#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 3.09 3.98 5.14 0.00 -1.26 -5.05 105.19 111.09 3fky n GLY 22 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.32 2.24 0.04 1.61 0.52 -1.26 -4.59 118.95 117.18 3fky s ARG 23 Ca 0.00 -0.93 0.07 0.00 -0.52 0.00 0.00 55.73 54.35 3fky s ARG 23 Cb 0.00 -2.44 -0.02 0.00 0.52 0.00 0.00 34.95 33.01 3fky s ARG 23 CO 0.00 -0.97 -0.21 0.42 0.02 0.00 0.00 175.30 174.56 3fky s ILE 24 N -2.89 1.69 -0.17 1.52 -1.09 -0.09 -4.96 121.20 115.20 3fky s ILE 24 Ca 0.61 -1.18 -0.05 0.00 -2.23 0.00 0.00 60.65 57.80 3fky s ILE 24 Cb -0.08 -1.46 -0.03 0.00 -1.58 0.00 0.00 42.46 39.31 3fky s ILE 24 CO 0.40 0.24 -0.00 -0.63 -1.23 0.00 0.00 174.94 173.72 3fky s ILE 25 N -0.77 4.14 -0.22 2.92 1.01 -1.26 0.02 121.20 127.04 3fky s ILE 25 Ca 0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 60.65 60.44 3fky s ILE 25 Cb -0.09 -2.84 0.01 0.00 0.01 0.00 0.00 42.46 39.54 3fky s ILE 25 CO 0.02 0.47 -0.07 0.00 0.00 0.00 0.00 174.94 175.36 3fky s ALA 26 N 0.52 2.72 -0.31 9.38 0.00 -0.12 -1.22 121.76 132.73 3fky s ALA 26 Ca -0.01 -1.27 -0.20 0.00 0.00 0.00 0.00 51.96 50.48 3fky s ALA 26 Cb -0.14 -1.64 -0.01 0.00 0.00 0.00 0.00 23.12 21.34 3fky s ALA 26 CO 0.02 -0.54 0.64 -2.00 0.00 0.00 0.00 175.76 173.88 3fky s GLU 27 N 1.41 3.87 -0.11 0.00 2.56 -0.36 -1.28 118.70 124.80 3fky s GLU 27 Ca 0.04 0.28 -0.25 0.00 0.00 0.00 0.00 54.97 55.04 3fky s GLU 27 Cb -0.15 -3.74 -0.02 0.00 2.00 0.00 0.00 34.13 32.22 3fky s GLU 27 CO -0.05 -0.60 0.82 0.71 -0.56 0.00 0.00 175.26 175.57 3fky s TYR 28 N 2.64 3.51 -0.09 5.30 1.51 0.64 0.02 117.35 130.88 3fky s TYR 28 Ca 0.25 1.33 0.03 0.00 -1.01 0.00 0.00 57.07 57.67 3fky s TYR 28 Cb -0.15 -2.97 -0.01 0.00 -0.11 0.00 0.00 41.96 38.73 3fky s TYR 28 CO 0.12 -0.10 -0.21 0.08 -1.11 0.00 0.00 175.55 174.33 3fky s VAL 29 N 1.55 2.40 0.26 0.71 1.01 0.31 -2.12 120.40 124.52 3fky s VAL 29 Ca 0.40 -0.91 -0.01 0.00 0.00 0.00 0.00 61.98 61.46 3fky s VAL 29 Cb -0.18 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 3fky s VAL 29 CO 0.17 0.55 0.26 -1.66 0.00 0.00 0.00 175.10 174.43 3fky s TRP 30 N 0.15 1.15 -0.13 5.22 -2.14 -0.39 -0.88 118.94 121.91 3fky s TRP 30 Ca -0.11 -1.33 -0.06 0.00 2.66 0.00 0.00 56.10 57.26 3fky s TRP 30 Cb -0.16 -0.41 -0.04 0.00 -3.10 0.00 0.00 33.47 29.76 3fky s TRP 30 CO 0.06 -0.81 0.09 0.42 -2.66 0.00 0.00 176.95 174.05 3fky s ILE 31 N -3.83 5.06 0.15 0.66 1.01 -1.26 -0.71 121.20 122.28 3fky s ILE 31 Ca 0.36 0.05 0.02 0.00 0.00 0.00 0.00 60.65 61.07 3fky s ILE 31 Cb 0.04 -3.21 0.02 0.00 0.01 0.00 0.00 42.46 39.31 3fky s ILE 31 CO 0.16 0.57 0.17 -0.90 0.00 0.00 0.00 174.94 174.94 3fky n ASP 32 N 2.47 0.93 -0.39 3.58 5.75 -0.72 -4.91 116.55 123.26 3fky n ASP 32 Ca -0.19 -1.45 0.04 0.00 -0.01 0.00 0.00 54.79 53.19 3fky n ASP 32 Cb 0.54 -0.07 0.15 0.00 -1.03 0.00 0.00 41.12 40.70 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 3.16 -0.03 0.00 6.12 0.00 -0.47 -4.63 105.19 109.34 3fky n GLY 33 Ca 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 0.09 0.00 -1.23 2.61 -2.24 -1.26 -4.88 114.28 107.37 3fky n THR 34 Ca 0.08 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.66 3fky n THR 34 Cb 0.19 -0.13 0.20 0.00 -2.10 0.00 0.00 70.33 68.48 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 4.44 3.55 3.38 0.00 -1.26 -5.00 105.19 115.30 3fky n GLY 35 Ca 0.00 -1.09 -0.26 0.00 0.00 0.00 0.00 46.02 44.67 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 -1.39 3.53 0.36 1.61 -0.87 -1.26 -4.98 114.94 111.94 3fky s ASN 36 Ca 0.56 -1.29 -0.09 0.00 -1.57 0.00 0.00 52.86 50.47 3fky s ASN 36 Cb 0.47 -0.32 -0.06 0.00 -0.02 0.00 0.00 41.25 41.32 3fky s ASN 36 CO 0.10 -0.36 0.69 -0.76 -2.57 0.00 0.00 177.10 174.20 3fky s LEU 37 N -3.62 3.92 0.12 0.60 2.01 -1.26 -1.75 118.68 118.70 3fky s LEU 37 Ca 0.34 0.99 0.05 0.00 0.01 0.00 0.00 54.13 55.51 3fky s LEU 37 Cb 0.06 -3.84 -0.04 0.00 0.01 0.00 0.00 46.19 42.38 3fky s LEU 37 CO 0.16 -0.32 -0.11 -0.13 1.01 0.00 0.00 176.35 176.96 3fky s ARG 38 N -3.72 0.97 0.08 1.70 1.81 0.12 -4.89 118.95 115.01 3fky s ARG 38 Ca 0.49 -1.28 -0.22 0.00 -1.72 0.00 0.00 55.73 52.99 3fky s ARG 38 Cb -0.10 -0.67 0.06 0.00 -0.45 0.00 0.00 34.95 33.78 3fky s ARG 38 CO 0.30 0.11 0.53 -1.54 -0.68 0.00 0.00 175.30 174.02 3fky s SER 39 N -2.70 -0.46 0.11 0.23 1.04 -1.26 -1.26 113.70 109.41 3fky s SER 39 Ca 0.10 0.11 -0.07 0.00 0.48 0.00 0.00 55.95 56.57 3fky s SER 39 Cb -0.02 0.52 -0.01 0.00 0.10 0.00 0.00 66.02 66.61 3fky s SER 39 CO 0.01 -0.79 0.18 -1.59 0.98 0.00 0.00 173.24 172.03 3fky s LYS 40 N -2.85 0.93 0.10 4.02 -2.85 -0.90 -5.00 119.74 113.19 3fky s LYS 40 Ca -0.03 -1.11 0.08 0.00 -1.00 0.00 0.00 55.97 53.91 3fky s LYS 40 Cb -0.00 0.33 -0.04 0.00 -2.06 0.00 0.00 37.83 36.06 3fky s LYS 40 CO -0.05 -0.30 -0.17 0.20 0.10 0.00 0.00 175.35 175.14 3fky s GLY 41 N -2.92 1.69 0.01 0.59 0.00 -1.26 -0.26 107.32 105.17 3fky s GLY 41 Ca 0.11 -1.30 0.01 0.00 0.00 0.00 0.00 44.72 43.53 3fky s GLY 41 CO -0.06 -1.27 -0.03 1.09 0.00 0.00 0.00 173.10 172.83 3fky s ARG 42 N -2.02 0.26 0.27 2.90 1.70 -0.40 -4.99 118.95 116.67 3fky s ARG 42 Ca 0.18 -0.39 -0.29 0.00 -0.47 0.00 0.00 55.73 54.76 3fky s ARG 42 Cb -0.11 -0.06 -0.09 0.00 -0.57 0.00 0.00 34.95 34.12 3fky s ARG 42 CO 0.10 0.00 0.97 0.99 -1.08 0.00 0.00 175.30 176.28 3fky s THR 43 N -0.81 3.99 0.07 4.99 2.01 -1.26 -0.94 115.64 123.69 3fky s THR 43 Ca -0.08 1.92 0.08 0.00 0.31 0.00 0.00 61.69 63.92 3fky s THR 43 Cb -0.06 -4.19 -0.03 0.00 0.01 0.00 0.00 72.50 68.24 3fky s THR 43 CO -0.00 0.39 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.34 3fky s LEU 44 N -1.44 2.23 0.37 4.42 1.43 0.10 -4.93 118.68 120.86 3fky s LEU 44 Ca 0.44 -0.61 0.09 0.00 -1.03 0.00 0.00 54.13 53.03 3fky s LEU 44 Cb -0.25 -0.99 0.74 0.00 0.03 0.00 0.00 46.19 45.72 3fky s LEU 44 CO 0.32 0.13 1.88 0.11 0.23 0.00 0.00 176.35 179.02 3fky h LYS 45 N 4.49 0.22 -3.75 1.70 1.79 -1.92 -0.21 116.57 118.89 3fky h LYS 45 Ca -0.45 -0.06 -0.12 0.00 -2.18 0.00 0.00 60.65 57.84 3fky h LYS 45 Cb 1.17 -0.03 -0.17 0.00 -1.58 0.00 0.00 32.23 31.62 3fky h LYS 45 CO 0.42 0.40 -0.49 0.21 -1.08 0.00 0.00 179.45 178.91 3fky s LYS 46 N -4.62 0.62 0.34 3.15 2.20 -1.26 -4.46 119.74 115.71 3fky s LYS 46 Ca -0.05 -0.74 -0.26 0.00 -0.36 0.00 0.00 55.97 54.55 3fky s LYS 46 Cb 0.15 0.25 -0.13 0.00 -1.51 0.00 0.00 37.83 36.59 3fky s LYS 46 CO 0.74 -0.16 0.98 -2.13 -0.36 0.00 0.00 175.35 174.42 3fky n ARG 47 N 0.70 1.32 -3.59 4.03 0.63 -1.26 -4.75 116.66 113.75 3fky n ARG 47 Ca -0.19 0.47 -0.37 0.00 -0.92 0.00 0.00 57.85 56.84 3fky n ARG 47 Cb 0.59 -1.90 -0.06 0.00 0.45 0.00 0.00 32.46 31.54 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 -1.16 5.21 0.00 5.15 -1.09 -1.26 -4.97 121.20 123.08 3fky s ILE 48 Ca 0.60 0.63 0.00 0.00 -2.23 0.00 0.00 60.65 59.65 3fky s ILE 48 Cb -0.64 -3.62 0.00 0.00 -1.58 0.00 0.00 42.46 36.61 3fky s ILE 48 CO 0.59 0.54 0.23 0.35 -1.23 0.00 0.00 174.94 175.42 3fky n THR 49 N 2.32 0.00 -3.52 2.92 -2.24 -1.26 -5.06 114.28 107.44 3fky n THR 49 Ca -0.15 -0.35 -0.16 0.00 -2.27 0.00 0.00 64.05 61.12 3fky n THR 49 Cb 0.53 1.20 -0.05 0.00 -2.10 0.00 0.00 70.33 69.90 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 -0.24 -0.61 0.53 3.42 1.04 -1.26 -5.02 113.70 111.55 3fky s SER 50 Ca 0.00 0.61 0.32 0.00 0.48 0.00 0.00 55.95 57.36 3fky s SER 50 Cb 0.00 0.52 1.46 0.00 0.10 0.00 0.00 66.02 68.10 3fky s SER 50 CO 0.00 -0.61 1.86 0.40 0.98 0.00 0.00 173.24 175.87 3fky h ILE 51 N 2.85 0.51 -0.06 -1.02 2.04 -1.97 -0.78 117.51 119.09 3fky h ILE 51 Ca -0.27 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 65.60 3fky h ILE 51 Cb 1.16 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 37.70 3fky h ILE 51 CO 0.38 0.01 0.05 0.44 0.00 0.00 0.00 178.15 179.02 3fky h ASP 52 N 0.04 0.00 1.56 1.72 3.32 -1.98 -1.43 116.42 119.65 3fky h ASP 52 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 3fky h ASP 52 Cb 1.83 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.38 3fky h ASP 52 CO -0.03 0.00 0.00 1.56 -1.72 0.00 0.00 179.24 179.05 3fky h GLN 53 N 0.00 0.00 -6.06 3.56 4.20 -1.56 -3.44 115.11 111.81 3fky h GLN 53 Ca 0.03 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.16 3fky h GLN 53 Cb 0.12 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.84 3fky h GLN 53 CO -0.00 0.00 0.53 -0.51 -0.67 0.00 0.00 178.83 178.18 3fky s LEU 54 N -5.65 4.17 0.55 1.46 1.43 -0.54 -5.03 118.68 115.07 3fky s LEU 54 Ca 0.06 1.31 -0.19 0.00 -1.03 0.00 0.00 54.13 54.29 3fky s LEU 54 Cb 0.08 -3.39 -0.06 0.00 0.03 0.00 0.00 46.19 42.85 3fky s LEU 54 CO 0.60 -0.48 1.10 -2.16 0.23 0.00 0.00 176.35 175.64 3fky s PRO 55 N 2.37 3.39 1.12 1.29 0.04 -1.26 -4.82 135.00 137.13 3fky s PRO 55 Ca 0.42 1.48 -0.13 0.00 0.04 0.00 0.00 61.00 62.81 3fky s PRO 55 Cb -0.17 -2.02 0.26 0.00 0.04 0.00 0.00 34.50 32.61 3fky s PRO 55 CO 0.12 -0.79 1.05 -1.21 0.04 0.00 0.00 177.00 176.21 3fky s GLU 56 N -3.45 -0.58 0.22 4.56 2.02 -1.26 -4.66 118.70 115.54 3fky s GLU 56 Ca 0.70 0.67 -0.11 0.00 0.02 0.00 0.00 54.97 56.25 3fky s GLU 56 Cb -0.21 -1.61 0.04 0.00 0.10 0.00 0.00 34.13 32.46 3fky s GLU 56 CO 0.28 -3.45 0.55 1.87 0.02 0.00 0.00 175.26 174.53 3fky n TRP 57 N -4.70 -1.68 -3.83 1.61 -0.00 -0.75 -4.96 117.44 103.13 3fky n TRP 57 Ca 0.03 -1.10 -0.07 0.00 -0.00 0.00 0.00 57.50 56.37 3fky n TRP 57 Cb 0.56 0.55 -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 -2.40 -0.17 0.36 5.87 4.22 -1.26 0.21 114.94 121.76 3fky s ASN 58 Ca 0.11 -0.71 -0.17 0.00 -2.14 0.00 0.00 52.86 49.96 3fky s ASN 58 Cb -0.03 0.71 0.04 0.00 1.28 0.00 0.00 41.25 43.25 3fky s ASN 58 CO 0.07 -1.34 0.76 0.72 -2.04 0.00 0.00 177.10 175.27 3fky s PHE 59 N -3.35 0.06 -0.74 1.54 -0.12 -0.52 -4.92 117.98 109.93 3fky s PHE 59 Ca 0.13 -0.67 -0.22 0.00 -0.05 0.00 0.00 56.93 56.12 3fky s PHE 59 Cb -0.05 0.78 0.08 0.00 -0.63 0.00 0.00 43.02 43.21 3fky s PHE 59 CO 0.07 -1.47 1.03 0.34 -0.05 0.00 0.00 175.22 175.14 3fky s ASP 60 N -3.03 6.28 0.46 1.98 -1.08 -1.26 -1.91 116.67 118.11 3fky s ASP 60 Ca 0.15 -1.21 0.31 0.00 -0.52 0.00 0.00 52.55 51.28 3fky s ASP 60 Cb -0.05 -2.43 1.65 0.00 -1.46 0.00 0.00 42.92 40.63 3fky s ASP 60 CO 0.10 -1.38 1.95 1.23 0.52 0.00 0.00 175.17 177.60 3fky h GLY 61 N 11.29 0.00 2.00 2.66 0.00 -1.88 -0.28 103.07 116.86 3fky h GLY 61 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.16 3fky h GLY 61 CO 1.18 0.00 0.00 1.48 0.00 0.00 0.00 176.54 179.20 3fky h SER 62 N 0.00 0.00 0.16 0.19 4.64 -1.90 0.12 113.55 116.76 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 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 3fky h SER 62 CO 0.00 0.00 -0.12 -1.20 -0.87 0.00 0.00 176.83 174.64 3fky n SER 63 N -3.00 0.98 0.00 4.97 7.64 -0.12 -3.98 113.62 120.11 3fky n SER 63 Ca 0.04 -1.03 0.00 0.00 1.01 0.00 0.00 58.87 58.89 3fky n