00 175.35 174.37 3fky n ARG 47 N 0.72 1.31 -3.55 4.03 0.63 -1.26 -4.76 116.66 113.79 3fky n ARG 47 Ca -0.19 0.46 -0.38 0.00 -0.92 0.00 0.00 57.85 56.82 3fky n ARG 47 Cb 0.59 -1.84 -0.06 0.00 0.45 0.00 0.00 32.46 31.60 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 -1.10 5.10 0.00 5.15 -1.09 -1.26 -4.98 121.20 123.03 3fky s ILE 48 Ca 0.59 0.75 0.00 0.00 -2.23 0.00 0.00 60.65 59.77 3fky s ILE 48 Cb -0.68 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 36.52 3fky s ILE 48 CO 0.60 0.57 0.20 0.35 -1.23 0.00 0.00 174.94 175.43 3fky n THR 49 N 1.92 0.00 -3.53 2.92 -2.24 -1.26 -5.07 114.28 107.03 3fky n THR 49 Ca -0.15 -0.33 -0.17 0.00 -2.27 0.00 0.00 64.05 61.14 3fky n THR 49 Cb 0.53 1.21 -0.06 0.00 -2.10 0.00 0.00 70.33 69.91 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 -0.26 -0.61 0.54 3.42 1.04 -1.26 -5.02 113.70 111.56 3fky s SER 50 Ca 0.00 0.65 0.36 0.00 0.48 0.00 0.00 55.95 57.44 3fky s SER 50 Cb 0.00 0.50 1.54 0.00 0.10 0.00 0.00 66.02 68.16 3fky s SER 50 CO 0.00 -0.57 1.82 0.40 0.98 0.00 0.00 173.24 175.87 3fky h ILE 51 N 2.91 0.43 0.00 -1.02 2.04 -1.97 -0.25 117.51 119.65 3fky h ILE 51 Ca -0.26 -0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 3fky h ILE 51 Cb 1.15 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.66 3fky h ILE 51 CO 0.38 0.00 -0.05 0.44 0.00 0.00 0.00 178.15 178.92 3fky h ASP 52 N 0.00 0.00 1.38 1.72 3.32 -1.98 -1.67 116.42 119.18 3fky h ASP 52 Ca 0.54 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.59 3fky h ASP 52 Cb 2.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.71 3fky h ASP 52 CO -0.01 0.05 0.00 1.56 -1.72 0.00 0.00 179.24 179.12 3fky h GLN 53 N 0.00 0.00 -6.17 3.56 4.20 -1.45 -3.44 115.11 111.80 3fky h GLN 53 Ca -0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 3fky h GLN 53 Cb 0.10 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 3fky h GLN 53 CO 0.01 0.00 0.68 -0.51 -0.67 0.00 0.00 178.83 178.34 3fky s LEU 54 N -5.37 4.18 0.59 1.46 1.43 -0.63 -5.03 118.68 115.31 3fky s LEU 54 Ca 0.06 1.46 -0.17 0.00 -1.03 0.00 0.00 54.13 54.45 3fky s LEU 54 Cb 0.09 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.72 3fky s LEU 54 CO 0.56 -0.55 1.10 -2.16 0.23 0.00 0.00 176.35 175.53 3fky s PRO 55 N 2.58 3.20 1.04 1.29 0.04 -1.26 -4.82 135.00 137.06 3fky s PRO 55 Ca 0.46 1.43 -0.12 0.00 0.04 0.00 0.00 61.00 62.81 3fky s PRO 55 Cb -0.17 -2.00 0.21 0.00 0.04 0.00 0.00 34.50 32.58 3fky s PRO 55 CO 0.12 -0.94 1.07 -1.21 0.04 0.00 0.00 177.00 176.09 3fky s GLU 56 N -3.71 0.10 0.19 4.56 2.02 -1.26 -4.65 118.70 115.94 3fky s GLU 56 Ca 0.68 0.93 -0.07 0.00 0.02 0.00 0.00 54.97 56.54 3fky s GLU 56 Cb -0.20 -1.67 0.03 0.00 0.10 0.00 0.00 34.13 32.39 3fky s GLU 56 CO 0.33 -3.07 0.36 1.87 0.02 0.00 0.00 175.26 174.78 3fky n TRP 57 N -4.47 -1.60 -3.83 1.61 -0.00 -0.82 -4.96 117.44 103.37 3fky n TRP 57 Ca 0.06 -0.89 -0.07 0.00 -0.00 0.00 0.00 57.50 56.60 3fky n TRP 57 Cb 0.54 0.43 -0.00 0.00 -0.00 0.00 0.00 31.31 32.28 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 -1.98 -0.15 0.33 5.87 4.22 -1.26 0.16 114.94 122.14 3fky s ASN 58 Ca 0.08 -0.75 -0.16 0.00 -2.14 0.00 0.00 52.86 49.88 3fky s ASN 58 Cb -0.02 0.72 0.03 0.00 1.28 0.00 0.00 41.25 43.26 3fky s ASN 58 CO 0.06 -1.37 0.72 0.72 -2.04 0.00 0.00 177.10 175.19 3fky s PHE 59 N -3.20 0.10 -0.77 1.54 -0.12 -0.45 -4.92 117.98 110.14 3fky s PHE 59 Ca 0.13 -0.64 -0.23 0.00 -0.05 0.00 0.00 56.93 56.14 3fky s PHE 59 Cb -0.05 0.68 0.07 0.00 -0.63 0.00 0.00 43.02 43.09 3fky s PHE 59 CO 0.08 -1.38 1.13 0.34 -0.05 0.00 0.00 175.22 175.34 3fky s ASP 60 N -3.02 6.30 0.57 1.98 -1.08 -1.26 -1.81 116.67 118.34 3fky s ASP 60 Ca 0.15 -1.12 0.38 0.00 -0.52 0.00 0.00 52.55 51.45 3fky s ASP 60 Cb -0.05 -2.47 2.05 0.00 -1.46 0.00 0.00 42.92 40.99 3fky s ASP 60 CO 0.10 -1.47 2.17 1.23 0.52 0.00 0.00 175.17 177.73 3fky h GLY 61 N 11.75 0.00 2.00 2.66 0.00 -1.88 -0.94 103.07 116.66 3fky h GLY 61 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.19 3fky h GLY 61 CO 1.22 0.00 0.00 1.48 0.00 0.00 0.00 176.54 179.24 3fky h SER 62 N 0.00 0.00 0.11 0.19 4.64 -1.90 0.11 113.55 116.71 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 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3fky h SER 62 CO 0.00 0.00 -0.13 -1.20 -0.87 0.00 0.00 176.83 174.63 3fky n SER 63 N -2.94 1.26 0.00 4.97 7.64 -0.36 -4.01 113.62 120.19 3fky n SER 63 Ca 0.03 -1.19 0.00 0.00 1.01 0.00 0.00 58.87 58.72 3fky n SER 63 Cb 0.45 0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 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 -0.24 0.60 -3.11 0.44 -2.24 -1.06 -5.03 114.28 103.65 3fky n THR 64 Ca 0.16 -0.61 -0.13 0.00 -2.27 0.00 0.00 64.05 61.20 3fky n THR 64 Cb 0.35 0.71 0.07 0.00 -2.10 0.00 0.00 70.33 69.36 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 -0.30 -2.13 0.00 3.42 2.85 -0.96 -1.52 115.26 116.63 3fky n ASN 65 Ca 0.00 -0.49 0.00 0.00 -0.11 0.00 0.00 54.58 53.98 3fky n ASN 65 Cb 0.34 -4.12 0.00 0.00 1.24 0.00 0.00 39.78 37.24 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 -3.43 2.28 -3.99 1.20 6.02 0.34 -3.65 117.38 116.14 3fky n GLN 66 Ca -0.22 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.67 3fky n GLN 66 Cb 0.63 -0.20 -0.07 0.00 1.02 0.00 0.00 30.24 31.62 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 -0.32 0.11 -0.29 -1.58 0.00 -0.88 -4.79 121.76 114.00 3fky s ALA 67 Ca 0.00 -0.97 0.23 0.00 0.00 0.00 0.00 51.96 51.21 3fky s ALA 67 Cb 0.00 0.90 -0.04 0.00 0.00 0.00 0.00 23.12 23.98 3fky s ALA 67 CO 0.00 -0.65 0.94 -2.30 0.00 0.00 0.00 175.76 173.75 3fky n PRO 68 N -0.22 0.53 0.00 0.00 -0.02 -1.26 -3.98 135.00 130.05 3fky n PRO 68 Ca -0.06 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 3fky n PRO 68 Cb 0.63 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 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 1.25 1.79 0.00 -1.23 0.00 -1.26 -4.89 105.19 100.84 3fky n GLY 69 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.81 0.00 0.00 1.61 -0.00 -1.26 -4.79 115.22 109.96 3fky n HIS 70 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 3fky n HIS 70 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 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 71 N 0.00 0.00 -3.09 4.39 2.03 -1.26 -4.23 116.55 114.39 3fky n ASP 71 Ca 0.00 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.30 3fky n ASP 71 Cb 0.00 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 3fky n ASP 71 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 3fky n SER 72 N -0.36 -0.76 -1.75 1.67 3.41 -1.26 -4.66 113.62 109.92 3fky n SER 72 Ca 0.00 -0.03 -0.00 0.00 -0.26 0.00 0.00 58.87 58.58 3fky n SER 72 Cb 0.00 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 3fky n SER 72 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3fky n ASP 73 N -0.48 -3.21 -4.72 4.04 2.03 -1.26 -4.87 116.55 108.08 3fky n ASP 73 Ca 0.00 0.27 -0.25 0.00 0.52 0.00 0.00 54.79 55.33 3fky n ASP 73 Cb 0.02 -1.88 -0.07 0.00 -0.72 0.00 0.00 41.12 38.48 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 -0.42 3.99 0.08 5.18 1.09 -0.75 -4.48 121.20 125.88 3fky s ILE 74 Ca 0.00 -1.38 0.03 0.00 -1.10 0.00 0.00 60.65 58.21 3fky s ILE 74 Cb -0.00 -3.05 -0.04 0.00 -1.06 0.00 0.00 42.46 38.31 3fky s ILE 74 CO 0.16 -0.17 0.06 -0.31 -0.10 0.00 0.00 174.94 174.58 3fky s TYR 75 N -1.85 3.14 -0.26 3.97 1.51 -0.06 -1.35 117.35 122.44 3fky s TYR 75 Ca 0.30 0.06 -0.03 0.00 -1.01 0.00 0.00 57.07 56.38 3fky s TYR 75 Cb -0.09 -1.60 0.02 0.00 -0.11 0.00 0.00 41.96 40.18 3fky s TYR 75 CO 0.21 0.51 -0.02 -0.51 -1.11 0.00 0.00 175.55 174.63 3fky s LEU 76 N -2.33 3.42 -0.37 -1.29 1.43 0.43 -1.43 118.68 118.53 3fky s LEU 76 Ca 0.28 -0.87 -0.13 0.00 -1.03 0.00 0.00 54.13 52.39 3fky s LEU 76 Cb -0.12 -1.72 0.01 0.00 0.03 0.00 0.00 46.19 44.39 3fky s LEU 76 CO 0.21 -0.16 0.24 -0.54 0.23 0.00 0.00 176.35 176.33 3fky s LYS 77 N 1.36 3.05 0.26 1.70 1.02 0.02 -1.95 119.74 125.20 3fky s LYS 77 Ca 0.00 -0.94 -0.31 0.00 0.02 0.00 0.00 55.97 54.74 3fky s LYS 77 Cb -0.17 -3.81 -0.13 0.00 -0.52 0.00 0.00 37.83 33.20 3fky s LYS 77 CO -0.02 -0.64 1.35 -2.30 -0.92 0.00 0.00 175.35 172.82 3fky n PRO 78 N 5.07 1.97 0.00 -1.68 -0.02 -1.26 -1.05 135.00 138.03 3fky n PRO 78 Ca -0.12 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 3fky n PRO 78 Cb 0.47 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 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 1.51 0.00 -3.73 -1.45 0.31 0.79 -4.86 118.33 110.89 3fky n VAL 79 Ca 0.10 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.32 3fky n VAL 79 Cb 0.32 -0.45 -0.07 0.00 -0.91 0.00 0.00 33.84 32.73 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 -1.70 -0.73 0.02 3.52 0.00 -1.07 -5.01 121.76 116.80 3fky s ALA 80 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 51.96 51.85 3fky s ALA 80 Cb 0.00 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.52 3fky s ALA 80 CO 0.00 -0.46 0.20 1.52 0.00 0.00 0.00 175.76 177.02 3fky s TYR 81 N -2.83 0.01 0.16 0.00 1.13 -1.26 -0.22 117.35 114.34 3fky s TYR 81 Ca -0.03 -0.15 -0.08 0.00 -1.41 0.00 0.00 57.07 55.41 3fky s TYR 81 Cb 0.00 -0.01 -0.01 0.00 -1.10 0.00 0.00 41.96 40.84 3fky s TYR 81 CO -0.05 -0.39 0.25 0.71 -2.51 0.00 0.00 175.55 173.55 3fky s TYR 82 N -2.08 0.46 0.33 -3.49 2.02 -0.06 -4.97 117.35 109.56 3fky s TYR 82 Ca -0.09 -0.83 -0.29 0.00 -0.37 0.00 0.00 57.07 55.49 3fky s TYR 82 Cb -0.03 -0.12 -0.11 0.00 -0.40 0.00 0.00 41.96 41.30 3fky s TYR 82 CO -0.01 -0.68 1.43 -2.14 -1.57 0.00 0.00 175.55 172.57 3fky s PRO 83 N -3.98 4.22 -0.46 -1.71 0.02 -1.26 0.39 135.00 132.22 3fky s PRO 83 Ca 0.18 2.40 -0.29 0.00 0.02 0.00 0.00 61.00 63.31 3fky s PRO 83 Cb 0.04 -3.03 0.03 0.00 0.02 0.00 0.00 34.50 31.55 3fky s PRO 83 CO -0.00 -0.41 1.14 0.34 -0.33 0.00 0.00 177.00 177.75 3fky s ASP 84 N -0.10 6.65 0.47 2.53 -1.08 -0.80 -4.37 116.67 119.96 3fky s ASP 84 Ca 0.54 0.53 0.32 0.00 -0.52 0.00 0.00 52.55 53.41 3fky s ASP 84 Cb -0.43 -2.55 1.47 0.00 -1.46 0.00 0.00 42.92 39.94 3fky s ASP 84 CO 0.54 -1.23 1.95 -0.65 0.52 0.00 0.00 175.17 176.30 3fky h PRO 85 N 9.20 0.00 0.00 4.34 0.11 -1.91 0.22 132.00 143.96 3fky h PRO 85 Ca -0.23 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.73 