#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a0g s TYR 2 N 0.00 2.35 0.05 1.61 1.51 -1.26 -2.13 117.35 119.48 1a0g s TYR 2 Ca 0.00 -0.37 0.07 0.00 -1.01 0.00 0.00 57.07 55.76 1a0g s TYR 2 Cb 0.00 -1.31 -0.03 0.00 -0.11 0.00 0.00 41.96 40.51 1a0g s TYR 2 CO 0.00 0.28 -0.21 0.99 -1.11 0.00 0.00 175.55 175.50 1a0g s THR 3 N -0.99 1.66 -0.33 -0.71 2.01 0.13 -4.56 115.64 112.84 1a0g s THR 3 Ca 0.14 -1.25 -0.22 0.00 0.31 0.00 0.00 61.69 60.67 1a0g s THR 3 Cb -0.10 -1.45 -0.00 0.00 0.01 0.00 0.00 72.50 70.96 1a0g s THR 3 CO 0.05 0.15 0.69 -0.22 -0.69 0.00 0.00 174.62 174.61 1a0g s LEU 4 N -1.30 4.16 -0.36 4.42 2.96 0.51 -0.54 118.68 128.53 1a0g s LEU 4 Ca 0.07 0.38 0.03 0.00 -0.22 0.00 0.00 54.13 54.39 1a0g s LEU 4 Cb -0.09 -2.90 0.11 0.00 0.50 0.00 0.00 46.19 43.80 1a0g s LEU 4 CO 0.02 -0.59 0.09 0.86 -1.32 0.00 0.00 176.35 175.41 1a0g s TRP 5 N 2.80 3.29 0.00 5.38 -0.00 -0.04 -1.39 118.94 128.98 1a0g s TRP 5 Ca 0.28 -2.80 0.00 0.00 -0.00 0.00 0.00 56.10 53.58 1a0g s TRP 5 Cb -0.14 -2.67 0.00 0.00 -0.00 0.00 0.00 33.47 30.65 1a0g s TRP 5 CO 0.14 -0.91 0.00 0.09 -0.00 0.00 0.00 176.95 176.27 1a0g n ASN 6 N 4.18 0.00 -0.77 5.86 3.02 0.22 -2.45 115.26 125.32 1a0g n ASN 6 Ca 0.03 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.66 1a0g n ASN 6 Cb 0.40 0.00 0.23 0.00 -0.61 0.00 0.00 39.78 39.81 1a0g n ASN 6 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1a0g n ASP 7 N 10.05 3.47 -4.34 6.41 5.75 -1.26 -4.85 116.55 131.78 1a0g n ASP 7 Ca 0.00 -3.10 -0.28 0.00 -0.01 0.00 0.00 54.79 51.39 1a0g n ASP 7 Cb 0.00 -0.53 -0.14 0.00 -1.03 0.00 0.00 41.12 39.42 1a0g n ASP 7 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1a0g s GLN 8 N -2.88 1.52 -0.32 0.11 -1.52 -1.03 -5.10 119.66 110.44 1a0g s GLN 8 Ca 0.41 -1.19 -0.11 0.00 -1.95 0.00 0.00 55.36 52.52 1a0g s GLN 8 Cb 0.34 -1.82 -0.01 0.00 -0.22 0.00 0.00 33.01 31.30 1a0g s GLN 8 CO 0.07 0.45 0.19 0.42 -0.25 0.00 0.00 175.29 176.17 1a0g s ILE 9 N -0.94 4.87 0.25 1.08 1.01 -1.26 -0.86 121.20 125.34 1a0g s ILE 9 Ca 0.11 -0.35 0.09 0.00 0.00 0.00 0.00 60.65 60.50 1a0g s ILE 9 Cb -0.10 -3.49 -0.05 0.00 0.01 0.00 0.00 42.46 38.83 1a0g s ILE 9 CO 0.04 0.03 -0.14 0.68 0.00 0.00 0.00 174.94 175.55 1a0g s VAL 10 N 1.65 1.96 0.35 2.92 -7.23 0.29 -4.94 120.40 115.41 1a0g s VAL 10 Ca 0.05 -2.25 -0.27 0.00 -1.81 0.00 0.00 61.98 57.70 1a0g s VAL 10 Cb -0.17 -2.23 -0.09 0.00 0.56 0.00 0.00 36.38 34.44 1a0g s VAL 10 CO 0.08 -0.46 1.20 -0.54 -0.31 0.00 0.00 175.10 175.07 1a0g s LYS 11 N -3.62 4.28 0.29 4.82 1.02 -1.26 0.18 119.74 125.45 1a0g s LYS 11 Ca 0.27 1.96 -0.02 0.00 0.02 0.00 0.00 55.97 58.19 1a0g s LYS 11 Cb -0.01 -2.92 0.62 0.00 -0.52 0.00 0.00 37.83 34.99 1a0g s LYS 11 CO 0.11 -0.16 1.58 -0.44 -0.92 0.00 0.00 175.35 175.52 1a0g h ASP 12 N 3.14 -0.54 -0.39 2.83 3.32 -1.75 -0.44 116.42 122.59 1a0g h ASP 12 Ca -0.48 0.26 0.11 0.00 0.02 0.00 0.00 57.03 56.94 1a0g h ASP 12 Cb 1.23 0.48 -0.02 0.00 0.22 0.00 0.00 39.33 41.24 1a0g h ASP 12 CO 0.64 -0.31 0.34 -0.33 -1.72 0.00 0.00 179.24 177.86 1a0g h GLU 13 N 0.03 0.00 0.00 3.56 3.07 -1.91 -2.30 114.58 117.03 1a0g h GLU 13 Ca 0.53 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.39 1a0g h GLU 13 Cb 1.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.92 1a0g h GLU 13 CO -0.88 0.00 -0.26 0.39 -1.40 0.00 0.00 179.01 176.86 1a0g n GLU 14 N -4.05 0.24 -2.42 2.33 1.02 -0.18 -4.88 120.64 112.70 1a0g n GLU 14 Ca 0.06 0.14 -0.42 0.00 -0.02 0.00 0.00 57.16 56.92 1a0g n GLU 14 Cb 0.52 -1.72 -0.03 0.00 -0.02 0.00 0.00 31.44 30.18 1a0g n GLU 14 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1a0g s VAL 15 N -3.11 4.10 -0.06 2.62 1.01 -0.87 -5.03 120.40 119.06 1a0g s VAL 15 Ca 0.09 1.48 0.02 0.00 0.00 0.00 0.00 61.98 63.57 1a0g s VAL 15 Cb 0.13 -3.95 0.02 0.00 0.00 0.00 0.00 36.38 32.58 1a0g s VAL 15 CO 0.64 0.06 -0.09 -0.54 0.00 0.00 0.00 175.10 175.18 1a0g s LYS 16 N 1.60 1.35 -0.20 2.72 1.02 -1.26 -5.10 119.74 119.87 1a0g s LYS 16 Ca 0.58 -0.28 -0.13 0.00 0.02 0.00 0.00 55.97 56.16 1a0g s LYS 16 Cb -0.28 -1.20 -0.05 0.00 -0.52 0.00 0.00 37.83 35.79 1a0g s LYS 16 CO 0.26 -0.04 0.26 0.42 -0.92 0.00 0.00 175.35 175.34 1a0g s ILE 17 N 0.84 5.31 0.27 2.17 -1.09 -1.26 -5.07 121.20 122.37 1a0g s ILE 17 Ca -0.12 0.44 -0.29 0.00 -2.23 0.00 0.00 60.65 58.44 1a0g s ILE 17 Cb -0.15 -3.60 -0.09 0.00 -1.58 0.00 0.00 42.46 37.04 1a0g s ILE 17 CO 0.02 0.34 1.11 -0.62 -1.23 0.00 0.00 174.94 174.56 1a0g s ASP 18 N 0.79 7.24 0.61 3.58 -1.08 -1.26 -4.92 116.67 121.62 1a0g s ASP 18 Ca 0.13 2.28 0.31 0.00 -0.52 0.00 0.00 52.55 54.75 1a0g s ASP 18 Cb -0.13 -2.63 1.80 0.00 -1.46 0.00 0.00 42.92 40.50 1a0g s ASP 18 CO 0.04 -0.18 2.16 0.07 0.52 0.00 0.00 175.17 177.78 1a0g h LYS 19 N 3.95 0.00 -0.70 4.34 2.10 -2.01 -1.57 116.57 122.68 1a0g h LYS 19 Ca -0.47 0.00 -0.26 0.00 -2.00 0.00 0.00 60.65 57.92 1a0g h LYS 19 Cb 1.21 0.00 -0.16 0.00 -0.90 0.00 0.00 32.23 32.38 1a0g h LYS 19 CO 0.68 0.00 0.28 0.39 -2.00 0.00 0.00 179.45 178.80 1a0g n GLU 20 N -3.63 2.99 -2.39 0.07 1.02 -1.26 -4.68 120.64 112.76 1a0g n GLU 20 Ca -0.00 -3.07 -0.42 0.00 -0.02 0.00 0.00 57.16 53.65 1a0g n GLU 20 Cb 0.24 -2.11 -0.03 0.00 -0.02 0.00 0.00 31.44 29.52 1a0g n GLU 20 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1a0g s ASP 21 N -1.44 7.03 0.63 1.62 -1.08 -0.59 -2.61 116.67 120.23 1a0g s ASP 21 Ca 0.53 2.03 0.36 0.00 -0.52 0.00 0.00 52.55 54.95 1a0g s ASP 21 Cb 0.44 -2.58 2.04 0.00 -1.46 0.00 0.00 42.92 41.36 1a0g s ASP 21 CO 0.10 -0.52 2.27 0.03 0.52 0.00 0.00 175.17 177.57 1a0g h ARG 22 N 6.94 0.00 0.00 4.34 3.08 -1.28 0.17 114.38 127.63 1a0g h ARG 22 Ca -0.41 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.56 1a0g h ARG 22 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 1a0g h ARG 22 CO 0.83 0.00 -0.41 0.78 -1.07 0.00 0.00 179.97 180.10 1a0g h GLY 23 N 0.00 0.00 1.40 0.04 0.00 -1.81 0.40 103.07 103.09 1a0g h GLY 23 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.04 1a0g h GLY 23 CO -0.00 0.00 -1.41 -1.82 0.00 0.00 0.00 176.54 173.31 1a0g h TYR 24 N 0.00 0.56 0.00 5.60 3.20 -1.02 -2.58 116.97 122.74 1a0g h TYR 24 Ca -0.00 -0.41 -0.09 0.00 3.14 0.00 0.00 58.73 61.36 1a0g h TYR 24 Cb 0.76 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 1a0g h TYR 24 CO 0.00 1.38 -1.58 1.04 -1.64 0.00 0.00 178.16 177.36 1a0g n GLN 25 N -3.53 0.64 0.00 1.82 6.02 -0.99 -4.64 117.38 116.70 1a0g n GLN 25 Ca -0.13 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 1a0g n GLN 25 Cb 1.05 -1.70 0.00 0.00 1.02 0.00 0.00 30.24 30.61 1a0g n GLN 25 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1a0g n PHE 26 N -2.62 0.00 -1.80 1.08 3.72 0.10 -4.98 117.46 112.96 1a0g n PHE 26 Ca -0.08 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.19 1a0g n PHE 26 Cb 0.71 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.22 1a0g n PHE 26 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1a0g n GLY 27 N 0.07 0.64 3.12 1.37 0.00 -0.97 -4.88 105.19 104.54 1a0g n GLY 27 Ca 0.00 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 1a0g n GLY 27 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1a0g n ASP 28 N -0.32 4.08 -3.60 1.61 2.03 -1.02 -3.66 116.55 115.66 1a0g n ASP 28 Ca -0.14 -2.84 -0.00 0.00 0.52 0.00 0.00 54.79 52.32 1a0g n ASP 28 Cb 0.52 -1.65 0.01 0.00 -0.72 0.00 0.00 41.12 39.29 1a0g n ASP 28 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1a0g s GLY 29 N 3.94 -0.08 0.16 0.27 0.00 -1.26 -2.05 107.32 108.31 1a0g s GLY 29 Ca 0.52 -0.02 0.05 0.00 0.00 0.00 0.00 44.72 45.27 1a0g s GLY 29 CO 0.00 3.18 -0.11 -1.34 0.00 0.00 0.00 173.10 174.84 1a0g s VAL 30 N -2.22 1.30 0.16 1.40 -7.23 0.00 -1.48 120.40 112.33 1a0g s VAL 30 Ca 0.23 -2.10 -0.07 0.00 -1.81 0.00 0.00 61.98 58.24 1a0g s VAL 30 Cb -0.01 -1.91 -0.02 0.00 0.56 0.00 0.00 36.38 35.00 1a0g s VAL 30 CO 0.01 -0.70 0.22 -0.72 -0.31 0.00 0.00 175.10 173.61 1a0g s TYR 31 N -3.25 0.55 0.05 2.82 1.13 -0.84 -0.91 117.35 116.89 1a0g s TYR 31 Ca 0.18 -0.91 -0.05 0.00 -1.41 0.00 0.00 57.07 54.89 1a0g s TYR 31 Cb 0.02 -0.18 -0.02 0.00 -1.10 0.00 0.00 41.96 40.68 1a0g s TYR 31 CO 0.02 -0.67 0.08 -1.21 -2.51 0.00 0.00 175.55 171.26 1a0g s GLU 32 N -4.00 0.62 -0.09 -3.49 0.41 -0.10 -4.89 118.70 107.16 1a0g s GLU 32 Ca 0.20 -0.87 -0.00 0.00 -0.41 0.00 0.00 54.97 53.88 1a0g s GLU 32 Cb 0.04 0.24 0.02 0.00 -1.78 0.00 0.00 34.13 32.66 1a0g s GLU 32 CO 0.01 -0.15 -0.05 0.08 -0.49 0.00 0.00 175.26 174.66 1a0g s VAL 33 N -3.02 0.76 -0.15 2.63 1.01 -1.26 -1.95 120.40 118.41 1a0g s VAL 33 Ca -0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 1a0g s VAL 33 Cb 0.01 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 1a0g s VAL 33 CO -0.06 0.31 -0.12 -0.69 0.00 0.00 0.00 175.10 174.54 1a0g s VAL 34 N 1.64 3.02 0.23 2.92 1.01 -0.36 -4.93 120.40 123.92 1a0g s VAL 34 Ca 0.02 -0.66 -0.28 0.00 0.00 0.00 0.00 61.98 61.06 1a0g s VAL 34 Cb -0.13 -2.29 -0.09 0.00 0.00 0.00 0.00 36.38 33.87 1a0g s VAL 34 CO -0.05 0.50 0.90 -0.75 0.00 0.00 0.00 175.10 175.69 1a0g s LYS 35 N 0.69 4.75 -0.07 2.72 2.47 -1.26 -0.68 119.74 128.35 1a0g s LYS 35 Ca -0.06 1.38 0.05 0.00 -1.56 0.00 0.00 55.97 55.78 1a0g s LYS 35 Cb -0.15 -3.22 -0.01 0.00 -1.46 0.00 0.00 37.83 32.99 1a0g s LYS 35 CO 0.02 0.51 -0.22 0.08 0.16 0.00 0.00 175.35 175.90 1a0g s VAL 36 N -1.23 2.31 -0.20 4.02 1.01 0.46 -0.76 120.40 126.02 1a0g s VAL 36 Ca 0.41 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.43 1a0g s VAL 36 Cb -0.24 -1.87 0.04 0.00 0.00 0.00 0.00 36.38 34.31 1a0g s VAL 36 CO 0.29 0.57 -0.09 -0.31 0.00 0.00 0.00 175.10 175.56 1a0g s TYR 37 N -0.12 2.31 -1.42 5.22 