SER 63 Cb 0.50 0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 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 -0.47 0.56 -3.12 0.44 -2.24 -1.07 -5.03 114.28 103.35 3fky n THR 64 Ca 0.16 -0.57 -0.13 0.00 -2.27 0.00 0.00 64.05 61.24 3fky n THR 64 Cb 0.32 0.72 0.07 0.00 -2.10 0.00 0.00 70.33 69.34 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 -0.28 -2.18 0.00 3.42 2.85 -0.92 -1.37 115.26 116.78 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 0.35 -4.16 0.00 0.00 1.24 0.00 0.00 39.78 37.21 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 -3.45 2.61 -4.04 1.20 6.02 0.36 -3.73 117.38 116.35 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 -0.28 -0.08 0.00 1.02 0.00 0.00 30.24 31.53 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 -0.35 0.34 -0.23 -1.58 0.00 -0.87 -4.78 121.76 114.29 3fky s ALA 67 Ca 0.00 -1.13 0.22 0.00 0.00 0.00 0.00 51.96 51.06 3fky s ALA 67 Cb 0.00 0.93 -0.07 0.00 0.00 0.00 0.00 23.12 23.98 3fky s ALA 67 CO 0.00 -0.61 0.91 -2.30 0.00 0.00 0.00 175.76 173.76 3fky n PRO 68 N -0.20 0.58 0.00 0.00 -0.02 -1.26 -4.02 135.00 130.08 3fky n PRO 68 Ca -0.06 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 3fky n PRO 68 Cb 0.63 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 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 1.22 1.83 2.29 -1.23 0.00 -1.26 -5.01 105.19 103.03 3fky n GLY 69 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.71 -0.46 0.00 1.61 -0.00 -1.26 -5.14 115.22 109.26 3fky n HIS 70 Ca 0.00 -0.61 0.00 0.00 -0.00 0.00 0.00 57.72 57.11 3fky n HIS 70 Cb 0.00 1.02 0.00 0.00 -0.00 0.00 0.00 29.99 31.01 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 -0.44 0.00 -4.71 4.39 2.03 -1.26 -5.08 116.55 111.48 3fky n ASP 73 Ca -0.17 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 54.89 3fky n ASP 73 Cb 0.62 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.96 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 3.94 0.09 5.18 1.09 -0.80 -4.47 121.20 126.23 3fky s ILE 74 Ca 0.00 -1.45 0.04 0.00 -1.10 0.00 0.00 60.65 58.15 3fky s ILE 74 Cb 0.00 -3.04 -0.04 0.00 -1.06 0.00 0.00 42.46 38.32 3fky s ILE 74 CO 0.00 -0.20 0.02 -0.31 -0.10 0.00 0.00 174.94 174.35 3fky s TYR 75 N -1.91 3.04 -0.26 3.97 1.51 -0.14 -1.44 117.35 122.13 3fky s TYR 75 Ca 0.30 -0.00 -0.03 0.00 -1.01 0.00 0.00 57.07 56.32 3fky s TYR 75 Cb -0.09 -1.55 0.02 0.00 -0.11 0.00 0.00 41.96 40.23 3fky s TYR 75 CO 0.21 0.49 -0.02 -0.51 -1.11 0.00 0.00 175.55 174.61 3fky s LEU 76 N -2.36 3.35 -0.39 -1.29 1.43 0.56 -1.28 118.68 118.69 3fky s LEU 76 Ca 0.27 -0.78 -0.12 0.00 -1.03 0.00 0.00 54.13 52.47 3fky s LEU 76 Cb -0.12 -1.73 0.03 0.00 0.03 0.00 0.00 46.19 44.40 3fky s LEU 76 CO 0.19 -0.14 0.24 -0.54 0.23 0.00 0.00 176.35 176.34 3fky s LYS 77 N 1.39 2.83 0.22 1.70 1.02 -0.04 -1.82 119.74 125.04 3fky s LYS 77 Ca 0.01 -1.12 -0.31 0.00 0.02 0.00 0.00 55.97 54.58 3fky s LYS 77 Cb -0.17 -3.80 -0.15 0.00 -0.52 0.00 0.00 37.83 33.19 3fky s LYS 77 CO -0.02 -0.75 1.16 -2.30 -0.92 0.00 0.00 175.35 172.51 3fky n PRO 78 N 5.03 1.39 0.00 -1.68 -0.02 -1.26 -1.19 135.00 137.27 3fky n PRO 78 Ca -0.11 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 3fky n PRO 78 Cb 0.46 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 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 1.15 0.00 -3.69 -1.45 0.31 0.86 -4.85 118.33 110.67 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 0.28 -0.40 -0.06 0.00 -0.91 0.00 0.00 33.84 32.76 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 -1.57 -0.82 0.01 3.52 0.00 -1.01 -5.01 121.76 116.87 3fky s ALA 80 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 51.96 51.82 3fky s ALA 80 Cb 0.00 0.52 0.02 0.00 0.00 0.00 0.00 23.12 23.65 3fky s ALA 80 CO 0.00 -0.54 0.26 1.52 0.00 0.00 0.00 175.76 177.00 3fky s TYR 81 N -3.26 -0.10 0.16 0.00 1.13 -1.26 -0.33 117.35 113.70 3fky s TYR 81 Ca -0.00 0.06 -0.07 0.00 -1.41 0.00 0.00 57.07 55.65 3fky s TYR 81 Cb 0.01 0.05 -0.02 0.00 -1.10 0.00 0.00 41.96 40.91 3fky s TYR 81 CO -0.08 -0.40 0.24 0.71 -2.51 0.00 0.00 175.55 173.50 3fky s TYR 82 N -1.76 0.53 0.33 -3.49 2.02 -0.11 -4.98 117.35 109.89 3fky s TYR 82 Ca -0.11 -0.89 -0.29 0.00 -0.37 0.00 0.00 57.07 55.42 3fky s TYR 82 Cb -0.04 -0.16 -0.10 0.00 -0.40 0.00 0.00 41.96 41.26 3fky s TYR 82 CO 0.01 -0.68 1.33 -2.14 -1.57 0.00 0.00 175.55 172.50 3fky s PRO 83 N -3.99 4.33 -0.40 -1.71 0.02 -1.26 0.17 135.00 132.16 3fky s PRO 83 Ca 0.20 2.25 -0.29 0.00 0.02 0.00 0.00 61.00 63.18 3fky s PRO 83 Cb 0.04 -3.06 0.02 0.00 0.02 0.00 0.00 34.50 31.52 3fky s PRO 83 CO 0.01 -0.23 1.10 0.34 -0.33 0.00 0.00 177.00 177.90 3fky s ASP 84 N -0.44 6.78 0.57 2.53 -1.08 -0.60 -4.38 116.67 120.05 3fky s ASP 84 Ca 0.49 0.75 0.35 0.00 -0.52 0.00 0.00 52.55 53.62 3fky s ASP 84 Cb -0.40 -2.54 1.54 0.00 -1.46 0.00 0.00 42.92 40.06 3fky s ASP 84 CO 0.54 -1.07 2.05 -0.65 0.52 0.00 0.00 175.17 176.56 3fky h PRO 85 N 8.67 0.00 0.00 4.34 0.11 -1.90 0.36 132.00 143.57 3fky h PRO 85 Ca -0.22 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.82 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 1.08 0.01 -0.70 0.74 -0.21 0.00 0.00 178.00 178.92 3fky h PHE 86 N 0.00 0.00 0.00 0.65 0.04 -1.96 -3.38 116.94 112.29 3fky h PHE 86 Ca -0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 3fky h PHE 86 Cb 0.43 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.57 3fky h PHE 86 CO 0.00 0.47 -0.13 0.00 -0.60 0.00 0.00 178.31 178.05 3fky h ARG 87 N -1.00 0.00 0.00 1.51 3.08 -1.93 -3.48 114.38 112.55 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 0.73 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.78 3fky h ARG 87 CO -0.06 0.13 0.00 0.54 -1.07 0.00 0.00 179.97 179.50 3fky n ARG 88 N -3.26 0.00 0.00 0.04 1.74 0.13 -4.82 116.66 110.49 3fky n ARG 88 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3fky n ARG 88 Cb 0.39 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.83 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 0.98 0.66 -0.13 0.00 -1.26 -2.15 105.19 103.29 3fky n GLY 89 Ca 0.00 -0.68 0.05 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.50 1.87 -4.80 1.61 8.00 -1.26 -4.82 116.55 115.66 3fky n ASP 90 Ca 0.00 -2.07 -0.34 0.00 0.71 0.00 0.00 54.79 53.09 3fky n ASP 90 Cb 0.00 -0.27 -0.02 0.00 -0.02 0.00 0.00 41.12 40.81 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 -0.88 6.09 0.02 -2.24 0.01 -0.91 -4.73 114.94 112.28 3fky s ASN 91 Ca 0.21 1.93 -0.01 0.00 -0.71 0.00 0.00 52.86 54.28 3fky s ASN 91 Cb 0.12 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.21 3fky s ASN 91 CO 0.13 -0.96 0.00 -0.51 -1.51 0.00 0.00 177.10 174.25 3fky s ILE 92 N -2.09 0.10 -0.17 0.60 2.07 -0.36 -1.56 121.20 119.79 3fky s ILE 92 Ca 0.67 -0.83 -0.06 0.00 -1.41 0.00 0.00 60.65 59.02 3fky s ILE 92 Cb -0.17 -0.28 -0.04 0.00 0.13 0.00 0.00 42.46 42.10 3fky s ILE 92 CO 0.26 -0.45 0.03 -0.69 -1.91 0.00 0.00 174.94 172.17 3fky s VAL 93 N -1.38 4.47 -0.26 4.00 1.01 0.13 -1.22 120.40 127.15 3fky s VAL 93 Ca -0.15 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 3fky s VAL 93 Cb -0.09 -3.00 0.04 0.00 0.00 0.00 0.00 36.38 33.33 3fky s VAL 93 CO -0.00 0.47 -0.06 -0.69 0.00 0.00 0.00 175.10 174.82 3fky s VAL 94 N 0.38 2.73 -0.25 2.92 1.01 0.10 -0.94 120.40 126.36 3fky s VAL 94 Ca 0.01 -1.23 -0.29 0.00 0.00 0.00 0.00 61.98 60.46 3fky s VAL 94 Cb -0.13 -2.47 0.00 0.00 0.00 0.00 0.00 36.38 33.79 3fky s VAL 94 CO 0.01 0.09 1.16 -0.22 0.00 0.00 0.00 175.10 176.14 3fky s LEU 95 N 1.26 4.04 -0.00 3.92 2.96 0.55 -0.53 118.68 130.89 3fky s LEU 95 Ca -0.03 1.35 0.06 0.00 -0.22 0.00 0.00 54.13 55.30 3fky s LEU 95 Cb -0.18 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 3fky s LEU 95 CO -0.04 -0.82 -0.19 0.00 -1.32 0.00 0.00 176.35 173.98 3fky s ALA 96 N 3.60 2.52 0.11 5.97 0.00 -0.06 -0.09 121.76 133.80 3fky s ALA 96 Ca 0.49 -1.11 -0.04 0.00 0.00 0.00 0.00 51.96 51.30 3fky s ALA 96 Cb -0.16 -0.77 -0.05 0.00 0.00 0.00 0.00 23.12 22.14 3fky s ALA 96 CO 0.14 0.56 0.33 0.00 0.00 0.00 0.00 175.76 176.78 3fky s ALA 97 N -0.80 3.85 -0.24 0.00 0.00 -0.33 -4.42 121.76 119.82 3fky s ALA 97 Ca 0.13 -0.62 -0.15 0.00 0.00 0.00 0.00 51.96 51.32 3fky s ALA 97 Cb -0.10 -2.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 3fky s ALA 97 CO 0.02 0.70 0.37 0.00 0.00 0.00 0.00 175.76 176.86 3fky s TYR 99 N 1.69 2.43 1.07 0.00 2.02 -0.40 -1.70 117.35 122.45 3fky s TYR 99 Ca 0.16 -0.82 -0.13 0.00 -0.37 0.00 0.00 57.07 55.92 3fky s TYR 99 Cb -0.15 -1.60 0.23 0.00 -0.40 0.00 0.00 41.96 40.04 3fky s TYR 99 CO 0.09 -0.28 1.07 -0.80 -1.57 0.00 0.00 175.55 174.05 3fky s ASN 100 N 0.02 1.89 0.00 2.29 0.01 0.81 -0.96 114.94 119.01 3fky s ASN 100 Ca -0.09 1.29 0.07 0.00 -0.71 0.00 0.00 52.86 53.42 3fky s ASN 100 Cb -0.15 -2.00 0.31 0.00 0.41 0.00 0.00 41.25 39.82 3fky s ASN 100 CO 0.05 -3.60 1.21 -0.46 -1.51 0.00 0.00 177.10 172.80 3fky n ASN 101 N -4.49 0.00 0.08 -1.22 6.94 -1.26 -1.39 115.26 113.91 3fky n ASN 101 Ca 0.04 0.47 -0.01 0.00 -0.02 0.00 0.00 54.58 55.05 3fky n ASN 101 Cb 0.56 -0.48 0.25 0.00 -2.36 0.00 0.00 39.78 37.76 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 0.31 0.00 0.53 3.32 -1.98 -3.46 116.42 115.14 3fky h ASP 102 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 3fky h ASP 102 Cb 0.12 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3fky h ASP 102 CO 0.00 0.61 0.00 0.61 -1.72 0.00 0.00 179.24 178.74 3fky n GLY 103 N -0.39 0.83 3.78 2.75 0.00 -0.49 -5.08 105.19 106.60 3fky n GLY 103 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.10 3.77 0.02 2.61 -4.23 -1.26 -4.81 115.64 109.64 3fky s THR 104 Ca 0.00 1.39 -0.30 0.00 -1.18 0.00 0.00 61.69 61.60 3fky s THR 104 Cb 0.00 -3.73 -0.07 0.00 1.34 0.00 0.00 72.50 70.04 3fky s THR 104 CO 0.00 0.04 1.58 -2.84 -0.54 0.00 0.00 174.62 172.86 3fky s PRO 105 N -2.39 4.22 0.96 3.99 0.02 -1.26 -0.13 135.00 140.40 3fky s PRO 105 Ca 0.56 2.19 -0.16 0.00 0.02 0.00 0.00 61.00 63.61 3fky s PRO 105 Cb -0.22 -3.69 -0.10 0.00 0.02 0.00 0.00 34.50 30.51 3fky s PRO 105 CO 0.28 -0.72 -0.44 -1.71 -0.33 0.00 0.00 177.00 174.08 3fky n ASN 106 N 5.94 -4.82 -0.34 2.53 5.15 -0.69 -4.70 115.26 118.33 3fky n ASN 106 Ca 0.15 0.25 0.13 0.00 -0.60 0.00 0.00 54.58 54.51 3fky n ASN 106 Cb 0.42 -0.89 0.26 0.00 -0.53 0.00 0.00 39.78 39.04 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 -1.09 0.01 -0.70 1.20 1.57 -1.91 -0.28 116.57 115.37 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 1.30 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 3fky h LYS 107 CO 0.27 0.01 0.00 1.19 -0.57 0.00 0.00 179.45 180.35 3fky n PHE 108 N -5.50 1.17 -3.07 -1.35 3.72 -1.26 -4.55 117.46 106.62 3fky n PHE 108 Ca 0.22 -0.53 -0.43 0.00 -0.05 0.00 0.00 57.45 56.66 3fky n PHE 108 Cb 0.71 -0.10 -0.06 0.00 -0.94 0.00 0.00 39.48 39.09 