#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fwa s ASN 3 N 0.00 0.75 -0.09 4.04 0.01 -1.26 -5.13 114.94 113.26 1fwa s ASN 3 Ca 0.00 -0.61 -0.11 0.00 -0.71 0.00 0.00 52.86 51.43 1fwa s ASN 3 Cb 0.00 0.06 0.03 0.00 0.41 0.00 0.00 41.25 41.75 1fwa s ASN 3 CO 0.00 -0.27 0.30 -0.51 -1.51 0.00 0.00 177.10 175.11 1fwa s ILE 4 N -1.75 0.02 0.59 0.60 2.07 -1.26 -5.15 121.20 116.32 1fwa s ILE 4 Ca -0.08 -0.13 -0.17 0.00 -1.41 0.00 0.00 60.65 58.86 1fwa s ILE 4 Cb -0.08 -0.47 -0.03 0.00 0.13 0.00 0.00 42.46 42.01 1fwa s ILE 4 CO -0.01 -0.07 1.10 -0.94 -1.91 0.00 0.00 174.94 173.11 1fwa s SER 5 N -0.20 5.55 0.31 4.50 1.04 -1.26 -4.88 113.70 118.76 1fwa s SER 5 Ca -0.03 2.01 -0.01 0.00 0.48 0.00 0.00 55.95 58.39 1fwa s SER 5 Cb -0.03 -2.56 0.49 0.00 0.10 0.00 0.00 66.02 64.02 1fwa s SER 5 CO 0.01 -1.33 1.97 0.03 0.98 0.00 0.00 173.24 174.90 1fwa h ARG 6 N 0.61 1.00 -0.09 4.02 3.08 -2.01 -0.77 114.38 120.22 1fwa h ARG 6 Ca -0.48 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 59.48 1fwa h ARG 6 Cb 1.24 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 31.07 1fwa h ARG 6 CO 0.56 0.68 -0.00 0.37 -1.07 0.00 0.00 179.97 180.51 1fwa h GLN 7 N 1.03 0.17 -0.51 0.04 5.75 -1.99 -0.65 115.11 118.94 1fwa h GLN 7 Ca 0.27 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.69 1fwa h GLN 7 Cb -0.09 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.43 1fwa h GLN 7 CO -0.06 0.44 0.20 0.00 -2.65 0.00 0.00 178.83 176.77 1fwa h ALA 8 N 0.72 1.40 -0.12 3.38 0.00 -1.91 -1.57 119.26 121.17 1fwa h ALA 8 Ca 0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1fwa h ALA 8 Cb 0.37 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1fwa h ALA 8 CO 0.01 0.45 0.05 -0.92 0.00 0.00 0.00 179.25 178.84 1fwa h TYR 9 N 0.72 0.18 -0.96 0.00 3.20 -0.92 -2.60 116.97 116.60 1fwa h TYR 9 Ca 0.17 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.06 1fwa h TYR 9 Cb 0.14 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.31 1fwa h TYR 9 CO 0.01 0.26 0.63 0.00 -1.64 0.00 0.00 178.16 177.42 1fwa h ALA 10 N 0.90 1.35 0.00 1.82 0.00 -0.51 0.13 119.26 122.95 1fwa h ALA 10 Ca 0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1fwa h ALA 10 Cb 0.16 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1fwa h ALA 10 CO -0.00 0.57 -0.18 -0.44 0.00 0.00 0.00 179.25 179.20 1fwa h ASP 11 N 1.25 0.00 0.07 0.00 3.45 -1.09 0.15 116.42 120.24 1fwa h ASP 11 Ca 0.37 0.00 -0.37 0.00 0.43 0.00 0.00 57.03 57.46 1fwa h ASP 11 Cb -0.06 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 38.67 1fwa h ASP 11 CO -0.10 0.18 -2.16 0.23 -1.57 0.00 0.00 179.24 175.82 1fwa n MET 12 N -3.95 0.70 -0.00 3.56 2.81 -0.70 -4.68 117.12 114.86 1fwa n MET 12 Ca -0.02 0.24 0.00 0.00 -1.81 0.00 0.00 57.70 56.11 1fwa n MET 12 Cb 0.27 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.15 1fwa n MET 12 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1fwa n PHE 13 N -3.49 0.01 0.00 2.03 3.01 -0.05 -4.95 117.46 114.02 1fwa n PHE 13 Ca -0.38 -0.16 0.00 0.00 1.01 0.00 0.00 57.45 57.92 1fwa n PHE 13 Cb 1.00 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 40.45 1fwa n PHE 13 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1fwa n GLY 14 N -0.12 0.12 3.70 1.37 0.00 0.51 -4.29 105.19 106.47 1fwa n GLY 14 Ca 0.00 -1.80 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 1fwa n GLY 14 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fwa s PRO 15 N -2.11 1.36 0.15 1.61 0.04 -1.26 -4.06 135.00 130.73 1fwa s PRO 15 Ca 0.00 1.30 0.01 0.00 0.04 0.00 0.00 61.00 62.36 1fwa s PRO 15 Cb 0.00 -1.78 -0.01 0.00 0.04 0.00 0.00 34.50 32.75 1fwa s PRO 15 CO 0.00 -2.32 0.05 -2.37 0.04 0.00 0.00 177.00 172.41 1fwa n THR 16 N -3.99 0.00 -1.73 1.26 5.66 -1.26 -4.95 114.28 109.27 1fwa n THR 16 Ca 0.10 -0.88 -0.62 0.00 -3.05 0.00 0.00 64.05 59.59 1fwa n THR 16 Cb 0.53 0.31 -0.08 0.00 -1.55 0.00 0.00 70.33 69.54 1fwa n THR 16 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1fwa n VAL 17 N -0.35 0.17 0.00 1.08 0.31 -1.26 -1.25 118.33 117.03 1fwa n VAL 17 Ca -0.02 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1fwa n VAL 17 Cb 0.23 -0.89 0.00 0.00 -0.91 0.00 0.00 33.84 32.27 1fwa n VAL 17 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fwa n GLY 18 N 4.08 2.76 3.80 2.92 0.00 -0.87 -4.98 105.19 112.90 1fwa n GLY 18 Ca 0.28 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.95 1fwa n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fwa s ASP 19 N -1.26 6.95 0.12 1.61 1.01 -0.38 -4.81 116.67 119.91 1fwa s ASP 19 Ca 0.00 1.83 0.09 0.00 0.71 0.00 0.00 52.55 55.18 1fwa s ASP 19 Cb 0.00 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.33 1fwa s ASP 19 CO 0.00 -0.35 -0.16 -0.54 0.21 0.00 0.00 175.17 174.33 1fwa s LYS 20 N -2.72 1.86 -0.02 8.23 1.02 -1.26 -1.61 119.74 125.24 1fwa s LYS 20 Ca 0.58 -1.17 0.02 0.00 0.02 0.00 0.00 55.97 55.43 1fwa s LYS 20 Cb -0.15 -2.15 0.00 0.00 -0.52 0.00 0.00 37.83 35.01 1fwa s LYS 20 CO 0.20 0.48 -0.08 0.08 -0.92 0.00 0.00 175.35 175.10 1fwa s VAL 21 N -1.22 0.74 0.01 3.17 1.01 0.13 -4.95 120.40 119.30 1fwa s VAL 21 Ca 0.19 -0.34 -0.28 0.00 0.00 0.00 0.00 61.98 61.56 1fwa s VAL 21 Cb -0.10 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 1fwa s VAL 21 CO 0.11 0.23 0.88 -0.60 0.00 0.00 0.00 175.10 175.73 1fwa s ARG 22 N 0.21 4.54 -0.55 2.72 3.52 -1.26 -1.33 118.95 126.80 1fwa s ARG 22 Ca -0.03 1.25 -0.27 0.00 -0.13 0.00 0.00 55.73 56.55 1fwa s ARG 22 Cb -0.08 -3.43 0.03 0.00 -1.56 0.00 0.00 34.95 29.91 1fwa s ARG 22 CO 0.00 0.06 1.10 -0.51 -0.81 0.00 0.00 175.30 175.14 1fwa s LEU 23 N 0.68 3.67 0.00 -0.88 1.43 -0.28 -4.72 118.68 118.59 1fwa s LEU 23 Ca 0.46 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.62 1fwa s LEU 23 Cb -0.20 -3.15 0.00 0.00 0.03 0.00 0.00 46.19 42.86 1fwa s LEU 23 CO 0.25 -1.35 0.00 0.00 0.23 0.00 0.00 176.35 175.48 1fwa n ALA 24 N 8.02 0.00 -1.29 4.21 0.00 -0.31 -1.74 120.51 129.40 1fwa n ALA 24 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.46 1fwa n ALA 24 Cb 0.49 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.15 1fwa n ALA 24 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1fwa n ASP 25 N 3.27 3.20 -3.73 0.00 5.75 -1.26 -4.83 116.55 118.94 1fwa n ASP 25 Ca 0.00 -3.55 -0.17 0.00 -0.01 0.00 0.00 54.79 51.06 1fwa n ASP 25 Cb 0.00 -0.67 0.09 0.00 -1.03 0.00 0.00 41.12 39.51 1fwa n ASP 25 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1fwa n THR 26 N -0.92 0.00 -0.36 2.12 -2.24 -0.71 -4.80 114.28 107.38 1fwa n THR 26 Ca 0.36 -1.05 0.11 0.00 -2.27 0.00 0.00 64.05 61.20 1fwa n THR 26 Cb 1.16 -1.11 0.33 0.00 -2.10 0.00 0.00 70.33 68.60 1fwa n THR 26 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1fwa n GLU 27 N -2.37 2.93 -3.15 -0.78 -0.58 -1.26 -4.69 120.64 110.73 1fwa n GLU 27 Ca 0.12 -2.64 -0.39 0.00 -0.42 0.00 0.00 57.16 53.82 1fwa n GLU 27 Cb 0.41 -1.64 -0.05 0.00 -0.57 0.00 0.00 31.44 29.59 1fwa n GLU 27 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1fwa s LEU 28 N -1.21 4.26 -0.03 -4.62 1.43 -1.26 -5.02 118.68 112.24 1fwa s LEU 28 Ca 0.49 0.98 0.07 0.00 -1.03 0.00 0.00 54.13 54.64 1fwa s LEU 28 Cb 0.27 -2.91 -0.02 0.00 0.03 0.00 0.00 46.19 43.57 1fwa s LEU 28 CO 0.31 -0.11 -0.24 0.26 0.23 0.00 0.00 176.35 176.79 1fwa s TRP 29 N 0.99 2.22 0.06 0.29 0.52 -1.26 -1.13 118.94 120.63 1fwa s TRP 29 Ca 0.32 -0.50 0.07 0.00 0.02 0.00 0.00 56.10 56.01 1fwa s TRP 29 Cb -0.16 -1.44 -0.03 0.00 -1.15 0.00 0.00 33.47 30.68 1fwa s TRP 29 CO 0.14 -0.09 -0.16 0.96 0.02 0.00 0.00 176.95 177.81 1fwa s ILE 30 N -0.42 2.92 -0.08 2.03 -4.36 -0.44 -1.09 121.20 119.75 1fwa s ILE 30 Ca 0.05 -1.22 0.04 0.00 -0.26 0.00 0.00 60.65 59.26 1fwa s ILE 30 Cb -0.11 -2.27 -0.01 0.00 1.25 0.00 0.00 42.46 41.33 1fwa s ILE 30 CO 0.00 0.28 -0.22 -0.70 0.24 0.00 0.00 174.94 174.54 1fwa s GLU 31 N -1.64 2.86 -0.01 0.37 2.12 -1.26 -0.69 118.70 120.44 1fwa s GLU 31 Ca 0.16 -0.84 -0.30 0.00 0.36 0.00 0.00 54.97 54.35 1fwa s GLU 31 Cb -0.11 -2.31 -0.07 0.00 0.26 0.00 0.00 34.13 31.90 1fwa s GLU 31 CO 0.07 0.31 1.78 0.08 -0.54 0.00 0.00 175.26 176.96 1fwa s VAL 32 N 0.04 3.34 0.04 3.70 1.01 -0.63 -4.88 120.40 123.01 1fwa s VAL 32 Ca -0.08 0.42 0.09 0.00 0.00 0.00 0.00 61.98 62.41 1fwa s VAL 32 Cb -0.15 -3.27 -0.22 0.00 0.00 0.00 0.00 36.38 32.73 1fwa s VAL 32 CO 0.05 -0.04 0.97 -0.33 0.00 0.00 0.00 175.10 175.75 1fwa h GLU 33 N 9.93 0.02 -3.11 2.72 5.08 -1.51 -2.32 114.58 125.39 1fwa h GLU 33 Ca -0.44 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 57.84 1fwa h GLU 33 Cb 1.20 0.01 -0.13 0.00 0.50 0.00 0.00 28.75 30.33 1fwa h GLU 33 CO 0.95 0.78 0.04 0.34 -1.00 0.00 0.00 179.01 180.13 1fwa s ASP 34 N -6.46 -0.39 -0.10 1.42 -1.08 -1.25 -4.92 116.67 103.89 1fwa s ASP 34 Ca -0.02 -0.09 -0.03 0.00 -0.52 0.00 0.00 52.55 51.89 1fwa s ASP 34 Cb 0.09 0.52 0.04 0.00 -1.46 0.00 0.00 42.92 42.11 1fwa s ASP 34 CO 0.82 -0.85 0.06 -0.62 0.52 0.00 0.00 175.17 175.11 1fwa s ASP 35 N -2.57 1.70 0.00 -0.34 -1.08 -1.26 -0.88 116.67 112.25 1fwa s ASP 35 Ca 0.00 -0.23 0.06 0.00 -0.52 0.00 0.00 52.55 51.86 1fwa s ASP 35 Cb 0.00 -0.22 0.28 0.00 -1.46 0.00 0.00 42.92 41.52 1fwa s ASP 35 CO -0.10 -0.28 1.19 0.18 0.52 0.00 0.00 175.17 176.68 1fwa n LEU 36 N 5.27 0.32 -4.97 -1.34 4.32 -0.50 -4.91 117.00 115.19 1fwa n LEU 36 Ca -0.05 -0.15 -0.24 0.00 -0.02 0.00 0.00 56.01 55.54 1fwa n LEU 36 Cb 0.49 -0.04 0.09 0.00 -1.62 0.00 0.00 43.42 42.35 1fwa n LEU 36 CO 0.08 0.08 0.56 0.28 -1.22 0.00 0.00 177.39 177.16 1fwa s THR 37 N -1.93 2.27 -0.24 -5.08 -1.32 -1.26 -4.49 115.64 103.59 1fwa s THR 37 Ca 0.10 -0.48 0.01 0.00 -1.21 0.00 0.00 61.69 60.11 1fwa s THR 37 Cb 0.05 -2.80 0.04 0.00 -1.51 0.00 0.00 72.50 68.28 1fwa s THR 37 CO 0.07 0.00 -0.11 -0.89 -2.21 0.00 0.00 174.62 171.49 1fwa s THR 38 N -3.16 2.41 -0.10 5.08 2.01 -1.26 -5.07 115.64 115.55 1fwa s THR 38 Ca 0.64 -1.29 -0.35 0.00 0.31 0.00 0.00 61.69 61.00 1fwa s THR 38 Cb -0.08 -2.28 -0.12 0.00 0.01 0.00 0.00 72.50 70.04 1fwa s THR 38 CO 0.44 0.15 1.88 -1.22 -0.69 0.00 0.00 174.62 175.18 1fwa n TYR 39 N 4.56 2.32 0.00 4.92 0.53 -1.26 -0.65 117.16 127.57 1fwa n TYR 39 Ca -0.16 0.03 0.00 0.00 -1.02 0.00 0.00 57.90 56.74 1fwa n TYR 39 Cb 0.45 -2.65 0.00 0.00 -1.03 0.00 0.00 39.34 36.11 1fwa n TYR 39 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1fwa n GLY 40 N 4.41 2.73 1.01 2.72 0.00 -1.26 -4.93 105.19 109.88 1fwa n GLY 40 Ca 0.23 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.33 1fwa n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fwa n GLU 41 N -1.13 3.21 -1.96 1.61 -0.58 0.18 -5.02 120.64 116.95 1fwa n GLU 41 Ca 0.00 -2.69 -0.39 0.00 -0.42 0.00 0.00 57.16 53.66 1fwa n GLU 41 Cb 0.00 -1.75 0.01 0.00 -0.57 0.00 0.00 31.44 29.12 1fwa n GLU 41 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1fwa s GLU 42 N -2.26 3.76 -0.09 3.49 8.01 -1.25 -4.87 118.70 125.49 1fwa s GLU 42 Ca 0.40 2.21 -0.13 0.00 0.01 0.00 0.00 54.97 57.46 1fwa s GLU 42 Cb 0.29 -2.63 -0.05 0.00 -4.31 0.00 0.00 34.13 27.43 1fwa s GLU 42 CO 0.13 -0.68 0.32 0.14 0.01 0.00 0.00 175.26 175.18 1fwa s VAL 43 N -1.27 5.23 -0.00 2.63 -7.23 -1.26 -4.94 120.40 113.55 1fwa s VAL 43 Ca 0.60 0.63 0.00 0.00 -1.81 0.00 0.00 61.98 61.40 1fwa s VAL 43 Cb -0.39 -3.63 0.00 0.00 0.56 0.00 0.00 36.38 32.92 1fwa s VAL 43 CO 0.50 0.51 -0.01 -0.75 -0.31 0.00 0.00 175.10 175.03 1fwa s LYS 44 N -0.43 0.11 0.00 4.82 2.20 -1.26 -4.73 119.74 120.45 1fwa s LYS 44 Ca 0.20 -0.04 0.02 0.00 -0.36 0.00 0.00 55.97 55.79 1fwa s LYS 44 Cb -0.14 -0.11 -0.03 0.00 -1.51 0.00 0.00 37.83 36.03 1fwa s LYS 44 CO 0.08 0.02 -0.03 0.12 -0.36 0.00 0.00 175.35 175.18 1fwa s PHE 45 N 0.01 2.98 -5.00 4.03 5.36 -1.26 -1.15 117.98 122.95 1fwa s PHE 45 Ca 0.00 0.02 0.00 0.00 -0.96 0.00 0.00 56.93 55.99 1fwa s PHE 45 Cb -0.01 -1.64 0.00 0.00 -0.34 0.00 0.00 43.02 41.03 1fwa s PHE 45 CO -0.00 0.42 0.00 0.41 -1.46 0.00 0.00 175.22 174.59 1fwa n GLY 46 N 1.47 -0.21 3.64 13.12 0.00 -1.26 -4.93 105.19 117.02 1fwa n GLY 46 Ca -0.15 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 1fwa n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwa n GLY 47 N -1.12 1.56 2.33 -0.02 0.00 -1.26 -1.75 105.19 104.93 1fwa n GLY 47 Ca 0.00 0.81 -0.13 0.00 0.00 0.00 0.00 46.02 46.70 1fwa n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwa n GLY 48 N 5.01 0.79 0.00 -0.02 0.00 -1.26 -5.01 105.19 104.70 1fwa n GLY 48 Ca 0.24 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1fwa n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fwa n LYS 49 N -2.48 2.81 0.07 1.61 4.76 -0.72 -5.05 118.16 119.16 1fwa n LYS 49 Ca -0.14 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.07 1fwa n LYS 49 Cb 0.50 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.54 1fwa n LYS 49 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1fwa h VAL 50 N 0.00 1.06 -0.72 -0.18 2.07 -1.44 -3.42 116.25 113.61 1fwa h VAL 50 Ca 0.00 -2.51 -0.56 0.00 0.82 0.00 0.00 66.70 64.45 1fwa h VAL 50 Cb 0.00 2.83 -0.07 0.00 -1.52 0.00 0.00 31.29 32.53 1fwa h VAL 50 CO 0.00 0.80 1.80 -0.63 0.02 0.00 0.00 177.57 179.57 1fwa s ILE 51 N -2.54 3.92 0.03 4.57 1.01 -0.74 -0.44 121.20 127.00 1fwa s ILE 51 Ca -0.16 -1.56 -0.01 0.00 0.00 0.00 0.00 60.65 58.93 1fwa s ILE 51 Cb 0.05 -4.98 -0.03 0.00 0.01 0.00 0.00 42.46 37.51 1fwa s ILE 51 CO 0.85 -1.66 -0.02 -0.13 0.00 0.00 0.00 174.94 173.97 1fwa s ARG 52 N 5.03 0.41 -0.20 2.79 0.52 -1.26 -4.81 118.95 121.43 1fwa s ARG 52 Ca 0.59 -0.79 -0.42 0.00 -0.52 0.00 0.00 55.73 54.59 1fwa s ARG 52 Cb 0.02 0.15 -0.19 0.00 0.52 0.00 0.00 34.95 35.45 1fwa s ARG 52 CO 0.10 -0.07 1.42 -3.47 0.02 0.00 0.00 175.30 173.29 1fwa n ASP 53 N 1.12 1.12 0.00 0.23 2.03 -1.26 -0.28 116.55 119.51 1fwa n ASP 53 Ca -0.21 1.15 0.00 0.00 0.52 0.00 0.00 54.79 56.25 1fwa n ASP 53 Cb 0.57 -1.00 0.00 0.00 -0.72 0.00 0.00 41.12 39.97 1fwa n ASP 53 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1fwa n GLY 54 N 2.99 2.95 0.00 0.27 0.00 -0.38 -4.86 105.19 106.16 1fwa n GLY 54 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1fwa n GLY 54 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1fwa n MET 55 N -2.00 0.00 0.00 1.61 2.81 0.61 -4.82 117.12 115.33 1fwa n MET 55 Ca 0.00 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.02 1fwa n MET 55 Cb 0.00 0.00 0.72 0.00 -0.71 0.00 0.00 33.22 33.23 1fwa n MET 55 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1fwa n GLY 56 N 4.69 -1.09 3.25 3.03 0.00 0.42 -4.42 105.19 111.06 1fwa n GLY 56 Ca 0.00 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 1fwa n GLY 56 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1fwa s GLN 57 N -2.41 3.07 0.10 1.61 0.74 -1.07 -3.16 119.66 118.54 1fwa s GLN 57 Ca 0.30 -0.85 0.00 0.00 0.05 0.00 0.00 55.36 54.87 1fwa s GLN 57 Cb 0.18 -2.35 0.02 0.00 1.10 0.00 0.00 33.01 31.96 1fwa s GLN 57 CO 0.39 0.20 0.13 0.41 -0.55 0.00 0.00 175.29 175.87 1fwa n GLY 58 N 3.48 1.09 1.13 2.59 0.00 0.37 -1.25 105.19 112.60 1fwa n GLY 58 Ca -0.19 -2.02 0.10 0.00 0.00 0.00 0.00 46.02 43.92 1fwa n GLY 58 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fwa n GLN 59 N -1.23 2.65 -1.73 1.61 1.13 -1.26 -4.22 117.38 114.32 1fwa n GLN 59 Ca 0.02 -2.41 -0.33 0.00 -1.94 0.00 0.00 57.00 52.34 1fwa n GLN 59 Cb 0.08 -1.48 0.05 0.00 0.11 0.00 0.00 30.24 29.00 1fwa n GLN 59 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1fwa s MET 60 N -1.09 2.78 0.82 -1.09 0.23 -1.26 -5.00 119.30 114.69 1fwa s MET 60 Ca 0.40 1.37 -0.12 0.00 -1.03 0.00 0.00 55.69 56.31 1fwa s MET 60 Cb 0.22 -1.95 0.08 0.00 -1.53 0.00 0.00 34.83 31.65 1fwa s MET 60 CO 0.29 -1.26 1.11 -0.51 -2.03 0.00 0.00 175.02 172.61 1fwa s LEU 61 N -4.93 2.49 0.31 0.18 1.43 -1.26 -4.46 118.68 112.43 1fwa s LEU 61 Ca 0.66 1.22 0.07 0.00 -1.03 0.00 0.00 54.13 55.05 1fwa s LEU 61 Cb -0.20 -3.78 0.76 0.00 0.03 0.00 0.00 46.19 43.00 1fwa s LEU 61 CO 0.42 -2.06 1.78 0.00 0.23 0.00 0.00 176.35 176.72 1fwa h ALA 62 N -1.16 1.70 0.00 4.21 0.00 -1.96 0.55 119.26 122.61 1fwa h ALA 62 Ca -0.48 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1fwa h ALA 62 Cb 1.28 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1fwa h ALA 62 CO 0.60 -0.08 -0.04 0.00 0.00 0.00 0.00 179.25 179.73 1fwa h ALA 63 N 1.65 1.39 -0.56 0.00 0.00 -1.99 -2.60 119.26 117.14 1fwa h ALA 63 Ca 0.58 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1fwa h ALA 63 Cb 0.93 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1fwa h ALA 63 CO -0.38 0.06 0.00 -0.25 0.00 0.00 0.00 179.25 178.68 1fwa n ASP 64 N -3.70 3.86 -4.10 0.00 8.00 0.18 -4.97 116.55 115.81 1fwa n ASP 64 Ca -0.03 -2.19 -0.09 0.00 0.71 0.00 0.00 54.79 53.19 1fwa n ASP 64 Cb 0.14 -0.44 -0.10 0.00 -0.02 0.00 0.00 41.12 40.70 1fwa n ASP 64 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fwa s VAL 66 N -3.99 4.65 -0.08 0.00 -7.23 -1.00 -4.89 120.40 107.86 1fwa s VAL 66 Ca 0.17 0.91 0.14 0.00 -1.81 0.00 0.00 61.98 61.39 1fwa s VAL 66 Cb 0.07 -3.82 -0.09 0.00 0.56 0.00 0.00 36.38 33.10 1fwa s VAL 66 CO -0.03 -1.07 1.13 0.44 -0.31 0.00 0.00 175.10 175.26 1fwa h ASP 67 N -0.18 0.00 -3.87 4.85 3.32 -1.41 -3.32 116.42 115.81 1fwa h ASP 67 Ca -0.44 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.47 1fwa h ASP 67 Cb 1.19 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.49 1fwa h ASP 67 CO 0.62 0.68 -0.31 -0.22 -1.72 0.00 0.00 179.24 178.28 1fwa s LEU 68 N -6.25 0.69 -0.04 1.55 2.96 -0.83 -0.29 118.68 116.47 1fwa s LEU 68 Ca 0.00 0.69 0.03 0.00 -0.22 0.00 0.00 54.13 54.63 1fwa s LEU 68 Cb 0.08 1.18 0.01 0.00 0.50 0.00 0.00 46.19 47.96 1fwa s LEU 68 CO 0.79 -0.12 -0.10 0.54 -1.32 0.00 0.00 176.35 176.14 1fwa s VAL 69 N 0.17 0.91 -0.41 1.68 0.11 -0.55 -0.75 120.40 121.57 1fwa s VAL 69 Ca -0.00 -0.41 -0.11 0.00 -2.93 0.00 0.00 61.98 58.52 1fwa s VAL 69 Cb -0.02 -0.82 0.05 0.00 -1.53 0.00 0.00 36.38 34.06 1fwa s VAL 69 CO 0.01 0.28 0.26 -0.76 -3.33 0.00 0.00 175.10 171.56 1fwa s LEU 70 N 0.30 5.05 0.16 2.54 1.02 0.14 -1.14 118.68 126.74 1fwa s LEU 70 Ca -0.06 -1.22 -0.28 0.00 0.02 0.00 0.00 54.13 52.60 1fwa s LEU 70 Cb -0.11 -2.05 -0.07 0.00 0.02 0.00 0.00 46.19 43.98 1fwa s LEU 70 CO 0.01 -0.49 0.87 0.42 0.02 0.00 0.00 176.35 177.19 1fwa s THR 71 N 1.53 4.36 -1.36 5.49 -4.23 -0.52 -1.29 115.64 119.63 1fwa s THR 71 Ca 0.03 1.91 -0.00 0.00 -1.18 0.00 0.00 61.69 62.44 1fwa s THR 71 Cb -0.21 -4.24 0.00 0.00 1.34 0.00 0.00 72.50 69.39 1fwa s THR 71 CO 0.05 0.44 0.56 0.59 -0.54 0.00 0.00 174.62 175.72 1fwa n ASN 72 N 2.06 -0.78 -4.82 3.99 3.02 -1.25 -0.96 115.26 116.52 1fwa n ASN 72 Ca -0.02 -0.91 -0.36 0.00 -0.03 0.00 0.00 54.58 53.25 1fwa n ASN 72 Cb 0.48 -3.55 -0.06 0.00 -0.61 0.00 0.00 39.78 36.04 1fwa n ASN 72 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fwa s ALA 73 N -3.81 3.46 -0.50 5.41 0.00 0.13 -3.18 121.76 123.28 1fwa s ALA 73 Ca 0.01 0.11 -0.15 0.00 0.00 0.00 0.00 51.96 51.94 1fwa s ALA 73 Cb -0.01 -2.76 0.10 0.00 0.00 0.00 0.00 23.12 20.45 1fwa s ALA 73 CO 0.85 0.35 0.44 -1.17 0.00 0.00 0.00 175.76 176.23 1fwa s LEU 74 N -1.82 5.87 0.07 0.00 2.96 -0.90 -1.18 118.68 123.68 1fwa s LEU 74 Ca 0.40 -1.57 -0.29 0.00 -0.22 0.00 0.00 54.13 52.45 1fwa s LEU 74 Cb -0.17 -2.18 -0.05 0.00 0.50 0.00 0.00 46.19 44.29 1fwa s LEU 74 CO 0.21 -0.74 0.93 -0.63 -1.32 0.00 0.00 176.35 174.80 1fwa s ILE 75 N 1.60 4.63 -0.23 6.68 1.01 0.17 -1.06 121.20 134.00 1fwa s ILE 75 Ca 0.04 2.00 0.01 0.00 0.00 0.00 0.00 60.65 62.70 1fwa s ILE 75 Cb -0.27 -4.29 0.06 0.00 0.01 0.00 0.00 42.46 37.97 1fwa s ILE 75 CO 0.05 0.29 -0.06 -0.69 0.00 0.00 0.00 174.94 174.52 1fwa s VAL 76 N 0.24 1.60 0.26 2.92 1.01 -0.94 -1.72 120.40 123.78 1fwa s VAL 76 Ca 0.47 -1.23 -0.06 0.00 0.00 0.00 0.00 61.98 61.16 1fwa s VAL 76 Cb -0.22 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 1fwa s VAL 76 CO 0.28 -0.06 0.36 -0.62 0.00 0.00 0.00 175.10 175.07 1fwa s ASP 77 N 1.37 0.26 0.61 3.32 2.15 -0.78 -4.54 116.67 119.06 1fwa s ASP 77 Ca -0.06 -1.22 0.35 0.00 0.43 0.00 0.00 52.55 52.05 1fwa s ASP 77 Cb -0.19 0.54 2.01 0.00 -0.30 0.00 0.00 42.92 44.99 1fwa s ASP 77 CO -0.06 -1.08 2.29 1.12 -0.17 0.00 0.00 175.17 177.27 1fwa h HIS 78 N 2.33 0.00 0.00 -5.34 2.07 -1.94 -2.73 115.15 109.55 1fwa h HIS 78 Ca -0.30 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.22 1fwa h HIS 78 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1fwa h HIS 78 CO 0.66 0.00 -0.81 -2.67 -3.07 0.00 0.00 177.93 172.05 1fwa n TRP 79 N -3.59 0.09 0.00 6.12 4.27 -1.26 -4.94 117.44 118.13 1fwa n TRP 79 Ca -0.03 0.03 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 1fwa n TRP 79 Cb 0.08 -0.24 0.00 0.00 -1.36 0.00 0.00 31.31 29.79 1fwa n TRP 79 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1fwa n GLY 80 N 1.46 1.55 2.86 -1.67 0.00 -1.03 -5.07 105.19 103.30 1fwa n GLY 80 Ca 0.04 -0.92 -0.30 0.00 0.00 0.00 0.00 46.02 44.84 1fwa n GLY 80 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fwa s ILE 81 N -2.00 1.74 0.14 -0.61 1.01 -1.25 -1.86 121.20 118.36 1fwa s ILE 81 Ca 0.00 -2.27 0.04 0.00 0.00 0.00 0.00 60.65 58.42 1fwa s ILE 81 Cb 0.00 -2.