#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jgu s ILE 2 N 0.00 2.92 0.00 1.12 1.01 -1.26 0.54 121.20 125.53 2jgu s ILE 2 Ca 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 60.65 58.64 2jgu s ILE 2 Cb 0.00 -2.50 0.00 0.00 0.01 0.00 0.00 42.46 39.97 2jgu s ILE 2 CO 0.00 -0.27 0.00 0.18 0.00 0.00 0.00 174.94 174.85 2jgu n LEU 3 N -0.38 0.00 -3.72 2.97 4.77 -0.09 -2.26 117.00 118.29 2jgu n LEU 3 Ca -0.08 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.91 2jgu n LEU 3 Cb 0.58 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.67 2jgu n LEU 3 CO 0.36 0.00 1.02 -0.62 -1.33 0.00 0.00 177.39 176.82 2jgu s ASP 4 N -1.23 -0.05 -0.24 -1.43 2.15 -1.24 -4.61 116.67 110.02 2jgu s ASP 4 Ca 0.00 -0.21 -0.18 0.00 0.43 0.00 0.00 52.55 52.59 2jgu s ASP 4 Cb 0.00 0.22 0.07 0.00 -0.30 0.00 0.00 42.92 42.90 2jgu s ASP 4 CO 0.00 -0.41 0.62 -0.69 -0.17 0.00 0.00 175.17 174.53 2jgu s VAL 5 N -2.42 -0.00 0.29 1.11 1.01 -1.26 -2.76 120.40 116.37 2jgu s VAL 5 Ca 0.17 0.01 -0.17 0.00 0.00 0.00 0.00 61.98 62.00 2jgu s VAL 5 Cb 0.03 -0.89 0.02 0.00 0.00 0.00 0.00 36.38 35.54 2jgu s VAL 5 CO -0.02 0.01 0.64 1.51 0.00 0.00 0.00 175.10 177.23 2jgu s ASP 6 N 0.98 -0.10 0.09 3.32 -4.77 -1.16 -4.92 116.67 110.11 2jgu s ASP 6 Ca -0.05 -0.84 0.05 0.00 -3.30 0.00 0.00 52.55 48.41 2jgu s ASP 6 Cb -0.05 0.70 -0.03 0.00 -1.09 0.00 0.00 42.92 42.44 2jgu s ASP 6 CO -0.09 -1.33 -0.14 -0.72 0.70 0.00 0.00 175.17 173.60 2jgu s TYR 7 N -3.68 1.25 0.27 2.11 -0.85 -1.25 0.15 117.35 115.35 2jgu s TYR 7 Ca 0.16 -0.51 0.11 0.00 -0.52 0.00 0.00 57.07 56.31 2jgu s TYR 7 Cb -0.04 -0.68 -0.05 0.00 0.38 0.00 0.00 41.96 41.57 2jgu s TYR 7 CO 0.09 0.07 -0.12 0.96 -1.52 0.00 0.00 175.55 175.03 2jgu s ILE 8 N -1.68 2.86 -0.27 -3.49 -4.36 0.13 -4.83 121.20 109.56 2jgu s ILE 8 Ca 0.02 -2.20 -0.06 0.00 -0.26 0.00 0.00 60.65 58.15 2jgu s ILE 8 Cb -0.08 -2.51 -0.00 0.00 1.25 0.00 0.00 42.46 41.12 2jgu s ILE 8 CO 0.02 -0.38 0.05 -0.89 0.24 0.00 0.00 174.94 173.99 2jgu s THR 9 N -2.41 3.92 -0.89 8.37 2.01 -1.26 0.58 115.64 125.98 2jgu s THR 9 Ca 0.30 -0.55 -0.05 0.00 0.31 0.00 0.00 61.69 61.70 2jgu s THR 9 Cb -0.06 -2.94 0.22 0.00 0.01 0.00 0.00 72.50 69.73 2jgu s THR 9 CO 0.17 0.20 0.79 -1.61 -0.69 0.00 0.00 174.62 173.48 2jgu s GLU 10 N 1.52 3.41 -0.26 4.92 2.02 -0.17 -4.83 118.70 125.31 2jgu s GLU 10 Ca 0.04 -3.02 -0.11 0.00 0.02 0.00 0.00 54.97 51.90 2jgu s GLU 10 Cb -0.16 -4.12 0.02 0.00 0.10 0.00 0.00 34.13 29.96 2jgu s GLU 10 CO 0.02 -1.25 0.24 -0.85 0.02 0.00 0.00 175.26 173.44 2jgu n GLU 11 N 2.86 -1.93 -0.16 1.61 0.28 -1.26 -3.57 120.64 118.47 2jgu n GLU 11 Ca 0.18 1.73 0.00 0.00 -0.16 0.00 0.00 57.16 58.92 2jgu n GLU 11 Cb 0.39 -3.31 0.00 0.00 1.43 0.00 0.00 31.44 29.95 2jgu n GLU 11 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2jgu n GLY 12 N 0.54 2.61 3.36 -1.84 0.00 -1.26 -5.00 105.19 103.59 2jgu n GLY 12 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 2jgu n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jgu s LYS 13 N -0.00 2.25 -0.03 1.61 -0.14 -1.23 -4.67 119.74 117.52 2jgu s LYS 13 Ca 0.00 -0.86 -0.15 0.00 -1.36 0.00 0.00 55.97 53.60 2jgu s LYS 13 Cb 0.00 -2.15 -0.05 0.00 -1.68 0.00 0.00 37.83 33.95 2jgu s LYS 13 CO 0.00 0.57 0.39 -1.25 -0.76 0.00 0.00 175.35 174.30 2jgu s PRO 14 N -0.61 3.95 -0.08 -1.68 0.04 -1.26 -1.00 135.00 134.36 2jgu s PRO 14 Ca 0.10 0.36 0.02 0.00 0.04 0.00 0.00 61.00 61.52 2jgu s PRO 14 Cb -0.10 -3.25 0.01 0.00 0.04 0.00 0.00 34.50 31.20 2jgu s PRO 14 CO -0.00 0.61 -0.13 0.08 0.04 0.00 0.00 177.00 177.60 2jgu s VAL 15 N -0.81 1.24 0.21 -0.36 1.01 0.20 -4.88 120.40 117.02 2jgu s VAL 15 Ca 0.23 -0.52 -0.24 0.00 0.00 0.00 0.00 61.98 61.46 2jgu s VAL 15 Cb -0.16 -1.14 -0.08 0.00 0.00 0.00 0.00 36.38 34.99 2jgu s VAL 15 CO 0.12 0.38 0.79 -0.63 0.00 0.00 0.00 175.10 175.77 2jgu s ILE 16 N 0.84 4.40 -0.00 2.22 -1.09 -0.93 0.22 121.20 126.86 2jgu s ILE 16 Ca -0.11 1.59 0.06 0.00 -2.23 0.00 0.00 60.65 59.96 2jgu s ILE 16 Cb -0.15 -4.03 -0.02 0.00 -1.58 0.00 0.00 42.46 36.69 2jgu s ILE 16 CO 0.01 0.35 -0.17 -0.13 -1.23 0.00 0.00 174.94 173.77 2jgu s ARG 17 N -1.59 1.36 -0.08 2.79 0.52 0.12 -1.01 118.95 121.06 2jgu s ARG 17 Ca 0.41 -0.66 0.05 0.00 -0.52 0.00 0.00 55.73 55.00 2jgu s ARG 17 Cb -0.20 -1.34 -0.01 0.00 0.52 0.00 0.00 34.95 33.92 2jgu s ARG 17 CO 0.24 0.36 -0.24 -0.51 0.02 0.00 0.00 175.30 175.17 2jgu s LEU 18 N -0.55 2.07 -0.43 2.53 1.02 0.75 -3.00 118.68 121.07 2jgu s LEU 18 Ca 0.06 -0.53 -0.15 0.00 0.02 0.00 0.00 54.13 53.53 2jgu s LEU 18 Cb -0.07 -1.37 0.04 0.00 0.02 0.00 0.00 46.19 44.81 2jgu s LEU 18 CO -0.00 0.20 0.35 -0.36 0.02 0.00 0.00 176.35 176.55 2jgu s PHE 19 N 0.09 3.23 0.25 0.29 0.40 -1.11 -2.92 117.98 118.21 2jgu s PHE 19 Ca -0.11 -0.69 0.08 0.00 -0.60 0.00 0.00 56.93 55.62 2jgu s PHE 19 Cb -0.16 -2.82 -0.04 0.00 0.51 0.00 0.00 43.02 40.51 2jgu s PHE 19 CO 0.06 -0.68 0.06 0.15 0.70 0.00 0.00 175.22 175.52 2jgu s LYS 20 N 1.72 2.51 -0.14 0.44 1.02 0.13 -0.91 119.74 124.51 2jgu s LYS 20 Ca 0.05 -1.26 0.01 0.00 0.02 0.00 0.00 55.97 54.79 2jgu s LYS 20 Cb -0.21 -2.32 -0.00 0.00 -0.52 0.00 0.00 37.83 34.79 2jgu s LYS 20 CO 0.09 0.39 -0.17 0.21 -0.92 0.00 0.00 175.35 174.95 2jgu s LYS 21 N -3.63 3.20 -0.27 1.68 2.36 0.19 -1.93 119.74 121.34 2jgu s LYS 21 Ca 0.31 -0.77 -0.01 0.00 -2.55 0.00 0.00 55.97 52.95 2jgu s LYS 21 Cb -0.07 -2.56 0.13 0.00 -1.05 0.00 0.00 37.83 34.28 2jgu s LYS 21 CO 0.21 0.07 0.30 -1.21 1.55 0.00 0.00 175.35 176.27 2jgu s GLU 22 N 0.67 0.31 -1.55 4.03 2.02 0.32 0.11 118.70 124.62 2jgu s GLU 22 Ca -0.08 0.02 -0.04 0.00 0.02 0.00 0.00 54.97 54.89 2jgu s GLU 22 Cb -0.16 -0.71 0.03 0.00 0.10 0.00 0.00 34.13 33.40 2jgu s GLU 22 CO 0.02 -0.92 0.24 0.27 0.02 0.00 0.00 175.26 174.90 2jgu n ASN 23 N 5.32 -0.01 0.00 -0.19 6.94 -1.26 -1.40 115.26 124.66 2jgu n ASN 23 Ca -0.03 -1.17 0.00 0.00 -0.02 0.00 0.00 54.58 53.36 2jgu n ASN 23 Cb 0.48 -2.14 0.00 0.00 -2.36 0.00 0.00 39.78 35.75 2jgu n ASN 23 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2jgu n GLY 24 N -2.17 0.82 3.74 4.83 0.00 -1.26 -5.07 105.19 106.07 2jgu n GLY 24 Ca -0.25 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.54 2jgu n GLY 24 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jgu s LYS 25 N -0.72 2.63 -0.03 1.61 2.47 -0.50 -5.10 119.74 120.10 2jgu s LYS 25 Ca 0.00 -1.21 0.01 0.00 -1.56 0.00 0.00 55.97 53.21 2jgu s LYS 25 Cb 0.00 -2.38 0.02 0.00 -1.46 0.00 0.00 37.83 34.01 2jgu s LYS 25 CO 0.00 0.39 -0.03 0.12 0.16 0.00 0.00 175.35 175.99 2jgu s PHE 26 N -2.18 0.53 0.20 4.03 5.36 -1.26 0.12 117.98 124.77 2jgu s PHE 26 Ca 0.32 -0.10 -0.20 0.00 -0.96 0.00 0.00 56.93 55.99 2jgu s PHE 26 Cb -0.07 -0.51 0.07 0.00 -0.34 0.00 0.00 43.02 42.17 2jgu s PHE 26 CO 0.22 -0.14 0.95 0.36 -1.46 0.00 0.00 175.22 175.15 2jgu n LYS 27 N 3.94 0.67 -5.20 10.12 -0.00 -0.81 -4.96 118.16 121.92 2jgu n LYS 27 Ca -0.25 -1.49 -0.32 0.00 -0.00 0.00 0.00 58.31 56.25 2jgu n LYS 27 Cb 0.51 1.99 -0.17 0.00 -0.00 0.00 0.00 35.03 37.37 2jgu n LYS 27 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2jgu s ILE 28 N -2.09 2.11 -0.09 0.58 1.01 -1.25 0.22 121.20 121.68 2jgu s ILE 28 Ca 0.21 -1.00 0.03 0.00 0.00 0.00 0.00 60.65 59.88 2jgu s ILE 28 Cb -0.03 -1.80 -0.01 0.00 0.01 0.00 0.00 42.46 40.62 2jgu s ILE 28 CO 0.06 0.56 -0.18 -1.61 0.00 0.00 0.00 174.94 173.77 2jgu s GLU 29 N 0.30 2.99 -0.06 2.79 8.01 -1.15 -4.95 118.70 126.63 2jgu s GLU 29 Ca -0.17 -0.78 0.05 0.00 0.01 0.00 0.00 54.97 54.08 2jgu s GLU 29 Cb -0.18 -2.42 -0.00 0.00 -4.31 0.00 0.00 34.13 27.22 2jgu s GLU 29 CO 0.08 0.31 -0.20 -1.01 0.01 0.00 0.00 175.26 174.46 2jgu s HIS 30 N 0.06 2.01 -0.13 1.61 3.76 -1.26 -0.18 115.29 121.17 2jgu s HIS 30 Ca -0.07 -0.64 0.02 0.00 -0.15 0.00 0.00 55.06 54.22 2jgu s HIS 30 Cb -0.15 -1.35 0.01 0.00 1.11 0.00 0.00 32.58 32.20 2jgu s HIS 30 CO 0.05 -0.22 -0.19 0.34 -0.85 0.00 0.00 174.74 173.87 2jgu s ASP 31 N 0.08 2.82 -0.07 1.40 -1.08 -0.18 -4.97 116.67 114.66 2jgu s ASP 31 Ca -0.07 -0.53 0.11 0.00 -0.52 0.00 0.00 52.55 51.54 2jgu s ASP 31 Cb -0.13 -1.29 0.24 0.00 -1.46 0.00 0.00 42.92 40.28 2jgu s ASP 31 CO 0.04 0.05 1.17 0.54 0.52 0.00 0.00 175.17 177.49 2jgu n ARG 32 N 4.12 2.41 -0.88 4.34 1.74 -1.26 -2.18 116.66 124.94 2jgu n ARG 32 Ca -0.20 -2.19 0.07 0.00 -0.77 0.00 0.00 57.85 54.77 2jgu n ARG 32 Cb 0.51 -1.36 0.40 0.00 -1.02 0.00 0.00 32.46 31.00 2jgu n ARG 32 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2jgu n THR 33 N -0.63 2.74 -4.44 0.55 -2.24 -1.26 -4.95 114.28 104.04 2jgu n THR 33 Ca 0.11 -1.42 -0.34 0.00 -2.27 0.00 0.00 64.05 60.13 2jgu n THR 33 Cb 0.52 -0.26 -0.11 0.00 -2.10 0.00 0.00 70.33 68.38 2jgu n THR 33 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2jgu s PHE 34 N -2.75 3.04 0.04 4.78 5.36 -1.26 -5.13 117.98 122.06 2jgu s PHE 34 Ca 0.54 -0.08 0.06 0.00 -0.96 0.00 0.00 56.93 56.49 2jgu s PHE 34 Cb 0.41 -1.85 -0.02 0.00 -0.34 0.00 0.00 43.02 41.22 2jgu s PHE 34 CO 0.16 0.19 -0.18 1.03 -1.46 0.00 0.00 175.22 174.96 2jgu s ARG 35 N -0.25 1.20 1.07 10.12 0.52 -1.26 -4.97 118.95 125.37 2jgu s ARG 35 Ca 0.05 -0.86 -0.12 0.00 -0.52 0.00 0.00 55.73 54.28 2jgu s ARG 35 Cb -0.13 -1.27 0.23 0.00 0.52 0.00 0.00 34.95 34.30 2jgu s ARG 35 CO 0.02 0.32 1.04 -2.30 0.02 0.00 0.00 175.30 174.41 2jgu n PRO 36 N 1.89 -1.61 -3.62 3.54 -0.01 -1.26 -4.80 135.00 129.13 2jgu n PRO 36 Ca -0.17 -0.43 -0.02 0.00 -0.01 0.00 0.00 63.50 62.87 2jgu n PRO 36 Cb 0.54 -2.24 -0.01 0.00 -0.01 0.00 0.00 33.50 31.77 2jgu n PRO 36 CO 0.00 0.00 0.00 1.52 -0.01 0.00 0.00 175.50 177.01 2jgu s TYR 37 N -2.50 -0.12 0.19 6.00 -0.85 -1.26 -1.52 117.35 117.29 2jgu s TYR 37 Ca 0.68 0.01 -0.17 0.00 -0.52 0.00 0.00 57.07 57.06 2jgu s TYR 37 Cb -0.24 0.55 0.03 0.00 0.38 0.00 0.00 41.96 42.67 2jgu s TYR 37 CO 0.62 -0.35 0.49 0.96 -1.52 0.00 0.00 175.55 175.76 2jgu s ILE 38 N -2.61 0.03 0.04 -3.49 -4.36 -1.10 -4.75 121.20 104.97 2jgu s ILE 38 Ca 0.11 -0.82 0.04 0.00 -0.26 0.00 0.00 60.65 59.72 2jgu s ILE 38 Cb 0.01 -1.57 -0.04 0.00 1.25 0.00 0.00 42.46 42.11 2jgu s ILE 38 CO -0.04 -0.15 -0.02 -0.31 0.24 0.00 0.00 174.94 174.66 2jgu s TYR 39 N -3.88 2.97 -0.05 1.37 4.12 -0.87 -1.29 117.35 119.72 2jgu s TYR 39 Ca 0.09 -0.01 0.03 0.00 0.02 0.00 0.00 57.07 57.21 2jgu s TYR 39 Cb -0.00 -1.58 0.00 0.00 -1.52 0.00 0.00 41.96 38.86 2jgu s TYR 39 CO -0.03 0.44 -0.15 0.00 0.02 0.00 0.00 175.55 175.83 2jgu s ALA 40 N -1.16 1.39 -0.13 3.71 0.00 -0.74 -0.42 121.76 124.41 2jgu s ALA 40 Ca 0.21 -0.56 -0.13 0.00 0.00 0.00 0.00 51.96 51.49 2jgu s ALA 40 Cb -0.11 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.43 2jgu s ALA 40 CO 0.13 0.20 0.28 -1.17 0.00 0.00 0.00 175.76 175.20 2jgu s LEU 41 N 0.33 4.30 -0.01 0.00 2.96 0.18 0.40 118.68 126.83 2jgu s LEU 41 Ca -0.09 0.56 0.03 0.00 -0.22 0.00 0.00 54.13 54.41 2jgu s LEU 41 Cb -0.13 -2.35 -0.01 0.00 0.50 0.00 0.00 46.19 44.21 2jgu s LEU 41 CO 0.03 0.19 -0.10 -0.22 -1.32 0.00 0.00 176.35 174.93 2jgu s LEU 42 N -0.04 1.96 0.25 -0.68 2.96 -1.26 -1.30 118.68 120.56 2jgu s LEU 42 Ca 0.17 -0.20 -0.05 0.00 -0.22 0.00 0.00 54.13 53.83 2jgu s LEU 42 Cb -0.13 -0.56 0.47 0.00 0.50 0.00 0.00 46.19 46.47 2jgu s LEU 42 CO 0.05 0.11 1.66 0.03 -1.32 0.00 0.00 176.35 176.89 2jgu h ARG 43 N 6.02 0.18 -0.92 1.98 3.08 -1.20 -3.39 114.38 120.14 2jgu h ARG 43 Ca -0.32 -0.01 0.16 0.00 0.07 0.00 0.00 59.98 59.88 2jgu h ARG 43 Cb 1.17 -0.04 -0.22 0.00 0.08 0.00 0.00 29.97 30.96 2jgu h ARG 43 CO 0.49 0.12 0.01 0.16 -1.07 0.00 0.00 179.97 179.68 2jgu s ASP 44 N -5.20 -0.84 0.63 7.04 3.84 -1.26 -4.95 116.67 115.92 2jgu s ASP 44 Ca -0.13 0.76 0.19 0.00 -0.00 0.00 0.00 52.55 53.37 2jgu s ASP 44 Cb 0.22 1.80 0.71 0.00 -1.38 0.00 0.00 42.92 44.27 2jgu s ASP 44 CO 0.76 -0.16 1.28 -2.24 -0.00 0.00 0.00 175.17 174.81 2jgu h ASP 45 N 7.86 0.00 -0.89 2.11 2.03 -1.97 0.38 116.42 125.94 2jgu h ASP 45 Ca -0.17 0.00 0.23 0.00 -0.73 0.00 0.00 57.03 56.35 2jgu h ASP 45 Cb 1.14 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.59 2jgu h ASP 45 CO 0.08 0.00 0.61 0.28 -1.03 0.00 0.00 179.24 179.18 2jgu h SER 46 N 0.00 0.24 -0.79 4.15 0.02 -1.95 -1.39 113.55 113.83 2jgu h SER 46 Ca 0.30 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.27 2jgu h SER 46 Cb 2.42 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 64.91 2jgu h SER 46 CO -0.00 0.09 0.46 0.11 -1.14 0.00 0.00 176.83 176.35 2jgu h LYS 47 N 0.23 1.09 0.00 3.45 6.56 -0.64 -3.32 116.57 123.94 2jgu h LYS 47 Ca 0.45 -0.10 0.00 0.00 -1.06 0.00 0.00 60.65 59.94 2jgu h LYS 47 Cb 1.39 -0.23 0.00 0.00 -0.57 0.00 0.00 32.23 32.83 2jgu h LYS 47 CO -0.11 0.78 0.00 0.44 -2.06 0.00 0.00 179.45 178.49 2jgu n ILE 48 N -4.37 0.00 0.70 1.86 -5.35 -0.52 0.57 119.36 112.25 2jgu n ILE 48 Ca 0.08 0.00 0.13 0.00 -0.27 0.00 0.00 62.75 62.69 2jgu n ILE 48 Cb 0.08 0.00 0.31 0.00 -1.74 0.00 0.00 39.64 38.28 2jgu n ILE 48 CO 0.00 0.00 0.00 -1.84 -1.76 0.00 0.00 176.55 172.95 2jgu n GLU 49 N -1.59 0.21 -0.08 6.28 0.28 -1.25 -3.97 120.64 120.53 2jgu n GLU 49 Ca 0.00 0.10 -0.14 0.00 -0.16 0.00 0.00 57.16 56.96 2jgu n GLU 49 Cb 0.00 -1.67 -0.10 0.00 1.43 0.00 0.00 31.44 31.10 2jgu n GLU 49 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 2jgu h GLU 50 N 0.00 0.00 -1.49 3.44 4.57 1.50 -3.38 114.58 119.23 2jgu h GLU 50 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2jgu h GLU 50 Cb 0.68 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 2jgu h GLU 50 CO 0.00 0.80 0.00 1.33 -1.18 0.00 0.00 179.01 179.96 2jgu n VAL 51 N -4.58 1.04 -0.02 0.32 0.24 -1.22 -3.19 118.33 110.92 2jgu n VAL 51 Ca -0.15 -0.13 -0.02 0.00 -2.04 0.00 0.00 64.34 62.00 2jgu n VAL 51 Cb 0.46 -1.06 -0.02 0.00 -1.47 0.00 0.00 33.84 31.75 2jgu n VAL 51 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2jgu n LYS 52 N 0.95 2.79 0.14 7.34 5.02 -1.26 -4.66 118.16 128.48 2jgu n LYS 52 Ca 0.00 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 2jgu n LYS 52 Cb 0.39 -1.08 0.46 0.00 -0.02 0.00 0.00 35.03 34.78 2jgu n LYS 52 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2jgu n LYS 53 N -2.22 0.11 -1.39 1.97 5.02 -1.19 -4.47 118.16 115.98 2jgu n LYS 53 Ca -0.06 0.60 -0.51 0.00 -2.02 0.00 0.00 58.31 56.33 2jgu n LYS 53 Cb 0.60 -1.93 -0.11 0.00 -0.02 0.00 0.00 35.03 33.57 2jgu n LYS 53 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2jgu n ILE 54 N -2.10 0.04 -2.89 -0.18 -0.00 -1.26 -4.92 119.36 108.05 2jgu n ILE 54 Ca -0.01 -0.13 -0.23 0.00 -0.00 0.00 0.00 62.75 62.38 2jgu n ILE 54 Cb 0.09 -0.97 0.02 0.00 -0.00 0.00 0.00 39.64 38.78 2jgu n ILE 54 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 2jgu s THR 55 N 7.65 3.87 0.00 1.39 -1.32 -1.26 -3.99 115.64 121.98 2jgu s THR 55 Ca 1.20 -0.45 0.00 0.00 -1.21 0.00 0.00 61.69 61.24 2jgu s THR 55 Cb -1.17 -3.44 0.00 0.00 -1.51 0.00 0.00 72.50 66.38 2jgu s THR 55 CO 0.54 -0.33 0.00 0.61 -2.21 0.00 0.00 174.62 173.23 2jgu n GLY 56 N -2.16 6.51 3.05 6.08 0.00 0.17 -4.96 105.19 113.89 2jgu n GLY 56 Ca 0.02 -1.75 0.05 0.00 0.00 0.00 0.00 46.02 44.34 2jgu n GLY 56 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jgu s GLU 57 N 0.88 0.06 0.00 1.61 2.56 -1.26 -3.75 118.70 118.81 2jgu s GLU 57 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.97 55.00 2jgu s GLU 57 Cb 0.00 0.02 0.00 0.00 2.00 0.00 0.00 34.13 36.15 2jgu s GLU 57 CO 0.00 -0.10 0.00 -2.13 -0.56 0.00 0.00 175.26 172.47 2jgu n ARG 58 N 4.70 3.36 0.00 4.30 0.63 1.01 -4.78 116.66 125.88 2jgu n ARG 58 Ca 0.09 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 2jgu n ARG 58 Cb 0.60 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.51 2jgu n ARG 58 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 2jgu n HIS 59 N 0.00 0.00 0.00 -0.14 -0.00 -1.26 -1.43 115.22 112.39 2jgu n HIS 59 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2jgu n HIS 59 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2jgu n HIS 59 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2jgu n GLY 60 N 0.00 1.51 3.32 1.57 0.00 -1.26 -5.08 105.19 105.25 2jgu n GLY 60 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2jgu n GLY 60 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jgu s LYS 61 N -0.21 1.15 -0.33 1.61 2.20 -0.52 -5.15 119.74 118.50 2jgu s LYS 61 Ca 0.00 -1.25 -0.18 0.00 -0.36 0.00 0.00 55.97 54.19 2jgu s LYS 61 Cb 0.00 0.36 -0.01 0.00 -1.51 0.00 0.00 37.83 36.67 2jgu s LYS 61 CO 0.00 -0.41 0.49 0.42 -0.36 0.00 0.00 175.35 175.49 2jgu s ILE 62 N -4.00 5.05 0.26 5.43 1.09 -1.26 0.33 121.20 128.10 2jgu s ILE 62 Ca 0.20 0.45 -0.10 0.00 -1.10 0.00 0.00 60.65 60.10 2jgu s ILE 62 Cb 0.04 -3.91 -0.07 0.00 -1.06 0.00 0.00 42.46 37.46 2jgu s ILE 62 CO 0.02 -0.12 0.59 -0.69 -0.10 0.00 0.00 174.94 174.64 2jgu s VAL 63 N 2.34 4.89 0.27 2.92 1.01 -1.25 -4.86 120.40 125.72 2jgu s VAL 63 Ca 0.19 0.50 -0.01 0.00 0.00 0.00 0.00 61.98 62.66 2jgu s VAL 63 Cb -0.16 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.59 2jgu s VAL 63 CO 0.12 -0.15 0.37 -1.14 0.00 0.00 0.00 175.10 174.30 2jgu n ARG 64 N -0.35 0.53 -3.61 2.72 0.63 -1.26 -0.65 116.66 114.66 2jgu n ARG 64 Ca 0.01 -2.15 -0.39 0.00 -0.92 0.00 0.00 57.85 54.39 2jgu n ARG 64 Cb 0.53 2.05 -0.08 0.00 0.45 0.00 0.00 32.46 35.41 2jgu n ARG 64 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 2jgu s ILE 65 N -2.74 4.16 0.75 5.15 2.07 -1.26 -4.78 121.20 124.55 2jgu s ILE 65 Ca 0.22 -2.55 -0.11 0.00 -1.41 0.00 0.00 60.65 56.81 2jgu s ILE 65 Cb -0.01 -3.69 0.04 0.00 0.13 0.00 0.00 42.46 38.94 2jgu s ILE 65 CO 0.16 -0.87 1.09 -0.69 -1.91 0.00 0.00 174.94 172.72 2jgu s VAL 66 N 0.37 3.39 0.00 4.00 1.01 -1.18 -4.83 120.40 123.17 2jgu s VAL 66 Ca 0.14 0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.60 2jgu s VAL 66 Cb -0.20 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.19 2jgu s VAL 66 CO -0.04 -0.57 0.00 0.47 0.00 0.00 0.00 175.10 174.96 2jgu n ASP 67 N -3.34 0.00 -3.05 3.32 8.00 -1.26 -3.40 116.55 116.81 2jgu n ASP 67 Ca 0.09 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.43 2jgu n ASP 67 Cb 0.53 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.59 2jgu n ASP 67 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2jgu n VAL 68 N 0.00 -0.55 -3.19 2.53 0.31 -1.26 -2.31 118.33 113.85 2jgu n VAL 68 Ca 0.00 -2.40 -0.32 0.00 -0.01 0.00 0.00 64.34 61.61 2jgu n VAL 68 Cb 0.00 -0.33 -0.06 0.00 -0.91 0.00 0.00 33.84 32.54 2jgu n VAL 68 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2jgu s GLU 69 N 0.25 3.94 0.17 5.55 -1.05 -1.22 -4.90 118.70 121.44 2jgu s GLU 69 Ca 0.32 0.56 -0.30 0.00 -0.15 0.00 0.00 54.97 55.40 2jgu s GLU 69 Cb 0.07 -2.48 -0.07 0.00 -0.44 0.00 0.00 34.13 31.21 2jgu s GLU 69 CO -0.14 0.18 0.98 0.21 0.95 0.00 0.00 175.26 177.44 2jgu s LYS 70 N -2.99 4.74 0.21 -4.83 2.20 -1.26 -2.90 119.74 114.90 2jgu s LYS 70 Ca 0.52 1.52 0.02 0.00 -0.36 0.00 0.00 55.97 57.68 2jgu s LYS 70 Cb -0.10 -3.32 -0.05 0.00 -1.51 0.00 0.00 37.83 32.85 2jgu s LYS 70 CO 0.19 0.30 0.01 0.08 -0.36 0.00 0.00 175.35 175.57 2jgu s VAL 71 N -0.48 0.82 -0.21 4.02 1.01 0.92 -4.91 120.40 121.56 2jgu s VAL 71 Ca 0.45 -2.01 -0.01 0.00 0.00 0.00 0.00 61.98 60.42 2jgu s VAL 71 Cb -0.25 -2.27 0.02 0.00 0.00 0.00 0.00 36.38 33.87 2jgu s VAL 71 CO 0.32 -0.36 -0.11 -1.83 0.00 0.00 0.00 175.10 173.11 2jgu s GLU 72 N -3.91 3.01 0.00 2.72 4.04 -1.26 0.15 118.70 123.45 2jgu s GLU 72 Ca 0.27 -0.85 0.00 0.00 0.04 0.00 0.00 54.97 54.44 2jgu s GLU 72 Cb 0.06 -2.82 0.00 0.00 0.02 0.00 0.00 34.13 31.39 2jgu s GLU 72 CO 0.07 -0.28 0.00 1.63 -1.84 0.00 0.00 175.26 174.84 2jgu n LYS 73 N 4.67 3.38 -3.68 -4.83 4.76 0.08 -4.97 118.16 117.56 2jgu n LYS 73 Ca -0.19 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.12 2jgu n LYS 73 Cb 0.49 0.00 -0.07 0.00 -1.84 0.00 0.00 35.03 33.61 2jgu n LYS 73 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2jgu s LYS 74 N 3.39 0.83 -0.03 1.97 1.02 -1.13 -2.44 119.74 123.36 2jgu s LYS 74 Ca 0.00 -0.18 0.03 0.00 0.02 0.00 0.00 55.97 55.84 2jgu s LYS 74 Cb 0.00 0.37 -0.00 0.00 -0.52 0.00 0.00 37.83 37.68 2jgu s LYS 74 CO 0.00 -0.26 -0.12 0.12 -0.92 0.00 0.00 175.35 174.17 2jgu s PHE 75 N -1.73 1.21 0.00 3.18 5.36 0.17 -1.26 117.98 124.90 2jgu s PHE 75 Ca -0.10 -0.31 0.00 0.00 -0.96 0.00 0.00 56.93 55.56 2jgu s PHE 75 Cb -0.03 -0.83 0.00 0.00 -0.34 0.00 0.00 43.02 41.82 2jgu s PHE 75 CO 0.03 -0.11 0.00 1.28 -1.46 0.00 0.00 175.22 174.96 2jgu n LEU 76 N 3.17 0.00 0.00 6.12 4.32 -1.26 0.30 117.00 129.64 2jgu n LEU 76 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.81 2jgu n LEU 76 Cb 0.54 -0.42 0.00 0.00 -1.62 0.00 0.00 43.42 41.92 2jgu n LEU 76 CO 0.25 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.03 2jgu n GLY 77 N 0.00 3.41 3.71 -0.72 0.00 -1.26 -4.73 105.19 105.60 2jgu n GLY 77 Ca 0.00 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.56 2jgu n GLY 77 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jgu s LYS 78 N 0.00 4.17 0.32 1.61 2.20 0.15 -4.97 119.74 123.22 2jgu s LYS 78 Ca 0.00 2.47 -0.29 0.00 -0.36 0.00 0.00 55.97 57.80 2jgu s LYS 78 Cb 0.00 -3.31 -0.10 0.00 -1.51 0.00 0.00 37.83 32.91 2jgu s LYS 78 CO 0.00 -0.72 1.21 -2.14 -0.36 0.00 0.00 175.35 173.34 2jgu s PRO 79 N 1.77 4.43 -0.23 4.03 0.02 -1.26 0.45 135.00 144.21 2jgu s PRO 79 Ca 0.74 2.01 -0.20 0.00 0.02 0.00 0.00 61.00 63.57 2jgu s PRO 79 Cb -0.45 -3.07 0.06 0.00 0.02 0.00 0.00 34.50 31.06 2jgu s PRO 79 CO 0.33 -0.05 0.60 -1.50 -0.33 0.00 0.00 177.00 176.05 2jgu s ILE 80 N -1.18 -0.00 0.05 2.83 1.10 -1.02 -4.83 121.20 118.15 2jgu s ILE 80 Ca 0.48 0.01 -0.12 0.00 -0.51 0.00 0.00 60.65 60.50 2jgu s ILE 80 Cb -0.36 -0.84 -0.06 0.00 0.15 0.00 0.00 42.46 41.35 2jgu s ILE 80 CO 0.46 0.00 0.42 0.28 -2.11 0.00 0.00 174.94 174.00 2jgu s THR 81 N 0.54 5.04 0.28 4.00 -1.32 -1.26 -0.74 115.64 122.18 2jgu s THR 81 Ca -0.02 0.65 -0.14 0.00 -1.21 0.00 0.00 61.69 60.97 2jgu s THR 81 Cb -0.05 -3.68 0.01 0.00 -1.51 0.00 0.00 72.50 67.27 2jgu s THR 81 CO -0.02 0.41 0.57 0.68 -2.21 0.00 0.00 174.62 174.04 2jgu s VAL 82 N -1.27 0.00 -0.41 5.08 -7.23 0.39 -4.64 120.40 112.32 2jgu s VAL 82 Ca 0.30 -1.28 -0.13 0.00 -1.81 0.00 0.00 61.98 59.06 2jgu s VAL 82 Cb -0.15 -2.25 0.04 0.00 0.56 0.00 0.00 36.38 34.58 2jgu s VAL 82 CO 0.16 0.00 0.28 0.26 -0.31 0.00 0.00 175.10 175.49 2jgu s TRP 83 N -3.76 3.25 -0.56 2.82 0.52 0.16 -0.05 118.94 121.33 2jgu s TRP 83 Ca 0.19 -0.87 -0.28 0.00 0.02 0.00 0.00 56.10 55.16 2jgu s TRP 83 Cb -0.02 -2.65 0.02 0.00 -1.15 0.00 0.00 33.47 29.66 2jgu s TRP 83 CO 0.10 -0.67 1.30 0.21 0.02 0.00 0.00 176.95 177.91 2jgu s LYS 84 N 1.60 3.44 -0.43 4.98 2.20 -1.14 -1.79 119.74 128.59 2jgu s LYS 84 Ca 0.03 0.40 -0.16 0.00 -0.36 0.00 0.00 55.97 55.89 2jgu s LYS 84 Cb -0.20 -4.06 0.03 0.00 -1.51 0.00 0.00 37.83 32.09 2jgu s LYS 84 CO 0.08 -1.77 0.36 -0.51 -0.36 0.00 0.00 175.35 173.15 2jgu s LEU 85 N 5.44 5.14 0.81 5.43 1.43 -0.41 -3.45 118.68 133.07 2jgu s LEU 85 Ca 0.48 -0.92 -0.12 0.00 -1.03 0.00 0.00 54.13 52.55 2jgu s LEU 85 Cb -0.09 -2.23 0.09 0.00 0.03 0.00 0.00 46.19 43.99 2jgu s LEU 85 CO 0.26 -0.54 1.17 -0.31 0.23 0.00 0.00 176.35 177.16 2jgu s TYR 86 N 1.83 2.78 0.00 0.29 1.51 -0.98 -2.69 117.35 120.09 2jgu s TYR 86 Ca 0.07 0.65 0.00 0.00 -1.01 0.00 0.00 57.07 56.78 2jgu s TYR 86 Cb -0.19 -3.52 0.00 0.00 -0.11 0.00 0.00 41.96 38.14 2jgu s TYR 86 CO 0.10 -1.82 0.00 1.28 -1.11 0.00 0.00 175.55 174.00 2jgu n LEU 87 N -3.31 0.00 -0.03 -1.29 4.32 -0.57 -3.10 117.00 113.02 2jgu n LEU 87 Ca 0.09 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 56.02 2jgu n LEU 87 Cb 0.61 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.39 2jgu n LEU 87 CO 0.55 0.00 -0.70 1.21 -1.22 0.00 0.00 177.39 177.23 2jgu n GLU 88 N 0.00 0.12 -4.66 3.23 4.07 -1.26 -4.38 120.64 117.75 2jgu n GLU 88 Ca 0.00 0.05 -0.23 0.00 -0.06 0.00 0.00 57.16 56.92 2jgu n GLU 88 Cb 0.00 -0.75 -0.15 0.00 -0.06 0.00 0.00 31.44 30.48 2jgu n GLU 88 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 2jgu s HIS 89 N -2.11 1.37 -2.00 4.31 2.46 -1.26 -4.24 115.29 113.82 2jgu s HIS 89 Ca -0.08 -0.27 0.02 0.00 0.47 0.00 0.00 55.06 55.19 2jgu s HIS 89 Cb 0.03 -0.87 0.11 0.00 -0.13 0.00 0.00 32.58 31.72 2jgu s HIS 89 CO 0.10 -0.01 0.38 -0.35 -2.47 0.00 0.00 174.74 172.39 2jgu n PRO 90 N 2.56 0.17 0.00 2.88 -0.04 -1.26 0.56 135.00 139.87 2jgu n PRO 90 Ca -0.15 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.40 2jgu n PRO 90 Cb 0.55 -1.17 -0.07 0.00 -0.04 0.00 0.00 33.50 32.76 2jgu n PRO 90 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2jgu n GLN 91 N -0.67 1.07 0.22 0.54 1.13 -1.26 -3.87 117.38 114.53 2jgu n GLN 91 Ca 0.01 -0.27 0.15 0.00 -1.94 0.00 0.00 57.00 54.95 2jgu n GLN 91 Cb 0.01 -1.37 0.52 0.00 0.11 0.00 0.00 30.24 29.50 2jgu n GLN 91 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 2jgu h ASP 92 N 0.64 0.00 0.38 1.08 3.32 -0.28 -3.35 116.42 118.21 2jgu h ASP 92 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2jgu h ASP 92 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 2jgu h ASP 92 CO 0.00 0.00 -0.18 0.58 -1.72 0.00 0.00 179.24 177.92 2jgu h VAL 93 N 0.00 0.58 0.00 -1.35 2.07 -1.67 -1.94 116.25 113.94 2jgu h VAL 93 Ca 0.00 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.03 2jgu h VAL 93 Cb 0.60 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2jgu h VAL 93 CO 0.00 0.09 0.00 -2.65 0.02 0.00 0.00 177.57 175.03 2jgu n PRO 94 N -5.19 0.08 -0.00 1.57 -0.02 -1.26 -1.10 135.00 129.09 2jgu n PRO 94 Ca -0.10 0.20 0.02 0.00 -2.02 0.00 0.00 63.50 61.61 2jgu n PRO 94 Cb 0.28 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.23 2jgu n PRO 94 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2jgu n THR 95 N -1.24 0.00 -0.08 3.45 -1.04 -1.19 -4.73 114.28 109.44 2jgu n THR 95 Ca 0.03 -0.28 -0.07 0.00 -2.04 0.00 0.00 64.05 61.69 2jgu n THR 95 Cb 0.04 0.76 -0.02 0.00 -1.82 0.00 0.00 70.33 69.28 2jgu n THR 95 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2jgu n LEU 96 N -1.34 1.88 -0.27 -4.42 -0.00 -0.25 -4.71 117.00 107.88 2jgu n LEU 96 Ca 0.00 0.48 -0.01 0.00 -0.00 0.00 0.00 56.01 56.49 2jgu n LEU 96 Cb 0.10 -0.81 0.03 0.00 -0.00 0.00 0.00 43.42 42.74 2jgu n LEU 96 CO 0.10 -0.37 0.41 -2.11 -0.00 0.00 0.00 177.39 175.43 2jgu n ARG 97 N -4.54 -0.17 -0.31 1.96 1.85 -0.76 -0.92 116.66 113.78 2jgu n ARG 97 Ca -0.11 1.09 0.04 0.00 -1.00 0.00 0.00 57.85 57.87 2jgu n ARG 97 Cb 0.40 -1.61 0.19 0.00 -1.05 0.00 0.00 32.46 30.38 2jgu n ARG 97 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2jgu h GLU 98 N 0.00 0.82 -0.82 2.89 4.39 -1.85 0.95 114.58 120.96 2jgu h GLU 98 Ca 0.25 -0.05 0.20 0.00 0.34 0.00 0.00 59.36 60.10 2jgu h GLU 98 Cb 0.42 -0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 28.84 2jgu h GLU 98 CO -0.70 0.54 0.56 0.87 -1.16 0.00 0.00 179.01 179.12 2jgu h LYS 99 N 0.84 0.25 0.00 2.33 1.79 -1.31 -1.35 116.57 119.12 2jgu h LYS 99 Ca 0.42 -0.01 -0.07 0.00 -2.18 0.00 0.00 60.65 58.81 2jgu h LYS 99 Cb 0.40 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.98 2jgu h LYS 99 CO -0.25 0.16 -0.39 0.28 -1.08 0.00 0.00 179.45 178.17 2jgu h VAL 100 N 0.25 1.53 0.00 0.50 2.07 0.88 -3.08 116.25 118.41 2jgu h VAL 100 Ca 0.41 -2.30 0.00 0.00 0.82 0.00 0.00 66.70 65.63 2jgu h VAL 100 Cb 1.22 3.04 0.00 0.00 -1.52 0.00 0.00 31.29 34.03 2jgu h VAL 100 CO -0.10 0.52 0.00 -2.11 0.02 0.00 0.00 177.57 175.90 2jgu n ARG 101 N -4.55 0.13 -0.13 1.57 1.85 -0.36 -0.83 116.66 114.34 2jgu n ARG 101 Ca -0.17 0.52 0.08 0.00 -1.00 0.00 0.00 57.85 57.29 2jgu n ARG 101 Cb 0.54 -1.83 0.27 0.00 -1.05 0.00 0.00 32.46 30.39 2jgu n ARG 101 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2jgu n GLU 102 N -2.09 1.81 -3.46 2.89 1.02 -0.53 -4.83 120.64 115.44 2jgu n GLU 102 Ca 0.00 -1.23 -0.37 0.00 -0.02 0.00 0.00 57.16 55.54 2jgu n GLU 102 Cb 0.11 -1.35 -0.06 0.00 -0.02 0.00 0.00 31.44 30.11 2jgu n GLU 102 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2jgu s HIS 103 N -1.65 3.55 0.45 -0.32 2.46 -0.01 -4.99 115.29 114.78 2jgu s HIS 103 Ca 0.29 0.80 0.27 0.00 0.47 0.00 0.00 55.06 56.89 2jgu s HIS 103 Cb 0.15 -2.39 1.32 0.00 -0.13 0.00 0.00 32.58 31.54 2jgu s HIS 103 CO 0.22 0.33 1.74 -1.35 -2.47 0.00 0.00 174.74 173.21 2jgu h PRO 104 N 6.14 0.20 0.00 2.88 0.11 -1.88 -1.23 132.00 138.21 2jgu h PRO 104 Ca -0.44 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 2jgu h PRO 104 Cb 1.19 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2jgu h PRO 104 CO 0.71 0.13 -0.15 0.00 -0.21 0.00 0.00 178.00 178.48 2jgu h ALA 105 N 1.54 0.90 -2.93 -0.75 0.00 -1.94 -3.44 119.26 112.63 2jgu h ALA 105 Ca 0.65 -0.14 -0.61 0.00 0.00 0.00 0.00 54.91 54.82 2jgu h ALA 105 Cb 2.04 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 19.69 2jgu h ALA 105 CO -0.24 0.19 -0.29 0.14 0.00 0.00 0.00 179.25 179.05 2jgu s VAL 106 N -3.14 5.25 -0.12 0.00 -7.23 -0.47 -0.57 120.40 114.12 2jgu s VAL 106 Ca 0.06 0.56 -0.13 0.00 -1.81 0.00 0.00 61.98 60.66 2jgu s VAL 106 Cb 0.06 -3.66 -0.11 0.00 0.56 0.00 0.00 36.38 33.22 2jgu s VAL 106 CO 0.69 0.28 0.32 0.58 -0.31 0.00 0.00 175.10 176.67 2jgu h VAL 107 N 5.00 0.77 -3.78 1.32 2.07 -1.47 -3.44 116.25 116.72 2jgu h VAL 107 Ca -0.37 -1.58 -0.08 0.00 0.82 0.00 0.00 66.70 65.48 2jgu h VAL 107 Cb 1.16 1.46 -0.14 0.00 -1.52 0.00 0.00 31.29 32.26 2jgu h VAL 107 CO 0.70 0.26 -0.33 -0.62 0.02 0.00 0.00 177.57 177.61 2jgu s ASP 108 N -5.86 0.07 0.10 0.57 -1.08 -1.24 -4.99 116.67 104.25 2jgu s ASP 108 Ca -0.09 -0.66 0.09 0.00 -0.52 0.00 0.00 52.55 51.37 2jgu s ASP 108 Cb -0.01 0.37 -0.04 0.00 -1.46 0.00 0.00 42.92 41.79 2jgu s ASP 108 CO 0.30 -0.77 -0.23 0.27 0.52 0.00 0.00 175.17 175.26 2jgu s ILE 109 N -3.88 1.87 0.10 4.11 -4.36 -1.26 0.47 121.20 118.26 2jgu s ILE 109 Ca 0.07 -1.58 0.01 0.00 -0.26 0.00 0.00 60.65 58.89 2jgu s ILE 109 Cb 0.04 -1.68 -0.04 0.00 1.25 0.00 0.00 42.46 42.03 2jgu s ILE 109 CO -0.09 0.01 -0.03 -0.36 0.24 0.00 0.00 174.94 174.71 2jgu s PHE 110 N -1.10 0.86 -1.56 1.37 0.08 0.44 -4.87 117.98 113.20 2jgu s PHE 110 Ca 0.09 -1.01 -0.10 0.00 0.12 0.00 0.00 56.93 56.03 2jgu s PHE 110 Cb -0.10 -0.52 0.08 0.00 -0.57 0.00 0.00 43.02 41.92 2jgu s PHE 110 CO 0.04 -0.25 0.64 0.39 -0.10 0.00 0.00 175.22 175.94 2jgu n GLU 111 N -0.05 -3.41 -0.13 0.44 1.02 -1.26 -2.05 120.64 115.20 2jgu n GLU 111 Ca -0.11 0.40 0.11 0.00 -0.02 0.00 0.00 57.16 57.54 2jgu n GLU 111 Cb 0.62 -4.88 0.30 0.00 -0.02 0.00 0.00 31.44 27.46 2jgu n GLU 111 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 2jgu n TYR 112 N -4.43 0.35 -1.41 -0.32 4.11 -1.26 -4.45 117.16 109.75 2jgu n TYR 112 Ca -0.09 -0.17 0.01 0.00 -0.00 0.00 0.00 57.90 57.64 2jgu n TYR 112 Cb 0.58 0.00 0.01 0.00 -0.00 0.00 0.00 39.34 39.93 2jgu n TYR 112 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.86 176.46 2jgu n ASP 113 N 0.79 0.37 -4.66 9.48 3.85 -1.26 -4.86 116.55 120.27 2jgu n ASP 113 Ca 0.17 -1.75 -0.43 0.00 -0.71 0.00 0.00 54.79 52.08 2jgu n ASP 113 Cb 0.43 -0.14 -0.02 0.00 -1.35 0.00 0.00 41.12 40.04 2jgu n ASP 113 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 2jgu s ILE 114 N -0.35 3.95 0.37 2.12 -1.09 -1.26 -4.96 121.20 119.98 2jgu s ILE 114 Ca 0.03 1.15 -0.27 0.00 -2.23 0.00 0.00 60.65 59.33 2jgu s ILE 114 Cb 0.03 -3.76 -0.12 0.00 -1.58 0.00 0.00 42.46 37.03 2jgu s ILE 114 CO 0.00 -0.12 1.25 -2.65 -1.23 0.00 0.00 174.94 172.19 2jgu n PRO 115 N 6.91 1.99 -0.05 2.79 -0.02 -1.26 -4.71 135.00 140.65 2jgu n PRO 115 Ca 0.16 0.70 -0.14 0.00 -2.02 0.00 0.00 63.50 62.19 2jgu n PRO 115 Cb 0.44 -2.30 -0.10 0.00 -0.02 0.00 0.00 33.50 31.52 2jgu n PRO 115 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2jgu h PHE 116 N 2.33 -1.59 0.00 6.00 3.57 -1.95 0.00 116.94 125.30 2jgu h PHE 116 Ca -0.46 0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.09 2jgu h PHE 116 Cb 1.29 0.72 -0.00 0.00 2.79 0.00 0.00 35.95 40.75 2jgu h PHE 116 CO 0.49 -0.51 -0.06 0.00 -2.23 0.00 0.00 178.31 176.00 2jgu h ALA 117 N -0.27 1.23 0.13 2.41 0.00 -1.91 0.43 119.26 121.28 2jgu h ALA 117 Ca 0.04 -0.05 -0.28 0.00 0.00 0.00 0.00 54.91 54.62 2jgu h ALA 117 Cb 0.63 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2jgu h ALA 117 CO -0.47 0.07 -1.32 0.87 0.00 0.00 0.00 179.25 178.41 2jgu h LYS 118 N 0.00 0.27 -0.61 0.00 1.57 -1.77 -2.77 116.57 113.26 2jgu h LYS 118 Ca -0.00 -0.46 -0.04 0.00 -1.87 0.00 0.00 60.65 58.28 2jgu h LYS 118 Cb 0.22 0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 2jgu h LYS 118 CO 0.01 1.19 0.23 -0.09 -0.57 0.00 0.00 179.45 180.22 2jgu h ARG 119 N 0.07 0.89 0.64 3.15 9.65 0.85 -2.68 114.38 126.95 2jgu h ARG 119 Ca -0.16 -0.15 -0.03 0.00 -1.10 0.00 0.00 59.98 58.54 2jgu h ARG 119 Cb 1.99 -0.15 0.01 0.00 -1.39 0.00 0.00 29.97 30.42 2jgu h ARG 119 CO 0.19 0.74 -0.31 -0.92 2.80 0.00 0.00 179.97 182.47 2jgu h TYR 120 N 0.87 -0.80 -0.59 2.20 3.20 -0.07 -0.79 116.97 120.99 2jgu h TYR 120 Ca 0.20 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 2jgu h TYR 120 Cb 0.19 0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.69 2jgu h TYR 120 CO 0.01 -0.49 0.27 -0.07 -1.64 0.00 0.00 178.16 176.25 2jgu h LEU 121 N -0.88 0.76 -0.00 2.82 3.38 -1.45 -1.76 115.31 118.18 2jgu h LEU 121 Ca -0.09 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 2jgu h LEU 121 Cb 0.67 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 2jgu h LEU 121 CO 0.14 0.66 0.00 0.40 0.09 0.00 0.00 178.44 179.73 2jgu h ILE 122 N 0.84 1.21 0.00 1.22 2.04 -1.37 0.54 117.51 121.99 2jgu h ILE 122 Ca 0.21 -0.61 -0.06 0.00 1.00 0.00 0.00 64.86 65.39 2jgu h ILE 122 Cb 0.11 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 2jgu h ILE 122 CO -0.03 0.16 -0.28 0.44 0.00 0.00 0.00 178.15 178.44 2jgu h ASP 123 N -0.25 0.00 -0.01 1.72 5.19 -1.01 -2.42 116.42 119.64 2jgu h ASP 123 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2jgu h ASP 123 Cb 0.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.77 2jgu h ASP 123 CO 0.00 0.28 -0.07 1.17 -3.12 0.00 0.00 179.24 177.50 2jgu n LYS 124 N -3.88 1.89 -1.26 3.56 4.81 -0.67 -4.96 118.16 117.65 2jgu n LYS 124 Ca -0.02 -1.42 -0.09 0.00 -0.87 0.00 0.00 58.31 55.91 2jgu n LYS 124 Cb 0.36 -1.47 -0.04 0.00 0.02 0.00 0.00 35.03 33.90 2jgu n LYS 124 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jgu n GLY 125 N 1.30 1.01 3.75 3.14 0.00 -0.09 -4.99 105.19 109.32 2jgu n GLY 125 Ca 0.15 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 2jgu n GLY 125 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jgu s LEU 126 N -2.07 4.60 -0.16 0.99 1.43 -0.01 -4.99 118.68 118.47 2jgu s LEU 126 Ca 0.00 1.98 -0.00 0.00 -1.03 0.00 0.00 54.13 55.08 2jgu s LEU 126 Cb 0.00 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.61 2jgu s LEU 126 CO 0.00 0.05 -0.15 -0.63 0.23 0.00 0.00 176.35 175.85 2jgu s ILE 127 N -0.92 2.68 0.90 -0.59 -1.09 -1.26 -4.63 121.20 116.29 2jgu s ILE 127 Ca 0.43 -0.76 -0.12 0.00 -2.23 0.00 0.00 60.65 57.98 2jgu s ILE 127 Cb -0.27 -2.14 0.13 0.00 -1.58 0.00 0.00 42.46 38.60 2jgu s ILE 127 CO 0.33 0.51 1.09 -2.84 -1.23 0.00 0.00 174.94 172.81 2jgu s PRO 128 N 0.91 1.26 -1.36 2.79 0.02 -1.26 -3.78 135.00 133.57 2jgu s PRO 128 Ca -0.03 0.76 -0.12 0.00 0.02 0.00 0.00 61.00 61.63 2jgu s PRO 128 Cb -0.15 -1.81 0.09 0.00 0.02 0.00 0.00 34.50 32.65 2jgu s PRO 128 CO -0.01 -2.23 0.56 -1.33 -0.33 0.00 0.00 177.00 173.66 2jgu n MET 129 N -3.86 -3.36 -0.03 5.54 2.81 -0.96 -4.48 117.12 112.78 2jgu n MET 129 Ca 0.07 0.44 -0.09 0.00 -1.81 0.00 0.00 57.70 56.30 2jgu n MET 129 Cb 0.56 -5.15 -0.08 0.00 -0.71 0.00 0.00 33.22 27.84 2jgu n MET 129 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 2jgu h GLU 130 N -1.10 -0.05 0.00 0.03 4.81 -1.82 -3.47 114.58 112.98 2jgu h GLU 130 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2jgu h GLU 130 Cb 1.31 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.70 2jgu h GLU 130 CO 0.58 0.52 0.00 0.41 -0.73 0.00 0.00 179.01 179.79 2jgu n GLY 131 N 1.37 -0.99 2.47 1.92 0.00 -1.26 -4.95 105.19 103.75 2jgu n GLY 131 Ca -0.07 -0.32 -0.16 0.00 0.00 0.00 0.00 46.02 45.47 2jgu n GLY 131 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jgu n GLU 132 N 0.00 0.76 -4.15 1.61 0.00 -1.26 -5.09 120.64 112.50 2jgu n GLU 132 Ca 0.00 -2.47 -0.23 0.00 0.00 0.00 0.00 57.16 54.46 2jgu n GLU 132 Cb 0.00 -1.34 -0.05 0.00 0.00 0.00 0.00 31.44 30.05 2jgu n GLU 132 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 2jgu s GLU 133 N -0.27 2.78 -0.45 5.31 0.41 -1.26 -5.05 118.70 120.17 2jgu s GLU 133 Ca 0.33 -1.12 -0.23 0.00 -0.41 0.00 0.00 54.97 53.55 2jgu s GLU 133 Cb 0.21 -2.48 0.03 0.00 -1.78 0.00 0.00 34.13 30.10 2jgu s GLU 133 CO -0.18 0.40 0.77 -2.00 -0.49 0.00 0.00 175.26 173.76 2jgu s GLU 134 N -3.74 3.39 0.57 1.61 2.12 -1.26 -5.03 118.70 116.36 2jgu s GLU 134 Ca 0.32 -0.14 -0.14 0.00 0.36 0.00 0.00 54.97 55.38 2jgu s GLU 134 Cb -0.08 -3.94 -0.06 0.00 0.26 0.00 0.00 34.13 30.31 2jgu s GLU 134 CO 0.24 -1.11 1.01 -0.51 -0.54 0.00 0.00 175.26 174.35 2jgu s LEU 135 N 3.24 3.44 -0.25 2.70 1.43 -1.26 -5.02 118.68 122.97 2jgu s LEU 135 Ca 0.29 1.53 -0.08 0.00 -1.03 0.00 0.00 54.13 54.85 2jgu s LEU 135 Cb -0.12 -4.50 -0.03 0.00 0.03 0.00 0.00 46.19 41.57 2jgu s LEU 135 CO 0.22 -0.77 0.09 -0.54 0.23 0.00 0.00 176.35 175.58 2jgu s LYS 136 N -4.53 3.69 -0.08 1.70 -0.14 -1.26 -4.96 119.74 114.15 2jgu s LYS 136 Ca 0.58 -0.46 -0.02 0.00 -1.36 0.00 0.00 55.97 54.71 2jgu s LYS 136 Cb -0.11 -3.37 -0.03 0.00 -1.68 0.00 0.00 37.83 32.64 2jgu s LYS 136 CO 0.41 -0.19 0.02 0.42 -0.76 0.00 0.00 175.35 175.25 2jgu s ILE 137 N 1.63 4.44 -0.11 2.17 1.09 -1.26 -0.91 121.20 128.24 2jgu s ILE 137 Ca 0.06 -0.23 -0.07 0.00 -1.10 0.00 0.00 60.65 59.31 2jgu s ILE 137 Cb -0.15 -2.89 0.04 0.00 -1.06 0.00 0.00 42.46 38.40 2jgu s ILE 137 CO 0.05 0.58 0.28 -0.22 -0.10 0.00 0.00 174.94 175.52 2jgu s LEU 138 N -0.98 0.49 0.23 2.97 2.96 -1.08 -4.73 118.68 118.54 2jgu s LEU 138 Ca 0.14 0.58 0.11 0.00 -0.22 0.00 0.00 54.13 54.75 2jgu s LEU 138 Cb -0.11 0.88 -0.05 0.00 0.50 0.00 0.00 46.19 47.41 2jgu s LEU 138 CO 0.03 -0.15 -0.20 0.00 -1.32 0.00 0.00 176.35 174.71 2jgu s ALA 139 N 0.98 2.52 0.15 5.97 0.00 -0.65 -1.18 121.76 129.54 2jgu s ALA 139 Ca -0.07 -1.74 -0.20 0.00 0.00 0.00 0.00 51.96 49.95 2jgu s ALA 139 Cb -0.08 -0.25 0.06 0.00 0.00 0.00 0.00 23.12 22.85 2jgu s ALA 139 CO -0.07 0.30 0.52 -0.59 0.00 0.00 0.00 175.76 175.92 2jgu s PHE 140 N -2.25 -0.41 0.09 0.00 -0.12 -1.13 0.04 117.98 114.19 2jgu s PHE 140 Ca 0.25 0.16 -0.04 0.00 -0.05 0.00 0.00 56.93 57.25 2jgu s PHE 140 Cb -0.05 0.44 -0.03 0.00 -0.63 0.00 0.00 43.02 42.75 2jgu s PHE 140 CO 0.12 -0.79 0.08 0.34 -0.05 0.00 0.00 175.22 174.92 2jgu s ASP 141 N -2.76 0.30 0.24 1.98 3.68 -0.73 -4.66 116.67 114.72 2jgu s ASP 141 Ca 0.02 -0.92 0.06 0.00 2.13 0.00 0.00 52.55 53.83 2jgu s ASP 141 Cb 0.00 0.28 -0.05 0.00 -1.45 0.00 0.00 42.92 41.70 2jgu s ASP 141 CO -0.12 -0.69 -0.06 0.27 0.13 0.00 0.00 175.17 174.69 2jgu s ILE 142 N -3.93 1.41 -0.02 4.11 -5.25 -1.26 -1.42 121.20 114.84 2jgu s ILE 142 Ca 0.10 -2.10 0.02 0.00 -0.99 0.00 0.00 60.65 57.68 2jgu s ILE 142 Cb 0.06 -2.28 0.00 0.00 2.95 0.00 0.00 42.46 43.20 2jgu s ILE 142 CO -0.07 -0.41 -0.05 -1.61 -1.79 0.00 0.00 174.94 171.00 2jgu s GLU 143 N -3.76 0.56 0.00 0.37 0.41 -0.73 -4.95 118.70 110.60 2jgu s GLU 143 Ca 0.26 -0.17 0.00 0.00 -0.41 0.00 0.00 54.97 54.65 2jgu s GLU 143 Cb 0.03 -0.56 0.00 0.00 -1.78 0.00 0.00 34.13 31.82 2jgu s GLU 143 CO 0.09 0.06 0.00 2.41 -0.49 0.00 0.00 175.26 177.33 2jgu n THR 144 N 3.27 0.00 -3.80 3.63 -1.04 -1.26 0.46 114.28 115.54 2jgu n THR 144 Ca -0.17 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.59 2jgu n THR 144 Cb 0.56 -0.11 -0.17 0.00 -1.82 0.00 0.00 70.33 68.78 2jgu n THR 144 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 2jgu s LEU 145 N 0.00 0.90 -0.66 -4.42 0.05 -1.25 -4.68 118.68 108.62 2jgu s LEU 145 Ca 0.00 -0.31 -0.26 0.00 0.05 0.00 0.00 54.13 53.61 2jgu s LEU 145 Cb 0.00 -0.59 0.04 0.00 -2.05 0.00 0.00 46.19 43.59 2jgu s LEU 145 CO 0.00 -0.20 1.16 -0.47 -0.55 0.00 0.00 176.35 176.29 2jgu s TYR 146 N 1.87 2.49 0.00 3.48 5.04 -1.26 -4.26 117.35 124.71 2jgu s TYR 146 Ca 0.04 -0.02 0.00 0.00 -2.44 0.00 0.00 57.07 54.65 2jgu s TYR 146 Cb -0.13 -4.48 0.00 0.00 0.35 0.00 0.00 41.96 37.70 2jgu s TYR 146 CO -0.07 -1.80 0.00 1.58 -1.34 0.00 0.00 175.55 173.93 2jgu n HIS 147 N 8.63 -0.32 0.26 4.97 -0.00 -1.26 -4.78 115.22 122.73 2jgu n HIS 147 Ca 0.03 0.00 0.15 0.00 -0.00 0.00 0.00 57.72 57.90 2jgu n HIS 147 Cb 0.48 0.00 0.59 0.00 -0.00 0.00 0.00 29.99 31.06 2jgu n HIS 147 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.34 177.83 2jgu h GLU 148 N 0.00 0.00 0.00 1.57 4.57 -2.02 -3.46 114.58 115.24 2jgu h GLU 148 Ca 0.00 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.93 2jgu h GLU 148 Cb 0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 28.53 2jgu h GLU 148 CO 0.00 0.04 -0.18 0.41 -1.18 0.00 0.00 179.01 178.10 2jgu n GLY 149 N 0.18 2.63 3.02 1.92 0.00 -1.26 -5.15 105.19 106.53 2jgu n GLY 149 Ca 0.01 -1.64 -0.37 0.00 0.00 0.00 0.00 46.02 44.01 2jgu n GLY 149 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2jgu n GLU 150 N -0.44 3.14 -0.04 1.61 0.00 -1.26 -4.86 120.64 118.78 2jgu n GLU 150 Ca 0.02 -4.52 -0.12 0.00 0.00 0.00 0.00 57.16 52.54 2jgu n GLU 150 Cb 0.44 -2.43 -0.14 0.00 0.00 0.00 0.00 31.44 29.31 2jgu n GLU 150 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2jgu n GLU 151 N 1.93 0.67 -1.11 3.44 -0.58 -1.26 -5.06 120.64 118.66 2jgu n GLU 151 Ca 0.24 0.23 0.00 0.00 -0.42 0.00 0.00 57.16 57.21 2jgu n GLU 151 Cb 0.37 -1.71 0.00 0.00 -0.57 0.00 0.00 31.44 29.53 2jgu n GLU 151 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2jgu n PHE 152 N -3.08 0.00 -0.31 -0.32 7.35 -1.26 -4.89 117.46 114.95 2jgu n PHE 152 Ca -0.24 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.45 2jgu n PHE 152 Cb 1.07 -1.11 0.00 0.00 0.35 0.00 0.00 39.48 39.79 2jgu n PHE 152 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2jgu n GLY 153 N 0.15 1.23 0.00 7.13 0.00 -1.26 -4.91 105.19 107.52 2jgu n GLY 153 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2jgu n GLY 153 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2jgu n LYS 154 N -0.34 1.53 -2.77 1.61 4.81 -1.26 -4.77 118.16 116.98 2jgu n LYS 154 Ca 0.00 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 2jgu n LYS 154 Cb 0.07 -0.93 -0.03 0.00 0.02 0.00 0.00 35.03 34.16 2jgu n LYS 154 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2jgu s GLY 155 N -1.98 1.85 1.15 3.14 0.00 -1.26 -4.99 107.32 105.23 2jgu s GLY 155 Ca 0.00 0.08 -0.14 0.00 0.00 0.00 0.00 44.72 44.67 2jgu s GLY 155 CO 0.00 1.96 1.04 2.56 0.00 0.00 0.00 173.10 178.66 2jgu s PRO 156 N 2.79 -0.77 -0.49 2.90 0.04 -1.26 -4.64 135.00 133.57 2jgu s PRO 156 Ca 0.41 0.63 -0.21 0.00 0.04 0.00 0.00 61.00 61.87 2jgu s PRO 156 Cb -0.16 -1.59 0.04 0.00 0.04 0.00 0.00 34.50 32.84 2jgu s PRO 156 CO 0.09 -3.57 0.71 0.42 0.04 0.00 0.00 177.00 174.69 2jgu s ILE 157 N -2.62 4.75 0.15 0.56 1.01 -1.26 -3.82 121.20 119.97 2jgu s ILE 157 Ca 0.68 -0.12 -0.13 0.00 0.00 0.00 0.00 60.65 61.08 2jgu s ILE 157 Cb -0.22 -4.33 0.02 0.00 0.01 0.00 0.00 42.46 37.94 2jgu s ILE 157 CO 0.62 -0.81 1.62 0.40 0.00 0.00 0.00 174.94 176.77 2jgu h ILE 158 N 5.90 1.25 -4.00 2.92 2.04 -0.27 -3.47 117.51 121.89 2jgu h ILE 158 Ca -0.26 -0.97 -0.12 0.00 1.00 0.00 0.00 64.86 64.50 2jgu h ILE 158 Cb 1.09 0.94 -0.12 0.00 -0.74 0.00 0.00 36.82 37.98 2jgu h ILE 158 CO 0.97 0.34 -0.36 -0.04 0.00 0.00 0.00 178.15 179.07 2jgu s MET 159 N -5.13 1.23 -0.25 2.37 -1.94 -0.60 -4.49 119.30 110.50 2jgu s MET 159 Ca -0.13 -1.30 -0.02 0.00 -1.71 0.00 0.00 55.69 52.53 2jgu s MET 159 Cb 0.11 0.37 0.13 0.00 2.01 0.00 0.00 34.83 37.45 2jgu s MET 159 CO 0.81 -0.45 0.37 -1.50 -0.01 0.00 0.00 175.02 174.23 2jgu s ILE 160 N -4.02 -0.58 0.27 2.53 2.07 -0.89 -1.78 121.20 118.80 2jgu s ILE 160 Ca 0.23 -0.10 0.09 0.00 -1.41 0.00 0.00 60.65 59.46 2jgu s ILE 160 Cb 0.03 -0.82 -0.04 0.00 0.13 0.00 0.00 42.46 41.76 2jgu s ILE 160 CO 0.04 -0.15 0.03 -0.94 -1.91 0.00 0.00 174.94 172.01 2jgu s SER 161 N 2.53 4.65 0.16 4.50 1.04 -0.50 0.13 113.70 126.20 2jgu s SER 161 Ca 0.12 -0.62 -0.14 0.00 0.48 0.00 0.00 55.95 55.79 2jgu s SER 161 Cb -0.15 -0.89 0.02 0.00 0.10 0.00 0.00 66.02 65.10 2jgu s SER 161 CO -0.17 -0.03 0.39 -0.72 0.98 0.00 0.00 173.24 173.69 2jgu s TYR 162 N -2.32 0.03 0.19 5.02 -0.85 -0.63 -1.77 117.35 117.03 2jgu s TYR 162 Ca 0.32 -0.38 -0.17 0.00 -0.52 0.00 0.00 57.07 56.32 2jgu s TYR 162 Cb -0.06 0.19 0.03 0.00 0.38 0.00 0.00 41.96 42.49 2jgu s TYR 162 CO 0.21 -0.77 0.51 0.00 -1.52 0.00 0.00 175.55 173.99 2jgu s ALA 163 N -3.88 -0.91 0.00 9.51 0.00 0.11 -1.05 121.76 125.54 2jgu s ALA 163 Ca 0.09 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 51.81 2jgu s ALA 163 Cb 0.02 0.85 0.00 0.00 0.00 0.00 0.00 23.12 23.99 2jgu s ALA 163 CO -0.05 -0.80 0.00 -0.40 0.00 0.00 0.00 175.76 174.51 2jgu n ASP 164 N -0.34 0.91 -0.30 0.00 5.75 -0.93 -1.64 116.55 120.00 2jgu n ASP 164 Ca -0.10 0.00 0.11 0.00 -0.01 0.00 0.00 54.79 54.79 2jgu n ASP 164 Cb 0.62 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.74 2jgu n ASP 164 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2jgu n GLU 165 N 0.00 0.76 -0.03 0.11 -0.58 -1.26 -4.49 120.64 115.15 2jgu n GLU 165 Ca 0.00 -0.61 -0.04 0.00 -0.42 0.00 0.00 57.16 56.09 2jgu n GLU 165 Cb 0.00 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.33 2jgu n GLU 165 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2jgu n ASN 166 N -0.59 3.38 -0.47 1.62 5.03 -1.26 -5.09 115.26 117.88 2jgu n ASN 166 Ca 0.08 -0.01 0.00 0.00 0.87 0.00 0.00 54.58 55.52 2jgu n ASN 166 Cb 0.41 0.44 0.00 0.00 -1.02 0.00 0.00 39.78 39.61 2jgu n ASN 166 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 2jgu n GLU 167 N -2.38 0.00 -3.15 3.52 0.28 -1.26 -5.15 120.64 112.50 2jgu n GLU 167 Ca -0.12 0.00 0.04 0.00 -0.16 0.00 0.00 57.16 56.93 2jgu n GLU 167 Cb 0.70 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.56 2jgu n GLU 167 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2jgu s ALA 168 N -1.01 -2.60 0.12 -1.84 0.00 -1.26 -2.18 121.76 113.00 2jgu s ALA 168 Ca 0.00 1.70 0.01 0.00 0.00 0.00 0.00 51.96 53.68 2jgu s ALA 168 Cb 0.00 -2.28 0.01 0.00 0.00 0.00 0.00 23.12 20.85 2jgu s ALA 168 CO 0.00 -1.39 0.11 0.54 0.00 0.00 0.00 175.76 175.01 2jgu n ARG 169 N 5.44 1.22 -3.73 0.00 5.12 -0.22 -4.90 116.66 119.59 2jgu n ARG 169 Ca -0.02 -0.71 -0.13 0.00 -1.93 0.00 0.00 57.85 55.06 2jgu n ARG 169 Cb 0.52 0.05 -0.13 0.00 -1.16 0.00 0.00 32.46 31.73 2jgu n ARG 169 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2jgu s VAL 170 N -0.38 -0.05 -0.15 1.55 1.01 -1.07 -1.60 120.40 119.71 2jgu s VAL 170 Ca 0.08 0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.19 2jgu s VAL 170 Cb -0.01 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 2jgu s VAL 170 CO 0.05 0.06 -0.06 -0.63 0.00 0.00 0.00 175.10 174.53 2jgu s ILE 171 N 1.26 3.74 0.21 2.22 -1.09 0.36 -1.82 121.20 126.08 2jgu s ILE 171 Ca -0.09 -0.42 -0.14 0.00 -2.23 0.00 0.00 60.65 57.77 2jgu s ILE 171 Cb -0.11 -2.62 0.01 0.00 -1.58 0.00 0.00 42.46 38.16 2jgu s ILE 171 CO -0.08 0.50 0.46 0.28 -1.23 0.00 0.00 174.94 174.88 2jgu s THR 172 N 0.34 0.03 -0.45 2.92 -1.32 0.56 -2.09 115.64 115.62 2jgu s THR 172 Ca -0.05 -1.14 0.03 0.00 -1.21 0.00 0.00 61.69 59.32 2jgu s THR 172 Cb -0.14 -1.87 0.45 0.00 -1.51 0.00 0.00 72.50 69.43 2jgu s THR 172 CO 0.03 -0.11 1.51 -2.67 -2.21 0.00 0.00 174.62 171.17 2jgu n TRP 173 N -0.33 2.97 -4.28 9.09 4.27 -1.25 0.70 117.44 128.61 2jgu n TRP 173 Ca -0.06 -2.57 -0.20 0.00 -3.89 0.00 0.00 57.50 50.78 2jgu n TRP 173 Cb 0.62 -0.73 -0.08 0.00 -1.36 0.00 0.00 31.31 29.76 2jgu n TRP 173 CO 0.00 0.00 0.00 0.21 -2.29 0.00 0.00 177.69 175.61 2jgu s LYS 174 N -3.69 1.80 -0.22 -2.67 2.47 -1.26 -4.80 119.74 111.37 2jgu s LYS 174 Ca 0.55 -2.04 -0.08 0.00 -1.56 0.00 0.00 55.97 52.85 2jgu s LYS 174 Cb 0.44 0.33 -0.04 0.00 -1.46 0.00 0.00 37.83 37.11 2jgu s LYS 174 CO -0.02 -0.67 0.09 0.54 0.16 0.00 0.00 175.35 175.45 2jgu s ASN 175 N -3.38 5.61 -0.24 1.43 4.22 -1.26 -4.70 114.94 116.62 2jgu s ASN 175 Ca 0.41 0.01 -0.04 0.00 -2.14 0.00 0.00 52.86 51.10 2jgu s ASN 175 Cb 0.02 -1.99 0.09 0.00 1.28 0.00 0.00 41.25 40.66 2jgu s ASN 175 CO 0.29 0.09 0.17 -0.63 -2.04 0.00 0.00 177.10 174.97 2jgu s ILE 176 N 0.90 -0.19 0.00 0.54 -1.09 -1.26 -5.02 121.20 115.08 2jgu s ILE 176 Ca 0.05 -0.40 0.00 0.00 -2.23 0.00 0.00 60.65 58.07 2jgu s ILE 176 Cb -0.14 -0.80 0.00 0.00 -1.58 0.00 0.00 42.46 39.95 2jgu s ILE 176 CO 0.03 -0.44 0.15 -0.67 -1.23 0.00 0.00 174.94 172.78 2jgu n ASP 177 N 5.28 0.00 -4.53 3.58 4.64 -1.26 -4.81 116.55 119.45 2jgu n ASP 177 Ca -0.05 -1.08 -0.34 0.00 -1.38 0.00 0.00 54.79 51.94 2jgu n ASP 177 Cb 0.46 0.00 -0.12 0.00 -1.04 0.00 0.00 41.12 40.43 2jgu n ASP 177 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 2jgu s LEU 178 N 0.00 3.20 0.13 -2.67 1.43 -1.26 -5.00 118.68 114.50 2jgu s LEU 178 Ca 0.00 -0.09 0.07 0.00 -1.03 0.00 0.00 54.13 53.09 2jgu s LEU 178 Cb 0.00 -1.74 0.39 0.00 0.03 0.00 0.00 46.19 44.87 2jgu s LEU 178 CO 0.00 0.26 1.15 -0.81 0.23 0.00 0.00 176.35 177.17 2jgu n PRO 179 N 2.94 0.05 -0.04 1.29 -0.04 -1.26 -1.42 135.00 136.52 2jgu n PRO 179 Ca -0.18 0.49 0.01 0.00 -0.04 0.00 0.00 63.50 63.79 2jgu n PRO 179 Cb 0.53 -1.76 0.02 0.00 -0.04 0.00 0.00 33.50 32.25 2jgu n PRO 179 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2jgu n TYR 180 N -1.71 0.00 -3.92 0.54 0.18 -1.26 -5.00 117.16 105.99 2jgu n TYR 180 Ca -0.00 -0.44 -0.21 0.00 1.88 0.00 0.00 57.90 59.12 2jgu n TYR 180 Cb 0.12 -0.05 -0.03 0.00 -0.38 0.00 0.00 39.34 38.99 2jgu n TYR 180 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 2jgu s VAL 181 N -1.02 4.10 -0.04 -3.48 1.01 -0.51 -2.61 120.40 117.86 2jgu s VAL 181 Ca 0.05 -1.32 -0.01 0.00 0.00 0.00 0.00 61.98 60.70 2jgu s VAL 181 Cb 0.04 -3.35 0.03 0.00 0.00 0.00 0.00 36.38 33.10 2jgu s VAL 181 CO 0.00 -0.26 0.04 -0.70 0.00 0.00 0.00 175.10 174.18 2jgu s GLU 182 N -3.95 0.06 -0.08 2.72 2.56 -0.75 -4.90 118.70 114.37 2jgu s GLU 182 Ca 0.37 0.27 -0.07 0.00 0.00 0.00 0.00 54.97 55.54 2jgu s GLU 182 Cb -0.07 -0.51 -0.04 0.00 2.00 0.00 0.00 34.13 35.51 2jgu s GLU 182 CO 0.26 -0.27 0.18 -1.12 -0.56 0.00 0.00 175.26 173.75 2jgu s SER 183 N 1.76 6.42 -0.06 -1.70 0.01 -1.24 -0.32 113.70 118.58 2jgu s SER 183 Ca 0.00 0.49 -0.02 0.00 1.31 0.00 0.00 55.95 57.72 2jgu s SER 183 Cb -0.12 -2.07 0.04 0.00 0.21 0.00 0.00 66.02 64.07 2jgu s SER 183 CO -0.03 0.36 0.12 -0.69 0.41 0.00 0.00 173.24 173.42 2jgu s VAL 184 N -1.11 -0.05 0.04 3.43 1.01 0.22 -4.93 120.40 119.01 2jgu s VAL 184 Ca 0.19 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.36 2jgu s VAL 184 Cb -0.13 -0.21 0.05 0.00 0.00 0.00 0.00 36.38 36.09 2jgu s VAL 184 CO 0.08 0.07 0.20 -1.54 0.00 0.00 0.00 175.10 173.91 2jgu n SER 185 N 4.13 0.03 -3.34 3.32 3.41 -1.26 -3.91 113.62 116.00 2jgu n SER 185 Ca -0.26 0.21 -0.15 0.00 -0.26 0.00 0.00 58.87 58.41 2jgu n SER 185 Cb 0.52 -0.09 -0.05 0.00 -0.26 0.00 0.00 64.21 64.32 2jgu n SER 185 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2jgu s THR 186 N -4.36 0.00 -0.22 6.66 -4.23 -1.26 -4.98 115.64 107.25 2jgu s THR 186 Ca -0.01 -1.67 0.22 0.00 -1.18 0.00 0.00 61.69 59.05 2jgu s THR 186 Cb 0.04 -2.59 0.26 0.00 1.34 0.00 0.00 72.50 71.55 2jgu s THR 186 CO 0.10 0.00 1.64 1.05 -0.54 0.00 0.00 174.62 176.87 2jgu h GLU 187 N 2.14 0.00 0.15 3.99 4.11 -1.92 -2.80 114.58 120.26 2jgu h GLU 187 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.15 2jgu h GLU 187 Cb 1.