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 -0.95 6.27 0.00 4.37 3.84 -0.12 -4.82 114.94 123.54 3fky s ASN 109 Ca 0.49 -0.64 0.09 0.00 0.21 0.00 0.00 52.86 53.01 3fky s ASN 109 Cb 0.28 -2.33 0.20 0.00 -0.55 0.00 0.00 41.25 38.85 3fky s ASN 109 CO 0.30 -0.94 1.09 1.41 -2.79 0.00 0.00 177.10 176.16 3fky n HIS 110 N 6.50 0.27 -0.07 0.43 8.25 -1.26 -4.52 115.22 124.82 3fky n HIS 110 Ca -0.03 -0.34 -0.15 0.00 -0.26 0.00 0.00 57.72 56.93 3fky n HIS 110 Cb 0.46 -0.02 -0.05 0.00 1.12 0.00 0.00 29.99 31.50 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 1.79 0.78 0.18 -0.41 2.43 -1.93 -2.96 114.38 114.26 3fky h ARG 111 Ca 0.00 -0.51 -0.01 0.00 -0.81 0.00 0.00 59.98 58.65 3fky h ARG 111 Cb 0.60 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 3fky h ARG 111 CO 0.00 1.14 -0.09 1.25 -1.51 0.00 0.00 179.97 180.76 3fky h HIS 112 N 0.52 -0.22 -0.20 2.20 2.76 -1.99 -1.02 115.15 117.19 3fky h HIS 112 Ca 0.00 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.22 3fky h HIS 112 Cb 1.13 0.07 -0.06 0.00 1.55 0.00 0.00 27.41 30.10 3fky h HIS 112 CO 0.08 -0.06 -0.24 1.49 -1.30 0.00 0.00 177.93 177.91 3fky h GLU 113 N -0.35 -0.26 -0.65 5.26 4.57 -1.83 -2.30 114.58 119.02 3fky h GLU 113 Ca -0.02 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.23 3fky h GLU 113 Cb 0.27 0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 28.86 3fky h GLU 113 CO 0.04 -0.17 0.36 0.00 -1.18 0.00 0.00 179.01 178.06 3fky h ALA 114 N 0.75 0.87 -0.74 2.92 0.00 -1.40 -2.19 119.26 119.46 3fky h ALA 114 Ca 0.12 0.02 0.16 0.00 0.00 0.00 0.00 54.91 55.21 3fky h ALA 114 Cb 0.45 -0.12 -0.11 0.00 0.00 0.00 0.00 17.79 18.02 3fky h ALA 114 CO -0.35 0.03 0.19 0.00 0.00 0.00 0.00 179.25 179.12 3fky h ALA 115 N 1.34 0.98 -0.39 0.00 0.00 -0.63 -0.01 119.26 120.55 3fky h ALA 115 Ca 0.29 0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.44 3fky h ALA 115 Cb 0.18 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 18.10 3fky h ALA 115 CO -0.18 -0.33 -0.38 0.87 0.00 0.00 0.00 179.25 179.23 3fky h LYS 116 N 0.29 -0.29 -0.49 0.00 1.57 -1.06 0.23 116.57 116.83 3fky h LYS 116 Ca 0.42 0.02 0.03 0.00 -1.87 0.00 0.00 60.65 59.25 3fky h LYS 116 Cb 0.71 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.05 3fky h LYS 116 CO -0.50 -0.19 0.27 -0.07 -0.57 0.00 0.00 179.45 178.39 3fky h LEU 117 N -0.30 0.42 -1.10 2.94 3.38 -1.05 -0.20 115.31 119.40 3fky h LEU 117 Ca 0.15 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 3fky h LEU 117 Cb 0.57 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 3fky h LEU 117 CO -0.55 0.29 0.15 -0.26 0.09 0.00 0.00 178.44 178.16 3fky h PHE 118 N 0.54 0.80 -0.37 1.13 0.04 -0.35 -1.30 116.94 117.43 3fky h PHE 118 Ca 0.20 -0.06 -0.11 0.00 2.80 0.00 0.00 57.97 60.80 3fky h PHE 118 Cb 0.06 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 37.96 3fky h PHE 118 CO -0.08 0.66 -0.20 0.00 -0.60 0.00 0.00 178.31 178.09 3fky h ALA 119 N 1.40 0.52 -0.09 2.45 0.00 -0.07 -1.24 119.26 122.23 3fky h ALA 119 Ca 0.17 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.73 3fky h ALA 119 Cb 0.25 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3fky h ALA 119 CO -0.01 0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.73 3fky h ALA 120 N 0.79 0.08 -0.79 0.00 0.00 -0.65 -2.88 119.26 115.81 3fky h ALA 120 Ca 0.08 0.02 -0.39 0.00 0.00 0.00 0.00 54.91 54.62 3fky h ALA 120 Cb 0.76 0.04 -0.23 0.00 0.00 0.00 0.00 17.79 18.35 3fky h ALA 120 CO 0.06 -0.46 0.49 0.72 0.00 0.00 0.00 179.25 180.06 3fky n HIS 121 N -5.10 2.44 -0.31 0.00 8.25 -0.53 -4.52 115.22 115.45 3fky n HIS 121 Ca -0.05 -1.52 0.20 0.00 -0.26 0.00 0.00 57.72 56.09 3fky n HIS 121 Cb 0.06 -0.79 0.38 0.00 1.12 0.00 0.00 29.99 30.76 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 -0.73 -0.07 0.04 -0.41 5.02 -0.48 -0.81 118.16 120.72 3fky n LYS 122 Ca 0.47 1.36 0.03 0.00 -2.02 0.00 0.00 58.31 58.15 3fky n LYS 122 Cb 1.43 -2.26 0.41 0.00 -0.02 0.00 0.00 35.03 34.59 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 0.41 1.07 4.39 3.32 -1.87 -2.22 116.42 121.52 3fky h ASP 123 Ca 0.65 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.60 3fky h ASP 123 Cb 1.51 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.95 3fky h ASP 123 CO -0.82 0.37 -0.31 -0.33 -1.72 0.00 0.00 179.24 176.43 3fky h GLU 124 N 0.46 0.00 -5.86 3.56 3.07 -1.35 -3.47 114.58 110.99 3fky h GLU 124 Ca 0.11 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 58.67 3fky h GLU 124 Cb 0.09 0.00 0.11 0.00 -0.84 0.00 0.00 28.75 28.11 3fky h GLU 124 CO -0.01 0.31 -0.78 0.39 -1.40 0.00 0.00 179.01 177.51 3fky n GLU 125 N -3.37 -1.60 -1.96 2.33 1.02 -0.84 -0.68 120.64 115.54 3fky n GLU 125 Ca 0.01 0.77 -0.41 0.00 -0.02 0.00 0.00 57.16 57.51 3fky n GLU 125 Cb 0.52 -4.84 -0.01 0.00 -0.02 0.00 0.00 31.44 27.08 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 -3.34 2.42 0.01 -3.67 1.01 -1.26 -3.88 121.20 112.49 3fky s ILE 126 Ca 0.37 0.41 0.08 0.00 0.00 0.00 0.00 60.65 61.51 3fky s ILE 126 Cb -0.10 -3.26 -0.03 0.00 0.01 0.00 0.00 42.46 39.09 3fky s ILE 126 CO 0.81 0.09 -0.23 0.26 0.00 0.00 0.00 174.94 175.87 3fky s TRP 127 N -0.90 2.42 0.14 3.97 0.52 0.11 -3.09 118.94 122.11 3fky s TRP 127 Ca 0.53 -0.35 0.08 0.00 0.02 0.00 0.00 56.10 56.37 3fky s TRP 127 Cb -0.43 -1.47 -0.04 0.00 -1.15 0.00 0.00 33.47 30.38 3fky s TRP 127 CO 0.55 0.11 -0.19 -0.06 0.02 0.00 0.00 176.95 177.38 3fky s PHE 128 N -0.76 1.76 -0.15 -1.98 0.08 -0.52 -2.03 117.98 114.39 3fky s PHE 128 Ca 0.12 -0.46 -0.04 0.00 0.12 0.00 0.00 56.93 56.67 3fky s PHE 128 Cb -0.10 -0.92 0.06 0.00 -0.57 0.00 0.00 43.02 41.50 3fky s PHE 128 CO 0.02 0.26 0.15 0.20 -0.10 0.00 0.00 175.22 175.75 3fky s GLY 129 N -2.35 0.15 -0.03 4.36 0.00 -0.72 -0.73 107.32 108.00 3fky s GLY 129 Ca 0.11 0.14 -0.07 0.00 0.00 0.00 0.00 44.72 44.90 3fky s GLY 129 CO 0.05 1.81 0.24 1.08 0.00 0.00 0.00 173.10 176.29 3fky s LEU 130 N 2.24 4.39 -0.66 0.66 1.43 -0.37 -0.61 118.68 125.75 3fky s LEU 130 Ca 0.04 0.57 -0.05 0.00 -1.03 0.00 0.00 54.13 53.65 3fky s LEU 130 Cb -0.14 -2.49 0.17 0.00 0.03 0.00 0.00 46.19 43.76 3fky s LEU 130 CO -0.09 0.31 0.50 -1.61 0.23 0.00 0.00 176.35 175.70 3fky s GLU 131 N -1.49 2.77 -0.47 1.70 2.02 -0.47 -1.31 118.70 121.45 3fky s GLU 131 Ca 0.23 -2.49 -0.29 0.00 0.02 0.00 0.00 54.97 52.44 3fky s GLU 131 Cb -0.13 -3.88 0.03 0.00 0.10 0.00 0.00 34.13 30.25 3fky s GLU 131 CO 0.13 -1.20 1.12 -1.14 0.02 0.00 0.00 175.26 174.19 3fky s GLN 132 N 0.03 3.72 0.13 1.61 2.00 0.03 -3.22 119.66 123.96 3fky s GLN 132 Ca 0.17 0.54 -0.08 0.00 -2.00 0.00 0.00 55.36 53.99 3fky s GLN 132 Cb -0.18 -3.91 -0.06 0.00 0.80 0.00 0.00 33.01 29.66 3fky s GLN 132 CO -0.04 -1.36 0.42 -1.21 -0.50 0.00 0.00 175.29 172.59 3fky s GLU 133 N 4.40 3.72 0.22 1.67 2.02 -0.68 -1.06 118.70 128.97 3fky s GLU 133 Ca 0.47 0.10 -0.10 0.00 0.02 0.00 0.00 54.97 55.46 3fky s GLU 133 Cb -0.07 -2.88 -0.01 0.00 0.10 0.00 0.00 34.13 31.26 3fky s GLU 133 CO 0.31 0.48 0.37 1.52 0.02 0.00 0.00 175.26 177.96 3fky s TYR 134 N -1.56 0.51 -0.01 1.61 -0.85 -0.19 -4.71 117.35 112.15 3fky s TYR 134 Ca 0.38 -0.84 0.03 0.00 -0.52 0.00 0.00 57.07 56.12 3fky s TYR 134 Cb -0.13 -0.00 -0.01 0.00 0.38 0.00 0.00 41.96 42.20 3fky s TYR 134 CO 0.21 -0.86 -0.09 0.99 -1.52 0.00 0.00 175.55 174.27 3fky s THR 135 N -4.03 0.74 0.23 -3.49 2.01 -0.61 -1.10 115.64 109.39 3fky s THR 135 Ca 0.24 -0.42 -0.12 0.00 0.31 0.00 0.00 61.69 61.70 3fky s THR 135 Cb 0.02 -0.62 -0.07 0.00 0.01 0.00 0.00 72.50 71.83 3fky s THR 135 CO 0.07 0.19 0.58 -0.76 -0.69 0.00 0.00 174.62 174.02 3fky s LEU 136 N -0.26 4.18 0.00 4.42 1.43 -0.11 -0.96 118.68 127.38 3fky s LEU 136 Ca 0.03 1.02 -0.03 0.00 -1.03 0.00 0.00 54.13 54.12 3fky s LEU 136 Cb -0.04 -3.67 -0.01 0.00 0.03 0.00 0.00 46.19 42.50 3fky s LEU 136 CO -0.00 -0.06 0.05 -0.36 0.23 0.00 0.00 176.35 176.21 3fky s PHE 137 N -1.78 0.10 0.99 0.29 0.08 -0.31 -1.66 117.98 115.70 3fky s PHE 137 Ca 0.47 -0.21 -0.16 0.00 0.12 0.00 0.00 56.93 57.14 3fky s PHE 137 Cb -0.12 -0.09 -0.03 0.00 -0.57 0.00 0.00 43.02 42.21 3fky s PHE 137 CO 0.20 -0.18 -0.20 -0.25 -0.10 0.00 0.00 175.22 174.69 3fky n ASP 138 N 1.93 -3.44 0.16 1.36 9.92 0.21 -1.25 116.55 125.44 3fky n ASP 138 Ca -0.20 0.19 0.12 0.00 -0.53 0.00 0.00 54.79 54.37 3fky n ASP 138 Cb 0.56 -0.97 0.58 0.00 -0.64 0.00 0.00 41.12 40.65 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 -1.41 0.00 -0.45 -1.24 2.86 -1.89 -2.60 114.93 110.20 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 1.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.97 3fky h MET 139 CO 0.30 0.00 0.00 0.66 1.06 0.00 0.00 176.91 178.93 3fky n TYR 140 N -2.32 1.09 -2.38 -0.22 4.01 -1.26 -4.95 117.16 111.14 3fky n TYR 140 Ca 0.00 -0.66 -0.16 0.00 -0.16 0.00 0.00 57.90 56.91 3fky n TYR 140 Cb 0.13 -0.22 -0.00 0.00 -0.31 0.00 0.00 39.34 38.94 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 0.47 -4.86 -4.58 7.72 8.00 -0.98 -5.01 116.55 117.31 3fky n ASP 141 Ca 0.21 -0.04 -0.30 0.00 0.71 0.00 0.00 54.79 55.37 3fky n ASP 141 Cb 0.78 -3.94 -0.10 0.00 -0.02 0.00 0.00 41.12 37.84 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 -2.33 4.41 0.16 -2.24 1.01 -1.26 -4.86 116.67 111.56 3fky s ASP 142 Ca 0.03 -0.37 -0.34 0.00 0.71 0.00 0.00 52.55 52.59 3fky s ASP 142 Cb -0.01 -0.86 -0.15 0.00 1.01 0.00 0.00 42.92 42.91 3fky s ASP 142 CO 0.04 0.19 1.36 0.52 0.21 0.00 0.00 175.17 177.48 3fky n VAL 143 N 0.77 0.47 -1.87 -1.27 0.31 -1.26 0.68 118.33 116.15 3fky n VAL 143 Ca -0.14 -0.12 -0.42 0.00 -0.01 0.00 0.00 64.34 63.66 3fky n VAL 143 Cb 0.52 -1.14 -0.03 0.00 -0.91 0.00 0.00 33.84 32.28 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 0.27 1.76 0.00 3.52 6.14 -0.67 -2.50 117.35 125.87 3fky s TYR 144 Ca 0.76 -0.05 0.00 0.00 0.64 0.00 0.00 57.07 58.42 3fky s TYR 144 Cb -0.79 -4.05 0.00 0.00 0.42 0.00 0.00 41.96 37.54 3fky s TYR 144 CO 0.47 -4.52 0.00 0.41 0.64 0.00 0.00 175.55 172.55 3fky n GLY 145 N 4.27 1.56 3.77 8.97 0.00 -1.26 -4.78 105.19 117.72 3fky n GLY 145 Ca 0.18 0.00 -0.40 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 -3.04 3.15 0.13 1.61 0.52 -1.04 -4.95 118.94 115.32 3fky s TRP 146 Ca 0.00 1.53 -0.22 0.00 0.02 0.00 0.00 56.10 57.43 3fky s TRP 146 Cb 0.00 -3.48 -0.13 0.00 -1.15 0.00 0.00 33.47 28.71 3fky s TRP 146 CO 0.00 -1.39 0.44 -2.30 0.02 0.00 0.00 176.95 173.72 3fky n PRO 147 N 0.54 0.00 -2.05 4.98 -0.02 -1.26 -4.79 135.00 132.41 3fky n PRO 147 Ca 0.02 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.07 3fky n PRO 147 Cb 0.44 -0.79 -0.03 0.00 -0.02 0.00 0.00 33.50 33.11 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 -0.66 3.57 0.00 -0.52 1.02 -1.26 -1.87 119.74 120.01 3fky s LYS 148 Ca 0.50 1.56 0.00 0.00 0.02 0.00 0.00 55.97 58.05 3fky s LYS 148 Cb -0.72 -4.12 0.00 0.00 -0.52 0.00 0.00 37.83 