#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3giq s LYS 6 N 0.00 4.37 0.38 3.49 2.20 -1.26 -4.98 119.74 123.94 3giq s LYS 6 Ca 0.00 2.17 -0.23 0.00 -0.36 0.00 0.00 55.97 57.54 3giq s LYS 6 Cb 0.00 -3.11 -0.10 0.00 -1.51 0.00 0.00 37.83 33.11 3giq s LYS 6 CO 0.00 -0.21 0.95 -0.51 -0.36 0.00 0.00 175.35 175.22 3giq s LEU 7 N -1.18 4.12 0.15 5.43 1.02 -0.83 -4.94 118.68 122.46 3giq s LEU 7 Ca 0.52 1.78 0.08 0.00 0.02 0.00 0.00 54.13 56.52 3giq s LEU 7 Cb -0.39 -4.29 -0.08 0.00 0.02 0.00 0.00 46.19 41.45 3giq s LEU 7 CO 0.47 -0.25 1.35 0.44 0.02 0.00 0.00 176.35 178.39 3giq h ASP 8 N 2.49 0.01 -4.90 2.29 3.32 -1.08 -0.14 116.42 118.41 3giq h ASP 8 Ca -0.48 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 56.47 3giq h ASP 8 Cb 1.19 -0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.54 3giq h ASP 8 CO 0.63 0.92 -0.09 0.12 -1.72 0.00 0.00 179.24 179.10 3giq s PHE 9 N -2.91 -0.39 -0.09 4.55 5.36 -0.99 -2.02 117.98 121.48 3giq s PHE 9 Ca 0.00 0.69 -0.07 0.00 -0.96 0.00 0.00 56.93 56.59 3giq s PHE 9 Cb 0.11 0.22 0.03 0.00 -0.34 0.00 0.00 43.02 43.04 3giq s PHE 9 CO 0.81 -0.46 0.23 -1.59 -1.46 0.00 0.00 175.22 172.75 3giq s LYS 10 N -1.14 0.25 -0.27 10.12 -2.85 -0.50 0.02 119.74 125.38 3giq s LYS 10 Ca -0.11 0.36 0.03 0.00 -1.00 0.00 0.00 55.97 55.24 3giq s LYS 10 Cb -0.03 0.08 0.07 0.00 -2.06 0.00 0.00 37.83 35.89 3giq s LYS 10 CO 0.06 -0.06 -0.07 0.42 0.10 0.00 0.00 175.35 175.81 3giq s ILE 11 N 0.33 2.08 0.28 3.79 1.01 0.20 -0.87 121.20 128.02 3giq s ILE 11 Ca -0.02 -1.72 0.09 0.00 0.00 0.00 0.00 60.65 59.01 3giq s ILE 11 Cb -0.03 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 3giq s ILE 11 CO -0.01 -0.16 0.03 0.42 0.00 0.00 0.00 174.94 175.21 3giq s THR 12 N 1.11 3.38 0.00 2.92 -4.23 -0.56 -1.31 115.64 116.95 3giq s THR 12 Ca -0.04 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 3giq s THR 12 Cb -0.20 -2.89 0.00 0.00 1.34 0.00 0.00 72.50 70.76 3giq s THR 12 CO -0.06 -0.33 0.00 0.61 -0.54 0.00 0.00 174.62 174.30 3giq n GLY 13 N -0.95 1.71 3.17 3.99 0.00 -1.26 0.45 105.19 112.29 3giq n GLY 13 Ca -0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 3giq n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3giq n GLY 14 N -2.00 1.79 3.52 -0.02 0.00 -1.19 -3.73 105.19 103.55 3giq n GLY 14 Ca 0.00 -2.18 -0.35 0.00 0.00 0.00 0.00 46.02 43.49 3giq n GLY 14 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3giq s TRP 15 N -1.99 3.10 -0.08 1.61 0.52 -0.38 -2.86 118.94 118.85 3giq s TRP 15 Ca 0.50 -0.25 -0.20 0.00 0.02 0.00 0.00 56.10 56.17 3giq s TRP 15 Cb -0.04 -2.07 -0.04 0.00 -1.15 0.00 0.00 33.47 30.17 3giq s TRP 15 CO 0.32 -0.09 0.57 0.42 0.02 0.00 0.00 176.95 178.19 3giq s ILE 16 N 0.74 5.10 -0.39 2.03 1.01 0.31 -0.20 121.20 129.81 3giq s ILE 16 Ca 0.01 1.16 0.03 0.00 0.00 0.00 0.00 60.65 61.86 3giq s ILE 16 Cb -0.14 -3.91 0.11 0.00 0.01 0.00 0.00 42.46 38.53 3giq s ILE 16 CO 0.02 0.31 0.13 -0.63 0.00 0.00 0.00 174.94 174.77 3giq s ILE 17 N 0.56 2.09 -2.00 2.92 1.01 -0.40 -1.95 121.20 123.43 3giq s ILE 17 Ca 0.31 -2.49 0.21 0.00 0.00 0.00 0.00 60.65 58.68 3giq s ILE 17 Cb -0.16 -2.52 0.61 0.00 0.01 0.00 0.00 42.46 40.40 3giq s ILE 17 CO 0.14 -0.69 1.72 -0.90 0.00 0.00 0.00 174.94 175.22 3giq n ASP 18 N 3.98 0.00 0.00 3.58 5.68 -1.26 -4.03 116.55 124.50 3giq n ASP 18 Ca 0.04 -0.99 0.00 0.00 -0.50 0.00 0.00 54.79 53.34 3giq n ASP 18 Cb 0.39 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.37 3giq n ASP 18 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3giq n GLY 19 N 0.59 1.30 0.08 6.12 0.00 -1.26 -1.84 105.19 110.18 3giq n GLY 19 Ca 0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 3giq n GLY 19 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3giq n THR 20 N -2.00 0.44 -0.06 2.61 -2.24 -1.26 -4.34 114.28 107.43 3giq n THR 20 Ca 0.00 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3giq n THR 20 Cb 0.00 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 67.72 3giq n THR 20 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3giq n GLY 21 N 1.36 0.49 3.77 3.38 0.00 -1.26 -5.06 105.19 107.86 3giq n GLY 21 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 3giq n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giq s ALA 22 N -2.20 2.69 0.46 4.61 0.00 -1.26 -4.75 121.76 121.30 3giq s ALA 22 Ca 0.00 0.88 -0.24 0.00 0.00 0.00 0.00 51.96 52.59 3giq s ALA 22 Cb 0.00 -3.38 -0.08 0.00 0.00 0.00 0.00 23.12 19.65 3giq s ALA 22 CO 0.00 -0.85 1.30 -0.35 0.00 0.00 0.00 175.76 175.87 3giq n PRO 23 N -1.30 1.91 -1.64 0.00 -0.04 -1.26 -4.80 135.00 127.87 3giq n PRO 23 Ca 0.12 0.68 -0.40 0.00 -0.04 0.00 0.00 63.50 63.87 3giq n PRO 23 Cb 0.50 -2.45 0.03 0.00 -0.04 0.00 0.00 33.50 31.54 3giq n PRO 23 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 3giq n ARG 24 N -0.22 1.28 -3.89 0.54 1.85 -1.26 -4.96 116.66 109.99 3giq n ARG 24 Ca 0.07 0.47 -0.11 0.00 -1.00 0.00 0.00 57.85 57.28 3giq n ARG 24 Cb 0.41 -2.19 -0.13 0.00 -1.05 0.00 0.00 32.46 29.50 3giq n ARG 24 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 177.63 176.64 3giq s ARG 25 N -2.41 0.09 -0.23 2.89 1.70 -0.82 -4.93 118.95 115.23 3giq s ARG 25 Ca 0.69 -0.14 -0.29 0.00 -0.47 0.00 0.00 55.73 55.52 3giq s ARG 25 Cb -0.48 0.03 -0.02 0.00 -0.57 0.00 0.00 34.95 33.91 3giq s ARG 25 CO 0.52 -0.01 1.54 0.50 -1.08 0.00 0.00 175.30 176.77 3giq s ARG 26 N -0.36 3.85 -0.03 3.89 6.06 -1.26 -0.53 118.95 130.56 3giq s ARG 26 Ca -0.04 1.58 -0.29 0.00 -2.50 0.00 0.00 55.73 54.49 3giq s ARG 26 Cb -0.03 -3.99 0.10 0.00 0.06 0.00 0.00 34.95 31.10 3giq s ARG 26 CO -0.00 -1.22 0.87 0.00 -2.50 0.00 0.00 175.30 172.45 3giq s ALA 27 N 4.93 -1.83 0.30 6.12 0.00 -1.14 -4.95 121.76 125.19 3giq s ALA 27 Ca 0.68 1.14 0.03 0.00 0.00 0.00 0.00 51.96 53.80 3giq s ALA 27 Cb -0.23 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 3giq s ALA 27 CO 0.27 -0.58 0.46 -0.51 0.00 0.00 0.00 175.76 175.41 3giq s ASP 28 N -2.06 6.29 -0.06 0.00 1.01 0.29 -4.39 116.67 117.74 3giq s ASP 28 Ca 0.02 0.25 0.03 0.00 0.71 0.00 0.00 52.55 53.56 3giq s ASP 28 Cb -0.01 -1.91 0.00 0.00 1.01 0.00 0.00 42.92 42.01 3giq s ASP 28 CO -0.05 -0.20 -0.17 -0.22 0.21 0.00 0.00 175.17 174.74 3giq s LEU 29 N -4.16 1.84 -0.02 1.23 0.20 -0.43 -1.08 118.68 116.27 3giq s LEU 29 Ca 0.37 -0.38 0.05 0.00 0.69 0.00 0.00 54.13 54.86 3giq s LEU 29 Cb -0.09 -1.01 -0.03 0.00 -0.43 0.00 0.00 46.19 44.63 3giq s LEU 29 CO 0.33 0.11 -0.14 -0.83 -0.29 0.00 0.00 176.35 175.52 3giq s GLY 30 N 0.36 1.57 -0.01 7.98 0.00 0.12 -0.63 107.32 116.71 3giq s GLY 30 Ca -0.12 -1.05 0.07 0.00 0.00 0.00 0.00 44.72 43.63 3giq s GLY 30 CO 0.04 -0.88 -0.22 0.14 0.00 0.00 0.00 173.10 172.18 3giq s VAL 31 N -0.82 1.77 -0.16 1.40 1.01 0.10 -0.79 120.40 122.91 3giq s VAL 31 Ca 0.13 -0.97 -0.08 0.00 0.00 0.00 0.00 61.98 61.06 3giq s VAL 31 Cb -0.11 -1.48 0.06 0.00 0.00 0.00 0.00 36.38 34.86 3giq s VAL 31 CO 0.03 0.49 0.37 -0.60 0.00 0.00 0.00 175.10 175.39 3giq s ARG 32 N -0.56 0.33 -1.44 2.72 6.06 -0.05 -0.43 118.95 125.58 3giq s ARG 32 Ca 0.09 0.78 -0.08 0.00 -2.50 0.00 0.00 55.73 54.02 3giq s ARG 32 Cb -0.09 0.01 0.05 0.00 0.06 0.00 0.00 34.95 34.98 3giq s ARG 32 CO -0.01 -0.18 0.84 -0.25 -2.50 0.00 0.00 175.30 173.20 3giq n ASP 33 N 4.50 -3.11 0.00 -2.12 8.00 -1.26 -1.89 116.55 120.67 3giq n ASP 33 Ca -0.20 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.49 3giq n ASP 33 Cb 0.54 -3.92 0.00 0.00 -0.02 0.00 0.00 41.12 37.72 3giq n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3giq n GLY 34 N -1.66 1.81 3.52 0.44 0.00 -1.26 -5.00 105.19 103.03 3giq n GLY 34 Ca -0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 3giq n GLY 34 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3giq s ARG 35 N -0.06 1.77 -0.41 1.61 0.52 -0.79 -0.53 118.95 121.05 3giq s ARG 35 Ca 0.00 -1.90 -0.29 0.00 -0.52 0.00 0.00 55.73 53.03 3giq s ARG 35 Cb 0.00 -1.65 0.01 0.00 0.52 0.00 0.00 34.95 33.83 3giq s ARG 35 CO 0.00 0.16 1.31 0.42 0.02 0.00 0.00 175.30 177.20 3giq s ILE 36 N -2.64 4.04 0.06 1.52 1.01 0.09 -0.87 121.20 124.41 3giq s ILE 36 Ca 0.32 1.08 -0.03 0.00 0.00 0.00 0.00 60.65 62.02 3giq s ILE 36 Cb 0.02 -4.32 -0.27 0.00 0.01 0.00 0.00 42.46 37.89 3giq s ILE 36 CO 0.16 -0.79 1.08 0.00 0.00 0.00 0.00 174.94 175.39 3giq h ALA 37 N 10.00 0.17 -2.24 9.38 0.00 -1.26 0.14 119.26 135.45 3giq h ALA 37 Ca -0.26 -0.95 0.11 0.00 0.00 0.00 0.00 54.91 53.81 3giq h ALA 37 Cb 1.09 0.07 -0.16 0.00 0.00 0.00 0.00 17.79 18.79 3giq h ALA 37 CO 1.09 1.05 0.49 0.00 0.00 0.00 0.00 179.25 181.89 3giq s ALA 38 N -2.65 -1.83 -0.05 0.00 0.00 -1.19 -4.81 121.76 111.24 3giq s ALA 38 Ca -0.05 1.04 -0.00 0.00 0.00 0.00 0.00 51.96 52.95 3giq s ALA 38 Cb 0.07 0.36 0.03 0.00 0.00 0.00 0.00 23.12 23.58 3giq s ALA 38 CO 0.87 -0.67 -0.00 0.42 0.00 0.00 0.00 175.76 176.38 3giq s ILE 39 N -3.01 0.32 0.00 0.00 1.01 -1.26 -0.70 121.20 117.57 3giq s ILE 39 Ca 0.04 0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.77 3giq s ILE 39 Cb -0.01 -0.44 0.00 0.00 0.01 0.00 0.00 42.46 42.02 3giq s ILE 39 CO -0.08 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.68 3giq n GLY 40 N 4.64 -0.39 3.53 6.18 0.00 -0.24 -4.92 105.19 113.98 3giq n GLY 40 Ca -0.16 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 3giq n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3giq s GLU 41 N -1.17 3.36 -0.09 1.61 2.56 -1.26 0.10 118.70 123.82 3giq s GLU 41 Ca 0.00 -0.35 0.13 0.00 0.00 0.00 0.00 54.97 54.75 3giq s GLU 41 Cb 0.00 -3.91 0.20 0.00 2.00 0.00 0.00 34.13 32.42 3giq s GLU 41 CO 0.00 -0.87 1.10 1.28 -0.56 0.00 0.00 175.26 176.21 3giq n LEU 42 N 6.01 1.60 -0.33 2.70 4.77 -1.26 -4.83 117.00 125.66 3giq n LEU 42 Ca -0.03 -2.43 0.04 0.00 -0.03 0.00 0.00 56.01 53.56 3giq n LEU 42 Cb 0.48 -0.29 0.19 0.00 -2.33 0.00 0.00 43.42 41.47 3giq n LEU 42 CO 0.50 0.57 1.20 1.23 -1.33 0.00 0.00 177.39 179.56 3giq h GLY 43 N 0.02 1.46 -2.30 -0.72 0.00 -2.00 -2.18 103.07 97.35 3giq h GLY 43 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.94 3giq h GLY 43 CO 0.00 0.19 0.00 0.00 0.00 0.00 0.00 176.54 176.73 3giq n ALA 44 N -2.36 2.41 -2.71 3.60 0.00 -1.26 -4.93 120.51 115.26 3giq n ALA 44 Ca 0.16 -1.07 -0.40 0.00 0.00 0.00 0.00 53.44 52.12 3giq n ALA 44 Cb 0.28 -0.94 -0.04 0.00 0.00 0.00 0.00 19.45 18.75 3giq n ALA 44 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3giq s HIS 45 N -1.26 3.55 0.35 0.00 4.02 -0.82 -5.03 115.29 116.11 3giq s HIS 45 Ca 0.42 1.28 -0.28 0.00 1.02 0.00 0.00 55.06 57.50 3giq s HIS 45 Cb 0.23 -2.87 -0.11 0.00 -1.02 0.00 0.00 32.58 28.81 3giq s HIS 45 CO 0.30 0.02 1.39 -2.14 1.02 0.00 0.00 174.74 175.33 3giq s PRO 46 N 1.07 4.23 -0.08 8.40 0.02 -1.26 -4.95 135.00 142.43 3giq s PRO 46 Ca 0.39 2.38 -0.14 0.00 0.02 0.00 0.00 61.00 63.65 3giq s PRO 46 Cb -0.18 -3.01 0.03 0.00 0.02 0.00 0.00 34.50 31.36 3giq s PRO 46 CO 0.18 -0.36 0.33 0.00 -0.33 0.00 0.00 177.00 176.83 3giq s ALA 47 N -1.14 -0.84 0.23 -1.55 0.00 -1.26 -1.96 121.76 115.25 3giq s ALA 47 Ca 0.51 0.69 -0.03 0.00 0.00 0.00 0.00 51.96 53.12 3giq s ALA 47 Cb -0.43 -0.27 0.24 0.00 0.00 0.00 0.00 23.12 22.66 3giq s ALA 47 CO 0.57 -0.21 1.68 0.00 0.00 0.00 0.00 175.76 177.80 3giq h ARG 48 N 4.78 0.78 -4.67 0.00 3.08 -1.07 -3.44 114.38 113.84 3giq h ARG 48 Ca -0.28 -0.27 -0.36 0.00 0.07 0.00 0.00 59.98 59.14 3giq h ARG 48 Cb 1.18 -0.06 -0.27 0.00 0.08 0.00 0.00 29.97 30.91 3giq h ARG 48 CO 0.34 0.88 -0.77 -1.01 -1.07 0.00 0.00 179.97 178.34 3giq s HIS 49 N -4.74 0.75 -0.01 3.04 3.76 -0.86 -5.01 115.29 112.23 3giq s HIS 49 Ca -0.09 -0.23 0.00 0.00 -0.15 0.00 0.00 55.06 54.59 3giq s HIS 49 Cb 0.14 -0.47 0.01 0.00 1.11 0.00 0.00 32.58 33.36 3giq s HIS 49 CO 0.83 -0.02 0.00 0.00 -0.85 0.00 0.00 174.74 174.70 3giq s ALA 50 N -0.49 0.08 -0.07 -1.40 0.00 -1.26 -1.40 121.76 117.22 3giq s ALA 50 Ca 0.00 0.06 0.05 0.00 0.00 0.00 0.00 51.96 52.07 3giq s ALA 50 Cb -0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 3giq s ALA 50 CO 0.00 -0.02 -0.23 -1.58 0.00 0.00 0.00 175.76 173.93 3giq s TRP 51 N 0.28 2.50 -0.50 0.00 0.51 -0.05 -4.97 118.94 116.70 3giq s TRP 51 Ca -0.02 -0.70 -0.20 0.00 -2.12 0.00 0.00 56.10 53.06 3giq s TRP 51 Cb -0.04 -1.63 0.05 0.00 -0.81 0.00 0.00 33.47 31.05 3giq s TRP 51 CO -0.01 -0.20 0.65 0.34 -0.51 0.00 0.00 176.95 177.22 3giq s ASP 52 N -0.13 6.24 -0.24 2.95 2.15 -1.26 -1.49 116.67 124.89 3giq s ASP 52 Ca -0.04 -0.81 0.10 0.00 0.43 0.00 0.00 52.55 52.23 3giq s ASP 52 Cb -0.14 -2.30 0.67 0.00 -0.30 0.00 0.00 42.92 40.85 3giq s ASP 52 CO 0.04 -0.90 1.60 0.00 -0.17 0.00 0.00 175.17 175.74 3giq n ALA 53 N 6.26 3.97 -1.67 3.66 0.00 0.17 -4.96 120.51 127.95 3giq n ALA 53 Ca -0.05 -1.78 -0.46 0.00 0.00 0.00 0.00 53.44 51.14 3giq n ALA 53 Cb 0.46 -1.16 -0.04 0.00 0.00 0.00 0.00 19.45 18.70 3giq n ALA 53 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3giq n SER 54 N 0.24 2.98 -0.03 0.00 7.64 -1.23 -0.75 113.62 122.47 3giq n SER 54 Ca 0.29 1.09 -0.00 0.00 1.01 0.00 0.00 58.87 61.26 3giq n SER 54 Cb 1.14 -1.42 -0.00 0.00 -1.01 0.00 0.00 64.21 62.92 3giq n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3giq n GLY 55 N 3.18 0.42 3.50 0.23 0.00 -1.26 -4.94 105.19 106.32 3giq n GLY 55 Ca 0.16 -0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 3giq n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3giq s LYS 56 N -0.59 1.75 -0.11 1.61 -0.14 0.07 -4.63 119.74 117.69 3giq s LYS 56 Ca 0.00 -1.98 -0.04 0.00 -1.36 0.00 0.00 55.97 52.58 3giq s LYS 56 Cb 0.00 -1.03 -0.04 0.00 -1.68 0.00 0.00 37.83 35.08 3giq s LYS 56 CO 0.00 -0.18 0.05 0.42 -0.76 0.00 0.00 175.35 174.88 3giq s ILE 57 N -3.16 4.72 -0.24 2.17 -1.09 0.75 -1.25 121.20 123.09 3giq s ILE 57 Ca 0.35 -0.08 -0.03 0.00 -2.23 0.00 0.00 60.65 58.65 3giq s ILE 57 Cb 0.09 -3.04 0.01 0.00 -1.58 0.00 0.00 42.46 37.94 3giq s ILE 57 CO 0.16 0.58 -0.03 -0.69 -1.23 0.00 0.00 174.94 173.73 3giq s VAL 58 N -0.67 3.24 0.28 2.92 1.01 0.73 -1.45 120.40 126.45 3giq s VAL 58 Ca 0.11 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.35 3giq s VAL 58 Cb -0.12 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 3giq s VAL 58 CO 0.02 0.27 0.13 0.00 0.00 0.00 0.00 175.10 175.52 3giq s ALA 59 N 1.41 1.81 0.48 5.51 0.00 -0.22 -1.28 121.76 129.48 3giq s ALA 59 Ca 0.03 -1.80 -0.22 0.00 0.00 0.00 0.00 51.96 49.97 3giq s ALA 59 Cb -0.16 1.11 -0.07 0.00 0.00 0.00 0.00 23.12 24.00 3giq s ALA 59 CO -0.03 -0.48 1.15 -2.14 0.00 0.00 0.00 175.76 174.25 3giq s PRO 60 N -3.95 3.68 0.54 0.00 0.02 -1.26 -0.95 135.00 133.09 3giq s PRO 60 Ca 0.37 1.70 -0.21 0.00 0.02 0.00 0.00 61.00 62.88 3giq s PRO 60 Cb 0.06 -2.30 -0.06 0.00 0.02 0.00 0.00 34.50 32.23 3giq s PRO 60 CO 0.15 -0.60 1.22 0.41 -0.33 0.00 0.00 177.00 177.84 3giq n GLY 61 N 0.34 0.38 3.78 0.52 0.00 -0.38 -4.42 105.19 105.40 3giq n GLY 61 Ca 0.08 -0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 3giq n GLY 61 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3giq s PHE 62 N -1.34 3.39 -0.33 1.61 0.08 -0.39 -4.68 117.98 116.32 3giq s PHE 62 Ca 0.72 1.68 -0.07 0.00 0.12 0.00 0.00 56.93 59.38 3giq s PHE 62 Cb -0.44 -3.14 0.03 0.00 -0.57 0.00 0.00 43.02 38.90 3giq s PHE 62 CO 0.49 -0.51 0.10 0.42 -0.10 0.00 0.00 175.22 175.63 3giq s ILE 63 N -1.53 3.86 -0.70 0.64 1.01 0.41 -0.86 121.20 124.03 3giq s ILE 63 Ca 0.54 -1.01 -0.25 0.00 0.00 0.00 0.00 60.65 59.93 3giq s ILE 63 Cb -0.24 -3.13 0.05 0.00 0.01 0.00 0.00 42.46 39.15 3giq s ILE 63 CO 0.30 -0.11 1.13 -0.62 0.00 0.00 0.00 174.94 175.64 3giq s ASP 64 N 1.43 6.17 0.00 3.58 -1.08 0.28 -4.78 116.67 122.27 3giq s ASP 64 Ca -0.00 -0.72 0.24 0.00 -0.52 0.00 0.00 52.55 51.55 3giq s ASP 64 Cb -0.19 -2.49 1.13 0.00 -1.46 0.00 0.00 42.92 39.91 3giq s ASP 64 CO 0.03 -1.64 1.79 1.33 0.52 0.00 0.00 175.17 177.19 3giq n VAL 65 N 6.16 0.29 -3.47 1.11 0.24 -1.21 -0.82 118.33 120.63 3giq n VAL 65 Ca -0.00 0.07 -0.26 0.00 -2.04 0.00 0.00 64.34 62.11 3giq n VAL 65 Cb 0.47 -0.67 -0.09 0.00 -1.47 0.00 0.00 33.84 32.08 3giq n VAL 65 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 3giq n HIS 66 N -1.39 1.50 -4.09 6.34 -0.00 -1.26 -4.62 115.22 111.70 3giq n HIS 66 Ca 0.09 -3.85 -0.24 0.00 -0.00 0.00 0.00 57.72 53.71 3giq n HIS 66 Cb 0.24 -0.34 -0.05 0.00 -0.00 0.00 0.00 29.99 29.84 3giq n HIS 66 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 3giq s GLY 67 N -1.33 1.57 -0.11 1.57 0.00 -0.19 -0.84 107.32 107.98 3giq s GLY 67 Ca 0.33 -1.30 0.19 0.00 0.00 0.00 0.00 44.72 43.94 3giq s GLY 67 CO -0.12 -1.32 1.19 1.42 0.00 0.00 0.00 173.10 174.27 3giq n HIS 68 N -0.73 0.15 0.21 1.90 8.25 -1.26 -3.84 115.22 119.91 3giq n HIS 68 Ca -0.08 -1.07 0.04 0.00 -0.26 0.00 0.00 57.72 56.35 3giq n HIS 68 Cb 0.56 -0.20 0.20 0.00 1.12 0.00 0.00 29.99 31.66 3giq n HIS 68 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3giq n ASP 69 N -0.30 3.09 -0.33 0.41 8.00 -1.26 -4.65 116.55 121.50 3giq n ASP 69 Ca 0.13 -2.37 0.08 0.00 0.71 0.00 0.00 54.79 53.35 3giq n ASP 69 Cb 0.93 -0.52 0.18 0.00 -0.02 0.00 0.00 41.12 41.68 3giq n ASP 69 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3giq n ASP 70 N 0.37 -0.26 -0.56 -2.24 10.43 -1.26 -1.16 116.55 121.87 3giq n ASP 70 Ca 0.14 1.58 0.12 0.00 2.57 0.00 0.00 54.79 59.20 3giq n ASP 70 Cb 0.64 -0.51 0.11 0.00 1.84 0.00 0.00 41.12 43.20 3giq n ASP 70 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3giq n LEU 71 N -5.46 2.05 0.24 0.64 4.77 -1.26 -4.39 117.00 113.59 3giq n LEU 71 Ca 0.17 -0.71 0.13 0.00 -0.03 0.00 0.00 56.01 55.56 3giq n LEU 71 Cb 0.55 -0.02 0.56 0.00 -2.33 0.00 0.00 43.42 42.18 3giq n LEU 71 CO -0.10 0.37 0.88 0.24 -1.33 0.00 0.00 177.39 177.45 3giq h MET 72 N 2.73 0.00 0.00 3.23 2.86 -1.41 -1.22 114.93 121.13 3giq h MET 72 Ca 0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3giq h MET 72 Cb 0.75 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.41 3giq h MET 72 CO 0.00 0.14 -0.00 0.74 1.06 0.00 0.00 176.91 178.85 3giq h PHE 73 N 0.00 0.00 0.00 -0.22 0.04 -1.77 0.57 116.94 115.56 3giq h PHE 73 Ca -0.00 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.60 3giq h PHE 73 Cb 0.62 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.74 3giq h PHE 73 CO 0.00 0.00 -1.65 1.55 -0.60 0.00 0.00 178.31 177.62 3giq n VAL 74 N -3.10 0.65 -0.03 -0.55 3.14 -1.09 -4.28 118.33 113.07 3giq n VAL 74 Ca -0.02 -0.30 -0.15 0.00 -2.96 0.00 0.00 64.34 60.91 3giq n VAL 74 Cb 0.14 -0.86 -0.09 0.00 -1.06 0.00 0.00 33.84 31.97 3giq n VAL 74 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 3giq h GLU 75 N 0.00 0.38 -1.83 1.45 5.08 -1.06 -3.40 114.58 115.19 3giq h GLU 75 Ca -0.25 -0.30 -0.50 0.00 -1.00 0.00 0.00 59.36 57.30 3giq h GLU 75 Cb 1.45 0.06 -0.34 0.00 0.50 0.00 0.00 28.75 30.42 3giq h GLU 75 CO -0.02 0.94 -0.95 1.63 -1.00 0.00 0.00 179.01 179.61 3giq n LYS 76 N -4.39 0.52 0.20 2.33 5.02 0.15 -5.03 118.16 116.96 3giq n LYS 76 Ca -0.08 -2.95 0.10 0.00 -2.02 0.00 0.00 58.31 53.37 3giq n LYS 76 Cb 0.52 -1.42 0.56 0.00 -0.02 0.00 0.00 35.03 34.67 3giq n LYS 76 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3giq h PRO 77 N 4.66 0.00 -0.28 1.97 0.13 -1.62 -3.08 132.00 133.78 3giq h PRO 77 Ca 0.12 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.20 3giq h PRO 77 Cb 0.93 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.04 3giq h PRO 77 CO 0.38 0.00 -0.03 0.38 -0.23 0.00 0.00 178.00 178.49 3giq h ASP 78 N 0.00 0.41 -5.03 1.44 2.03 -1.93 -3.39 116.42 109.95 3giq h ASP 78 Ca 0.00 -0.08 -0.28 0.00 -0.73 0.00 0.00 57.03 55.94 3giq h ASP 78 Cb 0.39 -0.11 -0.07 0.00 -0.83 0.00 0.00 39.33 38.72 3giq h ASP 78 CO 0.00 0.50 -0.40 0.18 -1.03 0.00 0.00 179.24 178.50 3giq n LEU 79 N -4.28 -1.06 0.28 0.15 4.77 -1.16 -4.81 117.00 110.89 3giq n LEU 79 Ca 0.01 -0.10 0.13 0.00 -0.03 0.00 0.00 56.01 56.02 3giq n LEU 79 Cb 0.25 -1.86 0.83 0.00 -2.33 0.00 0.00 43.42 40.31 3giq n LEU 79 CO 0.39 0.04 1.09 -0.09 -1.33 0.00 0.00 177.39 177.49 3giq h ARG 80 N -0.49 0.00 0.00 3.23 9.65 -1.89 -0.60 114.38 124.28 3giq h ARG 80 Ca -0.31 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.57 3giq h ARG 80 Cb 1.21 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.79 3giq h ARG 80 CO 0.39 0.02 0.00 0.11 2.80 0.00 0.00 179.97 183.30 3giq h TRP 81 N 0.00 0.00 0.00 2.20 0.09 -1.89 -1.75 115.95 114.60 3giq h TRP 81 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 58.89 58.93 3giq h TRP 81 Cb 0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 29.28 3giq h TRP 81 CO 0.00 0.00 -0.70 1.63 0.09 0.00 0.00 178.44 179.46 3giq n LYS 82 N -3.01 0.48 -0.23 0.12 4.76 -0.25 -4.33 118.16 115.69 3giq n LYS 82 Ca -0.00 0.53 0.03 0.00 -2.87 0.00 0.00 58.31 56.00 3giq n LYS 82 Cb 0.22 -1.70 0.27 0.00 -1.84 0.00 0.00 35.03 31.99 3giq n LYS 82 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 3giq h THR 83 N -1.00 1.10 0.00 -0.18 1.35 -1.51 -1.64 112.91 111.03 3giq h THR 83 Ca -0.08 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 3giq h THR 83 Cb 0.70 0.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.19 3giq h THR 83 CO -0.05 0.17 0.00 -1.54 -0.25 0.00 0.00 175.52 173.85 3giq n SER 84 N -4.46 0.30 -0.27 5.36 3.41 -0.66 -1.57 113.62 115.73 3giq n SER 84 Ca 0.11 0.60 0.07 0.00 -0.26 0.00 0.00 58.87 59.39 3giq n SER 84 Cb 0.14 -0.65 0.13 0.00 -0.26 0.00 0.00 64.21 63.57 3giq n SER 84 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3giq n GLN 85 N -1.86 2.14 -0.75 4.33 10.64 -0.69 -4.26 117.38 126.93 3giq n GLN 85 Ca 0.01 -2.34 0.00 0.00 -1.83 0.00 0.00 57.00 52.84 3giq n GLN 85 Cb 0.12 -1.44 0.00 0.00 -0.86 0.00 0.00 30.24 28.06 3giq n GLN 85 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3giq n GLY 86 N -0.87 0.68 3.71 2.61 0.00 -0.61 -4.46 105.19 106.25 3giq n GLY 86 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3giq n GLY 86 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3giq s ILE 87 N -2.32 4.89 -0.12 -0.61 1.01 -0.75 -1.26 121.20 122.04 3giq s ILE 87 Ca 0.00 1.97 0.03 0.00 0.00 0.00 0.00 60.65 62.65 3giq s ILE 87 Cb 0.00 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.16 3giq s ILE 87 CO 0.00 0.17 0.12 0.35 0.00 0.00 0.00 174.94 175.57 3giq n THR 88 N 3.92 0.00 -3.82 2.92 -2.24 -0.04 -3.95 114.28 111.07 3giq n THR 88 Ca 0.05 -0.36 -0.12 0.00 -2.27 0.00 0.00 64.05 61.34 3giq n THR 88 Cb 0.51 0.90 -0.12 0.00 -2.10 0.00 0.00 70.33 69.51 3giq n THR 88 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3giq s THR 89 N -1.46 0.00 -0.00 4.28 2.01 -1.12 -0.87 115.64 118.48 3giq s THR 89 Ca 0.01 -0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.02 3giq s THR 89 Cb 0.02 -0.22 -0.01 0.00 0.01 0.00 0.00 72.50 72.30 3giq s THR 89 CO 0.13 -0.01 -0.08 0.54 -0.69 0.00 0.00 174.62 174.51 3giq s VAL 90 N 0.05 0.61 -0.33 3.82 0.11 -0.45 -0.55 120.40 123.65 3giq s VAL 90 Ca -0.00 -0.36 -0.11 0.00 -2.93 0.00 0.00 61.98 58.58 3giq s VAL 90 Cb -0.01 -0.52 -0.00 0.00 -1.53 0.00 0.00 36.38 34.32 3giq s VAL 90 CO 0.00 0.15 0.19 -0.69 -3.33 0.00 0.00 175.10 171.43 3giq s VAL 91 N -0.22 4.80 0.57 2.04 1.01 0.00 -1.45 120.40 127.15 3giq s VAL 91 Ca 0.03 -0.45 0.09 0.00 0.00 0.00 0.00 61.98 61.64 3giq s VAL 91 Cb -0.03 -3.50 0.07 0.00 0.00 0.00 0.00 36.38 32.92 3giq s VAL 91 CO -0.00 -0.02 0.69 0.68 0.00 0.00 0.00 175.10 176.45 3giq s VAL 92 N 1.64 2.00 -0.02 2.92 -7.23 -0.08 -1.03 120.40 118.60 3giq s VAL 92 Ca 0.05 -1.13 -0.00 0.00 -1.81 0.00 0.00 61.98 59.08 3giq s VAL 92 Cb -0.18 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.63 3giq s VAL 92 CO 0.08 0.00 0.01 0.61 -0.31 0.00 0.00 175.10 175.48 3giq n GLY 93 N -2.12 0.66 3.94 2.32 0.00 -1.25 -1.55 105.19 107.19 3giq n GLY 93 Ca 0.11 -0.77 -0.24 0.00 0.00 0.00 0.00 46.02 45.12 3giq n GLY 93 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3giq s ASN 94 N -3.00 5.38 -1.37 1.61 0.01 -1.19 -4.30 114.94 112.07 3giq s ASN 94 Ca 0.00 0.40 -0.04 0.00 -0.71 0.00 0.00 52.86 52.52 3giq s ASN 94 Cb -0.00 -1.34 0.02 0.00 0.41 0.00 0.00 41.25 40.34 3giq s ASN 94 CO 0.00 -1.14 0.29 0.00 -1.51 0.00 0.00 177.10 174.75 3giq n GLY 96 N -1.13 1.81 3.26 0.00 0.00 -1.22 -3.53 105.19 104.37 3giq n GLY 96 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 3giq n GLY 96 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3giq s VAL 97 N -2.94 2.32 0.26 1.61 -7.23 -0.86 -0.70 120.40 112.85 3giq s VAL 97 Ca 0.00 -0.93 0.03 0.00 -1.81 0.00 0.00 61.98 59.27 3giq s VAL 97 Cb 0.00 -1.91 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 3giq s VAL 97 CO 0.00 0.55 0.20 -0.94 -0.31 0.00 0.00 175.10 174.60 3giq s SER 98 N 0.36 0.87 0.41 4.85 1.04 -1.26 -3.20 113.70 116.77 3giq s SER 98 Ca -0.17 -1.56 0.20 0.00 0.48 0.00 0.00 55.95 54.90 3giq s SER 98 Cb -0.17 0.46 0.88 0.00 0.10 0.00 0.00 66.02 67.29 3giq s SER 98 CO 0.08 -0.94 1.83 0.00 0.98 0.00 0.00 173.24 175.19 3giq h ALA 99 N 2.39 1.13 -2.60 5.32 0.00 -1.91 -3.46 119.26 120.14 3giq h ALA 99 Ca -0.31 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.25 3giq h ALA 99 Cb 1.24 -0.05 -0.15 0.00 0.00 0.00 0.00 17.79 18.83 3giq h ALA 99 CO 0.45 0.38 -0.19 0.00 0.00 0.00 0.00 179.25 179.90 3giq s ALA 100 N -3.85 -0.74 0.71 0.00 0.00 -1.26 -0.66 121.76 115.95 3giq s ALA 100 Ca -0.01 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.78 3giq s ALA 100 Cb 0.12 0.46 0.01 0.00 0.00 0.00 0.00 23.12 23.72 3giq s ALA 100 CO 0.67 -0.51 1.08 -1.25 0.00 0.00 0.00 175.76 175.75 3giq s PRO 101 N -3.13 2.86 0.28 0.00 0.04 -1.26 -4.32 135.00 129.47 3giq s PRO 101 Ca -0.01 0.63 -0.29 0.00 0.04 0.00 0.00 61.00 61.37 3giq s PRO 101 Cb 0.01 -2.01 -0.10 0.00 0.04 0.00 0.00 34.50 32.45 3giq s PRO 101 CO -0.07 -1.07 1.10 0.00 0.04 0.00 0.00 177.00 177.00 3giq s ALA 102 N -3.23 3.41 0.90 8.56 0.00 0.29 -4.79 121.76 126.90 3giq s ALA 102 Ca 0.58 0.90 -0.11 0.00 0.00 0.00 0.00 51.96 53.33 3giq s ALA 102 Cb -0.12 -3.33 0.13 0.00 0.00 0.00 0.00 23.12 19.80 3giq s ALA 102 CO 0.53 -0.16 1.11 -2.14 0.00 0.00 0.00 175.76 175.10 3giq s PRO 103 N -1.44 1.19 0.55 0.00 0.02 -1.26 -4.47 135.00 129.58 3giq s PRO 103 Ca 0.44 1.21 -0.20 0.00 0.02 0.00 0.00 61.00 62.48 3giq s PRO 103 Cb -0.32 -1.77 -0.06 0.00 0.02 0.00 0.00 34.50 32.37 3giq s PRO 103 CO 0.41 -2.40 1.15 -0.51 -0.33 0.00 0.00 177.00 175.32 3giq s LEU 104 N -6.41 3.76 0.07 -5.54 1.43 -0.08 -4.85 118.68 107.06 3giq s LEU 104 Ca 0.65 2.24 -0.35 0.00 -1.03 0.00 0.00 54.13 55.64 3giq s LEU 104 Cb -0.20 -4.55 -0.14 0.00 0.03 0.00 0.00 46.19 41.33 3giq s LEU 104 CO 0.58 -1.27 1.63 -2.65 0.23 0.00 0.00 176.35 174.87 3giq n PRO 105 N -1.28 2.00 0.00 1.29 -0.02 -1.26 -0.81 135.00 134.92 3giq n PRO 105 Ca 0.12 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 3giq n PRO 105 Cb 0.50 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 3giq n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3giq n GLY 106 N 3.58 3.40 3.72 -1.23 0.00 -1.26 -5.04 105.19 108.37 3giq n GLY 106 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3giq n GLY 106 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3giq s ASN 107 N -0.93 7.08 0.23 1.61 -0.87 0.01 -5.04 114.94 117.03 3giq s ASN 107 Ca 0.00 1.30 -0.04 0.00 -1.57 0.00 0.00 52.86 52.54 3giq s ASN 107 Cb 0.00 -2.44 -0.03 0.00 -0.02 0.00 0.00 41.25 38.76 3giq s ASN 107 CO 0.00 -0.11 0.27 0.28 -2.57 0.00 0.00 177.10 174.98 3giq s THR 108 N 0.65 0.00 -0.20 1.60 -1.32 -1.26 -4.66 115.64 110.45 3giq s THR 108 Ca 0.40 -1.79 -0.14 0.00 -1.21 0.00 0.00 61.69 58.95 3giq s THR 108 Cb -0.19 -2.42 0.06 0.00 -1.51 0.00 0.00 72.50 68.45 3giq s THR 108 CO 0.20 0.00 0.51 0.00 -2.21 0.00 0.00 174.62 173.12 3giq s ALA 109 N -3.99 -1.32 0.24 11.08 0.00 -1.26 -4.91 121.76 121.60 3giq s ALA 109 Ca 0.33 1.70 -0.05 0.00 0.00 0.00 0.00 51.96 53.95 3giq s ALA 109 Cb 0.04 -1.01 0.42 0.00 0.00 0.00 0.00 23.12 22.56 3giq s ALA 109 CO 0.13 -0.28 1.75 0.00 0.00 0.00 0.00 175.76 177.35 3giq h ALA 110 N 6.44 1.04 -0.04 0.00 0.00 -2.03 -1.51 119.26 123.16 3giq h ALA 110 Ca -0.32 0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.69 3giq h ALA 110 Cb 1.19 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 3giq h ALA 110 CO 0.22 -0.14 0.04 0.00 0.00 0.00 0.00 179.25 179.37 3giq h ALA 111 N 1.50 1.78 -0.11 0.00 0.00 -1.97 -2.22 119.26 118.24 3giq h ALA 111 Ca 0.39 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.24 3giq h ALA 111 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3giq h ALA 111 CO -0.35 -0.06 -0.23 -0.07 0.00 0.00 0.00 179.25 178.54 3giq h LEU 112 N 0.00 0.18 -2.08 0.00 3.38 -1.67 -2.74 115.31 112.37 3giq h LEU 112 Ca 0.02 -0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.00 3giq h LEU 112 Cb 0.10 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3giq h LEU 112 CO -0.00 0.42 0.15 0.00 0.09 0.00 0.00 178.44 179.10 3giq h ALA 113 N 1.60 2.07 0.00 1.53 0.00 -1.49 -1.57 119.26 121.40 3giq h ALA 113 Ca 0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3giq h ALA 113 Cb 0.50 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3giq h ALA 113 CO 0.03 -0.25 -0.02 -0.07 0.00 0.00 0.00 179.25 178.94 3giq h LEU 114 N 0.00 0.00 -0.34 0.00 3.38 -1.64 -2.11 115.31 114.59 3giq h LEU 114 Ca 0.09 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 3giq h LEU 114 Cb 0.39 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3giq h LEU 114 CO -0.00 0.02 -0.60 -0.07 0.09 0.00 0.00 178.44 177.88 3giq h LEU 115 N 0.00 0.00 0.00 1.67 3.38 -1.47 -3.40 115.31 115.49 3giq h LEU 115 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3giq h LEU 115 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3giq h LEU 115 CO 0.00 0.60 0.00 0.61 0.09 0.00 0.00 178.44 179.74 3giq n GLY 116 N 0.88 0.95 0.31 0.83 0.00 -0.80 -4.35 105.19 103.02 3giq n GLY 116 Ca 0.01 -2.11 0.12 0.00 0.00 0.00 0.00 46.02 44.04 3giq n GLY 116 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3giq n GLU 117 N -1.51 0.87 -1.84 1.61 1.02 -1.26 -4.76 120.64 114.77 3giq n GLU 117 Ca 0.00 -0.63 -0.42 0.00 -0.02 0.00 0.00 57.16 56.10 3giq n GLU 117 Cb 0.00 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 29.91 3giq n GLU 117 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3giq s THR 118 N -2.56 2.32 0.24 2.62 2.01 -1.26 -4.90 115.64 114.11 3giq s THR 118 Ca 0.20 0.24 -0.31 0.00 0.31 0.00 0.00 61.69 62.13 3giq s THR 118 Cb 0.18 -3.15 -0.13 0.00 0.01 0.00 0.00 72.50 69.41 3giq s THR 118 CO 0.58 0.02 1.42 -2.65 -0.69 0.00 0.00 174.62 173.30 3giq n PRO 119 N 3.43 2.05 -1.38 4.92 -0.02 -1.26 -4.92 135.00 137.83 3giq n PRO 119 Ca 0.13 0.73 -0.33 0.00 -2.02 0.00 0.00 63.50 62.01 3giq n PRO 119 Cb 0.37 -2.40 0.09 0.00 -0.02 0.00 0.00 33.50 31.55 3giq n PRO 119 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3giq s LEU 120 N 0.12 3.21 0.38 2.45 1.43 -1.26 -5.01 118.68 120.00 3giq s LEU 120 Ca 0.69 2.13 -0.17 0.00 -1.03 0.00 0.00 54.13 55.74 3giq s LEU 120 Cb -0.65 -4.56 -0.09 0.00 0.03 0.00 0.00 46.19 40.91 3giq s LEU 120 CO 0.49 -2.17 0.83 -0.36 0.23 0.00 0.00 176.35 175.37 3giq s PHE 121 N -2.36 3.36 0.13 0.29 0.08 0.16 -4.78 117.98 114.86 3giq s PHE 121 Ca 0.69 1.37 -0.20 0.00 0.12 0.00 0.00 56.93 58.91 3giq s PHE 121 Cb -0.23 -2.66 -0.02 0.00 -0.57 0.00 0.00 43.02 39.53 3giq s PHE 121 CO 0.48 -0.03 1.70 0.00 -0.10 0.00 0.00 175.22 177.27 3giq h ALA 122 N 1.97 0.14 -2.98 5.36 0.00 -1.93 0.85 119.26 122.67 3giq h ALA 122 Ca -0.48 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 3giq h ALA 122 Cb 1.18 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 3giq h ALA 122 CO 0.63 -0.48 0.15 0.16 0.00 0.00 0.00 179.25 179.71 3giq s ASP 123 N -5.20 0.26 0.20 0.00 1.47 -1.26 -2.96 116.67 109.18 3giq s ASP 123 Ca -0.13 -1.24 -0.11 0.00 1.18 0.00 0.00 52.55 52.25 3giq s ASP 123 Cb 0.11 0.80 0.14 0.00 -0.34 0.00 0.00 42.92 43.63 3giq s ASP 123 CO 0.69 -1.59 1.87 0.58 0.68 0.00 0.00 175.17 177.40 3giq h VAL 124 N 2.03 1.18 -0.93 2.11 2.07 -1.90 -1.99 116.25 118.82 3giq h VAL 124 Ca -0.31 -0.33 0.07 0.00 0.82 0.00 0.00 66.70 66.94 3giq h VAL 124 Cb 1.25 0.