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 2jgu h GLU 187 CO 0.39 0.16 -0.15 0.87 0.07 0.00 0.00 179.01 180.35 2jgu h LYS 188 N 0.00 -0.31 0.00 1.06 6.56 -1.95 -2.68 116.57 119.25 2jgu h LYS 188 Ca -0.00 0.02 -0.04 0.00 -1.06 0.00 0.00 60.65 59.57 2jgu h LYS 188 Cb 1.01 0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 32.74 2jgu h LYS 188 CO 0.02 -0.21 -0.19 0.93 -2.06 0.00 0.00 179.45 177.94 2jgu h GLU 189 N -0.33 0.00 0.33 3.15 4.39 -1.91 -2.59 114.58 117.63 2jgu h GLU 189 Ca 0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 2jgu h GLU 189 Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2jgu h GLU 189 CO -0.04 0.19 -0.16 1.98 -1.16 0.00 0.00 179.01 179.82 2jgu h MET 190 N 0.00 -0.43 -0.98 2.33 1.85 -1.21 -1.51 114.93 114.98 2jgu h MET 190 Ca -0.00 0.03 0.08 0.00 -0.61 0.00 0.00 59.70 59.20 2jgu h MET 190 Cb 0.40 0.10 -0.07 0.00 0.43 0.00 0.00 31.60 32.46 2jgu h MET 190 CO 0.02 -0.22 0.63 0.82 -0.40 0.00 0.00 176.91 177.76 2jgu h ILE 191 N -0.55 1.03 -0.52 1.77 2.04 -1.30 -1.80 117.51 118.18 2jgu h ILE 191 Ca -0.05 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.39 2jgu h ILE 191 Cb 0.41 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 2jgu h ILE 191 CO 0.08 0.20 0.14 0.11 0.00 0.00 0.00 178.15 178.68 2jgu h LYS 192 N 1.09 0.83 -0.05 2.37 1.57 -1.12 -0.10 116.57 121.16 2jgu h LYS 192 Ca 0.44 -0.19 0.03 0.00 -1.87 0.00 0.00 60.65 59.06 2jgu h LYS 192 Cb 0.27 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 2jgu h LYS 192 CO -0.19 0.78 -0.14 0.00 -0.57 0.00 0.00 179.45 179.33 2jgu h ARG 193 N 0.73 -0.20 0.06 3.15 2.47 -0.86 0.77 114.38 120.50 2jgu h ARG 193 Ca 0.17 0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.91 2jgu h ARG 193 Cb 0.31 0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.64 2jgu h ARG 193 CO -0.00 -0.13 -0.40 0.35 0.56 0.00 0.00 179.97 180.35 2jgu h PHE 194 N -0.21 -1.16 -0.63 3.04 -0.00 -1.13 0.63 116.94 117.49 2jgu h PHE 194 Ca 0.06 0.03 0.12 0.00 -0.00 0.00 0.00 57.97 58.18 2jgu h PHE 194 Cb 0.29 0.50 -0.09 0.00 -0.00 0.00 0.00 35.95 36.65 2jgu h PHE 194 CO -0.22 -0.44 0.15 -0.07 -0.00 0.00 0.00 178.31 177.73 2jgu h LEU 195 N -0.54 0.03 -1.91 0.59 3.38 0.01 0.27 115.31 117.13 2jgu h LEU 195 Ca 0.00 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2jgu h LEU 195 Cb 0.56 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 2jgu h LEU 195 CO -0.23 0.02 0.07 -0.09 0.09 0.00 0.00 178.44 178.29 2jgu h ARG 196 N 0.28 0.12 0.10 1.13 2.43 0.13 -1.52 114.38 117.05 2jgu h ARG 196 Ca 0.33 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.49 2jgu h ARG 196 Cb 0.50 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2jgu h ARG 196 CO -0.41 0.08 -0.05 0.82 -1.51 0.00 0.00 179.97 178.90 2jgu h ILE 197 N 0.12 1.13 0.00 1.20 1.08 0.36 0.67 117.51 122.07 2jgu h ILE 197 Ca 0.04 -1.17 0.00 0.00 -0.39 0.00 0.00 64.86 63.34 2jgu h ILE 197 Cb 0.00 1.84 0.00 0.00 -3.07 0.00 0.00 36.82 35.59 2jgu h ILE 197 CO -0.01 0.27 0.00 0.16 -0.69 0.00 0.00 178.15 177.88 2jgu h ILE 198 N -0.71 0.00 0.00 -0.67 -2.65 -0.71 0.17 117.51 112.94 2jgu h ILE 198 Ca -0.01 -0.02 -0.00 0.00 1.03 0.00 0.00 64.86 65.86 2jgu h ILE 198 Cb 0.54 0.58 0.00 0.00 -2.05 0.00 0.00 36.82 35.90 2jgu h ILE 198 CO 0.02 0.00 -0.00 -0.09 0.03 0.00 0.00 178.15 178.11 2jgu h ARG 199 N 0.00 -0.00 -0.17 0.16 2.43 -0.62 0.31 114.38 116.49 2jgu h ARG 199 Ca 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2jgu h ARG 199 Cb 0.03 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2jgu h ARG 199 CO 0.00 0.99 0.10 0.93 -1.51 0.00 0.00 179.97 180.48 2jgu h GLU 200 N -1.00 0.24 -0.49 0.20 5.08 -0.11 -3.18 114.58 115.33 2jgu h GLU 200 Ca -0.00 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.20 2jgu h GLU 200 Cb 0.99 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 2jgu h GLU 200 CO 0.00 0.23 -0.22 -0.22 -1.00 0.00 0.00 179.01 177.80 2jgu h LYS 201 N 0.18 1.01 -6.36 2.33 1.63 -0.82 -3.49 116.57 111.05 2jgu h LYS 201 Ca 0.06 -0.43 -0.36 0.00 -0.85 0.00 0.00 60.65 59.07 2jgu h LYS 201 Cb 0.06 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.67 2jgu h LYS 201 CO -0.01 1.11 -0.79 -3.47 -3.45 0.00 0.00 179.45 172.84 2jgu n ASP 202 N -4.11 -5.64 -4.84 4.20 2.03 0.11 -4.93 116.55 103.38 2jgu n ASP 202 Ca 0.00 -0.74 -0.32 0.00 0.52 0.00 0.00 54.79 54.24 2jgu n ASP 202 Cb 0.46 -2.73 -0.05 0.00 -0.72 0.00 0.00 41.12 38.08 2jgu n ASP 202 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2jgu s PRO 203 N -4.56 4.03 0.05 -0.67 0.04 -1.26 -4.87 135.00 127.77 2jgu s PRO 203 Ca 0.04 0.87 0.01 0.00 0.04 0.00 0.00 61.00 61.96 2jgu s PRO 203 Cb -0.02 -2.26 -0.25 0.00 0.04 0.00 0.00 34.50 32.01 2jgu s PRO 203 CO 0.86 -0.04 1.05 -0.44 0.04 0.00 0.00 177.00 178.46 2jgu h ASP 204 N 1.65 0.24 -3.22 6.66 3.32 -1.38 -3.45 116.42 120.25 2jgu h ASP 204 Ca -0.48 -0.29 -0.56 0.00 0.02 0.00 0.00 57.03 55.72 2jgu h ASP 204 Cb 1.18 -0.08 -0.36 0.00 0.22 0.00 0.00 39.33 40.30 2jgu h ASP 204 CO 0.63 1.23 -0.82 -0.63 -1.72 0.00 0.00 179.24 177.93 2jgu s ILE 205 N -2.65 1.28 -0.22 0.35 1.01 -0.83 -0.94 121.20 119.20 2jgu s ILE 205 Ca -0.04 -0.48 -0.06 0.00 0.00 0.00 0.00 60.65 60.07 2jgu s ILE 205 Cb 0.08 -1.22 -0.03 0.00 0.01 0.00 0.00 42.46 41.30 2jgu s ILE 205 CO 0.85 0.41 0.03 -0.51 0.00 0.00 0.00 174.94 175.72 2jgu s ILE 206 N 1.35 4.17 -0.21 2.92 1.10 0.11 -2.63 121.20 128.01 2jgu s ILE 206 Ca -0.00 -0.23 -0.13 0.00 -0.51 0.00 0.00 60.65 59.78 2jgu s ILE 206 Cb -0.14 -2.91 -0.05 0.00 0.15 0.00 0.00 42.46 39.51 2jgu s ILE 206 CO -0.06 0.39 0.26 -0.69 -2.11 0.00 0.00 174.94 172.73 2jgu s VAL 207 N 1.20 5.31 0.00 4.00 1.01 -0.33 -0.27 120.40 131.32 2jgu s VAL 207 Ca 0.04 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.43 2jgu s VAL 207 Cb -0.14 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.64 2jgu s VAL 207 CO 0.02 0.33 0.00 0.35 0.00 0.00 0.00 175.10 175.81 2jgu n THR 208 N 4.09 0.00 -3.16 3.92 -2.24 -0.96 -2.83 114.28 113.10 2jgu n THR 208 Ca -0.12 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.52 2jgu n THR 208 Cb 0.52 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.70 2jgu n THR 208 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2jgu s TYR 209 N -0.18 -0.55 -0.14 4.78 5.04 -1.26 -1.08 117.35 123.96 2jgu s TYR 209 Ca 0.00 -0.98 0.00 0.00 -2.44 0.00 0.00 57.07 53.65 2jgu s TYR 209 Cb 0.00 -0.22 0.00 0.00 0.35 0.00 0.00 41.96 42.09 2jgu s TYR 209 CO 0.00 -1.06 0.00 -1.71 -1.34 0.00 0.00 175.55 171.44 2jgu n ASN 210 N 3.52 -2.82 0.20 4.32 5.15 -1.26 -4.85 115.26 119.51 2jgu n ASN 210 Ca 0.18 0.03 0.06 0.00 -0.60 0.00 0.00 54.58 54.25 2jgu n ASN 210 Cb 0.51 -0.79 0.38 0.00 -0.53 0.00 0.00 39.78 39.35 2jgu n ASN 210 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 2jgu h GLY 211 N 0.00 0.00 0.93 8.20 0.00 -1.92 0.93 103.07 111.20 2jgu h GLY 211 Ca -0.03 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.31 2jgu h GLY 211 CO 0.04 0.00 0.11 -0.55 0.00 0.00 0.00 176.54 176.14 2jgu h ASP 212 N 0.00 0.18 0.94 0.19 3.32 -1.92 -0.81 116.42 118.31 2jgu h ASP 212 Ca -0.00 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 2jgu h ASP 212 Cb 0.82 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 2jgu h ASP 212 CO 0.04 0.13 -1.11 -1.28 -1.72 0.00 0.00 179.24 175.31 2jgu h SER 213 N 0.24 0.00 0.00 6.45 0.87 -1.68 -3.40 113.55 116.02 2jgu h SER 213 Ca 0.09 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2jgu h SER 213 Cb 0.01 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2jgu h SER 213 CO -0.05 0.27 0.00 0.33 -0.53 0.00 0.00 176.83 176.85 2jgu n PHE 214 N -2.82 0.00 -0.23 2.24 -0.00 0.32 -4.64 117.46 112.33 2jgu n PHE 214 Ca -0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 57.45 57.38 2jgu n PHE 214 Cb 0.68 0.10 0.03 0.00 -0.00 0.00 0.00 39.48 40.30 2jgu n PHE 214 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 2jgu h ASP 215 N 0.00 -1.04 -0.38 -2.13 5.19 -1.59 -0.76 116.42 115.71 2jgu h ASP 215 Ca 0.00 0.23 -0.06 0.00 -0.62 0.00 0.00 57.03 56.58 2jgu h ASP 215 Cb 0.00 0.55 -0.01 0.00 0.18 0.00 0.00 39.33 40.05 2jgu h ASP 215 CO 0.00 -0.29 0.01 -0.26 -3.12 0.00 0.00 179.24 175.58 2jgu h PHE 216 N -0.10 0.73 0.00 4.55 -1.00 -1.43 -2.85 116.94 116.84 2jgu h PHE 216 Ca 0.27 -0.12 0.00 0.00 2.81 0.00 0.00 57.97 60.93 2jgu h PHE 216 Cb 0.55 -0.19 0.00 0.00 3.61 0.00 0.00 35.95 39.92 2jgu h PHE 216 CO -0.64 0.75 -0.17 -0.35 -1.61 0.00 0.00 178.31 176.29 2jgu n PRO 217 N -4.48 0.04 -0.03 1.51 -0.04 -1.07 -2.70 135.00 128.23 2jgu n PRO 217 Ca -0.01 0.02 -0.13 0.00 -0.04 0.00 0.00 63.50 63.34 2jgu n PRO 217 Cb 0.27 -1.54 -0.09 0.00 -0.04 0.00 0.00 33.50 32.11 2jgu n PRO 217 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 2jgu h TYR 218 N 0.00 0.15 -0.78 0.54 3.20 -1.05 -2.20 116.97 116.84 2jgu h TYR 218 Ca 0.00 -0.05 0.14 0.00 3.14 0.00 0.00 58.73 61.97 2jgu h TYR 218 Cb 0.53 -0.03 -0.09 0.00 1.54 0.00 0.00 36.73 38.68 2jgu h TYR 218 CO 0.00 0.58 0.34 -0.07 -1.64 0.00 0.00 178.16 177.37 2jgu h LEU 219 N -0.32 0.35 0.33 2.82 3.38 -1.51 -1.97 115.31 118.38 2jgu h LEU 219 Ca 0.01 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2jgu h LEU 219 Cb 0.56 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2jgu h LEU 219 CO 0.01 0.14 -0.16 0.00 0.09 0.00 0.00 178.44 178.52 2jgu h ALA 220 N 1.55 -0.44 -0.63 1.53 0.00 -1.45 -3.08 119.26 116.74 2jgu h ALA 220 Ca 0.42 -0.19 0.18 0.00 0.00 0.00 0.00 54.91 55.33 2jgu h ALA 220 Cb 0.63 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2jgu h ALA 220 CO -0.39 -0.56 0.59 -0.22 0.00 0.00 0.00 179.25 178.68 2jgu h LYS 221 N -0.82 0.00 -0.82 0.00 1.63 -1.04 -0.25 116.57 115.27 2jgu h LYS 221 Ca -0.05 0.00 -0.38 0.00 -0.85 0.00 0.00 60.65 59.38 2jgu h LYS 221 Cb 0.52 0.00 -0.23 0.00 -0.60 0.00 0.00 32.23 31.93 2jgu h LYS 221 CO 0.07 0.00 0.43 -2.13 -3.45 0.00 0.00 179.45 174.37 2jgu n ARG 222 N -3.81 2.58 0.00 1.90 3.00 -0.77 -4.16 116.66 115.40 2jgu n ARG 222 Ca 0.12 -3.06 0.00 0.00 -0.00 0.00 0.00 57.85 54.92 2jgu n ARG 222 Cb 0.83 -2.13 0.00 0.00 0.00 0.00 0.00 32.46 31.16 2jgu n ARG 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2jgu n ALA 223 N -0.88 0.46 0.55 5.13 0.00 -0.27 -4.55 120.51 120.96 2jgu n ALA 223 Ca 0.50 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.96 2jgu n ALA 223 Cb 1.49 0.00 0.10 0.00 0.00 0.00 0.00 19.45 21.04 2jgu n ALA 223 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jgu n GLU 224 N -0.62 0.27 0.00 0.00 -0.58 -0.27 -1.58 120.64 117.86 2jgu n GLU 224 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2jgu n GLU 224 Cb 0.00 -1.20 0.00 0.00 -0.57 0.00 0.00 31.44 29.67 2jgu n GLU 224 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2jgu n LYS 225 N -0.70 3.17 0.00 3.49 0.00 -1.26 -4.75 118.16 118.11 2jgu n LYS 225 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.34 2jgu n LYS 225 Cb 0.01 -0.63 0.00 0.00 0.00 0.00 0.00 35.03 34.41 2jgu n LYS 225 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2jgu n LEU 226 N -0.90 1.33 -2.89 3.14 7.94 -0.61 -5.05 117.00 119.96 2jgu n LEU 226 Ca 0.00 -1.33 -0.02 0.00 -1.11 0.00 0.00 56.01 53.55 2jgu n LEU 226 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2jgu n LEU 226 CO 0.00 0.33 0.24 0.61 -1.11 0.00 0.00 177.39 177.46 2jgu n GLY 227 N -0.22 -1.20 3.49 -3.96 0.00 -0.93 -5.03 105.19 97.34 2jgu n GLY 227 Ca 0.00 0.64 -0.04 0.00 0.00 0.00 0.00 46.02 46.63 2jgu n GLY 227 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jgu s ILE 228 N -2.85 -0.87 0.22 -0.61 1.09 -1.23 -5.11 121.20 111.84 2jgu s ILE 228 Ca 0.07 0.06 -0.30 0.00 -1.10 0.00 0.00 60.65 59.38 2jgu s ILE 228 Cb -0.02 -0.88 -0.09 0.00 -1.06 0.00 0.00 42.46 40.41 2jgu s ILE 228 CO 0.70 0.02 1.22 -0.54 -0.10 0.00 0.00 174.94 176.25 2jgu s LYS 229 N 2.79 4.47 -1.18 2.79 3.01 -1.26 -4.74 119.74 125.63 2jgu s LYS 229 Ca -0.03 1.95 -0.16 0.00 -1.01 0.00 0.00 55.97 56.71 2jgu s LYS 229 Cb -0.12 -3.20 0.13 0.00 -1.01 0.00 0.00 37.83 33.62 2jgu s LYS 229 CO -0.17 -0.09 1.48 -1.17 0.51 0.00 0.00 175.35 175.90 2jgu s LEU 230 N -0.56 4.58 -1.32 3.17 2.96 -1.26 -4.88 118.68 121.36 2jgu s LEU 230 Ca 0.52 -2.57 -0.15 0.00 -0.22 0.00 0.00 54.13 51.72 2jgu s LEU 230 Cb -0.34 -2.47 -0.02 0.00 0.50 0.00 0.00 46.19 43.86 2jgu s LEU 230 CO 0.39 -0.98 2.27 0.41 -1.32 0.00 0.00 176.35 177.13 2jgu n THR 231 N 5.44 3.21 -0.04 3.68 -1.04 -1.26 -2.79 114.28 121.48 2jgu n THR 231 Ca 0.38 -2.58 0.02 0.00 -2.04 0.00 0.00 64.05 59.83 2jgu n THR 231 Cb 0.45 -2.53 -0.14 0.00 -1.82 0.00 0.00 70.33 66.29 2jgu n THR 231 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2jgu n ILE 232 N 5.00 0.46 -1.15 12.58 5.41 -0.63 -4.72 119.36 136.32 2jgu n ILE 232 Ca 0.55 -0.54 -0.28 0.00 1.00 0.00 0.00 62.75 63.48 2jgu n ILE 232 Cb 0.35 -0.17 0.23 0.00 -0.71 0.00 0.00 39.64 39.35 2jgu n ILE 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2jgu n GLY 233 N 1.65 -2.58 0.15 7.39 0.00 0.18 -4.88 105.19 107.10 2jgu n GLY 233 Ca -0.13 -1.52 0.12 0.00 0.00 0.00 0.00 46.02 44.49 2jgu n GLY 233 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2jgu h ARG 234 N 0.00 0.00 -0.71 1.61 3.08 0.43 -2.84 114.38 115.95 2jgu h ARG 234 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.66 2jgu h ARG 234 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 2jgu h ARG 234 CO 0.26 0.00 0.00 -0.40 -1.07 0.00 0.00 179.97 178.76 2jgu n ASP 235 N -2.71 4.00 -3.20 7.04 5.68 -1.26 -4.88 116.55 121.23 2jgu n ASP 235 Ca 0.03 -2.57 -0.09 0.00 -0.50 0.00 0.00 54.79 51.66 2jgu n ASP 235 Cb 0.51 -0.60 0.00 0.00 -1.14 0.00 0.00 41.12 39.89 2jgu n ASP 235 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jgu n GLY 236 N 0.46 -1.19 3.36 6.12 0.00 -1.07 -5.01 105.19 107.86 2jgu n GLY 236 Ca 0.18 0.67 -0.10 0.00 0.00 0.00 0.00 46.02 46.78 2jgu n GLY 236 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jgu s SER 237 N -2.84 0.02 0.57 1.61 1.04 -1.26 -4.91 113.70 107.93 2jgu s SER 237 Ca 0.06 -0.86 -0.04 0.00 0.48 0.00 0.00 55.95 55.59 2jgu s SER 237 Cb -0.01 0.45 0.01 0.00 0.10 0.00 0.00 66.02 66.57 2jgu s SER 237 CO 0.79 -0.91 0.86 -1.61 0.98 0.00 0.00 173.24 173.35 2jgu s GLU 238 N -3.97 2.84 0.48 4.02 2.02 -1.12 0.52 118.70 123.49 2jgu s GLU 238 Ca 0.17 -0.17 -0.24 0.00 0.02 0.00 0.00 54.97 54.75 2jgu s GLU 238 Cb 0.03 -2.33 -0.07 0.00 0.10 0.00 0.00 34.13 31.86 2jgu s GLU 238 CO 0.01 -0.68 1.39 -2.14 0.02 0.00 0.00 175.26 173.85 2jgu s PRO 239 N -4.92 3.52 -0.02 0.39 0.02 -1.26 -4.72 135.00 128.00 2jgu s PRO 239 Ca 0.54 2.32 0.04 0.00 0.02 0.00 0.00 61.00 63.91 2jgu s PRO 239 Cb -0.10 -2.52 -0.01 0.00 0.02 0.00 0.00 34.50 31.89 2jgu s PRO 239 CO 0.43 -0.92 -0.13 0.21 -0.33 0.00 0.00 177.00 176.27 2jgu s LYS 240 N -2.60 1.16 0.20 5.54 2.20 -1.04 -5.04 119.74 120.16 2jgu s LYS 240 Ca 0.64 -0.45 -0.28 0.00 -0.36 0.00 0.00 55.97 55.52 2jgu s LYS 240 Cb -0.42 -1.09 -0.08 0.00 -1.51 0.00 0.00 37.83 34.73 2jgu s LYS 240 CO 0.52 0.23 0.89 -1.64 -0.36 0.00 0.00 175.35 174.99 2jgu s MET 241 N -0.12 4.75 0.07 4.03 -1.94 -1.26 -2.12 119.30 122.71 2jgu s MET 241 Ca 0.01 1.38 0.05 0.00 -1.71 0.00 0.00 55.69 55.42 2jgu s MET 241 Cb -0.07 -3.29 -0.03 0.00 2.01 0.00 0.00 34.83 33.45 2jgu s MET 241 CO 0.00 0.49 -0.13 -0.65 -0.01 0.00 0.00 175.02 174.72 2jgu s GLN 242 N -0.98 0.80 0.37 2.03 -1.52 0.21 -4.92 119.66 115.64 2jgu s GLN 242 Ca 0.40 -0.97 -0.22 0.00 -1.95 0.00 0.00 55.36 52.62 2jgu s GLN 242 Cb -0.25 -0.74 -0.10 0.00 -0.22 0.00 0.00 33.01 31.71 2jgu s GLN 242 CO 0.30 0.16 0.90 -0.98 -0.25 0.00 0.00 175.29 175.41 2jgu s ARG 243 N -1.90 4.31 0.00 2.91 1.70 -1.26 -1.91 118.95 122.80 2jgu s ARG 243 Ca -0.01 1.10 0.00 0.00 -0.47 0.00 0.00 55.73 56.35 2jgu s ARG 243 Cb -0.09 -2.46 0.00 0.00 -0.57 0.00 0.00 34.95 31.83 2jgu s ARG 243 CO 0.02 0.13 0.00 -0.89 -1.08 0.00 0.00 175.30 173.47 2jgu n ILE 244 N -0.12 0.00 -0.78 4.99 5.41 -1.23 -4.88 119.36 122.74 2jgu n ILE 244 Ca 0.04 0.00 -0.33 0.00 1.00 0.00 0.00 62.75 63.46 2jgu n ILE 244 Cb 0.52 0.00 0.12 0.00 -0.71 0.00 0.00 39.64 39.57 2jgu n ILE 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2jgu n GLY 245 N 0.00 -2.66 0.57 7.39 0.00 -1.26 -4.57 105.19 104.66 2jgu n GLY 245 Ca 0.00 -0.52 0.37 0.00 0.00 0.00 0.00 46.02 45.87 2jgu n GLY 245 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2jgu h ASP 246 N -1.72 0.00 -4.03 1.61 1.82 -2.01 -3.39 116.42 108.70 2jgu h ASP 246 Ca -0.45 0.00 -0.44 0.00 -0.39 0.00 0.00 57.03 55.74 2jgu h ASP 246 Cb 1.31 0.00 0.16 0.00 0.68 0.00 0.00 39.33 41.48 2jgu h ASP 246 CO 0.30 0.00 0.37 -0.04 -1.61 0.00 0.00 179.24 178.26 2jgu s MET 247 N -4.70 0.53 -0.18 0.28 -1.94 -1.26 -5.04 119.30 106.97 2jgu s MET 247 Ca -0.04 -0.25 0.00 0.00 -1.71 0.00 0.00 55.69 53.69 2jgu s MET 247 Cb 0.20 -1.82 0.04 0.00 2.01 0.00 0.00 34.83 35.27 2jgu s MET 247 CO 0.69 -2.51 -0.09 -0.08 -0.01 0.00 0.00 175.02 173.02 2jgu s THR 248 N -3.67 1.45 0.56 2.05 -1.32 -1.26 -3.57 115.64 109.87 2jgu s THR 248 Ca 0.71 -0.85 0.06 0.00 -1.21 0.00 0.00 61.69 60.40 2jgu s THR 248 Cb -0.06 -1.55 0.07 0.00 -1.51 0.00 0.00 72.50 69.44 2jgu s THR 248 CO 0.53 0.17 0.77 0.00 -2.21 0.00 0.00 174.62 173.88 2jgu s ALA 249 N 1.49 4.33 -0.29 11.08 0.00 -0.80 -4.68 121.76 132.88 2jgu s ALA 249 Ca -0.00 -1.80 0.01 0.00 0.00 0.00 0.00 51.96 50.16 2jgu s ALA 249 Cb -0.16 -1.72 0.09 0.00 0.00 0.00 0.00 23.12 21.33 2jgu s ALA 249 CO -0.08 -0.81 0.04 0.08 0.00 0.00 0.00 175.76 174.99 2jgu s VAL 250 N -2.69 1.35 0.52 0.00 1.01 -1.26 0.66 120.40 119.98 2jgu s VAL 250 Ca 0.60 -1.51 -0.13 0.00 0.00 0.00 0.00 61.98 60.94 2jgu s VAL 250 Cb -0.08 -1.89 -0.06 0.00 0.00 0.00 0.00 36.38 34.35 2jgu s VAL 250 CO 0.38 -0.48 0.93 -0.70 0.00 0.00 0.00 175.10 175.24 2jgu s GLU 251 N 1.41 3.77 -0.19 2.72 2.12 -0.90 -4.68 118.70 122.96 2jgu s GLU 251 Ca 0.05 0.72 -0.04 0.00 0.36 0.00 0.00 54.97 56.06 2jgu s GLU 251 Cb -0.18 -2.20 0.06 0.00 0.26 0.00 0.00 34.13 32.07 2jgu s GLU 251 CO -0.15 -0.30 0.06 0.08 -0.54 0.00 0.00 175.26 174.41 2jgu s VAL 252 N -2.74 0.29 -0.35 3.70 1.01 -1.26 -2.49 120.40 118.57 2jgu s VAL 252 Ca 0.55 -0.42 -0.40 0.00 0.00 0.00 0.00 61.98 61.71 2jgu s VAL 252 Cb -0.10 -0.87 -0.15 0.00 0.00 0.00 0.00 36.38 35.26 2jgu s VAL 252 CO 0.39 -0.25 1.93 0.29 0.00 0.00 0.00 175.10 177.46 2jgu n LYS 253 N 5.13 0.86 0.00 2.72 4.76 -1.26 -1.88 118.16 128.49 2jgu n LYS 253 Ca -0.08 0.29 0.00 0.00 -2.87 0.00 0.00 58.31 55.64 2jgu n LYS 253 Cb 0.48 -2.07 0.00 0.00 -1.84 0.00 0.00 35.03 31.60 2jgu n LYS 253 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jgu n GLY 254 N 5.42 2.53 3.56 0.72 0.00 -1.26 0.11 105.19 116.27 2jgu n GLY 254 Ca 0.36 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.12 2jgu n GLY 254 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jgu s ARG 255 N -0.63 1.88 -0.28 1.61 0.52 -0.79 -4.86 118.95 116.40 2jgu s ARG 255 Ca 0.00 -2.10 0.03 0.00 -0.52 0.00 0.00 55.73 53.14 2jgu s ARG 255 Cb 0.00 -1.16 0.07 0.00 0.52 0.00 0.00 34.95 34.38 2jgu s ARG 255 CO 0.00 -0.22 -0.06 0.42 0.02 0.00 0.00 175.30 175.46 2jgu s ILE 256 N -3.04 2.09 -0.71 1.52 1.01 -0.11 -4.33 121.20 117.61 2jgu s ILE 256 Ca 0.29 -1.76 -0.27 0.00 0.00 0.00 0.00 60.65 58.91 2jgu s ILE 256 Cb 0.07 -2.31 0.02 0.00 0.01 0.00 0.00 42.46 40.25 2jgu s ILE 256 CO 0.14 -0.20 1.38 -2.28 0.00 0.00 0.00 174.94 173.98 2jgu s HIS 257 N 1.10 2.17 -0.35 3.97 5.65 -1.26 -0.71 115.29 125.87 2jgu s HIS 257 Ca -0.03 0.11 -0.08 0.00 0.25 0.00 0.00 55.06 55.31 2jgu s HIS 257 Cb -0.20 -4.53 0.03 0.00 -1.18 0.00 0.00 32.58 26.71 2jgu s HIS 257 CO -0.06 -2.11 0.13 0.12 -0.65 0.00 0.00 174.74 172.17 2jgu s PHE 258 N 6.33 3.25 -0.86 3.88 2.19 0.63 -4.81 117.98 128.59 2jgu s PHE 258 Ca 0.41 -1.27 -0.20 0.00 0.33 0.00 0.00 56.93 56.19 2jgu s PHE 258 Cb -0.09 -2.32 0.10 0.00 -1.31 0.00 0.00 43.02 39.40 2jgu s PHE 258 CO 0.16 -0.70 1.12 0.34 1.83 0.00 0.00 175.22 177.97 2jgu s ASP 259 N 1.45 6.47 0.15 6.13 -1.08 -1.26 -2.26 116.67 126.27 2jgu s ASP 259 Ca -0.00 -1.64 -0.14 0.00 -0.52 0.00 0.00 52.55 50.25 2jgu s ASP 259 Cb -0.19 -2.43 0.12 0.00 -1.46 0.00 0.00 42.92 38.96 2jgu s ASP 259 CO 0.04 -1.24 1.05 0.18 0.52 0.00 0.00 175.17 175.72 2jgu n LEU 260 N 7.20 -0.50 -0.08 -1.34 4.77 -0.24 -2.94 117.00 123.87 2jgu n LEU 260 Ca 0.16 1.18 -0.02 0.00 -0.03 0.00 0.00 56.01 57.31 2jgu n LEU 260 Cb 0.48 -0.25 -0.02 0.00 -2.33 0.00 0.00 43.42 41.31 2jgu n LEU 260 CO 0.57 -1.04 0.24 0.00 -1.33 0.00 0.00 177.39 175.83 2jgu n TYR 261 N -4.96 -0.09 0.18 -1.77 9.36 -1.26 -0.17 117.16 118.45 2jgu n TYR 261 Ca 0.06 0.25 0.18 0.00 3.32 0.00 0.00 57.90 61.71 2jgu n TYR 261 Cb 0.25 -0.37 0.77 0.00 -0.63 0.00 0.00 39.34 39.37 2jgu n TYR 261 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2jgu h HIS 262 N 0.00 0.00 0.08 2.98 3.86 -1.86 -2.90 115.15 117.31 2jgu h HIS 262 Ca 0.03 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 58.91 2jgu h HIS 262 Cb 0.08 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.53 2jgu h HIS 262 CO -0.48 0.00 -1.84 0.28 0.86 0.00 0.00 177.93 176.75 2jgu h VAL 263 N 0.00 0.77 0.08 2.45 2.07 -0.73 -3.39 116.25 117.50 2jgu h VAL 263 Ca 0.12 -2.52 -0.00 0.00 0.82 0.00 0.00 66.70 65.12 2jgu h VAL 263 Cb 0.91 2.51 0.00 0.00 -1.52 0.00 0.00 31.29 33.19 2jgu h VAL 263 CO -0.00 0.75 -0.04 0.40 0.02 0.00 0.00 177.57 178.70 2jgu h ILE 264 N 0.05 1.13 0.00 4.57 2.04 -1.30 -3.32 117.51 120.68 2jgu h ILE 264 Ca -0.35 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 64.70 2jgu h ILE 264 Cb 2.03 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 39.75 2jgu h ILE 264 CO 0.10 0.20 0.00 -1.14 0.00 0.00 0.00 178.15 177.30 2jgu n ARG 265 N -4.97 0.00 0.00 2.37 0.63 -1.18 -3.11 116.66 110.41 2jgu n ARG 265 Ca -0.08 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.85 2jgu n ARG 265 Cb 0.22 -0.82 0.00 0.00 0.45 0.00 0.00 32.46 32.30 2jgu n ARG 265 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2jgu n THR 266 N 0.90 0.00 0.00 5.15 -2.24 -1.25 -5.05 114.28 111.79 2jgu n THR 266 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2jgu n THR 266 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2jgu n THR 266 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2jgu n THR 267 N -2.01 0.00 -1.57 4.28 -1.04 -1.18 -4.25 114.28 108.51 2jgu n THR 267 Ca 0.00 0.00 -0.57 0.00 -2.04 0.00 0.00 64.05 61.44 2jgu n THR 267 Cb 0.00 -0.21 -0.08 0.00 -1.82 0.00 0.00 70.33 68.22 2jgu n THR 267 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 2jgu n ILE 268 N 0.00 0.20 -2.02 12.58 -5.35 -1.26 -4.88 119.36 118.62 2jgu n ILE 268 Ca 0.00 -0.10 -0.41 0.00 -0.27 0.00 0.00 62.75 61.97 2jgu n ILE 268 Cb 0.00 -1.16 -0.02 0.00 -1.74 0.00 0.00 39.64 36.72 2jgu n ILE 268 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2jgu s ASN 269 N 4.95 6.65 -0.06 7.28 3.84 -1.26 -4.78 114.94 131.56 2jgu s ASN 269 Ca 1.06 2.79 -0.09 0.00 0.21 0.00 0.00 52.86 56.83 2jgu s ASN 269 Cb -1.12 -2.65 0.02 0.00 -0.55 0.00 0.00 41.25 36.95 2jgu s ASN 269 CO 0.63 -0.64 0.24 -0.76 -2.79 0.00 0.00 177.10 173.78 2jgu s LEU 270 N -1.85 1.12 0.02 3.21 1.43 -1.26 -5.07 118.68 116.28 2jgu s LEU 270 Ca 0.50 0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 53.83 2jgu s LEU 270 Cb -0.42 0.88 -0.03 0.00 0.03 0.00 0.00 46.19 46.65 2jgu s LEU 270 CO 0.56 -0.19 1.11 1.55 0.23 0.00 0.00 176.35 179.60 2jgu h PRO 271 N 5.19 -0.12 -5.73 1.29 0.13 -2.02 -3.44 132.00 127.31 2jgu h PRO 271 Ca -0.27 0.01 -0.62 0.00 -0.87 0.00 0.00 66.00 64.24 2jgu h PRO 271 Cb 1.19 0.03 -0.13 0.00 0.13 0.00 0.00 31.00 32.22 2jgu h PRO 271 CO 0.37 -0.08 -0.62 0.95 -0.23 0.00 0.00 178.00 178.39 2jgu s THR 272 N -3.55 2.05 -0.42 1.56 -4.23 -1.26 -5.09 115.64 104.70 2jgu s THR 272 Ca -0.03 -2.06 0.10 0.00 -1.18 0.00 0.00 61.69 58.52 2jgu s THR 272 Cb 0.01 -2.89 0.41 0.00 1.34 0.00 0.00 72.50 71.37 2jgu s THR 272 CO 0.12 -0.06 0.96 -1.22 -0.54 0.00 0.00 174.62 173.89 2jgu n TYR 273 N -0.91 2.27 -1.62 3.99 4.02 -1.26 -4.71 117.16 118.95 2jgu n TYR 273 Ca -0.05 -3.30 -0.31 0.00 -0.01 0.00 0.00 57.90 54.23 2jgu n TYR 273 Cb 0.66 -0.31 0.05 0.00 -0.02 0.00 0.00 39.34 39.72 2jgu n TYR 273 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2jgu s THR 274 N -4.05 4.05 0.19 -0.72 -4.23 -1.26 -4.75 115.64 104.87 2jgu s THR 274 Ca 0.40 0.67 -0.12 0.00 -1.18 0.00 0.00 61.69 61.46 2jgu s THR 274 Cb 0.39 -3.45 0.11 0.00 1.34 0.00 0.00 72.50 70.89 2jgu s THR 274 CO -0.09 -0.87 1.74 0.25 -0.54 0.00 0.00 174.62 175.11 2jgu h LEU 275 N -0.69 0.13 0.34 4.79 6.46 -1.98 0.25 115.31 124.61 2jgu h LEU 275 Ca -0.44 0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 57.38 2jgu h LEU 275 Cb 1.21 0.07 -0.00 0.00 -0.73 0.00 0.00 40.66 41.21 2jgu h LEU 275 CO 0.58 0.10 -0.19 1.05 -0.62 0.00 0.00 178.44 179.35 2jgu h GLU 276 N 0.32 -0.48 -0.35 1.25 9.09 -1.97 0.94 114.58 123.38 2jgu h GLU 276 Ca 0.25 0.03 0.04 0.00 0.05 0.00 0.00 59.36 59.74 2jgu h GLU 276 Cb 0.30 0.11 -0.07 0.00 -1.65 0.00 0.00 28.75 27.44 2jgu h GLU 276 CO -0.28 -0.32 -0.47 0.00 0.05 0.00 0.00 179.01 177.99 2jgu h ALA 277 N 0.15 -0.71 -0.28 1.06 0.00 -1.45 -1.84 119.26 116.19 2jgu h ALA 277 Ca -0.04 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2jgu h ALA 277 Cb 0.40 1.