32.46 3fky s LYS 148 CO 0.42 -1.57 0.00 0.41 -0.92 0.00 0.00 175.35 173.69 3fky n GLY 149 N 5.06 2.62 0.00 -3.33 0.00 -1.26 -4.93 105.19 103.34 3fky n GLY 149 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -1.98 4.94 3.05 -0.02 0.00 -0.78 -5.18 105.19 105.21 3fky n GLY 150 Ca 0.00 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.17 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 2.62 0.20 1.24 1.61 2.02 -1.26 -4.53 117.35 119.24 3fky s TYR 151 Ca 0.00 -0.43 -0.20 0.00 -0.37 0.00 0.00 57.07 56.07 3fky s TYR 151 Cb 0.00 -0.15 0.30 0.00 -0.40 0.00 0.00 41.96 41.71 3fky s TYR 151 CO 0.00 -0.26 1.08 -1.25 -1.57 0.00 0.00 175.55 173.55 3fky s PRO 152 N -1.78 -1.51 1.12 -1.71 0.04 -1.26 -4.73 135.00 125.16 3fky s PRO 152 Ca -0.12 -0.04 -0.12 0.00 0.04 0.00 0.00 61.00 60.76 3fky s PRO 152 Cb -0.07 -1.56 0.26 0.00 0.04 0.00 0.00 34.50 33.17 3fky s PRO 152 CO -0.01 -3.91 1.04 0.00 0.04 0.00 0.00 177.00 174.15 3fky n ALA 153 N -4.91 -2.46 -1.27 8.56 0.00 -1.26 -4.96 120.51 114.21 3fky n ALA 153 Ca 0.13 -1.05 -0.31 0.00 0.00 0.00 0.00 53.44 52.22 3fky n ALA 153 Cb 0.60 -2.04 0.10 0.00 0.00 0.00 0.00 19.45 18.11 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 -4.44 1.99 0.81 0.00 0.02 -1.26 -4.97 135.00 127.14 3fky s PRO 154 Ca 0.68 1.03 -0.13 0.00 0.02 0.00 0.00 61.00 62.60 3fky s PRO 154 Cb -0.25 -1.88 0.08 0.00 0.02 0.00 0.00 34.50 32.47 3fky s PRO 154 CO 0.64 -1.79 1.19 1.04 -0.33 0.00 0.00 177.00 177.74 3fky n GLN 155 N -3.61 0.19 0.00 5.54 6.02 -1.26 -4.51 117.38 119.75 3fky n GLN 155 Ca 0.08 0.14 0.00 0.00 -0.01 0.00 0.00 57.00 57.21 3fky n GLN 155 Cb 0.54 -2.42 0.00 0.00 1.02 0.00 0.00 30.24 29.37 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 0.58 3.44 0.44 1.08 0.00 -1.26 -4.94 105.19 104.52 3fky n GLY 156 Ca 0.13 -0.53 0.12 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 1.59 -0.09 1.61 -0.04 -1.26 -4.28 135.00 132.53 3fky n PRO 157 Ca 0.00 -0.87 -0.13 0.00 -0.04 0.00 0.00 63.50 62.46 3fky n PRO 157 Cb 0.00 -1.42 -0.14 0.00 -0.04 0.00 0.00 33.50 31.90 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 0.07 0.23 -1.66 0.54 4.01 -1.26 -4.48 117.16 114.61 3fky n TYR 158 Ca 0.17 0.07 -0.47 0.00 -0.16 0.00 0.00 57.90 57.52 3fky n TYR 158 Cb 0.30 -1.04 -0.04 0.00 -0.31 0.00 0.00 39.34 38.25 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 -2.99 2.33 -2.82 -0.72 9.36 -1.08 -0.91 117.16 120.33 3fky n TYR 159 Ca -0.34 -0.10 -0.19 0.00 3.32 0.00 0.00 57.90 60.59 3fky n TYR 159 Cb 1.09 -2.70 0.00 0.00 -0.63 0.00 0.00 39.34 37.10 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 -2.37 1.78 -0.18 0.00 0.00 -0.09 -4.94 107.32 101.52 3fky s GLY 161 Ca 0.18 0.46 -0.10 0.00 0.00 0.00 0.00 44.72 45.25 3fky s GLY 161 CO 0.22 0.84 0.44 0.54 0.00 0.00 0.00 173.10 175.13 3fky s VAL 162 N -2.68 -0.02 0.00 1.40 0.11 -1.26 -4.88 120.40 113.06 3fky s VAL 162 Ca 0.65 0.08 0.00 0.00 -2.93 0.00 0.00 61.98 59.78 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 0.54 0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.96 3fky n GLY 163 N 4.19 3.85 0.27 6.54 0.00 -1.26 -4.85 105.19 113.94 3fky n GLY 163 Ca -0.22 -1.61 0.06 0.00 0.00 0.00 0.00 46.02 44.24 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 0.87 -0.00 4.61 0.00 -2.01 -0.56 119.26 122.17 3fky h ALA 164 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3fky h ALA 164 Cb 0.00 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3fky h ALA 164 CO 0.00 -0.40 -0.29 0.41 0.00 0.00 0.00 179.25 178.97 3fky n GLY 165 N -1.39 -0.85 0.00 0.00 0.00 -1.26 -4.22 105.19 97.47 3fky n GLY 165 Ca 0.14 -0.36 0.12 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 -0.94 0.00 -3.68 1.61 4.76 -0.22 -4.87 118.16 114.82 3fky n LYS 166 Ca 0.11 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.40 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 -3.00 0.03 -0.09 -0.18 0.11 -1.24 -4.46 120.40 111.56 3fky s VAL 167 Ca 0.11 -0.25 0.02 0.00 -2.93 0.00 0.00 61.98 58.94 3fky s VAL 167 Cb 0.18 -0.74 0.01 0.00 -1.53 0.00 0.00 36.38 34.30 3fky s VAL 167 CO 0.67 -0.14 -0.16 -0.31 -3.33 0.00 0.00 175.10 171.84 3fky s TYR 168 N -1.01 1.86 -1.29 1.54 2.02 -1.26 -4.79 117.35 114.41 3fky s TYR 168 Ca -0.10 -0.77 -0.04 0.00 -0.37 0.00 0.00 57.07 55.78 3fky s TYR 168 Cb -0.03 -1.32 0.00 0.00 -0.40 0.00 0.00 41.96 40.21 3fky s TYR 168 CO 0.05 -0.37 0.51 0.00 -1.57 0.00 0.00 175.55 174.17 3fky n ALA 169 N 3.88 -0.81 -0.27 3.71 0.00 -1.26 -4.81 120.51 120.97 3fky n ALA 169 Ca -0.21 0.24 0.14 0.00 0.00 0.00 0.00 53.44 53.62 3fky n ALA 169 Cb 0.52 -3.34 0.42 0.00 0.00 0.00 0.00 19.45 17.05 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 -1.17 0.58 -0.99 0.00 2.43 -1.99 -1.26 114.38 111.98 3fky h ARG 170 Ca -0.44 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 58.70 3fky h ARG 170 Cb 1.30 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.67 3fky h ARG 170 CO 0.47 0.38 0.65 0.38 -1.51 0.00 0.00 179.97 180.34 3fky h ASP 171 N 0.60 1.15 -0.01 -3.80 2.03 -1.99 0.21 116.42 114.61 3fky h ASP 171 Ca 0.47 -0.04 -0.00 0.00 -0.73 0.00 0.00 57.03 56.73 3fky h ASP 171 Cb 0.88 -0.29 -0.00 0.00 -0.83 0.00 0.00 39.33 39.10 3fky h ASP 171 CO -0.21 0.84 0.00 -0.03 -1.03 0.00 0.00 179.24 178.81 3fky h MET 172 N 1.35 0.02 -0.87 4.15 4.05 -1.63 -1.30 114.93 120.70 3fky h MET 172 Ca 0.36 -0.01 0.11 0.00 -0.28 0.00 0.00 59.70 59.89 3fky h MET 172 Cb -0.14 -0.00 -0.08 0.00 -0.80 0.00 0.00 31.60 30.58 3fky h MET 172 CO -0.08 0.33 0.49 0.82 0.23 0.00 0.00 176.91 178.70 3fky h ILE 173 N -0.28 0.86 -0.42 1.77 5.03 -0.94 -0.89 117.51 122.63 3fky h ILE 173 Ca 0.00 -0.27 -0.08 0.00 -0.12 0.00 0.00 64.86 64.39 3fky h ILE 173 Cb 0.32 0.01 -0.01 0.00 -3.03 0.00 0.00 36.82 34.10 3fky h ILE 173 CO 0.00 0.14 -0.06 -0.33 -0.68 0.00 0.00 178.15 177.22 3fky h GLU 174 N 0.78 0.79 -0.80 2.37 4.39 -0.50 -1.92 114.58 119.69 3fky h GLU 174 Ca 0.44 -0.28 0.08 0.00 0.34 0.00 0.00 59.36 59.93 3fky h GLU 174 Cb 0.47 -0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 29.00 3fky h GLU 174 CO -0.28 0.89 0.46 0.00 -1.16 0.00 0.00 179.01 178.92 3fky h ALA 175 N 0.87 1.11 0.19 3.43 0.00 -0.02 -0.48 119.26 124.36 3fky h ALA 175 Ca 0.11 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3fky h ALA 175 Cb 0.58 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3fky h ALA 175 CO 0.03 0.13 -0.09 1.25 0.00 0.00 0.00 179.25 180.57 3fky h HIS 176 N 0.81 -0.24 -0.58 0.00 -0.00 -1.02 -0.01 115.15 114.10 3fky h HIS 176 Ca 0.37 -0.01 0.10 0.00 -0.00 0.00 0.00 60.37 60.83 3fky h HIS 176 Cb 0.27 0.08 -0.11 0.00 -0.00 0.00 0.00 27.41 27.65 3fky h HIS 176 CO -0.06 -0.07 -0.39 -0.92 -0.00 0.00 0.00 177.93 176.49 3fky h TYR 177 N -0.36 -1.12 -0.37 5.26 -0.00 -0.77 0.98 116.97 120.59 3fky h TYR 177 Ca -0.03 0.08 0.07 0.00 -0.00 0.00 0.00 58.73 58.85 3fky h TYR 177 Cb 0.28 0.57 -0.07 0.00 -0.00 0.00 0.00 36.73 37.52 3fky h TYR 177 CO -0.03 -0.41 -0.06 0.00 -0.00 0.00 0.00 178.16 177.66 3fky h ARG 178 N -0.20 0.04 -0.07 1.82 -0.00 -0.87 -1.19 114.38 113.90 3fky h ARG 178 Ca 0.20 -0.00 0.04 0.00 -0.50 0.00 0.00 59.98 59.72 3fky h ARG 178 Cb 0.56 -0.01 -0.05 0.00 0.00 0.00 0.00 29.97 30.48 3fky h ARG 178 CO -0.69 0.02 -0.20 0.00 0.00 0.00 0.00 179.97 179.10 3fky h ALA 179 N 1.35 -0.20 -0.65 0.04 0.00 0.46 0.72 119.26 120.99 3fky h ALA 179 Ca 0.18 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.17 3fky h ALA 179 Cb 0.27 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 3fky h ALA 179 CO -0.35 -0.68 0.36 0.00 0.00 0.00 0.00 179.25 178.58 3fky h LEU 181 N 0.66 1.00 -0.71 0.00 3.38 -0.31 -1.63 115.31 117.70 3fky h LEU 181 Ca 0.29 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 3fky h LEU 181 Cb 0.19 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3fky h LEU 181 CO -0.18 0.82 0.44 0.22 0.09 0.00 0.00 178.44 179.83 3fky h TYR 182 N 1.11 0.92 0.00 1.13 3.20 -0.22 -0.86 116.97 122.25 3fky h TYR 182 Ca 0.28 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.15 3fky h TYR 182 Cb 0.05 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.02 3fky h TYR 182 CO 0.00 0.61 0.00 0.00 -1.64 0.00 0.00 178.16 177.13 3fky n ALA 183 N -2.31 1.82 -0.92 1.82 0.00 -0.57 -4.73 120.51 115.61 3fky n ALA 183 Ca 0.06 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3fky n ALA 183 Cb 0.04 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.13 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 0.34 0.48 3.67 0.00 0.00 -0.33 -4.37 105.19 104.99 3fky n GLY 184 Ca 0.04 -0.52 -0.34 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 4.33 -3.40 0.99 4.77 -0.67 -4.89 117.00 118.12 3fky n LEU 185 Ca 0.00 0.62 -0.39 0.00 -0.03 0.00 0.00 56.01 56.21 3fky n LEU 185 Cb 0.00 -1.49 -0.02 0.00 -2.33 0.00 0.00 43.42 39.59 3fky n LEU 185 CO 0.00 -1.73 2.80 1.21 -1.33 0.00 0.00 177.39 178.34 3fky n GLU 186 N -2.82 4.24 -2.88 3.23 4.07 -1.26 -4.68 120.64 120.54 3fky n GLU 186 Ca 0.14 -2.96 -0.42 0.00 -0.06 0.00 0.00 57.16 53.85 3fky n GLU 186 Cb 0.50 -2.69 -0.04 0.00 -0.06 0.00 0.00 31.44 29.14 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 0.14 4.65 -0.18 6.31 2.07 -1.26 -0.66 121.20 132.26 3fky s ILE 187 Ca 0.60 0.99 0.18 0.00 -1.41 0.00 0.00 60.65 61.02 3fky s ILE 187 Cb 0.18 -4.28 -0.02 0.00 0.13 0.00 0.00 42.46 38.47 3fky s ILE 187 CO -0.08 -0.52 1.07 0.77 -1.91 0.00 0.00 174.94 174.27 3fky h SER 188 N 8.54 0.00 0.00 4.50 4.64 -0.39 -3.48 113.55 127.36 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 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 3fky h SER 188 CO 0.95 0.37 0.00 0.61 -0.87 0.00 0.00 176.83 177.89 3fky n GLY 189 N 1.28 0.87 3.11 -0.77 0.00 -1.20 -4.98 105.19 103.50 3fky n GLY 189 Ca -0.04 -0.94 -0.08 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.06 -0.61 2.07 -1.26 -0.79 121.20 118.74 3fky s ILE 190 Ca 0.00 -1.53 -0.30 0.00 -1.41 0.00 0.00 60.65 57.41 3fky s ILE 190 Cb 0.00 -1.30 0.09 0.00 0.13 0.00 0.00 42.46 41.38 3fky s ILE 190 CO 0.00 -0.84 0.78 0.54 -1.91 0.00 0.00 174.94 173.51 3fky s ASN 191 N -2.69 -0.54 0.10 4.50 4.22 -0.69 -5.00 114.94 114.85 3fky s ASN 191 Ca 0.03 0.50 -0.30 0.00 -2.14 0.00 0.00 52.86 50.95 3fky s ASN 191 Cb 0.05 0.46 -0.06 0.00 1.28 0.00 0.00 41.25 42.98 3fky s ASN 191 CO -0.09 -0.57 1.02 0.00 -2.04 0.00 0.00 177.10 175.42 3fky s ALA 192 N -1.57 3.27 0.74 3.54 0.00 -1.26 -1.51 121.76 124.96 3fky s ALA 192 Ca -0.06 0.65 -0.03 0.00 0.00 0.00 0.00 51.96 52.52 3fky s ALA 192 Cb -0.00 -3.32 0.07 0.00 0.00 0.00 0.00 23.12 19.87 3fky s ALA 192 CO 0.04 -0.14 0.47 0.39 0.00 0.00 0.00 175.76 176.52 3fky n GLU 193 N 2.99 -0.07 -0.01 0.00 -0.58 0.90 -0.57 120.64 123.30 3fky n GLU 193 Ca 0.04 -1.00 -0.17 0.00 -0.42 0.00 0.00 57.16 55.61 3fky n GLU 193 Cb 0.49 -0.40 -0.11 0.00 -0.57 0.00 0.00 31.44 30.85 