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.09 3giq h VAL 124 CO 0.40 0.18 0.60 -0.65 0.02 0.00 0.00 177.57 178.12 3giq h PRO 125 N 0.97 1.03 -0.56 1.57 0.11 -1.92 0.13 132.00 133.32 3giq h PRO 125 Ca 0.26 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.22 3giq h PRO 125 Cb -0.11 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.75 3giq h PRO 125 CO -0.06 0.68 -0.02 0.00 -0.21 0.00 0.00 178.00 178.39 3giq h ALA 126 N 1.50 0.75 -0.10 -0.75 0.00 -1.84 -0.09 119.26 118.72 3giq h ALA 126 Ca 0.40 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3giq h ALA 126 Cb 0.20 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3giq h ALA 126 CO -0.15 0.60 0.03 -0.92 0.00 0.00 0.00 179.25 178.81 3giq h TYR 127 N 0.88 0.17 0.00 0.00 3.20 -0.60 -2.01 116.97 118.61 3giq h TYR 127 Ca 0.16 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 3giq h TYR 127 Cb 0.57 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 3giq h TYR 127 CO 0.04 0.31 -0.30 0.74 -1.64 0.00 0.00 178.16 177.32 3giq h PHE 128 N -0.03 0.00 -0.35 -3.82 0.04 -0.70 -1.92 116.94 110.17 3giq h PHE 128 Ca 0.03 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.67 3giq h PHE 128 Cb 0.23 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 3giq h PHE 128 CO 0.00 0.30 -0.32 0.00 -0.60 0.00 0.00 178.31 177.69 3giq h ALA 129 N 1.70 0.78 -0.46 2.45 0.00 -0.80 -0.04 119.26 122.89 3giq h ALA 129 Ca -0.00 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 3giq h ALA 129 Cb 0.56 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3giq h ALA 129 CO 0.04 0.65 -0.14 0.00 0.00 0.00 0.00 179.25 179.80 3giq h ALA 130 N 0.99 0.88 -0.21 0.00 0.00 -0.80 -1.76 119.26 118.38 3giq h ALA 130 Ca 0.07 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 3giq h ALA 130 Cb 0.85 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3giq h ALA 130 CO 0.07 0.63 -0.49 -0.07 0.00 0.00 0.00 179.25 179.40 3giq h LEU 131 N 0.77 0.60 -0.97 0.00 3.38 -1.14 -1.25 115.31 116.71 3giq h LEU 131 Ca 0.12 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 3giq h LEU 131 Cb 0.66 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3giq h LEU 131 CO 0.05 0.99 -0.20 0.44 0.09 0.00 0.00 178.44 179.81 3giq h ASP 132 N 0.44 0.51 0.98 -0.43 3.32 -0.76 -2.20 116.42 118.27 3giq h ASP 132 Ca 0.02 -0.16 -0.19 0.00 0.02 0.00 0.00 57.03 56.73 3giq h ASP 132 Cb 1.02 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.40 3giq h ASP 132 CO 0.09 0.72 -0.90 0.00 -1.72 0.00 0.00 179.24 177.43 3giq h ALA 133 N 1.33 0.48 -2.44 3.45 0.00 -1.14 -3.37 119.26 117.56 3giq h ALA 133 Ca 0.07 -0.82 -0.59 0.00 0.00 0.00 0.00 54.91 53.57 3giq h ALA 133 Cb 0.61 -0.14 -0.40 0.00 0.00 0.00 0.00 17.79 17.86 3giq h ALA 133 CO 0.04 1.12 -0.82 0.94 0.00 0.00 0.00 179.25 180.53 3giq n GLN 134 N -3.41 1.20 -1.53 0.00 7.27 -0.49 -5.10 117.38 115.32 3giq n GLN 134 Ca -0.00 -3.83 -0.51 0.00 0.07 0.00 0.00 57.00 52.73 3giq n GLN 134 Cb 0.87 -1.85 -0.05 0.00 2.41 0.00 0.00 30.24 31.62 3giq n GLN 134 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 3giq n ARG 135 N 1.89 0.73 -1.97 3.69 5.12 -0.84 -4.63 116.66 120.64 3giq n ARG 135 Ca 0.25 0.26 -0.32 0.00 -1.93 0.00 0.00 57.85 56.11 3giq n ARG 135 Cb 0.44 -1.69 0.01 0.00 -1.16 0.00 0.00 32.46 30.06 3giq n ARG 135 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3giq s PRO 136 N -0.33 3.30 0.34 5.56 0.04 -1.26 -4.41 135.00 138.24 3giq s PRO 136 Ca 0.76 1.12 0.05 0.00 0.04 0.00 0.00 61.00 62.97 3giq s PRO 136 Cb -0.96 -2.03 0.62 0.00 0.04 0.00 0.00 34.50 32.17 3giq s PRO 136 CO 0.54 -0.82 1.89 1.98 0.04 0.00 0.00 177.00 180.63 3giq h MET 137 N 0.22 0.53 -5.28 4.56 4.05 -1.91 0.24 114.93 117.34 3giq h MET 137 Ca -0.46 -0.10 -0.50 0.00 -0.28 0.00 0.00 59.70 58.35 3giq h MET 137 Cb 1.21 -0.08 -0.14 0.00 -0.80 0.00 0.00 31.60 31.80 3giq h MET 137 CO 0.58 0.54 -0.60 0.96 0.23 0.00 0.00 176.91 178.61 3giq s ILE 138 N -5.01 1.28 0.44 1.77 -4.36 -1.26 -3.84 121.20 110.22 3giq s ILE 138 Ca -0.08 -2.00 -0.24 0.00 -0.26 0.00 0.00 60.65 58.08 3giq s ILE 138 Cb 0.16 -2.79 -0.08 0.00 1.25 0.00 0.00 42.46 41.00 3giq s ILE 138 CO 0.76 0.00 1.20 0.20 0.24 0.00 0.00 174.94 177.34 3giq s ASN 139 N -3.53 6.20 -0.08 4.36 -0.87 -0.05 -4.20 114.94 116.76 3giq s ASN 139 Ca 0.35 2.40 0.01 0.00 -1.57 0.00 0.00 52.86 54.05 3giq s ASN 139 Cb 0.08 -2.61 0.02 0.00 -0.02 0.00 0.00 41.25 38.72 3giq s ASN 139 CO 0.16 -0.90 -0.10 -0.69 -2.57 0.00 0.00 177.10 172.99 3giq s VAL 140 N -1.45 1.08 0.03 1.60 1.01 -0.41 -1.35 120.40 120.91 3giq s VAL 140 Ca 0.62 -0.39 0.06 0.00 0.00 0.00 0.00 61.98 62.26 3giq s VAL 140 Cb -0.31 -1.03 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 3giq s VAL 140 CO 0.39 0.36 -0.16 0.00 0.00 0.00 0.00 175.10 175.68 3giq s ALA 141 N 1.08 2.65 -0.01 5.51 0.00 -0.53 -0.35 121.76 130.11 3giq s ALA 141 Ca -0.07 -1.15 0.04 0.00 0.00 0.00 0.00 51.96 50.78 3giq s ALA 141 Cb -0.14 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.16 3giq s ALA 141 CO -0.01 0.58 -0.12 0.00 0.00 0.00 0.00 175.76 176.20 3giq s ALA 142 N -0.91 1.05 0.15 0.00 0.00 -1.26 -0.90 121.76 119.88 3giq s ALA 142 Ca 0.15 -0.53 0.05 0.00 0.00 0.00 0.00 51.96 51.63 3giq s ALA 142 Cb -0.11 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 3giq s ALA 142 CO 0.05 0.25 0.10 -0.51 0.00 0.00 0.00 175.76 175.65 3giq s LEU 143 N -0.25 3.71 -0.17 0.00 1.43 -0.60 -1.00 118.68 121.81 3giq s LEU 143 Ca 0.04 -0.16 -0.08 0.00 -1.03 0.00 0.00 54.13 52.90 3giq s LEU 143 Cb -0.05 -2.35 -0.05 0.00 0.03 0.00 0.00 46.19 43.78 3giq s LEU 143 CO -0.00 0.09 0.11 0.54 0.23 0.00 0.00 176.35 177.32 3giq s VAL 144 N -1.68 5.27 0.07 -1.59 0.11 -0.28 -4.38 120.40 117.92 3giq s VAL 144 Ca 0.30 0.13 -0.30 0.00 -2.93 0.00 0.00 61.98 59.19 3giq s VAL 144 Cb -0.10 -3.36 -0.05 0.00 -1.53 0.00 0.00 36.38 31.33 3giq s VAL 144 CO 0.22 0.49 0.95 -0.83 -3.33 0.00 0.00 175.10 172.61 3giq s GLY 145 N -0.03 2.95 0.41 6.54 0.00 -1.26 -1.06 107.32 114.88 3giq s GLY 145 Ca 0.09 0.54 0.07 0.00 0.00 0.00 0.00 44.72 45.42 3giq s GLY 145 CO 0.00 1.50 2.05 0.84 0.00 0.00 0.00 173.10 177.49 3giq h HIS 146 N 5.99 0.49 -0.38 1.90 6.17 -0.73 -0.94 115.15 127.64 3giq h HIS 146 Ca -0.42 0.01 -0.02 0.00 0.71 0.00 0.00 60.37 60.65 3giq h HIS 146 Cb 1.21 -0.16 -0.02 0.00 2.52 0.00 0.00 27.41 30.96 3giq h HIS 146 CO 0.66 0.33 0.17 0.00 0.71 0.00 0.00 177.93 179.80 3giq h ALA 147 N 1.74 0.49 -0.63 5.26 0.00 -1.16 -0.68 119.26 124.28 3giq h ALA 147 Ca 0.14 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3giq h ALA 147 Cb -0.03 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 3giq h ALA 147 CO -0.03 0.07 0.40 -0.91 0.00 0.00 0.00 179.25 178.78 3giq h ASN 148 N 0.47 0.68 -0.22 0.00 2.35 -1.24 0.39 115.58 118.01 3giq h ASN 148 Ca 0.13 -0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.89 3giq h ASN 148 Cb 0.14 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 3giq h ASN 148 CO -0.01 0.48 0.10 -0.07 -1.65 0.00 0.00 177.43 176.28 3giq h LEU 149 N 0.81 0.15 -0.32 1.61 3.38 -0.80 0.59 115.31 120.73 3giq h LEU 149 Ca 0.24 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 3giq h LEU 149 Cb -0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3giq h LEU 149 CO -0.07 0.12 0.12 0.03 0.09 0.00 0.00 178.44 178.72 3giq h ARG 150 N 0.22 0.49 0.00 1.13 3.08 -0.79 -1.20 114.38 117.31 3giq h ARG 150 Ca 0.09 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 3giq h ARG 150 Cb 0.03 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 3giq h ARG 150 CO -0.07 0.50 -0.13 -0.07 -1.07 0.00 0.00 179.97 179.13 3giq h LEU 151 N 0.37 0.00 0.00 3.04 3.38 -0.68 -0.17 115.31 121.24 3giq h LEU 151 Ca 0.11 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.89 3giq h LEU 151 Cb 0.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3giq h LEU 151 CO -0.01 0.13 -1.35 0.00 0.09 0.00 0.00 178.44 177.30 3giq h ALA 152 N 1.87 0.66 0.00 1.53 0.00 -0.60 -0.19 119.26 122.53 3giq h ALA 152 Ca -0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.01 3giq h ALA 152 Cb 0.38 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3giq h ALA 152 CO 0.02 1.00 -1.71 0.00 0.00 0.00 0.00 179.25 178.55 3giq n ALA 153 N -2.40 2.98 -3.91 0.00 0.00 -0.48 -4.62 120.51 112.08 3giq n ALA 153 Ca -0.09 -0.46 -0.34 0.00 0.00 0.00 0.00 53.44 52.55 3giq n ALA 153 Cb 0.86 -0.66 -0.15 0.00 0.00 0.00 0.00 19.45 19.50 3giq n ALA 153 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3giq s MET 154 N -3.23 3.12 0.56 0.00 -1.94 -0.10 -4.89 119.30 112.82 3giq s MET 154 Ca -0.05 -0.76 0.28 0.00 -1.71 0.00 0.00 55.69 53.45 3giq s MET 154 Cb 0.12 -2.71 1.65 0.00 2.01 0.00 0.00 34.83 35.90 3giq s MET 154 CO 0.79 -0.20 2.18 0.07 -0.01 0.00 0.00 175.02 177.84 3giq h ARG 155 N 7.98 0.00 -2.93 2.03 0.11 -1.90 -3.19 114.38 116.49 3giq h ARG 155 Ca -0.44 0.00 -0.61 0.00 0.10 0.00 0.00 59.98 59.03 3giq h ARG 155 Cb 1.15 0.00 -0.40 0.00 1.11 0.00 0.00 29.97 31.83 3giq h ARG 155 CO 0.63 0.05 -0.74 0.34 0.10 0.00 0.00 179.97 180.35 3giq s ASP 156 N -6.20 3.55 0.00 0.08 -1.08 -1.26 -4.98 116.67 106.78 3giq s ASP 156 Ca -0.04 -2.89 0.07 0.00 -0.52 0.00 0.00 52.55 49.17 3giq s ASP 156 Cb 0.14 -1.07 0.45 0.00 -1.46 0.00 0.00 42.92 40.98 3giq s ASP 156 CO 0.57 -0.22 0.86 -0.81 0.52 0.00 0.00 175.17 176.08 3giq n PRO 157 N 3.18 0.31 -0.13 4.34 -0.04 -1.21 -2.09 135.00 139.37 3giq n PRO 157 Ca 0.13 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.68 3giq n PRO 157 Cb 0.36 -1.37 0.15 0.00 -0.04 0.00 0.00 33.50 32.60 3giq n PRO 157 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3giq n GLN 158 N -0.87 2.09 -3.38 0.54 1.13 -1.26 -4.78 117.38 110.84 3giq n GLN 158 Ca 0.06 -1.94 -0.21 0.00 -1.94 0.00 0.00 57.00 52.96 3giq n GLN 158 Cb 0.03 -1.38 0.01 0.00 0.11 0.00 0.00 30.24 29.01 3giq n GLN 158 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3giq s ALA 159 N -1.25 4.46 0.25 -1.58 0.00 -0.89 -5.01 121.76 117.75 3giq s ALA 159 Ca 0.28 -1.78 -0.27 0.00 0.00 0.00 0.00 51.96 50.20 3giq s ALA 159 Cb 0.17 -1.18 -0.09 0.00 0.00 0.00 0.00 23.12 22.02 3giq s ALA 159 CO 0.24 -0.52 0.89 0.00 0.00 0.00 0.00 175.76 176.36 3giq s ALA 160 N -2.61 3.33 0.39 0.00 0.00 -1.26 -4.94 121.76 116.67 3giq s ALA 160 Ca 0.50 0.50 -0.25 0.00 0.00 0.00 0.00 51.96 52.71 3giq s ALA 160 Cb -0.05 -3.11 -0.09 0.00 0.00 0.00 0.00 23.12 19.87 3giq s ALA 160 CO 0.31 0.23 1.09 -1.25 0.00 0.00 0.00 175.76 176.13 3giq s PRO 161 N -1.54 4.16 0.81 0.00 0.04 -1.26 -5.04 135.00 132.17 3giq s PRO 161 Ca 0.43 1.62 -0.12 0.00 0.04 0.00 0.00 61.00 62.98 3giq s PRO 161 Cb -0.22 -2.62 0.08 0.00 0.04 0.00 0.00 34.50 31.77 3giq s PRO 161 CO 0.27 -0.17 1.16 0.95 0.04 0.00 0.00 177.00 179.25 3giq s THR 162 N -1.55 2.26 0.29 1.26 -4.23 -1.26 -4.79 115.64 107.63 3giq s THR 162 Ca 0.57 0.09 -0.01 0.00 -1.18 0.00 0.00 61.69 61.15 3giq s THR 162 Cb -0.25 -3.03 0.27 0.00 1.34 0.00 0.00 72.50 70.83 3giq s THR 162 CO 0.32 -0.11 1.93 0.00 -0.54 0.00 0.00 174.62 176.22 3giq h ALA 163 N -1.08 1.45 -0.46 3.99 0.00 -1.99 -0.54 119.26 120.63 3giq h ALA 163 Ca -0.47 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.29 3giq h ALA 163 Cb 1.32 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 3giq h ALA 163 CO 0.65 0.46 -0.18 0.00 0.00 0.00 0.00 179.25 180.18 3giq h ALA 164 N 1.48 0.83 -0.24 0.00 0.00 -1.99 -1.59 119.26 117.76 3giq h ALA 164 Ca 0.36 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 3giq h ALA 164 Cb 0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3giq h ALA 164 CO -0.11 0.65 -0.41 0.93 0.00 0.00 0.00 179.25 180.31 3giq h GLU 165 N 0.78 0.56 -0.38 0.00 5.08 -1.71 -0.06 114.58 118.86 3giq h GLU 165 Ca 0.11 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 3giq h GLU 165 Cb 0.71 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 3giq h GLU 165 CO 0.05 0.87 0.12 0.37 -1.00 0.00 0.00 179.01 179.42 3giq h GLN 166 N 0.46 0.59 -0.31 2.33 5.75 -0.93 -1.50 115.11 121.49 3giq h GLN 166 Ca 0.04 -0.13 -0.07 0.00 -0.15 0.00 0.00 58.65 58.34 3giq h GLN 166 Cb 0.91 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.36 3giq h GLN 166 CO 0.08 0.60 -0.12 0.37 -2.65 0.00 0.00 178.83 177.11 3giq h GLN 167 N 0.46 0.53 -0.40 1.69 5.75 -1.09 -1.84 115.11 120.22 3giq h GLN 167 Ca 0.12 -0.15 -0.02 0.00 -0.15 0.00 0.00 58.65 58.45 3giq h GLN 167 Cb 0.26 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.73 3giq h GLN 167 CO -0.00 0.64 0.19 0.00 -2.65 0.00 0.00 178.83 177.01 3giq h ALA 168 N 1.39 0.52 -0.68 3.38 0.00 -0.61 0.16 119.26 123.41 3giq h ALA 168 Ca 0.09 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3giq h ALA 168 Cb 0.50 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3giq h ALA 168 CO 0.03 0.08 0.22 0.52 0.00 0.00 0.00 179.25 180.10 3giq h MET 169 N 0.51 1.04 -0.55 0.00 2.86 -0.97 0.22 114.93 118.04 3giq h MET 169 Ca 0.14 -0.21 -0.11 0.00 -2.06 0.00 0.00 59.70 57.45 3giq h MET 169 Cb 0.12 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 3giq h MET 169 CO -0.02 0.89 -0.09 1.96 1.06 0.00 0.00 176.91 180.71 3giq h GLN 170 N 1.01 1.04 -0.40 1.72 4.20 -0.97 -0.70 115.11 121.01 3giq h GLN 170 Ca 0.22 -0.38 -0.10 0.00 0.06 0.00 0.00 58.65 58.46 3giq h GLN 170 Cb 0.28 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 3giq h GLN 170 CO -0.01 1.07 -0.15 -0.44 -0.67 0.00 0.00 178.83 178.63 3giq h ASP 171 N 0.93 0.73 -0.50 1.46 3.32 -0.25 0.91 116.42 123.01 3giq h ASP 171 Ca 0.15 -0.23 -0.10 0.00 0.02 0.00 0.00 57.03 56.87 3giq h ASP 171 Cb 0.66 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 3giq h ASP 171 CO 0.05 0.89 -0.06 0.24 -1.72 0.00 0.00 179.24 178.64 3giq h MET 172 N 0.66 0.97 -0.34 3.56 2.86 -0.72 -1.18 114.93 120.74 3giq h MET 172 Ca 0.11 -0.32 -0.06 0.00 -2.06 0.00 0.00 59.70 57.37 3giq h MET 172 Cb 0.62 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 3giq h MET 172 CO 0.04 0.99 -0.01 1.25 1.06 0.00 0.00 176.91 180.24 3giq h LEU 173 N 0.87 0.59 -0.54 1.22 5.85 -0.74 -1.46 115.31 121.10 3giq h LEU 173 Ca 0.15 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.59 3giq h LEU 173 Cb 0.60 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 3giq h LEU 173 CO 0.04 0.77 0.31 -0.61 -0.34 0.00 0.00 178.44 178.60 3giq h GLN 174 N 0.41 0.59 -0.48 1.25 4.15 -0.60 -0.05 115.11 120.38 3giq h GLN 174 Ca 0.09 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 3giq h GLN 174 Cb 0.47 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.00 3giq h GLN 174 CO 0.02 0.39 0.28 0.00 -1.93 0.00 0.00 178.83 177.59 3giq h ALA 175 N 1.26 0.62 -0.67 3.38 0.00 -1.08 -0.50 119.26 122.26 3giq h ALA 175 Ca 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3giq h ALA 175 Cb 0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3giq h ALA 175 CO -0.12 0.12 0.43 0.00 0.00 0.00 0.00 179.25 179.67 3giq h ALA 176 N 1.12 0.85 -0.54 0.00 0.00 -0.67 -0.84 119.26 119.20 3giq h ALA 176 Ca 0.17 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 3giq h ALA 176 Cb 0.02 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3giq h ALA 176 CO -0.03 0.31 -0.04 -0.07 0.00 0.00 0.00 179.25 179.42 3giq h LEU 177 N 0.91 0.93 -1.34 0.00 3.38 -0.71 -1.27 115.31 117.21 3giq h LEU 177 Ca 0.24 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 3giq h LEU 177 Cb -0.07 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.42 3giq h LEU 177 CO -0.05 1.01 -0.32 -0.33 0.09 0.00 0.00 178.44 178.84 3giq h GLU 178 N 0.87 0.00 0.00 1.13 5.08 -0.65 -2.14 114.58 118.87 3giq h GLU 178 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3giq h GLU 178 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3giq h GLU 178 CO 0.03 0.32 0.00 0.00 -1.00 0.00 0.00 179.01 178.36 3giq n ALA 179 N -2.42 2.14 0.00 3.43 0.00 -0.36 -4.90 120.51 118.40 3giq n ALA 179 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3giq n ALA 179 Cb 0.38 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3giq n ALA 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3giq n GLY 180 N 1.01 0.60 3.76 0.00 0.00 -0.80 -4.83 105.19 104.93 3giq n GLY 180 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 3giq n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giq s ALA 181 N -1.56 3.08 -1.55 4.61 0.00 -0.53 -0.46 121.76 125.35 3giq s ALA 181 Ca 0.00 1.30 0.29 0.00 0.00 0.00 0.00 51.96 53.55 3giq s ALA 181 Cb 0.00 -3.53 1.20 0.00 0.00 0.00 0.00 23.12 20.79 3giq s ALA 181 CO 0.00 -1.09 1.85 1.33 0.00 0.00 0.00 175.76 177.85 3giq n VAL 182 N -0.41 0.00 -3.27 0.00 0.24 -0.17 -4.60 118.33 110.13 3giq n VAL 182 Ca 0.07 -0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.32 3giq n VAL 182 Cb 0.44 -0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.68 