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 1fwa s ILE 81 CO 0.00 -0.71 -0.09 0.68 0.00 0.00 0.00 174.94 174.82 1fwa s VAL 82 N 0.81 1.06 -0.23 2.92 -7.23 -0.70 -1.19 120.40 115.85 1fwa s VAL 82 Ca 0.13 -2.04 -0.09 0.00 -1.81 0.00 0.00 61.98 58.17 1fwa s VAL 82 Cb -0.21 -1.84 -0.05 0.00 0.56 0.00 0.00 36.38 34.85 1fwa s VAL 82 CO -0.10 -0.75 0.13 -0.75 -0.31 0.00 0.00 175.10 173.31 1fwa s LYS 83 N -3.77 4.01 0.12 4.82 2.47 -0.06 0.43 119.74 127.77 1fwa s LYS 83 Ca 0.16 -0.30 -0.26 0.00 -1.56 0.00 0.00 55.97 54.01 1fwa s LYS 83 Cb 0.03 -3.44 0.07 0.00 -1.46 0.00 0.00 37.83 33.04 1fwa s LYS 83 CO -0.00 0.10 1.02 0.00 0.16 0.00 0.00 175.35 176.62 1fwa s ALA 84 N 0.92 -1.76 0.09 3.13 0.00 -0.33 -1.41 121.76 122.40 1fwa s ALA 84 Ca 0.06 0.23 -0.08 0.00 0.00 0.00 0.00 51.96 52.17 1fwa s ALA 84 Cb -0.13 0.59 -0.06 0.00 0.00 0.00 0.00 23.12 23.52 1fwa s ALA 84 CO 0.03 -1.05 0.37 -0.51 0.00 0.00 0.00 175.76 174.61 1fwa s ASP 85 N -2.95 6.57 -0.14 0.00 1.01 -0.36 -0.69 116.67 120.11 1fwa s ASP 85 Ca 0.13 0.69 0.02 0.00 0.71 0.00 0.00 52.55 54.10 1fwa s ASP 85 Cb -0.00 -2.14 0.01 0.00 1.01 0.00 0.00 42.92 41.80 1fwa s ASP 85 CO 0.01 0.15 -0.20 -0.63 0.21 0.00 0.00 175.17 174.71 1fwa s ILE 86 N -1.46 2.23 -0.13 0.77 1.01 -0.41 -1.09 121.20 122.11 1fwa s ILE 86 Ca 0.35 -0.93 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 1fwa s ILE 86 Cb -0.13 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 1fwa s ILE 86 CO 0.20 0.54 0.04 -0.83 0.00 0.00 0.00 174.94 174.89 1fwa s GLY 87 N 0.75 1.92 -0.09 6.18 0.00 0.28 -0.69 107.32 115.66 1fwa s GLY 87 Ca -0.08 -0.75 0.03 0.00 0.00 0.00 0.00 44.72 43.91 1fwa s GLY 87 CO -0.00 -0.30 -0.19 0.14 0.00 0.00 0.00 173.10 172.76 1fwa s VAL 88 N -0.42 1.67 -0.02 1.40 1.01 0.07 -0.37 120.40 123.74 1fwa s VAL 88 Ca 0.09 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1fwa s VAL 88 Cb -0.12 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 34.81 1fwa s VAL 88 CO 0.02 0.47 0.03 -0.75 0.00 0.00 0.00 175.10 174.87 1fwa s LYS 89 N 0.61 -0.02 -1.49 2.72 2.20 -0.20 -1.30 119.74 122.26 1fwa s LYS 89 Ca -0.14 0.18 -0.02 0.00 -0.36 0.00 0.00 55.97 55.63 1fwa s LYS 89 Cb -0.17 -0.26 0.00 0.00 -1.51 0.00 0.00 37.83 35.90 1fwa s LYS 89 CO 0.04 -0.16 0.26 -0.25 -0.36 0.00 0.00 175.35 174.88 1fwa n ASP 90 N 4.17 -5.50 0.00 1.43 8.00 -1.26 -2.05 116.55 121.34 1fwa n ASP 90 Ca -0.28 -0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.09 1fwa n ASP 90 Cb 0.50 -4.45 0.00 0.00 -0.02 0.00 0.00 41.12 37.16 1fwa n ASP 90 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fwa n GLY 91 N -1.22 0.69 3.38 0.44 0.00 -1.26 -5.01 105.19 102.21 1fwa n GLY 91 Ca -0.16 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.65 1fwa n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fwa s ARG 92 N -0.16 1.43 -0.20 1.61 0.52 -0.87 -0.49 118.95 120.79 1fwa s ARG 92 Ca 0.00 -1.64 -0.29 0.00 -0.52 0.00 0.00 55.73 53.28 1fwa s ARG 92 Cb 0.00 -1.32 -0.03 0.00 0.52 0.00 0.00 34.95 34.12 1fwa s ARG 92 CO 0.00 0.23 1.59 0.42 0.02 0.00 0.00 175.30 177.56 1fwa s ILE 93 N -2.81 3.73 -0.17 1.52 1.01 -0.08 -1.04 121.20 123.37 1fwa s ILE 93 Ca 0.24 0.84 -0.24 0.00 0.00 0.00 0.00 60.65 61.49 1fwa s ILE 93 Cb -0.02 -3.71 -0.21 0.00 0.01 0.00 0.00 42.46 38.53 1fwa s ILE 93 CO 0.09 -0.26 0.47 0.15 0.00 0.00 0.00 174.94 175.39 1fwa h PHE 94 N 10.38 0.00 -2.36 3.97 3.57 -1.00 0.11 116.94 131.61 1fwa h PHE 94 Ca -0.34 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.25 1fwa h PHE 94 Cb 1.15 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.74 1fwa h PHE 94 CO 0.90 1.16 0.45 0.00 -2.23 0.00 0.00 178.31 178.59 1fwa s ALA 95 N -2.31 -1.79 -0.24 2.41 0.00 -1.07 -4.79 121.76 113.97 1fwa s ALA 95 Ca -0.23 0.96 0.02 0.00 0.00 0.00 0.00 51.96 52.71 1fwa s ALA 95 Cb 0.01 0.45 0.06 0.00 0.00 0.00 0.00 23.12 23.63 1fwa s ALA 95 CO 0.61 -0.68 -0.09 0.42 0.00 0.00 0.00 175.76 176.02 1fwa s ILE 96 N -3.13 1.84 0.00 0.00 1.01 -1.26 -0.56 121.20 119.10 1fwa s ILE 96 Ca 0.04 -1.38 0.00 0.00 0.00 0.00 0.00 60.65 59.31 1fwa s ILE 96 Cb -0.01 -2.01 0.00 0.00 0.01 0.00 0.00 42.46 40.45 1fwa s ILE 96 CO -0.09 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.44 1fwa n GLY 97 N 4.56 1.11 3.13 6.18 0.00 -0.25 -4.96 105.19 114.96 1fwa n GLY 97 Ca -0.13 0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1fwa n GLY 97 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fwa s LYS 98 N 3.99 2.74 0.36 1.61 2.36 -1.26 -1.22 119.74 128.31 1fwa s LYS 98 Ca 0.00 -1.01 -0.04 0.00 -2.55 0.00 0.00 55.97 52.37 1fwa s LYS 98 Cb 0.00 -2.76 -0.04 0.00 -1.05 0.00 0.00 37.83 33.97 1fwa s LYS 98 CO 0.00 -0.36 0.62 0.00 1.55 0.00 0.00 175.35 177.16 1fwa s ALA 99 N 1.24 3.58 0.00 3.13 0.00 -1.26 -0.05 121.76 128.41 1fwa s ALA 99 Ca -0.00 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.32 1fwa s ALA 99 Cb -0.16 -2.33 0.00 0.00 0.00 0.00 0.00 23.12 20.63 1fwa s ALA 99 CO -0.09 0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.10 1fwa n GLY 100 N -1.52 0.23 3.24 0.00 0.00 -0.45 -4.69 105.19 102.00 1fwa n GLY 100 Ca -0.02 -1.41 -0.35 0.00 0.00 0.00 0.00 46.02 44.24 1fwa n GLY 100 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1fwa s ASN 101 N -4.00 4.59 0.65 1.61 2.47 -1.19 -1.61 114.94 117.45 1fwa s ASN 101 Ca 0.00 -0.86 0.42 0.00 0.42 0.00 0.00 52.86 52.84 1fwa s ASN 101 Cb 0.00 -1.73 2.28 0.00 -1.45 0.00 0.00 41.25 40.35 1fwa s ASN 101 CO 0.00 -0.16 2.34 -0.65 -3.72 0.00 0.00 177.10 174.91 1fwa h PRO 102 N 8.07 0.00 -0.30 0.43 0.11 -1.92 -0.06 132.00 138.34 1fwa h PRO 102 Ca -0.31 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.75 1fwa h PRO 102 Cb 1.11 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1fwa h PRO 102 CO 0.58 0.00 -0.01 -0.44 -0.21 0.00 0.00 178.00 177.92 1fwa h ASP 103 N 0.00 0.42 0.00 -2.05 3.32 -1.93 -3.36 116.42 112.82 1fwa h ASP 103 Ca -0.00 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1fwa h ASP 103 Cb 0.03 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.47 1fwa h ASP 103 CO 0.00 0.50 -0.10 2.30 -1.72 0.00 0.00 179.24 180.22 1fwa n ILE 104 N -4.30 0.00 -4.19 0.35 -5.35 -1.03 -5.08 119.36 99.77 1fwa n ILE 104 Ca 0.01 -0.19 -0.29 0.00 -0.27 0.00 0.00 62.75 62.01 1fwa n ILE 104 Cb 0.23 0.84 -0.08 0.00 -1.74 0.00 0.00 39.64 38.89 1fwa n ILE 104 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1fwa s GLN 105 N -0.58 2.36 0.32 6.28 -0.21 -0.06 -5.08 119.66 122.69 1fwa s GLN 105 Ca 0.00 -1.00 -0.04 0.00 0.02 0.00 0.00 55.36 54.34 1fwa s GLN 105 Cb 0.00 -2.40 -0.05 0.00 1.00 0.00 0.00 33.01 31.56 1fwa s GLN 105 CO 0.00 0.50 0.58 -1.25 -2.12 0.00 0.00 175.29 173.00 1fwa s PRO 106 N -2.52 3.61 -1.37 2.91 0.04 -1.26 -4.45 135.00 131.96 1fwa s PRO 106 Ca 0.25 -0.01 -0.00 0.00 0.04 0.00 0.00 61.00 61.28 1fwa s PRO 106 Cb -0.11 -2.62 0.00 0.00 0.04 0.00 0.00 34.50 31.82 1fwa s PRO 106 CO 0.17 0.16 0.04 0.09 0.04 0.00 0.00 177.00 177.50 1fwa n ASN 107 N -1.18 -4.79 -4.67 6.66 4.13 -1.26 -4.94 115.26 109.22 1fwa n ASN 107 Ca -0.02 0.08 -0.43 0.00 1.68 0.00 0.00 54.58 55.89 1fwa n ASN 107 Cb 0.54 -4.02 -0.02 0.00 -1.54 0.00 0.00 39.78 34.75 1fwa n ASN 107 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1fwa s VAL 108 N -2.81 4.54 -0.22 2.41 1.01 -1.26 -4.51 120.40 119.55 1fwa s VAL 108 Ca 0.02 1.85 0.07 0.00 0.00 0.00 0.00 61.98 63.93 1fwa s VAL 108 Cb -0.01 -4.19 -0.09 0.00 0.00 0.00 0.00 36.38 32.08 1fwa s VAL 108 CO 0.03 -0.12 0.26 0.35 0.00 0.00 0.00 175.10 175.61 1fwa n THR 109 N 5.15 0.00 -3.86 3.92 -2.24 0.93 -4.86 114.28 113.33 1fwa n THR 109 Ca 0.12 -0.27 -0.30 0.00 -2.27 0.00 0.00 64.05 61.33 1fwa n THR 109 Cb 0.46 0.75 -0.14 0.00 -2.10 0.00 0.00 70.33 69.31 1fwa n THR 109 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1fwa s ILE 110 N -1.99 1.96 0.12 2.28 1.01 -0.60 -4.91 121.20 119.07 1fwa s ILE 110 Ca 0.01 -2.73 -0.31 0.00 0.00 0.00 0.00 60.65 57.62 1fwa s ILE 110 Cb 0.05 -2.39 -0.08 0.00 0.01 0.00 0.00 42.46 40.05 1fwa s ILE 110 CO 0.30 -0.79 1.40 -2.16 0.00 0.00 0.00 174.94 173.68 1fwa s PRO 111 N 0.29 4.32 -0.19 2.79 0.04 -1.26 -1.34 135.00 139.65 1fwa s PRO 111 Ca 0.16 2.09 -0.07 0.00 0.04 0.00 0.00 61.00 63.21 1fwa s PRO 111 Cb -0.24 -3.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 1fwa s PRO 111 CO -0.03 -0.44 0.06 0.42 0.04 0.00 0.00 177.00 177.04 1fwa s ILE 112 N 1.09 4.66 0.00 0.56 1.01 -0.63 -2.37 121.20 125.51 1fwa s ILE 112 Ca 0.65 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 61.22 1fwa s ILE 112 Cb -0.37 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 38.99 1fwa s ILE 112 CO 0.30 0.44 0.00 0.61 0.00 0.00 0.00 174.94 176.30 1fwa n GLY 113 N 3.73 4.29 0.30 6.18 0.00 -1.26 -0.48 105.19 117.94 1fwa n GLY 113 Ca -0.17 -1.74 0.09 0.00 0.00 0.00 0.00 46.02 44.21 1fwa n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwa h ALA 114 N 1.00 2.02 -0.17 4.61 0.00 -1.78 -1.78 119.26 123.16 1fwa h ALA 114 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fwa h ALA 114 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1fwa h ALA 114 CO 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1fwa n ALA 115 N -2.54 2.48 -2.73 0.00 0.00 -1.26 -4.87 120.51 111.59 1fwa n ALA 115 Ca 0.02 -0.29 -0.36 0.00 0.00 0.00 0.00 53.44 52.80 1fwa n ALA 115 Cb 0.19 -0.99 -0.10 0.00 0.00 0.00 0.00 19.45 18.56 1fwa n ALA 115 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fwa s THR 116 N -1.77 5.17 0.29 0.00 2.01 -0.67 -4.45 115.64 116.22 1fwa s THR 116 Ca 0.11 0.11 -0.05 0.00 0.31 0.00 0.00 61.69 62.17 1fwa s THR 116 Cb 0.06 -3.40 -0.05 0.00 0.01 0.00 0.00 72.50 69.12 1fwa s THR 116 CO 0.08 0.37 0.56 -0.70 -0.69 0.00 0.00 174.62 174.24 1fwa s GLU 117 N 0.93 3.63 -0.05 4.92 2.56 0.60 -4.88 118.70 126.41 1fwa s GLU 117 Ca 0.07 0.01 0.04 0.00 0.00 0.00 0.00 54.97 55.09 1fwa s GLU 117 Cb -0.13 -2.64 -0.00 0.00 2.00 0.00 0.00 34.13 33.36 1fwa s GLU 117 CO 0.03 0.20 -0.18 0.08 -0.56 0.00 0.00 175.26 174.83 1fwa s VAL 118 N -2.10 1.52 -0.16 3.70 1.01 -1.26 -1.48 120.40 121.63 1fwa s VAL 118 Ca 0.44 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1fwa s VAL 118 Cb -0.11 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 34.98 1fwa s VAL 118 CO 0.30 0.44 -0.20 -0.63 0.00 0.00 0.00 175.10 175.00 1fwa s ILE 119 N 0.07 2.02 -0.46 2.22 1.01 -0.29 -4.97 121.20 120.81 1fwa s ILE 119 Ca -0.05 -0.93 -0.26 0.00 0.00 0.00 0.00 60.65 59.40 1fwa s ILE 119 Cb -0.12 -1.81 0.03 0.00 0.01 0.00 0.00 42.46 40.56 1fwa s ILE 119 CO 0.03 0.54 0.96 0.00 0.00 0.00 0.00 174.94 176.47 1fwa s ALA 120 N 1.12 3.24 -1.54 9.38 0.00 -1.26 -1.43 121.76 131.26 1fwa s ALA 120 Ca 0.00 -0.71 0.16 0.00 0.00 0.00 0.00 51.96 51.42 1fwa s ALA 120 Cb -0.14 -3.67 0.40 0.00 0.00 0.00 0.00 23.12 19.70 1fwa s ALA 120 CO -0.09 -2.05 1.32 0.00 0.00 0.00 0.00 175.76 174.94 1fwa n ALA 121 N 7.24 2.31 -1.76 0.00 0.00 -0.13 -4.91 120.51 123.26 1fwa n ALA 121 Ca 0.07 -1.10 -0.42 0.00 0.00 0.00 0.00 53.44 51.99 1fwa n ALA 121 Cb 0.49 -0.64 -0.03 0.00 0.00 0.00 0.00 19.45 19.26 1fwa n ALA 121 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1fwa s GLU 122 N -1.08 4.15 0.00 0.00 1.03 -1.01 -0.73 118.70 121.07 1fwa s GLU 122 Ca 0.32 2.54 0.00 0.00 0.03 0.00 0.00 54.97 57.86 1fwa s GLU 122 Cb 0.17 -3.54 0.00 0.00 -0.80 0.00 0.00 34.13 29.96 1fwa s GLU 122 CO 0.23 -0.81 0.00 0.41 -1.33 0.00 0.00 175.26 173.76 1fwa n GLY 123 N 4.16 0.78 3.50 -3.83 0.00 -1.26 -4.78 105.19 103.76 1fwa n GLY 123 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 1fwa n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fwa s LYS 124 N -0.38 1.81 -0.14 1.61 -0.14 0.10 -4.36 119.74 118.24 1fwa s LYS 124 Ca 0.00 -1.48 -0.05 0.00 -1.36 0.00 0.00 55.97 53.09 1fwa s LYS 124 Cb 0.00 -1.97 -0.03 0.00 -1.68 0.00 0.00 37.83 34.15 1fwa s LYS 124 CO 0.00 0.39 0.02 0.42 -0.76 0.00 0.00 175.35 175.43 1fwa s ILE 125 N -1.92 4.46 -0.08 2.17 1.01 0.17 -2.11 121.20 124.90 1fwa s ILE 125 Ca 0.25 -0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.77 1fwa s ILE 125 Cb -0.07 -2.94 -0.01 0.00 0.01 0.00 0.00 42.46 39.44 1fwa s ILE 125 CO 0.14 0.53 -0.21 -0.69 0.00 0.00 0.00 174.94 174.71 1fwa s VAL 126 N -0.17 2.37 0.24 2.92 1.01 -0.23 -0.03 120.40 126.51 1fwa s VAL 126 Ca 0.06 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.12 1fwa s VAL 126 Cb -0.12 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 1fwa s VAL 126 CO 0.02 0.56 0.07 0.42 0.00 0.00 0.00 175.10 176.16 1fwa s THR 127 N -0.01 0.66 0.70 3.92 -4.23 -0.31 -2.20 115.64 114.16 1fwa s THR 127 Ca -0.07 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.33 1fwa s THR 127 Cb -0.15 -2.51 0.01 0.00 1.34 0.00 0.00 72.50 71.19 1fwa s THR 127 CO 0.05 -0.13 1.06 0.00 -0.54 0.00 0.00 174.62 175.06 1fwa s ALA 128 N -3.68 2.66 0.41 3.99 0.00 -1.26 -1.03 121.76 122.85 1fwa s ALA 128 Ca 0.34 0.10 -0.24 0.00 0.00 0.00 0.00 51.96 52.17 1fwa s ALA 128 Cb 0.07 -3.18 -0.08 0.00 0.00 0.00 0.00 23.12 19.93 1fwa s ALA 128 CO 0.11 -1.24 1.10 0.20 0.00 0.00 0.00 175.76 175.93 1fwa s GLY 129 N -3.74 2.77 0.76 0.00 0.00 -0.86 -4.58 107.32 101.67 1fwa s GLY 129 Ca 0.58 0.81 -0.11 0.00 0.00 0.00 0.00 44.72 46.00 1fwa s GLY 129 CO 0.55 1.26 1.09 -0.32 0.00 0.00 0.00 173.10 175.68 1fwa s GLY 130 N -1.44 1.73 -0.20 0.20 0.00 0.25 -4.65 107.32 103.22 1fwa s GLY 130 Ca 0.59 0.30 -0.02 0.00 0.00 0.00 0.00 44.72 45.59 1fwa s GLY 130 CO 0.31 0.65 0.02 -0.42 0.00 0.00 0.00 173.10 173.66 1fwa s ILE 131 N -2.84 0.70 -0.33 0.90 1.01 0.62 -0.79 121.20 120.48 1fwa s ILE 131 Ca 0.62 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 60.48 1fwa s ILE 131 Cb -0.18 -1.16 -0.02 0.00 0.01 0.00 0.00 42.46 41.11 1fwa s ILE 131 CO 0.54 -0.18 0.22 -0.62 0.00 0.00 0.00 174.94 174.90 1fwa s ASP 132 N 1.78 5.99 -0.19 3.58 -1.08 -0.60 -4.69 116.67 121.45 1fwa s ASP 132 Ca -0.02 -0.36 0.15 0.00 -0.52 0.00 0.00 52.55 51.80 1fwa s ASP 132 Cb -0.17 -2.12 0.75 0.00 -1.46 0.00 0.00 42.92 39.92 1fwa s ASP 132 CO -0.08 -0.20 1.67 0.35 0.52 0.00 0.00 175.17 177.44 1fwa n THR 133 N 5.08 2.44 -3.13 1.71 -2.24 -1.26 -0.90 114.28 115.97 1fwa n THR 133 Ca -0.13 -1.41 -0.21 0.00 -2.27 0.00 0.00 64.05 60.03 1fwa n THR 133 Cb 0.50 -0.15 -0.04 0.00 -2.10 0.00 0.00 70.33 68.54 1fwa n THR 133 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1fwa n HIS 134 N 0.62 1.24 -3.70 4.78 -0.00 -1.12 -4.65 115.22 112.38 1fwa n HIS 134 Ca 0.26 -3.86 -0.37 0.00 -0.00 0.00 0.00 57.72 53.76 1fwa n HIS 134 Cb 1.07 -0.44 -0.07 0.00 -0.00 0.00 0.00 29.99 30.56 1fwa n HIS 134 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1fwa s ILE 135 N -2.85 5.36 -0.37 3.57 -1.09 -0.62 -1.86 121.20 123.35 1fwa s ILE 135 Ca 0.42 0.39 -0.09 0.00 -2.23 0.00 0.00 60.65 59.14 1fwa s ILE 135 Cb 0.31 -3.52 0.04 0.00 -1.58 0.00 0.00 42.46 37.71 1fwa s ILE 135 CO -0.10 0.52 0.17 -1.00 -1.23 0.00 0.00 174.94 173.31 1fwa s HIS 136 N -0.37 3.26 -1.01 3.97 3.76 -1.26 -1.50 115.29 122.14 1fwa s HIS 136 Ca 0.15 -1.23 -0.20 0.00 -0.15 0.00 0.00 55.06 53.64 1fwa s HIS 136 Cb -0.13 -2.44 -0.09 0.00 1.11 0.00 0.00 32.58 31.03 1fwa s HIS 136 CO 0.04 -0.71 2.01 0.91 -0.85 0.00 0.00 174.74 176.14 1fwa n TRP 137 N 4.91 2.50 0.06 1.40 7.02 -0.15 -4.54 117.44 128.64 1fwa n TRP 137 Ca -0.12 -2.16 -0.10 0.00 -1.02 0.00 0.00 57.50 54.10 1fwa n TRP 137 Cb 0.45 -2.04 -0.13 0.00 -2.42 0.00 0.00 31.31 27.17 1fwa n TRP 137 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 1fwa h ILE 138 N 4.47 1.50 -2.23 -0.99 2.04 -1.87 -0.76 117.51 119.68 1fwa h ILE 138 Ca 0.46 -3.19 -0.07 0.00 1.00 0.00 0.00 64.86 63.05 1fwa h ILE 138 Cb 0.68 2.81 -0.19 0.00 -0.74 0.00 0.00 36.82 39.38 1fwa h ILE 138 CO 1.88 0.89 0.09 0.00 0.00 0.00 0.00 178.15 181.01 1fwa h PRO 140 N 3.20 0.00 -0.01 0.00 0.13 -1.98 -3.13 132.00 130.20 1fwa h PRO 140 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1fwa h PRO 140 Cb 1.15 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 1fwa h PRO 140 CO 0.39 0.10 0.04 1.96 -0.23 0.00 0.00 178.00 180.26 1fwa h GLN 141 N 0.00 0.00 -0.53 0.86 7.50 -2.02 -2.16 115.11 118.76 1fwa h GLN 141 Ca -0.00 0.00 0.04 0.00 0.50 0.00 0.00 58.65 59.18 1fwa h GLN 141 Cb 0.55 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.05 1fwa h GLN 141 CO 0.01 0.00 0.35 1.96 -1.50 0.00 0.00 178.83 179.65 1fwa h GLN 142 N 0.00 0.57 -0.86 1.46 4.20 -1.97 -2.78 115.11 115.73 1fwa h GLN 142 Ca 0.00 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 1fwa h GLN 142 Cb 0.08 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 27.70 1fwa h GLN 142 CO -0.00 0.37 0.44 0.00 -0.67 0.00 0.00 178.83 178.97 1fwa h ALA 143 N 1.70 1.10 -0.31 3.87 0.00 -1.65 -1.21 119.26 122.77 1fwa h ALA 143 Ca 0.21 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 1fwa h ALA 143 Cb 0.12 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1fwa h ALA 143 CO -0.06 0.64 -0.47 1.49 0.00 0.00 0.00 179.25 180.86 1fwa h GLU 144 N 1.21 0.83 -0.28 0.00 4.81 -1.69 -0.74 114.58 118.72 1fwa h GLU 144 Ca 0.30 -0.48 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 1fwa h GLU 144 Cb 0.08 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1fwa h GLU 144 CO -0.04 1.11 0.18 1.49 -0.73 0.00 0.00 179.01 181.02 1fwa h GLU 145 N 0.65 0.37 -0.41 1.92 4.57 -1.32 -1.05 114.58 119.32 1fwa h GLU 145 Ca 0.03 -0.02 -0.09 0.00 -1.18 0.00 0.00 59.36 58.10 1fwa h GLU 145 Cb 1.06 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.55 1fwa h GLU 145 CO 0.10 0.25 -0.10 0.00 -1.18 0.00 0.00 179.01 178.08 1fwa h ALA 146 N 1.09 0.56 -0.53 2.92 0.00 -1.18 -2.65 119.26 119.47 1fwa h ALA 146 Ca 0.10 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.69 1fwa h