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 -0.85 1.44 -3.46 2.62 2.07 -1.86 -2.86 116.25 113.34 3fky h VAL 194 Ca -0.15 -2.00 -0.52 0.00 0.82 0.00 0.00 66.70 64.84 3fky h VAL 194 Cb 0.50 2.56 0.02 0.00 -1.52 0.00 0.00 31.29 32.84 3fky h VAL 194 CO 0.14 0.58 0.56 -0.32 0.02 0.00 0.00 177.57 178.55 3fky s MET 195 N -3.28 4.48 0.36 1.57 -2.45 -1.26 -4.15 119.30 114.57 3fky s MET 195 Ca -0.14 1.88 -0.29 0.00 -1.25 0.00 0.00 55.69 55.89 3fky s MET 195 Cb 0.03 -3.24 -0.11 0.00 1.25 0.00 0.00 34.83 32.76 3fky s MET 195 CO 0.81 -0.10 1.52 -2.30 1.05 0.00 0.00 175.02 175.99 3fky n PRO 196 N 2.59 2.69 -2.15 4.11 -0.02 -1.26 -1.58 135.00 139.38 3fky n PRO 196 Ca 0.05 0.95 -0.18 0.00 -2.02 0.00 0.00 63.50 62.29 3fky n PRO 196 Cb 0.45 -2.69 -0.03 0.00 -0.02 0.00 0.00 33.50 31.21 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 0.89 -5.28 -4.29 2.55 3.41 -1.26 -4.93 113.62 104.71 3fky n SER 197 Ca 0.03 0.10 -0.32 0.00 -0.26 0.00 0.00 58.87 58.41 3fky n SER 197 Cb 0.38 -4.35 -0.16 0.00 -0.26 0.00 0.00 64.21 59.82 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 -4.58 3.14 0.36 4.33 0.74 -0.62 -0.94 119.66 122.10 3fky s GLN 198 Ca 0.00 -0.80 0.04 0.00 0.05 0.00 0.00 55.36 54.65 3fky s GLN 198 Cb 0.00 -2.43 -0.05 0.00 1.10 0.00 0.00 33.01 31.63 3fky s GLN 198 CO 0.00 0.22 0.07 -1.58 -0.55 0.00 0.00 175.29 173.45 3fky s TRP 199 N 0.28 1.96 0.01 1.67 0.52 -0.26 -0.07 118.94 123.06 3fky s TRP 199 Ca -0.14 -1.00 0.01 0.00 0.02 0.00 0.00 56.10 54.98 3fky s TRP 199 Cb -0.17 -1.32 -0.01 0.00 -1.15 0.00 0.00 33.47 30.83 3fky s TRP 199 CO 0.07 -0.01 -0.03 -2.00 0.02 0.00 0.00 176.95 175.00 3fky s GLU 200 N -3.84 0.26 0.06 4.98 2.12 -0.57 -1.02 118.70 120.68 3fky s GLU 200 Ca 0.32 -0.29 0.05 0.00 0.36 0.00 0.00 54.97 55.41 3fky s GLU 200 Cb 0.07 -0.13 -0.03 0.00 0.26 0.00 0.00 34.13 34.31 3fky s GLU 200 CO 0.15 0.03 -0.15 -0.59 -0.54 0.00 0.00 175.26 174.15 3fky s PHE 201 N -0.55 1.29 -0.08 5.30 -0.12 -0.23 -1.70 117.98 121.89 3fky s PHE 201 Ca -0.04 -0.40 0.01 0.00 -0.05 0.00 0.00 56.93 56.45 3fky s PHE 201 Cb -0.04 -0.75 -0.03 0.00 -0.63 0.00 0.00 43.02 41.57 3fky s PHE 201 CO -0.00 0.06 -0.10 -0.65 -0.05 0.00 0.00 175.22 174.47 3fky s GLN 202 N -1.42 2.89 -0.18 1.99 1.11 0.03 -0.79 119.66 123.30 3fky s GLN 202 Ca 0.01 -0.62 0.01 0.00 0.01 0.00 0.00 55.36 54.77 3fky s GLN 202 Cb -0.09 -2.56 0.02 0.00 -1.01 0.00 0.00 33.01 29.37 3fky s GLN 202 CO 0.02 0.52 -0.18 0.08 0.01 0.00 0.00 175.29 175.74 3fky s VAL 203 N -0.44 1.92 0.00 1.09 1.01 -0.43 0.29 120.40 123.84 3fky s VAL 203 Ca 0.06 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3fky s VAL 203 Cb -0.12 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.49 3fky s VAL 203 CO 0.02 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.22 3fky n GLY 204 N 4.66 1.18 3.82 4.51 0.00 0.16 -1.24 105.19 118.28 3fky n GLY 204 Ca -0.19 -1.12 -0.36 0.00 0.00 0.00 0.00 46.02 44.35 3fky n GLY 204 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3fky s PRO 205 N -2.00 4.20 0.23 1.61 0.02 -1.26 -4.47 135.00 133.33 3fky s PRO 205 Ca 0.00 0.79 0.11 0.00 0.02 0.00 0.00 61.00 61.92 3fky s PRO 205 Cb 0.00 -2.91 -0.05 0.00 0.02 0.00 0.00 34.50 31.57 3fky s PRO 205 CO 0.00 0.42 -0.21 0.00 -0.33 0.00 0.00 177.00 176.88 3fky s THR 207 N -2.17 5.02 0.00 0.00 2.01 -1.26 -1.44 115.64 117.79 3fky s THR 207 Ca 0.25 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.31 3fky s THR 207 Cb -0.06 -3.32 0.00 0.00 0.01 0.00 0.00 72.50 69.13 3fky s THR 207 CO 0.12 0.38 0.00 0.61 -0.69 0.00 0.00 174.62 175.04 3fky n GLY 208 N 4.17 1.67 0.18 4.40 0.00 -1.18 -1.31 105.19 113.13 3fky n GLY 208 Ca -0.16 0.49 0.03 0.00 0.00 0.00 0.00 46.02 46.38 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 1.20 -0.93 -0.61 1.08 -1.94 -3.04 117.51 113.27 3fky h ILE 209 Ca 0.00 -1.42 0.15 0.00 -0.39 0.00 0.00 64.86 63.20 3fky h ILE 209 Cb 0.00 1.78 -0.09 0.00 -3.07 0.00 0.00 36.82 35.44 3fky h ILE 209 CO 0.00 0.39 0.54 0.44 -0.69 0.00 0.00 178.15 178.83 3fky h ASP 210 N 0.00 0.71 -0.11 1.72 3.32 -1.56 -1.42 116.42 119.08 3fky h ASP 210 Ca -0.00 0.08 0.04 0.00 0.02 0.00 0.00 57.03 57.17 3fky h ASP 210 Cb 0.75 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.20 3fky h ASP 210 CO 0.05 0.32 -0.19 -0.03 -1.72 0.00 0.00 179.24 177.67 3fky h MET 211 N 0.77 -0.24 0.40 3.56 4.05 -1.69 0.17 114.93 121.95 3fky h MET 211 Ca 0.50 0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.92 3fky h MET 211 Cb 0.66 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.51 3fky h MET 211 CO -0.34 -0.16 -0.26 0.78 0.23 0.00 0.00 176.91 177.17 3fky h GLY 212 N -0.25 -0.67 0.04 1.39 0.00 -1.51 -0.80 103.07 101.28 3fky h GLY 212 Ca 0.09 0.29 0.07 0.00 0.00 0.00 0.00 47.33 47.78 3fky h GLY 212 CO -0.26 -0.25 -0.27 -0.55 0.00 0.00 0.00 176.54 175.21 3fky h ASP 213 N -0.64 -0.87 -0.56 0.19 3.32 -0.91 -1.34 116.42 115.61 3fky h ASP 213 Ca -0.04 0.16 -0.09 0.00 0.02 0.00 0.00 57.03 57.08 3fky h ASP 213 Cb 0.53 0.41 -0.02 0.00 0.22 0.00 0.00 39.33 40.47 3fky h ASP 213 CO 0.04 -0.29 0.01 1.56 -1.72 0.00 0.00 179.24 178.83 3fky h GLN 214 N -0.25 0.98 -0.46 3.56 4.20 -0.56 -1.40 115.11 121.18 3fky h GLN 214 Ca 0.15 -0.31 -0.04 0.00 0.06 0.00 0.00 58.65 58.51 3fky h GLN 214 Cb 0.49 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 3fky h GLN 214 CO -0.44 0.98 0.14 1.25 -0.67 0.00 0.00 178.83 180.10 3fky h LEU 215 N 0.87 0.67 -0.64 1.46 5.85 -0.87 0.46 115.31 123.11 3fky h LEU 215 Ca 0.16 -0.21 0.06 0.00 0.84 0.00 0.00 57.88 58.73 3fky h LEU 215 Cb 0.53 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 3fky h LEU 215 CO 0.03 0.70 0.35 -0.50 -0.34 0.00 0.00 178.44 178.68 3fky h TRP 216 N 0.61 0.65 -0.23 1.25 4.06 -1.09 -0.12 115.95 121.08 3fky h TRP 216 Ca 0.15 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.12 3fky h TRP 216 Cb 0.27 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.22 3fky h TRP 216 CO 0.01 0.31 0.12 0.52 -3.56 0.00 0.00 178.44 175.85 3fky h MET 217 N 0.66 0.33 -0.82 0.49 2.86 -0.66 -0.90 114.93 116.88 3fky h MET 217 Ca 0.29 -0.04 0.15 0.00 -2.06 0.00 0.00 59.70 58.04 3fky h MET 217 Cb 0.17 -0.06 -0.10 0.00 0.06 0.00 0.00 31.60 31.67 3fky h MET 217 CO -0.18 0.32 0.39 0.00 1.06 0.00 0.00 176.91 178.50 3fky h ALA 218 N 0.99 1.23 -0.54 6.32 0.00 -0.55 0.98 119.26 127.69 3fky h ALA 218 Ca 0.08 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3fky h ALA 218 Cb 0.09 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3fky h ALA 218 CO -0.01 -0.16 0.25 0.00 0.00 0.00 0.00 179.25 179.33 3fky h ARG 219 N 0.54 0.79 -0.17 0.00 3.08 -0.66 0.06 114.38 118.02 3fky h ARG 219 Ca 0.46 -0.13 0.04 0.00 0.07 0.00 0.00 59.98 60.42 3fky h ARG 219 Cb 0.69 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.57 3fky h ARG 219 CO -0.40 0.66 -0.09 -0.92 -1.07 0.00 0.00 179.97 178.16 3fky h TYR 220 N 0.73 -0.21 -0.94 3.04 5.03 0.30 -1.80 116.97 123.12 3fky h TYR 220 Ca 0.18 0.02 0.06 0.00 2.58 0.00 0.00 58.73 61.57 3fky h TYR 220 Cb 0.14 0.12 -0.06 0.00 1.55 0.00 0.00 36.73 38.48 3fky h TYR 220 CO -0.00 -0.14 0.60 0.74 -1.32 0.00 0.00 178.16 178.04 3fky h PHE 221 N -0.08 1.12 0.72 -3.82 0.04 -0.54 -0.17 116.94 114.21 3fky h PHE 221 Ca 0.10 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.86 3fky h PHE 221 Cb 0.22 -0.37 0.01 0.00 2.20 0.00 0.00 35.95 38.01 3fky h PHE 221 CO -0.24 0.58 -0.34 1.25 -0.60 0.00 0.00 178.31 178.96 3fky h LEU 222 N 1.10 -0.82 -0.71 1.54 5.85 -0.52 0.12 115.31 121.87 3fky h LEU 222 Ca 0.40 0.03 0.14 0.00 0.84 0.00 0.00 57.88 59.29 3fky h LEU 222 Cb 0.15 0.21 -0.13 0.00 0.37 0.00 0.00 40.66 41.25 3fky h LEU 222 CO -0.17 -0.50 -0.17 0.45 -0.34 0.00 0.00 178.44 177.71 3fky h HIS 223 N -1.13 -0.37 -0.27 1.25 3.86 -1.22 -1.23 115.15 116.04 3fky h HIS 223 Ca -0.10 0.06 -0.06 0.00 -1.16 0.00 0.00 60.37 59.11 3fky h HIS 223 Cb 0.74 0.27 -0.01 0.00 1.06 0.00 0.00 27.41 29.47 3fky h HIS 223 CO 0.02 -0.30 -0.08 -0.09 0.86 0.00 0.00 177.93 178.34 3fky h ARG 224 N 0.00 0.53 -0.46 2.45 9.65 -0.89 -1.93 114.38 123.72 3fky h ARG 224 Ca 0.34 -0.21 -0.13 0.00 -1.10 0.00 0.00 59.98 58.88 3fky h ARG 224 Cb 0.52 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.06 3fky h ARG 224 CO -0.73 0.75 -0.23 -0.24 2.80 0.00 0.00 179.97 182.31 3fky h VAL 225 N 0.28 1.27 0.00 0.20 3.04 -0.56 -2.83 116.25 117.64 3fky h VAL 225 Ca 0.07 -1.40 -0.03 0.00 -1.01 0.00 0.00 66.70 64.33 3fky h VAL 225 Cb 0.56 1.17 -0.00 0.00 -2.01 0.00 0.00 31.29 31.01 3fky h VAL 225 CO 0.03 0.48 -0.14 0.00 -1.01 0.00 0.00 177.57 176.93 3fky h ALA 226 N 0.85 1.61 -0.98 3.17 0.00 -1.07 -0.97 119.26 121.86 3fky h ALA 226 Ca 0.10 -0.13 0.23 0.00 0.00 0.00 0.00 54.91 55.11 3fky h ALA 226 Cb 0.82 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.46 3fky h ALA 226 CO 0.07 0.18 0.56 0.93 0.00 0.00 0.00 179.25 180.99 3fky h GLU 227 N 0.00 0.58 0.00 0.00 5.08 -1.09 0.30 114.58 119.46 3fky h GLU 227 Ca -0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3fky h GLU 227 Cb 0.28 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3fky h GLU 227 CO 0.02 0.38 0.00 0.39 -1.00 0.00 0.00 179.01 178.80 3fky n GLU 228 N -4.88 0.14 -0.18 2.33 1.02 -0.37 -1.65 120.64 117.06 3fky n GLU 228 Ca 0.25 0.44 0.05 0.00 -0.02 0.00 0.00 57.16 57.88 3fky n GLU 228 Cb 0.68 -1.80 0.14 0.00 -0.02 0.00 0.00 31.44 30.44 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 -2.08 0.42 -2.68 -0.32 3.72 1.00 -4.96 117.46 112.56 3fky n PHE 229 Ca 0.02 -0.60 -0.19 0.00 -0.05 0.00 0.00 57.45 56.62 3fky n PHE 229 Cb 0.17 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 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 3.55 1.37 0.00 -0.66 -4.97 105.19 103.96 3fky n GLY 230 Ca 0.11 0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.94 4.18 0.02 -0.61 1.01 -0.78 -3.79 121.20 118.29 3fky s ILE 231 Ca 0.12 -0.26 -0.17 0.00 0.00 0.00 0.00 60.65 60.34 3fky s ILE 231 Cb -0.06 -2.85 -0.06 0.00 0.01 0.00 0.00 42.46 39.51 3fky s ILE 231 CO 0.15 0.49 0.50 -0.54 0.00 0.00 0.00 174.94 175.54 3fky s LYS 232 N 0.28 4.11 -0.18 2.79 1.02 -0.38 -4.10 119.74 123.29 3fky s LYS 232 Ca -0.01 0.58 -0.08 0.00 0.02 0.00 0.00 55.97 56.48 3fky s LYS 232 Cb -0.13 -3.26 -0.04 0.00 -0.52 0.00 0.00 37.83 33.87 3fky s LYS 232 CO 0.02 0.59 0.07 0.42 -0.92 0.00 0.00 175.35 175.53 3fky s ILE 233 N -0.84 4.84 -0.25 2.17 1.01 -1.26 -1.16 121.20 125.72 3fky s ILE 233 Ca 0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 60.65 60.88 3fky s ILE 233 Cb -0.18 -3.18 0.02 0.00 0.01 0.00 0.00 42.46 39.13 3fky s ILE 233 CO 0.16 0.47 -0.06 -0.55 0.00 0.00 0.00 174.94 174.95 3fky s SER 234 N 0.31 4.32 -0.05 3.58 0.15 -0.14 -4.96 113.70 116.91 3fky s SER 234 Ca 0.04 -0.83 0.13 0.00 0.70 0.00 0.00 55.95 55.99 3fky s SER 234 Cb -0.12 -1.67 0.47 0.00 -1.71 0.00 0.00 66.02 62.99 3fky s SER 234 CO -0.00 -0.12 