#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1daa s TYR 2 N 0.00 2.45 -0.02 1.61 1.51 -1.26 -0.61 117.35 121.03 1daa s TYR 2 Ca 0.00 -0.34 0.08 0.00 -1.01 0.00 0.00 57.07 55.80 1daa s TYR 2 Cb 0.00 -1.48 -0.02 0.00 -0.11 0.00 0.00 41.96 40.35 1daa s TYR 2 CO 0.00 0.11 -0.26 0.99 -1.11 0.00 0.00 175.55 175.29 1daa s THR 3 N -0.76 2.09 -0.02 -0.71 2.01 0.30 -4.63 115.64 113.92 1daa s THR 3 Ca 0.12 -1.10 -0.30 0.00 0.31 0.00 0.00 61.69 60.72 1daa s THR 3 Cb -0.10 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.66 1daa s THR 3 CO 0.02 0.58 1.06 -0.22 -0.69 0.00 0.00 174.62 175.36 1daa s LEU 4 N -0.61 4.33 -0.26 4.42 2.96 0.36 -1.19 118.68 128.68 1daa s LEU 4 Ca 0.10 1.71 -0.03 0.00 -0.22 0.00 0.00 54.13 55.69 1daa s LEU 4 Cb -0.10 -3.57 0.09 0.00 0.50 0.00 0.00 46.19 43.11 1daa s LEU 4 CO -0.01 -0.39 0.10 0.86 -1.32 0.00 0.00 176.35 175.59 1daa s TRP 5 N 1.44 0.85 0.00 5.38 -0.00 -0.24 -1.47 118.94 124.91 1daa s TRP 5 Ca 0.53 -1.05 0.00 0.00 -0.00 0.00 0.00 56.10 55.57 1daa s TRP 5 Cb -0.22 -1.14 0.00 0.00 -0.00 0.00 0.00 33.47 32.11 1daa s TRP 5 CO 0.25 -0.76 0.00 0.09 -0.00 0.00 0.00 176.95 176.53 1daa n ASN 6 N 5.10 0.00 -0.81 5.86 5.03 -0.04 -2.01 115.26 128.39 1daa n ASN 6 Ca -0.06 0.00 0.06 0.00 0.87 0.00 0.00 54.58 55.45 1daa n ASN 6 Cb 0.44 0.00 0.16 0.00 -1.02 0.00 0.00 39.78 39.36 1daa n ASN 6 CO 0.00 0.00 0.00 -0.90 -1.83 0.00 0.00 177.26 174.53 1daa n ASP 7 N 5.82 1.54 -4.23 6.41 5.75 -1.26 -4.81 116.55 125.76 1daa n ASP 7 Ca 0.00 -3.42 -0.25 0.00 -0.01 0.00 0.00 54.79 51.11 1daa n ASP 7 Cb 0.00 -0.47 -0.14 0.00 -1.03 0.00 0.00 41.12 39.48 1daa n ASP 7 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1daa s GLN 8 N -2.42 1.40 -0.35 0.11 -0.21 -0.85 -5.11 119.66 112.23 1daa s GLN 8 Ca 0.37 -0.87 -0.11 0.00 0.02 0.00 0.00 55.36 54.76 1daa s GLN 8 Cb 0.37 -1.47 0.01 0.00 1.00 0.00 0.00 33.01 32.92 1daa s GLN 8 CO -0.09 0.38 0.20 0.42 -2.12 0.00 0.00 175.29 174.08 1daa s ILE 9 N -0.72 4.77 0.38 1.08 1.09 -1.26 -1.07 121.20 125.46 1daa s ILE 9 Ca 0.07 -0.60 0.08 0.00 -1.10 0.00 0.00 60.65 59.10 1daa s ILE 9 Cb -0.08 -3.55 -0.06 0.00 -1.06 0.00 0.00 42.46 37.71 1daa s ILE 9 CO 0.01 -0.11 0.11 0.68 -0.10 0.00 0.00 174.94 175.53 1daa s VAL 10 N 1.61 2.43 0.57 2.92 -7.23 -0.34 -4.89 120.40 115.48 1daa s VAL 10 Ca 0.04 -1.81 -0.19 0.00 -1.81 0.00 0.00 61.98 58.21 1daa s VAL 10 Cb -0.18 -2.94 -0.05 0.00 0.56 0.00 0.00 36.38 33.78 1daa s VAL 10 CO 0.07 -0.08 1.15 -0.54 -0.31 0.00 0.00 175.10 175.40 1daa s LYS 11 N -3.82 3.17 0.21 4.82 1.02 -1.26 -0.54 119.74 123.34 1daa s LYS 11 Ca 0.38 1.66 -0.10 0.00 0.02 0.00 0.00 55.97 57.93 1daa s LYS 11 Cb 0.03 -1.97 0.29 0.00 -0.52 0.00 0.00 37.83 35.66 1daa s LYS 11 CO 0.21 -1.01 1.68 -0.44 -0.92 0.00 0.00 175.35 174.88 1daa h ASP 12 N 0.98 -0.14 -0.58 2.83 3.32 -1.19 -1.26 116.42 120.38 1daa h ASP 12 Ca -0.50 0.13 0.17 0.00 0.02 0.00 0.00 57.03 56.85 1daa h ASP 12 Cb 1.27 0.21 -0.02 0.00 0.22 0.00 0.00 39.33 41.01 1daa h ASP 12 CO 0.56 -0.06 0.57 -0.33 -1.72 0.00 0.00 179.24 178.26 1daa h GLU 13 N 0.18 0.00 0.00 3.56 3.07 -1.91 -1.52 114.58 117.96 1daa h GLU 13 Ca 0.32 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.18 1daa h GLU 13 Cb 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 1daa h GLU 13 CO -0.46 0.00 -0.15 0.93 -1.40 0.00 0.00 179.01 177.93 1daa h GLU 14 N 0.00 0.00 -5.88 2.33 5.08 -1.59 -3.46 114.58 111.06 1daa h GLU 14 Ca 0.28 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 58.06 1daa h GLU 14 Cb 1.41 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.60 1daa h GLU 14 CO -0.00 0.00 -0.09 0.54 -1.00 0.00 0.00 179.01 178.46 1daa s VAL 15 N -3.15 5.09 -0.07 3.13 0.11 -0.58 -5.04 120.40 119.89 1daa s VAL 15 Ca 0.08 1.07 0.01 0.00 -2.93 0.00 0.00 61.98 60.21 1daa s VAL 15 Cb 0.10 -3.86 0.02 0.00 -1.53 0.00 0.00 36.38 31.11 1daa s VAL 15 CO 0.65 0.37 -0.07 -0.54 -3.33 0.00 0.00 175.10 172.17 1daa s LYS 16 N 0.27 1.24 -0.07 1.54 1.02 -1.26 -5.11 119.74 117.38 1daa s LYS 16 Ca 0.28 -0.22 -0.12 0.00 0.02 0.00 0.00 55.97 55.93 1daa s LYS 16 Cb -0.16 -1.19 -0.05 0.00 -0.52 0.00 0.00 37.83 35.91 1daa s LYS 16 CO 0.13 -0.10 0.30 0.42 -0.92 0.00 0.00 175.35 175.18 1daa s ILE 17 N 1.06 5.24 0.33 2.17 1.09 -1.26 -5.10 121.20 124.73 1daa s ILE 17 Ca -0.08 0.57 -0.26 0.00 -1.10 0.00 0.00 60.65 59.78 1daa s ILE 17 Cb -0.14 -3.59 -0.10 0.00 -1.06 0.00 0.00 42.46 37.57 1daa s ILE 17 CO -0.01 0.56 0.94 -0.62 -0.10 0.00 0.00 174.94 175.72 1daa s ASP 18 N -0.79 7.32 0.49 3.58 2.15 -1.26 -4.98 116.67 123.18 1daa s ASP 18 Ca 0.19 1.83 0.23 0.00 0.43 0.00 0.00 52.55 55.23 1daa s ASP 18 Cb -0.14 -2.58 1.30 0.00 -0.30 0.00 0.00 42.92 41.19 1daa s ASP 18 CO 0.08 -0.08 2.04 0.07 -0.17 0.00 0.00 175.17 177.11 1daa h LYS 19 N 3.10 0.00 -0.63 4.34 2.10 -2.02 -1.87 116.57 121.60 1daa h LYS 19 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1daa h LYS 19 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1daa h LYS 19 CO 0.65 0.15 0.00 0.39 -2.00 0.00 0.00 179.45 178.64 1daa n GLU 20 N -3.86 4.28 -1.71 0.07 1.02 -1.26 -4.63 120.64 114.56 1daa n GLU 20 Ca -0.02 -2.91 -0.42 0.00 -0.02 0.00 0.00 57.16 53.79 1daa n GLU 20 Cb 0.25 -2.09 -0.03 0.00 -0.02 0.00 0.00 31.44 29.55 1daa n GLU 20 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1daa s ASP 21 N -0.79 6.40 0.64 1.62 -1.08 -0.71 -2.62 116.67 120.13 1daa s ASP 21 Ca 0.51 2.81 0.41 0.00 -0.52 0.00 0.00 52.55 55.76 1daa s ASP 21 Cb 0.36 -2.58 2.19 0.00 -1.46 0.00 0.00 42.92 41.44 1daa s ASP 21 CO 0.19 -1.00 2.30 0.03 0.52 0.00 0.00 175.17 177.21 1daa h ARG 22 N 8.04 0.00 0.00 4.34 3.08 -1.48 -0.65 114.38 127.71 1daa h ARG 22 Ca -0.45 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.51 1daa h ARG 22 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.25 1daa h ARG 22 CO 0.95 0.01 -0.43 0.78 -1.07 0.00 0.00 179.97 180.21 1daa h GLY 23 N 0.29 0.00 1.39 0.04 0.00 -1.81 -0.49 103.07 102.49 1daa h GLY 23 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.07 1daa h GLY 23 CO 0.00 0.00 -1.43 -1.82 0.00 0.00 0.00 176.54 173.30 1daa h TYR 24 N 0.00 0.05 0.00 5.60 3.20 -1.47 -2.99 116.97 121.36 1daa h TYR 24 Ca -0.00 -0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.64 1daa h TYR 24 Cb 0.98 -0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.21 1daa h TYR 24 CO 0.00 1.04 -1.89 1.04 -1.64 0.00 0.00 178.16 176.71 1daa n GLN 25 N -3.20 0.65 0.00 1.82 6.02 -0.93 -4.68 117.38 117.06 1daa n GLN 25 Ca -0.11 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 1daa n GLN 25 Cb 1.01 -1.64 0.00 0.00 1.02 0.00 0.00 30.24 30.63 1daa n GLN 25 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1daa n PHE 26 N -2.68 0.00 -2.80 1.08 3.72 -0.23 -4.99 117.46 111.57 1daa n PHE 26 Ca -0.16 -0.03 -0.21 0.00 -0.05 0.00 0.00 57.45 56.99 1daa n PHE 26 Cb 0.88 -0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.43 1daa n PHE 26 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1daa n GLY 27 N -0.03 -0.51 3.48 1.37 0.00 -1.12 -4.89 105.19 103.49 1daa n GLY 27 Ca 0.00 0.07 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 1daa n GLY 27 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1daa n ASP 28 N -2.27 5.14 -3.82 1.61 2.03 -0.99 -3.91 116.55 114.34 1daa n ASP 28 Ca -0.15 -2.96 0.03 0.00 0.52 0.00 0.00 54.79 52.23 1daa n ASP 28 Cb 0.64 -1.62 0.01 0.00 -0.72 0.00 0.00 41.12 39.43 1daa n ASP 28 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1daa s GLY 29 N 3.16 -0.24 0.20 0.27 0.00 -1.26 -1.28 107.32 108.17 1daa s GLY 29 Ca 0.46 0.28 0.03 0.00 0.00 0.00 0.00 44.72 45.49 1daa s GLY 29 CO 0.02 4.51 -0.00 -1.34 0.00 0.00 0.00 173.10 176.29 1daa s VAL 30 N -2.07 0.84 0.35 1.40 -7.23 -0.29 -1.54 120.40 111.86 1daa s VAL 30 Ca 0.26 -2.01 -0.10 0.00 -1.81 0.00 0.00 61.98 58.32 1daa s VAL 30 Cb 0.02 -2.21 0.02 0.00 0.56 0.00 0.00 36.38 34.77 1daa s VAL 30 CO -0.03 -0.41 0.62 -0.72 -0.31 0.00 0.00 175.10 174.26 1daa s TYR 31 N -3.55 0.51 0.11 2.82 1.13 -1.01 -1.12 117.35 116.24 1daa s TYR 31 Ca 0.26 -0.96 -0.17 0.00 -1.41 0.00 0.00 57.07 54.79 1daa s TYR 31 Cb 0.06 0.38 0.04 0.00 -1.10 0.00 0.00 41.96 41.34 1daa s TYR 31 CO 0.06 -1.31 0.43 -1.21 -2.51 0.00 0.00 175.55 171.01 1daa s GLU 32 N -2.91 1.06 -0.05 -3.49 0.41 -0.43 -4.86 118.70 108.43 1daa s GLU 32 Ca 0.22 -0.61 0.03 0.00 -0.41 0.00 0.00 54.97 54.19 1daa s GLU 32 Cb -0.03 0.47 0.01 0.00 -1.78 0.00 0.00 34.13 32.80 1daa s GLU 32 CO 0.14 -0.41 -0.12 0.08 -0.49 0.00 0.00 175.26 174.46 1daa s VAL 33 N -3.54 1.04 -0.07 2.63 1.01 -1.26 -2.25 120.40 117.96 1daa s VAL 33 Ca 0.01 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.56 1daa s VAL 33 Cb 0.01 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1daa s VAL 33 CO -0.10 0.32 -0.17 -0.69 0.00 0.00 0.00 175.10 174.46 1daa s VAL 34 N 0.38 1.52 0.16 2.92 1.01 -0.40 -4.93 120.40 121.06 1daa s VAL 34 Ca -0.08 -0.72 -0.18 0.00 0.00 0.00 0.00 61.98 61.00 1daa s VAL 34 Cb -0.12 -1.33 -0.07 0.00 0.00 0.00 0.00 36.38 34.85 1daa s VAL 34 CO 0.02 0.44 0.63 -0.75 0.00 0.00 0.00 175.10 175.44 1daa s LYS 35 N 0.41 4.17 -0.16 2.72 2.47 -1.26 -0.78 119.74 127.31 1daa s LYS 35 Ca -0.14 0.73 0.00 0.00 -1.56 0.00 0.00 55.97 55.01 1daa s LYS 35 Cb -0.16 -3.01 0.00 0.00 -1.46 0.00 0.00 37.83 33.20 1daa s LYS 35 CO 0.05 0.50 -0.16 0.08 0.16 0.00 0.00 175.35 175.98 1daa s VAL 36 N -1.37 2.52 -0.25 4.02 1.01 -0.09 -1.43 120.40 124.81 1daa s VAL 36 Ca 0.37 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 1daa s VAL 36 Cb -0.17 -2.06 0.03 0.00 0.00 0.00 0.00 36.38 34.17 1daa s VAL 36 CO 0.20 0.52 -0.07 -0.31 0.00 0.00 0.00 175.10 175.43 1daa s TYR 37 N 0.96 3.07 -1.48 5.22 2.02 0.32 -1.89 117.35 125.56 1daa s TYR 37 Ca -0.03 -1.64 -0.12 0.00 -0.37 0.00 0.00 57.07 54.91 1daa s TYR 37 Cb -0.15 -2.04 0.07 0.00 -0.40 0.00 0.00 41.96 39.44 1daa s TYR 37 CO -0.03 -0.75 1.02 0.09 -1.57 0.00 0.00 175.55 174.31 1daa n ASN 38 N 4.64 -5.00 0.00 2.29 3.02 -0.81 -1.60 115.26 117.81 1daa n ASN 38 Ca -0.16 -0.73 0.00 0.00 -0.03 0.00 0.00 54.58 53.66 1daa n ASN 38 Cb 0.47 -4.16 0.00 0.00 -0.61 0.00 0.00 39.78 35.48 1daa n ASN 38 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1daa n GLY 39 N -1.76 1.43 3.58 7.41 0.00 -0.05 -5.00 105.19 110.80 1daa n GLY 39 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1daa n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1daa s GLU 40 N -0.33 2.84 -0.08 1.61 2.02 -0.63 -5.02 118.70 119.12 1daa s GLU 40 Ca 0.00 -0.54 -0.30 0.00 0.02 0.00 0.00 54.97 54.15 1daa s GLU 40 Cb 0.00 -2.63 -0.02 0.00 0.10 0.00 0.00 34.13 31.59 1daa s GLU 40 CO 0.00 0.63 1.06 -1.64 0.02 0.00 0.00 175.26 175.32 1daa s MET 41 N -0.70 4.42 -0.02 1.61 -1.94 -1.26 -0.52 119.30 120.88 1daa s MET 41 Ca 0.11 1.47 -0.20 0.00 -1.71 0.00 0.00 55.69 55.35 1daa s MET 41 Cb -0.11 -3.53 -0.05 0.00 2.01 0.00 0.00 34.83 33.14 1daa s MET 41 CO 0.02 -0.32 0.59 0.12 -0.01 0.00 0.00 175.02 175.42 1daa s PHE 42 N 1.95 3.66 -1.84 -0.03 5.36 -0.51 -4.36 117.98 122.22 1daa s PHE 42 Ca 0.51 1.18 -0.20 0.00 -0.96 0.00 0.00 56.93 57.45 1daa s PHE 42 Cb -0.20 -2.61 0.20 0.00 -0.34 0.00 0.00 43.02 40.07 1daa s PHE 42 CO 0.20 0.32 0.52 0.25 -1.46 0.00 0.00 175.22 175.05 1daa n THR 43 N 2.85 -0.18 -0.11 0.12 -2.24 -1.26 -4.49 114.28 108.97 1daa n THR 43 Ca -0.07 -0.07 -0.02 0.00 -2.27 0.00 0.00 64.05 61.62 1daa n THR 43 Cb 0.51 -0.61 0.22 0.00 -2.10 0.00 0.00 70.33 68.35 1daa n THR 43 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1daa h VAL 44 N -1.02 1.21 -0.06 2.28 3.04 -1.95 -2.51 116.25 117.24 1daa h VAL 44 Ca -0.61 -0.76 -0.12 0.00 -1.01 0.00 0.00 66.70 64.20 1daa h VAL 44 Cb 1.39 0.68 -0.01 0.00 -2.01 0.00 0.00 31.29 31.33 1daa h VAL 44 CO 0.87 0.28 -0.49 0.78 -1.01 0.00 0.00 177.57 178.00 1daa h ASN 45 N 0.76 0.17 -0.43 3.17 -0.26 -1.95 -1.46 115.58 115.57 1daa h ASN 45 Ca 0.17 -0.08 -0.06 0.00 -0.56 0.00 0.00 56.30 55.77 1daa h ASN 45 Cb 0.26 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 37.46 1daa h ASN 45 CO -0.00 0.63 0.03 -0.33 -1.06 0.00 0.00 177.43 176.70 1daa h GLU 46 N 0.12 0.74 -0.44 0.81 3.07 -1.88 -0.38 114.58 116.63 1daa h GLU 46 Ca 0.00 -0.22 -0.08 0.00 -0.50 0.00 0.00 59.36 58.56 1daa h GLU 46 Cb 0.91 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.73 1daa h GLU 46 CO 0.07 0.80 -0.04 0.45 -1.40 0.00 0.00 179.01 178.89 1daa h HIS 47 N 0.59 0.88 -0.73 4.33 3.86 -1.22 -1.92 115.15 120.95 1daa h HIS 47 Ca 0.13 -0.17 -0.02 0.00 -1.16 0.00 0.00 60.37 59.15 1daa h HIS 47 Cb 0.44 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.65 1daa h HIS 47 CO 0.03 0.88 0.39 0.82 0.86 0.00 0.00 177.93 180.91 1daa h ILE 48 N 0.64 1.23 -0.83 2.45 2.04 -1.12 -0.97 117.51 120.94 1daa h ILE 48 Ca 0.12 -0.58 -0.00 0.00 1.00 0.00 0.00 64.86 65.39 1daa h ILE 48 Cb 0.55 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 1daa h ILE 48 CO 0.03 0.25 0.51 0.44 0.00 0.00 0.00 178.15 179.39 1daa h ASP 49 N 1.01 0.98 0.25 1.72 3.32 -0.94 -2.27 116.42 120.50 1daa h ASP 49 Ca 0.26 -0.05 -0.12 0.00 0.02 0.00 0.00 57.03 57.13 1daa h ASP 49 Cb 0.06 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 1daa h ASP 49 CO -0.04 0.75 -0.46 -0.09 -1.72 0.00 0.00 179.24 177.67 1daa h ARG 50 N 1.13 0.26 -0.03 3.56 2.43 -0.89 -1.51 114.38 119.33 1daa h ARG 50 Ca 0.30 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1daa h ARG 50 Cb -0.07 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1daa h ARG 50 CO -0.06 0.67 0.02 1.25 -1.51 0.00 0.00 179.97 180.35 1daa h LEU 51 N 0.21 0.04 -1.12 3.80 5.85 -0.68 -0.04 115.31 123.38 1daa h LEU 51 Ca 0.01 -0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 1daa h LEU 51 Cb 0.90 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 1daa h LEU 51 CO 0.07 0.08 -0.38 1.88 -0.34 0.00 0.00 178.44 179.75 1daa h TYR 52 N 0.00 0.13 -0.16 1.25 -1.99 -1.36 -0.45 116.97 114.40 1daa h TYR 52 Ca 0.01 -0.03 -0.18 0.00 2.00 0.00 0.00 58.73 60.53 1daa h TYR 52 Cb 0.04 -0.03 -0.00 0.00 2.00 0.00 0.00 36.73 38.74 1daa h TYR 52 CO -0.06 0.48 -0.64 0.00 -0.00 0.00 0.00 178.16 177.94 1daa h ALA 53 N 1.52 0.58 -0.30 3.88 0.00 -0.87 -1.62 119.26 122.45 1daa h ALA 53 Ca 0.01 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 1daa h ALA 53 Cb 0.72 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1daa h ALA 53 CO 0.05 0.71 0.07 0.77 0.00 0.00 0.00 179.25 180.85 1daa h SER 54 N 0.42 0.45 -0.72 0.00 0.02 -0.65 -2.14 113.55 110.95 1daa h SER 54 Ca -0.01 -0.24 0.04 0.00 -0.84 0.00 0.00 61.79 60.74 1daa h SER 54 Cb 1.21 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 63.58 1daa h SER 54 CO 0.12 0.57 0.43 0.00 -1.14 0.00 0.00 176.83 176.82 1daa h ALA 55 N 0.90 0.95 -0.17 3.77 0.00 -1.07 -2.72 119.26 120.91 1daa h ALA 55 Ca 0.09 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1daa h ALA 55 Cb 0.30 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1daa h ALA 55 CO 0.00 0.17 -0.33 0.93 0.00 0.00 0.00 179.25 180.02 1daa h GLU 56 N 0.82 0.34 0.00 0.00 5.08 -1.12 0.19 114.58 119.90 1daa h GLU 56 Ca 0.30 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1daa h GLU 56 Cb 0.09 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 1daa h GLU 56 CO -0.14 0.64 -0.09 0.87 -1.00 0.00 0.00 179.01 179.29 1daa h LYS 57 N 0.30 0.00 -0.21 2.33 1.57 -1.06 -1.77 116.57 117.73 1daa h LYS 57 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1daa h LYS 57 Cb 0.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1daa h LYS 57 CO 0.06 0.09 0.00 0.44 -0.57 0.00 0.00 179.45 179.47 1daa n ILE 58 N -3.87 1.81 -3.47 1.86 -5.35 -1.06 -5.01 119.36 104.27 1daa n ILE 58 Ca -0.02 -1.68 -0.23 0.00 -0.27 0.00 0.00 62.75 60.55 1daa n ILE 58 Cb 0.18 -0.01 0.07 0.00 -1.74 0.00 0.00 39.64 38.14 1daa n ILE 58 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1daa n ARG 59 N -0.46 -7.25 -3.57 6.28 1.74 -0.67 -5.03 116.66 107.71 1daa n ARG 59 Ca 0.16 0.82 -0.36 0.00 -0.77 0.00 0.00 57.85 57.70 1daa n ARG 59 Cb 0.68 -5.78 -0.07 0.00 -1.02 0.00 0.00 32.46 26.27 1daa n ARG 59 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1daa s ILE 60 N -3.29 5.31 -0.39 0.55 1.01 -0.02 -5.00 121.20 119.38 1daa s ILE 60 Ca 0.52 0.52 -0.15 0.00 0.00 0.00 0.00 60.65 61.54 1daa s ILE 60 Cb -0.23 -3.61 0.01 0.00 0.01 0.00 0.00 42.46 38.64 1daa s ILE 60 CO 0.65 0.42 0.30 -0.89 0.00 0.00 0.00 174.94 175.42 1daa s THR 61 N 0.26 5.25 0.17 2.92 2.01 -1.26 -4.00 115.64 120.99 1daa s THR 61 Ca 0.16 -0.49 -0.30 0.00 0.31 0.00 0.00 61.69 61.37 1daa s THR 61 Cb -0.13 -3.88 -0.08 0.00 0.01 0.00 0.00 72.50 68.43 1daa s THR 61 CO 0.04 -0.23 1.21 -0.63 -0.69 0.00 0.00 174.62 174.32 1daa s ILE 62 N 1.74 3.59 -1.95 1.82 1.01 -1.26 -4.76 121.20 121.40 1daa s ILE 62 Ca 0.06 1.30 0.32 0.00 0.00 0.00 0.00 60.65 62.33 1daa s ILE 62 Cb -0.18 -3.83 0.87 0.00 0.01 0.00 0.00 42.46 39.32 1daa s ILE 62 CO 0.10 0.19 2.21 -0.81 0.00 0.00 0.00 174.94 176.63 1daa n PRO 63 N 2.72 0.95 -4.41 2.79 -0.04 -1.26 -4.83 135.00 130.92 1daa n PRO 63 Ca 0.05 -0.01 -0.24 0.00 -0.04 0.00 0.00 63.50 63.26 1daa n PRO 63 Cb 0.45 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.30 1daa n PRO 63 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1daa s TYR 64 N -2.06 2.14 0.78 0.54 2.02 -1.26 -5.13 117.35 114.38 1daa s TYR 64 Ca 0.46 -0.39 -0.11 0.00 -0.37 0.00 0.00 57.07 56.66 1daa s TYR 64 Cb 0.22 -1.02 0.06 0.00 -0.40 0.00 0.00 41.96 40.82 1daa s TYR 64 CO 0.38 0.51 1.09 0.95 -1.57 0.00 0.00 175.55 176.90 1daa s THR 65 N -2.08 3.34 0.49 -0.71 -4.23 -1.26 -4.90 115.64 106.30 1daa s THR 65 Ca 0.22 0.43 0.18 0.00 -1.18 0.00 0.00 61.69 61.35 1daa s THR 65 Cb -0.06 -2.96 0.25 0.00 1.34 0.00 0.00 72.50 71.07 1daa s THR 65 CO 0.10 -0.57 2.10 0.11 -0.54 0.00 0.00 174.62 175.82 1daa h LYS 66 N -1.12 0.00 0.14 3.99 1.57 -1.99 -2.46 116.57 116.70 1daa h LYS 66 Ca -0.44 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.05 1daa h LYS 66 Cb 1.24 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.55 1daa h LYS 66 CO 0.53 0.08 -1.28 0.22 -0.57 0.00 0.00 179.45 178.43 1daa h ASP 67 N 0.00 0.46 -0.68 0.86 3.58 -2.00 -2.42 116.42 116.22 1daa h ASP 67 Ca -0.00 -0.50 0.01 0.00 0.42 0.00 0.00 57.03 56.95 1daa h ASP 67 Cb 0.14 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 1daa h ASP 67 CO 0.01 1.39 0.45 0.50 -2.88 0.00 0.00 179.24 178.71 1daa h LYS 68 N 0.08 0.90 -0.40 0.28 1.63 -1.90 -1.82 116.57 115.34 1daa h LYS 68 Ca -0.15 -0.06 0.02 0.00 -0.85 0.00 0.00 60.65 59.61 1daa h LYS 68 Cb 1.99 -0.20 -0.03 0.00 -0.60 0.00 0.00 32.23 33.39 1daa h LYS 68 CO 0.21 0.60 0.22 0.35 -3.45 0.00 0.00 179.45 177.38 1daa h PHE 69 N 0.93 0.41 -0.83 1.91 3.04 -1.42 -1.52 116.94 119.46 1daa h PHE 69 Ca 0.25 0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.24 1daa h PHE 69 Cb -0.10 -0.13 -0.05 0.00 2.56 0.00 0.00 35.95 38.24 1daa h PHE 69 CO -0.02 0.23 0.54 1.25 -2.02 0.00 0.00 178.31 178.28 1daa h HIS 70 N 0.45 1.01 -0.43 0.41 2.76 -1.12 -1.49 115.15 116.74 1daa h HIS 70 Ca 0.17 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.27 1daa h