#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 3.22 3.97 5.14 0.00 -1.26 -5.06 105.19 111.19 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 -0.52 2.78 0.02 1.61 0.52 -1.26 -4.59 118.95 117.52 3fky s ARG 23 Ca 0.00 -0.72 0.09 0.00 -0.52 0.00 0.00 55.73 54.57 3fky s ARG 23 Cb 0.00 -2.55 -0.03 0.00 0.52 0.00 0.00 34.95 32.89 3fky s ARG 23 CO 0.00 -0.48 -0.26 0.42 0.02 0.00 0.00 175.30 175.01 3fky s ILE 24 N -2.62 2.06 -0.19 1.52 -1.09 -0.36 -4.97 121.20 115.55 3fky s ILE 24 Ca 0.53 -1.28 -0.06 0.00 -2.23 0.00 0.00 60.65 57.62 3fky s ILE 24 Cb -0.10 -1.75 -0.03 0.00 -1.58 0.00 0.00 42.46 39.00 3fky s ILE 24 CO 0.37 0.42 0.02 -0.63 -1.23 0.00 0.00 174.94 173.89 3fky s ILE 25 N -0.74 4.23 -0.23 2.92 1.01 -1.26 0.27 121.20 127.41 3fky s ILE 25 Ca 0.11 -0.22 -0.04 0.00 0.00 0.00 0.00 60.65 60.49 3fky s ILE 25 Cb -0.10 -2.91 -0.00 0.00 0.01 0.00 0.00 42.46 39.46 3fky s ILE 25 CO 0.01 0.44 -0.04 0.00 0.00 0.00 0.00 174.94 175.35 3fky s ALA 26 N 0.75 2.82 -0.24 9.38 0.00 -0.15 -1.21 121.76 133.10 3fky s ALA 26 Ca 0.01 -1.21 -0.19 0.00 0.00 0.00 0.00 51.96 50.57 3fky s ALA 26 Cb -0.14 -1.73 -0.03 0.00 0.00 0.00 0.00 23.12 21.23 3fky s ALA 26 CO 0.02 -0.49 0.55 -2.00 0.00 0.00 0.00 175.76 173.84 3fky s GLU 27 N 1.47 4.12 -0.15 0.00 2.56 -0.30 -1.50 118.70 124.89 3fky s GLU 27 Ca 0.05 0.42 -0.20 0.00 0.00 0.00 0.00 54.97 55.24 3fky s GLU 27 Cb -0.15 -3.62 -0.03 0.00 2.00 0.00 0.00 34.13 32.33 3fky s GLU 27 CO -0.03 -0.31 0.56 0.71 -0.56 0.00 0.00 175.26 175.63 3fky s TYR 28 N 2.16 3.45 -0.10 5.30 1.51 0.12 0.35 117.35 130.15 3fky s TYR 28 Ca 0.23 0.92 0.04 0.00 -1.01 0.00 0.00 57.07 57.26 3fky s TYR 28 Cb -0.16 -2.68 -0.00 0.00 -0.11 0.00 0.00 41.96 39.01 3fky s TYR 28 CO 0.09 0.01 -0.22 0.08 -1.11 0.00 0.00 175.55 174.40 3fky s VAL 29 N 1.21 2.24 0.26 0.71 1.01 0.49 -2.22 120.40 124.10 3fky s VAL 29 Ca 0.28 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 61.28 3fky s VAL 29 Cb -0.16 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 3fky s VAL 29 CO 0.11 0.56 0.28 -1.66 0.00 0.00 0.00 175.10 174.39 3fky s TRP 30 N 0.23 1.13 -0.15 5.22 -2.14 -0.55 -0.74 118.94 121.95 3fky s TRP 30 Ca -0.14 -1.31 -0.06 0.00 2.66 0.00 0.00 56.10 57.24 3fky s TRP 30 Cb -0.17 -0.38 -0.04 0.00 -3.10 0.00 0.00 33.47 29.78 3fky s TRP 30 CO 0.07 -0.83 0.08 0.42 -2.66 0.00 0.00 176.95 174.03 3fky s ILE 31 N -3.80 4.97 0.10 0.66 1.01 -1.26 -0.47 121.20 122.42 3fky s ILE 31 Ca 0.35 0.02 0.02 0.00 0.00 0.00 0.00 60.65 61.04 3fky s ILE 31 Cb 0.03 -3.19 0.02 0.00 0.01 0.00 0.00 42.46 39.33 3fky s ILE 31 CO 0.16 0.54 0.13 -0.90 0.00 0.00 0.00 174.94 174.86 3fky n ASP 32 N 2.79 0.55 -0.39 3.58 5.75 -0.62 -4.92 116.55 123.29 3fky n ASP 32 Ca -0.18 -1.28 0.07 0.00 -0.01 0.00 0.00 54.79 53.39 3fky n ASP 32 Cb 0.53 -0.06 0.25 0.00 -1.03 0.00 0.00 41.12 40.82 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 3.79 -0.06 0.00 6.12 0.00 -0.38 -4.64 105.19 110.02 3fky n GLY 33 Ca 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 0.05 0.00 -1.14 2.61 -2.24 -1.26 -4.90 114.28 107.40 3fky n THR 34 Ca 0.11 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.65 3fky n THR 34 Cb 0.21 -0.23 0.16 0.00 -2.10 0.00 0.00 70.33 68.37 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 4.51 3.52 3.38 0.00 -1.26 -5.00 105.19 115.33 3fky n GLY 35 Ca 0.00 -1.15 -0.24 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.24 3.26 0.37 1.61 -0.87 -1.26 -4.99 114.94 111.82 3fky s ASN 36 Ca 0.55 -1.28 -0.06 0.00 -1.57 0.00 0.00 52.86 50.50 3fky s ASN 36 Cb 0.46 -0.27 -0.05 0.00 -0.02 0.00 0.00 41.25 41.38 3fky s ASN 36 CO 0.09 -0.39 0.66 -0.76 -2.57 0.00 0.00 177.10 174.13 3fky s LEU 37 N -3.57 3.90 0.12 0.60 2.01 -1.26 -1.60 118.68 118.88 3fky s LEU 37 Ca 0.33 0.83 0.03 0.00 0.01 0.00 0.00 54.13 55.34 3fky s LEU 37 Cb 0.06 -3.70 -0.04 0.00 0.01 0.00 0.00 46.19 42.52 3fky s LEU 37 CO 0.16 -0.34 -0.09 -0.13 1.01 0.00 0.00 176.35 176.95 3fky s ARG 38 N -3.99 0.93 -0.01 1.70 1.81 0.38 -4.88 118.95 114.89 3fky s ARG 38 Ca 0.46 -1.35 -0.28 0.00 -1.72 0.00 0.00 55.73 52.84 3fky s ARG 38 Cb -0.10 -0.44 0.07 0.00 -0.45 0.00 0.00 34.95 34.02 3fky s ARG 38 CO 0.34 0.04 0.63 -1.54 -0.68 0.00 0.00 175.30 174.09 3fky s SER 39 N -2.98 -0.60 0.13 0.23 1.04 -1.26 -1.48 113.70 108.79 3fky s SER 39 Ca 0.13 0.54 -0.01 0.00 0.48 0.00 0.00 55.95 57.08 3fky s SER 39 Cb 0.02 0.53 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 3fky s SER 39 CO -0.02 -0.65 0.06 -1.59 0.98 0.00 0.00 173.24 172.02 3fky s LYS 40 N -1.63 0.91 0.11 4.02 -2.85 -0.94 -4.98 119.74 114.37 3fky s LYS 40 Ca -0.09 -1.41 0.09 0.00 -1.00 0.00 0.00 55.97 53.56 3fky s LYS 40 Cb -0.01 0.24 -0.04 0.00 -2.06 0.00 0.00 37.83 35.97 3fky s LYS 40 CO 0.06 -0.25 -0.21 0.20 0.10 0.00 0.00 175.35 175.24 3fky s GLY 41 N -3.04 1.63 0.01 0.59 0.00 -1.26 0.11 107.32 105.36 3fky s GLY 41 Ca 0.23 -1.37 0.01 0.00 0.00 0.00 0.00 44.72 43.59 3fky s GLY 41 CO 0.01 -1.33 -0.05 1.09 0.00 0.00 0.00 173.10 172.81 3fky s ARG 42 N -1.99 0.38 0.28 2.90 1.70 -0.56 -4.98 118.95 116.67 3fky s ARG 42 Ca 0.16 -0.36 -0.29 0.00 -0.47 0.00 0.00 55.73 54.77 3fky s ARG 42 Cb -0.10 -0.27 -0.09 0.00 -0.57 0.00 0.00 34.95 33.91 3fky s ARG 42 CO 0.08 0.06 1.02 0.99 -1.08 0.00 0.00 175.30 176.38 3fky s THR 43 N -0.58 3.77 0.10 4.99 2.01 -1.26 -0.97 115.64 123.70 3fky s THR 43 Ca -0.03 1.72 0.10 0.00 0.31 0.00 0.00 61.69 63.78 3fky s THR 43 Cb -0.05 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 3fky s THR 43 CO -0.00 0.36 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.28 3fky s LEU 44 N -1.52 2.28 0.34 4.42 1.43 0.14 -4.93 118.68 120.84 3fky s LEU 44 Ca 0.45 -0.69 0.07 0.00 -1.03 0.00 0.00 54.13 52.94 3fky s LEU 44 Cb -0.28 -1.10 0.61 0.00 0.03 0.00 0.00 46.19 45.45 3fky s LEU 44 CO 0.35 0.15 1.81 0.11 0.23 0.00 0.00 176.35 179.00 3fky h LYS 45 N 4.15 0.27 -3.72 1.70 1.79 -1.92 -0.95 116.57 117.89 3fky h LYS 45 Ca -0.48 -0.09 -0.13 0.00 -2.18 0.00 0.00 60.65 57.77 3fky h LYS 45 Cb 1.17 -0.02 -0.18 0.00 -1.58 0.00 0.00 32.23 31.62 3fky h LYS 45 CO 0.40 0.51 -0.50 0.21 -1.08 0.00 0.00 179.45 178.99 3fky s LYS 46 N -4.48 0.59 0.32 3.15 2.20 -1.26 -4.47 119.74 115.79 3fky s LYS 46 Ca -0.05 -0.68 -0.27 0.00 -0.36 0.00 0.00 55.97 54.61 3fky s LYS 46 Cb 0.14 0.23 -0.13 0.00 -1.51 0.00 0.00 37.83 36.56 3fky s LYS 46 CO 0.76 -0.15 0.93 -2.13 -0.36 0.00 0.00 175.35 174.39 3fky n ARG 47 N 0.87 1.19 -3.61 4.03 0.63 -1.26 -4.76 116.66 113.75 3fky n ARG 47 Ca -0.20 0.42 -0.37 0.00 -0.92 0.00 0.00 57.85 56.78 3fky n ARG 47 Cb 0.58 -1.80 -0.06 0.00 0.45 0.00 0.00 32.46 31.63 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 -1.15 5.21 0.00 5.15 -1.09 -1.26 -4.97 121.20 123.09 3fky s ILE 48 Ca 0.60 0.62 0.00 0.00 -2.23 0.00 0.00 60.65 59.65 3fky s ILE 48 Cb -0.67 -3.62 0.00 0.00 -1.58 0.00 0.00 42.46 36.59 3fky s ILE 48 CO 0.59 0.56 0.23 0.35 -1.23 0.00 0.00 174.94 175.44 3fky n THR 49 N 2.17 0.00 -3.55 2.92 -2.24 -1.26 -5.06 114.28 107.26 3fky n THR 49 Ca -0.15 -0.37 -0.16 0.00 -2.27 0.00 0.00 64.05 61.10 3fky n THR 49 Cb 0.53 1.17 -0.06 0.00 -2.10 0.00 0.00 70.33 69.87 3fky n THR 49 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3fky s SER 50 N -0.27 -0.61 0.50 3.42 1.04 -1.26 -5.02 113.70 111.49 3fky s SER 50 Ca 0.00 0.75 0.33 0.00 0.48 0.00 0.00 55.95 57.51 3fky s SER 50 Cb 0.00 0.61 1.46 0.00 0.10 0.00 0.00 66.02 68.19 3fky s SER 50 CO 0.00 -0.51 1.76 0.40 0.98 0.00 0.00 173.24 175.87 3fky h ILE 51 N 3.05 0.37 -0.07 -1.02 2.04 -1.97 0.53 117.51 120.45 3fky h ILE 51 Ca -0.26 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 65.59 3fky h ILE 51 Cb 1.15 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 3fky h ILE 51 CO 0.33 0.02 0.06 0.44 0.00 0.00 0.00 178.15 179.00 3fky h ASP 52 N 0.10 0.00 1.48 1.72 3.32 -1.98 -0.66 116.42 120.40 3fky h ASP 52 Ca 0.63 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.68 3fky h ASP 52 Cb 2.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.80 3fky h ASP 52 CO -0.11 0.00 0.00 1.56 -1.72 0.00 0.00 179.24 178.97 3fky h GLN 53 N 0.00 0.00 -6.05 3.56 4.20 -1.31 -3.44 115.11 112.07 3fky h GLN 53 Ca 0.03 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.17 3fky h GLN 53 Cb 0.15 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.88 3fky h GLN 53 CO -0.00 0.00 0.40 -0.51 -0.67 0.00 0.00 178.83 178.05 3fky s LEU 54 N -5.30 4.22 0.49 1.46 1.43 -0.26 -5.02 118.68 115.69 3fky s LEU 54 Ca 0.07 1.28 -0.21 0.00 -1.03 0.00 0.00 54.13 54.25 3fky s LEU 54 Cb 0.09 -3.31 -0.08 0.00 0.03 0.00 0.00 46.19 42.92 3fky s LEU 54 CO 0.58 -0.37 1.09 -2.16 0.23 0.00 0.00 176.35 175.72 3fky s PRO 55 N 1.92 3.71 1.05 1.29 0.04 -1.26 -4.83 135.00 136.91 3fky s PRO 55 Ca 0.41 1.52 -0.12 0.00 0.04 0.00 0.00 61.00 62.86 3fky s PRO 55 Cb -0.17 -2.17 0.22 0.00 0.04 0.00 0.00 34.50 32.42 3fky s PRO 55 CO 0.15 -0.54 1.08 -1.21 0.04 0.00 0.00 177.00 176.52 3fky s GLU 56 N -3.07 -0.07 0.32 4.56 2.02 -1.26 -4.69 118.70 116.52 3fky s GLU 56 Ca 0.67 1.11 -0.11 0.00 0.02 0.00 0.00 54.97 56.66 3fky s GLU 56 Cb -0.21 -1.63 0.04 0.00 0.10 0.00 0.00 34.13 32.43 3fky s GLU 56 CO 0.25 -3.23 0.62 1.87 0.02 0.00 0.00 175.26 174.79 3fky n TRP 57 N -4.60 -2.03 -3.83 1.61 -0.00 -0.69 -4.95 117.44 102.94 3fky n TRP 57 Ca 0.07 -1.57 -0.07 0.00 -0.00 0.00 0.00 57.50 55.92 3fky n TRP 57 Cb 0.53 0.73 -0.00 0.00 -0.00 0.00 0.00 31.31 32.57 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 -2.70 -0.16 0.31 5.87 4.22 -1.26 0.27 114.94 121.48 3fky s ASN 58 Ca 0.14 -0.76 -0.19 0.00 -2.14 0.00 0.00 52.86 49.91 3fky s ASN 58 Cb -0.04 0.74 0.05 0.00 1.28 0.00 0.00 41.25 43.27 3fky s ASN 58 CO 0.11 -1.40 0.81 0.72 -2.04 0.00 0.00 177.10 175.30 3fky s PHE 59 N -3.30 -0.01 -0.82 1.54 -0.12 -0.44 -4.92 117.98 109.91 3fky s PHE 59 Ca 0.13 -0.53 -0.22 0.00 -0.05 0.00 0.00 56.93 56.26 3fky s PHE 59 Cb -0.05 0.76 0.08 0.00 -0.63 0.00 0.00 43.02 43.18 3fky s PHE 59 CO 0.08 -1.33 1.15 0.34 -0.05 0.00 0.00 175.22 175.41 3fky s ASP 60 N -3.04 6.37 0.54 1.98 -1.08 -1.26 -1.64 116.67 118.54 3fky s ASP 60 Ca 0.14 -1.31 0.32 0.00 -0.52 0.00 0.00 52.55 51.19 3fky s ASP 60 Cb -0.05 -2.46 1.77 0.00 -1.46 0.00 0.00 42.92 40.72 3fky s ASP 60 CO 0.08 -1.40 1.98 1.23 0.52 0.00 0.00 175.17 177.59 3fky h GLY 61 N 11.58 0.00 2.00 2.66 0.00 -1.88 -1.39 103.07 116.04 3fky h GLY 61 Ca -0.06 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.22 3fky h GLY 61 CO 1.22 0.00 -0.23 1.48 0.00 0.00 0.00 176.54 179.01 3fky h SER 62 N 0.00 0.00 0.31 0.19 4.64 -1.90 0.15 113.55 116.94 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 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 3fky h SER 62 CO 0.00 0.23 -0.16 -1.20 -0.87 0.00 0.00 176.83 174.83 3fky n SER 63 N -3.22 0.70 -0.03 4.97 7.64 -0.53 -3.90 113.62 119.26 3fky n SER 63 Ca 0.02 -0.71 0.01 0.00 