ALA 146 Cb -0.03 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1fwa h ALA 146 CO -0.02 0.44 0.35 1.25 0.00 0.00 0.00 179.25 181.27 1fwa h LEU 147 N 0.60 0.60 -1.76 0.00 5.85 -0.93 -0.82 115.31 118.85 1fwa h LEU 147 Ca 0.10 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1fwa h LEU 147 Cb 0.63 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 1fwa h LEU 147 CO 0.04 0.44 0.02 0.58 -0.34 0.00 0.00 178.44 179.18 1fwa h VAL 148 N 0.71 1.07 0.00 1.05 2.07 -1.14 -1.63 116.25 118.39 1fwa h VAL 148 Ca 0.19 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1fwa h VAL 148 Cb -0.08 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1fwa h VAL 148 CO -0.04 0.09 0.00 0.77 0.02 0.00 0.00 177.57 178.40 1fwa h SER 149 N 0.17 0.00 0.00 0.57 4.64 -0.97 -3.39 113.55 114.57 1fwa h SER 149 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1fwa h SER 149 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1fwa h SER 149 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1fwa n GLY 150 N 0.90 1.43 3.57 -0.77 0.00 -0.61 -4.83 105.19 104.88 1fwa n GLY 150 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1fwa n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fwa s VAL 151 N -2.00 5.07 -1.06 1.61 1.01 -0.39 -0.58 120.40 124.05 1fwa s VAL 151 Ca 0.00 0.09 0.14 0.00 0.00 0.00 0.00 61.98 62.21 1fwa s VAL 151 Cb 0.00 -3.39 -0.06 0.00 0.00 0.00 0.00 36.38 32.92 1fwa s VAL 151 CO 0.00 0.30 0.72 0.35 0.00 0.00 0.00 175.10 176.47 1fwa n THR 152 N 4.80 0.00 -4.31 3.92 -2.24 0.03 -3.30 114.28 113.18 1fwa n THR 152 Ca -0.15 -0.28 -0.21 0.00 -2.27 0.00 0.00 64.05 61.15 1fwa n THR 152 Cb 0.52 1.10 -0.16 0.00 -2.10 0.00 0.00 70.33 69.69 1fwa n THR 152 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1fwa s THR 153 N -2.00 0.71 -0.11 4.28 2.01 -0.98 -0.81 115.64 118.75 1fwa s THR 153 Ca 0.09 -0.26 -0.01 0.00 0.31 0.00 0.00 61.69 61.82 1fwa s THR 153 Cb 0.11 -0.68 0.03 0.00 0.01 0.00 0.00 72.50 71.97 1fwa s THR 153 CO 0.45 0.25 -0.07 -0.04 -0.69 0.00 0.00 174.62 174.52 1fwa s MET 154 N 0.59 1.42 -0.11 4.92 -1.94 0.26 -1.56 119.30 122.87 1fwa s MET 154 Ca -0.09 -0.21 0.01 0.00 -1.71 0.00 0.00 55.69 53.69 1fwa s MET 154 Cb -0.12 -1.52 -0.01 0.00 2.01 0.00 0.00 34.83 35.19 1fwa s MET 154 CO 0.01 -0.27 -0.16 0.08 -0.01 0.00 0.00 175.02 174.66 1fwa s VAL 155 N 1.74 2.77 -0.79 -6.03 1.01 -0.08 -2.83 120.40 116.18 1fwa s VAL 155 Ca 0.05 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1fwa s VAL 155 Cb -0.13 -2.13 0.00 0.00 0.00 0.00 0.00 36.38 34.12 1fwa s VAL 155 CO -0.08 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.17 1fwa n GLY 156 N 3.43 -0.57 3.34 4.51 0.00 -1.08 -1.58 105.19 113.23 1fwa n GLY 156 Ca -0.18 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 1fwa n GLY 156 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fwa s GLY 157 N 0.00 -0.07 0.00 -0.02 0.00 -0.56 -0.73 107.32 105.93 1fwa s GLY 157 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.42 1fwa s GLY 157 CO 0.00 -0.46 0.00 0.61 0.00 0.00 0.00 173.10 173.25 1fwa n GLY 158 N -0.21 1.98 0.00 0.20 0.00 -1.13 -0.98 105.19 105.04 1fwa n GLY 158 Ca -0.14 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.51 1fwa n GLY 158 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fwa n THR 159 N -1.37 0.10 0.00 2.61 -2.24 -1.23 -4.58 114.28 107.58 1fwa n THR 159 Ca 0.00 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1fwa n THR 159 Cb 0.00 1.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.63 1fwa n THR 159 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fwa n GLY 160 N -0.05 0.62 2.60 3.38 0.00 -0.29 -4.88 105.19 106.56 1fwa n GLY 160 Ca 0.00 -2.16 -0.35 0.00 0.00 0.00 0.00 46.02 43.51 1fwa n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fwa n PRO 161 N 0.00 2.75 -4.19 1.61 -0.04 -0.70 -4.42 135.00 130.01 1fwa n PRO 161 Ca 0.00 -2.02 -0.27 0.00 -0.04 0.00 0.00 63.50 61.17 1fwa n PRO 161 Cb 0.00 -2.82 -0.08 0.00 -0.04 0.00 0.00 33.50 30.56 1fwa n PRO 161 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fwa s ALA 162 N 3.14 3.20 0.25 0.55 0.00 -1.26 -4.98 121.76 122.67 1fwa s ALA 162 Ca 0.55 -1.32 -0.02 0.00 0.00 0.00 0.00 51.96 51.16 1fwa s ALA 162 Cb 0.14 -1.02 0.50 0.00 0.00 0.00 0.00 23.12 22.74 1fwa s ALA 162 CO -0.03 0.53 1.74 0.00 0.00 0.00 0.00 175.76 178.00 1fwa h ALA 163 N 2.87 1.17 -0.77 0.00 0.00 -1.99 0.08 119.26 120.62 1fwa h ALA 163 Ca -0.47 0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.56 1fwa h ALA 163 Cb 1.19 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 1fwa h ALA 163 CO 0.58 -0.16 0.50 0.78 0.00 0.00 0.00 179.25 180.95 1fwa h GLY 164 N 0.53 1.10 1.99 0.00 0.00 -1.94 -2.67 103.07 102.08 1fwa h GLY 164 Ca 0.44 -0.39 -0.18 0.00 0.00 0.00 0.00 47.33 47.20 1fwa h GLY 164 CO -0.39 0.36 -0.85 -0.84 0.00 0.00 0.00 176.54 174.83 1fwa h THR 165 N 1.01 1.61 -0.72 4.70 2.02 -1.55 0.39 112.91 120.36 1fwa h THR 165 Ca 0.29 -2.90 0.00 0.00 0.77 0.00 0.00 66.41 64.58 1fwa h THR 165 Cb -0.06 2.57 -0.04 0.00 -1.74 0.00 0.00 68.15 68.88 1fwa h THR 165 CO -0.08 0.83 0.47 0.45 0.37 0.00 0.00 175.52 177.55 1fwa h HIS 166 N 0.00 0.92 0.03 3.16 3.86 -0.70 -3.22 115.15 119.20 1fwa h HIS 166 Ca -0.01 0.02 -0.36 0.00 -1.16 0.00 0.00 60.37 58.86 1fwa h HIS 166 Cb 1.50 -0.31 -0.05 0.00 1.06 0.00 0.00 27.41 29.61 1fwa h HIS 166 CO 0.00 0.59 -2.17 0.00 0.86 0.00 0.00 177.93 177.21 1fwa n ALA 167 N -2.43 1.34 -2.48 2.45 0.00 -1.03 -4.62 120.51 113.74 1fwa n ALA 167 Ca 0.08 -0.97 -0.19 0.00 0.00 0.00 0.00 53.44 52.36 1fwa n ALA 167 Cb 0.04 -0.43 -0.11 0.00 0.00 0.00 0.00 19.45 18.96 1fwa n ALA 167 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1fwa s THR 168 N -2.54 1.44 -1.29 0.00 -4.23 0.12 -4.98 115.64 104.16 1fwa s THR 168 Ca -0.19 -1.78 -0.07 0.00 -1.18 0.00 0.00 61.69 58.48 1fwa s THR 168 Cb 0.07 -1.62 0.15 0.00 1.34 0.00 0.00 72.50 72.45 1fwa s THR 168 CO 0.75 -0.40 2.14 0.35 -0.54 0.00 0.00 174.62 176.92 1fwa n THR 169 N 0.45 4.90 -4.56 3.99 -2.24 -1.26 -4.17 114.28 111.39 1fwa n THR 169 Ca -0.15 -4.44 -0.23 0.00 -2.27 0.00 0.00 64.05 56.96 1fwa n THR 169 Cb 0.57 -2.18 -0.16 0.00 -2.10 0.00 0.00 70.33 66.46 1fwa n THR 169 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fwa s THR 171 N 0.40 3.89 -0.15 0.00 2.01 -0.70 -2.83 115.64 118.27 1fwa s THR 171 Ca -0.09 -2.36 -0.29 0.00 0.31 0.00 0.00 61.69 59.26 1fwa s THR 171 Cb -0.13 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.78 1fwa s THR 171 CO 0.02 -0.81 1.69 -2.84 -0.69 0.00 0.00 174.62 171.99 1fwa s PRO 172 N 0.66 3.89 0.34 4.92 0.02 -1.26 -3.98 135.00 139.59 1fwa s PRO 172 Ca 0.12 1.92 0.00 0.00 0.02 0.00 0.00 61.00 63.06 1fwa s PRO 172 Cb -0.22 -4.05 0.00 0.00 0.02 0.00 0.00 34.50 30.25 1fwa s PRO 172 CO -0.03 -1.19 0.00 0.41 -0.33 0.00 0.00 177.00 175.86 1fwa n GLY 173 N 4.56 -2.85 0.30 0.52 0.00 -1.26 -4.10 105.19 102.35 1fwa n GLY 173 Ca 0.19 -1.23 0.11 0.00 0.00 0.00 0.00 46.02 45.09 1fwa n GLY 173 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1fwa h PRO 174 N -0.81 0.31 0.30 1.61 0.11 -1.91 0.24 132.00 131.86 1fwa h PRO 174 Ca -0.10 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 1fwa h PRO 174 Cb 0.79 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1fwa h PRO 174 CO 0.04 0.20 -0.15 2.35 -0.21 0.00 0.00 178.00 180.24 1fwa h TRP 175 N 0.32 -0.38 -0.39 0.65 7.01 -2.00 -0.63 115.95 120.53 1fwa h TRP 175 Ca 0.51 -0.01 -0.07 0.00 2.11 0.00 0.00 58.89 61.44 1fwa h TRP 175 Cb 0.96 0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 28.13 1fwa h TRP 175 CO -0.21 -0.07 -0.04 1.88 -2.79 0.00 0.00 178.44 177.21 1fwa h TYR 176 N -0.71 0.67 -0.13 2.65 -1.99 -1.65 -1.49 116.97 114.33 1fwa h TYR 176 Ca -0.04 -0.09 -0.01 0.00 2.00 0.00 0.00 58.73 60.59 1fwa h TYR 176 Cb 0.48 -0.19 -0.01 0.00 2.00 0.00 0.00 36.73 39.02 1fwa h TYR 176 CO 0.02 0.67 0.05 0.82 -0.00 0.00 0.00 178.16 179.72 1fwa h ILE 177 N 0.60 1.14 -0.55 -2.88 2.04 -0.92 -0.86 117.51 116.08 1fwa h ILE 177 Ca 0.12 -0.42 0.04 0.00 1.00 0.00 0.00 64.86 65.59 1fwa h ILE 177 Cb 0.44 1.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 1fwa h ILE 177 CO 0.02 0.13 0.31 0.28 0.00 0.00 0.00 178.15 178.89 1fwa h SER 178 N 0.06 0.48 -0.74 1.72 0.02 -0.91 -0.66 113.55 113.52 1fwa h SER 178 Ca 0.04 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 1fwa h SER 178 Cb 0.16 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.58 1fwa h SER 178 CO -0.00 0.33 0.43 -0.09 -1.14 0.00 0.00 176.83 176.36 1fwa h ARG 179 N 0.61 1.02 0.00 3.45 9.65 -1.02 -2.11 114.38 125.97 1fwa h ARG 179 Ca 0.23 -0.10 -0.14 0.00 -1.10 0.00 0.00 59.98 58.87 1fwa h ARG 179 Cb 0.08 -0.21 -0.02 0.00 -1.39 0.00 0.00 29.97 28.44 1fwa h ARG 179 CO -0.13 0.74 -0.65 0.52 2.80 0.00 0.00 179.97 183.25 1fwa h MET 180 N 1.02 0.00 -0.41 0.20 2.86 -0.78 -1.71 114.93 116.11 1fwa h MET 180 Ca 0.26 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.78 1fwa h MET 180 Cb -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1fwa h MET 180 CO -0.05 0.65 -0.24 -0.07 1.06 0.00 0.00 176.91 178.26 1fwa h LEU 181 N 0.00 0.86 -0.37 1.22 3.38 -0.80 -0.91 115.31 118.68 1fwa h LEU 181 Ca -0.01 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.55 1fwa h LEU 181 Cb 1.19 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1fwa h LEU 181 CO 0.08 1.06 -0.14 1.56 0.09 0.00 0.00 178.44 181.09 1fwa h GLN 182 N 0.72 0.75 -0.12 1.13 4.20 -1.25 -2.97 115.11 117.57 1fwa h GLN 182 Ca 0.09 -0.31 -0.07 0.00 0.06 0.00 0.00 58.65 58.42 1fwa h GLN 182 Cb 0.78 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 1fwa h GLN 182 CO 0.06 0.92 -0.23 0.00 -0.67 0.00 0.00 178.83 178.91 1fwa h ALA 183 N 0.81 1.38 -0.35 3.87 0.00 -1.21 -2.97 119.26 120.79 1fwa h ALA 183 Ca 0.09 -0.28 0.09 0.00 0.00 0.00 0.00 54.91 54.81 1fwa h ALA 183 Cb 0.68 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1fwa h ALA 183 CO 0.05 0.43 0.25 0.00 0.00 0.00 0.00 179.25 179.98 1fwa h ALA 184 N 1.57 2.24 -0.03 0.00 0.00 -0.99 -1.62 119.26 120.44 1fwa h ALA 184 Ca 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1fwa h ALA 184 Cb 0.52 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1fwa h ALA 184 CO 0.04 -0.34 0.04 -0.44 0.00 0.00 0.00 179.25 178.55 1fwa h ASP 185 N 0.07 0.00 1.00 0.00 3.45 -1.60 -1.09 116.42 118.25 1fwa h ASP 185 Ca 0.17 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.63 1fwa h ASP 185 Cb 0.58 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.35 1fwa h ASP 185 CO -0.01 0.00 -0.15 -1.20 -1.57 0.00 0.00 179.24 176.31 1fwa n SER 186 N -3.55 0.33 -4.76 6.45 7.64 -0.61 -4.71 113.62 114.42 1fwa n SER 186 Ca -0.02 0.35 -0.36 0.00 1.01 0.00 0.00 58.87 59.85 1fwa n SER 186 Cb 0.12 -0.37 -0.08 0.00 -1.01 0.00 0.00 64.21 62.88 1fwa n SER 186 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1fwa s LEU 187 N -3.45 4.11 0.00 -3.43 1.43 -0.41 -5.01 118.68 111.91 1fwa s LEU 187 Ca 0.12 0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.50 1fwa s LEU 187 Cb 0.17 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.37 1fwa s LEU 187 CO 0.59 0.29 0.73 -0.81 0.23 0.00 0.00 176.35 177.38 1fwa n PRO 188 N 2.76 0.77 -4.21 1.29 -0.04 -1.26 -4.81 135.00 129.49 1fwa n PRO 188 Ca -0.18 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.16 1fwa n PRO 188 Cb 0.53 -1.14 -0.10 0.00 -0.04 0.00 0.00 33.50 32.75 1fwa n PRO 188 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1fwa s VAL 189 N 0.10 0.89 0.26 0.52 -7.23 -1.26 -5.01 120.40 108.67 1fwa s VAL 189 Ca 0.00 -1.99 -0.30 0.00 -1.81 0.00 0.00 61.98 57.88 1fwa s VAL 189 Cb 0.00 -1.80 -0.09 0.00 0.56 0.00 0.00 36.38 35.05 1fwa s VAL 189 CO 0.00 -0.78 1.05 0.20 -0.31 0.00 0.00 175.10 175.26 1fwa s ASN 190 N -3.11 7.39 0.01 4.85 0.01 0.01 -4.60 114.94 119.51 1fwa s ASN 190 Ca 0.15 2.15 0.03 0.00 -0.71 0.00 0.00 52.86 54.49 1fwa s ASN 190 Cb 0.04 -2.62 -0.01 0.00 0.41 0.00 0.00 41.25 39.07 1fwa s ASN 190 CO -0.02 -0.05 -0.10 -0.63 -1.51 0.00 0.00 177.10 174.80 1fwa s ILE 191 N -1.11 0.78 -0.00 0.60 1.01 -0.62 -0.58 121.20 121.30 1fwa s ILE 191 Ca 0.44 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 60.46 1fwa s ILE 191 Cb -0.30 -0.70 -0.00 0.00 0.01 0.00 0.00 42.46 41.47 1fwa s ILE 191 CO 0.38 0.07 -0.01 -0.83 0.00 0.00 0.00 174.94 174.55 1fwa s GLY 192 N -0.62 0.04 0.12 6.18 0.00 -1.13 -0.99 107.32 110.91 1fwa s GLY 192 Ca 0.01 -0.04 0.05 0.00 0.00 0.00 0.00 44.72 44.75 1fwa s GLY 192 CO 0.00 -0.03 0.03 1.08 0.00 0.00 0.00 173.10 174.18 1fwa s LEU 193 N -0.03 3.54 -0.10 0.66 1.43 -1.26 -2.64 118.68 120.28 1fwa s LEU 193 Ca 0.00 -0.19 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1fwa s LEU 193 Cb -0.00 -2.22 -0.02 0.00 0.03 0.00 0.00 46.19 43.97 1fwa s LEU 193 CO -0.00 0.14 -0.11 -0.76 0.23 0.00 0.00 176.35 175.85 1fwa s LEU 194 N -2.58 2.89 0.63 1.79 1.43 0.09 -0.25 118.68 122.67 1fwa s LEU 194 Ca 0.27 -0.20 0.04 0.00 -1.03 0.00 0.00 54.13 53.22 1fwa s LEU 194 Cb -0.11 -1.63 0.10 0.00 0.03 0.00 0.00 46.19 44.57 1fwa s LEU 194 CO 0.20 0.26 0.87 -0.83 0.23 0.00 0.00 176.35 177.07 1fwa s GLY 195 N -0.21 1.77 -0.44 -3.19 0.00 -0.16 -1.71 107.32 103.39 1fwa s GLY 195 Ca 0.01 -1.86 -0.26 0.00 0.00 0.00 0.00 44.72 42.61 1fwa s GLY 195 CO 0.03 -1.38 0.95 1.25 0.00 0.00 0.00 173.10 173.95 1fwa s LYS 196 N -4.87 3.65 0.00 2.90 2.20 -1.26 -4.50 119.74 117.86 1fwa s LYS 196 Ca 0.63 0.33 0.28 0.00 -0.36 0.00 0.00 55.97 56.85 1fwa s LYS 196 Cb -0.06 -3.89 0.99 0.00 -1.51 0.00 0.00 37.83 33.36 1fwa s LYS 196 CO 0.41 -1.16 1.71 0.41 -0.36 0.00 0.00 175.35 176.36 1fwa n GLY 197 N 4.76 -0.34 3.57 5.54 0.00 -1.26 -4.77 105.19 112.68 1fwa n GLY 197 Ca 0.07 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 1fwa n GLY 197 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fwa s ASN 198 N -2.23 6.54 0.01 1.61 -0.87 -1.26 -4.53 114.94 114.21 1fwa s ASN 198 Ca 0.33 -1.89 -0.27 0.00 -1.57 0.00 0.00 52.86 49.45 1fwa s ASN 198 Cb 0.20 -2.58 0.07 0.00 -0.02 0.00 0.00 41.25 38.92 1fwa s ASN 198 CO 0.42 -1.47 0.62 -0.69 -2.57 0.00 0.00 177.10 173.41 1fwa s VAL 199 N 5.11 0.01 -0.53 1.60 1.01 -1.26 -4.99 120.40 121.34 1fwa s VAL 199 Ca 0.52 -0.06 0.15 0.00 0.00 0.00 0.00 61.98 62.59 1fwa s VAL 199 Cb 0.02 -0.98 0.54 0.00 0.00 0.00 0.00 36.38 35.96 1fwa s VAL 199 CO -0.00 -0.03 1.46 -1.20 0.00 0.00 0.00 175.10 175.32 1fwa n SER 200 N 0.59 4.02 -4.01 3.32 7.64 -1.26 -4.50 113.62 119.43 1fwa n SER 200 Ca -0.19 -2.67 -0.31 0.00 1.01 0.00 0.00 58.87 56.71 1fwa n SER 200 Cb 0.59 -0.49 -0.15 0.00 -1.01 0.00 0.00 64.21 63.15 1fwa n SER 200 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1fwa s GLN 201 N -2.22 1.78 0.25 1.43 2.00 -1.26 -5.01 119.66 116.62 1fwa s GLN 201 Ca 0.41 -1.43 -0.06 0.00 -2.00 0.00 0.00 55.36 52.27 1fwa s GLN 201 Cb 0.30 -2.88 0.45 0.00 0.80 0.00 0.00 33.01 31.68 1fwa s GLN 201 CO 0.14 -0.72 1.64 -1.35 -0.50 0.00 0.00 175.29 174.50 1fwa h PRO 202 N 7.77 0.12 -0.46 1.67 0.11 -1.91 -1.54 132.00 137.76 1fwa h PRO 202 Ca -0.14 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.05 1fwa h PRO 202 Cb 1.04 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.09 1fwa h PRO 202 CO 0.47 0.08 0.32 -0.44 -0.21 0.00 0.00 178.00 178.22 1fwa h ASP 203 N 0.13 0.23 0.67 -2.05 3.32 -1.98 0.17 116.42 116.91 1fwa h ASP 203 Ca 0.42 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.45 1fwa h ASP 203 Cb 0.74 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.24 1fwa h ASP 203 CO -0.64 0.14 -0.10 0.00 -1.72 0.00 0.00 179.24 176.92 1fwa h ALA 204 N 1.76 1.09 0.10 3.45 0.00 -1.72 -1.90 119.26 122.05 1fwa h ALA 204 Ca 0.21 -0.09 -0.31 0.00 0.00 0.00 0.00 54.91 54.72 1fwa h ALA 204 Cb 0.51 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1fwa h ALA 204 CO -0.04 0.13 -1.63 -0.07 0.00 0.00 0.00 179.25 177.64 1fwa h LEU 205 N 0.00 0.33 -1.34 0.00 3.38 -1.11 -3.34 115.31 113.23 1fwa h LEU 205 Ca -0.00 -0.83 0.06 0.00 0.09 0.00 0.00 57.88 57.20 1fwa h LEU 205 Cb 0.47 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 1fwa h LEU 205 CO 0.01 1.70 0.49 0.03 0.09 0.00 0.00 178.44 180.76 1fwa h ARG 206 N -0.28 0.78 -0.57 1.13 3.08 -0.93 -1.47 114.38 116.12 1fwa h ARG 206 Ca -0.36 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 59.64 1fwa h ARG 206 Cb 1.79 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 31.64 1fwa h ARG 206 CO 0.02 0.52 0.34 0.93 -1.07 0.00 0.00 179.97 180.70 1fwa h GLU 207 N 0.80 0.77 -0.48 0.04 5.08 -1.50 0.10 114.58 119.40 1fwa h GLU 207 Ca 0.32 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.55 1fwa h GLU 207 Cb 0.24 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1fwa h GLU 207 CO -0.11 0.56 0.05 1.96 -1.00 0.00 0.00 179.01 180.47 1fwa h GLN 208 N 0.76 0.81 -0.47 2.33 4.20 -1.43 -0.77 115.11 120.54 1fwa h GLN 208 Ca 0.20 -0.23 -0.07 0.00 0.06 0.00 0.00 58.65 58.61 1fwa h GLN 208 Cb -0.01 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 1fwa h GLN 208 CO -0.04 0.83 0.03 0.28 -0.67 0.00 0.00 178.83 179.26 1fwa h VAL 209 N 0.67 1.26 0.00 -0.54 2.07 -1.05 -2.28 116.25 116.37 1fwa h VAL 209 Ca 0.14 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 1fwa h VAL 209 Cb 0.43 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1fwa h VAL 209 CO 0.01 0.35 -0.11 0.00 0.02 0.00 0.00 177.57 177.85 1fwa h ALA 210 N 0.93 1.27 0.00 1.67 0.00 -0.65 -1.91 119.26 120.58 1fwa h ALA 210 Ca 0.14 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1fwa h ALA 210 Cb 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1fwa h ALA 210 CO 0.02 0.13 -0.07 0.00 0.00 0.00 0.00 179.25 179.33 1fwa h ALA 211 N 1.89 0.96 0.00 0.00 0.00 -0.57 -3.35 119.26 118.19 1fwa h ALA 211 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fwa h ALA 211 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1fwa h ALA 211 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1fwa n GLY 212 N 1.17 0.75 3.76 0.00 0.00 -0.72 -4.71 105.19 105.46 1fwa n GLY 212 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1fwa n GLY 212 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fwa s VAL 213 N 0.00 2.81 -2.26 1.61 -7.23 -1.16 -3.80 120.40 110.37 1fwa s VAL 213 Ca 0.00 0.60 0.23 0.00 -1.81 0.00 0.00 61.98 61.00 1fwa s VAL 213 Cb 0.00 -3.31 0.49 0.00 0.56 0.00 0.00 36.38 34.13 1fwa s VAL 213 CO 0.00 -0.01 1.44 2.30 -0.31 0.00 0.00 175.10 178.52 1fwa n ILE 214 N -0.66 0.68 -3.68 -0.62 -5.35 0.65 -4.00 119.36 106.38 1fwa n ILE 214 Ca 0.08 -0.84 0.01 0.00 -0.27 0.00 0.00 62.75 61.73 1fwa n ILE 214 Cb 0.47 0.82 -0.00 0.00 -1.74 0.00 0.00 39.64 39.19 1fwa n ILE 214 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1fwa s GLY 215 N -1.31 -0.35 0.00 3.28 0.00 -1.21 -2.86 107.32 104.88 1fwa s GLY 215 Ca 0.42 0.53 0.00 0.00 0.00 0.00 0.00 44.72 45.66 1fwa s GLY 215 CO 0.32 0.85 0.00 1.04 0.00 0.00 0.00 173.10 175.31 1fwa n LEU 216 N -0.55 0.00 -3.48 0.66 4.77 0.09 -0.98 117.00 117.51 1fwa n LEU 216 Ca -0.07 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.92 1fwa n LEU 216 Cb 0.62 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.67 1fwa n LEU 216 CO 0.13 0.00 0.42 -0.63 -1.33 0.00 0.00 177.39 175.98 1fwa s ILE 218 N 0.28 -0.75 -0.01 -0.08 1.09 -0.06 -1.45 121.20 120.23 1fwa s ILE 218 Ca 0.00 0.00 0.06 0.00 -1.10 0.00 0.00 60.65 59.61 1fwa s ILE 218 Cb 0.00 -1.00 -0.02 0.00 -1.06 0.00 0.00 42.46 40.38 1fwa s ILE 218 CO 0.00 0.00 -0.19 -2.28 -0.10 0.00 0.00 174.94 172.37 1fwa s HIS 219 N 2.70 1.66 0.47 3.97 2.46 -1.26 -1.01 115.29 124.29 1fwa s HIS 219 Ca -0.02 -0.32 0.14 0.00 0.47 0.00 0.00 55.06 55.33 1fwa s HIS 219 Cb -0.10 -1.06 1.09 0.00 -0.13 0.00 0.00 32.58 32.39 1fwa s HIS 219 CO -0.18 -0.02 2.06 1.05 -2.47 0.00 0.00 174.74 175.18 1fwa h GLU 220 N 5.61 0.04 0.00 2.88 4.11 -1.70 -1.89 114.58 123.64 1fwa h GLU 220 Ca -0.38 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.04 1fwa h GLU 220 Cb 1.15 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 1fwa h GLU 220 CO 0.48 0.13 -0.04 -0.44 0.07 0.00 0.00 179.01 179.21 1fwa h ASP 221 N 0.04 0.00 -0.26 3.06 5.19 -1.93 0.42 116.42 122.94 1fwa h ASP 221 Ca 0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1fwa h ASP 221 Cb 0.17 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.68 1fwa h ASP 221 CO 0.01 0.04 0.00 0.79 -3.12 0.00 0.00 179.24 176.96 1fwa n TRP 222 N -3.46 0.33 -0.29 4.55 7.02 -0.75 -5.02 117.44 119.82 1fwa n TRP 222 Ca -0.02 -0.24 0.00 0.00 -1.02 0.00 0.00 57.50 56.21 1fwa n TRP 222 Cb 0.15 -0.01 0.00 0.00 -2.42 0.00 0.00 31.31 29.03 1fwa n TRP 222 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1fwa n GLY 223 N 0.94 -0.73 2.58 6.99 0.00 0.14 -4.89 105.19 110.21 1fwa n GLY 223 Ca 0.13 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 45.10 1fwa n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwa n ALA 224 N 0.01 6.44 -2.34 4.61 0.00 -1.23 -4.83 120.51 123.17 1fwa n ALA 224 Ca 0.00 -4.17 -0.28 0.00 0.00 0.00 0.00 53.44 48.98 1fwa n ALA 224 Cb 0.00 -2.78 -0.02 0.00 0.00 0.00 0.00 19.45 16.65 1fwa n ALA 224 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1fwa s THR 225 N -1.01 4.91 0.37 0.00 -4.23 -1.26 -4.38 115.64 110.04 1fwa s THR 225 Ca 0.50 0.25 0.11 0.00 -1.18 0.00 0.00 61.69 61.37 1fwa s THR 225 Cb 0.16 -3.78 0.34 0.00 1.34 0.00 0.00 72.50 70.56 1fwa s THR 225 CO -0.07 -0.56 1.86 -0.65 -0.54 0.00 0.00 174.62 174.66 1fwa h PRO 226 N 1.05 0.59 -0.14 3.99 0.11 -1.93 -0.55 132.00 135.12 1fwa h PRO 226 Ca -0.47 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1fwa h PRO 226 Cb 1.20 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1fwa h PRO 226 CO 0.64 0.39 0.02 0.00 -0.21 0.00 0.00 178.00 178.83 1fwa h ALA 227 N 1.61 0.18 -0.46 -0.75 0.00 -1.97 -0.92 119.26 116.95 1fwa h ALA 227 Ca 0.47 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1fwa h ALA 227 Cb 0.87 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1fwa h ALA 227 CO -0.21 -0.15 0.20 0.00 0.00 0.00 0.00 179.25 179.09 1fwa h ALA 228 N 0.79 0.59 -0.35 0.00 0.00 -1.55 -1.26 119.26 117.49 1fwa h ALA 228 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1fwa h ALA 228 Cb 0.31 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1fwa h ALA 228 CO 0.00 0.18 0.22 0.82 0.00 0.00 0.00 179.25 180.48 1fwa h ILE 229 N 0.60 1.10 -0.62 0.00 2.04 -1.08 -0.97 117.51 118.57 1fwa h ILE 229 Ca 0.15 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 1fwa h ILE 229 Cb 0.16 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 1fwa h ILE 229 CO -0.02 0.09 0.32 -0.78 0.00 0.00 0.00 178.15 177.77 1fwa h ASP 230 N 0.46 0.80 -0.14 1.72 -0.00 -0.98 -1.82 116.42 116.46 1fwa h ASP 230 Ca 0.13 -0.11 -0.00 0.00 -0.00 0.00 0.00 57.03 57.04 1fwa h ASP 230 Cb -0.04 -0.20 -0.01 0.00 -0.00 0.00 0.00 39.33 39.08 1fwa h ASP 230 CO -0.03 0.69 0.09 0.00 -0.00 0.00 0.00 179.24 179.99 1fwa h ALA 232 N 1.02 0.74 -0.23 0.00 0.00 -1.03 -2.26 119.26 117.50 1fwa h ALA 232 Ca 0.05 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1fwa h ALA 232 Cb 0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1fwa h ALA 232 CO -0.01 0.26 -0.16 -0.07 0.00 0.00 0.00 179.25 179.27 1fwa h LEU 233 N 0.78 0.38 -0.34 0.00 3.38 -1.17 -0.26 115.31 118.08 1fwa h LEU 233 Ca 0.20 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 1fwa h LEU 233 Cb 0.05 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1fwa h LEU 233 CO -0.03 0.57 0.04 0.74 0.09 0.00 0.00 178.44 179.85 1fwa h THR 234 N 0.36 1.24 -0.44 0.22 2.02 -0.80 -0.39 112.91 115.13 1fwa h THR 234 Ca 0.07 -0.86 -0.13 0.00 0.77 0.00 0.00 66.41 66.26 1fwa h THR 234 Cb 0.50 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1fwa h THR 234 CO 0.03 0.29 -0.23 0.58 0.37 0.00 0.00 175.52 176.56 1fwa h VAL 235 N 0.40 1.27 -0.82 3.16 2.07 -1.16 -2.72 116.25 118.45 1fwa h VAL 235 Ca 0.10 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 1fwa h VAL 235 Cb 0.37 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 1fwa h VAL 235 CO 0.01 0.47 0.48 0.00 0.02 0.00 0.00 177.57 178.55 1fwa h ALA 236 N 0.96 1.04 -0.04 1.67 0.00 -0.87 -0.52 119.26 121.50 1fwa h ALA 236 Ca 0.10 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1fwa h ALA 236 Cb 0.78 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1fwa h ALA 236 CO 0.06 0.51 -0.13 -0.44 0.00 0.00 0.00 179.25 179.26 1fwa h ASP 237 N 1.12 0.06 0.68 0.00 3.32 -0.83 -1.29 116.42 119.47 1fwa h ASP 237 Ca 0.29 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.24 1fwa h ASP 237 Cb -0.03 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1fwa h ASP 237 CO -0.05 0.20 -1.40 -1.84 -1.72 0.00 0.00 179.24 174.43 1fwa n GLU 238 N -4.35 0.62 -0.08 3.56 0.28 -0.80 -4.34 120.64 115.53 1fwa n GLU 238 Ca -0.02 0.11 0.08 0.00 -0.16 0.00 0.00 57.16 57.17 1fwa n GLU 238 Cb 0.22 -1.76 0.11 0.00 1.43 0.00 0.00 31.44 31.45 1fwa n GLU 238 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 1fwa n MET 239 N -2.71 1.71 -3.53 3.44 2.81 -0.27 -5.01 117.12 113.56 1fwa n MET 239 Ca -0.07 -1.71 -0.21 0.00 -1.81 0.00 0.00 57.70 53.91 1fwa n MET 239 Cb 0.71 -1.33 0.05 0.00 -0.71 0.00 0.00 33.22 31.95 1fwa n MET 239 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1fwa n ASP 240 N 0.91 -3.59 -4.40 7.83 2.03 -0.50 -4.64 116.55 114.19 1fwa n ASP 240 Ca 0.12 -0.80 -0.20 0.00 0.52 0.00 0.00 54.79 54.43 1fwa n ASP 240 Cb 0.43 -4.41 -0.10 0.00 -0.72 0.00 0.00 41.12 36.32 1fwa n ASP 240 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1fwa s ILE 241 N -3.50 1.47 0.09 5.18 -5.25 -1.19 -4.58 121.20 113.43 1fwa s ILE 241 Ca 0.22 -2.10 0.01 0.00 -0.99 0.00 0.00 60.65 57.79 1fwa s ILE 241 Cb -0.05 -2.41 -0.04 0.00 2.95 0.00 0.00 42.46 42.91 1fwa s ILE 241 CO 0.79 -0.32 0.24 -1.58 -1.79 0.00 0.00 174.94 172.28 1fwa s GLN 242 N -3.76 3.44 -0.11 0.37 2.00 -1.13 -4.65 119.66 115.81 1fwa s GLN 242 Ca 0.29 -0.50 0.01 0.00 -2.00 0.00 0.00 55.36 53.16 1fwa s GLN 242 Cb 0.04 -3.01 -0.02 0.00 0.80 0.00 0.00 33.01 30.83 1fwa s GLN 242 CO 0.11 0.57 -0.15 0.08 -0.50 0.00 0.00 175.29 175.40 1fwa s VAL 243 N -1.60 2.92 -0.10 1.34 1.01 -1.26 -0.73 120.40 121.98 1fwa s VAL 243 Ca 0.35 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1fwa s VAL 243 Cb -0.12 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 1fwa s VAL 243 CO 0.28 0.54 -0.11 0.00 0.00 0.00 0.00 175.10 175.82 1fwa s ALA 244 N 0.11 2.75 -0.04 5.51 0.00 -0.53 -0.98 121.76 128.58 1fwa s ALA 244 Ca -0.07 -0.90 0.06 0.00 0.00 0.00 0.00 51.96 51.05 1fwa s ALA 244 Cb -0.15 -1.20 -0.02 0.00 0.00 0.00 0.00 23.12 21.75 1fwa s ALA 244 CO 0.05 0.38 -0.22 -1.17 0.00 0.00 0.00 175.76 174.81 1fwa s LEU 245 N -0.14 2.30 -0.31 0.00 2.96 0.39 -0.88 118.68 123.01 1fwa s LEU 245 Ca -0.00 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 53.53 1fwa s LEU 245 Cb -0.13 -1.43 0.10 0.00 0.50 0.00 0.00 46.19 45.23 1fwa s LEU 245 CO 0.03 0.30 0.08 -2.28 -1.32 0.00 0.00 176.35 173.17 1fwa s HIS 246 N -0.51 2.16 1.13 5.38 5.65 -0.18 -1.66 115.29 127.26 1fwa s HIS 246 Ca 0.07 -1.99 -0.17 0.00 0.25 0.00 0.00 55.06 53.22 1fwa s HIS 246 Cb -0.11 -1.96 0.25 0.00 -1.18 0.00 0.00 32.58 29.58 1fwa s HIS 246 CO 0.01 -0.88 1.11 -1.54 -0.65 0.00 0.00 174.74 172.78 1fwa s SER 247 N 1.46 1.56 -0.94 9.88 1.04 -1.26 -2.46 113.70 122.98 1fwa s SER 247 Ca 0.09 0.81 -0.24 0.00 0.48 0.00 0.00 55.95 57.09 1fwa s SER 247 Cb -0.18 -1.20 -0.02 0.00 0.10 0.00 0.00 66.02 64.72 1fwa s SER 247 CO -0.20 -3.75 1.81 -0.62 0.98 0.00 0.00 173.24 171.46 1fwa s ASP 248 N -3.77 5.52 0.25 7.02 -1.08 -1.26 -3.79 116.67 119.55 1fwa s ASP 248 Ca 0.69 -0.91 -0.04 0.00 -0.52 0.00 0.00 52.55 51.77 1fwa s ASP 248 Cb -0.13 -2.56 0.39 0.00 -1.46 0.00 0.00 42.92 39.16 1fwa s ASP 248 CO 0.56 -2.40 1.83 0.74 0.52 0.00 0.00 175.17 176.42 1fwa h THR 249 N 7.11 0.96 0.00 1.71 2.02 -1.93 -2.14 112.91 120.65 1fwa h THR 249 Ca 0.13 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1fwa h THR 249 Cb 1.00 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 1fwa h THR 249 CO 1.27 0.16 0.00 0.18 0.37 0.00 0.00 175.52 177.50 1fwa n LEU 250 N -4.68 0.30 -2.03 2.58 4.77 -1.26 -2.68 117.00 114.00 1fwa n LEU 250 Ca 0.14 0.60 -0.20 0.00 -0.03 0.00 0.00 56.01 56.52 1fwa n LEU 250 Cb 0.24 -0.60 -0.04 0.00 -2.33 0.00 0.00 43.42 40.69 1fwa n LEU 250 CO 0.29 -0.56 -0.22 0.59 -1.33 0.00 0.00 177.39 176.16 1fwa n ASN 251 N -1.86 -5.42 -0.34 -1.43 3.02 -0.80 -4.87 115.26 103.55 1fwa n ASN 251 Ca 0.01 0.23 -0.04 0.00 -0.03 0.00 0.00 54.58 54.75 1fwa n ASN 251 Cb 0.11 -4.65 0.09 0.00 -0.61 0.00 0.00 39.78 34.72 1fwa n ASN 251 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1fwa h GLU 252 N 0.00 1.26 0.00 3.52 4.81 -1.88 -3.13 114.58 119.17 1fwa h GLU 252 Ca -0.44 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 1fwa h GLU 252 Cb 1.32 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 30.44 1fwa h GLU 252 CO 0.57 0.91 -0.93 -1.13 -0.73 0.00 0.00 179.01 177.70 1fwa n SER 253 N -4.34 0.92 0.00 1.04 3.41 -1.26 -5.06 113.62 108.32 1fwa n SER 253 Ca 0.10 -0.95 0.00 0.00 -0.26 0.00 0.00 58.87 57.75 1fwa n SER 253 Cb 0.09 1.01 0.00 0.00 -0.26 0.00 0.00 64.21 65.04 1fwa n SER 253 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fwa n GLY 254 N 1.46 -0.25 2.89 5.00 0.00 -1.18 -4.93 105.19 108.19 1fwa n GLY 254 Ca 0.04 -1.32 -0.17 0.00 0.00 0.00 0.00 46.02 44.57 1fwa n GLY 254 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1fwa n PHE 255 N -1.06 -2.97 -0.22 1.61 3.01 -1.26 -4.28 117.46 112.28 1fwa n PHE 255 Ca 0.00 -1.35 0.11 0.00 1.01 0.00 0.00 57.45 57.23 1fwa n PHE 255 Cb 0.00 -0.52 0.40 0.00 -0.01 0.00 0.00 39.48 39.34 1fwa n PHE 255 CO 0.00 0.00 0.00 -0.24 1.01 0.00 0.00 176.76 177.53 1fwa h VAL 256 N -0.47 0.88 0.00 -4.37 3.04 -1.93 -0.27 116.25 113.13 1fwa h VAL 256 Ca -0.24 -0.22 -0.04 0.00 -1.01 0.00 0.00 66.70 65.18 1fwa h VAL 256 Cb 0.91 0.17 -0.01 0.00 -2.01 0.00 0.00 31.29 30.36 1fwa h VAL 256 CO 0.27 0.12 -0.21 1.05 -1.01 0.00 0.00 177.57 177.79 1fwa h GLU 257 N 0.65 0.00 -0.14 4.17 9.09 -1.97 -0.89 114.58 125.49 1fwa h GLU 257 Ca 0.39 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 59.63 1fwa h GLU 257 Cb 0.62 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.73 1fwa h GLU 257 CO -0.16 0.21 -0.58 -0.44 0.05 0.00 0.00 179.01 178.09 1fwa h ASP 258 N 0.00 0.75 -0.26 3.06 3.32 -1.40 -1.73 116.42 120.15 1fwa h ASP 258 Ca -0.00 -0.62 -0.01 0.00 0.02 0.00 0.00 57.03 56.41 1fwa h ASP 258 Cb 0.39 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1fwa h ASP 258 CO 0.03 1.25 0.12 0.74 -1.72 0.00 0.00 179.24 179.65 1fwa h THR 259 N 0.29 1.15 -0.94 0.35 2.02 -1.21 0.29 112.91 114.87 1fwa h THR 259 Ca -0.03 -0.44 0.05 0.00 0.77 0.00 0.00 66.41 66.76 1fwa h THR 259 Cb 1.21 0.96 -0.06 0.00 -1.74 0.00 0.00 68.15 68.53 1fwa h THR 259 CO 0.12 0.15 0.61 -0.07 0.37 0.00 0.00 175.52 176.71 1fwa h LEU 260 N 0.28 0.99 -0.65 2.58 3.38 -1.17 0.14 115.31 120.86 1fwa h LEU 260 Ca 0.09 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 1fwa h LEU 260 Cb 0.13 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1fwa h LEU 260 CO -0.01 0.65 -0.26 0.00 0.09 0.00 0.00 178.44 178.92 1fwa h ALA 261 N 1.47 0.83 -0.48 1.53 0.00 -0.85 -2.22 119.26 119.54 1fwa h ALA 261 Ca 0.39 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1fwa h ALA 261 Cb 0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1fwa h ALA 261 CO -0.13 0.64 0.01 0.00 0.00 0.00 0.00 179.25 179.77 1fwa h ALA 262 N 1.04 1.12 -0.40 0.00 0.00 0.48 -2.14 119.26 119.35 1fwa h ALA 262 Ca 0.09 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1fwa h ALA 262 Cb 0.78 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1fwa h ALA 262 CO 0.06 0.57 0.01 0.82 0.00 0.00 0.00 179.25 180.71 1fwa h ILE 263 N 0.74 1.22 -6.26 0.00 2.04 -0.73 -3.41 117.51 111.11 1fwa h ILE 263 Ca 0.15 -0.87 -0.46 0.00 1.00 0.00 0.00 64.86 64.68 1fwa h ILE 263 Cb 0.43 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 1fwa h ILE 263 CO 0.02 0.30 -0.81 0.61 0.00 0.00 0.00 178.15 178.27 1fwa n GLY 264 N -0.79 -0.37 2.41 5.37 0.00 -0.81 -2.23 105.19 108.77 1fwa n GLY 264 Ca 0.02 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1fwa n GLY 264 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwa n GLY 265 N -1.67 0.34 3.86 -0.02 0.00 -1.26 -5.02 105.19 101.43 1fwa n GLY 265 Ca -0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1fwa n GLY 265 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fwa s ARG 266 N -0.69 3.89 0.27 1.61 0.52 -0.95 -4.81 118.95 118.79 1fwa s ARG 266 Ca 0.00 0.45 -0.30 0.00 -0.52 0.00 0.00 55.73 55.35 1fwa s ARG 266 Cb 0.00 -2.55 -0.11 0.00 0.52 0.00 0.00 34.95 32.80 1fwa s ARG 266 CO 0.00 0.25 1.60 0.99 0.02 0.00 0.00 175.30 178.16 1fwa s THR 267 N -1.89 2.13 -0.22 0.02 2.01 -1.26 -4.78 115.64 111.65 1fwa s THR 267 Ca 0.50 0.11 -0.24 0.00 0.31 0.00 0.00 61.69 62.37 1fwa s THR 267 Cb -0.11 -3.07 0.06 0.00 0.01 0.00 0.00 72.50 69.40 1fwa s THR 267 CO 0.19 0.02 0.65 -0.51 -0.69 0.00 0.00 174.62 174.28 1fwa s ILE 268 N 0.25 0.00 -0.31 1.82 2.07 -0.83 -4.72 121.20 119.48 1fwa s ILE 268 Ca 0.65 -0.01 -0.14 0.00 -1.41 0.00 0.00 60.65 59.74 1fwa s ILE 268 Cb -0.47 -0.92 -0.03 0.00 0.13 0.00 0.00 42.46 41.17 1fwa s ILE 268 CO 0.44 -0.01 0.32 -2.28 -1.91 0.00 0.00 174.94 171.51 1fwa s HIS 269 N 0.11 3.22 -0.32 3.50 5.65 -0.15 -1.53 115.29 125.76 1fwa s HIS 269 Ca -0.02 0.12 -0.18 0.00 0.25 0.00 0.00 55.06 55.24 1fwa s HIS 269 Cb -0.04 -2.57 -0.01 0.00 -1.18 0.00 0.00 32.58 28.78 1fwa s HIS 269 CO 0.02 -0.31 0.50 0.95 -0.65 0.00 0.00 174.74 175.25 1fwa s THR 270 N 1.96 5.05 0.49 0.89 -4.23 -0.43 -0.46 115.64 118.92 1fwa s THR 270 Ca 0.11 0.49 -0.20 0.00 -1.18 0.00 0.00 61.69 60.91 1fwa s THR 270 Cb -0.16 -3.90 -0.08 0.00 1.34 0.00 0.00 72.50 69.69 1fwa s THR 270 CO 0.11 -0.11 1.04 -0.36 -0.54 0.00 0.00 174.62 174.77 1fwa s PHE 271 N 2.34 2.98 -0.60 3.99 0.08 -0.66 -2.11 117.98 123.98 1fwa s PHE 271 Ca 0.19 1.57 -0.16 0.00 0.12 0.00 0.00 56.93 58.65 1fwa s PHE 271 Cb -0.16 -3.08 0.02 0.00 -0.57 0.00 0.00 43.02 39.24 1fwa s PHE 271 CO 0.12 -0.88 0.34 -2.39 -0.10 0.00 0.00 175.22 172.31 1fwa n HIS 272 N -1.01 -0.74 0.30 0.36 1.44 -1.08 -4.76 115.22 109.73 1fwa n HIS 272 Ca 0.09 0.07 0.16 0.00 -2.01 0.00 0.00 57.72 56.04 1fwa n HIS 272 Cb 0.52 -1.40 0.88 0.00 0.12 0.00 0.00 29.99 30.11 1fwa n HIS 272 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 1fwa h THR 273 N 0.18 0.00 -0.03 0.61 2.02 -1.26 -1.04 112.91 113.39 1fwa h THR 273 Ca -0.36 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 66.69 1fwa h THR 273 Cb 0.72 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 1fwa h THR 273 CO 0.26 0.00 -0.56 -0.08 0.37 0.00 0.00 175.52 175.51 1fwa h GLU 274 N 0.00 0.08 0.00 6.66 4.22 -1.86 -2.67 114.58 121.01 1fwa h GLU 274 Ca 0.00 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.39 1fwa h GLU 274 Cb 0.35 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1fwa h GLU 274 CO 0.00 0.62 0.00 0.41 -2.18 0.00 0.00 179.01 177.86 1fwa n GLY 275 N 0.10 1.50 0.37 1.92 0.00 -0.39 -4.52 105.19 104.17 1fwa n GLY 275 Ca -0.02 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 45.89 1fwa n GLY 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwa h ALA 276 N 0.00 1.75 0.00 4.61 0.00 -1.80 0.14 119.26 123.95 1fwa h ALA 276 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1fwa h ALA 276 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1fwa h ALA 276 CO 0.00 0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1fwa n GLY 277 N -1.41 -1.25 0.00 0.00 0.00 -1.26 -4.86 105.19 96.40 1fwa n GLY 277 Ca 0.18 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1fwa n GLY 277 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwa n GLY 278 N 1.13 4.64 0.00 -0.02 0.00 0.48 -5.03 105.19 106.39 1fwa n GLY 278 Ca 0.12 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1fwa n GLY 278 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwa n GLY 279 N -1.60 4.48 3.18 -0.02 0.00 -1.25 -4.44 105.19 105.53 1fwa n GLY 279 Ca 0.00 -1.36 -0.58 0.00 0.00 0.00 0.00 46.02 44.08 1fwa n GLY 279 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fwa n HIS 280 N -1.96 1.47 -3.25 1.61 8.25 -1.24 -4.06 115.22 116.04 1fwa n HIS 280 Ca 0.00 0.96 -0.38 0.00 -0.26 0.00 0.00 57.72 58.04 1fwa n HIS 280 Cb 0.00 -1.91 -0.06 0.00 1.12 0.00 0.00 29.99 29.14 1fwa n HIS 280 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fwa s ALA 281 N 2.76 3.46 -1.13 -1.41 0.00 -1.09 -1.59 121.76 122.76 1fwa s ALA 281 Ca 0.91 -0.08 0.12 0.00 0.00 0.00 0.00 51.96 52.92 1fwa s ALA 281 Cb -1.28 -2.71 0.33 0.00 0.00 0.00 0.00 23.12 19.46 1fwa s ALA 281 CO 0.69 0.05 1.26 -0.35 0.00 0.00 0.00 175.76 177.41 1fwa n PRO 282 N 3.35 2.67 -0.89 0.00 -0.04 -1.26 -4.94 135.00 133.89 1fwa n PRO 282 Ca -0.06 -2.06 -0.03 0.00 -0.04 0.00 0.00 63.50 61.31 1fwa n PRO 282 Cb 0.51 -1.31 0.29 0.00 -0.04 0.00 0.00 33.50 32.95 1fwa n PRO 282 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1fwa n ASP 283 N 0.69 4.36 0.30 3.54 5.68 -1.12 -4.59 116.55 125.40 1fwa n ASP 283 Ca 0.13 -3.26 0.16 0.00 -0.50 0.00 0.00 54.79 51.32 1fwa n ASP 283 Cb 0.44 -0.69 0.92 0.00 -1.14 0.00 0.00 41.12 40.65 1fwa n ASP 283 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 1fwa h ILE 284 N 2.29 0.46 0.00 2.12 6.09 -1.58 -2.18 117.51 124.72 1fwa h ILE 284 Ca 0.21 -0.10 -0.00 0.00 -1.37 0.00 0.00 64.86 63.59 1fwa h ILE 284 Cb 2.08 1.07 -0.00 0.00 0.47 0.00 0.00 36.82 40.44 1fwa h ILE 284 CO 0.60 0.02 -0.01 -0.29 -3.07 0.00 0.00 178.15 175.40 1fwa h ILE 285 N 0.00 0.22 0.00 2.19 2.10 -1.71 -2.15 117.51 118.17 1fwa h ILE 285 Ca -0.00 -0.08 0.00 0.00 1.08 0.00 0.00 64.86 65.86 1fwa h ILE 285 Cb 0.07 1.06 0.00 0.00 -1.09 0.00 0.00 36.82 36.86 1fwa h ILE 285 CO 0.00 0.01 0.00 0.35 -1.08 0.00 0.00 178.15 177.43 1fwa n THR 286 N -3.38 1.06 0.22 2.19 -2.24 -0.82 -2.69 114.28 108.62 1fwa n THR 286 Ca -0.03 0.26 0.07 0.00 -2.27 0.00 0.00 64.05 62.09 1fwa n THR 286 Cb 0.10 -1.09 0.52 0.00 -2.10 0.00 0.00 70.33 67.76 1fwa n THR 286 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fwa h ALA 287 N 2.42 1.40 0.00 6.98 0.00 -1.61 -2.99 119.26 125.46 1fwa h ALA 287 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1fwa h ALA 287 Cb 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1fwa h ALA 287 CO 0.00 0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.54 1fwa h ALA 289 N 2.48 0.61 -2.56 0.00 0.00 -1.73 -3.39 119.26 114.67 1fwa h ALA 289 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 1fwa h ALA 289 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1fwa h ALA 289 CO 0.00 0.00 0.01 -1.01 0.00 0.00 0.00 179.25 178.25 1fwa s HIS 290 N -3.29 3.63 0.29 0.00 3.76 -0.68 -4.68 115.29 114.32 1fwa s HIS 290 Ca 0.03 1.22 0.19 0.00 -0.15 0.00 