HIS 70 Cb 0.04 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 28.65 1daa h HIS 70 CO -0.08 0.60 -0.07 1.96 -1.30 0.00 0.00 177.93 179.04 1daa h GLN 71 N 1.07 0.80 -0.93 5.26 4.20 -0.95 -0.91 115.11 123.65 1daa h GLN 71 Ca 0.32 -0.29 0.02 0.00 0.06 0.00 0.00 58.65 58.76 1daa h GLN 71 Cb -0.04 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.64 1daa h GLN 71 CO -0.10 0.91 0.61 -0.07 -0.67 0.00 0.00 178.83 179.51 1daa h LEU 72 N 0.63 1.04 -0.84 1.46 3.38 -1.13 -0.88 115.31 118.96 1daa h LEU 72 Ca 0.11 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1daa h LEU 72 Cb 0.59 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1daa h LEU 72 CO 0.04 0.74 -0.38 -0.07 0.09 0.00 0.00 178.44 178.85 1daa h LEU 73 N 1.22 0.42 -0.65 1.67 3.38 -0.75 -2.22 115.31 118.38 1daa h LEU 73 Ca 0.35 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1daa h LEU 73 Cb -0.08 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1daa h LEU 73 CO -0.09 0.76 0.12 -0.74 0.09 0.00 0.00 178.44 178.59 1daa h HIS 74 N 0.34 1.12 -0.48 1.13 2.76 -0.15 -2.60 115.15 117.27 1daa h HIS 74 Ca 0.03 -0.15 -0.00 0.00 -2.20 0.00 0.00 60.37 58.05 1daa h HIS 74 Cb 0.82 -0.31 -0.02 0.00 1.55 0.00 0.00 27.41 29.45 1daa h HIS 74 CO 0.02 0.94 0.29 1.49 -1.30 0.00 0.00 177.93 179.37 1daa h GLU 75 N 0.98 0.64 -0.54 5.26 4.81 -1.09 -2.32 114.58 122.32 1daa h GLU 75 Ca 0.20 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1daa h GLU 75 Cb 0.41 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1daa h GLU 75 CO 0.01 0.47 0.25 1.25 -0.73 0.00 0.00 179.01 180.26 1daa h LEU 76 N 0.63 0.72 -0.83 1.64 5.85 -1.21 -0.98 115.31 121.13 1daa h LEU 76 Ca 0.17 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1daa h LEU 76 Cb -0.01 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.79 1daa h LEU 76 CO -0.03 0.66 0.48 0.58 -0.34 0.00 0.00 178.44 179.78 1daa h VAL 77 N 0.73 1.24 0.21 1.05 2.07 -1.32 -2.72 116.25 117.51 1daa h VAL 77 Ca 0.19 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1daa h VAL 77 Cb 0.13 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.01 1daa h VAL 77 CO -0.02 0.26 -0.10 -0.33 0.02 0.00 0.00 177.57 177.39 1daa h GLU 78 N 1.14 -0.27 -0.94 1.57 5.08 -0.85 -0.83 114.58 119.48 1daa h GLU 78 Ca 0.29 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1daa h GLU 78 Cb -0.01 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 1daa h GLU 78 CO -0.05 -0.08 0.60 0.87 -1.00 0.00 0.00 179.01 179.35 1daa h LYS 79 N -0.42 1.25 -0.00 2.33 1.57 -1.21 -1.73 116.57 118.36 1daa h LYS 79 Ca -0.03 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1daa h LYS 79 Cb 0.32 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1daa h LYS 79 CO 0.05 0.85 -0.06 0.09 -0.57 0.00 0.00 179.45 179.81 1daa n ASN 80 N -4.40 0.09 -3.64 0.86 4.13 -1.03 -4.94 115.26 106.34 1daa n ASN 80 Ca 0.11 0.21 -0.21 0.00 1.68 0.00 0.00 54.58 56.36 1daa n ASN 80 Cb 0.03 -0.34 0.05 0.00 -1.54 0.00 0.00 39.78 37.98 1daa n ASN 80 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1daa n GLU 81 N -1.42 -5.81 -2.59 3.52 1.02 -0.37 -4.93 120.64 110.06 1daa n GLU 81 Ca 0.09 0.71 -0.42 0.00 -0.02 0.00 0.00 57.16 57.52 1daa n GLU 81 Cb 0.32 -5.49 -0.03 0.00 -0.02 0.00 0.00 31.44 26.21 1daa n GLU 81 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1daa s LEU 82 N -6.72 4.40 0.00 -4.62 2.96 -0.89 -4.97 118.68 108.84 1daa s LEU 82 Ca 0.14 1.84 0.00 0.00 -0.22 0.00 0.00 54.13 55.89 1daa s LEU 82 Cb -0.07 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.04 1daa s LEU 82 CO 0.78 -0.30 0.00 -3.20 -1.32 0.00 0.00 176.35 172.31 1daa n ASN 83 N 3.61 0.00 -4.28 3.68 2.85 -1.26 -3.99 115.26 115.88 1daa n ASN 83 Ca 0.06 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 54.20 1daa n ASN 83 Cb 0.49 -0.09 -0.15 0.00 1.24 0.00 0.00 39.78 41.27 1daa n ASN 83 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1daa s THR 84 N -0.22 2.75 -1.39 -0.44 2.01 -1.26 -0.87 115.64 116.22 1daa s THR 84 Ca 0.00 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.26 1daa s THR 84 Cb 0.00 -2.16 0.00 0.00 0.01 0.00 0.00 72.50 70.35 1daa s THR 84 CO 0.00 0.51 0.00 0.61 -0.69 0.00 0.00 174.62 175.05 1daa n GLY 85 N 4.03 -0.73 3.31 4.40 0.00 -0.79 -1.18 105.19 114.23 1daa n GLY 85 Ca -0.19 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 1daa n GLY 85 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1daa s HIS 86 N -4.00 0.68 -0.12 1.61 -3.43 -0.33 -0.92 115.29 108.77 1daa s HIS 86 Ca 0.00 -1.01 -0.00 0.00 -0.80 0.00 0.00 55.06 53.25 1daa s HIS 86 Cb 0.00 -0.23 -0.02 0.00 -1.43 0.00 0.00 32.58 30.90 1daa s HIS 86 CO 0.00 -0.71 -0.11 0.42 -2.00 0.00 0.00 174.74 172.34 1daa s ILE 87 N -4.04 3.21 -0.11 -5.38 1.01 0.04 -1.35 121.20 114.58 1daa s ILE 87 Ca 0.25 -0.61 -0.02 0.00 0.00 0.00 0.00 60.65 60.27 1daa s ILE 87 Cb 0.04 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.14 1daa s ILE 87 CO 0.05 0.53 -0.05 -0.47 0.00 0.00 0.00 174.94 175.00 1daa s TYR 88 N 0.19 3.00 -0.07 3.97 5.04 -0.10 -1.27 117.35 128.12 1daa s TYR 88 Ca -0.07 -0.14 -0.11 0.00 -2.44 0.00 0.00 57.07 54.31 1daa s TYR 88 Cb -0.15 -1.84 0.02 0.00 0.35 0.00 0.00 41.96 40.34 1daa s TYR 88 CO 0.05 0.15 0.27 -0.59 -1.34 0.00 0.00 175.55 174.09 1daa s PHE 89 N -0.22 -0.23 0.09 4.97 -0.71 -0.95 -1.07 117.98 119.87 1daa s PHE 89 Ca 0.03 0.50 -0.02 0.00 -1.04 0.00 0.00 56.93 56.40 1daa s PHE 89 Cb -0.13 0.08 -0.04 0.00 -1.21 0.00 0.00 43.02 41.73 1daa s PHE 89 CO 0.02 -0.23 0.04 1.14 -1.34 0.00 0.00 175.22 174.85 1daa s GLN 90 N -0.47 0.79 -0.08 1.99 -2.07 -0.14 -1.31 119.66 118.36 1daa s GLN 90 Ca -0.06 -1.29 0.01 0.00 -1.82 0.00 0.00 55.36 52.21 1daa s GLN 90 Cb -0.04 0.24 0.02 0.00 -1.09 0.00 0.00 33.01 32.14 1daa s GLN 90 CO 0.02 -0.20 -0.11 0.08 -1.32 0.00 0.00 175.29 173.76 1daa s VAL 91 N -3.97 1.08 0.36 3.63 1.01 -0.28 -1.76 120.40 120.48 1daa s VAL 91 Ca 0.14 -0.41 0.08 0.00 0.00 0.00 0.00 61.98 61.79 1daa s VAL 91 Cb 0.07 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 1daa s VAL 91 CO -0.05 0.35 0.14 0.42 0.00 0.00 0.00 175.10 175.97 1daa s THR 92 N 0.95 2.74 -0.04 3.92 -4.23 -0.83 -1.13 115.64 117.03 1daa s THR 92 Ca -0.09 -1.73 0.31 0.00 -1.18 0.00 0.00 61.69 59.00 1daa s THR 92 Cb -0.15 -2.95 0.33 0.00 1.34 0.00 0.00 72.50 71.07 1daa s THR 92 CO 0.00 -0.13 1.92 -0.09 -0.54 0.00 0.00 174.62 175.78 1daa h ARG 93 N 1.53 0.00 0.00 3.99 2.43 -1.53 -3.05 114.38 117.75 1daa h ARG 93 Ca -0.43 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1daa h ARG 93 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1daa h ARG 93 CO 0.65 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 179.52 1daa n GLY 94 N -0.33 0.78 3.51 2.80 0.00 -1.26 -3.78 105.19 106.92 1daa n GLY 94 Ca 0.00 -2.20 -0.34 0.00 0.00 0.00 0.00 46.02 43.49 1daa n GLY 94 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1daa s THR 95 N -0.89 3.86 0.04 2.61 -4.23 -1.26 -1.18 115.64 114.59 1daa s THR 95 Ca 0.00 -0.38 -0.12 0.00 -1.18 0.00 0.00 61.69 60.02 1daa s THR 95 Cb 0.00 -2.68 0.01 0.00 1.34 0.00 0.00 72.50 71.18 1daa s THR 95 CO 0.00 0.51 0.25 -0.55 -0.54 0.00 0.00 174.62 174.29 1daa s SER 96 N 0.19 -0.05 0.04 3.99 0.15 -1.08 -4.94 113.70 111.99 1daa s SER 96 Ca -0.02 -0.26 -0.37 0.00 0.70 0.00 0.00 55.95 56.00 1daa s SER 96 Cb -0.14 0.32 -0.16 0.00 -1.71 0.00 0.00 66.02 64.33 1daa s SER 96 CO 0.03 -0.57 1.46 -2.65 1.20 0.00 0.00 173.24 172.71 1daa n PRO 97 N 0.70 1.35 -1.67 5.44 -0.02 -1.26 -4.77 135.00 134.77 1daa n PRO 97 Ca -0.19 0.49 -0.51 0.00 -2.02 0.00 0.00 63.50 61.27 1daa n PRO 97 Cb 0.59 -2.17 -0.05 0.00 -0.02 0.00 0.00 33.50 31.85 1daa n PRO 97 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1daa n ARG 98 N 3.27 1.88 -3.53 -0.52 0.63 -1.26 -4.97 116.66 112.16 1daa n ARG 98 Ca 0.20 0.68 -0.17 0.00 -0.92 0.00 0.00 57.85 57.63 1daa n ARG 98 Cb 0.20 -2.53 -0.06 0.00 0.45 0.00 0.00 32.46 30.52 1daa n ARG 98 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1daa s ALA 99 N 4.26 -1.78 0.07 5.13 0.00 -1.26 -5.09 121.76 123.09 1daa s ALA 99 Ca 0.95 1.40 -0.16 0.00 0.00 0.00 0.00 51.96 54.15 1daa s ALA 99 Cb -0.78 -0.14 -0.15 0.00 0.00 0.00 0.00 23.12 22.05 1daa s ALA 99 CO 0.55 -0.36 1.30 0.45 0.00 0.00 0.00 175.76 177.69 1daa h HIS 100 N 3.15 0.80 -4.24 0.00 3.86 -2.03 -3.45 115.15 113.23 1daa h HIS 100 Ca -0.27 -0.31 -0.51 0.00 -1.16 0.00 0.00 60.37 58.12 1daa h HIS 100 Cb 1.14 -0.14 0.14 0.00 1.06 0.00 0.00 27.41 29.62 1daa h HIS 100 CO 0.38 1.09 0.29 1.14 0.86 0.00 0.00 177.93 181.68 1daa s GLN 101 N -3.91 1.83 0.50 2.45 0.00 -1.26 -4.95 119.66 114.31 1daa s GLN 101 Ca -0.12 1.14 -0.23 0.00 -0.00 0.00 0.00 55.36 56.15 1daa s GLN 101 Cb 0.07 -1.85 -0.06 0.00 0.00 0.00 0.00 33.01 31.17 1daa s GLN 101 CO 0.84 -1.93 1.39 -0.06 0.00 0.00 0.00 175.29 175.53 1daa s PHE 102 N -2.87 2.36 -0.20 9.60 0.08 -1.26 -4.84 117.98 120.85 1daa s PHE 102 Ca 0.62 1.32 -0.37 0.00 0.12 0.00 0.00 56.93 58.62 1daa s PHE 102 Cb -0.18 -3.86 -0.13 0.00 -0.57 0.00 0.00 43.02 38.27 1daa s PHE 102 CO 0.57 -2.94 1.86 -2.30 -0.10 0.00 0.00 175.22 172.31 1daa n PRO 103 N -0.63 1.62 0.21 0.24 -0.02 -1.26 -4.86 135.00 130.29 1daa n PRO 103 Ca 0.08 0.58 0.05 0.00 -2.02 0.00 0.00 63.50 62.19 1daa n PRO 103 Cb 0.43 -2.40 0.44 0.00 -0.02 0.00 0.00 33.50 31.96 1daa n PRO 103 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1daa h GLU 104 N 8.75 0.00 -6.04 -0.52 5.08 -1.99 -3.38 114.58 116.47 1daa h GLU 104 Ca -0.45 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.34 