1.01 0.00 0.00 58.87 59.20 3fky n SER 63 Cb 0.55 0.01 0.01 0.00 -1.01 0.00 0.00 64.21 63.77 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 -0.82 0.74 -3.13 0.44 -2.24 -1.13 -5.03 114.28 103.11 3fky n THR 64 Ca 0.14 -0.77 -0.14 0.00 -2.27 0.00 0.00 64.05 61.01 3fky n THR 64 Cb 0.31 0.59 0.07 0.00 -2.10 0.00 0.00 70.33 69.19 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 -0.41 -2.46 0.00 3.42 2.85 -0.96 -1.25 115.26 116.45 3fky n ASN 65 Ca 0.01 -0.47 0.00 0.00 -0.11 0.00 0.00 54.58 54.01 3fky n ASN 65 Cb 0.37 -4.06 0.00 0.00 1.24 0.00 0.00 39.78 37.33 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 -3.48 2.91 -4.10 1.20 6.02 0.43 -3.70 117.38 116.66 3fky n GLN 66 Ca -0.19 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.70 3fky n GLN 66 Cb 0.62 -0.34 -0.09 0.00 1.02 0.00 0.00 30.24 31.45 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 -0.44 0.62 -0.28 -1.58 0.00 -0.60 -4.80 121.76 114.67 3fky s ALA 67 Ca 0.00 -1.32 0.23 0.00 0.00 0.00 0.00 51.96 50.87 3fky s ALA 67 Cb 0.00 0.99 -0.04 0.00 0.00 0.00 0.00 23.12 24.07 3fky s ALA 67 CO 0.00 -0.58 0.95 -2.30 0.00 0.00 0.00 175.76 173.83 3fky n PRO 68 N -0.18 0.55 0.00 0.00 -0.02 -1.26 -3.97 135.00 130.12 3fky n PRO 68 Ca -0.04 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3fky n PRO 68 Cb 0.64 -1.72 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 1.24 1.80 2.22 -1.23 0.00 -1.26 -5.00 105.19 102.96 3fky n GLY 69 Ca -0.00 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 -0.80 -0.53 0.00 1.61 -0.00 -1.26 -5.14 115.22 109.11 3fky n HIS 70 Ca 0.00 -0.62 0.00 0.00 -0.00 0.00 0.00 57.72 57.10 3fky n HIS 70 Cb 0.00 1.01 0.00 0.00 -0.00 0.00 0.00 29.99 31.00 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 -4.77 4.39 2.03 -1.26 -5.08 116.55 111.41 3fky n ASP 73 Ca -0.15 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 54.90 3fky n ASP 73 Cb 0.63 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.97 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 4.32 0.04 5.18 1.09 -0.65 -4.49 121.20 126.69 3fky s ILE 74 Ca 0.00 -1.19 0.01 0.00 -1.10 0.00 0.00 60.65 58.38 3fky s ILE 74 Cb 0.00 -3.21 -0.04 0.00 -1.06 0.00 0.00 42.46 38.15 3fky s ILE 74 CO 0.00 -0.13 0.08 -0.31 -0.10 0.00 0.00 174.94 174.48 3fky s TYR 75 N -1.79 3.24 -0.28 3.97 1.51 -0.09 -1.33 117.35 122.59 3fky s TYR 75 Ca 0.30 0.14 -0.05 0.00 -1.01 0.00 0.00 57.07 56.46 3fky s TYR 75 Cb -0.10 -1.68 0.02 0.00 -0.11 0.00 0.00 41.96 40.09 3fky s TYR 75 CO 0.23 0.53 0.02 -0.51 -1.11 0.00 0.00 175.55 174.71 3fky s LEU 76 N -2.09 3.59 -0.37 -1.29 1.43 0.76 -1.33 118.68 119.38 3fky s LEU 76 Ca 0.26 -0.78 -0.13 0.00 -1.03 0.00 0.00 54.13 52.45 3fky s LEU 76 Cb -0.12 -1.79 0.01 0.00 0.03 0.00 0.00 46.19 44.32 3fky s LEU 76 CO 0.18 -0.17 0.24 -0.54 0.23 0.00 0.00 176.35 176.30 3fky s LYS 77 N 1.42 3.10 0.28 1.70 1.02 0.07 -1.70 119.74 125.64 3fky s LYS 77 Ca 0.01 -0.91 -0.30 0.00 0.02 0.00 0.00 55.97 54.79 3fky s LYS 77 Cb -0.17 -3.82 -0.13 0.00 -0.52 0.00 0.00 37.83 33.19 3fky s LYS 77 CO -0.00 -0.62 1.36 -2.30 -0.92 0.00 0.00 175.35 172.86 3fky n PRO 78 N 5.08 2.05 0.00 -1.68 -0.02 -1.26 -0.83 135.00 138.33 3fky n PRO 78 Ca -0.12 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 3fky n PRO 78 Cb 0.48 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 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 1.32 0.00 -3.72 -1.45 0.31 0.84 -4.85 118.33 110.78 3fky n VAL 79 Ca 0.09 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.31 3fky n VAL 79 Cb 0.33 -0.39 -0.06 0.00 -0.91 0.00 0.00 33.84 32.81 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 -1.66 -0.72 0.02 3.52 0.00 -1.01 -5.01 121.76 116.91 3fky s ALA 80 Ca 0.00 -0.10 -0.11 0.00 0.00 0.00 0.00 51.96 51.75 3fky s ALA 80 Cb 0.00 0.50 0.01 0.00 0.00 0.00 0.00 23.12 23.63 3fky s ALA 80 CO 0.00 -0.52 0.22 1.52 0.00 0.00 0.00 175.76 176.98 3fky s TYR 81 N -3.28 -0.01 0.16 0.00 1.13 -1.26 -0.20 117.35 113.89 3fky s TYR 81 Ca 0.00 -0.12 -0.07 0.00 -1.41 0.00 0.00 57.07 55.48 3fky s TYR 81 Cb 0.01 0.01 -0.02 0.00 -1.10 0.00 0.00 41.96 40.86 3fky s TYR 81 CO -0.08 -0.41 0.23 0.71 -2.51 0.00 0.00 175.55 173.49 3fky s TYR 82 N -2.12 0.56 0.32 -3.49 2.02 -0.11 -4.98 117.35 109.55 3fky s TYR 82 Ca -0.08 -0.91 -0.29 0.00 -0.37 0.00 0.00 57.07 55.41 3fky s TYR 82 Cb -0.03 -0.18 -0.10 0.00 -0.40 0.00 0.00 41.96 41.25 3fky s TYR 82 CO -0.01 -0.68 1.39 -2.14 -1.57 0.00 0.00 175.55 172.53 3fky s PRO 83 N -4.00 4.28 -0.49 -1.71 0.02 -1.26 -0.02 135.00 131.81 3fky s PRO 83 Ca 0.20 2.32 -0.29 0.00 0.02 0.00 0.00 61.00 63.25 3fky s PRO 83 Cb 0.04 -3.06 0.02 0.00 0.02 0.00 0.00 34.50 31.53 3fky s PRO 83 CO 0.02 -0.33 1.25 0.34 -0.33 0.00 0.00 177.00 177.94 3fky s ASP 84 N -0.16 6.47 0.51 2.53 -1.08 -0.68 -4.33 116.67 119.93 3fky s ASP 84 Ca 0.53 0.47 0.34 0.00 -0.52 0.00 0.00 52.55 53.37 3fky s ASP 84 Cb -0.42 -2.55 1.69 0.00 -1.46 0.00 0.00 42.92 40.18 3fky s ASP 84 CO 0.52 -1.39 2.03 -0.65 0.52 0.00 0.00 175.17 176.20 3fky h PRO 85 N 9.87 0.00 0.00 4.34 0.11 -1.90 0.34 132.00 144.75 3fky h PRO 85 Ca -0.25 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.69 3fky h PRO 85 Cb 1.07 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3fky h PRO 85 CO 1.13 0.00 -1.29 1.19 -0.21 0.00 0.00 178.00 178.83 3fky n PHE 86 N -2.80 0.52 0.23 0.65 3.72 -1.26 -4.35 117.46 114.17 3fky n PHE 86 Ca -0.01 0.23 0.12 0.00 -0.05 0.00 0.00 57.45 57.73 3fky n PHE 86 Cb 0.15 -0.84 0.42 0.00 -0.94 0.00 0.00 39.48 38.26 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 -3.49 114.38 109.96 3fky h ARG 87 Ca -0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.80 3fky h ARG 87 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 3fky h ARG 87 CO -0.15 0.14 0.00 0.54 -1.07 0.00 0.00 179.97 179.43 3fky n ARG 88 N -3.22 0.00 0.00 0.04 1.74 0.12 -4.84 116.66 110.50 3fky n ARG 88 Ca 0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 3fky n ARG 88 Cb 0.45 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.89 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 1.26 0.88 -0.13 0.00 -1.26 -2.24 105.19 103.70 3fky n GLY 89 Ca 0.00 -0.64 0.05 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.09 2.52 -4.80 1.61 8.00 -1.26 -4.83 116.55 116.70 3fky n ASP 90 Ca 0.00 -2.17 -0.33 0.00 0.71 0.00 0.00 54.79 53.00 3fky n ASP 90 Cb 0.00 -0.37 -0.02 0.00 -0.02 0.00 0.00 41.12 40.71 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 -0.79 6.18 0.03 -2.24 0.01 -0.95 -4.75 114.94 112.43 3fky s ASN 91 Ca 0.26 1.84 -0.01 0.00 -0.71 0.00 0.00 52.86 54.24 3fky s ASN 91 Cb 0.16 -2.54 -0.02 0.00 0.41 0.00 0.00 41.25 39.25 3fky s ASN 91 CO 0.14 -0.89 -0.01 -0.51 -1.51 0.00 0.00 177.10 174.32 3fky s ILE 92 N -2.23 0.14 -0.15 0.60 2.07 -0.35 -1.69 121.20 119.57 3fky s ILE 92 Ca 0.65 -1.12 -0.03 0.00 -1.41 0.00 0.00 60.65 58.74 3fky s ILE 92 Cb -0.15 -0.62 -0.02 0.00 0.13 0.00 0.00 42.46 41.80 3fky s ILE 92 CO 0.27 -0.62 -0.06 -0.69 -1.91 0.00 0.00 174.94 171.94 3fky s VAL 93 N -2.12 3.70 -0.26 4.00 1.01 0.97 -1.15 120.40 126.55 3fky s VAL 93 Ca -0.10 -0.42 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 3fky s VAL 93 Cb -0.05 -2.61 0.03 0.00 0.00 0.00 0.00 36.38 33.75 3fky s VAL 93 CO -0.03 0.49 -0.05 -0.69 0.00 0.00 0.00 175.10 174.82 3fky s VAL 94 N 0.43 2.89 -0.29 2.92 1.01 0.16 -0.93 120.40 126.59 3fky s VAL 94 Ca -0.05 -1.08 -0.29 0.00 0.00 0.00 0.00 61.98 60.56 3fky s VAL 94 Cb -0.15 -2.50 0.01 0.00 0.00 0.00 0.00 36.38 33.74 3fky s VAL 94 CO 0.03 0.15 1.21 -0.22 0.00 0.00 0.00 175.10 176.27 3fky s LEU 95 N 1.31 3.95 -0.00 3.92 2.96 0.72 -0.38 118.68 131.16 3fky s LEU 95 Ca -0.01 1.22 0.05 0.00 -0.22 0.00 0.00 54.13 55.18 3fky s LEU 95 Cb -0.17 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.95 3fky s LEU 95 CO -0.04 -0.95 -0.15 0.00 -1.32 0.00 0.00 176.35 173.88 3fky s ALA 96 N 3.95 2.66 0.08 5.97 0.00 0.08 -0.11 121.76 134.39 3fky s ALA 96 Ca 0.52 -1.08 -0.04 0.00 0.00 0.00 0.00 51.96 51.35 3fky s ALA 96 Cb -0.16 -0.87 -0.05 0.00 0.00 0.00 0.00 23.12 22.04 3fky s ALA 96 CO 0.19 0.57 0.31 0.00 0.00 0.00 0.00 175.76 176.82 3fky s ALA 97 N -0.84 3.86 -0.27 0.00 0.00 -0.01 -4.40 121.76 120.09 3fky s ALA 97 Ca 0.13 -0.62 -0.14 0.00 0.00 0.00 0.00 51.96 51.34 3fky s ALA 97 Cb -0.11 -2.05 -0.04 0.00 0.00 0.00 0.00 23.12 20.93 3fky s ALA 97 CO 0.03 0.70 0.32 0.00 0.00 0.00 0.00 175.76 176.81 3fky s TYR 99 N 1.92 2.42 1.04 0.00 2.02 -0.44 -1.47 117.35 122.84 3fky s TYR 99 Ca 0.13 -0.78 -0.13 0.00 -0.37 0.00 0.00 57.07 55.92 3fky s TYR 99 Cb -0.16 -1.60 0.21 0.00 -0.40 0.00 0.00 41.96 40.02 3fky s TYR 99 CO 0.10 -0.26 1.08 -0.80 -1.57 0.00 0.00 175.55 174.10 3fky s ASN 100 N -0.04 2.20 0.01 2.29 0.01 0.11 -0.92 114.94 118.61 3fky s ASN 100 Ca -0.07 1.23 0.09 0.00 -0.71 0.00 0.00 52.86 53.41 3fky s ASN 100 Cb -0.15 -1.93 0.40 0.00 0.41 0.00 0.00 41.25 39.99 3fky s ASN 100 CO 0.05 -3.40 1.30 -0.46 -1.51 0.00 0.00 177.10 173.07 3fky n ASN 101 N -4.36 0.03 0.07 -1.22 6.94 -1.26 -1.25 115.26 114.20 3fky n ASN 101 Ca 0.05 0.51 0.00 0.00 -0.02 0.00 0.00 54.58 55.11 3fky n ASN 101 Cb 0.57 -0.51 0.31 0.00 -2.36 0.00 0.00 39.78 37.78 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 0.34 0.00 0.53 3.32 -1.98 -3.45 116.42 115.18 3fky h ASP 102 Ca 0.00 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.96 3fky h ASP 102 Cb 0.15 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3fky h ASP 102 CO 0.00 0.53 0.00 0.61 -1.72 0.00 0.00 179.24 178.66 3fky n GLY 103 N -0.68 0.86 3.78 2.75 0.00 -0.38 -5.09 105.19 106.43 3fky n GLY 103 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.12 3.65 0.02 2.61 -4.23 -1.26 -4.80 115.64 109.51 3fky s THR 104 Ca 0.00 1.26 -0.30 0.00 -1.18 0.00 0.00 61.69 61.47 3fky s THR 104 Cb 0.00 -3.65 -0.06 0.00 1.34 0.00 0.00 72.50 70.13 3fky s THR 104 CO 0.00 0.00 1.49 -2.84 -0.54 0.00 0.00 174.62 172.74 3fky s PRO 105 N -2.52 4.25 0.91 3.99 0.02 -1.26 0.09 135.00 140.48 3fky s PRO 105 Ca 0.58 2.09 -0.16 0.00 0.02 0.00 0.00 61.00 63.53 3fky s PRO 105 Cb -0.23 -3.60 -0.11 0.00 0.02 0.00 0.00 34.50 30.59 3fky s PRO 105 CO 0.28 -0.64 -0.39 -1.71 -0.33 0.00 0.00 177.00 174.21 3fky n ASN 106 N 5.53 -4.64 -0.32 2.53 5.15 -0.54 -4.70 115.26 118.26 3fky n ASN 106 Ca 0.14 0.30 0.15 0.00 -0.60 0.00 0.00 54.58 54.57 3fky n ASN 106 Cb 0.43 -0.89 0.29 0.00 -0.53 0.00 0.00 39.78 39.08 3fky n ASN 106 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3fky n LYS 107 N 1.33 -0.07 -0.51 1.20 5.02 -1.26 -0.87 118.16 123.00 3fky n LYS 107 Ca 0.02 1.39 0.09 0.00 -2.02 0.00 0.00 58.31 57.79 3fky n LYS 107 Cb 0.54 -2.23 0.32 0.00 -0.02 0.00 0.00 35.03 33.64 3fky n LYS 107 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3fky n PHE 108 N -5.36 1.24 -3.12 2.13 3.72 -1.26 -4.52 117.46 110.28 3fky n PHE 108 Ca 0.23 -0.60 -0.43 