2.02 0.86 -2.14 117.35 124.08 1a0g s TYR 37 Ca -0.04 -1.54 -0.04 0.00 -0.37 0.00 0.00 57.07 55.08 1a0g s TYR 37 Cb -0.14 -1.58 0.03 0.00 -0.40 0.00 0.00 41.96 39.86 1a0g s TYR 37 CO 0.04 -0.73 0.63 0.09 -1.57 0.00 0.00 175.55 174.01 1a0g n ASN 38 N 4.71 -1.51 0.00 2.29 3.02 -0.34 -1.24 115.26 122.20 1a0g n ASN 38 Ca -0.14 -0.91 0.00 0.00 -0.03 0.00 0.00 54.58 53.50 1a0g n ASN 38 Cb 0.46 -3.49 0.00 0.00 -0.61 0.00 0.00 39.78 36.14 1a0g n ASN 38 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a0g n GLY 39 N -1.75 2.17 3.59 7.41 0.00 0.10 -4.91 105.19 111.81 1a0g n GLY 39 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 1a0g n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a0g s GLU 40 N -0.10 3.53 -0.10 1.61 2.02 -0.37 -5.03 118.70 120.27 1a0g s GLU 40 Ca 0.00 -0.44 -0.30 0.00 0.02 0.00 0.00 54.97 54.26 1a0g s GLU 40 Cb 0.00 -2.95 -0.01 0.00 0.10 0.00 0.00 34.13 31.26 1a0g s GLU 40 CO 0.00 0.40 1.03 -1.64 0.02 0.00 0.00 175.26 175.07 1a0g s MET 41 N -0.04 4.41 -0.10 1.61 -1.94 -1.26 -0.09 119.30 121.88 1a0g s MET 41 Ca 0.03 1.43 -0.23 0.00 -1.71 0.00 0.00 55.69 55.21 1a0g s MET 41 Cb -0.13 -3.54 -0.03 0.00 2.01 0.00 0.00 34.83 33.14 1a0g s MET 41 CO 0.02 -0.33 0.70 0.12 -0.01 0.00 0.00 175.02 175.52 1a0g s PHE 42 N 2.02 3.53 -1.65 -0.03 5.36 0.07 -4.26 117.98 123.01 1a0g s PHE 42 Ca 0.49 1.20 -0.12 0.00 -0.96 0.00 0.00 56.93 57.54 1a0g s PHE 42 Cb -0.19 -2.83 0.11 0.00 -0.34 0.00 0.00 43.02 39.77 1a0g s PHE 42 CO 0.19 0.01 0.53 0.25 -1.46 0.00 0.00 175.22 174.73 1a0g n THR 43 N 4.04 -1.29 -0.28 0.12 -2.24 -1.26 -4.48 114.28 108.88 1a0g n THR 43 Ca -0.01 -0.21 -0.06 0.00 -2.27 0.00 0.00 64.05 61.51 1a0g n THR 43 Cb 0.51 -1.56 0.06 0.00 -2.10 0.00 0.00 70.33 67.24 1a0g n THR 43 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1a0g h VAL 44 N -1.51 1.24 -0.36 2.28 3.04 -1.94 -2.33 116.25 116.67 1a0g h VAL 44 Ca -0.61 -0.68 -0.02 0.00 -1.01 0.00 0.00 66.70 64.38 1a0g h VAL 44 Cb 1.39 0.28 -0.02 0.00 -2.01 0.00 0.00 31.29 30.92 1a0g h VAL 44 CO 0.76 0.29 0.15 0.78 -1.01 0.00 0.00 177.57 178.54 1a0g h ASN 45 N 1.08 0.45 -0.39 3.17 4.21 -1.94 -0.29 115.58 121.87 1a0g h ASN 45 Ca 0.26 -0.04 -0.14 0.00 1.21 0.00 0.00 56.30 57.59 1a0g h ASN 45 Cb 0.11 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.19 1a0g h ASN 45 CO -0.03 0.41 -0.31 -0.33 -1.29 0.00 0.00 177.43 175.88 1a0g h GLU 46 N 0.51 0.89 -0.13 0.81 3.07 -1.81 0.69 114.58 118.60 1a0g h GLU 46 Ca 0.13 -0.44 -0.13 0.00 -0.50 0.00 0.00 59.36 58.41 1a0g h GLU 46 Cb 0.09 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 1a0g h GLU 46 CO -0.01 1.09 -0.50 0.45 -1.40 0.00 0.00 179.01 178.64 1a0g h HIS 47 N 0.71 0.42 -0.32 4.33 3.86 -1.04 -1.36 115.15 121.74 1a0g h HIS 47 Ca 0.07 -0.14 -0.13 0.00 -1.16 0.00 0.00 60.37 59.02 1a0g h HIS 47 Cb 0.90 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 29.28 1a0g h HIS 47 CO 0.06 0.77 -0.29 0.82 0.86 0.00 0.00 177.93 180.15 1a0g h ILE 48 N 0.27 1.29 -0.40 2.45 2.04 -0.82 0.01 117.51 122.35 1a0g h ILE 48 Ca 0.01 -1.45 -0.00 0.00 1.00 0.00 0.00 64.86 64.42 1a0g h ILE 48 Cb 0.97 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 38.53 1a0g h ILE 48 CO 0.08 0.47 0.24 0.44 0.00 0.00 0.00 178.15 179.39 1a0g h ASP 49 N 0.54 0.47 0.08 1.72 3.32 -0.77 -2.26 116.42 119.52 1a0g h ASP 49 Ca 0.06 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 1a0g h ASP 49 Cb 0.86 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.28 1a0g h ASP 49 CO 0.07 0.39 -0.24 -0.09 -1.72 0.00 0.00 179.24 177.65 1a0g h ARG 50 N 0.52 0.28 -0.33 3.56 2.43 -1.08 -1.21 114.38 118.56 1a0g h ARG 50 Ca 0.14 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1a0g h ARG 50 Cb -0.00 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1a0g h ARG 50 CO -0.03 0.50 0.15 1.25 -1.51 0.00 0.00 179.97 180.34 1a0g h LEU 51 N 0.25 0.43 -1.06 3.80 5.85 -0.47 -0.23 115.31 123.87 1a0g h LEU 51 Ca 0.04 -0.14 -0.09 0.00 0.84 0.00 0.00 57.88 58.54 1a0g h LEU 51 Cb 0.56 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1a0g h LEU 51 CO 0.04 0.45 -0.26 1.88 -0.34 0.00 0.00 178.44 180.21 1a0g h TYR 52 N 0.39 0.38 -0.30 1.25 -1.99 -1.12 -0.82 116.97 114.76 1a0g h TYR 52 Ca 0.11 -0.08 -0.09 0.00 2.00 0.00 0.00 58.73 60.67 1a0g h TYR 52 Cb 0.14 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 38.76 1a0g h TYR 52 CO -0.01 0.58 -0.18 0.00 -0.00 0.00 0.00 178.16 178.55 1a0g h ALA 53 N 1.42 0.42 -0.43 3.88 0.00 -0.83 -0.50 119.26 123.22 1a0g h ALA 53 Ca 0.05 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1a0g h ALA 53 Cb 0.63 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1a0g h ALA 53 CO 0.05 0.34 0.21 0.77 0.00 0.00 0.00 179.25 180.62 1a0g h SER 54 N 0.39 0.56 -0.54 0.00 0.02 -0.78 -1.39 113.55 111.80 1a0g h SER 54 Ca 0.06 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1a0g h SER 54 Cb 0.72 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.09 1a0g h SER 54 CO 0.05 0.52 0.27 0.00 -1.14 0.00 0.00 176.83 176.54 1a0g h ALA 55 N 1.06 0.70 -0.58 3.77 0.00 -1.04 -2.53 119.26 120.63 1a0g h ALA 55 Ca 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1a0g h ALA 55 Cb 0.11 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1a0g h ALA 55 CO -0.02 0.24 0.30 1.49 0.00 0.00 0.00 179.25 181.26 1a0g h GLU 56 N 0.73 0.80 0.00 0.00 4.81 -0.83 0.28 114.58 120.36 1a0g h GLU 56 Ca 0.19 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 59.30 1a0g h GLU 56 Cb 0.09 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.31 1a0g h GLU 56 CO -0.03 0.60 -0.13 0.87 -0.73 0.00 0.00 179.01 179.59 1a0g h LYS 57 N 0.81 0.00 -0.25 1.92 1.57 -0.81 -1.76 116.57 118.05 1a0g h LYS 57 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1a0g h LYS 57 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1a0g h LYS 57 CO -0.03 0.13 0.00 0.44 -0.57 0.00 0.00 179.45 179.42 1a0g n ILE 58 N -4.12 1.90 -3.62 1.86 -5.35 -0.82 -5.00 119.36 104.21 1a0g n ILE 58 Ca -0.02 -1.68 -0.23 0.00 -0.27 0.00 0.00 62.75 60.55 1a0g n ILE 58 Cb 0.21 -0.05 0.07 0.00 -1.74 0.00 0.00 39.64 38.13 1a0g n ILE 58 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1a0g n ARG 59 N -0.36 -6.86 -3.68 6.28 1.74 -0.46 -5.01 116.66 108.31 1a0g n ARG 59 Ca 0.18 0.77 -0.36 0.00 -0.77 0.00 0.00 57.85 57.67 1a0g n ARG 59 Cb 0.74 -5.73 -0.09 0.00 -1.02 0.00 0.00 32.46 26.35 1a0g n ARG 59 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1a0g s ILE 60 N -3.37 5.37 -0.38 0.55 1.01 -0.04 -4.98 121.20 119.36 1a0g s ILE 60 Ca 0.38 0.20 -0.15 0.00 0.00 0.00 0.00 60.65 61.08 1a0g s ILE 60 Cb -0.18 -3.50 0.01 0.00 0.01 0.00 0.00 42.46 38.80 1a0g s ILE 60 CO 0.76 0.37 0.32 -0.89 0.00 0.00 0.00 174.94 175.50 1a0g s THR 61 N 0.84 5.23 -0.15 2.92 2.01 -1.26 -3.99 115.64 121.24 1a0g s THR 61 Ca 0.08 -0.40 -0.29 0.00 0.31 0.00 0.00 61.69 61.39 1a0g s THR 61 Cb -0.13 -3.88 -0.02 0.00 0.01 0.00 0.00 72.50 68.49 1a0g s THR 61 CO 0.03 -0.22 1.30 -0.63 -0.69 0.00 0.00 174.62 174.40 1a0g s ILE 62 N 1.81 4.20 -1.03 1.82 1.01 -1.26 -4.83 121.20 122.93 1a0g s ILE 62 Ca 0.07 1.46 0.01 0.00 0.00 0.00 0.00 60.65 62.20 1a0g s ILE 62 Cb -0.18 -3.94 0.01 0.00 0.01 0.00 0.00 42.46 38.36 1a0g s ILE 62 CO 0.11 -0.12 1.03 -0.81 0.00 0.00 0.00 174.94 175.15 1a0g n PRO 63 N 6.58 0.00 -4.31 2.79 -0.04 -1.26 -4.72 135.00 134.04 1a0g n PRO 63 Ca 0.14 0.46 -0.27 0.00 -0.04 0.00 0.00 63.50 63.80 1a0g n PRO 63 Cb 0.45 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.31 1a0g n PRO 63 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1a0g s TYR 64 N -2.97 2.59 0.83 0.54 2.02 -1.26 -5.13 117.35 113.97 1a0g s TYR 64 Ca 0.01 -0.24 -0.12 0.00 -0.37 0.00 0.00 57.07 56.35 1a0g s TYR 64 Cb 0.01 -1.26 0.10 0.00 -0.40 0.00 0.00 41.96 40.40 1a0g s TYR 64 CO 0.03 0.52 1.19 0.95 -1.57 0.00 0.00 175.55 176.66 1a0g s THR 65 N -1.74 2.00 0.37 -0.71 -4.23 -1.26 -4.88 115.64 105.19 1a0g s THR 65 Ca 0.25 0.00 0.10 0.00 -1.18 0.00 0.00 61.69 60.86 1a0g s THR 65 Cb -0.08 -2.97 0.13 0.00 1.34 0.00 0.00 72.50 70.91 1a0g s THR 65 CO 0.15 0.00 1.87 0.11 -0.54 0.00 0.00 174.62 176.20 1a0g h LYS 66 N -1.15 0.18 -0.49 3.99 1.57 -1.98 -2.23 116.57 116.44 1a0g h LYS 66 Ca -0.46 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.19 1a0g h LYS 66 Cb 1.32 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.60 1a0g h LYS 66 CO 0.63 0.40 0.01 -0.44 -0.57 0.00 0.00 179.45 179.49 1a0g h ASP 67 N 0.16 0.84 -0.27 0.86 3.32 -1.99 0.38 116.42 119.73 1a0g h ASP 67 Ca 0.03 -0.30 -0.05 0.00 0.02 0.00 0.00 57.03 56.73 1a0g h ASP 67 Cb 0.50 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1a0g h ASP 67 CO 0.03 0.94 -0.03 0.50 -1.72 0.00 0.00 179.24 178.96 1a0g h LYS 68 N 0.73 0.50 -0.86 3.56 1.63 -1.89 -1.43 116.57 118.81 1a0g h LYS 68 Ca 0.14 -0.17 -0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1a0g h LYS 68 Cb 0.50 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.05 1a0g h LYS 68 CO 0.02 0.68 0.52 0.35 -3.45 0.00 0.00 179.45 177.57 1a0g h PHE 69 N 0.27 1.13 -0.17 1.91 3.04 -1.30 0.66 116.94 122.48 1a0g h PHE 69 Ca 0.07 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.01 1a0g h PHE 69 Cb 0.48 -0.37 -0.01 0.00 2.56 0.00 0.00 35.95 38.61 1a0g h PHE 69 CO 0.04 0.75 0.06 1.25 -2.02 0.00 0.00 178.31 178.39 1a0g h HIS 70 N 1.18 0.26 -0.93 0.41 2.76 -0.75 -2.16 115.15 115.93 1a0g h HIS 70 Ca 0.31 -0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.48 1a0g h HIS 70 Cb -0.05 -0.08 -0.05 0.00 1.55 0.00 0.00 27.41 28.78 1a0g h HIS 70 CO 0.00 0.34 0.61 0.37 -1.30 0.00 0.00 177.93 177.96 1a0g h GLN 71 N 0.11 1.17 -0.60 5.26 4.15 -0.28 -2.44 115.11 122.48 1a0g h