3giq n VAL 182 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3giq n GLY 183 N 1.31 -0.35 3.24 7.63 0.00 -1.26 -1.43 105.19 114.33 3giq n GLY 183 Ca 0.13 -1.28 -0.19 0.00 0.00 0.00 0.00 46.02 44.69 3giq n GLY 183 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3giq s PHE 184 N -2.97 1.45 0.19 1.61 -0.12 -0.16 -1.12 117.98 116.85 3giq s PHE 184 Ca 0.00 -0.52 0.10 0.00 -0.05 0.00 0.00 56.93 56.47 3giq s PHE 184 Cb 0.00 -0.77 -0.04 0.00 -0.63 0.00 0.00 43.02 41.58 3giq s PHE 184 CO 0.00 0.15 -0.19 -1.54 -0.05 0.00 0.00 175.22 173.59 3giq s SER 185 N -2.29 3.72 0.12 1.98 1.04 -0.22 -1.37 113.70 116.67 3giq s SER 185 Ca 0.07 -0.76 0.09 0.00 0.48 0.00 0.00 55.95 55.83 3giq s SER 185 Cb -0.06 -0.42 -0.04 0.00 0.10 0.00 0.00 66.02 65.60 3giq s SER 185 CO 0.03 0.12 -0.22 0.42 0.98 0.00 0.00 173.24 174.57 3giq s THR 186 N -1.66 1.88 -0.53 2.02 -4.23 -0.39 -0.60 115.64 112.12 3giq s THR 186 Ca 0.22 -1.63 0.06 0.00 -1.18 0.00 0.00 61.69 59.16 3giq s THR 186 Cb -0.08 -1.70 0.23 0.00 1.34 0.00 0.00 72.50 72.29 3giq s THR 186 CO 0.12 -0.04 0.60 0.61 -0.54 0.00 0.00 174.62 175.37 3giq n GLY 187 N 0.97 3.77 0.12 3.99 0.00 -1.23 -0.93 105.19 111.88 3giq n GLY 187 Ca -0.19 -2.18 0.11 0.00 0.00 0.00 0.00 46.02 43.77 3giq n GLY 187 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3giq n LEU 188 N 1.35 0.57 -0.46 0.99 4.77 -0.66 -1.68 117.00 121.88 3giq n LEU 188 Ca 0.26 0.67 0.13 0.00 -0.03 0.00 0.00 56.01 57.04 3giq n LEU 188 Cb 0.45 -0.64 0.38 0.00 -2.33 0.00 0.00 43.42 41.29 3giq n LEU 188 CO 0.28 -0.64 0.72 0.00 -1.33 0.00 0.00 177.39 176.42 3giq n ALA 189 N -1.75 2.81 -2.46 -1.18 0.00 -1.22 -3.93 120.51 112.79 3giq n ALA 189 Ca 0.01 -0.48 -0.23 0.00 0.00 0.00 0.00 53.44 52.74 3giq n ALA 189 Cb 0.16 -1.08 -0.10 0.00 0.00 0.00 0.00 19.45 18.43 3giq n ALA 189 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3giq s TYR 190 N -2.21 2.19 0.25 0.00 2.02 -0.68 -4.96 117.35 113.97 3giq s TYR 190 Ca 0.31 -0.42 -0.17 0.00 -0.37 0.00 0.00 57.07 56.42 3giq s TYR 190 Cb 0.20 -1.02 -0.08 0.00 -0.40 0.00 0.00 41.96 40.66 3giq s TYR 190 CO 0.41 0.61 0.72 -0.65 -1.57 0.00 0.00 175.55 175.07 3giq s GLN 191 N -3.56 4.14 0.00 -0.62 -1.52 -1.26 -0.46 119.66 116.38 3giq s GLN 191 Ca 0.29 0.76 0.25 0.00 -1.95 0.00 0.00 55.36 54.71 3giq s GLN 191 Cb -0.03 -2.71 0.51 0.00 -0.22 0.00 0.00 33.01 30.56 3giq s GLN 191 CO 0.14 0.31 1.42 -0.35 -0.25 0.00 0.00 175.29 176.56 3giq n PRO 192 N 0.31 0.01 -0.24 2.91 -0.04 -1.26 -4.75 135.00 131.95 3giq n PRO 192 Ca -0.00 0.00 0.22 0.00 -0.04 0.00 0.00 63.50 63.68 3giq n PRO 192 Cb 0.52 -1.51 0.57 0.00 -0.04 0.00 0.00 33.50 33.04 3giq n PRO 192 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3giq h GLY 193 N 4.98 0.69 1.85 0.55 0.00 -1.69 -0.82 103.07 108.63 3giq h GLY 193 Ca 0.00 -0.14 0.01 0.00 0.00 0.00 0.00 47.33 47.20 3giq h GLY 193 CO 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 176.54 176.58 3giq h ALA 194 N 1.60 1.33 0.00 3.60 0.00 -0.89 -1.26 119.26 123.64 3giq h ALA 194 Ca 0.47 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.31 3giq h ALA 194 Cb 1.35 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 3giq h ALA 194 CO -0.15 -0.08 -0.32 0.28 0.00 0.00 0.00 179.25 178.98 3giq h VAL 195 N 0.00 0.70 -3.93 0.00 2.07 -1.42 -3.46 116.25 110.21 3giq h VAL 195 Ca 0.01 -1.48 -0.54 0.00 0.82 0.00 0.00 66.70 65.52 3giq h VAL 195 Cb 0.14 1.97 0.10 0.00 -1.52 0.00 0.00 31.29 31.98 3giq h VAL 195 CO -0.00 0.32 0.75 0.00 0.02 0.00 0.00 177.57 178.66 3giq s ALA 196 N -3.47 3.56 0.45 1.67 0.00 -0.48 -4.93 121.76 118.56 3giq s ALA 196 Ca 0.01 1.52 0.07 0.00 0.00 0.00 0.00 51.96 53.57 3giq s ALA 196 Cb 0.10 -3.59 -0.00 0.00 0.00 0.00 0.00 23.12 19.63 3giq s ALA 196 CO 0.68 -0.99 0.40 -0.65 0.00 0.00 0.00 175.76 175.20 3giq s GLN 197 N -2.05 2.44 0.21 0.00 -0.21 -1.26 -4.98 119.66 113.82 3giq s GLN 197 Ca 0.52 -1.67 -0.13 0.00 0.02 0.00 0.00 55.36 54.11 3giq s GLN 197 Cb -0.45 -2.31 0.25 0.00 1.00 0.00 0.00 33.01 31.50 3giq s GLN 197 CO 0.61 -0.33 1.63 0.00 -2.12 0.00 0.00 175.29 175.08 3giq h ALA 198 N 0.93 0.45 -0.76 6.09 0.00 -1.99 -2.03 119.26 121.94 3giq h ALA 198 Ca -0.40 0.25 0.11 0.00 0.00 0.00 0.00 54.91 54.87 3giq h ALA 198 Cb 1.27 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 19.46 3giq h ALA 198 CO 0.57 -0.42 0.38 0.00 0.00 0.00 0.00 179.25 179.78 3giq h ALA 199 N 1.64 1.08 -0.21 0.00 0.00 -1.98 0.21 119.26 120.00 3giq h ALA 199 Ca 0.31 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 3giq h ALA 199 Cb 0.49 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3giq h ALA 199 CO -0.65 -0.05 0.08 1.49 0.00 0.00 0.00 179.25 180.11 3giq h GLU 200 N 0.62 0.32 -0.34 0.00 4.81 -1.77 -1.26 114.58 116.96 3giq h GLU 200 Ca 0.39 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.41 3giq h GLU 200 Cb 0.46 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 3giq h GLU 200 CO -0.30 0.39 -0.37 -0.07 -0.73 0.00 0.00 179.01 177.93 3giq h LEU 201 N 0.18 0.83 -0.96 1.64 3.38 -1.12 -2.91 115.31 116.35 3giq h LEU 201 Ca 0.07 -0.37 -0.09 0.00 0.09 0.00 0.00 57.88 57.58 3giq h LEU 201 Cb 0.19 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3giq h LEU 201 CO -0.00 1.11 -0.24 -0.33 0.09 0.00 0.00 178.44 179.06 3giq h GLU 202 N 0.65 0.47 -0.56 1.13 5.08 -0.55 -0.65 114.58 120.14 3giq h GLU 202 Ca 0.06 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 3giq h GLU 202 Cb 0.92 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 3giq h GLU 202 CO 0.08 0.68 0.26 0.78 -1.00 0.00 0.00 179.01 179.82 3giq h GLY 203 N 1.01 0.87 1.37 -3.84 0.00 -1.09 -0.28 103.07 101.11 3giq h GLY 203 Ca 0.06 -0.43 -0.16 0.00 0.00 0.00 0.00 47.33 46.80 3giq h GLY 203 CO 0.05 0.41 -0.49 1.41 0.00 0.00 0.00 176.54 177.92 3giq h LEU 204 N 0.76 0.73 -1.24 3.11 3.38 -1.32 -3.00 115.31 117.73 3giq h LEU 204 Ca 0.19 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 3giq h LEU 204 Cb 0.13 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3giq h LEU 204 CO -0.02 1.10 0.07 0.00 0.09 0.00 0.00 178.44 179.67 3giq h ALA 205 N 0.92 1.39 -0.70 1.53 0.00 -0.75 -2.33 119.26 119.32 3giq h ALA 205 Ca 0.02 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 3giq h ALA 205 Cb 1.04 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 3giq h ALA 205 CO 0.10 0.44 0.15 0.00 0.00 0.00 0.00 179.25 179.93 3giq h ARG 206 N 0.57 1.13 -0.33 0.00 3.08 -0.91 0.27 114.38 118.20 3giq h ARG 206 Ca 0.13 -0.28 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 3giq h ARG 206 Cb 0.26 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 3giq h ARG 206 CO 0.00 1.01 0.14 0.28 -1.07 0.00 0.00 179.97 180.33 3giq h VAL 207 N 1.07 1.18 -0.29 2.04 2.07 -1.38 -1.38 116.25 119.57 3giq h VAL 207 Ca 0.22 -0.54 -0.04 0.00 0.82 0.00 0.00 66.70 67.16 3giq h VAL 207 Cb 0.40 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3giq h VAL 207 CO 0.01 0.19 0.04 0.00 0.02 0.00 0.00 177.57 177.83 3giq h ALA 208 N 0.98 0.38 -0.85 1.67 0.00 -1.27 -3.07 119.26 117.11 3giq h ALA 208 Ca 0.11 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.87 3giq h ALA 208 Cb 0.17 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 3giq h ALA 208 CO -0.01 0.08 0.54 0.00 0.00 0.00 0.00 179.25 179.85 3giq h ALA 209 N 0.87 1.14 -0.32 0.00 0.00 -0.82 0.19 119.26 120.32 3giq h ALA 209 Ca 0.09 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3giq h ALA 209 Cb 0.35 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3giq h ALA 209 CO 0.01 0.32 0.22 1.49 0.00 0.00 0.00 179.25 181.29 3giq h GLU 210 N 1.01 0.16 -0.47 0.00 4.57 -1.16 -0.83 114.58 117.87 3giq h GLU 210 Ca 0.35 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 3giq h GLU 210 Cb 0.09 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 3giq h GLU 210 CO -0.14 0.10 0.00 0.54 -1.18 0.00 0.00 179.01 178.33 3giq n ARG 211 N -4.47 3.36 -3.70 1.92 1.74 -0.66 -4.96 116.66 109.89 3giq n ARG 211 Ca 0.04 -2.68 -0.22 0.00 -0.77 0.00 0.00 57.85 54.21 3giq n ARG 211 Cb 0.28 -1.74 0.04 0.00 -1.02 0.00 0.00 32.46 30.02 3giq n ARG 211 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3giq n ARG 212 N 0.52 -5.26 -4.25 5.56 1.74 -0.32 -5.00 116.66 109.66 3giq n ARG 212 Ca 0.21 0.65 -0.27 0.00 -0.77 0.00 0.00 57.85 57.67 3giq n ARG 212 Cb 0.79 -5.31 -0.06 0.00 -1.02 0.00 0.00 32.46 26.86 3giq n ARG 212 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3giq s ARG 213 N -6.01 2.20 0.34 5.56 1.81 0.58 -5.00 118.95 118.43 3giq s ARG 213 Ca 0.10 -2.02 0.04 0.00 -1.72 0.00 0.00 55.73 52.14 3giq s ARG 213 Cb -0.05 -1.88 -0.02 0.00 -0.45 0.00 0.00 34.95 32.55 3giq s ARG 213 CO 0.80 -0.27 0.50 -0.51 -0.68 0.00 0.00 175.30 175.14 3giq s LEU 214 N -3.96 4.00 -0.25 2.53 1.43 -0.51 -4.09 118.68 117.83 3giq s LEU 214 Ca 0.32 0.07 -0.00 0.00 -1.03 0.00 0.00 54.13 53.48 3giq s LEU 214 Cb 0.03 -2.95 0.07 0.00 0.03 0.00 0.00 46.19 43.37 3giq s LEU 214 CO 0.18 -0.38 0.02 -2.28 0.23 0.00 0.00 176.35 174.12 3giq s HIS 215 N -2.23 1.96 -0.11 0.29 5.65 -0.86 -0.99 115.29 119.00 3giq s HIS 215 Ca 0.42 -1.61 -0.05 0.00 0.25 0.00 0.00 55.06 54.08 3giq s HIS 215 Cb -0.09 -1.57 -0.04 0.00 -1.18 0.00 0.00 32.58 29.70 3giq s HIS 215 CO 0.33 -0.77 0.07 0.95 -0.65 0.00 0.00 174.74 174.67 3giq s THR 216 N 1.54 4.93 -0.01 0.89 -4.23 -0.47 -1.64 115.64 116.64 3giq s THR 216 Ca 0.01 -0.01 0.01 0.00 -1.18 0.00 0.00 61.69 60.52 3giq s THR 216 Cb -0.18 -3.13 0.00 0.00 1.34 0.00 0.00 72.50 70.54 3giq s THR 216 CO -0.12 0.60 -0.04 -0.55 -0.54 0.00 0.00 174.62 173.97 3giq s SER 217 N -0.81 0.62 -0.50 3.99 0.15 0.26 -1.26 113.70 116.15 3giq s SER 217 Ca 0.13 -0.09 -0.18 0.00 0.70 0.00 0.00 55.95 56.52 3giq s SER 217 Cb -0.12 -0.15 0.07 0.00 -1.71 0.00 0.00 66.02 64.11 3giq s SER 217 CO 0.03 0.02 0.54 -2.28 1.20 0.00 0.00 173.24 172.75 3giq s HIS 218 N 0.20 3.13 1.06 3.44 2.46 -0.11 -0.86 115.29 124.60 3giq s HIS 218 Ca -0.02 -0.74 -0.12 0.00 0.47 0.00 0.00 55.06 54.66 3giq s HIS 218 Cb -0.06 -3.43 0.22 0.00 -0.13 0.00 0.00 32.58 29.19 3giq s HIS 218 CO -0.00 -0.96 1.07 0.96 -2.47 0.00 0.00 174.74 173.35 3giq s ILE 219 N 2.22 2.08 0.30 0.89 -4.36 -1.26 -1.65 121.20 119.41 3giq s ILE 219 Ca 0.10 0.03 0.04 0.00 -0.26 0.00 0.00 60.65 60.56 3giq s ILE 219 Cb -0.22 -2.09 0.30 0.00 1.25 0.00 0.00 42.46 41.69 3giq s ILE 219 CO 0.09 -0.03 1.82 -0.09 0.24 0.00 0.00 174.94 176.97 3giq h ARG 220 N -2.29 0.84 -2.50 0.37 2.43 -1.82 -3.24 114.38 108.17 3giq h ARG 220 Ca -0.54 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 58.49 3giq h ARG 220 Cb 1.31 -0.19 -0.23 0.00 -0.42 0.00 0.00 29.97 30.43 3giq h ARG 220 CO 0.47 0.56 -0.14 1.21 -1.51 0.00 0.00 179.97 180.57 3giq s ASN 221 N -5.61 -0.55 -0.16 -3.80 3.84 -1.26 -3.82 114.94 103.59 3giq s ASN 221 Ca -0.11 1.03 0.18 0.00 0.21 0.00 0.00 52.86 54.16 3giq s ASN 221 Cb 0.23 1.02 0.41 0.00 -0.55 0.00 0.00 41.25 42.37 3giq s ASN 221 CO 0.80 -0.18 1.29 -0.62 -2.79 0.00 0.00 177.10 175.60 3giq n GLU 222 N 3.04 2.09 0.00 0.43 1.02 -1.26 -3.41 120.64 122.55 3giq n GLU 222 Ca -0.15 -2.73 0.00 0.00 -0.02 0.00 0.00 57.16 54.26 3giq n GLU 222 Cb 0.56 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 3giq n GLU 222 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3giq n ALA 223 N -0.98 0.00 -0.03 0.62 0.00 -1.26 -0.40 120.51 118.46 3giq n ALA 223 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.74 3giq n ALA 223 Cb 0.77 0.00 0.52 0.00 0.00 0.00 0.00 19.45 20.75 3giq n ALA 223 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3giq h ASP 224 N 0.00 0.30 -0.63 0.00 5.19 -1.92 -2.13 116.42 117.23 3giq h ASP 224 Ca 0.00 0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 56.25 3giq h ASP 224 Cb 0.00 -0.06 -0.10 0.00 0.18 0.00 0.00 39.33 39.35 3giq h ASP 224 CO 0.00 0.19 0.19 0.61 -3.12 0.00 0.00 179.24 177.11 3giq n GLY 225 N -1.53 3.77 0.32 2.75 0.00 -1.26 -4.66 105.19 104.58 3giq n GLY 225 Ca 0.08 -1.02 -0.03 0.00 0.00 0.00 0.00 46.02 45.04 3giq n GLY 225 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3giq h VAL 226 N 2.52 1.19 -0.41 1.61 3.04 -1.40 -0.44 116.25 122.37 3giq h VAL 226 Ca 0.21 -0.37 -0.03 0.00 -1.01 0.00 0.00 66.70 65.49 3giq h VAL 226 Cb 2.14 0.01 -0.02 0.00 -2.01 0.00 0.00 31.29 31.41 3giq h VAL 226 CO 0.63 0.20 0.12 -0.33 -1.01 0.00 0.00 177.57 177.18 3giq h GLU 227 N 1.09 0.63 -0.32 4.17 5.08 -1.84 -1.03 114.58 122.37 3giq h GLU 227 Ca 0.31 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.45 3giq h GLU 227 Cb -0.10 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 3giq h GLU 227 CO -0.08 0.63 -0.15 0.00 -1.00 0.00 0.00 179.01 178.42 3giq h ALA 228 N 0.97 1.15 -0.64 3.43 0.00 -1.86 -1.50 119.26 120.81 3giq h ALA 228 Ca 0.13 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 3giq h ALA 228 Cb 0.27 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3giq h ALA 228 CO -0.00 0.54 0.10 0.00 0.00 0.00 0.00 179.25 179.88 3giq h ALA 229 N 1.33 0.85 -0.32 0.00 0.00 -0.72 0.36 119.26 120.76 3giq h ALA 229 Ca 0.09 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 3giq h ALA 229 Cb 0.55 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3giq h ALA 229 CO 0.04 0.61 -0.09 0.28 0.00 0.00 0.00 179.25 180.08 3giq h VAL 230 N 0.97 1.28 -0.96 0.00 2.07 -0.97 -2.93 116.25 115.71 3giq h VAL 230 Ca 0.19 -1.15 0.05 0.00 0.82 0.00 0.00 66.70 66.61 3giq h VAL 230 Cb 0.43 1.37 -0.06 0.00 -1.52 0.00 0.00 31.29 31.51 3giq h VAL 230 CO 0.01 0.37 0.63 -0.08 0.02 0.00 0.00 177.57 178.52 3giq h GLU 231 N 0.40 1.13 -0.18 1.57 4.57 -1.00 -1.53 114.58 119.54 3giq h GLU 231 Ca 0.08 -0.07 0.01 0.00 -1.18 0.00 0.00 59.36 58.21 3giq h GLU 231 Cb 0.59 -0.26 -0.02 0.00 -0.16 0.00 0.00 28.75 28.91 3giq h GLU 231 CO 0.03 0.75 0.07 1.49 -1.18 0.00 0.00 179.01 180.17 3giq h GLU 232 N 1.17 0.15 0.00 1.92 4.81 -0.75 0.27 114.58 122.15 3giq h GLU 232 Ca 0.39 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.52 3giq h GLU 232 Cb 0.08 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 3giq h GLU 232 CO -0.13 0.10 -0.47 -0.39 -0.73 0.00 0.00 179.01 177.39 3giq h VAL 233 N 0.16 0.95 -0.12 0.32 -1.51 -1.38 -2.81 116.25 111.85 3giq h VAL 233 Ca 0.07 -1.88 -0.17 0.00 -1.23 0.00 0.00 66.70 63.49 3giq h VAL 233 Cb 0.04 2.15 -0.00 0.00 -2.13 0.00 0.00 31.29 31.34 3giq h VAL 233 CO -0.07 0.46 -0.65 -0.07 -1.23 0.00 0.00 177.57 176.00 3giq h LEU 234 N 0.00 0.55 -1.15 4.19 3.38 -1.02 -2.42 115.31 118.84 3giq h LEU 234 Ca -0.00 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.60 3giq h LEU 234 Cb 1.11 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 3giq h LEU 234 CO 0.06 1.06 0.22 0.00 0.09 0.00 0.00 178.44 179.86 3giq h ALA 235 N 0.94 1.33 -0.30 1.53 0.00 -0.78 0.17 119.26 122.15 3giq h ALA 235 Ca -0.02 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 3giq h ALA 235 Cb 1.21 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3giq h ALA 235 CO 0.12 0.50 0.02 0.82 0.00 0.00 0.00 179.25 180.70 3giq h ILE 236 N 0.80 1.25 -0.68 0.00 2.04 -1.33 -1.03 117.51 118.57 3giq h ILE 236 Ca 0.19 -0.90 -0.06 0.00 1.00 0.00 0.00 64.86 65.09 3giq h ILE 236 Cb 0.17 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 3giq h ILE 236 CO -0.02 0.29 0.19 1.23 0.00 0.00 0.00 178.15 179.85 3giq h GLY 237 N 0.33 1.15 0.92 5.37 0.00 -0.90 -1.26 103.07 108.68 3giq h GLY 237 Ca 0.09 -0.70 -0.03 0.00 0.00 0.00 0.00 47.33 46.69 3giq h GLY 237 CO 0.01 0.65 0.12 3.21 0.00 0.00 0.00 176.54 180.53 3giq h ARG 238 N 1.00 0.54 0.00 4.80 3.08 -0.58 0.73 114.38 123.96 3giq h ARG 238 Ca 0.22 -0.11 -0.07 0.00 0.07 0.00 0.00 59.98 60.09 3giq h ARG 238 Cb 0.33 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3giq h ARG 238 CO -0.00 0.56 -0.32 0.78 -1.07 0.00 0.00 179.97 179.92 3giq h GLY 239 N 0.42 0.00 0.00 0.04 0.00 -1.06 -3.33 103.07 99.14 3giq h GLY 239 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 3giq h GLY 239 CO -0.01 0.00 -0.98 -1.30 0.00 0.00 0.00 176.54 174.26 3giq n THR 240 N -3.31 0.00 -1.00 4.70 -2.24 -0.49 -5.00 114.28 106.95 3giq n THR 240 Ca 0.01 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3giq n THR 240 Cb 0.56 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 3giq n THR 240 