0.00 -0.05 0.00 0.00 57.45 56.60 3fky n PHE 108 Cb 0.75 -0.18 -0.06 0.00 -0.94 0.00 0.00 39.48 39.05 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 6.25 0.00 4.37 3.84 -0.05 -4.82 114.94 123.52 3fky s ASN 109 Ca 0.47 -0.76 0.10 0.00 0.21 0.00 0.00 52.86 52.88 3fky s ASN 109 Cb 0.29 -2.31 0.20 0.00 -0.55 0.00 0.00 41.25 38.88 3fky s ASN 109 CO 0.24 -0.91 1.07 1.41 -2.79 0.00 0.00 177.10 176.13 3fky n HIS 110 N 6.32 0.26 -0.11 0.43 8.25 -1.26 -4.53 115.22 124.58 3fky n HIS 110 Ca -0.05 -0.31 -0.14 0.00 -0.26 0.00 0.00 57.72 56.96 3fky n HIS 110 Cb 0.46 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.52 3fky n HIS 110 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 3fky h ARG 111 N 1.87 0.92 0.18 -0.41 2.43 -1.92 -2.93 114.38 114.52 3fky h ARG 111 Ca 0.00 -0.52 -0.01 0.00 -0.81 0.00 0.00 59.98 58.64 3fky h ARG 111 Cb 0.60 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 3fky h ARG 111 CO 0.00 1.17 -0.09 1.25 -1.51 0.00 0.00 179.97 180.80 3fky h HIS 112 N 0.74 -0.22 -0.14 2.20 2.76 -2.00 -0.82 115.15 117.66 3fky h HIS 112 Ca 0.04 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.26 3fky h HIS 112 Cb 1.05 0.07 -0.06 0.00 1.55 0.00 0.00 27.41 30.03 3fky h HIS 112 CO 0.07 0.01 -0.22 1.49 -1.30 0.00 0.00 177.93 177.97 3fky h GLU 113 N -0.43 -0.27 -0.82 5.26 4.57 -1.83 -1.90 114.58 119.16 3fky h GLU 113 Ca -0.02 0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.22 3fky h GLU 113 Cb 0.33 0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 28.93 3fky h GLU 113 CO 0.04 -0.18 0.51 0.00 -1.18 0.00 0.00 179.01 178.20 3fky h ALA 114 N 0.71 1.10 -0.67 2.92 0.00 -1.44 -2.16 119.26 119.72 3fky h ALA 114 Ca 0.10 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.14 3fky h ALA 114 Cb 0.43 -0.23 -0.10 0.00 0.00 0.00 0.00 17.79 17.88 3fky h ALA 114 CO -0.30 0.27 0.13 0.00 0.00 0.00 0.00 179.25 179.35 3fky h ALA 115 N 1.37 0.81 -0.44 0.00 0.00 -0.36 -0.37 119.26 120.29 3fky h ALA 115 Ca 0.35 0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.50 3fky h ALA 115 Cb 0.11 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.04 3fky h ALA 115 CO -0.15 -0.33 -0.31 0.87 0.00 0.00 0.00 179.25 179.33 3fky h LYS 116 N 0.24 -0.21 -0.44 0.00 1.57 -0.96 0.28 116.57 117.06 3fky h LYS 116 Ca 0.37 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.16 3fky h LYS 116 Cb 0.59 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.93 3fky h LYS 116 CO -0.48 -0.14 0.26 -0.07 -0.57 0.00 0.00 179.45 178.46 3fky h LEU 117 N -0.22 0.53 -0.99 2.94 3.38 -1.12 -0.32 115.31 119.51 3fky h LEU 117 Ca 0.19 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 3fky h LEU 117 Cb 0.53 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 3fky h LEU 117 CO -0.56 0.43 0.21 -0.26 0.09 0.00 0.00 178.44 178.35 3fky h PHE 118 N 0.58 0.96 -0.39 1.13 0.04 -0.55 -1.34 116.94 117.38 3fky h PHE 118 Ca 0.16 -0.07 -0.06 0.00 2.80 0.00 0.00 57.97 60.80 3fky h PHE 118 Cb 0.00 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 37.85 3fky h PHE 118 CO -0.03 0.76 0.02 0.00 -0.60 0.00 0.00 178.31 178.46 3fky h ALA 119 N 1.31 0.52 -0.05 2.45 0.00 -0.03 -2.01 119.26 121.44 3fky h ALA 119 Ca 0.21 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.90 3fky h ALA 119 Cb 0.24 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3fky h ALA 119 CO -0.01 0.27 -0.10 0.00 0.00 0.00 0.00 179.25 179.40 3fky h ALA 120 N 0.89 -0.07 -0.72 0.00 0.00 -0.77 -2.96 119.26 115.63 3fky h ALA 120 Ca 0.11 0.03 -0.37 0.00 0.00 0.00 0.00 54.91 54.68 3fky h ALA 120 Cb 0.43 0.20 -0.22 0.00 0.00 0.00 0.00 17.79 18.20 3fky h ALA 120 CO 0.02 -0.58 0.47 0.72 0.00 0.00 0.00 179.25 179.88 3fky n HIS 121 N -5.24 2.23 -0.33 0.00 8.25 -0.53 -4.53 115.22 115.08 3fky n HIS 121 Ca -0.05 -1.46 0.24 0.00 -0.26 0.00 0.00 57.72 56.19 3fky n HIS 121 Cb 0.16 -0.75 0.45 0.00 1.12 0.00 0.00 29.99 30.97 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 0.79 0.07 -0.52 -0.41 1.57 -1.19 0.32 116.57 117.21 3fky h LYS 122 Ca 0.45 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.21 3fky h LYS 122 Cb 2.35 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 34.62 3fky h LYS 122 CO 0.80 0.05 0.23 -0.44 -0.57 0.00 0.00 179.45 179.52 3fky h ASP 123 N 0.07 0.65 0.82 0.86 3.32 -1.87 -2.17 116.42 118.11 3fky h ASP 123 Ca 0.73 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.64 3fky h ASP 123 Cb 1.74 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 41.11 3fky h ASP 123 CO -0.78 0.57 -0.32 -0.33 -1.72 0.00 0.00 179.24 176.66 3fky h GLU 124 N 0.73 0.00 -5.76 3.56 3.07 -1.30 -3.47 114.58 111.41 3fky h GLU 124 Ca 0.18 0.00 -0.23 0.00 -0.50 0.00 0.00 59.36 58.81 3fky h GLU 124 Cb 0.10 0.00 0.07 0.00 -0.84 0.00 0.00 28.75 28.09 3fky h GLU 124 CO -0.02 0.32 -0.57 0.39 -1.40 0.00 0.00 179.01 177.73 3fky n GLU 125 N -3.53 -1.55 -2.11 2.33 1.02 -0.82 -0.54 120.64 115.45 3fky n GLU 125 Ca -0.00 1.01 -0.41 0.00 -0.02 0.00 0.00 57.16 57.73 3fky n GLU 125 Cb 0.47 -4.96 -0.02 0.00 -0.02 0.00 0.00 31.44 26.91 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 -3.20 2.82 -0.01 -3.67 1.01 -1.26 -3.72 121.20 113.17 3fky s ILE 126 Ca 0.23 0.74 0.06 0.00 0.00 0.00 0.00 60.65 61.68 3fky s ILE 126 Cb -0.05 -3.47 -0.03 0.00 0.01 0.00 0.00 42.46 38.92 3fky s ILE 126 CO 0.79 0.14 -0.19 0.26 0.00 0.00 0.00 174.94 175.94 3fky s TRP 127 N -0.46 2.53 0.15 3.97 0.52 0.15 -2.94 118.94 122.86 3fky s TRP 127 Ca 0.54 -0.28 0.08 0.00 0.02 0.00 0.00 56.10 56.47 3fky s TRP 127 Cb -0.40 -1.53 -0.04 0.00 -1.15 0.00 0.00 33.47 30.35 3fky s TRP 127 CO 0.46 0.14 -0.19 -0.06 0.02 0.00 0.00 176.95 177.32 3fky s PHE 128 N -0.76 1.80 -0.18 -1.98 0.08 -0.58 -2.00 117.98 114.37 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 0.08 0.00 -0.57 0.00 0.00 43.02 41.50 3fky s PHE 128 CO 0.02 0.29 0.17 0.20 -0.10 0.00 0.00 175.22 175.80 3fky s GLY 129 N -2.46 0.13 0.01 4.36 0.00 -0.55 -0.79 107.32 108.02 3fky s GLY 129 Ca 0.13 0.10 -0.09 0.00 0.00 0.00 0.00 44.72 44.86 3fky s GLY 129 CO 0.06 1.95 0.32 1.08 0.00 0.00 0.00 173.10 176.51 3fky s LEU 130 N 2.26 4.39 -0.54 0.66 1.43 -0.52 -0.59 118.68 125.77 3fky s LEU 130 Ca 0.05 0.71 -0.05 0.00 -1.03 0.00 0.00 54.13 53.80 3fky s LEU 130 Cb -0.15 -2.67 0.14 0.00 0.03 0.00 0.00 46.19 43.54 3fky s LEU 130 CO -0.10 0.26 0.37 -1.61 0.23 0.00 0.00 176.35 175.51 3fky s GLU 131 N -1.56 2.46 -0.44 1.70 2.02 -0.50 -1.42 118.70 120.95 3fky s GLU 131 Ca 0.27 -2.13 -0.25 0.00 0.02 0.00 0.00 54.97 52.88 3fky s GLU 131 Cb -0.14 -3.79 0.02 0.00 0.10 0.00 0.00 34.13 30.32 3fky s GLU 131 CO 0.15 -1.16 0.88 -1.14 0.02 0.00 0.00 175.26 174.01 3fky s GLN 132 N 0.66 3.58 -0.01 1.61 2.00 0.65 -3.14 119.66 125.01 3fky s GLN 132 Ca 0.12 0.18 -0.05 0.00 -2.00 0.00 0.00 55.36 53.61 3fky s GLN 132 Cb -0.22 -3.90 -0.04 0.00 0.80 0.00 0.00 33.01 29.65 3fky s GLN 132 CO -0.03 -1.12 0.22 -1.21 -0.50 0.00 0.00 175.29 172.65 3fky s GLU 133 N 3.55 3.51 0.22 1.67 2.02 -0.83 -1.08 118.70 127.77 3fky s GLU 133 Ca 0.35 -0.19 -0.10 0.00 0.02 0.00 0.00 54.97 55.05 3fky s GLU 133 Cb -0.11 -3.09 -0.01 0.00 0.10 0.00 0.00 34.13 31.02 3fky s GLU 133 CO 0.24 0.67 0.37 1.52 0.02 0.00 0.00 175.26 178.07 3fky s TYR 134 N -1.30 0.52 -0.02 1.61 -0.85 0.08 -4.68 117.35 112.72 3fky s TYR 134 Ca 0.27 -0.85 0.02 0.00 -0.52 0.00 0.00 57.07 55.99 3fky s TYR 134 Cb -0.13 -0.01 -0.00 0.00 0.38 0.00 0.00 41.96 42.20 3fky s TYR 134 CO 0.17 -0.87 -0.08 0.99 -1.52 0.00 0.00 175.55 174.24 3fky s THR 135 N -4.03 0.67 0.27 -3.49 2.01 -0.71 -0.77 115.64 109.59 3fky s THR 135 Ca 0.24 -0.32 -0.12 0.00 0.31 0.00 0.00 61.69 61.80 3fky s THR 135 Cb 0.02 -0.58 -0.08 0.00 0.01 0.00 0.00 72.50 71.86 3fky s THR 135 CO 0.08 0.20 0.63 -0.76 -0.69 0.00 0.00 174.62 174.08 3fky s LEU 136 N 0.04 4.11 0.00 4.42 1.43 -0.04 -1.02 118.68 127.63 3fky s LEU 136 Ca -0.00 1.06 -0.04 0.00 -1.03 0.00 0.00 54.13 54.11 3fky s LEU 136 Cb -0.06 -3.85 -0.00 0.00 0.03 0.00 0.00 46.19 42.31 3fky s LEU 136 CO -0.00 -0.14 0.08 -0.36 0.23 0.00 0.00 176.35 176.16 3fky s PHE 137 N -1.91 0.10 0.97 0.29 0.08 -0.43 -1.47 117.98 115.61 3fky s PHE 137 Ca 0.50 -0.21 -0.14 0.00 0.12 0.00 0.00 56.93 57.20 3fky s PHE 137 Cb -0.11 -0.08 0.02 0.00 -0.57 0.00 0.00 43.02 42.28 3fky s PHE 137 CO 0.20 -0.22 0.20 -0.25 -0.10 0.00 0.00 175.22 175.05 3fky n ASP 138 N 1.71 -2.60 0.25 1.36 9.92 0.23 -1.40 116.55 126.03 3fky n ASP 138 Ca -0.22 0.26 0.17 0.00 -0.53 0.00 0.00 54.79 54.48 3fky n ASP 138 Cb 0.56 -1.12 0.88 0.00 -0.64 0.00 0.00 41.12 40.79 3fky n ASP 138 CO 0.00 0.00 0.00 0.24 0.13 0.00 0.00 177.20 177.57 3fky h MET 139 N -1.54 0.00 -0.57 -1.24 2.86 -1.89 -2.42 114.93 110.13 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 1.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.95 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 1.28 -2.29 -0.22 4.01 -1.26 -4.95 117.16 111.02 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 0.10 -0.22 -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 0.89 -4.85 -4.63 7.72 8.00 -0.91 -5.00 116.55 117.77 3fky n ASP 141 Ca 0.24 -0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.44 3fky n ASP 141 Cb 0.83 -3.96 -0.09 0.00 -0.02 0.00 0.00 41.12 37.88 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 -2.28 4.70 0.19 -2.24 1.01 -1.26 -4.86 116.67 111.93 3fky s ASP 142 Ca 0.00 -0.30 -0.33 0.00 0.71 0.00 0.00 52.55 52.63 3fky s ASP 142 Cb 0.00 -1.01 -0.15 0.00 1.01 0.00 0.00 42.92 42.78 3fky s ASP 142 CO 0.00 0.16 1.33 0.52 0.21 0.00 0.00 175.17 177.39 3fky n VAL 143 N 0.52 0.69 -1.79 -1.27 0.31 -1.26 0.76 118.33 116.30 3fky n VAL 143 Ca -0.12 -0.17 -0.42 0.00 -0.01 0.00 0.00 64.34 63.62 3fky n VAL 143 Cb 0.53 -1.17 -0.03 0.00 -0.91 0.00 0.00 33.84 32.26 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 0.08 1.51 0.00 3.52 6.14 -0.54 -2.41 117.35 125.64 3fky s TYR 144 Ca 0.73 0.01 0.00 0.00 0.64 0.00 0.00 57.07 58.45 3fky s TYR 144 Cb -0.76 -4.08 0.00 0.00 0.42 0.00 0.00 41.96 37.53 3fky s TYR 144 CO 0.49 -4.57 0.00 0.41 0.64 0.00 0.00 175.55 172.52 3fky n GLY 145 N 4.72 1.10 3.77 8.97 0.00 -1.26 -4.76 105.19 117.72 3fky n GLY 145 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.19 3.22 0.11 1.61 0.52 -1.01 -4.94 118.94 115.25 3fky s TRP 146 Ca 0.00 1.59 -0.22 0.00 0.02 0.00 0.00 56.10 57.49 3fky s TRP 146 Cb 0.00 -3.35 -0.12 0.00 -1.15 0.00 0.00 33.47 28.84 3fky s TRP 146 CO 0.00 -1.07 0.46 -2.30 0.02 0.00 0.00 176.95 174.06 3fky n PRO 147 N 0.40 0.00 -2.05 4.98 -0.02 -1.26 -4.76 135.00 132.29 3fky n PRO 147 Ca 0.03 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.08 3fky n PRO 147 Cb 0.46 -0.79 -0.03 0.00 -0.02 0.00 0.00 33.50 33.13 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 -0.53 3.65 0.00 -0.52 1.02 -1.26 -1.87 119.74 120.23 3fky s LYS 148 Ca 0.49 1.64 0.00 0.00 0.02 0.00 0.00 55.97 58.12 3fky