GLN 71 Ca 0.06 -0.07 -0.10 0.00 0.77 0.00 0.00 58.65 59.31 1a0g h GLN 71 Cb 0.20 -0.26 -0.02 0.00 0.21 0.00 0.00 27.48 27.60 1a0g h GLN 71 CO -0.00 0.78 -0.00 -0.07 -1.93 0.00 0.00 178.83 177.60 1a0g h LEU 72 N 1.21 1.04 -0.89 -2.39 3.38 -0.70 -2.57 115.31 114.39 1a0g h LEU 72 Ca 0.36 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1a0g h LEU 72 Cb -0.06 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.37 1a0g h LEU 72 CO -0.10 1.09 0.41 -0.07 0.09 0.00 0.00 178.44 179.87 1a0g h LEU 73 N 0.95 1.10 -0.41 1.67 3.38 -0.94 -1.59 115.31 119.47 1a0g h LEU 73 Ca 0.17 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1a0g h LEU 73 Cb 0.56 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1a0g h LEU 73 CO 0.03 0.92 0.22 -0.74 0.09 0.00 0.00 178.44 178.95 1a0g h HIS 74 N 1.20 0.58 -0.97 1.13 2.76 -1.29 -1.93 115.15 116.63 1a0g h HIS 74 Ca 0.29 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.44 1a0g h HIS 74 Cb 0.10 -0.18 -0.05 0.00 1.55 0.00 0.00 27.41 28.84 1a0g h HIS 74 CO 0.01 0.45 0.61 0.93 -1.30 0.00 0.00 177.93 178.64 1a0g h GLU 75 N 0.53 1.30 -0.35 5.26 5.08 -1.11 -1.08 114.58 124.20 1a0g h GLU 75 Ca 0.14 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1a0g h GLU 75 Cb 0.08 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 1a0g h GLU 75 CO -0.02 0.88 0.20 1.25 -1.00 0.00 0.00 179.01 180.32 1a0g h LEU 76 N 1.32 0.43 -0.49 1.33 5.85 -0.81 0.60 115.31 123.55 1a0g h LEU 76 Ca 0.35 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.96 1a0g h LEU 76 Cb -0.10 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 1a0g h LEU 76 CO -0.07 0.38 0.17 0.58 -0.34 0.00 0.00 178.44 179.16 1a0g h VAL 77 N 0.45 1.22 0.12 1.05 2.07 -0.98 -2.09 116.25 118.09 1a0g h VAL 77 Ca 0.12 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 1a0g h VAL 77 Cb 0.04 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1a0g h VAL 77 CO -0.02 0.26 -0.06 -0.08 0.02 0.00 0.00 177.57 177.69 1a0g h GLU 78 N 0.65 -0.16 -0.32 1.57 4.81 -0.97 -0.48 114.58 119.68 1a0g h GLU 78 Ca 0.16 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1a0g h GLU 78 Cb 0.24 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1a0g h GLU 78 CO -0.01 0.05 0.12 0.87 -0.73 0.00 0.00 179.01 179.31 1a0g h LYS 79 N -0.35 0.45 -0.01 1.92 1.79 -0.85 -1.64 116.57 117.89 1a0g h LYS 79 Ca -0.02 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 1a0g h LYS 79 Cb 0.28 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 1a0g h LYS 79 CO 0.03 0.39 -0.30 0.09 -1.08 0.00 0.00 179.45 178.58 1a0g n ASN 80 N -4.39 0.86 -3.59 0.86 3.02 -0.79 -4.89 115.26 106.34 1a0g n ASN 80 Ca 0.02 -0.71 -0.22 0.00 -0.03 0.00 0.00 54.58 53.63 1a0g n ASN 80 Cb 0.14 0.14 0.05 0.00 -0.61 0.00 0.00 39.78 39.50 1a0g n ASN 80 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1a0g n GLU 81 N -0.87 -3.49 -2.81 3.52 1.02 -0.27 -4.92 120.64 112.81 1a0g n GLU 81 Ca 0.11 0.64 -0.42 0.00 -0.02 0.00 0.00 57.16 57.47 1a0g n GLU 81 Cb 0.34 -5.07 -0.03 0.00 -0.02 0.00 0.00 31.44 26.66 1a0g n GLU 81 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1a0g s LEU 82 N -6.35 4.20 0.00 -4.62 2.96 -0.69 -4.95 118.68 109.23 1a0g s LEU 82 Ca 0.22 1.31 0.00 0.00 -0.22 0.00 0.00 54.13 55.44 1a0g s LEU 82 Cb -0.06 -3.36 0.00 0.00 0.50 0.00 0.00 46.19 43.28 1a0g s LEU 82 CO 0.81 -0.41 0.00 -3.20 -1.32 0.00 0.00 176.35 172.22 1a0g n ASN 83 N 5.13 0.00 -3.93 3.68 2.85 -1.26 -3.73 115.26 118.00 1a0g n ASN 83 Ca 0.06 0.09 -0.26 0.00 -0.11 0.00 0.00 54.58 54.35 1a0g n ASN 83 Cb 0.49 -0.35 -0.17 0.00 1.24 0.00 0.00 39.78 40.99 1a0g n ASN 83 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1a0g s THR 84 N -0.69 1.04 -0.02 -0.44 2.01 -1.26 0.03 115.64 116.31 1a0g s THR 84 Ca 0.00 -0.32 0.00 0.00 0.31 0.00 0.00 61.69 61.68 1a0g s THR 84 Cb 0.00 -1.04 0.00 0.00 0.01 0.00 0.00 72.50 71.47 1a0g s THR 84 CO 0.00 0.37 0.00 0.61 -0.69 0.00 0.00 174.62 174.91 1a0g n GLY 85 N 4.74 -0.88 3.26 4.40 0.00 -0.91 -0.74 105.19 115.05 1a0g n GLY 85 Ca -0.14 -0.09 -0.09 0.00 0.00 0.00 0.00 46.02 45.69 1a0g n GLY 85 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1a0g s HIS 86 N -4.00 0.05 -0.12 1.61 -3.43 -0.30 -0.40 115.29 108.69 1a0g s HIS 86 Ca 0.00 -0.43 -0.03 0.00 -0.80 0.00 0.00 55.06 53.80 1a0g s HIS 86 Cb 0.00 0.05 -0.03 0.00 -1.43 0.00 0.00 32.58 31.17 1a0g s HIS 86 CO 0.00 -0.61 -0.03 0.42 -2.00 0.00 0.00 174.74 172.51 1a0g s ILE 87 N -3.85 3.97 -0.11 -5.38 1.01 0.14 -1.54 121.20 115.44 1a0g s ILE 87 Ca 0.05 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.36 1a0g s ILE 87 Cb 0.04 -2.70 -0.01 0.00 0.01 0.00 0.00 42.46 39.79 1a0g s ILE 87 CO -0.11 0.54 -0.15 -0.47 0.00 0.00 0.00 174.94 174.75 1a0g s TYR 88 N -0.13 2.75 -0.02 3.97 5.04 0.35 -1.23 117.35 128.09 1a0g s TYR 88 Ca 0.03 -0.63 -0.07 0.00 -2.44 0.00 0.00 57.07 53.95 1a0g s TYR 88 Cb -0.13 -1.79 0.01 0.00 0.35 0.00 0.00 41.96 40.40 1a0g s TYR 88 CO 0.02 -0.19 0.16 -0.59 -1.34 0.00 0.00 175.55 173.61 1a0g s PHE 89 N 0.19 -0.03 0.11 4.97 -0.71 -0.82 -0.92 117.98 120.78 1a0g s PHE 89 Ca -0.09 0.04 -0.05 0.00 -1.04 0.00 0.00 56.93 55.79 1a0g s PHE 89 Cb -0.15 -0.01 -0.02 0.00 -1.21 0.00 0.00 43.02 41.62 1a0g s PHE 89 CO 0.05 -0.24 0.14 1.14 -1.34 0.00 0.00 175.22 174.97 1a0g s GLN 90 N -1.00 0.91 -0.03 1.99 -2.07 0.28 -0.92 119.66 118.82 1a0g s GLN 90 Ca -0.11 -1.21 0.01 0.00 -1.82 0.00 0.00 55.36 52.23 1a0g s GLN 90 Cb -0.06 0.30 0.02 0.00 -1.09 0.00 0.00 33.01 32.18 1a0g s GLN 90 CO 0.01 -0.28 -0.01 0.08 -1.32 0.00 0.00 175.29 173.77 1a0g s VAL 91 N -3.96 0.25 0.27 3.63 1.01 -0.09 -2.13 120.40 119.38 1a0g s VAL 91 Ca 0.14 0.02 0.10 0.00 0.00 0.00 0.00 61.98 62.24 1a0g s VAL 91 Cb 0.06 -0.32 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 1a0g s VAL 91 CO -0.04 0.15 -0.03 0.42 0.00 0.00 0.00 175.10 175.60 1a0g s THR 92 N 0.86 3.26 0.40 3.92 -4.23 -0.62 -0.82 115.64 118.41 1a0g s THR 92 Ca -0.09 -1.99 0.39 0.00 -1.18 0.00 0.00 61.69 58.82 1a0g s THR 92 Cb -0.12 -2.76 0.40 0.00 1.34 0.00 0.00 72.50 71.35 1a0g s THR 92 CO -0.01 -0.37 2.18 -0.09 -0.54 0.00 0.00 174.62 175.80 1a0g h ARG 93 N 1.93 0.00 0.00 3.99 2.43 -1.75 -2.52 114.38 118.47 1a0g h ARG 93 Ca -0.43 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1a0g h ARG 93 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1a0g h ARG 93 CO 0.61 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 179.48 1a0g n GLY 94 N -0.85 0.51 3.68 2.80 0.00 -1.26 -3.89 105.19 106.18 1a0g n GLY 94 Ca -0.02 -2.26 -0.35 0.00 0.00 0.00 0.00 46.02 43.39 1a0g n GLY 94 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a0g s THR 95 N -0.51 5.00 0.04 2.61 2.01 -1.26 -0.76 115.64 122.77 1a0g s THR 95 Ca 0.00 0.04 -0.27 0.00 0.31 0.00 0.00 61.69 61.77 1a0g s THR 95 Cb 0.00 -3.25 0.08 0.00 0.01 0.00 0.00 72.50 69.34 1a0g s THR 95 CO 0.00 0.47 0.72 -0.55 -0.69 0.00 0.00 174.62 174.56 1a0g s SER 96 N 0.25 -0.54 0.25 3.53 0.15 -1.07 -4.90 113.70 111.36 1a0g s SER 96 Ca 0.05 0.24 -0.31 0.00 0.70 0.00 0.00 55.95 56.63 1a0g s SER 96 Cb -0.12 0.51 -0.12 0.00 -1.71 0.00 0.00 66.02 64.59 1a0g s SER 96 CO -0.00 -0.74 1.65 -2.16 1.20 0.00 0.00 173.24 173.19 1a0g s PRO 97 N -2.66 4.13 -0.38 5.44 0.04 -1.26 -4.79 135.00 135.52 1a0g s PRO 97 Ca -0.02 2.58 -0.41 0.00 0.04 0.00 0.00 61.00 63.19 1a0g s PRO 97 Cb -0.01 -3.05 -0.16 0.00 0.04 0.00 0.00 34.50 31.32 1a0g s PRO 97 CO -0.04 -0.68 1.89 -2.13 0.04 0.00 0.00 177.00 176.07 1a0g n ARG 98 N 3.08 0.71 -3.63 4.56 0.63 -1.26 -4.95 116.66 115.79 1a0g n ARG 98 Ca 0.12 0.24 -0.12 0.00 -0.92 0.00 0.00 57.85 57.17 1a0g n ARG 98 Cb 0.36 -1.95 -0.07 0.00 0.45 0.00 0.00 32.46 31.25 1a0g n ARG 98 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1a0g s ALA 99 N 4.70 -1.82 0.15 5.13 0.00 -1.26 -5.08 121.76 123.58 1a0g s ALA 99 Ca 1.06 2.12 -0.15 0.00 0.00 0.00 0.00 51.96 54.99 1a0g s ALA 99 Cb -1.19 -1.26 0.03 0.00 0.00 0.00 0.00 23.12 20.70 1a0g s ALA 99 CO 0.65 -0.34 1.74 0.45 0.00 0.00 0.00 175.76 178.26 1a0g h HIS 100 N 5.45 0.66 -4.24 0.00 3.86 -2.03 -3.45 115.15 115.40 1a0g h HIS 100 Ca -0.29 -0.03 -0.51 0.00 -1.16 0.00 0.00 60.37 58.38 1a0g h HIS 100 Cb 1.18 -0.21 0.14 0.00 1.06 0.00 0.00 27.41 29.58 1a0g h HIS 100 CO 0.30 0.52 0.29 1.14 0.86 0.00 0.00 177.93 181.04 1a0g s GLN 101 N -5.76 1.88 0.51 2.45 0.00 -1.26 -4.96 119.66 112.51 1a0g s GLN 101 Ca -0.13 1.13 -0.22 0.00 -0.00 0.00 0.00 55.36 56.13 1a0g s GLN 101 Cb 0.11 -1.86 -0.07 0.00 0.00 0.00 0.00 33.01 31.20 1a0g s GLN 101 CO 0.75 -1.90 1.24 1.19 0.00 0.00 0.00 175.29 176.57 1a0g n PHE 102 N -3.69 1.91 -1.02 9.60 3.72 -1.26 -5.01 117.46 121.71 1a0g n PHE 102 Ca 0.09 0.46 -0.14 0.00 -0.05 0.00 0.00 57.45 57.80 1a0g n PHE 102 Cb 0.53 -2.32 0.11 0.00 -0.94 0.00 0.00 39.48 36.87 1a0g n PHE 102 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1a0g n PRO 103 N -0.64 -1.53 -2.32 -1.08 -0.02 -1.26 -4.97 135.00 123.18 1a0g n PRO 103 Ca 0.10 -0.91 -0.41 0.00 -2.02 0.00 0.00 63.50 60.26 1a0g n PRO 103 Cb 0.43 -0.75 -0.03 0.00 -0.02 0.00 0.00 33.50 33.13 1a0g n PRO 103 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1a0g s GLU 104 N -4.28 4.45 0.00 -0.52 2.02 -1.26 -4.84 118.70 114.27 1a0g s GLU 104 Ca 0.35 1.94 0.00 0.00 0.02 0.00 0.00 54.97 57.28 1a0g s GLU 104 Cb -0.02 -3.22 0.00 0.00 0.10 0.00 0.00 34.13 30.98 1a0g s GLU 104 CO 0.26 -0.15 0.43 0.09 0.02 0.00 0.00 175.26 175.92 1a0g n ASN 105 N 2.52 0.00 0.17 -0.19 5.03 -1.26 -0.63 115.26 120.90 1a0g n ASN 105 Ca 0.05 0.08 0.06 0.00 0.87 0.00 0.00 54.58 55.63 1a0g n ASN 105 Cb 0.44 -0.08 0.08 0.00 -1.02 0.00 0.00 39.78 39.20 1a0g n ASN 105 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1a0g