3fky h PRO 85 Cb 1.06 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 3fky h PRO 85 CO 1.12 0.00 -1.11 1.19 -0.21 0.00 0.00 178.00 178.99 3fky n PHE 86 N -2.75 0.76 0.25 0.65 3.72 -1.26 -4.36 117.46 114.47 3fky n PHE 86 Ca -0.00 0.33 0.14 0.00 -0.05 0.00 0.00 57.45 57.87 3fky n PHE 86 Cb 0.20 -0.91 0.46 0.00 -0.94 0.00 0.00 39.48 38.30 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 -0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.82 3fky h ARG 87 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.06 3fky h ARG 87 CO -0.14 0.04 0.00 0.54 -1.07 0.00 0.00 179.97 179.34 3fky n ARG 88 N -3.13 0.00 0.00 0.04 1.74 0.77 -4.82 116.66 111.26 3fky n ARG 88 Ca 0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 3fky n ARG 88 Cb 0.41 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.85 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 1.86 1.03 -0.13 0.00 -1.26 -2.23 105.19 104.46 3fky n GLY 89 Ca 0.00 -0.55 0.06 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.13 2.96 -4.81 1.61 8.00 -1.26 -4.84 116.55 118.08 3fky n ASP 90 Ca 0.00 -2.23 -0.33 0.00 0.71 0.00 0.00 54.79 52.94 3fky n ASP 90 Cb 0.00 -0.43 -0.01 0.00 -0.02 0.00 0.00 41.12 40.66 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 -0.78 6.14 0.02 -2.24 0.01 -0.95 -4.74 114.94 112.41 3fky s ASN 91 Ca 0.31 1.79 -0.03 0.00 -0.71 0.00 0.00 52.86 54.21 3fky s ASN 91 Cb 0.19 -2.54 -0.01 0.00 0.41 0.00 0.00 41.25 39.31 3fky s ASN 91 CO 0.16 -0.92 0.04 -0.51 -1.51 0.00 0.00 177.10 174.36 3fky s ILE 92 N -2.36 0.11 -0.16 0.60 2.07 -0.50 -1.90 121.20 119.06 3fky s ILE 92 Ca 0.63 -0.89 -0.04 0.00 -1.41 0.00 0.00 60.65 58.95 3fky s ILE 92 Cb -0.15 -0.44 -0.03 0.00 0.13 0.00 0.00 42.46 41.98 3fky s ILE 92 CO 0.30 -0.49 -0.03 -0.69 -1.91 0.00 0.00 174.94 172.13 3fky s VAL 93 N -1.65 4.00 -0.24 4.00 1.01 0.16 -1.06 120.40 126.62 3fky s VAL 93 Ca -0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.51 3fky s VAL 93 Cb -0.08 -2.76 0.02 0.00 0.00 0.00 0.00 36.38 33.57 3fky s VAL 93 CO -0.01 0.49 -0.08 -0.69 0.00 0.00 0.00 175.10 174.81 3fky s VAL 94 N 0.36 2.78 -0.25 2.92 1.01 0.16 -0.88 120.40 126.50 3fky s VAL 94 Ca -0.03 -0.98 -0.29 0.00 0.00 0.00 0.00 61.98 60.67 3fky s VAL 94 Cb -0.14 -2.37 0.01 0.00 0.00 0.00 0.00 36.38 33.87 3fky s VAL 94 CO 0.03 0.26 1.11 -0.22 0.00 0.00 0.00 175.10 176.28 3fky s LEU 95 N 1.33 4.05 -0.01 3.92 2.96 0.70 -0.18 118.68 131.44 3fky s LEU 95 Ca 0.01 1.34 0.07 0.00 -0.22 0.00 0.00 54.13 55.33 3fky s LEU 95 Cb -0.16 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.97 3fky s LEU 95 CO -0.06 -0.78 -0.23 0.00 -1.32 0.00 0.00 176.35 173.97 3fky s ALA 96 N 3.47 2.33 0.13 5.97 0.00 0.01 -0.15 121.76 133.52 3fky s ALA 96 Ca 0.47 -1.11 -0.05 0.00 0.00 0.00 0.00 51.96 51.28 3fky s ALA 96 Cb -0.16 -0.65 -0.05 0.00 0.00 0.00 0.00 23.12 22.26 3fky s ALA 96 CO 0.12 0.54 0.36 0.00 0.00 0.00 0.00 175.76 176.77 3fky s ALA 97 N -0.69 3.81 -0.27 0.00 0.00 -0.22 -4.45 121.76 119.95 3fky s ALA 97 Ca 0.11 -0.58 -0.14 0.00 0.00 0.00 0.00 51.96 51.35 3fky s ALA 97 Cb -0.10 -2.10 -0.04 0.00 0.00 0.00 0.00 23.12 20.88 3fky s ALA 97 CO 0.00 0.68 0.33 0.00 0.00 0.00 0.00 175.76 176.78 3fky s TYR 99 N 1.92 2.52 1.07 0.00 2.02 -0.51 -1.59 117.35 122.78 3fky s TYR 99 Ca 0.13 -0.71 -0.13 0.00 -0.37 0.00 0.00 57.07 56.00 3fky s TYR 99 Cb -0.16 -1.64 0.23 0.00 -0.40 0.00 0.00 41.96 39.99 3fky s TYR 99 CO 0.10 -0.21 1.07 -0.80 -1.57 0.00 0.00 175.55 174.14 3fky s ASN 100 N -0.09 1.91 0.11 2.29 0.01 0.86 -0.88 114.94 119.15 3fky s ASN 100 Ca -0.05 1.22 0.15 0.00 -0.71 0.00 0.00 52.86 53.47 3fky s ASN 100 Cb -0.14 -1.91 0.65 0.00 0.41 0.00 0.00 41.25 40.26 3fky s ASN 100 CO 0.04 -3.58 1.45 -0.46 -1.51 0.00 0.00 177.10 173.04 3fky n ASN 101 N -4.48 0.25 0.02 -1.22 6.94 -1.26 -1.30 115.26 114.22 3fky n ASN 101 Ca 0.05 0.58 0.01 0.00 -0.02 0.00 0.00 54.58 55.19 3fky n ASN 101 Cb 0.57 -0.63 0.33 0.00 -2.36 0.00 0.00 39.78 37.68 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 0.44 0.00 0.53 3.32 -1.98 -3.46 116.42 115.28 3fky h ASP 102 Ca 0.00 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.97 3fky h ASP 102 Cb 0.18 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3fky h ASP 102 CO 0.00 0.51 0.00 0.61 -1.72 0.00 0.00 179.24 178.64 3fky n GLY 103 N -0.93 1.14 3.78 2.75 0.00 -0.42 -5.09 105.19 106.41 3fky n GLY 103 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.21 3.42 -0.00 2.61 -4.23 -1.26 -4.79 115.64 109.17 3fky s THR 104 Ca 0.00 1.01 -0.30 0.00 -1.18 0.00 0.00 61.69 61.22 3fky s THR 104 Cb 0.00 -3.48 -0.06 0.00 1.34 0.00 0.00 72.50 70.29 3fky s THR 104 CO 0.00 -0.07 1.55 -2.84 -0.54 0.00 0.00 174.62 172.73 3fky s PRO 105 N -2.82 4.22 0.87 3.99 0.02 -1.26 -0.10 135.00 139.92 3fky s PRO 105 Ca 0.64 2.14 -0.17 0.00 0.02 0.00 0.00 61.00 63.63 3fky s PRO 105 Cb -0.24 -3.72 -0.14 0.00 0.02 0.00 0.00 34.50 30.43 3fky s PRO 105 CO 0.29 -0.71 -0.53 -1.71 -0.33 0.00 0.00 177.00 174.00 3fky n ASN 106 N 6.04 -5.10 -0.33 2.53 5.15 -0.62 -4.69 115.26 118.23 3fky n ASN 106 Ca 0.15 0.32 0.21 0.00 -0.60 0.00 0.00 54.58 54.66 3fky n ASN 106 Cb 0.42 -0.82 0.40 0.00 -0.53 0.00 0.00 39.78 39.26 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 -0.76 0.04 -0.62 1.20 1.57 -1.91 -0.56 116.57 115.53 3fky h LYS 107 Ca -0.43 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3fky h LYS 107 Cb 1.34 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.64 3fky h LYS 107 CO 0.29 0.03 0.00 1.19 -0.57 0.00 0.00 179.45 180.39 3fky n PHE 108 N -5.36 1.05 -3.07 -1.35 3.72 -1.26 -4.52 117.46 106.68 3fky n PHE 108 Ca 0.29 -0.55 -0.43 0.00 -0.05 0.00 0.00 57.45 56.70 3fky n PHE 108 Cb 0.95 -0.10 -0.06 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 -1.01 6.28 0.00 4.37 3.84 -0.22 -4.84 114.94 123.36 3fky s ASN 109 Ca 0.45 -0.63 0.11 0.00 0.21 0.00 0.00 52.86 53.00 3fky s ASN 109 Cb 0.26 -2.33 0.25 0.00 -0.55 0.00 0.00 41.25 38.87 3fky s ASN 109 CO 0.27 -0.94 1.14 1.41 -2.79 0.00 0.00 177.10 176.18 3fky n HIS 110 N 6.50 0.33 -0.00 0.43 8.25 -1.26 -4.53 115.22 124.93 3fky n HIS 110 Ca -0.03 -0.34 -0.17 0.00 -0.26 0.00 0.00 57.72 56.92 3fky n HIS 110 Cb 0.46 -0.02 -0.07 0.00 1.12 0.00 0.00 29.99 31.49 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 2.16 0.73 0.27 -0.41 2.43 -1.93 -2.94 114.38 114.70 3fky h ARG 111 Ca 0.00 -0.63 -0.01 0.00 -0.81 0.00 0.00 59.98 58.52 3fky h ARG 111 Cb 0.66 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 3fky h ARG 111 CO 0.00 1.24 -0.13 1.25 -1.51 0.00 0.00 179.97 180.82 3fky h HIS 112 N 0.48 -0.34 -0.23 2.20 2.76 -2.00 -1.04 115.15 116.98 3fky h HIS 112 Ca -0.07 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.15 3fky h HIS 112 Cb 1.46 0.11 -0.06 0.00 1.55 0.00 0.00 27.41 30.47 3fky h HIS 112 CO 0.08 -0.13 -0.17 1.49 -1.30 0.00 0.00 177.93 177.90 3fky h GLU 113 N -0.49 -0.17 -0.88 5.26 4.57 -1.83 -1.74 114.58 119.30 3fky h GLU 113 Ca -0.04 0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.18 3fky h GLU 113 Cb 0.37 0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.94 3fky h GLU 113 CO 0.06 -0.11 0.57 0.00 -1.18 0.00 0.00 179.01 178.35 3fky h ALA 114 N 0.95 1.14 -0.57 2.92 0.00 -1.44 -2.44 119.26 119.83 3fky h ALA 114 Ca 0.13 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.11 3fky h ALA 114 Cb 0.37 -0.32 -0.09 0.00 0.00 0.00 0.00 17.79 17.76 3fky h ALA 114 CO -0.33 0.44 0.08 0.00 0.00 0.00 0.00 179.25 179.43 3fky h ALA 115 N 1.35 0.63 -0.60 0.00 0.00 -0.30 -0.95 119.26 119.40 3fky h ALA 115 Ca 0.34 0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.49 3fky h ALA 115 Cb -0.03 0.22 -0.11 0.00 0.00 0.00 0.00 17.79 17.86 3fky h ALA 115 CO -0.10 -0.34 -0.38 0.87 0.00 0.00 0.00 179.25 179.29 3fky h LYS 116 N 0.20 -0.18 -0.42 0.00 1.57 -0.99 0.21 116.57 116.96 3fky h LYS 116 Ca 0.30 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 59.10 3fky h LYS 116 Cb 0.45 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 3fky h LYS 116 CO -0.42 -0.12 0.26 -0.07 -0.57 0.00 0.00 179.45 178.53 3fky h LEU 117 N -0.19 0.44 -1.15 2.94 3.38 -1.25 -0.23 115.31 119.25 3fky h LEU 117 Ca 0.21 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 3fky h LEU 117 Cb 0.56 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 3fky h LEU 117 CO -0.69 0.32 0.18 -0.26 0.09 0.00 0.00 178.44 178.07 3fky h PHE 118 N 0.53 0.78 -0.35 1.13 0.04 -0.45 -1.18 116.94 117.44 3fky h PHE 118 Ca 0.16 -0.05 -0.10 0.00 2.80 0.00 0.00 57.97 60.78 3fky h PHE 118 Cb -0.03 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 37.88 3fky h PHE 118 CO -0.06 0.63 -0.19 0.00 -0.60 0.00 0.00 178.31 178.09 3fky h ALA 119 N 1.44 0.49 -0.01 2.45 0.00 -0.22 -1.77 119.26 121.64 3fky h ALA 119 Ca 0.18 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.74 3fky h ALA 119 Cb 0.20 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3fky h ALA 119 CO -0.01 0.43 -0.05 0.00 0.00 0.00 0.00 179.25 179.62 3fky h ALA 120 N 0.78 -0.05 -0.70 0.00 0.00 -0.73 -2.99 119.26 115.57 3fky h ALA 120 Ca 0.07 0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.63 3fky h ALA 120 Cb 0.73 0.10 -0.22 0.00 0.00 0.00 0.00 17.79 18.40 3fky h ALA 120 CO 0.05 -0.54 0.46 0.72 0.00 0.00 0.00 179.25 179.94 3fky n HIS 121 N -5.17 2.17 -0.33 0.00 8.25 -0.48 -4.53 115.22 115.14 3fky n HIS 121 Ca -0.06 -1.44 0.21 0.00 -0.26 0.00 0.00 57.72 56.17 3fky n HIS 121 Cb 0.10 -0.74 0.40 0.00 1.12 0.00 0.00 29.99 30.87 3fky n HIS 121 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 3fky h LYS 122 N 0.75 0.02 -0.42 -0.41 1.57 -1.17 -0.14 116.57 116.77 3fky h LYS 122 Ca 0.45 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.20 3fky h LYS 122 Cb 2.32 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.60 3fky h LYS 122 CO 0.78 0.01 0.16 -0.44 -0.57 0.00 0.00 179.45 179.39 3fky h ASP 123 N 0.02 0.54 0.95 0.86 3.32 -1.87 -2.11 116.42 118.13 3fky h ASP 123 Ca 0.69 -0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.63 3fky h ASP 123 Cb 1.60 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 41.00 3fky h ASP 123 CO -0.85 0.50 -0.25 -0.33 -1.72 0.00 0.00 179.24 176.59 3fky h GLU 124 N 0.59 0.00 -5.77 3.56 3.07 -1.39 -3.47 114.58 111.18 3fky h GLU 124 Ca 0.14 