1daa h GLU 104 Cb 1.30 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.49 1daa h GLU 104 CO 0.96 0.29 0.00 -0.80 -1.00 0.00 0.00 179.01 178.47 1daa s ASN 105 N -6.83 6.95 -0.55 1.42 -0.87 -1.26 -4.99 114.94 108.80 1daa s ASN 105 Ca -0.03 1.14 -0.28 0.00 -1.57 0.00 0.00 52.86 52.12 1daa s ASN 105 Cb 0.14 -2.37 0.02 0.00 -0.02 0.00 0.00 41.25 39.02 1daa s ASN 105 CO 0.70 0.03 1.34 -0.89 -2.57 0.00 0.00 177.10 175.71 1daa s THR 106 N 0.16 3.87 0.25 1.60 2.01 -1.26 -4.97 115.64 117.30 1daa s THR 106 Ca 0.32 0.77 -0.15 0.00 0.31 0.00 0.00 61.69 62.95 1daa s THR 106 Cb -0.18 -4.52 -0.08 0.00 0.01 0.00 0.00 72.50 67.74 1daa s THR 106 CO 0.17 -1.19 0.66 -0.69 -0.69 0.00 0.00 174.62 172.87 1daa s VAL 107 N 5.63 4.74 0.14 3.82 1.01 -1.26 -5.09 120.40 129.40 1daa s VAL 107 Ca 0.50 0.89 -0.21 0.00 0.00 0.00 0.00 61.98 63.16 1daa s VAL 107 Cb -0.10 -3.69 -0.07 0.00 0.00 0.00 0.00 36.38 32.52 1daa s VAL 107 CO 0.26 -0.00 0.67 -0.54 0.00 0.00 0.00 175.10 175.49 1daa s LYS 108 N -2.55 4.31 0.80 2.72 1.02 -1.26 -4.92 119.74 119.86 1daa s LYS 108 Ca 0.47 0.88 -0.14 0.00 0.02 0.00 0.00 55.97 57.21 1daa s LYS 108 Cb -0.13 -3.13 0.06 0.00 -0.52 0.00 0.00 37.83 34.11 1daa s LYS 108 CO 0.19 0.55 1.10 -2.30 -0.92 0.00 0.00 175.35 173.97 1daa n PRO 109 N 1.37 0.22 -4.25 -1.68 -0.02 -1.25 -4.21 135.00 125.18 1daa n PRO 109 Ca -0.07 0.15 -0.34 0.00 -2.02 0.00 0.00 63.50 61.22 1daa n PRO 109 Cb 0.50 -2.36 -0.12 0.00 -0.02 0.00 0.00 33.50 31.50 1daa n PRO 109 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1daa s VAL 110 N -2.07 3.97 -0.06 -1.45 1.01 -1.15 -4.86 120.40 115.78 1daa s VAL 110 Ca 0.72 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 62.44 1daa s VAL 110 Cb -0.30 -2.76 -0.02 0.00 0.00 0.00 0.00 36.38 33.30 1daa s VAL 110 CO 0.52 0.47 -0.22 -0.63 0.00 0.00 0.00 175.10 175.24 1daa s ILE 111 N 0.61 2.37 -0.03 2.22 1.09 -1.26 -1.96 121.20 124.24 1daa s ILE 111 Ca -0.01 -0.96 0.02 0.00 -1.10 0.00 0.00 60.65 58.59 1daa s ILE 111 Cb -0.14 -1.88 0.01 0.00 -1.06 0.00 0.00 42.46 39.38 1daa s ILE 111 CO 0.02 0.57 -0.08 -0.63 -0.10 0.00 0.00 174.94 174.73 1daa s ILE 112 N -0.33 0.71 -0.05 2.92 -1.09 -0.72 -0.86 121.20 121.78 1daa s ILE 112 Ca 0.02 -0.30 -0.10 0.00 -2.23 0.00 0.00 60.65 58.04 1daa s ILE 112 Cb -0.13 -0.65 0.02 0.00 -1.58 0.00 0.00 42.46 40.12 1daa s ILE 112 CO 0.02 0.23 0.23 -0.83 -1.23 0.00 0.00 174.94 173.37 1daa s GLY 113 N 0.37 -0.12 0.21 6.18 0.00 -0.54 -0.97 107.32 112.45 1daa s GLY 113 Ca -0.06 0.39 -0.22 0.00 0.00 0.00 0.00 44.72 44.83 1daa s GLY 113 CO 0.01 0.25 0.67 -2.52 0.00 0.00 0.00 173.10 171.51 1daa s TYR 114 N -0.62 -0.36 0.28 1.90 1.13 -0.23 -0.49 117.35 118.97 1daa s TYR 114 Ca -0.07 0.03 0.10 0.00 -1.41 0.00 0.00 57.07 55.71 1daa s TYR 114 Cb -0.04 0.63 -0.04 0.00 -1.10 0.00 0.00 41.96 41.41 1daa s TYR 114 CO 0.02 -1.03 -0.01 0.95 -2.51 0.00 0.00 175.55 172.97 1daa s THR 115 N -3.81 3.26 -0.11 -3.49 -4.23 -1.26 -0.92 115.64 105.08 1daa s THR 115 Ca 0.06 -1.94 -0.05 0.00 -1.18 0.00 0.00 61.69 58.58 1daa s THR 115 Cb -0.03 -2.81 0.05 0.00 1.34 0.00 0.00 72.50 71.05 1daa s THR 115 CO -0.03 -0.34 0.24 -0.75 -0.54 0.00 0.00 174.62 173.20 1daa s LYS 116 N -3.68 0.17 -0.03 3.99 2.20 -0.46 -4.99 119.74 116.95 1daa s LYS 116 Ca 0.32 0.59 -0.30 0.00 -0.36 0.00 0.00 55.97 56.22 1daa s LYS 116 Cb -0.05 -0.11 -0.04 0.00 -1.51 0.00 0.00 37.83 36.12 1daa s LYS 116 CO 0.20 -0.21 1.20 -2.00 -0.36 0.00 0.00 175.35 174.18 1daa s GLU 117 N 1.67 4.37 -0.29 4.03 2.56 -1.26 -1.19 118.70 128.59 1daa s GLU 117 Ca -0.05 1.69 -0.03 0.00 0.00 0.00 0.00 54.97 56.58 1daa s GLU 117 Cb -0.11 -3.52 0.17 0.00 2.00 0.00 0.00 34.13 32.67 1daa s GLU 117 CO -0.08 -0.40 0.56 1.21 -0.56 0.00 0.00 175.26 175.99 1daa s ASN 118 N 1.40 -1.05 0.93 -1.70 2.47 -0.33 -4.92 114.94 111.74 1daa s ASN 118 Ca 0.56 0.87 -0.11 0.00 0.42 0.00 0.00 52.86 54.61 1daa s ASN 118 Cb -0.26 1.99 0.15 0.00 -1.45 0.00 0.00 41.25 41.68 1daa s ASN 118 CO 0.24 -0.26 1.10 -2.84 -3.72 0.00 0.00 177.10 171.62 1daa s PRO 119 N 2.80 0.95 0.44 0.43 0.02 -1.26 -3.20 135.00 135.18 1daa s PRO 119 Ca 0.15 1.21 -0.25 0.00 0.02 0.00 0.00 61.00 62.13 1daa s PRO 119 Cb -0.15 -1.74 -0.08 0.00 0.02 0.00 0.00 34.50 32.55 1daa s PRO 119 CO -0.20 -2.57 1.38 1.03 -0.33 0.00 0.00 177.00 176.32 1daa s ARG 120 N -4.72 3.78 -0.95 5.54 0.52 -1.26 -4.90 118.95 116.97 1daa s ARG 120 Ca 0.65 2.31 -0.08 0.00 -0.52 0.00 0.00 55.73 58.10 1daa s ARG 120 Cb -0.21 -2.68 -0.06 0.00 0.52 0.00 0.00 34.95 32.51 1daa s ARG 120 CO 0.59 -0.70 2.14 -0.35 0.02 0.00 0.00 175.30 176.99 1daa n PRO 121 N -0.09 2.12 -0.02 3.54 -0.04 -1.26 -4.78 135.00 134.47 1daa n PRO 121 Ca 0.05 -1.55 -0.01 0.00 -0.04 0.00 0.00 63.50 61.94 1daa n PRO 121 Cb 0.43 -2.53 0.26 0.00 -0.04 0.00 0.00 33.50 31.62 1daa n PRO 121 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1daa h LEU 122 N 8.85 0.54 -0.82 1.53 3.38 -2.00 -2.12 115.31 124.68 1daa h LEU 122 Ca 0.51 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 58.26 1daa h LEU 122 Cb 0.23 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1daa h LEU 122 CO 1.52 0.62 -0.21 -0.08 0.09 0.00 0.00 178.44 180.39 1daa h GLU 123 N 0.55 0.66 -0.16 1.13 4.81 -1.99 -1.95 114.58 117.62 1daa h GLU 123 Ca 0.11 -0.25 -0.20 0.00 -0.13 0.00 0.00 59.36 58.90 1daa h GLU 123 Cb 0.37 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1daa h GLU 123 CO 0.01 0.82 -0.69 -0.91 -0.73 0.00 0.00 179.01 177.51 1daa h ASN 124 N 0.58 0.77 0.30 1.04 4.21 -1.73 0.37 115.58 121.13 1daa h ASN 124 Ca 0.09 -0.47 -0.09 0.00 1.21 0.00 0.00 56.30 57.04 1daa h ASN 124 Cb 0.67 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.63 1daa h ASN 124 CO 0.05 1.24 -0.37 -0.07 -1.29 0.00 0.00 177.43 177.00 1daa h LEU 125 N 0.47 0.10 0.00 1.61 3.38 -1.32 0.12 115.31 119.67 1daa h LEU 125 Ca -0.03 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1daa h LEU 125 Cb 1.29 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1daa h LEU 125 CO 0.14 0.46 -0.02 -0.08 0.09 0.00 0.00 178.44 179.03 1daa h GLU 126 N 0.08 0.00 0.01 1.13 4.81 -1.25 -3.41 114.58 115.96 1daa h GLU 126 Ca 0.01 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.01 1daa h GLU 126 Cb 0.69 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.04 1daa h GLU 126 CO 0.05 0.00 -1.15 0.87 -0.73 0.00 0.00 179.01 178.05 1daa h LYS 127 N -0.99 0.02 0.00 1.92 1.79 -1.01 -3.46 116.57 114.84 1daa h LYS 127 Ca 0.00 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1daa h LYS 127 Cb 0.02 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.68 1daa h LYS 127 CO 0.00 0.92 0.00 0.41 -1.08 0.00 0.00 179.45 179.70 1daa n GLY 128 N 1.40 0.34 3.35 3.86 0.00 0.42 -4.71 105.19 109.84 1daa n GLY 128 Ca -0.04 -1.92 -0.18 0.00 0.00 0.00 0.00 46.02 43.89 1daa n GLY 128 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1daa s VAL 129 N -1.63 0.78 0.03 1.61 -7.23 0.51 -4.80 120.40 109.67 1daa s VAL 129 Ca 0.00 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.13 1daa s VAL 129 Cb 0.00 -2.60 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 1daa s VAL 129 CO 0.00 -0.07 0.24 -0.54 -0.31 0.00 0.00 175.10 174.41 1daa s LYS 130 N -3.97 3.50 0.25 4.82 1.02 -1.26 -0.52 119.74 123.57 1daa s LYS 130 Ca 0.35 -0.26 0.01 0.00 0.02 0.00 0.00 55.97 56.09 1daa s LYS 130 Cb 0.08 -3.05 -0.05 0.00 -0.52 0.00 0.00 37.83 34.29 1daa s LYS 130 CO 0.13 0.63 0.12 0.00 -0.92 0.00 0.00 175.35 175.30 1daa s ALA 131 N -1.40 1.59 0.00 5.17 0.00 -0.47 -1.32 121.76 125.33 1daa s ALA 131 Ca 0.31 -1.81 -0.03 0.00 0.00 0.00 0.00 51.96 50.44 1daa s ALA 131 Cb -0.13 1.17 -0.01 0.00 0.00 0.00 0.00 23.12 24.15 1daa s ALA 131 CO 0.21 -0.51 0.04 -0.08 0.00 0.00 0.00 175.76 175.42 1daa s THR 132 N -3.86 0.07 0.19 0.00 -1.32 -0.97 -2.25 115.64 107.51 1daa s THR 132 Ca 0.38 -0.62 -0.25 0.00 -1.21 0.00 0.00 61.69 60.00 1daa s THR 132 Cb 0.07 -0.26 -0.08 0.00 -1.51 0.00 0.00 72.50 70.72 1daa s THR 132 CO 0.14 -0.34 0.79 -0.36 -2.21 0.00 0.00 174.62 172.64 1daa s PHE 133 N -1.05 3.86 -0.01 9.09 0.08 -1.26 -0.94 117.98 127.76 1daa s PHE 133 Ca -0.12 1.63 -0.00 0.00 0.12 0.00 0.00 56.93 58.56 1daa s PHE 133 Cb -0.07 -2.77 0.01 0.00 -0.57 0.00 0.00 43.02 39.61 1daa s PHE 133 CO -0.00 0.47 0.01 0.08 -0.10 0.00 0.00 175.22 175.68 1daa s VAL 134 N -1.24 -0.01 0.25 -0.44 1.01 0.03 -4.89 120.40 115.11 1daa s VAL 134 Ca 0.38 0.04 -0.30 0.00 0.00 0.00 0.00 61.98 62.11 1daa s VAL 134 Cb -0.22 -0.03 -0.09 0.00 0.00 0.00 0.00 36.38 36.03 1daa s VAL 134 CO 0.26 0.02 1.27 -0.70 0.00 0.00 0.00 175.10 175.94 1daa s GLU 135 N 0.22 4.43 -0.55 2.72 2.56 -1.26 -1.43 118.70 125.39 1daa s GLU 135 Ca -0.02 2.05 -0.24 0.00 0.00 0.00 0.00 54.97 56.76 1daa s GLU 135 Cb -0.03 -3.16 0.04 0.00 2.00 0.00 0.00 34.13 32.98 1daa s GLU 135 CO -0.01 -0.14 0.94 0.34 -0.56 0.00 0.00 175.26 175.83 1daa s ASP 136 N -0.12 6.35 -0.16 -1.70 -1.08 0.40 -4.74 116.67 115.62 1daa s ASP 136 Ca 0.52 -0.33 0.16 0.00 -0.52 0.00 0.00 52.55 52.38 1daa s ASP 136 Cb -0.36 -2.44 0.66 0.00 -1.46 0.00 0.00 42.92 39.31 1daa s ASP 136 CO 0.43 -1.23 1.57 2.30 0.52 0.00 0.00 175.17 178.76 1daa n ILE 137 N 6.21 2.16 -1.79 4.11 -5.35 -1.26 -4.79 119.36 118.65 1daa n ILE 137 Ca 0.02 -1.44 -0.29 0.00 -0.27 0.00 0.00 62.75 60.77 1daa n ILE 137 Cb 0.47 -0.07 0.10 0.00 -1.74 0.00 0.00 39.64 38.41 1daa n ILE 137 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1daa s ARG 138 N -2.32 1.70 1.13 6.28 0.52 -1.26 -4.98 118.95 120.02 1daa s ARG 138 Ca 0.47 0.16 -0.16 0.00 -0.52 