h THR 106 N 0.00 0.56 -2.92 3.41 1.35 -2.02 -3.46 112.91 109.83 1a0g h THR 106 Ca 0.00 -1.79 -0.53 0.00 -0.55 0.00 0.00 66.41 63.55 1a0g h THR 106 Cb 0.10 2.27 0.04 0.00 -1.73 0.00 0.00 68.15 68.83 1a0g h THR 106 CO 0.00 0.32 0.83 -0.69 -0.25 0.00 0.00 175.52 175.73 1a0g s VAL 107 N -3.05 2.79 0.15 6.82 1.01 0.20 -5.01 120.40 123.31 1a0g s VAL 107 Ca 0.05 0.58 -0.08 0.00 0.00 0.00 0.00 61.98 62.52 1a0g s VAL 107 Cb 0.07 -3.37 -0.06 0.00 0.00 0.00 0.00 36.38 33.02 1a0g s VAL 107 CO 0.72 0.05 0.44 -0.54 0.00 0.00 0.00 175.10 175.77 1a0g s LYS 108 N 0.99 3.73 0.50 2.72 1.02 -1.26 -4.93 119.74 122.51 1a0g s LYS 108 Ca 0.68 0.13 -0.21 0.00 0.02 0.00 0.00 55.97 56.58 1a0g s LYS 108 Cb -0.42 -2.84 -0.06 0.00 -0.52 0.00 0.00 37.83 33.99 1a0g s LYS 108 CO 0.32 0.45 1.17 -2.14 -0.92 0.00 0.00 175.35 174.23 1a0g s PRO 109 N -2.44 3.54 -0.22 -1.68 0.02 -1.25 -4.13 135.00 128.84 1a0g s PRO 109 Ca 0.40 1.76 -0.06 0.00 0.02 0.00 0.00 61.00 63.12 1a0g s PRO 109 Cb -0.13 -2.24 -0.03 0.00 0.02 0.00 0.00 34.50 32.13 1a0g s PRO 109 CO 0.21 -0.73 0.03 0.08 -0.33 0.00 0.00 177.00 176.27 1a0g s VAL 110 N -1.60 4.20 -0.18 3.83 1.01 -0.95 -4.85 120.40 121.85 1a0g s VAL 110 Ca 0.68 -0.22 -0.03 0.00 0.00 0.00 0.00 61.98 62.40 1a0g s VAL 110 Cb -0.28 -2.92 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 1a0g s VAL 110 CO 0.33 0.40 -0.05 -0.63 0.00 0.00 0.00 175.10 175.15 1a0g s ILE 111 N 1.15 3.59 -0.06 2.22 1.01 -1.26 -1.60 121.20 126.26 1a0g s ILE 111 Ca 0.04 -0.45 0.04 0.00 0.00 0.00 0.00 60.65 60.28 1a0g s ILE 111 Cb -0.14 -2.59 -0.00 0.00 0.01 0.00 0.00 42.46 39.73 1a0g s ILE 111 CO 0.02 0.46 -0.18 -0.63 0.00 0.00 0.00 174.94 174.61 1a0g s ILE 112 N 0.85 1.53 -0.13 2.92 -1.09 -0.91 -0.61 121.20 123.76 1a0g s ILE 112 Ca -0.01 -0.76 -0.12 0.00 -2.23 0.00 0.00 60.65 57.53 1a0g s ILE 112 Cb -0.15 -1.32 0.03 0.00 -1.58 0.00 0.00 42.46 39.44 1a0g s ILE 112 CO 0.01 0.44 0.35 -0.83 -1.23 0.00 0.00 174.94 173.69 1a0g s GLY 113 N 0.15 -0.26 0.20 6.18 0.00 -0.48 -0.55 107.32 112.55 1a0g s GLY 113 Ca -0.07 0.97 -0.14 0.00 0.00 0.00 0.00 44.72 45.48 1a0g s GLY 113 CO 0.03 0.83 0.45 -2.52 0.00 0.00 0.00 173.10 171.89 1a0g s TYR 114 N 0.13 0.14 0.38 1.90 1.13 -0.09 -0.36 117.35 120.57 1a0g s TYR 114 Ca -0.01 -0.50 0.08 0.00 -1.41 0.00 0.00 57.07 55.24 1a0g s TYR 114 Cb -0.03 0.22 -0.04 0.00 -1.10 0.00 0.00 41.96 41.01 1a0g s TYR 114 CO 0.01 -0.88 0.18 0.95 -2.51 0.00 0.00 175.55 173.30 1a0g s THR 115 N -3.93 2.69 -0.25 -3.49 -4.23 -1.26 -0.50 115.64 104.67 1a0g s THR 115 Ca 0.14 -1.66 -0.11 0.00 -1.18 0.00 0.00 61.69 58.89 1a0g s THR 115 Cb 0.00 -2.98 0.10 0.00 1.34 0.00 0.00 72.50 70.96 1a0g s THR 115 CO 0.01 -0.09 0.57 -0.75 -0.54 0.00 0.00 174.62 173.82 1a0g s LYS 116 N -3.90 0.53 0.13 3.99 2.20 -0.59 -4.95 119.74 117.15 1a0g s LYS 116 Ca 0.40 1.19 -0.30 0.00 -0.36 0.00 0.00 55.97 56.90 1a0g s LYS 116 Cb -0.00 0.40 -0.07 0.00 -1.51 0.00 0.00 37.83 36.65 1a0g s LYS 116 CO 0.23 -0.19 1.27 -1.21 -0.36 0.00 0.00 175.35 175.09 1a0g s GLU 117 N 2.23 4.41 -0.30 4.03 0.41 -1.26 -1.15 118.70 127.07 1a0g s GLU 117 Ca -0.07 1.93 -0.06 0.00 -0.41 0.00 0.00 54.97 56.36 1a0g s GLU 117 Cb -0.09 -3.27 0.16 0.00 -1.78 0.00 0.00 34.13 29.15 1a0g s GLU 117 CO -0.17 -0.26 0.68 1.21 -0.49 0.00 0.00 175.26 176.23 1a0g s ASN 118 N 0.70 -1.18 0.75 -0.19 2.47 0.08 -4.89 114.94 112.68 1a0g s ASN 118 Ca 0.58 1.10 -0.12 0.00 0.42 0.00 0.00 52.86 54.85 1a0g s ASN 118 Cb -0.33 2.14 0.05 0.00 -1.45 0.00 0.00 41.25 41.65 1a0g s ASN 118 CO 0.33 -0.22 1.10 -2.16 -3.72 0.00 0.00 177.10 172.43 1a0g s PRO 119 N 2.85 2.33 0.56 0.43 0.04 -1.26 -3.38 135.00 136.56 1a0g s PRO 119 Ca 0.08 1.28 -0.21 0.00 0.04 0.00 0.00 61.00 62.18 1a0g s PRO 119 Cb -0.13 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 1a0g s PRO 119 CO -0.19 -1.60 1.31 1.03 0.04 0.00 0.00 177.00 177.58 1a0g s ARG 120 N -4.62 3.10 -1.50 4.56 0.52 -1.26 -4.86 118.95 114.89 1a0g s ARG 120 Ca 0.64 2.11 -0.11 0.00 -0.52 0.00 0.00 55.73 57.85 1a0g s ARG 120 Cb -0.19 -2.17 0.01 0.00 0.52 0.00 0.00 34.95 33.12 1a0g s ARG 120 CO 0.52 -1.18 2.53 -0.35 0.02 0.00 0.00 175.30 176.83 1a0g n PRO 121 N -1.16 3.52 -0.30 3.54 -0.04 -1.26 -4.72 135.00 134.57 1a0g n PRO 121 Ca 0.11 -2.64 0.04 0.00 -0.04 0.00 0.00 63.50 60.98 1a0g n PRO 121 Cb 0.46 -2.96 0.18 0.00 -0.04 0.00 0.00 33.50 31.15 1a0g n PRO 121 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1a0g h LEU 122 N 7.95 0.65 -0.94 1.53 3.38 -1.99 -0.90 115.31 124.98 1a0g h LEU 122 Ca 0.70 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.75 1a0g h LEU 122 Cb 0.44 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.08 1a0g h LEU 122 CO 1.77 0.35 0.62 -0.08 0.09 0.00 0.00 178.44 181.19 1a0g h GLU 123 N 0.76 1.20 0.02 1.13 4.81 -2.01 -2.38 114.58 118.11 1a0g h GLU 123 Ca 0.42 -0.07 -0.21 0.00 -0.13 0.00 0.00 59.36 59.37 1a0g h GLU 123 Cb 0.44 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1a0g h GLU 123 CO -0.28 0.79 -0.96 -0.91 -0.73 0.00 0.00 179.01 176.93 1a0g h ASN 124 N 1.23 0.13 0.41 1.04 2.35 -1.68 -1.77 115.58 117.30 1a0g h ASN 124 Ca 0.36 -0.12 -0.06 0.00 -0.55 0.00 0.00 56.30 55.93 1a0g h ASN 124 Cb -0.07 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 1a0g h ASN 124 CO -0.10 1.01 -0.30 -0.07 -1.65 0.00 0.00 177.43 176.32 1a0g h LEU 125 N 0.04 0.00 0.00 1.61 3.38 -0.85 -0.28 115.31 119.21 1a0g h LEU 125 Ca -0.04 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.76 1a0g h LEU 125 Cb 1.65 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.37 1a0g h LEU 125 CO 0.14 0.30 -1.02 -0.08 0.09 0.00 0.00 178.44 177.86 1a0g h GLU 126 N 0.00 0.00 0.03 1.13 4.81 -1.44 -3.42 114.58 115.68 1a0g h GLU 126 Ca -0.00 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.99 1a0g h GLU 126 Cb 0.58 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.94 1a0g h GLU 126 CO 0.04 0.85 -1.13 0.87 -0.73 0.00 0.00 179.01 178.91 1a0g h LYS 127 N -1.00 0.06 0.00 1.92 1.79 -1.38 -3.45 116.57 114.51 1a0g h LYS 127 Ca -0.27 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 1a0g h LYS 127 Cb 1.15 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1a0g h LYS 127 CO -0.16 1.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.62 1a0g n GLY 128 N 1.42 0.06 3.44 3.86 0.00 -0.12 -4.78 105.19 109.08 1a0g n GLY 128 Ca -0.04 -1.79 -0.23 0.00 0.00 0.00 0.00 46.02 43.97 1a0g n GLY 128 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1a0g s VAL 129 N -2.14 0.60 -0.04 1.61 -7.23 0.26 -4.85 120.40 108.61 1a0g s VAL 129 Ca 0.00 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.16 1a0g s VAL 129 Cb 0.00 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 1a0g s VAL 129 CO 0.00 0.00 0.02 -0.54 -0.31 0.00 0.00 175.10 174.27 1a0g s LYS 130 N -3.77 2.94 0.32 4.82 1.02 -1.26 -0.57 119.74 123.24 1a0g s LYS 130 Ca 0.30 -0.48 0.03 0.00 0.02 0.00 0.00 55.97 55.84 1a0g s LYS 130 Cb 0.04 -2.77 -0.05 0.00 -0.52 0.00 0.00 37.83 34.53 1a0g s LYS 130 CO 0.16 0.67 0.09 0.00 -0.92 0.00 0.00 175.35 175.35 1a0g s ALA 131 N -1.01 2.29 0.04 5.17 0.00 0.38 -0.27 121.76 128.36 1a0g s ALA 131 Ca 0.17 -1.81 -0.07 0.00 0.00 0.00 0.00 51.96 50.25 1a0g s ALA 131 Cb -0.12 0.82 -0.00 0.00 0.00 0.00 0.00 23.12 23.82 1a0g s ALA 131 CO 0.07 -0.37 0.14 -0.08 0.00 0.00 0.00 175.76 175.52 1a0g s THR 132 N -3.42 0.12 -0.09 0.00 -1.32 -1.06 -1.84 115.64 108.02 1a0g s THR 132 Ca 0.34 -0.98 -0.20 0.00 -1.21 0.00 0.00 61.69 59.64 1a0g s THR 132 Cb 0.07 -0.86 -0.04 0.00 -1.51 0.00 0.00 72.50 70.16 1a0g s THR 132 CO 0.15 -0.54 0.55 -0.36 -2.21 0.00 0.00 174.62 172.20 1a0g s PHE 133 N -2.48 3.55 -0.04 9.09 0.08 -1.26 -0.43 117.98 126.49 1a0g s PHE 133 Ca -0.06 1.01 0.02 0.00 0.12 0.00 0.00 56.93 58.02 1a0g s PHE 133 Cb -0.02 -2.62 0.01 0.00 -0.57 0.00 0.00 43.02 39.82 1a0g s PHE 133 CO -0.04 0.17 -0.09 0.08 -0.10 0.00 0.00 175.22 175.24 1a0g s VAL 134 N 0.59 0.82 0.27 -0.44 1.01 -0.36 -4.93 120.40 117.36 1a0g s VAL 134 Ca 0.30 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 61.65 1a0g s VAL 134 Cb -0.16 -0.76 -0.11 0.00 0.00 0.00 0.00 36.38 35.35 1a0g s VAL 134 CO 0.13 0.27 1.54 -0.70 0.00 0.00 0.00 175.10 176.35 1a0g s GLU 135 N 0.54 4.17 -0.53 2.72 2.12 -1.26 -2.30 118.70 124.16 1a0g s GLU 135 Ca -0.09 2.48 -0.25 0.00 0.36 0.00 0.00 54.97 57.47 1a0g s GLU 135 Cb -0.13 -3.06 0.04 0.00 0.26 0.00 0.00 34.13 31.24 1a0g s GLU 135 CO 0.01 -0.56 0.98 0.34 -0.54 0.00 0.00 175.26 175.49 1a0g s ASP 136 N 0.48 6.39 -0.19 -1.70 -1.08 -0.03 -4.74 116.67 115.80 1a0g s ASP 136 Ca 0.62 -0.17 0.16 0.00 -0.52 0.00 0.00 52.55 52.64 1a0g s ASP 136 Cb -0.46 -2.46 0.53 0.00 -1.46 0.00 0.00 42.92 39.07 1a0g s ASP 136 CO 0.46 -1.22 1.43 2.30 0.52 0.00 0.00 175.17 178.65 1a0g n ILE 137 N 6.32 2.31 -1.52 4.11 -5.35 -1.26 -4.74 119.36 119.23 1a0g n ILE 137 Ca 0.04 -1.93 -0.29 0.00 -0.27 0.00 0.00 62.75 60.29 1a0g n ILE 137 Cb 0.48 -0.26 0.17 0.00 -1.74 0.00 0.00 39.64 38.28 1a0g n ILE 137 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1a0g s ARG 138 N -2.86 0.54 1.08 6.28 0.52 -1.26 -5.04 118.95 118.21 1a0g s ARG 138 Ca 0.42 0.07 -0.16 0.00 -0.52 0.00 0.00 55.73 55.55 1a0g s ARG 138 Cb 0.35 -1.79 0.23 0.00 0.52 0.00 0.00 34.95 34.26 1a0g s ARG 138 CO 0.08 -2.56 1.12 1.67 0.02 0.00 0.00 175.30 175.63 1a0g s TRP 139 N -3.35 1.40 -1.20 -0.53 1.48 -1.26 -4.93 118.94 110.55 1a0g s TRP 139 Ca 0.67 0.70 0.06 0.00 -1.06 0.00 0.00 56.10 56.48 1a0g s TRP 139 Cb -0.11 -3.42 0.28 0.00 -1.16 0.00 0.00 33.47 29.06 1a0g s TRP 139 CO 0.54 -3.27 1.05 1.28 -4.06 0.00 0.00 176.95 172.48 1a0g n LEU 140 N -4.37 2.27 -2.69 -4.66 