0.00 55.06 56.35 1fwa s HIS 290 Cb 0.10 -2.49 0.87 0.00 1.11 0.00 0.00 32.58 32.17 1fwa s HIS 290 CO 0.75 0.39 1.84 -1.00 -0.85 0.00 0.00 174.74 175.87 1fwa h PRO 291 N 3.51 0.00 -0.04 8.40 0.13 -1.91 -3.13 132.00 138.95 1fwa h PRO 291 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1fwa h PRO 291 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1fwa h PRO 291 CO 0.65 0.31 0.00 0.27 -0.23 0.00 0.00 178.00 179.01 1fwa n ASN 292 N -3.73 1.75 -4.60 1.44 6.94 -1.26 -0.32 115.26 115.48 1fwa n ASN 292 Ca -0.01 -1.60 -0.36 0.00 -0.02 0.00 0.00 54.58 52.59 1fwa n ASN 292 Cb 0.41 -0.02 -0.10 0.00 -2.36 0.00 0.00 39.78 37.71 1fwa n ASN 292 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1fwa s ILE 293 N -1.97 4.95 -0.44 1.53 -1.09 -1.18 -1.97 121.20 121.02 1fwa s ILE 293 Ca 0.36 0.03 -0.10 0.00 -2.23 0.00 0.00 60.65 58.72 1fwa s ILE 293 Cb 0.21 -3.29 0.09 0.00 -1.58 0.00 0.00 42.46 37.89 1fwa s ILE 293 CO 0.32 0.38 0.30 -0.76 -1.23 0.00 0.00 174.94 173.95 1fwa s LEU 294 N 0.97 5.37 -0.07 2.97 1.43 -0.59 -4.36 118.68 124.42 1fwa s LEU 294 Ca 0.06 -1.63 -0.16 0.00 -1.03 0.00 0.00 54.13 51.37 1fwa s LEU 294 Cb -0.14 -2.01 -0.05 0.00 0.03 0.00 0.00 46.19 44.02 1fwa s LEU 294 CO 0.03 -0.60 0.42 -2.16 0.23 0.00 0.00 176.35 174.28 1fwa s PRO 295 N 1.42 4.15 0.26 1.29 0.04 -1.26 -1.31 135.00 139.59 1fwa s PRO 295 Ca 0.04 0.39 0.05 0.00 0.04 0.00 0.00 61.00 61.52 1fwa s PRO 295 Cb -0.24 -3.34 -0.06 0.00 0.04 0.00 0.00 34.50 30.90 1fwa s PRO 295 CO 0.01 0.41 -0.01 -1.54 0.04 0.00 0.00 177.00 175.91 1fwa s SER 296 N -0.16 2.27 0.16 6.66 1.04 -0.90 -1.42 113.70 121.34 1fwa s SER 296 Ca 0.24 -1.24 0.10 0.00 0.48 0.00 0.00 55.95 55.54 1fwa s SER 296 Cb -0.16 -0.07 -0.04 0.00 0.10 0.00 0.00 66.02 65.85 1fwa s SER 296 CO 0.11 -0.47 -0.22 -0.44 0.98 0.00 0.00 173.24 173.20 1fwa s SER 297 N -3.39 3.58 0.38 7.02 0.01 -0.48 -1.05 113.70 119.77 1fwa s SER 297 Ca 0.30 -0.74 0.04 0.00 1.31 0.00 0.00 55.95 56.87 1fwa s SER 297 Cb 0.06 -0.36 -0.00 0.00 0.21 0.00 0.00 66.02 65.92 1fwa s SER 297 CO 0.11 0.15 0.55 0.42 0.41 0.00 0.00 173.24 174.88 1fwa s THR 298 N -1.38 3.98 -0.38 1.44 -4.23 -1.26 -1.02 115.64 112.78 1fwa s THR 298 Ca 0.19 -0.81 0.23 0.00 -1.18 0.00 0.00 61.69 60.11 1fwa s THR 298 Cb -0.09 -3.41 0.18 0.00 1.34 0.00 0.00 72.50 70.51 1fwa s THR 298 CO 0.09 -0.21 1.36 -0.55 -0.54 0.00 0.00 174.62 174.78 1fwa h ASN 299 N 0.69 0.00 0.04 3.99 7.08 -1.11 -3.39 115.58 122.87 1fwa h ASN 299 Ca -0.46 -0.02 -0.00 0.00 -3.08 0.00 0.00 56.30 52.74 1fwa h ASN 299 Cb 1.26 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 37.50 1fwa h ASN 299 CO 0.54 0.01 -0.02 1.55 -2.08 0.00 0.00 177.43 177.43 1fwa h PRO 300 N 0.00 0.00 -0.01 4.14 0.13 -1.82 -1.37 132.00 133.08 1fwa h PRO 300 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1fwa h PRO 300 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1fwa h PRO 300 CO 0.00 0.02 -0.09 0.25 -0.23 0.00 0.00 178.00 177.95 1fwa n THR 301 N -4.03 0.00 -3.67 1.56 -2.24 -1.26 -4.81 114.28 99.83 1fwa n THR 301 Ca -0.03 -0.12 -0.38 0.00 -2.27 0.00 0.00 64.05 61.25 1fwa n THR 301 Cb 0.10 0.11 -0.12 0.00 -2.10 0.00 0.00 70.33 68.33 1fwa n THR 301 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1fwa s LEU 302 N -2.27 3.96 0.57 3.22 1.43 -0.52 -3.12 118.68 121.96 1fwa s LEU 302 Ca 0.34 -0.43 0.08 0.00 -1.03 0.00 0.00 54.13 53.08 1fwa s LEU 302 Cb 0.20 -1.99 0.08 0.00 0.03 0.00 0.00 46.19 44.51 1fwa s LEU 302 CO 0.43 -0.15 0.78 -2.16 0.23 0.00 0.00 176.35 175.48 1fwa s PRO 303 N 1.62 2.31 -0.18 1.29 0.04 -1.26 -4.84 135.00 133.98 1fwa s PRO 303 Ca 0.05 -1.48 -0.29 0.00 0.04 0.00 0.00 61.00 59.32 1fwa s PRO 303 Cb -0.17 -2.62 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 1fwa s PRO 303 CO 0.06 -0.84 1.87 -0.47 0.04 0.00 0.00 177.00 177.66 1fwa s TYR 304 N -2.68 1.65 0.42 0.56 5.04 -1.18 -4.95 117.35 116.21 1fwa s TYR 304 Ca 0.61 0.35 0.03 0.00 -2.44 0.00 0.00 57.07 55.63 1fwa s TYR 304 Cb -0.06 -4.04 -0.04 0.00 0.35 0.00 0.00 41.96 38.17 1fwa s TYR 304 CO 0.39 -3.78 0.06 0.95 -1.34 0.00 0.00 175.55 171.82 1fwa s THR 305 N 6.07 1.12 0.49 4.34 -4.23 -1.26 -1.28 115.64 120.89 1fwa s THR 305 Ca 0.84 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.52 1fwa s THR 305 Cb -0.30 -2.49 0.24 0.00 1.34 0.00 0.00 72.50 71.29 1fwa s THR 305 CO 0.34 0.00 2.09 -0.07 -0.54 0.00 0.00 174.62 176.44 1fwa h LEU 306 N 1.72 0.00 -1.36 4.79 3.38 -1.10 -2.90 115.31 119.85 1fwa h LEU 306 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1fwa h LEU 306 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1fwa h LEU 306 CO 0.69 0.08 -0.26 0.59 0.09 0.00 0.00 178.44 179.62 1fwa n ASN 307 N -4.36 2.37 0.06 -0.43 3.02 -1.26 -4.67 115.26 109.99 1fwa n ASN 307 Ca -0.03 -1.69 -0.12 0.00 -0.03 0.00 0.00 54.58 52.71 1fwa n ASN 307 Cb 0.16 0.26 -0.05 0.00 -0.61 0.00 0.00 39.78 39.53 1fwa n ASN 307 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1fwa h THR 308 N 3.31 0.26 0.01 3.41 2.02 -1.89 -3.03 112.91 117.00 1fwa h THR 308 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1fwa h THR 308 Cb 0.84 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1fwa h THR 308 CO 0.00 0.00 -0.01 0.40 0.37 0.00 0.00 175.52 176.28 1fwa h ILE 309 N -0.49 1.00 -0.96 3.11 1.08 -1.83 -3.16 117.51 116.25 1fwa h ILE 309 Ca 0.06 -0.05 0.19 0.00 -0.39 0.00 0.00 64.86 64.67 1fwa h ILE 309 Cb 0.59 1.03 -0.11 0.00 -3.07 0.00 0.00 36.82 35.26 1fwa h ILE 309 CO -0.29 0.01 0.55 0.44 -0.69 0.00 0.00 178.15 178.17 1fwa h ASP 310 N -0.04 0.68 1.36 1.72 5.19 -1.86 -1.94 116.42 121.53 1fwa h ASP 310 Ca -0.00 0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 1fwa h ASP 310 Cb 0.03 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.54 1fwa h ASP 310 CO 0.00 0.22 -0.12 -1.84 -3.12 0.00 0.00 179.24 174.39 1fwa n GLU 311 N -4.83 0.27 -0.04 3.56 0.28 -1.15 -4.33 120.64 114.40 1fwa n GLU 311 Ca 0.22 0.19 -0.12 0.00 -0.16 0.00 0.00 57.16 57.30 1fwa n GLU 311 Cb 0.56 -1.78 0.02 0.00 1.43 0.00 0.00 31.44 31.67 1fwa n GLU 311 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1fwa h HIS 312 N 0.00 0.89 0.26 -1.84 3.86 -1.32 -3.28 115.15 113.71 1fwa h HIS 312 Ca 0.00 -0.30 0.01 0.00 -1.16 0.00 0.00 60.37 58.91 1fwa h HIS 312 Cb 0.74 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 29.00 1fwa h HIS 312 CO 0.00 1.08 -0.39 1.25 0.86 0.00 0.00 177.93 180.73 1fwa h LEU 313 N 0.56 -1.09 -1.34 2.43 5.85 -1.75 -0.37 115.31 119.59 1fwa h LEU 313 Ca 0.02 0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 1fwa h LEU 313 Cb 1.08 0.39 -0.01 0.00 0.37 0.00 0.00 40.66 42.49 1fwa h LEU 313 CO 0.11 -0.50 -0.30 0.44 -0.34 0.00 0.00 178.44 177.85 1fwa h ASP 314 N -0.71 0.00 -0.36 1.25 3.45 -1.87 -2.10 116.42 116.09 1fwa h ASP 314 Ca -0.00 0.00 -0.08 0.00 0.43 0.00 0.00 57.03 57.38 1fwa h ASP 314 Cb 0.68 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.44 1fwa h ASP 314 CO -0.14 0.30 -0.08 -0.03 -1.57 0.00 0.00 179.24 177.71 1fwa h MET 315 N 0.00 0.69 -0.01 3.56 4.05 -1.56 -2.81 114.93 118.85 1fwa h MET 315 Ca -0.00 -0.26 0.01 0.00 -0.28 0.00 0.00 59.70 59.16 1fwa h MET 315 Cb 0.64 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.39 1fwa h MET 315 CO 0.04 0.85 -0.04 1.25 0.23 0.00 0.00 176.91 179.24 1fwa h LEU 316 N 0.49 -0.10 0.25 3.39 7.12 -0.58 -2.54 115.31 123.33 1fwa h LEU 316 Ca 0.09 0.02 0.01 0.00 0.13 0.00 0.00 57.88 58.13 1fwa h LEU 316 Cb 0.59 0.05 -0.03 0.00 -0.53 0.00 0.00 40.66 40.74 1fwa h LEU 316 CO 0.03 -0.05 -0.35 0.24 -0.13 0.00 0.00 178.44 178.18 1fwa h MET 317 N -0.06 -0.64 -0.90 1.25 2.86 -1.35 -2.69 114.93 113.41 1fwa h MET 317 Ca 0.02 0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.71 1fwa h MET 317 Cb 0.08 0.14 -0.05 0.00 0.06 0.00 0.00 31.60 31.84 1fwa h MET 317 CO -0.04 -0.42 0.59 0.28 1.06 0.00 0.00 176.91 178.37 1fwa h VAL 318 N -0.66 1.22 -0.03 -2.22 2.07 -1.50 -1.98 116.25 113.16 1fwa h VAL 318 Ca -0.00 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 1fwa h VAL 318 Cb 0.63 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1fwa h VAL 318 CO -0.12 0.22 -0.17 0.00 0.02 0.00 0.00 177.57 177.51 1fwa h ALA 319 N 1.33 1.67 -0.23 1.67 0.00 -1.35 -3.13 119.26 119.22 1fwa h ALA 319 Ca 0.33 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1fwa h ALA 319 Cb -0.12 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1fwa h ALA 319 CO -0.08 0.25 0.00 0.72 0.00 0.00 0.00 179.25 180.14 1fwa n HIS 320 N -4.31 0.52 -3.76 0.00 -0.00 -1.01 -3.80 115.22 102.86 1fwa n HIS 320 Ca -0.02 -0.69 -0.27 0.00 -0.00 0.00 0.00 57.72 56.74 1fwa n HIS 320 Cb 0.25 -0.15 0.05 0.00 -0.00 0.00 0.00 29.99 30.14 1fwa n HIS 320 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1fwa n HIS 321 N -0.22 -2.52 -3.46 4.41 8.25 -0.80 -4.98 115.22 115.90 1fwa n HIS 321 Ca 0.14 0.95 -0.32 0.00 -0.26 0.00 0.00 57.72 58.23 1fwa n HIS 321 Cb 0.60 -4.48 -0.05 0.00 1.12 0.00 0.00 29.99 27.17 1fwa n HIS 321 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1fwa s LEU 322 N -7.22 4.21 -0.35 2.41 1.43 -0.84 -5.06 118.68 113.25 1fwa s LEU 322 Ca 0.57 0.88 -0.12 0.00 -1.03 0.00 0.00 54.13 54.42 1fwa s LEU 322 Cb -0.27 -3.55 -0.00 0.00 0.03 0.00 0.00 46.19 42.40 1fwa s LEU 322 CO 0.79 -0.02 0.23 -0.62 0.23 0.00 0.00 176.35 176.95 1fwa s ASP 323 N -2.28 5.90 0.31 2.29 -1.08 -1.26 -4.75 116.67 115.80 1fwa s ASP 323 Ca 0.45 -0.62 0.23 0.00 -0.52 0.00 0.00 52.55 52.08 1fwa s ASP 323 Cb -0.12 -2.09 1.15 0.00 -1.46 0.00 0.00 42.92 40.40 1fwa s ASP 323 CO 0.21 -0.29 1.70 -0.81 0.52 0.00 0.00 175.17 176.50 1fwa n PRO 324 N 5.07 0.16 0.13 4.34 -0.04 -1.26 -1.03 135.00 142.38 1fwa n PRO 324 Ca -0.12 0.58 0.10 0.00 -0.04 0.00 0.00 63.50 64.01 1fwa n PRO 324 Cb 0.48 -1.95 0.04 0.00 -0.04 0.00 0.00 33.50 32.03 1fwa n PRO 324 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1fwa h ASP 325 N 0.00 0.00 -3.37 3.54 3.32 -2.00 -3.44 116.42 114.47 1fwa h ASP 325 Ca 0.00 0.00 -0.62 0.00 0.02 0.00 0.00 57.03 56.43 1fwa h ASP 325 Cb 0.12 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.54 1fwa h ASP 325 CO 0.00 0.08 0.45 -0.63 -1.72 0.00 0.00 179.24 177.42 1fwa s ILE 326 N -3.26 4.53 0.26 0.35 1.01 -0.19 -4.94 121.20 118.95 1fwa s ILE 326 Ca 0.01 0.27 -0.04 0.00 0.00 0.00 0.00 60.65 60.89 1fwa s ILE 326 Cb 0.08 -4.44 0.32 0.00 0.01 0.00 0.00 42.46 38.43 1fwa s ILE 326 CO 0.76 -0.94 1.62 0.00 0.00 0.00 0.00 174.94 176.38 1fwa h ALA 327 N 9.16 0.90 -0.08 9.38 0.00 -1.84 0.21 119.26 136.99 1fwa h ALA 327 Ca -0.26 0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1fwa h ALA 327 Cb 1.08 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1fwa h ALA 327 CO 1.03 -0.45 -0.13 0.93 0.00 0.00 0.00 179.25 180.63 1fwa h GLU 328 N 0.09 0.13 -0.31 0.00 3.07 -1.92 -0.02 114.58 115.63 1fwa h GLU 328 Ca 0.47 -0.02 -0.16 0.00 -0.50 0.00 0.00 59.36 59.14 1fwa h GLU 328 Cb 0.86 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.74 1fwa h GLU 328 CO -0.73 0.26 -0.45 -0.44 -1.40 0.00 0.00 179.01 176.25 1fwa h ASP 329 N 0.12 0.87 1.12 1.42 5.19 -0.85 -2.70 116.42 121.59 1fwa h ASP 329 Ca 0.03 -0.42 -0.16 0.00 -0.62 0.00 0.00 57.03 55.85 1fwa h ASP 329 Cb 0.31 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.55 1fwa h ASP 329 CO 0.02 1.19 -0.77 -0.37 -3.12 0.00 0.00 179.24 176.18 1fwa h VAL 330 N 0.64 1.37 -0.40 -1.35 -1.51 -0.87 -2.99 116.25 111.14 1fwa h VAL 330 Ca 0.04 -2.82 -0.15 0.00 -1.23 0.00 0.00 66.70 62.53 1fwa h VAL 330 Cb 1.03 2.60 -0.01 0.00 -2.13 0.00 0.00 31.29 32.78 1fwa h VAL 330 CO 0.10 0.76 -0.35 0.00 -1.23 0.00 0.00 177.57 176.84 1fwa h ALA 331 N 1.23 0.62 0.00 5.19 0.00 -0.98 -2.02 119.26 123.29 1fwa h ALA 331 Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1fwa h ALA 331 Cb 1.54 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1fwa h ALA 331 CO 0.10 0.68 0.00 0.35 0.00 0.00 0.00 179.25 180.38 1fwa h PHE 332 N 0.77 0.00 0.02 0.00 3.57 -1.55 -2.15 116.94 117.60 1fwa h PHE 332 Ca 0.07 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.42 1fwa h PHE 332 Cb 0.94 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.69 1fwa h PHE 332 CO 0.06 0.00 -0.58 0.00 -2.23 0.00 0.00 178.31 175.56 1fwa h ALA 333 N 2.23 0.05 -0.87 2.41 0.00 -1.36 -3.29 119.26 118.43 1fwa h ALA 333 Ca 0.00 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.31 1fwa h ALA 333 Cb 0.75 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 1fwa h ALA 333 CO 0.00 0.32 0.44 0.93 0.00 0.00 0.00 179.25 180.94 1fwa h GLU 334 N -0.19 1.24 0.00 0.00 5.08 -1.21 -2.41 114.58 117.10 1fwa h GLU 334 Ca -0.08 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1fwa h GLU 334 Cb 1.32 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1fwa h GLU 334 CO 0.11 0.94 0.00 -1.13 -1.00 0.00 0.00 179.01 177.93 1fwa n SER 335 N -4.31 0.34 0.07 1.42 3.41 -0.82 -1.93 113.62 111.81 1fwa n SER 335 Ca 0.09 0.62 0.06 0.00 -0.26 0.00 0.00 58.87 59.38 1fwa n SER 335 Cb 0.13 -0.68 -0.03 0.00 -0.26 0.00 0.00 64.21 63.36 1fwa n SER 335 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1fwa h ARG 336 N 0.00 0.00 -4.32 4.33 3.08 -1.50 -3.45 114.38 112.52 1fwa h ARG 336 Ca 0.00 0.00 -0.74 0.00 0.07 0.00 0.00 59.98 59.31 1fwa h ARG 336 Cb 0.15 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 29.98 1fwa h ARG 336 CO 0.00 0.15 -0.27 0.42 -1.07 0.00 0.00 179.97 179.20 1fwa s ILE 337 N -3.14 5.19 -0.11 2.04 1.01 -0.81 -3.43 121.20 121.95 1fwa s ILE 337 Ca -0.01 -1.10 -0.00 0.00 0.00 0.00 0.00 60.65 59.54 1fwa s ILE 337 Cb 0.09 -4.19 0.02 0.00 0.01 0.00 0.00 42.46 38.40 1fwa s ILE 337 CO 0.80 -0.66 -0.08 -0.13 0.00 0.00 0.00 174.94 174.86 1fwa s ARG 338 N 1.74 1.58 0.30 2.79 0.52 -1.26 -4.98 118.95 119.63 1fwa s ARG 338 Ca 0.05 -0.28 0.02 0.00 -0.52 0.00 0.00 55.73 55.01 1fwa s ARG 338 Cb -0.25 -1.61 0.59 0.00 0.52 0.00 0.00 34.95 34.20 1fwa s ARG 338 CO 0.06 -0.26 1.87 -0.09 0.02 0.00 0.00 175.30 176.91 1fwa h ARG 339 N 8.13 0.94 -0.38 3.54 2.43 -1.98 -1.88 114.38 125.18 1fwa h ARG 339 Ca -0.30 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 58.82 1fwa h ARG 339 Cb 1.13 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.45 1fwa h ARG 339 CO 0.42 0.62 0.23 0.93 -1.51 0.00 0.00 179.97 180.66 1fwa h GLU 340 N 0.96 0.46 0.02 0.20 3.07 -1.92 -0.66 114.58 116.71 1fwa h GLU 340 Ca 0.45 -0.03 -0.21 0.00 -0.50 0.00 0.00 59.36 59.07 1fwa h GLU 340 Cb 0.42 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.20 1fwa h GLU 340 CO -0.21 0.30 -0.98 1.79 -1.40 0.00 0.00 179.01 178.51 1fwa h THR 341 N 0.47 1.64 -0.46 1.13 1.35 -1.69 -2.91 112.91 112.43 1fwa h THR 341 Ca 0.14 -3.16 -0.06 0.00 -0.55 0.00 0.00 66.41 62.79 1fwa h THR 341 Cb -0.02 2.75 -0.02 0.00 -1.73 0.00 0.00 68.15 69.13 1fwa h THR 341 CO -0.05 0.91 0.05 0.40 -0.25 0.00 0.00 175.52 176.58 1fwa h ILE 342 N 0.02 1.25 -0.53 6.82 2.04 -1.12 -1.61 117.51 124.38 1fwa h ILE 342 Ca -0.03 -0.95 -0.11 0.00 1.00 0.00 0.00 64.86 64.78 1fwa h ILE 342 Cb 1.70 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.73 1fwa h ILE 342 CO 0.14 0.33 -0.09 0.00 0.00 0.00 0.00 178.15 178.52 1fwa h ALA 343 N 0.94 0.84 -0.33 1.87 0.00 -1.19 -3.12 119.26 118.26 1fwa h ALA 343 Ca 0.14 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 1fwa h ALA 343 Cb 0.42 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1fwa h ALA 343 CO 0.01 0.66 -0.24 0.00 0.00 0.00 0.00 179.25 179.68 1fwa h ALA 344 N 1.01 0.96 -0.93 0.00 0.00 -1.36 -3.25 119.26 115.70 1fwa h ALA 344 Ca 0.14 -0.36 0.18 0.00 0.00 0.00 0.00 54.91 54.87 1fwa h ALA 344 Cb 0.64 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.19 1fwa h ALA 344 CO 0.04 0.60 0.51 1.49 0.00 0.00 0.00 179.25 181.90 1fwa h GLU 345 N 0.57 0.64 -0.78 0.00 4.81 -1.23 -1.21 114.58 117.38 1fwa h GLU 345 Ca 0.08 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1fwa h GLU 345 Cb 0.71 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 1fwa h GLU 345 CO 0.05 0.42 0.33 -0.44 -0.73 0.00 0.00 179.01 178.64 1fwa h ASP 346 N 0.66 1.07 -0.39 1.04 3.32 -1.68 -2.05 116.42 118.39 1fwa h ASP 346 Ca 0.53 -0.17 -0.13 0.00 0.02 0.00 0.00 57.03 57.28 1fwa h ASP 346 Cb 0.82 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1fwa h ASP 346 CO -0.39 0.94 -0.28 0.58 -1.72 0.00 0.00 179.24 178.37 1fwa h VAL 347 N 1.13 1.28 -0.01 -1.35 2.07 -1.44 -2.27 116.25 115.67 1fwa h VAL 347 Ca 0.26 -1.44 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 1fwa h VAL 347 Cb 0.20 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1fwa h VAL 347 CO -0.02 0.48 -0.11 -0.07 0.02 0.00 0.00 177.57 177.86 1fwa h LEU 348 N 0.68 0.01 -0.16 2.57 3.38 -1.03 -0.02 115.31 120.73 1fwa h LEU 348 Ca 0.07 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 1fwa h LEU 348 Cb 0.86 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1fwa h LEU 348 CO 0.07 0.13 -0.39 0.45 0.09 0.00 0.00 178.44 178.79 1fwa h HIS 349 N 0.01 0.71 -0.14 1.13 3.86 -1.15 0.19 115.15 119.76 1fwa h HIS 349 Ca 0.00 -0.27 -0.02 0.00 -1.16 0.00 0.00 60.37 58.93 1fwa h HIS 349 Cb 0.21 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 1fwa h HIS 349 CO 0.00 1.01 -0.00 0.22 0.86 0.00 0.00 177.93 180.02 1fwa h ASP 350 N 0.20 0.17 1.13 2.45 3.58 -0.65 -1.64 116.42 121.65 1fwa h ASP 350 Ca -0.00 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.43 1fwa h ASP 350 Cb 0.99 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 42.00 1fwa h ASP 350 CO 0.08 0.22 -0.37 0.18 -2.88 0.00 0.00 179.24 176.48 1fwa n LEU 351 N -4.41 0.76 0.00 2.28 4.77 -0.14 -4.95 117.00 115.32 1fwa n LEU 351 Ca -0.01 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 1fwa n LEU 351 Cb 0.16 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1fwa n LEU 351 CO 0.36 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 1fwa n GLY 352 N 1.32 0.71 0.08 -0.72 0.00 -0.62 -4.71 105.19 101.26 1fwa n GLY 352 Ca 0.04 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.58 1fwa n GLY 352 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwa h ALA 353 N 0.00 0.33 -3.25 4.61 0.00 -0.85 -2.47 119.26 117.64 1fwa h ALA 353 Ca 0.00 -0.98 -0.61 0.00 0.00 0.00 0.00 54.91 53.31 1fwa h ALA 353 Cb 0.00 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 17.62 1fwa h ALA 353 CO 0.00 1.21 -0.55 -0.06 0.00 0.00 0.00 179.25 179.85 1fwa s PHE 354 N -2.68 3.27 -0.74 0.00 0.40 -1.08 -4.82 117.98 112.33 1fwa s PHE 354 Ca -0.02 0.10 0.17 0.00 -0.60 0.00 0.00 56.93 56.59 1fwa s PHE 354 Cb 0.09 -2.11 -0.20 0.00 0.51 0.00 0.00 43.02 41.31 1fwa s PHE 354 CO 0.84 0.15 0.71 0.43 0.70 0.00 0.00 175.22 178.04 1fwa n SER 355 N 3.65 0.83 -4.03 1.36 7.64 -0.51 -4.67 113.62 117.88 1fwa n SER 355 Ca -0.16 -0.81 -0.08 0.00 1.01 0.00 0.00 58.87 58.82 1fwa n SER 355 Cb 0.52 1.09 -0.10 0.00 -1.01 0.00 0.00 64.21 64.71 1fwa n SER 355 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1fwa s LEU 356 N -2.98 2.33 0.07 -3.43 1.02 -1.02 -4.25 118.68 110.42 1fwa s LEU 356 Ca 0.05 -0.78 0.07 0.00 0.02 0.00 0.00 54.13 53.50 1fwa s LEU 356 Cb 0.13 0.21 -0.03 0.00 0.02 0.00 0.00 46.19 46.52 1fwa s LEU 356 CO 0.72 -0.49 -0.20 0.42 0.02 0.00 0.00 176.35 176.82 1fwa s THR 357 N -2.94 1.62 0.35 5.49 -4.23 -0.86 -1.39 115.64 113.69 1fwa s THR 357 Ca -0.02 -1.32 -0.07 0.00 -1.18 0.00 0.00 61.69 59.11 1fwa s THR 357 Cb 0.01 -1.44 0.02 0.00 1.34 0.00 0.00 72.50 72.42 1fwa s THR 357 CO -0.06 0.07 0.57 -0.94 -0.54 0.00 