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.79 3fky h GLU 124 Cb 0.13 0.00 0.06 0.00 -0.84 0.00 0.00 28.75 28.10 3fky h GLU 124 CO -0.01 0.25 -0.54 0.39 -1.40 0.00 0.00 179.01 177.70 3fky n GLU 125 N -3.40 -1.52 -2.27 2.33 1.02 -0.79 -0.70 120.64 115.31 3fky n GLU 125 Ca 0.00 1.04 -0.39 0.00 -0.02 0.00 0.00 57.16 57.79 3fky n GLU 125 Cb 0.45 -4.92 -0.02 0.00 -0.02 0.00 0.00 31.44 26.92 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 -3.18 3.07 0.00 -3.67 1.01 -1.26 -3.82 121.20 113.35 3fky s ILE 126 Ca 0.20 0.98 0.08 0.00 0.00 0.00 0.00 60.65 61.91 3fky s ILE 126 Cb -0.05 -3.59 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 3fky s ILE 126 CO 0.79 0.16 -0.26 0.26 0.00 0.00 0.00 174.94 175.90 3fky s TRP 127 N -1.28 2.27 0.13 3.97 0.52 0.13 -3.19 118.94 121.49 3fky s TRP 127 Ca 0.52 -0.42 0.08 0.00 0.02 0.00 0.00 56.10 56.30 3fky s TRP 127 Cb -0.34 -1.43 -0.04 0.00 -1.15 0.00 0.00 33.47 30.51 3fky s TRP 127 CO 0.43 0.01 -0.18 -0.06 0.02 0.00 0.00 176.95 177.18 3fky s PHE 128 N -0.66 1.70 -0.14 -1.98 0.08 -0.38 -1.82 117.98 114.78 3fky s PHE 128 Ca 0.10 -0.47 -0.04 0.00 0.12 0.00 0.00 56.93 56.65 3fky s PHE 128 Cb -0.10 -0.89 0.06 0.00 -0.57 0.00 0.00 43.02 41.53 3fky s PHE 128 CO -0.00 0.24 0.16 0.20 -0.10 0.00 0.00 175.22 175.72 3fky s GLY 129 N -2.34 0.11 -0.06 4.36 0.00 -0.52 -0.73 107.32 108.15 3fky s GLY 129 Ca 0.11 0.25 -0.05 0.00 0.00 0.00 0.00 44.72 45.02 3fky s GLY 129 CO 0.05 1.82 0.17 1.08 0.00 0.00 0.00 173.10 176.22 3fky s LEU 130 N 2.26 4.38 -0.52 0.66 1.43 -0.39 -0.17 118.68 126.34 3fky s LEU 130 Ca 0.04 0.43 -0.04 0.00 -1.03 0.00 0.00 54.13 53.53 3fky s LEU 130 Cb -0.14 -2.36 0.14 0.00 0.03 0.00 0.00 46.19 43.86 3fky s LEU 130 CO -0.08 0.33 0.34 -1.61 0.23 0.00 0.00 176.35 175.56 3fky s GLU 131 N -1.48 2.34 -0.39 1.70 2.02 -0.30 -1.28 118.70 121.30 3fky s GLU 131 Ca 0.21 -2.13 -0.25 0.00 0.02 0.00 0.00 54.97 52.83 3fky s GLU 131 Cb -0.12 -3.71 0.02 0.00 0.10 0.00 0.00 34.13 30.41 3fky s GLU 131 CO 0.11 -1.14 0.87 -1.14 0.02 0.00 0.00 175.26 173.98 3fky s GLN 132 N 0.63 3.73 -0.03 1.61 2.00 0.34 -3.02 119.66 124.92 3fky s GLN 132 Ca 0.12 0.37 -0.03 0.00 -2.00 0.00 0.00 55.36 53.81 3fky s GLN 132 Cb -0.22 -3.84 -0.04 0.00 0.80 0.00 0.00 33.01 29.72 3fky s GLN 132 CO -0.04 -0.97 0.15 -1.21 -0.50 0.00 0.00 175.29 172.73 3fky s GLU 133 N 3.38 3.37 0.20 1.67 2.02 -0.86 -0.70 118.70 127.79 3fky s GLU 133 Ca 0.35 -0.31 -0.09 0.00 0.02 0.00 0.00 54.97 54.94 3fky s GLU 133 Cb -0.12 -3.08 -0.01 0.00 0.10 0.00 0.00 34.13 31.02 3fky s GLU 133 CO 0.20 0.69 0.34 1.52 0.02 0.00 0.00 175.26 178.03 3fky s TYR 134 N -1.23 0.48 -0.03 1.61 -0.85 -0.09 -4.67 117.35 112.58 3fky s TYR 134 Ca 0.24 -0.82 0.02 0.00 -0.52 0.00 0.00 57.07 55.99 3fky s TYR 134 Cb -0.12 -0.03 0.01 0.00 0.38 0.00 0.00 41.96 42.20 3fky s TYR 134 CO 0.14 -0.82 -0.08 0.99 -1.52 0.00 0.00 175.55 174.27 3fky s THR 135 N -4.01 0.71 0.17 -3.49 2.01 -0.69 -0.97 115.64 109.37 3fky s THR 135 Ca 0.22 -0.31 -0.16 0.00 0.31 0.00 0.00 61.69 61.75 3fky s THR 135 Cb 0.02 -0.64 -0.07 0.00 0.01 0.00 0.00 72.50 71.82 3fky s THR 135 CO 0.05 0.23 0.60 -0.76 -0.69 0.00 0.00 174.62 174.05 3fky s LEU 136 N 0.26 4.34 0.02 4.42 1.43 -0.18 -0.83 118.68 128.13 3fky s LEU 136 Ca -0.04 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.24 3fky s LEU 136 Cb -0.09 -3.37 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 3fky s LEU 136 CO 0.00 0.08 -0.03 -0.36 0.23 0.00 0.00 176.35 176.27 3fky s PHE 137 N -1.49 0.27 0.89 0.29 0.08 -0.28 -0.97 117.98 116.78 3fky s PHE 137 Ca 0.39 -0.39 -0.15 0.00 0.12 0.00 0.00 56.93 56.91 3fky s PHE 137 Cb -0.15 -0.18 -0.04 0.00 -0.57 0.00 0.00 43.02 42.08 3fky s PHE 137 CO 0.20 -0.13 0.08 -0.25 -0.10 0.00 0.00 175.22 175.02 3fky n ASP 138 N 1.97 -3.03 0.27 1.36 9.92 0.25 -1.30 116.55 125.97 3fky n ASP 138 Ca -0.21 0.36 0.18 0.00 -0.53 0.00 0.00 54.79 54.59 3fky n ASP 138 Cb 0.56 -1.07 0.94 0.00 -0.64 0.00 0.00 41.12 40.91 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 -1.09 0.00 -0.54 -1.24 2.86 -1.89 -1.88 114.93 111.15 3fky h MET 139 Ca -0.44 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.20 3fky h MET 139 Cb 1.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.97 3fky h MET 139 CO 0.33 0.00 0.00 0.66 1.06 0.00 0.00 176.91 178.96 3fky n TYR 140 N -2.72 1.19 -2.27 -0.22 4.01 -1.26 -4.95 117.16 110.94 3fky n TYR 140 Ca -0.02 -0.62 -0.16 0.00 -0.16 0.00 0.00 57.90 56.94 3fky n TYR 140 Cb 0.07 -0.20 -0.01 0.00 -0.31 0.00 0.00 39.34 38.90 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 0.81 -4.68 -4.63 7.72 8.00 -0.71 -5.01 116.55 118.06 3fky n ASP 141 Ca 0.23 -0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.44 3fky n ASP 141 Cb 0.79 -3.80 -0.09 0.00 -0.02 0.00 0.00 41.12 38.00 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 -2.31 4.63 0.17 -2.24 1.01 -1.26 -4.86 116.67 111.81 3fky s ASP 142 Ca 0.00 -0.39 -0.33 0.00 0.71 0.00 0.00 52.55 52.53 3fky s ASP 142 Cb 0.00 -0.95 -0.15 0.00 1.01 0.00 0.00 42.92 42.84 3fky s ASP 142 CO 0.00 0.13 1.41 0.52 0.21 0.00 0.00 175.17 177.43 3fky n VAL 143 N 0.22 0.46 -1.89 -1.27 0.31 -1.26 0.83 118.33 115.73 3fky n VAL 143 Ca -0.11 -0.11 -0.42 0.00 -0.01 0.00 0.00 64.34 63.68 3fky n VAL 143 Cb 0.54 -1.26 -0.03 0.00 -0.91 0.00 0.00 33.84 32.18 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 0.33 1.86 0.00 3.52 6.14 -0.14 -2.48 117.35 126.58 3fky s TYR 144 Ca 0.75 0.02 0.00 0.00 0.64 0.00 0.00 57.07 58.48 3fky s TYR 144 Cb -0.75 -4.03 0.00 0.00 0.42 0.00 0.00 41.96 37.60 3fky s TYR 144 CO 0.46 -4.39 0.00 0.41 0.64 0.00 0.00 175.55 172.67 3fky n GLY 145 N 4.23 1.68 3.77 8.97 0.00 -1.26 -4.78 105.19 117.80 3fky n GLY 145 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.96 3.19 0.12 1.61 0.52 -1.03 -4.94 118.94 115.44 3fky s TRP 146 Ca 0.00 1.57 -0.24 0.00 0.02 0.00 0.00 56.10 57.45 3fky s TRP 146 Cb 0.00 -3.40 -0.14 0.00 -1.15 0.00 0.00 33.47 28.78 3fky s TRP 146 CO 0.00 -1.19 0.51 -2.30 0.02 0.00 0.00 176.95 173.99 3fky n PRO 147 N 0.41 0.00 -2.01 4.98 -0.02 -1.26 -4.78 135.00 132.32 3fky n PRO 147 Ca 0.02 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.08 3fky n PRO 147 Cb 0.46 -0.88 -0.03 0.00 -0.02 0.00 0.00 33.50 33.03 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 -0.60 3.79 0.00 -0.52 1.02 -1.26 -2.08 119.74 120.10 3fky s LYS 148 Ca 0.55 1.84 0.00 0.00 0.02 0.00 0.00 55.97 58.38 3fky s LYS 148 Cb -0.79 -4.08 0.00 0.00 -0.52 0.00 0.00 37.83 32.44 3fky s LYS 148 CO 0.44 -1.31 0.00 0.41 -0.92 0.00 0.00 175.35 173.98 3fky n GLY 149 N 4.71 2.29 0.00 -3.33 0.00 -1.26 -4.93 105.19 102.68 3fky n GLY 149 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.96 5.15 3.02 -0.02 0.00 -0.88 -5.18 105.19 105.31 3fky n GLY 150 Ca 0.00 -1.67 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 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 3.18 0.26 1.10 1.61 2.02 -1.26 -4.57 117.35 119.68 3fky s TYR 151 Ca 0.00 -0.53 -0.18 0.00 -0.37 0.00 0.00 57.07 55.98 3fky s TYR 151 Cb 0.00 -0.19 0.27 0.00 -0.40 0.00 0.00 41.96 41.65 3fky s TYR 151 CO 0.00 -0.23 0.92 -0.35 -1.57 0.00 0.00 175.55 174.32 3fky n PRO 152 N 1.37 -3.09 -0.60 -1.71 -0.04 -1.26 -4.74 135.00 124.93 3fky n PRO 152 Ca -0.23 -1.49 -0.29 0.00 -0.04 0.00 0.00 63.50 61.46 3fky n PRO 152 Cb 0.56 -1.45 0.24 0.00 -0.04 0.00 0.00 33.50 32.80 3fky n PRO 152 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fky s ALA 153 N -2.89 -0.16 0.78 0.55 0.00 -1.26 -4.97 121.76 113.81 3fky s ALA 153 Ca 0.61 -0.04 -0.11 0.00 0.00 0.00 0.00 51.96 52.42 3fky s ALA 153 Cb -0.07 -3.27 0.06 0.00 0.00 0.00 0.00 23.12 19.85 3fky s ALA 153 CO 0.48 -3.66 1.09 -2.14 0.00 0.00 0.00 175.76 171.52 3fky s PRO 154 N -4.51 2.19 0.81 0.00 0.02 -1.26 -4.96 135.00 127.28 3fky s PRO 154 Ca 0.68 1.10 -0.13 0.00 0.02 0.00 0.00 61.00 62.67 3fky s PRO 154 Cb -0.24 -1.89 0.08 0.00 0.02 0.00 0.00 34.50 32.47 3fky s PRO 154 CO 0.63 -1.67 1.21 -0.65 -0.33 0.00 0.00 177.00 176.19 3fky s GLN 155 N -4.92 1.63 0.00 5.54 -0.21 -1.26 -4.51 119.66 115.92 3fky s GLN 155 Ca 0.61 1.77 0.00 0.00 0.02 0.00 0.00 55.36 57.76 3fky s GLN 155 Cb -0.17 -1.77 0.00 0.00 1.00 0.00 0.00 33.01 32.07 3fky s GLN 155 CO 0.56 -2.23 0.00 0.41 -2.12 0.00 0.00 175.29 171.91 3fky n GLY 156 N 0.51 3.52 0.34 3.09 0.00 -1.26 -4.94 105.19 106.45 3fky n GLY 156 Ca 0.14 -0.55 0.14 0.00 0.00 0.00 0.00 46.02 45.74 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 1.46 -0.07 1.61 -0.04 -1.26 -4.25 135.00 132.46 3fky n PRO 157 Ca 0.00 -0.68 -0.12 0.00 -0.04 0.00 0.00 63.50 62.66 3fky n PRO 157 Cb 0.00 -1.47 -0.14 0.00 -0.04 0.00 0.00 33.50 31.85 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 -0.17 0.48 -1.66 0.54 4.01 -1.26 -4.44 117.16 114.67 3fky n TYR 158 Ca 0.20 0.15 -0.44 0.00 -0.16 0.00 0.00 57.90 57.65 3fky n TYR 158 Cb 0.27 -1.08 -0.03 0.00 -0.31 0.00 0.00 39.34 38.19 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 -3.02 2.42 -2.80 -0.72 9.36 -1.11 -1.14 117.16 120.15 3fky n TYR 159 Ca -0.30 -0.27 -0.19 0.00 3.32 0.00 0.00 57.90 60.47 3fky n TYR 159 Cb 1.08 -2.76 0.00 0.00 -0.63 0.00 0.00 39.34 37.03 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 -2.36 1.66 -0.20 0.00 0.00 -0.29 -4.94 107.32 101.18 3fky s GLY 161 Ca 0.17 0.25 -0.13 0.00 0.00 0.00 0.00 44.72 45.00 3fky s GLY 161 CO 0.21 0.66 0.50 0.54 0.00 0.00 0.00 173.10 175.01 3fky s VAL 162 N -2.83 -0.01 0.00 1.40 0.11 -1.26 -4.89 120.40 112.92 3fky s VAL 162 Ca 0.63 0.