4.77 -1.26 -4.14 117.00 106.91 1a0g n LEU 140 Ca 0.09 -1.14 -0.21 0.00 -0.03 0.00 0.00 56.01 54.72 1a0g n LEU 140 Cb 0.59 -0.43 -0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1a0g n LEU 140 CO 0.51 0.38 0.05 0.54 -1.33 0.00 0.00 177.39 177.54 1a0g n ARG 141 N 0.25 2.48 0.03 3.23 5.12 -1.26 -4.67 116.66 121.84 1a0g n ARG 141 Ca 0.10 -4.09 0.06 0.00 -1.93 0.00 0.00 57.85 51.99 1a0g n ARG 141 Cb 0.46 -1.91 0.28 0.00 -1.16 0.00 0.00 32.46 30.14 1a0g n ARG 141 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1a0g h ASP 143 N 0.00 0.00 -3.45 0.00 2.03 -1.52 -3.16 116.42 110.32 1a0g h ASP 143 Ca 0.00 0.00 -0.60 0.00 -0.73 0.00 0.00 57.03 55.70 1a0g h ASP 143 Cb 0.20 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 38.60 1a0g h ASP 143 CO 0.00 0.00 -0.09 -0.63 -1.03 0.00 0.00 179.24 177.49 1a0g s ILE 144 N -3.40 5.14 -1.32 4.15 1.01 -0.87 -4.70 121.20 121.20 1a0g s ILE 144 Ca 0.04 0.90 -0.12 0.00 0.00 0.00 0.00 60.65 61.47 1a0g s ILE 144 Cb 0.09 -3.81 0.12 0.00 0.01 0.00 0.00 42.46 38.87 1a0g s ILE 144 CO 0.49 0.21 1.90 0.29 0.00 0.00 0.00 174.94 177.83 1a0g n LYS 145 N 4.56 3.32 -2.66 2.79 5.02 -1.26 -4.96 118.16 124.97 1a0g n LYS 145 Ca -0.06 -3.29 -0.21 0.00 -2.02 0.00 0.00 58.31 52.73 1a0g n LYS 145 Cb 0.51 -3.10 0.05 0.00 -0.02 0.00 0.00 35.03 32.47 1a0g n LYS 145 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1a0g s SER 146 N 2.16 5.08 0.00 4.39 1.04 -1.26 -1.99 113.70 123.11 1a0g s SER 146 Ca 0.44 -0.14 0.31 0.00 0.48 0.00 0.00 55.95 57.03 1a0g s SER 146 Cb 0.08 -0.62 1.76 0.00 0.10 0.00 0.00 66.02 67.34 1a0g s SER 146 CO -0.01 -1.30 2.14 0.18 0.98 0.00 0.00 173.24 175.23 1a0g n LEU 147 N -2.43 0.00 -4.56 2.42 4.77 -0.55 -4.52 117.00 112.14 1a0g n LEU 147 Ca 0.10 0.08 -0.40 0.00 -0.03 0.00 0.00 56.01 55.76 1a0g n LEU 147 Cb 0.60 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1a0g n LEU 147 CO 0.44 -0.00 1.50 0.20 -1.33 0.00 0.00 177.39 178.20 1a0g s ASN 148 N -2.17 6.45 -0.13 -1.43 0.02 -1.25 -4.71 114.94 111.72 1a0g s ASN 148 Ca 0.41 -1.47 0.18 0.00 -1.02 0.00 0.00 52.86 50.97 1a0g s ASN 148 Cb 0.21 -2.57 0.28 0.00 0.02 0.00 0.00 41.25 39.19 1a0g s ASN 148 CO 0.39 -1.56 1.14 0.18 0.02 0.00 0.00 177.10 177.27 1a0g n LEU 149 N 9.13 2.31 0.14 0.60 4.77 -1.26 -4.75 117.00 127.95 1a0g n LEU 149 Ca 0.34 -3.04 0.04 0.00 -0.03 0.00 0.00 56.01 53.33 1a0g n LEU 149 Cb 0.50 -0.41 0.46 0.00 -2.33 0.00 0.00 43.42 41.64 1a0g n LEU 149 CO 0.66 0.70 0.97 0.25 -1.33 0.00 0.00 177.39 178.64 1a0g h LEU 150 N 0.00 0.18 -0.43 2.23 5.85 -1.99 -0.62 115.31 120.54 1a0g h LEU 150 Ca 0.00 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 1a0g h LEU 150 Cb 1.00 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 1a0g h LEU 150 CO 0.00 0.27 0.01 1.23 -0.34 0.00 0.00 178.44 179.61 1a0g h GLY 151 N 0.53 0.81 1.81 3.75 0.00 -1.97 -2.09 103.07 105.91 1a0g h GLY 151 Ca 0.05 -0.59 -0.10 0.00 0.00 0.00 0.00 47.33 46.68 1a0g h GLY 151 CO 0.01 0.54 -0.41 0.00 0.00 0.00 0.00 176.54 176.67 1a0g h ALA 152 N 0.91 1.13 -0.33 3.60 0.00 -1.68 -2.22 119.26 120.67 1a0g h ALA 152 Ca 0.12 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1a0g h ALA 152 Cb 0.47 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1a0g h ALA 152 CO 0.02 0.58 0.09 0.28 0.00 0.00 0.00 179.25 180.22 1a0g h VAL 153 N 0.17 1.22 -0.18 0.00 2.07 -0.94 -0.43 116.25 118.16 1a0g h VAL 153 Ca 0.02 -0.72 -0.11 0.00 0.82 0.00 0.00 66.70 66.70 1a0g h VAL 153 Cb 0.81 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1a0g h VAL 153 CO 0.06 0.24 -0.37 -0.07 0.02 0.00 0.00 177.57 177.46 1a0g h LEU 154 N 0.37 0.39 -0.12 2.57 3.38 -1.24 -1.98 115.31 118.69 1a0g h LEU 154 Ca 0.10 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 1a0g h LEU 154 Cb 0.28 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1a0g h LEU 154 CO -0.00 0.73 -0.22 0.00 0.09 0.00 0.00 178.44 179.05 1a0g h ALA 155 N 1.29 0.19 -0.77 1.53 0.00 -1.27 -2.55 119.26 117.67 1a0g h ALA 155 Ca 0.03 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1a0g h ALA 155 Cb 0.80 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 1a0g h ALA 155 CO 0.06 0.14 0.48 -0.22 0.00 0.00 0.00 179.25 179.71 1a0g h LYS 156 N -0.06 1.05 -0.10 0.00 1.63 -1.00 -1.89 116.57 116.19 1a0g h LYS 156 Ca 0.01 -0.09 -0.08 0.00 -0.85 0.00 0.00 60.65 59.64 1a0g h LYS 156 Cb 0.79 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 32.19 1a0g h LYS 156 CO 0.05 0.73 -0.29 0.37 -3.45 0.00 0.00 179.45 176.86 1a0g h GLN 157 N 1.06 0.18 -0.34 1.90 5.75 -1.38 0.17 115.11 122.45 1a0g h GLN 157 Ca 0.28 -0.06 -0.13 0.00 -0.15 0.00 0.00 58.65 58.59 1a0g h GLN 157 Cb -0.06 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 1a0g h GLN 157 CO -0.05 0.46 -0.29 1.49 -2.65 0.00 0.00 178.83 177.78 1a0g h GLU 158 N 0.16 0.80 -0.20 1.69 4.81 -0.96 -0.74 114.58 120.14 1a0g h GLU 158 Ca 0.02 -0.41 -0.04 0.00 -0.13 0.00 0.00 59.36 58.81 1a0g h GLU 158 Cb 0.60 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.98 1a0g h GLU 158 CO 0.04 1.04 -0.03 0.00 -0.73 0.00 0.00 179.01 179.34 1a0g h ALA 159 N 0.75 0.27 -0.84 2.92 0.00 -1.13 -2.75 119.26 118.48 1a0g h ALA 159 Ca 0.06 -0.23 0.10 0.00 0.00 0.00 0.00 54.91 54.84 1a0g h ALA 159 Cb 0.87 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 1a0g h ALA 159 CO 0.08 0.02 0.55 1.25 0.00 0.00 0.00 179.25 181.14 1a0g h HIS 160 N 0.10 0.86 0.00 0.00 -0.00 -0.59 -0.29 115.15 115.23 1a0g h HIS 160 Ca 0.05 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.40 1a0g h HIS 160 Cb 0.45 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 27.57 1a0g h HIS 160 CO 0.04 0.40 -0.23 0.93 -0.00 0.00 0.00 177.93 179.08 1a0g h GLU 161 N 0.80 0.00 -0.59 5.26 5.08 -0.91 -2.76 114.58 121.45 1a0g h GLU 161 Ca 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 1a0g h GLU 161 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1a0g h GLU 161 CO -0.16 0.23 0.00 1.63 -1.00 0.00 0.00 179.01 179.71 1a0g n LYS 162 N -3.32 2.69 -0.98 2.33 5.02 -0.27 -4.90 118.16 118.73 1a0g n LYS 162 Ca 0.01 -2.10 0.00 0.00 -2.02 0.00 0.00 58.31 54.20 1a0g n LYS 162 Cb 0.47 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.89 1a0g n LYS 162 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1a0g n GLY 163 N 1.17 0.41 3.91 0.72 0.00 -1.04 -5.02 105.19 105.34 1a0g n GLY 163 Ca 0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 1a0g n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a0g h TYR 165 N 0.99 0.27 -3.42 0.00 3.20 -0.90 -3.29 116.97 113.82 1a0g h TYR 165 Ca -0.48 -0.19 -0.14 0.00 3.14 0.00 0.00 58.73 61.06 1a0g h TYR 165 Cb 1.20 -0.01 -0.20 0.00 1.54 0.00 0.00 36.73 39.26 1a0g h TYR 165 CO 0.57 1.27 -0.44 -2.00 -1.64 0.00 0.00 178.16 175.92 1a0g s GLU 166 N -2.62 0.54 -0.24 1.82 2.56 -1.24 -4.90 118.70 114.62 1a0g s GLU 166 Ca -0.08 -0.38 -0.09 0.00 0.00 0.00 0.00 54.97 54.41 1a0g s GLU 166 Cb 0.08 0.23 -0.04 0.00 2.00 0.00 0.00 34.13 36.39 1a0g s GLU 166 CO 0.83 -0.14 0.13 0.00 -0.56 0.00 0.00 175.26 175.53 1a0g s ALA 167 N -1.49 3.46 -0.25 6.30 0.00 -1.26 -2.56 121.76 125.95 1a0g s ALA 167 Ca -0.14 -0.97 -0.14 0.00 0.00 0.00 0.00 51.96 50.71 1a0g s ALA 167 Cb -0.06 -2.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 1a0g s ALA 167 CO 0.02 -0.29 0.35 0.42 0.00 0.00 0.00 175.76 176.25 1a0g s ILE 168 N 1.25 5.21 0.28 0.00 1.01 0.43 -1.86 121.20 127.52 1a0g s ILE 168 Ca 0.06 0.53 -0.08 0.00 0.00 0.00 0.00 60.65 61.17 1a0g s ILE 168 Cb -0.14 -3.67 -0.06 0.00 0.01 0.00 0.00 42.46 38.59 1a0g s ILE 168 CO 0.05 0.20 0.59 -0.76 0.00 0.00 0.00 174.94 175.02 1a0g s LEU 169 N 1.80 4.08 -0.09 2.97 1.43 -0.06 -1.22 118.68 127.59 1a0g s LEU 169 Ca 0.15 0.88 -0.08 0.00 -1.03 0.00 0.00 54.13 54.05 1a0g s LEU 169 Cb -0.15 -3.68 0.02 0.00 0.03 0.00 0.00 46.19 42.41 1a0g s LEU 169 CO 0.09 -0.17 0.23 -1.38 0.23 0.00 0.00 176.35 175.35 1a0g s HIS 170 N -2.00 -0.26 -0.41 0.29 -3.43 -0.97 -1.35 115.29 107.16 1a0g s HIS 170 Ca 0.47 0.63 -0.12 0.00 -0.80 0.00 0.00 55.06 55.24 1a0g s HIS 170 Cb -0.11 0.08 0.05 0.00 -1.43 0.00 0.00 32.58 31.17 1a0g s HIS 170 CO 0.26 -0.13 0.27 1.03 -2.00 0.00 0.00 174.74 174.16 1a0g s ARG 171 N 0.19 2.81 -1.27 -0.38 1.81 0.16 -0.85 118.95 121.42 1a0g s ARG 171 Ca -0.01 -1.22 -0.08 0.00 -1.72 0.00 0.00 55.73 52.70 1a0g s ARG 171 Cb -0.02 -3.85 -0.01 0.00 -0.45 0.00 0.00 34.95 30.62 1a0g s ARG 171 CO -0.00 -0.83 0.65 0.09 -0.68 0.00 0.00 175.30 174.52 1a0g n ASN 172 N 5.04 -2.64 0.00 0.23 3.02 -1.26 -1.59 115.26 118.05 1a0g n ASN 172 Ca -0.11 -0.96 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 1a0g n ASN 172 Cb 0.45 -3.49 0.00 0.00 -0.61 0.00 0.00 39.78 36.13 1a0g n ASN 172 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1a0g n ASN 173 N -2.89 0.00 -4.64 6.41 3.02 -1.26 -4.98 115.26 110.92 1a0g n ASN 173 Ca -0.22 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 53.92 1a0g n ASN 173 Cb 0.65 -0.70 -0.05 0.00 -0.61 0.00 0.00 39.78 39.07 1a0g n ASN 173 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1a0g s THR 174 N -2.31 4.92 0.22 3.41 2.01 -0.62 -0.83 115.64 122.43 1a0g s THR 174 Ca 0.00 1.37 -0.30 0.00 0.31 0.00 0.00 61.69 63.07 1a0g s THR 174 Cb 0.00 -4.03 -0.10 0.00 0.01 0.00 0.00 72.50 68.38 1a0g s THR 174 CO 0.00 0.00 1.41 -0.69 -0.69 0.00 0.00 174.62 174.66 1a0g s VAL 175 N 2.49 2.85 0.00 3.82 1.01 0.21 -0.66 120.40 130.12 1a0g s VAL 175 Ca 0.31 0.69 0.00 0.00 0.00 0.00 0.00 61.98 62.99 1a0g s VAL 175 Cb -0.16 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1a0g s VAL 175 CO 0.09 0.10 0.00 0.35 0.00 0.00 0.00 175.10 175.64 1a0g n THR 176 N 2.71 0.00 -3.37 3.92 -2.24 -0.45 -4.50 114.28 110.34 1a0g n THR 176 Ca 0.08 0.11 -0.03 0.00 -2.27 0.00 0.00 64.05 61.94 1a0g n THR 176 Cb 0.41 -1.00 0.00 0.00 -2.10 0.00 0.00 70.33 67.64 1a0g n THR 176 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1a0g n GLU 177 N -1.74 0.22 -3.05 -0.78 0.28 -1.26 -4.53 120.64 109.79 1a0g n GLU 177 Ca 0.00 -0.56 -0.20 0.00 -0.16 0.00 0.00 57.16 56.25 1a0g n GLU 177 Cb 0.00 0.62 0.06 0.00 1.43 0.00 0.00 31.44 33.56 1a0g n GLU 177 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1a0g s GLY 178 N -1.48 1.73 0.50 -1.84 0.00 0.14 -0.88 107.32 105.49 1a0g s GLY 178 Ca 0.05 -2.16 0.19 0.00 0.00 0.00 0.00 44.72 42.80 1a0g s GLY 178 CO 0.03 -1.70 2.09 1.48 0.00 0.00 0.00 173.10 175.00 1a0g h SER 179 N 0.16 0.00 0.00 1.64 4.64 -1.72 -3.23 113.55 115.04 1a0g h SER 179 Ca -0.29 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.88 1a0g h SER 179 Cb 1.29 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 63.10 1a0g h SER 179 CO 0.41 0.09 -0.76 -1.54 -0.87 0.00 0.00 176.83 174.17 1a0g n SER 180 N -4.21 0.33 -3.71 4.97 3.41 -1.26 -4.80 113.62 108.34 1a0g n SER 180 Ca -0.03 -1.97 -0.09 0.00 -0.26 0.00 0.00 58.87 56.53 1a0g n SER 180 Cb 0.18 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 63.99 1a0g n SER 180 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1a0g s SER 181 N -1.58 -0.07 0.06 4.04 1.04 -1.22 -4.71 113.70 111.25 1a0g s SER 181 Ca 0.21 -0.87 0.03 0.00 0.48 0.00 0.00 55.95 55.79 1a0g s SER 181 Cb 0.24 0.69 -0.04 0.00 0.10 0.00 0.00 66.02 67.02 1a0g s SER 181 CO -0.10 -1.33 0.05 0.20 0.98 0.00 0.00 173.24 173.04 1a0g s ASN 182 N -3.00 5.40 -0.11 7.02 -0.87 -0.23 0.27 114.94 123.42 1a0g s ASN 182 Ca 0.17 -0.02 -0.02 0.00 -1.57 0.00 0.00 52.86 51.43 1a0g s ASN 182 Cb -0.04 -1.43 -0.03 0.00 -0.02 0.00 0.00 41.25 39.73 1a0g s ASN 182 CO 0.09 0.20 -0.04 -0.69 -2.57 0.00 0.00 177.10 174.10 1a0g s VAL 183 N -1.30 3.94 0.01 1.60 1.01 -1.26 -1.09 120.40 123.31 1a0g s VAL 183 Ca 0.26 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 61.93 1a0g s VAL 183 Cb -0.12 -2.67 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 1a0g s VAL 183 CO 0.18 0.56 -0.17 -0.36 0.00 0.00 0.00 175.10 175.31 1a0g s PHE 184 N -0.37 1.52 0.05 5.22 0.40 0.23 -4.46 117.98 120.57 1a0g s PHE 184 Ca 0.06 -0.32 0.07 0.00 -0.60 0.00 0.00 56.93 56.14 1a0g s PHE 184 Cb -0.12 -0.94 -0.02 0.00 0.51 0.00 0.00 43.02 42.44 1a0g s PHE 184 CO 0.02 0.02 -0.19 0.20 0.70 0.00 0.00 175.22 175.96 1a0g s GLY 185 N -0.74 1.06 -0.10 4.36 0.00 0.41 -1.55 107.32 110.76 1a0g s GLY 185 Ca 0.06 -1.02 0.03 0.00 0.00 0.00 0.00 44.72 43.78 1a0g s GLY 185 CO 0.00 -0.96 -0.19 -0.42 0.00 0.00 0.00 173.10 171.53 1a0g s ILE 186 N -0.83 1.73 -0.05 0.90 1.01 0.96 0.35 121.20 125.27 1a0g s ILE 186 Ca 0.06 -0.81 -0.02 0.00 0.00 0.00 0.00 60.65 59.89 1a0g s ILE 186 Cb -0.09 -1.53 0.03 0.00 0.01 0.00 0.00 42.46 40.88 1a0g s ILE 186 CO 0.02 0.49 0.04 -0.75 0.00 0.00 0.00 174.94 174.73 1a0g s LYS 187 N 0.64 0.15 -1.49 2.79 2.47 -0.83 -0.46 119.74 123.00 1a0g s LYS 187 Ca -0.13 0.29 -0.11 0.00 -1.56 0.00 0.00 55.97 54.45 1a0g s LYS 187 Cb -0.16 -0.66 0.07 0.00 -1.46 0.00 0.00 37.83 35.62 1a0g s LYS 187 CO 0.04 -0.32 0.95 -0.25 0.16 0.00 0.00 175.35 175.93 1a0g n ASP 188 N 5.24 -4.33 -0.03 1.43 8.00 -1.26 -1.52 116.55 124.08 1a0g n ASP 188 Ca -0.05 -0.77 -0.00 0.00 0.71 0.00 0.00 54.79 54.68 1a0g n ASP 188 Cb 0.50 -3.98 -0.00 0.00 -0.02 0.00 0.00 41.12 37.62 1a0g n ASP 188 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a0g n GLY 189 N -1.70 0.39 3.50 0.44 0.00 -1.26 -5.00 105.19 101.55 1a0g n GLY 189 Ca -0.01 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1a0g n GLY 189 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a0g s ILE 190 N -1.75 3.81 -0.20 -0.61 1.01 -0.58 -4.13 121.20 118.76 1a0g s ILE 190 Ca 0.00 -0.39 -0.19 0.00 0.00 0.00 0.00 60.65 60.07 1a0g s ILE 190 Cb 0.00 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.79 1a0g s ILE 190 CO 0.00 0.51 0.55 -0.22 0.00 0.00 0.00 174.94 175.78 1a0g s LEU 191 N 0.22 4.15 -0.04 2.97 2.96 0.32 -1.97 118.68 127.29 1a0g s LEU 191 Ca -0.03 0.72 0.05 0.00 -0.22 0.00 0.00 54.13 54.65 1a0g s LEU 191 Cb -0.14 -2.76 -0.02 0.00 0.50 0.00 0.00 46.19 43.77 1a0g s LEU 191 CO 0.03 -0.20 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.37 1a0g s TYR 192 N 1.69 2.58 -0.23 5.38 2.02 0.15 0.34 117.35 129.29 1a0g s TYR 192 Ca 0.25 -0.26 -0.26 0.00 -0.37 0.00 0.00 57.07 56.43 1a0g s TYR 192 Cb -0.16 -1.59 0.08 0.00 -0.40 0.00 0.00 41.96 39.90 1a0g s TYR 192 CO 0.10 0.10 0.78 -0.08 -1.57 0.00 0.00 175.55 174.88 1a0g s THR 193 N -0.67 0.00 0.29 -0.71 -1.32 -1.01 -0.45 115.64 111.78 1a0g s THR 193 Ca 0.10 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.29 1a0g s THR 193 Cb -0.11 -1.00 -0.13 0.00 -1.51 0.00 0.00 72.50 69.76 1a0g s THR 193 CO 0.00 0.00 1.35 1.57 -2.21 0.00 0.00 174.62 175.33 1a0g n HIS 194 N 2.20 2.23 -1.05 9.09 -0.00 -1.26 -2.05 115.22 124.39 1a0g n HIS 194 Ca -0.14 0.49 -0.31 0.00 0.46 0.00 0.00 57.72 58.21 1a0g n HIS 194 Cb 0.56 -2.44 0.12 0.00 -0.12 0.00 0.00 29.99 28.11 1a0g n HIS 194 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 1a0g s PRO 195 N -1.14 1.73 -1.28 1.57 0.04 -1.26 -4.85 135.00 129.81 1a0g s PRO 195 Ca 0.62 1.39 -0.17 0.00 0.04 0.00 0.00 61.00 62.87 1a0g s PRO 195 Cb -0.60 -1.82 0.10 0.00 0.04 0.00 0.00 34.50 32.21 1a0g s PRO 195 CO 0.56 -2.07 1.67 0.00 0.04 0.00 0.00 177.00 177.19 1a0g n ALA 196 N -3.73 3.65 -2.97 8.56 0.00 -1.26 -4.73 120.51 120.03 1a0g n ALA 196 Ca 0.11 -3.95 0.00 0.00 0.00 0.00 0.00 53.44 49.60 1a0g n ALA 196 Cb 0.52 -3.47 0.00 0.00 0.00 0.00 0.00 19.45 16.51 1a0g n ALA 196 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1a0g n ASN 197 N 7.68 1.89 0.00 0.00 0.23 -1.26 -4.99 115.26 118.81 1a0g n ASN 197 Ca 0.46 -0.02 0.04 0.00 -0.53 0.00 0.00 54.58 54.53 1a0g n ASN 197 Cb 0.45 0.00 0.17 0.00 -2.08 0.00 0.00 39.78 38.32 1a0g n ASN 197 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1a0g n ASN 198 N -0.02 0.00 0.11 0.53 6.94 -1.26 -2.78 115.26 118.78 1a0g n ASN 198 Ca 0.00 0.44 0.12 0.00 -0.02 0.00 0.00 54.58 55.12 1a0g n ASN 198 Cb 0.00 -0.46 0.24 0.00 -2.36 0.00 0.00 39.78 37.20 1a0g n ASN 198 CO 0.00 0.00 0.00 0.24 -1.03 0.00 0.00 177.26 176.47 1a0g h MET 199 N 0.00 0.00 -4.41 -3.83 2.86 -1.90 0.21 114.93 107.86 1a0g h MET 199 Ca 0.00 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.44 1a0g h MET 199 Cb 0.12 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 31.64 1a0g h MET 199 CO 0.00 0.00 -0.54 0.96 1.06 0.00 0.00 176.91 178.39 1a0g s ILE 200 N -3.17 0.02 0.10 -1.22 -4.36 -1.12 -4.75 121.20 106.71 1a0g s ILE 200 Ca 0.07 -1.88 -0.23 0.00 -0.26 0.00 0.00 60.65 58.35 1a0g s ILE 200 Cb 0.11 -2.36 -0.07 0.00 1.25 0.00 0.00 42.46 41.39 1a0g s ILE 200 CO 0.67 -0.09 0.71 0.00 0.24 0.00 0.00 174.94 176.48 1a0g s ALA 201 N -4.11 3.47 -1.19 2.27 0.00 -1.20 -2.93 121.76 118.07 1a0g s ALA 201 Ca 0.33 0.24 -0.17 0.00 0.00 0.00 0.00 51.96 52.36 1a0g s ALA 201 Cb 0.06 -2.87 0.11 0.00 0.00 0.00 0.00 23.12 20.43 1a0g s ALA 201 CO 0.09 0.26 1.52 0.21 0.00 0.00 0.00 175.76 177.85 1a0g s LYS 202 N -0.84 3.94 0.44 0.00 2.20 -1.26 -4.98 119.74 119.24 1a0g s LYS 202 Ca 0.34 -2.10 -0.24 0.00 -0.36 0.00 0.00 55.97 53.61 1a0g s LYS 202 Cb -0.21 -5.27 -0.10 0.00 -1.51 0.00 0.00 37.83 30.74 1a0g s LYS 202 CO 0.23 -2.01 1.14 0.41 -0.36 0.00 0.00 175.35 174.76 1a0g n GLY 203 N 5.08 0.17 0.17 5.54 0.00 -1.26 -4.92 105.19 109.97 1a0g n GLY 203 Ca 0.40 0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.43 1a0g n GLY 203 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1a0g h ILE 204 N 1.71 1.39 -0.46 -0.61 2.04 -1.98 -2.62 117.51 116.98 1a0g h ILE 204 Ca -0.46 -2.33 -0.10 0.00 1.00 0.00 0.00 64.86 62.96 1a0g h ILE 204 Cb 1.32 2.31 -0.02 0.00 -0.74 0.00 0.00 36.82 39.69 1a0g h ILE 204 CO 0.58 0.70 -0.12 0.74 0.00 0.00 0.00 178.15 180.05 1a0g h THR 205 N 0.26 1.26 -0.34 -0.27 2.02 -1.91 -1.45 112.91 112.48 1a0g h THR 205 Ca -0.06 -1.22 0.04 0.00 0.77 0.00 0.00 66.41 65.94 1a0g h THR 205 Cb 1.49 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 68.90 1a0g h THR 205 CO 0.15 0.42 0.11 -0.09 0.37 0.00 0.00 175.52 176.49 1a0g h ARG 206 N 0.77 0.25 -0.07 6.66 2.43 -1.87 0.19 114.38 122.73 1a0g h ARG 206 Ca 0.12 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.18 1a0g h ARG 206 Cb 0.63 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1a0g h ARG 206 CO 0.04 0.16 -0.42 -0.44 -1.51 0.00 0.00 179.97 177.81 1a0g h ASP 207 N 0.26 0.16 -0.39 -3.80 3.32 -1.17 -1.67 116.42 113.12 1a0g h ASP 207 Ca 0.15 -0.07 -0.12 0.00 0.02 0.00 0.00 57.03 57.01 1a0g h ASP 207 Cb 0.13 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1a0g h ASP 207 CO -0.16 0.57 -0.24 0.58 -1.72 0.00 0.00 179.24 178.27 1a0g h VAL 208 N 0.13 1.28 -0.73 -1.35 2.07 -0.65 -2.14 116.25 114.86 1a0g h VAL 208 Ca 0.01 -1.39 -0.06 0.00 0.82 0.00 0.00 66.70 66.08 1a0g h VAL 208 Cb 0.80 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1a0g h VAL 208 CO 0.06 0.46 0.23 0.58 0.02 0.00 0.00 177.57 178.93 1a0g h VAL 209 N 0.66 1.26 -0.26 2.57 2.07 -0.70 -0.01 116.25 121.84 1a0g h VAL 209 Ca 0.08 -0.90 -0.09 0.00 0.82 0.00 0.00 66.70 66.61 1a0g h VAL 209 Cb 0.81 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1a0g h VAL 209 CO 0.07 0.36 -0.22 0.40 0.02 0.00 0.00 177.57 178.20 1a0g h ILE 210 N 1.09 1.26 -0.35 4.57 2.04 -1.28 -0.31 117.51 124.51 1a0g h ILE 210 Ca 0.24 -1.20 -0.15 0.00 1.00 0.00 0.00 64.86 64.75 1a0g h ILE 210 Cb 0.31 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 1a0g h ILE 210 CO -0.01 0.38 -0.37 0.00 0.00 0.00 0.00 178.15 178.15 1a0g h ALA 211 N 1.33 0.67 -0.72 1.87 0.00 -0.84 -1.78 119.26 119.79 1a0g h ALA 211 Ca 0.07 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1a0g h ALA 211 Cb 0.62 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1a0g h ALA 211 CO 0.04 0.67 0.31 0.00 0.00 0.00 0.00 179.25 180.28 1a0g h ALA 213 N 1.15 0.39 -0.60 0.00 0.00 -0.88 -1.32 119.26 117.99 1a0g h ALA 213 Ca 0.24 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1a0g h ALA 213 Cb 0.17 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1a0g h ALA 213 CO -0.02 -0.07 0.34 -0.91 0.00 0.00 0.00 179.25 178.59 1a0g h ASN 214 N 0.36 0.73 -0.64 0.00 2.35 -1.07 -0.45 115.58 116.85 1a0g h ASN 214 Ca 0.10 -0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.72 1a0g h ASN 214 Cb 0.09 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 1a0g h ASN 214 CO -0.01 0.58 0.07 -0.33 -1.65 0.00 0.00 177.43 176.08 1a0g h GLU 215 N 0.84 1.09 -0.81 0.81 5.08 -0.56 -2.64 114.58 118.39 1a0g h GLU 215 Ca 0.22 -0.31 -0.18 0.00 -1.00 0.00 0.00 59.36 58.09 1a0g h GLU 215 Cb 0.00 -0.12 -0.11 0.00 0.50 0.00 0.00 28.75 29.03 1a0g h GLU 215 CO -0.04 1.02 0.23 0.44 -1.00 0.00 0.00 179.01 179.66 1a0g n ILE 216 N -4.20 2.48 -2.83 3.13 -5.35 -0.56 -4.93 119.36 107.09 1a0g n ILE 216 Ca 0.04 -1.31 -0.17 0.00 -0.27 0.00 0.00 62.75 61.04 1a0g n ILE 216 Cb 0.31 -0.43 -0.00 0.00 -1.74 0.00 0.00 39.64 37.78 1a0g n ILE 216 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1a0g n ASN 217 N -0.07 -3.98 -4.68 7.28 3.02 -0.84 -4.97 115.26 111.03 1a0g n ASN 217 Ca 0.34 -0.06 -0.39 0.00 -0.03 0.00 0.00 54.58 54.44 1a0g n ASN 217 Cb 1.21 -3.33 -0.06 0.00 -0.61 0.00 0.00 39.78 36.98 1a0g n ASN 217 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1a0g s MET 218 N -5.45 4.26 0.26 3.52 -2.45 -0.24 -5.02 119.30 114.18 1a0g s MET 218 Ca 0.17 0.50 -0.30 0.00 -1.25 0.00 0.00 55.69 54.82 1a0g s MET 218 Cb -0.09 -3.52 -0.11 0.00 1.25 0.00 0.00 34.83 32.36 1a0g s MET 218 CO 0.21 -0.06 1.52 -2.14 1.05 0.00 0.00 175.02 175.60 1a0g s PRO 219 N 1.34 4.19 -0.15 4.11 0.02 -1.26 -4.28 135.00 138.98 1a0g s PRO 219 Ca 0.27 2.44 0.02 0.00 0.02 0.00 0.00 61.00 63.74 1a0g s PRO 219 Cb -0.16 -3.07 0.01 0.00 0.02 0.00 0.00 34.50 31.30 1a0g s PRO 219 CO 0.11 -0.54 -0.19 0.08 -0.33 0.00 0.00 177.00 176.13 1a0g s VAL 220 N 0.08 2.32 -0.20 3.83 1.01 -1.26 -0.52 120.40 125.66 1a0g s VAL 220 Ca 0.62 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1a0g s VAL 220 Cb -0.45 -1.95 0.03 0.00 0.00 0.00 0.00 36.38 34.01 1a0g s VAL 220 CO 0.44 0.53 -0.17 -0.54 0.00 0.00 0.00 175.10 175.37 1a0g s LYS 221 N 0.83 2.81 -1.16 2.72 1.02 0.15 -4.94 119.74 121.17 1a0g s LYS 221 Ca -0.06 -0.95 -0.13 0.00 0.02 0.00 0.00 55.97 54.84 1a0g s LYS 221 Cb -0.15 -2.66 0.19 0.00 -0.52 0.00 0.00 37.83 34.69 1a0g s LYS 221 CO -0.01 -0.30 1.32 -1.21 -0.92 0.00 0.00 175.35 174.23 1a0g s GLU 222 N 1.25 4.06 -0.01 1.68 2.02 -1.26 -2.40 118.70 124.04 1a0g s GLU 222 Ca 0.02 -2.65 0.01 0.00 0.02 0.00 0.00 54.97 52.36 1a0g s GLU 222 Cb -0.15 -4.93 0.01 0.00 0.10 0.00 0.00 34.13 29.16 1a0g s GLU 222 CO -0.11 -1.64 -0.03 0.42 0.02 0.00 0.00 175.26 173.92 1a0g s ILE 223 N 1.02 0.28 0.56 -1.63 1.01 -0.87 -4.33 121.20 117.25 1a0g s ILE 223 Ca 0.39 -0.09 -0.19 0.00 0.00 0.00 0.00 60.65 60.76 1a0g s ILE 223 Cb -0.05 -0.28 -0.05 0.00 0.01 0.00 0.00 42.46 42.09 1a0g s ILE 223 CO -0.03 0.11 1.15 -2.84 0.00 0.00 0.00 174.94 173.33 1a0g s PRO 224 N 0.30 3.22 0.08 2.79 0.02 -1.26 -4.00 135.00 136.15 1a0g s PRO 224 Ca -0.03 1.65 0.05 0.00 0.02 0.00 0.00 61.00 62.69 1a0g s PRO 224 Cb -0.06 -1.98 -0.03 0.00 0.02 0.00 0.00 34.50 32.45 1a0g s PRO 224 CO -0.01 -0.97 -0.13 -0.59 -0.33 0.00 0.00 177.00 174.97 1a0g s PHE 225 N -1.77 1.17 0.79 6.54 -0.12 -1.26 -5.00 117.98 118.33 1a0g s PHE 225 Ca 0.74 -0.50 -0.12 0.00 -0.05 0.00 0.00 56.93 57.00 1a0g s PHE 225 Cb -0.25 -0.65 0.07 0.00 -0.63 0.00 0.00 43.02 41.55 1a0g s PHE 225 CO 0.29 0.05 1.16 0.95 -0.05 0.00 0.00 175.22 177.62 1a0g s THR 226 N -1.51 2.25 0.33 -4.49 -4.23 -1.26 -0.62 115.64 106.11 1a0g s THR 226 Ca -0.01 0.06 0.03 0.00 -1.18 0.00 0.00 61.69 60.59 1a0g s THR 226 Cb -0.09 -3.07 0.17 0.00 1.34 0.00 0.00 72.50 70.85 1a0g s THR 226 CO 0.02 -0.10 1.88 0.71 -0.54 0.00 0.00 174.62 176.60 1a0g h THR 227 N -0.97 1.20 -0.10 3.99 1.35 -1.34 -0.01 112.91 117.03 1a0g h THR 227 Ca -0.46 -0.72 -0.20 0.00 -0.55 0.00 0.00 66.41 64.48 1a0g h THR 227 Cb 1.32 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.54 1a0g h THR 227 CO 0.65 0.26 -0.77 0.45 -0.25 0.00 0.00 175.52 175.86 1a0g h HIS 228 N 0.61 0.77 -0.26 4.73 3.86 -1.93 -2.63 115.15 120.29 1a0g h HIS 228 Ca 0.14 -0.35 -0.13 0.00 -1.16 0.00 0.00 60.37 58.87 1a0g h HIS 228 Cb 0.27 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 1a0g h HIS 228 CO 0.01 1.14 -0.37 0.93 0.86 0.00 0.00 177.93 180.50 1a0g h GLU 229 N 0.38 0.60 -0.82 2.45 5.08 -1.79 -2.95 114.58 117.53 1a0g h GLU 229 Ca -0.05 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.01 1a0g h GLU 229 Cb 1.37 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.58 1a0g h GLU 229 CO 0.14 0.88 0.44 0.00 -1.00 0.00 0.00 179.01 179.48 1a0g h ALA 230 N 1.09 1.05 0.00 3.43 0.00 -0.89 -0.76 119.26 123.17 1a0g h ALA 230 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1a0g h ALA 230 Cb 0.87 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1a0g h ALA 230 CO 0.08 0.56 0.00 1.28 0.00 0.00 0.00 179.25 181.17 1a0g n LEU 231 N -4.40 0.54 -1.14 0.00 4.77 -1.00 -1.59 117.00 114.18 1a0g n LEU 231 Ca 0.08 0.68 0.08 0.00 -0.03 0.00 0.00 56.01 56.82 1a0g n LEU 231 Cb 0.10 -0.66 0.27 0.00 -2.33 0.00 0.00 43.42 40.80 1a0g n LEU 231 CO 0.38 -0.68 0.74 0.29 -1.33 0.00 0.00 177.39 176.79 1a0g n LYS 232 N -2.15 3.21 -2.22 3.23 5.02 -0.31 -4.73 118.16 120.22 1a0g n LYS 232 Ca 0.01 -2.60 -0.32 0.00 -2.02 0.00 0.00 58.31 53.38 1a0g n LYS 232 Cb 0.14 -1.65 -0.02 0.00 -0.02 0.00 0.00 35.03 33.48 1a0g n LYS 232 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1a0g s MET 233 N -1.66 3.83 0.05 1.97 -1.94 -0.62 -4.98 119.30 115.94 1a0g s MET 233 Ca 0.41 0.89 -0.16 0.00 -1.71 0.00 0.00 55.69 55.12 1a0g s MET 233 Cb 0.26 -2.12 -0.24 0.00 2.01 0.00 0.00 34.83 34.74 1a0g s MET 233 CO 0.20 -0.37 1.15 -0.44 -0.01 0.00 0.00 175.02 175.55 1a0g h ASP 234 N 0.51 0.79 -5.13 3.03 3.32 -1.10 -3.36 116.42 114.47 1a0g h ASP 234 Ca -0.46 -0.76 -0.13 0.00 0.02 0.00 0.00 57.03 55.70 1a0g h ASP 234 Cb 1.19 -0.24 -0.17 0.00 0.22 0.00 0.00 39.33 40.32 1a0g h ASP 234 CO 0.62 1.44 -0.62 -1.61 -1.72 0.00 0.00 179.24 177.35 1a0g s GLU 235 N -3.24 0.55 -0.09 3.56 2.02 -0.76 -4.50 118.70 116.22 1a0g s GLU 235 Ca -0.11 -0.92 -0.13 0.00 0.02 0.00 0.00 54.97 53.83 1a0g s GLU 235 Cb 0.06 0.20 0.03 0.00 0.10 0.00 0.00 34.13 34.52 1a0g s GLU 235 CO 0.89 -0.12 0.33 -1.17 0.02 0.00 0.00 175.26 175.22 1a0g s LEU 236 N -2.34 0.74 0.12 1.80 2.96 -1.26 -0.02 118.68 120.68 1a0g s LEU 236 Ca -0.02 0.49 -0.23 0.00 -0.22 0.00 0.00 54.13 54.16 1a0g s LEU 236 Cb 0.01 1.21 0.06 0.00 0.50 0.00 0.00 46.19 47.97 1a0g s LEU 236 CO -0.06 -0.23 0.56 0.72 -1.32 0.00 0.00 176.35 176.03 1a0g s PHE 237 N -0.31 -0.48 0.15 5.38 -0.12 -0.60 -1.07 117.98 120.94 1a0g s PHE 237 Ca -0.04 0.35 0.10 0.00 -0.05 0.00 0.00 56.93 57.29 1a0g s PHE 237 Cb -0.03 0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 1a0g s PHE 237 CO 0.02 -0.78 -0.21 0.14 -0.05 0.00 0.00 175.22 174.34 1a0g s VAL 238 N -3.35 2.57 0.05 -2.49 -7.23 -0.22 -0.60 120.40 109.13 1a0g s VAL 238 Ca -0.01 -1.75 0.06 0.00 -1.81 0.00 0.00 61.98 58.47 1a0g s VAL 238 Cb -0.00 -2.20 -0.02 0.00 0.56 0.00 0.00 36.38 34.72 1a0g s VAL 238 CO -0.09 0.01 -0.17 0.42 -0.31 0.00 0.00 175.10 174.95 1a0g s THR 239 N -1.34 1.38 -0.03 5.32 -4.23 -0.25 -1.34 115.64 115.15 1a0g s THR 239 Ca 0.18 -1.13 -0.29 0.00 -1.18 0.00 0.00 61.69 59.27 1a0g s THR 239 Cb -0.09 -1.23 0.10 0.00 1.34 0.00 0.00 72.50 72.62 1a0g s THR 239 CO 0.09 0.07 0.88 -0.94 -0.54 0.00 0.00 174.62 174.19 1a0g s SER 240 N -1.23 -0.39 0.39 3.99 1.04 -1.16 -1.06 113.70 115.28 1a0g s SER 240 Ca 0.04 0.12 0.17 0.00 0.48 0.00 0.00 55.95 56.75 1a0g s SER 240 Cb -0.08 0.39 1.05 0.00 0.10 0.00 0.00 66.02 67.47 1a0g s SER 240 CO 0.02 -0.58 1.81 0.74 0.98 0.00 0.00 173.24 176.20 1a0g h THR 241 N 2.16 0.61 0.00 2.02 2.02 -1.89 0.51 112.91 118.34 1a0g h THR 241 Ca -0.22 -0.15 -0.22 0.00 0.77 0.00 0.00 66.41 66.58 1a0g h THR 241 Cb 1.22 0.