0.00 174.62 173.72 1fwa s SER 358 N -1.47 0.64 -0.10 3.99 1.04 -0.19 -4.68 113.70 112.93 1fwa s SER 358 Ca 0.06 -1.37 -0.08 0.00 0.48 0.00 0.00 55.95 55.04 1fwa s SER 358 Cb -0.09 0.72 -0.03 0.00 0.10 0.00 0.00 66.02 66.72 1fwa s SER 358 CO 0.03 -1.41 -0.16 -1.54 0.98 0.00 0.00 173.24 171.14 1fwa n SER 359 N -1.39 1.20 -0.53 7.02 3.41 -1.26 -1.78 113.62 120.30 1fwa n SER 359 Ca -0.02 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 1fwa n SER 359 Cb 0.61 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 1fwa n SER 359 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1fwa n ASP 360 N -3.77 -1.36 -4.61 4.04 -0.08 -0.77 -2.66 116.55 107.33 1fwa n ASP 360 Ca -0.06 0.00 -0.65 0.00 -1.51 0.00 0.00 54.79 52.56 1fwa n ASP 360 Cb 0.24 -0.34 -0.10 0.00 2.34 0.00 0.00 41.12 43.26 1fwa n ASP 360 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1fwa n SER 361 N 0.05 1.12 -1.69 1.67 3.41 -1.19 -1.80 113.62 115.20 1fwa n SER 361 Ca 0.00 1.05 -0.18 0.00 -0.26 0.00 0.00 58.87 59.48 1fwa n SER 361 Cb 0.34 -0.89 -0.06 0.00 -0.26 0.00 0.00 64.21 63.33 1fwa n SER 361 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fwa n GLN 362 N 5.00 -1.48 -2.73 4.33 6.02 -0.50 -4.14 117.38 123.86 1fwa n GLN 362 Ca 0.37 1.00 -0.09 0.00 -0.01 0.00 0.00 57.00 58.27 1fwa n GLN 362 Cb -0.05 -5.39 0.05 0.00 1.02 0.00 0.00 30.24 25.87 1fwa n GLN 362 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fwa n ALA 363 N 0.40 2.39 -1.30 -1.58 0.00 -0.74 -4.88 120.51 114.79 1fwa n ALA 363 Ca -0.18 -2.54 0.00 0.00 0.00 0.00 0.00 53.44 50.72 1fwa n ALA 363 Cb 0.59 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1fwa n ALA 363 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1fwa n MET 364 N -0.15 0.00 -3.62 0.00 2.81 -1.23 -4.95 117.12 109.97 1fwa n MET 364 Ca 0.07 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.92 1fwa n MET 364 Cb 0.80 -1.55 -0.03 0.00 -0.71 0.00 0.00 33.22 31.73 1fwa n MET 364 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1fwa s GLY 365 N -2.31 -0.10 -0.31 3.03 0.00 -0.90 -4.44 107.32 102.28 1fwa s GLY 365 Ca 0.00 2.27 -0.03 0.00 0.00 0.00 0.00 44.72 46.96 1fwa s GLY 365 CO 0.00 0.89 0.03 0.50 0.00 0.00 0.00 173.10 174.51 1fwa s ARG 366 N -1.53 2.46 0.54 2.90 0.52 -1.26 -1.42 118.95 121.16 1fwa s ARG 366 Ca 0.08 -1.26 0.25 0.00 -0.52 0.00 0.00 55.73 54.28 1fwa s ARG 366 Cb -0.01 -3.25 1.41 0.00 0.52 0.00 0.00 34.95 33.61 1fwa s ARG 366 CO -0.05 -0.64 2.01 -0.24 0.02 0.00 0.00 175.30 176.40 1fwa h VAL 367 N 6.40 0.73 -0.65 3.52 3.04 -1.91 -1.51 116.25 125.86 1fwa h VAL 367 Ca -0.21 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.48 1fwa h VAL 367 Cb 1.07 0.76 0.00 0.00 -2.01 0.00 0.00 31.29 31.10 1fwa h VAL 367 CO 0.55 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.72 1fwa n GLY 368 N -1.62 2.10 0.13 3.17 0.00 -1.26 -4.43 105.19 103.28 1fwa n GLY 368 Ca 0.08 -0.71 0.09 0.00 0.00 0.00 0.00 46.02 45.48 1fwa n GLY 368 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fwa n GLU 369 N 1.37 1.14 -0.00 1.61 1.02 -0.57 -4.78 120.64 120.44 1fwa n GLU 369 Ca 0.22 -2.42 -0.13 0.00 -0.02 0.00 0.00 57.16 54.82 1fwa n GLU 369 Cb 0.58 -1.39 -0.09 0.00 -0.02 0.00 0.00 31.44 30.52 1fwa n GLU 369 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1fwa h VAL 370 N 0.78 1.27 0.24 2.62 2.07 -1.77 -1.91 116.25 119.56 1fwa h VAL 370 Ca -0.00 -0.81 -0.01 0.00 0.82 0.00 0.00 66.70 66.70 1fwa h VAL 370 Cb 1.04 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 1fwa h VAL 370 CO 0.00 0.21 -0.12 0.40 0.02 0.00 0.00 177.57 178.09 1fwa h ILE 371 N -0.32 0.81 -0.53 4.57 2.04 -1.89 -2.65 117.51 119.55 1fwa h ILE 371 Ca 0.00 -0.66 0.11 0.00 1.00 0.00 0.00 64.86 65.31 1fwa h ILE 371 Cb 0.35 1.18 -0.09 0.00 -0.74 0.00 0.00 36.82 37.51 1fwa h ILE 371 CO 0.00 0.14 -0.07 0.25 0.00 0.00 0.00 178.15 178.47 1fwa h LEU 372 N -0.68 -0.36 -0.89 1.44 6.46 -1.63 -1.66 115.31 117.99 1fwa h LEU 372 Ca -0.03 0.14 -0.11 0.00 -0.12 0.00 0.00 57.88 57.76 1fwa h LEU 372 Cb 0.47 0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 1fwa h LEU 372 CO 0.05 -0.13 -0.42 0.03 -0.62 0.00 0.00 178.44 177.35 1fwa h ARG 373 N 0.05 0.28 -0.76 1.25 3.08 -1.40 -2.21 114.38 114.67 1fwa h ARG 373 Ca 0.26 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1fwa h ARG 373 Cb 0.41 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.42 1fwa h ARG 373 CO -0.49 0.66 0.46 1.15 -1.07 0.00 0.00 179.97 180.67 1fwa h THR 374 N 0.23 1.22 0.00 2.04 2.02 -0.94 -1.49 112.91 115.99 1fwa h THR 374 Ca 0.02 -0.48 -0.13 0.00 0.77 0.00 0.00 66.41 66.59 1fwa h THR 374 Cb 0.85 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1fwa h THR 374 CO 0.07 0.23 -0.64 -0.50 0.37 0.00 0.00 175.52 175.05 1fwa h TRP 375 N 1.05 0.00 -0.33 3.16 4.06 -1.24 -2.47 115.95 120.18 1fwa h TRP 375 Ca 0.27 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 61.12 1fwa h TRP 375 Cb -0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.11 1fwa h TRP 375 CO -0.01 0.64 -0.23 1.96 -3.56 0.00 0.00 178.44 177.24 1fwa h GLN 376 N 0.00 0.63 -0.17 0.49 4.20 -0.85 -1.07 115.11 118.34 1fwa h GLN 376 Ca -0.01 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.44 1fwa h GLN 376 Cb 1.16 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.90 1fwa h GLN 376 CO 0.08 0.81 0.03 0.28 -0.67 0.00 0.00 178.83 179.36 1fwa h VAL 377 N 0.56 1.22 -0.61 -0.54 2.07 -1.05 -1.04 116.25 116.85 1fwa h VAL 377 Ca 0.08 -0.73 0.07 0.00 0.82 0.00 0.00 66.70 66.94 1fwa h VAL 377 Cb 0.70 1.37 -0.06 0.00 -1.52 0.00 0.00 31.29 31.78 1fwa h VAL 377 CO 0.05 0.22 0.30 0.00 0.02 0.00 0.00 177.57 178.17 1fwa h ALA 378 N 0.82 0.81 0.16 1.67 0.00 -1.16 0.66 119.26 122.21 1fwa h ALA 378 Ca 0.05 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1fwa h ALA 378 Cb 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1fwa h ALA 378 CO 0.00 -0.06 -0.08 1.25 0.00 0.00 0.00 179.25 180.37 1fwa h HIS 379 N 0.55 -0.20 -0.17 0.00 6.17 -1.06 -0.32 115.15 120.12 1fwa h HIS 379 Ca 0.29 -0.00 -0.02 0.00 0.71 0.00 0.00 60.37 61.34 1fwa h HIS 379 Cb 0.24 0.07 -0.01 0.00 2.52 0.00 0.00 27.41 30.23 1fwa h HIS 379 CO -0.11 -0.09 0.02 0.00 0.71 0.00 0.00 177.93 178.46 1fwa h ARG 380 N -0.25 0.25 0.01 5.26 2.47 -0.69 -0.84 114.38 120.59 1fwa h ARG 380 Ca -0.02 -0.03 -0.24 0.00 -1.26 0.00 0.00 59.98 58.43 1fwa h ARG 380 Cb 0.19 -0.05 0.01 0.00 -1.65 0.00 0.00 29.97 28.47 1fwa h ARG 380 CO 0.04 0.25 -0.98 0.52 0.56 0.00 0.00 179.97 180.36 1fwa h MET 381 N 0.25 0.44 -0.25 0.04 2.86 -0.60 -1.74 114.93 115.93 1fwa h MET 381 Ca 0.06 -0.49 -0.04 0.00 -2.06 0.00 0.00 59.70 57.17 1fwa h MET 381 Cb 0.14 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 1fwa h MET 381 CO 0.00 1.15 0.01 -0.22 1.06 0.00 0.00 176.91 178.91 1fwa h LYS 382 N 0.24 0.43 -0.76 1.72 3.64 -0.56 0.37 116.57 121.65 1fwa h LYS 382 Ca -0.09 -0.13 0.04 0.00 -1.27 0.00 0.00 60.65 59.20 1fwa h LYS 382 Cb 1.63 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.35 1fwa h LYS 382 CO 0.17 0.60 0.47 0.28 -2.27 0.00 0.00 179.45 178.70 1fwa h VAL 383 N 0.21 1.07 0.12 2.00 2.07 -1.19 -0.30 116.25 120.23 1fwa h VAL 383 Ca 0.07 -0.31 -0.26 0.00 0.82 0.00 0.00 66.70 67.02 1fwa h VAL 383 Cb 0.39 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1fwa h VAL 383 CO 0.01 0.16 -1.30 1.56 0.02 0.00 0.00 177.57 178.03 1fwa h GLN 384 N 0.90 0.26 -0.00 1.57 4.20 -1.14 -3.40 115.11 117.48 1fwa h GLN 384 Ca 0.32 -0.44 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1fwa h GLN 384 Cb 0.08 0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.02 1fwa h GLN 384 CO -0.14 1.21 -0.77 0.54 -0.67 0.00 0.00 178.83 179.00 1fwa n ARG 385 N -3.96 1.13 0.00 1.46 1.74 0.13 -5.08 116.66 112.08 1fwa n ARG 385 Ca -0.23 -0.16 0.00 0.00 -0.77 0.00 0.00 57.85 56.69 1fwa n ARG 385 Cb 0.89 -1.35 0.00 0.00 -1.02 0.00 0.00 32.46 30.97 1fwa n ARG 385 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fwa n GLY 386 N 1.40 -1.02 3.77 -0.13 0.00 -0.12 -4.87 105.19 104.20 1fwa n GLY 386 Ca 0.04 -1.22 -0.37 0.00 0.00 0.00 0.00 46.02 44.48 1fwa n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwa s ALA 387 N -1.14 2.92 0.53 4.61 0.00 -1.26 -4.58 121.76 122.84 1fwa s ALA 387 Ca 0.00 0.99 -0.17 0.00 0.00 0.00 0.00 51.96 52.78 1fwa s ALA 387 Cb 0.00 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.64 1fwa s ALA 387 CO 0.00 -0.79 1.01 -0.51 0.00 0.00 0.00 175.76 175.47 1fwa s LEU 388 N -3.19 3.60 0.59 0.00 1.43 -1.26 -4.92 118.68 114.94 1fwa s LEU 388 Ca 0.66 1.65 0.29 0.00 -1.03 0.00 0.00 54.13 55.70 1fwa s LEU 388 Cb -0.30 -4.52 1.70 0.00 0.03 0.00 0.00 46.19 43.10 1fwa s LEU 388 CO 0.36 -0.75 2.13 0.00 0.23 0.00 0.00 176.35 178.32 1fwa h ALA 389 N 0.83 1.74 0.00 4.21 0.00 -1.99 -1.42 119.26 122.64 1fwa h ALA 389 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1fwa h ALA 389 Cb 1.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1fwa h ALA 389 CO 0.60 -0.25 -0.21 0.39 0.00 0.00 0.00 179.25 179.78 1fwa n GLU 390 N -3.78 0.00 -2.00 0.00 4.71 -1.26 -4.92 120.64 113.40 1fwa n GLU 390 Ca 0.01 0.00 -0.39 0.00 -0.01 0.00 0.00 57.16 56.77 1fwa n GLU 390 Cb 0.28 -1.50 0.01 0.00 -1.01 0.00 0.00 31.44 29.22 1fwa n GLU 390 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1fwa s GLU 391 N -3.00 3.72 -0.02 3.49 0.41 -0.54 -4.92 118.70 117.85 1fwa s GLU 391 Ca 0.13 2.14 0.03 0.00 -0.41 0.00 0.00 54.97 56.86 1fwa s GLU 391 Cb 0.18 -2.58 -0.00 0.00 -1.78 0.00 0.00 34.13 29.95 1fwa s GLU 391 CO 0.60 -0.69 -0.09 -0.08 -0.49 0.00 0.00 175.26 174.51 1fwa s THR 392 N -1.31 0.78 0.07 3.63 -1.32 -1.26 -5.00 115.64 111.22 1fwa s THR 392 Ca 0.62 -0.39 0.00 0.00 -1.21 0.00 0.00 61.69 60.71 1fwa s THR 392 Cb -0.38 -0.67 0.00 0.00 -1.51 0.00 0.00 72.50 69.94 1fwa s THR 392 CO 0.47 0.23 0.00 0.61 -2.21 0.00 0.00 174.62 173.72 1fwa n GLY 393 N 3.07 -1.72 2.94 6.08 0.00 -1.26 -4.49 105.19 109.82 1fwa n GLY 393 Ca -0.16 -1.46 -0.43 0.00 0.00 0.00 0.00 46.02 43.98 1fwa n GLY 393 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1fwa n ASP 394 N -2.16 5.85 -3.34 1.61 2.03 -1.26 -4.91 116.55 114.37 1fwa n ASP 394 Ca -0.00 -3.28 -0.08 0.00 0.52 0.00 0.00 54.79 51.94 1fwa n ASP 394 Cb 0.11 -1.36 0.00 0.00 -0.72 0.00 0.00 41.12 39.15 1fwa n ASP 394 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1fwa s ASN 395 N -0.63 -0.10 -0.24 1.67 6.03 -1.26 -4.98 114.94 115.42 1fwa s ASN 395 Ca 0.35 -0.92 0.13 0.00 -1.03 0.00 0.00 52.86 51.38 1fwa s ASN 395 Cb 0.07 0.80 0.54 0.00 -3.03 0.00 0.00 41.25 39.63 1fwa s ASN 395 CO 0.06 -1.54 1.49 0.47 -2.03 0.00 0.00 177.10 175.55 1fwa n ASP 396 N -1.00 3.44 -0.23 3.54 8.00 -0.25 -4.78 116.55 125.28 1fwa n ASP 396 Ca -0.06 -3.33 0.00 0.00 0.71 0.00 0.00 54.79 52.11 1fwa n ASP 396 Cb 0.60 -0.60 0.07 0.00 -0.02 0.00 0.00 41.12 41.16 1fwa n ASP 396 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1fwa h ASN 397 N 1.54 -0.64 -0.49 -2.24 4.21 -1.91 -0.31 115.58 115.75 1fwa h ASN 397 Ca 0.13 0.20 -0.05 0.00 1.21 0.00 0.00 56.30 57.79 1fwa h ASN 397 Cb 1.65 0.42 -0.02 0.00 -1.12 0.00 0.00 38.32 39.25 1fwa h ASN 397 CO 0.36 -0.22 0.13 0.15 -1.29 0.00 0.00 177.43 176.55 1fwa h PHE 398 N -0.00 0.81 -0.50 1.19 3.04 -1.91 -1.21 116.94 118.35 1fwa h PHE 398 Ca 0.32 -0.09 -0.03 0.00 3.98 0.00 0.00 57.97 62.15 1fwa h PHE 398 Cb 0.49 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.75 1fwa h PHE 398 CO -0.55 0.72 0.20 -0.09 -2.02 0.00 0.00 178.31 176.57 1fwa h ARG 399 N 0.66 0.72 -0.54 1.11 2.43 -1.76 -0.63 114.38 116.37 1fwa h ARG 399 Ca 0.15 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 59.14 1fwa h ARG 399 Cb 0.31 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1fwa h ARG 399 CO -0.00 0.60 0.04 0.28 -1.51 0.00 0.00 179.97 179.38 1fwa h VAL 400 N 0.72 1.26 -0.41 0.20 2.07 -0.67 -1.84 116.25 117.57 1fwa h VAL 400 Ca 0.17 -1.04 -0.11 0.00 0.82 0.00 0.00 66.70 66.55 1fwa h VAL 400 Cb 0.15 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1fwa h VAL 400 CO -0.02 0.37 -0.17 0.11 0.02 0.00 0.00 177.57 177.88 1fwa h LYS 401 N 0.80 0.78 -0.41 1.57 1.57 -0.64 -0.92 116.57 119.32 1fwa h LYS 401 Ca 0.16 -0.29 -0.04 0.00 -1.87 0.00 0.00 60.65 58.61 1fwa h LYS 401 Cb 0.47 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 1fwa h LYS 401 CO 0.02 0.90 0.09 -0.09 -0.57 0.00 0.00 179.45 179.80 1fwa h ARG 402 N 0.69 0.66 -0.00 3.15 2.43 -0.97 -2.89 114.38 117.45 1fwa h ARG 402 Ca 0.11 -0.16 -0.22 0.00 -0.81 0.00 0.00 59.98 58.89 1fwa h ARG 402 Cb 0.67 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1fwa h ARG 402 CO 0.05 0.69 -0.92 1.88 -1.51 0.00 0.00 179.97 180.16 1fwa h TYR 403 N 0.52 0.55 -0.04 2.20 -1.99 -1.24 -3.20 116.97 113.78 1fwa h TYR 403 Ca 0.13 -0.30 -0.08 0.00 2.00 0.00 0.00 58.73 60.48 1fwa h TYR 403 Cb 0.33 -0.06 -0.01 0.00 2.00 0.00 0.00 36.73 38.99 1fwa h TYR 403 CO 0.02 1.11 -0.36 0.97 -0.00 0.00 0.00 178.16 179.90 1fwa h ILE 404 N 0.21 1.27 0.00 -2.88 2.10 -1.20 -2.35 117.51 114.66 1fwa h ILE 404 Ca -0.07 -1.30 -0.02 0.00 1.08 0.00 0.00 64.86 64.56 1fwa h ILE 404 Cb 1.55 1.65 -0.00 0.00 -1.09 0.00 0.00 36.82 38.92 1fwa h ILE 404 CO 0.16 0.38 -0.08 0.00 -1.08 0.00 0.00 178.15 177.52 1fwa h ALA 405 N 1.57 1.46 0.00 0.18 0.00 -1.50 -2.81 119.26 118.16 1fwa h ALA 405 Ca 0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1fwa h ALA 405 Cb 0.67 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1fwa h ALA 405 CO 0.05 0.10 -0.17 0.87 0.00 0.00 0.00 179.25 180.10 1fwa h LYS 406 N 0.00 0.00 0.00 0.00 1.57 -1.49 -1.79 116.57 114.86 1fwa h LYS 406 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fwa h LYS 406 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1fwa h LYS 406 CO 0.01 0.17 -0.00 2.48 -0.57 0.00 0.00 179.45 181.53 1fwa n TYR 407 N -4.18 0.00 0.00 -1.35 0.18 -1.07 -2.02 117.16 108.72 1fwa n TYR 407 Ca -0.02 -0.71 0.00 0.00 1.88 0.00 0.00 57.90 59.05 1fwa n TYR 407 Cb 0.24 -0.09 0.00 0.00 -0.38 0.00 0.00 39.34 39.11 1fwa n TYR 407 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1fwa n THR 408 N -0.89 0.00 -0.13 -3.48 -2.24 -1.17 -0.27 114.28 106.09 1fwa n THR 408 Ca 0.07 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.74 1fwa n THR 408 Cb 0.42 -0.05 0.02 0.00 -2.10 0.00 0.00 70.33 68.62 1fwa n THR 408 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1fwa h ILE 409 N 0.00 1.27 -0.52 2.28 6.09 -1.40 -2.99 117.51 122.24 1fwa h ILE 409 Ca 0.00 -1.42 -0.04 0.00 -1.37 0.00 0.00 64.86 62.03 1fwa h ILE 409 Cb 0.00 1.20 -0.02 0.00 0.47 0.00 0.00 36.82 38.47 1fwa h ILE 409 CO 0.00 0.48 0.17 0.78 -3.07 0.00 0.00 178.15 176.51 1fwa h ASN 410 N 0.80 0.76 -0.21 2.19 2.35 -1.63 -0.06 115.58 119.77 1fwa h ASN 410 Ca 0.10 -0.20 -0.08 0.00 -0.55 0.00 0.00 56.30 55.57 1fwa h ASN 410 Cb 0.83 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 1fwa h ASN 410 CO 0.07 0.76 -0.10 -0.65 -1.65 0.00 0.00 177.43 175.86 1fwa h PRO 411 N 0.72 0.59 -0.58 0.81 0.11 -1.76 -1.06 132.00 130.82 1fwa h PRO 411 Ca 0.17 -0.17 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 1fwa h PRO 411 Cb 0.27 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.29 1fwa h PRO 411 CO -0.01 0.69 0.22 0.00 -0.21 0.00 0.00 178.00 178.69 1fwa h ALA 412 N 1.35 0.75 -0.13 -0.75 0.00 -1.28 -2.08 119.26 117.12 1fwa h ALA 412 Ca 0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1fwa h ALA 412 Cb 0.50 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1fwa h ALA 412 CO 0.03 0.38 -0.01 -0.07 0.00 0.00 0.00 179.25 179.58 1fwa h LEU 413 N 0.80 0.24 -1.01 0.00 3.38 -0.77 -0.95 115.31 117.01 1fwa h LEU 413 Ca 0.19 -0.33 0.10 0.00 0.09 0.00 0.00 57.88 57.94 1fwa h LEU 413 Cb 0.22 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 1fwa h LEU 413 CO -0.01 0.51 0.64 0.74 0.09 0.00 0.00 178.44 180.40 1fwa h THR 414 N -0.04 0.97 -0.65 0.22 2.02 -1.10 -2.69 112.91 111.65 1fwa h THR 414 Ca 0.04 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1fwa h THR 414 Cb 0.39 -0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.62 1fwa h THR 414 CO 0.01 0.19 0.00 1.41 0.37 0.00 0.00 175.52 177.50 1fwa n HIS 415 N -4.58 0.86 -2.35 3.16 8.25 -0.79 -4.83 115.22 114.94 1fwa n HIS 415 Ca 0.18 -0.43 -0.10 0.00 -0.26 0.00 0.00 57.72 57.11 1fwa n HIS 415 Cb 0.30 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.42 1fwa n HIS 415 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fwa n GLY 416 N 1.56 0.03 0.00 -1.41 0.00 -0.97 -4.74 105.19 99.66 1fwa n GLY 416 Ca 0.22 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1fwa n GLY 416 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1fwa n ILE 417 N -3.94 0.61 0.28 -0.61 -5.35 -0.40 -2.09 119.36 107.86 1fwa n ILE 417 Ca -0.09 -0.66 0.12 0.00 -0.27 0.00 0.00 62.75 61.85 1fwa n ILE 417 Cb 0.58 0.74 0.58 0.00 -1.74 0.00 0.00 39.64 39.80 1fwa n ILE 417 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1fwa h ALA 418 N 0.00 1.00 0.00 -1.28 0.00 -1.62 -0.58 119.26 116.77 1fwa h ALA 418 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fwa h ALA 418 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1fwa h ALA 418 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 179.25 180.37 1fwa h HIS 419 N 0.00 0.00 0.00 0.00 2.07 -1.89 -3.36 115.15 111.97 1fwa h HIS 419 Ca 0.00 0.00 -0.31 0.00 -2.85 0.00 0.00 60.37 57.21 1fwa h HIS 419 Cb 0.19 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.12 1fwa h HIS 419 CO 0.00 0.00 -2.11 0.39 -3.07 0.00 0.00 177.93 173.14 1fwa n GLU 420 N -2.97 0.46 -3.86 5.12 -0.58 -0.31 -4.74 120.64 113.76 1fwa n GLU 420 Ca 0.03 0.14 -0.17 0.00 -0.42 0.00 0.00 57.16 56.74 1fwa n GLU 420 Cb 0.41 -1.32 -0.06 0.00 -0.57 0.00 0.00 31.44 29.89 1fwa n GLU 420 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1fwa n VAL 421 N -3.40 0.00 0.00 2.62 0.24 -0.71 -0.59 118.33 116.49 1fwa n VAL 421 Ca -0.36 -2.02 0.00 0.00 -2.04 0.00 0.00 64.34 59.92 1fwa n VAL 421 Cb 0.83 0.98 0.00 0.00 -1.47 0.00 0.00 33.84 34.19 1fwa n VAL 421 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fwa n GLY 422 N -0.51 2.23 3.75 7.63 0.00 -1.26 -4.17 105.19 112.86 1fwa n GLY 422 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.02 1fwa n GLY 422 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fwa s SER 423 N -1.73 -0.23 -0.92 1.61 1.04 -1.26 -1.98 113.70 110.23 1fwa s SER 423 Ca 0.00 -0.42 -0.17 0.00 0.48 0.00 0.00 55.95 55.85 1fwa s SER 423 Cb 0.00 0.56 0.17 0.00 0.10 0.00 0.00 66.02 66.84 1fwa s SER 423 CO 0.00 -1.01 1.02 -0.63 0.98 0.00 0.00 173.24 173.59 1fwa s ILE 424 N -3.48 5.09 0.02 -1.02 1.01 -1.26 -4.92 121.20 116.64 1fwa s ILE 424 Ca 0.11 -2.00 0.00 0.00 0.00 0.00 0.00 60.65 58.76 1fwa s ILE 424 Cb -0.03 -4.67 -0.02 0.00 0.01 0.00 0.00 42.46 37.75 1fwa s ILE 424 CO 0.02 -1.34 -0.03 -1.61 0.00 0.00 0.00 174.94 171.98 1fwa s GLU 425 N 1.64 0.28 0.32 2.79 2.02 -1.26 -5.09 118.70 119.41 1fwa s GLU 425 Ca 0.28 -0.55 -0.29 0.00 0.02 0.00 0.00 54.97 54.44 1fwa s GLU 425 Cb -0.07 0.08 -0.12 0.00 0.10 0.00 0.00 34.13 34.12 1fwa s GLU 425 CO -0.09 -0.04 1.42 1.33 0.02 0.00 0.00 175.26 177.90 1fwa n VAL 426 N 1.77 1.64 0.00 2.63 0.24 -1.26 -2.44 118.33 120.90 1fwa n VAL 426 Ca -0.23 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 1fwa n VAL 426 Cb 0.56 -1.73 0.00 0.00 -1.47 0.00 0.00 33.84 31.19 1fwa n VAL 426 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fwa n GLY 427 