#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hg7 n GLN 5 N 0.00 0.00 -4.21 -1.46 7.27 -1.26 -2.41 117.38 115.31 3hg7 n GLN 5 Ca 0.00 0.00 -0.23 0.00 0.07 0.00 0.00 57.00 56.84 3hg7 n GLN 5 Cb 0.00 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 32.59 3hg7 n GLN 5 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 3hg7 s ARG 6 N 0.00 2.58 -0.10 3.69 0.52 -0.79 -5.02 118.95 119.82 3hg7 s ARG 6 Ca 0.00 -1.21 0.04 0.00 -0.52 0.00 0.00 55.73 54.04 3hg7 s ARG 6 Cb 0.00 -2.36 0.00 0.00 0.52 0.00 0.00 34.95 33.11 3hg7 s ARG 6 CO 0.00 0.40 -0.24 0.99 0.02 0.00 0.00 175.30 176.47 3hg7 s THR 7 N -2.15 2.05 -0.16 0.02 2.01 -1.26 -0.21 115.64 115.94 3hg7 s THR 7 Ca 0.31 -1.01 -0.06 0.00 0.31 0.00 0.00 61.69 61.25 3hg7 s THR 7 Cb -0.07 -1.78 -0.04 0.00 0.01 0.00 0.00 72.50 70.62 3hg7 s THR 7 CO 0.22 0.56 0.05 -0.22 -0.69 0.00 0.00 174.62 174.54 3hg7 s LEU 8 N 0.40 3.80 -0.15 4.42 2.96 0.82 -1.21 118.68 129.73 3hg7 s LEU 8 Ca -0.17 0.12 -0.03 0.00 -0.22 0.00 0.00 54.13 53.83 3hg7 s LEU 8 Cb -0.18 -1.94 -0.02 0.00 0.50 0.00 0.00 46.19 44.55 3hg7 s LEU 8 CO 0.08 0.24 -0.06 -0.22 -1.32 0.00 0.00 176.35 175.07 3hg7 s LEU 9 N -0.03 3.14 -0.28 -0.68 2.96 -0.41 -0.29 118.68 123.10 3hg7 s LEU 9 Ca 0.06 -0.16 -0.12 0.00 -0.22 0.00 0.00 54.13 53.69 3hg7 s LEU 9 Cb -0.12 -1.74 -0.05 0.00 0.50 0.00 0.00 46.19 44.78 3hg7 s LEU 9 CO 0.01 0.18 0.22 -0.76 -1.32 0.00 0.00 176.35 174.68 3hg7 s LEU 10 N 0.31 4.03 -0.45 -0.68 1.43 -0.14 -1.75 118.68 121.43 3hg7 s LEU 10 Ca -0.05 0.03 0.09 0.00 -1.03 0.00 0.00 54.13 53.17 3hg7 s LEU 10 Cb -0.14 -2.17 0.33 0.00 0.03 0.00 0.00 46.19 44.23 3hg7 s LEU 10 CO 0.03 -0.08 0.77 -0.11 0.23 0.00 0.00 176.35 177.20 3hg7 n LEU 11 N 5.11 1.99 -4.21 1.79 7.94 -0.31 -1.31 117.00 127.99 3hg7 n LEU 11 Ca -0.13 -5.20 -0.20 0.00 -1.11 0.00 0.00 56.01 49.38 3hg7 n LEU 11 Cb 0.52 0.26 -0.12 0.00 0.53 0.00 0.00 43.42 44.61 3hg7 n LEU 11 CO 0.34 2.27 -0.47 -0.55 -1.11 0.00 0.00 177.39 177.87 3hg7 s SER 12 N -2.59 1.97 0.60 1.96 0.15 -1.26 -2.88 113.70 111.64 3hg7 s SER 12 Ca 0.42 -0.67 0.38 0.00 0.70 0.00 0.00 55.95 56.79 3hg7 s SER 12 Cb 0.30 -0.08 1.86 0.00 -1.71 0.00 0.00 66.02 66.39 3hg7 s SER 12 CO -0.10 -0.05 2.16 0.06 1.20 0.00 0.00 173.24 176.51 3hg7 h GLN 13 N 4.11 0.00 -0.70 5.44 3.07 -1.96 -1.27 115.11 123.80 3hg7 h GLN 13 Ca -0.42 0.00 -0.07 0.00 0.09 0.00 0.00 58.65 58.24 3hg7 h GLN 13 Cb 1.19 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.70 3hg7 h GLN 13 CO 0.42 0.00 0.09 -0.25 0.09 0.00 0.00 178.83 179.18 3hg7 n ASP 14 N -3.05 4.90 -0.29 0.06 8.00 -1.26 -4.71 116.55 120.20 3hg7 n ASP 14 Ca -0.01 -2.91 0.10 0.00 0.71 0.00 0.00 54.79 52.68 3hg7 n ASP 14 Cb 0.19 -0.69 0.23 0.00 -0.02 0.00 0.00 41.12 40.84 3hg7 n ASP 14 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 3hg7 h ASN 15 N 3.05 -0.24 -0.59 -2.24 2.35 -1.62 0.13 115.58 116.42 3hg7 h ASN 15 Ca 0.09 0.21 -0.00 0.00 -0.55 0.00 0.00 56.30 56.05 3hg7 h ASN 15 Cb 1.94 0.34 -0.03 0.00 0.05 0.00 0.00 38.32 40.62 3hg7 h ASN 15 CO 0.52 -0.20 0.35 0.00 -1.65 0.00 0.00 177.43 176.45 3hg7 h ALA 16 N 1.79 0.75 -0.05 -0.83 0.00 -1.86 0.16 119.26 119.22 3hg7 h ALA 16 Ca 0.50 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 3hg7 h ALA 16 Cb 0.96 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 3hg7 h ALA 16 CO -0.71 0.24 -0.00 1.25 0.00 0.00 0.00 179.25 180.02 3hg7 h HIS 17 N 0.80 0.10 -0.76 0.00 -0.00 -1.66 -2.35 115.15 111.26 3hg7 h HIS 17 Ca 0.21 -0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.61 3hg7 h HIS 17 Cb -0.01 -0.02 -0.05 0.00 -0.00 0.00 0.00 27.41 27.33 3hg7 h HIS 17 CO -0.02 0.39 0.47 1.88 -0.00 0.00 0.00 177.93 180.65 3hg7 h TYR 18 N -0.23 0.86 -0.50 5.26 0.05 -0.77 -1.18 116.97 120.46 3hg7 h TYR 18 Ca 0.01 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.80 3hg7 h TYR 18 Cb 0.36 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 37.80 3hg7 h TYR 18 CO 0.04 0.45 0.24 1.49 -1.05 0.00 0.00 178.16 179.33 3hg7 h GLU 19 N 0.87 0.72 0.11 4.88 4.81 -0.61 0.82 114.58 126.18 3hg7 h GLU 19 Ca 0.33 -0.11 0.02 0.00 -0.13 0.00 0.00 59.36 59.47 3hg7 h GLU 19 Cb 0.12 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 3hg7 h GLU 19 CO -0.15 0.60 -0.25 -0.09 -0.73 0.00 0.00 179.01 178.39 3hg7 h ARG 20 N 0.66 -0.43 -0.32 1.92 2.43 -1.13 -0.91 114.38 116.61 3hg7 h ARG 20 Ca 0.17 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.35 3hg7 h ARG 20 Cb 0.12 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 3hg7 h ARG 20 CO -0.02 -0.29 0.10 -0.07 -1.51 0.00 0.00 179.97 178.18 3hg7 h LEU 21 N -0.45 0.47 -1.02 3.80 3.38 -0.97 -2.03 115.31 118.49 3hg7 h LEU 21 Ca 0.03 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 3hg7 h LEU 21 Cb 0.47 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3hg7 h LEU 21 CO -0.15 0.55 -0.32 -0.07 0.09 0.00 0.00 178.44 178.54 3hg7 h LEU 22 N 0.37 0.30 -1.09 1.67 4.07 -0.84 -2.10 115.31 117.69 3hg7 h LEU 22 Ca 0.10 -0.11 -0.09 0.00 0.08 0.00 0.00 57.88 57.87 3hg7 h LEU 22 Cb 0.25 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.89 3hg7 h LEU 22 CO -0.00 0.62 -0.41 0.11 -1.08 0.00 0.00 178.44 177.67 3hg7 h LYS 23 N 0.26 0.00 -0.00 1.13 1.57 -1.02 -2.91 116.57 115.60 3hg7 h LYS 23 Ca 0.03 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.66 3hg7 h LYS 23 Cb 0.70 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 3hg7 h LYS 23 CO 0.05 0.41 -0.72 0.00 -0.57 0.00 0.00 179.45 178.62 3hg7 h ALA 24 N 1.59 0.80 0.00 3.86 0.00 -0.91 -3.23 119.26 121.36 3hg7 h ALA 24 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.25 3hg7 h ALA 24 Cb 0.81 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3hg7 h ALA 24 CO 0.05 0.89 0.00 0.00 0.00 0.00 0.00 179.25 180.19 3hg7 h ALA 25 