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.72 1a0g h THR 241 CO 0.32 0.08 -1.72 0.35 0.37 0.00 0.00 175.52 174.92 1a0g n THR 242 N -4.59 1.23 0.37 3.16 -2.24 -1.26 -4.20 114.28 106.75 1a0g n THR 242 Ca 0.23 -0.73 0.12 0.00 -2.27 0.00 0.00 64.05 61.39 1a0g n THR 242 Cb 0.77 -0.70 0.12 0.00 -2.10 0.00 0.00 70.33 68.42 1a0g n THR 242 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1a0g h SER 243 N 0.00 0.00 0.00 3.42 0.02 -1.80 -3.42 113.55 111.77 1a0g h SER 243 Ca -0.25 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1a0g h SER 243 Cb 1.77 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.31 1a0g h SER 243 CO 0.05 0.05 0.00 -0.62 -1.14 0.00 0.00 176.83 175.17 1a0g n GLU 244 N -2.43 0.00 -3.72 3.45 1.02 0.17 -3.36 120.64 115.76 1a0g n GLU 244 Ca 0.02 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.80 1a0g n GLU 244 Cb 0.49 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.81 1a0g n GLU 244 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1a0g s ILE 245 N 0.00 3.64 -0.30 -3.67 1.01 -1.26 -2.97 121.20 117.64 1a0g s ILE 245 Ca 0.00 -2.60 -0.12 0.00 0.00 0.00 0.00 60.65 57.93 1a0g s ILE 245 Cb 0.00 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 1a0g s ILE 245 CO 0.00 -0.82 0.21 -0.89 0.00 0.00 0.00 174.94 173.44 1a0g s THR 246 N 0.40 5.26 0.27 2.92 2.01 -0.45 -4.77 115.64 121.28 1a0g s THR 246 Ca 0.14 -0.00 -0.29 0.00 0.31 0.00 0.00 61.69 61.84 1a0g s THR 246 Cb -0.21 -3.59 -0.10 0.00 0.01 0.00 0.00 72.50 68.62 1a0g s THR 246 CO -0.04 0.15 1.27 -2.84 -0.69 0.00 0.00 174.62 172.47 1a0g s PRO 247 N 1.74 4.42 -0.26 4.92 0.02 -1.26 -1.05 135.00 143.52 1a0g s PRO 247 Ca 0.07 2.08 -0.05 0.00 0.02 0.00 0.00 61.00 63.11 1a0g s PRO 247 Cb -0.17 -3.14 0.01 0.00 0.02 0.00 0.00 34.50 31.22 1a0g s PRO 247 CO 0.11 -0.13 0.02 0.08 -0.33 0.00 0.00 177.00 176.74 1a0g s VAL 248 N -0.70 3.60 -0.43 3.83 1.01 -0.23 0.91 120.40 128.39 1a0g s VAL 248 Ca 0.51 -0.68 0.19 0.00 0.00 0.00 0.00 61.98 61.99 1a0g s VAL 248 Cb -0.37 -2.79 -0.25 0.00 0.00 0.00 0.00 36.38 32.97 1a0g s VAL 248 CO 0.45 0.21 0.59 2.30 0.00 0.00 0.00 175.10 178.65 1a0g n ILE 249 N 4.81 0.00 -3.74 2.22 -5.35 0.26 -4.31 119.36 113.25 1a0g n ILE 249 Ca -0.16 -0.26 -0.12 0.00 -0.27 0.00 0.00 62.75 61.94 1a0g n ILE 249 Cb 0.49 0.52 -0.11 0.00 -1.74 0.00 0.00 39.64 38.79 1a0g n ILE 249 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1a0g s GLU 250 N -3.03 0.34 -0.22 6.28 2.12 -1.18 -0.56 118.70 122.44 1a0g s GLU 250 Ca -0.00 0.53 -0.01 0.00 0.36 0.00 0.00 54.97 55.84 1a0g s GLU 250 Cb 0.13 0.07 0.06 0.00 0.26 0.00 0.00 34.13 34.66 1a0g s GLU 250 CO 0.77 -0.09 0.01 0.42 -0.54 0.00 0.00 175.26 175.83 1a0g s ILE 251 N 0.65 0.91 -1.24 -3.70 1.01 0.08 -0.47 121.20 118.44 1a0g s ILE 251 Ca -0.04 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 59.72 1a0g s ILE 251 Cb -0.05 -1.36 0.00 0.00 0.01 0.00 0.00 42.46 41.07 1a0g s ILE 251 CO -0.04 -0.20 1.05 0.47 0.00 0.00 0.00 174.94 176.22 1a0g n ASP 252 N 4.90 -3.65 0.00 3.58 8.00 -0.77 -2.45 116.55 126.16 1a0g n ASP 252 Ca -0.10 -0.58 0.00 0.00 0.71 0.00 0.00 54.79 54.83 1a0g n ASP 252 Cb 0.46 -5.01 0.00 0.00 -0.02 0.00 0.00 41.12 36.55 1a0g n ASP 252 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a0g n GLY 253 N -1.45 2.89 3.64 0.44 0.00 -1.26 -4.97 105.19 104.48 1a0g n GLY 253 Ca -0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1a0g n GLY 253 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a0g s LYS 254 N -0.07 4.16 0.50 1.61 1.02 -1.03 -5.04 119.74 120.90 1a0g s LYS 254 Ca 0.00 0.71 -0.19 0.00 0.02 0.00 0.00 55.97 56.51 1a0g s LYS 254 Cb 0.00 -3.63 -0.08 0.00 -0.52 0.00 0.00 37.83 33.60 1a0g s LYS 254 CO 0.00 -0.41 1.02 -0.51 -0.92 0.00 0.00 175.35 174.52 1a0g s LEU 255 N 2.49 3.76 -0.24 3.17 1.02 -1.26 -0.75 118.68 126.87 1a0g s LEU 255 Ca 0.30 1.80 -0.18 0.00 0.02 0.00 0.00 54.13 56.07 1a0g s LEU 255 Cb -0.16 -4.54 -0.03 0.00 0.02 0.00 0.00 46.19 41.48 1a0g s LEU 255 CO 0.09 -0.75 0.53 -0.63 0.02 0.00 0.00 176.35 175.60 1a0g s ILE 256 N -2.22 5.07 0.00 -0.59 -1.09 0.27 -4.83 121.20 117.81 1a0g s ILE 256 Ca 0.64 0.93 0.00 0.00 -2.23 0.00 0.00 60.65 59.99 1a0g s ILE 256 Cb -0.14 -3.84 0.00 0.00 -1.58 0.00 0.00 42.46 36.90 1a0g s ILE 256 CO 0.24 0.11 0.00 -1.14 -1.23 0.00 0.00 174.94 172.91 1a0g n ARG 257 N 5.35 0.00 0.00 2.79 0.63 -1.26 -0.51 116.66 123.66 1a0g n ARG 257 Ca -0.04 0.00 0.06 0.00 -0.92 0.00 0.00 57.85 56.95 1a0g n ARG 257 Cb 0.50 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.36 1a0g n ARG 257 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 1a0g n ASP 258 N 6.74 0.74 0.00 6.15 5.68 -1.26 -4.98 116.55 129.62 1a0g n ASP 258 Ca 0.00 -0.87 0.00 0.00 -0.50 0.00 0.00 54.79 53.42 1a0g n ASP 258 Cb 0.00 0.88 0.00 0.00 -1.14 0.00 0.00 41.12 40.86 1a0g n ASP 258 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1a0g n GLY 259 N 1.21 0.94 3.32 6.12 0.00 0.33 -5.05 105.19 112.06 1a0g n GLY 259 Ca 0.03 -0.49 -0.24 0.00 0.00 0.00 0.00 46.02 45.31 1a0g n GLY 259 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a0g s LYS 260 N -1.73 1.21 0.02 1.61 1.02 -1.26 -4.93 119.74 115.68 1a0g s LYS 260 Ca 0.00 -1.25 -0.30 0.00 0.02 0.00 0.00 55.97 54.44 1a0g s LYS 260 Cb 0.00 -1.48 -0.07 0.00 -0.52 0.00 0.00 37.83 35.76 1a0g s LYS 260 CO 0.00 0.34 1.56 0.08 -0.92 0.00 0.00 175.35 176.41 1a0g s VAL 261 N -1.32 3.39 1.09 3.17 1.01 -1.26 -4.97 120.40 121.51 1a0g s VAL 261 Ca 0.10 0.74 -0.13 0.00 0.00 0.00 0.00 61.98 62.69 1a0g s VAL 261 Cb -0.09 -3.48 0.24 0.00 0.00 0.00 0.00 36.38 33.05 1a0g s VAL 261 CO 0.05 -0.02 1.07 -0.83 0.00 0.00 0.00 175.10 175.37 1a0g s GLY 262 N 2.42 1.55 0.12 4.51 0.00 -1.26 -4.91 107.32 109.75 1a0g s GLY 262 Ca 0.70 -0.39 -0.13 0.00 0.00 0.00 0.00 44.72 44.90 1a0g s GLY 262 CO 0.30 0.30 1.47 -2.09 0.00 0.00 0.00 173.10 173.08 1a0g h GLU 263 N -2.25 0.80 -0.10 2.90 4.81 -1.96 -2.70 114.58 116.09 1a0g h GLU 263 Ca -0.56 -0.38 -0.15 0.00 -0.13 0.00 0.00 59.36 58.13 1a0g h GLU 263 Cb 1.33 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 1a0g h GLU 263 CO 0.53 1.01 -0.59 -1.49 -0.73 0.00 0.00 179.01 177.75 1a0g h TRP 264 N 0.59 0.41 -0.45 0.92 4.06 -1.99 -1.55 115.95 117.94 1a0g h TRP 264 Ca 0.07 -0.15 -0.00 0.00 2.06 0.00 0.00 58.89 60.86 1a0g h TRP 264 Cb 0.82 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 28.88 1a0g h TRP 264 CO 0.06 0.83 0.27 1.15 -3.56 0.00 0.00 178.44 177.19 1a0g h THR 265 N 0.24 1.15 -0.83 1.49 2.02 -1.94 -0.06 112.91 114.99 1a0g h THR 265 Ca -0.00 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.81 1a0g h THR 265 Cb 1.10 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 68.03 1a0g h THR 265 CO 0.10 0.15 0.46 0.03 0.37 0.00 0.00 175.52 176.63 1a0g h ARG 266 N 0.60 1.16 -0.26 6.66 2.47 -1.24 0.80 114.38 124.57 1a0g h ARG 266 Ca 0.16 -0.13 -0.07 0.00 -1.26 0.00 0.00 59.98 58.68 1a0g h ARG 266 Cb 0.01 -0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 28.09 1a0g h ARG 266 CO -0.03 0.85 -0.13 0.87 0.56 0.00 0.00 179.97 182.09 1a0g h LYS 267 N 1.16 0.44 -0.15 0.04 1.57 -0.69 -2.00 116.57 116.94 1a0g h LYS 267 Ca 0.29 -0.12 -0.11 0.00 -1.87 0.00 0.00 60.65 58.84 1a0g h LYS 267 Cb 0.02 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1a0g h LYS 267 CO -0.05 0.57 -0.34 -0.07 -0.57 0.00 0.00 179.45 178.99 1a0g h LEU 268 N 0.41 0.56 -0.96 2.94 3.38 -0.04 -2.04 115.31 119.57 1a0g h LEU 268 Ca 0.08 -0.56 0.08 0.00 0.09 0.00 0.00 57.88 57.57 1a0g h LEU 268 Cb 0.48 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 1a0g h LEU 268 CO 0.03 1.02 0.60 1.56 0.09 0.00 0.00 178.44 181.75 1a0g h GLN 269 N 0.13 1.01 -0.24 1.13 4.20 -0.68 0.23 115.11 120.89 1a0g h GLN 269 Ca 0.00 -0.06 -0.17 0.00 0.06 0.00 0.00 58.65 58.48 1a0g h GLN 269 Cb 0.94 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.49 1a0g h GLN 269 CO 0.07 0.67 -0.53 0.87 -0.67 0.00 0.00 178.83 179.25 1a0g h LYS 270 N 1.04 0.68 -0.12 1.46 1.57 -1.31 -0.92 116.57 118.97 1a0g h LYS 270 Ca 0.44 -0.42 -0.16 0.00 -1.87 0.00 0.00 60.65 58.64 1a0g h LYS 270 Cb 0.29 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1a0g h LYS 270 CO -0.21 1.04 -0.61 0.37 -0.57 0.00 0.00 179.45 179.47 1a0g h GLN 271 N 0.53 0.42 -0.27 3.15 5.75 -0.67 -3.09 115.11 120.93 1a0g h GLN 271 Ca 0.02 -0.29 -0.02 0.00 -0.15 0.00 0.00 58.65 58.21 1a0g h GLN 271 Cb 1.09 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.67 1a0g h GLN 271 CO 0.11 0.90 0.09 0.35 -2.65 0.00 0.00 178.83 177.62 1a0g h PHE 272 N 0.31 0.44 -0.26 3.99 3.57 -0.42 -2.68 116.94 121.88 1a0g h PHE 272 Ca -0.01 -0.04 0.08 0.00 3.53 0.00 0.00 57.97 61.53 1a0g h PHE 272 Cb 1.15 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.75 1a0g h PHE 272 CO 0.04 0.47 0.29 1.49 -2.23 0.00 0.00 178.31 178.36 1a0g h GLU 273 N 0.28 0.00 0.00 1.11 4.57 -1.09 0.12 114.58 119.57 1a0g h GLU 273 Ca 0.09 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1a0g h GLU 273 Cb 0.23 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1a0g h GLU 273 CO -0.00 0.00 0.00 1.79 -1.18 0.00 0.00 179.01 179.62 1a0g h THR 274 N 0.00 0.00 0.00 0.32 1.35 -1.40 -3.21 112.91 109.97 1a0g h THR 274 Ca 0.13 -0.38 -0.11 0.00 -0.55 0.00 0.00 66.41 65.50 1a0g h THR 274 Cb 0.70 1.24 -0.02 0.00 -1.73 0.00 0.00 68.15 68.34 1a0g h THR 274 CO -0.00 0.00 -1.72 0.29 -0.25 0.00 0.00 175.52 173.84 1a0g n LYS 275 N -2.34 0.64 -2.66 4.72 5.02 0.03 -4.95 118.16 118.62 1a0g n LYS 275 Ca 0.03 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.93 1a0g n LYS 275 Cb 0.33 -1.65 -0.05 0.00 -0.02 0.00 0.00 35.03 33.63 1a0g n LYS 275 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1a0g s ILE 276 N -3.16 3.89 0.26 -0.18 -4.36 -1.21 -4.99 121.20 111.45 1a0g s ILE 276 Ca -0.06 1.87 -0.30 0.00 -0.26 0.00 0.00 60.65 61.90 1a0g s ILE 276 Cb 0.10 -4.17 -0.11 0.00 1.25 0.00 0.00 42.46 39.53 1a0g s ILE 276 CO 0.85 0.42 1.58 -2.84 0.24 0.00 0.00 174.94 175.19 1a0g s PRO 277 N -1.37 4.16 -0.31 0.37 0.02 -1.26 -4.95 135.00 131.66 1a0g s PRO 277 Ca 0.43 2.51 0.18 0.00 0.02 0.00 0.00 61.00 64.15 1a0g s PRO 277 Cb -0.27 -3.06 0.46 0.00 0.02 0.00 0.00 34.50 31.65 1a0g s PRO 277 CO 0.34 -0.61 1.01 1.63 -0.33 0.00 0.00 177.00 179.04 1a0g n LYS 278 N 2.65 1.25 -2.10 5.54 5.02 -1.26 -4.77 118.16 124.49 1a0g n LYS 278 Ca 0.10 -3.18 -0.33 0.00 -2.02 0.00 0.00 58.31 52.88 1a0g n LYS 278 Cb 0.38 -1.21 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 1a0g n LYS 278 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1a0g s PRO 279 N -2.99 3.40 0.00 1.97 0.04 -1.26 -5.17 135.00 130.99 1a0g s PRO 279 Ca 0.26 1.18 0.25 0.00 0.04 0.00 0.00 61.00 62.74 1a0g s PRO 279 Cb 0.43 -2.05 0.40 0.00 0.04 0.00 0.00 34.50 33.33 1a0g s PRO 279 CO 0.02 -0.74 1.38 1.28 0.04 0.00 0.00 177.00 178.98