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.21 2jgu h ALA 277 CO 0.05 -0.93 -0.02 0.28 0.00 0.00 0.00 179.25 178.63 2jgu h VAL 278 N -0.33 0.78 -0.79 0.00 2.07 -0.23 -2.79 116.25 114.96 2jgu h VAL 278 Ca 0.06 -0.02 0.12 0.00 0.82 0.00 0.00 66.70 67.68 2jgu h VAL 278 Cb 0.50 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.92 2jgu h VAL 278 CO -0.51 0.01 0.52 0.22 0.02 0.00 0.00 177.57 177.83 2jgu h TYR 279 N 0.06 0.68 0.08 1.57 3.20 0.13 -2.97 116.97 119.73 2jgu h TYR 279 Ca 0.13 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 2jgu h TYR 279 Cb 0.19 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.24 2jgu h TYR 279 CO -0.23 0.29 -0.04 1.49 -1.64 0.00 0.00 178.16 178.03 2jgu h GLU 280 N 0.61 -0.11 -1.30 1.82 4.81 -1.07 -3.11 114.58 116.23 2jgu h GLU 280 Ca 0.38 0.01 0.42 0.00 -0.13 0.00 0.00 59.36 60.03 2jgu h GLU 280 Cb 0.62 0.02 -0.09 0.00 0.63 0.00 0.00 28.75 29.93 2jgu h GLU 280 CO -0.14 -0.07 0.88 0.00 -0.73 0.00 0.00 179.01 178.94 2jgu n ALA 281 N -2.08 1.27 -0.08 2.92 0.00 -1.14 0.87 120.51 122.26 2jgu n ALA 281 Ca -0.01 0.64 -0.10 0.00 0.00 0.00 0.00 53.44 53.96 2jgu n ALA 281 Cb 0.04 -0.88 -0.15 0.00 0.00 0.00 0.00 19.45 18.46 2jgu n ALA 281 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2jgu n ILE 282 N -4.02 1.45 -1.36 0.00 -6.64 -1.14 -4.59 119.36 103.06 2jgu n ILE 282 Ca 0.34 -0.82 0.04 0.00 -1.77 0.00 0.00 62.75 60.53 2jgu n ILE 282 Cb 1.41 -0.66 0.05 0.00 -1.44 0.00 0.00 39.64 39.00 2jgu n ILE 282 CO 0.00 0.00 0.00 2.22 -1.77 0.00 0.00 176.55 177.00 2jgu n PHE 283 N -2.86 0.00 0.00 4.28 1.16 -0.62 -5.08 117.46 114.33 2jgu n PHE 283 Ca -0.30 -0.42 0.00 0.00 -1.87 0.00 0.00 57.45 54.86 2jgu n PHE 283 Cb 1.13 -0.08 0.00 0.00 -1.61 0.00 0.00 39.48 38.91 2jgu n PHE 283 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2jgu n GLY 284 N -0.58 1.16 0.00 4.97 0.00 0.25 -5.01 105.19 105.98 2jgu n GLY 284 Ca 0.06 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.56 2jgu n GLY 284 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jgu n LYS 285 N 0.00 0.00 -4.56 1.61 5.02 -1.26 -4.39 118.16 114.58 2jgu n LYS 285 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.02 2jgu n LYS 285 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.93 2jgu n LYS 285 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2jgu s PRO 286 N 0.00 1.98 0.00 1.97 0.04 -1.26 -4.16 135.00 133.57 2jgu s PRO 286 Ca 0.00 -2.22 0.00 0.00 0.04 0.00 0.00 61.00 58.82 2jgu s PRO 286 Cb 0.00 -0.81 0.00 0.00 0.04 0.00 0.00 34.50 33.73 2jgu s PRO 286 CO 0.00 -0.44 0.00 1.63 0.04 0.00 0.00 177.00 178.23 2jgu n LYS 287 N -0.98 0.00 0.00 4.56 5.02 -1.26 -4.99 118.16 120.51 2jgu n LYS 287 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 2jgu n LYS 287 Cb 0.65 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.66 2jgu n LYS 287 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2jgu n GLU 288 N 0.00 0.00 -3.63 1.97 -0.58 -1.26 -5.17 120.64 111.98 2jgu n GLU 288 Ca 0.00 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.69 2jgu n GLU 288 Cb 0.00 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.82 2jgu n GLU 288 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2jgu s LYS 289 N -0.67 0.22 0.00 3.49 2.20 -1.26 -5.05 119.74 118.66 2jgu s LYS 289 Ca 0.00 0.08 0.00 0.00 -0.36 0.00 0.00 55.97 55.69 2jgu s LYS 289 Cb 0.00 0.10 0.00 0.00 -1.51 0.00 0.00 37.83 36.42 2jgu s LYS 289 CO 0.00 -0.06 0.00 0.28 -0.36 0.00 0.00 175.35 175.21 2jgu n VAL 290 N 0.77 0.00 -4.54 4.02 0.31 -1.26 -5.08 118.33 112.55 2jgu n VAL 290 Ca -0.04 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.02 2jgu n VAL 290 Cb 0.58 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.41 2jgu n VAL 290 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2jgu s TYR 291 N 0.00 2.42 0.00 3.52 2.02 -1.26 -4.22 117.35 119.83 2jgu s TYR 291 Ca 0.00 -0.51 0.00 0.00 -0.37 0.00 0.00 57.07 56.19 2jgu s TYR 291 Cb 0.00 -1.42 0.00 0.00 -0.40 0.00 0.00 41.96 40.14 2jgu s TYR 291 CO 0.00 0.57 0.00 0.00 -1.57 0.00 0.00 175.55 174.55 2jgu n ALA 292 N -0.82 0.00 -0.68 3.71 0.00 -1.26 -4.91 120.51 116.55 2jgu n ALA 292 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.38 2jgu n ALA 292 Cb 0.64 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.38 2jgu n ALA 292 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jgu n ASP 293 N 0.00 4.64 -0.63 0.00 4.64 -1.26 -4.36 116.55 119.58 2jgu n ASP 293 Ca 0.00 -2.95 0.00 0.00 -1.38 0.00 0.00 54.79 50.46 2jgu n ASP 293 Cb 0.00 -0.69 0.00 0.00 -1.04 0.00 0.00 41.12 39.39 2jgu n ASP 293 CO 0.00 0.00 0.00 -1.84 -0.82 0.00 0.00 177.20 174.54 2jgu n GLU 294 N 0.14 0.73 -0.18 -0.67 0.00 -1.26 -3.67 120.64 115.73 2jgu n GLU 294 Ca 0.31 0.00 0.01 0.00 0.00 0.00 0.00 57.16 57.48 2jgu n GLU 294 Cb 1.18 -1.31 0.26 0.00 0.00 0.00 0.00 31.44 31.57 2jgu n GLU 294 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 2jgu h ILE 295 N 0.07 1.19 -1.71 3.84 2.04 -1.86 0.17 117.51 121.24 2jgu h ILE 295 Ca 0.00 -0.39 0.50 0.00 1.00 0.00 0.00 64.86 65.97 2jgu h ILE 295 Cb 0.46 0.21 -0.07 0.00 -0.74 0.00 0.00 36.82 36.68 2jgu h ILE 295 CO 0.00 0.19 1.32 0.00 0.00 0.00 0.00 178.15 179.65 2jgu n ALA 296 N -2.43 1.64 -0.51 1.87 0.00 -1.24 -2.62 120.51 117.22 2jgu n ALA 296 Ca 0.07 0.57 0.00 0.00 0.00 0.00 0.00 53.44 54.08 2jgu n ALA 296 Cb 0.06 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.52 2jgu n ALA 296 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2jgu n LYS 297 N -3.69 0.00 -0.73 0.00 3.00 0.60 -3.49 118.16 113.85 2jgu n LYS 297 Ca 0.39 0.04 -0.23 0.00 -0.00 0.00 0.00 58.31 58.50 2jgu n LYS 297 Cb 1.83 -0.33 0.01 0.00 0.00 0.00 0.00 35.03 36.54 2jgu n LYS 297 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2jgu n ALA 298 N -1.86 -2.97 -0.66 3.14 0.00 -1.08 -3.70 120.51 113.38 2jgu n ALA 298 Ca 0.00 -0.13 -0.21 0.00 0.00 0.00 0.00 53.44 53.10 2jgu n ALA 298 Cb 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2jgu n ALA 298 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2jgu n TRP 299 N -1.09 -1.22 -1.53 0.00 7.02 -1.26 -2.11 117.44 117.25 2jgu n TRP 299 Ca 0.03 0.29 -0.00 0.00 -1.02 0.00 0.00 57.50 56.80 2jgu n TRP 299 Cb 0.30 -0.90 0.00 0.00 -2.42 0.00 0.00 31.31 28.30 2jgu n TRP 299 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2jgu n GLU 300 N 0.71 -0.04 -1.32 -0.99 1.02 -1.26 -4.89 120.64 113.87 2jgu n GLU 300 Ca 0.05 0.53 -0.33 0.00 -0.02 0.00 0.00 57.16 57.39 2jgu n GLU 300 Cb 0.22 -1.59 0.10 0.00 -0.02 0.00 0.00 31.44 30.14 2jgu n GLU 300 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2jgu n SER 301 N -0.76 7.00 -4.77 1.62 7.64 -0.90 -3.86 113.62 119.59 2jgu n SER 301 Ca 0.00 -3.76 -0.40 0.00 1.01 0.00 0.00 58.87 55.72 2jgu n SER 301 Cb 0.26 -0.95 -0.02 0.00 -1.01 0.00 0.00 64.21 62.50 2jgu n SER 301 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2jgu s GLY 302 N -1.75 2.98 0.00 0.23 0.00 -1.23 -4.82 107.32 102.74 2jgu s GLY 302 Ca 0.63 1.27 0.00 0.00 0.00 0.00 0.00 44.72 46.63 2jgu s GLY 302 CO 0.01 1.91 0.00 -2.21 0.00 0.00 0.00 173.10 172.81 2jgu n GLU 303 N 0.65 0.00 -0.01 2.90 0.00 -1.26 -3.74 120.64 119.17 2jgu n GLU 303 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.17 2jgu n GLU 303 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.86 2jgu n GLU 303 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2jgu n ASN 304 N 0.00 0.00 0.22 4.31 4.13 -1.26 -4.25 115.26 118.41 2jgu n ASN 304 Ca 0.00 0.00 0.10 0.00 1.68 0.00 0.00 54.58 56.36 2jgu n ASN 304 Cb 0.00 -0.62 0.44 0.00 -1.54 0.00 0.00 39.78 38.05 2jgu n ASN 304 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 2jgu h LEU 305 N 0.00 0.00 -0.80 3.41 6.46 -1.87 0.42 115.31 122.93 2jgu h LEU 305 Ca 0.00 0.00 0.04 0.00 -0.12 0.00 0.00 57.88 57.80 2jgu h LEU 305 Cb 0.00 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 39.88 2jgu h LEU 305 CO 0.00 0.23 0.51 -0.08 -0.62 0.00 0.00 178.44 178.48 2jgu h GLU 306 N 0.00 0.95 0.00 1.25 4.81 -1.92 0.13 114.58 119.80 2jgu h GLU 306 Ca -0.00 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2jgu h GLU 306 Cb 0.78 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.94 2jgu h GLU 306 CO 0.03 0.63 0.00 -2.13 -0.73 0.00 0.00 179.01 176.81 2jgu n ARG 307 N -4.60 0.00 -0.26 1.92 0.63 0.15 -2.61 116.66 111.88 2jgu n ARG 307 Ca 0.10 0.55 0.22 0.00 -0.92 0.00 0.00 57.85 57.81 2jgu n ARG 307 Cb 0.11 -1.46 0.41 0.00 0.45 0.00 0.00 32.46 31.97 2jgu n ARG 307 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2jgu n VAL 308 N -2.06 -0.33 0.42 5.15 0.31 -0.89 0.27 118.33 121.20 2jgu n VAL 308 Ca 0.00 1.63 -0.19 0.00 -0.01 0.00 0.00 64.34 65.77 2jgu n VAL 308 Cb 0.00 -2.59 -0.09 0.00 -0.91 0.00 0.00 33.84 30.24 2jgu n VAL 308 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jgu h ALA 309 N 1.58 -1.15 -0.91 3.52 0.00 -0.56 -1.55 119.26 120.19 2jgu h ALA 309 Ca 0.63 -0.23 0.20 0.00 0.00 0.00 0.00 54.91 55.51 2jgu h ALA 309 Cb 1.60 0.53 -0.17 0.00 0.00 0.00 0.00 17.79 19.75 2jgu h ALA 309 CO -0.64 -1.16 -0.15 1.17 0.00 0.00 0.00 179.25 178.47 2jgu n LYS 310 N -5.59 -0.08 0.12 0.00 3.00 0.14 0.13 118.16 115.88 2jgu n LYS 310 Ca -0.14 1.40 0.03 0.00 -0.00 0.00 0.00 58.31 59.60 2jgu n LYS 310 Cb 0.47 -2.13 0.41 0.00 0.00 0.00 0.00 35.03 33.78 2jgu n LYS 310 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.40 176.48 2jgu h TYR 311 N 0.00 0.25 0.00 5.64 -0.00 -1.08 -2.12 116.97 119.67 2jgu h TYR 311 Ca 0.47 -0.02 -0.00 0.00 -0.00 0.00 0.00 58.73 59.18 2jgu h TYR 311 Cb 0.81 -0.08 0.00 0.00 -0.00 0.00 0.00 36.73 37.46 2jgu h TYR 311 CO -0.63 0.33 -0.00 1.03 -0.00 0.00 0.00 178.16 178.90 2jgu h SER 312 N 0.24 0.00 -0.34 -2.11 0.87 0.21 0.15 113.55 112.57 2jgu h SER 312 Ca 0.05 -0.88 0.10 0.00 -1.23 0.00 0.00 61.79 59.83 2jgu h SER 312 Cb 0.30 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 2jgu h SER 312 CO 0.01 0.88 0.68 0.00 -0.53 0.00 0.00 176.83 177.88 2jgu h MET 313 N -0.88 0.00 0.00 2.24 -0.00 -1.18 -0.32 114.93 114.79 2jgu h MET 313 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2jgu h MET 313 Cb 0.88 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.48 2jgu h MET 313 CO 0.00 0.00 -0.09 0.93 -0.00 0.00 0.00 176.91 177.75 2jgu h GLU 314 N 0.00 0.00 -0.90 -0.10 5.08 -1.00 -2.72 114.58 114.95 2jgu h GLU 314 Ca 0.16 0.00 0.37 0.00 -1.00 0.00 0.00 59.36 58.89 2jgu h GLU 314 Cb 1.52 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.62 2jgu h GLU 314 CO -0.00 0.00 0.49 -0.25 -1.00 0.00 0.00 179.01 178.25 2jgu n ASP 315 N -4.43 0.30 0.10 1.42 10.43 0.49 -1.07 116.55 123.80 2jgu n ASP 315 Ca -0.01 1.43 -0.05 0.00 2.57 0.00 0.00 54.79 58.73 2jgu n ASP 315 Cb 0.05 -0.70 -0.02 0.00 1.84 0.00 0.00 41.12 42.28 2jgu n ASP 315 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2jgu h ALA 316 N 1.72 -0.41 -1.00 2.24 0.00 -1.45 -2.22 119.26 118.13 2jgu h ALA 316 Ca 0.74 -0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.80 2jgu h ALA 316 Cb 2.00 0.13 -0.11 0.00 0.00 0.00 0.00 17.79 19.80 2jgu h ALA 316 CO -0.65 -0.39 0.61 -0.22 0.00 0.00 0.00 179.25 178.60 2jgu h LYS 317 N -0.81 0.66 0.22 0.00 3.64 -0.96 1.40 116.57 120.71 2jgu h LYS 317 Ca -0.03 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2jgu h LYS 317 Cb 0.25 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2jgu h LYS 317 CO 0.05 0.43 -0.11 0.00 -2.27 0.00 0.00 179.45 177.56 2jgu h ALA 318 N 1.67 -0.93 -0.99 5.00 0.00 -1.22 -0.81 119.26 121.99 2jgu h ALA 318 Ca 0.60 -0.07 0.25 0.00 0.00 0.00 0.00 54.91 55.69 2jgu h ALA 318 Cb 1.05 0.12 -0.19 0.00 0.00 0.00 0.00 17.79 18.77 2jgu h ALA 318 CO -0.41 -0.90 -0.07 2.41 0.00 0.00 0.00 179.25 180.28 2jgu n THR 319 N -2.92 -0.42 0.42 0.00 -1.04 0.10 -0.28 114.28 110.15 2jgu n THR 319 Ca -0.04 2.21 -0.20 0.00 -2.04 0.00 0.00 64.05 63.99 2jgu n THR 319 Cb 0.12 -3.18 -0.10 0.00 -1.82 0.00 0.00 70.33 65.35 2jgu n THR 319 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 2jgu h TYR 320 N 0.00 -1.28 -0.85 -1.42 3.20 0.19 -2.30 116.97 114.51 2jgu h TYR 320 Ca 0.56 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.59 2jgu h TYR 320 Cb 1.07 0.46 -0.06 0.00 1.54 0.00 0.00 36.73 39.74 2jgu h TYR 320 CO -0.59 -0.72 0.56 0.93 -1.64 0.00 0.00 178.16 176.70 2jgu h GLU 321 N -1.17 0.44 -0.04 1.82 5.08 0.88 -0.38 114.58 121.21 2jgu h GLU 321 Ca -0.10 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 2jgu h GLU 321 Cb 0.94 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.10 2jgu h GLU 321 CO 0.10 0.29 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.15 2jgu h LEU 322 N 0.46 0.23 -0.68 1.33 3.38 -1.30 -3.13 115.31 115.60 2jgu h LEU 322 Ca 0.43 -0.64 0.13 0.00 0.09 0.00 0.00 57.88 57.89 2jgu h LEU 322 Cb 0.98 -0.07 -0.13 0.00 0.09 0.00 0.00 40.66 41.53 2jgu h LEU 322 CO -0.16 0.84 -0.24 1.23 0.09 0.00 0.00 178.44 180.20 2jgu h GLY 323 N -0.36 0.29 0.83 0.83 0.00 -0.52 0.75 103.07 104.89 2jgu h GLY 323 Ca -0.01 0.31 0.13 0.00 0.00 0.00 0.00 47.33 47.77 2jgu h GLY 323 CO 0.04 -0.25 0.46 1.70 0.00 0.00 0.00 176.54 178.48 2jgu h LYS 324 N -0.06 0.34 0.00 4.80 1.63 -1.23 0.10 116.57 122.16 2jgu h LYS 324 Ca 0.31 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 60.05 2jgu h LYS 324 Cb 0.54 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.09 2jgu h LYS 324 CO -0.73 0.23 -0.20 1.49 -3.45 0.00 0.00 179.45 176.79 2jgu h GLU 325 N 0.35 0.00 -0.00 1.90 4.57 0.26 -3.37 114.58 118.30 2jgu h GLU 325 Ca 0.33 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.51 2jgu h GLU 325 Cb 0.78 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.37 2jgu h GLU 325 CO -0.09 0.88 -0.06 1.19 -1.18 0.00 0.00 179.01 179.75 2jgu n PHE 326 N -4.60 0.00 -0.03 0.92 3.01 0.18 -4.21 117.46 112.73 2jgu n PHE 326 Ca -0.12 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.18 2jgu n PHE 326 Cb 0.46 -0.36 -0.08 0.00 -0.01 0.00 0.00 39.48 39.48 2jgu n PHE 326 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 2jgu h LEU 327 N 0.07 0.65 -1.77 4.37 6.46 -0.95 -3.28 115.31 120.87 2jgu h LEU 327 Ca 0.00 -0.63 -0.03 0.00 -0.12 0.00 0.00 57.88 57.10 2jgu h LEU 327 Cb 0.41 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 40.14 2jgu h LEU 327 CO 0.00 1.17 -0.15 -0.65 -0.62 0.00 0.00 178.44 178.19 2jgu h PRO 328 N 0.17 0.00 0.79 5.25 0.11 -1.77 0.34 132.00 136.89 2jgu h PRO 328 Ca -0.03 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.04 2jgu h PRO 328 Cb 1.14 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.26 2jgu h PRO 328 CO 0.11 0.15 -0.38 1.98 -0.21 0.00 0.00 178.00 179.65 2jgu h MET 329 N 0.00 -1.02 -0.10 1.05 1.85 -1.80 -0.36 114.93 114.55 2jgu h MET 329 Ca -0.00 0.07 -0.02 0.00 -0.61 0.00 0.00 59.70 59.14 2jgu h MET 329 Cb 0.30 0.23 -0.01 0.00 0.43 0.00 0.00 31.60 32.55 2jgu h MET 329 CO 0.02 -0.67 -0.03 0.93 -0.40 0.00 0.00 176.91 176.76 2jgu h GLU 330 N -1.23 0.14 -0.35 0.39 4.39 -1.46 0.24 114.58 116.69 2jgu h GLU 330 Ca -0.11 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 2jgu h GLU 330 Cb 0.82 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.43 2jgu h GLU 330 CO 0.18 0.19 0.16 0.82 -1.16 0.00 0.00 179.01 179.20 2jgu h ILE 331 N 0.14 1.17 -0.37 3.13 1.08 -0.17 -1.43 117.51 121.06 2jgu h ILE 331 Ca 0.03 -0.48 -0.09 0.00 -0.39 0.00 0.00 64.86 63.94 2jgu h ILE 331 Cb 0.16 0.84 -0.02 0.00 -3.07 0.00 0.00 36.82 34.73 2jgu h ILE 331 CO 0.01 0.17 -0.14 1.56 -0.69 0.00 0.00 178.15 179.06 2jgu h GLN 332 N 0.42 0.67 -0.10 2.37 1.08 0.74 -0.30 115.11 119.99 2jgu h GLN 332 Ca 0.12 -0.22 -0.10 0.00 -1.45 0.00 0.00 58.65 57.00 2jgu h GLN 332 Cb 0.13 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 2jgu h GLN 332 CO -0.01 0.78 -0.39 -0.07 -0.95 0.00 0.00 178.83 178.19 2jgu h LEU 333 N 0.60 0.22 -0.91 1.46 3.38 -0.31 -0.36 115.31 119.39 2jgu h LEU 333 Ca 0.10 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 2jgu h LEU 333 Cb 0.59 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 2jgu h LEU 333 CO 0.04 0.60 0.16 0.28 0.09 0.00 0.00 178.44 179.60 2jgu h SER 334 N 0.18 0.90 0.02 -0.43 0.02 -0.82 0.37 113.55 113.79 2jgu h SER 334 Ca 0.02 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2jgu h SER 334 Cb 0.77 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.08 2jgu h SER 334 CO 0.06 0.87 -0.01 -0.09 -1.14 0.00 0.00 176.83 176.52 2jgu h ARG 335 N 0.92 -0.03 -0.24 3.45 2.43 -0.47 0.16 114.38 120.60 2jgu h ARG 335 Ca 0.20 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.39 2jgu h ARG 335 Cb 0.31 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 2jgu h ARG 335 CO -0.00 0.46 0.09 -0.07 -1.51 0.00 0.00 179.97 178.94 2jgu h LEU 336 N -0.52 0.12 -0.94 3.80 3.38 -0.81 -3.00 115.31 117.34 2jgu h LEU 336 Ca -0.00 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 2jgu h LEU 336 Cb 0.50 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2jgu h LEU 336 CO 0.00 0.10 -0.45 0.58 0.09 0.00 0.00 178.44 178.77 2jgu h VAL 337 N 0.21 1.33 0.00 1.22 2.07 -0.24 -3.48 116.25 117.36 2jgu h VAL 337 Ca 0.10 -1.59 0.00 0.00 0.82 0.00 0.00 66.70 66.03 2jgu h VAL 337 Cb 0.06 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 2jgu h VAL 337 CO -0.10 0.47 0.00 0.61 0.02 0.00 0.00 177.57 178.58 2jgu n GLY 338 N -0.13 0.77 3.39 2.17 0.00 0.55 -4.64 105.19 107.30 2jgu n GLY 338 Ca -0.02 -0.67 -0.21 0.00 0.00 0.00 0.00 46.02 45.12 2jgu n GLY 338 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jgu s GLN 339 N -3.00 1.70 0.19 1.61 -1.52 -1.14 -4.64 119.66 112.86 2jgu s GLN 339 Ca 0.00 -1.99 -0.17 0.00 -1.95 0.00 0.00 55.36 51.25 2jgu s GLN 339 Cb 0.00 -0.27 -0.08 0.00 -0.22 0.00 0.00 33.01 32.44 2jgu s GLN 339 CO 0.00 -0.45 0.65 -2.14 -0.25 0.00 0.00 175.29 173.10 2jgu s PRO 340 N -3.77 4.14 0.43 2.91 0.02 -1.26 -4.43 135.00 133.03 2jgu s PRO 340 Ca 0.33 0.71 0.09 0.00 0.02 0.00 0.00 61.00 62.15 2jgu s PRO 340 Cb 0.04 -2.90 0.94 0.00 0.02 0.00 0.00 34.50 32.60 2jgu s PRO 340 CO 0.17 0.43 2.06 1.25 -0.33 0.00 0.00 177.00 180.59 2jgu h LEU 341 N 3.49 0.35 -0.96 -5.54 5.85 -1.92 0.49 115.31 117.06 2jgu h LEU 341 Ca -0.48 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.19 2jgu h LEU 341 Cb 1.19 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 2jgu h LEU 341 CO 0.65 0.28 0.35 -0.25 -0.34 0.00 0.00 178.44 179.13 2jgu h TRP 342 N 0.40 1.10 0.45 1.25 7.01 -1.87 -1.82 115.95 122.47 2jgu h TRP 342 Ca 0.11 -0.05 -0.02 0.00 2.11 0.00 0.00 58.89 61.03 2jgu h TRP 342 Cb -0.00 -0.34 0.00 0.00 -2.10 0.00 0.00 29.16 26.72 2jgu h TRP 342 CO 0.00 0.80 -0.22 -0.44 -2.79 0.00 0.00 178.44 175.80 2jgu h ASP 343 N 1.08 -0.51 -0.92 2.65 3.32 -1.62 -3.28 116.42 117.14 2jgu h ASP 343 Ca 0.26 0.02 0.27 0.00 0.02 0.00 0.00 57.03 57.60 2jgu h ASP 343 Cb 0.13 0.13 -0.16 0.00 0.22 0.00 0.00 39.33 39.66 2jgu h ASP 343 CO -0.03 -0.28 0.23 0.58 -1.72 0.00 0.00 179.24 178.02 2jgu h VAL 344 N -0.77 0.20 -0.52 -1.35 2.07 -0.10 0.26 116.25 116.04 2jgu h VAL 344 Ca -0.06 -0.05 0.09 0.00 0.82 0.00 0.00 66.70 67.50 2jgu h VAL 344 Cb 0.46 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 2jgu h VAL 344 CO 0.10 0.03 0.35 0.28 0.02 0.00 0.00 177.57 178.35 2jgu h SER 345 N 0.14 0.28 -0.80 0.57 0.02 -1.42 -3.04 113.55 109.29 2jgu h SER 345 Ca 0.60 0.01 -0.51 0.00 -0.84 0.00 0.00 61.79 61.04 2jgu h SER 345 Cb 1.29 -0.05 -0.28 0.00 0.14 0.00 0.00 62.40 63.49 2jgu h SER 345 CO -0.73 0.17 0.26 0.54 -1.14 0.00 0.00 176.83 175.92 2jgu n ARG 346 N -4.46 2.62 -3.92 3.45 1.74 0.90 -4.45 116.66 112.54 2jgu n ARG 346 Ca 0.08 -3.41 -0.11 0.00 -0.77 0.00 0.00 57.85 53.64 2jgu n ARG 346 Cb 0.37 -2.16 -0.13 0.00 -1.02 0.00 0.00 32.46 29.52 2jgu n ARG 346 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2jgu s SER 347 N -2.28 0.10 0.80 0.55 1.04 -1.15 -4.80 113.70 107.97 2jgu s SER 347 Ca 0.56 -0.21 -0.14 0.00 0.48 0.00 0.00 55.95 56.64 2jgu s SER 347 Cb 0.46 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.66 2jgu s SER 347 CO 0.02 -0.14 0.77 -1.54 0.98 0.00 0.00 173.24 173.34 2jgu n SER 348 N 2.40 -0.48 0.26 7.02 3.41 -1.26 -4.76 113.62 120.21 2jgu n SER 348 Ca -0.17 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.08 2jgu n SER 348 Cb 0.58 -1.33 0.70 0.00 -0.26 0.00 0.00 64.21 63.89 2jgu n SER 348 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2jgu h THR 349 N -0.82 0.76 -0.93 6.66 1.35 -2.00 -1.03 112.91 116.91 2jgu h THR 349 Ca -0.45 -0.39 0.18 0.00 -0.55 0.00 0.00 66.41 65.20 2jgu h THR 349 Cb 1.32 1.23 -0.11 0.00 -1.73 0.00 0.00 68.15 68.86 2jgu h THR 349 CO 0.42 0.10 0.51 1.23 -0.25 0.00 0.00 175.52 177.53 2jgu h GLY 350 N 0.48 1.61 1.29 5.82 0.00 -1.91 -2.46 103.07 107.89 2jgu h GLY 350 Ca -0.00 -0.29 -0.32 0.00 0.00 0.00 0.00 47.33 46.72 2jgu h GLY 350 CO 0.01 -0.11 -1.41 -0.57 0.00 0.00 0.00 176.54 174.47 2jgu h ASN 351 N 0.64 0.83 -0.81 0.19 -0.73 -1.53 -3.20 115.58 110.97 2jgu h ASN 351 Ca 0.54 -0.86 0.12 0.00 1.87 0.00 0.00 56.30 57.97 2jgu h ASN 351 Cb 0.87 -0.27 -0.06 0.00 0.27 0.00 0.00 38.32 39.13 2jgu h ASN 351 CO -0.41 1.66 0.53 -0.07 -0.37 0.00 0.00 177.43 178.77 2jgu h LEU 352 N 0.18 0.62 -0.33 0.34 3.38 -1.06 -0.03 115.31 118.41 2jgu h LEU 352 Ca -0.23 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 2jgu h LEU 352 Cb 2.10 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.73 2jgu h LEU 352 CO 0.26 0.35 0.08 0.58 0.09 0.00 0.00 178.44 179.80 2jgu h VAL 353 N 0.67 1.22 -0.84 1.22 2.07 -1.51 0.16 116.25 119.24 2jgu h VAL 353 Ca 0.39 -0.73 0.01 0.00 0.82 0.00 0.00 66.70 67.18 2jgu h VAL 353 Cb 0.57 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 2jgu h VAL 353 CO -0.15 0.25 0.56 -0.08 0.02 0.00 0.00 177.57 178.16 2jgu h GLU 354 N 0.37 1.11 0.00 1.57 4.81 -1.04 0.62 114.58 122.03 2jgu h GLU 354 Ca 0.10 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.18 2jgu h GLU 354 Cb 0.29 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2jgu h GLU 354 CO 0.00 0.74 -0.40 -1.49 -0.73 0.00 0.00 179.01 177.14 2jgu h TRP 355 N 1.15 0.00 0.00 0.92 4.06 -1.01 0.79 115.95 121.85 2jgu h TRP 355 Ca 0.31 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.24 2jgu h TRP 355 Cb -0.13 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.03 2jgu h TRP 355 CO -0.01 0.40 -0.10 0.35 -3.56 0.00 0.00 178.44 175.51 2jgu h PHE 356 N 0.00 0.00 0.11 0.49 3.57 0.31 -2.73 116.94 118.68 2jgu h PHE 356 Ca -0.00 0.00 -0.35 0.00 3.53 0.00 0.00 57.97 61.14 2jgu h PHE 356 Cb 0.90 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.62 2jgu h PHE 356 CO 0.00 0.10 -1.94 1.28 -2.23 0.00 0.00 