N 1.25 1.00 -6.50 0.00 0.00 -1.18 -3.48 119.26 110.35 3hg7 h ALA 25 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.51 3hg7 h ALA 25 Cb 1.28 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.08 3hg7 h ALA 25 CO 0.10 0.00 -1.10 0.72 0.00 0.00 0.00 179.25 178.96 3hg7 n HIS 26 N -2.30 -2.57 -3.52 0.00 -0.00 -1.22 -4.93 115.22 100.68 3hg7 n HIS 26 Ca 0.03 1.07 -0.39 0.00 -0.00 0.00 0.00 57.72 58.42 3hg7 n HIS 26 Cb 0.26 -2.27 -0.10 0.00 -0.00 0.00 0.00 29.99 27.88 3hg7 n HIS 26 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 3hg7 s LEU 27 N -3.23 4.16 0.59 2.41 1.43 -1.26 -5.07 118.68 117.71 3hg7 s LEU 27 Ca 0.26 -0.05 -0.16 0.00 -1.03 0.00 0.00 54.13 53.15 3hg7 s LEU 27 Cb -0.03 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 3hg7 s LEU 27 CO 0.87 -0.14 1.06 -2.16 0.23 0.00 0.00 176.35 176.21 3hg7 s PRO 28 N 1.85 3.33 -1.70 1.29 0.04 -1.26 -3.68 135.00 134.86 3hg7 s PRO 28 Ca 0.09 1.23 -0.02 0.00 0.04 0.00 0.00 61.00 62.35 3hg7 s PRO 28 Cb -0.16 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.35 3hg7 s PRO 28 CO 0.11 -0.80 0.25 0.72 0.04 0.00 0.00 177.00 177.31 3hg7 n HIS 29 N -1.95 -1.40 -3.79 0.56 8.25 -1.26 -4.97 115.22 110.66 3hg7 n HIS 29 Ca 0.09 0.21 -0.27 0.00 -0.26 0.00 0.00 57.72 57.49 3hg7 n HIS 29 Cb 0.53 -4.21 -0.17 0.00 1.12 0.00 0.00 29.99 27.26 3hg7 n HIS 29 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3hg7 s LEU 30 N -6.29 1.28 -0.07 2.41 2.96 -1.01 -1.88 118.68 116.08 3hg7 s LEU 30 Ca 0.12 -0.70 -0.26 0.00 -0.22 0.00 0.00 54.13 53.07 3hg7 s LEU 30 Cb -0.05 -0.68 -0.03 0.00 0.50 0.00 0.00 46.19 45.93 3hg7 s LEU 30 CO 0.15 -0.26 0.84 -0.60 -1.32 0.00 0.00 176.35 175.17 3hg7 s ARG 31 N 1.80 4.44 -0.29 1.98 3.52 0.70 -4.93 118.95 126.17 3hg7 s ARG 31 Ca -0.00 1.12 -0.07 0.00 -0.13 0.00 0.00 55.73 56.64 3hg7 s ARG 31 Cb -0.16 -3.49 -0.00 0.00 -1.56 0.00 0.00 34.95 29.74 3hg7 s ARG 31 CO -0.07 -0.10 0.09 0.42 -0.81 0.00 0.00 175.30 174.83 3hg7 s ILE 32 N 1.29 4.15 0.23 4.11 1.01 -1.26 -0.13 121.20 130.60 3hg7 s ILE 32 Ca 0.43 -0.51 0.10 0.00 0.00 0.00 0.00 60.65 60.66 3hg7 s ILE 32 Cb -0.18 -3.08 -0.04 0.00 0.01 0.00 0.00 42.46 39.16 3hg7 s ILE 32 CO 0.20 0.15 -0.07 -0.76 0.00 0.00 0.00 174.94 174.46 3hg7 s LEU 33 N 1.55 3.03 -0.01 2.97 1.43 0.61 -4.98 118.68 123.27 3hg7 s LEU 33 Ca 0.04 -0.66 0.01 0.00 -1.03 0.00 0.00 54.13 52.49 3hg7 s LEU 33 Cb -0.17 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.44 3hg7 s LEU 33 CO 0.03 0.05 -0.03 -0.60 0.23 0.00 0.00 176.35 176.03 3hg7 s ARG 34 N -3.28 0.32 -0.12 1.70 3.52 -1.26 -0.97 118.95 118.86 3hg7 s ARG 34 Ca 0.28 -0.10 -0.01 0.00 -0.13 0.00 0.00 55.73 55.77 3hg7 s ARG 34 Cb -0.07 -0.33 0.03 0.00 -1.56 0.00 0.00 34.95 33.02 3hg7 s ARG 34 CO 0.17 0.04 -0.03 0.00 -0.81 0.00 0.00 175.30 174.68 3hg7 s ALA 35 N 0.10 1.06 -1.29 6.12 0.00 -0.43 -4.93 121.76 122.40 3hg7 s ALA 35 Ca -0.01 -0.45 0.27 0.00 0.00 0.00 0.00 51.96 51.77 3hg7 s ALA 35 Cb -0.04 -0.92 0.80 0.00 0.00 0.00 0.00 23.12 22.97 3hg7 s ALA 35 CO -0.00 -0.60 1.61 -0.25 0.00 0.00 0.00 175.76 176.52 3hg7 n ASP 36 N 5.03 0.54 -3.78 0.00 9.92 -1.26 -4.50 116.55 122.49 3hg7 n ASP 36 Ca -0.10 -0.35 -0.15 0.00 -0.53 0.00 0.00 54.79 53.66 3hg7 n ASP 36 Cb 0.49 0.05 -0.09 0.00 -0.64 0.00 0.00 41.12 40.94 3hg7 n ASP 36 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3hg7 s ASN 37 N -2.79 0.86 0.18 -2.24 2.20 -1.26 -5.05 114.94 106.84 3hg7 s ASN 37 Ca 0.18 -1.55 -0.06 0.00 -0.94 0.00 0.00 52.86 50.49 3hg7 s ASN 37 Cb 0.19 0.47 0.07 0.00 -2.00 0.00 0.00 41.25 39.98 3hg7 s ASN 37 CO 0.59 -0.96 1.49 -0.61 -2.94 0.00 0.00 177.10 174.67 3hg7 h GLN 38 N 2.38 0.67 -0.29 3.55 4.15 -1.96 -2.67 115.11 120.93 3hg7 h GLN 38 Ca -0.30 -0.40 0.03 0.00 0.77 0.00 0.00 58.65 58.74 3hg7 h GLN 38 Cb 1.24 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.94 3hg7 h GLN 38 CO 0.45 1.02 0.10 1.03 -1.93 0.00 0.00 178.83 179.49 3hg7 h SER 39 N 0.52 0.10 -0.21 -0.69 0.87 -1.99 -0.44 113.55 111.71 3hg7 h SER 39 Ca 0.02 0.03 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 3hg7 h SER 39 Cb 1.07 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.04 3hg7 h SER 39 CO 0.10 0.09 -0.09 0.44 -0.53 0.00 0.00 176.83 176.84 3hg7 h ASP 40 N 0.23 0.55 -0.08 6.23 3.32 -1.96 -2.82 116.42 121.89 3hg7 h ASP 40 Ca 0.13 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 56.96 3hg7 h ASP 40 Cb 0.10 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 3hg7 h ASP 40 CO -0.14 0.69 -0.16 0.00 -1.72 0.00 0.00 179.24 177.91 3hg7 h ALA 41 N 1.37 1.25 -1.00 3.45 0.00 -1.00 -2.96 119.26 120.37 3hg7 h ALA 41 Ca 0.10 -0.28 0.19 0.00 0.00 0.00 0.00 54.91 54.91 3hg7 h ALA 41 Cb 0.49 -0.12 -0.11 0.00 0.00 0.00 0.00 17.79 18.05 3hg7 h ALA 41 CO 0.03 0.49 0.60 0.93 0.00 0.00 0.00 179.25 181.30 3hg7 h GLU 42 N 0.41 0.74 0.00 0.00 4.39 -0.83 -0.02 114.58 119.27 3hg7 h GLU 42 Ca 0.07 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.73 3hg7 h GLU 42 Cb 0.53 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3hg7 h GLU 42 CO 0.03 0.49 0.00 0.87 -1.16 0.00 0.00 179.01 179.24 3hg7 h LYS 43 N 0.76 0.00 0.00 2.33 1.57 -1.61 -3.38 116.57 116.24 3hg7 h LYS 43 Ca 0.57 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.30 3hg7 h LYS 43 Cb 0.88 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.18 3hg7 h LYS 43 CO -0.38 0.00 -1.46 1.28 -0.57 0.00 0.00 179.45 178.32 3hg7 n LEU 44 N -3.07 0.00 0.12 2.94 4.77 -0.20 -4.71 117.00 116.85 3hg7 n LEU 44 Ca 0.03 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.01 3hg7 n LEU 44 Cb 0.47 0.07 0.26 0.00 -2.33 0.00 0.00 43.42 41.89 3hg7 n LEU 44 CO 0.32 0.07 0.67 -0.29 -1.33 0.00 0.00 177.39 176.82 3hg7 h ILE 45 N 0.00 1.30 0.00 -0.08 2.10 -1.26 -1.23 117.51 118.35 3hg7 h