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3giq n GLY 241 N 1.74 0.51 3.70 3.38 0.00 0.25 -4.88 105.19 109.91 3giq n GLY 241 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3giq n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giq n ALA 243 N 4.55 2.15 -2.56 0.00 0.00 -1.26 -4.57 120.51 118.82 3giq n ALA 243 Ca 0.12 0.38 -0.23 0.00 0.00 0.00 0.00 53.44 53.71 3giq n ALA 243 Cb 0.44 -2.41 -0.14 0.00 0.00 0.00 0.00 19.45 17.34 3giq n ALA 243 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3giq s THR 244 N -0.02 1.42 -0.08 0.00 2.01 0.11 -2.04 115.64 117.05 3giq s THR 244 Ca 0.65 -1.15 0.01 0.00 0.31 0.00 0.00 61.69 61.51 3giq s THR 244 Cb -0.54 -1.26 0.02 0.00 0.01 0.00 0.00 72.50 70.73 3giq s THR 244 CO 0.49 0.08 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.72 3giq s VAL 245 N -0.87 0.97 -0.50 3.82 1.01 -0.65 -1.06 120.40 123.12 3giq s VAL 245 Ca 0.05 -0.33 -0.21 0.00 0.00 0.00 0.00 61.98 61.49 3giq s VAL 245 Cb -0.09 -0.95 0.05 0.00 0.00 0.00 0.00 36.38 35.39 3giq s VAL 245 CO 0.02 0.34 0.72 -0.69 0.00 0.00 0.00 175.10 175.48 3giq s VAL 246 N 1.16 4.73 0.50 2.92 1.01 -0.16 -0.57 120.40 129.99 3giq s VAL 246 Ca -0.06 -0.14 -0.22 0.00 0.00 0.00 0.00 61.98 61.57 3giq s VAL 246 Cb -0.14 -4.34 -0.06 0.00 0.00 0.00 0.00 36.38 31.83 3giq s VAL 246 CO -0.02 -0.84 1.23 -0.44 0.00 0.00 0.00 175.10 175.03 3giq s SER 247 N 2.57 5.80 -0.30 3.32 0.01 -0.04 -2.72 113.70 122.33 3giq s SER 247 Ca 0.21 2.45 -0.08 0.00 1.31 0.00 0.00 55.95 59.84 3giq s SER 247 Cb -0.16 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.47 3giq s SER 247 CO 0.16 -1.18 0.17 0.00 0.41 0.00 0.00 173.24 172.79 3giq n HIS 248 N -0.76 -0.36 -1.78 2.43 -0.00 -1.01 -4.75 115.22 108.98 3giq n HIS 248 Ca 0.09 0.03 -0.42 0.00 -0.00 0.00 0.00 57.72 57.42 3giq n HIS 248 Cb 0.47 -0.69 -0.02 0.00 -0.00 0.00 0.00 29.99 29.75 3giq n HIS 248 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 3giq s HIS 249 N -4.39 2.81 0.23 -1.40 5.04 -0.50 -4.96 115.29 112.12 3giq s HIS 249 Ca 0.11 0.70 -0.22 0.00 -1.54 0.00 0.00 55.06 54.11 3giq s HIS 249 Cb -0.06 -4.07 0.06 0.00 0.04 0.00 0.00 32.58 28.55 3giq s HIS 249 CO 0.25 -3.69 0.90 -1.59 -2.34 0.00 0.00 174.74 168.26 3giq s LYS 250 N -0.10 1.55 -0.19 2.88 -2.85 -1.26 -4.84 119.74 114.93 3giq s LYS 250 Ca 0.66 -0.93 -0.02 0.00 -1.00 0.00 0.00 55.97 54.68 3giq s LYS 250 Cb -0.48 0.48 0.06 0.00 -2.06 0.00 0.00 37.83 35.83 3giq s LYS 250 CO 0.44 -0.72 0.02 0.00 0.10 0.00 0.00 175.35 175.19 3giq s MET 252 N 1.80 3.74 0.00 0.00 -1.94 0.46 -4.50 119.30 118.86 3giq s MET 252 Ca -0.01 0.15 0.00 0.00 -1.71 0.00 0.00 55.69 54.12 3giq s MET 252 Cb -0.17 -3.03 0.00 0.00 2.01 0.00 0.00 34.83 33.64 3giq s MET 252 CO -0.08 0.59 0.00 -1.33 -0.01 0.00 0.00 175.02 174.19 3giq n MET 253 N 1.02 0.00 -0.34 2.03 2.81 0.15 -4.38 117.12 118.40 3giq n MET 253 Ca -0.09 0.00 0.22 0.00 -1.81 0.00 0.00 57.70 56.02 3giq n MET 253 Cb 0.52 0.00 0.45 0.00 -0.71 0.00 0.00 33.22 33.49 3giq n MET 253 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 3giq h PRO 254 N 0.00 0.42 0.00 0.03 0.11 -1.92 0.10 132.00 130.74 3giq h PRO 254 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 3giq h PRO 254 Cb 0.00 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.02 3giq h PRO 254 CO 0.00 0.28 0.00 0.00 -0.21 0.00 0.00 178.00 178.07 3giq n GLN 255 N -4.89 0.07 0.00 1.05 0.00 -1.26 -2.52 117.38 109.83 3giq n GLN 255 Ca 0.29 0.38 0.05 0.00 0.00 0.00 0.00 57.00 57.72 3giq n GLN 255 Cb 0.89 -1.66 0.00 0.00 0.00 0.00 0.00 30.24 29.48 3giq n GLN 255 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 3giq n ASN 256 N -1.80 1.27 -4.72 2.61 5.03 0.34 -5.00 115.26 112.99 3giq n ASN 256 Ca 0.02 -1.14 -0.42 0.00 0.87 0.00 0.00 54.58 53.92 3giq n ASN 256 Cb 0.15 0.42 -0.03 0.00 -1.02 0.00 0.00 39.78 39.30 3giq n ASN 256 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 3giq s TRP 257 N -1.29 2.91 0.00 3.10 0.51 -1.05 -1.93 118.94 121.19 3giq s TRP 257 Ca 0.09 0.42 0.00 0.00 -2.12 0.00 0.00 56.10 54.49 3giq s TRP 257 Cb 0.08 -4.07 0.00 0.00 -0.81 0.00 0.00 33.47 28.67 3giq s TRP 257 CO 0.24 -4.03 0.00 0.41 -0.51 0.00 0.00 176.95 173.05 3giq n GLY 258 N 3.92 0.98 0.00 0.98 0.00 -1.26 -4.94 105.19 104.87 3giq n GLY 258 Ca 0.15 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.23 3giq n GLY 258 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3giq n ARG 259 N -1.69 0.07 0.31 1.61 1.74 -0.81 -2.27 116.66 115.62 3giq n ARG 259 Ca 0.00 0.25 0.20 0.00 -0.77 0.00 0.00 57.85 57.53 3giq n ARG 259 Cb 0.00 -1.50 0.95 0.00 -1.02 0.00 0.00 32.46 30.89 3giq n ARG 259 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3giq h SER 260 N 0.00 0.00 -0.38 0.55 4.64 -1.92 -1.43 113.55 115.00 3giq h SER 260 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3giq h SER 260 Cb 0.17 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 3giq h SER 260 CO 0.00 0.00 0.22 -0.09 -0.87 0.00 0.00 176.83 176.09 3giq h ARG 261 N 0.00 0.53 -0.12 4.77 9.65 -1.88 -0.17 114.38 127.16 3giq h ARG 261 Ca -0.00 -0.06 -0.12 0.00 -1.10 0.00 0.00 59.98 58.70 3giq h ARG 261 Cb 0.26 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.74 3giq h ARG 261 CO 0.00 0.42 -0.41 0.00 2.80 0.00 0.00 179.97 182.78 3giq h ALA 262 N 1.08 0.22 -0.49 2.80 0.00 -1.52 -2.58 119.26 118.78 3giq h ALA 262 Ca 0.14 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 3giq h ALA 262 Cb 0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3giq h ALA 262 CO -0.02 0.33 0.10 1.79 0.00 0.00 0.00 179.25 181.45 3giq h THR 263 N 0.10 1.24 -0.07 0.00 1.35 -1.30 -1.58 112.91 112.65 3giq h THR 263 Ca -0.02 -0.88 -0.09 0.00 -0.55 0.00 0.00 66.41 64.88 3giq h THR 263 Cb 1.03 0.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.32 3giq h THR 263 CO 0.09 0.31 -0.36 -0.07 -0.25 0.00 0.00 175.52 175.24 3giq h LEU 264 N 0.67 0.14 -0.62 3.87 3.38 -1.11 -0.73 115.31 120.91 3giq h LEU 264 Ca 0.15 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 3giq h LEU 264 Cb 0.36 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3giq h LEU 264 CO 0.01 0.50 -0.29 0.00 0.09 0.00 0.00 178.44 178.75 3giq h ALA 265 N 1.51 0.80 -0.30 1.53 0.00 -1.15 -0.13 119.26 121.53 3giq h ALA 265 Ca 0.01 -0.40 -0.09 0.00 0.00 0.00 0.00 54.91 54.44 3giq h ALA 265 Cb 0.70 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3giq h ALA 265 CO 0.05 0.65 -0.15 -0.97 0.00 0.00 0.00 179.25 178.83 3giq h ASN 266 N 0.67 0.64 -0.85 0.00 -0.73 -0.83 -0.85 115.58 113.63 3giq h ASN 266 Ca 0.08 -0.41 0.05 0.00 1.87 0.00 0.00 56.30 57.89 3giq h ASN 266 Cb 0.82 -0.18 -0.06 0.00 0.27 0.00 0.00 38.32 39.17 3giq h ASN 266 CO 0.07 0.91 0.54 0.40 -0.37 0.00 0.00 177.43 178.98 3giq h ILE 267 N 0.38 1.08 -0.48 2.57 2.04 -0.96 -1.10 117.51 121.04 3giq h ILE 267 Ca 0.07 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.55 3giq h ILE 267 Cb 0.67 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 3giq h ILE 267 CO 0.04 0.18 0.18 0.44 0.00 0.00 0.00 178.15 179.00 3giq h ASP 268 N 1.01 0.68 -0.76 1.72 3.32 -0.66 -1.55 116.42 120.17 3giq h ASP 268 Ca 0.36 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.24 3giq h ASP 268 Cb 0.10 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 3giq h ASP 268 CO -0.15 0.67 0.51 0.03 -1.72 0.00 0.00 179.24 178.58 3giq h ARG 269 N 0.64 0.98 -0.15 3.56 3.08 -0.41 -0.60 114.38 121.48 3giq h ARG 269 Ca 0.16 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 3giq h ARG 269 Cb 0.22 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3giq h ARG 269 CO -0.01 0.65 -0.02 0.00 -1.07 0.00 0.00 179.97 179.52 3giq h ALA 270 N 1.53 0.21 0.00 0.04 0.00 -0.77 -2.67 119.26 117.60 3giq h ALA 270 Ca 0.29 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3giq h ALA 270 Cb -0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3giq h ALA 270 CO -0.07 -0.07 -0.19 0.07 0.00 0.00 0.00 179.25 179.00 3giq h ARG 271 N -0.00 0.00 0.00 0.00 0.11 -1.01 -1.94 114.38 111.55 3giq h ARG 271 Ca 0.04 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.03 3giq h ARG 271 Cb 0.41 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.48 3giq h ARG 271 CO 0.01 0.19 -0.41 0.93 0.10 0.00 0.00 179.97 180.79 3giq h GLU 272 N 0.00 0.00 -0.00 0.08 5.08 -1.00 -2.62 114.58 116.12 3giq h GLU 272 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3giq h GLU 272 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 3giq h GLU 272 CO 0.02 0.41 -0.06 1.04 -1.00 0.00 0.00 179.01 179.43 3giq n GLN 273 N -3.78 0.84 0.00 2.33 6.02 -0.76 -4.91 117.38 117.12 3giq n GLN 273 Ca -0.01 -0.24 0.00 0.00 -0.01 0.00 0.00 57.00 56.74 3giq n GLN 273 Cb 0.48 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.25 3giq n GLN 273 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3giq n GLY 274 N 1.20 0.66 3.72 1.08 0.00 -0.99 -5.08 105.19 105.79 3giq n GLY 274 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3giq n GLY 274 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3giq s VAL 275 N -2.00 4.61 -0.38 1.61 1.01 -1.04 -4.99 120.40 119.23 3giq s VAL 275 Ca 0.00 2.07 -0.29 0.00 0.00 0.00 0.00 61.98 63.76 3giq s VAL 275 Cb 0.00 -4.32 0.02 0.00 0.00 0.00 0.00 36.38 32.08 3giq s VAL 275 CO 0.00 0.27 1.09 -1.61 0.00 0.00 0.00 175.10 174.85 3giq s GLU 276 N 0.31 3.93 -0.02 2.72 2.02 -1.26 -3.84 118.70 122.56 3giq s GLU 276 Ca 0.49 0.87 0.02 0.00 0.02 0.00 0.00 54.97 56.36 3giq s GLU 276 Cb -0.23 -3.80 0.01 0.00 0.10 0.00 0.00 34.13 30.21 3giq s GLU 276 CO 0.29 -1.08 -0.07 0.54 0.02 0.00 0.00 175.26 174.97 3giq s VAL 277 N 3.93 0.62 0.30 2.63 0.11 -1.26 0.05 120.40 126.79 3giq s VAL 277 Ca 0.46 -0.27 0.06 0.00 -2.93 0.00 0.00 61.98 59.30 3giq s VAL 277 Cb -0.10 -0.57 -0.02 0.00 -1.53 0.00 0.00 36.38 34.16 3giq s VAL 277 CO 0.21 0.21 0.27 0.00 -3.33 0.00 0.00 175.10 172.46 3giq n ALA 278 N 3.37 0.52 -3.64 1.54 0.00 -0.22 -4.92 120.51 117.16 3giq n ALA 278 Ca -0.19 -1.69 -0.09 0.00 0.00 0.00 0.00 53.44 51.47 3giq n ALA 278 Cb 0.54 1.37 -0.00 0.00 0.00 0.00 0.00 19.45 21.36 3giq n ALA 278 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 3giq s LEU 279 N 0.00 0.11 0.11 0.00 2.34 -0.80 -0.98 118.68 119.45 3giq s LEU 279 Ca 0.34 -1.04 -0.14 0.00 0.06 0.00 0.00 54.13 53.35 3giq s LEU 279 Cb 0.01 2.53 0.03 0.00 -0.56 0.00 0.00 46.19 48.20 3giq s LEU 279 CO 0.24 -1.50 0.35 1.51 -1.06 0.00 0.00 176.35 175.89 3giq s ASP 280 N -3.05 -0.15 0.13 1.48 1.47 -1.10 -0.36 116.67 115.09 3giq s ASP 280 Ca 0.17 -0.39 -0.09 0.00 1.18 0.00 0.00 52.55 53.42 3giq s ASP 280 Cb -0.04 0.44 -0.01 0.00 -0.34 0.00 0.00 42.92 42.97 3giq s ASP 280 CO 0.11 -0.81 0.24 0.27 0.68 0.00 0.00 175.17 175.66 3giq s ILE 281 N -3.77 0.10 0.01 2.11 -5.25 -0.95 -1.41 121.20 112.03 3giq s ILE 281 Ca 0.03 -1.31 0.05 0.00 -0.99 0.00 0.00 60.65 58.43 3giq s ILE 281 Cb 0.02 -1.63 -0.03 0.00 2.95 0.00 0.00 42.46 43.77 3giq s ILE 281 CO -0.11 -0.45 -0.13 -0.72 -1.79 0.00 0.00 174.94 171.74 3giq s TYR 282 N -3.92 2.72 -0.64 1.37 -0.85 -1.23 -1.44 117.35 113.35 3giq s TYR 282 Ca 0.12 -0.15 -0.06 0.00 -0.52 0.00 0.00 57.07 56.46 3giq s TYR 282 Cb 0.04 -1.56 -0.14 0.00 0.38 0.00 0.00 41.96 40.68 3giq s TYR 282 CO -0.05 0.28 2.75 -0.35 -1.52 0.00 0.00 175.55 176.67 3giq n PRO 283 N 1.73 2.25 -3.84 -3.49 -0.04 -1.26 -4.86 135.00 125.49 3giq n PRO 283 Ca -0.16 -1.31 -0.12 0.00 -0.04 0.00 0.00 63.50 61.87 3giq n PRO 283 Cb 0.52 -2.26 -0.09 0.00 -0.04 0.00 0.00 33.50 31.63 3giq n PRO 283 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3giq s TYR 284 N 2.10 -0.02 -1.43 0.54 2.02 -1.26 -5.01 117.35 114.30 3giq s TYR 284 Ca 0.54 -0.04 0.11 0.00 -0.37 0.00 0.00 57.07 57.31 3giq s TYR 284 Cb 0.20 -0.00 0.42 0.00 -0.40 0.00 0.00 41.96 42.17 3giq s TYR 284 CO -0.02 -0.34 1.28 -0.35 -1.57 0.00 0.00 175.55 174.55 3giq n PRO 285 N 1.28 2.50 -4.71 -1.71 -0.04 -1.26 -4.84 135.00 126.21 3giq n PRO 285 Ca -0.22 -1.65 -0.24 0.00 -0.04 0.00 0.00 63.50 61.35 3giq n PRO 285 Cb 0.56 -1.58 -0.15 0.00 -0.04 0.00 0.00 33.50 32.29 3giq n PRO 285 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3giq s GLY 286 N -0.78 0.76 0.55 0.55 0.00 -1.26 -1.86 107.32 105.29 3giq s GLY 286 Ca 0.30 -0.64 0.09 0.00 0.00 0.00 0.00 44.72 44.47 3giq s GLY 286 CO 0.15 -0.47 0.77 -1.14 0.00 0.00 0.00 173.10 172.41 3giq n SER 287 N 2.84 1.95 -3.64 1.64 3.41 0.64 -4.85 113.62 115.61 3giq n SER 287 Ca -0.15 -2.43 -0.05 0.00 -0.26 0.00 0.00 58.87 55.97 3giq n SER 287 Cb 0.54 -0.41 -0.06 0.00 -0.26 0.00 0.00 64.21 64.02 3giq n SER 287 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3giq s SER 288 N -4.42 -0.94 0.00 4.04 0.15 -1.26 -1.10 113.70 110.17 3giq s SER 288 Ca 0.58 1.46 0.00 0.00 0.70 0.00 0.00 55.95 58.69 3giq s SER 288 Cb -0.05 1.54 0.00 0.00 -1.71 0.00 0.00 66.02 65.81 3giq s SER 288 CO 0.37 -0.22 0.00 1.07 1.20 0.00 0.00 173.24 175.65 3giq n THR 289 N 4.48 0.00 -1.53 6.45 5.66 -0.86 -5.00 114.28 123.47 3giq n THR 289 Ca -0.18 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.49 3giq n THR 289 Cb 0.57 0.00 0.08 0.00 -1.55 0.00 0.00 70.33 69.43 3giq n THR 289 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 3giq s ILE 290 N -1.94 2.83 -0.04 1.09 -4.36 -1.26 -0.75 121.20 116.78 3giq s ILE 290 Ca 0.00 0.38 -0.30 0.00 -0.26 0.00 0.00 60.65 60.47 3giq s ILE 290 Cb 0.00 -2.88 -0.03 0.00 1.25 0.00 0.00 42.46 40.80 3giq s ILE 290 CO 0.00 -0.25 1.18 -0.22 0.24 0.00 0.00 174.94 175.89 3giq s LEU 291 N -5.17 4.29 -0.36 0.37 2.96 0.22 -4.39 118.68 116.60 3giq s LEU 291 Ca 0.69 1.82 -0.02 0.00 -0.22 0.00 0.00 54.13 56.40 3giq s LEU 291 Cb -0.23 -3.56 0.09 0.00 0.50 0.00 0.00 46.19 42.98 3giq s LEU 291 CO 0.45 -0.55 0.11 -0.63 -1.32 0.00 0.00 176.35 174.41 3giq s ILE 292 N 2.02 3.04 0.43 6.68 1.01 -1.26 -4.83 121.20 128.28 3giq s ILE 292 Ca 0.56 -1.85 0.21 0.00 0.00 0.00 0.00 60.65 59.56 3giq s ILE 292 Cb -0.25 -2.99 0.41 0.00 0.01 0.00 0.00 42.46 39.64 3giq s ILE 292 CO 0.23 -0.47 1.82 -0.65 0.00 0.00 0.00 174.94 175.87 3giq h PRO 293 N 7.97 0.33 0.00 2.79 0.11 -1.91 -0.35 132.00 140.93 3giq h PRO 293 Ca -0.15 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3giq h PRO 293 Cb 1.05 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3giq h PRO 293 CO 0.61 0.22 0.00 0.93 -0.21 0.00 0.00 178.00 179.55 3giq h GLU 294 N 0.34 0.00 -0.00 1.05 3.07 -1.94 -1.04 114.58 116.05 3giq h GLU 294 Ca 0.53 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.39 3giq h GLU 294 Cb 1.45 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.36 3giq h GLU 294 CO -0.20 0.00 -0.60 0.54 -1.40 0.00 0.00 179.01 177.35 3giq n ARG 295 N -2.43 0.43 -0.13 2.33 1.74 -0.14 -4.47 116.66 113.99 3giq n ARG 295 Ca -0.02 -0.32 0.17 0.00 -0.77 0.00 0.00 57.85 56.92 3giq n ARG 295 Cb 0.05 -1.49 0.55 0.00 -1.02 0.00 0.00 32.46 30.55 3giq n ARG 295 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3giq h ALA 296 N 3.33 2.23 -0.08 7.54 0.00 -1.29 -2.02 119.26 128.96 3giq h ALA 296 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3giq h ALA 296 Cb 0.56 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3giq h ALA 296 CO 0.00 -0.42 0.00 0.39 0.00 0.00 0.00 179.25 179.22 3giq n GLU 297 N -4.45 1.99 -0.00 0.00 -0.58 -1.26 -4.46 120.64 111.87 3giq n GLU 297 Ca 0.13 -1.82 0.03 0.00 -0.42 0.00 0.00 57.16 55.09 3giq n GLU 297 Cb 0.56 -1.41 -0.04 0.00 -0.57 0.00 0.00 31.44 29.98 3giq n GLU 297 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 3giq n THR 298 N 1.20 0.00 -4.04 2.62 -2.24 -0.88 -4.97 114.28 105.97 3giq n THR 298 Ca 0.13 -0.22 -0.27 0.00 -2.27 0.00 0.00 64.05 61.42 3giq n THR 298 Cb 0.53 0.58 -0.17 0.00 -2.10 0.00 0.00 70.33 69.17 3giq n THR 298 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3giq s ILE 299 N -2.14 1.18 0.58 2.28 1.01 -0.81 -5.10 121.20 118.20 3giq s ILE 299 Ca -0.01 -0.40 -0.07 0.00 0.00 0.00 0.00 60.65 60.17 3giq s ILE 299 Cb 0.04 -1.15 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 3giq s ILE 299 CO 0.26 0.39 0.91 -1.81 0.00 0.00 0.00 174.94 174.68 3giq s ASP 300 N 1.49 5.81 -1.44 3.58 1.01 -1.26 -4.34 116.67 121.52 3giq s ASP 300 Ca 0.02 0.89 -0.03 0.00 0.71 0.00 0.00 52.55 54.14 3giq s ASP 300 Cb -0.13 -1.95 0.00 0.00 1.01 0.00 0.00 42.92 