178.31 175.52 2jgu n LEU 357 N -4.42 2.34 -0.13 0.59 4.77 0.68 -2.81 117.00 118.03 2jgu n LEU 357 Ca -0.03 0.25 0.14 0.00 -0.03 0.00 0.00 56.01 56.34 2jgu n LEU 357 Cb 0.18 -0.91 0.50 0.00 -2.33 0.00 0.00 43.42 40.86 2jgu n LEU 357 CO 0.35 0.78 1.20 -0.07 -1.33 0.00 0.00 177.39 178.32 2jgu h LEU 358 N 0.06 0.38 -0.19 2.23 3.38 -0.88 0.24 115.31 120.53 2jgu h LEU 358 Ca -0.40 0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.37 2jgu h LEU 358 Cb 2.03 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.71 2jgu h LEU 358 CO 0.09 0.21 -0.94 -0.09 0.09 0.00 0.00 178.44 177.80 2jgu h ARG 359 N 0.41 0.22 -0.00 1.13 2.43 -1.60 -2.83 114.38 114.14 2jgu h ARG 359 Ca 0.33 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2jgu h ARG 359 Cb 0.71 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 2jgu h ARG 359 CO -0.10 1.01 -0.21 1.63 -1.51 0.00 0.00 179.97 180.79 2jgu n LYS 360 N -3.63 0.25 0.04 0.20 4.76 0.03 -2.64 118.16 117.16 2jgu n LYS 360 Ca -0.04 -0.09 -0.13 0.00 -2.87 0.00 0.00 58.31 55.17 2jgu n LYS 360 Cb 0.85 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 32.40 2jgu n LYS 360 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2jgu h ALA 361 N 3.22 0.42 0.36 7.82 0.00 -0.56 -3.02 119.26 127.50 2jgu h ALA 361 Ca 0.00 -1.18 -0.02 0.00 0.00 0.00 0.00 54.91 53.71 2jgu h ALA 361 Cb 0.45 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2jgu h ALA 361 CO 0.00 1.28 -0.17 -0.92 0.00 0.00 0.00 179.25 179.44 2jgu h TYR 362 N 0.04 -0.45 -1.29 0.00 3.20 -1.50 0.26 116.97 117.23 2jgu h TYR 362 Ca -0.22 -0.01 0.46 0.00 3.14 0.00 0.00 58.73 62.10 2jgu h TYR 362 Cb 1.97 0.15 -0.15 0.00 1.54 0.00 0.00 36.73 40.24 2jgu h TYR 362 CO 0.04 -0.28 0.80 0.39 -1.64 0.00 0.00 178.16 177.47 2jgu n GLU 363 N -4.71 -0.04 -0.31 1.82 1.02 -1.08 0.11 120.64 117.44 2jgu n GLU 363 Ca -0.06 1.28 0.07 0.00 -0.02 0.00 0.00 57.16 58.43 2jgu n GLU 363 Cb 0.19 -2.47 0.21 0.00 -0.02 0.00 0.00 31.44 29.35 2jgu n GLU 363 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2jgu n ARG 364 N -4.85 2.98 -2.99 3.49 1.85 -1.14 -5.01 116.66 110.99 2jgu n ARG 364 Ca 0.40 -2.39 -0.10 0.00 -1.00 0.00 0.00 57.85 54.76 2jgu n ARG 364 Cb 1.50 -1.51 0.04 0.00 -1.05 0.00 0.00 32.46 31.45 2jgu n ARG 364 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 2jgu n ASN 365 N 0.31 -6.38 -3.68 2.89 5.15 0.12 -4.98 115.26 108.69 2jgu n ASN 365 Ca 0.16 -0.47 -0.22 0.00 -0.60 0.00 0.00 54.58 53.46 2jgu n ASN 365 Cb 0.62 -4.69 -0.18 0.00 -0.53 0.00 0.00 39.78 35.00 2jgu n ASN 365 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2jgu s GLU 366 N -3.89 0.06 0.41 1.20 2.56 0.78 -2.84 118.70 116.99 2jgu s GLU 366 Ca 0.29 0.25 -0.27 0.00 0.00 0.00 0.00 54.97 55.25 2jgu s GLU 366 Cb -0.04 -0.82 -0.10 0.00 2.00 0.00 0.00 34.13 35.18 2jgu s GLU 366 CO 0.65 -0.38 1.46 0.08 -0.56 0.00 0.00 175.26 176.51 2jgu s VAL 367 N 2.13 2.04 0.01 3.70 1.01 -0.39 -4.41 120.40 124.49 2jgu s VAL 367 Ca 0.04 0.04 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 2jgu s VAL 367 Cb -0.13 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 2jgu s VAL 367 CO -0.04 0.01 0.63 0.00 0.00 0.00 0.00 175.10 175.69 2jgu s ALA 368 N -1.16 3.47 0.93 5.51 0.00 -1.26 -4.74 121.76 124.51 2jgu s ALA 368 Ca 0.56 0.08 -0.10 0.00 0.00 0.00 0.00 51.96 52.50 2jgu s ALA 368 Cb -0.45 -2.79 0.15 0.00 0.00 0.00 0.00 23.12 20.03 2jgu s ALA 368 CO 0.60 0.16 1.13 -2.14 0.00 0.00 0.00 175.76 175.52 2jgu s PRO 369 N -0.23 0.92 0.59 0.00 0.02 -1.26 -4.40 135.00 130.64 2jgu s PRO 369 Ca 0.32 1.45 -0.07 0.00 0.02 0.00 0.00 61.00 62.72 2jgu s PRO 369 Cb -0.19 -1.72 -0.01 0.00 0.02 0.00 0.00 34.50 32.60 2jgu s PRO 369 CO 0.18 -2.67 0.93 -0.80 -0.33 0.00 0.00 177.00 174.31 2jgu s ASN 370 N -2.72 5.80 1.04 2.53 0.01 -1.26 -4.87 114.94 115.47 2jgu s ASN 370 Ca 0.66 0.93 -0.12 0.00 -0.71 0.00 0.00 52.86 53.62 2jgu s ASN 370 Cb -0.22 -1.97 0.21 0.00 0.41 0.00 0.00 41.25 39.68 2jgu s ASN 370 CO 0.58 -0.98 1.07 -0.54 -1.51 0.00 0.00 177.10 175.73 2jgu s LYS 371 N -5.03 0.12 0.52 -0.60 1.02 -1.26 -4.67 119.74 109.85 2jgu s LYS 371 Ca 0.53 0.69 -0.19 0.00 0.02 0.00 0.00 55.97 57.03 2jgu s LYS 371 Cb -0.11 -1.69 -0.07 0.00 -0.52 0.00 0.00 37.83 35.45 2jgu s LYS 371 CO 0.47 -2.98 1.05 -2.14 -0.92 0.00 0.00 175.35 170.83 2jgu s PRO 372 N -4.79 3.65 0.00 -1.68 0.02 -1.26 -5.03 135.00 125.90 2jgu s PRO 372 Ca 0.66 1.32 0.00 0.00 0.02 0.00 0.00 61.00 63.00 2jgu s PRO 372 Cb -0.21 -2.07 0.00 0.00 0.02 0.00 0.00 34.50 32.24 2jgu s PRO 372 CO 0.60 -0.55 0.00 -1.13 -0.33 0.00 0.00 177.00 175.58 2jgu n SER 373 N -1.29 -1.05 0.08 2.53 3.41 -1.26 -4.80 113.62 111.23 2jgu n SER 373 Ca 0.09 -0.47 -0.20 0.00 -0.26 0.00 0.00 58.87 58.03 2jgu n SER 373 Cb 0.53 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.37 2jgu n SER 373 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2jgu h GLU 374 N 0.00 0.58 0.20 4.33 4.57 -1.96 -3.01 114.58 119.28 2jgu h GLU 374 Ca 0.00 -0.71 -0.01 0.00 -1.18 0.00 0.00 59.36 57.46 2jgu h GLU 374 Cb 0.00 0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 2jgu h GLU 374 CO 0.00 1.30 -0.10 1.49 -1.18 0.00 0.00 179.01 180.53 2jgu h GLU 375 N 0.28 -0.26 -0.72 1.92 4.81 -1.98 0.25 114.58 118.89 2jgu h GLU 375 Ca -0.15 0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.20 2jgu h GLU 375 Cb 1.80 0.06 -0.05 0.00 0.63 0.00 0.00 28.75 31.19 2jgu h GLU 375 CO 0.21 0.14 0.47 1.49 -0.73 0.00 0.00 179.01 180.60 2jgu h GLU 376 N -0.83 0.55 0.00 1.92 4.81 -1.94 0.57 114.58 119.67 2jgu h GLU 376 Ca -0.03 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.11 2jgu h GLU 376 Cb 0.52 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 2jgu h GLU 376 CO 0.04 0.36 -0.29 -0.92 -0.73 0.00 0.00 179.01 177.47 2jgu h TYR 377 N 0.56 0.00 0.03 0.92 3.20 -1.49 -3.16 116.97 117.03 2jgu h TYR 377 Ca 0.33 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.20 2jgu h TYR 377 Cb 0.55 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.82 2jgu h TYR 377 CO -0.00 0.29 -0.01 1.96 -1.64 0.00 0.00 178.16 178.76 2jgu h GLN 378 N 0.00 -0.04 0.00 1.82 1.08 0.37 -3.27 115.11 115.07 2jgu h GLN 378 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2jgu h GLN 378 Cb 1.10 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 2jgu h GLN 378 CO 0.04 0.38 0.00 0.54 -0.95 0.00 0.00 178.83 178.84 2jgu n ARG 379 N -4.91 0.00 -0.10 1.46 1.74 -0.72 -2.50 116.66 111.63 2jgu n ARG 379 Ca -0.08 0.71 0.03 0.00 -0.77 0.00 0.00 57.85 57.73 2jgu n ARG 379 Cb 0.23 -1.25 0.05 0.00 -1.02 0.00 0.00 32.46 30.47 2jgu n ARG 379 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2jgu n ARG 380 N -1.95 -0.03 0.00 5.56 1.74 -1.20 0.75 116.66 121.54 2jgu n ARG 380 Ca 0.00 0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.53 2jgu n ARG 380 Cb 0.00 -0.69 0.00 0.00 -1.02 0.00 0.00 32.46 30.75 2jgu n ARG 380 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2jgu n LEU 381 N -4.40 0.00 -4.43 0.55 4.77 -1.04 -3.42 117.00 109.03 2jgu n LEU 381 Ca 0.05 0.11 -0.44 0.00 -0.03 0.00 0.00 56.01 55.71 2jgu n LEU 381 Cb 0.17 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 41.08 2jgu n LEU 381 CO -0.03 -0.11 0.21 -0.60 -1.33 0.00 0.00 177.39 175.53 2jgu s ARG 382 N -2.03 3.07 0.00 3.23 3.52 3.79 -4.91 118.95 125.63 2jgu s ARG 382 Ca 0.00 -1.02 0.00 0.00 -0.13 0.00 0.00 55.73 54.58 2jgu s ARG 382 Cb 0.00 -4.09 0.00 0.00 -1.56 0.00 0.00 34.95 29.30 2jgu s ARG 382 CO 0.00 -1.12 0.00 -0.85 -0.81 0.00 0.00 175.30 172.52 2jgu n GLU 383 N 5.80 0.38 -0.05 5.12 0.28 -1.22 -4.66 120.64 126.29 2jgu n GLU 383 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.92 2jgu n GLU 383 Cb 0.45 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.32 2jgu n GLU 383 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2jgu n SER 384 N 0.00 0.00 0.00 -1.84 7.64 -1.26 -4.83 113.62 113.33 2jgu n SER 384 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2jgu n SER 384 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2jgu n SER 384 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2jgu n TYR 385 N 0.00 0.00 -2.63 1.43 4.01 -1.26 -4.92 117.16 113.79 2jgu n TYR 385 Ca 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.71 2jgu n TYR 385 Cb 0.00 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.09 2jgu n TYR 385 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2jgu n THR 386 N 0.00 0.00 -2.22 -0.72 -1.04 -1.26 -5.11 114.28 103.93 2jgu n THR 386 Ca 0.00 -0.78 -0.37 0.00 -2.04 0.00 0.00 64.05 60.86 2jgu n THR 386 Cb 0.00 0.78 -0.03 0.00 -1.82 0.00 0.00 70.33 69.26 2jgu n THR 386 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2jgu s GLY 387 N -0.65 0.48 0.00 3.41 0.00 -1.26 -4.85 107.32 104.45 2jgu s GLY 387 Ca 0.08 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.58 2jgu s GLY 387 CO -0.06 3.17 0.00 0.61 0.00 0.00 0.00 173.10 176.82 2jgu n GLY 388 N 6.06 0.95 3.96 0.20 0.00 -1.26 -4.75 105.19 110.35 2jgu n GLY 388 Ca 0.23 0.09 -0.22 0.00 0.00 0.00 0.00 46.02 46.11 2jgu n GLY 388 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jgu s PHE 389 N 0.00 3.46 0.00 1.61 0.40 -1.26 -4.94 117.98 117.26 2jgu s PHE 389 Ca 0.00 0.05 0.00 0.00 -0.60 0.00 0.00 56.93 56.38 2jgu s PHE 389 Cb 0.00 -1.62 0.00 0.00 0.51 0.00 0.00 43.02 41.91 2jgu s PHE 389 CO 0.00 0.43 0.00 0.28 0.70 0.00 0.00 175.22 176.63 2jgu n VAL 390 N -1.23 0.00 0.00 -0.44 0.31 -1.26 -3.79 118.33 111.92 2jgu n VAL 390 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2jgu n VAL 390 Cb 0.56 0.66 0.00 0.00 -0.91 0.00 0.00 33.84 34.15 2jgu n VAL 390 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2jgu n LYS 391 N 0.00 0.00 -2.80 5.55 4.01 -1.26 -4.81 118.16 118.85 2jgu n LYS 391 Ca 0.00 0.00 -0.32 0.00 -0.51 0.00 0.00 58.31 57.48 2jgu n LYS 391 Cb 0.24 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 34.72 2jgu n LYS 391 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 2jgu s GLU 392 N 0.00 3.95 0.36 1.97 0.41 -1.26 -4.70 118.70 119.42 2jgu s GLU 392 Ca 0.00 0.75 -0.26 0.00 -0.41 0.00 0.00 54.97 55.05 2jgu s GLU 392 Cb 0.00 -2.30 -0.09 0.00 -1.78 0.00 0.00 34.13 29.96 2jgu s GLU 392 CO 0.00 -0.05 1.07 -2.14 -0.49 0.00 0.00 175.26 173.65 2jgu s PRO 393 N -3.59 4.33 -0.81 0.39 0.02 -1.26 -4.86 135.00 129.21 2jgu s PRO 393 Ca 0.56 1.62 -0.25 0.00 0.02 0.00 0.00 61.00 62.95 2jgu s PRO 393 Cb -0.10 -2.78 0.01 0.00 0.02 0.00 0.00 34.50 31.65 2jgu s PRO 393 CO 0.25 -0.02 1.55 -1.21 -0.33 0.00 0.00 177.00 177.25 2jgu s GLU 394 N -2.11 3.08 1.04 5.54 0.41 -0.79 -4.94 118.70 120.93 2jgu s GLU 394 Ca 0.53 -0.31 -0.21 0.00 -0.41 0.00 0.00 54.97 54.57 2jgu s GLU 394 Cb -0.26 -4.68 -0.05 0.00 -1.78 0.00 0.00 34.13 27.36 2jgu s GLU 394 CO 0.33 -2.48 -0.64 1.63 -0.49 0.00 0.00 175.26 173.60 2jgu n LYS 395 N 9.12 -0.63 0.00 1.61 5.02 -1.26 -4.79 118.16 127.23 2jgu n LYS 395 Ca 0.21 -0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 2jgu n LYS 395 Cb 0.50 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 2jgu n LYS 395 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jgu n GLY 396 N 2.71 2.58 3.68 0.72 0.00 -1.25 -4.94 105.19 108.68 2jgu n GLY 396 Ca 0.00 -1.73 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 2jgu n GLY 396 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jgu s LEU 397 N 0.00 4.33 0.35 0.99 1.98 -1.26 -4.44 118.68 120.63 2jgu s LEU 397 Ca 0.00 2.27 0.08 0.00 -2.89 0.00 0.00 54.13 53.60 2jgu s LEU 397 Cb 0.00 -3.55 -0.07 0.00 0.66 0.00 0.00 46.19 43.23 2jgu s LEU 397 CO 0.00 -0.85 -0.06 0.26 -1.89 0.00 0.00 176.35 173.80 2jgu s TRP 398 N 3.13 2.35 0.34 5.38 0.52 0.15 -5.00 118.94 125.81 2jgu s TRP 398 Ca 0.71 -0.58 0.04 0.00 0.02 0.00 0.00 56.10 56.28 2jgu s TRP 398 Cb -0.35 -1.43 -0.03 0.00 -1.15 0.00 0.00 33.47 30.51 2jgu s TRP 398 CO 0.29 0.50 0.15 -1.83 0.02 0.00 0.00 176.95 176.08 2jgu s GLU 399 N -3.66 1.71 -0.99 4.98 -1.05 -1.26 -2.52 118.70 115.91 2jgu s GLU 399 Ca 0.33 -2.00 -0.16 0.00 -0.15 0.00 0.00 54.97 52.99 2jgu s GLU 399 Cb 0.04 -0.27 0.02 0.00 -0.44 0.00 0.00 34.13 33.49 2jgu s GLU 399 CO 0.16 -0.46 0.30 0.09 0.95 0.00 0.00 175.26 176.31 2jgu n ASN 400 N -1.08 -1.53 -4.78 0.83 3.02 -0.76 -4.88 115.26 106.09 2jgu n ASN 400 Ca -0.01 -0.96 -0.38 0.00 -0.03 0.00 0.00 54.58 53.20 2jgu n ASN 400 Cb 0.65 -1.16 -0.06 0.00 -0.61 0.00 0.00 39.78 38.59 2jgu n ASN 400 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2jgu s ILE 401 N -3.96 4.27 -0.07 2.41 -1.09 -0.60 -4.75 121.20 117.41 2jgu s ILE 401 Ca 0.22 1.77 0.06 0.00 -2.23 0.00 0.00 60.65 60.47 2jgu s ILE 401 Cb -0.12 -4.09 -0.01 0.00 -1.58 0.00 0.00 42.46 36.66 2jgu s ILE 401 CO 0.73 0.33 -0.25 -0.69 -1.23 0.00 0.00 174.94 173.83 2jgu s VAL 402 N -1.39 2.03 -0.22 2.92 1.01 0.50 -1.65 120.40 123.61 2jgu s VAL 402 Ca 0.43 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.32 2jgu s VAL 402 Cb -0.21 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.42 2jgu s VAL 402 CO 0.26 0.56 -0.01 -0.47 0.00 0.00 0.00 175.10 175.44 2jgu s TYR 403 N -0.04 3.00 -0.23 5.22 5.04 -0.93 0.23 117.35 129.65 2jgu s TYR 403 Ca -0.07 -0.71 -0.05 0.00 -2.44 0.00 0.00 57.07 53.81 2jgu s TYR 403 Cb -0.15 -2.12 -0.01 0.00 0.35 0.00 0.00 41.96 40.03 2jgu s TYR 403 CO 0.05 -0.42 -0.02 -0.51 -1.34 0.00 0.00 175.55 173.30 2jgu s LEU 404 N 1.36 3.01 0.31 6.97 1.43 0.46 -1.14 118.68 131.09 2jgu s LEU 404 Ca 0.04 -0.35 -0.16 0.00 -1.03 0.00 0.00 54.13 52.63 2jgu s LEU 404 Cb -0.15 -1.78 -0.09 0.00 0.03 0.00 0.00 46.19 44.21 2jgu s LEU 404 CO -0.00 -0.02 0.75 -0.62 0.23 0.00 0.00 176.35 176.68 2jgu s ASP 405 N 1.51 6.83 -0.18 2.29 2.15 0.05 -2.74 116.67 126.58 2jgu s ASP 405 Ca 0.06 1.33 -0.05 0.00 0.43 0.00 0.00 52.55 54.32 2jgu s ASP 405 Cb -0.14 -2.39 -0.03 0.00 -0.30 0.00 0.00 42.92 40.05 2jgu s ASP 405 CO -0.02 -0.18 0.01 -0.31 -0.17 0.00 0.00 175.17 174.50 2jgu s TYR 406 N -1.92 3.10 -0.43 -5.34 1.51 -0.96 0.87 117.35 114.17 2jgu s TYR 406 Ca 0.53 -0.24 -0.28 0.00 -1.01 0.00 0.00 57.07 56.07 2jgu s TYR 406 Cb -0.11 -2.05 -0.01 0.00 -0.11 0.00 0.00 41.96 39.67 2jgu s TYR 406 CO 0.18 -0.07 1.73 0.15 -1.11 0.00 0.00 175.55 176.43 2jgu s LYS 407 N 0.65 3.17 -0.88 -0.62 1.02 0.48 -4.06 119.74 119.51 2jgu s LYS 407 Ca 0.00 1.07 -0.09 0.00 0.02 0.00 0.00 55.97 56.97 2jgu s LYS 407 Cb -0.14 -4.22 0.01 0.00 -0.52 0.00 0.00 37.83 32.97 2jgu s LYS 407 CO 0.02 -2.06 0.59 -1.13 -0.92 0.00 0.00 175.35 171.85 2jgu n SER 408 N 10.70 -4.35 -0.17 2.83 3.41 -1.26 -4.49 113.62 120.29 2jgu n SER 408 Ca 0.21 -1.02 -0.05 0.00 -0.26 0.00 0.00 58.87 57.75 2jgu n SER 408 Cb 0.49 -1.50 0.01 0.00 -0.26 0.00 0.00 64.21 62.95 2jgu n SER 408 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2jgu h LEU 409 N -0.81 -0.97 -0.18 1.04 5.85 -1.93 -1.41 115.31 116.91 2jgu h LEU 409 Ca -0.63 0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.22 2jgu h LEU 409 Cb 1.33 0.49 -0.00 0.00 0.37 0.00 0.00 40.66 42.86 2jgu h LEU 409 CO 0.39 -0.28 -0.16 1.88 -0.34 0.00 0.00 178.44 179.93 2jgu h TYR 410 N -0.16 0.50 -0.44 1.25 0.05 -1.96 0.37 116.97 116.59 2jgu h TYR 410 Ca 0.23 -0.15 0.01 0.00 0.05 0.00 0.00 58.73 58.87 2jgu h TYR 410 Cb 0.52 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 38.13 2jgu h TYR 410 CO -0.56 0.78 0.29 -1.35 -1.05 0.00 0.00 178.16 176.27 2jgu h PRO 411 N 0.08 0.57 -0.20 4.88 0.11 -1.84 -0.65 132.00 134.95 2jgu h PRO 411 Ca 0.03 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.92 2jgu h PRO 411 Cb 0.68 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.66 2jgu h PRO 411 CO 0.04 0.38 -0.63 0.66 -0.21 0.00 0.00 178.00 178.24 2jgu h SER 412 N 0.59 0.82 -0.07 -2.05 4.64 -0.97 -2.22 113.55 114.29 2jgu h SER 412 Ca 0.16 -0.48 -0.01 0.00 -0.47 0.00 0.00 61.79 61.00 2jgu h SER 412 Cb -0.05 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 61.80 2jgu h SER 412 CO -0.04 1.25 0.01 0.40 -0.87 0.00 0.00 176.83 177.58 2jgu h ILE 413 N 0.53 1.22 -0.58 0.95 2.04 0.82 -1.86 117.51 120.63 2jgu h ILE 413 Ca -0.01 -0.66 0.11 0.00 1.00 0.00 0.00 64.86 65.30 2jgu h ILE 413 Cb 1.22 1.52 -0.09 0.00 -0.74 0.00 0.00 36.82 38.73 2jgu h ILE 413 CO 0.13 0.19 0.04 0.40 0.00 0.00 0.00 178.15 178.90 2jgu h ILE 414 N -0.12 0.57 0.05 -0.67 2.04 -1.20 -1.18 117.51 117.00 2jgu h ILE 414 Ca 0.02 -0.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 2jgu h ILE 414 Cb 0.28 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 2jgu h ILE 414 CO 0.00 0.03 -0.03 0.40 0.00 0.00 0.00 178.15 178.55 2jgu h ILE 415 N 0.15 1.10 -0.49 -0.67 2.04 -1.34 -1.89 117.51 116.41 2jgu h ILE 415 Ca 0.30 -0.49 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 2jgu h ILE 415 Cb 0.47 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 2jgu h ILE 415 CO -0.46 0.12 0.13 0.74 0.00 0.00 0.00 178.15 178.68 2jgu h THR 416 N -0.29 1.21 -0.43 -0.27 2.02 -0.78 -2.79 112.91 111.57 2jgu h THR 416 Ca -0.01 -0.73 0.00 0.00 0.77 0.00 0.00 66.41 66.45 2jgu h THR 416 Cb 0.26 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.36 2jgu h THR 416 CO 0.01 0.27 0.00 1.41 0.37 0.00 0.00 175.52 177.58 2jgu n HIS 417 N -4.30 1.10 -3.99 3.16 8.25 -0.50 -4.94 115.22 114.00 2jgu n HIS 417 Ca 0.03 -0.69 -0.27 0.00 -0.26 0.00 0.00 57.72 56.53 2jgu n HIS 417 Cb 0.20 -0.24 -0.02 0.00 1.12 0.00 0.00 29.99 31.05 2jgu n HIS 417 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2jgu n ASN 418 N 0.33 -1.05 -4.68 0.41 5.15 -0.77 -4.78 115.26 109.87 2jgu n ASN 418 Ca 0.21 -0.99 -0.42 0.00 -0.60 0.00 0.00 54.58 52.77 2jgu n ASN 418 Cb 0.81 -3.06 -0.03 0.00 -0.53 0.00 0.00 39.78 36.98 2jgu n ASN 418 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2jgu s VAL 419 N -3.81 4.06 -0.23 3.44 1.01 -0.82 -4.74 120.40 119.31 2jgu s VAL 419 Ca 0.16 1.37 -0.28 0.00 0.00 0.00 0.00 61.98 63.24 2jgu s VAL 419 Cb -0.09 -3.88 0.14 0.00 0.00 0.00 0.00 36.38 32.55 2jgu s VAL 419 CO 0.89 -0.04 1.11 -0.55 0.00 0.00 0.00 175.10 176.51 2jgu s SER 420 N 1.85 -0.31 0.35 3.32 0.15 -1.26 -4.52 113.70 113.29 2jgu s SER 420 Ca 0.59 0.46 0.08 0.00 0.70 0.00 0.00 55.95 57.78 2jgu s SER 420 Cb -0.26 0.42 0.79 0.00 -1.71 0.00 0.00 66.02 65.25 2jgu s SER 420 CO 0.22 -0.21 1.89 -0.65 1.20 0.00 0.00 173.24 175.69 2jgu h PRO 421 N 3.05 0.70 0.00 5.44 0.11 -1.90 -1.55 132.00 137.85 2jgu h PRO 421 Ca -0.21 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2jgu h PRO 421 Cb 1.17 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2jgu h PRO 421 CO 0.22 0.46 0.00 -0.40 -0.21 0.00 0.00 178.00 178.07 2jgu n ASP 422 N -4.54 0.00 0.00 -2.05 5.75 -1.26 -2.89 116.55 111.56 2jgu n ASP 422 Ca 0.16 -1.56 0.00 0.00 -0.01 0.00 0.00 54.79 53.38 2jgu n ASP 422 Cb 0.41 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.50 2jgu n ASP 422 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2jgu n THR 423 N -0.61 0.03 -2.40 2.12 -2.24 -0.60 -4.86 114.28 105.72 2jgu n THR 423 Ca 0.05 -0.33 -0.43 0.00 -2.27 0.00 0.00 64.05 61.07 2jgu n THR 423 Cb 0.02 1.34 -0.02 0.00 -2.10 0.00 0.00 70.33 69.57 2jgu n THR 423 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2jgu s LEU 424 N -0.03 3.57 -1.02 3.22 1.98 -1.10 0.10 118.68 125.39 2jgu s LEU 424 Ca 0.00 0.69 -0.08 0.00 -2.89 0.00 0.00 54.13 51.86 2jgu s LEU 424 Cb 0.00 -3.49 0.07 0.00 0.66 0.00 0.00 46.19 43.43 2jgu s LEU 424 CO 0.00 -1.44 0.31 0.59 -1.89 0.00 0.00 176.35 173.92 2jgu n ASN 425 N 8.75 -2.87 -4.75 3.68 3.02 0.38 -4.83 115.26 118.64 2jgu n ASN 425 Ca 0.15 -0.20 -0.41 0.00 -0.03 0.00 0.00 54.58 54.10 2jgu n ASN 425 Cb 0.48 -2.44 -0.03 0.00 -0.61 0.00 0.00 39.78 37.18 2jgu n ASN 425 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2jgu s LEU 426 N -6.09 4.46 0.25 3.41 2.96 -1.24 -4.92 118.68 117.50 2jgu s LEU 426 Ca 0.30 2.43 -0.30 0.00 -0.22 0.00 0.00 54.13 56.34 2jgu s LEU 426 Cb -0.16 -3.63 -0.10 0.00 0.50 0.00 0.00 46.19 42.80 2jgu s LEU 426 CO 0.37 -0.41 1.43 -0.70 -1.32 0.00 0.00 176.35 175.72 2jgu s GLU 427 N -0.99 4.27 -1.29 1.98 2.12 -1.26 -3.62 118.70 119.92 2jgu s GLU 427 Ca 0.51 2.29 -0.04 0.00 0.36 0.00 0.00 54.97 58.09 2jgu s GLU 427 Cb -0.36 -3.11 0.00 0.00 0.26 0.00 0.00 34.13 30.92 2jgu s GLU 427 CO 0.43 -0.40 0.48 0.41 -0.54 0.00 0.00 175.26 175.64 2jgu n GLY 428 N 2.15 -0.30 3.83 -1.50 0.00 -1.26 -5.00 105.19 103.11 2jgu n GLY 428 Ca 0.06 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 2jgu n GLY 428 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jgu n LYS 430 N -3.19 0.95 -4.80 0.00 4.76 -1.26 -4.99 118.16 109.64 2jgu n LYS 430 Ca 0.07 -0.08 -0.26 0.00 -2.87 0.00 0.00 58.31 55.18 2jgu n LYS 430 Cb 0.55 -1.29 -0.16 0.00 -1.84 0.00 0.00 35.03 32.30 2jgu n LYS 430 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2jgu s ASN 431 N -3.70 2.11 -0.28 4.39 2.47 -1.26 -5.07 114.94 113.60 2jgu s ASN 431 Ca -0.05 -0.35 -0.26 0.00 0.42 0.00 0.00 52.86 52.62 2jgu s ASN 431 Cb 0.06 -0.66 0.17 0.00 -1.45 0.00 0.00 41.25 39.37 2jgu s ASN 431 CO 0.49 0.13 1.30 -0.72 -3.72 0.00 0.00 177.10 174.57 2jgu s TYR 432 N 0.15 -0.18 0.22 0.43 -0.85 -1.26 0.28 117.35 116.13 2jgu s TYR 432 Ca -0.06 0.42 0.02 0.00 -0.52 0.00 0.00 57.07 56.93 2jgu s TYR 432 Cb -0.12 0.45 -0.03 0.00 0.38 0.00 0.00 41.96 42.63 2jgu s TYR 432 CO 0.03 -0.10 0.37 -0.51 -1.52 0.00 0.00 175.55 173.81 2jgu s ASP 433 N -0.15 6.34 -0.13 -0.18 -0.00 -1.16 -4.95 116.67 116.43 2jgu s ASP 433 Ca 0.06 0.23 0.02 0.00 -0.00 0.00 0.00 52.55 52.86 2jgu s ASP 433 Cb -0.04 -1.93 0.01 0.00 -0.00 0.00 0.00 42.92 40.96 2jgu s ASP 433 CO -0.11 -0.06 -0.19 -0.63 -0.00 0.00 0.00 175.17 174.18 2jgu s ILE 434 N -1.93 1.84 -0.40 0.77 1.01 -1.26 -2.59 121.20 118.65 2jgu s ILE 434 Ca 0.36 -0.84 -0.39 0.00 0.00 0.00 0.00 60.65 59.78 2jgu s ILE 434 Cb -0.10 -1.65 -0.14 0.00 0.01 0.00 0.00 42.46 40.57 2jgu s ILE 434 CO 0.30 0.51 2.16 0.00 0.00 0.00 0.00 174.94 177.90 2jgu n ALA 435 N 4.20 0.73 -0.09 9.38 0.00 0.15 -4.85 120.51 130.03 2jgu n ALA 435 Ca -0.20 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2jgu n ALA 435 Cb 0.51 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.59 2jgu n ALA 435 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2jgu n PRO 436 N 7.86 0.00 0.11 0.00 -0.02 -1.26 -0.81 135.00 140.88 2jgu n PRO 436 Ca 0.46 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 62.07 2jgu n PRO 436 Cb 0.13 -0.03 0.39 0.00 -0.02 0.00 0.00 33.50 33.97 2jgu n PRO 436 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2jgu h GLN 437 N 0.00 0.00 -0.28 -0.52 4.20 -1.89 -3.33 115.11 113.30 2jgu h GLN 437 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2jgu h GLN 437 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2jgu h GLN 437 CO 0.00 0.00 0.00 1.55 -0.67 0.00 0.00 178.83 179.71 2jgu n VAL 438 N -2.31 2.01 -0.23 -0.54 3.14 -1.02 -4.99 118.33 114.40 2jgu n VAL 438 Ca 0.05 -1.69 0.00 0.00 -2.96 0.00 0.00 64.34 59.74 2jgu n VAL 438 Cb 0.44 -0.09 0.00 0.00 -1.06 0.00 0.00 33.84 33.12 2jgu n VAL 438 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2jgu n GLY 439 N -0.29 0.00 3.65 7.55 0.00 0.01 -4.93 105.19 111.18 2jgu n GLY 439 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2jgu n GLY 439 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jgu n HIS 440 N -1.27 1.78 -4.02 1.61 8.25 -1.26 -4.59 115.22 115.72 2jgu n HIS 440 Ca 0.00 0.58 -0.33 0.00 -0.26 0.00 0.00 57.72 57.70 2jgu n HIS 440 Cb 0.00 -2.33 -0.15 0.00 1.12 0.00 0.00 29.99 28.63 2jgu n HIS 440 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2jgu s LYS 441 N -1.90 2.71 -0.37 -0.41 1.02 -1.26 -0.67 119.74 118.86 2jgu s LYS 441 Ca 0.59 -1.05 -0.16 0.00 0.02 0.00 0.00 55.97 55.37 2jgu s LYS 441 Cb -0.58 -2.87 0.00 0.00 -0.52 0.00 0.00 37.83 33.86 2jgu s LYS 441 CO 0.60 -0.40 0.40 -0.06 -0.92 0.00 0.00 175.35 174.96 2jgu s PHE 442 N 1.26 3.19 0.93 3.18 0.40 -1.07 0.14 117.98 126.02 2jgu s PHE 442 Ca -0.01 -0.16 -0.13 0.00 -0.60 0.00 0.00 56.93 56.03 2jgu s PHE 442 Cb -0.17 -2.76 0.05 0.00 0.51 0.00 0.00 43.02 40.65 2jgu s PHE 442 CO -0.07 -0.54 0.54 0.00 0.70 0.00 0.00 175.22 175.85 2jgu n LYS 444 N -2.04 0.01 0.20 0.00 5.02 0.14 -4.81 118.16 116.69 2jgu n LYS 444 Ca 0.08 -0.42 0.15 0.00 -2.02 0.00 0.00 58.31 56.09 2jgu n LYS 444 Cb 0.53 -0.73 0.61 0.00 -0.02 0.00 0.00 35.03 35.42 2jgu n LYS 444 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2jgu h ASP 445 N 0.00 0.00 -3.70 4.39 5.19 -1.95 -3.44 116.42 116.91 2jgu h ASP 445 Ca 0.00 0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 56.24 2jgu h ASP 445 Cb 0.40 0.00 -0.26 0.00 0.18 0.00 0.00 39.33 39.64 2jgu h ASP 445 CO 0.00 0.00 -0.42 0.27 -3.12 0.00 0.00 179.24 175.97 2jgu s ILE 446 N -3.51 -0.01 0.94 0.35 -4.36 -1.26 -5.13 121.20 108.22 2jgu s ILE 446 Ca 0.02 0.04 -0.15 0.00 -0.26 0.00 0.00 60.65 60.30 2jgu s ILE 446 Cb 0.09 -0.39 0.05 0.00 1.25 0.00 0.00 42.46 43.46 2jgu s ILE 446 CO 0.45 0.01 -0.21 -2.65 