N 1.19 2.28 3.87 7.63 0.00 0.40 -4.96 105.19 115.59 1fwa n GLY 427 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 1fwa n GLY 427 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fwa s LYS 428 N -0.65 3.81 0.29 1.61 1.02 -1.02 -4.77 119.74 120.03 1fwa s LYS 428 Ca 0.00 0.53 -0.30 0.00 0.02 0.00 0.00 55.97 56.23 1fwa s LYS 428 Cb 0.00 -2.36 -0.13 0.00 -0.52 0.00 0.00 37.83 34.82 1fwa s LYS 428 CO 0.00 -0.06 1.38 -0.11 -0.92 0.00 0.00 175.35 175.65 1fwa n LEU 429 N -1.30 3.51 -3.66 3.17 7.94 0.25 -0.90 117.00 126.02 1fwa n LEU 429 Ca 0.03 1.17 -0.42 0.00 -1.11 0.00 0.00 56.01 55.69 1fwa n LEU 429 Cb 0.54 -1.48 -0.02 0.00 0.53 0.00 0.00 43.42 42.99 1fwa n LEU 429 CO 0.47 -0.38 2.53 0.00 -1.11 0.00 0.00 177.39 178.90 1fwa n ALA 430 N 1.22 4.90 -3.01 1.96 0.00 0.35 -4.68 120.51 121.25 1fwa n ALA 430 Ca 0.08 -3.62 -0.44 0.00 0.00 0.00 0.00 53.44 49.46 1fwa n ALA 430 Cb 0.34 -3.55 -0.08 0.00 0.00 0.00 0.00 19.45 16.17 1fwa n ALA 430 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fwa s ASP 431 N 3.74 6.04 0.10 0.00 1.01 -1.26 -2.19 116.67 124.12 1fwa s ASP 431 Ca 0.51 -1.42 0.05 0.00 0.71 0.00 0.00 52.55 52.41 1fwa s ASP 431 Cb 0.14 -2.14 -0.04 0.00 1.01 0.00 0.00 42.92 41.90 1fwa s ASP 431 CO -0.02 -0.64 -0.13 -0.76 0.21 0.00 0.00 175.17 173.82 1fwa s LEU 432 N 1.59 2.37 -0.08 1.23 1.43 -0.50 -2.03 118.68 122.68 1fwa s LEU 432 Ca 0.04 -0.76 0.01 0.00 -1.03 0.00 0.00 54.13 52.39 1fwa s LEU 432 Cb -0.25 -0.50 0.02 0.00 0.03 0.00 0.00 46.19 45.49 1fwa s LEU 432 CO 0.05 -0.15 -0.10 -0.69 0.23 0.00 0.00 176.35 175.70 1fwa s VAL 433 N -1.97 1.02 -0.18 -1.59 1.01 -0.20 -0.15 120.40 118.34 1fwa s VAL 433 Ca 0.05 -0.37 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 1fwa s VAL 433 Cb -0.06 -0.98 -0.05 0.00 0.00 0.00 0.00 36.38 35.30 1fwa s VAL 433 CO 0.02 0.34 0.11 -0.69 0.00 0.00 0.00 175.10 174.88 1fwa s VAL 434 N 1.04 5.21 0.08 2.92 1.01 -0.16 -1.16 120.40 129.33 1fwa s VAL 434 Ca -0.08 0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.07 1fwa s VAL 434 Cb -0.15 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 1fwa s VAL 434 CO -0.01 0.47 -0.15 0.26 0.00 0.00 0.00 175.10 175.67 1fwa s TRP 435 N 0.14 1.32 -0.03 5.22 0.52 0.96 -0.32 118.94 126.76 1fwa s TRP 435 Ca 0.08 -0.45 -0.16 0.00 0.02 0.00 0.00 56.10 55.59 1fwa s TRP 435 Cb -0.12 -0.74 -0.05 0.00 -1.15 0.00 0.00 33.47 31.41 1fwa s TRP 435 CO -0.01 0.09 0.42 0.45 0.02 0.00 0.00 176.95 177.92 1fwa s SER 436 N -1.77 6.78 0.35 2.95 0.15 -1.26 -0.65 113.70 120.25 1fwa s SER 436 Ca -0.00 0.93 0.12 0.00 0.70 0.00 0.00 55.95 57.69 1fwa s SER 436 Cb -0.10 -2.26 0.92 0.00 -1.71 0.00 0.00 66.02 62.87 1fwa s SER 436 CO 0.03 0.25 1.79 -0.65 1.20 0.00 0.00 173.24 175.85 1fwa h PRO 437 N 5.19 0.56 0.00 5.44 0.11 -1.92 -0.46 132.00 140.92 1fwa h PRO 437 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1fwa h PRO 437 Cb 1.21 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1fwa h PRO 437 CO 0.65 0.37 0.00 0.00 -0.21 0.00 0.00 178.00 178.81 1fwa h ALA 438 N 1.64 1.00 -0.02 -0.75 0.00 -1.88 -0.77 119.26 118.49 1fwa h ALA 438 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.48 1fwa h ALA 438 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1fwa h ALA 438 CO -0.33 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.11 1fwa n PHE 439 N -3.03 0.04 -1.61 0.00 3.72 -0.27 -4.53 117.46 111.79 1fwa n PHE 439 Ca -0.00 -0.63 -0.50 0.00 -0.05 0.00 0.00 57.45 56.27 1fwa n PHE 439 Cb 0.23 -0.08 -0.05 0.00 -0.94 0.00 0.00 39.48 38.64 1fwa n PHE 439 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1fwa n PHE 440 N -0.68 1.66 -0.42 1.38 7.35 -0.68 -0.99 117.46 125.07 1fwa n PHE 440 Ca 0.05 0.56 0.00 0.00 -0.76 0.00 0.00 57.45 57.30 1fwa n PHE 440 Cb 0.36 -2.37 0.00 0.00 0.35 0.00 0.00 39.48 37.82 1fwa n PHE 440 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1fwa n GLY 441 N 2.59 1.43 0.60 7.13 0.00 -1.26 -4.57 105.19 111.11 1fwa n GLY 441 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 1fwa n GLY 441 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1fwa n VAL 442 N -2.00 1.25 -3.61 1.61 0.31 -0.16 -3.57 118.33 112.16 1fwa n VAL 442 Ca 0.00 0.21 -0.26 0.00 -0.01 0.00 0.00 64.34 64.28 1fwa n VAL 442 Cb 0.00 -1.90 -0.17 0.00 -0.91 0.00 0.00 33.84 30.86 1fwa n VAL 442 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1fwa s LYS 443 N -2.39 0.06 0.67 5.55 1.02 -0.94 -4.91 119.74 118.81 1fwa s LYS 443 Ca -0.14 -0.09 -0.15 0.00 0.02 0.00 0.00 55.97 55.61 1fwa s LYS 443 Cb 0.03 -1.81 0.01 0.00 -0.52 0.00 0.00 37.83 35.54 1fwa s LYS 443 CO 0.20 -0.68 1.12 -2.14 -0.92 0.00 0.00 175.35 172.93 1fwa s PRO 444 N 2.14 2.69 -0.04 -1.68 0.02 -1.26 -4.72 135.00 132.15 1fwa s PRO 444 Ca 0.02 1.42 0.05 0.00 0.02 0.00 0.00 61.00 62.51 1fwa s PRO 444 Cb -0.16 -1.93 -0.24 0.00 0.02 0.00 0.00 34.50 32.18 1fwa s PRO 444 CO -0.10 -1.34 0.69 0.00 -0.33 0.00 0.00 177.00 175.92 1fwa h ALA 445 N -0.07 0.58 -2.26 -1.55 0.00 -1.03 -3.42 119.26 111.52 1fwa h ALA 445 Ca -0.47 -1.34 -0.05 0.00 0.00 0.00 0.00 54.91 53.05 1fwa h ALA 445 Cb 1.25 0.44 -0.22 0.00 0.00 0.00 0.00 17.79 19.26 1fwa h ALA 445 CO 0.53 1.42 -0.04 0.99 0.00 0.00 0.00 179.25 182.15 1fwa s THR 446 N -2.60 -0.00 -0.21 0.00 2.01 -1.08 -4.18 115.64 109.58 1fwa s THR 446 Ca -0.09 0.01 0.00 0.00 0.31 0.00 0.00 61.69 61.93 1fwa s THR 446 Cb 0.08 -0.85 0.02 0.00 0.01 0.00 0.00 72.50 71.76 1fwa s THR 446 CO 0.82 0.01 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.92 1fwa s VAL 447 N 0.84 2.36 -0.19 3.82 1.01 -0.83 -0.99 120.40 126.42 1fwa s VAL 447 Ca -0.04 -1.02 -0.07 0.00 0.00 0.00 0.00 61.98 60.85 1fwa s VAL 447 Cb -0.05 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 1fwa s VAL 447 CO -0.07 0.38 0.05 -0.63 0.00 0.00 0.00 175.10 174.84 1fwa s ILE 448 N 1.29 4.61 -0.20 2.22 1.01 0.78 -1.02 121.20 129.89 1fwa s ILE 448 Ca 0.02 -0.09 0.01 0.00 0.00 0.00 0.00 60.65 60.58 1fwa s ILE 448 Cb -0.15 -3.09 0.02 0.00 0.01 0.00 0.00 42.46 39.26 1fwa s ILE 448 CO -0.09 0.44 -0.16 -0.54 0.00 0.00 0.00 174.94 174.58 1fwa s LYS 449 N 0.61 2.92 -1.43 2.79 1.02 0.11 -1.41 119.74 124.34 1fwa s LYS 449 Ca 0.03 -0.89 -0.03 0.00 0.02 0.00 0.00 55.97 55.10 1fwa s LYS 449 Cb -0.13 -2.68 0.01 0.00 -0.52 0.00 0.00 37.83 34.51 1fwa s LYS 449 CO 0.02 -0.27 0.25 0.41 -0.92 0.00 0.00 175.35 174.84 1fwa n GLY 450 N 4.62 -0.50 0.96 -3.33 0.00 -0.93 -1.58 105.19 104.42 1fwa n GLY 450 Ca -0.19 0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1fwa n GLY 450 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fwa n GLY 451 N -1.12 0.75 3.24 -0.02 0.00 -0.95 -4.26 105.19 102.83 1fwa n GLY 451 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 1fwa n GLY 451 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fwa s MET 452 N -0.68 1.55 0.03 1.61 -1.94 -0.62 -4.96 119.30 114.30 1fwa s MET 452 Ca 0.00 -0.86 -0.30 0.00 -1.71 0.00 0.00 55.69 52.82 1fwa s MET 452 Cb 0.00 -1.59 -0.06 0.00 2.01 0.00 0.00 34.83 35.18 1fwa s MET 452 CO 0.00 0.42 1.46 0.42 -0.01 0.00 0.00 175.02 177.31 1fwa s ILE 453 N -0.65 3.50 -0.18 2.53 1.01 -1.26 0.09 121.20 126.23 1fwa s ILE 453 Ca 0.08 0.93 0.16 0.00 0.00 0.00 0.00 60.65 61.82 1fwa s ILE 453 Cb -0.08 -3.60 -0.22 0.00 0.01 0.00 0.00 42.46 38.56 1fwa s ILE 453 CO 0.01 0.01 0.05 0.00 0.00 0.00 0.00 174.94 175.01 1fwa n ALA 454 N 5.22 1.54 -3.46 9.38 0.00 -0.19 -1.57 120.51 131.44 1fwa n ALA 454 Ca 0.13 -1.21 -0.16 0.00 0.00 0.00 0.00 53.44 52.20 1fwa n ALA 454 Cb 0.43 -0.14 -0.07 0.00 0.00 0.00 0.00 19.45 19.67 1fwa n ALA 454 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1fwa s ILE 455 N -2.45 0.01 0.05 0.00 2.07 -1.20 -0.69 121.20 118.99 1fwa s ILE 455 Ca -0.10 -0.11 -0.27 0.00 -1.41 0.00 0.00 60.65 58.76 1fwa s ILE 455 Cb 0.06 -0.89 0.09 0.00 0.13 0.00 0.00 42.46 41.85 1fwa s ILE 455 CO 0.75 -0.06 0.89 0.00 -1.91 0.00 0.00 174.94 174.61 1fwa s ALA 456 N -0.96 -1.77 0.29 1.50 0.00 -1.17 -1.96 121.76 117.69 1fwa s ALA 456 Ca -0.10 0.75 -0.29 0.00 0.00 0.00 0.00 51.96 52.32 1fwa s ALA 456 Cb -0.02 0.50 -0.10 0.00 0.00 0.00 0.00 23.12 23.51 1fwa s ALA 456 CO 0.07 -0.79 1.20 -2.14 0.00 0.00 0.00 175.76 174.10 1fwa s PRO 457 N -3.20 4.51 -0.02 0.00 0.02 -1.26 -2.02 135.00 133.03 1fwa s PRO 457 Ca 0.07 1.98 -0.00 0.00 0.02 0.00 0.00 61.00 63.07 1fwa s PRO 457 Cb -0.01 -3.15 0.03 0.00 0.02 0.00 0.00 34.50 31.39 1fwa s PRO 457 CO -0.06 0.01 0.03 1.41 -0.33 0.00 0.00 177.00 178.06 1fwa s MET 458 N -1.41 -0.03 0.00 5.54 1.75 -0.23 -4.90 119.30 120.01 1fwa s MET 458 Ca 0.47 0.16 0.00 0.00 -1.25 0.00 0.00 55.69 55.08 1fwa s MET 458 Cb -0.35 -0.21 0.00 0.00 2.84 0.00 0.00 34.83 37.11 1fwa s MET 458 CO 0.45 -0.14 0.00 0.41 -0.65 0.00 0.00 175.02 175.09 1fwa n GLY 459 N 4.01 -0.07 3.68 2.11 0.00 -0.30 -2.36 105.19 112.25 1fwa n GLY 459 Ca -0.25 -1.81 -0.66 0.00 0.00 0.00 0.00 46.02 43.30 1fwa n GLY 459 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1fwa n ASP 460 N -2.28 1.25 0.16 1.61 -0.08 -0.25 -4.84 116.55 112.12 1fwa n ASP 460 Ca 0.00 1.10 0.04 0.00 -1.51 0.00 0.00 54.79 54.42 1fwa n ASP 460 Cb 0.00 -0.91 0.44 0.00 2.34 0.00 0.00 41.12 42.99 1fwa n ASP 460 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1fwa h ILE 461 N 5.32 1.15 -0.02 5.18 1.08 -1.92 -2.18 117.51 126.12 1fwa h ILE 461 Ca -0.39 -0.68 0.00 0.00 -0.39 0.00 0.00 64.86 63.40 1fwa h ILE 461 Cb 1.37 1.22 0.00 0.00 -3.07 0.00 0.00 36.82 36.34 1fwa h ILE 461 CO 0.99 0.21 -0.08 -3.20 -0.69 0.00 0.00 178.15 175.39 1fwa n ASN 462 N -4.31 1.67 -4.68 1.72 5.15 -1.26 -4.97 115.26 108.57 1fwa n ASN 462 Ca -0.01 -1.46 -0.29 0.00 -0.60 0.00 0.00 54.58 52.22 1fwa n ASN 462 Cb 0.25 0.05 0.16 0.00 -0.53 0.00 0.00 39.78 39.71 1fwa n ASN 462 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1fwa s ALA 463 N -2.12 1.13 -0.46 5.20 0.00 -0.82 -4.93 121.76 119.75 1fwa s ALA 463 Ca 0.33 -0.19 0.26 0.00 0.00 0.00 0.00 51.96 52.36 1fwa s ALA 463 Cb 0.20 -3.17 0.73 0.00 0.00 0.00 0.00 23.12 20.89 1fwa s ALA 463 CO 0.38 -2.69 1.74 0.66 0.00 0.00 0.00 175.76 175.84 1fwa h SER 464 N -1.79 0.00 -5.41 0.00 4.64 -1.93 -3.45 113.55 105.61 1fwa h SER 464 Ca -0.52 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.62 1fwa h SER 464 Cb 1.31 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.25 1fwa h SER 464 CO 0.55 0.00 -0.60 0.27 -0.87 0.00 0.00 176.83 176.18 1fwa s ILE 465 N -3.26 0.09 -1.38 0.95 -4.36 -1.26 -5.07 121.20 106.92 1fwa s ILE 465 Ca 0.07 -1.84 0.30 0.00 -0.26 0.00 0.00 60.65 58.92 1fwa s ILE 465 Cb 0.09 -2.03 0.50 0.00 1.25 0.00 0.00 42.46 42.26 1fwa s ILE 465 CO 0.59 -0.43 2.04 -0.81 0.24 0.00 0.00 174.94 176.58 1fwa n PRO 466 N -0.12 0.38 0.09 0.37 -0.04 -1.26 -4.18 135.00 130.25 1fwa n PRO 466 Ca -0.05 -0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.43 1fwa n PRO 466 Cb 0.64 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.58 1fwa n PRO 466 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1fwa h THR 467 N 0.00 0.55 -4.04 0.52 1.35 -1.92 -0.79 112.91 108.58 1fwa h THR 467 Ca 0.00 -1.91 -0.56 0.00 -0.55 0.00 0.00 66.41 63.40 1fwa h THR 467 Cb 0.31 2.12 0.15 0.00 -1.73 0.00 0.00 68.15 69.00 1fwa h THR 467 CO 0.00 0.32 0.57 -2.65 -0.25 0.00 0.00 175.52 173.50 1fwa n PRO 468 N -3.01 1.50 -1.64 4.72 -0.02 -1.26 -4.79 135.00 130.50 1fwa n PRO 468 Ca -0.03 0.56 -0.33 0.00 -2.02 0.00 0.00 63.50 61.68 1fwa n PRO 468 Cb 0.75 -2.56 0.06 0.00 -0.02 0.00 0.00 33.50 31.73 1fwa n PRO 468 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1fwa s GLN 469 N -3.04 2.60 0.16 -0.52 -1.52 -1.26 -1.09 119.66 114.99 1fwa s GLN 469 Ca 0.75 1.44 -0.27 0.00 -1.95 0.00 0.00 55.36 55.34 1fwa s GLN 469 Cb -0.40 -1.92 -0.08 0.00 -0.22 0.00 0.00 33.01 30.39 1fwa s GLN 469 CO 0.46 -1.41 0.83 -1.25 -0.25 0.00 0.00 175.29 173.66 1fwa s PRO 470 N -4.13 4.63 -0.25 2.91 0.04 -1.26 -4.23 135.00 132.70 1fwa s PRO 470 Ca 0.68 1.24 -0.07 0.00 0.04 0.00 0.00 61.00 62.89 1fwa s PRO 470 Cb -0.22 -3.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.01 1fwa s PRO 470 CO 0.44 0.48 0.07 0.08 0.04 0.00 0.00 177.00 178.11 1fwa s VAL 471 N -0.88 4.24 0.12 -0.36 1.01 -1.26 -3.51 120.40 119.76 1fwa s VAL 471 Ca 0.38 -0.25 -0.11 0.00 0.00 0.00 0.00 61.98 62.00 1fwa s VAL 471 Cb -0.23 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 33.15 1fwa s VAL 471 CO 0.27 0.31 0.29 -1.38 0.00 0.00 0.00 175.10 174.59 1fwa s HIS 472 N 1.60 0.09 0.06 5.22 -3.43 -1.00 -4.86 115.29 112.97 1fwa s HIS 472 Ca 0.06 -0.47 -0.31 0.00 -0.80 0.00 0.00 55.06 53.55 1fwa s HIS 472 Cb -0.15 0.06 -0.08 0.00 -1.43 0.00 0.00 32.58 30.98 1fwa s HIS 472 CO 0.03 -0.65 1.60 0.71 -2.00 0.00 0.00 174.74 174.43 1fwa s TYR 473 N -3.87 2.53 0.02 0.38 1.51 -1.26 -1.07 117.35 115.60 1fwa s TYR 473 Ca 0.07 0.43 0.03 0.00 -1.01 0.00 0.00 57.07 56.60 1fwa s TYR 473 Cb 0.03 -3.90 -0.02 0.00 -0.11 0.00 0.00 41.96 37.96 1fwa s TYR 473 CO -0.08 -3.56 -0.11 1.03 -1.11 0.00 0.00 175.55 171.72 1fwa s ARG 474 N 2.54 0.74 0.32 -0.62 0.52 -0.86 -4.94 118.95 116.66 1fwa s ARG 474 Ca 0.72 -0.60 -0.29 0.00 -0.52 0.00 0.00 55.73 55.04 1fwa s ARG 474 Cb -0.38 -0.69 -0.11 0.00 0.52 0.00 0.00 34.95 34.29 1fwa s ARG 474 CO 0.31 0.17 1.47 -2.14 0.02 0.00 0.00 175.30 175.13 1fwa s PRO 475 N -0.92 4.19 0.11 3.54 0.02 -1.26 -3.02 135.00 137.67 1fwa s PRO 475 Ca -0.01 2.45 0.01 0.00 0.02 0.00 0.00 61.00 63.48 1fwa s PRO 475 Cb -0.07 -3.03 0.01 0.00 0.02 0.00 0.00 34.50 31.44 1fwa s PRO 475 CO 0.01 -0.47 0.09 -1.33 -0.33 0.00 0.00 177.00 174.97 1fwa n MET 476 N 1.30 1.28 0.09 5.54 2.81 0.14 -4.94 117.12 123.32 1fwa n MET 476 Ca 0.04 -0.70 0.15 0.00 -1.81 0.00 0.00 57.70 55.38 1fwa n MET 476 Cb 0.39 0.06 0.65 0.00 -0.71 0.00 0.00 33.22 33.61 1fwa n MET 476 CO 0.00 0.00 0.00 0.74 1.51 0.00 0.00 175.97 178.22 1fwa h PHE 477 N 0.47 0.05 0.00 2.03 -1.00 -1.84 -1.20 116.94 115.45 1fwa h PHE 477 Ca -0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.71 1fwa h PHE 477 Cb 0.26 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 39.80 1fwa h PHE 477 CO 0.00 0.03 0.00 0.41 -1.61 0.00 0.00 178.31 177.14 1fwa n GLY 478 N -1.59 -1.09 1.03 -1.45 0.00 -0.61 -1.83 105.19 99.65 1fwa n GLY 478 Ca 0.05 0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.18 1fwa n GLY 478 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwa n ALA 479 N -1.62 2.32 -2.79 4.61 0.00 -0.45 -3.73 120.51 118.86 1fwa n ALA 479 Ca 0.03 -1.15 -0.35 0.00 0.00 0.00 0.00 53.44 51.96 1fwa n ALA 479 Cb 0.18 -0.72 -0.09 0.00 0.00 0.00 0.00 19.45 18.83 1fwa n ALA 479 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fwa s LEU 480 N -1.08 4.02 0.00 0.00 1.43 -0.76 -4.81 118.68 117.48 1fwa s LEU 480 Ca 0.37 0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 1fwa s LEU 480 Cb 0.20 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 44.40 1fwa s LEU 480 CO 0.26 0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.68 1fwa n GLY 481 N 3.20 0.51 0.24 -3.19 0.00 -1.26 -1.28 105.19 103.40 1fwa n GLY 481 Ca -0.17 0.09 0.09 0.00 0.00 0.00 0.00 46.02 46.03 1fwa n GLY 481 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1fwa h SER 482 N 0.00 0.00 -0.23 1.61 0.02 -1.96 -2.49 113.55 110.50 1fwa h SER 482 Ca 0.00 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 1fwa h SER 482 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1fwa h SER 482 CO 0.00 0.19 -0.33 0.00 -1.14 0.00 0.00 176.83 175.55 1fwa h ALA 483 N 1.81 0.78 -0.16 3.77 0.00 -1.48 -2.71 119.26 121.28 1fwa h ALA 483 Ca -0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 1fwa h ALA 483 Cb 0.44 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1fwa h ALA 483 CO 0.02 0.65 0.09 -0.09 0.00 0.00 0.00 179.25 179.93 1fwa h ARG 484 N 0.62 0.21 -0.89 0.00 2.43 -0.82 -2.07 114.38 113.87 1fwa h ARG 484 Ca 0.07 -0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.34 1fwa h ARG 484 Cb 0.86 -0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.30 1fwa h ARG 484 CO 0.08 0.20 0.57 0.45 -1.51 0.00 0.00 179.97 179.76 1fwa h HIS 485 N 0.17 0.87 0.00 2.20 3.86 -1.37 -0.35 115.15 120.53 1fwa h HIS 485 Ca 0.06 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1fwa h HIS 485 Cb 0.04 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.24 1fwa h HIS 485 CO -0.05 0.35 0.00 1.25 0.86 0.00 0.00 177.93 180.34 1fwa h HIS 486 N 0.76 0.00 -0.16 2.45 -0.00 -1.12 -2.76 115.15 114.31 1fwa h HIS 486 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.80 1fwa h HIS 486 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.02 1fwa h HIS 486 CO -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.93 177.93 1fwa s ARG 488 N -1.19 1.68 -0.00 0.00 1.70 -0.74 -3.39 118.95 117.01 1fwa s ARG 488 Ca 0.22 -1.87 0.05 0.00 -0.47 0.00 0.00 55.73 53.67 1fwa s ARG 488 Cb 0.14 -1.40 -0.02 0.00 -0.57 0.00 0.00 34.95 33.11 1fwa s ARG 488 CO 0.20 0.07 -0.17 -0.51 -1.08 0.00 0.00 175.30 173.81 1fwa s LEU 489 N -3.53 2.06 -0.23 -1.89 1.43 -1.26 -3.07 118.68 112.20 1fwa s LEU 489 Ca 0.31 -0.34 -0.04 0.00 -1.03 0.00 0.00 54.13 53.03 1fwa s LEU 489 Cb 0.04 -0.88 -0.00 0.00 0.03 0.00 0.00 46.19 45.38 1fwa s LEU 489 CO 0.14 0.19 -0.04 -0.89 0.23 0.00 0.00 176.35 175.99 1fwa s THR 490 N -0.48 3.31 0.04 5.49 2.01 -0.28 -1.58 115.64 124.15 1fwa s THR 490 Ca 0.06 -0.59 -0.24 0.00 0.31 0.00 0.00 61.69 61.23 1fwa s THR 490 Cb -0.07 -2.54 -0.06 0.00 0.01 0.00 0.00 72.50 69.84 1fwa s THR 490 CO -0.00 0.37 0.72 -0.36 -0.69 0.00 0.00 174.62 174.65 1fwa s PHE 491 N 1.45 3.73 0.23 4.92 0.40 -0.16 -1.57 117.98 126.99 1fwa s PHE 491 Ca 0.05 1.40 0.07 0.00 -0.60 0.00 0.00 56.93 57.85 1fwa s PHE 491 Cb -0.15 -2.75 -0.05 0.00 0.51 0.00 0.00 43.02 40.58 1fwa s PHE 491 CO -0.03 0.32 -0.10 -0.51 0.70 0.00 0.00 175.22 175.59 1fwa s LEU 492 N -0.19 2.50 0.61 -0.37 1.43 0.31 -4.56 118.68 118.40 1fwa s LEU 492 Ca 0.36 -1.09 -0.12 0.00 -1.03 0.00 0.00 54.13 52.24 1fwa s LEU 492 Cb -0.20 -0.60 -0.04 0.00 0.03 0.00 0.00 46.19 45.38 1fwa s LEU 492 CO 0.21 -0.27 1.03 -0.94 0.23 0.00 0.00 176.35 176.61 1fwa s SER 493 N -3.35 6.17 0.33 2.29 1.04 -1.25 -1.71 113.70 117.21 1fwa s SER 493 Ca 0.25 1.50 0.02 0.00 0.48 0.00 0.00 55.95 58.21 1fwa s SER 493 Cb 0.01 -2.49 0.61 0.00 0.10 0.00 0.00 66.02 64.26 1fwa s SER 493 CO 0.08 -0.91 1.94 1.56 0.98 0.00 0.00 173.24 176.89 1fwa h GLN 494 N -0.07 0.90 -0.53 4.02 4.20 -1.82 -1.88 115.11 119.92 1fwa h GLN 494 Ca -0.45 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.15 1fwa h GLN 494 Cb 1.19 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.75 1fwa h GLN 494 CO 0.61 0.60 0.11 0.00 -0.67 0.00 0.00 178.83 179.47 1fwa h ALA 495 N 1.55 0.71 -0.46 3.87 0.00 -1.87 -1.93 119.26 121.13 1fwa h ALA 495 Ca 0.35 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1fwa h ALA 495 Cb 0.18 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1fwa h ALA 495 CO -0.12 0.42 0.05 0.00 0.00 0.00 0.00 179.25 179.61 1fwa h ALA 496 N 1.00 0.61 -0.31 0.00 0.00 -1.58 -0.69 119.26 118.29 1fwa h ALA 496 Ca 0.17 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1fwa h ALA 496 Cb 0.37 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1fwa h ALA 496 CO 0.01 0.36 0.13 0.00 0.00 0.00 0.00 179.25 179.74 1fwa h ALA 497 N 0.94 0.37 -0.30 0.00 0.00 -1.19 -2.30 119.26 116.78 1fwa h ALA 497 Ca 0.14 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1fwa h ALA 497 Cb 0.42 