s LYS 148 Cb -0.71 -4.10 0.00 0.00 -0.52 0.00 0.00 37.83 32.50 3fky s LYS 148 CO 0.39 -1.47 0.00 0.41 -0.92 0.00 0.00 175.35 173.76 3fky n GLY 149 N 4.92 2.93 0.00 -3.33 0.00 -1.26 -4.93 105.19 103.52 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 -2.00 5.31 3.08 -0.02 0.00 -0.78 -5.18 105.19 105.60 3fky n GLY 150 Ca 0.00 -1.45 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 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 3.22 0.20 1.12 1.61 2.02 -1.26 -4.51 117.35 119.75 3fky s TYR 151 Ca 0.00 -0.47 -0.19 0.00 -0.37 0.00 0.00 57.07 56.04 3fky s TYR 151 Cb 0.00 -0.15 0.27 0.00 -0.40 0.00 0.00 41.96 41.68 3fky s TYR 151 CO 0.00 -0.30 1.09 -0.35 -1.57 0.00 0.00 175.55 174.41 3fky n PRO 152 N 1.08 -2.67 -0.54 -1.71 -0.04 -1.26 -4.69 135.00 125.17 3fky n PRO 152 Ca -0.21 -1.73 -0.29 0.00 -0.04 0.00 0.00 63.50 61.23 3fky n PRO 152 Cb 0.57 -1.51 0.23 0.00 -0.04 0.00 0.00 33.50 32.76 3fky n PRO 152 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fky n ALA 153 N -4.58 -2.68 -1.45 0.55 0.00 -1.26 -4.97 120.51 106.13 3fky n ALA 153 Ca -0.20 -1.07 -0.32 0.00 0.00 0.00 0.00 53.44 51.85 3fky n ALA 153 Cb 0.56 -1.98 0.06 0.00 0.00 0.00 0.00 19.45 18.09 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 -4.32 2.69 0.79 0.00 0.02 -1.26 -4.97 135.00 127.95 3fky s PRO 154 Ca 0.67 1.15 -0.15 0.00 0.02 0.00 0.00 61.00 62.69 3fky s PRO 154 Cb -0.24 -1.95 0.02 0.00 0.02 0.00 0.00 34.50 32.35 3fky s PRO 154 CO 0.64 -1.31 0.80 1.04 -0.33 0.00 0.00 177.00 177.84 3fky n GLN 155 N -3.02 0.20 0.00 5.54 6.02 -1.26 -4.51 117.38 120.35 3fky n GLN 155 Ca 0.09 0.12 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 3fky n GLN 155 Cb 0.53 -2.10 0.00 0.00 1.02 0.00 0.00 30.24 29.69 3fky n GLN 155 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3fky n GLY 156 N 1.18 3.11 0.44 1.08 0.00 -1.26 -4.95 105.19 104.78 3fky n GLY 156 Ca 0.11 -0.47 0.12 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.07 1.61 -0.04 -1.26 -4.25 135.00 132.57 3fky n PRO 157 Ca 0.00 -0.87 -0.14 0.00 -0.04 0.00 0.00 63.50 62.45 3fky n PRO 157 Cb 0.00 -1.43 -0.14 0.00 -0.04 0.00 0.00 33.50 31.89 3fky n PRO 157 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3fky n TYR 158 N 0.07 0.45 -1.67 0.54 4.01 -1.26 -4.48 117.16 114.82 3fky n TYR 158 Ca 0.18 0.13 -0.47 0.00 -0.16 0.00 0.00 57.90 57.57 3fky n TYR 158 Cb 0.30 -1.07 -0.04 0.00 -0.31 0.00 0.00 39.34 38.22 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 -3.10 2.33 -3.00 -0.72 9.36 -1.07 -0.81 117.16 120.15 3fky n TYR 159 Ca -0.33 -0.07 -0.20 0.00 3.32 0.00 0.00 57.90 60.62 3fky n TYR 159 Cb 1.07 -2.69 0.01 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 -2.52 1.81 -0.22 0.00 0.00 0.01 -4.93 107.32 101.48 3fky s GLY 161 Ca 0.26 0.56 -0.13 0.00 0.00 0.00 0.00 44.72 45.40 3fky s GLY 161 CO 0.32 0.95 0.54 0.54 0.00 0.00 0.00 173.10 175.45 3fky s VAL 162 N -2.59 -0.01 0.00 1.40 0.11 -1.26 -4.88 120.40 113.17 3fky s VAL 162 Ca 0.67 0.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.76 3fky s VAL 162 Cb -0.22 -0.79 0.00 0.00 -1.53 0.00 0.00 36.38 33.84 3fky s VAL 162 CO 0.55 0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.94 3fky n GLY 163 N 4.08 3.60 0.27 6.54 0.00 -1.26 -4.86 105.19 113.56 3fky n GLY 163 Ca -0.21 -1.70 0.06 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 0.98 -0.00 4.61 0.00 -2.01 0.02 119.26 122.86 3fky h ALA 164 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3fky h ALA 164 Cb 0.00 0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3fky h ALA 164 CO 0.00 -0.32 -0.29 0.41 0.00 0.00 0.00 179.25 179.05 3fky n GLY 165 N -1.35 -0.90 0.03 0.00 0.00 -1.26 -4.27 105.19 97.44 3fky n GLY 165 Ca 0.14 -0.35 0.12 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.00 0.11 -3.70 1.61 4.76 -0.01 -4.87 118.16 115.07 3fky n LYS 166 Ca 0.10 0.03 -0.14 0.00 -2.87 0.00 0.00 58.31 55.44 3fky n LYS 166 Cb 0.33 -1.57 -0.08 0.00 -1.84 0.00 0.00 35.03 31.86 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 -3.06 0.03 -0.09 -0.18 0.11 -1.24 -4.40 120.40 111.56 3fky s VAL 167 Ca 0.09 -0.21 0.03 0.00 -2.93 0.00 0.00 61.98 58.96 3fky s VAL 167 Cb 0.16 -0.70 0.01 0.00 -1.53 0.00 0.00 36.38 34.32 3fky s VAL 167 CO 0.69 -0.12 -0.18 -0.31 -3.33 0.00 0.00 175.10 171.85 3fky s TYR 168 N -0.75 2.07 -1.21 1.54 2.02 -1.26 -4.79 117.35 114.97 3fky s TYR 168 Ca -0.08 -0.88 -0.07 0.00 -0.37 0.00 0.00 57.07 55.67 3fky s TYR 168 Cb -0.03 -1.44 0.01 0.00 -0.40 0.00 0.00 41.96 40.09 3fky s TYR 168 CO 0.04 -0.40 0.90 0.00 -1.57 0.00 0.00 175.55 174.52 3fky n ALA 169 N 3.83 -1.06 -0.25 3.71 0.00 -1.26 -4.81 120.51 120.67 3fky n ALA 169 Ca -0.20 0.33 0.07 0.00 0.00 0.00 0.00 53.44 53.63 3fky n ALA 169 Cb 0.52 -4.50 0.31 0.00 0.00 0.00 0.00 19.45 15.78 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 -2.07 0.83 -0.97 0.00 2.43 -1.99 -1.23 114.38 111.37 3fky h ARG 170 Ca -0.48 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 58.66 3fky h ARG 170 Cb 1.32 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 30.63 3fky h ARG 170 CO 0.48 0.55 0.64 0.38 -1.51 0.00 0.00 179.97 180.51 3fky h ASP 171 N 0.85 1.08 -0.09 -3.80 2.03 -1.99 0.17 116.42 114.68 3fky h ASP 171 Ca 0.38 -0.02 -0.01 0.00 -0.73 0.00 0.00 57.03 56.65 3fky h ASP 171 Cb 0.34 -0.26 -0.00 0.00 -0.83 0.00 0.00 39.33 38.58 3fky h ASP 171 CO -0.15 0.76 0.01 -0.03 -1.03 0.00 0.00 179.24 178.80 3fky h MET 172 N 1.26 0.14 -0.84 4.15 4.05 -1.63 -1.02 114.93 121.05 3fky h MET 172 Ca 0.37 -0.04 0.11 0.00 -0.28 0.00 0.00 59.70 59.87 3fky h MET 172 Cb -0.06 -0.02 -0.08 0.00 -0.80 0.00 0.00 31.60 30.64 3fky h MET 172 CO -0.10 0.37 0.47 0.82 0.23 0.00 0.00 176.91 178.69 3fky h ILE 173 N -0.10 0.85 -0.42 1.77 5.03 -0.84 -1.51 117.51 122.28 3fky h ILE 173 Ca 0.03 -0.26 -0.11 0.00 -0.12 0.00 0.00 64.86 64.40 3fky h ILE 173 Cb 0.30 0.04 -0.01 0.00 -3.03 0.00 0.00 36.82 34.12 3fky h ILE 173 CO 0.00 0.14 -0.17 -0.33 -0.68 0.00 0.00 178.15 177.11 3fky h GLU 174 N 0.74 0.86 -0.57 2.37 4.39 -0.50 -2.21 114.58 119.67 3fky h GLU 174 Ca 0.42 -0.36 0.05 0.00 0.34 0.00 0.00 59.36 59.81 3fky h GLU 174 Cb 0.46 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.03 3fky h GLU 174 CO -0.28 1.00 0.30 0.00 -1.16 0.00 0.00 179.01 178.87 3fky h ALA 175 N 0.84 0.75 0.03 3.43 0.00 -0.32 -0.75 119.26 123.23 3fky h ALA 175 Ca 0.10 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.04 3fky h ALA 175 Cb 0.72 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3fky h ALA 175 CO 0.05 -0.04 -0.08 1.25 0.00 0.00 0.00 179.25 180.44 3fky h HIS 176 N 0.57 -0.19 -0.41 0.00 -0.00 -1.20 0.15 115.15 114.05 3fky h HIS 176 Ca 0.26 0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.71 3fky h HIS 176 Cb 0.16 0.08 -0.09 0.00 -0.00 0.00 0.00 27.41 27.56 3fky h HIS 176 CO -0.10 -0.12 -0.29 -0.92 -0.00 0.00 0.00 177.93 176.51 3fky h TYR 177 N -0.15 -0.78 -0.31 5.26 -0.00 -0.78 0.12 116.97 120.33 3fky h TYR 177 Ca 0.02 0.06 0.05 0.00 -0.00 0.00 0.00 58.73 58.85 3fky h TYR 177 Cb 0.17 0.41 -0.04 0.00 -0.00 0.00 0.00 36.73 37.26 3fky h TYR 177 CO -0.13 -0.36 0.04 0.00 -0.00 0.00 0.00 178.16 177.71 3fky h ARG 178 N -0.21 0.14 -0.14 1.82 -0.00 -0.87 -0.87 114.38 114.24 3fky h ARG 178 Ca 0.19 -0.01 0.05 0.00 -0.50 0.00 0.00 59.98 59.70 3fky h ARG 178 Cb 0.51 -0.03 -0.05 0.00 0.00 0.00 0.00 29.97 30.40 3fky h ARG 178 CO -0.53 0.09 -0.20 0.00 0.00 0.00 0.00 179.97 179.33 3fky h ALA 179 N 1.24 -0.14 -0.69 0.04 0.00 0.64 0.23 119.26 120.58 3fky h ALA 179 Ca 0.14 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.14 3fky h ALA 179 Cb 0.17 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 3fky h ALA 179 CO -0.21 -0.65 0.43 0.00 0.00 0.00 0.00 179.25 178.82 3fky h LEU 181 N 0.82 0.75 -0.82 0.00 3.38 -0.53 -1.07 115.31 117.84 3fky h LEU 181 Ca 0.29 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 3fky h LEU 181 Cb 0.06 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 3fky h LEU 181 CO -0.12 0.53 0.47 0.22 0.09 0.00 0.00 178.44 179.64 3fky h TYR 182 N 0.88 1.10 0.00 1.13 3.20 -0.18 -0.23 116.97 122.88 3fky h TYR 182 Ca 0.25 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.11 3fky h TYR 182 Cb -0.08 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 37.84 3fky h TYR 182 CO -0.03 0.75 0.00 0.00 -1.64 0.00 0.00 178.16 177.24 3fky n ALA 183 N -2.37 1.75 -1.05 1.82 0.00 -0.54 -4.70 120.51 115.42 3fky n ALA 183 Ca 0.08 0.01 -0.02 0.00 0.00 0.00 0.00 53.44 53.51 3fky n ALA 183 Cb 0.07 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.19 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 0.18 0.52 3.71 0.00 0.00 -0.10 -4.32 105.19 105.18 3fky n GLY 184 Ca 0.03 -0.85 -0.33 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.38 3.19 -1.40 0.99 1.43 -0.45 -4.88 118.68 117.17 3fky s LEU 185 Ca 0.00 2.31 -0.07 0.00 -1.03 0.00 0.00 54.13 55.34 3fky s LEU 185 Cb 0.00 -4.58 0.07 0.00 0.03 0.00 0.00 46.19 41.71 3fky s LEU 185 CO 0.00 -2.49 2.50 1.21 0.23 0.00 0.00 176.35 177.80 3fky n GLU 186 N -3.14 4.30 -2.81 1.70 4.07 -1.26 -4.66 120.64 118.83 3fky n GLU 186 Ca 0.13 -3.14 -0.43 0.00 -0.06 0.00 0.00 57.16 53.67 3fky n GLU 186 Cb 0.51 -2.70 -0.04 0.00 -0.06 0.00 0.00 31.44 29.15 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 -0.17 4.49 -0.18 6.31 2.07 -1.26 -0.13 121.20 132.32 3fky s ILE 187 Ca 0.57 0.86 0.17 0.00 -1.41 0.00 0.00 60.65 60.84 3fky s ILE 187 Cb 0.18 -4.42 0.03 0.00 0.13 0.00 0.00 42.46 38.38 3fky s ILE 187 CO -0.08 -0.78 1.25 0.77 -1.91 0.00 0.00 174.94 174.20 3fky h SER 188 N 8.96 0.00 0.00 4.50 4.64 -0.04 -3.48 113.55 128.13 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 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3fky h SER 188 CO 1.02 0.42 0.00 0.61 -0.87 0.00 0.00 176.83 178.01 3fky n GLY 189 N 1.25 0.43 3.10 -0.77 0.00 -1.20 -4.98 105.19 103.02 3fky n GLY 189 Ca -0.01 -0.99 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 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 0.14 -0.02 -0.61 2.07 -1.26 -0.90 121.20 118.61 3fky s ILE 190 Ca 0.00 -1.16 -0.30 0.00 -1.41 0.00 0.00 60.65 57.78 3fky s ILE 190 Cb 0.00 -0.91 0.07 0.00 0.13 0.00 0.00 42.46 41.75 3fky s ILE 190 CO 0.00 -0.64 0.67 0.54 -1.91 0.00 0.00 174.94 173.60 3fky s ASN 191 N -2.16 -0.64 0.06 4.50 4.22 -0.68 -5.00 114.94 115.23 3fky s ASN 191 Ca -0.04 0.62 -0.30 0.00 -2.14 0.00 0.00 52.86 51.00 3fky s ASN 191 Cb -0.01 0.55 -0.05 0.00 1.28 0.00 0.00 41.25 43.02 3fky s ASN 191 CO -0.05 -0.66 0.96 0.00 -2.04 0.00 0.00 177.10 175.31 3fky s ALA 192 N -1.53 3.22 0.83 3.54 0.00 -1.26 -1.59 121.76 124.96 3fky s ALA 192 Ca -0.09 0.54 -0.06 0.00 0.00 0.00 0.00 51.96 52.35 3fky s ALA 192 Cb -0.00 -3.29 0.15 0.00 0.00 0.00 0.00 23.12 19.98 3fky s ALA 192 CO 0.07 -0.11 0.94 0.39 0.00 0.00 0.00 175.76 177.05 3fky n GLU 193 N 3.26 -0.48 -0.03 0.00 -0.58 0.37 0.10 120.64 123.27 3fky n GLU 193 Ca 0.04 -1.95 -0.12 0.00 -0.42 0.00 0.00 57.16 54.70 3fky n GLU 193 Cb 0.50 -0.81 -0.07 0.00 -0.57 0.00 0.00 31.44 30.49 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 -1.06 1.26 -3.37 2.62 2.07 -1.86 -2.84 116.25 113.08 3fky h VAL 194 Ca -0.31 -0.84 -0.52 0.00 0.82 0.00 0.00 66.70 65.84 3fky h VAL 194 Cb 0.98 1.62 0.01 0.00 -1.52 0.00 0.00 31.29 32.38 3fky h VAL 194 CO 0.27 0.24 0.56 -0.32 0.02 0.00 0.00 177.57 178.33 3fky s MET 195 N -4.90 4.48 0.37 1.57 -2.45 -1.26 -4.06 119.30 113.05 3fky s MET 195 Ca -0.14 1.83 -0.27 0.00 -1.25 0.00 0.00 55.69 55.85 3fky s MET 195 Cb 0.05 -3.28 -0.11 0.00 1.25 0.00 0.00 34.83 32.73 3fky s MET 195 CO 0.70 -0.14 1.35 -2.30 1.05 0.00 0.00 175.02 175.68 3fky n PRO 196 N 3.05 2.26 -2.68 4.11 -0.02 -1.26 -1.85 135.00 138.61 3fky n PRO 196 Ca 0.06 0.80 -0.21 0.00 -2.02 0.00 0.00 63.50 62.13 3fky n PRO 196 Cb 0.45 -2.46 0.01 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 0.51 -5.66 -4.17 2.55 3.41 -1.26 -4.94 113.62 104.06 3fky n SER 197 Ca 0.04 -0.11 -0.30 0.00 -0.26 0.00 0.00 58.87 58.24 3fky n SER 197 Cb 0.38 -4.66 -0.17 0.00 -0.26 0.00 0.00 64.21 59.50 3fky n SER 197 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3fky s GLN 198 N -5.34 2.50 0.36 4.33 0.74 -0.77 -0.86 119.66 120.63 3fky s GLN 198 Ca 0.13 -0.75 0.04 0.00 0.05 0.00 0.00 55.36 54.83 3fky s GLN 198 Cb -0.06 -1.98 -0.05 0.00 1.10 0.00 0.00 33.01 32.02 3fky s GLN 198 CO 0.16 0.19 0.07 -1.58 -0.55 0.00 0.00 175.29 173.59 3fky s TRP 199 N 0.28 1.92 0.01 1.67 0.52 0.05 -0.48 118.94 122.92 3fky s TRP 199 Ca -0.13 -1.04 0.00 0.00 0.02 0.00 0.00 56.10 54.95 3fky s TRP 199 Cb -0.16 -1.28 -0.01 0.00 -1.15 0.00 0.00 33.47 30.87 3fky s TRP 199 CO 0.06 -0.05 -0.02 -2.00 0.02 0.00 0.00 176.95 174.96 3fky s GLU 200 N -3.84 0.18 0.04 4.98 2.12 -0.62 -0.74 118.70 120.83 3fky s GLU 200 Ca 0.31 -0.26 0.04 0.00 0.36 0.00 0.00 54.97 55.42 3fky s GLU 200 Cb 0.07 -0.04 -0.02 0.00 0.26 0.00 0.00 34.13 34.39 3fky s GLU 200 CO 0.14 0.00 -0.12 -0.59 -0.54 0.00 0.00 175.26 174.16 3fky s PHE 201 N -0.55 1.00 -0.08 5.30 -0.12 -0.24 -1.69 117.98 121.59 3fky s PHE 201 Ca -0.05 -0.39 0.02 0.00 -0.05 0.00 0.00 56.93 56.46 3fky s PHE 201 Cb -0.04 -0.59 -0.02 0.00 -0.63 0.00 0.00 43.02 41.74 3fky s PHE 201 CO -0.00 0.00 -0.14 -0.65 -0.05 0.00 0.00 175.22 174.38 3fky s GLN 202 N -1.30 2.85 -0.15 1.99 1.11 -0.08 -0.26 119.66 123.81 3fky s GLN 202 Ca -0.02 -0.69 0.01 0.00 0.01 0.00 0.00 55.36 54.67 3fky s GLN 202 Cb -0.08 -2.48 0.02 0.00 -1.01 0.00 0.00 33.01 29.46 3fky s GLN 202 CO 0.01 0.46 -0.19 0.08 0.01 0.00 0.00 175.29 175.67 3fky s VAL 203 N -0.31 1.89 0.00 1.09 1.01 -0.51 0.61 120.40 124.18 3fky s VAL 203 Ca 0.03 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.16 3fky s VAL 203 Cb -0.13 -1.71 0.00 0.00 0.00 0.00 0.00 36.38 34.54 3fky s VAL 203 CO 0.03 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.25 3fky n GLY 204 N 4.45 2.12 3.83 4.51 0.00 0.82 -1.44 105.19 119.47 3fky n GLY 204 Ca -0.20 -1.12 -0.34 0.00 0.00 0.00 0.00 46.02 44.36 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 4.17 0.20 1.61 0.02 -1.26 -4.41 135.00 133.33 3fky s PRO 205 Ca 0.00 0.85 0.09 0.00 0.02 0.00 0.00 61.00 61.96 3fky s PRO 205 Cb 0.00 -2.60 -0.04 0.00 0.02 0.00 0.00 34.50 31.88 3fky s PRO 205 CO 0.00 0.23 -0.19 0.00 -0.33 0.00 0.00 177.00 176.72 3fky s THR 207 N -2.23 5.09 0.00 0.00 2.01 -1.26 -1.53 115.64 117.72 3fky s THR 207 Ca 0.20 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.28 3fky s THR 207 Cb -0.05 -3.36 0.00 0.00 0.01 0.00 0.00 72.50 69.10 3fky s THR 207 CO 0.09 0.37 0.00 0.61 -0.69 0.00 0.00 174.62 175.00 3fky n GLY 208 N 4.18 1.62 0.20 4.40 0.00 -1.15 -1.26 105.19 113.18 3fky n GLY 208 Ca -0.16 0.52 0.06 0.00 0.00 0.00 0.00 46.02 46.44 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 1.00 -0.90 -0.61 1.08 -1.94 -3.09 117.51 113.06 3fky h ILE 209 Ca 0.00 -1.21 0.10 0.00 -0.39 0.00 0.00 64.86 63.37 3fky h ILE 209 Cb 0.00 1.70 -0.08 0.00 -3.07 0.00 0.00 36.82 35.37 3fky h ILE 209 CO 0.00 0.32 0.54 0.44 -0.69 0.00 0.00 178.15 178.76 3fky h ASP 210 N 0.00 0.78 0.00 1.72 3.32 -1.54 -1.54 116.42 119.16 3fky h ASP 210 Ca -0.00 0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.12 3fky h ASP 210 Cb 0.67 -0.11 -0.06 0.00 0.22 0.00 0.00 39.33 40.06 3fky h ASP 210 CO 0.04 0.43 -0.44 -0.03 -1.72 0.00 0.00 179.24 177.53 3fky h MET 211 N 0.88 -0.57 -0.11 3.56 4.05 -1.70 0.15 114.93 121.19 3fky h MET 211 Ca 0.44 0.04 0.04 0.00 -0.28 0.00 0.00 59.70 59.93 3fky h MET 211 Cb 0.41 0.13 -0.04 0.00 -0.80 0.00 0.00 31.60 31.29 3fky h MET 211 CO -0.25 -0.38 -0.15 0.78 0.23 0.00 0.00 176.91 177.14 3fky h GLY 212 N -0.59 -0.09 0.54 1.39 0.00 -1.55 -1.02 103.07 101.75 3fky h GLY 212 Ca 0.04 0.18 0.03 0.00 0.00 0.00 0.00 47.33 47.58 3fky h GLY 212 CO -0.32 -0.15 -0.19 -0.55 0.00 0.00 0.00 176.54 175.33 3fky h ASP 213 N -0.19 -0.56 -0.44 0.19 3.32 -0.88 -1.68 116.42 116.18 3fky h ASP 213 Ca 0.09 0.08 -0.08 0.00 0.02 0.00 0.00 57.03 57.14 3fky h ASP 213 Cb 0.31 0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 3fky h ASP 213 CO -0.22 -0.26 -0.03 1.56 -1.72 0.00 0.00 179.24 178.57 3fky h GLN 214 N -0.30 0.80 -0.41 3.56 4.20 -0.53 -1.61 115.11 120.81 3fky h GLN 214 Ca 0.06 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.50 3fky h GLN 214 Cb 0.38 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 3fky h GLN 214 CO -0.18 0.88 0.25 1.25 -0.67 0.00 0.00 178.83 180.36 3fky h LEU 215 N 0.64 0.50 -0.88 1.46 5.85 -1.08 0.19 115.31 121.98 3fky h LEU 215 Ca 0.12 -0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.86 3fky h LEU 215 Cb 0.54 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 3fky h LEU 215 CO 0.03 0.40 0.55 -0.50 -0.34 0.00 0.00 178.44 178.58 3fky h TRP 216 N 0.55 1.01 -0.35 1.25 4.06 -1.16 0.71 115.95 122.02 3fky h TRP 216 Ca 0.15 0.03 -0.06 0.00 2.06 0.00 0.00 58.89 61.06 3fky h TRP 216 Cb -0.00 -0.32 -0.01 0.00 -1.00 0.00 0.00 29.16 27.82 3fky h TRP 216 CO -0.03 0.50 -0.03 0.52 -3.56 0.00 0.00 178.44 175.84 3fky h MET 217 N 0.98 0.64 -0.75 0.49 2.86 -0.61 -0.88 114.93 117.65 3fky h MET 217 Ca 0.39 -0.22 0.09 0.00 -2.06 0.00 0.00 59.70 57.90 3fky h MET 217 Cb 0.21 -0.05 -0.07 0.00 0.06 0.00 0.00 31.60 31.75 3fky h MET 217 CO -0.19 0.77 0.41 0.00 1.06 0.00 0.00 176.91 178.96 3fky h ALA 218 N 0.85 1.05 -0.51 6.32 0.00 -0.09 0.20 119.26 127.08 3fky h ALA 218 Ca 0.10 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3fky h ALA 218 Cb 0.50 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3fky h ALA 218 CO 0.02 0.03 0.23 0.00 0.00 0.00 0.00 179.25 179.53 3fky h ARG 219 N 0.69 0.75 -0.13 0.00 3.08 -0.61 0.77 114.38 118.94 3fky h ARG 219 Ca 0.36 -0.12 0.05 0.00 0.07 0.00 0.00 59.98 60.34 3fky h ARG 219 Cb 0.34 -0.13 -0.06 0.00 0.08 0.00 0.00 29.97 30.21 3fky h ARG 219 CO -0.25 0.64 -0.23 -0.92 -1.07 0.00 0.00 179.97 178.15 3fky h TYR 220 N 0.69 -0.60 -0.87 3.04 5.03 0.34 -1.29 116.97 123.31 3fky h TYR 220 Ca 0.17 0.03 0.06 0.00 2.58 0.00 0.00 58.73 61.57 3fky h TYR 220 Cb 0.15 0.29 -0.06 0.00 1.55 0.00 0.00 36.73 38.66 3fky h TYR 220 CO -0.00 -0.31 0.57 0.74 -1.32 0.00 0.00 178.16 177.84 3fky h PHE 221 N -0.29 0.99 0.76 -3.82 0.04 -0.17 -0.30 116.94 114.15 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 0.44 -0.33 0.01 0.00 2.20 0.00 0.00 35.95 38.27 3fky h PHE 221 CO -0.33 0.53 -0.37 1.25 -0.60 0.00 0.00 178.31 178.79 3fky h LEU 222 N 0.98 -0.87 -0.67 1.54 5.85 -0.21 0.19 115.31 122.13 3fky h LEU 222 Ca 0.37 0.03 0.13 0.00 0.84 0.00 0.00 57.88 59.25 3fky h LEU 222 Cb 0.19 0.22 -0.13 0.00 0.37 0.00 0.00 40.66 41.32 3fky h LEU 222 CO -0.13 -0.53 -0.17 0.45 -0.34 0.00 0.00 178.44 177.72 3fky h HIS 223 N -1.21 -0.36 -0.22 1.25 3.86 -1.06 -1.06 115.15 116.35 3fky h HIS 223 Ca -0.10 0.06 -0.03 0.00 -1.16 0.00 0.00 60.37 59.14 3fky h HIS 223 Cb 0.78 0.26 -0.01 0.00 1.06 0.00 0.00 27.41 29.51 3fky h HIS 223 CO 0.01 -0.29 0.02 -0.09 0.86 0.00 0.00 177.93 178.44 3fky h ARG 224 N -0.00 0.38 -0.28 2.45 9.65 -0.98 -1.78 114.38 123.82 3fky h ARG 224 Ca 0.32 -0.11 -0.15 0.00 -1.10 0.00 0.00 59.98 58.94 3fky h ARG 224 Cb 0.49 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.02 3fky h ARG 224 CO -0.69 0.54 -0.42 -0.24 2.80 0.00 0.00 179.97 181.96 3fky h VAL 225 N 0.16 1.29 0.00 0.20 3.04 -0.75 -2.71 116.25 117.49 3fky h VAL 225 Ca 0.06 -1.60 -0.04 0.00 -1.01 0.00 0.00 66.70 64.11 3fky h VAL 225 Cb 0.36 1.53 -0.01 0.00 -2.01 0.00 0.00 31.29 31.16 3fky h VAL 225 CO 0.01 0.52 -0.19 0.00 -1.01 0.00 0.00 177.57 176.89 3fky h ALA 226 N 0.96 1.66 -0.89 3.17 0.00 -0.93 -0.79 119.26 122.43 3fky h ALA 226 Ca 0.04 -0.18 0.21 0.00 0.00 0.00 0.00 54.91 54.99 3fky h ALA 226 Cb 0.96 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.60 3fky h ALA 226 CO 0.09 0.24 0.40 0.93 0.00 0.00 0.00 179.25 180.91 3fky h GLU 227 N 0.00 0.41 0.00 0.00 5.08 -0.98 0.31 114.58 119.40 3fky h GLU 227 Ca -0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3fky h GLU 227 Cb 0.35 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3fky h GLU 227 CO 0.03 0.27 0.00 0.39 -1.00 0.00 0.00 179.01 178.70 3fky n GLU 228 N -5.02 0.15 -0.16 2.33 1.02 -0.30 -1.23 120.64 117.43 3fky n GLU 228 Ca 0.22 0.50 0.05 0.00 -0.02 0.00 0.00 57.16 57.90 3fky n GLU 228 Cb 0.63 -1.86 0.13 0.00 -0.02 0.00 0.00 31.44 30.31 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 -2.16 0.39 -2.29 -0.32 3.72 0.10 -4.96 117.46 111.94 3fky n PHE 229 Ca 0.01 -0.55 -0.20 0.00 -0.05 0.00 0.00 57.45 56.66 3fky n PHE 229 Cb 0.13 -0.07 -0.02 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 0.11 -0.18 3.65 1.37 0.00 -0.37 -4.97 105.19 104.80 3fky n GLY 230 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 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 4.90 0.10 -0.61 1.01 -0.74 -3.73 121.20 119.20 3fky s ILE 231 Ca 0.00 0.01 -0.22 0.00 0.00 0.00 0.00 60.65 60.44 3fky s ILE 231 Cb 0.00 -3.21 -0.07 0.00 0.01 0.00 0.00 42.46 39.19 3fky s ILE 231 CO 0.00 0.46 0.65 -0.54 0.00 0.00 0.00 174.94 175.51 3fky s LYS 232 N 0.36 4.35 -0.15 2.79 1.02 -0.49 -4.07 119.74 123.55 3fky s LYS 232 Ca 0.04 0.90 -0.06 0.00 0.02 0.00 0.00 55.97 56.87 3fky s LYS 232 Cb -0.12 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 33.90 3fky s LYS 232 CO -0.00 0.60 0.05 0.42 -0.92 0.00 0.00 175.35 175.49 3fky s ILE 233 N -1.06 4.70 -0.18 2.17 1.01 -1.26 -1.32 121.20 125.26 3fky s ILE 233 Ca 0.32 -0.08 -0.00 0.00 0.00 0.00 0.00 60.65 60.89 3fky s ILE 233 Cb -0.21 -3.08 0.01 0.00 0.01 0.00 0.00 42.46 39.20 3fky s ILE 233 CO 0.22 0.51 -0.16 -0.55 0.00 0.00 0.00 174.94 174.96 3fky s SER 234 N -0.05 3.45 -0.02 3.58 0.15 -0.19 -4.95 113.70 115.67 3fky s SER 234 Ca 0.06 -0.57 0.21 0.00 0.70 0.00 0.00 55.95 56.35 3fky s SER 234 Cb -0.12 -1.54 0.62 0.00 -1.71 0.00 0.00 66.02 63.26 3fky s SER 234 CO 0.01 0.01 1.51 0.49 1.20 0.00 0.00 173.24 176.47 3fky n PHE 235 N 4.54 0.99 -1.76 3.44 3.72 -1.26 -1.74 117.46 125.38 3fky n PHE 235 Ca -0.20 -0.47 -0.41 0.00 -0.05 0.00 0.00 57.45 56.31 3fky n PHE 235 Cb 0.51 -0.03 -0.00 0.00 -0.94 0.00 0.00 39.48 39.01 3fky n PHE 235 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 3fky n HIS 236 N 1.44 2.92 0.25 1.38 -0.00 -1.26 -2.46 115.22 117.49 3fky n HIS 236 Ca 0.23 0.43 0.14 0.00 0.46 0.00 0.00 57.72 58.98 3fky n HIS 236 Cb 0.62 -2.53 0.55 0.00 -0.12 0.00 0.00 29.99 28.51 3fky n HIS 236 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3fky h PRO 237 N 3.20 0.00 -1.81 1.57 0.11 -1.85 -3.36 132.00 129.85 3fky h PRO 237 Ca -0.50 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.17 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 0.66 0.09 -0.83 1.17 -0.21 0.00 0.00 178.00 178.88 3fky n LYS 238 N -3.21 0.37 -0.03 1.05 3.00 -1.26 0.51 118.16 118.59 3fky n LYS 238 Ca 0.01 -2.79 -0.03 0.00 -0.00 0.00 0.00 58.31 55.50 3fky n LYS 238 Cb 0.37 -1.55 0.20 0.00 0.00 0.00 0.00 35.03 34.06 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 0.59 -5.03 1.64 0.11 -1.84 -3.39 132.00 129.26 3fky h PRO 239 Ca 0.17 -0.18 -0.63 0.00 0.11 0.00 0.00 66.00 65.47 3fky h PRO 239 Cb 0.97 -0.06 -0.34 0.00 0.11 0.00 0.00 31.00 31.69 3fky h PRO 239 CO 0.28 0.71 -0.86 -0.51 -0.21 0.00 0.00 178.00 177.41 3fky s LEU 240 N -8.89 1.93 0.57 2.35 1.43 -1.26 -5.11 118.68 109.70 3fky s LEU 240 Ca -0.08 -0.49 -0.19 0.00 -1.03 0.00 0.00 54.13 52.34 3fky s LEU 240 Cb 0.14 -1.24 -0.04 0.00 0.03 0.00 0.00 46.19 45.08 3fky s LEU 240 CO 0.79 0.09 1.15 -0.54 0.23 0.00 0.00 176.35 178.07 3fky s LYS 241 N 0.64 3.15 0.00 1.70 1.02 -1.26 -4.57 119.74 120.42 3fky s LYS 241 Ca -0.13 1.65 0.00 0.00 0.02 0.00 0.00 55.97 57.51 3fky s LYS 241 Cb -0.16 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 35.17 3fky s LYS 241 CO 0.04 -1.02 0.00 0.41 -0.92 0.00 0.00 175.35 173.86 3fky n GLY 242 N 0.18 0.08 0.13 -3.33 0.00 -1.26 -4.60 105.19 96.40 3fky n GLY 242 Ca 0.12 -1.86 0.12 0.00 0.00 0.00 0.00 46.02 44.39 3fky n GLY 242 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fky n ASP 243 N 0.00 0.96 -4.73 1.61 9.92 -1.26 -4.92 116.55 118.13 3fky n ASP 243 Ca 0.00 -0.76 -0.42 0.00 -0.53 0.00 0.00 54.79 53.08 3fky n ASP 243 Cb 0.00 0.41 -0.02 0.00 -0.64 0.00 0.00 41.12 40.87 3fky n ASP 243 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 3fky n TRP 244 N -1.07 2.77 -1.61 1.24 7.02 -1.26 -4.89 117.44 119.65 3fky n TRP 244 Ca 0.07 0.17 -0.39 0.00 -1.02 0.00 0.00 57.50 56.33 3fky n TRP 244 Cb 0.36 -2.62 0.03 0.00 -2.42 0.00 0.00 31.31 26.66 3fky n TRP 244 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 3fky n ASN 245 N 2.96 0.95 -2.31 -0.99 4.13 -1.26 -4.86 115.26 113.88 3fky n ASN 245 Ca 0.12 0.91 -0.05 0.00 1.68 0.00 0.00 54.58 57.24 3fky n ASN 245 Cb 0.35 -1.37 0.03 0.00 -1.54 0.00 0.00 39.78 37.26 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 1.25 -1.23 2.89 7.41 0.00 -1.26 -4.68 105.19 109.56 3fky n GLY 246 Ca 0.11 -1.67 -0.27 0.00 0.00 0.00 0.00 46.02 44.20 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 -3.96 1.28 0.48 4.61 0.00 0.18 -4.93 121.76 119.41 3fky s ALA 247 Ca 0.12 -0.54 0.05 0.00 0.00 0.00 0.00 51.96 51.59 3fky s ALA 247 Cb -0.00 -0.93 -0.01 0.00 0.00 0.00 0.00 23.12 22.17 3fky s ALA 247 CO 0.08 -0.48 0.21 0.20 0.00 0.00 0.00 175.76 175.77 3fky s GLY 248 N 1.73 2.51 -0.43 0.00 0.00 -1.26 -0.97 107.32 108.89 3fky s GLY 248 Ca 0.04 -1.44 0.09 0.00 0.00 0.00 0.00 44.72 43.41 3fky s GLY 248 CO -0.08 -1.99 0.66 0.00 0.00 0.00 0.00 173.10 171.69 3fky n HIS 250 N 0.79 1.65 -3.14 0.00 8.25 -1.19 -4.56 115.22 117.02 3fky n HIS 250 Ca 0.24 0.67 -0.40 0.00 -0.26 0.00 0.00 57.72 57.97 3fky n HIS 250 Cb 0.55 -2.38 -0.07 0.00 1.12 0.00 0.00 29.99 29.21 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 4.93 3.60 -0.09 -1.41 0.00 -0.70 -1.42 121.76 126.68 3fky s ALA 251 Ca 1.08 -0.49 -0.13 0.00 0.00 0.00 0.00 51.96 52.42 3fky s ALA 251 Cb -1.24 -3.00 -0.05 0.00 0.00 0.00 0.00 23.12 18.84 3fky s ALA 251 CO 0.66 -0.80 0.32 -0.80 0.00 0.00 0.00 175.76 175.13 3fky s ASN 252 N 1.50 6.58 0.02 0.00 0.01 0.25 -0.37 114.94 122.94 3fky s ASN 252 Ca 0.25 0.69 0.03 0.00 -0.71 0.00 0.00 52.86 53.12 3fky s ASN 252 Cb -0.15 -2.19 -0.02 0.00 0.41 0.00 0.00 41.25 39.29 3fky s ASN 252 CO 0.09 0.23 -0.10 -0.69 -1.51 0.00 0.00 177.10 175.12 3fky s VAL 253 N -0.36 0.79 -0.20 1.60 1.01 -0.10 -1.48 120.40 121.66 3fky s VAL 253 Ca 0.20 -0.77 -0.27 0.00 0.00 0.00 0.00 61.98 61.13 3fky s VAL 253 Cb -0.14 -0.73 0.09 0.00 0.00 0.00 0.00 36.38 35.59 3fky s VAL 253 CO 0.08 -0.03 0.82 -0.94 0.00 0.00 0.00 175.10 175.03 3fky s SER 254 N -0.90 -0.60 0.37 3.32 1.04 -0.85 -1.60 113.70 114.49 3fky s SER 254 Ca -0.01 0.97 0.08 0.00 0.48 0.00 0.00 55.95 57.47 3fky s SER 254 Cb -0.07 0.91 -0.03 0.00 0.10 0.00 0.00 66.02 66.93 3fky s SER 254 CO 0.01 -0.34 0.24 0.42 0.98 0.00 0.00 173.24 174.55 3fky s THR 255 N -0.30 2.98 0.26 2.02 -4.23 -1.26 0.35 115.64 115.45 3fky s THR 255 Ca -0.03 -1.53 -0.01 0.00 -1.18 0.00 0.00 61.69 58.94 3fky s THR 255 Cb -0.03 -3.04 0.24 0.00 1.34 0.00 0.00 72.50 71.01 3fky s THR 255 CO 0.02 -0.11 1.73 0.50 -0.54 0.00 0.00 174.62 176.21 3fky h LYS 256 N 1.33 0.46 -0.40 3.99 3.64 -0.90 -1.52 116.57 123.17 3fky h LYS 256 Ca -0.43 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 58.94 3fky h LYS 256 Cb 1.26 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 3fky h LYS 256 CO 0.61 0.31 0.23 0.93 -2.27 0.00 0.00 179.45 179.26 3fky h GLU 257 N 0.48 0.46 0.00 1.90 5.08 -1.92 -1.75 114.58 118.83 3fky h GLU 257 Ca 0.47 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.79 3fky h GLU 257 Cb 0.75 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.90 3fky h GLU 257 CO -0.43 0.30 -0.06 0.52 -1.00 0.00 0.00 179.01 178.34 3fky h MET 258 N 0.47 0.00 0.00 2.33 2.86 -1.56 -2.67 114.93 116.36 3fky h MET 258 Ca 0.16 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.78 3fky h MET 258 Cb 0.01 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.67 3fky h MET 258 CO -0.08 0.06 -0.59 0.00 1.06 0.00 0.00 176.91 177.36 3fky h ARG 259 N 0.00 0.00 -6.10 1.72 3.08 -0.89 0.62 114.38 112.81 3fky h ARG 259 Ca -0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 3fky h ARG 259 Cb 0.14 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 3fky h ARG 259 CO 0.01 0.06 -0.30 -0.65 -1.07 0.00 0.00 179.97 178.01 3fky s GLN 260 N -3.24 3.66 0.37 0.04 -0.21 -1.01 -4.61 119.66 114.66 3fky s GLN 260 Ca 0.03 0.01 -0.23 0.00 0.02 0.00 0.00 55.36 55.19 3fky s GLN 260 Cb 0.08 -2.94 -0.15 0.00 1.00 0.00 0.00 33.01 30.99 3fky s GLN 260 CO 0.74 0.53 0.31 -2.30 -2.12 0.00 0.00 175.29 172.46 3fky n PRO 261 N 0.58 0.19 -1.38 2.91 -0.02 -1.26 -2.30 135.00 133.72 3fky n PRO 261 Ca -0.06 0.07 -0.02 0.00 -2.02 0.00 0.00 63.50 61.47 3fky n PRO 261 Cb 0.52 -1.16 -0.01 0.00 -0.02 0.00 0.00 33.50 32.83 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 2.10 0.46 0.16 -1.23 0.00 -1.21 -4.97 105.19 100.50 3fky n GLY 262 Ca 0.12 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 45.08 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 0.50 1.55 -0.02 0.00 -0.37 -3.23 103.07 101.50 3fky h GLY 263 Ca -0.05 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.70 3fky h GLY 263 CO 0.07 0.52 0.13 2.41 0.00 0.00 0.00 176.54 179.67 3fky n THR 264 N -4.41 1.28 0.24 4.70 -1.04 -0.25 0.85 114.28 115.66 3fky n THR 264 Ca -0.06 0.59 -0.11 0.00 -2.04 0.00 0.00 64.05 62.43 3fky n THR 264 Cb 0.46 -1.59 -0.05 0.00 -1.82 0.00 0.00 70.33 67.33 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 -0.63 0.00 -2.82 3.64 -1.83 0.11 116.57 115.04 3fky h LYS 265 Ca 0.00 0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.34 3fky h LYS 265 Cb 0.26 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 3fky h LYS 265 CO 0.00 -0.42 -0.39 1.88 -2.27 0.00 0.00 179.45 178.25 3fky h TYR 266 N -0.66 0.00 0.22 1.91 0.05 0.25 -0.85 116.97 117.89 3fky h TYR 266 Ca -0.06 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.72 3fky h TYR 266 Cb 0.52 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.26 3fky h TYR 266 CO -0.00 0.39 -0.15 0.82 -1.05 0.00 0.00 178.16 178.17 3fky h ILE 267 N 0.00 0.68 -0.97 -2.88 2.04 -1.34 -0.06 117.51 114.99 3fky h ILE 267 Ca -0.00 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.88 3fky h ILE 267 Cb 0.76 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 37.47 3fky h ILE 267 CO 0.05 0.00 0.64 -0.33 0.00 0.00 0.00 178.15 178.51 3fky h GLU 268 N -0.36 1.23 -0.05 2.37 5.08 -0.51 -0.16 114.58 122.17 3fky h GLU 268 Ca -0.02 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3fky h GLU 268 Cb 0.31 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3fky h GLU 268 CO 0.01 0.81 -0.01 1.96 -1.00 0.00 0.00 179.01 180.78 3fky h GLN 269 N 1.26 -0.00 -0.39 2.33 4.20 -0.95 -1.79 115.11 119.77 3fky h GLN 269 Ca 0.38 0.00 0.03 0.00 0.06 0.00 0.00 58.65 59.12 3fky h GLN 269 Cb -0.05 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.69 3fky h GLN 269 CO -0.10 -0.00 0.18 0.00 -0.67 0.00 0.00 178.83 178.24 3fky h ALA 270 N 1.05 0.48 -0.83 3.87 0.00 -0.50 -1.57 119.26 121.75 3fky h ALA 270 Ca 0.02 0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.06 3fky h ALA 270 Cb 0.04 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 3fky h ALA 270 CO -0.05 -0.19 0.54 0.82 0.00 0.00 0.00 179.25 180.37 3fky h ILE 271 N 0.37 0.94 -0.12 0.00 2.04 -0.74 0.87 117.51 120.87 3fky h ILE 271 Ca 0.17 -0.26 -0.09 0.00 1.00 0.00 0.00 64.86 65.67 3fky h ILE 271 Cb 0.10 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 3fky h ILE 271 CO -0.13 0.14 -0.29 -0.08 0.00 0.00 0.00 178.15 177.79 3fky h GLU 272 N 0.77 0.41 -0.75 2.37 4.81 -0.61 -1.18 114.58 120.39 3fky h GLU 272 Ca 0.39 -0.28 0.08 0.00 -0.13 0.00 0.00 59.36 59.42 3fky h GLU 272 Cb 0.46 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.82 3fky h GLU 272 CO -0.16 0.89 0.42 0.87 -0.73 0.00 0.00 179.01 180.30 3fky h LYS 273 N -0.01 0.72 -0.78 1.92 1.57 -0.53 -1.04 116.57 118.42 3fky h LYS 273 Ca -0.00 -0.04 0.05 0.00 -1.87 0.00 0.00 60.65 58.79 3fky h LYS 273 Cb 0.89 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.99 3fky h LYS 273 CO 0.06 0.47 0.51 -0.07 -0.57 0.00 0.00 179.45 179.86 3fky h LEU 274 N 0.74 0.77 -1.58 2.94 3.38 -0.64 -1.14 115.31 119.78 3fky h LEU 274 Ca 0.35 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.28 3fky h LEU 274 Cb 0.28 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3fky h LEU 274 CO -0.22 0.51 -0.20 0.77 0.09 0.00 0.00 178.44 179.39 3fky h SER 275 N 0.88 0.00 1.90 -0.43 4.64 0.08 -1.97 113.55 118.65 3fky h SER 275 Ca 0.32 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.63 3fky h SER 275 Cb 0.