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.73 3fky s VAL 162 Cb -0.19 -0.73 0.00 0.00 -1.53 0.00 0.00 36.38 33.93 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 3.80 3.63 0.26 6.54 0.00 -1.26 -4.84 105.19 113.31 3fky n GLY 163 Ca -0.19 -1.69 0.04 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 0.79 -0.00 4.61 0.00 -2.01 -1.15 119.26 121.50 3fky h ALA 164 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3fky h ALA 164 Cb 0.00 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3fky h ALA 164 CO 0.00 -0.37 -0.26 0.41 0.00 0.00 0.00 179.25 179.03 3fky n GLY 165 N -1.36 -0.88 0.03 0.00 0.00 -1.26 -4.23 105.19 97.48 3fky n GLY 165 Ca 0.12 -0.34 0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.96 0.10 -3.65 1.61 4.76 -0.43 -4.88 118.16 114.71 3fky n LYS 166 Ca 0.11 -0.05 -0.15 0.00 -2.87 0.00 0.00 58.31 55.35 3fky n LYS 166 Cb 0.33 -1.50 -0.08 0.00 -1.84 0.00 0.00 35.03 31.94 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 -2.93 0.02 -0.10 -0.18 0.11 -1.25 -4.45 120.40 111.63 3fky s VAL 167 Ca 0.14 -0.19 0.02 0.00 -2.93 0.00 0.00 61.98 59.02 3fky s VAL 167 Cb 0.18 -0.80 0.01 0.00 -1.53 0.00 0.00 36.38 34.24 3fky s VAL 167 CO 0.64 -0.10 -0.16 -0.31 -3.33 0.00 0.00 175.10 171.84 3fky s TYR 168 N -0.97 1.93 -0.93 1.54 2.02 -1.26 -4.80 117.35 114.88 3fky s TYR 168 Ca -0.10 -0.84 -0.01 0.00 -0.37 0.00 0.00 57.07 55.75 3fky s TYR 168 Cb -0.03 -1.38 0.00 0.00 -0.40 0.00 0.00 41.96 40.16 3fky s TYR 168 CO 0.06 -0.41 0.16 0.00 -1.57 0.00 0.00 175.55 173.79 3fky n ALA 169 N 3.98 -0.44 -0.26 3.71 0.00 -1.26 -4.81 120.51 121.43 3fky n ALA 169 Ca -0.20 0.13 0.15 0.00 0.00 0.00 0.00 53.44 53.51 3fky n ALA 169 Cb 0.52 -1.90 0.42 0.00 0.00 0.00 0.00 19.45 18.49 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 -0.37 0.57 -0.90 0.00 2.43 -1.99 -0.90 114.38 113.21 3fky h ARG 170 Ca -0.28 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.84 3fky h ARG 170 Cb 1.20 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.58 3fky h ARG 170 CO 0.32 0.38 0.53 0.38 -1.51 0.00 0.00 179.97 180.07 3fky h ASP 171 N 0.59 1.09 -0.25 -3.80 2.03 -1.99 0.20 116.42 114.28 3fky h ASP 171 Ca 0.46 -0.07 -0.06 0.00 -0.73 0.00 0.00 57.03 56.63 3fky h ASP 171 Cb 0.89 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 39.11 3fky h ASP 171 CO -0.21 0.84 -0.08 -0.03 -1.03 0.00 0.00 179.24 178.73 3fky h MET 172 N 1.24 0.50 -0.69 4.15 4.05 -1.57 -1.42 114.93 121.20 3fky h MET 172 Ca 0.32 -0.20 0.05 0.00 -0.28 0.00 0.00 59.70 59.59 3fky h MET 172 Cb -0.04 -0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 30.69 3fky h MET 172 CO -0.06 0.74 0.40 0.82 0.23 0.00 0.00 176.91 179.04 3fky h ILE 173 N 0.23 1.01 -0.59 1.77 5.03 -0.82 -1.77 117.51 122.38 3fky h ILE 173 Ca 0.06 -0.26 -0.06 0.00 -0.12 0.00 0.00 64.86 64.48 3fky h ILE 173 Cb 0.57 0.19 -0.02 0.00 -3.03 0.00 0.00 36.82 34.52 3fky h ILE 173 CO 0.03 0.14 0.12 -0.33 -0.68 0.00 0.00 178.15 177.43 3fky h GLU 174 N 0.76 0.95 -0.82 2.37 4.39 -0.56 -2.12 114.58 119.55 3fky h GLU 174 Ca 0.30 -0.24 0.06 0.00 0.34 0.00 0.00 59.36 59.82 3fky h GLU 174 Cb 0.13 -0.12 -0.06 0.00 -0.10 0.00 0.00 28.75 28.60 3fky h GLU 174 CO -0.16 0.89 0.50 0.00 -1.16 0.00 0.00 179.01 179.08 3fky h ALA 175 N 1.02 1.12 0.20 3.43 0.00 -0.68 -0.92 119.26 123.43 3fky h ALA 175 Ca 0.18 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3fky h ALA 175 Cb 0.38 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3fky h ALA 175 CO 0.01 0.22 -0.10 1.25 0.00 0.00 0.00 179.25 180.63 3fky h HIS 176 N 0.91 -0.25 -0.53 0.00 -0.00 -1.10 0.33 115.15 114.50 3fky h HIS 176 Ca 0.36 -0.01 0.09 0.00 -0.00 0.00 0.00 60.37 60.81 3fky h HIS 176 Cb 0.18 0.08 -0.10 0.00 -0.00 0.00 0.00 27.41 27.57 3fky h HIS 176 CO -0.04 -0.07 -0.39 -0.92 -0.00 0.00 0.00 177.93 176.51 3fky h TYR 177 N -0.38 -1.13 -0.40 5.26 -0.00 -0.93 0.11 116.97 119.49 3fky h TYR 177 Ca -0.03 0.07 0.08 0.00 -0.00 0.00 0.00 58.73 58.86 3fky h TYR 177 Cb 0.30 0.57 -0.08 0.00 -0.00 0.00 0.00 36.73 37.52 3fky h TYR 177 CO -0.03 -0.41 -0.10 0.00 -0.00 0.00 0.00 178.16 177.62 3fky h ARG 178 N -0.23 -0.00 -0.26 1.82 -0.00 -0.94 -1.24 114.38 113.52 3fky h ARG 178 Ca 0.19 0.00 0.06 0.00 -0.50 0.00 0.00 59.98 59.73 3fky h ARG 178 Cb 0.56 0.00 -0.06 0.00 0.00 0.00 0.00 29.97 30.47 3fky h ARG 178 CO -0.65 -0.00 -0.12 0.00 0.00 0.00 0.00 179.97 179.20 3fky h ALA 179 N 1.40 0.10 -0.48 0.04 0.00 0.77 0.27 119.26 121.36 3fky h ALA 179 Ca 0.19 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3fky h ALA 179 Cb 0.30 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3fky h ALA 179 CO -0.42 -0.52 0.31 0.00 0.00 0.00 0.00 179.25 178.63 3fky h LEU 181 N 0.65 0.78 -0.83 0.00 3.38 -0.61 -1.60 115.31 117.08 3fky h LEU 181 Ca 0.18 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.10 3fky h LEU 181 Cb -0.07 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 3fky h LEU 181 CO -0.04 0.61 0.54 0.22 0.09 0.00 0.00 178.44 179.86 3fky h TYR 182 N 0.88 1.03 0.00 1.13 3.20 -0.30 0.68 116.97 123.58 3fky h TYR 182 Ca 0.23 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.13 3fky h TYR 182 Cb -0.03 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 37.90 3fky h TYR 182 CO -0.02 0.63 0.00 0.00 -1.64 0.00 0.00 178.16 177.13 3fky n ALA 183 N -2.33 1.93 -1.08 1.82 0.00 -0.57 -4.73 120.51 115.55 3fky n ALA 183 Ca 0.09 -0.08 -0.03 0.00 0.00 0.00 0.00 53.44 53.43 3fky n ALA 183 Cb 0.04 -1.31 -0.01 0.00 0.00 0.00 0.00 19.45 18.17 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 0.41 0.59 3.74 0.00 0.00 0.23 -4.39 105.19 105.77 3fky n GLY 184 Ca 0.07 -0.60 -0.34 0.00 0.00 0.00 0.00 46.02 45.14 3fky n GLY 184 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fky s LEU 185 N -0.59 3.40 -1.49 0.99 1.43 -0.65 -4.89 118.68 116.88 3fky s LEU 185 Ca 0.00 2.32 -0.08 0.00 -1.03 0.00 0.00 54.13 55.34 3fky s LEU 185 Cb 0.00 -4.59 0.01 0.00 0.03 0.00 0.00 46.19 41.64 3fky s LEU 185 CO 0.00 -2.04 2.69 1.21 0.23 0.00 0.00 176.35 178.44 3fky n GLU 186 N -2.43 4.10 -2.75 1.70 4.07 -1.26 -4.64 120.64 119.41 3fky n GLU 186 Ca 0.13 -2.78 -0.43 0.00 -0.06 0.00 0.00 57.16 54.02 3fky n GLU 186 Cb 0.50 -2.73 -0.03 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 0.69 4.41 -0.20 6.31 2.07 -1.26 -0.48 121.20 132.74 3fky s ILE 187 Ca 0.62 0.93 0.17 0.00 -1.41 0.00 0.00 60.65 60.96 3fky s ILE 187 Cb 0.18 -4.48 0.08 0.00 0.13 0.00 0.00 42.46 38.37 3fky s ILE 187 CO -0.08 -0.86 1.39 0.77 -1.91 0.00 0.00 174.94 174.26 3fky h SER 188 N 9.06 0.00 0.00 4.50 4.64 -0.47 -3.48 113.55 127.80 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 1.05 0.42 0.00 0.61 -0.87 0.00 0.00 176.83 178.05 3fky n GLY 189 N 1.22 0.22 3.12 -0.77 0.00 -1.22 -4.98 105.19 102.79 3fky n GLY 189 Ca 0.01 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.91 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 0.15 -0.11 -0.61 2.07 -1.26 -1.14 121.20 118.30 3fky s ILE 190 Ca 0.00 -1.21 -0.30 0.00 -1.41 0.00 0.00 60.65 57.73 3fky s ILE 190 Cb 0.00 -1.03 0.09 0.00 0.13 0.00 0.00 42.46 41.64 3fky s ILE 190 CO 0.00 -0.67 0.77 0.54 -1.91 0.00 0.00 174.94 173.67 3fky s ASN 191 N -2.32 -0.59 0.12 4.50 4.22 -0.87 -5.00 114.94 114.98 3fky s ASN 191 Ca -0.02 0.73 -0.30 0.00 -2.14 0.00 0.00 52.86 51.13 3fky s ASN 191 Cb 0.01 0.60 -0.06 0.00 1.28 0.00 0.00 41.25 43.08 3fky s ASN 191 CO -0.06 -0.49 1.02 0.00 -2.04 0.00 0.00 177.10 175.53 3fky s ALA 192 N -0.94 3.28 0.70 3.54 0.00 -1.26 -1.42 121.76 125.66 3fky s ALA 192 Ca -0.07 0.66 -0.03 0.00 0.00 0.00 0.00 51.96 52.52 3fky s ALA 192 Cb -0.01 -3.32 0.10 0.00 0.00 0.00 0.00 23.12 19.90 3fky s ALA 192 CO 0.06 -0.12 0.66 0.39 0.00 0.00 0.00 175.76 176.75 3fky n GLU 193 N 2.85 -0.08 -0.04 0.00 -0.58 0.55 -0.25 120.64 123.10 3fky n GLU 193 Ca 0.03 -1.55 -0.13 0.00 -0.42 0.00 0.00 57.16 55.09 3fky n GLU 193 Cb 0.48 -0.52 -0.08 0.00 -0.57 0.00 0.00 31.44 30.75 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 -0.77 1.39 -3.40 2.62 2.07 -1.85 -2.93 116.25 113.37 3fky h VAL 194 Ca -0.22 -1.37 -0.52 0.00 0.82 0.00 0.00 66.70 65.41 3fky h VAL 194 Cb 0.74 2.08 0.01 0.00 -1.52 0.00 0.00 31.29 32.60 3fky h VAL 194 CO 0.21 0.39 0.56 -0.32 0.02 0.00 0.00 177.57 178.42 3fky s MET 195 N -4.11 4.48 0.33 1.57 -2.45 -1.26 -4.15 119.30 113.71 3fky s MET 195 Ca -0.15 1.85 -0.29 0.00 -1.25 0.00 0.00 55.69 55.85 3fky s MET 195 Cb 0.04 -3.27 -0.12 0.00 1.25 0.00 0.00 34.83 32.73 3fky s MET 195 CO 0.73 -0.13 1.37 -2.30 1.05 0.00 0.00 175.02 175.74 3fky n PRO 196 N 2.88 2.27 -2.24 4.11 -0.02 -1.26 -1.71 135.00 139.02 3fky n PRO 196 Ca 0.06 0.80 -0.19 0.00 -2.02 0.00 0.00 63.50 62.15 3fky n PRO 196 Cb 0.45 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.48 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 0.99 -5.38 -4.26 2.55 3.41 -1.26 -4.93 113.62 104.74 3fky n SER 197 Ca 0.05 0.05 -0.32 0.00 -0.26 0.00 0.00 58.87 58.39 3fky n SER 197 Cb 0.36 -4.44 -0.16 0.00 -0.26 0.00 0.00 64.21 59.70 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 -4.74 3.02 0.35 4.33 0.74 -0.70 -1.01 119.66 121.64 3fky s GLN 198 Ca 0.00 -0.85 0.04 0.00 0.05 0.00 0.00 55.36 54.60 3fky s GLN 198 Cb 0.00 -2.33 -0.05 0.00 1.10 0.00 0.00 33.01 31.72 3fky s GLN 198 CO 0.00 0.23 0.07 -1.58 -0.55 0.00 0.00 175.29 173.46 3fky s TRP 199 N 0.24 1.91 0.02 1.67 0.52 -0.14 -0.33 118.94 122.83 3fky s TRP 199 Ca -0.15 -1.04 0.01 0.00 0.02 0.00 0.00 56.10 54.95 3fky s TRP 199 Cb -0.17 -1.26 -0.01 0.00 -1.15 0.00 0.00 33.47 30.88 3fky s TRP 199 CO 0.07 -0.06 -0.04 -2.00 0.02 0.00 0.00 176.95 174.94 3fky s GLU 200 N -3.86 0.33 0.03 4.98 2.12 -0.51 -0.91 118.70 120.89 3fky s GLU 200 Ca 0.33 -0.46 0.03 0.00 0.36 0.00 0.00 54.97 55.23 3fky s GLU 200 Cb 0.07 -0.13 -0.02 0.00 0.26 0.00 0.00 34.13 34.32 3fky s GLU 200 CO 0.15 0.02 -0.10 -0.59 -0.54 0.00 0.00 175.26 174.20 3fky s PHE 201 N -0.91 0.84 -0.09 5.30 -0.12 0.12 -2.06 117.98 121.08 3fky s PHE 201 Ca -0.08 -0.36 0.01 0.00 -0.05 0.00 0.00 56.93 56.45 3fky s PHE 201 Cb -0.07 -0.51 -0.02 0.00 -0.63 0.00 0.00 43.02 41.79 3fky s PHE 201 CO -0.00 -0.02 -0.11 -0.65 -0.05 0.00 0.00 175.22 174.39 3fky s GLN 202 N -1.12 2.92 -0.14 1.99 1.11 -0.29 -0.50 119.66 123.62 3fky s GLN 202 Ca -0.03 -0.64 0.01 0.00 0.01 0.00 0.00 55.36 54.71 3fky s GLN 202 Cb -0.08 -2.55 0.02 0.00 -1.01 0.00 0.00 33.01 29.39 3fky s GLN 202 CO 0.01 0.48 -0.17 0.08 0.01 0.00 0.00 175.29 175.69 3fky s VAL 203 N -0.34 1.76 0.00 1.09 1.01 -0.41 0.19 120.40 123.70 3fky s VAL 203 Ca 0.04 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.24 3fky s VAL 203 Cb -0.13 -1.60 0.00 0.00 0.00 0.00 0.00 36.38 34.65 3fky s VAL 203 CO 0.02 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.23 3fky n GLY 204 N 4.42 2.12 3.81 4.51 0.00 0.37 -1.26 105.19 119.17 3fky n GLY 204 Ca -0.19 -1.10 -0.36 0.00 0.00 0.00 0.00 46.02 44.37 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 4.27 0.21 1.61 0.05 -1.26 -4.39 135.00 133.49 3fky s PRO 205 Ca 0.00 0.89 0.10 0.00 0.05 0.00 0.00 61.00 62.04 3fky s