0.00 0.00 55.73 55.68 1daa s ARG 138 Cb 0.34 -1.92 0.25 0.00 0.52 0.00 0.00 34.95 34.14 1daa s ARG 138 CO 0.17 -1.79 1.09 1.67 0.02 0.00 0.00 175.30 176.46 1daa s TRP 139 N -3.49 1.16 -0.90 -0.53 1.48 -1.26 -4.96 118.94 110.43 1daa s TRP 139 Ca 0.63 0.72 0.11 0.00 -1.06 0.00 0.00 56.10 56.50 1daa s TRP 139 Cb -0.12 -3.34 0.54 0.00 -1.16 0.00 0.00 33.47 29.38 1daa s TRP 139 CO 0.50 -3.53 1.37 1.28 -4.06 0.00 0.00 176.95 172.50 1daa n LEU 140 N -4.57 3.85 -2.91 -4.66 4.77 -1.26 -4.21 117.00 108.01 1daa n LEU 140 Ca 0.09 -1.95 -0.25 0.00 -0.03 0.00 0.00 56.01 53.88 1daa n LEU 140 Cb 0.58 -0.55 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1daa n LEU 140 CO 0.51 0.56 0.08 0.54 -1.33 0.00 0.00 177.39 177.75 1daa n ARG 141 N 0.59 2.82 0.00 3.23 5.12 -1.26 -4.71 116.66 122.45 1daa n ARG 141 Ca 0.19 -4.52 0.08 0.00 -1.93 0.00 0.00 57.85 51.67 1daa n ARG 141 Cb 0.77 -2.12 0.41 0.00 -1.16 0.00 0.00 32.46 30.36 1daa n ARG 141 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1daa h ASP 143 N 0.00 0.00 -3.28 0.00 2.03 -1.50 -3.10 116.42 110.57 1daa h ASP 143 Ca 0.00 0.00 -0.58 0.00 -0.73 0.00 0.00 57.03 55.72 1daa h ASP 143 Cb 0.19 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 38.62 1daa h ASP 143 CO 0.00 0.00 -0.10 -0.63 -1.03 0.00 0.00 179.24 177.48 1daa s ILE 144 N -3.49 5.08 -1.17 4.15 1.01 -0.90 -4.73 121.20 121.15 1daa s ILE 144 Ca 0.03 1.04 -0.13 0.00 0.00 0.00 0.00 60.65 61.58 1daa s ILE 144 Cb 0.09 -3.84 0.18 0.00 0.01 0.00 0.00 42.46 38.90 1daa s ILE 144 CO 0.51 0.39 1.36 -0.75 0.00 0.00 0.00 174.94 176.45 1daa s LYS 145 N 0.14 4.07 0.51 2.79 2.20 -1.26 -5.00 119.74 123.19 1daa s LYS 145 Ca 0.27 -2.61 0.08 0.00 -0.36 0.00 0.00 55.97 53.35 1daa s LYS 145 Cb -0.16 -4.97 0.05 0.00 -1.51 0.00 0.00 37.83 31.23 1daa s LYS 145 CO 0.13 -1.69 0.70 -1.54 -0.36 0.00 0.00 175.35 172.60 1daa s SER 146 N 2.67 5.32 0.00 1.43 1.04 -1.26 -2.40 113.70 120.49 1daa s SER 146 Ca 0.40 -0.56 0.31 0.00 0.48 0.00 0.00 55.95 56.57 1daa s SER 146 Cb -0.04 -0.24 1.65 0.00 0.10 0.00 0.00 66.02 67.49 1daa s SER 146 CO -0.02 -1.10 2.10 0.18 0.98 0.00 0.00 173.24 175.38 1daa n LEU 147 N -2.11 0.19 -4.58 2.42 4.77 -0.59 -4.55 117.00 112.55 1daa n LEU 147 Ca 0.12 0.03 -0.40 0.00 -0.03 0.00 0.00 56.01 55.73 1daa n LEU 147 Cb 0.60 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1daa n LEU 147 CO 0.40 0.03 1.83 0.20 -1.33 0.00 0.00 177.39 178.53 1daa s ASN 148 N -2.21 6.49 -0.16 -1.43 0.02 -1.25 -4.71 114.94 111.69 1daa s ASN 148 Ca 0.40 -2.17 0.16 0.00 -1.02 0.00 0.00 52.86 50.23 1daa s ASN 148 Cb 0.21 -2.58 0.49 0.00 0.02 0.00 0.00 41.25 39.40 1daa s ASN 148 CO 0.40 -1.53 1.39 0.18 0.02 0.00 0.00 177.10 177.56 1daa n LEU 149 N 9.47 3.71 0.00 0.60 4.77 -1.26 -4.72 117.00 129.57 1daa n LEU 149 Ca 0.46 -2.91 -0.05 0.00 -0.03 0.00 0.00 56.01 53.48 1daa n LEU 149 Cb 0.47 -0.50 0.16 0.00 -2.33 0.00 0.00 43.42 41.21 1daa n LEU 149 CO 0.74 0.68 0.68 0.25 -1.33 0.00 0.00 177.39 178.41 1daa h LEU 150 N 1.73 0.53 -1.16 2.23 5.85 -1.99 -0.61 115.31 121.89 1daa h LEU 150 Ca 0.00 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.52 1daa h LEU 150 Cb 1.35 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.19 1daa h LEU 150 CO 0.19 0.81 0.53 1.23 -0.34 0.00 0.00 178.44 180.86 1daa h GLY 151 N 1.05 1.17 1.78 3.75 0.00 -1.94 -2.50 103.07 106.38 1daa h GLY 151 Ca 0.06 -0.45 -0.21 0.00 0.00 0.00 0.00 47.33 46.72 1daa h GLY 151 CO 0.06 0.44 -0.96 0.00 0.00 0.00 0.00 176.54 176.08 1daa h ALA 152 N 1.46 0.42 -0.38 3.60 0.00 -1.78 -2.68 119.26 119.89 1daa h ALA 152 Ca 0.30 -0.78 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 1daa h ALA 152 Cb -0.10 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1daa h ALA 152 CO -0.06 0.97 0.23 0.28 0.00 0.00 0.00 179.25 180.67 1daa h VAL 153 N 0.09 1.13 -0.33 0.00 2.07 -0.90 -1.57 116.25 116.74 1daa h VAL 153 Ca -0.06 -0.29 -0.16 0.00 0.82 0.00 0.00 66.70 67.01 1daa h VAL 153 Cb 1.63 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 1daa h VAL 153 CO 0.15 0.13 -0.42 -0.07 0.02 0.00 0.00 177.57 177.37 1daa h LEU 154 N 0.50 0.88 -0.35 2.57 3.38 -1.47 -2.30 115.31 118.51 1daa h LEU 154 Ca 0.14 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 1daa h LEU 154 Cb 0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1daa h LEU 154 CO -0.03 1.18 0.02 0.00 0.09 0.00 0.00 178.44 179.70 1daa h ALA 155 N 0.86 0.47 -0.31 1.53 0.00 -1.45 -2.30 119.26 118.06 1daa h ALA 155 Ca 0.05 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1daa h ALA 155 Cb 0.99 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1daa h ALA 155 CO 0.10 0.22 -0.13 -0.22 0.00 0.00 0.00 179.25 179.22 1daa h LYS 156 N 0.43 0.54 -0.61 0.00 3.64 -1.28 -2.18 116.57 117.11 1daa h LYS 156 Ca 0.10 -0.16 -0.09 0.00 -1.27 0.00 0.00 60.65 59.23 1daa h LYS 156 Cb 0.43 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1daa h LYS 156 CO 0.01 0.66 0.01 0.37 -2.27 0.00 0.00 179.45 178.24 1daa h GLN 157 N 0.50 1.06 -0.41 1.90 5.75 -1.32 -0.83 115.11 121.76 1daa h GLN 157 Ca 0.09 -0.32 0.02 0.00 -0.15 0.00 0.00 58.65 58.28 1daa h GLN 157 Cb 0.52 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.94 1daa h GLN 157 CO 0.03 1.02 0.24 1.49 -2.65 0.00 0.00 178.83 178.96 1daa h GLU 158 N 0.97 0.47 -0.19 1.69 4.81 -1.16 -0.73 114.58 120.44 1daa h GLU 158 Ca 0.18 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.40 1daa h GLU 158 Cb 0.54 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 1daa h GLU 158 CO 0.03 0.31 0.05 0.00 -0.73 0.00 0.00 179.01 178.66 1daa h ALA 159 N 1.18 0.20 -0.16 2.92 0.00 -1.18 -2.63 119.26 119.59 1daa h ALA 159 Ca 0.16 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1daa h ALA 159 Cb 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1daa h ALA 159 CO -0.08 -0.39 -0.15 1.25 0.00 0.00 0.00 179.25 179.89 1daa h HIS 160 N 0.13 0.27 0.00 0.00 -0.00 -0.73 -0.28 115.15 114.53 1daa h HIS 160 Ca 0.08 -0.03 -0.07 0.00 -0.00 0.00 0.00 60.37 60.36 1daa h HIS 160 Cb 0.07 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.40 1daa h HIS 160 CO -0.13 0.40 -0.31 0.93 -0.00 0.00 0.00 177.93 178.82 1daa h GLU 161 N 0.24 0.00 -0.47 5.26 5.08 -0.93 -2.82 114.58 120.94 1daa h GLU 161 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1daa h GLU 161 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1daa h GLU 161 CO 0.02 0.31 0.00 1.63 -1.00 0.00 0.00 179.01 179.97 1daa n LYS 162 N -3.67 2.13 -1.18 2.33 5.02 -0.36 -4.90 118.16 117.52 1daa n LYS 162 Ca -0.01 -1.51 -0.06 0.00 -2.02 0.00 0.00 58.31 54.71 1daa n LYS 162 Cb 0.42 -1.41 -0.03 0.00 -0.02 0.00 0.00 35.03 33.99 1daa n LYS 162 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1daa n GLY 163 N 1.03 0.84 3.92 0.72 0.00 -1.06 -5.03 105.19 105.61 1daa n GLY 163 Ca 0.14 -0.54 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 1daa n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1daa h TYR 165 N 1.93 0.28 -3.55 0.00 3.20 -1.48 -3.31 116.97 114.05 1daa h TYR 165 Ca -0.48 -0.21 -0.13 0.00 3.14 0.00 0.00 58.73 61.05 1daa h TYR 165 Cb 1.19 -0.01 -0.19 0.00 1.54 0.00 0.00 36.73 39.26 1daa h TYR 165 CO 0.56 1.20 -0.47 -2.00 -1.64 0.00 0.00 178.16 175.80 1daa s GLU 166 N -2.65 0.55 -0.24 1.82 2.56 -1.24 -4.92 118.70 114.58 1daa s GLU 166 Ca -0.04 -0.50 -0.10 0.00 0.00 0.00 0.00 54.97 54.33 1daa s GLU 166 Cb 0.08 0.23 -0.04 0.00 2.00 0.00 0.00 34.13 36.39 1daa s GLU 166 CO 0.85 -0.14 0.14 0.00 -0.56 0.00 0.00 175.26 175.55 1daa s ALA 167 N -1.83 3.47 -0.26 6.30 0.00 -1.26 -2.29 121.76 125.88 1daa s ALA 167 Ca -0.11 -0.97 -0.14 0.00 0.00 0.00 0.00 51.96 50.73 1daa s ALA 167 Cb -0.05 -2.26 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 1daa s ALA 167 CO -0.00 -0.30 0.32 0.42 0.00 0.00 0.00 175.76 176.20 1daa s ILE 168 N 1.27 5.22 0.30 0.00 1.01 -0.11 -1.51 121.20 127.37 1daa s ILE 168 Ca 0.06 0.48 -0.07 0.00 0.00 0.00 0.00 60.65 61.12 1daa s ILE 168 Cb -0.14 -3.65 -0.06 0.00 0.01 0.00 0.00 42.46 38.61 1daa s ILE 168 CO 0.06 0.20 0.59 -0.76 0.00 0.00 0.00 174.94 175.03 1daa s LEU 169 N 1.88 4.04 -0.08 2.97 1.43 -0.07 -0.79 118.68 128.05 1daa s LEU 169 Ca 0.13 0.85 -0.14 0.00 -1.03 0.00 0.00 54.13 53.94 1daa s LEU 169 Cb -0.16 -3.66 0.03 0.00 0.03 0.00 0.00 46.19 42.43 1daa s LEU 169 CO 0.10 -0.20 0.34 -1.38 0.23 0.00 0.00 176.35 175.43 1daa s HIS 170 N -2.07 -0.31 -0.34 0.29 -3.43 -0.51 -1.79 115.29 107.12 1daa s HIS 170 Ca 0.46 0.67 -0.09 0.00 -0.80 0.00 0.00 55.06 55.31 1daa s HIS 170 Cb -0.11 0.12 0.02 0.00 -1.43 0.00 0.00 32.58 31.18 1daa s HIS 170 CO 0.28 -0.28 0.15 1.03 -2.00 0.00 0.00 174.74 173.92 1daa s ARG 171 N -0.45 2.93 -1.45 -0.38 0.52 -0.20 -0.45 118.95 119.47 1daa s ARG 171 Ca -0.06 -0.99 -0.00 0.00 -0.52 0.00 0.00 55.73 54.17 1daa s ARG 171 Cb -0.04 -3.57 0.00 0.00 0.52 0.00 0.00 34.95 31.86 1daa s ARG 171 CO 0.02 -0.59 0.29 0.09 0.02 0.00 0.00 175.30 175.14 1daa n ASN 172 N 4.93 0.08 0.00 0.23 5.03 -1.26 -1.50 115.26 122.77 1daa n ASN 172 Ca -0.13 -1.09 0.00 0.00 0.87 0.00 0.00 54.58 54.23 1daa n ASN 172 Cb 0.47 -2.63 0.00 0.00 -1.02 0.00 0.00 39.78 36.60 1daa n ASN 172 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1daa n ASN 173 N -2.96 -3.39 -4.59 6.41 4.13 -1.26 -5.00 115.26 108.60 1daa n ASN 173 Ca -0.32 0.00 -0.40 0.00 1.68 0.00 0.00 54.58 55.54 1daa n ASN 173 Cb 0.69 -1.91 -0.08 0.00 -1.54 0.00 0.00 39.78 36.94 1daa n ASN 173 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1daa s THR 174 N -1.71 5.08 0.24 3.41 2.01 -0.56 -1.93 115.64 122.19 