1.35 0.49 1.20 0.00 0.00 173.24 176.16 3fky n PHE 235 N 4.68 0.90 -1.80 3.44 3.72 -1.26 -1.57 117.46 125.56 3fky n PHE 235 Ca -0.17 -0.38 -0.41 0.00 -0.05 0.00 0.00 57.45 56.45 3fky n PHE 235 Cb 0.47 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 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 -1.61 2.56 0.18 1.38 2.46 -1.26 -2.19 115.29 116.80 3fky s HIS 236 Ca 0.34 1.19 0.26 0.00 0.47 0.00 0.00 55.06 57.32 3fky s HIS 236 Cb 0.21 -4.00 1.06 0.00 -0.13 0.00 0.00 32.58 29.72 3fky s HIS 236 CO 0.19 -2.99 1.89 -1.35 -2.47 0.00 0.00 174.74 170.01 3fky h PRO 237 N 2.86 0.00 -1.81 2.88 0.11 -1.85 -3.37 132.00 130.82 3fky h PRO 237 Ca -0.51 0.00 -0.44 0.00 0.11 0.00 0.00 66.00 65.16 3fky h PRO 237 Cb 1.24 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 32.05 3fky h PRO 237 CO 0.63 0.18 -0.83 1.17 -0.21 0.00 0.00 178.00 178.95 3fky n LYS 238 N -3.39 0.37 0.10 1.05 3.00 -1.26 0.23 118.16 118.26 3fky n LYS 238 Ca -0.00 -2.78 0.01 0.00 -0.00 0.00 0.00 58.31 55.54 3fky n LYS 238 Cb 0.38 -1.55 0.33 0.00 0.00 0.00 0.00 35.03 34.20 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 5.18 0.28 -4.75 1.64 0.11 -1.84 -3.39 132.00 129.23 3fky h PRO 239 Ca 0.17 -0.08 -0.56 0.00 0.11 0.00 0.00 66.00 65.64 3fky h PRO 239 Cb 0.97 -0.03 -0.33 0.00 0.11 0.00 0.00 31.00 31.72 3fky h PRO 239 CO 0.28 0.46 -0.83 -0.51 -0.21 0.00 0.00 178.00 177.19 3fky s LEU 240 N -8.67 1.76 0.58 2.35 1.43 -1.26 -5.10 118.68 109.76 3fky s LEU 240 Ca -0.05 -0.36 -0.18 0.00 -1.03 0.00 0.00 54.13 52.50 3fky s LEU 240 Cb 0.15 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.36 3fky s LEU 240 CO 0.75 0.07 1.12 -0.54 0.23 0.00 0.00 176.35 177.97 3fky s LYS 241 N 0.58 3.21 0.00 1.70 1.02 -1.26 -4.58 119.74 120.41 3fky s LYS 241 Ca -0.16 1.53 0.00 0.00 0.02 0.00 0.00 55.97 57.36 3fky s LYS 241 Cb -0.16 -1.99 0.00 0.00 -0.52 0.00 0.00 37.83 35.15 3fky s LYS 241 CO 0.05 -0.95 0.00 0.41 -0.92 0.00 0.00 175.35 173.94 3fky n GLY 242 N -0.09 0.12 0.19 -3.33 0.00 -1.26 -4.59 105.19 96.23 3fky n GLY 242 Ca 0.11 -1.85 0.11 0.00 0.00 0.00 0.00 46.02 44.40 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 1.15 -4.72 1.61 9.92 -1.26 -4.91 116.55 118.35 3fky n ASP 243 Ca 0.00 -0.93 -0.43 0.00 -0.53 0.00 0.00 54.79 52.91 3fky n ASP 243 Cb 0.00 0.47 -0.03 0.00 -0.64 0.00 0.00 41.12 40.92 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 -0.91 2.69 -1.57 1.24 7.02 -1.26 -4.89 117.44 119.76 3fky n TRP 244 Ca 0.08 0.15 -0.38 0.00 -1.02 0.00 0.00 57.50 56.33 3fky n TRP 244 Cb 0.37 -2.63 0.05 0.00 -2.42 0.00 0.00 31.31 26.68 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 3.30 0.28 -2.51 -0.99 4.13 -1.26 -4.84 115.26 113.37 3fky n ASN 245 Ca 0.14 0.80 -0.07 0.00 1.68 0.00 0.00 54.58 57.13 3fky n ASN 245 Cb 0.34 -1.32 0.04 0.00 -1.54 0.00 0.00 39.78 37.30 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 1.42 -0.55 2.87 7.41 0.00 -1.26 -4.69 105.19 110.40 3fky n GLY 246 Ca 0.13 -1.78 -0.26 0.00 0.00 0.00 0.00 46.02 44.11 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 -3.60 1.18 0.48 4.61 0.00 0.14 -4.94 121.76 119.63 3fky s ALA 247 Ca 0.17 -0.46 0.06 0.00 0.00 0.00 0.00 51.96 51.74 3fky s ALA 247 Cb -0.01 -0.88 -0.00 0.00 0.00 0.00 0.00 23.12 22.23 3fky s ALA 247 CO 0.12 -0.45 0.31 0.20 0.00 0.00 0.00 175.76 175.94 3fky s GLY 248 N 1.77 2.35 -0.47 0.00 0.00 -1.26 -1.05 107.32 108.66 3fky s GLY 248 Ca 0.05 -1.58 0.08 0.00 0.00 0.00 0.00 44.72 43.26 3fky s GLY 248 CO -0.07 -1.90 0.65 0.00 0.00 0.00 0.00 173.10 171.77 3fky n HIS 250 N 0.96 1.82 -3.28 0.00 8.25 -1.20 -4.57 115.22 117.21 3fky n HIS 250 Ca 0.25 0.66 -0.39 0.00 -0.26 0.00 0.00 57.72 57.97 3fky n HIS 250 Cb 0.50 -2.40 -0.08 0.00 1.12 0.00 0.00 29.99 29.13 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 4.29 3.58 -0.11 -1.41 0.00 -0.64 -1.36 121.76 126.10 3fky s ALA 251 Ca 1.04 -0.62 -0.12 0.00 0.00 0.00 0.00 51.96 52.26 3fky s ALA 251 Cb -1.19 -2.82 -0.05 0.00 0.00 0.00 0.00 23.12 19.07 3fky s ALA 251 CO 0.67 -0.65 0.27 -0.80 0.00 0.00 0.00 175.76 175.26 3fky s ASN 252 N 1.47 6.50 0.04 0.00 0.01 0.22 -0.19 114.94 122.98 3fky s ASN 252 Ca 0.20 0.60 0.04 0.00 -0.71 0.00 0.00 52.86 52.99 3fky s ASN 252 Cb -0.16 -2.17 -0.02 0.00 0.41 0.00 0.00 41.25 39.32 3fky s ASN 252 CO 0.09 0.24 -0.12 -0.69 -1.51 0.00 0.00 177.10 175.11 3fky s VAL 253 N -0.29 0.93 -0.16 1.60 1.01 0.20 -1.76 120.40 121.94 3fky s VAL 253 Ca 0.17 -0.96 -0.28 0.00 0.00 0.00 0.00 61.98 60.91 3fky s VAL 253 Cb -0.14 -0.87 0.09 0.00 0.00 0.00 0.00 36.38 35.46 3fky s VAL 253 CO 0.06 -0.08 0.79 -0.94 0.00 0.00 0.00 175.10 174.93 3fky s SER 254 N -1.17 -0.61 0.37 3.32 1.04 -0.86 -1.38 113.70 114.41 3fky s SER 254 Ca -0.01 0.89 0.08 0.00 0.48 0.00 0.00 55.95 57.39 3fky s SER 254 Cb -0.08 0.81 -0.03 0.00 0.10 0.00 0.00 66.02 66.82 3fky s SER 254 CO 0.01 -0.41 0.26 0.42 0.98 0.00 0.00 173.24 174.50 3fky s THR 255 N -0.56 2.98 0.23 2.02 -4.23 -1.26 0.09 115.64 114.91 3fky s THR 255 Ca -0.05 -1.50 -0.08 0.00 -1.18 0.00 0.00 61.69 58.89 3fky s THR 255 Cb -0.02 -3.05 0.19 0.00 1.34 0.00 0.00 72.50 70.97 3fky s THR 255 CO 0.04 -0.11 1.70 0.50 -0.54 0.00 0.00 174.62 176.22 3fky h LYS 256 N 1.30 0.28 -0.60 3.99 3.64 -1.01 -1.48 116.57 122.68 3fky h LYS 256 Ca -0.43 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.01 3fky h LYS 256 Cb 1.26 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.95 3fky h LYS 256 CO 0.61 0.18 0.27 0.93 -2.27 0.00 0.00 179.45 179.17 3fky h GLU 257 N 0.29 0.47 0.00 1.90 5.08 -1.92 -1.72 114.58 118.68 3fky h GLU 257 Ca 0.36 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.66 3fky h GLU 257 Cb 0.56 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 3fky h GLU 257 CO -0.44 0.31 -0.15 0.52 -1.00 0.00 0.00 179.01 178.26 3fky h MET 258 N 0.49 0.00 0.00 2.33 2.86 -1.55 -2.85 114.93 116.20 3fky h MET 258 Ca 0.29 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.91 3fky h MET 258 Cb 0.28 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 3fky h MET 258 CO -0.24 0.15 -0.64 0.00 1.06 0.00 0.00 176.91 177.24 3fky h ARG 259 N 0.00 0.00 -6.28 1.72 3.08 -0.95 0.88 114.38 112.84 3fky h ARG 259 Ca -0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 3fky h ARG 259 Cb 0.33 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 3fky h ARG 259 CO 0.02 0.03 -0.24 -0.65 -1.07 0.00 0.00 179.97 178.06 3fky s GLN 260 N -3.27 3.66 0.40 0.04 -0.21 -1.03 -4.58 119.66 114.66 3fky s GLN 260 Ca 0.02 -0.01 -0.23 0.00 0.02 0.00 0.00 55.36 55.17 3fky s GLN 260 Cb 0.08 -2.77 -0.14 0.00 1.00 0.00 0.00 33.01 31.18 3fky s GLN 260 CO 0.75 0.39 0.44 -2.30 -2.12 0.00 0.00 175.29 172.45 3fky n PRO 261 N -0.16 0.41 -1.47 2.91 -0.02 -1.26 -2.35 135.00 133.06 3fky n PRO 261 Ca -0.02 0.15 -0.03 0.00 -2.02 0.00 0.00 63.50 61.59 3fky n PRO 261 Cb 0.52 -1.36 -0.01 0.00 -0.02 0.00 0.00 33.50 32.64 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 1.92 0.45 0.18 -1.23 0.00 -1.21 -4.98 105.19 100.31 3fky n GLY 262 Ca 0.12 -0.89 -0.14 0.00 0.00 0.00 0.00 46.02 45.11 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 0.59 1.66 -0.02 0.00 -0.35 -3.23 103.07 101.71 3fky h GLY 263 Ca -0.06 -0.67 0.00 0.00 0.00 0.00 0.00 47.33 46.60 3fky h GLY 263 CO 0.08 0.60 0.09 2.41 0.00 0.00 0.00 176.54 179.72 3fky n THR 264 N -4.34 1.63 0.29 4.70 -1.04 -0.32 0.11 114.28 115.30 3fky n THR 264 Ca -0.06 0.51 -0.11 0.00 -2.04 0.00 0.00 64.05 62.35 3fky n THR 264 Cb 0.48 -1.51 -0.05 0.00 -1.82 0.00 0.00 70.33 67.42 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 -0.70 0.00 -2.82 3.64 -1.83 0.22 116.57 115.08 3fky h LYS 265 Ca 0.00 0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 3fky h LYS 265 Cb 0.18 0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 3fky h LYS 265 CO 0.00 -0.47 -0.39 1.88 -2.27 0.00 0.00 179.45 178.20 3fky h TYR 266 N -0.74 0.00 -0.01 1.91 0.05 0.51 -1.00 116.97 117.69 3fky h TYR 266 Ca -0.07 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.71 3fky h TYR 266 Cb 0.56 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.30 3fky h TYR 266 CO 0.10 0.39 0.00 0.82 -1.05 0.00 0.00 178.16 178.43 3fky h ILE 267 N 0.00 1.06 -0.70 -2.88 2.04 -1.22 0.22 117.51 116.03 3fky h ILE 267 Ca -0.00 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.69 3fky h ILE 267 Cb 0.77 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 3fky h ILE 267 CO 0.05 0.04 0.46 -0.33 0.00 0.00 0.00 178.15 178.37 3fky h GLU 268 N -0.06 0.93 -0.39 2.37 5.08 -0.41 -0.41 114.58 121.67 3fky h GLU 268 Ca 0.00 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.36 3fky h GLU 268 Cb 0.07 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.06 3fky h GLU 268 CO -0.00 0.62 0.06 1.96 -1.00 0.00 0.00 179.01 180.65 3fky h GLN 269 N 0.95 0.18 -0.47 2.33 4.20 -1.02 -1.59 115.11 119.69 3fky h GLN 269 Ca 0.26 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.95 3fky h GLN 269 Cb -0.10 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 3fky h GLN 269 CO -0.05 0.12 0.30 0.00 -0.67 0.00 0.00 178.83 178.52 3fky h ALA 270 N 1.31 0.60 -0.54 3.87 0.00 -0.31 -1.71 119.26 122.48 3fky h ALA 270 Ca 0.19 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.08 3fky h ALA 270 Cb 0.24 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3fky h ALA 270 CO -0.26 0.08 0.36 0.82 0.00 0.00 0.00 179.25 180.25 3fky h ILE 271 N 0.64 1.05 -0.10 0.00 2.04 -0.68 -0.04 117.51 120.42 3fky h ILE 271 Ca 0.17 -0.21 -0.11 0.00 1.00 0.00 0.00 64.86 65.71 3fky h ILE 271 Cb -0.03 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 3fky h ILE 271 CO -0.03 0.11 -0.37 -0.08 0.00 0.00 0.00 178.15 177.78 3fky h GLU 272 N 0.60 0.43 -0.80 2.37 4.81 -0.62 -1.50 114.58 119.87 3fky h GLU 272 Ca 0.22 -0.32 0.08 0.00 -0.13 0.00 0.00 59.36 59.21 3fky h GLU 272 Cb 0.13 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.50 3fky h GLU 272 CO -0.06 0.95 0.46 0.87 -0.73 0.00 0.00 179.01 180.51 3fky h LYS 273 N -0.00 0.78 -0.64 1.92 1.57 -0.68 -0.60 116.57 118.92 3fky h LYS 273 Ca -0.02 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 3fky h LYS 273 Cb 1.00 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 33.10 3fky h LYS 273 CO 0.08 0.51 0.42 -0.07 -0.57 0.00 0.00 179.45 179.83 3fky h LEU 274 N 0.80 0.71 -1.62 2.94 3.38 -0.89 -1.68 115.31 118.96 3fky h LEU 274 Ca 0.38 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.29 3fky h LEU 274 Cb 0.30 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3fky h LEU 274 CO -0.22 0.51 -0.21 0.77 0.09 0.00 0.00 178.44 179.38 3fky h SER 275 N 0.84 0.00 1.79 -0.43 4.64 -0.02 -2.15 113.55 118.22 3fky h SER 275 Ca 0.24 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.53 3fky h SER 275 Cb -0.05 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.03 3fky h SER 275 CO -0.06 0.21 -0.22 0.11 -0.87 0.00 