PRO 205 Cb 0.00 -2.87 -0.05 0.00 0.05 0.00 0.00 34.50 31.64 3fky s PRO 205 CO 0.00 0.38 -0.19 0.00 0.05 0.00 0.00 177.00 177.24 3fky s THR 207 N -2.23 4.75 0.00 0.00 2.01 -1.26 -1.25 115.64 117.66 3fky s THR 207 Ca 0.22 -0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.18 3fky s THR 207 Cb -0.05 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.27 3fky s THR 207 CO 0.10 0.38 0.00 0.61 -0.69 0.00 0.00 174.62 175.02 3fky n GLY 208 N 4.25 2.23 0.20 4.40 0.00 -1.19 -1.23 105.19 113.85 3fky n GLY 208 Ca -0.16 0.39 0.05 0.00 0.00 0.00 0.00 46.02 46.31 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 1.03 -0.79 -0.61 1.08 -1.94 -2.98 117.51 113.30 3fky h ILE 209 Ca 0.00 -1.14 0.13 0.00 -0.39 0.00 0.00 64.86 63.46 3fky h ILE 209 Cb 0.00 1.65 -0.09 0.00 -3.07 0.00 0.00 36.82 35.31 3fky h ILE 209 CO 0.00 0.30 0.39 0.44 -0.69 0.00 0.00 178.15 178.59 3fky h ASP 210 N 0.00 0.46 -0.12 1.72 3.32 -1.53 -1.04 116.42 119.24 3fky h ASP 210 Ca -0.00 0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.18 3fky h ASP 210 Cb 0.62 0.01 -0.06 0.00 0.22 0.00 0.00 39.33 40.12 3fky h ASP 210 CO 0.04 0.22 -0.38 -0.03 -1.72 0.00 0.00 179.24 177.36 3fky h MET 211 N 0.59 -0.45 -0.12 3.56 4.05 -1.68 0.24 114.93 121.11 3fky h MET 211 Ca 0.42 0.03 0.04 0.00 -0.28 0.00 0.00 59.70 59.91 3fky h MET 211 Cb 0.56 0.10 -0.04 0.00 -0.80 0.00 0.00 31.60 31.42 3fky h MET 211 CO -0.34 -0.30 -0.13 0.78 0.23 0.00 0.00 176.91 177.15 3fky h GLY 212 N -0.47 -0.05 0.59 1.39 0.00 -1.56 -1.27 103.07 101.70 3fky h GLY 212 Ca 0.08 0.16 0.05 0.00 0.00 0.00 0.00 47.33 47.62 3fky h GLY 212 CO -0.37 -0.14 0.00 -0.55 0.00 0.00 0.00 176.54 175.48 3fky h ASP 213 N -0.16 -0.10 -0.25 0.19 3.32 -0.26 -1.95 116.42 117.21 3fky h ASP 213 Ca 0.09 0.06 -0.09 0.00 0.02 0.00 0.00 57.03 57.11 3fky h ASP 213 Cb 0.29 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 3fky h ASP 213 CO -0.22 -0.02 -0.18 1.56 -1.72 0.00 0.00 179.24 178.66 3fky h GLN 214 N 0.09 0.57 -0.55 3.56 4.20 -0.39 -1.77 115.11 120.82 3fky h GLN 214 Ca 0.13 -0.27 0.00 0.00 0.06 0.00 0.00 58.65 58.57 3fky h GLN 214 Cb 0.16 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.91 3fky h GLN 214 CO -0.21 0.85 0.36 1.25 -0.67 0.00 0.00 178.83 180.41 3fky h LEU 215 N 0.29 0.63 -0.65 1.46 5.85 -1.14 0.13 115.31 121.87 3fky h LEU 215 Ca 0.05 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.80 3fky h LEU 215 Cb 0.71 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 3fky h LEU 215 CO 0.05 0.46 0.37 -0.50 -0.34 0.00 0.00 178.44 178.47 3fky h TRP 216 N 0.74 0.68 -0.49 1.25 4.06 -1.27 0.60 115.95 121.51 3fky h TRP 216 Ca 0.20 0.02 -0.04 0.00 2.06 0.00 0.00 58.89 61.14 3fky h TRP 216 Cb -0.08 -0.21 -0.02 0.00 -1.00 0.00 0.00 29.16 27.85 3fky h TRP 216 CO -0.04 0.34 0.17 0.52 -3.56 0.00 0.00 178.44 175.87 3fky h MET 217 N 0.69 0.76 -0.75 0.49 2.86 -0.59 -0.80 114.93 117.59 3fky h MET 217 Ca 0.28 -0.16 0.10 0.00 -2.06 0.00 0.00 59.70 57.86 3fky h MET 217 Cb 0.14 -0.11 -0.07 0.00 0.06 0.00 0.00 31.60 31.62 3fky h MET 217 CO -0.16 0.70 0.39 0.00 1.06 0.00 0.00 176.91 178.90 3fky h ALA 218 N 1.02 1.05 -0.41 6.32 0.00 -0.26 0.21 119.26 127.19 3fky h ALA 218 Ca 0.16 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3fky h ALA 218 Cb 0.25 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3fky h ALA 218 CO -0.01 -0.01 0.21 0.00 0.00 0.00 0.00 179.25 179.44 3fky h ARG 219 N 0.66 0.58 -0.39 0.00 3.08 -0.59 0.43 114.38 118.15 3fky h ARG 219 Ca 0.37 -0.08 0.07 0.00 0.07 0.00 0.00 59.98 60.41 3fky h ARG 219 Cb 0.38 -0.11 -0.06 0.00 0.08 0.00 0.00 29.97 30.26 3fky h ARG 219 CO -0.27 0.49 0.02 -0.92 -1.07 0.00 0.00 179.97 178.22 3fky h TYR 220 N 0.52 0.01 -0.97 3.04 5.03 0.17 -1.26 116.97 123.51 3fky h TYR 220 Ca 0.14 0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.49 3fky h TYR 220 Cb 0.10 0.06 -0.05 0.00 1.55 0.00 0.00 36.73 38.38 3fky h TYR 220 CO -0.02 -0.06 0.64 0.74 -1.32 0.00 0.00 178.16 178.15 3fky h PHE 221 N 0.12 1.21 0.74 -3.82 0.04 -0.22 -0.95 116.94 114.07 3fky h PHE 221 Ca 0.19 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.95 3fky h PHE 221 Cb 0.26 -0.41 0.01 0.00 2.20 0.00 0.00 35.95 38.01 3fky h PHE 221 CO -0.25 0.76 -0.36 1.25 -0.60 0.00 0.00 178.31 179.11 3fky h LEU 222 N 1.30 -0.85 -0.69 1.54 5.85 -0.10 0.12 115.31 122.48 3fky h LEU 222 Ca 0.36 0.03 0.13 0.00 0.84 0.00 0.00 57.88 59.24 3fky h LEU 222 Cb -0.14 0.22 -0.13 0.00 0.37 0.00 0.00 40.66 40.98 3fky h LEU 222 CO -0.08 -0.56 -0.26 0.45 -0.34 0.00 0.00 178.44 177.65 3fky h HIS 223 N -1.10 -0.66 -0.51 1.25 3.86 -1.22 -0.79 115.15 115.99 3fky h HIS 223 Ca -0.10 0.07 -0.08 0.00 -1.16 0.00 0.00 60.37 59.10 3fky h HIS 223 Cb 0.77 0.40 -0.02 0.00 1.06 0.00 0.00 27.41 29.62 3fky h HIS 223 CO 0.03 -0.35 0.01 -0.09 0.86 0.00 0.00 177.93 178.39 3fky h ARG 224 N -0.07 0.89 -0.25 2.45 9.65 -1.04 -1.98 114.38 124.03 3fky h ARG 224 Ca 0.30 -0.28 -0.19 0.00 -1.10 0.00 0.00 59.98 58.72 3fky h ARG 224 Cb 0.55 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.05 3fky h ARG 224 CO -0.74 0.91 -0.58 -0.24 2.80 0.00 0.00 179.97 182.12 3fky h VAL 225 N 0.75 1.28 0.00 0.20 3.04 -0.48 -2.92 116.25 118.13 3fky h VAL 225 Ca 0.14 -1.78 -0.03 0.00 -1.01 0.00 0.00 66.70 64.03 3fky h VAL 225 Cb 0.50 1.70 -0.00 0.00 -2.01 0.00 0.00 31.29 31.48 3fky h VAL 225 CO 0.02 0.57 -0.14 0.00 -1.01 0.00 0.00 177.57 177.01 3fky h ALA 226 N 0.74 1.46 -0.80 3.17 0.00 -0.94 -1.31 119.26 121.58 3fky h ALA 226 Ca 0.01 -0.13 0.17 0.00 0.00 0.00 0.00 54.91 54.95 3fky h ALA 226 Cb 1.17 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.83 3fky h ALA 226 CO 0.12 0.18 0.29 0.93 0.00 0.00 0.00 179.25 180.78 3fky h GLU 227 N 0.00 0.37 0.00 0.00 5.08 -1.16 0.22 114.58 119.09 3fky h GLU 227 Ca -0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3fky h GLU 227 Cb 0.32 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3fky h GLU 227 CO 0.02 0.24 0.00 0.39 -1.00 0.00 0.00 179.01 178.66 3fky n GLU 228 N -5.06 0.10 -0.10 2.33 1.02 -0.49 -1.11 120.64 117.33 3fky n GLU 228 Ca 0.17 0.49 0.03 0.00 -0.02 0.00 0.00 57.16 57.83 3fky n GLU 228 Cb 0.50 -1.76 0.08 0.00 -0.02 0.00 0.00 31.44 30.25 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 -1.95 0.25 -2.46 -0.32 3.72 0.71 -4.96 117.46 112.45 3fky n PHE 229 Ca 0.01 -0.51 -0.20 0.00 -0.05 0.00 0.00 57.45 56.70 3fky n PHE 229 Cb 0.10 -0.04 -0.01 0.00 -0.94 0.00 0.00 39.48 38.59 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 0.02 -0.50 3.59 1.37 0.00 -0.26 -4.98 105.19 104.42 3fky n GLY 230 Ca 0.07 0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.99 4.36 0.03 -0.61 1.01 -0.77 -3.73 121.20 118.49 3fky s ILE 231 Ca 0.03 -0.20 -0.17 0.00 0.00 0.00 0.00 60.65 60.31 3fky s ILE 231 Cb -0.01 -2.92 -0.06 0.00 0.01 0.00 0.00 42.46 39.48 3fky s ILE 231 CO 0.03 0.50 0.50 -0.54 0.00 0.00 0.00 174.94 175.43 3fky s LYS 232 N 0.13 4.09 -0.17 2.79 1.02 -0.42 -4.08 119.74 123.10 3fky s LYS 232 Ca 0.02 0.58 -0.06 0.00 0.02 0.00 0.00 55.97 56.53 3fky s LYS 232 Cb -0.13 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 33.90 3fky s LYS 232 CO 0.02 0.62 0.03 0.42 -0.92 0.00 0.00 175.35 175.51 3fky s ILE 233 N -0.94 4.51 -0.22 2.17 1.01 -1.26 -1.13 121.20 125.34 3fky s ILE 233 Ca 0.27 -0.14 -0.03 0.00 0.00 0.00 0.00 60.65 60.75 3fky s ILE 233 Cb -0.18 -3.01 0.01 0.00 0.01 0.00 0.00 42.46 39.29 3fky s ILE 233 CO 0.16 0.48 -0.07 -0.55 0.00 0.00 0.00 174.94 174.96 3fky s SER 234 N 0.28 4.11 -0.03 3.58 0.15 -0.01 -4.96 113.70 116.82 3fky s SER 234 Ca 0.01 -0.56 0.18 0.00 0.70 0.00 0.00 55.95 56.28 3fky s SER 234 Cb -0.13 -1.68 0.56 0.00 -1.71 0.00 0.00 66.02 63.07 3fky s SER 234 CO 0.01 -0.05 1.46 0.49 1.20 0.00 0.00 173.24 176.36 3fky n PHE 235 N 4.74 0.96 -1.81 3.44 3.72 -1.26 -1.70 117.46 125.55 3fky n PHE 235 Ca -0.18 -0.44 -0.41 0.00 -0.05 0.00 0.00 57.45 56.37 3fky n PHE 235 Cb 0.50 -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 0.00 176.76 175.13 3fky s HIS 236 N -1.39 2.71 0.35 1.38 2.46 -1.26 -2.26 115.29 117.28 3fky s HIS 236 Ca 0.42 0.96 0.27 0.00 0.47 0.00 0.00 55.06 57.18 3fky s HIS 236 Cb 0.23 -4.02 1.33 0.00 -0.13 0.00 0.00 32.58 29.99 3fky s HIS 236 CO 0.25 -3.25 2.01 -1.35 -2.47 0.00 0.00 174.74 169.93 3fky h PRO 237 N 4.11 0.00 -1.95 2.88 0.11 -1.85 -3.36 132.00 131.95 3fky h PRO 237 Ca -0.48 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.17 3fky h PRO 237 Cb 1.23 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 32.02 3fky h PRO 237 CO 0.73 0.14 -0.83 0.21 -0.21 0.00 0.00 178.00 178.05 3fky s LYS 238 N -4.05 0.94 0.33 1.05 2.47 -1.26 0.46 119.74 119.68 3fky s LYS 238 Ca -0.02 -1.77 0.06 0.00 -1.56 0.00 0.00 55.97 52.68 3fky s LYS 238 Cb 0.12 -0.99 0.57 0.00 -1.46 0.00 0.00 37.83 36.07 3fky s LYS 238 CO 0.59 -1.37 1.80 -1.35 0.16 0.00 0.00 175.35 175.19 3fky h PRO 239 N 5.49 0.36 -4.70 4.03 0.11 -1.83 -3.39 132.00 132.06 3fky h PRO 239 Ca 0.20 -0.11 -0.56 0.00 0.11 0.00 0.00 66.00 65.64 3fky h PRO 239 Cb 0.97 -0.03 -0.34 0.00 0.11 0.00 0.00 31.00 31.71 3fky h PRO 239 CO 0.26 0.56 -0.83 -0.51 -0.21 0.00 0.00 178.00 177.26 3fky s LEU 240 N -8.67 1.70 0.51 2.35 1.43 -1.26 -5.11 118.68 109.64 3fky s LEU 240 Ca -0.06 -0.38 -0.21 0.00 -1.03 0.00 0.00 54.13 52.46 3fky s LEU 240 Cb 0.14 -0.99 -0.06 0.00 0.03 0.00 0.00 46.19 45.31 3fky s LEU 240 CO 0.76 0.03 1.14 -0.54 0.23 0.00 0.00 176.35 177.98 3fky s LYS 241 N 0.79 3.50 0.00 1.70 1.02 -1.26 -4.56 119.74 120.93 3fky s LYS 241 Ca -0.11 1.66 0.00 0.00 0.02 0.00 0.00 55.97 57.54 3fky s LYS 241 Cb -0.16 -2.14 0.00 0.00 -0.52 0.00 0.00 37.83 35.02 3fky s LYS 241 CO 0.02 -0.74 0.00 0.41 -0.92 0.00 0.00 175.35 174.12 3fky n GLY 242 N 0.24 0.09 0.18 -3.33 0.00 -1.26 -4.62 105.19 96.49 3fky n GLY 242 Ca 0.10 -1.91 0.12 0.00 0.00 0.00 0.00 46.02 44.33 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 1.00 -4.73 1.61 9.92 -1.26 -4.90 116.55 118.19 3fky n ASP 243 Ca 0.00 -0.79 -0.42 0.00 -0.53 0.00 0.00 54.79 53.05 3fky n ASP 243 Cb 0.00 0.32 -0.02 0.00 -0.64 0.00 0.00 41.12 40.78 3fky n ASP 243 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 3fky s TRP 244 N -2.71 2.84 0.59 1.24 0.52 -1.26 -4.88 118.94 115.28 3fky s TRP 244 Ca 0.17 0.47 -0.18 0.00 0.02 0.00 0.00 56.10 56.58 