1daa s THR 174 Ca 0.00 0.54 -0.31 0.00 0.31 0.00 0.00 61.69 62.23 1daa s THR 174 Cb 0.00 -3.84 -0.11 0.00 0.01 0.00 0.00 72.50 68.56 1daa s THR 174 CO 0.00 -0.02 1.61 -0.69 -0.69 0.00 0.00 174.62 174.83 1daa s VAL 175 N 2.26 2.21 0.00 3.82 1.01 -0.44 -1.03 120.40 128.23 1daa s VAL 175 Ca 0.18 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1daa s VAL 175 Cb -0.16 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1daa s VAL 175 CO 0.11 0.02 0.00 0.35 0.00 0.00 0.00 175.10 175.58 1daa n THR 176 N 3.03 0.00 -3.80 3.92 -2.24 -0.74 -4.60 114.28 109.86 1daa n THR 176 Ca 0.11 0.18 -0.09 0.00 -2.27 0.00 0.00 64.05 61.98 1daa n THR 176 Cb 0.37 -1.11 -0.01 0.00 -2.10 0.00 0.00 70.33 67.49 1daa n THR 176 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1daa n GLU 177 N -2.04 0.65 -2.41 -0.78 0.28 -1.25 -4.59 120.64 110.50 1daa n GLU 177 Ca 0.00 -1.93 -0.24 0.00 -0.16 0.00 0.00 57.16 54.83 1daa n GLU 177 Cb 0.00 2.04 0.07 0.00 1.43 0.00 0.00 31.44 34.99 1daa n GLU 177 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1daa s GLY 178 N -2.60 1.76 0.50 -1.84 0.00 0.23 -0.89 107.32 104.48 1daa s GLY 178 Ca 0.18 -1.26 0.24 0.00 0.00 0.00 0.00 44.72 43.88 1daa s GLY 178 CO 0.13 -0.83 2.06 1.48 0.00 0.00 0.00 173.10 175.94 1daa h SER 179 N -0.43 0.00 -0.14 1.64 4.64 -1.63 -3.24 113.55 114.39 1daa h SER 179 Ca -0.42 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.71 1daa h SER 179 Cb 1.29 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.05 1daa h SER 179 CO 0.52 0.14 -0.89 -1.54 -0.87 0.00 0.00 176.83 174.18 1daa n SER 180 N -3.83 0.68 -3.78 4.97 3.41 -1.26 -4.86 113.62 108.96 1daa n SER 180 Ca -0.02 -2.03 -0.09 0.00 -0.26 0.00 0.00 58.87 56.47 1daa n SER 180 Cb 0.24 -0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 63.97 1daa n SER 180 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1daa s SER 181 N -2.36 -0.26 0.22 4.04 1.04 -1.22 -4.76 113.70 110.40 1daa s SER 181 Ca 0.25 -0.53 -0.00 0.00 0.48 0.00 0.00 55.95 56.14 1daa s SER 181 Cb 0.32 0.62 -0.04 0.00 0.10 0.00 0.00 66.02 67.02 1daa s SER 181 CO -0.10 -1.13 0.41 0.20 0.98 0.00 0.00 173.24 173.60 1daa s ASN 182 N -2.89 6.38 -0.08 7.02 0.01 -0.59 -0.60 114.94 124.18 1daa s ASN 182 Ca 0.11 0.40 0.05 0.00 -0.71 0.00 0.00 52.86 52.71 1daa s ASN 182 Cb -0.02 -2.01 -0.00 0.00 0.41 0.00 0.00 41.25 39.62 1daa s ASN 182 CO 0.00 -0.08 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.59 1daa s VAL 183 N -1.93 1.97 0.05 1.60 1.01 -1.26 -1.46 120.40 120.38 1daa s VAL 183 Ca 0.39 -0.99 0.08 0.00 0.00 0.00 0.00 61.98 61.46 1daa s VAL 183 Cb -0.11 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 1daa s VAL 183 CO 0.30 0.54 -0.23 -0.36 0.00 0.00 0.00 175.10 175.35 1daa s PHE 184 N 0.13 2.05 0.04 5.22 0.40 -0.52 -4.46 117.98 120.85 1daa s PHE 184 Ca -0.12 -0.39 0.06 0.00 -0.60 0.00 0.00 56.93 55.89 1daa s PHE 184 Cb -0.16 -1.22 -0.02 0.00 0.51 0.00 0.00 43.02 42.13 1daa s PHE 184 CO 0.06 0.12 -0.19 0.20 0.70 0.00 0.00 175.22 176.11 1daa s GLY 185 N -1.24 1.00 -0.13 4.36 0.00 -0.69 -2.23 107.32 108.39 1daa s GLY 185 Ca 0.10 -0.97 0.01 0.00 0.00 0.00 0.00 44.72 43.86 1daa s GLY 185 CO 0.02 -0.91 -0.17 -0.42 0.00 0.00 0.00 173.10 171.63 1daa s ILE 186 N -0.79 2.67 -0.11 0.90 1.01 0.14 -0.96 121.20 124.06 1daa s ILE 186 Ca 0.06 -0.79 -0.04 0.00 0.00 0.00 0.00 60.65 59.88 1daa s ILE 186 Cb -0.08 -2.10 0.05 0.00 0.01 0.00 0.00 42.46 40.34 1daa s ILE 186 CO 0.01 0.53 0.10 -0.75 0.00 0.00 0.00 174.94 174.84 1daa s LYS 187 N 0.47 0.01 -1.34 2.79 2.47 -0.83 -0.79 119.74 122.53 1daa s LYS 187 Ca -0.12 0.20 -0.05 0.00 -1.56 0.00 0.00 55.97 54.44 1daa s LYS 187 Cb -0.16 -1.07 0.02 0.00 -1.46 0.00 0.00 37.83 35.15 1daa s LYS 187 CO 0.05 -0.49 0.98 -0.25 0.16 0.00 0.00 175.35 175.80 1daa n ASP 188 N 5.30 -3.64 0.00 1.43 8.00 -1.26 -2.50 116.55 123.88 1daa n ASP 188 Ca -0.05 -0.67 0.00 0.00 0.71 0.00 0.00 54.79 54.78 1daa n ASP 188 Cb 0.50 -4.61 0.00 0.00 -0.02 0.00 0.00 41.12 36.98 1daa n ASP 188 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1daa n GLY 189 N -1.60 0.82 3.77 0.44 0.00 -1.26 -5.01 105.19 102.35 1daa n GLY 189 Ca -0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 1daa n GLY 189 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1daa s ILE 190 N -3.37 4.96 -0.16 -0.61 1.01 -1.04 -4.24 121.20 117.75 1daa s ILE 190 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 60.65 60.47 1daa s ILE 190 Cb 0.00 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.29 1daa s ILE 190 CO 0.00 0.59 0.49 -0.22 0.00 0.00 0.00 174.94 175.80 1daa s LEU 191 N -0.74 4.21 0.03 2.97 2.96 0.17 -1.96 118.68 126.32 1daa s LEU 191 Ca 0.12 0.73 0.08 0.00 -0.22 0.00 0.00 54.13 54.85 1daa s LEU 191 Cb -0.12 -2.69 -0.03 0.00 0.50 0.00 0.00 46.19 43.86 1daa s LEU 191 CO 0.03 -0.08 -0.25 -0.31 -1.32 0.00 0.00 176.35 174.42 1daa s TYR 192 N 1.12 2.38 0.06 5.38 1.51 -0.13 -0.74 117.35 126.92 1daa s TYR 192 Ca 0.25 -0.38 -0.27 0.00 -1.01 0.00 0.00 57.07 55.66 1daa s TYR 192 Cb -0.15 -1.43 0.08 0.00 -0.11 0.00 0.00 41.96 40.34 1daa s TYR 192 CO 0.10 0.12 0.68 -0.08 -1.11 0.00 0.00 175.55 175.25 1daa s THR 193 N -0.79 0.00 0.36 -0.71 -1.32 -1.07 -1.70 115.64 110.41 1daa s THR 193 Ca 0.12 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 60.33 1daa s THR 193 Cb -0.10 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.80 1daa s THR 193 CO 0.02 0.00 1.21 -2.28 -2.21 0.00 0.00 174.62 171.36 1daa s HIS 194 N -2.72 3.13 0.53 9.09 2.46 -1.26 -2.17 115.29 124.35 1daa s HIS 194 Ca -0.03 1.52 -0.21 0.00 0.47 0.00 0.00 55.06 56.82 1daa s HIS 194 Cb -0.01 -3.49 -0.05 0.00 -0.13 0.00 0.00 32.58 28.90 1daa s HIS 194 CO -0.04 -1.42 1.22 -1.25 -2.47 0.00 0.00 174.74 170.78 1daa s PRO 195 N -1.97 3.31 -1.09 2.88 0.04 -1.26 -4.88 135.00 132.03 1daa s PRO 195 Ca 0.52 1.89 -0.22 0.00 0.04 0.00 0.00 61.00 63.23 1daa s PRO 195 Cb -0.34 -2.18 0.05 0.00 0.04 0.00 0.00 34.50 32.07 1daa s PRO 195 CO 0.45 -0.95 1.53 0.00 0.04 0.00 0.00 177.00 178.06 1daa s ALA 196 N -1.52 2.84 0.00 8.56 0.00 -1.26 -4.73 121.76 125.65 1daa s ALA 196 Ca 0.71 -2.41 0.00 0.00 0.00 0.00 0.00 51.96 50.26 1daa s ALA 196 Cb -0.32 -4.56 0.00 0.00 0.00 0.00 0.00 23.12 18.24 1daa s ALA 196 CO 0.37 -3.56 0.00 0.27 0.00 0.00 0.00 175.76 172.83 1daa n ASN 197 N 8.85 1.51 0.00 0.00 2.04 -1.26 -5.01 115.26 121.39 1daa n ASN 197 Ca 0.37 0.00 0.07 0.00 -0.44 0.00 0.00 54.58 54.58 1daa n ASN 197 Cb 0.50 0.00 0.32 0.00 -2.53 0.00 0.00 39.78 38.07 1daa n ASN 197 CO 0.00 0.00 0.00 -0.46 -0.44 0.00 0.00 177.26 176.36 1daa n ASN 198 N 0.00 0.00 0.19 0.53 6.94 -1.26 -2.77 115.26 118.88 1daa n ASN 198 Ca 0.00 0.47 0.13 0.00 -0.02 0.00 0.00 54.58 55.16 1daa n ASN 198 Cb 0.00 -0.49 0.32 0.00 -2.36 0.00 0.00 39.78 37.25 1daa n ASN 198 CO 0.00 0.00 0.00 0.24 -1.03 0.00 0.00 177.26 176.47 1daa h MET 199 N 0.00 0.00 -4.71 -3.83 2.86 -1.91 0.10 114.93 107.45 1daa h MET 199 Ca 0.00 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.36 1daa h MET 199 Cb 0.25 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 31.76 1daa h MET 199 CO 0.00 0.00 -0.63 0.96 1.06 0.00 0.00 176.91 178.30 1daa s ILE 200 N -3.24 0.36 -0.00 -1.22 -4.36 -1.12 -4.79 121.20 106.83 1daa s ILE 200 Ca 0.07 -1.98 -0.22 0.00 -0.26 0.00 0.00 60.65 58.26 1daa s ILE 200 Cb 0.08 -2.37 -0.05 0.00 1.25 0.00 0.00 42.46 41.37 1daa s ILE 200 CO 0.62 -0.20 0.65 -0.22 0.24 0.00 0.00 174.94 176.03 1daa s LEU 201 N -3.19 4.41 -1.08 0.37 2.96 -1.17 -3.10 118.68 117.88 1daa s LEU 201 Ca 0.32 1.24 -0.21 0.00 -0.22 0.00 0.00 54.13 55.26 1daa s LEU 201 Cb 0.07 -3.03 0.07 0.00 0.50 0.00 0.00 46.19 43.81 1daa s LEU 201 CO 0.09 0.05 1.47 -0.75 -1.32 0.00 0.00 176.35 175.89 1daa s LYS 202 N -0.01 3.71 0.44 1.98 2.20 -1.26 -4.95 119.74 121.85 1daa s LYS 202 Ca 0.34 -1.47 -0.25 0.00 -0.36 0.00 0.00 55.97 54.23 1daa s LYS 202 Cb -0.19 -5.33 -0.08 0.00 -1.51 0.00 0.00 37.83 30.72 1daa s LYS 202 CO 0.19 -2.15 1.37 0.20 -0.36 0.00 0.00 175.35 174.60 1daa s GLY 203 N 4.54 2.92 0.13 5.54 0.00 -1.26 -4.95 107.32 114.24 1daa s GLY 203 Ca 0.46 1.35 -0.08 0.00 0.00 0.00 0.00 44.72 46.45 1daa s GLY 203 CO -0.05 1.95 1.35 -2.22 0.00 0.00 0.00 173.10 174.13 1daa h ILE 204 N 2.32 1.32 -0.81 0.90 2.04 -1.98 -2.24 117.51 119.04 1daa h ILE 204 Ca -0.50 -2.04 -0.04 0.00 1.00 0.00 0.00 64.86 63.28 1daa h ILE 204 Cb 1.26 2.04 -0.04 0.00 -0.74 0.00 0.00 36.82 39.34 1daa h ILE 204 CO 0.61 0.63 0.36 0.74 0.00 0.00 0.00 178.15 180.50 1daa h THR 205 N 0.44 1.26 -0.59 -0.27 2.02 -1.92 -1.19 112.91 112.65 1daa h THR 205 Ca -0.05 -0.77 0.11 0.00 0.77 0.00 0.00 66.41 66.48 1daa h THR 205 Cb 1.38 0.25 -0.08 0.00 -1.74 0.00 0.00 68.15 67.95 1daa h THR 205 CO 0.15 0.32 0.14 -0.09 0.37 0.00 0.00 175.52 176.41 1daa h ARG 206 N 1.17 0.28 0.00 6.66 2.43 -1.87 0.28 114.38 123.32 1daa h ARG 206 Ca 0.28 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.29 1daa h ARG 206 Cb 0.16 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1daa h ARG 206 CO -0.03 0.18 -0.67 -0.44 -1.51 0.00 0.00 179.97 177.50 1daa h ASP 207 N 0.28 0.00 -0.50 -3.80 3.32 -0.93 -1.51 116.42 113.28 1daa h ASP 207 Ca 0.31 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.25 1daa h ASP 207 Cb 0.44 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1daa h ASP 207 CO -0.38 0.67 -0.09 0.58 -1.72 0.00 0.00 179.24 178.31 1daa h VAL 208 N 0.00 1.27 -0.32 -1.35 2.07 -0.42 -1.84 116.25 115.65 1daa h VAL 208 Ca -0.01 -1.23 -0.16 0.00 0.82 0.00 0.00 66.70 66.13 1daa h VAL 208 