ILE 45 Ca -0.07 -1.47 -0.00 0.00 1.08 0.00 0.00 64.86 64.40 3hg7 h ILE 45 Cb 0.77 1.70 -0.00 0.00 -1.09 0.00 0.00 36.82 38.19 3hg7 h ILE 45 CO 0.00 0.43 -0.01 1.23 -1.08 0.00 0.00 178.15 178.73 3hg7 h GLY 46 N 1.22 0.00 0.82 8.18 0.00 -1.83 -1.71 103.07 109.76 3hg7 h GLY 46 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3hg7 h GLY 46 CO 0.06 0.00 -0.30 1.18 0.00 0.00 0.00 176.54 177.48 3hg7 n GLU 47 N -3.18 0.41 -3.06 4.80 1.02 -0.46 -3.93 120.64 116.23 3hg7 n GLU 47 Ca -0.02 -0.21 -0.41 0.00 -0.02 0.00 0.00 57.16 56.50 3hg7 n GLU 47 Cb 0.11 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 29.98 3hg7 n GLU 47 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hg7 s ALA 48 N -2.73 3.62 0.18 0.62 0.00 -0.64 -4.58 121.76 118.22 3hg7 s ALA 48 Ca 0.19 -0.36 0.06 0.00 0.00 0.00 0.00 51.96 51.86 3hg7 s ALA 48 Cb 0.19 -3.09 0.02 0.00 0.00 0.00 0.00 23.12 20.24 3hg7 s ALA 48 CO 0.58 -0.83 1.40 0.45 0.00 0.00 0.00 175.76 177.37 3hg7 h HIS 49 N 7.83 0.10 -4.25 0.00 3.86 -1.31 -3.00 115.15 118.38 3hg7 h HIS 49 Ca -0.26 -0.06 -0.53 0.00 -1.16 0.00 0.00 60.37 58.36 3hg7 h HIS 49 Cb 1.12 -0.01 -0.28 0.00 1.06 0.00 0.00 27.41 29.29 3hg7 h HIS 49 CO 0.75 0.89 -0.83 0.42 0.86 0.00 0.00 177.93 180.02 3hg7 s ILE 50 N -3.13 1.34 -0.03 2.45 1.01 -0.58 -1.17 121.20 121.09 3hg7 s ILE 50 Ca -0.01 -0.81 0.04 0.00 0.00 0.00 0.00 60.65 59.87 3hg7 s ILE 50 Cb 0.11 -1.13 -0.00 0.00 0.01 0.00 0.00 42.46 41.44 3hg7 s ILE 50 CO 0.81 0.31 -0.15 -0.22 0.00 0.00 0.00 174.94 175.69 3hg7 s LEU 51 N -0.57 1.91 -0.14 2.97 2.96 -0.02 -1.29 118.68 124.49 3hg7 s LEU 51 Ca 0.06 -0.29 0.01 0.00 -0.22 0.00 0.00 54.13 53.69 3hg7 s LEU 51 Cb -0.07 -0.82 0.02 0.00 0.50 0.00 0.00 46.19 45.82 3hg7 s LEU 51 CO -0.00 0.14 -0.17 -0.32 -1.32 0.00 0.00 176.35 174.68 3hg7 s MET 52 N -0.03 2.51 0.12 1.98 -2.45 -0.72 -0.26 119.30 120.46 3hg7 s MET 52 Ca -0.01 -0.65 -0.25 0.00 -1.25 0.00 0.00 55.69 53.53 3hg7 s MET 52 Cb -0.09 -2.18 0.07 0.00 1.25 0.00 0.00 34.83 33.88 3hg7 s MET 52 CO 0.01 -0.15 0.78 0.00 1.05 0.00 0.00 175.02 176.70 3hg7 s ALA 53 N 1.22 -1.62 0.23 4.11 0.00 -1.04 -1.16 121.76 123.49 3hg7 s ALA 53 Ca 0.00 0.47 -0.30 0.00 0.00 0.00 0.00 51.96 52.13 3hg7 s ALA 53 Cb -0.14 0.69 -0.09 0.00 0.00 0.00 0.00 23.12 23.58 3hg7 s ALA 53 CO -0.07 -0.83 0.99 -1.21 0.00 0.00 0.00 175.76 174.63 3hg7 s GLU 54 N -3.49 4.77 0.23 0.00 8.01 -1.14 -1.67 118.70 125.41 3hg7 s GLU 54 Ca 0.06 1.57 -0.08 0.00 0.01 0.00 0.00 54.97 56.52 3hg7 s GLU 54 Cb -0.02 -3.27 0.38 0.00 -4.31 0.00 0.00 34.13 26.91 3hg7 s GLU 54 CO -0.06 0.38 1.65 -1.35 0.01 0.00 0.00 175.26 175.89 3hg7 h PRO 55 N 4.36 0.13 0.00 0.39 0.11 -1.93 -1.21 132.00 133.84 3hg7 h PRO 55 Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 3hg7 h PRO 55 Cb 1.20 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 3hg7 h PRO 55 CO 0.69 0.08 -0.05 0.00 -0.21 0.00 0.00 178.00 178.51 3hg7 h ALA 56 N 1.64 1.84 -0.16 -0.75 0.00 -1.94 -0.80 119.26 119.08 3hg7 h ALA 56 Ca 0.38 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 55.03 3hg7 h ALA 56 Cb 0.64 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.43 3hg7 h ALA 56 CO -0.59 0.06 -0.73 0.00 0.00 0.00 0.00 179.25 177.99 3hg7 h ARG 57 N 0.00 0.77 -0.04 0.00 3.08 -1.57 -3.33 114.38 113.30 3hg7 h ARG 57 Ca -0.00 -0.62 -0.22 0.00 0.07 0.00 0.00 59.98 59.21 3hg7 h ARG 57 Cb 0.09 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.27 3hg7 h ARG 57 CO 0.01 1.23 -0.86 0.00 -1.07 0.00 0.00 179.97 179.27 3hg7 h ALA 58 N 0.55 0.41 -0.71 0.04 0.00 -0.91 -3.39 119.26 115.25 3hg7 h ALA 58 Ca -0.05 -0.66 0.16 0.00 0.00 0.00 0.00 54.91 54.36 3hg7 h ALA 58 Cb 1.36 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 19.01 3hg7 h ALA 58 CO 0.15 0.77 0.01 -0.22 0.00 0.00 0.00 179.25 179.96 3hg7 h LYS 59 N 0.29 0.11 0.00 0.00 3.64 -1.27 0.13 116.57 119.48 3hg7 h LYS 59 Ca -0.06 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3hg7 h LYS 59 Cb 1.48 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.28 3hg7 h LYS 59 CO 0.15 0.07 0.00 -0.35 -2.27 0.00 0.00 179.45 177.06 3hg7 n PRO 60 N -5.32 0.13 -0.00 1.90 -0.04 -1.26 -2.95 135.00 127.46 3hg7 n PRO 60 Ca 0.12 0.35 0.09 0.00 -0.04 0.00 0.00 63.50 64.02 3hg7 n PRO 60 Cb 0.43 -1.75 -0.11 0.00 -0.04 0.00 0.00 33.50 32.03 3hg7 n PRO 60 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3hg7 n LEU 61 N -2.00 0.74 -0.12 1.53 4.77 0.38 -4.69 117.00 117.61 3hg7 n LEU 61 Ca 0.03 -0.43 -0.00 0.00 -0.03 0.00 0.00 56.01 55.57 3hg7 n LEU 61 Cb 0.22 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 41.57 3hg7 n LEU 61 CO 0.18 0.19 1.09 -0.07 -1.33 0.00 0.00 177.39 177.45 3hg7 h LEU 62 N 0.00 0.71 -2.66 2.23 3.38 -1.21 -1.07 115.31 116.69 3hg7 h LEU 62 Ca 0.00 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 3hg7 h LEU 62 Cb 0.48 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 3hg7 h LEU 62 CO 0.00 0.62 -0.01 0.00 0.09 0.00 0.00 178.44 179.14 3hg7 h ALA 63 N 1.49 1.26 -0.00 1.53 0.00 -1.84 -1.16 119.26 120.55 3hg7 h ALA 63 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3hg7 h ALA 63 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3hg7 h ALA 63 CO -0.02 0.01 -0.32 1.63 0.00 0.00 0.00 179.25 180.54 3hg7 n LYS 64 N -3.47 0.19 -1.48 0.00 5.02 -0.41 -4.63 118.16 113.39 3hg7 n LYS 64 Ca -0.03 -0.09 -0.39 0.00 -2.02 0.00 0.00 58.31 55.78 3hg7 n LYS 64 Cb 0.09 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.58 3hg7 n LYS 64 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hg7 n ALA 65 N -1.33 7.30 1.86 7.82 0.00 -0.44 -3.55 120.51 132.18 3hg7 n ALA 65 Ca 0.08 -3.67 0.14 0.00 0.00 0.00 0.00 53.44 49.99 3hg7 n ALA 65 Cb 0.33 -3.26 0.76 0.00 0.00 0.00 0.00 19.45 17.28 3hg7 n ALA 65 