3fky s TRP 244 Cb 0.18 -4.13 -0.06 0.00 -1.15 0.00 0.00 33.47 28.31 3fky s TRP 244 CO 0.62 -4.13 0.87 0.09 0.02 0.00 0.00 176.95 174.42 3fky n ASN 245 N 3.38 0.36 -2.68 2.95 4.13 -1.26 -4.84 115.26 117.31 3fky n ASN 245 Ca 0.13 0.79 -0.09 0.00 1.68 0.00 0.00 54.58 57.09 3fky n ASN 245 Cb 0.36 -1.34 0.06 0.00 -1.54 0.00 0.00 39.78 37.32 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 1.40 -0.81 2.85 7.41 0.00 -1.26 -4.67 105.19 110.10 3fky n GLY 246 Ca 0.13 -1.75 -0.26 0.00 0.00 0.00 0.00 46.02 44.15 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 -3.74 1.11 0.51 4.61 0.00 0.17 -4.94 121.76 119.48 3fky s ALA 247 Ca 0.24 -0.44 0.04 0.00 0.00 0.00 0.00 51.96 51.80 3fky s ALA 247 Cb -0.01 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.22 3fky s ALA 247 CO 0.17 -0.52 0.21 0.20 0.00 0.00 0.00 175.76 175.83 3fky s GLY 248 N 1.80 2.60 -0.40 0.00 0.00 -1.26 -0.66 107.32 109.40 3fky s GLY 248 Ca 0.04 -1.12 0.10 0.00 0.00 0.00 0.00 44.72 43.74 3fky s GLY 248 CO -0.07 -2.03 0.64 0.00 0.00 0.00 0.00 173.10 171.64 3fky n HIS 250 N 0.81 1.67 -3.26 0.00 8.25 -1.17 -4.54 115.22 116.99 3fky n HIS 250 Ca 0.24 0.81 -0.40 0.00 -0.26 0.00 0.00 57.72 58.10 3fky n HIS 250 Cb 0.57 -2.33 -0.08 0.00 1.12 0.00 0.00 29.99 29.27 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 4.33 3.54 -0.09 -1.41 0.00 -0.72 -1.15 121.76 126.27 3fky s ALA 251 Ca 1.08 -0.78 -0.13 0.00 0.00 0.00 0.00 51.96 52.12 3fky s ALA 251 Cb -1.33 -2.91 -0.05 0.00 0.00 0.00 0.00 23.12 18.84 3fky s ALA 251 CO 0.71 -0.90 0.33 -0.80 0.00 0.00 0.00 175.76 175.09 3fky s ASN 252 N 1.64 6.60 0.04 0.00 0.01 0.76 -0.92 114.94 123.07 3fky s ASN 252 Ca 0.19 0.71 0.04 0.00 -0.71 0.00 0.00 52.86 53.09 3fky s ASN 252 Cb -0.16 -2.20 -0.02 0.00 0.41 0.00 0.00 41.25 39.28 3fky s ASN 252 CO 0.11 0.23 -0.12 -0.69 -1.51 0.00 0.00 177.10 175.11 3fky s VAL 253 N -0.35 0.95 -0.14 1.60 1.01 -0.39 -1.43 120.40 121.64 3fky s VAL 253 Ca 0.20 -1.01 -0.29 0.00 0.00 0.00 0.00 61.98 60.88 3fky s VAL 253 Cb -0.14 -0.89 0.09 0.00 0.00 0.00 0.00 36.38 35.43 3fky s VAL 253 CO 0.08 -0.10 0.80 -0.94 0.00 0.00 0.00 175.10 174.94 3fky s SER 254 N -1.26 -0.58 0.36 3.32 1.04 -0.76 -1.77 113.70 114.05 3fky s SER 254 Ca -0.01 0.78 0.08 0.00 0.48 0.00 0.00 55.95 57.28 3fky s SER 254 Cb -0.08 0.67 -0.05 0.00 0.10 0.00 0.00 66.02 66.66 3fky s SER 254 CO 0.01 -0.43 0.14 0.42 0.98 0.00 0.00 173.24 174.36 3fky s THR 255 N -0.75 2.79 0.24 2.02 -4.23 -1.26 0.22 115.64 114.66 3fky s THR 255 Ca -0.05 -1.73 -0.04 0.00 -1.18 0.00 0.00 61.69 58.69 3fky s THR 255 Cb -0.01 -2.95 0.21 0.00 1.34 0.00 0.00 72.50 71.08 3fky s THR 255 CO 0.05 -0.14 1.73 0.50 -0.54 0.00 0.00 174.62 176.22 3fky h LYS 256 N 1.54 0.43 -0.57 3.99 3.64 -1.01 -0.91 116.57 123.68 3fky h LYS 256 Ca -0.43 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 58.97 3fky h LYS 256 Cb 1.25 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.93 3fky h LYS 256 CO 0.65 0.28 0.29 0.93 -2.27 0.00 0.00 179.45 179.33 3fky h GLU 257 N 0.44 0.54 0.00 1.90 5.08 -1.92 -1.96 114.58 118.66 3fky h GLU 257 Ca 0.41 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.71 3fky h GLU 257 Cb 0.61 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 3fky h GLU 257 CO -0.40 0.35 -0.13 0.52 -1.00 0.00 0.00 179.01 178.35 3fky h MET 258 N 0.55 0.00 0.00 2.33 2.86 -1.45 -2.68 114.93 116.55 3fky h MET 258 Ca 0.25 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.88 3fky h MET 258 Cb 0.17 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.82 3fky h MET 258 CO -0.18 0.13 -0.64 0.00 1.06 0.00 0.00 176.91 177.29 3fky h ARG 259 N 0.00 0.00 -6.22 1.72 3.08 -0.95 0.22 114.38 112.23 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 0.40 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 3fky h ARG 259 CO 0.02 0.04 -0.27 -0.65 -1.07 0.00 0.00 179.97 178.03 3fky s GLN 260 N -3.27 3.65 0.40 0.04 -0.21 -1.01 -4.57 119.66 114.70 3fky s GLN 260 Ca 0.02 -0.02 -0.23 0.00 0.02 0.00 0.00 55.36 55.16 3fky s GLN 260 Cb 0.08 -2.81 -0.14 0.00 1.00 0.00 0.00 33.01 31.14 3fky s GLN 260 CO 0.75 0.44 0.43 -2.30 -2.12 0.00 0.00 175.29 172.48 3fky n PRO 261 N 0.05 0.39 -1.75 2.91 -0.02 -1.26 -2.30 135.00 133.02 3fky n PRO 261 Ca -0.02 0.14 -0.05 0.00 -2.02 0.00 0.00 63.50 61.56 3fky n PRO 261 Cb 0.52 -1.34 -0.01 0.00 -0.02 0.00 0.00 33.50 32.65 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 1.94 0.38 0.21 -1.23 0.00 -1.20 -4.98 105.19 100.31 3fky n GLY 262 Ca 0.12 -0.75 -0.19 0.00 0.00 0.00 0.00 46.02 45.20 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 0.82 1.67 -0.02 0.00 -0.42 -3.28 103.07 101.84 3fky h GLY 263 Ca -0.11 -1.32 0.00 0.00 0.00 0.00 0.00 47.33 45.90 3fky h GLY 263 CO 0.14 1.17 0.10 2.41 0.00 0.00 0.00 176.54 180.36 3fky n THR 264 N -3.88 1.32 0.12 4.70 -1.04 -0.64 0.53 114.28 115.39 3fky n THR 264 Ca -0.10 0.61 -0.05 0.00 -2.04 0.00 0.00 64.05 62.47 3fky n THR 264 Cb 0.83 -1.61 -0.03 0.00 -1.82 0.00 0.00 70.33 67.71 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 -0.31 -0.03 -2.82 3.64 -1.84 0.79 116.57 116.00 3fky h LYS 265 Ca 0.00 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.34 3fky h LYS 265 Cb 0.20 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 3fky h LYS 265 CO 0.00 -0.20 -0.27 1.88 -2.27 0.00 0.00 179.45 178.59 3fky h TYR 266 N -0.32 0.06 0.02 1.91 0.05 -0.13 -0.50 116.97 118.05 3fky h TYR 266 Ca -0.03 -0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.75 3fky h TYR 266 Cb 0.25 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 3fky h TYR 266 CO 0.09 0.32 -0.05 0.82 -1.05 0.00 0.00 178.16 178.29 3fky h ILE 267 N 0.05 0.88 -0.90 -2.88 2.04 -1.10 0.22 117.51 115.82 3fky h ILE 267 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 3fky h ILE 267 Cb 0.50 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 37.42 3fky h ILE 267 CO 0.04 0.00 0.53 -0.33 0.00 0.00 0.00 178.15 178.38 3fky h GLU 268 N -0.09 1.23 -0.35 2.37 5.08 -0.17 -0.90 114.58 121.75 3fky h GLU 268 Ca 0.02 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3fky h GLU 268 Cb 0.11 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 3fky h GLU 268 CO -0.04 0.87 0.17 1.96 -1.00 0.00 0.00 179.01 180.98 3fky h GLN 269 N 1.24 0.35 -0.32 2.33 4.20 -0.87 -1.66 115.11 120.38 3fky h GLN 269 Ca 0.32 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 59.01 3fky h GLN 269 Cb -0.03 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 3fky h GLN 269 CO -0.06 0.23 0.20 0.00 -0.67 0.00 0.00 178.83 178.53 3fky h ALA 270 N 1.18 0.40 -0.67 3.87 0.00 -0.37 -2.15 119.26 121.53 3fky h ALA 270 Ca 0.15 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.07 3fky h ALA 270 Cb 0.06 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3fky h ALA 270 CO -0.10 -0.11 0.44 0.82 0.00 0.00 0.00 179.25 180.30 3fky h ILE 271 N 0.42 1.03 -0.18 0.00 2.04 -0.86 0.55 117.51 120.51 3fky h ILE 271 Ca 0.11 -0.25 -0.09 0.00 1.00 0.00 0.00 64.86 65.63 3fky h ILE 271 Cb -0.01 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 36.33 3fky h ILE 271 CO -0.02 0.13 -0.26 -0.08 0.00 0.00 0.00 178.15 177.92 3fky h GLU 272 N 0.71 0.50 -0.76 2.37 4.81 -0.85 -1.52 114.58 119.84 3fky h GLU 272 Ca 0.28 -0.29 0.07 0.00 -0.13 0.00 0.00 59.36 59.29 3fky h GLU 272 Cb 0.21 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.55 3fky h GLU 272 CO -0.09 0.88 0.45 0.87 -0.73 0.00 0.00 179.01 180.39 3fky h LYS 273 N 0.15 0.78 -0.55 1.92 1.57 -0.72 0.42 116.57 120.15 3fky h LYS 273 Ca 0.02 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.78 3fky h LYS 273 Cb 0.83 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.93 3fky h LYS 273 CO 0.06 0.52 0.36 -0.07 -0.57 0.00 0.00 179.45 179.75 3fky h LEU 274 N 0.81 0.55 -1.39 2.94 3.38 -0.75 -1.20 115.31 119.66 3fky h LEU 274 Ca 0.34 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.26 3fky h LEU 274 Cb 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3fky h LEU 274 CO -0.19 0.38 -0.22 0.77 0.09 0.00 0.00 178.44 179.28 3fky h SER 275 N 0.65 0.00 1.77 -0.43 4.64 0.15 -2.25 113.55 118.08 3fky h SER 275 Ca 0.22 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.54 3fky h SER 275 Cb 0.07 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3fky h SER 275 CO -0.06 0.22 -0.23 0.11 -0.87 0.00 0.00 176.83 176.00 3fky h LYS 276 N 0.00 0.00 -0.25 4.77 6.56 -0.94 -3.32 116.57 123.39 3fky h LYS 276 Ca -0.00 0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 59.43 3fky h LYS 276 Cb 0.61 0.00 -0.10 0.00 -0.57 0.00 0.00 32.23 32.17 3fky h LYS 276 CO 0.03 0.00 -0.37 0.54 -2.06 0.00 0.00 179.45 177.58 3fky n ARG 277 N -3.00 1.97 -0.17 3.15 1.74 -0.87 -4.77 116.66 114.70 3fky n ARG 277 Ca 0.03 -3.39 -0.04 0.00 -0.77 0.00 0.00 57.85 53.68 3fky n ARG 277 Cb 0.54 -1.79 0.06 0.00 -1.02 0.00 0.00 32.46 30.24 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 1.19 0.47 -0.50 -1.55 2.76 -1.59 -2.08 115.15 113.85 3fky h HIS 278 Ca 0.14 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.27 3fky h HIS 278 Cb 1.29 -0.13 -0.02 0.00 1.55 0.00 0.00 27.41 30.10 3fky h HIS 278 CO 0.89 0.22 0.05 0.00 -1.30 0.00 0.00 177.93 177.79 3fky h ALA 279 N 1.29 0.67 -0.60 5.26 0.00 -1.91 -1.05 119.26 122.92 3fky h ALA 279 Ca 0.23 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3fky h ALA 279 Cb 0.16 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3fky h ALA 279 CO -0.17 0.43 0.17 0.93 0.00 0.00 0.00 179.25 180.60 3fky h GLU 280 N 0.72 0.92 0.54 0.00 3.07 -1.87 -1.93 114.58 116.03 3fky h GLU 280 Ca 0.15 -0.19 -0.03 0.00 -0.50 0.00 0.00 59.36 58.79 3fky h GLU 280 Cb 0.44 -0.14 0.01 0.00 -0.84 0.00 0.00 28.75 28.21 3fky h GLU 280 CO 0.02 0.81 -0.26 0.45 -1.40 0.00 0.00 179.01 178.62 3fky h HIS 281 N 0.89 -0.68 -0.98 4.33 3.86 -1.28 -3.22 115.15 118.07 3fky h HIS 281 Ca 0.20 -0.02 0.33 0.00 -1.16 0.00 0.00 60.37 59.72 3fky h HIS 281 Cb 0.29 0.22 -0.17 0.00 1.06 0.00 0.00 27.41 28.81 3fky h HIS 281 CO 0.02 -0.37 0.38 0.82 0.86 0.00 0.00 177.93 179.63 3fky h ILE 282 N -1.12 0.12 -0.94 2.45 1.08 -1.14 0.27 117.51 118.24 3fky h ILE 282 Ca -0.07 -0.04 0.08 0.00 -0.39 0.00 0.00 64.86 64.43 3fky h ILE 282 Cb 0.61 0.01 -0.06 0.00 -3.07 0.00 0.00 36.82 34.30 3fky h ILE 282 CO 0.12 0.02 0.61 0.50 -0.69 