Cb 1.34 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 32.06 1daa h VAL 208 CO 0.09 0.43 -0.42 0.58 0.02 0.00 0.00 177.57 178.27 1daa h VAL 209 N 0.87 1.28 -0.45 2.57 2.07 -0.79 -0.14 116.25 121.66 1daa h VAL 209 Ca 0.14 -1.60 -0.08 0.00 0.82 0.00 0.00 66.70 65.97 1daa h VAL 209 Cb 0.64 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1daa h VAL 209 CO 0.04 0.52 -0.07 0.40 0.02 0.00 0.00 177.57 178.49 1daa h ILE 210 N 0.65 1.25 -0.01 4.57 2.04 -1.10 -0.63 117.51 124.29 1daa h ILE 210 Ca 0.05 -1.10 -0.00 0.00 1.00 0.00 0.00 64.86 64.81 1daa h ILE 210 Cb 0.99 0.98 -0.00 0.00 -0.74 0.00 0.00 36.82 38.05 1daa h ILE 210 CO 0.09 0.38 0.00 0.00 0.00 0.00 0.00 178.15 178.63 1daa h ALA 211 N 1.21 0.01 -0.97 1.87 0.00 -1.08 -1.91 119.26 118.38 1daa h ALA 211 Ca 0.13 -0.07 0.15 0.00 0.00 0.00 0.00 54.91 55.12 1daa h ALA 211 Cb 0.53 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.24 1daa h ALA 211 CO 0.03 -0.43 0.61 0.00 0.00 0.00 0.00 179.25 179.47 1daa h ALA 213 N 1.58 0.52 0.00 0.00 0.00 -0.94 -1.57 119.26 118.85 1daa h ALA 213 Ca 0.50 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1daa h ALA 213 Cb 0.67 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1daa h ALA 213 CO -0.27 0.34 -0.11 -0.91 0.00 0.00 0.00 179.25 178.30 1daa h ASN 214 N 0.51 0.00 0.90 0.00 -0.26 -0.48 -0.34 115.58 115.91 1daa h ASN 214 Ca 0.10 0.00 -0.16 0.00 -0.56 0.00 0.00 56.30 55.68 1daa h ASN 214 Cb 0.55 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.78 1daa h ASN 214 CO 0.03 0.11 -0.78 -0.33 -1.06 0.00 0.00 177.43 175.39 1daa h GLU 215 N 0.00 0.00 -0.56 0.81 5.08 -0.46 -3.07 114.58 116.39 1daa h GLU 215 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1daa h GLU 215 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1daa h GLU 215 CO 0.01 0.78 0.00 0.44 -1.00 0.00 0.00 179.01 179.25 1daa n ILE 216 N -3.51 0.74 -3.49 3.13 -5.35 -0.66 -4.96 119.36 105.26 1daa n ILE 216 Ca -0.00 -0.80 -0.20 0.00 -0.27 0.00 0.00 62.75 61.48 1daa n ILE 216 Cb 0.78 0.53 0.06 0.00 -1.74 0.00 0.00 39.64 39.27 1daa n ILE 216 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1daa n ASN 217 N 1.32 -3.76 -4.48 7.28 4.05 -0.67 -5.03 115.26 113.98 1daa n ASN 217 Ca 0.21 -0.77 -0.34 0.00 0.45 0.00 0.00 54.58 54.12 1daa n ASN 217 Cb 0.54 -4.57 -0.12 0.00 1.23 0.00 0.00 39.78 36.86 1daa n ASN 217 CO 0.00 0.00 0.00 -0.32 -3.05 0.00 0.00 177.26 173.89 1daa s MET 218 N -5.33 3.67 0.27 1.20 1.75 -0.23 -5.03 119.30 115.60 1daa s MET 218 Ca 0.22 -0.51 -0.29 0.00 -1.25 0.00 0.00 55.69 53.86 1daa s MET 218 Cb -0.05 -3.03 -0.10 0.00 2.84 0.00 0.00 34.83 34.50 1daa s MET 218 CO 0.78 0.12 1.32 -2.14 -0.65 0.00 0.00 175.02 174.45 1daa s PRO 219 N 0.70 4.37 -0.11 4.11 0.02 -1.26 -4.20 135.00 138.63 1daa s PRO 219 Ca -0.01 2.15 0.03 0.00 0.02 0.00 0.00 61.00 63.20 1daa s PRO 219 Cb -0.14 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.26 1daa s PRO 219 CO 0.02 -0.22 -0.23 0.08 -0.33 0.00 0.00 177.00 176.32 1daa s VAL 220 N -0.54 2.03 -0.16 3.83 1.01 -1.26 -0.66 120.40 124.65 1daa s VAL 220 Ca 0.53 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1daa s VAL 220 Cb -0.38 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.25 1daa s VAL 220 CO 0.46 0.55 -0.13 -0.54 0.00 0.00 0.00 175.10 175.44 1daa s LYS 221 N 0.50 2.20 -1.19 2.72 1.02 0.08 -4.97 119.74 120.11 1daa s LYS 221 Ca -0.15 -0.65 -0.10 0.00 0.02 0.00 0.00 55.97 55.09 1daa s LYS 221 Cb -0.17 -2.20 0.21 0.00 -0.52 0.00 0.00 37.83 35.15 1daa s LYS 221 CO 0.05 -0.30 1.46 0.39 -0.92 0.00 0.00 175.35 176.03 1daa n GLU 222 N 4.75 3.60 -4.33 1.68 1.02 -1.26 -2.61 120.64 123.50 1daa n GLU 222 Ca -0.16 -4.02 -0.19 0.00 -0.02 0.00 0.00 57.16 52.77 1daa n GLU 222 Cb 0.49 -2.83 -0.15 0.00 -0.02 0.00 0.00 31.44 28.93 1daa n GLU 222 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1daa s ILE 223 N 0.09 0.67 0.46 -3.67 -4.36 -0.92 -4.34 121.20 109.13 1daa s ILE 223 Ca 0.38 -0.33 -0.22 0.00 -0.26 0.00 0.00 60.65 60.22 1daa s ILE 223 Cb -0.01 -0.59 -0.07 0.00 1.25 0.00 0.00 42.46 43.04 1daa s ILE 223 CO -0.00 0.20 1.13 -2.16 0.24 0.00 0.00 174.94 174.35 1daa s PRO 224 N 0.02 3.77 0.29 0.37 0.04 -1.26 -4.05 135.00 134.18 1daa s PRO 224 Ca -0.00 1.68 0.11 0.00 0.04 0.00 0.00 61.00 62.83 1daa s PRO 224 Cb -0.06 -2.34 -0.05 0.00 0.04 0.00 0.00 34.50 32.09 1daa s PRO 224 CO -0.00 -0.52 -0.15 -0.59 0.04 0.00 0.00 177.00 175.78 1daa s PHE 225 N -1.63 2.38 0.64 0.56 -0.71 -1.26 -5.03 117.98 112.93 1daa s PHE 225 Ca 0.64 -0.35 -0.00 0.00 -1.04 0.00 0.00 56.93 56.18 1daa s PHE 225 Cb -0.26 -1.10 0.08 0.00 -1.21 0.00 0.00 43.02 40.53 1daa s PHE 225 CO 0.31 0.67 0.90 0.95 -1.34 0.00 0.00 175.22 176.71 1daa s THR 226 N -2.50 2.38 0.28 -4.49 -4.23 -1.26 -1.32 115.64 104.49 1daa s THR 226 Ca 0.31 -0.60 -0.02 0.00 -1.18 0.00 0.00 61.69 60.20 1daa s THR 226 Cb -0.04 -2.78 0.17 0.00 1.34 0.00 0.00 72.50 71.19 1daa s THR 226 CO 0.16 0.00 1.84 0.71 -0.54 0.00 0.00 174.62 176.79 1daa h THR 227 N -0.26 1.23 -0.61 3.99 1.35 -1.75 -0.31 112.91 116.54 1daa h THR 227 Ca -0.39 -0.77 -0.06 0.00 -0.55 0.00 0.00 66.41 64.64 1daa h THR 227 Cb 1.28 0.57 -0.03 0.00 -1.73 0.00 0.00 68.15 68.25 1daa h THR 227 CO 0.47 0.30 0.16 0.45 -0.25 0.00 0.00 175.52 176.65 1daa h HIS 228 N 0.87 1.02 -0.02 4.73 3.86 -1.94 -2.61 115.15 121.05 1daa h HIS 228 Ca 0.20 -0.12 -0.16 0.00 -1.16 0.00 0.00 60.37 59.13 1daa h HIS 228 Cb 0.24 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.41 1daa h HIS 228 CO 0.02 0.85 -0.70 0.93 0.86 0.00 0.00 177.93 179.89 1daa h GLU 229 N 0.89 0.13 -0.93 2.45 5.08 -1.85 -3.03 114.58 117.31 1daa h GLU 229 Ca 0.19 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1daa h GLU 229 Cb 0.34 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.57 1daa h GLU 229 CO 0.00 0.78 0.59 0.00 -1.00 0.00 0.00 179.01 179.38 1daa h ALA 230 N 1.19 1.29 0.00 3.43 0.00 -0.84 -1.22 119.26 123.11 1daa h ALA 230 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1daa h ALA 230 Cb 1.24 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1daa h ALA 230 CO 0.10 0.63 0.00 -0.07 0.00 0.00 0.00 179.25 179.91 1daa h LEU 231 N 1.27 0.00 -0.48 0.00 3.38 -1.35 -2.91 115.31 115.21 1daa h LEU 231 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1daa h LEU 231 Cb -0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1daa h LEU 231 CO -0.07 0.00 -0.33 0.29 0.09 0.00 0.00 178.44 178.42 1daa n LYS 232 N -3.02 0.76 -1.11 1.13 5.02 -0.49 -4.79 118.16 115.66 1daa n LYS 232 Ca 0.01 -0.48 -0.32 0.00 -2.02 0.00 0.00 58.31 55.50 1daa n LYS 232 Cb 0.34 -1.49 0.12 0.00 -0.02 0.00 0.00 35.03 33.98 1daa n LYS 232 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1daa s MET 233 N -2.57 1.70 0.08 1.97 -1.94 -1.06 -4.97 119.30 112.52 1daa s MET 233 Ca 0.22 1.59 -0.06 0.00 -1.71 0.00 0.00 55.69 55.73 1daa s MET 233 Cb 0.19 -1.80 -0.26 0.00 2.01 0.00 0.00 34.83 34.97 1daa s MET 233 CO 0.56 -2.13 1.16 -0.44 -0.01 0.00 0.00 175.02 174.15 1daa h ASP 234 N -1.06 0.49 -5.10 3.03 3.32 -1.31 -3.38 116.42 112.41 1daa h ASP 234 Ca -0.45 -0.50 -0.12 0.00 0.02 0.00 0.00 57.03 55.98 1daa h ASP 234 Cb 1.27 -0.16 -0.17 0.00 0.22 0.00 0.00 39.33 40.50 1daa h ASP 234 CO 0.47 1.37 -0.52 -1.61 -1.72 0.00 0.00 179.24 177.23 1daa s GLU 235 N -2.77 0.62 -0.09 3.56 2.02 -0.95 -4.53 118.70 116.57 1daa s GLU 235 Ca -0.05 -0.80 -0.12 0.00 0.02 0.00 0.00 54.97 54.02 1daa s GLU 235 Cb 0.07 0.24 0.03 0.00 0.10 0.00 0.00 34.13 34.57 1daa s GLU 235 CO 0.89 -0.16 0.31 -1.17 0.02 0.00 0.00 175.26 175.15 1daa s LEU 236 N -2.24 0.81 0.19 1.80 1.98 -1.26 -0.68 118.68 119.27 1daa s LEU 236 Ca -0.03 0.47 -0.18 0.00 -2.89 0.00 0.00 54.13 51.50 1daa s LEU 236 Cb 0.00 1.14 0.03 0.00 0.66 0.00 0.00 46.19 48.02 1daa s LEU 236 CO -0.05 -0.21 0.52 0.72 -1.89 0.00 0.00 176.35 175.44 1daa s PHE 237 N -0.27 -0.15 0.17 5.38 -0.12 -0.95 -0.81 117.98 121.22 1daa s PHE 237 Ca -0.04 -0.18 0.11 0.00 -0.05 0.00 0.00 56.93 56.77 1daa s PHE 237 Cb -0.03 0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 42.71 1daa s PHE 237 CO 0.01 -0.90 -0.22 0.14 -0.05 0.00 0.00 175.22 174.21 1daa s VAL 238 N -3.86 2.51 -0.00 -2.49 -7.23 -0.81 -1.44 120.40 107.08 1daa s VAL 238 Ca 0.08 -1.84 0.05 0.00 -1.81 0.00 0.00 61.98 58.45 1daa s VAL 238 Cb -0.01 -2.18 -0.01 0.00 0.56 0.00 0.00 36.38 34.74 1daa s VAL 238 CO -0.04 -0.04 -0.14 0.42 -0.31 0.00 0.00 175.10 174.99 1daa s THR 239 N -1.45 1.14 0.21 5.32 -4.23 -0.53 -1.91 115.64 114.18 1daa s THR 239 Ca 0.19 -0.68 -0.23 0.00 -1.18 0.00 0.00 61.69 59.80 1daa s THR 239 Cb -0.09 -0.96 0.05 0.00 1.34 0.00 0.00 72.50 72.83 1daa s THR 239 CO 0.10 0.28 0.75 -0.94 -0.54 0.00 0.00 174.62 174.27 1daa s SER 240 N -0.46 -0.32 0.41 3.99 1.04 -1.14 -1.55 113.70 115.68 1daa s SER 240 Ca 0.05 -0.39 0.15 0.00 0.48 0.00 0.00 55.95 56.24 1daa s SER 240 Cb -0.06 0.63 1.01 0.00 0.10 0.00 0.00 66.02 67.70 1daa s SER 240 CO -0.00 -1.12 1.91 0.74 0.98 0.00 0.00 173.24 175.74 1daa h THR 241 N 2.00 0.79 0.00 2.02 2.02 -1.91 0.37 112.91 118.21 1daa h THR 241 Ca -0.23 -0.16 -0.24 0.00 0.77 0.00 0.00 66.41 66.55 1daa h THR 241 Cb 1.26 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.92 1daa h THR 241 CO 0.27 0.08 -1.93 0.35 0.37 0.00 0.00 175.52 174.67 1daa n THR 242 N -4.49 1.15 1.05 3.16 -2.24 -1.26 -4.24 114.28 107.40 1daa n THR 242 Ca 0.15 -0.74 0.12 0.00 -2.27 0.00 0.00 64.05 61.31 1daa n THR 242 Cb 0.53 -0.56 0.13 0.00 -2.10 0.00 0.00 70.33 68.33 1daa n THR 242 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1daa