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1fwa h ALA 497 CO 0.01 -0.26 -0.18 0.00 0.00 0.00 0.00 179.25 178.82 1fwa h ALA 498 N 1.18 1.13 0.00 0.00 0.00 -1.19 -2.74 119.26 117.64 1fwa h ALA 498 Ca 0.14 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1fwa h ALA 498 Cb 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1fwa h ALA 498 CO -0.12 0.54 0.00 0.09 0.00 0.00 0.00 179.25 179.76 1fwa n ASN 499 N -4.16 0.00 -0.54 0.00 3.02 -0.28 -4.88 115.26 108.41 1fwa n ASN 499 Ca 0.00 0.10 -0.05 0.00 -0.03 0.00 0.00 54.58 54.60 1fwa n ASN 499 Cb 0.37 -0.31 -0.00 0.00 -0.61 0.00 0.00 39.78 39.22 1fwa n ASN 499 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fwa n GLY 500 N 0.20 0.23 0.37 7.41 0.00 -1.01 -4.94 105.19 107.44 1fwa n GLY 500 Ca 0.08 -0.70 0.01 0.00 0.00 0.00 0.00 46.02 45.41 1fwa n GLY 500 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fwa h VAL 501 N 0.00 1.15 -0.62 1.61 2.07 -1.67 -0.86 116.25 117.93 1fwa h VAL 501 Ca -0.12 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 66.98 1fwa h VAL 501 Cb 1.01 -0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1fwa h VAL 501 CO 0.14 0.21 0.25 0.00 0.02 0.00 0.00 177.57 178.19 1fwa h ALA 502 N 1.46 1.28 -0.04 1.67 0.00 -1.89 -0.90 119.26 120.83 1fwa h ALA 502 Ca 0.37 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 1fwa h ALA 502 Cb 0.04 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.59 1fwa h ALA 502 CO -0.12 0.54 -0.57 0.93 0.00 0.00 0.00 179.25 180.03 1fwa h GLU 503 N 0.89 0.45 -0.43 0.00 3.07 -1.73 -0.04 114.58 116.79 1fwa h GLU 503 Ca 0.21 -0.44 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 1fwa h GLU 503 Cb 0.17 0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.17 1fwa h GLU 503 CO -0.02 1.08 0.28 -0.09 -1.40 0.00 0.00 179.01 178.86 1fwa h ARG 504 N -0.02 0.56 0.00 2.33 2.43 -0.99 -2.54 114.38 116.15 1fwa h ARG 504 Ca -0.06 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1fwa h ARG 504 Cb 1.25 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1fwa h ARG 504 CO 0.11 0.38 -0.24 1.28 -1.51 0.00 0.00 179.97 180.00 1fwa n LEU 505 N -4.78 0.34 -3.12 3.80 4.77 -0.36 -4.95 117.00 112.70 1fwa n LEU 505 Ca 0.01 0.31 -0.16 0.00 -0.03 0.00 0.00 56.01 56.15 1fwa n LEU 505 Cb 0.03 -0.36 0.08 0.00 -2.33 0.00 0.00 43.42 40.83 1fwa n LEU 505 CO 0.35 0.01 0.12 -3.20 -1.33 0.00 0.00 177.39 173.34 1fwa n ASN 506 N -1.66 -2.76 -4.72 -1.43 2.85 -0.63 -4.95 115.26 101.95 1fwa n ASN 506 Ca 0.06 -0.52 -0.42 0.00 -0.11 0.00 0.00 54.58 53.59 1fwa n ASN 506 Cb 0.36 -4.49 -0.03 0.00 1.24 0.00 0.00 39.78 36.86 1fwa n ASN 506 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1fwa s LEU 507 N -5.90 4.38 0.07 1.20 1.02 -0.12 -4.94 118.68 114.39 1fwa s LEU 507 Ca 0.10 2.43 0.16 0.00 0.02 0.00 0.00 54.13 56.85 1fwa s LEU 507 Cb -0.04 -3.60 -0.13 0.00 0.02 0.00 0.00 46.19 42.44 1fwa s LEU 507 CO 0.63 -0.66 0.86 0.03 0.02 0.00 0.00 176.35 177.23 1fwa h ARG 508 N 6.30 0.00 -7.50 1.70 -0.00 -1.92 -3.47 114.38 109.49 1fwa h ARG 508 Ca -0.43 0.00 -0.47 0.00 -0.50 0.00 0.00 59.98 58.58 1fwa h ARG 508 Cb 1.21 0.00 0.12 0.00 0.00 0.00 0.00 29.97 31.30 1fwa h ARG 508 CO 0.84 0.31 0.34 -1.12 0.00 0.00 0.00 179.97 180.34 1fwa s SER 509 N -5.83 4.02 0.47 7.04 0.01 -1.26 -4.75 113.70 113.40 1fwa s SER 509 Ca -0.02 1.00 -0.23 0.00 1.31 0.00 0.00 55.95 58.01 1fwa s SER 509 Cb 0.09 -1.61 -0.07 0.00 0.21 0.00 0.00 66.02 64.64 1fwa s SER 509 CO 0.81 -2.23 1.18 0.00 0.41 0.00 0.00 173.24 173.40 1fwa s ALA 510 N -3.32 2.94 -0.06 1.44 0.00 -1.04 -4.85 121.76 116.86 1fwa s ALA 510 Ca 0.62 0.95 0.01 0.00 0.00 0.00 0.00 51.96 53.55 1fwa s ALA 510 Cb -0.14 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.56 1fwa s ALA 510 CO 0.52 -0.72 -0.07 0.42 0.00 0.00 0.00 175.76 175.92 1fwa s ILE 511 N -1.55 3.70 0.04 0.00 -1.09 -1.26 -1.13 121.20 119.92 1fwa s ILE 511 Ca 0.65 -0.52 0.04 0.00 -2.23 0.00 0.00 60.65 58.59 1fwa s ILE 511 Cb -0.29 -2.52 -0.02 0.00 -1.58 0.00 0.00 42.46 38.04 1fwa s ILE 511 CO 0.35 0.57 -0.12 0.00 -1.23 0.00 0.00 174.94 174.51 1fwa s ALA 512 N -0.84 1.00 -0.03 9.38 0.00 -0.61 -4.90 121.76 125.76 1fwa s ALA 512 Ca 0.13 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.31 1fwa s ALA 512 Cb -0.11 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.86 1fwa s ALA 512 CO 0.02 0.15 -0.07 0.08 0.00 0.00 0.00 175.76 175.95 1fwa s VAL 513 N -0.98 3.66 0.27 0.00 1.01 -1.26 -0.53 120.40 122.57 1fwa s VAL 513 Ca -0.01 -0.64 -0.16 0.00 0.00 0.00 0.00 61.98 61.16 1fwa s VAL 513 Cb -0.08 -2.55 -0.09 0.00 0.00 0.00 0.00 36.38 33.67 1fwa s VAL 513 CO 0.01 0.49 0.71 0.68 0.00 0.00 0.00 175.10 176.99 1fwa s VAL 514 N -0.91 4.66 -0.10 2.92 -7.23 -0.70 -4.91 120.40 114.14 1fwa s VAL 514 Ca 0.15 1.04 -0.30 0.00 -1.81 0.00 0.00 61.98 61.05 1fwa s VAL 514 Cb -0.11 -3.70 0.09 0.00 0.56 0.00 0.00 36.38 33.22 1fwa s VAL 514 CO 0.05 -0.02 0.81 -1.59 -0.31 0.00 0.00 175.10 174.04 1fwa s LYS 515 N -2.57 0.86 0.00 4.82 -2.85 -0.89 -4.41 119.74 114.71 1fwa s LYS 515 Ca 0.49 0.23 0.00 0.00 -1.00 0.00 0.00 55.97 55.70 1fwa s LYS 515 Cb -0.13 0.41 0.00 0.00 -2.06 0.00 0.00 37.83 36.05 1fwa s LYS 515 CO 0.19 -0.26 0.00 0.41 0.10 0.00 0.00 175.35 175.78 1fwa n GLY 516 N 0.89 0.62 0.14 0.59 0.00 -1.26 -4.40 105.19 101.78 1fwa n GLY 516 Ca -0.15 -0.77 0.04 0.00 0.00 0.00 0.00 46.02 45.13 1fwa n GLY 516 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fwa h ARG 518 N 0.00 0.00 0.00 0.00 2.47 -1.89 -3.38 114.38 111.58 1fwa h ARG 518 Ca -0.02 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1fwa h ARG 518 Cb 1.35 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.67 1fwa h ARG 518 CO 0.05 0.39 -0.52 0.25 0.56 0.00 0.00 179.97 180.70 1fwa n THR 519 N -3.00 0.02 -2.56 2.04 -2.24 -1.25 -4.62 114.28 102.68 1fwa n THR 519 Ca -0.07 -0.02 -0.38 0.00 -2.27 0.00 0.00 64.05 61.31 1fwa n THR 519 Cb 0.84 0.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.25 1fwa n THR 519 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1fwa s VAL 520 N -3.01 3.73 0.24 2.28 -7.23 -1.25 -5.05 120.40 110.11 1fwa s VAL 520 Ca 0.11 1.47 0.01 0.00 -1.81 0.00 0.00 61.98 61.76 1fwa s VAL 520 Cb 0.17 -3.83 -0.04 0.00 0.56 0.00 0.00 36.38 33.24 1fwa s VAL 520 CO 0.70 0.15 0.18 0.00 -0.31 0.00 0.00 175.10 175.83 1fwa s GLN 521 N -2.07 1.38 0.32 4.82 -2.07 -1.26 -4.86 119.66 115.93 1fwa s GLN 521 Ca 0.52 -1.75 0.08 0.00 -1.82 0.00 0.00 55.36 52.40 1fwa s GLN 521 Cb -0.25 0.29 0.82 0.00 -1.09 0.00 0.00 33.01 32.78 1fwa s GLN 521 CO 0.31 -0.48 1.78 -0.22 -1.32 0.00 0.00 175.29 175.36 1fwa h LYS 522 N 2.46 0.66 0.00 9.60 1.63 -0.87 -0.32 116.57 129.73 1fwa h LYS 522 Ca -0.32 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.44 1fwa h LYS 522 Cb 1.24 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.72 1fwa h LYS 522 CO 0.48 0.44 0.00 0.00 -3.45 0.00 0.00 179.45 176.91 1fwa h ALA 523 N 1.65 1.00 0.00 5.00 0.00 -1.81 -2.14 119.26 122.96 1fwa h ALA 523 Ca 0.58 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.49 1fwa h ALA 523 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1fwa h ALA 523 CO -0.37 0.00 -0.48 -0.25 0.00 0.00 0.00 179.25 178.16 1fwa n ASP 524 N -2.80 0.56 -4.64 0.00 8.00 -0.13 -4.85 116.55 112.69 1fwa n ASP 524 Ca -0.02 0.07 -0.43 0.00 0.71 0.00 0.00 54.79 55.13 1fwa n ASP 524 Cb 0.11 0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.24 1fwa n ASP 524 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1fwa s MET 525 N -3.09 3.92 0.03 -1.24 -1.94 -0.80 -4.92 119.30 111.26 1fwa s MET 525 Ca 0.09 1.78 -0.31 0.00 -1.71 0.00 0.00 55.69 55.54 1fwa s MET 525 Cb 0.15 -4.00 -0.10 0.00 2.01 0.00 0.00 34.83 32.89 1fwa s MET 525 CO 0.68 -1.15 1.94 0.28 -0.01 0.00 0.00 175.02 176.77 1fwa n VAL 526 N 6.12 0.68 -0.92 -6.03 0.31 -1.26 -1.98 118.33 115.24 1fwa n VAL 526 Ca 0.18 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1fwa n VAL 526 Cb 0.45 -2.21 0.00 0.00 -0.91 0.00 0.00 33.84 31.16 1fwa n VAL 526 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1fwa n HIS 527 N 7.07 0.00 -3.14 3.52 8.25 -1.26 -4.79 115.22 124.87 1fwa n HIS 527 Ca 0.20 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.49 1fwa n HIS 527 Cb 0.38 -1.84 -0.02 0.00 1.12 0.00 0.00 29.99 29.64 1fwa n HIS 527 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1fwa n ASN 528 N -0.80 0.45 -0.57 0.41 3.02 -0.84 -4.72 115.26 112.22 1fwa n ASN 528 Ca 0.00 -3.07 0.06 0.00 -0.03 0.00 0.00 54.58 51.53 1fwa n ASN 528 Cb 0.40 -0.34 0.15 0.00 -0.61 0.00 0.00 39.78 39.38 1fwa n ASN 528 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1fwa n SER 529 N 0.34 2.96 -4.74 6.41 3.41 -1.19 -4.56 113.62 116.26 1fwa n SER 529 Ca 0.23 -2.28 -0.41 0.00 -0.26 0.00 0.00 58.87 56.15 1fwa n SER 529 Cb 0.66 -0.27 -0.03 0.00 -0.26 0.00 0.00 64.21 64.31 1fwa n SER 529 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1fwa s LEU 530 N -1.49 4.41 -0.58 1.04 2.96 -0.93 -4.60 118.68 119.47 1fwa s LEU 530 Ca 0.24 2.53 0.04 0.00 -0.22 0.00 0.00 54.13 56.72 1fwa s LEU 530 Cb 0.16 -3.62 0.15 0.00 0.50 0.00 0.00 46.19 43.38 1fwa s LEU 530 CO 0.11 -0.60 0.35 -1.10 -1.32 0.00 0.00 176.35 173.79 1fwa s GLN 531 N -0.34 2.10 0.51 1.98 -0.21 -1.26 -4.39 119.66 118.04 1fwa s GLN 531 Ca 0.57 -2.85 -0.18 0.00 0.02 0.00 0.00 55.36 52.92 1fwa s GLN 531 Cb -0.39 -3.26 -0.08 0.00 1.00 0.00 0.00 33.01 30.29 1fwa s GLN 531 CO 0.41 -1.19 1.00 -1.25 -2.12 0.00 0.00 175.29 172.15 1fwa s PRO 532 N -0.69 3.85 -1.13 2.91 0.04 -1.26 -4.93 135.00 133.79 1fwa s PRO 532 Ca 0.20 1.10 -0.19 0.00 0.04 0.00 0.00 61.00 62.16 1fwa s PRO 532 Cb -0.17 -2.12 0.10 0.00 0.04 0.00 0.00 34.50 32.35 1fwa s PRO 532 CO -0.07 -0.36 1.48 1.21 0.04 0.00 0.00 177.00 179.30 1fwa s ASN 533 N -2.67 6.74 -0.08 6.66 2.47 -1.26 -4.41 114.94 122.39 1fwa s ASN 533 Ca 0.62 -2.17 -0.04 0.00 0.42 0.00 0.00 52.86 51.68 1fwa s ASN 533 Cb -0.12 -2.51 -0.04 0.00 -1.45 0.00 0.00 41.25 37.13 1fwa s ASN 533 CO 0.27 -1.17 0.11 -0.51 -3.72 0.00 0.00 177.10 172.08 1fwa s ILE 534 N 3.65 5.13 0.04 -5.21 2.07 -1.26 -0.77 121.20 124.86 1fwa s ILE 534 Ca 0.45 -0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.70 1fwa s ILE 534 Cb -0.00 -3.25 -0.03 0.00 0.13 0.00 0.00 42.46 39.31 1fwa s ILE 534 CO -0.02 0.55 -0.07 0.42 -1.91 0.00 0.00 174.94 173.91 1fwa s THR 535 N -1.05 0.47 -0.09 4.00 -4.23 0.11 -4.90 115.64 109.95 1fwa s THR 535 Ca 0.17 -1.16 0.03 0.00 -1.18 0.00 0.00 61.69 59.55 1fwa s THR 535 Cb -0.12 -0.68 0.01 0.00 1.34 0.00 0.00 72.50 73.04 1fwa s THR 535 CO 0.07 -0.47 -0.17 -0.69 -0.54 0.00 0.00 174.62 172.81 1fwa s VAL 536 N -1.70 1.58 -0.20 2.29 1.01 -1.26 -0.61 120.40 121.51 1fwa s VAL 536 Ca -0.08 -0.73 -0.29 0.00 0.00 0.00 0.00 61.98 60.88 1fwa s VAL 536 Cb -0.08 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 1fwa s VAL 536 CO -0.01 0.46 1.28 -0.62 0.00 0.00 0.00 175.10 176.21 1fwa s ASP 537 N 0.62 6.86 0.45 3.32 2.15 -0.09 -4.92 116.67 125.07 1fwa s ASP 537 Ca -0.14 1.57 0.18 0.00 0.43 0.00 0.00 52.55 54.59 1fwa s ASP 537 Cb -0.16 -2.54 1.13 0.00 -0.30 0.00 0.00 42.92 41.05 1fwa s ASP 537 CO 0.04 -0.85 1.92 0.00 -0.17 0.00 0.00 175.17 176.10 1fwa h ALA 538 N 8.54 2.23 0.00 3.66 0.00 -1.95 0.55 119.26 132.29 1fwa h ALA 538 Ca -0.26 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.41 1fwa h ALA 538 Cb 1.10 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1fwa h ALA 538 CO 0.99 -0.44 -1.34 1.04 0.00 0.00 0.00 179.25 179.49 1fwa n GLN 539 N -4.46 0.56 0.06 0.00 6.02 -1.26 -4.54 117.38 113.76 1fwa n GLN 539 Ca 0.15 0.53 0.12 0.00 -0.01 0.00 0.00 57.00 57.79 1fwa n GLN 539 Cb 0.60 -1.71 0.16 0.00 1.02 0.00 0.00 30.24 30.31 1fwa n GLN 539 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 1fwa h THR 540 N -1.00 0.00 0.00 5.09 1.35 -1.97 -3.48 112.91 112.90 1fwa h THR 540 Ca -0.35 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 64.98 1fwa h THR 540 Cb 1.26 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 1fwa h THR 540 CO -0.21 0.00 0.00 -1.22 -0.25 0.00 0.00 175.52 173.84 1fwa n TYR 541 N -2.15 0.00 -1.98 4.73 4.01 0.19 -4.93 117.16 117.03 1fwa n TYR 541 Ca 0.03 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.36 1fwa n TYR 541 Cb 0.45 -0.90 -0.02 0.00 -0.31 0.00 0.00 39.34 38.55 1fwa n TYR 541 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1fwa s GLU 542 N -0.85 4.24 -0.17 -0.72 2.02 -1.26 -4.39 118.70 117.58 1fwa s GLU 542 Ca 0.00 2.34 -0.12 0.00 0.02 0.00 0.00 54.97 57.21 1fwa s GLU 542 Cb 0.00 -3.11 -0.05 0.00 0.10 0.00 0.00 34.13 31.07 1fwa s GLU 542 CO 0.00 -0.48 0.23 0.08 0.02 0.00 0.00 175.26 175.11 1fwa s VAL 543 N 0.22 5.35 0.02 2.63 1.01 -1.26 -0.91 120.40 127.45 1fwa s VAL 543 Ca 0.62 0.41 0.03 0.00 0.00 0.00 0.00 61.98 63.03 1fwa s VAL 543 Cb -0.43 -3.56 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 1fwa s VAL 543 CO 0.41 0.43 -0.08 -0.13 0.00 0.00 0.00 175.10 175.73 1fwa s ARG 544 N 0.28 0.60 -0.15 2.72 0.52 0.22 -1.28 118.95 121.86 1fwa s ARG 544 Ca 0.14 -0.48 0.00 0.00 -0.52 0.00 0.00 55.73 54.87 1fwa s ARG 544 Cb -0.12 -0.52 0.02 0.00 0.52 0.00 0.00 34.95 34.85 1fwa s ARG 544 CO 0.02 0.13 -0.15 0.08 0.02 0.00 0.00 175.30 175.40 1fwa s VAL 545 N -0.65 1.67 -1.45 3.52 1.01 -0.29 0.06 120.40 124.26 1fwa s VAL 545 Ca -0.01 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 1fwa s VAL 545 Cb -0.06 -1.55 0.03 0.00 0.00 0.00 0.00 36.38 34.80 1fwa s VAL 545 CO 0.00 0.47 0.54 0.47 0.00 0.00 0.00 175.10 176.58 1fwa n ASP 546 N 4.73 -5.24 0.00 3.32 8.00 0.05 -1.33 116.55 126.08 1fwa n ASP 546 Ca -0.18 -0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.02 1fwa n ASP 546 Cb 0.50 -4.27 0.00 0.00 -0.02 0.00 0.00 41.12 37.33 1fwa n ASP 546 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fwa n GLY 547 N -1.37 3.05 3.76 0.44 0.00 -1.26 -5.01 105.19 104.80 1fwa n GLY 547 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1fwa n GLY 547 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1fwa s GLU 548 N -0.14 4.76 0.10 1.61 -1.05 -0.44 -4.95 118.70 118.58 1fwa s GLU 548 Ca 0.00 1.40 -0.30 0.00 -0.15 0.00 0.00 54.97 55.92 1fwa s GLU 548 Cb 0.00 -3.18 -0.06 0.00 -0.44 0.00 0.00 34.13 30.45 1fwa s GLU 548 CO 0.00 0.48 1.15 -1.17 0.95 0.00 0.00 175.26 176.67 1fwa s LEU 549 N -1.35 4.41 -0.18 1.83 2.96 -1.26 -1.13 118.68 123.95 1fwa s LEU 549 Ca 0.42 2.02 -0.06 0.00 -0.22 0.00 0.00 54.13 56.29 1fwa s LEU 549 Cb -0.24 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.83 1fwa s LEU 549 CO 0.29 -0.37 0.03 -0.63 -1.32 0.00 0.00 176.35 174.36 1fwa s ILE 550 N 0.59 4.45 0.18 6.68 -1.09 -0.40 -4.94 121.20 126.67 1fwa s ILE 550 Ca 0.55 -0.15 -0.24 0.00 -2.23 0.00 0.00 60.65 58.58 1fwa s ILE 550 Cb -0.29 -3.00 0.07 0.00 -1.58 0.00 0.00 42.46 37.66 1fwa s ILE 550 CO 0.31 0.45 0.98 0.28 -1.23 0.00 0.00 174.94 175.73 1fwa s THR 551 N 0.56 0.00 0.31 2.92 -1.32 -1.26 -4.50 115.64 112.35 1fwa s THR 551 Ca 0.01 -0.66 -0.17 0.00 -1.21 0.00 0.00 61.69 59.66 1fwa s THR 551 Cb -0.13 -2.33 0.03 0.00 -1.51 0.00 0.00 72.50 68.55 1fwa s THR 551 CO 0.02 0.00 0.69 -0.94 -2.21 0.00 0.00 174.62 172.18 1fwa s SER 552 N -3.10 -0.10 -0.05 8.08 1.04 -1.25 -4.86 113.70 113.46 1fwa s SER 552 Ca 0.15 -0.85 -0.01 0.00 0.48 0.00 0.00 55.95 55.73 1fwa s SER 552 Cb -0.02 0.74 -0.04 0.00 0.10 0.00 0.00 66.02 66.80 1fwa s SER 552 CO 0.04 -1.41 0.03 -1.61 0.98 0.00 0.00 173.24 171.26 1fwa s GLU 553 N -3.45 2.97 0.19 4.02 0.41 -1.26 -4.90 118.70 116.68 1fwa s GLU 553 Ca 0.15 -0.46 -0.30 0.00 -0.41 0.00 0.00 54.97 53.95 1fwa s GLU 553 Cb -0.05 -2.80 -0.08 0.00 -1.78 0.00 0.00 34.13 29.42 1fwa s GLU 553 CO 0.09 0.68 1.20 -1.25 -0.49 0.00 0.00 175.26 175.49 1fwa s PRO 554 N -1.24 4.49 0.33 0.39 0.04 -1.26 -4.90 135.00 132.85 1fwa s PRO 554 Ca 0.17 1.89 -0.26 0.00 0.04 0.00 0.00 61.00 62.84 1fwa s PRO 554 Cb -0.12 -3.23 -0.10 0.00 0.04 0.00 0.00 34.50 31.09 1fwa s PRO 554 CO 0.07 -0.09 0.97 0.00 0.04 0.00 0.00 177.00 177.99 1fwa s ALA 555 N -0.09 3.20 -0.15 8.56 0.00 -0.41 -4.59 121.76 128.29 1fwa s ALA 555 Ca 0.53 0.58 0.16 0.00 0.00 0.00 0.00 51.96 53.24 1fwa s ALA 555 Cb -0.33 -3.21 -0.24 0.00 0.00 0.00 0.00 23.12 19.34 1fwa s ALA 555 CO 0.37 0.08 0.27 -0.40 0.00 0.00 0.00 175.76 176.08 1fwa n ASP 556 N 0.50 0.28 -3.88 0.00 5.75 -1.26 -0.59 116.55 117.34 1fwa n ASP 556 Ca 0.02 0.13 -0.12 0.00 -0.01 0.00 0.00 54.79 54.82 1fwa n ASP 556 Cb 0.50 0.68 -0.14 0.00 -1.03 0.00 0.00 41.12 41.13 1fwa n ASP 556 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1fwa s VAL 557 N -2.55 0.01 0.13 2.12 1.01 -1.26 -4.91 120.40 114.95 1fwa s VAL 557 Ca -0.08 -0.09 0.08 0.00 0.00 0.00 0.00 61.98 61.89 1fwa s VAL 557 Cb 0.07 -0.04 -0.04 0.00 0.00 0.00 0.00 36.38 36.37 1fwa s VAL 557 CO 0.83 -0.05 -0.19 -0.76 0.00 0.00 0.00 175.10 174.93 1fwa s LEU 558 N -0.14 2.37 1.06 3.92 1.43 -1.26 -5.14 118.68 120.92 1fwa s LEU 558 Ca -0.01 -0.77 -0.18 0.00 -1.03 0.00 0.00 54.13 52.14 1fwa s LEU 558 Cb -0.01 -0.82 0.24 0.00 0.03 0.00 0.00 46.19 45.63 1fwa s LEU 558 CO -0.00 -0.00 1.28 -2.84 0.23 0.00 0.00 176.35 175.02 1fwa s PRO 559 N -2.34 -0.15 -1.51 1.29 0.02 -1.26 -4.04 135.00 127.01 1fwa s PRO 559 Ca 0.10 -0.41 -0.14 0.00 0.02 0.00 0.00 61.00 60.57 1fwa s PRO 559 Cb -0.08 -1.75 0.11 0.00 0.02 0.00 0.00 34.50 32.80 1fwa s PRO 559 CO 0.05 -2.94 0.74 -1.33 -0.33 0.00 0.00 177.00 173.19 1fwa n MET 560 N -4.14 -3.92 0.00 5.54 2.81 -1.26 -4.88 117.12 111.28 1fwa n MET 560 Ca 0.16 0.47 0.00 0.00 -1.81 0.00 0.00 57.70 56.52 1fwa n MET 560 Cb 0.59 -5.25 0.00 0.00 -0.71 0.00 0.00 33.22 27.86 1fwa n MET 560 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1fwa n ALA 561 N -4.15 0.00 0.19 3.04 0.00 -1.26 -4.95 120.51 113.39 1fwa n ALA 561 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.60 1fwa n ALA 561 Cb 0.52 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.62 1fwa n ALA 561 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1fwa h GLN 562 N 0.00 0.00 0.00 0.00 4.20 -1.90 -2.03 115.11 115.38 1fwa h GLN 562 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1fwa h GLN 562 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1fwa h GLN 562 CO 0.00 0.00 0.00 -0.09 -0.67 0.00 0.00 178.83 178.07 1fwa h ARG 563 N 0.00 0.00 0.00 1.46 2.43 -1.93 -3.37 114.38 112.97 1fwa h ARG 563 Ca 0.00 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1fwa h ARG 563 Cb 0.12 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1fwa h ARG 563 CO 0.00 0.00 -1.56 0.66 -1.51 0.00 0.00 179.97 177.56 1fwa n TYR 564 N -3.08 0.00 -3.93 2.20 4.02 -0.77 -5.03 117.16 110.57 1fwa n TYR 564 Ca 0.03 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.56 1fwa n TYR 564 Cb 0.48 -0.36 -0.07 0.00 -0.02 0.00 0.00 39.34 39.38 1fwa n TYR 564 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1fwa s PHE 565 N -2.43 3.53 0.19 -0.72 0.40 -1.19 -4.99 117.98 112.77 1fwa s PHE 565 Ca -0.04 0.47 0.15 0.00 -0.60 0.00 0.00 56.93 56.91 1fwa s PHE 565 Cb 0.04 -1.94 0.50 0.00 0.51 0.00 0.00 43.02 42.14 1fwa s PHE 565 CO 0.40 0.68 1.66 1.25 0.70 0.00 0.00 175.22 179.90 1fwa h LEU 566 N 5.12 0.00 -0.20 -0.37 5.85 -1.94 -3.47 115.31 120.29 1fwa h LEU 566 Ca -0.53 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.19 1fwa h LEU 566 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 1fwa h LEU 566 CO 0.59 0.49 0.00 0.49 -0.34 0.00 0.00 178.44 179.67