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hg7 n ASN 66 N 3.35 0.39 -0.49 0.00 3.02 -1.26 -2.14 115.26 118.12 3hg7 n ASN 66 Ca 0.74 -1.22 0.05 0.00 -0.03 0.00 0.00 54.58 54.12 3hg7 n ASN 66 Cb 0.24 -0.01 0.08 0.00 -0.61 0.00 0.00 39.78 39.49 3hg7 n ASN 66 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3hg7 n LYS 67 N -0.66 1.30 -2.32 3.52 5.02 -1.25 -5.04 118.16 118.73 3hg7 n LYS 67 Ca 0.21 -1.44 -0.42 0.00 -2.02 0.00 0.00 58.31 54.63 3hg7 n LYS 67 Cb 0.16 -1.22 -0.03 0.00 -0.02 0.00 0.00 35.03 33.92 3hg7 n LYS 67 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3hg7 s LEU 68 N -0.93 4.32 -0.13 -0.35 2.96 -0.91 -4.11 118.68 119.53 3hg7 s LEU 68 Ca 0.16 2.03 0.02 0.00 -0.22 0.00 0.00 54.13 56.11 3hg7 s LEU 68 Cb 0.10 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 43.13 3hg7 s LEU 68 CO 0.14 -0.64 -0.11 -1.20 -1.32 0.00 0.00 176.35 173.23 3hg7 n SER 69 N 4.98 2.92 -3.71 3.68 7.64 -0.32 -4.60 113.62 124.20 3hg7 n SER 69 Ca 0.12 -0.07 -0.13 0.00 1.01 0.00 0.00 58.87 59.80 3hg7 n SER 69 Cb 0.45 -0.13 -0.14 0.00 -1.01 0.00 0.00 64.21 63.38 3hg7 n SER 69 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 3hg7 s TRP 70 N -2.27 -0.30 -0.24 1.43 -0.00 -1.10 -0.70 118.94 115.77 3hg7 s TRP 70 Ca -0.17 0.75 -0.00 0.00 -0.00 0.00 0.00 56.10 56.68 3hg7 s TRP 70 Cb 0.05 -0.04 0.03 0.00 -0.00 0.00 0.00 33.47 33.51 3hg7 s TRP 70 CO 0.32 -0.25 -0.10 0.12 -0.00 0.00 0.00 176.95 177.04 3hg7 s PHE 71 N 1.66 3.07 -0.44 5.86 2.19 -0.04 -0.84 117.98 129.44 3hg7 s PHE 71 Ca -0.05 -1.77 -0.20 0.00 0.33 0.00 0.00 56.93 55.24 3hg7 s PHE 71 Cb -0.11 -2.00 0.03 0.00 -1.31 0.00 0.00 43.02 39.62 3hg7 s PHE 71 CO -0.08 -0.78 0.60 -1.14 1.83 0.00 0.00 175.22 175.65 3hg7 s GLN 72 N 1.26 3.23 0.39 10.12 2.00 0.64 -1.25 119.66 136.04 3hg7 s GLN 72 Ca -0.01 -0.49 -0.26 0.00 -2.00 0.00 0.00 55.36 52.60 3hg7 s GLN 72 Cb -0.17 -3.96 -0.09 0.00 0.80 0.00 0.00 33.01 29.59 3hg7 s GLN 72 CO -0.06 -0.99 1.18 0.45 -0.50 0.00 0.00 175.29 175.37 3hg7 s SER 73 N 2.00 6.59 0.00 6.67 0.15 0.11 -2.50 113.70 126.72 3hg7 s SER 73 Ca 0.20 2.38 0.27 0.00 0.70 0.00 0.00 55.95 59.50 3hg7 s SER 73 Cb -0.15 -2.62 0.81 0.00 -1.71 0.00 0.00 66.02 62.35 3hg7 s SER 73 CO 0.17 -0.63 1.60 0.35 1.20 0.00 0.00 173.24 175.93 3hg7 n THR 74 N 0.22 0.00 -4.32 6.45 -2.24 -0.67 -4.13 114.28 109.59 3hg7 n THR 74 Ca 0.03 -0.13 -0.27 0.00 -2.27 0.00 0.00 64.05 61.41 3hg7 n THR 74 Cb 0.46 0.38 -0.10 0.00 -2.10 0.00 0.00 70.33 68.96 3hg7 n THR 74 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3hg7 s TYR 75 N -2.46 2.54 0.18 4.78 2.02 -1.26 -4.73 117.35 118.42 3hg7 s TYR 75 Ca 0.26 -0.26 -0.09 0.00 -0.37 0.00 0.00 57.07 56.61 3hg7 s TYR 75 Cb 0.19 -1.27 0.06 0.00 -0.40 0.00 0.00 41.96 40.54 3hg7 s TYR 75 CO 0.50 0.48 1.60 0.00 -1.57 0.00 0.00 175.55 176.57 3hg7 h ALA 76 N 3.14 0.77 -2.57 3.71 0.00 -1.90 -3.18 119.26 119.24 3hg7 h ALA 76 Ca -0.47 -0.35 -0.56 0.00 0.00 0.00 0.00 54.91 53.52 3hg7 h ALA 76 Cb 1.20 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 3hg7 h ALA 76 CO 0.51 0.67 0.21 0.20 0.00 0.00 0.00 179.25 180.84 3hg7 s GLY 77 N -3.67 2.50 -0.02 0.00 0.00 -1.26 -4.66 107.32 100.20 3hg7 s GLY 77 Ca -0.11 0.14 0.04 0.00 0.00 0.00 0.00 44.72 44.79 3hg7 s GLY 77 CO 0.86 1.38 0.87 3.33 0.00 0.00 0.00 173.10 179.55 3hg7 n VAL 78 N 4.09 0.61 -0.12 1.40 0.24 -1.26 -4.81 118.33 118.47 3hg7 n VAL 78 Ca 0.01 -0.69 0.21 0.00 -2.04 0.00 0.00 64.34 61.84 3hg7 n VAL 78 Cb 0.51 0.52 0.63 0.00 -1.47 0.00 0.00 33.84 34.02 3hg7 n VAL 78 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 3hg7 h ASP 79 N 0.00 0.15 0.47 -1.34 5.19 -2.00 0.14 116.42 119.04 3hg7 h ASP 79 Ca 0.00 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 3hg7 h ASP 79 Cb 0.97 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.47 3hg7 h ASP 79 CO 0.00 0.07 0.00 -0.37 -3.12 0.00 0.00 179.24 175.82 3hg7 h VAL 80 N 0.16 0.00 -0.01 -1.35 -1.51 -1.97 -1.94 116.25 109.63 3hg7 h VAL 80 Ca 0.36 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.62 3hg7 h VAL 80 Cb 1.19 1.04 0.00 0.00 -2.13 0.00 0.00 31.29 31.39 3hg7 h VAL 80 CO -0.06 0.00 -0.27 0.18 -1.23 0.00 0.00 177.57 176.19 3hg7 n LEU 81 N -2.73 1.31 -0.50 4.19 4.77 0.48 -3.77 117.00 120.75 3hg7 n LEU 81 Ca -0.00 -0.40 0.13 0.00 -0.03 0.00 0.00 56.01 55.71 3hg7 n LEU 81 Cb 0.17 -0.08 0.33 0.00 -2.33 0.00 0.00 43.42 41.51 3hg7 n LEU 81 CO 0.20 0.24 0.68 0.18 -1.33 0.00 0.00 177.39 177.36 3hg7 n LEU 82 N -0.41 1.70 -4.60 2.23 4.77 -0.73 -4.86 117.00 115.10 3hg7 n LEU 82 Ca 0.12 -0.55 -0.51 0.00 -0.03 0.00 0.00 56.01 55.04 3hg7 n LEU 82 Cb 0.38 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.37 3hg7 n LEU 82 CO 0.25 0.29 0.94 -0.67 -1.33 0.00 0.00 177.39 176.88 3hg7 n ASP 83 N 0.10 1.83 0.31 -1.43 -0.08 -1.25 -4.84 116.55 111.20 3hg7 n ASP 83 Ca 0.15 1.11 0.19 0.00 -1.51 0.00 0.00 54.79 54.73 3hg7 n ASP 83 Cb 0.41 -1.22 1.04 0.00 2.34 0.00 0.00 41.12 43.70 3hg7 n ASP 83 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hg7 h ALA 84 N 4.76 1.31 0.00 -1.67 0.00 -1.95 -0.97 119.26 120.74 3hg7 h ALA 84 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3hg7 h ALA 84 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3hg7 h ALA 84 CO 0.79 -0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.99 3hg7 h ARG 85 N 0.00 0.00 -6.59 0.00 3.08 -1.97 -3.46 114.38 105.44 3hg7 h ARG 85 Ca 0.01 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.55 3hg7 h ARG 85 Cb 0.10 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 3hg7 h ARG 85 CO -0.00 0.00 0.01 0.00 -1.07 0.00 0.00 179.97 178.91 3hg7 s ARG 87 N -2.83 2.19 -0.06 0.00 1.70 -1.26 -4.95 118.95 113.75 3hg7 s ARG 87 Ca 0.50 1.80 0.08 0.00 -0.47 0.00 0.00 55.73 57.64 3hg7 s ARG 87 Cb -0.11 -1.84 0.13 0.00 -0.57 0.00 0.00 34.95 32.56 3hg7 s ARG 87 CO 0.19 -1.80 1.06 0.54 -1.08 0.00 0.00 175.30 174.21 3hg7 n ARG 88 N -2.61 0.57 -1.33 3.89 1.74 -1.26 -4.89 116.66 112.77 3hg7 n ARG 88 Ca 0.14 -1.68 -0.30 0.00 -0.77 0.00 0.00 57.85 55.23 3hg7 n ARG 88 Cb 0.50 -0.93 0.05 0.00 -1.02 0.00 0.00 32.46 31.05 3hg7 n ARG 88 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3hg7 n ASP 89 N -0.62 7.25 -3.83 0.55 5.75 -1.26 -4.86 116.55 119.52 3hg7 n ASP 89 Ca 0.07 -3.56 -0.09 0.00 -0.01 0.00 0.00 54.79 51.21 3hg7 n ASP 89 Cb 0.67 -1.04 -0.03 0.00 -1.03 0.00 0.00 41.12 39.68 3hg7 n ASP 89 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 3hg7 s TYR 90 N -3.15 -0.04 -0.23 2.11 1.13 -1.26 -4.81 117.35 111.10 3hg7 s TYR 90 Ca 0.54 -0.34 -0.17 0.00 -1.41 0.00 0.00 57.07 55.68 3hg7 s TYR 90 Cb 0.42 0.45 -0.03 0.00 -1.10 0.00 0.00 41.96 41.70 3hg7 s TYR 90 CO -0.10 -1.04 0.46 -0.65 -2.51 0.00 0.00 175.55 171.71 3hg7 s GLN 91 N -3.92 4.12 -0.18 -3.49 -0.21 0.12 -4.98 119.66 111.12 3hg7 s GLN 91 Ca 0.13 0.26 -0.07 0.00 0.02 0.00 0.00 55.36 55.69 3hg7 s GLN 91 Cb -0.03 -3.60 -0.04 0.00 1.00 0.00 0.00 33.01 30.34 3hg7 s GLN 91 CO 0.03 -0.20 0.06 -1.17 -2.12 0.00 0.00 175.29 171.89 3hg7 s LEU 92 N 1.83 3.82 0.12 2.90 2.96 -1.26 -0.86 118.68 128.18 3hg7 s LEU 92 Ca 0.20 0.08 0.10 0.00 -0.22 0.00 0.00 54.13 54.29 3hg7 s LEU 92 Cb -0.15 -1.97 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 3hg7 s LEU 92 CO 0.09 0.17 -0.26 0.42 -1.32 0.00 0.00 176.35 175.45 3hg7 s THR 93 N 0.39 2.17 0.00 3.68 -4.23 -0.38 -0.59 115.64 116.68 3hg7 s THR 93 Ca 0.03 -1.70 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 3hg7 s THR 93 Cb -0.12 -1.92 0.00 0.00 1.34 0.00 0.00 72.50 71.80 3hg7 s THR 93 CO 0.00 0.09 0.00 -0.46 -0.54 0.00 0.00 174.62 173.71 3hg7 n ASN 94 N 1.00 1.13 -4.41 3.99 6.94 -0.37 -0.71 115.26 122.82 3hg7 n ASN 94 Ca -0.18 -0.65 -0.35 0.00 -0.02 0.00 0.00 54.58 53.37 3hg7 n ASN 94 Cb 0.53 0.00 -0.13 0.00 -2.36 0.00 0.00 39.78 37.82 3hg7 n ASN 94 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3hg7 s VAL 95 N 0.42 3.94 0.10 3.53 1.01 -1.20 -4.74 120.40 123.45 3hg7 s VAL 95 Ca 0.00 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.68 3hg7 s VAL 95 Cb 0.00 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 3hg7 s VAL 95 CO 0.00 0.39 -0.04 0.00 0.00 0.00 0.00 175.10 175.45 3hg7 s ARG 96 N 1.34 0.82 0.00 2.72 1.70 -1.26 -4.17 118.95 120.11 3hg7 s ARG 96 Ca 0.04 -1.34 0.00 0.00 -0.47 0.00 0.00 55.73 53.97 3hg7 s ARG 96 Cb -0.15 -0.11 0.00 0.00 -0.57 0.00 0.00 34.95 34.13 3hg7 s ARG 96 CO 0.01 -0.06 0.00 0.41 -1.08 0.00 0.00 175.30 174.58 3hg7 n GLY 97 N -0.04 1.04 0.44 3.88 0.00 -1.26 -4.88 105.19 104.37 3hg7 n GLY 97 Ca -0.12 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.94 3hg7 n GLY 97 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3hg7 n ILE 98 N -2.00 1.06 0.50 -0.61 -5.35 -1.26 -4.66 119.36 107.03 3hg7 n ILE 98 Ca 0.00 -1.05 0.06 0.00 -0.27 0.00 0.00 62.75 61.49 3hg7 n ILE 98 Cb 0.00 0.46 0.04 0.00 -1.74 0.00 0.00 39.64 38.40 3hg7 n ILE 98 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3hg7 n PHE 99 N 0.13 0.00 0.13 4.28 3.01 -1.26 -4.74 117.46 119.01 3hg7 n PHE 99 Ca 0.08 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.44 3hg7 n PHE 99 Cb 0.39 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.80 3hg7 n PHE 99 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3hg7 h GLY 100 N 2.36 -1.10 0.69 1.37 0.00 -1.83 -1.09 103.07 103.47 3hg7 h GLY 100 Ca 0.00 0.52 0.11 0.00 0.00 0.00 0.00 47.33 47.96 3hg7 h GLY 100 CO 0.00 -0.34 0.57 -2.55 0.00 0.00 0.00 176.54 174.22 3hg7 h PRO 101 N -0.53 0.81 -0.38 4.80 0.11 -1.92 -0.86 132.00 134.04 3hg7 h PRO 101 Ca -0.02 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.89 3hg7 h PRO 101 Cb 0.49 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 3hg7 h PRO 101 CO -0.09 0.53 -0.34 -0.07 -0.21 0.00 0.00 178.00 177.82 3hg7 h LEU 102 N 0.83 0.90 -0.56 2.35 3.38 -1.83 -2.08 115.31 118.30 3hg7 h LEU 102 Ca 0.42 -0.39 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 3hg7 h LEU 102 Cb 0.48 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3hg7 h LEU 102 CO -0.18 1.15 -0.28 0.24 0.09 0.00 0.00 178.44 179.46 3hg7 h MET 103 N 0.72 0.86 -0.65 1.13 2.86 -0.69 -1.96 114.93 117.19 3hg7 h MET 103 Ca 0.07 -0.39 0.07 0.00 -2.06 0.00 0.00 59.70 57.40 3hg7 h MET 103 Cb 0.91 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.49 3hg7 h MET 103 CO 0.08 1.03 0.33 0.77 1.06 0.00 0.00 176.91 180.18 3hg7 h SER 104 N 0.73 0.46 -0.56 1.22 0.02 -1.03 -0.86 113.55 113.52 3hg7 h SER 104 Ca 0.09 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3hg7 h SER 104 Cb 0.83 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.31 3hg7 h SER 104 CO 0.07 0.29 0.34 -0.33 -1.14 0.00 0.00 176.83 176.06 3hg7 h GLU 105 N 0.60 0.76 -0.10 3.45 5.08 -1.21 -0.01 114.58 123.15 3hg7 h GLU 105 Ca 0.30 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 3hg7 h GLU 105 Cb 0.26 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 3hg7 h GLU 105 CO -0.22 0.54 -0.02 -0.92 -1.00 0.00 0.00 179.01 177.39 3hg7 h TYR 106 N 0.76 0.21 -0.09 4.33 3.20 -1.12 0.12 116.97 124.38 3hg7 h TYR 106 Ca 0.20 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 3hg7 h TYR 106 Cb -0.03 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.19 3hg7 h TYR 106 CO -0.03 0.48 -0.02 0.28 -1.64 0.00 0.00 178.16 177.24 3hg7 h VAL 107 N -0.13 1.30 0.00 1.81 2.07 -1.09 -1.50 116.25 118.71 3hg7 h VAL 107 Ca 0.03 -0.95 -0.16 0.00 0.82 0.00 0.00 66.70 66.44 3hg7 h VAL 107 Cb 0.41 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 3hg7 h VAL 107 CO 0.01 0.27 -0.75 -0.26 0.02 0.00 0.00 177.57 176.86 3hg7 h PHE 108 N -0.17 0.00 -0.24 1.57 0.04 -1.05 0.10 116.94 117.20 3hg7 h PHE 108 Ca 0.02 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 3hg7 h PHE 108 Cb 0.43 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.57 3hg7 h PHE 108 CO 0.05 0.75 0.14 0.78 -0.60 0.00 0.00 178.31 179.44 3hg7 h GLY 109 N 2.63 0.35 1.20 -1.45 0.00 -0.94 0.73 103.07 105.58 3hg7 h GLY 109 Ca -0.01 -0.14 -0.13 0.00 0.00 0.00 0.00 47.33 47.05 3hg7 h GLY 109 CO 0.10 0.14 -0.26 0.45 0.00 0.00 0.00 176.54 176.97 3hg7 h HIS 110 N 0.30 1.05 -0.21 5.60 3.86 -1.11 0.59 115.15 125.22 3hg7 h HIS 110 Ca 0.09 -0.26 -0.03 0.00 -1.16 0.00 0.00 60.37 59.00 3hg7 h HIS 110 Cb 0.02 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.24 3hg7 h HIS 110 CO -0.05 1.06 0.00 1.25 0.86 0.00 0.00 177.93 181.05 3hg7 h LEU 111 N 0.77 0.36 -0.61 2.43 5.85 -0.66 -1.94 115.31 121.51 3hg7 h LEU 111 Ca 0.09 -0.31 -0.15 0.00 0.84 0.00 0.00 57.88 58.36 3hg7 h LEU 111 Cb 0.82 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 3hg7 h LEU 111 CO 0.07 0.58 -0.63 -0.07 -0.34 0.00 0.00 178.44 178.05 3hg7 h LEU 112 N 0.13 0.26 -0.50 2.25 3.38 -0.79 0.20 115.31 120.24 3hg7 h LEU 112 Ca 0.06 -0.16 0.09 0.00 0.09 0.00 0.00 57.88 57.96 3hg7 h LEU 112 Cb 0.39 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.00 3hg7 h LEU 112 CO 0.01 0.83 0.09 -1.28 0.09 0.00 0.00 178.44 178.17 3hg7 h SER 113 N 0.16 -0.03 0.21 -0.43 0.87 -0.68 -1.02 113.55 112.63 3hg7 h SER 113 Ca -0.01 0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 3hg7 h SER 113 Cb 1.15 0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.25 3hg7 h SER 113 CO 0.10 0.01 -0.10 -0.07 -0.53 0.00 0.00 176.83 176.24 3hg7 h LEU 114 N 0.22 -0.24 -1.32 2.23 3.38 -1.02 -1.00 115.31 117.56 3hg7 h LEU 114 Ca 0.25 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 58.08 3hg7 h LEU 114 Cb 0.35 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.11 3hg7 h LEU 114 CO -0.34 0.09 0.51 0.24 0.09 0.00 0.00 178.44 179.02 3hg7 h MET 115 N -0.58 0.80 -0.26 1.13 2.86 -0.80 -2.60 114.93 115.47 3hg7 h MET 115 Ca -0.03 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 3hg7 h MET 115 Cb 0.43 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.91 3hg7 h MET 115 CO 0.05 0.53 0.00 0.54 1.06 0.00 0.00 176.91 179.08 3hg7 n ARG 116 N -4.48 2.41 -3.69 1.72 5.12 -0.40 -4.53 116.66 112.81 3hg7 n ARG 116 Ca 0.12 -2.15 -0.23 0.00 -1.93 0.00 0.00 57.85 53.66 3hg7 n ARG 116 Cb 0.23 -1.49 0.05 0.00 -1.16 0.00 0.00 32.46 30.09 3hg7 n ARG 116 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3hg7 n GLN 117 N 1.42 -5.84 -0.31 5.56 6.02 -0.75 -4.90 117.38 118.58 3hg7 n GLN 117 Ca 0.17 0.69 -0.02 0.00 -0.01 0.00 0.00 57.00 57.83 3hg7 n GLN 117 Cb 0.60 -5.49 0.10 0.00 1.02 0.00 0.00 30.24 26.47 3hg7 n GLN 117 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3hg7 h LEU 118 N -2.05 0.93 -1.33 1.08 3.38 -1.50 -2.05 115.31 113.76 3hg7 h LEU 118 Ca -0.59 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.33 3hg7 h LEU 118 Cb 1.36 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 3hg7 h LEU 118 CO 0.58 0.65 0.04 -0.65 0.09 0.00 0.00 178.44 179.14 3hg7 h PRO 119 N 1.09 0.49 -0.44 1.13 0.11 -1.91 -0.27 132.00 132.20 3hg7 h PRO 119 Ca 0.33 -0.09 -0.02 0.00 0.11 0.00 0.00 66.00 66.33 3hg7 h PRO 119 Cb -0.03 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 30.98 3hg7 h PRO 119 CO -0.10 0.49 0.19 1.25 -0.21 0.00 0.00 178.00 179.61 3hg7 h LEU 120 N 0.47 0.60 -0.94 2.35 6.46 -1.77 -1.55 115.31 120.94 3hg7 h LEU 120 Ca 0.11 -0.15 -0.09 0.00 -0.12 0.00 0.00 57.88 57.63 3hg7 h LEU 120 Cb 0.25 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.01 3hg7 h LEU 120 CO 0.00 0.58 -0.19 1.88 -0.62 0.00 0.00 178.44 180.09 3hg7 h TYR 121 N 0.57 0.61 -0.44 1.25 0.05 -0.86 0.13 116.97 118.27 3hg7 h TYR 121 Ca 0.15 -0.12 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 3hg7 h TYR 121 Cb 0.16 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 3hg7 h TYR 121 CO -0.00 0.71 0.25 -0.09 -1.05 0.00 0.00 178.16 177.98 3hg7 h ARG 122 N 0.50 0.61 -0.57 4.88 2.43 -0.86 -0.78 114.38 120.58 3hg7 h ARG 122 Ca 0.08 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 59.08 3hg7 h ARG 122 Cb 0.61 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 3hg7 h ARG 122 CO 0.04 0.48 -0.03 0.93 -1.51 0.00 0.00 179.97 179.88 3hg7 h GLU 123 N 0.58 1.02 -0.17 0.20 4.39 -0.69 -2.08 114.58 117.83 3hg7 h GLU 123 Ca 0.16 -0.33 -0.04 0.00 0.34 0.00 0.00 59.36 59.48 3hg7 h GLU 123 Cb 0.04 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 3hg7 h GLU 123 CO -0.03 1.02 -0.08 1.96 -1.16 0.00 0.00 179.01 180.72 3hg7 h GLN 124 N 0.93 0.26 -0.44 2.33 4.20 -0.53 -2.75 115.11 119.10 3hg7 h GLN 124 Ca 0.16 -0.05 -0.14 0.00 0.06 0.00 0.00 58.65 58.68 3hg7 h GLN 124 Cb 0.58 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 3hg7 h GLN 124 CO 0.03 0.36 -0.28 0.37 -0.67 0.00 0.00 178.83 178.64 3hg7 h GLN 125 N 0.25 0.96 -0.15 1.46 4.15 -0.67 0.08 115.11 121.19 3hg7 h GLN 125 Ca 0.05 -0.44 0.04 0.00 0.77 0.00 0.00 58.65 59.08 3hg7 h GLN 125 Cb 0.31 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.98 3hg7 h GLN 125 CO 0.02 1.11 0.13 0.87 -1.93 0.00 0.00 178.83 179.02 3hg7 h LYS 126 N 0.81 0.00 -0.52 1.69 1.57 -1.10 -1.46 116.57 117.56 3hg7 h LYS 126 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3hg7 h LYS 126 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.17 3hg7 h LYS 126 CO 0.08 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.96 3hg7 n GLN 127 N -4.22 2.99 -3.83 3.15 10.64 -0.95 -4.98 117.38 120.18 3hg7 n GLN 127 Ca 0.01 -2.47 -0.27 0.00 -1.83 0.00 0.00 57.00 52.44 3hg7 n GLN 127 Cb 0.25 -1.53 0.03 0.00 -0.86 0.00 0.00 30.24 28.13 3hg7 n GLN 127 