0.24 0.00 0.00 174.94 172.79 2jgu n PRO 447 N 3.27 -1.24 -4.63 0.37 -0.02 -1.26 -4.96 135.00 126.53 2jgu n PRO 447 Ca -0.16 -0.36 -0.27 0.00 -2.02 0.00 0.00 63.50 60.69 2jgu n PRO 447 Cb 0.57 -1.33 -0.14 0.00 -0.02 0.00 0.00 33.50 32.58 2jgu n PRO 447 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2jgu s GLY 448 N -1.56 1.25 0.20 -1.23 0.00 -1.26 -4.94 107.32 99.79 2jgu s GLY 448 Ca 0.33 -1.18 -0.21 0.00 0.00 0.00 0.00 44.72 43.67 2jgu s GLY 448 CO 0.41 -1.11 1.56 -2.75 0.00 0.00 0.00 173.10 171.21 2jgu h PHE 449 N 4.63 -1.14 0.01 1.90 3.57 -1.92 0.11 116.94 124.10 2jgu h PHE 449 Ca -0.45 0.10 -0.23 0.00 3.53 0.00 0.00 57.97 60.91 2jgu h PHE 449 Cb 1.16 0.62 0.00 0.00 2.79 0.00 0.00 35.95 40.52 2jgu h PHE 449 CO 0.52 -0.40 -0.97 0.82 -2.23 0.00 0.00 178.31 176.06 2jgu h ILE 450 N -0.08 1.39 -0.16 1.41 2.04 -1.96 -3.09 117.51 117.07 2jgu h ILE 450 Ca 0.28 -2.46 0.01 0.00 1.00 0.00 0.00 64.86 63.69 2jgu h ILE 450 Cb 0.57 2.44 -0.02 0.00 -0.74 0.00 0.00 36.82 39.07 2jgu h ILE 450 CO -0.86 0.73 0.06 -0.65 0.00 0.00 0.00 178.15 177.43 2jgu h PRO 451 N 0.24 0.13 -0.79 2.37 0.11 -1.51 0.28 132.00 132.82 2jgu h PRO 451 Ca -0.09 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.99 2jgu h PRO 451 Cb 1.61 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.65 2jgu h PRO 451 CO 0.17 0.09 0.39 0.66 -0.21 0.00 0.00 178.00 179.10 2jgu h SER 452 N 0.14 1.02 -0.29 -2.05 4.64 -1.12 0.32 113.55 116.21 2jgu h SER 452 Ca 0.07 -0.11 -0.00 0.00 -0.47 0.00 0.00 61.79 61.27 2jgu h SER 452 Cb 0.03 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 61.85 2jgu h SER 452 CO -0.06 0.85 0.17 -0.07 -0.87 0.00 0.00 176.83 176.85 2jgu h LEU 453 N 1.13 0.36 -0.17 5.97 3.38 -1.35 -0.30 115.31 124.33 2jgu h LEU 453 Ca 0.28 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2jgu h LEU 453 Cb 0.09 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2jgu h LEU 453 CO -0.04 0.32 0.06 -0.07 0.09 0.00 0.00 178.44 178.81 2jgu h LEU 454 N 0.37 0.24 -0.71 1.67 3.38 0.08 0.12 115.31 120.45 2jgu h LEU 454 Ca 0.10 -0.18 0.13 0.00 0.09 0.00 0.00 57.88 58.02 2jgu h LEU 454 Cb 0.04 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 40.63 2jgu h LEU 454 CO -0.02 0.36 0.26 1.23 0.09 0.00 0.00 178.44 180.36 2jgu h GLY 455 N 0.11 1.04 1.99 0.83 0.00 -0.22 0.30 103.07 107.11 2jgu h GLY 455 Ca 0.06 -0.12 -0.09 0.00 0.00 0.00 0.00 47.33 47.17 2jgu h GLY 455 CO -0.00 -0.09 -0.44 0.45 0.00 0.00 0.00 176.54 176.46 2jgu h HIS 456 N 0.41 0.01 0.01 5.60 3.86 -0.37 0.41 115.15 125.09 2jgu h HIS 456 Ca 0.38 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.59 2jgu h HIS 456 Cb 0.56 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.02 2jgu h HIS 456 CO -0.18 0.45 -0.00 -0.07 0.86 0.00 0.00 177.93 178.98 2jgu h LEU 457 N 0.01 -0.01 -1.35 2.43 3.38 0.20 -2.14 115.31 117.84 2jgu h LEU 457 Ca -0.00 0.00 0.44 0.00 0.09 0.00 0.00 57.88 58.40 2jgu h LEU 457 Cb 0.78 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.40 2jgu h LEU 457 CO 0.06 -0.01 0.82 -0.07 0.09 0.00 0.00 178.44 179.33 2jgu h LEU 458 N -0.02 0.26 -0.94 1.67 3.38 -0.47 0.65 115.31 119.83 2jgu h LEU 458 Ca -0.00 0.15 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 2jgu h LEU 458 Cb 0.01 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2jgu h LEU 458 CO 0.00 -0.22 -0.41 -0.08 0.09 0.00 0.00 178.44 177.83 2jgu h GLU 459 N 0.08 0.24 0.00 1.13 4.81 -0.05 -2.34 114.58 118.45 2jgu h GLU 459 Ca 0.83 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.92 2jgu h GLU 459 Cb 2.55 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.93 2jgu h GLU 459 CO -0.47 0.62 -0.13 1.49 -0.73 0.00 0.00 179.01 179.79 2jgu h GLU 460 N 0.20 0.00 0.00 1.92 4.81 0.96 -2.87 114.58 119.60 2jgu h GLU 460 Ca 0.02 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.15 2jgu h GLU 460 Cb 0.81 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 2jgu h GLU 460 CO 0.06 0.12 -0.49 -0.09 -0.73 0.00 0.00 179.01 177.88 2jgu h ARG 461 N 0.00 0.00 -0.02 1.92 2.43 -0.94 -2.78 114.38 114.99 2jgu h ARG 461 Ca -0.00 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.98 2jgu h ARG 461 Cb 1.09 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 2jgu h ARG 461 CO 0.02 0.49 -0.82 1.96 -1.51 0.00 0.00 179.97 180.10 2jgu h GLN 462 N 0.00 0.27 0.00 0.20 1.08 -1.21 -1.64 115.11 113.81 2jgu h GLN 462 Ca -0.00 -0.26 -0.00 0.00 -1.45 0.00 0.00 58.65 56.93 2jgu h GLN 462 Cb 0.98 0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 28.48 2jgu h GLN 462 CO 0.06 0.95 -0.02 0.87 -0.95 0.00 0.00 178.83 179.74 2jgu h LYS 463 N 0.17 0.00 0.00 1.46 1.57 -1.37 0.18 116.57 118.58 2jgu h LYS 463 Ca -0.04 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.51 2jgu h LYS 463 Cb 1.42 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.70 2jgu h LYS 463 CO 0.13 0.02 -1.28 -0.89 -0.57 0.00 0.00 179.45 176.86 2jgu n ILE 464 N -3.18 1.53 -0.16 1.86 5.41 -1.08 -2.10 119.36 121.64 2jgu n ILE 464 Ca -0.01 -0.03 -0.02 0.00 1.00 0.00 0.00 62.75 63.69 2jgu n ILE 464 Cb 0.20 -2.06 0.06 0.00 -0.71 0.00 0.00 39.64 37.13 2jgu n ILE 464 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2jgu h LYS 465 N -1.00 0.13 -0.32 0.38 1.57 -1.14 -1.26 116.57 114.93 2jgu h LYS 465 Ca -0.34 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.43 2jgu h LYS 465 Cb 1.26 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.53 2jgu h LYS 465 CO -0.21 0.09 0.21 1.15 -0.57 0.00 0.00 179.45 180.12 2jgu h THR 466 N 0.13 1.07 -0.17 -0.16 2.02 -0.77 -2.96 112.91 112.08 2jgu h THR 466 Ca 0.25 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 2jgu h THR 466 Cb 0.38 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 2jgu h THR 466 CO -0.41 0.08 -0.02 0.50 0.37 0.00 0.00 175.52 176.04 2jgu h LYS 467 N 0.43 0.24 0.65 6.66 3.64 -0.83 -2.89 116.57 124.47 2jgu h LYS 467 Ca 0.12 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 2jgu h LYS 467 Cb -0.04 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 2jgu h LYS 467 CO -0.03 0.28 -0.35 0.52 -2.27 0.00 0.00 179.45 177.60 2jgu h MET 468 N 0.24 -0.89 0.00 1.90 2.86 -1.08 -1.13 114.93 116.82 2jgu h MET 468 Ca 0.06 0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2jgu h MET 468 Cb 0.20 0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.06 2jgu h MET 468 CO 0.01 -0.59 0.45 1.63 1.06 0.00 0.00 176.91 179.46 2jgu n LYS 469 N -5.50 0.05 -0.03 1.72 5.02 -1.09 -0.04 118.16 118.29 2jgu n LYS 469 Ca -0.13 0.45 0.05 0.00 -2.02 0.00 0.00 58.31 56.66 2jgu n LYS 469 Cb 0.38 -2.10 -0.15 0.00 -0.02 0.00 0.00 35.03 33.15 2jgu n LYS 469 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2jgu n GLU 470 N -1.76 0.71 -3.06 1.97 2.13 -0.47 -5.03 120.64 115.12 2jgu n GLU 470 Ca -0.00 -0.13 -0.39 0.00 0.66 0.00 0.00 57.16 57.29 2jgu n GLU 470 Cb 0.46 -1.46 -0.05 0.00 0.27 0.00 0.00 31.44 30.66 2jgu n GLU 470 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 2jgu s THR 471 N -3.11 4.86 -0.80 6.31 -1.32 0.94 -4.97 115.64 117.55 2jgu s THR 471 Ca -0.07 1.47 0.17 0.00 -1.21 0.00 0.00 61.69 62.05 2jgu s THR 471 Cb 0.11 -4.04 -0.19 0.00 -1.51 0.00 0.00 72.50 66.86 2jgu s THR 471 CO 0.78 0.35 0.73 0.00 -2.21 0.00 0.00 174.62 174.28 2jgu n GLN 472 N 3.02 1.24 -2.56 7.08 3.00 -1.26 -4.82 117.38 123.08 2jgu n GLN 472 Ca -0.03 -0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.52 2jgu n GLN 472 Cb 0.51 -1.32 -0.02 0.00 0.00 0.00 0.00 30.24 29.40 2jgu n GLN 472 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2jgu s ASP 473 N -2.67 7.07 0.00 1.08 3.68 -1.26 -4.83 116.67 119.74 2jgu s ASP 473 Ca 0.06 1.58 0.21 0.00 2.13 0.00 0.00 52.55 56.54 2jgu s ASP 473 Cb 0.13 -2.55 1.03 0.00 -1.45 0.00 0.00 42.92 40.08 2jgu s ASP 473 CO 0.71 -0.64 1.69 -0.81 0.13 0.00 0.00 175.17 176.25 2jgu n PRO 474 N 5.96 0.21 0.03 4.34 -0.04 -1.26 -1.45 135.00 142.80 2jgu n PRO 474 Ca 0.12 0.10 -0.03 0.00 -0.04 0.00 0.00 63.50 63.65 2jgu n PRO 474 Cb 0.46 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.40 2jgu n PRO 474 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2jgu h ILE 475 N 0.00 0.04 -0.67 0.52 2.04 -1.99 -2.87 117.51 114.58 2jgu h ILE 475 Ca 0.00 -0.88 0.13 0.00 1.00 0.00 0.00 64.86 65.11 2jgu h ILE 475 Cb 0.25 0.07 -0.09 0.00 -0.74 0.00 0.00 36.82 36.32 2jgu h ILE 475 CO 0.00 0.01 0.19 -0.08 0.00 0.00 0.00 178.15 178.27 2jgu h GLU 476 N -1.05 0.31 -0.50 2.37 4.81 -1.91 -2.43 114.58 116.17 2jgu h GLU 476 Ca -0.02 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.27 2jgu h GLU 476 Cb 0.17 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.42 2jgu h GLU 476 CO 0.03 0.20 0.15 -0.22 -0.73 0.00 0.00 179.01 178.45 2jgu h LYS 477 N 0.32 0.30 -0.40 1.92 3.64 -1.30 0.39 116.57 121.44 2jgu h LYS 477 Ca 0.36 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.58 2jgu h LYS 477 Cb 0.55 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 2jgu h LYS 477 CO -0.42 0.20 -0.29 0.97 -2.27 0.00 0.00 179.45 177.64 2jgu h ILE 478 N 0.31 1.28 -0.24 2.00 2.10 -1.26 0.35 117.51 122.05 2jgu h ILE 478 Ca 0.25 -1.46 0.02 0.00 1.08 0.00 0.00 64.86 64.75 2jgu h ILE 478 Cb 0.29 1.32 -0.02 0.00 -1.09 0.00 0.00 36.82 37.32 2jgu h ILE 478 CO -0.28 0.49 0.08 0.25 -1.08 0.00 0.00 178.15 177.62 2jgu h LEU 479 N 0.72 0.10 -0.68 2.19 5.85 -0.95 0.66 115.31 123.20 2jgu h LEU 479 Ca 0.08 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 2jgu h LEU 479 Cb 0.87 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.89 2jgu h LEU 479 CO 0.08 0.09 0.27 -0.07 -0.34 0.00 0.00 178.44 178.46 2jgu h LEU 480 N 0.20 0.94 -1.40 2.25 3.38 -0.12 0.10 115.31 120.67 2jgu h LEU 480 Ca 0.10 -0.18 0.20 0.00 0.09 0.00 0.00 57.88 58.09 2jgu h LEU 480 Cb 0.07 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.50 2jgu h LEU 480 CO -0.10 0.86 0.60 -0.78 0.09 0.00 0.00 178.44 179.11 2jgu h ASP 481 N 0.97 0.50 0.18 -0.43 3.58 0.13 -1.24 116.42 120.12 2jgu h ASP 481 Ca 0.23 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.72 2jgu h ASP 481 Cb 0.22 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.23 2jgu h ASP 481 CO -0.02 0.20 -0.09 1.88 -2.88 0.00 0.00 179.24 178.34 2jgu h TYR 482 N 0.50 -0.23 -0.70 0.28 0.99 0.10 -1.84 116.97 116.07 2jgu h TYR 482 Ca 0.49 -0.01 0.13 0.00 2.00 0.00 0.00 58.73 61.35 2jgu h TYR 482 Cb 1.08 0.07 -0.13 0.00 1.00 0.00 0.00 36.73 38.75 2jgu h TYR 482 CO -0.00 0.18 -0.25 0.00 -0.00 0.00 0.00 178.16 178.09 2jgu h ARG 483 N -0.74 -0.06 0.49 4.88 3.08 -0.16 -1.79 114.38 120.08 2jgu h ARG 483 Ca -0.02 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 2jgu h ARG 483 Cb 0.51 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2jgu h ARG 483 CO 0.04 -0.04 -0.23 0.37 -1.07 0.00 0.00 179.97 179.04 2jgu h GLN 484 N -0.06 -0.63 -0.57 0.04 -0.00 -1.36 -1.95 115.11 110.58 2jgu h GLN 484 Ca 0.31 0.04 0.17 0.00 -0.00 0.00 0.00 58.65 59.17 2jgu h GLN 484 Cb 0.55 0.14 -0.02 0.00 0.00 0.00 0.00 27.48 28.15 2jgu h GLN 484 CO -0.75 -0.42 0.45 0.87 0.00 0.00 0.00 178.83 178.98 2jgu h LYS 485 N -0.65 0.00 0.03 1.69 1.79 -0.50 -0.13 116.57 118.80 2jgu h LYS 485 Ca -0.07 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.30 2jgu h LYS 485 Cb 0.50 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.16 2jgu h LYS 485 CO 0.11 0.00 -0.41 0.00 -1.08 0.00 0.00 179.45 178.07 2jgu h ALA 486 N 1.64 0.00 -0.60 3.86 0.00 -1.16 -0.61 119.26 122.40 2jgu h ALA 486 Ca 0.27 -0.55 0.03 0.00 0.00 0.00 0.00 54.91 54.66 2jgu h ALA 486 Cb 1.16 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2jgu h ALA 486 CO -0.00 0.19 0.40 0.82 0.00 0.00 0.00 179.25 180.66 2jgu h ILE 487 N -0.48 1.10 -0.01 0.00 2.04 -0.58 0.08 117.51 119.65 2jgu h ILE 487 Ca -0.06 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.54 2jgu h ILE 487 Cb 1.22 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 37.59 2jgu h ILE 487 CO 0.08 0.13 -0.00 0.50 0.00 0.00 0.00 178.15 178.86 2jgu h LYS 488 N 0.73 0.02 -0.16 2.37 3.64 -1.00 0.44 116.57 122.62 2jgu h LYS 488 Ca 0.24 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.66 2jgu h LYS 488 Cb 0.04 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.80 2jgu h LYS 488 CO -0.06 0.35 -0.24 1.25 -2.27 0.00 0.00 179.45 178.48 2jgu h LEU 489 N -0.31 -0.74 -0.06 5.20 5.85 -0.28 -0.47 115.31 124.50 2jgu h LEU 489 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.85 2jgu h LEU 489 Cb 0.34 0.34 -0.00 0.00 0.37 0.00 0.00 40.66 41.70 2jgu h LEU 489 CO 0.00 -0.28 0.03 0.25 -0.34 0.00 0.00 178.44 178.09 2jgu h LEU 490 N -0.29 0.04 -1.52 2.25 5.85 -0.96 -2.54 115.31 118.15 2jgu h LEU 490 Ca 0.11 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 2jgu h LEU 490 Cb 0.45 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2jgu h LEU 490 CO -0.32 0.03 0.20 0.00 -0.34 0.00 0.00 178.44 178.01 2jgu h ALA 491 N 1.03 1.64 0.00 1.25 0.00 0.22 -1.42 119.26 121.98 2jgu h ALA 491 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2jgu h ALA 491 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2jgu h ALA 491 CO -0.02 0.31 0.00 0.09 0.00 0.00 0.00 179.25 179.63 2jgu n ASN 492 N -4.43 0.56 -1.69 0.00 4.13 -0.22 -3.54 115.26 110.08 2jgu n ASN 492 Ca 0.03 0.59 0.08 0.00 1.68 0.00 0.00 54.58 56.96 2jgu n ASN 492 Cb 0.10 -0.73 0.37 0.00 -1.54 0.00 0.00 39.78 37.98 2jgu n ASN 492 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2jgu n SER 493 N -2.07 5.05 0.05 6.41 7.64 -0.53 -4.31 113.62 125.86 2jgu n SER 493 Ca 0.04 -2.63 -0.07 0.00 1.01 0.00 0.00 58.87 57.23 2jgu n SER 493 Cb 0.31 -0.62 -0.12 0.00 -1.01 0.00 0.00 64.21 62.77 2jgu n SER 493 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 2jgu h PHE 494 N 3.96 0.00 0.39 1.43 0.04 -1.68 -2.65 116.94 118.43 2jgu h PHE 494 Ca 0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 2jgu h PHE 494 Cb 1.64 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.77 2jgu h PHE 494 CO 0.88 0.97 -0.39 -0.92 -0.60 0.00 0.00 178.31 178.26 2jgu h TYR 495 N 0.00 -1.08 -0.78 -0.55 3.20 -1.84 -1.62 116.97 114.30 2jgu h TYR 495 Ca -0.05 0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.92 2jgu h TYR 495 Cb 1.79 0.42 -0.05 0.00 1.54 0.00 0.00 36.73 40.42 2jgu h TYR 495 CO 0.00 -0.52 0.51 0.78 -1.64 0.00 0.00 178.16 177.30 2jgu h GLY 496 N -0.77 1.03 0.18 1.82 0.00 -1.85 -2.02 103.07 101.45 2jgu h GLY 496 Ca -0.05 -0.30 0.01 0.00 0.00 0.00 0.00 47.33 46.99 2jgu h GLY 496 CO -0.05 0.19 -0.51 -1.82 0.00 0.00 0.00 176.54 174.34 2jgu h TYR 497 N 0.74 -1.48 -1.33 5.60 3.20 -1.05 0.49 116.97 123.13 2jgu h TYR 497 Ca 0.36 0.04 0.39 0.00 3.14 0.00 0.00 58.73 62.65 2jgu h TYR 497 Cb 0.41 0.63 -0.06 0.00 1.54 0.00 0.00 36.73 39.24 2jgu h TYR 497 CO -0.00 -0.60 0.95 1.88 -1.64 0.00 0.00 178.16 178.75 2jgu h TYR 498 N -0.77 0.08 -0.03 -3.82 0.99 -0.55 1.22 116.97 114.09 2jgu h TYR 498 Ca -0.01 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2jgu h TYR 498 Cb 0.76 -0.02 0.00 0.00 1.00 0.00 0.00 36.73 38.47 2jgu h TYR 498 CO -0.43 -0.01 0.00 0.41 -0.00 0.00 0.00 178.16 178.14 2jgu n GLY 499 N -1.76 0.11 3.66 3.88 0.00 0.15 -3.06 105.19 108.17 2jgu n GLY 499 Ca 0.30 -0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 2jgu n GLY 499 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2jgu s TYR 500 N -1.99 2.89 0.24 1.61 5.04 0.42 -4.94 117.35 120.63 2jgu s TYR 500 Ca 0.37 1.04 -0.12 0.00 -2.44 0.00 0.00 57.07 55.92 2jgu s TYR 500 Cb 0.21 -3.49 0.33 0.00 0.35 0.00 0.00 41.96 39.36 2jgu s TYR 500 CO 0.33 -1.63 1.59 0.00 -1.34 0.00 0.00 175.55 174.49 2jgu h ALA 501 N 8.12 0.48 -0.18 3.97 0.00 -1.91 -1.05 119.26 128.69 2jgu h ALA 501 Ca -0.27 0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2jgu h ALA 501 Cb 1.11 0.67 0.00 0.00 0.00 0.00 0.00 17.79 19.57 2jgu h ALA 501 CO 0.96 -0.44 0.00 1.63 0.00 0.00 0.00 179.25 181.41 2jgu n LYS 502 N -5.53 1.80 -1.93 0.00 5.02 -1.26 -4.76 118.16 111.51 2jgu n LYS 502 Ca 0.11 -1.21 -0.41 0.00 -2.02 0.00 0.00 58.31 54.78 2jgu n LYS 502 Cb 0.42 -1.40 -0.02 0.00 -0.02 0.00 0.00 35.03 34.00 2jgu n LYS 502 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jgu s ALA 503 N -1.77 3.68 0.30 7.82 0.00 -0.40 -4.61 121.76 126.78 2jgu s ALA 503 Ca 0.33 1.41 0.08 0.00 0.00 0.00 0.00 51.96 53.78 2jgu s ALA 503 Cb 0.18 -3.59 0.45 0.00 0.00 0.00 0.00 23.12 20.16 2jgu s ALA 503 CO 0.27 -0.83 1.69 0.00 0.00 0.00 0.00 175.76 176.89 2jgu h ARG 504 N 5.10 0.15 -1.02 0.00 3.08 -1.89 -2.91 114.38 116.88 2jgu h ARG 504 Ca -0.46 -0.08 -0.55 0.00 0.07 0.00 0.00 59.98 58.97 2jgu h ARG 504 Cb 1.22 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 30.98 2jgu h ARG 504 CO 0.79 0.59 0.70 0.91 -1.07 0.00 0.00 179.97 181.89 2jgu n TRP 505 N -3.97 2.97 -1.48 3.04 8.01 -1.26 -4.70 117.44 120.05 2jgu n TRP 505 Ca -0.02 -2.19 -0.39 0.00 -1.31 0.00 0.00 57.50 53.59 2jgu n TRP 505 Cb 0.51 -1.09 0.03 0.00 -2.01 0.00 0.00 31.31 28.75 2jgu n TRP 505 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.69 177.66 2jgu n TYR 506 N -0.97 -0.48 -2.67 -5.99 9.36 -1.10 -4.81 117.16 110.51 2jgu n TYR 506 Ca 0.58 0.49 -0.02 0.00 3.32 0.00 0.00 57.90 62.27 2jgu n TYR 506 Cb 1.27 -1.99 0.03 0.00 -0.63 0.00 0.00 39.34 38.03 2jgu n TYR 506 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2jgu h LYS 508 N 4.33 0.00 -0.00 0.00 3.64 -1.93 0.13 116.57 122.74 2jgu h LYS 508 Ca -0.02 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.21 2jgu h LYS 508 Cb 1.19 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.99 2jgu h LYS 508 CO -0.12 0.00 -0.71 0.93 -2.27 0.00 0.00 179.45 177.27 2jgu h GLU 509 N 0.00 0.02 -0.45 1.90 3.07 -1.95 0.56 114.58 117.73 2jgu h GLU 509 Ca 0.15 -0.02 -0.12 0.00 -0.50 0.00 0.00 59.36 58.87 2jgu h GLU 509 Cb 0.71 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.61 2jgu h GLU 509 CO -0.00 0.72 -0.18 0.00 -1.40 0.00 0.00 179.01 178.15 2jgu h ALA 511 N 1.02 0.56 -0.47 0.00 0.00 -0.90 -2.99 119.26 116.48 2jgu h ALA 511 Ca 0.11 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 2jgu h ALA 511 Cb 0.71 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2jgu h ALA 511 CO 0.05 0.45 0.13 0.93 0.00 0.00 0.00 179.25 180.82 2jgu h GLU 512 N 0.61 0.75 -0.30 0.00 5.08 -0.76 -2.81 114.58 117.15 2jgu h GLU 512 Ca 0.10 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2jgu h GLU 512 Cb 0.65 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2jgu h GLU 512 CO 0.04 0.72 -0.01 0.77 -1.00 0.00 0.00 179.01 179.53 2jgu h SER 513 N 0.64 0.43 0.49 1.42 0.02 -1.41 -0.74 113.55 114.40 2jgu h SER 513 Ca 0.15 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 2jgu h SER 513 Cb 0.30 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.73 2jgu h SER 513 CO -0.00 0.51 -0.24 0.58 -1.14 0.00 0.00 176.83 176.54 2jgu h VAL 514 N 0.44 0.33 -0.61 2.27 2.07 -1.45 0.43 116.25 119.74 2jgu h VAL 514 Ca 0.10 -0.47 0.12 0.00 0.82 0.00 0.00 66.70 67.27 2jgu h VAL 514 Cb 0.31 0.48 -0.12 0.00 -1.52 0.00 0.00 31.29 30.45 2jgu h VAL 514 CO 0.01 0.06 -0.16 0.74 0.02 0.00 0.00 177.57 178.24 2jgu h THR 515 N -1.01 0.39 -0.37 2.57 2.02 -1.36 1.31 112.91 116.46 2jgu h THR 515 Ca -0.07 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.04 2jgu h THR 515 Cb 0.60 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 2jgu h THR 515 CO 0.11 0.00 -0.05 0.00 0.37 0.00 0.00 175.52 175.95 2jgu h ALA 516 N 1.60 0.50 0.00 6.16 0.00 -1.15 -0.67 119.26 125.70 2jgu h ALA 516 Ca 0.29 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2jgu h ALA 516 Cb 0.45 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2jgu h ALA 516 CO -0.63 0.32 -0.11 -1.49 0.00 0.00 0.00 179.25 177.34 2jgu h TRP 517 N 0.49 0.00 -0.22 0.00 6.55 0.15 0.12 115.95 123.03 2jgu h TRP 517 Ca 0.10 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.93 2jgu h TRP 517 Cb 0.54 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.83 2jgu h TRP 517 CO 0.04 0.11 0.11 0.78 -1.05 0.00 0.00 178.44 178.44 2jgu h GLY 518 N 0.40 0.33 0.95 1.49 0.00 0.30 -3.03 103.07 103.51 2jgu h GLY 518 Ca -0.00 -0.16 0.01 0.00 0.00 0.00 0.00 47.33 47.19 2jgu h GLY 518 CO 0.01 0.15 0.40 -0.09 0.00 0.00 0.00 176.54 177.01 2jgu h ARG 519 N 0.24 0.78 -0.55 4.80 2.43 0.35 -3.07 114.38 119.35 2jgu h ARG 519 Ca 0.08 -0.05 0.09 0.00 -0.81 0.00 0.00 59.98 59.28 2jgu h ARG 519 Cb 0.09 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 2jgu h ARG 519 CO -0.01 0.51 0.37 -0.22 -1.51 0.00 0.00 179.97 179.11 2jgu h LYS 520 N 0.80 0.38 0.10 0.20 3.64 -1.34 -1.83 116.57 118.52 2jgu h LYS 520 Ca 0.23 -0.02 -0.27 0.00 -1.27 0.00 0.00 60.65 59.32 2jgu h LYS 520 Cb -0.05 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 2jgu h LYS 520 CO -0.07 0.25 -1.26 1.88 -2.27 0.00 0.00 179.45 177.98 2jgu h TYR 521 N 0.39 0.40 0.40 1.91 -1.99 -1.54 -2.39 116.97 114.14 2jgu h TYR 521 Ca 0.25 -0.29 -0.02 0.00 2.00 0.00 0.00 58.73 60.67 2jgu h TYR 521 Cb 0.47 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 39.18 2jgu h TYR 521 CO -0.00 1.25 -0.22 0.82 -0.00 0.00 0.00 178.16 180.00 2jgu h ILE 522 N 0.06 0.00 0.00 -2.88 1.08 -1.47 -0.20 117.51 114.09 2jgu h ILE 522 Ca -0.13 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.34 2jgu h ILE 522 Cb 1.95 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.70 2jgu h ILE 522 CO 0.18 0.00 0.00 -0.62 -0.69 0.00 0.00 178.15 177.02 2jgu n GLU 523 N -3.69 0.00 0.00 2.37 1.02 -0.71 -0.50 120.64 119.14 2jgu n GLU 523 Ca -0.07 0.20 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 2jgu n GLU 523 Cb 0.24 -0.71 0.00 0.00 -0.02 0.00 0.00 31.44 30.94 2jgu n GLU 523 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2jgu n LEU 524 N -0.41 0.00 -0.20 -4.62 0.00 -0.90 0.46 117.00 111.33 2jgu n LEU 524 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 56.01 55.94 2jgu n LEU 524 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 43.42 43.45 2jgu n LEU 524 CO 0.00 0.00 1.06 0.58 0.00 0.00 0.00 177.39 179.03 2jgu h VAL 525 N 0.00 1.18 -0.50 1.96 2.07 0.76 -1.61 116.25 120.11 2jgu h VAL 525 Ca 0.00 -0.43 0.02 0.00 0.82 0.00 0.00 66.70 67.11 2jgu h VAL 525 Cb 0.00 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 2jgu h VAL 525 CO 0.00 0.19 0.30 -0.25 0.02 0.00 0.00 177.57 177.83 2jgu h TRP 526 N 0.76 0.57 0.00 1.57 7.01 1.28 0.53 115.95 127.66 2jgu h TRP 526 Ca 0.20 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.22 2jgu h TRP 526 Cb 0.02 -0.18 0.00 0.00 -2.10 0.00 0.00 29.16 26.90 2jgu h TRP 526 CO -0.02 0.33 0.00 1.17 -2.79 0.00 0.00 178.44 177.13 2jgu n LYS 527 N -4.80 0.00 -0.33 2.65 4.81 -0.36 -1.67 118.16 118.48 2jgu n LYS 527 Ca 0.03 0.37 0.26 0.00 -0.87 0.00 0.00 58.31 58.10 2jgu n LYS 527 Cb 0.07 -1.30 0.50 0.00 0.02 0.00 0.00 35.03 34.31 2jgu n LYS 527 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2jgu h GLU 528 N 0.00 0.06 0.08 1.64 4.39 -1.31 1.08 114.58 120.52 2jgu h GLU 528 Ca 0.00 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 2jgu h GLU 528 Cb 0.00 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2jgu h GLU 528 CO 0.00 0.04 -0.04 1.25 -1.16 0.00 0.00 179.01 179.10 2jgu h LEU 529 N 0.07 -0.09 0.07 1.33 5.85 0.14 -2.59 115.31 120.08 2jgu h LEU 529 Ca 0.77 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 59.31 2jgu h LEU 529 Cb 1.90 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.96 2jgu h LEU 529 CO -0.77 0.12 -0.03 -0.33 -0.34 0.00 0.00 178.44 177.09 2jgu h GLU 530 N -0.31 -0.09 0.28 1.25 5.08 0.19 -2.97 114.58 118.00 2jgu h GLU 530 Ca -0.01 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 2jgu h GLU 530 Cb 0.27 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2jgu h GLU 530 CO 0.02 0.33 -0.14 0.93 -1.00 0.00 0.00 179.01 179.15 2jgu h GLU 531 N -0.54 -0.37 0.00 2.33 5.08 -0.29 -1.29 114.58 119.51 2jgu h GLU 531 Ca -0.01 0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 2jgu h GLU 531 Cb 0.46 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2jgu h GLU 531 CO 0.02 -0.24 -0.33 0.87 -1.00 0.00 0.00 179.01 178.32 2jgu h LYS 532 N -0.57 0.00 -0.30 2.33 1.57 -1.69 -3.30 116.57 114.62 2jgu h LYS 532 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2jgu h LYS 532 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2jgu h LYS 532 CO 0.06 0.33 0.00 1.19 -0.57 0.00 0.00 179.45 180.46 2jgu n PHE 533 N -4.06 0.40 -3.81 -1.35 3.01 -1.08 -5.03 117.46 105.54 2jgu n PHE 533 Ca -0.02 -0.47 -0.23 0.00 1.01 0.00 0.00 57.45 57.74 2jgu n PHE 533 Cb 0.38 -0.03 0.01 0.00 -0.01 0.00 0.00 39.48 39.83 2jgu n PHE 533 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jgu n GLY 534 N 0.43 -0.26 3.52 1.37 0.00 -0.49 -4.95 105.19 104.82 2jgu n GLY 534 Ca 0.10 0.13 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 2jgu n GLY 534 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jgu s PHE 535 N -3.80 2.52 -0.25 1.61 0.40 -1.21 -4.71 117.98 112.54 2jgu s PHE 535 Ca 0.01 -0.27 -0.10 0.00 -0.60 0.00 0.00 56.93 55.97 2jgu s PHE 535 Cb -0.00 -1.24 -0.05 0.00 0.51 0.00 0.00 43.02 42.24 2jgu s PHE 535 CO 0.85 0.50 0.15 0.21 0.70 0.00 0.00 175.22 177.63 2jgu s LYS 536 N -2.73 3.96 -0.06 0.44 2.20 0.44 -4.25 119.74 119.73 2jgu s LYS 536 Ca 0.23 -0.32 -0.30 0.00 -0.36 0.00 0.00 55.97 55.22 2jgu s LYS 536 Cb -0.09 -3.54 -0.02 0.00 -1.51 0.00 0.00 37.83 32.68 2jgu s LYS 536 CO 0.13 -0.06 1.01 0.08 -0.36 0.00 0.00 175.35 176.16 2jgu s VAL 537 N 1.37 4.77 -0.55 4.02 1.01 -1.26 -2.68 120.40 127.08 2jgu s VAL 537 Ca 0.07 2.02 0.23 0.00 0.00 0.00 0.00 61.98 64.30 2jgu s VAL 537 Cb -0.15 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.89 2jgu s VAL 537 CO 0.07 0.06 1.12 0.18 0.00 0.00 0.00 175.10 176.53 2jgu n LEU 538 N 4.62 0.66 0.00 3.92 4.77 0.01 -4.66 117.00 126.32 2jgu n LEU 538 Ca 0.08 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 2jgu n LEU 538 Cb 0.49 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 2jgu n LEU 538 CO 0.52 -0.02 0.00 0.00 -1.33 0.00 0.00 177.39 176.56 2jgu n TYR 539 N -2.12 0.00 -3.47 -1.77 9.36 -1.22 -1.89 117.16 116.05 2jgu n TYR 539 Ca 0.02 0.00 -0.37 0.00 3.32 0.00 0.00 57.90 60.86 2jgu n TYR 539 Cb 0.46 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 39.10 2jgu n TYR 539 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 2jgu s ILE 540 N 0.00 5.17 -0.32 2.97 1.01 -1.26 -2.39 121.20 126.38 2jgu s ILE 540 Ca 0.00 0.77 -0.01 0.00 0.00 0.00 0.00 60.65 61.41 2jgu s ILE 540 Cb 0.00 -3.71 0.13 0.00 0.01 0.00 0.00 42.46 38.89 2jgu s ILE 540 CO 0.00 0.46 0.24 -0.62 0.00 0.00 0.00 174.94 175.02 2jgu s ASP 541 N -0.19 2.43 0.00 3.58 -1.08 0.15 -4.45 116.67 117.10 2jgu s ASP 541 Ca 0.22 -1.43 0.00 0.00 -0.52 0.00 0.00 52.55 50.82 2jgu s ASP 541 Cb -0.15 0.05 0.00 0.00 -1.46 0.00 0.00 42.92 41.36 2jgu s ASP 541 CO 0.10 -0.36 0.00 0.35 0.52 0.00 0.00 175.17 175.78 2jgu n THR 542 N 4.77 0.00 0.00 1.71 -2.24 -1.25 -2.53 114.28 114.74 2jgu n THR 542 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2jgu n THR 542 Cb 0.43 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 2jgu n THR 542 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2jgu n ASP 543 N 0.00 1.16 0.00 3.42 9.92 -1.26 -4.85 116.55 124.94 2jgu n ASP 543 Ca 0.00 -0.03 0.00 0.00 -0.53 0.00 0.00 54.79 54.23 2jgu n ASP 543 Cb 0.00 0.28 0.00 0.00 -0.64 0.00 0.00 41.12 40.76 2jgu n ASP 543 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jgu n GLY 544 N 0.63 2.76 0.00 0.44 0.00 -1.05 -2.27 105.19 105.70 2jgu n GLY 544 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2jgu n GLY 544 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2jgu n LEU 545 N 0.00 0.00 -4.79 0.99 -0.00 -1.11 0.31 117.00 112.39 2jgu n LEU 545 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 56.01 55.65 2jgu n LEU 545 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.35 2jgu n LEU 545 CO 0.00 0.00 -0.21 -0.31 -0.00 0.00 0.00 177.39 176.87 2jgu s TYR 546 N -2.00 3.44 0.35 1.47 2.02 -1.00 -0.40 117.35 121.22 2jgu s TYR 546 Ca 0.00 0.39 -0.05 0.00 -0.37 0.00 0.00 57.07 57.04 2jgu s TYR 546 Cb 0.00 -1.93 0.01 0.00 -0.40 0.00 0.00 41.96 39.64 2jgu s TYR 546 CO 0.00 0.58 0.52 0.00 -1.57 0.00 0.00 175.55 175.08 2jgu s ALA 547 N -0.76 0.52 0.00 3.71 0.00 0.14 -0.81 121.76 124.55 2jgu s ALA 547 Ca 0.13 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.70 2jgu s ALA 547 Cb -0.12 1.08 0.00 0.00 0.00 0.00 0.00 23.12 24.08 2jgu s ALA 547 CO 0.03 -0.82 0.00 -2.37 0.00 0.00 0.00 175.76 172.60 2jgu n THR 548 N -0.56 0.00 -3.83 0.00 5.66 -1.09 -0.37 114.28 114.10 2jgu n THR 548 Ca -0.01 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.70 2jgu n THR 548 Cb 0.61 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.24 2jgu n THR 548 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 2jgu s ILE 549 N -2.76 1.14 0.18 1.09 -1.09 -1.26 0.17 121.20 118.67 2jgu s ILE 549 Ca 0.00 -1.26 -0.24 0.00 -2.23 0.00 0.00 60.65 56.92 2jgu s ILE 549 Cb 0.00 -1.67 -0.15 0.00 -1.58 0.00 0.00 42.46 39.06 2jgu s ILE 549 CO 0.00 -0.39 0.44 -2.65 -1.23 0.00 0.00 174.94 171.11 2jgu n PRO 550 N 4.78 0.00 -0.29 2.79 -0.02 -1.26 0.38 135.00 141.38 2jgu n PRO 550 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 2jgu n PRO 550 Cb 0.44 -0.87 0.00 0.00 -0.02 0.00 0.00 33.50 33.05 2jgu n PRO 550 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgu n GLY 551 N 1.74 0.05 3.72 -1.23 0.00 -1.26 -4.90 105.19 103.32 2jgu n GLY 551 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2jgu n GLY 551 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jgu n GLY 552 N -2.00 0.71 3.75 -0.02 0.00 0.16 -4.97 105.19 102.83 2jgu n GLY 552 Ca 0.00 0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2jgu n GLY 552 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jgu s GLU 553 N -2.32 4.32 0.00 1.61 2.56 -1.26 -4.95 118.70 118.66 2jgu s GLU 553 Ca 0.61 2.23 0.21 0.00 0.00 0.00 0.00 54.97 58.02 2jgu s GLU 553 Cb -0.48 -3.11 1.09 0.00 2.00 0.00 0.00 34.13 33.63 2jgu s GLU 553 CO 0.57 -0.30 1.66 0.45 -0.56 0.00 0.00 175.26 177.09 2jgu n SER 554 N 1.75 0.00 -3.03 -1.70 2.88 -1.26 -2.85 113.62 109.42 2jgu n SER 554 Ca 0.04 -0.13 -0.20 0.00 -1.33 0.00 0.00 58.87 57.24 2jgu n SER 554 Cb 0.41 -0.23 -0.03 0.00 -0.75 0.00 0.00 64.21 63.61 2jgu n SER 554 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jgu n GLU 555 N -1.23 1.79 0.00 -1.46 1.02 -1.26 -4.01 120.64 115.49 2jgu n GLU 555 Ca 0.11 -3.87 0.00 0.00 -0.02 0.00 0.00 57.16 53.38 2jgu n GLU 555 Cb 0.15 -1.85 0.00 0.00 -0.02 0.00 0.00 31.44 29.72 2jgu n GLU 555 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2jgu n GLU 556 N 0.05 0.00 -0.03 3.49 4.07 -1.25 -4.66 120.64 122.31 2jgu n GLU 556 Ca 0.26 0.00 -0.17 0.00 -0.06 0.00 0.00 57.16 57.19 2jgu n GLU 556 Cb 0.60 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.91 2jgu n GLU 556 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 2jgu h ILE 557 N 0.00 1.28 0.21 6.31 2.04 -1.68 0.37 117.51 126.04 2jgu h ILE 557 Ca 0.00 -1.92 0.00 0.00 1.00 0.00 0.00 64.86 63.94 2jgu h ILE 557 Cb 0.00 1.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.96 2jgu h ILE 557 CO 0.00 0.61 -0.21 0.11 0.00 0.00 0.00 178.15 178.66 2jgu h LYS 558 N 0.57 -0.44 0.00 2.37 1.57 -1.86 0.52 116.57 119.30 2jgu h LYS 558 Ca -0.04 0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 2jgu h LYS 558 Cb 1.35 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.76 2jgu h LYS 558 CO 0.15 -0.29 -0.28 1.57 -0.57 0.00 0.00 179.45 180.03 2jgu h LYS 559 N -0.45 0.00 -0.25 3.15 2.10 -1.79 0.37 116.57 119.69 2jgu h LYS 559 Ca -0.00 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.50 2jgu h LYS 559 Cb 0.42 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.75 2jgu h LYS 559 CO -0.05 0.28 -0.46 0.87 -2.00 0.00 0.00 179.45 178.09 2jgu h LYS 560 N 0.00 0.66 0.79 0.07 6.56 0.06 -1.02 116.57 123.70 2jgu h LYS 560 Ca -0.00 -0.37 -0.04 0.00 -1.06 0.00 0.00 60.65 59.18 2jgu h LYS 560 Cb 0.65 0.02 0.01 0.00 -0.57 0.00 0.00 32.23 32.34 2jgu h LYS 560 CO 0.04 0.98 -0.38 0.00 -2.06 0.00 0.00 179.45 178.03 2jgu h ALA 561 N 0.96 -1.28 -0.58 3.86 0.00 0.22 -0.00 119.26 122.43 2jgu h ALA 561 Ca 0.03 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.76 2jgu h ALA 561 Cb 1.00 0.41 -0.07 0.00 0.00 0.00 0.00 17.79 19.14 2jgu h ALA 561 CO 0.09 -1.20 -0.34 1.28 0.00 0.00 0.00 179.25 179.08 2jgu n LEU 562 N -4.88 -0.61 -0.32 0.00 4.77 0.01 -0.82 117.00 115.14 2jgu n LEU 562 Ca -0.13 1.45 -0.02 0.00 -0.03 0.00 0.00 56.01 57.28 2jgu n LEU 562 Cb 0.42 -0.34 0.04 0.00 -2.33 0.00 0.00 43.42 41.21 2jgu n LEU 562 CO 0.32 -1.05 0.61 -0.33 -1.33 0.00 0.00 177.39 175.61 2jgu h GLU 563 N 0.00 -0.05 -0.31 3.23 5.08 -0.86 -1.54 114.58 120.12 2jgu h GLU 563 Ca 0.09 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.52 2jgu h GLU 563 Cb 0.24 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2jgu h GLU 563 CO -0.54 -0.03 0.22 0.35 -1.00 0.00 0.00 179.01 178.00 2jgu h PHE 564 N -0.05 0.12 -0.52 4.33 3.57 0.10 -2.33 116.94 122.17 2jgu h PHE 564 Ca 0.32 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.72 2jgu h PHE 564 Cb 0.59 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.27 2jgu h PHE 564 CO -0.79 0.07 -0.11 0.28 -2.23 0.00 0.00 178.31 175.53 2jgu h VAL 565 N 0.12 1.27 0.00 1.41 2.07 -0.61 -0.39 116.25 120.12 2jgu h VAL 565 Ca 0.14 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.41 2jgu h VAL 565 Cb 0.42 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2jgu h VAL 565 CO -0.02 0.44 0.00 0.07 0.02 0.00 0.00 177.57 178.08 2jgu h LYS 566 N 0.86 0.00 0.46 1.57 2.10 -1.42 -2.24 116.57 117.89 2jgu h LYS 566 Ca 0.13 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.76 2jgu h LYS 566 Cb 0.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 2jgu h LYS 566 CO 0.05 0.00 -0.22 -0.92 -2.00 0.00 0.00 179.45 176.35 2jgu h TYR 567 N 0.00 -0.58 -0.41 0.07 3.20 -1.06 -3.34 116.97 114.84 2jgu h TYR 567 Ca 0.00 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.87 2jgu h TYR 567 Cb 0.79 0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.23 2jgu h TYR 567 CO 0.00 -0.32 0.27 0.97 -1.64 0.00 0.00 178.16 177.44 2jgu h ILE 568 N -1.13 1.09 -0.95 1.81 -0.00 -1.08 -3.00 117.51 114.25 2jgu h ILE 568 Ca -0.06 -0.19 0.24 0.00 -0.00 0.00 0.00 64.86 64.85 2jgu h ILE 568 Cb 0.52 0.50 -0.13 0.00 -0.00 0.00 0.00 36.82 37.71 2jgu h ILE 568 CO 0.10 0.10 0.48 0.78 -0.00 0.00 0.00 178.15 179.62 2jgu h ASN 569 N 0.54 0.47 0.30 2.19 -0.26 -1.56 2.35 115.58 119.61 2jgu h ASN 569 Ca 0.16 0.15 0.00 0.00 -0.56 0.00 0.00 56.30 56.05 2jgu h ASN 569 Cb -0.04 0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.32 2jgu h ASN 569 CO -0.05 0.02 0.00 -1.28 -1.06 0.00 0.00 177.43 175.06 2jgu h SER 570 N 0.46 0.00 0.07 5.81 0.87 -1.65 -1.01 113.55 118.10 2jgu h SER 570 Ca 0.61 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.17 2jgu h SER 570 Cb 1.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2jgu h SER 570 CO -0.52 0.00 -1.78 0.29 -0.53 0.00 0.00 176.83 174.29 2jgu n LYS 571 N -2.73 0.56 -2.79 2.24 4.76 0.78 -4.91 118.16 116.07 2jgu n LYS 571 Ca -0.01 -0.15 -0.40 0.00 -2.87 0.00 0.00 58.31 54.88 2jgu n LYS 571 Cb 0.13 -1.54 -0.06 0.00 -1.84 0.00 0.00 35.03 31.72 2jgu n LYS 571 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2jgu s LEU 572 N -4.35 4.62 0.57 -0.35 1.43 -0.25 -5.05 118.68 115.30 2jgu s LEU 572 Ca -0.05 1.88 -0.17 0.00 -1.03 0.00 0.00 54.13 54.76 2jgu s LEU 572 Cb 0.14 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.76 2jgu s LEU 572 CO 0.89 0.15 1.06 -2.16 0.23 0.00 0.00 176.35 176.52 2jgu s PRO 573 N -1.05 3.39 0.00 1.29 0.04 -1.26 -4.80 135.00 132.61 2jgu s PRO 573 Ca 0.41 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.73 2jgu s PRO 573 Cb -0.25 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.25 2jgu s PRO 573 CO 0.31 -0.76 0.00 0.41 0.04 0.00 0.00 177.00 176.99 2jgu n GLY 574 N -0.72 2.25 2.22 0.56 0.00 -1.26 -1.95 105.19 106.30 2jgu n GLY 574 Ca 0.09 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 2jgu n GLY 574 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2jgu n LEU 575 N 0.00 6.94 -4.79 0.99 -0.00 -1.26 -4.96 117.00 113.92 2jgu n LEU 575 Ca 0.00 -4.36 -0.38 0.00 -0.00 0.00 0.00 56.01 51.27 2jgu n LEU 575 Cb 0.00 -0.82 -0.06 0.00 -0.00 0.00 0.00 43.42 42.54 2jgu n LEU 575 CO 0.00 1.60 0.47 -0.76 -0.00 0.00 0.00 177.39 178.70 2jgu s LEU 576 N -3.74 4.52 -0.28 1.47 2.01 -0.82 -4.83 118.68 116.99 2jgu s LEU 576 Ca 0.61 1.60 -0.20 0.00 0.01 0.00 0.00 54.13 56.15 2jgu s LEU 576 Cb 0.48 -3.41 0.12 0.00 0.01 0.00 0.00 46.19 43.40 2jgu s LEU 576 CO 0.01 0.15 0.93 -0.70 1.01 0.00 0.00 176.35 177.74 2jgu s GLU 577 N -1.41 0.51 0.29 1.70 2.12 -1.26 -4.78 118.70 115.87 2jgu s GLU 577 Ca 0.38 0.76 -0.00 0.00 0.36 0.00 0.00 54.97 56.47 2jgu s GLU 577 Cb -0.21 0.17 -0.04 0.00 0.26 0.00 0.00 34.13 34.31 2jgu s GLU 577 CO 0.25 -0.09 0.50 -0.51 -0.54 0.00 0.00 175.26 174.86 2jgu s LEU 578 N 0.94 4.10 0.05 2.70 2.01 -1.26 0.18 118.68 127.41 2jgu s LEU 578 Ca -0.04 0.46 -0.10 0.00 0.01 0.00 0.00 54.13 54.45 2jgu s LEU 578 Cb -0.04 -3.28 0.01 0.00 0.01 0.00 0.00 46.19 42.88 2jgu s LEU 578 CO -0.12 -0.20 0.22 -0.70 1.01 0.00 0.00 176.35 176.56 2jgu s GLU 579 N -3.91 0.76 -0.70 1.70 2.12 0.25 -4.81 118.70 114.11 2jgu s GLU 579 Ca 0.40 -0.69 -0.25 0.00 0.36 0.00 0.00 54.97 54.78 2jgu s GLU 579 Cb -0.10 0.32 0.05 0.00 0.26 0.00 0.00 34.13 34.65 2jgu s GLU 579 CO 0.33 -0.23 1.15 -0.47 -0.54 0.00 0.00 175.26 175.50 2jgu s TYR 580 N -2.92 2.45 0.05 5.30 5.04 -1.26 -0.77 117.35 125.24 2jgu s TYR 580 Ca -0.02 -0.22 -0.12 0.00 -2.44 0.00 0.00 57.07 54.27 2jgu s TYR 580 Cb 0.01 -4.49 -0.33 0.00 0.35 0.00 0.00 41.96 37.50 2jgu s TYR 580 CO -0.06 -1.89 1.05 0.93 -1.34 0.00 0.00 175.55 174.25 2jgu h GLU 581 N 9.82 0.46 -1.46 4.97 4.39 -1.49 -3.48 114.58 127.79 2jgu h GLU 581 Ca -0.28 -0.77 0.32 0.00 0.34 0.00 0.00 59.36 58.96 2jgu h GLU 581 Cb 1.06 0.29 -0.12 0.00 -0.10 0.00 0.00 28.75 29.87 2jgu h GLU 581 CO 1.24 1.37 0.82 0.20 -1.16 0.00 0.00 179.01 181.48 2jgu s GLY 582 N -4.62 -0.41 -0.04 -3.84 0.00 -1.20 -5.00 107.32 92.22 2jgu s GLY 582 Ca -0.07 0.74 0.03 0.00 0.00 0.00 0.00 44.72 45.42 2jgu s GLY 582 CO 0.93 0.14 -0.13 -0.12 0.00 0.00 0.00 173.10 173.92 2jgu s PHE 583 N -2.44 1.35 -0.08 1.90 5.36 -1.26 -2.18 117.98 120.63 2jgu s PHE 583 Ca 0.14 -0.38 0.02 0.00 -0.96 0.00 0.00 56.93 55.74 2jgu s PHE 583 Cb 0.04 -0.94 0.01 0.00 -0.34 0.00 0.00 43.02 41.80 2jgu s PHE 583 CO -0.04 -0.15 -0.13 0.71 -1.46 0.00 0.00 175.22 174.15 2jgu s TYR 584 N 0.19 1.62 0.55 10.12 1.51 -0.66 -4.27 117.35 126.41 2jgu s TYR 584 Ca -0.05 -0.65 0.24 0.00 -1.01 0.00 0.00 57.07 55.60 2jgu s TYR 584 Cb -0.11 -1.18 1.48 0.00 -0.11 0.00 0.00 41.96 42.04 2jgu s TYR 584 CO 0.02 -0.34 2.11 -0.22 -1.11 0.00 0.00 175.55 176.01 2jgu h LYS 585 N 7.12 0.00 -2.77 -0.62 3.64 -0.96 -1.60 116.57 121.39 2jgu h LYS 585 Ca -0.30 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.18 2jgu h LYS 585 Cb 1.18 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.95 2jgu h LYS 585 CO 0.47 0.00 0.34 1.03 -2.27 0.00 0.00 179.45 179.02 2jgu s ARG 586 N -4.88 1.64 0.00 1.90 0.52 -1.22 -1.83 118.95 115.08 2jgu s ARG 586 Ca -0.05 -0.95 0.00 0.00 -0.52 0.00 0.00 55.73 54.22 2jgu s ARG 586 Cb 0.17 0.54 0.00 0.00 0.52 0.00 0.00 34.95 36.17 2jgu s ARG 586 CO 0.63 -0.76 0.00 0.41 0.02 0.00 0.00 175.30 175.61 2jgu n GLY 587 N -0.49 0.38 3.51 -3.53 0.00 -1.05 -2.27 105.19 101.74 2jgu n GLY 587 Ca -0.05 -1.10 -0.14 0.00 0.00 0.00 0.00 46.02 44.73 2jgu n GLY 587 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jgu s PHE 588 N -2.00 -0.52 -0.34 1.61 -0.12 -0.81 -0.68 117.98 115.11 2jgu s PHE 588 Ca 0.00 0.72 0.02 0.00 -0.05 0.00 0.00 56.93 57.62 2jgu s PHE 588 Cb 0.00 0.47 0.10 0.00 -0.63 0.00 0.00 43.02 42.96 2jgu s PHE 588 CO 0.00 -0.59 0.09 -0.06 -0.05 0.00 0.00 175.22 174.61 2jgu s PHE 589 N -1.98 2.85 0.07 3.49 0.40 -1.26 -1.22 117.98 120.33 2jgu s PHE 589 Ca -0.04 -2.50 -0.32 0.00 -0.60 0.00 0.00 56.93 53.47 2jgu s PHE 589 Cb -0.00 -2.40 -0.16 0.00 0.51 0.00 0.00 43.02 40.96 2jgu s PHE 589 CO 0.01 -0.90 1.49 0.28 0.70 0.00 0.00 175.22 176.79 2jgu h VAL 590 N 6.43 0.00 -0.78 -0.44 2.07 -1.72 -3.42 116.25 118.39 2jgu h VAL 590 Ca -0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.44 2jgu h VAL 590 Cb 1.01 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2jgu h VAL 590 CO 0.51 0.00 0.00 0.35 0.02 0.00 0.00 177.57 178.45 2jgu n THR 591 N -5.15 0.00 0.00 2.57 -2.24 -1.01 -4.82 114.28 103.63 2jgu n THR 591 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 2jgu n THR 591 Cb 0.43 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 2jgu n THR 591 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2jgu n LYS 592 N 0.00 0.00 -0.61 -0.78 4.76 -1.26 -2.49 118.16 117.78 2jgu n LYS 592 Ca 0.00 0.56 0.06 0.00 -2.87 0.00 0.00 58.31 56.07 2jgu n LYS 592 Cb 0.00 -0.88 0.19 0.00 -1.84 0.00 0.00 35.03 32.50 2jgu n LYS 592 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2jgu n LYS 593 N -2.26 1.45 -4.52 1.97 5.02 -1.26 -4.93 118.16 113.63 2jgu n LYS 593 Ca 0.00 -3.15 -0.33 0.00 -2.02 0.00 0.00 58.31 52.80 2jgu n LYS 593 Cb 0.00 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.36 2jgu n LYS 593 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2jgu s ARG 594 N -2.99 3.23 -0.05 1.97 0.52 -1.04 -3.56 118.95 117.04 2jgu s ARG 594 Ca 0.37 -0.74 -0.31 0.00 -0.52 0.00 0.00 55.73 54.53 2jgu s ARG 594 Cb 0.36 -2.64 0.12 0.00 0.52 0.00 0.00 34.95 33.31 2jgu s ARG 594 CO -0.07 0.02 1.18 1.52 0.02 0.00 0.00 175.30 177.98 2jgu s TYR 595 N 0.81 -0.11 0.11 -0.53 -0.85 -1.11 -1.86 117.35 113.80 2jgu s TYR 595 Ca -0.05 -0.01 -0.10 0.00 -0.52 0.00 0.00 57.07 56.39 2jgu s TYR 595 Cb -0.15 0.55 0.00 0.00 0.38 0.00 0.00 41.96 42.74 2jgu s TYR 595 CO 0.00 -0.35 0.24 0.00 -1.52 0.00 0.00 175.55 173.92 2jgu s ALA 596 N -2.60 -0.32 0.12 9.51 0.00 -0.36 -2.88 121.76 125.23 2jgu s ALA 596 Ca 0.12 -0.56 -0.26 0.00 0.00 0.00 0.00 51.96 51.26 2jgu s ALA 596 Cb 0.02 0.58 0.07 0.00 0.00 0.00 0.00 23.12 23.78 2jgu s ALA 596 CO -0.04 -0.55 0.91 0.14 0.00 0.00 0.00 175.76 176.22 2jgu s VAL 597 N -3.87 0.00 -0.02 0.00 -7.23 -0.63 -1.93 120.40 106.72 2jgu s VAL 597 Ca 0.06 -0.47 -0.02 0.00 -1.81 0.00 0.00 61.98 59.74 2jgu s VAL 597 Cb 0.04 -1.68 0.01 0.00 0.56 0.00 0.00 36.38 35.31 2jgu s VAL 597 CO -0.10 0.00 0.06 -0.51 -0.31 0.00 0.00 175.10 174.25 2jgu s ILE 598 N -3.29 -0.00 0.79 -0.62 2.07 -0.96 -2.20 121.20 116.98 2jgu s ILE 598 Ca 0.10 0.02 -0.05 0.00 -1.41 0.00 0.00 60.65 59.31 2jgu s ILE 598 Cb -0.01 -0.10 0.15 0.00 0.13 0.00 0.00 42.46 42.62 2jgu s ILE 598 CO -0.01 0.01 1.08 1.51 -1.91 0.00 0.00 174.94 175.62 2jgu s ASP 599 N 0.12 4.01 0.00 4.50 3.84 -0.20 -0.44 116.67 128.50 2jgu s ASP 599 Ca -0.01 -0.21 0.00 0.00 -0.00 0.00 0.00 52.55 52.34 2jgu s ASP 599 Cb -0.01 -0.07 0.00 0.00 -1.38 0.00 0.00 42.92 41.45 2jgu s ASP 599 CO -0.00 -2.10 0.89 -0.62 -0.00 0.00 0.00 175.17 173.34 2jgu n GLU 600 N -3.08 0.00 -1.35 2.11 1.02 -1.26 -2.12 120.64 115.95 2jgu n GLU 600 Ca 0.15 0.40 -0.09 0.00 -0.02 0.00 0.00 57.16 57.61 2jgu n GLU 600 Cb 0.60 -1.56 0.11 0.00 -0.02 0.00 0.00 31.44 30.58 2jgu n GLU 600 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2jgu n GLU 601 N -1.39 2.53 -0.86 3.49 2.13 -1.26 -4.98 120.64 120.30 2jgu n GLU 601 Ca 0.00 -3.70 0.00 0.00 0.66 0.00 0.00 57.16 54.12 2jgu n GLU 601 Cb 0.06 -1.90 0.00 0.00 0.27 0.00 0.00 31.44 29.87 2jgu n GLU 601 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jgu n GLY 602 N -0.87 0.58 3.77 8.31 0.00 -0.90 -5.02 105.19 111.05 2jgu n GLY 602 Ca 0.30 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.93 2jgu n GLY 602 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jgu s LYS 603 N -0.43 4.61 -0.17 1.61 2.20 -1.26 -4.82 119.74 121.48 2jgu s LYS 603 Ca 0.00 1.21 -0.01 0.00 -0.36 0.00 0.00 55.97 56.82 2jgu s LYS 603 Cb 0.00 -3.28 -0.01 0.00 -1.51 0.00 0.00 37.83 33.04 2jgu s LYS 603 CO 0.00 0.53 -0.12 0.08 -0.36 0.00 0.00 175.35 175.47 2jgu s VAL 604 N -1.02 2.89 -0.07 4.02 1.01 -1.26 -1.04 120.40 124.94 2jgu s VAL 604 Ca 0.37 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.68 2jgu s VAL 604 Cb -0.23 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 2jgu s VAL 604 CO 0.27 0.50 -0.09 -0.63 0.00 0.00 0.00 175.10 175.15 2jgu s ILE 605 N 0.88 3.56 -0.27 2.22 1.01 -0.93 -5.01 121.20 122.65 2jgu s ILE 605 Ca -0.03 -0.53 -0.24 0.00 0.00 0.00 0.00 60.65 59.84 2jgu s ILE 605 Cb -0.15 -2.44 0.08 0.00 0.01 0.00 0.00 42.46 39.96 2jgu s ILE 605 CO -0.00 0.60 0.79 0.28 0.00 0.00 0.00 174.94 176.60 2jgu s THR 606 N -0.77 0.00 0.28 2.92 -1.32 -1.26 -1.60 115.64 113.88 2jgu s THR 606 Ca 0.12 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.66 2jgu s THR 606 Cb -0.11 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.82 2jgu s THR 606 CO 0.01 0.00 -0.04 -0.60 -2.21 0.00 0.00 174.62 171.79 2jgu s ARG 607 N 0.43 1.53 0.00 7.08 3.52 -1.14 -4.83 118.95 125.54 2jgu s ARG 607 Ca 0.00 -1.78 0.00 0.00 -0.13 0.00 0.00 55.73 53.82 2jgu s ARG 607 Cb -0.05 -1.04 0.00 0.00 -1.56 0.00 0.00 34.95 32.30 2jgu s ARG 607 CO -0.02 -0.01 0.00 0.41 -0.81 0.00 0.00 175.30 174.87 2jgu n GLY 608 N -0.57 0.48 0.00 8.12 0.00 -1.23 -2.77 105.19 109.22 2jgu n GLY 608 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2jgu n GLY 608 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jgu n LEU 609 N 0.00 0.00 0.00 0.99 4.77 -1.26 -4.72 117.00 116.78 2jgu n LEU 609 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2jgu n LEU 609 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2jgu n LEU 609 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.44 2jgu n GLU 610 N 0.00 0.00 0.00 3.23 1.02 -1.26 -5.12 120.64 118.51 2jgu n GLU 610 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2jgu n GLU 610 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2jgu n GLU 610 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2jgu n SER 617 N 0.00 0.00 -1.23 1.62 7.64 -1.26 -5.10 113.62 115.29 2jgu n SER 617 Ca 0.00 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.99 2jgu n SER 617 Cb 0.00 0.00 0.27 0.00 -1.01 0.00 0.00 64.21 63.47 2jgu n SER 617 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2jgu n GLU 618 N 0.00 2.62 -0.02 1.43 2.13 -0.48 -1.67 120.64 124.64 2jgu n GLU 618 Ca 0.00 -2.47 -0.18 0.00 0.66 0.00 0.00 57.16 55.17 2jgu n GLU 618 Cb 0.00 -1.53 -0.14 0.00 0.27 0.00 0.00 31.44 30.05 2jgu n GLU 618 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 2jgu n ILE 619 N 1.52 1.69 0.04 6.31 3.06 -1.20 -3.02 119.36 127.77 2jgu n ILE 619 Ca 0.22 -0.68 -0.02 0.00 -2.50 0.00 0.00 62.75 59.77 2jgu n ILE 619 Cb 0.60 -1.52 -0.01 0.00 0.54 0.00 0.00 39.64 39.26 2jgu n ILE 619 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2jgu h ALA 620 N 0.26 -0.33 -0.69 1.51 0.00 -1.90 -1.32 119.26 116.79 2jgu h ALA 620 Ca -0.43 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.52 2jgu h ALA 620 Cb 2.02 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 19.78 2jgu h ALA 620 CO 0.06 -0.32 -0.37 1.17 0.00 0.00 0.00 179.25 179.79 2jgu n LYS 621 N -3.09 -0.26 -0.19 0.00 4.81 -0.67 0.30 118.16 119.05 2jgu n LYS 621 Ca -0.02 1.04 -0.02 0.00 -0.87 0.00 0.00 58.31 58.45 2jgu n LYS 621 Cb 0.06 -1.54 0.19 0.00 0.02 0.00 0.00 35.03 33.76 2jgu n LYS 621 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 2jgu h GLU 622 N 0.00 0.96 0.13 1.64 4.81 -1.64 -2.90 114.58 117.58 2jgu h GLU 622 Ca 0.14 -0.13 -0.29 0.00 -0.13 0.00 0.00 59.36 58.96 2jgu h GLU 622 Cb 0.32 -0.18 0.03 0.00 0.63 0.00 0.00 28.75 29.55 2jgu h GLU 622 CO -0.65 0.74 -1.20 1.15 -0.73 0.00 0.00 179.01 178.32 2jgu h THR 623 N 0.95 1.31 0.00 0.32 2.02 0.57 -2.82 112.91 115.26 2jgu h THR 623 Ca 0.23 -2.46 0.00 0.00 0.77 0.00 0.00 66.41 64.95 2jgu h THR 623 Cb 0.11 2.75 0.00 0.00 -1.74 0.00 0.00 68.15 69.28 2jgu h THR 623 CO -0.03 0.74 0.00 -0.61 0.37 0.00 0.00 175.52 175.99 2jgu h GLN 624 N 0.20 0.00 0.00 6.66 4.15 0.43 -1.27 115.11 125.27 2jgu h GLN 624 Ca -0.19 0.00 -0.28 0.00 0.77 0.00 0.00 58.65 58.96 2jgu h GLN 624 Cb 1.88 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 29.52 2jgu h GLN 624 CO 0.23 0.00 -1.70 0.00 -1.93 0.00 0.00 178.83 175.43 2jgu n ALA 625 N -2.07 1.55 -0.02 3.38 0.00 -1.10 -2.42 120.51 119.83 2jgu n ALA 625 Ca -0.03 -0.76 -0.14 0.00 0.00 0.00 0.00 53.44 52.51 2jgu n ALA 625 Cb 0.09 -0.