41.86 3giq s ASP 300 CO -0.07 -0.96 0.39 0.47 0.21 0.00 0.00 175.17 175.22 3giq n ASP 301 N -2.57 -5.57 -4.64 0.27 9.92 -1.26 -4.59 116.55 108.11 3giq n ASP 301 Ca 0.04 -0.19 -0.43 0.00 -0.53 0.00 0.00 54.79 53.68 3giq n ASP 301 Cb 0.57 -4.46 -0.03 0.00 -0.64 0.00 0.00 41.12 36.56 3giq n ASP 301 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3giq s ILE 302 N -3.06 3.71 -0.17 0.53 1.01 -1.26 -4.65 121.20 117.31 3giq s ILE 302 Ca 0.19 0.83 -0.06 0.00 0.00 0.00 0.00 60.65 61.61 3giq s ILE 302 Cb -0.09 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 3giq s ILE 302 CO 0.24 -0.19 0.03 -0.60 0.00 0.00 0.00 174.94 174.43 3giq s ARG 303 N 4.33 3.90 0.09 2.79 3.52 -1.00 -0.41 118.95 132.16 3giq s ARG 303 Ca 0.71 -0.39 -0.30 0.00 -0.13 0.00 0.00 55.73 55.61 3giq s ARG 303 Cb -0.28 -3.13 -0.06 0.00 -1.56 0.00 0.00 34.95 29.92 3giq s ARG 303 CO 0.28 0.27 1.16 0.42 -0.81 0.00 0.00 175.30 176.62 3giq s ILE 304 N 0.35 4.02 -0.13 4.11 -1.09 -0.13 -0.35 121.20 127.99 3giq s ILE 304 Ca 0.01 1.53 0.19 0.00 -2.23 0.00 0.00 60.65 60.15 3giq s ILE 304 Cb -0.13 -3.98 -0.27 0.00 -1.58 0.00 0.00 42.46 36.50 3giq s ILE 304 CO 0.01 0.16 0.30 0.35 -1.23 0.00 0.00 174.94 174.53 3giq n THR 305 N 3.45 0.86 -3.56 2.92 -2.24 -0.31 0.49 114.28 115.88 3giq n THR 305 Ca 0.07 -0.71 -0.07 0.00 -2.27 0.00 0.00 64.05 61.07 3giq n THR 305 Cb 0.47 -0.32 -0.02 0.00 -2.10 0.00 0.00 70.33 68.35 3giq n THR 305 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3giq s TRP 306 N -2.91 -0.24 -0.27 4.78 1.48 -1.24 -0.44 118.94 120.09 3giq s TRP 306 Ca -0.09 0.18 -0.12 0.00 -1.06 0.00 0.00 56.10 55.02 3giq s TRP 306 Cb 0.09 0.52 0.10 0.00 -1.16 0.00 0.00 33.47 33.02 3giq s TRP 306 CO 0.86 -0.35 0.62 0.45 -4.06 0.00 0.00 176.95 174.46 3giq s SER 307 N -2.18 -0.93 0.02 -2.66 0.15 -1.26 -1.33 113.70 105.52 3giq s SER 307 Ca 0.07 1.44 -0.23 0.00 0.70 0.00 0.00 55.95 57.93 3giq s SER 307 Cb -0.01 1.74 -0.16 0.00 -1.71 0.00 0.00 66.02 65.88 3giq s SER 307 CO -0.06 -0.23 1.37 0.74 1.20 0.00 0.00 173.24 176.27 3giq h THR 308 N 5.60 1.32 0.00 6.45 2.02 -1.53 -2.08 112.91 124.69 3giq h THR 308 Ca -0.24 -1.05 -0.09 0.00 0.77 0.00 0.00 66.41 65.79 3giq h THR 308 Cb 1.16 1.84 -0.01 0.00 -1.74 0.00 0.00 68.15 69.39 3giq h THR 308 CO 0.14 0.30 -0.44 1.55 0.37 0.00 0.00 175.52 177.43 3giq h PRO 309 N -0.18 0.00 -2.08 6.66 0.13 -1.80 -3.37 132.00 131.35 3giq h PRO 309 Ca 0.02 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.59 3giq h PRO 309 Cb 0.49 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.22 3giq h PRO 309 CO 0.01 0.44 -0.93 0.72 -0.23 0.00 0.00 178.00 178.01 3giq n HIS 310 N -3.34 1.31 0.26 1.56 8.25 -1.22 -4.93 115.22 117.10 3giq n HIS 310 Ca 0.01 -3.82 0.17 0.00 -0.26 0.00 0.00 57.72 53.82 3giq n HIS 310 Cb 0.63 -0.43 0.87 0.00 1.12 0.00 0.00 29.99 32.18 3giq n HIS 310 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3giq h PRO 311 N 3.77 0.00 0.00 -0.41 0.13 -1.56 -1.06 132.00 132.87 3giq h PRO 311 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3giq h PRO 311 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 3giq h PRO 311 CO 0.61 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.43 3giq h GLU 312 N 0.00 0.00 -0.00 0.86 9.09 -1.92 -3.15 114.58 119.46 3giq h GLU 312 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3giq h GLU 312 Cb 0.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.14 3giq h GLU 312 CO 0.00 0.00 -0.08 0.00 0.05 0.00 0.00 179.01 178.98 3giq s SER 314 N -2.35 6.37 0.00 0.00 0.01 -1.19 -1.43 113.70 115.11 3giq s SER 314 Ca 0.33 2.88 0.00 0.00 1.31 0.00 0.00 55.95 60.47 3giq s SER 314 Cb 0.20 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.83 3giq s SER 314 CO 0.44 -0.97 0.00 0.61 0.41 0.00 0.00 173.24 173.73 3giq n GLY 315 N 3.83 1.32 3.91 3.44 0.00 0.18 -4.99 105.19 112.89 3giq n GLY 315 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 3giq n GLY 315 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3giq s GLU 316 N -0.67 3.61 0.17 1.61 2.02 -0.51 -4.78 118.70 120.15 3giq s GLU 316 Ca 0.00 -0.02 -0.26 0.00 0.02 0.00 0.00 54.97 54.71 3giq s GLU 316 Cb 0.00 -2.62 -0.08 0.00 0.10 0.00 0.00 34.13 31.53 3giq s GLU 316 CO 0.00 0.17 0.79 0.71 0.02 0.00 0.00 175.26 176.95 3giq s TYR 317 N -2.17 3.91 0.28 1.61 2.02 -1.26 -0.96 117.35 120.78 3giq s TYR 317 Ca 0.44 1.65 0.00 0.00 -0.37 0.00 0.00 57.07 58.79 3giq s TYR 317 Cb -0.10 -2.78 0.51 0.00 -0.40 0.00 0.00 41.96 39.18 3giq s TYR 317 CO 0.32 0.51 1.85 1.25 -1.57 0.00 0.00 175.55 177.91 3giq h LEU 318 N 4.34 0.97 -0.89 -1.29 5.85 -1.09 -1.63 115.31 121.55 3giq h LEU 318 Ca -0.47 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.30 3giq h LEU 318 Cb 1.21 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 3giq h LEU 318 CO 0.66 0.55 0.59 0.00 -0.34 0.00 0.00 178.44 179.90 3giq h ALA 319 N 1.51 1.13 -0.27 1.25 0.00 -1.93 -0.35 119.26 120.61 3giq h ALA 319 Ca 0.48 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.19 3giq h ALA 319 Cb 0.38 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3giq h ALA 319 CO -0.23 0.53 -0.39 -0.44 0.00 0.00 0.00 179.25 178.71 3giq h ASP 320 N 1.21 0.66 -0.01 0.00 3.32 -1.72 -1.64 116.42 118.25 3giq h ASP 320 Ca 0.33 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 3giq h ASP 320 Cb -0.14 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.23 3giq h ASP 320 CO -0.07 0.98 0.00 0.40 -1.72 0.00 0.00 179.24 178.83 3giq h ILE 321 N 0.52 1.23 -0.95 0.35 2.04 -0.95 -1.76 117.51 117.99 3giq h ILE 321 Ca 0.05 -0.69 0.02 0.00 1.00 0.00 0.00 64.86 65.24 3giq h ILE 321 Cb 0.91 1.69 -0.05 0.00 -0.74 0.00 0.00 36.82 38.63 3giq h ILE 321 CO 0.08 0.18 0.62 0.00 0.00 0.00 0.00 178.15 179.03 3giq h ALA 322 N 0.71 1.23 -0.43 1.87 0.00 -1.04 -0.93 119.26 120.68 3giq h ALA 322 Ca 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3giq h ALA 322 Cb 0.29 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3giq h ALA 322 CO 0.00 0.54 0.20 0.00 0.00 0.00 0.00 179.25 179.99 3giq h ALA 323 N 1.37 0.55 -0.70 0.00 0.00 -1.20 0.80 119.26 120.08 3giq h ALA 323 Ca 0.37 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 3giq h ALA 323 Cb -0.06 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3giq h ALA 323 CO -0.10 0.13 0.28 -0.09 0.00 0.00 0.00 179.25 179.46 3giq h ARG 324 N 0.55 1.04 0.00 0.00 2.43 -0.73 -2.51 114.38 115.16 3giq h ARG 324 Ca 0.15 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3giq h ARG 324 Cb 0.14 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 3giq h ARG 324 CO -0.02 0.85 -0.16 0.91 -1.51 0.00 0.00 179.97 180.04 3giq n TRP 325 N -4.29 0.52 -2.68 2.20 8.01 -0.41 -4.95 117.44 115.84 3giq n TRP 325 Ca 0.06 0.15 -0.09 0.00 -1.31 0.00 0.00 57.50 56.31 3giq n TRP 325 Cb 0.18 -0.70 0.02 0.00 -2.01 0.00 0.00 31.31 28.80 3giq n TRP 325 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3giq n GLY 326 N 1.39 0.26 3.28 6.99 0.00 0.20 -5.05 105.19 112.26 3giq n GLY 326 Ca 0.06 -0.39 -0.15 0.00 0.00 0.00 0.00 46.02 45.54 3giq n GLY 326 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giq s ASP 328 N -3.27 5.34 0.40 0.00 3.84 -1.26 -4.35 116.67 117.38 3giq s ASP 328 Ca 0.38 1.38 0.07 0.00 -0.00 0.00 0.00 52.55 54.38 3giq s ASP 328 Cb 0.08 -2.23 0.85 0.00 -1.38 0.00 0.00 42.92 40.23 3giq s ASP 328 CO 0.13 -1.44 2.04 0.11 -0.00 0.00 0.00 175.17 176.02 3giq h LYS 329 N -0.72 0.57 -0.41 2.11 1.57 -1.91 -1.75 116.57 116.04 3giq h LYS 329 Ca -0.45 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.23 3giq h LYS 329 Cb 1.23 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 3giq h LYS 329 CO 0.60 0.38 0.01 1.15 -0.57 0.00 0.00 179.45 181.01 3giq h THR 330 N 0.58 1.26 -0.68 -0.16 2.02 -1.88 -1.34 112.91 112.71 3giq h THR 330 Ca 0.18 -1.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.31 3giq h THR 330 Cb 0.00 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 3giq h THR 330 CO -0.04 0.34 0.25 0.74 0.37 0.00 0.00 175.52 177.18 3giq h THR 331 N 0.55 1.25 -0.76 3.16 2.02 -1.83 -2.05 112.91 115.24 3giq h THR 331 Ca 0.12 -0.81 -0.04 0.00 0.77 0.00 0.00 66.41 66.44 3giq h THR 331 Cb 0.47 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 3giq h THR 331 CO 0.02 0.32 0.32 0.00 0.37 0.00 0.00 175.52 176.55 3giq h ALA 332 N 1.11 0.99 -0.66 6.16 0.00 -1.14 -1.59 119.26 124.13 3giq h ALA 332 Ca 0.22 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3giq h ALA 332 Cb 0.25 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3giq h ALA 332 CO -0.01 0.60 0.20 0.00 0.00 0.00 0.00 179.25 180.03 3giq h ALA 333 N 1.16 1.11 -0.36 0.00 0.00 -0.93 -1.24 119.26 119.00 3giq h ALA 333 Ca 0.26 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3giq h ALA 333 Cb 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3giq h ALA 333 CO -0.02 0.61 -0.20 0.00 0.00 0.00 0.00 179.25 179.63 3giq h ARG 334 N 0.98 0.69 0.00 0.00 3.08 -0.98 -2.58 114.38 115.56 3giq h ARG 334 Ca 0.22 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 3giq h ARG 334 Cb 0.28 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3giq h ARG 334 CO -0.01 0.84 -0.25 0.00 -1.07 0.00 0.00 179.97 179.49 3giq h ARG 335 N 0.61 0.00 0.00 0.04 3.08 -0.78 -2.94 114.38 114.39 3giq h ARG 335 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 3giq h ARG 335 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.73 3giq h ARG 335 CO 0.05 0.25 -0.22 -0.07 -1.07 0.00 0.00 179.97 178.91 3giq h LEU 336 N 0.00 0.00 -9.92 3.04 3.38 -0.86 -3.45 115.31 107.49 3giq h LEU 336 Ca -0.00 -0.04 -0.53 0.00 0.09 0.00 0.00 57.88 57.40 3giq h LEU 336 Cb 0.78 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.62 3giq h LEU 336 CO 0.03 0.02 0.67 0.00 0.09 0.00 0.00 178.44 179.25 3giq s ALA 337 N -3.18 3.43 0.30 1.53 0.00 -1.05 -3.76 121.76 119.04 3giq s ALA 337 Ca 0.08 1.35 -0.28 0.00 0.00 0.00 0.00 51.96 53.10 3giq s ALA 337 Cb 0.10 -3.52 -0.09 0.00 0.00 0.00 0.00 23.12 19.60 3giq s ALA 337 CO 0.66 -0.84 1.01 -1.25 0.00 0.00 0.00 175.76 175.34 3giq s PRO 338 N -2.05 4.60 0.32 0.00 0.04 -1.26 -4.60 135.00 132.05 3giq s PRO 338 Ca 0.53 1.56 -0.12 0.00 0.04 0.00 0.00 61.00 63.00 3giq s PRO 338 Cb -0.41 -3.01 0.02 0.00 0.04 0.00 0.00 34.50 31.14 3giq s PRO 338 CO 0.55 0.25 0.60 0.00 0.04 0.00 0.00 177.00 178.44 3giq s ALA 339 N -1.36 -0.28 0.22 8.56 0.00 -1.25 -1.81 121.76 125.84 3giq s ALA 339 Ca 0.47 -0.92 0.05 0.00 0.00 0.00 0.00 51.96 51.57 3giq s ALA 339 Cb -0.25 0.95 -0.05 0.00 0.00 0.00 0.00 23.12 23.76 3giq s ALA 339 CO 0.32 -0.91 -0.06 0.20 0.00 0.00 0.00 175.76 175.31 3giq s GLY 340 N -3.07 1.49 0.27 0.00 0.00 -0.44 -0.61 107.32 104.96 3giq s GLY 340 Ca 0.21 -1.72 -0.16 0.00 0.00 0.00 0.00 44.72 43.05 3giq s GLY 340 CO 0.12 -1.71 0.60 0.00 0.00 0.00 0.00 173.10 172.11 3giq s ALA 341 N -3.22 -0.65 -0.08 3.20 0.00 0.07 -1.17 121.76 119.92 3giq s ALA 341 Ca 0.25 -0.65 0.03 0.00 0.00 0.00 0.00 51.96 51.59 3giq s ALA 341 Cb 0.03 0.96 -0.02 0.00 0.00 0.00 0.00 23.12 24.09 3giq s ALA 341 CO 0.07 -0.94 -0.17 0.42 0.00 0.00 0.00 175.76 175.15 3giq s ILE 342 N -3.85 2.80 -0.23 0.00 1.01 0.53 -2.04 121.20 119.43 3giq s ILE 342 Ca 0.17 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 60.05 3giq s ILE 342 Cb -0.03 -2.11 0.05 0.00 0.01 0.00 0.00 42.46 40.38 3giq s ILE 342 CO 0.09 0.57 -0.13 -0.31 0.00 0.00 0.00 174.94 175.15 3giq s TYR 343 N -0.25 2.98 -0.92 3.97 2.02 -0.26 -2.38 117.35 122.50 3giq s TYR 343 Ca 0.01 -2.02 -0.20 0.00 -0.37 0.00 0.00 57.07 54.49 3giq s TYR 343 Cb -0.13 -1.87 0.12 0.00 -0.40 0.00 0.00 41.96 39.68 3giq s TYR 343 CO 0.03 -0.84 1.15 -0.06 -1.57 0.00 0.00 175.55 174.26 3giq s PHE 344 N 1.21 3.01 -0.00 2.71 0.08 -1.26 -0.26 117.98 123.46 3giq s PHE 344 Ca -0.04 -1.25 0.00 0.00 0.12 0.00 0.00 56.93 55.76 3giq s PHE 344 Cb -0.18 -4.33 0.01 0.00 -0.57 0.00 0.00 43.02 37.95 3giq s PHE 344 CO -0.08 -1.56 0.66 0.00 -0.10 0.00 0.00 175.22 174.14 3giq n ALA 345 N 6.93 1.31 -2.55 5.36 0.00 -1.15 -4.86 120.51 125.55 3giq n ALA 345 Ca 0.23 -0.69 -0.24 0.00 0.00 0.00 0.00 53.44 52.74 3giq n ALA 345 Cb 0.49 -0.06 -0.08 0.00 0.00 0.00 0.00 19.45 19.81 3giq n ALA 345 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3giq s MET 346 N -0.26 2.20 -0.39 0.00 -1.94 -0.78 -0.67 119.30 117.46 3giq s MET 346 Ca 0.01 -1.62 -0.16 0.00 -1.71 0.00 0.00 55.69 52.21 3giq s MET 346 Cb 0.01 -2.05 0.01 0.00 2.01 0.00 0.00 34.83 34.81 3giq s MET 346 CO 0.00 0.18 0.38 0.34 -0.01 0.00 0.00 175.02 175.91 3giq s ASP 347 N -3.74 6.16 0.54 3.03 -1.08 -1.26 -4.82 116.67 115.50 3giq s ASP 347 Ca 0.35 -0.60 0.24 0.00 -0.52 0.00 0.00 52.55 52.02 3giq s ASP 347 Cb -0.02 -2.20 1.42 0.00 -1.46 0.00 0.00 42.92 40.66 3giq s ASP 347 CO 0.20 -0.47 2.05 -0.08 0.52 0.00 0.00 175.17 177.39 3giq h GLU 348 N 8.63 0.00 -0.23 4.34 4.57 -1.93 0.11 114.58 130.07 3giq h GLU 348 Ca -0.28 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 57.80 3giq h GLU 348 Cb 1.12 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.70 3giq h GLU 348 CO 0.75 0.00 -0.31 -0.44 -1.18 0.00 0.00 179.01 177.82 3giq h ASP 349 N 0.00 0.47 0.07 1.04 3.32 -2.00 -2.30 116.42 117.02 3giq h ASP 349 Ca 0.16 -0.18 -0.21 0.00 0.02 0.00 0.00 57.03 56.83 3giq h ASP 349 Cb 0.69 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.11 3giq h ASP 349 CO -0.00 0.77 -0.77 -0.08 -1.72 0.00 0.00 179.24 177.43 3giq h GLU 350 N 0.40 0.59 -0.80 3.56 4.81 -1.24 -2.40 114.58 119.51 3giq h GLU 350 Ca 0.05 -0.49 0.07 0.00 -0.13 0.00 0.00 59.36 58.86 3giq h GLU 350 Cb 0.75 0.11 -0.06 0.00 0.63 0.00 0.00 28.75 30.17 3giq h GLU 350 CO 0.06 1.11 0.47 0.28 -0.73 0.00 0.00 179.01 180.21 3giq h VAL 351 N 0.40 0.98 -0.62 0.32 2.07 -1.03 -0.39 116.25 117.98 3giq h VAL 351 Ca -0.05 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.10 3giq h VAL 351 Cb 1.37 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 3giq h VAL 351 CO 0.15 0.15 0.07 0.11 0.02 0.00 0.00 177.57 178.07 3giq h LYS 352 N 0.84 1.05 -0.51 1.57 1.57 -1.31 -1.80 116.57 117.99 3giq h LYS 352 Ca 0.36 -0.30 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 3giq h LYS 352 Cb 0.23 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3giq h LYS 352 CO -0.20 0.99 0.04 0.00 -0.57 0.00 0.00 179.45 179.71 3giq h ARG 353 N 0.96 0.82 -0.52 3.15 3.08 -0.79 -1.71 114.38 119.38 3giq h ARG 353 Ca 0.19 -0.21 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 3giq h ARG 353 Cb 0.47 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 3giq h ARG 353 CO 0.02 0.80 0.03 0.82 -1.07 0.00 0.00 179.97 180.57 3giq h ILE 354 N 0.77 1.26 -0.20 2.04 2.04 -0.90 -2.48 117.51 120.05 3giq h ILE 354 Ca 0.16 -1.04 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 3giq h ILE 354 Cb 0.42 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 3giq h ILE 354 CO 0.01 0.37 0.03 0.15 0.00 0.00 0.00 178.15 178.72 3giq h PHE 355 N 0.76 0.29 0.00 1.37 3.57 -0.91 -1.62 116.94 120.40 3giq h PHE 355 Ca 0.15 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.64 3giq h PHE 355 Cb 0.48 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.13 3giq h PHE 355 CO 0.04 0.27 0.00 1.96 -2.23 0.00 0.00 178.31 178.35 3giq h GLN 356 N 0.29 0.00 -6.74 1.11 4.20 -0.84 -3.42 115.11 109.70 3giq h GLN 356 Ca 0.07 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.22 3giq h GLN 356 Cb 0.14 0.00 0.09 0.00 0.30 0.00 0.00 27.48 28.02 3giq h GLN 356 CO -0.00 0.00 0.70 1.58 -0.67 0.00 0.00 178.83 180.44 3giq n HIS 357 N -2.59 2.53 0.05 2.96 -0.00 -0.61 -4.85 115.22 112.73 3giq n HIS 357 Ca 0.01 0.40 0.21 0.00 0.46 0.00 0.00 57.72 58.81 3giq n HIS 357 Cb 0.23 -2.51 0.73 0.00 -0.12 0.00 0.00 29.99 28.33 3giq n HIS 357 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3giq h PRO 358 N 3.85 0.00 -0.48 1.57 0.11 -1.89 -1.79 132.00 133.37 3giq h PRO 358 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3giq h PRO 358 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3giq h PRO 358 CO 0.72 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.51 3giq s MET 361 N 1.56 2.42 -0.19 0.00 -1.94 0.51 -4.86 119.30 116.80 3giq s MET 361 Ca 0.24 -1.66 -0.07 0.00 -1.71 0.00 0.00 55.69 52.49 3giq s MET 361 Cb -0.15 -2.46 -0.04 0.00 2.01 0.00 0.00 34.83 