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3fky h SER 275 CO -0.11 0.20 -0.10 0.11 -0.87 0.00 0.00 176.83 176.06 3fky h LYS 276 N 0.00 0.00 -0.26 4.77 6.56 -0.91 -3.33 116.57 123.40 3fky h LYS 276 Ca -0.00 0.00 -0.16 0.00 -1.06 0.00 0.00 60.65 59.43 3fky h LYS 276 Cb 0.50 0.00 -0.10 0.00 -0.57 0.00 0.00 32.23 32.06 3fky h LYS 276 CO 0.03 0.09 -0.32 0.54 -2.06 0.00 0.00 179.45 177.72 3fky n ARG 277 N -3.12 1.95 -0.23 3.15 1.74 -0.76 -4.75 116.66 114.63 3fky n ARG 277 Ca 0.04 -3.36 -0.03 0.00 -0.77 0.00 0.00 57.85 53.73 3fky n ARG 277 Cb 0.57 -1.80 0.08 0.00 -1.02 0.00 0.00 32.46 30.29 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 1.15 0.73 -0.36 -1.55 2.76 -1.61 -2.09 115.15 114.20 3fky h HIS 278 Ca 0.16 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.30 3fky h HIS 278 Cb 1.35 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 30.06 3fky h HIS 278 CO 0.92 0.39 0.02 0.00 -1.30 0.00 0.00 177.93 177.96 3fky h ALA 279 N 1.32 0.48 -0.73 5.26 0.00 -1.90 -0.78 119.26 122.89 3fky h ALA 279 Ca 0.28 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3fky h ALA 279 Cb 0.10 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3fky h ALA 279 CO -0.14 0.22 0.35 0.93 0.00 0.00 0.00 179.25 180.61 3fky h GLU 280 N 0.44 1.05 0.46 0.00 3.07 -1.85 -0.93 114.58 116.82 3fky h GLU 280 Ca 0.10 -0.15 -0.02 0.00 -0.50 0.00 0.00 59.36 58.79 3fky h GLU 280 Cb 0.42 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 3fky h GLU 280 CO 0.01 0.81 -0.22 0.45 -1.40 0.00 0.00 179.01 178.67 3fky h HIS 281 N 1.04 -0.58 -1.03 4.33 3.86 -1.27 -3.14 115.15 118.37 3fky h HIS 281 Ca 0.25 -0.01 0.32 0.00 -1.16 0.00 0.00 60.37 59.77 3fky h HIS 281 Cb 0.12 0.19 -0.14 0.00 1.06 0.00 0.00 27.41 28.63 3fky h HIS 281 CO 0.01 -0.25 0.60 0.82 0.86 0.00 0.00 177.93 179.97 3fky h ILE 282 N -0.98 0.32 -0.67 2.45 1.08 -0.90 0.22 117.51 119.03 3fky h ILE 282 Ca -0.06 -0.11 0.02 0.00 -0.39 0.00 0.00 64.86 64.32 3fky h ILE 282 Cb 0.58 -0.04 -0.04 0.00 -3.07 0.00 0.00 36.82 34.26 3fky h ILE 282 CO 0.10 0.06 0.44 0.50 -0.69 0.00 0.00 178.15 178.57 3fky h LYS 283 N 0.33 0.82 0.00 2.37 3.64 -1.12 -3.35 116.57 119.26 3fky h LYS 283 Ca 0.73 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 60.06 3fky h LYS 283 Cb 1.71 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.34 3fky h LYS 283 CO -0.56 0.54 0.00 1.28 -2.27 0.00 0.00 179.45 178.44 3fky n LEU 284 N -4.45 0.00 0.00 5.20 4.77 0.77 -4.65 117.00 118.64 3fky n LEU 284 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3fky n LEU 284 Cb 0.09 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3fky n LEU 284 CO 0.35 0.00 0.00 -1.22 -1.33 0.00 0.00 177.39 175.19 3fky n TYR 285 N 0.00 0.00 0.00 -1.77 0.53 -1.12 -4.57 117.16 110.23 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 -0.42 0.00 0.00 -1.03 0.00 0.00 39.34 37.89 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 0.42 2.76 3.84 2.72 0.00 -1.26 -1.15 105.19 112.52 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 6.32 -0.97 1.61 1.04 -1.26 -3.24 113.70 117.20 3fky s SER 287 Ca 0.00 1.59 -0.12 0.00 0.48 0.00 0.00 55.95 57.89 3fky s SER 287 Cb 0.00 -2.50 0.12 0.00 0.10 0.00 0.00 66.02 63.74 3fky s SER 287 CO 0.00 -0.80 0.30 -0.90 0.98 0.00 0.00 173.24 172.82 3fky n ASP 288 N -1.99 -0.92 0.20 7.02 5.68 -1.26 -4.72 116.55 120.56 3fky n ASP 288 Ca 0.07 -0.64 0.15 0.00 -0.50 0.00 0.00 54.79 53.86 3fky n ASP 288 Cb 0.54 -0.82 0.61 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 -0.45 0.00 -0.04 -1.12 -1.24 -1.89 -2.63 115.58 108.21 3fky h ASN 289 Ca -0.31 0.00 0.01 0.00 0.71 0.00 0.00 56.30 56.71 3fky h ASN 289 Cb 0.72 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.76 3fky h ASN 289 CO 0.46 0.00 0.04 -2.24 -1.29 0.00 0.00 177.43 174.40 3fky h ASP 290 N 0.00 0.00 -0.20 1.15 -0.00 -1.85 0.20 116.42 115.71 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 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.72 3fky h ASP 290 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 179.24 180.39 3fky n MET 291 N -3.97 1.99 0.00 4.15 0.00 -0.99 -5.01 117.12 113.29 3fky n MET 291 Ca -0.02 -0.94 0.00 0.00 0.00 0.00 0.00 57.70 56.74 3fky n MET 291 Cb 0.13 -1.55 0.00 0.00 0.00 0.00 0.00 33.22 31.80 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 0.19 0.37 -3.06 3.17 0.63 0.68 -4.77 116.66 113.88 3fky n ARG 292 Ca 0.08 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.62 3fky n ARG 292 Cb 0.43 -0.71 -0.05 0.00 0.45 0.00 0.00 32.46 32.57 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 -3.06 7.16 0.35 6.15 0.15 -1.26 -5.02 113.70 118.17 3fky s SER 301 Ca 0.00 1.39 0.16 0.00 0.70 0.00 0.00 55.95 58.20 3fky s SER 301 Cb 0.00 -2.44 0.63 0.00 -1.71 0.00 0.00 66.02 62.51 3fky s SER 301 CO 0.00 0.08 1.73 0.24 1.20 0.00 0.00 173.24 176.49 3fky h MET 302 N 5.40 0.00 0.00 5.44 2.86 -1.94 -3.23 114.93 123.46 3fky h MET 302 Ca -0.45 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.04 3fky h MET 302 Cb 1.20 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.84 3fky h MET 302 CO 0.69 0.43 -1.83 0.25 1.06 0.00 0.00 176.91 177.51 3fky n THR 303 N -3.68 0.57 -3.24 2.22 -2.24 -1.26 -4.96 114.28 101.68 3fky n THR 303 Ca -0.01 -0.48 -0.39 0.00 -2.27 0.00 0.00 64.05 60.90 3fky n THR 303 Cb 0.51 -0.32 -0.06 0.00 -2.10 0.00 0.00 70.33 68.36 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 -2.61 3.54 -0.15 6.98 0.00 -1.22 -5.02 121.76 123.29 3fky s ALA 304 Ca -0.06 0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.92 3fky s ALA 304 Cb 0.06 -2.69 -0.02 0.00 0.00 0.00 0.00 23.12 20.48 3fky s ALA 304 CO 0.58 0.28 -0.10 0.12 0.00 0.00 0.00 175.76 176.64 3fky s PHE 305 N -0.64 2.88 0.09 0.00 5.36 -1.26 -4.63 117.98 119.79 3fky s PHE 305 Ca 0.30 -0.59 -0.05 0.00 -0.96 0.00 0.00 56.93 55.63 3fky s PHE 305 Cb -0.19 -1.90 -0.02 0.00 -0.34 0.00 0.00 43.02 40.57 3fky s PHE 305 CO 0.18 -0.20 0.11 -1.54 -1.46 0.00 0.00 175.22 172.31 3fky s SER 306 N 0.47 0.26 0.06 6.13 1.04 -1.26 -4.97 113.70 115.42 3fky s SER 306 Ca -0.07 -0.89 -0.11 0.00 0.48 0.00 0.00 55.95 55.35 3fky s SER 306 Cb -0.15 0.30 0.01 0.00 0.10 0.00 0.00 66.02 66.28 3fky s SER 306 CO 0.04 -0.71 0.25 -0.94 0.98 0.00 0.00 173.24 172.86 3fky s SER 307 N -2.93 -0.03 0.00 7.02 1.04 -1.26 -0.33 113.70 117.22 3fky s SER 307 Ca 0.11 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.18 3fky s SER 307 Cb 0.06 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.52 3fky s SER 307 CO -0.07 -0.63 0.00 0.61 0.98 0.00 0.00 173.24 174.13 3fky n GLY 308 N 0.44 0.80 3.77 7.32 0.00 -1.06 -5.00 105.19 111.47 3fky n GLY 308 Ca -0.18 -0.62 -0.37 0.00 0.00 0.00 0.00 46.02 44.85 3fky n GLY 308 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fky s VAL 309 N -2.00 3.13 -0.54 1.61 1.01 -1.26 -1.90 120.40 120.45 3fky s VAL 309 Ca 0.00 0.85 -0.06 0.00 0.00 0.00 0.00 61.98 62.77 3fky s VAL 309 Cb 0.00 -3.43 0.01 0.00 0.00 0.00 0.00 36.38 32.96 3fky s VAL 309 CO 0.00 -0.01 0.44 0.00 0.00 0.00 0.00 175.10 175.54 3fky n ALA 310 N -0.44 -2.22 -3.39 5.51 0.00 0.80 -4.84 120.51 115.93 3fky n ALA 310 Ca 0.07 -0.10 -0.20 0.00 0.00 0.00 0.00 53.44 53.21 3fky n ALA 310 Cb 0.48 -0.74 -0.09 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 -2.34 1.66 0.00 0.00 3.84 -1.26 -4.96 114.94 111.88 3fky s ASN 311 Ca 0.06 -1.72 0.07 0.00 0.21 0.00 0.00 52.86 51.49 3fky s ASN 311 Cb -0.01 0.31 0.45 0.00 -0.55 0.00 0.00 41.25 41.45 3fky s ASN 311 CO 0.64 -0.28 1.09 0.54 -2.79 0.00 0.00 177.10 176.30 3fky n ARG 312 N 4.22 0.76 -0.01 0.43 1.74 -1.26 -2.45 116.66 120.09 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 0.43 -1.15 -0.14 0.00 -1.02 0.00 0.00 32.46 30.57 3fky n ARG 312 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fky n GLY 313 N 0.34 -0.87 3.92 -0.13 0.00 -1.26 -5.02 105.19 102.17 3fky n GLY 313 Ca 0.06 -0.47 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 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 -4.01 4.78 0.06 1.61 1.04 -1.03 -4.74 113.70 111.41 3fky s SER 314 Ca -0.05 0.53 -0.16 0.00 0.48 0.00 0.00 55.95 56.74 3fky s SER 314 Cb 0.13 -1.16 -0.17 0.00 0.10 0.00 0.00 66.02 64.93 3fky s SER 314 CO 0.80 -1.64 1.27 0.28 0.98 0.00 0.00 173.24 174.93 3fky h SER 315 N -0.68 0.71 -3.86 7.02 0.02 -1.00 -3.44 113.55 112.32 3fky h SER 315 Ca -0.45 -0.62 -0.65 0.00 -0.84 0.00 0.00 61.79 59.23 3fky h SER 315 Cb 1.32 -0.21 -0.32 0.00 0.14 0.00 0.00 62.40 63.33 3fky h SER 315 CO 0.61 1.21 -0.87 -0.63 -1.14 0.00 0.00 176.83 176.02 3fky s ILE 316 N -3.76 1.86 -0.10 3.27 -1.09 -0.78 -1.27 121.20 119.32 3fky s ILE 316 Ca -0.12 -0.95 0.03 0.00 -2.23 0.00 0.00 60.65 57.38 3fky s ILE 316 Cb 0.07 -1.59 0.01 0.00 -1.58 0.00 0.00 42.46 39.36 3fky s ILE 316 CO 0.85 0.52 -0.20 -0.60 -1.23 0.00 0.00 174.94 174.27 3fky s ARG 317 N -0.01 2.70 -0.31 2.79 3.52 0.39 -2.55 118.95 125.47 3fky s ARG 317 Ca -0.06 -0.75 -0.15 0.00 -0.13 0.00 0.00 55.73 54.63 3fky s ARG 317 Cb -0.14 -2.12 -0.02 0.00 -1.56 0.00 0.00 34.95 31.11 3fky s ARG 317 CO 0.04 0.08 0.39 0.42 -0.81 0.00 0.00 175.30 175.42 3fky s ILE 318 N 0.58 5.15 0.24 4.11 1.01 -0.80 -0.82 121.20 130.67 3fky s ILE 318 Ca -0.14 0.31 -0.31 0.00 0.00 0.00 0.00 60.65 60.51 3fky s ILE 318 Cb -0.17 -3.79 -0.13 0.00 0.01 0.00 0.00 42.46 38.38 3fky s ILE 318 CO 0.05 -0.00 1.46 -2.65 0.00 0.00 0.00 174.94 173.79 3fky n PRO 319 N 5.41 2.17 -0.31 2.79 -0.02 -1.26 -0.14 135.00 143.63 3fky n PRO 319 Ca -0.08 0.77 0.09 0.00 -2.02 0.00 0.00 63.50 62.26 3fky n PRO 319 Cb 0.50 -2.47 0.26 0.00 -0.02 0.00 0.00 33.50 31.77 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 4.54 0.65 -0.27 -0.52 2.43 -1.95 0.22 114.38 119.49 3fky h ARG 320 Ca -0.45 -0.04 0.06 0.00 -0.81 0.00 0.00 59.98 58.74 3fky h ARG 320 Cb 1.26 -0.15 -0.08 0.00 -0.42 0.00 0.00 29.97 30.59 3fky h ARG 320 CO 0.78 0.43 -0.35 0.77 -1.51 0.00 0.00 179.97 180.09 3fky h SER 321 N 0.67 -1.14 -0.07 -3.80 0.02 -1.99 0.13 113.55 107.37 3fky h SER 321 Ca 0.50 0.18 0.03 0.00 -0.84 0.00 0.00 61.79 61.66 3fky h SER 321 Cb 0.73 0.50 -0.04 0.00 0.14 0.00 0.00 62.40 63.74 3fky h SER 321 CO -0.37 -0.36 -0.14 0.58 -1.14 0.00 0.00 176.83 175.40 3fky h VAL 322 N -0.35 0.64 -0.10 2.27 2.07 -1.26 -1.95 116.25 117.57 3fky h VAL 322 Ca 0.13 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.69 3fky h VAL 322 Cb 0.56 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.91 3fky h VAL 322 CO -0.46 0.00 -0.33 0.00 0.02 0.00 0.00 177.57 176.81 3fky h ALA 323 N 0.81 -0.40 -0.59 1.67 0.00 -0.77 0.93 119.26 120.90 3fky h ALA 323 Ca 0.07 0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.11 3fky h ALA 323 Cb 0.30 0.61 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 3fky h ALA 323 CO -0.18 -0.81 0.40 1.57 0.00 0.00 0.00 179.25 180.23 3fky