0.00 0.00 178.15 178.71 3fky h LYS 283 N 0.11 1.01 0.00 2.37 3.64 -1.36 -3.34 116.57 119.00 3fky h LYS 283 Ca 0.72 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 60.04 3fky h LYS 283 Cb 1.70 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 33.29 3fky h LYS 283 CO -0.75 0.67 0.00 1.28 -2.27 0.00 0.00 179.45 178.38 3fky n LEU 284 N -4.51 0.00 0.00 5.20 4.77 0.95 -4.63 117.00 118.77 3fky n LEU 284 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3fky n LEU 284 Cb 0.23 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 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 -4.59 117.16 110.23 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 -0.53 0.00 0.00 -1.03 0.00 0.00 39.34 37.78 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 0.82 2.84 3.84 2.72 0.00 -1.26 -0.80 105.19 113.34 3fky n GLY 286 Ca 0.00 -1.49 -0.32 0.00 0.00 0.00 0.00 46.02 44.21 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 6.57 -1.07 1.61 1.04 -1.26 -3.28 113.70 117.30 3fky s SER 287 Ca 0.00 1.56 -0.14 0.00 0.48 0.00 0.00 55.95 57.86 3fky s SER 287 Cb 0.00 -2.51 0.14 0.00 0.10 0.00 0.00 66.02 63.75 3fky s SER 287 CO 0.00 -0.63 0.34 -0.90 0.98 0.00 0.00 173.24 173.03 3fky n ASP 288 N -1.69 -1.09 0.17 7.02 5.68 -1.26 -4.72 116.55 120.67 3fky n ASP 288 Ca 0.07 -0.69 0.13 0.00 -0.50 0.00 0.00 54.79 53.80 3fky n ASP 288 Cb 0.54 -0.96 0.58 0.00 -1.14 0.00 0.00 41.12 40.14 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 -0.49 0.00 0.11 -1.12 -1.24 -1.90 -2.49 115.58 108.45 3fky h ASN 289 Ca -0.34 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.66 3fky h ASN 289 Cb 0.84 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.89 3fky h ASN 289 CO 0.51 0.00 -0.02 -2.24 -1.29 0.00 0.00 177.43 174.39 3fky h ASP 290 N 0.00 0.00 -0.32 1.15 -0.00 -1.86 0.15 116.42 115.54 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 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.66 3fky h ASP 290 CO 0.00 0.02 0.00 1.15 -0.00 0.00 0.00 179.24 180.41 3fky n MET 291 N -3.59 2.24 0.00 4.15 0.00 -0.94 -4.60 117.12 114.38 3fky n MET 291 Ca -0.03 -1.35 0.00 0.00 0.00 0.00 0.00 57.70 56.32 3fky n MET 291 Cb 0.12 -1.52 0.00 0.00 0.00 0.00 0.00 33.22 31.82 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 0.43 0.00 0.00 3.17 0.63 0.48 -4.76 116.66 116.61 3fky n ARG 292 Ca 0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.05 3fky n ARG 292 Cb 0.46 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.37 3fky n ARG 292 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3fky n LEU 293 N 0.00 0.00 0.00 6.15 7.99 -0.99 -4.57 117.00 125.58 3fky n LEU 293 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.00 3fky n LEU 293 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 3fky n LEU 293 CO 0.00 0.00 0.00 1.07 -1.51 0.00 0.00 177.39 176.95 3fky n THR 294 N 0.00 0.00 0.00 -5.08 5.66 -1.26 -3.75 114.28 109.85 3fky n THR 294 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 3fky n THR 294 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 3fky n THR 294 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3fky n GLY 295 N -0.01 0.51 2.89 1.09 0.00 -1.26 -4.87 105.19 103.54 3fky n GLY 295 Ca 0.00 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 3fky n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fky n ALA 300 N 0.00 -5.58 -2.74 4.61 0.00 -1.26 -5.16 120.51 110.37 3fky n ALA 300 Ca 0.00 -1.21 -0.18 0.00 0.00 0.00 0.00 53.44 52.06 3fky n ALA 300 Cb 0.00 -0.83 -0.15 0.00 0.00 0.00 0.00 19.45 18.47 3fky n ALA 300 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3fky s SER 301 N -0.96 0.91 0.36 0.00 0.15 -1.26 -4.57 113.70 108.32 3fky s SER 301 Ca 0.36 -0.14 0.19 0.00 0.70 0.00 0.00 55.95 57.05 3fky s SER 301 Cb 0.05 -0.11 0.58 0.00 -1.71 0.00 0.00 66.02 64.82 3fky s SER 301 CO 0.67 0.09 1.68 0.24 1.20 0.00 0.00 173.24 177.12 3fky h MET 302 N 6.00 0.00 0.00 5.44 2.86 -1.90 -3.27 114.93 124.06 3fky h MET 302 Ca -0.30 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.20 3fky h MET 302 Cb 1.18 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.82 3fky h MET 302 CO 0.50 0.39 -1.71 0.25 1.06 0.00 0.00 176.91 177.40 3fky n THR 303 N -3.45 0.53 -3.20 2.22 -2.24 -1.26 -4.97 114.28 101.91 3fky n THR 303 Ca 0.00 -0.42 -0.39 0.00 -2.27 0.00 0.00 64.05 60.98 3fky n THR 303 Cb 0.55 -0.41 -0.06 0.00 -2.10 0.00 0.00 70.33 68.31 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 -2.46 3.54 -0.14 6.98 0.00 -1.23 -5.02 121.76 123.43 3fky s ALA 304 Ca -0.05 0.10 -0.00 0.00 0.00 0.00 0.00 51.96 52.01 3fky s ALA 304 Cb 0.05 -2.72 -0.01 0.00 0.00 0.00 0.00 23.12 20.43 3fky s ALA 304 CO 0.48 0.34 -0.13 0.12 0.00 0.00 0.00 175.76 176.57 3fky s PHE 305 N -0.95 2.82 0.11 0.00 5.36 -1.26 -4.62 117.98 119.44 3fky s PHE 305 Ca 0.31 -0.73 -0.06 0.00 -0.96 0.00 0.00 56.93 55.48 3fky s PHE 305 Cb -0.20 -1.87 -0.01 0.00 -0.34 0.00 0.00 43.02 40.59 3fky s PHE 305 CO 0.20 -0.28 0.16 -1.54 -1.46 0.00 0.00 175.22 172.31 3fky s SER 306 N 0.52 0.18 0.05 6.13 1.04 -1.26 -4.96 113.70 115.40 3fky s SER 306 Ca -0.09 -0.85 -0.12 0.00 0.48 0.00 0.00 55.95 55.37 3fky s SER 306 Cb -0.16 0.34 0.02 0.00 0.10 0.00 0.00 66.02 66.32 3fky s SER 306 CO 0.04 -0.76 0.28 -0.94 0.98 0.00 0.00 173.24 172.84 3fky s SER 307 N -2.93 -0.07 0.00 7.02 1.04 -1.26 -0.22 113.70 117.28 3fky s SER 307 Ca 0.12 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.26 3fky s SER 307 Cb 0.05 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.52 3fky s SER 307 CO -0.06 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.14 3fky n GLY 308 N 0.46 0.93 3.77 7.32 0.00 -1.11 -5.00 105.19 111.56 3fky n GLY 308 Ca -0.18 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 44.90 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 3.00 -0.45 1.61 1.01 -1.26 -2.34 120.40 119.96 3fky s VAL 309 Ca 0.00 0.64 -0.09 0.00 0.00 0.00 0.00 61.98 62.53 3fky s VAL 309 Cb 0.00 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 33.13 3fky s VAL 309 CO 0.00 -0.12 0.40 0.00 0.00 0.00 0.00 175.10 175.38 3fky n ALA 310 N -1.27 -2.05 -3.36 5.51 0.00 0.39 -4.83 120.51 114.89 3fky n ALA 310 Ca 0.12 -0.04 -0.17 0.00 0.00 0.00 0.00 53.44 53.34 3fky n ALA 310 Cb 0.50 -0.78 -0.08 0.00 0.00 0.00 0.00 19.45 19.10 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 -2.05 1.15 0.00 0.00 3.84 -1.25 -4.96 114.94 111.67 3fky s ASN 311 Ca 0.09 -1.54 0.08 0.00 0.21 0.00 0.00 52.86 51.69 3fky s ASN 311 Cb -0.01 0.58 0.47 0.00 -0.55 0.00 0.00 41.25 41.73 3fky s ASN 311 CO 0.57 -0.26 1.12 0.54 -2.79 0.00 0.00 177.10 176.28 3fky n ARG 312 N 4.28 0.79 -0.01 0.43 1.74 -1.26 -2.51 116.66 120.13 3fky n ARG 312 Ca 0.11 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.29 3fky n ARG 312 Cb 0.45 -1.15 -0.15 0.00 -1.02 0.00 0.00 32.46 30.59 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 0.38 -0.91 3.92 -0.13 0.00 -1.26 -4.89 105.19 102.31 3fky n GLY 313 Ca 0.06 -0.48 -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 -4.16 4.57 0.02 1.61 1.04 -1.04 -4.49 113.70 111.24 3fky s SER 314 Ca -0.06 0.50 -0.21 0.00 0.48 0.00 0.00 55.95 56.66 3fky s SER 314 Cb 0.13 -1.04 -0.18 0.00 0.10 0.00 0.00 66.02 65.03 3fky s SER 314 CO 0.83 -1.79 1.22 0.28 0.98 0.00 0.00 173.24 174.76 3fky h SER 315 N -0.81 0.42 -4.12 7.02 0.02 -0.93 -3.44 113.55 111.72 3fky h SER 315 Ca -0.45 -0.62 -0.69 0.00 -0.84 0.00 0.00 61.79 59.19 3fky h SER 315 Cb 1.31 -0.12 -0.31 0.00 0.14 0.00 0.00 62.40 63.42 3fky h SER 315 CO 0.59 0.97 -0.88 -0.63 -1.14 0.00 0.00 176.83 175.74 3fky s ILE 316 N -3.75 2.10 -0.11 3.27 -1.09 -0.88 -0.82 121.20 119.92 3fky s ILE 316 Ca -0.14 -1.06 0.02 0.00 -2.23 0.00 0.00 60.65 57.24 3fky s ILE 316 Cb 0.04 -1.75 0.01 0.00 -1.58 0.00 0.00 42.46 39.18 3fky s ILE 316 CO 0.78 0.57 -0.18 -0.60 -1.23 0.00 0.00 174.94 174.28 3fky s ARG 317 N -0.26 2.46 -0.35 2.79 3.52 0.68 -2.75 118.95 125.04 3fky s ARG 317 Ca -0.01 -0.65 -0.18 0.00 -0.13 0.00 0.00 55.73 54.76 3fky s ARG 317 Cb -0.13 -2.02 -0.00 0.00 -1.56 0.00 0.00 34.95 31.23 3fky s ARG 317 CO 0.03 -0.02 0.49 0.42 -0.81 0.00 0.00 175.30 175.41 3fky s ILE 318 N 0.85 5.04 0.21 4.11 1.01 -0.99 -0.90 121.20 130.53 3fky s ILE 318 Ca -0.09 0.28 -0.32 0.00 0.00 0.00 0.00 60.65 60.52 3fky s ILE 318 Cb -0.15 -3.94 -0.14 0.00 0.01 0.00 0.00 42.46 38.23 3fky s ILE 318 CO -0.00 -0.20 1.40 -2.65 0.00 0.00 0.00 174.94 173.48 3fky n PRO 319 N 5.68 1.86 -0.34 2.79 -0.02 -1.26 -0.46 135.00 143.25 3fky n PRO 319 Ca -0.05 0.67 0.11 0.00 -2.02 0.00 0.00 63.50 62.20 3fky n PRO 319 Cb 0.49 -2.32 0.31 0.00 -0.02 0.00 0.00 33.50 31.97 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 4.41 0.79 -0.08 -0.52 2.43 -1.95 0.81 114.38 120.27 3fky h ARG 320 Ca -0.45 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 58.71 3fky h ARG 320 Cb 1.29 -0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 30.60 3fky h ARG 320 CO 0.77 0.52 -0.30 0.77 -1.51 0.00 0.00 179.97 180.23 3fky h SER 321 N 0.81 -0.91 -0.06 -3.80 0.02 -1.99 0.12 113.55 107.74 3fky h SER 321 Ca 0.53 0.13 0.04 0.00 -0.84 0.00 0.00 61.79 61.64 3fky h SER 321 Cb 0.76 0.38 -0.05 0.00 0.14 0.00 0.00 62.40 63.63 3fky h SER 321 CO -0.30 -0.35 -0.23 0.58 -1.14 0.00 0.00 176.83 175.39 3fky h VAL 322 N -0.40 0.46 -0.32 2.27 2.07 -1.15 -1.78 116.25 117.41 3fky h VAL 322 Ca 0.08 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.67 3fky h VAL 322 Cb 0.53 0.46 -0.08 0.00 -1.52 0.00 0.00 31.29 30.68 3fky h VAL 322 CO -0.30 0.00 -0.20 0.00 0.02 0.00 0.00 177.57 177.09 3fky h ALA 323 N 0.59 0.01 0.00 1.67 0.00 -0.76 0.14 119.26 120.91 3fky h ALA 323 Ca 0.08 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3fky h ALA 323 Cb 0.43 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 3fky h ALA 323 CO -0.25 -0.60 -0.06 1.57 0.00 0.00 0.00 179.25 179.92 3fky h LYS 324 N -0.17 0.00 0.00 0.00 2.10 -0.49 -2.93 116.57 115.08 3fky h LYS 324 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 3fky h LYS 324 Cb 0.42 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 3fky h LYS 324 CO -0.42 0.06 -1.13 0.39 -2.00 0.00 0.00 179.45 176.35 3fky n GLU 325 N -4.39 0.11 -0.71 0.07 1.02 -0.34 -4.99 120.64 111.41 3fky n GLU 325 Ca -0.03 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 