34.19 3giq s MET 361 CO 0.10 -0.57 0.04 0.08 -0.01 0.00 0.00 175.02 174.66 3giq s VAL 362 N -2.61 4.48 -0.16 -6.03 1.01 -1.26 -2.23 120.40 113.61 3giq s VAL 362 Ca 0.50 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.34 3giq s VAL 362 Cb -0.05 -3.02 0.04 0.00 0.00 0.00 0.00 36.38 33.35 3giq s VAL 362 CO 0.31 0.44 -0.04 -0.83 0.00 0.00 0.00 175.10 174.98 3giq s GLY 363 N 0.62 0.89 0.28 4.51 0.00 -0.52 -3.29 107.32 109.81 3giq s GLY 363 Ca 0.02 -0.75 -0.01 0.00 0.00 0.00 0.00 44.72 43.98 3giq s GLY 363 CO 0.02 0.99 1.84 1.48 0.00 0.00 0.00 173.10 177.42 3giq h SER 364 N 8.15 0.77 -4.27 1.64 4.64 -1.83 -3.25 113.55 119.41 3giq h SER 364 Ca -0.24 -0.13 -0.40 0.00 -0.47 0.00 0.00 61.79 60.56 3giq h SER 364 Cb 1.11 -0.20 0.02 0.00 -0.31 0.00 0.00 62.40 63.03 3giq h SER 364 CO 0.39 0.75 -0.57 -0.67 -0.87 0.00 0.00 176.83 175.85 3giq n ASP 365 N -4.28 -5.69 -4.77 4.97 2.03 -0.02 -4.59 116.55 104.19 3giq n ASP 365 Ca 0.04 -0.22 -0.39 0.00 0.52 0.00 0.00 54.79 54.74 3giq n ASP 365 Cb 0.22 -4.65 -0.00 0.00 -0.72 0.00 0.00 41.12 35.97 3giq n ASP 365 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 3giq s GLY 366 N -2.54 2.90 -0.72 0.27 0.00 -1.26 -4.85 107.32 101.12 3giq s GLY 366 Ca 0.24 1.17 0.01 0.00 0.00 0.00 0.00 44.72 46.14 3giq s GLY 366 CO 0.29 1.73 0.54 1.08 0.00 0.00 0.00 173.10 176.74 3giq s LEU 367 N -2.62 5.08 0.37 0.66 1.43 -1.26 -4.03 118.68 118.31 3giq s LEU 367 Ca 0.59 -3.45 0.23 0.00 -1.03 0.00 0.00 54.13 50.48 3giq s LEU 367 Cb -0.36 -1.78 1.26 0.00 0.03 0.00 0.00 46.19 45.34 3giq s LEU 367 CO 0.46 -0.21 1.69 1.55 0.23 0.00 0.00 176.35 180.07 3giq h PRO 368 N 6.15 0.00 0.00 1.29 0.13 -1.86 -2.55 132.00 135.17 3giq h PRO 368 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3giq h PRO 368 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 3giq h PRO 368 CO 0.76 0.00 -1.01 -1.71 -0.23 0.00 0.00 178.00 175.80 3giq n ASN 369 N -2.34 0.66 -4.77 1.44 4.05 -1.26 -4.95 115.26 108.09 3giq n ASN 369 Ca -0.02 0.07 -0.41 0.00 0.45 0.00 0.00 54.58 54.67 3giq n ASN 369 Cb 0.10 0.63 -0.01 0.00 1.23 0.00 0.00 39.78 41.74 3giq n ASN 369 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 3giq s ASP 370 N -4.54 6.35 0.14 1.20 1.11 -0.96 -4.94 116.67 115.03 3giq s ASP 370 Ca 0.02 3.02 -0.14 0.00 0.18 0.00 0.00 52.55 55.64 3giq s ASP 370 Cb 0.12 -2.66 -0.00 0.00 1.07 0.00 0.00 42.92 41.45 3giq s ASP 370 CO 0.79 -0.88 1.59 0.00 1.18 0.00 0.00 175.17 177.85 3giq h ALA 371 N 3.47 0.60 -2.61 5.23 0.00 -1.83 -3.34 119.26 120.77 3giq h ALA 371 Ca -0.50 -0.27 -0.60 0.00 0.00 0.00 0.00 54.91 53.55 3giq h ALA 371 Cb 1.23 -0.16 -0.39 0.00 0.00 0.00 0.00 17.79 18.47 3giq h ALA 371 CO 0.68 0.38 -0.84 0.50 0.00 0.00 0.00 179.25 179.98 3giq s ARG 372 N -5.03 1.43 0.92 0.00 6.06 0.41 -5.04 118.95 117.71 3giq s ARG 372 Ca -0.13 -2.52 -0.11 0.00 -2.50 0.00 0.00 55.73 50.46 3giq s ARG 372 Cb 0.11 -2.10 0.14 0.00 0.06 0.00 0.00 34.95 33.16 3giq s ARG 372 CO 0.81 -1.35 1.09 -1.25 -2.50 0.00 0.00 175.30 172.09 3giq s PRO 373 N -0.45 1.07 0.21 5.12 0.04 -1.26 -4.40 135.00 135.33 3giq s PRO 373 Ca 0.30 0.91 -0.30 0.00 0.04 0.00 0.00 61.00 61.95 3giq s PRO 373 Cb 0.01 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 32.68 3giq s PRO 373 CO -0.18 -2.39 1.23 -1.58 0.04 0.00 0.00 177.00 174.11 3giq s HIS 374 N -2.86 3.36 0.25 0.56 5.65 -1.26 -4.66 115.29 116.34 3giq s HIS 374 Ca 0.64 1.39 0.25 0.00 0.25 0.00 0.00 55.06 57.59 3giq s HIS 374 Cb -0.19 -3.49 1.33 0.00 -1.18 0.00 0.00 32.58 29.06 3giq s HIS 374 CO 0.58 -1.38 1.72 -1.00 -0.65 0.00 0.00 174.74 174.00 3giq h PRO 375 N 5.00 0.00 -0.05 2.88 0.13 -1.79 -2.34 132.00 135.82 3giq h PRO 375 Ca -0.45 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.69 3giq h PRO 375 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 3giq h PRO 375 CO 0.74 0.00 0.13 0.07 -0.23 0.00 0.00 178.00 178.71 3giq h ARG 376 N 0.00 0.00 -0.87 0.86 0.11 -1.87 -0.22 114.38 112.39 3giq h ARG 376 Ca 0.00 0.00 0.04 0.00 0.10 0.00 0.00 59.98 60.12 3giq h ARG 376 Cb 0.40 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.43 3giq h ARG 376 CO 0.00 0.00 0.57 1.25 0.10 0.00 0.00 179.97 181.89 3giq h LEU 377 N 0.00 0.93 0.00 0.08 5.85 -1.67 -3.07 115.31 117.43 3giq h LEU 377 Ca 0.02 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3giq h LEU 377 Cb 0.28 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.09 3giq h LEU 377 CO -0.00 0.64 -1.20 0.79 -0.34 0.00 0.00 178.44 178.33 3giq n TRP 378 N -4.45 0.00 -0.18 1.25 7.02 -0.24 -4.69 117.44 116.16 3giq n TRP 378 Ca 0.12 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.60 3giq n TRP 378 Cb 0.11 -0.17 0.00 0.00 -2.42 0.00 0.00 31.31 28.83 3giq n TRP 378 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3giq n GLY 379 N 1.69 1.09 0.48 6.99 0.00 -0.36 -4.51 105.19 110.57 3giq n GLY 379 Ca -0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 3giq n GLY 379 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3giq h SER 380 N 0.00 -1.55 -0.48 1.61 0.02 -1.75 0.22 113.55 111.62 3giq h SER 380 Ca 0.00 0.16 -0.09 0.00 -0.84 0.00 0.00 61.79 61.02 3giq h SER 380 Cb 0.44 0.56 -0.02 0.00 0.14 0.00 0.00 62.40 63.53 3giq h SER 380 CO 0.00 -0.57 -0.02 -0.26 -1.14 0.00 0.00 176.83 174.83 3giq h PHE 381 N -0.79 1.00 0.00 3.45 0.04 -1.88 -2.03 116.94 116.72 3giq h PHE 381 Ca -0.02 -0.16 -0.06 0.00 2.80 0.00 0.00 57.97 60.53 3giq h PHE 381 Cb 0.77 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.65 3giq h PHE 381 CO -0.42 0.91 -0.30 1.79 -0.60 0.00 0.00 178.31 179.69 3giq h THR 382 N 0.85 0.61 -0.10 -1.55 1.35 -1.77 -1.98 112.91 110.32 3giq h THR 382 Ca 0.15 -1.48 -0.18 0.00 -0.55 0.00 0.00 66.41 64.35 3giq h THR 382 Cb 0.53 2.01 -0.00 0.00 -1.73 0.00 0.00 68.15 68.96 3giq h THR 382 CO 0.03 0.29 -0.69 -0.09 -0.25 0.00 0.00 175.52 174.81 3giq h ARG 383 N 0.00 0.44 -0.17 4.72 2.43 -0.63 0.85 114.38 122.03 3giq h ARG 383 Ca -0.00 -0.34 -0.03 0.00 -0.81 0.00 0.00 59.98 58.80 3giq h ARG 383 Cb 0.99 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.60 3giq h ARG 383 CO 0.04 0.97 -0.01 0.28 -1.51 0.00 0.00 179.97 179.74 3giq h VAL 384 N 0.31 1.26 -0.44 0.20 2.07 -1.09 0.20 116.25 118.76 3giq h VAL 384 Ca -0.02 -0.87 -0.05 0.00 0.82 0.00 0.00 66.70 66.58 3giq h VAL 384 Cb 1.26 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 3giq h VAL 384 CO 0.12 0.26 0.10 -0.07 0.02 0.00 0.00 177.57 178.00 3giq h LEU 385 N 0.05 0.68 0.10 2.57 3.38 -1.28 0.55 115.31 121.36 3giq h LEU 385 Ca 0.05 -0.24 -0.21 0.00 0.09 0.00 0.00 57.88 57.57 3giq h LEU 385 Cb 0.40 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3giq h LEU 385 CO 0.01 0.75 -1.04 1.23 0.09 0.00 0.00 178.44 179.48 3giq h GLY 386 N 0.59 0.25 0.15 0.83 0.00 -0.84 -2.55 103.07 101.50 3giq h GLY 386 Ca 0.14 -0.64 -0.27 0.00 0.00 0.00 0.00 47.33 46.56 3giq h GLY 386 CO 0.00 0.56 -1.50 0.54 0.00 0.00 0.00 176.54 176.14 3giq n ARG 387 N -4.11 0.61 0.00 4.80 5.12 0.67 -1.62 116.66 122.13 3giq n ARG 387 Ca -0.20 0.49 -0.18 0.00 -1.93 0.00 0.00 57.85 56.02 3giq n ARG 387 Cb 0.81 -1.73 -0.08 0.00 -1.16 0.00 0.00 32.46 30.30 3giq n ARG 387 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 3giq h TYR 388 N -0.74 1.07 0.00 -1.55 -1.99 -1.02 -0.29 116.97 112.45 3giq h TYR 388 Ca -0.38 -0.51 0.00 0.00 2.00 0.00 0.00 58.73 59.84 3giq h TYR 388 Cb 1.50 -0.15 0.00 0.00 2.00 0.00 0.00 36.73 40.08 3giq h TYR 388 CO 0.09 1.35 -0.20 0.28 -0.00 0.00 0.00 178.16 179.67 3giq h VAL 389 N 0.48 0.00 -0.12 -2.88 2.07 -1.00 -1.50 116.25 113.30 3giq h VAL 389 Ca -0.08 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 3giq h VAL 389 Cb 1.51 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3giq h VAL 389 CO 0.18 0.00 0.01 -0.09 0.02 0.00 0.00 177.57 177.69 3giq h ARG 390 N -0.56 0.20 0.01 1.57 2.43 -1.46 -0.93 114.38 115.63 3giq h ARG 390 Ca 0.00 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.06 3giq h ARG 390 Cb 0.20 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3giq h ARG 390 CO 0.00 0.41 -0.20 0.93 -1.51 0.00 0.00 179.97 179.60 3giq h GLU 391 N -0.04 0.13 0.00 0.20 5.08 -1.28 -3.38 114.58 115.29 3giq h GLU 391 Ca 0.03 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3giq h GLU 391 Cb 0.32 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3giq h GLU 391 CO 0.00 0.92 -1.11 0.00 -1.00 0.00 0.00 179.01 177.82 3giq n ALA 392 N -2.54 3.32 -3.78 3.43 0.00 -0.12 -4.99 120.51 115.83 3giq n ALA 392 Ca -0.10 -0.41 -0.26 0.00 0.00 0.00 0.00 53.44 52.67 3giq n ALA 392 Cb 0.49 -0.96 0.04 0.00 0.00 0.00 0.00 19.45 19.03 3giq n ALA 392 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3giq n ARG 393 N -2.03 -5.95 0.22 0.00 0.63 -0.35 -4.86 116.66 104.33 3giq n ARG 393 Ca 0.01 0.66 0.08 0.00 -0.92 0.00 0.00 57.85 57.69 3giq n ARG 393 Cb 0.45 -5.52 0.53 0.00 0.45 0.00 0.00 32.46 28.37 3giq n ARG 393 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 3giq h LEU 394 N -2.16 0.00 -7.63 6.15 3.38 -1.47 -3.46 115.31 110.12 3giq h LEU 394 Ca -0.59 0.00 0.20 0.00 0.09 0.00 0.00 57.88 57.58 3giq h LEU 394 Cb 1.37 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.04 3giq h LEU 394 CO 0.62 0.24 0.55 0.00 0.09 0.00 0.00 178.44 179.93 3giq s MET 395 N -4.03 1.09 0.75 1.13 0.23 -1.26 -4.99 119.30 112.22 3giq s MET 395 Ca -0.02 -0.62 -0.11 0.00 -1.03 0.00 0.00 55.69 53.91 3giq s MET 395 Cb 0.13 0.36 0.04 0.00 -1.53 0.00 0.00 34.83 33.83 3giq s MET 395 CO 0.65 -0.50 1.09 0.95 -2.03 0.00 0.00 175.02 175.18 3giq s THR 396 N -3.03 3.33 0.24 3.16 -4.23 -1.26 -4.72 115.64 109.12 3giq s THR 396 Ca 0.14 0.43 -0.05 0.00 -1.18 0.00 0.00 61.69 61.02 3giq s THR 396 Cb -0.01 -3.29 0.17 0.00 1.34 0.00 0.00 72.50 70.72 3giq s THR 396 CO 0.02 -0.56 1.81 0.25 -0.54 0.00 0.00 174.62 175.60 3giq h LEU 397 N -0.87 1.01 -0.94 4.79 5.85 -1.98 -0.67 115.31 122.50 3giq h LEU 397 Ca -0.46 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.13 3giq h LEU 397 Cb 1.26 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.98 3giq h LEU 397 CO 0.61 0.89 0.62 -0.33 -0.34 0.00 0.00 178.44 179.90 3giq h GLU 398 N 1.07 1.22 -0.29 1.25 3.07 -1.92 -0.03 114.58 118.96 3giq h GLU 398 Ca 0.25 -0.07 -0.12 0.00 -0.50 0.00 0.00 59.36 58.92 3giq h GLU 398 Cb 0.20 -0.28 -0.00 0.00 -0.84 0.00 0.00 28.75 27.83 3giq h GLU 398 CO -0.02 0.81 -0.28 1.96 -1.40 0.00 0.00 179.01 180.07 3giq h GLN 399 N 1.26 0.71 -0.42 2.33 4.20 -1.70 -2.79 115.11 118.68 3giq h GLN 399 Ca 0.35 -0.37 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 3giq h GLN 399 Cb -0.12 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 3giq h GLN 399 CO -0.08 0.99 0.17 0.00 -0.67 0.00 0.00 178.83 179.23 3giq h ALA 400 N 0.71 0.55 -0.84 3.87 0.00 -0.76 -2.46 119.26 120.32 3giq h ALA 400 Ca 0.05 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.84 3giq h ALA 400 Cb 0.85 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 3giq h ALA 400 CO 0.07 0.16 0.55 0.28 0.00 0.00 0.00 179.25 180.32 3giq h VAL 401 N 0.54 1.16 -0.83 0.00 2.07 -1.03 -1.47 116.25 116.70 3giq h VAL 401 Ca 0.14 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 3giq h VAL 401 Cb 0.20 -0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 29.92 3giq h VAL 401 CO -0.01 0.20 0.45 0.00 0.02 0.00 0.00 177.57 178.22 3giq h ALA 402 N 1.50 1.23 0.00 1.67 0.00 -1.18 -1.13 119.26 121.35 3giq h ALA 402 Ca 0.33 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3giq h ALA 402 Cb -0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 3giq h ALA 402 CO -0.09 0.62 -0.15 0.00 0.00 0.00 0.00 179.25 179.62 3giq h ARG 403 N 1.16 0.00 -0.00 0.00 2.47 -0.83 -1.11 114.38 116.07 3giq h ARG 403 Ca 0.29 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.01 3giq h ARG 403 Cb 0.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.35 3giq h ARG 403 CO -0.05 0.15 -0.79 -1.33 0.56 0.00 0.00 179.97 178.52 3giq n MET 404 N -3.83 0.00 0.00 0.04 2.81 -0.71 -4.01 117.12 111.42 3giq n MET 404 Ca -0.02 -0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 3giq n MET 404 Cb 0.25 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.26 3giq n MET 404 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3giq n THR 405 N -1.50 0.00 -0.18 2.03 -2.24 -0.51 -0.45 114.28 111.43 3giq n THR 405 Ca 0.05 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.76 3giq n THR 405 Cb 0.33 -0.41 0.03 0.00 -2.10 0.00 0.00 70.33 68.18 3giq n THR 405 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3giq h ALA 406 N 0.00 0.69 0.12 6.98 0.00 -1.00 -2.14 119.26 123.91 3giq h ALA 406 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3giq h ALA 406 Cb 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.58 3giq h ALA 406 CO 0.00 0.11 -0.06 1.25 0.00 0.00 0.00 179.25 180.56 3giq h LEU 407 N 0.72 -0.13 -0.67 0.00 5.85 -1.47 -0.82 115.31 118.79 3giq h LEU 407 Ca 0.20 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.97 3giq h LEU 407 Cb -0.07 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 3giq h LEU 407 CO -0.05 -0.08 0.37 -0.65 -0.34 0.00 0.00 178.44 177.69 3giq h PRO 408 N -0.18 0.66 -0.69 5.25 0.11 -1.72 0.60 132.00 136.03 3giq h PRO 408 Ca -0.02 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.06 3giq h PRO 408 Cb 0.14 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.06 3giq h PRO 408 CO 0.03 0.44 0.45 0.00 -0.21 0.00 0.00 178.00 178.71 3giq h ALA 409 N 1.35 1.49 -0.18 -0.75 0.00 -1.12 0.71 119.26 120.75 3giq h ALA 409 Ca 0.30 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.00 3giq h ALA 409 Cb 0.19 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3giq h ALA 409 CO -0.18 0.47 -0.47 -0.09 0.00 0.00 0.00 179.25 178.98 3giq h ARG 410 N 0.94 0.64 -0.35 0.00 9.65 -0.28 0.17 114.38 125.15 3giq h ARG 410 Ca 0.25 -0.44 -0.10 0.00 -1.10 0.00 0.00 59.98 58.59 3giq h ARG 410 Cb -0.10 0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 3giq h ARG 410 CO -0.05 1.06 -0.16 0.28 2.80 0.00 0.00 179.97 183.90 3giq h VAL 411 N 0.31 1.28 -0.01 0.20 2.07 -0.51 -3.24 116.25 116.36 3giq h VAL 411 Ca -0.01 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.24 3giq h VAL 411 Cb 1.08 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 3giq h VAL 411 CO 0.10 0.42 -0.43 0.49 0.02 0.00 0.00 177.57 178.17 3giq n PHE 412 N -4.32 0.00 -2.66 1.57 3.72 0.21 -4.96 117.46 111.01 3giq n PHE 412 Ca -0.02 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.31 3giq n PHE 412 Cb 0.39 -0.12 0.03 0.00 -0.94 0.00 0.00 39.48 38.84 3giq n PHE 412 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3giq n GLY 413 N 1.41 0.32 3.39 1.37 0.00 0.30 -5.00 105.19 106.97 3giq n GLY 413 Ca 0.09 -0.33 -0.44 0.00 0.00 0.00 0.00 46.02 45.34 3giq n GLY 413 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3giq s PHE 414 N -3.11 2.96 0.36 1.61 0.08 0.34 -5.02 117.98 115.19 3giq s PHE 414 Ca 0.10 -0.94 -0.28 0.00 0.12 0.00 0.00 56.93 55.93 3giq s PHE 414 Cb -0.04 -4.07 -0.10 0.00 -0.57 0.00 0.00 43.02 38.24 3giq s PHE 414 CO 0.24 -1.36 1.28 0.00 -0.10 0.00 0.00 175.22 175.28 3giq s ALA 415 N 2.86 3.39 -1.57 5.36 0.00 -1.26 -3.30 121.76 127.25 3giq s ALA 415 Ca 0.14 1.20 -0.03 0.00 0.00 0.00 0.00 51.96 53.27 3giq s ALA 415 Cb -0.22 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 19.45 3giq s ALA 415 CO 0.06 -0.66 0.36 0.39 0.00 0.00 0.00 175.76 175.91 3giq n GLU 416 N 0.56 -3.55 -3.98 0.00 -0.58 -1.26 -4.91 120.64 106.91 3giq n GLU 416 Ca 0.01 0.88 -0.09 0.00 -0.42 0.00 0.00 57.16 57.54 3giq n GLU 416 Cb 0.43 -5.65 -0.08 0.00 -0.57 0.00 0.00 31.44 25.57 3giq n GLU 416 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3giq s ARG 417 N -5.47 0.91 0.00 3.49 0.52 -1.21 -0.22 118.95 116.96 3giq s ARG 417 Ca 0.19 -1.16 0.00 0.00 -0.52 0.00 0.00 55.73 54.25 3giq s ARG 417 Cb -0.09 0.31 0.00 0.00 0.52 0.00 0.00 34.95 35.69 3giq s ARG 417 CO 0.24 -0.28 0.00 0.41 0.02 0.00 0.00 175.30 175.69 3giq n GLY 418 N -0.08 0.82 3.25 -3.53 0.00 -1.26 -4.82 105.19 99.57 3giq n GLY 418 Ca -0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 3giq n GLY 418 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3giq s VAL 419 N -3.17 0.03 -0.68 1.61 -7.23 -1.26 -1.75 120.40 107.95 3giq s VAL 419 