0.00 176.83 176.00 3fky h LYS 276 N 0.00 0.00 -0.26 4.77 6.56 -1.05 -3.32 116.57 123.27 3fky h LYS 276 Ca -0.00 0.00 -0.14 0.00 -1.06 0.00 0.00 60.65 59.45 3fky h LYS 276 Cb 0.46 0.00 -0.08 0.00 -0.57 0.00 0.00 32.23 32.03 3fky h LYS 276 CO 0.03 0.16 -0.20 0.54 -2.06 0.00 0.00 179.45 177.91 3fky n ARG 277 N -3.12 1.77 -0.26 3.15 1.74 -0.84 -4.76 116.66 114.35 3fky n ARG 277 Ca 0.03 -3.24 0.01 0.00 -0.77 0.00 0.00 57.85 53.89 3fky n ARG 277 Cb 0.60 -1.77 0.14 0.00 -1.02 0.00 0.00 32.46 30.41 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 1.01 0.73 -0.35 -1.55 2.76 -1.58 -1.81 115.15 114.36 3fky h HIS 278 Ca 0.17 0.03 -0.10 0.00 -2.20 0.00 0.00 60.37 58.26 3fky h HIS 278 Cb 1.49 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 30.22 3fky h HIS 278 CO 0.98 0.29 -0.18 0.00 -1.30 0.00 0.00 177.93 177.72 3fky h ALA 279 N 1.42 0.49 -0.63 5.26 0.00 -1.91 -0.75 119.26 123.14 3fky h ALA 279 Ca 0.36 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3fky h ALA 279 Cb 0.33 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3fky h ALA 279 CO -0.24 0.43 0.16 0.93 0.00 0.00 0.00 179.25 180.52 3fky h GLU 280 N 0.52 0.98 0.57 0.00 3.07 -1.85 -1.43 114.58 116.45 3fky h GLU 280 Ca 0.08 -0.21 -0.03 0.00 -0.50 0.00 0.00 59.36 58.69 3fky h GLU 280 Cb 0.73 -0.14 0.01 0.00 -0.84 0.00 0.00 28.75 28.50 3fky h GLU 280 CO 0.05 0.87 -0.28 0.45 -1.40 0.00 0.00 179.01 178.71 3fky h HIS 281 N 0.94 -0.71 -1.02 4.33 3.86 -1.24 -3.16 115.15 118.15 3fky h HIS 281 Ca 0.20 -0.02 0.34 0.00 -1.16 0.00 0.00 60.37 59.73 3fky h HIS 281 Cb 0.32 0.24 -0.15 0.00 1.06 0.00 0.00 27.41 28.88 3fky h HIS 281 CO 0.02 -0.39 0.58 0.82 0.86 0.00 0.00 177.93 179.83 3fky h ILE 282 N -1.08 0.26 -0.74 2.45 1.08 -0.99 0.16 117.51 118.64 3fky h ILE 282 Ca -0.08 -0.10 0.06 0.00 -0.39 0.00 0.00 64.86 64.36 3fky h ILE 282 Cb 0.65 -0.04 -0.05 0.00 -3.07 0.00 0.00 36.82 34.31 3fky h ILE 282 CO 0.13 0.05 0.49 0.50 -0.69 0.00 0.00 178.15 178.63 3fky h LYS 283 N 0.28 0.78 0.00 2.37 3.64 -1.22 -3.35 116.57 119.06 3fky h LYS 283 Ca 0.75 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 60.08 3fky h LYS 283 Cb 1.78 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.43 3fky h LYS 283 CO -0.61 0.52 0.00 1.28 -2.27 0.00 0.00 179.45 178.37 3fky n LEU 284 N -4.48 0.00 0.00 5.20 4.77 0.53 -4.64 117.00 118.39 3fky n LEU 284 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 3fky n LEU 284 Cb 0.21 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 3fky n LEU 284 CO 0.34 0.00 0.00 -1.22 -1.33 0.00 0.00 177.39 175.18 3fky n TYR 285 N 0.00 0.00 0.00 -1.77 0.53 -1.12 -4.59 117.16 110.21 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 -0.40 0.00 0.00 -1.03 0.00 0.00 39.34 37.91 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 0.43 2.64 3.83 2.72 0.00 -1.26 -1.51 105.19 112.04 3fky n GLY 286 Ca 0.00 -1.47 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 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 6.24 -0.87 1.61 1.04 -1.26 -3.01 113.70 117.45 3fky s SER 287 Ca 0.00 1.65 -0.11 0.00 0.48 0.00 0.00 55.95 57.97 3fky s SER 287 Cb 0.00 -2.51 0.11 0.00 0.10 0.00 0.00 66.02 63.72 3fky s SER 287 CO 0.00 -0.85 0.28 -0.90 0.98 0.00 0.00 173.24 172.74 3fky n ASP 288 N -1.89 -0.90 0.17 7.02 5.68 -1.26 -4.73 116.55 120.64 3fky n ASP 288 Ca 0.07 -0.55 0.13 0.00 -0.50 0.00 0.00 54.79 53.94 3fky n ASP 288 Cb 0.54 -0.79 0.58 0.00 -1.14 0.00 0.00 41.12 40.30 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 -0.40 0.00 0.08 -1.12 -1.24 -1.88 -2.50 115.58 108.52 3fky h ASN 289 Ca -0.28 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.73 3fky h ASN 289 Cb 0.70 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.75 3fky h ASN 289 CO 0.42 0.00 -0.03 -2.24 -1.29 0.00 0.00 177.43 174.29 3fky h ASP 290 N 0.00 0.00 -0.21 1.15 -0.00 -1.85 0.32 116.42 115.83 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 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.62 3fky h ASP 290 CO 0.00 0.03 0.00 1.15 -0.00 0.00 0.00 179.24 180.42 3fky n MET 291 N -3.76 2.15 0.00 4.15 0.00 -0.94 -5.01 117.12 113.71 3fky n MET 291 Ca -0.03 -1.03 0.00 0.00 0.00 0.00 0.00 57.70 56.64 3fky n MET 291 Cb 0.12 -1.63 0.00 0.00 0.00 0.00 0.00 33.22 31.71 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 0.22 0.05 -3.13 3.17 0.63 0.10 -4.75 116.66 112.94 3fky n ARG 292 Ca 0.09 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.63 3fky n ARG 292 Cb 0.49 -0.68 -0.06 0.00 0.45 0.00 0.00 32.46 32.66 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 -3.30 7.18 0.35 6.15 0.15 -1.26 -5.02 113.70 117.93 3fky s SER 301 Ca 0.00 1.40 0.18 0.00 0.70 0.00 0.00 55.95 58.23 3fky s SER 301 Cb 0.00 -2.42 0.44 0.00 -1.71 0.00 0.00 66.02 62.33 3fky s SER 301 CO 0.00 0.19 1.62 0.24 1.20 0.00 0.00 173.24 176.49 3fky h MET 302 N 4.80 0.00 0.00 5.44 2.86 -1.95 -3.28 114.93 122.81 3fky h MET 302 Ca -0.47 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.03 3fky h MET 302 Cb 1.21 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.84 3fky h MET 302 CO 0.66 0.40 -1.76 0.25 1.06 0.00 0.00 176.91 177.53 3fky n THR 303 N -3.35 0.51 -3.33 2.22 -2.24 -1.26 -4.98 114.28 101.84 3fky n THR 303 Ca 0.01 -0.44 -0.38 0.00 -2.27 0.00 0.00 64.05 60.97 3fky n THR 303 Cb 0.60 -0.32 -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 -2.56 3.61 -0.13 6.98 0.00 -1.24 -5.02 121.76 123.40 3fky s ALA 304 Ca -0.06 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 51.87 3fky s ALA 304 Cb 0.06 -2.57 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 3fky s ALA 304 CO 0.53 0.43 -0.17 0.12 0.00 0.00 0.00 175.76 176.67 3fky s PHE 305 N -1.16 2.73 0.10 0.00 5.36 -1.26 -4.65 117.98 119.10 3fky s PHE 305 Ca 0.29 -0.86 -0.06 0.00 -0.96 0.00 0.00 56.93 55.34 3fky s PHE 305 Cb -0.18 -1.81 -0.02 0.00 -0.34 0.00 0.00 43.02 40.67 3fky s PHE 305 CO 0.18 -0.33 0.15 -1.54 -1.46 0.00 0.00 175.22 172.22 3fky s SER 306 N 0.45 0.20 0.03 6.13 1.04 -1.26 -4.96 113.70 115.33 3fky s SER 306 Ca -0.12 -0.84 -0.15 0.00 0.48 0.00 0.00 55.95 55.33 3fky s SER 306 Cb -0.16 0.33 0.02 0.00 0.10 0.00 0.00 66.02 66.31 3fky s SER 306 CO 0.05 -0.74 0.32 -0.94 0.98 0.00 0.00 173.24 172.91 3fky s SER 307 N -2.92 -0.16 0.00 7.02 1.04 -1.26 -0.18 113.70 117.25 3fky s SER 307 Ca 0.10 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.42 3fky s SER 307 Cb 0.05 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.53 3fky s SER 307 CO -0.07 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.17 3fky n GLY 308 N 0.68 0.77 3.77 7.32 0.00 -1.10 -5.01 105.19 111.63 3fky n GLY 308 Ca -0.19 -0.63 -0.36 0.00 0.00 0.00 0.00 46.02 44.84 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 3.21 -0.52 1.61 1.01 -1.26 -2.03 120.40 120.41 3fky s VAL 309 Ca 0.00 0.86 -0.08 0.00 0.00 0.00 0.00 61.98 62.76 3fky s VAL 309 Cb 0.00 -3.41 0.01 0.00 0.00 0.00 0.00 36.38 32.98 3fky s VAL 309 CO 0.00 -0.06 0.45 0.00 0.00 0.00 0.00 175.10 175.49 3fky n ALA 310 N -0.66 -2.21 -3.38 5.51 0.00 0.91 -4.84 120.51 115.83 3fky n ALA 310 Ca 0.08 -0.08 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 3fky n ALA 310 Cb 0.49 -0.80 -0.09 0.00 0.00 0.00 0.00 19.45 19.06 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 -2.26 1.53 0.00 0.00 3.84 -1.26 -4.96 114.94 111.84 3fky s ASN 311 Ca 0.08 -1.47 0.11 0.00 0.21 0.00 0.00 52.86 51.79 3fky s ASN 311 Cb -0.01 0.42 0.65 0.00 -0.55 0.00 0.00 41.25 41.76 3fky s ASN 311 CO 0.65 -0.30 1.29 0.54 -2.79 0.00 0.00 177.10 176.49 3fky n ARG 312 N 4.47 0.84 -0.01 0.43 1.74 -1.26 -2.59 116.66 120.27 3fky n ARG 312 Ca 0.08 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.23 3fky n ARG 312 Cb 0.44 -1.20 -0.15 0.00 -1.02 0.00 0.00 32.46 30.53 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 0.48 -1.04 3.91 -0.13 0.00 -1.26 -5.02 105.19 102.13 3fky n GLY 313 Ca 0.08 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.36 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 -4.77 4.69 0.06 1.61 1.04 -1.07 -4.76 113.70 110.51 3fky s SER 314 Ca -0.08 0.70 -0.17 0.00 0.48 0.00 0.00 55.95 56.89 3fky s SER 314 Cb 0.12 -1.28 -0.16 0.00 0.10 0.00 0.00 66.02 64.80 3fky s SER 314 CO 0.89 -1.75 1.27 0.28 0.98 0.00 0.00 173.24 174.90 3fky h SER 315 N -0.87 0.69 -3.82 7.02 0.02 -0.89 -3.44 113.55 112.27 3fky h SER 315 Ca -0.45 -0.62 -0.64 0.00 -0.84 0.00 0.00 61.79 59.23 3fky h SER 315 Cb 1.32 -0.20 -0.32 0.00 0.14 0.00 0.00 62.40 63.34 3fky h SER 315 CO 0.64 1.19 -0.87 -0.63 -1.14 0.00 0.00 176.83 176.02 3fky s ILE 316 N -3.78 1.84 -0.11 3.27 -1.09 -0.83 -1.21 121.20 119.29 3fky s ILE 316 Ca -0.12 -0.93 0.03 0.00 -2.23 0.00 0.00 60.65 57.40 3fky s ILE 316 Cb 0.06 -1.57 0.01 0.00 -1.58 0.00 0.00 42.46 39.38 3fky s ILE 316 CO 0.84 0.51 -0.21 -0.60 -1.23 0.00 0.00 174.94 174.25 3fky s ARG 317 N 0.04 2.80 -0.31 2.79 3.52 0.32 -2.72 118.95 125.39 3fky s ARG 317 Ca -0.07 -0.79 -0.16 0.00 -0.13 0.00 0.00 55.73 54.58 3fky s ARG 317 Cb -0.14 -2.18 -0.02 0.00 -1.56 0.00 0.00 34.95 31.04 3fky s ARG 317 CO 0.04 0.09 0.41 0.42 -0.81 0.00 0.00 175.30 175.45 3fky s ILE 318 N 0.55 5.13 0.22 4.11 1.01 -0.86 -0.98 121.20 130.38 3fky s ILE 318 Ca -0.14 0.40 -0.32 0.00 0.00 0.00 0.00 60.65 60.58 3fky s ILE 318 Cb -0.17 -3.79 -0.13 0.00 0.01 0.00 0.00 42.46 38.37 3fky s ILE 318 CO 0.05 0.01 1.50 -2.65 0.00 0.00 0.00 174.94 173.84 3fky n PRO 319 N 5.44 2.18 -0.25 2.79 -0.02 -1.26 -0.07 135.00 143.82 3fky n PRO 319 Ca -0.08 0.78 0.15 0.00 -2.02 0.00 0.00 63.50 62.34 3fky n PRO 319 Cb 0.50 -2.50 0.44 0.00 -0.02 0.00 0.00 33.50 31.93 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 4.94 0.53 0.13 -0.52 2.43 -1.95 0.12 114.38 120.06 3fky h ARG 320 Ca -0.45 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 58.69 3fky h ARG 320 Cb 1.26 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.67 3fky h ARG 320 CO 0.81 0.35 -0.16 0.77 -1.51 0.00 0.00 179.97 180.23 3fky h SER 321 N 0.55 -0.44 -0.05 -3.80 0.02 -1.99 0.13 113.55 107.97 3fky h SER 321 Ca 0.46 0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.49 3fky h SER 321 Cb 0.93 0.16 -0.05 0.00 0.14 0.00 0.00 62.40 63.58 3fky h SER 321 CO -0.20 -0.24 -0.22 0.58 -1.14 0.00 0.00 176.83 175.61 3fky h VAL 322 N -0.34 0.47 -0.29 2.27 2.07 -1.07 -2.08 116.25 117.29 3fky h VAL 322 Ca 0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.60 3fky h VAL 322 Cb 0.33 0.47 -0.07 0.00 -1.52 0.00 0.00 31.29 30.51 3fky h VAL 322 CO -0.06 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 177.36 3fky h ALA 323 N 0.58 0.04 0.00 1.67 0.00 -0.81 0.14 119.26 120.89 3fky h ALA 323 Ca 0.08 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3fky h ALA 323 Cb 0.43 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3fky h ALA 323 CO -0.24 -0.57 -0.08 1.57 0.00 0.00 0.00 179.25 179.93 3fky h LYS 324 N -0.14 0.00 0.00 0.00 2.10 -0.55 -2.84 116.57 115.15 3fky h LYS 324 Ca 0.15 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.80 3fky h LYS 324 Cb 0.