3fky n GLU 325 Cb 0.14 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 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 1.46 0.80 3.58 0.62 0.00 0.36 -4.87 105.19 107.13 3fky n GLY 326 Ca 0.03 0.00 -0.10 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 -3.03 -0.39 0.00 1.61 1.13 -1.22 -0.58 117.35 114.87 3fky s TYR 327 Ca 0.00 0.11 0.00 0.00 -1.41 0.00 0.00 57.07 55.77 3fky s TYR 327 Cb 0.00 0.61 0.00 0.00 -1.10 0.00 0.00 41.96 41.47 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 0.32 3.44 5.49 0.00 0.78 -4.62 105.19 110.21 3fky n GLY 328 Ca -0.12 -0.55 -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 0.71 0.24 1.61 -0.85 -1.26 -3.99 117.35 113.80 3fky s TYR 329 Ca 0.00 -1.00 0.11 0.00 -0.52 0.00 0.00 57.07 55.66 3fky s TYR 329 Cb 0.00 -0.10 -0.05 0.00 0.38 0.00 0.00 41.96 42.19 3fky s TYR 329 CO 0.00 -0.88 -0.20 -0.59 -1.52 0.00 0.00 175.55 172.36 3fky s PHE 330 N -3.99 2.21 -0.32 -3.49 -0.12 -0.73 -4.52 117.98 107.01 3fky s PHE 330 Ca 0.29 -0.37 -0.06 0.00 -0.05 0.00 0.00 56.93 56.74 3fky s PHE 330 Cb 0.02 -1.00 0.03 0.00 -0.63 0.00 0.00 43.02 41.44 3fky s PHE 330 CO 0.11 0.60 0.07 -2.00 -0.05 0.00 0.00 175.22 173.96 3fky s GLU 331 N -3.26 2.75 -0.48 1.99 2.12 -0.08 -1.26 118.70 120.48 3fky s GLU 331 Ca 0.26 -1.08 -0.25 0.00 0.36 0.00 0.00 54.97 54.25 3fky s GLU 331 Cb -0.05 -3.37 0.03 0.00 0.26 0.00 0.00 34.13 31.00 3fky s GLU 331 CO 0.12 -0.58 0.93 0.34 -0.54 0.00 0.00 175.26 175.54 3fky s ASP 332 N 1.41 6.47 0.00 -1.70 -1.08 -0.10 -0.23 116.67 121.44 3fky s ASP 332 Ca -0.01 0.03 0.20 0.00 -0.52 0.00 0.00 52.55 52.25 3fky s ASP 332 Cb -0.19 -2.45 0.60 0.00 -1.46 0.00 0.00 42.92 39.42 3fky s ASP 332 CO 0.02 -1.09 1.47 0.54 0.52 0.00 0.00 175.17 176.62 3fky n ARG 333 N 7.24 1.96 0.08 4.34 1.74 -0.00 -1.75 116.66 130.27 3fky n ARG 333 Ca 0.05 -1.45 -0.21 0.00 -0.77 0.00 0.00 57.85 55.47 3fky n ARG 333 Cb 0.48 -1.41 -0.12 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 2.78 0.61 -6.90 5.56 3.08 -1.90 -3.45 114.38 114.15 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 0.25 0.09 0.00 0.08 0.00 0.00 29.97 31.00 3fky h ARG 334 CO 0.00 1.34 0.72 -2.14 -1.07 0.00 0.00 179.97 178.83 3fky s PRO 335 N -3.04 4.22 0.61 0.04 0.02 -1.26 -4.90 135.00 130.68 3fky s PRO 335 Ca -0.09 2.41 -0.08 0.00 0.02 0.00 0.00 61.00 63.26 3fky s PRO 335 Cb 0.06 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.56 3fky s PRO 335 CO 0.92 -0.39 0.95 0.00 -0.33 0.00 0.00 177.00 178.16 3fky s ALA 336 N -1.04 3.19 0.40 -1.55 0.00 0.02 -1.56 121.76 121.22 3fky s ALA 336 Ca 0.52 -0.53 0.18 0.00 0.00 0.00 0.00 51.96 52.13 3fky s ALA 336 Cb -0.43 -2.75 1.09 0.00 0.00 0.00 0.00 23.12 21.03 3fky s ALA 336 CO 0.57 -0.82 1.79 1.03 0.00 0.00 0.00 175.76 178.33 3fky h SER 337 N -0.26 0.44 -0.29 0.00 0.87 -1.00 -2.29 113.55 111.02 3fky h SER 337 Ca -0.45 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 3fky h SER 337 Cb 1.24 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 3fky h SER 337 CO 0.62 0.11 0.00 -0.46 -0.53 0.00 0.00 176.83 176.57 3fky n ASN 338 N -4.60 2.10 -4.75 6.23 6.94 -0.96 -4.78 115.26 115.43 3fky n ASN 338 Ca 0.24 -2.12 -0.35 0.00 -0.02 0.00 0.00 54.58 52.32 3fky n ASN 338 Cb 0.84 -0.32 0.04 0.00 -2.36 0.00 0.00 39.78 37.97 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 -1.63 2.71 -0.43 1.53 1.10 -0.86 -4.85 121.20 118.76 3fky s ILE 339 Ca 0.22 0.42 -0.23 0.00 -0.51 0.00 0.00 60.65 60.55 3fky s ILE 339 Cb 0.13 -3.12 0.02 0.00 0.15 0.00 0.00 42.46 39.64 3fky s ILE 339 CO 0.12 -0.11 0.77 -0.62 -2.11 0.00 0.00 174.94 172.98 3fky s ASP 340 N -1.74 6.43 0.42 4.50 -1.08 -1.26 -4.95 116.67 118.98 3fky s ASP 340 Ca 0.76 -0.04 0.21 0.00 -0.52 0.00 0.00 52.55 52.95 3fky s ASP 340 Cb -0.29 -2.38 1.16 0.00 -1.46 0.00 0.00 42.92 39.96 3fky s ASP 340 CO 0.34 -0.86 1.77 1.55 0.52 0.00 0.00 175.17 178.50 3fky h PRO 341 N 8.87 0.33 -0.65 4.34 0.13 -1.94 0.11 132.00 143.20 3fky h PRO 341 Ca -0.25 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 64.87 3fky h PRO 341 Cb 1.09 -0.07 -0.03 0.00 0.13 0.00 0.00 31.00 32.11 3fky h PRO 341 CO 0.94 0.22 0.42 1.88 -0.23 0.00 0.00 178.00 181.23 3fky h TYR 342 N 0.34 0.82 -0.11 1.56 0.05 -1.90 0.24 116.97 117.97 3fky h TYR 342 Ca 0.59 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 59.36 3fky h TYR 342 Cb 1.61 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 39.07 3fky h TYR 342 CO -0.00 0.52 -0.04 -0.07 -1.05 0.00 0.00 178.16 177.52 3fky h LEU 343 N 0.88 0.22 0.57 3.88 3.38 -1.09 -0.45 115.31 122.70 3fky h LEU 343 Ca 0.24 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 3fky h LEU 343 Cb -0.09 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 40.60 3fky h LEU 343 CO -0.05 0.56 -0.27 0.58 0.09 0.00 0.00 178.44 179.34 3fky h VAL 344 N -0.12 0.40 -0.12 1.22 2.07 -1.09 -1.14 116.25 117.46 3fky h VAL 344 Ca 0.03 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 67.32 3fky h VAL 344 Cb 0.47 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 3fky h VAL 344 CO 0.01 0.03 -0.19 0.71 0.02 0.00 0.00 177.57 178.15 3fky h THR 345 N -0.88 1.20 0.81 2.57 1.35 -0.62 -0.24 112.91 117.10 3fky h THR 345 Ca -0.08 -0.91 -0.04 0.00 -0.55 0.00 0.00 66.41 64.83 3fky h THR 345 Cb 0.63 1.32 0.01 0.00 -1.73 0.00 0.00 68.15 68.38 3fky h THR 345 CO 0.13 0.28 -0.39 1.23 -0.25 0.00 0.00 175.52 176.52 3fky h GLY 346 N 0.82 -1.14 2.00 5.82 0.00 -0.98 -2.04 103.07 107.56 3fky h GLY 346 Ca 0.04 0.42 -0.06 0.00 0.00 0.00 0.00 47.33 47.72 3fky h GLY 346 CO 0.03 -0.41 -0.30 1.19 0.00 0.00 0.00 176.54 177.05 3fky h ILE 347 N -1.19 0.92 0.11 2.60 2.10 -1.09 -1.02 117.51 119.95 3fky h ILE 347 Ca -0.11 -1.14 -0.00 0.00 1.08 0.00 0.00 64.86 64.69 3fky h ILE 347 Cb 0.85 1.67 -0.00 0.00 -1.09 0.00 0.00 36.82 38.24 3fky h ILE 347 CO 0.18 0.29 -0.07 -0.03 -1.08 0.00 0.00 178.15 177.45 3fky h MET 348 N 0.00 -0.17 -0.39 2.19 4.05 -0.97 -1.51 114.93 118.13 3fky h MET 348 Ca -0.00 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 3fky h MET 348 Cb 0.65 0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.47 3fky h MET 348 CO 0.04 -0.11 0.25 0.00 0.23 0.00 0.00 176.91 177.32 3fky h GLU 350 N 0.52 0.20 0.00 0.00 4.81 -0.95 0.34 114.58 119.51 3fky h GLU 350 Ca 0.14 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3fky h GLU 350 Cb -0.05 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.28 3fky h GLU 350 CO -0.03 0.14 -1.20 0.25 -0.73 0.00 0.00 179.01 177.44 3fky n THR 351 N -5.18 0.45 0.01 0.32 -2.24 -0.59 -1.61 114.28 105.45 3fky n THR 351 Ca 0.09 -0.51 -0.22 0.00 -2.27 0.00 0.00 64.05 61.15 3fky n THR 351 Cb 0.34 -0.22 -0.14 0.00 -2.10 0.00 0.00 70.33 68.21 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 0.82 0.00 2.28 2.07 -0.67 -3.41 116.25 117.34 3fky h VAL 352 Ca 0.00 -2.38 -0.34 0.00 0.82 0.00 0.00 66.70 64.80 3fky h VAL 352 Cb 0.97 2.59 -0.06 0.00 -1.52 0.00 0.00 31.29 33.27 3fky h VAL 352 CO 0.00 0.79 -2.18 0.00 0.02 0.00 0.00 177.57 176.21 3fky n GLY 354 N 1.68 4.24 3.54 0.00 0.00 -0.63 -5.03 105.19 108.98 3fky n GLY 354 Ca -0.27 -1.28 -0.28 0.00 0.00 0.00 0.00 46.02 44.18 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 -1.20 -0.16 0.01 4.61 0.00 -0.77 -4.57 121.76 119.68 3fky s ALA 355 Ca 0.00 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 51.75 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 -3.62 -0.03 0.42 0.00 0.00 0.00 175.76 172.53 3fky s ILE 356 N -2.60 0.20 -0.43 0.00 1.01 -1.25 -5.00 121.20 113.13 3fky s ILE 356 Ca 0.68 -0.35 0.26 0.00 0.00 0.00 0.00 60.65 61.24 3fky s ILE 356 Cb -0.23 -0.22 0.31 0.00 0.01 0.00 0.00 42.46 42.33 3fky s ILE 356 CO 0.63 -0.10 1.77 -2.24 0.00 0.00 0.00 174.94 175.00 3fky h ASP 357 N 5.66 0.00 1.54 3.58 2.03 -2.04 -2.88 116.42 124.30 3fky h ASP 357 Ca -0.28 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 55.99 3fky h ASP 357 Cb 1.20 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.70 3fky h ASP 357 CO 0.48 0.00 -0.14 -1.13 -1.03 0.00 0.00 179.24 177.42 3fky h ASN 358 N 0.00 0.00 -4.65 4.15 -1.24 -2.02 -3.46 115.58 108.37 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 0.65 0.00 -0.20 0.00 0.73 0.00 0.00 38.32 39.50 3fky h ASN 358 CO 0.00 0.14 0.03 0.00 -1.29 0.00 0.00 177.43 176.31 3fky s ALA 359 N -3.32 -1.48 -0.27 1.57 0.00 -1.09 -5.09 121.76 112.08 3fky s ALA 359 Ca 0.04 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.25 3fky s ALA 359 Cb 0.07 -0.32 0.08 0.00 0.00 0.00 0.00 23.12 22.95 3fky s ALA 359 CO 0.66 -0.32 0.03 0.34 0.00 0.00 0.00 175.76 176.47 3fky s ASP 360 N -0.71 3.90 0.13 0.00 -1.08 -1.26 -3.97 116.67 113.68 3fky s ASP 360 Ca -0.08 -1.44 -0.19 0.00 -0.52 0.00 0.00 52.55 50.33 3fky s ASP 360 Cb -0.02 -1.02 -0.02 0.00 -1.46 0.00 0.00 42.92 40.39 3fky s ASP 360 CO 0.06 -0.34 1.76 0.24 0.52 0.00 0.00 175.17 177.41 3fky h MET 361 N 8.01 0.23 -0.17 4.34 2.86 -1.94 -1.57 114.93 126.69 3fky h MET 361 Ca -0.14 -0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.41 3fky h MET 361 Cb 1.05 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 3fky h MET 361 CO 0.44 0.15 -0.23 0.00 1.06 0.00 0.00 176.91 178.33 3fky h THR 362 N 0.24 1.24 -0.62 2.22 1.03 -1.96 -1.85 112.91 113.22 3fky h THR 362 Ca 0.10 -1.10 -0.09 0.00 -0.01 0.00 0.00 66.41 65.32 3fky h THR 362 Cb 0.05 1.36 -0.02 0.00 -1.07 0.00 0.00 68.15 68.46 3fky h THR 362 CO -0.09 0.34 0.04 0.11 -0.01 0.00 0.00 175.52 175.92 3fky h LYS 363 N 0.28 1.05 -5.11 0.00 1.57 -1.84 -3.36 116.57 109.15 3fky h LYS 363 Ca 0.05 -0.30 -0.03 0.00 -1.87 0.00 0.00 60.65 58.49 3fky h LYS 363 Cb 0.56 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 3fky h LYS 363 CO 0.04 1.00 0.35 -1.91 -0.57 0.00 0.00 179.45 178.36 3fky n GLU 364 N -4.19 0.16 -2.70 3.15 4.07 -0.65 -4.22 120.64 116.25 3fky n GLU 364 Ca 0.03 -1.08 -0.05 0.00 -0.06 0.00 0.00 57.16 56.01 3fky n GLU 364 Cb 0.32 -3.10 0.05 0.00 -0.06 0.00 0.00 31.44 28.65 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 15.70 -1.79 0.01 4.31 3.01 -1.26 -4.99 117.46 132.45 3fky n PHE 365 Ca 0.36 -1.07 0.00 0.00 1.01 0.00 0.00 57.45 57.75 3fky n PHE 365 Cb 0.44 1.28 0.00 0.00 -0.01 0.00 0.00 39.48 41.19 3fky n PHE 365 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92