Ca 0.00 -0.28 -0.18 0.00 -1.81 0.00 0.00 61.98 59.72 3giq s VAL 419 Cb 0.00 -0.59 0.13 0.00 0.56 0.00 0.00 36.38 36.49 3giq s VAL 419 CO 0.00 -0.15 0.76 -0.76 -0.31 0.00 0.00 175.10 174.63 3giq s LEU 420 N -0.74 5.69 0.00 1.32 1.43 -0.77 -4.85 118.68 120.76 3giq s LEU 420 Ca -0.08 -1.80 -0.15 0.00 -1.03 0.00 0.00 54.13 51.06 3giq s LEU 420 Cb -0.04 -2.29 0.02 0.00 0.03 0.00 0.00 46.19 43.92 3giq s LEU 420 CO 0.03 -0.98 0.33 0.00 0.23 0.00 0.00 176.35 175.96 3giq s GLN 421 N 2.09 0.73 0.26 1.70 -2.07 -1.26 -4.82 119.66 116.29 3giq s GLN 421 Ca 0.15 -0.26 -0.30 0.00 -1.82 0.00 0.00 55.36 53.13 3giq s GLN 421 Cb -0.19 0.32 -0.13 0.00 -1.09 0.00 0.00 33.01 31.92 3giq s GLN 421 CO 0.01 -0.21 1.40 -2.30 -1.32 0.00 0.00 175.29 172.86 3giq n PRO 422 N 1.06 2.10 0.00 9.60 -0.02 -1.26 -2.12 135.00 144.36 3giq n PRO 422 Ca -0.21 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3giq n PRO 422 Cb 0.57 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 3giq n PRO 422 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3giq n GLY 423 N 1.87 3.24 3.83 -1.23 0.00 0.47 -4.98 105.19 108.40 3giq n GLY 423 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 3giq n GLY 423 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giq s ALA 424 N -2.62 2.87 0.39 4.61 0.00 -0.90 -4.72 121.76 121.40 3giq s ALA 424 Ca 0.00 0.15 -0.27 0.00 0.00 0.00 0.00 51.96 51.84 3giq s ALA 424 Cb 0.00 -3.16 -0.10 0.00 0.00 0.00 0.00 23.12 19.87 3giq s ALA 424 CO 0.00 -0.79 1.39 -1.58 0.00 0.00 0.00 175.76 174.78 3giq s TRP 425 N -2.83 2.71 -1.57 0.00 0.52 0.69 -0.73 118.94 117.73 3giq s TRP 425 Ca 0.59 1.31 -0.11 0.00 0.02 0.00 0.00 56.10 57.91 3giq s TRP 425 Cb -0.13 -3.83 -0.05 0.00 -1.15 0.00 0.00 33.47 28.31 3giq s TRP 425 CO 0.45 -2.50 2.75 0.00 0.02 0.00 0.00 176.95 177.66 3giq n ALA 426 N 0.28 7.01 -2.54 0.98 0.00 0.32 -4.67 120.51 121.89 3giq n ALA 426 Ca 0.02 -3.65 -0.42 0.00 0.00 0.00 0.00 53.44 49.39 3giq n ALA 426 Cb 0.42 -3.39 -0.07 0.00 0.00 0.00 0.00 19.45 16.40 3giq n ALA 426 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3giq s ASP 427 N 2.36 6.35 0.03 0.00 1.01 -1.26 -1.00 116.67 124.16 3giq s ASP 427 Ca 0.63 -0.14 0.02 0.00 0.71 0.00 0.00 52.55 53.78 3giq s ASP 427 Cb 0.17 -2.31 -0.02 0.00 1.01 0.00 0.00 42.92 41.77 3giq s ASP 427 CO -0.07 -0.66 -0.08 -0.69 0.21 0.00 0.00 175.17 173.89 3giq s VAL 428 N 2.68 0.55 -0.03 -1.27 1.01 0.05 -1.25 120.40 122.14 3giq s VAL 428 Ca 0.22 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.38 3giq s VAL 428 Cb -0.15 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.67 3giq s VAL 428 CO 0.16 -0.22 -0.11 0.54 0.00 0.00 0.00 175.10 175.47 3giq s VAL 429 N -1.01 0.93 -0.16 2.92 0.11 -0.12 0.02 120.40 123.08 3giq s VAL 429 Ca -0.06 -0.43 -0.00 0.00 -2.93 0.00 0.00 61.98 58.56 3giq s VAL 429 Cb -0.08 -0.83 -0.01 0.00 -1.53 0.00 0.00 36.38 33.94 3giq s VAL 429 CO 0.00 0.29 -0.13 -0.69 -3.33 0.00 0.00 175.10 171.24 3giq s VAL 430 N 0.26 2.85 0.04 2.04 1.01 -0.05 -1.05 120.40 125.49 3giq s VAL 430 Ca -0.05 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.15 3giq s VAL 430 Cb -0.10 -2.21 -0.00 0.00 0.00 0.00 0.00 36.38 34.06 3giq s VAL 430 CO 0.01 0.50 0.15 0.72 0.00 0.00 0.00 175.10 176.49 3giq s PHE 431 N 0.81 0.12 -0.39 5.22 -0.12 -0.53 -0.31 117.98 122.79 3giq s PHE 431 Ca -0.05 -0.40 -0.23 0.00 -0.05 0.00 0.00 56.93 56.21 3giq s PHE 431 Cb -0.15 -0.08 0.01 0.00 -0.63 0.00 0.00 43.02 42.17 3giq s PHE 431 CO 0.00 -0.41 0.77 0.34 -0.05 0.00 0.00 175.22 175.87 3giq s ASP 432 N -2.17 6.50 0.53 1.98 -1.08 -0.04 -0.18 116.67 122.21 3giq s ASP 432 Ca -0.04 0.20 0.21 0.00 -0.52 0.00 0.00 52.55 52.39 3giq s ASP 432 Cb -0.01 -2.39 1.41 0.00 -1.46 0.00 0.00 42.92 40.48 3giq s ASP 432 CO -0.05 -0.77 2.15 1.55 0.52 0.00 0.00 175.17 178.57 3giq h PRO 433 N 8.63 0.00 0.00 4.34 0.13 -1.89 0.71 132.00 143.92 3giq h PRO 433 Ca -0.25 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.79 3giq h PRO 433 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3giq h PRO 433 CO 0.92 0.05 -0.64 -0.44 -0.23 0.00 0.00 178.00 177.66 3giq h ASP 434 N 0.00 0.00 0.00 1.44 3.32 -1.92 -3.38 116.42 115.88 3giq h ASP 434 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3giq h ASP 434 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 3giq h ASP 434 CO 0.01 0.38 -1.28 0.35 -1.72 0.00 0.00 179.24 176.98 3giq n THR 435 N -3.09 0.00 -1.64 0.35 -2.24 -1.06 -5.02 114.28 101.59 3giq n THR 435 Ca -0.00 -0.20 -0.50 0.00 -2.27 0.00 0.00 64.05 61.08 3giq n THR 435 Cb 0.70 0.38 -0.05 0.00 -2.10 0.00 0.00 70.33 69.26 3giq n THR 435 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 3giq n VAL 436 N -1.73 0.09 -3.58 2.28 3.14 0.22 -4.41 118.33 114.35 3giq n VAL 436 Ca -0.01 -0.02 -0.07 0.00 -2.96 0.00 0.00 64.34 61.28 3giq n VAL 436 Cb 0.20 -1.20 -0.04 0.00 -1.06 0.00 0.00 33.84 31.74 3giq n VAL 436 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3giq s ALA 437 N 1.30 -1.97 0.50 1.55 0.00 -0.54 -3.72 121.76 118.88 3giq s ALA 437 Ca 0.85 1.52 -0.18 0.00 0.00 0.00 0.00 51.96 54.15 3giq s ALA 437 Cb -0.85 -0.46 -0.08 0.00 0.00 0.00 0.00 23.12 21.72 3giq s ALA 437 CO 0.46 -0.44 0.99 0.16 0.00 0.00 0.00 175.76 176.92 3giq s ASP 438 N -1.63 6.61 0.00 0.00 -4.77 -1.24 -1.36 116.67 114.28 3giq s ASP 438 Ca 0.04 1.64 0.00 0.00 -3.30 0.00 0.00 52.55 50.92 3giq s ASP 438 Cb -0.01 -2.52 0.00 0.00 -1.09 0.00 0.00 42.92 39.30 3giq s ASP 438 CO -0.03 -0.59 0.00 0.54 0.70 0.00 0.00 175.17 175.78 3giq n ARG 439 N -1.37 3.42 -1.97 2.11 5.12 -1.26 -4.87 116.66 117.84 3giq n ARG 439 Ca 0.07 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.57 3giq n ARG 439 Cb 0.54 -0.62 -0.03 0.00 -1.16 0.00 0.00 32.46 31.19 3giq n ARG 439 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3giq s ALA 440 N -1.12 3.74 0.44 7.54 0.00 -1.19 -4.74 121.76 126.42 3giq s ALA 440 Ca 0.00 1.31 0.04 0.00 0.00 0.00 0.00 51.96 53.31 3giq s ALA 440 Cb 0.00 -3.61 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 3giq s ALA 440 CO 0.00 -0.77 0.03 0.95 0.00 0.00 0.00 175.76 175.96 3giq s THR 441 N 1.25 1.40 0.26 0.00 -4.23 -0.04 -4.89 115.64 109.37 3giq s THR 441 Ca 0.69 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 59.15 3giq s THR 441 Cb -0.42 -2.56 0.26 0.00 1.34 0.00 0.00 72.50 71.12 3giq s THR 441 CO 0.31 0.00 1.92 -0.50 -0.54 0.00 0.00 174.62 175.81 3giq h TRP 442 N 1.65 1.25 0.09 3.99 4.06 -1.94 -0.47 115.95 124.57 3giq h TRP 442 Ca -0.43 0.03 -0.28 0.00 2.06 0.00 0.00 58.89 60.27 3giq h TRP 442 Cb 1.27 -0.42 0.02 0.00 -1.00 0.00 0.00 29.16 29.04 3giq h TRP 442 CO 1.12 0.76 -1.17 -0.44 -3.56 0.00 0.00 178.44 175.16 3giq h ASP 443 N 1.33 0.78 -2.73 -3.49 3.32 -1.96 -3.38 116.42 110.28 3giq h ASP 443 Ca 0.38 -0.70 -0.61 0.00 0.02 0.00 0.00 57.03 56.12 3giq h ASP 443 Cb -0.10 -0.24 -0.41 0.00 0.22 0.00 0.00 39.33 38.80 3giq h ASP 443 CO -0.10 1.51 -0.67 -0.62 -1.72 0.00 0.00 179.24 177.64 3giq n GLU 444 N -3.76 1.63 0.00 3.56 1.02 -1.09 -4.97 120.64 117.04 3giq n GLU 444 Ca -0.12 -4.24 0.09 0.00 -0.02 0.00 0.00 57.16 52.88 3giq n GLU 444 Cb 0.95 -2.12 0.48 0.00 -0.02 0.00 0.00 31.44 30.73 3giq n GLU 444 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 3giq n PRO 445 N 1.86 0.34 -0.15 3.49 -0.04 -0.20 -0.86 135.00 139.43 3giq n PRO 445 Ca 0.24 0.09 0.06 0.00 -0.04 0.00 0.00 63.50 63.84 3giq n PRO 445 Cb 0.39 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.49 3giq n PRO 445 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3giq n THR 446 N -1.21 0.80 -2.02 0.52 -2.24 -1.26 -4.35 114.28 104.52 3giq n THR 446 Ca 0.10 -0.90 -0.41 0.00 -2.27 0.00 0.00 64.05 60.57 3giq n THR 446 Cb 0.12 0.65 -0.02 0.00 -2.10 0.00 0.00 70.33 68.98 3giq n THR 446 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3giq s LEU 447 N -0.99 4.39 0.52 3.22 1.43 -1.22 -4.97 118.68 121.04 3giq s LEU 447 Ca 0.22 2.63 -0.18 0.00 -1.03 0.00 0.00 54.13 55.77 3giq s LEU 447 Cb 0.12 -3.62 -0.07 0.00 0.03 0.00 0.00 46.19 42.65 3giq s LEU 447 CO 0.16 -0.70 1.02 0.00 0.23 0.00 0.00 176.35 177.05 3giq s ALA 448 N 0.18 2.91 0.97 4.21 0.00 -1.26 -3.17 121.76 125.60 3giq s ALA 448 Ca 0.61 0.39 -0.12 0.00 0.00 0.00 0.00 51.96 52.84 3giq s ALA 448 Cb -0.42 -3.19 0.17 0.00 0.00 0.00 0.00 23.12 19.68 3giq s ALA 448 CO 0.41 -0.38 1.09 -1.12 0.00 0.00 0.00 175.76 175.76 3giq s SER 449 N -2.57 2.79 0.22 0.00 0.01 -1.26 -4.26 113.70 108.63 3giq s SER 449 Ca 0.63 1.50 0.10 0.00 1.31 0.00 0.00 55.95 59.48 3giq s SER 449 Cb -0.13 -2.17 -0.05 0.00 0.21 0.00 0.00 66.02 63.88 3giq s SER 449 CO 0.27 -3.07 -0.19 0.68 0.41 0.00 0.00 173.24 171.35 3giq s VAL 450 N -2.83 2.09 0.00 3.43 -7.23 -0.46 -4.77 120.40 110.63 3giq s VAL 450 Ca 0.65 -2.18 0.00 0.00 -1.81 0.00 0.00 61.98 58.64 3giq s VAL 450 Cb -0.20 -2.09 0.00 0.00 0.56 0.00 0.00 36.38 34.65 3giq s VAL 450 CO 0.59 -0.39 0.00 0.61 -0.31 0.00 0.00 175.10 175.59 3giq n GLY 451 N -0.20 0.88 3.55 2.32 0.00 -1.26 -1.47 105.19 109.00 3giq n GLY 451 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 3giq n GLY 451 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3giq s ILE 452 N -2.39 4.97 -0.05 -0.61 -1.09 -1.26 -0.86 121.20 119.91 3giq s ILE 452 Ca 0.00 0.28 -0.01 0.00 -2.23 0.00 0.00 60.65 58.69 3giq s ILE 452 Cb 0.00 -4.03 -0.26 0.00 -1.58 0.00 0.00 42.46 36.59 3giq s ILE 452 CO 0.00 -0.31 0.65 0.00 -1.23 0.00 0.00 174.94 174.04 3giq h ALA 453 N 8.55 0.44 -1.92 9.38 0.00 -1.03 -3.48 119.26 131.20 3giq h ALA 453 Ca -0.27 -1.29 0.08 0.00 0.00 0.00 0.00 54.91 53.43 3giq h ALA 453 Cb 1.12 0.47 -0.19 0.00 0.00 0.00 0.00 17.79 19.19 3giq h ALA 453 CO 0.80 1.30 0.48 0.20 0.00 0.00 0.00 179.25 182.04 3giq s GLY 454 N -5.20 -0.39 -0.02 0.00 0.00 -1.09 -4.37 107.32 96.25 3giq s GLY 454 Ca -0.13 1.52 0.00 0.00 0.00 0.00 0.00 44.72 46.12 3giq s GLY 454 CO 0.82 0.73 0.02 0.14 0.00 0.00 0.00 173.10 174.81 3giq s VAL 455 N -1.96 -0.03 -0.06 1.40 1.01 -0.19 -0.87 120.40 119.70 3giq s VAL 455 Ca -0.00 0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.19 3giq s VAL 455 Cb -0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 36.38 36.27 3giq s VAL 455 CO -0.02 0.08 -0.18 -0.76 0.00 0.00 0.00 175.10 174.22 3giq s LEU 456 N 0.86 2.50 -0.22 3.92 1.43 0.10 -1.55 118.68 125.73 3giq s LEU 456 Ca -0.07 -0.31 0.02 0.00 -1.03 0.00 0.00 54.13 52.73 3giq s LEU 456 Cb -0.11 -1.49 0.04 0.00 0.03 0.00 0.00 46.19 44.66 3giq s LEU 456 CO -0.02 0.30 -0.13 -0.69 0.23 0.00 0.00 176.35 176.04 3giq s VAL 457 N -0.47 1.98 -1.48 -1.59 1.01 0.18 -0.77 120.40 119.26 3giq s VAL 457 Ca 0.06 -1.27 -0.12 0.00 0.00 0.00 0.00 61.98 60.65 3giq s VAL 457 Cb -0.12 -2.00 0.07 0.00 0.00 0.00 0.00 36.38 34.33 3giq s VAL 457 CO 0.01 0.17 0.93 0.59 0.00 0.00 0.00 175.10 176.81 3giq n ASN 458 N 4.56 -5.12 0.00 3.32 5.03 -1.10 -1.48 115.26 120.46 3giq n ASN 458 Ca -0.16 -0.65 0.00 0.00 0.87 0.00 0.00 54.58 54.64 3giq n ASN 458 Cb 0.45 -4.09 0.00 0.00 -1.02 0.00 0.00 39.78 35.12 3giq n ASN 458 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3giq n GLY 459 N -1.68 1.70 3.60 7.41 0.00 -0.17 -4.13 105.19 111.92 3giq n GLY 459 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 3giq n GLY 459 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3giq s ALA 460 N -3.25 3.11 0.22 4.61 0.00 -0.55 -4.91 121.76 120.98 3giq s ALA 460 Ca 0.00 -0.84 -0.30 0.00 0.00 0.00 0.00 51.96 50.82 3giq s ALA 460 Cb 0.00 -1.43 -0.10 0.00 0.00 0.00 0.00 23.12 21.60 3giq s ALA 460 CO 0.00 0.47 1.42 -2.00 0.00 0.00 0.00 175.76 175.65 3giq s GLU 461 N -0.49 4.29 0.00 0.00 2.12 -1.26 -0.64 118.70 122.72 3giq s GLU 461 Ca 0.08 2.23 0.00 0.00 0.36 0.00 0.00 54.97 57.64 3giq s GLU 461 Cb -0.12 -3.15 0.00 0.00 0.26 0.00 0.00 34.13 31.12 3giq s GLU 461 CO 0.02 -0.41 0.00 1.33 -0.54 0.00 0.00 175.26 175.66 3giq n VAL 462 N 2.73 0.00 -3.81 3.70 0.24 -0.60 -3.99 118.33 116.60 3giq n VAL 462 Ca 0.08 -0.05 -0.12 0.00 -2.04 0.00 0.00 64.34 62.21 3giq n VAL 462 Cb 0.41 0.46 -0.12 0.00 -1.47 0.00 0.00 33.84 33.11 3giq n VAL 462 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3giq s PHE 463 N -1.45 -0.19 -0.08 6.34 5.36 -1.18 -3.22 117.98 123.56 3giq s PHE 463 Ca 0.00 0.47 0.25 0.00 -0.96 0.00 0.00 56.93 56.69 3giq s PHE 463 Cb 0.00 0.06 0.74 0.00 -0.34 0.00 0.00 43.02 43.48 3giq s PHE 463 CO 0.00 -0.09 1.75 -1.00 -1.46 0.00 0.00 175.22 174.41 3giq h PRO 464 N 5.89 0.00 -4.69 10.12 0.13 -1.88 -0.48 132.00 141.09 3giq h PRO 464 Ca -0.25 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.19 3giq h PRO 464 Cb 1.20 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.11 3giq h PRO 464 CO 0.40 0.15 -0.52 -1.14 -0.23 0.00 0.00 178.00 176.66 3giq s GLN 465 N -3.42 3.21 0.75 0.86 2.00 -1.26 -5.08 119.66 116.71 3giq s GLN 465 Ca 0.03 -0.82 -0.11 0.00 -2.00 0.00 0.00 55.36 52.45 3giq s GLN 465 Cb 0.08 -3.70 0.05 0.00 0.80 0.00 0.00 33.01 30.23 3giq s GLN 465 CO 0.64 -0.53 1.10 -2.14 -0.50 0.00 0.00 175.29 173.86 3giq s PRO 466 N 1.63 2.35 0.55 1.67 0.02 -1.20 -4.05 135.00 135.97 3giq s PRO 466 Ca 0.04 1.21 -0.20 0.00 0.02 0.00 0.00 61.00 62.07 3giq s PRO 466 Cb -0.18 -1.91 -0.05 0.00 0.02 0.00 0.00 34.50 32.39 3giq s PRO 466 CO 0.08 -1.58 1.24 -1.25 -0.33 0.00 0.00 177.00 175.16 3giq s PRO 467 N -4.75 3.18 0.14 5.54 0.04 -1.26 -4.95 135.00 132.95 3giq s PRO 467 Ca 0.62 1.93 -0.13 0.00 0.04 0.00 0.00 61.00 63.46 3giq s PRO 467 Cb -0.18 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.25 3giq s PRO 467 CO 0.53 -1.06 1.61 0.00 0.04 0.00 0.00 177.00 178.12 3giq h ALA 468 N 1.29 0.62 -3.00 8.56 0.00 -1.95 -3.46 119.26 121.32 3giq h ALA 468 Ca -0.50 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.15 3giq h ALA 468 Cb 1.29 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3giq h ALA 468 CO 0.57 0.38 0.00 -0.40 0.00 0.00 0.00 179.25 179.80 3giq n ASP 469 N -4.41 0.00 -4.65 0.00 5.68 -1.26 -5.07 116.55 106.84 3giq n ASP 469 Ca 0.00 0.00 -0.47 0.00 -0.50 0.00 0.00 54.79 53.82 3giq n ASP 469 Cb 0.28 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.21 3giq n ASP 469 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3giq n GLY 470 N 3.98 0.91 3.86 6.12 0.00 -1.26 -4.97 105.19 113.83 3giq n GLY 470 Ca 0.00 0.65 -0.32 0.00 0.00 0.00 0.00 46.02 46.35 3giq n GLY 470 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3giq s ARG 471 N 0.67 3.91 0.02 1.61 0.52 -1.26 -4.89 118.95 119.53 3giq s ARG 471 Ca 0.79 0.57 0.28 0.00 -0.52 0.00 0.00 55.73 56.85 3giq s ARG 471 Cb -0.75 -2.44 1.18 0.00 0.52 0.00 0.00 34.95 33.47 3giq s ARG 471 CO 0.41 0.11 1.90 -0.35 0.02 0.00 0.00 175.30 177.40 3giq n PRO 472 N -0.65 0.03 -1.90 3.54 -0.04 -1.26 -4.73 135.00 129.99 3giq n PRO 472 Ca 0.03 0.03 -0.37 0.00 -0.04 0.00 0.00 63.50 63.14 3giq n PRO 472 Cb 0.53 -1.54 0.04 0.00 -0.04 0.00 0.00 33.50 32.50 3giq n PRO 472 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3giq s GLY 473 N -3.07 2.83 0.13 0.55 0.00 0.07 -4.71 107.32 103.13 3giq s GLY 473 Ca 0.13 1.18 0.10 0.00 0.00 0.00 0.00 44.72 46.13 3giq s GLY 473 CO 0.53 1.64 -0.23 1.20 0.00 0.00 0.00 173.10 176.24 3giq s GLN 474 N -3.07 1.29 -0.16 2.90 -0.21 -1.26 -4.21 119.66 114.94 3giq s GLN 474 Ca 0.74 -1.31 -0.28 0.00 0.02 0.00 0.00 55.36 54.53 3giq s GLN 474 Cb -0.36 -1.64 -0.00 0.00 1.00 0.00 0.00 33.01 32.01 3giq s GLN 474 CO 0.41 0.38 0.98 0.08 -2.12 0.00 0.00 175.29 175.01 3giq s VAL 475 N -1.28 4.77 -1.09 1.09 1.01 -1.26 -1.28 120.40 122.36 3giq s VAL 475 Ca 0.12 1.95 -0.16 0.00 0.00 0.00 0.00 61.98 63.89 3giq s VAL 475 Cb -0.09 -4.27 0.15 0.00 0.00 0.00 0.00 36.38 32.17 3giq s VAL 475 CO 0.06 -0.05 1.30 -0.76 0.00 0.00 0.00 175.10 175.65 3giq s LEU 476 N 2.45 5.04 -0.13 3.92 1.43 0.52 -4.92 118.68 126.98 3giq s LEU 476 Ca 0.45 -2.57 -0.29 0.00 -1.03 0.00 0.00 54.13 50.68 3giq s LEU 476 Cb -0.17 -2.40 -0.02 0.00 0.03 0.00 0.00 46.19 43.63 3giq s LEU 476 CO 0.13 -0.89 1.30 -0.13 0.23 0.00 0.00 176.35 176.98 3giq s ARG 477 N 2.10 4.25 0.00 1.70 0.52 -1.26 -4.67 118.95 121.59 3giq s ARG 477 Ca 0.38 1.73 0.21 0.00 -0.52 0.00 0.00 55.73 57.54 3giq s ARG 477 Cb -0.04 -3.74 1.26 0.00 0.52 0.00 0.00 34.95 32.95 3giq s ARG 477 CO -0.04 -0.67 1.64 0.00 0.02 0.00 0.00 175.30 176.25