n SER 243 N -2.76 2.77 0.00 3.42 3.41 -1.13 -4.67 113.62 114.66 1daa n SER 243 Ca -0.19 -1.91 0.00 0.00 -0.26 0.00 0.00 58.87 56.52 1daa n SER 243 Cb 0.95 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.94 1daa n SER 243 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1daa n GLU 244 N 1.12 0.00 -3.71 4.33 1.02 0.11 -3.34 120.64 120.16 1daa n GLU 244 Ca 0.14 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.91 1daa n GLU 244 Cb 0.56 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.88 1daa n GLU 244 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1daa s ILE 245 N 0.00 3.58 -0.34 -3.67 1.01 -1.26 -2.90 121.20 117.62 1daa s ILE 245 Ca 0.00 -2.12 -0.12 0.00 0.00 0.00 0.00 60.65 58.42 1daa s ILE 245 Cb 0.00 -3.41 -0.00 0.00 0.01 0.00 0.00 42.46 39.06 1daa s ILE 245 CO 0.00 -0.74 0.21 -0.89 0.00 0.00 0.00 174.94 173.52 1daa s THR 246 N 1.02 4.92 0.33 2.92 2.01 -0.80 -4.75 115.64 121.29 1daa s THR 246 Ca 0.09 -0.45 -0.29 0.00 0.31 0.00 0.00 61.69 61.35 1daa s THR 246 Cb -0.23 -3.58 -0.12 0.00 0.01 0.00 0.00 72.50 68.58 1daa s THR 246 CO -0.03 -0.05 1.46 -2.65 -0.69 0.00 0.00 174.62 172.65 1daa n PRO 247 N 5.05 2.49 -3.73 4.92 -0.02 -1.26 -1.92 135.00 140.53 1daa n PRO 247 Ca -0.13 0.88 -0.38 0.00 -2.02 0.00 0.00 63.50 61.85 1daa n PRO 247 Cb 0.49 -2.58 -0.12 0.00 -0.02 0.00 0.00 33.50 31.26 1daa n PRO 247 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1daa s VAL 248 N -0.73 3.97 -2.39 -1.45 1.01 0.01 -0.37 120.40 120.45 1daa s VAL 248 Ca 0.58 -0.93 0.23 0.00 0.00 0.00 0.00 61.98 61.85 1daa s VAL 248 Cb -0.52 -3.17 0.07 0.00 0.00 0.00 0.00 36.38 32.76 1daa s VAL 248 CO 0.58 -0.09 1.15 2.30 0.00 0.00 0.00 175.10 179.03 1daa n ILE 249 N 4.86 0.00 -3.64 2.22 -5.35 0.32 -4.27 119.36 113.50 1daa n ILE 249 Ca -0.13 -0.36 -0.08 0.00 -0.27 0.00 0.00 62.75 61.91 1daa n ILE 249 Cb 0.46 1.35 -0.07 0.00 -1.74 0.00 0.00 39.64 39.64 1daa n ILE 249 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1daa s GLU 250 N -2.26 0.69 -0.16 6.28 2.12 -1.23 -1.24 118.70 122.90 1daa s GLU 250 Ca 0.22 1.06 0.00 0.00 0.36 0.00 0.00 54.97 56.61 1daa s GLU 250 Cb 0.19 0.21 0.03 0.00 0.26 0.00 0.00 34.13 34.81 1daa s GLU 250 CO 0.46 -0.12 -0.10 0.42 -0.54 0.00 0.00 175.26 175.37 1daa s ILE 251 N 1.20 1.40 -1.41 -3.70 1.01 -0.06 -1.36 121.20 118.27 1daa s ILE 251 Ca -0.07 -0.69 -0.07 0.00 0.00 0.00 0.00 60.65 59.82 1daa s ILE 251 Cb -0.05 -1.43 0.04 0.00 0.01 0.00 0.00 42.46 41.03 1daa s ILE 251 CO -0.13 0.28 0.89 0.47 0.00 0.00 0.00 174.94 176.44 1daa n ASP 252 N 4.80 -3.36 0.00 3.58 8.00 -0.95 -1.30 116.55 127.31 1daa n ASP 252 Ca -0.14 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.59 1daa n ASP 252 Cb 0.48 -4.11 0.00 0.00 -0.02 0.00 0.00 41.12 37.48 1daa n ASP 252 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1daa n GLY 253 N -1.66 2.69 3.68 0.44 0.00 -1.26 -5.02 105.19 104.05 1daa n GLY 253 Ca -0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 1daa n GLY 253 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1daa s LYS 254 N -0.29 4.23 0.38 1.61 1.02 -0.42 -5.06 119.74 121.21 1daa s LYS 254 Ca 0.00 0.44 -0.26 0.00 0.02 0.00 0.00 55.97 56.18 1daa s LYS 254 Cb 0.00 -3.53 -0.09 0.00 -0.52 0.00 0.00 37.83 33.69 1daa s LYS 254 CO 0.00 -0.08 1.14 -0.51 -0.92 0.00 0.00 175.35 174.98 1daa s LEU 255 N 1.42 4.23 -0.46 3.17 1.43 -1.26 -0.89 118.68 126.33 1daa s LEU 255 Ca 0.25 2.29 -0.23 0.00 -1.03 0.00 0.00 54.13 55.41 1daa s LEU 255 Cb -0.15 -3.99 0.03 0.00 0.03 0.00 0.00 46.19 42.10 1daa s LEU 255 CO 0.10 -0.57 0.78 -0.63 0.23 0.00 0.00 176.35 176.25 1daa s ILE 256 N -1.42 4.65 0.00 -0.59 -1.09 -0.38 -4.82 121.20 117.55 1daa s ILE 256 Ca 0.55 0.37 0.00 0.00 -2.23 0.00 0.00 60.65 59.35 1daa s ILE 256 Cb -0.29 -4.32 0.00 0.00 -1.58 0.00 0.00 42.46 36.26 1daa s ILE 256 CO 0.37 -0.73 0.00 -1.14 -1.23 0.00 0.00 174.94 172.21 1daa n ARG 257 N 6.71 0.00 -0.29 2.79 0.63 -1.26 -1.62 116.66 123.61 1daa n ARG 257 Ca 0.02 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.03 1daa n ARG 257 Cb 0.48 0.00 0.23 0.00 0.45 0.00 0.00 32.46 33.62 1daa n ARG 257 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 1daa n ASP 258 N 9.79 3.46 -0.09 6.15 5.75 -1.26 -4.96 116.55 135.39 1daa n ASP 258 Ca 0.00 -2.11 -0.01 0.00 -0.01 0.00 0.00 54.79 52.66 1daa n ASP 258 Cb 0.00 -0.36 -0.01 0.00 -1.03 0.00 0.00 41.12 39.72 1daa n ASP 258 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1daa n GLY 259 N 0.83 0.49 3.47 6.12 0.00 -0.64 -5.03 105.19 110.43 1daa n GLY 259 Ca 0.17 -0.77 -0.26 0.00 0.00 0.00 0.00 46.02 45.16 1daa n GLY 259 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1daa s LYS 260 N -1.66 1.68 0.13 1.61 1.02 -1.26 -4.92 119.74 116.35 1daa s LYS 260 Ca 0.00 -1.53 -0.31 0.00 0.02 0.00 0.00 55.97 54.15 1daa s LYS 260 Cb 0.00 -1.90 -0.10 0.00 -0.52 0.00 0.00 37.83 35.32 1daa s LYS 260 CO 0.00 0.39 1.63 0.08 -0.92 0.00 0.00 175.35 176.53 1daa s VAL 261 N -1.89 2.70 0.71 3.17 1.01 -1.26 -4.97 120.40 119.87 1daa s VAL 261 Ca 0.24 0.39 -0.11 0.00 0.00 0.00 0.00 61.98 62.50 1daa s VAL 261 Cb -0.07 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 33.07 1daa s VAL 261 CO 0.12 0.02 1.08 -0.83 0.00 0.00 0.00 175.10 175.49 1daa s GLY 262 N 1.69 1.64 0.15 4.51 0.00 -1.26 -4.94 107.32 109.12 1daa s GLY 262 Ca 0.73 -0.16 -0.12 0.00 0.00 0.00 0.00 44.72 45.16 1daa s GLY 262 CO 0.32 0.19 1.61 1.05 0.00 0.00 0.00 173.10 176.27 1daa h GLU 263 N -0.72 0.90 0.00 2.90 4.11 -1.96 -2.29 114.58 117.52 1daa h GLU 263 Ca -0.45 -0.28 -0.07 0.00 0.07 0.00 0.00 59.36 58.63 1daa h GLU 263 Cb 1.24 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1daa h GLU 263 CO 0.61 0.92 -0.34 -1.49 0.07 0.00 0.00 179.01 178.78 1daa h TRP 264 N 0.77 0.00 -0.18 2.06 4.06 -1.99 -1.55 115.95 119.12 1daa h TRP 264 Ca 0.15 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 61.00 1daa h TRP 264 Cb 0.51 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.67 1daa h TRP 264 CO 0.04 0.34 -0.28 1.15 -3.56 0.00 0.00 178.44 176.13 1daa h THR 265 N 0.00 1.34 -0.62 1.49 2.02 -1.90 -1.06 112.91 114.18 1daa h THR 265 Ca -0.00 -1.50 -0.02 0.00 0.77 0.00 0.00 66.41 65.66 1daa h THR 265 Cb 0.69 1.87 -0.03 0.00 -1.74 0.00 0.00 68.15 68.94 1daa h THR 265 CO 0.04 0.46 0.31 0.03 0.37 0.00 0.00 175.52 176.74 1daa h ARG 266 N 0.17 0.87 -0.51 6.66 2.47 -1.17 0.18 114.38 123.05 1daa h ARG 266 Ca 0.02 -0.10 -0.05 0.00 -1.26 0.00 0.00 59.98 58.58 1daa h ARG 266 Cb 0.86 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.99 1daa h ARG 266 CO 0.07 0.66 0.11 0.87 0.56 0.00 0.00 179.97 182.24 1daa h LYS 267 N 0.87 0.83 -0.24 0.04 1.57 -1.08 -1.93 116.57 116.64 1daa h LYS 267 Ca 0.22 -0.20 -0.11 0.00 -1.87 0.00 0.00 60.65 58.68 1daa h LYS 267 Cb 0.07 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1daa h LYS 267 CO -0.03 0.80 -0.33 -0.07 -0.57 0.00 0.00 179.45 179.24 1daa h LEU 268 N 0.72 0.53 -0.62 2.94 3.38 -0.71 -2.10 115.31 119.44 1daa h LEU 268 Ca 0.16 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 1daa h LEU 268 Cb 0.35 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1daa h LEU 268 CO 0.00 0.83 -0.16 1.56 0.09 0.00 0.00 178.44 180.76 1daa h GLN 269 N 0.43 0.92 -0.77 1.13 4.20 -0.79 -1.01 115.11 119.22 1daa h GLN 269 Ca 0.05 -0.35 -0.05 0.00 0.06 0.00 0.00 58.65 58.35 1daa h GLN 269 Cb 0.79 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.49 1daa h GLN 269 CO 0.06 1.01 0.27 0.87 -0.67 0.00 0.00 178.83 180.37 1daa h LYS 270 N 0.81 1.18 -0.25 1.46 1.57 -1.23 -0.32 116.57 119.78 1daa h LYS 270 Ca 0.12 -0.24 -0.14 0.00 -1.87 0.00 0.00 60.65 58.52 1daa h LYS 270 Cb 0.71 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1daa h LYS 270 CO 0.05 0.98 -0.42 0.37 -0.57 0.00 0.00 179.45 179.87 1daa h GLN 271 N 1.14 0.62 -0.33 3.15 5.75 -1.25 -2.87 115.11 121.31 1daa h GLN 271 Ca 0.25 -0.32 -0.10 0.00 -0.15 0.00 0.00 58.65 58.33 1daa h GLN 271 Cb 0.27 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1daa h GLN 271 CO -0.01 0.92 -0.21 0.35 -2.65 0.00 0.00 178.83 177.23 1daa h PHE 272 N 0.50 0.69 -0.03 3.99 3.57 -0.84 -2.67 116.94 122.15 1daa h PHE 272 Ca 0.04 -0.14 0.01 0.00 3.53 0.00 0.00 57.97 61.40 1daa h PHE 272 Cb 0.94 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.50 1daa h PHE 272 CO 0.04 0.78 0.02 0.93 -2.23 0.00 0.00 178.31 177.86 1daa h GLU 273 N 0.55 0.00 0.00 1.11 4.39 -0.84 -0.71 114.58 119.09 1daa h GLU 273 Ca 0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.78 1daa h GLU 273 Cb 0.66 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 1daa h GLU 273 CO 0.05 0.00 0.00 0.25 -1.16 0.00 0.00 179.01 178.15 1daa n THR 274 N -4.35 0.77 0.58 1.13 -2.24 -1.01 -2.84 114.28 106.32 1daa n THR 274 Ca -0.02 0.14 0.11 0.00 -2.27 0.00 0.00 64.05 62.01 1daa n THR 274 Cb 0.12 -0.97 0.03 0.00 -2.10 0.00 0.00 70.33 67.40 1daa n THR 274 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1daa n LYS 275 N -1.96 0.28 -2.27 -0.78 5.02 -0.28 -4.92 118.16 113.25 1daa n LYS 275 Ca 0.03 -0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.92 1daa n LYS 275 Cb 0.25 -1.59 -0.03 0.00 -0.02 0.00 0.00 35.03 33.64 1daa n LYS 275 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1daa s ILE 276 N -3.19 3.05 -2.00 -0.18 -1.09 -1.13 -5.04 121.20 111.62 1daa s ILE 276 Ca 0.04 1.04 0.02 0.00 -2.23 0.00 0.00 60.65 59.52 1daa s ILE 276 Cb 0.14 -3.65 0.06 0.00 -1.58 0.00 0.00 42.46 37.44 1daa s ILE 276 CO 0.80 0.23 0.62 -0.81 -1.23 0.00 0.00 174.94 174.54