h LYS 324 N -0.42 0.31 -0.00 0.00 2.10 -0.49 -2.59 116.57 115.49 3fky h LYS 324 Ca 0.09 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.72 3fky h LYS 324 Cb 0.55 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.81 3fky h LYS 324 CO -0.34 0.21 -0.81 0.39 -2.00 0.00 0.00 179.45 176.90 3fky n GLU 325 N -4.46 0.06 -0.91 0.07 1.02 -0.69 -4.98 120.64 110.75 3fky n GLU 325 Ca 0.10 -0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 3fky n GLU 325 Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 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 1.49 0.90 3.45 0.62 0.00 0.24 -4.85 105.19 107.03 3fky n GLY 326 Ca 0.05 0.00 -0.11 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 -3.56 -0.31 0.00 1.61 1.13 -1.21 -0.51 117.35 114.50 3fky s TYR 327 Ca 0.00 0.02 0.00 0.00 -1.41 0.00 0.00 57.07 55.68 3fky s TYR 327 Cb 0.00 0.45 0.00 0.00 -1.10 0.00 0.00 41.96 41.31 3fky s TYR 327 CO 0.00 -0.86 0.00 0.41 -2.51 0.00 0.00 175.55 172.59 3fky n GLY 328 N -0.33 0.11 3.42 5.49 0.00 0.21 -4.60 105.19 109.48 3fky n GLY 328 Ca -0.14 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 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 0.82 0.22 1.61 -0.85 -1.26 -3.99 117.35 113.89 3fky s TYR 329 Ca 0.00 -1.09 0.10 0.00 -0.52 0.00 0.00 57.07 55.56 3fky s TYR 329 Cb 0.00 -0.16 -0.05 0.00 0.38 0.00 0.00 41.96 42.13 3fky s TYR 329 CO 0.00 -0.88 -0.19 -0.59 -1.52 0.00 0.00 175.55 172.37 3fky s PHE 330 N -3.89 2.04 -0.33 -3.49 -0.12 -0.63 -4.53 117.98 107.03 3fky s PHE 330 Ca 0.30 -0.43 -0.07 0.00 -0.05 0.00 0.00 56.93 56.69 3fky s PHE 330 Cb 0.02 -0.95 0.03 0.00 -0.63 0.00 0.00 43.02 41.49 3fky s PHE 330 CO 0.13 0.49 0.11 -2.00 -0.05 0.00 0.00 175.22 173.90 3fky s GLU 331 N -3.19 2.74 -0.52 1.99 2.12 0.00 -0.93 118.70 120.91 3fky s GLU 331 Ca 0.23 -1.10 -0.25 0.00 0.36 0.00 0.00 54.97 54.20 3fky s GLU 331 Cb -0.05 -3.47 0.03 0.00 0.26 0.00 0.00 34.13 30.91 3fky s GLU 331 CO 0.10 -0.62 0.98 0.34 -0.54 0.00 0.00 175.26 175.51 3fky s ASP 332 N 1.44 6.42 0.00 -1.70 -1.08 0.51 -0.46 116.67 121.79 3fky s ASP 332 Ca -0.00 -0.10 0.19 0.00 -0.52 0.00 0.00 52.55 52.12 3fky s ASP 332 Cb -0.19 -2.46 0.71 0.00 -1.46 0.00 0.00 42.92 39.52 3fky s ASP 332 CO 0.03 -1.20 1.52 0.54 0.52 0.00 0.00 175.17 176.57 3fky n ARG 333 N 7.52 1.69 0.07 4.34 1.74 -0.40 -1.72 116.66 129.90 3fky n ARG 333 Ca 0.05 -1.04 -0.21 0.00 -0.77 0.00 0.00 57.85 55.87 3fky n ARG 333 Cb 0.48 -1.37 -0.12 0.00 -1.02 0.00 0.00 32.46 30.43 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 2.03 0.63 -6.87 5.56 3.08 -1.90 -3.45 114.38 113.46 3fky h ARG 334 Ca 0.00 -0.79 -0.53 0.00 0.07 0.00 0.00 59.98 58.73 3fky h ARG 334 Cb 0.45 0.25 0.08 0.00 0.08 0.00 0.00 29.97 30.83 3fky h ARG 334 CO 0.00 1.35 0.76 -2.14 -1.07 0.00 0.00 179.97 178.87 3fky s PRO 335 N -3.07 4.20 0.62 0.04 0.02 -1.26 -4.93 135.00 130.62 3fky s PRO 335 Ca -0.10 2.44 -0.10 0.00 0.02 0.00 0.00 61.00 63.26 3fky s PRO 335 Cb 0.06 -3.03 -0.02 0.00 0.02 0.00 0.00 34.50 31.53 3fky s PRO 335 CO 0.92 -0.45 1.00 0.00 -0.33 0.00 0.00 177.00 178.14 3fky s ALA 336 N -0.71 3.11 0.44 -1.55 0.00 -0.30 -1.21 121.76 121.55 3fky s ALA 336 Ca 0.55 -0.29 0.24 0.00 0.00 0.00 0.00 51.96 52.46 3fky s ALA 336 Cb -0.44 -2.94 1.24 0.00 0.00 0.00 0.00 23.12 20.98 3fky s ALA 336 CO 0.54 -0.77 1.78 1.03 0.00 0.00 0.00 175.76 178.34 3fky h SER 337 N -0.31 0.31 -0.36 0.00 0.87 -1.19 -2.12 113.55 110.75 3fky h SER 337 Ca -0.45 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 3fky h SER 337 Cb 1.22 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 3fky h SER 337 CO 0.62 0.05 0.00 -0.46 -0.53 0.00 0.00 176.83 176.52 3fky n ASN 338 N -4.50 3.09 -4.76 6.23 6.94 -1.03 -4.78 115.26 116.45 3fky n ASN 338 Ca 0.25 -2.31 -0.35 0.00 -0.02 0.00 0.00 54.58 52.15 3fky n ASN 338 Cb 0.98 -0.47 0.02 0.00 -2.36 0.00 0.00 39.78 37.95 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 -1.77 2.93 -0.42 1.53 1.10 -0.80 -4.84 121.20 118.93 3fky s ILE 339 Ca 0.30 0.55 -0.23 0.00 -0.51 0.00 0.00 60.65 60.76 3fky s ILE 339 Cb 0.20 -3.18 0.02 0.00 0.15 0.00 0.00 42.46 39.65 3fky s ILE 339 CO 0.13 -0.15 0.78 -0.62 -2.11 0.00 0.00 174.94 172.96 3fky s ASP 340 N -1.83 6.45 0.40 4.50 -1.08 -1.26 -4.96 116.67 118.89 3fky s ASP 340 Ca 0.74 0.02 0.17 0.00 -0.52 0.00 0.00 52.55 52.96 3fky s ASP 340 Cb -0.26 -2.38 1.07 0.00 -1.46 0.00 0.00 42.92 39.88 3fky s ASP 340 CO 0.32 -0.85 1.81 1.55 0.52 0.00 0.00 175.17 178.52 3fky h PRO 341 N 8.83 0.42 -0.48 4.34 0.13 -1.94 0.35 132.00 143.65 3fky h PRO 341 Ca -0.25 -0.03 0.03 0.00 -0.87 0.00 0.00 66.00 64.89 3fky h PRO 341 Cb 1.09 -0.09 -0.04 0.00 0.13 0.00 0.00 31.00 32.09 3fky h PRO 341 CO 0.94 0.28 0.26 1.88 -0.23 0.00 0.00 178.00 181.12 3fky h TYR 342 N 0.43 0.47 -0.23 1.56 0.05 -1.90 0.27 116.97 117.63 3fky h TYR 342 Ca 0.54 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 59.30 3fky h TYR 342 Cb 1.32 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 38.91 3fky h TYR 342 CO -0.00 0.25 -0.01 -0.07 -1.05 0.00 0.00 178.16 177.28 3fky h LEU 343 N 0.51 0.40 0.63 3.88 3.38 -1.24 -0.45 115.31 122.41 3fky h LEU 343 Ca 0.20 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 3fky h LEU 343 Cb 0.08 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.73 3fky h LEU 343 CO -0.12 0.62 -0.30 0.58 0.09 0.00 0.00 178.44 179.30 3fky h VAL 344 N 0.17 0.27 -0.42 1.22 2.07 -1.06 -1.22 116.25 117.28 3fky h VAL 344 Ca 0.06 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 3fky h VAL 344 Cb 0.42 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 3fky h VAL 344 CO 0.01 0.03 0.12 0.71 0.02 0.00 0.00 177.57 178.46 3fky h THR 345 N -1.04 1.18 0.97 2.57 1.35 -0.57 0.08 112.91 117.44 3fky h THR 345 Ca -0.09 -0.61 -0.05 0.00 -0.55 0.00 0.00 66.41 65.11 3fky h THR 345 Cb 0.69 0.74 0.01 0.00 -1.73 0.00 0.00 68.15 67.86 3fky h THR 345 CO 0.14 0.23 -0.46 1.23 -0.25 0.00 0.00 175.52 176.40 3fky h GLY 346 N 0.80 -1.36 2.00 5.82 0.00 -1.05 -1.67 103.07 107.61 3fky h GLY 346 Ca 0.14 0.50 -0.03 0.00 0.00 0.00 0.00 47.33 47.94 3fky h GLY 346 CO -0.01 -0.49 -0.16 1.19 0.00 0.00 0.00 176.54 177.07 3fky h ILE 347 N -1.31 0.50 -0.03 2.60 2.10 -1.08 -0.91 117.51 119.38 3fky h ILE 347 Ca -0.13 -0.80 -0.00 0.00 1.08 0.00 0.00 64.86 65.01 3fky h ILE 347 Cb 1.00 1.55 -0.00 0.00 -1.09 0.00 0.00 36.82 38.27 3fky h ILE 347 CO 0.22 0.15 0.01 -0.03 -1.08 0.00 0.00 178.15 177.42 3fky h MET 348 N 0.00 0.04 -0.16 2.19 4.05 -0.78 -1.62 114.93 118.65 3fky h MET 348 Ca -0.00 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 3fky h MET 348 Cb 0.53 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.32 3fky h MET 348 CO 0.02 0.21 0.10 0.00 0.23 0.00 0.00 176.91 177.47 3fky h GLU 350 N 0.20 -0.00 0.00 0.00 4.81 -1.01 0.49 114.58 119.06 3fky h GLU 350 Ca 0.06 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.14 3fky h GLU 350 Cb 0.00 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 3fky h GLU 350 CO -0.01 -0.00 -1.25 1.79 -0.73 0.00 0.00 179.01 178.81 3fky h THR 351 N -0.00 0.52 0.20 0.32 1.35 -1.11 -0.83 112.91 113.37 3fky h THR 351 Ca 0.31 -1.96 -0.35 0.00 -0.55 0.00 0.00 66.41 63.86 3fky h THR 351 Cb 0.48 2.06 0.02 0.00 -1.73 0.00 0.00 68.15 68.97 3fky h THR 351 CO -0.68 0.30 -1.68 0.58 -0.25 0.00 0.00 175.52 173.79 3fky h VAL 352 N 0.00 1.02 0.00 6.82 2.07 -0.61 -3.39 116.25 122.16 3fky h VAL 352 Ca -0.13 -2.57 -0.29 0.00 0.82 0.00 0.00 66.70 64.53 3fky h VAL 352 Cb 1.52 2.83 -0.05 0.00 -1.52 0.00 0.00 31.29 34.06 3fky h VAL 352 CO 0.05 0.85 -2.22 0.00 0.02 0.00 0.00 177.57 176.26 3fky n GLY 354 N 1.63 4.08 3.44 0.00 0.00 -0.37 -5.03 105.19 108.94 3fky n GLY 354 Ca -0.26 -1.29 -0.28 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.90 -0.67 0.01 4.61 0.00 -0.86 -4.58 121.76 119.36 3fky s ALA 355 Ca 0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 51.96 51.67 3fky s ALA 355 Cb 0.00 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 19.93 3fky s ALA 355 CO 0.00 -4.07 -0.00 0.42 0.00 0.00 0.00 175.76 172.10 3fky s ILE 356 N -2.41 0.04 -0.53 0.00 1.01 -1.25 -5.00 121.20 113.06 3fky s ILE 356 Ca 0.69 -0.36 0.26 0.00 0.00 0.00 0.00 60.65 61.23 3fky s ILE 356 Cb -0.23 -0.12 0.30 0.00 0.01 0.00 0.00 42.46 42.42 3fky s ILE 356 CO 0.64 -0.20 1.75 -2.24 0.00 0.00 0.00 174.94 174.89 3fky h ASP 357 N 5.53 0.00 1.44 3.58 2.03 -2.04 -2.91 116.42 124.04 3fky h ASP 357 Ca -0.27 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 55.99 3fky h ASP 357 Cb 1.21 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.70 3fky h ASP 357 CO 0.47 0.00 -0.19 -1.13 -1.03 0.00 0.00 179.24 177.35 3fky h ASN 358 N 0.00 0.00 -4.77 4.15 -1.24 -2.02 -3.46 115.58 108.24 3fky h ASN 358 Ca 0.00 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 56.92 3fky h ASN 358 Cb 0.67 0.00 -0.20 0.00 0.73 0.00 0.00 38.32 39.52 3fky h ASN 358 CO 0.00 0.19 -0.07 0.00 -1.29 0.00 0.00 177.43 176.27 3fky s ALA 359 N -3.33 -1.26 -0.26 1.57 0.00 -1.10 -5.10 121.76 112.29 3fky s ALA 359 Ca 0.04 0.94 -0.01 0.00 0.00 0.00 0.00 51.96 52.93 3fky s ALA 359 Cb 0.08 -0.15 0.08 0.00 0.00 0.00 0.00 23.12 23.13 3fky s ALA 359 CO 0.66 -0.30 0.04 0.34 0.00 0.00 0.00 175.76 176.50 3fky s ASP 360 N -0.94 3.72 0.13 0.00 -1.08 -1.26 -3.96 116.67 113.28 3fky s ASP 360 Ca -0.10 -1.33 -0.22 0.00 -0.52 0.00 0.00 52.55 50.39 3fky s ASP 360 Cb -0.03 -0.92 -0.03 0.00 -1.46 0.00 0.00 42.92 40.48 3fky s ASP 360 CO 0.06 -0.34 1.68 0.24 0.52 0.00 0.00 175.17 177.33 3fky h MET 361 N 8.07 -0.13 -0.48 4.34 2.86 -1.94 -1.54 114.93 126.11 3fky h MET 361 Ca -0.15 0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.46 3fky h MET 361 Cb 1.06 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.72 3fky h MET 361 CO 0.42 -0.08 0.13 0.00 1.06 0.00 0.00 176.91 178.44 3fky h THR 362 N -0.13 1.20 -0.63 2.22 1.03 -1.96 -1.44 112.91 113.21 3fky h THR 362 Ca 0.09 -0.70 -0.06 0.00 -0.01 0.00 0.00 66.41 65.72 3fky h THR 362 Cb 0.26 0.69 -0.03 0.00 -1.07 0.00 0.00 68.15 68.01 3fky h THR 362 CO -0.21 0.26 0.14 0.11 -0.01 0.00 0.00 175.52 175.80 3fky h LYS 363 N 0.70 0.99 -5.13 0.00 1.57 -1.88 -3.36 116.57 109.46 3fky h LYS 363 Ca 0.16 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 3fky h LYS 363 Cb 0.23 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 3fky h LYS 363 CO -0.01 0.89 0.33 -1.91 -0.57 0.00 0.00 179.45 178.18 3fky n GLU 364 N -4.24 0.19 -2.70 3.15 4.07 -0.54 -4.20 120.64 116.36 3fky n GLU 364 Ca 0.04 -1.08 -0.05 0.00 -0.06 0.00 0.00 57.16 56.01 3fky n GLU 364 Cb 0.26 -3.18 0.06 0.00 -0.06 0.00 0.00 31.44 28.51 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 16.11 -1.66 0.15 4.31 3.01 -1.26 -4.99 117.46 133.13 3fky n PHE 365 Ca 0.38 -1.06 0.02 0.00 1.01 0.00 0.00 57.45 57.80 3fky n PHE 365 Cb 0.44 1.27 0.02 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