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 3hg7 n ARG 128 N 0.92 -5.48 -3.80 2.61 1.74 -0.55 -4.97 116.66 107.13 3hg7 n ARG 128 Ca 0.19 0.62 -0.36 0.00 -0.77 0.00 0.00 57.85 57.53 3hg7 n ARG 128 Cb 0.61 -5.41 -0.13 0.00 -1.02 0.00 0.00 32.46 26.51 3hg7 n ARG 128 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3hg7 s LEU 129 N -7.09 3.44 -0.46 0.55 2.96 -0.07 -5.03 118.68 112.98 3hg7 s LEU 129 Ca 0.44 -0.44 -0.21 0.00 -0.22 0.00 0.00 54.13 53.70 3hg7 s LEU 129 Cb -0.22 -1.86 0.03 0.00 0.50 0.00 0.00 46.19 44.65 3hg7 s LEU 129 CO 0.82 -0.09 0.70 0.86 -1.32 0.00 0.00 176.35 177.32 3hg7 s TRP 130 N 1.54 3.02 -0.30 5.38 -0.11 -1.26 -4.49 118.94 122.72 3hg7 s TRP 130 Ca 0.05 -0.07 -0.08 0.00 1.22 0.00 0.00 56.10 57.21 3hg7 s TRP 130 Cb -0.16 -3.50 0.14 0.00 -1.50 0.00 0.00 33.47 28.45 3hg7 s TRP 130 CO 0.01 -0.96 0.65 -1.14 -4.62 0.00 0.00 176.95 170.89 3hg7 s GLN 131 N 2.99 0.57 0.34 5.86 2.00 -1.26 -5.15 119.66 125.01 3hg7 s GLN 131 Ca 0.24 1.37 -0.14 0.00 -2.00 0.00 0.00 55.36 54.83 3hg7 s GLN 131 Cb -0.14 0.82 -0.08 0.00 0.80 0.00 0.00 33.01 34.40 3hg7 s GLN 131 CO 0.19 -0.27 0.74 0.45 -0.50 0.00 0.00 175.29 175.89 3hg7 s SER 132 N 2.89 6.72 0.18 6.67 0.15 -1.26 -5.05 113.70 124.00 3hg7 s SER 132 Ca -0.01 1.24 0.07 0.00 0.70 0.00 0.00 55.95 57.95 3hg7 s SER 132 Cb -0.12 -2.36 -0.04 0.00 -1.71 0.00 0.00 66.02 61.78 3hg7 s SER 132 CO -0.19 -0.24 -0.14 -1.00 1.20 0.00 0.00 173.24 172.87 3hg7 s HIS 133 N -2.06 1.62 0.57 3.44 0.09 -1.26 -5.13 115.29 112.56 3hg7 s HIS 133 Ca 0.53 -0.59 -0.21 0.00 -0.00 0.00 0.00 55.06 54.80 3hg7 s HIS 133 Cb -0.10 -0.77 -0.04 0.00 -0.00 0.00 0.00 32.58 31.66 3hg7 s HIS 133 CO 0.20 0.29 1.31 -2.14 -0.00 0.00 0.00 174.74 174.41 3hg7 s PRO 134 N -3.49 3.01 0.25 8.40 0.02 -1.26 -5.04 135.00 136.90 3hg7 s PRO 134 Ca 0.20 2.12 -0.12 0.00 0.02 0.00 0.00 61.00 63.22 3hg7 s PRO 134 Cb -0.01 -2.13 -0.01 0.00 0.02 0.00 0.00 34.50 32.38 3hg7 s PRO 134 CO 0.05 -1.26 0.46 1.52 -0.33 0.00 0.00 177.00 177.45 3hg7 s TYR 135 N -1.37 0.45 0.22 6.54 -0.85 -1.26 -5.04 117.35 116.04 3hg7 s TYR 135 Ca 0.75 -0.80 0.09 0.00 -0.52 0.00 0.00 57.07 56.59 3hg7 s TYR 135 Cb -0.38 0.13 -0.05 0.00 0.38 0.00 0.00 41.96 42.05 3hg7 s TYR 135 CO 0.43 -0.98 -0.17 -0.65 -1.52 0.00 0.00 175.55 172.66 3hg7 s GLN 136 N -3.96 1.43 0.71 -3.49 -0.21 -1.26 -5.16 119.66 107.72 3hg7 s GLN 136 Ca 0.24 -1.61 -0.07 0.00 0.02 0.00 0.00 55.36 53.94 3hg7 s GLN 136 Cb -0.00 -1.37 0.07 0.00 1.00 0.00 0.00 33.01 32.71 3hg7 s GLN 136 CO 0.10 0.25 1.03 0.20 -2.12 0.00 0.00 175.29 174.74 3hg7 s GLY 137 N -3.26 1.68 0.30 3.09 0.00 -1.26 -4.90 107.32 102.97 3hg7 s GLY 137 Ca 0.24 -0.93 0.26 0.00 0.00 0.00 0.00 44.72 44.29 3hg7 s GLY 137 CO 0.09 -0.51 1.75 1.41 0.00 0.00 0.00 173.10 175.85 3hg7 h LEU 138 N -0.64 0.00 -9.27 0.66 3.38 -1.98 -3.46 115.31 103.99 3hg7 h LEU 138 Ca -0.44 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 56.87 3hg7 h LEU 138 Cb 1.32 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.09 3hg7 h LEU 138 CO 0.60 0.00 0.88 0.29 0.09 0.00 0.00 178.44 180.30 3hg7 n LYS 139 N -2.50 1.69 -0.81 1.13 5.02 -1.24 -1.71 118.16 119.75 3hg7 n LYS 139 Ca 0.04 0.62 0.00 0.00 -2.02 0.00 0.00 58.31 56.95 3hg7 n LYS 139 Cb 0.39 -2.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.04 3hg7 n LYS 139 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hg7 n GLY 140 N 3.86 1.20 3.85 0.72 0.00 0.62 -4.95 105.19 110.50 3hg7 n GLY 140 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 3hg7 n GLY 140 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hg7 s ARG 141 N -0.07 3.46 -0.24 1.61 1.81 -0.69 -4.60 118.95 120.24 3hg7 s ARG 141 Ca 0.00 0.83 -0.08 0.00 -1.72 0.00 0.00 55.73 54.76 3hg7 s ARG 141 Cb 0.00 -2.06 -0.03 0.00 -0.45 0.00 0.00 34.95 32.40 3hg7 s ARG 141 CO 0.00 -0.68 0.08 0.95 -0.68 0.00 0.00 175.30 174.98 3hg7 s THR 142 N -3.07 4.56 -0.26 0.02 -4.23 -1.26 -0.49 115.64 110.91 3hg7 s THR 142 Ca 0.56 -0.09 -0.13 0.00 -1.18 0.00 0.00 61.69 60.85 3hg7 s THR 142 Cb -0.12 -3.12 -0.05 0.00 1.34 0.00 0.00 72.50 70.56 3hg7 s THR 142 CO 0.52 0.36 0.26 -0.22 -0.54 0.00 0.00 174.62 174.99 3hg7 s LEU 143 N 1.32 4.07 -0.21 4.79 2.96 0.11 -1.19 118.68 130.52 3hg7 s LEU 143 Ca 0.05 0.17 -0.08 0.00 -0.22 0.00 0.00 54.13 54.05 3hg7 s LEU 143 Cb -0.15 -2.25 -0.04 0.00 0.50 0.00 0.00 46.19 44.25 3hg7 s LEU 143 CO 0.04 -0.06 0.10 -0.22 -1.32 0.00 0.00 176.35 174.89 3hg7 s LEU 144 N 1.61 3.84 -0.12 -0.68 2.96 -0.16 -1.06 118.68 125.07 3hg7 s LEU 144 Ca 0.11 0.04 0.03 0.00 -0.22 0.00 0.00 54.13 54.08 3hg7 s LEU 144 Cb -0.15 -2.00 0.00 0.00 0.50 0.00 0.00 46.19 44.54 3hg7 s LEU 144 CO 0.09 0.10 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.36 3hg7 s ILE 145 N 0.84 2.13 -0.43 6.68 1.01 -0.25 -0.31 121.20 130.87 3hg7 s ILE 145 Ca 0.05 -0.98 -0.17 0.00 0.00 0.00 0.00 60.65 59.55 3hg7 s ILE 145 Cb -0.13 -1.84 0.03 0.00 0.01 0.00 0.00 42.46 40.53 3hg7 s ILE 145 CO 0.02 0.55 0.45 -0.76 0.00 0.00 0.00 174.94 175.20 3hg7 s LEU 146 N 0.58 4.96 0.00 2.97 1.43 0.48 -0.85 118.68 128.25 3hg7 s LEU 146 Ca -0.13 -0.78 0.00 0.00 -1.03 0.00 0.00 54.13 52.20 3hg7 s LEU 146 Cb -0.17 -2.36 0.00 0.00 0.03 0.00 0.00 46.19 43.69 3hg7 s LEU 146 CO 0.04 -0.61 0.00 0.61 0.23 0.00 0.00 176.35 176.61 3hg7 n GLY 147 N 5.13 3.41 0.05 -3.19 0.00 -0.65 -0.86 105.19 109.06 3hg7 n GLY 147 Ca -0.08 -1.22 0.06 0.00 0.00 0.00 0.00 46.02 44.78 3hg7 n GLY 147 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3hg7 n THR 148 N 0.42 1.51 0.00 2.61 5.66 -1.26 -4.09 114.28 119.13 3hg7 n THR 148 Ca 0.00 -1.74 0.00 0.00 -3.05 0.00 0.00 64.05 59.26 3hg7 n THR 148 Cb 0.00 0.07 0.00 0.00 -1.55 0.00 0.00 70.33 68.85 3hg7 n THR 148 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3hg7 n