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 3fky h LYS 324 CO -0.37 0.08 -0.99 0.39 -2.00 0.00 0.00 179.45 176.56 3fky n GLU 325 N -4.03 0.01 -0.72 0.07 1.02 -0.28 -4.99 120.64 111.72 3fky n GLU 325 Ca -0.03 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 3fky n GLU 325 Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 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 1.50 0.93 3.56 0.62 0.00 0.34 -4.86 105.19 107.28 3fky n GLY 326 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.47 -0.37 0.00 1.61 1.13 -1.23 -0.43 117.35 114.59 3fky s TYR 327 Ca 0.00 0.07 0.00 0.00 -1.41 0.00 0.00 57.07 55.73 3fky s TYR 327 Cb 0.00 0.57 0.00 0.00 -1.10 0.00 0.00 41.96 41.43 3fky s TYR 327 CO 0.00 -0.97 0.00 0.41 -2.51 0.00 0.00 175.55 172.48 3fky n GLY 328 N -0.39 0.18 3.46 5.49 0.00 0.30 -4.62 105.19 109.62 3fky n GLY 328 Ca -0.12 -0.49 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 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 0.77 0.24 1.61 -0.85 -1.26 -3.99 117.35 113.88 3fky s TYR 329 Ca 0.00 -1.06 0.09 0.00 -0.52 0.00 0.00 57.07 55.58 3fky s TYR 329 Cb 0.00 -0.08 -0.05 0.00 0.38 0.00 0.00 41.96 42.21 3fky s TYR 329 CO 0.00 -0.95 -0.15 -0.59 -1.52 0.00 0.00 175.55 172.34 3fky s PHE 330 N -3.76 1.92 -0.29 -3.49 -0.12 -0.48 -4.56 117.98 107.21 3fky s PHE 330 Ca 0.29 -0.52 -0.04 0.00 -0.05 0.00 0.00 56.93 56.61 3fky s PHE 330 Cb 0.01 -0.91 0.03 0.00 -0.63 0.00 0.00 43.02 41.52 3fky s PHE 330 CO 0.13 0.46 0.02 -2.00 -0.05 0.00 0.00 175.22 173.77 3fky s GLU 331 N -3.62 2.76 -0.48 1.99 2.12 -0.16 -0.63 118.70 120.68 3fky s GLU 331 Ca 0.26 -1.05 -0.24 0.00 0.36 0.00 0.00 54.97 54.29 3fky s GLU 331 Cb -0.01 -3.21 0.03 0.00 0.26 0.00 0.00 34.13 31.20 3fky s GLU 331 CO 0.10 -0.51 0.88 0.34 -0.54 0.00 0.00 175.26 175.53 3fky s ASP 332 N 1.36 6.42 0.00 -1.70 -1.08 0.73 -0.52 116.67 121.88 3fky s ASP 332 Ca -0.01 -0.09 0.18 0.00 -0.52 0.00 0.00 52.55 52.11 3fky s ASP 332 Cb -0.18 -2.42 0.65 0.00 -1.46 0.00 0.00 42.92 39.50 3fky s ASP 332 CO -0.01 -1.05 1.48 0.54 0.52 0.00 0.00 175.17 176.65 3fky n ARG 333 N 7.08 1.75 0.10 4.34 1.74 -0.35 -1.62 116.66 129.70 3fky n ARG 333 Ca 0.04 -1.14 -0.22 0.00 -0.77 0.00 0.00 57.85 55.75 3fky n ARG 333 Cb 0.48 -1.37 -0.14 0.00 -1.02 0.00 0.00 32.46 30.42 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 2.18 0.55 -6.95 5.56 3.08 -1.90 -3.45 114.38 113.44 3fky h ARG 334 Ca 0.00 -0.80 -0.53 0.00 0.07 0.00 0.00 59.98 58.72 3fky h ARG 334 Cb 0.48 0.28 0.10 0.00 0.08 0.00 0.00 29.97 30.91 3fky h ARG 334 CO 0.00 1.36 0.69 -2.14 -1.07 0.00 0.00 179.97 178.81 3fky s PRO 335 N -2.81 3.96 0.53 0.04 0.02 -1.26 -4.93 135.00 130.54 3fky s PRO 335 Ca -0.10 2.36 -0.06 0.00 0.02 0.00 0.00 61.00 63.22 3fky s PRO 335 Cb 0.04 -2.81 -0.02 0.00 0.02 0.00 0.00 34.50 31.73 3fky s PRO 335 CO 0.92 -0.57 0.84 0.00 -0.33 0.00 0.00 177.00 177.85 3fky s ALA 336 N -1.19 3.35 0.41 -1.55 0.00 -0.57 -1.37 121.76 120.84 3fky s ALA 336 Ca 0.56 -0.54 0.21 0.00 0.00 0.00 0.00 51.96 52.19 3fky s ALA 336 Cb -0.42 -2.62 1.18 0.00 0.00 0.00 0.00 23.12 21.25 3fky s ALA 336 CO 0.55 -0.52 1.75 1.03 0.00 0.00 0.00 175.76 178.58 3fky h SER 337 N 0.06 0.39 -0.33 0.00 0.87 -1.20 -1.82 113.55 111.52 3fky h SER 337 Ca -0.46 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 3fky h SER 337 Cb 1.22 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 3fky h SER 337 CO 0.61 0.04 0.00 -0.46 -0.53 0.00 0.00 176.83 176.50 3fky n ASN 338 N -4.61 2.40 -4.75 6.23 6.94 -0.93 -4.77 115.26 115.78 3fky n ASN 338 Ca 0.27 -2.16 -0.36 0.00 -0.02 0.00 0.00 54.58 52.31 3fky n ASN 338 Cb 0.97 -0.36 0.05 0.00 -2.36 0.00 0.00 39.78 38.08 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 2.57 -0.46 1.53 1.10 -0.69 -4.85 121.20 118.77 3fky s ILE 339 Ca 0.25 0.34 -0.23 0.00 -0.51 0.00 0.00 60.65 60.49 3fky s ILE 339 Cb 0.15 -3.07 0.03 0.00 0.15 0.00 0.00 42.46 39.72 3fky s ILE 339 CO 0.13 -0.10 0.81 -0.62 -2.11 0.00 0.00 174.94 173.05 3fky s ASP 340 N -1.72 6.42 0.38 4.50 -1.08 -1.26 -4.96 116.67 118.95 3fky s ASP 340 Ca 0.77 -0.10 0.15 0.00 -0.52 0.00 0.00 52.55 52.85 3fky s ASP 340 Cb -0.30 -2.39 1.01 0.00 -1.46 0.00 0.00 42.92 39.77 3fky s ASP 340 CO 0.36 -0.95 1.79 1.55 0.52 0.00 0.00 175.17 178.45 3fky h PRO 341 N 9.01 0.47 -0.50 4.34 0.13 -1.94 0.18 132.00 143.69 3fky h PRO 341 Ca -0.25 -0.03 0.06 0.00 -0.87 0.00 0.00 66.00 64.92 3fky h PRO 341 Cb 1.08 -0.11 -0.05 0.00 0.13 0.00 0.00 31.00 32.05 3fky h PRO 341 CO 0.97 0.31 0.21 1.88 -0.23 0.00 0.00 178.00 181.15 3fky h TYR 342 N 0.49 0.37 -0.18 1.56 0.05 -1.90 0.22 116.97 117.58 3fky h TYR 342 Ca 0.56 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 59.32 3fky h TYR 342 Cb 1.27 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 38.91 3fky h TYR 342 CO -0.00 0.15 -0.04 -0.07 -1.05 0.00 0.00 178.16 177.14 3fky h LEU 343 N 0.41 0.35 0.61 3.88 3.38 -0.95 0.33 115.31 123.32 3fky h LEU 343 Ca 0.24 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 3fky h LEU 343 Cb 0.22 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 40.88 3fky h LEU 343 CO -0.21 0.63 -0.29 0.58 0.09 0.00 0.00 178.44 179.24 3fky h VAL 344 N 0.07 0.30 -0.57 1.22 2.07 -1.13 -0.62 116.25 117.58 3fky h VAL 344 Ca 0.05 -0.27 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 3fky h VAL 344 Cb 0.48 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 3fky h VAL 344 CO 0.02 0.03 0.25 0.71 0.02 0.00 0.00 177.57 178.60 3fky h THR 345 N -1.02 1.20 0.77 2.57 1.35 -0.67 0.34 112.91 117.45 3fky h THR 345 Ca -0.08 -0.59 -0.03 0.00 -0.55 0.00 0.00 66.41 65.15 3fky h THR 345 Cb 0.68 0.49 -0.00 0.00 -1.73 0.00 0.00 68.15 67.59 3fky h THR 345 CO 0.14 0.24 -0.44 1.23 -0.25 0.00 0.00 175.52 176.44 3fky h GLY 346 N 0.92 -1.21 2.00 5.82 0.00 -0.87 -1.75 103.07 107.97 3fky h GLY 346 Ca 0.20 0.48 -0.04 0.00 0.00 0.00 0.00 47.33 47.97 3fky h GLY 346 CO -0.02 -0.43 -0.19 1.19 0.00 0.00 0.00 176.54 177.09 3fky h ILE 347 N -1.12 0.61 -0.11 2.60 2.10 -0.95 -1.29 117.51 119.35 3fky h ILE 347 Ca -0.10 -0.87 -0.01 0.00 1.08 0.00 0.00 64.86 64.96 3fky h ILE 347 Cb 0.89 1.57 -0.00 0.00 -1.09 0.00 0.00 36.82 38.18 3fky h ILE 347 CO 0.12 0.19 0.04 -0.03 -1.08 0.00 0.00 178.15 177.39 3fky h MET 348 N 0.00 0.16 -0.24 2.19 4.05 -0.73 -1.80 114.93 118.57 3fky h MET 348 Ca -0.00 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.38 3fky h MET 348 Cb 0.55 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.31 3fky h MET 348 CO 0.02 0.28 0.13 0.00 0.23 0.00 0.00 176.91 177.57 3fky h GLU 350 N 0.27 0.09 0.00 0.00 4.81 -1.07 0.39 114.58 119.07 3fky h GLU 350 Ca 0.08 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.26 3fky h GLU 350 Cb 0.07 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 3fky h GLU 350 CO -0.01 0.06 -1.22 0.25 -0.73 0.00 0.00 179.01 177.35 3fky n THR 351 N -5.33 0.71 0.03 0.32 -2.24 -0.69 -1.39 114.28 105.69 3fky n THR 351 Ca 0.10 -0.58 -0.21 0.00 -2.27 0.00 0.00 64.05 61.09 3fky n THR 351 Cb 0.39 -0.40 -0.14 0.00 -2.10 0.00 0.00 70.33 68.07 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 0.76 0.00 2.28 2.07 -0.85 -3.40 116.25 117.11 3fky h VAL 352 Ca -0.05 -2.45 -0.31 0.00 0.82 0.00 0.00 66.70 64.72 3fky h VAL 352 Cb 1.16 2.59 -0.06 0.00 -1.52 0.00 0.00 31.29 33.46 3fky h VAL 352 CO 0.01 0.86 -2.27 0.00 0.02 0.00 0.00 177.57 176.19 3fky n GLY 354 N 1.75 4.27 3.54 0.00 0.00 -0.48 -5.03 105.19 109.24 3fky n GLY 354 Ca -0.28 -1.21 -0.28 0.00 0.00 0.00 0.00 46.02 44.25 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 -0.91 -0.15 0.01 4.61 0.00 -0.86 -4.57 121.76 119.89 3fky s ALA 355 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.71 3fky s ALA 355 Cb 0.00 -3.19 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 3fky s ALA 355 CO 0.00 -3.62 -0.02 0.42 0.00 0.00 0.00 175.76 172.54 3fky s ILE 356 N -2.62 0.14 -0.42 0.00 1.01 -1.26 -5.00 121.20 113.06 3fky s ILE 356 Ca 0.68 -0.33 0.26 0.00 0.00 0.00 0.00 60.65 61.26 3fky s ILE 356 Cb -0.23 -0.18 0.31 0.00 0.01 0.00 0.00 42.46 42.38 3fky s ILE 356 CO 0.63 -0.12 1.77 -2.24 0.00 0.00 0.00 174.94 174.97 3fky h ASP 357 N 5.66 0.00 1.75 3.58 2.03 -2.04 -2.76 116.42 124.64 3fky h ASP 357 Ca -0.27 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.03 3fky h ASP 357 Cb 1.21 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.71 3fky h ASP 357 CO 0.48 0.00 0.00 -1.13 -1.03 0.00 0.00 179.24 177.56 3fky h ASN 358 N 0.00 0.00 -4.74 4.15 -1.24 -2.02 -3.46 115.58 108.27 3fky h ASN 358 Ca 0.00 0.00 -0.07 0.00 0.71 0.00 0.00 56.30 56.94 3fky h ASN 358 Cb 0.65 0.00 -0.20 0.00 0.73 0.00 0.00 38.32 39.51 3fky h ASN 358 CO 0.00 0.00 0.06 0.00 -1.29 0.00 0.00 177.43 176.20 3fky s ALA 359 N -3.32 -1.52 -0.24 1.57 0.00 -1.04 -5.09 121.76 112.13 3fky s ALA 359 Ca 0.06 1.23 -0.01 0.00 0.00 0.00 0.00 51.96 53.24 3fky s ALA 359 Cb 0.06 -0.24 0.07 0.00 0.00 0.00 0.00 23.12 23.01 3fky s ALA 359 CO 0.64 -0.33 0.01 0.34 0.00 0.00 0.00 175.76 176.42 3fky s ASP 360 N -0.84 3.58 0.10 0.00 -1.08 -1.26 -3.97 116.67 113.19 3fky s ASP 360 Ca -0.09 -1.17 -0.22 0.00 -0.52 0.00 0.00 52.55 50.55 3fky s ASP 360 Cb -0.02 -0.93 -0.12 0.00 -1.46 0.00 0.00 42.92 40.39 3fky s ASP 360 CO 0.07 -0.30 1.73 0.24 0.52 0.00 0.00 175.17 177.43 3fky h MET 361 N 8.07 0.12 -0.18 4.34 2.86 -1.94 -1.84 114.93 126.36 3fky h MET 361 Ca -0.16 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.40 3fky h MET 361 Cb 1.08 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.70 3fky h MET 361 CO 0.40 0.10 -0.21 0.00 1.06 0.00 0.00 176.91 178.27 3fky h THR 362 N 0.09 1.23 -0.66 2.22 1.03 -1.96 -1.74 112.91 113.13 3fky h THR 362 Ca 0.03 -1.05 -0.06 0.00 -0.01 0.00 0.00 66.41 65.32 3fky h THR 362 Cb 0.02 1.32 -0.03 0.00 -1.07 0.00 0.00 68.15 68.39 3fky h THR 362 CO -0.01 0.33 0.16 0.11 -0.01 0.00 0.00 175.52 176.10 3fky h LYS 363 N 0.28 1.04 -5.13 0.00 1.57 -1.91 -3.37 116.57 109.06 3fky h LYS 363 Ca 0.05 -0.24 -0.03 0.00 -1.87 0.00 0.00 60.65 58.56 3fky h LYS 363 Cb 0.53 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 3fky h LYS 363 CO 0.04 0.92 0.30 -1.91 -0.57 0.00 0.00 179.45 178.23 3fky n GLU 364 N -4.24 0.19 -2.69 3.15 4.07 -0.65 -4.23 120.64 116.23 3fky n GLU 364 Ca 0.05 -1.10 -0.05 0.00 -0.06 0.00 0.00 57.16 56.00 3fky n GLU 364 Cb 0.25 -3.23 0.05 0.00 -0.06 0.00 0.00 31.44 28.45 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 16.36 -1.53 -0.03 4.31 3.01 -1.26 -4.98 117.46 133.33 3fky n PHE 365 Ca 0.39 -0.98 0.00 0.00 1.01 0.00 0.00 57.45 57.87 3fky n PHE 365 Cb 0.44 1.23 0.00 0.00 -0.01 0.00 0.00 39.48 41.14 3fky n PHE 365 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92