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.67 2jgu n ALA 625 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jgu h ARG 626 N 0.00 0.71 0.34 0.00 3.08 -1.12 -0.28 114.38 117.10 2jgu h ARG 626 Ca -0.28 -0.53 -0.00 0.00 0.07 0.00 0.00 59.98 59.24 2jgu h ARG 626 Cb 1.97 0.10 -0.03 0.00 0.08 0.00 0.00 29.97 32.09 2jgu h ARG 626 CO 0.07 1.15 -0.44 0.28 -1.07 0.00 0.00 179.97 179.97 2jgu h VAL 627 N 0.50 0.13 -0.53 2.04 2.07 -1.35 -2.27 116.25 116.84 2jgu h VAL 627 Ca -0.03 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.60 2jgu h VAL 627 Cb 1.30 0.13 -0.09 0.00 -1.52 0.00 0.00 31.29 31.12 2jgu h VAL 627 CO 0.14 0.00 0.02 -0.07 0.02 0.00 0.00 177.57 177.68 2jgu h LEU 628 N -0.82 -0.20 -0.06 2.57 -0.00 -1.30 -2.26 115.31 113.24 2jgu h LEU 628 Ca -0.02 0.12 0.04 0.00 -0.00 0.00 0.00 57.88 58.02 2jgu h LEU 628 Cb 0.75 0.21 -0.05 0.00 -0.00 0.00 0.00 40.66 41.57 2jgu h LEU 628 CO -0.12 -0.07 -0.30 -0.33 -0.00 0.00 0.00 178.44 177.62 2jgu h GLU 629 N 0.13 -0.40 -0.64 1.13 5.08 -0.68 -0.06 114.58 119.14 2jgu h GLU 629 Ca 0.27 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.79 2jgu h GLU 629 Cb 0.41 0.09 -0.10 0.00 0.50 0.00 0.00 28.75 29.65 2jgu h GLU 629 CO -0.43 -0.27 0.09 1.15 -1.00 0.00 0.00 179.01 178.55 2jgu h THR 630 N -0.41 0.55 0.34 1.13 2.02 -0.85 0.40 112.91 116.08 2jgu h THR 630 Ca 0.08 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 2jgu h THR 630 Cb 0.53 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2jgu h THR 630 CO -0.30 0.04 -0.16 0.40 0.37 0.00 0.00 175.52 175.87 2jgu h ILE 631 N 0.21 0.00 0.09 3.11 1.08 -1.27 0.23 117.51 120.96 2jgu h ILE 631 Ca 0.35 -0.44 -0.00 0.00 -0.39 0.00 0.00 64.86 64.37 2jgu h ILE 631 Cb 0.56 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.31 2jgu h ILE 631 CO -0.48 0.00 -0.07 -0.07 -0.69 0.00 0.00 178.15 176.84 2jgu h LEU 632 N -0.90 -0.18 -0.49 1.44 3.38 -0.88 -0.10 115.31 117.58 2jgu h LEU 632 Ca -0.05 0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 2jgu h LEU 632 Cb 0.35 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2jgu h LEU 632 CO 0.08 -0.10 -0.46 0.50 0.09 0.00 0.00 178.44 178.55 2jgu h LYS 633 N -0.15 0.73 -0.22 1.13 3.64 -0.41 -3.32 116.57 117.97 2jgu h LYS 633 Ca -0.01 -0.41 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 2jgu h LYS 633 Cb 0.13 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2jgu h LYS 633 CO 0.00 1.03 0.00 0.72 -2.27 0.00 0.00 179.45 178.94 2jgu n HIS 634 N -4.02 0.40 -0.91 1.91 8.25 -0.75 -5.00 115.22 115.11 2jgu n HIS 634 Ca -0.03 -0.61 -0.05 0.00 -0.26 0.00 0.00 57.72 56.77 2jgu n HIS 634 Cb 0.57 -0.10 -0.02 0.00 1.12 0.00 0.00 29.99 31.56 2jgu n HIS 634 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jgu n GLY 635 N -0.10 0.51 3.24 -1.41 0.00 -0.05 -4.88 105.19 102.49 2jgu n GLY 635 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 2jgu n GLY 635 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jgu s ASP 636 N -1.52 5.61 0.22 1.61 -1.08 0.65 -4.89 116.67 117.27 2jgu s ASP 636 Ca 0.00 -1.66 -0.07 0.00 -0.52 0.00 0.00 52.55 50.30 2jgu s ASP 636 Cb 0.00 -1.97 0.17 0.00 -1.46 0.00 0.00 42.92 39.66 2jgu s ASP 636 CO 0.00 -0.57 1.80 0.58 0.52 0.00 0.00 175.17 177.49 2jgu h VAL 637 N 6.13 1.26 0.37 1.11 2.07 -1.92 -3.26 116.25 122.00 2jgu h VAL 637 Ca -0.21 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.50 2jgu h VAL 637 Cb 1.08 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 2jgu h VAL 637 CO 0.78 0.33 -0.18 -0.33 0.02 0.00 0.00 177.57 178.19 2jgu h GLU 638 N 1.19 -0.48 -0.78 1.57 5.08 -1.98 -2.67 114.58 116.52 2jgu h GLU 638 Ca 0.28 0.03 0.30 0.00 -1.00 0.00 0.00 59.36 58.97 2jgu h GLU 638 Cb 0.17 0.11 -0.11 0.00 0.50 0.00 0.00 28.75 29.42 2jgu h GLU 638 CO -0.03 -0.32 0.46 -1.91 -1.00 0.00 0.00 179.01 176.22 2jgu n GLU 639 N -3.40 -0.03 0.08 2.33 4.07 -1.25 0.27 120.64 122.72 2jgu n GLU 639 Ca -0.06 0.89 -0.21 0.00 -0.06 0.00 0.00 57.16 57.71 2jgu n GLU 639 Cb 0.19 -1.66 -0.12 0.00 -0.06 0.00 0.00 31.44 29.80 2jgu n GLU 639 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2jgu h ALA 640 N 1.22 0.04 -0.51 4.31 0.00 -1.58 0.25 119.26 122.99 2jgu h ALA 640 Ca 0.58 -0.76 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 2jgu h ALA 640 Cb 1.68 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.55 2jgu h ALA 640 CO -0.43 0.71 -0.16 0.28 0.00 0.00 0.00 179.25 179.65 2jgu h VAL 641 N 0.29 1.27 0.00 0.00 2.07 0.13 2.17 116.25 122.18 2jgu h VAL 641 Ca -0.17 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.03 2jgu h VAL 641 Cb 1.87 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 2jgu h VAL 641 CO 0.23 0.46 0.06 -1.14 0.02 0.00 0.00 177.57 177.20 2jgu n ARG 642 N -4.13 0.05 -0.02 1.57 0.00 0.78 0.68 116.66 115.59 2jgu n ARG 642 Ca 0.01 0.52 0.06 0.00 -0.00 0.00 0.00 57.85 58.44 2jgu n ARG 642 Cb 0.43 -1.72 -0.14 0.00 0.00 0.00 0.00 32.46 31.03 2jgu n ARG 642 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 2jgu n ILE 643 N -1.75 0.20 0.09 5.15 2.08 0.67 -3.82 119.36 121.98 2jgu n ILE 643 Ca -0.01 -0.47 -0.14 0.00 0.56 0.00 0.00 62.75 62.70 2jgu n ILE 643 Cb 0.07 -0.03 -0.09 0.00 -0.75 0.00 0.00 39.64 38.85 2jgu n ILE 643 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 2jgu h VAL 644 N 0.00 1.47 0.86 1.39 2.07 0.63 -3.34 116.25 119.33 2jgu h VAL 644 Ca -0.08 -2.79 -0.04 0.00 0.82 0.00 0.00 66.70 64.60 2jgu h VAL 644 Cb 1.04 2.69 0.01 0.00 -1.52 0.00 0.00 31.29 33.51 2jgu h VAL 644 CO 0.00 0.82 -0.41 0.11 0.02 0.00 0.00 177.57 178.11 2jgu h LYS 645 N 0.13 -1.12 -1.87 1.57 1.57 -0.55 -0.85 116.57 115.45 2jgu h LYS 645 Ca -0.10 0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2jgu h LYS 645 Cb 1.76 0.25 0.00 0.00 0.08 0.00 0.00 32.23 34.33 2jgu h LYS 645 CO 0.18 -0.74 0.00 -1.91 -0.57 0.00 0.00 179.45 176.41 2jgu n GLU 646 N -5.56 0.03 0.00 3.15 2.13 -1.25 -1.91 120.64 117.23 2jgu n GLU 646 Ca -0.15 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.67 2jgu n GLU 646 Cb 0.46 -1.46 0.00 0.00 0.27 0.00 0.00 31.44 30.71 2jgu n GLU 646 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2jgu n VAL 647 N 0.96 0.00 0.15 6.31 0.31 -1.03 -4.65 118.33 120.39 2jgu n VAL 647 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.43 2jgu n VAL 647 Cb 0.01 -0.36 0.55 0.00 -0.91 0.00 0.00 33.84 33.13 2jgu n VAL 647 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2jgu n ILE 648 N -2.34 1.11 -2.02 2.52 2.08 -0.35 -1.24 119.36 119.12 2jgu n ILE 648 Ca 0.00 0.72 -0.26 0.00 0.56 0.00 0.00 62.75 63.77 2jgu n ILE 648 Cb 0.00 -1.72 0.02 0.00 -0.75 0.00 0.00 39.64 37.19 2jgu n ILE 648 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2jgu n GLN 649 N -2.21 3.48 0.00 0.38 1.13 -0.85 -3.85 117.38 115.46 2jgu n GLN 649 Ca -0.01 -4.12 0.00 0.00 -1.94 0.00 0.00 57.00 50.93 2jgu n GLN 649 Cb 0.03 -2.28 0.00 0.00 0.11 0.00 0.00 30.24 28.11 2jgu n GLN 649 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 2jgu n LYS 650 N -0.69 0.00 -0.07 -1.09 4.81 -0.37 -4.47 118.16 116.28 2jgu n LYS 650 Ca 0.45 -0.10 -0.09 0.00 -0.87 0.00 0.00 58.31 57.71 2jgu n LYS 650 Cb 0.88 -0.28 -0.08 0.00 0.02 0.00 0.00 35.03 35.57 2jgu n LYS 650 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2jgu n LEU 651 N 0.00 1.71 -0.74 3.14 7.94 -1.15 -0.06 117.00 127.84 2jgu n LEU 651 Ca 0.00 -0.05 0.12 0.00 -1.11 0.00 0.00 56.01 54.97 2jgu n LEU 651 Cb 0.33 -0.18 0.10 0.00 0.53 0.00 0.00 43.42 44.21 2jgu n LEU 651 CO 0.00 0.56 0.54 0.00 -1.11 0.00 0.00 177.39 177.38 2jgu n ALA 652 N -2.73 2.88 -0.08 1.96 0.00 -1.25 -3.43 120.51 117.86 2jgu n ALA 652 Ca -0.24 -0.65 -0.08 0.00 0.00 0.00 0.00 53.44 52.47 2jgu n ALA 652 Cb 0.83 -0.84 -0.12 0.00 0.00 0.00 0.00 19.45 19.32 2jgu n ALA 652 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2jgu n ASN 653 N 0.71 1.29 -0.57 0.00 4.13 -1.26 -5.05 115.26 114.51 2jgu n ASN 653 Ca 0.13 -0.01 0.00 0.00 1.68 0.00 0.00 54.58 56.38 2jgu n ASN 653 Cb 0.53 0.78 0.00 0.00 -1.54 0.00 0.00 39.78 39.55 2jgu n ASN 653 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2jgu n TYR 654 N -2.62 0.00 -1.86 3.10 4.01 -0.85 -4.98 117.16 113.95 2jgu n TYR 654 Ca -0.26 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.29 2jgu n TYR 654 Cb 0.99 -1.14 0.07 0.00 -0.31 0.00 0.00 39.34 38.95 2jgu n TYR 654 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2jgu n GLU 655 N -0.57 3.10 -4.12 -0.72 4.71 0.91 -4.97 120.64 118.98 2jgu n GLU 655 Ca 0.00 -3.90 -0.29 0.00 -0.01 0.00 0.00 57.16 52.96 2jgu n GLU 655 Cb 0.41 -2.14 -0.17 0.00 -1.01 0.00 0.00 31.44 28.53 2jgu n GLU 655 CO 0.00 0.00 0.00 0.96 0.09 0.00 0.00 177.13 178.18 2jgu s ILE 656 N -4.31 1.41 0.01 -3.67 -0.00 -1.25 -5.03 121.20 108.35 2jgu s ILE 656 Ca 0.50 -0.55 -0.10 0.00 -0.00 0.00 0.00 60.65 60.50 2jgu s ILE 656 Cb 0.41 -1.33 -0.05 0.00 -0.00 0.00 0.00 42.46 41.49 2jgu s ILE 656 CO 0.02 0.43 0.26 -2.65 -0.00 0.00 0.00 174.94 172.99 2jgu n PRO 657 N 4.64 0.00 -0.04 0.37 -0.02 -1.26 -4.64 135.00 134.05 2jgu n PRO 657 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 2jgu n PRO 657 Cb 0.50 -0.37 0.00 0.00 -0.02 0.00 0.00 33.50 33.61 2jgu n PRO 657 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2jgu n PRO 658 N 0.37 0.82 -0.07 0.52 -0.02 -1.26 -3.27 135.00 132.10 2jgu n PRO 658 Ca 0.05 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.46 2jgu n PRO 658 Cb 0.03 -1.09 -0.10 0.00 -0.02 0.00 0.00 33.50 32.32 2jgu n PRO 658 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2jgu n GLU 659 N 0.67 1.74 -0.53 -0.52 1.02 -1.26 -4.61 120.64 117.15 2jgu n GLU 659 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.12 2jgu n GLU 659 Cb 0.41 -1.33 0.17 0.00 -0.02 0.00 0.00 31.44 30.67 2jgu n GLU 659 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2jgu n LYS 660 N -2.53 2.53 -0.06 3.49 5.02 -1.20 -4.48 118.16 120.93 2jgu n LYS 660 Ca -0.22 -1.62 -0.03 0.00 -2.02 0.00 0.00 58.31 54.42 2jgu n LYS 660 Cb 0.92 -1.80 -0.14 0.00 -0.02 0.00 0.00 35.03 33.99 2jgu n LYS 660 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2jgu n LEU 661 N 0.07 0.00 0.00 -0.35 4.77 -1.26 -1.38 117.00 118.85 2jgu n LEU 661 Ca 0.21 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 2jgu n LEU 661 Cb 0.88 0.30 0.00 0.00 -2.33 0.00 0.00 43.42 42.27 2jgu n LEU 661 CO 0.23 0.30 0.00 0.00 -1.33 0.00 0.00 177.39 176.59 2jgu n ALA 662 N -2.49 0.00 0.00 -1.18 0.00 -1.26 -4.70 120.51 110.88 2jgu n ALA 662 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2jgu n ALA 662 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.34 2jgu n ALA 662 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jgu n PRO 679 N 0.00 0.00 -2.94 0.00 -0.04 -1.26 -4.64 135.00 126.12 2jgu n PRO 679 Ca 0.00 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.19 2jgu n PRO 679 Cb 0.00 -0.09 -0.01 0.00 -0.04 0.00 0.00 33.50 33.36 2jgu n PRO 679 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 2jgu s HIS 680 N -2.70 3.52 0.00 0.54 -3.43 -1.26 -4.17 115.29 107.79 2jgu s HIS 680 Ca 0.00 0.71 0.00 0.00 -0.80 0.00 0.00 55.06 54.97 2jgu s HIS 680 Cb 0.00 -2.20 0.00 0.00 -1.43 0.00 0.00 32.58 28.95 2jgu s HIS 680 CO 0.00 -0.10 0.00 0.28 -2.00 0.00 0.00 174.74 172.92 2jgu n VAL 681 N -1.82 0.00 -0.34 -5.38 0.31 -1.26 -4.44 118.33 105.40 2jgu n VAL 681 Ca -0.01 0.00 0.24 0.00 -0.01 0.00 0.00 64.34 64.56 2jgu n VAL 681 Cb 0.55 0.00 0.47 0.00 -0.91 0.00 0.00 33.84 33.95 2jgu n VAL 681 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jgu h ALA 682 N 0.00 1.98 -0.99 3.52 0.00 -2.03 -0.40 119.26 121.33 2jgu h ALA 682 Ca 0.00 0.18 -0.64 0.00 0.00 0.00 0.00 54.91 54.44 2jgu h ALA 682 Cb 0.00 0.14 -0.35 0.00 0.00 0.00 0.00 17.79 17.58 2jgu h ALA 682 CO 0.00 -0.57 0.16 0.28 0.00 0.00 0.00 179.25 179.12 2jgu n VAL 683 N -5.01 3.12 -3.39 0.00 0.31 -1.26 -3.83 118.33 108.26 2jgu n VAL 683 Ca 0.31 -3.84 -0.34 0.00 -0.01 0.00 0.00 64.34 60.47 2jgu n VAL 683 Cb 0.98 -1.18 -0.05 0.00 -0.91 0.00 0.00 33.84 32.67 2jgu n VAL 683 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jgu n ALA 684 N -0.73 4.27 -0.37 3.52 0.00 -0.16 -4.04 120.51 123.00 2jgu n ALA 684 Ca 0.52 -4.72 0.00 0.00 0.00 0.00 0.00 53.44 49.24 2jgu n ALA 684 Cb 0.68 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 18.60 2jgu n ALA 684 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2jgu n LYS 685 N 1.45 0.23 0.00 0.00 3.00 -1.25 -4.89 118.16 116.70 2jgu n LYS 685 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.57 2jgu n LYS 685 Cb 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 35.03 35.38 2jgu n LYS 685 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2jgu n LYS 686 N 0.00 3.58 0.16 1.64 5.02 -1.26 -4.78 118.16 122.52 2jgu n LYS 686 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 2jgu n LYS 686 Cb 0.00 -0.39 0.53 0.00 -0.02 0.00 0.00 35.03 35.15 2jgu n LYS 686 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2jgu h LEU 687 N 0.00 0.00 0.00 -0.35 5.85 -1.91 -2.97 115.31 115.94 2jgu h LEU 687 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2jgu h LEU 687 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2jgu h LEU 687 CO 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 2jgu n ALA 688 N -1.83 1.12 -0.06 1.25 0.00 -1.26 -2.03 120.51 117.70 2jgu n ALA 688 Ca 0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.43 2jgu n ALA 688 Cb 0.24 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.67 2jgu n ALA 688 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jgu h ALA 689 N 2.02 0.00 0.00 0.00 0.00 -1.91 -3.40 119.26 115.97 2jgu h ALA 689 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2jgu h ALA 689 Cb 0.01 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2jgu h ALA 689 CO 0.00 0.33 0.00 1.63 0.00 0.00 0.00 179.25 181.21 2jgu n LYS 690 N -4.56 0.00 -1.84 0.00 5.02 -0.86 -4.53 118.16 111.38 2jgu n LYS 690 Ca -0.05 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.08 2jgu n LYS 690 Cb 0.17 -1.20 -0.05 0.00 -0.02 0.00 0.00 35.03 33.94 2jgu n LYS 690 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jgu n GLY 691 N 1.02 0.76 1.83 0.72 0.00 -1.26 -4.77 105.19 103.49 2jgu n GLY 691 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2jgu n GLY 691 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2jgu n VAL 692 N -2.71 2.60 -0.87 1.61 0.31 -1.24 -4.87 118.33 113.16 2jgu n VAL 692 Ca -0.18 -1.28 -0.07 0.00 -0.01 0.00 0.00 64.34 62.81 2jgu n VAL 692 Cb 0.58 -1.65 -0.02 0.00 -0.91 0.00 0.00 33.84 31.84 2jgu n VAL 692 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2jgu n LYS 693 N 1.59 0.00 -2.63 5.55 5.02 -1.26 -4.74 118.16 121.69 2jgu n LYS 693 Ca 0.24 -0.16 -0.39 0.00 -2.02 0.00 0.00 58.31 55.98 2jgu n LYS 693 Cb 0.66 -1.24 -0.05 0.00 -0.02 0.00 0.00 35.03 34.37 2jgu n LYS 693 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 2jgu s ILE 694 N 3.48 3.85 0.01 -0.18 -1.16 -1.26 -5.06 121.20 120.89 2jgu s ILE 694 Ca 0.10 1.71 -0.11 0.00 -0.51 0.00 0.00 60.65 61.85 2jgu s ILE 694 Cb 0.02 -4.03 0.01 0.00 0.61 0.00 0.00 42.46 39.07 2jgu s ILE 694 CO 0.05 0.30 0.23 -0.54 -2.81 0.00 0.00 174.94 172.17 2jgu s LYS 695 N -1.67 0.64 0.00 3.50 1.02 -1.26 -5.05 119.74 116.93 2jgu s LYS 695 Ca 0.47 -0.42 0.00 0.00 0.02 0.00 0.00 55.97 56.03 2jgu s LYS 695 Cb -0.26 0.27 0.00 0.00 -0.52 0.00 0.00 37.83 37.33 2jgu s LYS 695 CO 0.32 -0.18 0.68 -2.30 -0.92 0.00 0.00 175.35 172.95 2jgu n PRO 696 N 1.05 0.00 0.00 -1.68 -0.02 -1.26 -3.31 135.00 129.78 2jgu n PRO 696 Ca -0.21 -0.32 0.00 0.00 -2.02 0.00 0.00 63.50 60.95 2jgu n PRO 696 Cb 0.57 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 2jgu n PRO 696 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgu n GLY 697 N 3.46 0.00 2.99 -1.23 0.00 -1.26 -5.17 105.19 103.98 2jgu n GLY 697 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2jgu n GLY 697 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jgu s MET 698 N 0.00 0.87 0.36 1.61 -1.94 -1.21 -4.82 119.30 114.17 2jgu s MET 698 Ca 0.00 -0.27 -0.28 0.00 -1.71 0.00 0.00 55.69 53.42 2jgu s MET 698 Cb 0.00 -0.83 -0.11 0.00 2.01 0.00 0.00 34.83 35.90 2jgu s MET 698 CO 0.00 0.10 1.46 1.55 -0.01 0.00 0.00 175.02 178.12 2jgu n VAL 699 N 3.30 1.88 -3.44 -6.03 3.14 -1.26 -4.98 118.33 110.94 2jgu n VAL 699 Ca -0.18 -0.47 0.00 0.00 -2.96 0.00 0.00 64.34 60.73 2jgu n VAL 699 Cb 0.54 -1.89 -0.03 0.00 -1.06 0.00 0.00 33.84 31.40 2jgu n VAL 699 CO 0.00 0.00 0.00 0.27 -6.46 0.00 0.00 176.83 170.64 2jgu s ILE 700 N -0.98 -0.96 -0.31 1.55 -5.25 -1.26 -5.04 121.20 108.95 2jgu s ILE 700 Ca 0.55 0.01 0.06 0.00 -0.99 0.00 0.00 60.65 60.28 2jgu s ILE 700 Cb -0.50 -0.97 0.46 0.00 2.95 0.00 0.00 42.46 44.40 2jgu s ILE 700 CO 0.62 -0.00 1.24 0.61 -1.79 0.00 0.00 174.94 175.61 2jgu n GLY 701 N 5.43 6.38 3.65 6.27 0.00 -1.26 -5.08 105.19 120.57 2jgu n GLY 701 Ca -0.07 -2.65 -0.41 0.00 0.00 0.00 0.00 46.02 42.88 2jgu n GLY 701 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2jgu n TYR 702 N -0.72 1.59 -2.32 1.61 -0.00 -1.26 -5.01 117.16 111.05 2jgu n TYR 702 Ca 0.45 0.55 -0.28 0.00 -0.00 0.00 0.00 57.90 58.61 2jgu n TYR 702 Cb 0.95 -2.29 0.02 0.00 -0.00 0.00 0.00 39.34 38.01 2jgu n TYR 702 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.86 175.36 2jgu s ILE 703 N -1.22 4.37 0.11 -3.48 2.07 -1.26 -4.71 121.20 117.07 2jgu s ILE 703 Ca 0.62 0.32 -0.03 0.00 -1.41 0.00 0.00 60.65 60.15 2jgu s ILE 703 Cb -0.55 -3.71 0.01 0.00 0.13 0.00 0.00 42.46 38.34 2jgu s ILE 703 CO 0.58 -0.79 0.19 0.52 -1.91 0.00 0.00 174.94 173.53 2jgu n VAL 704 N -2.54 0.00 -0.93 4.00 0.31 -1.26 -4.97 118.33 112.94 2jgu n VAL 704 Ca 0.04 -0.39 0.12 0.00 -0.01 0.00 0.00 64.34 64.09 2jgu n VAL 704 Cb 0.56 0.30 -0.05 0.00 -0.91 0.00 0.00 33.84 33.75 2jgu n VAL 704 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2jgu n ASP 729 N -1.51 -5.54 0.00 4.52 2.03 -1.26 -4.77 116.55 110.02 2jgu n ASP 729 Ca -0.01 0.70 0.00 0.00 0.52 0.00 0.00 54.79 55.99 2jgu n ASP 729 Cb 0.17 -3.03 0.00 0.00 -0.72 0.00 0.00 41.12 37.54 2jgu n ASP 729 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jgu n ALA 730 N -3.09 2.51 0.00 -1.67 0.00 -1.26 -4.56 120.51 112.44 2jgu n ALA 730 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2jgu n ALA 730 Cb 0.43 0.50 0.00 0.00 0.00 0.00 0.00 19.45 20.38 2jgu n ALA 730 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2jgu n GLU 731 N -2.75 0.00 0.00 0.00 4.07 -1.26 -2.51 120.64 118.20 2jgu n GLU 731 Ca 0.00 0.32 0.00 0.00 -0.06 0.00 0.00 57.16 57.42 2jgu n GLU 731 Cb 0.50 -1.54 0.00 0.00 -0.06 0.00 0.00 31.44 30.34 2jgu n GLU 731 CO 0.00 0.00 0.00 0.98 -0.06 0.00 0.00 177.13 178.05 2jgu n TYR 732 N -1.31 0.00 0.00 4.31 9.36 -1.26 -2.24 117.16 126.02 2jgu n TYR 732 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2jgu n TYR 732 Cb 0.04 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.75 2jgu n TYR 732 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2jgu n TYR 733 N 0.00 0.00 -0.07 2.98 4.02 -1.20 0.65 117.16 123.54 2jgu n TYR 733 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.77 2jgu n TYR 733 Cb 0.00 -0.37 -0.05 0.00 -0.02 0.00 0.00 39.34 38.90 2jgu n TYR 733 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 2jgu h ILE 734 N 0.00 1.28 0.00 -0.72 2.04 -1.72 0.69 117.51 119.07 2jgu h ILE 734 Ca 0.00 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.86 2jgu h ILE 734 Cb 0.00 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 2jgu h ILE 734 CO 0.00 0.31 0.00 -0.62 0.00 0.00 0.00 178.15 177.84 2jgu n GLU 735 N -4.62 0.00 0.16 2.37 -0.58 2.93 -0.90 120.64 120.01 2jgu n GLU 735 Ca -0.04 0.21 0.17 0.00 -0.42 0.00 0.00 57.16 57.07 2jgu n GLU 735 Cb 0.27 -0.67 0.77 0.00 -0.57 0.00 0.00 31.44 31.24 2jgu n GLU 735 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 2jgu h ASN 736 N 0.00 0.00 0.00 1.62 -0.00 -1.26 -3.36 115.58 112.59 2jgu h ASN 736 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 2jgu h ASN 736 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.32 2jgu h ASN 736 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 177.43 179.10 2jgu n GLN 737 N -4.04 0.00 0.00 6.67 -0.06 -1.14 -4.71 117.38 114.11 2jgu n GLN 737 Ca 0.03 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.03 2jgu n GLN 737 Cb 0.37 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.55 2jgu n GLN 737 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 2jgu n VAL 738 N 0.00 0.00 0.36 1.69 0.31 0.24 -2.22 118.33 118.71 2jgu n VAL 738 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.19 2jgu n VAL 738 Cb 0.00 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 32.86 2jgu n VAL 738 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2jgu h LEU 739 N 0.00 -0.79 -1.96 7.52 3.38 -1.19 -2.93 115.31 119.33 2jgu h LEU 739 Ca 0.00 0.03 0.30 0.00 0.09 0.00 0.00 57.88 58.30 2jgu h LEU 739 Cb 0.00 0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 2jgu h LEU 739 CO 0.00 -0.53 0.76 -0.65 0.09 0.00 0.00 178.44 178.10 2jgu h PRO 740 N -0.99 0.02 0.00 1.13 0.11 -1.59 1.15 132.00 131.83 2jgu h PRO 740 Ca -0.10 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2jgu h PRO 740 Cb 0.71 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.82 2jgu h PRO 740 CO 0.16 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 177.96 2jgu n ALA 741 N -2.73 2.22 0.08 -0.75 0.00 -1.12 -2.58 120.51 115.62 2jgu n ALA 741 Ca 0.23 -0.02 0.01 0.00 0.00 0.00 0.00 53.44 53.65 2jgu n ALA 741 Cb 1.11 -1.46 -0.01 0.00 0.00 0.00 0.00 19.45 19.09 2jgu n ALA 741 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2jgu n VAL 742 N -2.16 0.00 0.10 0.00 0.31 -0.68 -4.63 118.33 111.27 2jgu n VAL 742 Ca 0.05 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 2jgu n VAL 742 Cb 0.40 0.91 -0.02 0.00 -0.91 0.00 0.00 33.84 34.22 2jgu n VAL 742 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2jgu h LEU 743 N 0.00 0.00 0.23 7.52 7.12 0.16 -3.15 115.31 127.19 2jgu h LEU 743 Ca 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.00 2jgu h LEU 743 Cb 0.05 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.19 2jgu h LEU 743 CO 0.00 0.60 -0.11 0.03 -0.13 0.00 0.00 178.44 178.83 2jgu h ARG 744 N 0.00 -0.30 -0.48 1.25 3.08 -1.76 -2.84 114.38 113.32 2jgu h ARG 744 Ca -0.04 0.02 0.11 0.00 0.07 0.00 0.00 59.98 60.14 2jgu h ARG 744 Cb 1.49 0.07 -0.09 0.00 0.08 0.00 0.00 29.97 31.52 2jgu h ARG 744 CO 0.07 -0.20 -0.08 -0.89 -1.07 0.00 0.00 179.97 177.80 2jgu n ILE 745 N -3.40 -0.20 0.18 2.04 5.41 -1.26 -0.73 119.36 121.40 2jgu n ILE 745 Ca -0.04 1.09 0.06 0.00 1.00 0.00 0.00 62.75 64.87 2jgu n ILE 745 Cb 0.12 -1.54 0.21 0.00 -0.71 0.00 0.00 39.64 37.73 2jgu n ILE 745 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2jgu h LEU 746 N 0.00 0.00 -0.81 1.39 3.38 -1.55 -3.12 115.31 114.60 2jgu h LEU 746 Ca 0.25 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.37 2jgu h LEU 746 Cb 0.43 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.03 2jgu h LEU 746 CO -0.48 0.34 -0.27 -0.33 0.09 0.00 0.00 178.44 177.78 2jgu h GLU 747 N 0.00 -0.04 0.00 1.13 5.08 -0.67 0.60 114.58 120.68 2jgu h GLU 747 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2jgu h GLU 747 Cb 1.09 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2jgu h GLU 747 CO 0.04 -0.02 0.44 0.41 -1.00 0.00 0.00 179.01 178.88 2jgu n GLY 748 N -1.51 -0.18 0.10 -3.84 0.00 -1.18 0.36 105.19 98.95 2jgu n GLY 748 Ca 0.10 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.13 2jgu n GLY 748 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jgu n PHE 749 N -1.23 0.00 0.00 1.61 3.01 0.21 -3.82 117.46 117.24 2jgu n PHE 749 Ca 0.00 -0.20 0.00 0.00 1.01 0.00 0.00 57.45 58.26 2jgu n PHE 749 Cb 0.44 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.87 2jgu n PHE 749 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jgu n GLY 750 N -0.24 2.66 3.12 1.37 0.00 1.14 -5.01 105.19 108.23 2jgu n GLY 750 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 2jgu n GLY 750 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2jgu n TYR 751 N -0.82 -1.88 -3.71 1.61 4.02 -1.25 -4.91 117.16 110.22 2jgu n TYR 751 Ca 0.00 0.37 -0.14 0.00 -0.01 0.00 0.00 57.90 58.12 2jgu n TYR 751 Cb 0.00 -1.48 -0.08 0.00 -0.02 0.00 0.00 39.34 37.76 2jgu n TYR 751 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 2jgu s ARG 752 N -2.60 0.76 0.12 -0.72 3.00 -1.26 -4.56 118.95 113.69 2jgu s ARG 752 Ca 0.45 -0.14 0.06 0.00 -1.00 0.00 0.00 55.73 55.09 2jgu s ARG 752 Cb -0.03 0.34 0.41 0.00 0.00 0.00 0.00 34.95 35.68 2jgu s ARG 752 CO 0.68 -0.22 0.54 0.36 0.00 0.00 0.00 175.30 176.66 2jgu n LYS 753 N 1.12 -0.02 0.00 5.12 2.85 -1.26 -3.81 118.16 122.16 2jgu n LYS 753 Ca -0.21 0.48 0.00 0.00 -1.05 0.00 0.00 58.31 57.54 2jgu n LYS 753 Cb 0.57 -0.84 0.00 0.00 -0.65 0.00 0.00 35.03 34.10 2jgu n LYS 753 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2jgu n GLU 754 N -3.91 0.00 0.00 -1.58 -0.58 -1.26 -2.23 120.64 111.09 2jgu n GLU 754 Ca 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.86 2jgu n GLU 754 Cb 0.40 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.27 2jgu n GLU 754 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2jgu n ASP 755 N 0.00 0.00 -0.05 1.62 5.75 -1.26 0.37 116.55 122.98 2jgu n ASP 755 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 54.79 54.82 2jgu n ASP 755 Cb 0.00 0.00 0.08 0.00 -1.03 0.00 0.00 41.12 40.17 2jgu n ASP 755 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2jgu n LEU 756 N -2.13 0.03 0.00 -2.12 4.77 -1.23 0.18 117.00 116.50 2jgu n LEU 756 Ca 0.00 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 2jgu n LEU 756 Cb 0.00 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2jgu n LEU 756 CO 0.00 -0.29 0.07 0.54 -1.33 0.00 0.00 177.39 176.38 2jgu n ARG 757 N -3.59 0.00 0.00 3.23 1.74 1.18 -4.53 116.66 114.68 2jgu n ARG 757 Ca 0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.13 2jgu n ARG 757 Cb 0.18 -0.56 0.00 0.00 -1.02 0.00 0.00 32.46 31.06 2jgu n ARG 757 CO 0.00 0.00 0.00 2.48 -1.52 0.00 0.00 177.63 178.59