GLY 149 N -1.05 -1.18 0.21 1.09 0.00 -1.26 -4.36 105.19 98.63 3hg7 n GLY 149 Ca 0.09 -1.48 0.03 0.00 0.00 0.00 0.00 46.02 44.66 3hg7 n GLY 149 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hg7 h SER 150 N 0.00 0.07 0.11 1.61 4.64 -1.97 -0.45 113.55 117.57 3hg7 h SER 150 Ca 0.00 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 3hg7 h SER 150 Cb 0.00 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3hg7 h SER 150 CO 0.00 0.35 -0.05 0.40 -0.87 0.00 0.00 176.83 176.65 3hg7 h ILE 151 N 0.07 1.09 -0.52 0.95 2.04 -1.91 -2.04 117.51 117.19 3hg7 h ILE 151 Ca 0.01 -1.00 0.05 0.00 1.00 0.00 0.00 64.86 64.92 3hg7 h ILE 151 Cb 0.52 1.71 -0.05 0.00 -0.74 0.00 0.00 36.82 38.26 3hg7 h ILE 151 CO 0.04 0.23 0.24 1.23 0.00 0.00 0.00 178.15 179.90 3hg7 h GLY 152 N -0.64 0.73 0.94 5.37 0.00 -1.65 -2.26 103.07 105.57 3hg7 h GLY 152 Ca -0.02 -0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.17 3hg7 h GLY 152 CO 0.03 0.08 0.38 1.46 0.00 0.00 0.00 176.54 178.48 3hg7 h GLN 153 N 0.47 0.74 -0.53 4.80 4.20 -1.13 -0.35 115.11 123.31 3hg7 h GLN 153 Ca 0.24 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.84 3hg7 h GLN 153 Cb 0.18 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 3hg7 h GLN 153 CO -0.19 0.49 0.09 1.25 -0.67 0.00 0.00 178.83 179.80 3hg7 h HIS 154 N 0.76 0.93 -0.18 2.96 2.76 -0.90 -0.83 115.15 120.64 3hg7 h HIS 154 Ca 0.23 -0.13 -0.04 0.00 -2.20 0.00 0.00 60.37 58.23 3hg7 h HIS 154 Cb -0.04 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 28.65 3hg7 h HIS 154 CO -0.04 0.83 -0.06 0.82 -1.30 0.00 0.00 177.93 178.18 3hg7 h ILE 155 N 0.76 1.15 0.12 6.26 2.04 -1.29 -1.65 117.51 124.91 3hg7 h ILE 155 Ca 0.16 -0.64 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 3hg7 h ILE 155 Cb 0.40 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3hg7 h ILE 155 CO 0.01 0.21 -0.06 0.00 0.00 0.00 0.00 178.15 178.31 3hg7 h ALA 156 N 1.68 -0.16 -0.87 1.87 0.00 -0.31 -1.10 119.26 120.37 3hg7 h ALA 156 Ca 0.06 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.91 3hg7 h ALA 156 Cb 0.28 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 3hg7 h ALA 156 CO 0.01 -0.51 0.57 0.45 0.00 0.00 0.00 179.25 179.78 3hg7 h HIS 157 N -0.32 1.04 -0.45 0.00 3.86 -0.64 -0.99 115.15 117.65 3hg7 h HIS 157 Ca -0.02 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 3hg7 h HIS 157 Cb 0.26 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.37 3hg7 h HIS 157 CO -0.02 0.59 0.06 1.15 0.86 0.00 0.00 177.93 180.58 3hg7 h THR 158 N 1.07 1.25 -0.42 2.45 2.02 -1.24 -0.22 112.91 117.82 3hg7 h THR 158 Ca 0.35 -0.92 0.01 0.00 0.77 0.00 0.00 66.41 66.62 3hg7 h THR 158 Cb 0.06 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 3hg7 h THR 158 CO -0.11 0.32 0.27 1.23 0.37 0.00 0.00 175.52 177.60 3hg7 h GLY 159 N 0.61 0.59 1.07 2.16 0.00 -0.59 -1.41 103.07 105.49 3hg7 h GLY 159 Ca 0.13 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 3hg7 h GLY 159 CO 0.01 0.21 0.57 0.50 0.00 0.00 0.00 176.54 177.83 3hg7 h LYS 160 N 0.56 1.24 -0.98 4.80 1.79 -1.11 -0.24 116.57 122.62 3hg7 h LYS 160 Ca 0.16 -0.10 0.09 0.00 -2.18 0.00 0.00 60.65 58.61 3hg7 h LYS 160 Cb -0.06 -0.27 -0.07 0.00 -1.58 0.00 0.00 32.23 30.26 3hg7 h LYS 160 CO -0.04 0.85 0.63 1.25 -1.08 0.00 0.00 179.45 181.07 3hg7 h HIS 161 N 1.26 1.14 -0.17 -1.35 2.76 -0.61 -0.46 115.15 117.72 3hg7 h HIS 161 Ca 0.33 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.53 3hg7 h HIS 161 Cb -0.08 -0.37 0.00 0.00 1.55 0.00 0.00 27.41 28.51 3hg7 h HIS 161 CO 0.00 0.54 0.00 1.19 -1.30 0.00 0.00 177.93 178.36 3hg7 n PHE 162 N -4.54 0.23 -0.95 5.26 3.72 -0.26 -4.87 117.46 116.05 3hg7 n PHE 162 Ca 0.16 -0.11 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 3hg7 n PHE 162 Cb 0.26 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 3hg7 n PHE 162 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hg7 n GLY 163 N 0.85 0.45 3.83 1.37 0.00 -0.18 -3.69 105.19 107.81 3hg7 n GLY 163 Ca 0.09 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 3hg7 n GLY 163 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3hg7 s MET 164 N -1.32 4.01 0.28 1.61 -1.94 -0.30 -0.27 119.30 121.37 3hg7 s MET 164 Ca 0.00 1.02 -0.29 0.00 -1.71 0.00 0.00 55.69 54.71 3hg7 s MET 164 Cb 0.00 -2.15 -0.09 0.00 2.01 0.00 0.00 34.83 34.60 3hg7 s MET 164 CO 0.00 -0.22 1.04 0.15 -0.01 0.00 0.00 175.02 175.98 3hg7 s LYS 165 N -3.78 4.65 -0.19 2.03 1.02 0.36 -4.21 119.74 119.62 3hg7 s LYS 165 Ca 0.60 1.65 -0.00 0.00 0.02 0.00 0.00 55.97 58.24 3hg7 s LYS 165 Cb -0.10 -3.13 0.05 0.00 -0.52 0.00 0.00 37.83 34.13 3hg7 s LYS 165 CO 0.26 0.27 -0.05 0.08 -0.92 0.00 0.00 175.35 174.98 3hg7 s VAL 166 N -1.25 1.24 -0.06 3.17 1.01 -1.26 0.09 120.40 123.35 3hg7 s VAL 166 Ca 0.45 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.66 3hg7 s VAL 166 Cb -0.28 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 3hg7 s VAL 166 CO 0.36 0.07 -0.12 -0.76 0.00 0.00 0.00 175.10 174.65 3hg7 s LEU 167 N 1.56 2.89 0.19 3.92 1.43 -0.22 -0.16 118.68 128.30 3hg7 s LEU 167 Ca -0.01 -0.13 0.10 0.00 -1.03 0.00 0.00 54.13 53.06 3hg7 s LEU 167 Cb -0.16 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 3hg7 s LEU 167 CO -0.08 0.35 -0.17 -0.83 0.23 0.00 0.00 176.35 175.86 3hg7 s GLY 168 N -0.77 1.73 0.03 -3.19 0.00 0.01 -1.09 107.32 104.05 3hg7 s GLY 168 Ca 0.12 -1.58 0.05 0.00 0.00 0.00 0.00 44.72 43.31 3hg7 s GLY 168 CO 0.01 -1.61 -0.14 0.14 0.00 0.00 0.00 173.10 171.50 3hg7 s VAL 169 N -1.74 1.13 0.17 1.40 1.01 -0.03 0.40 120.40 122.74 3hg7 s VAL 169 Ca 0.23 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.26 3hg7 s VAL 169 Cb -0.08 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.29 3hg7 s VAL 169 CO 0.13 0.05 0.00 -0.24 0.00 0.00 0.00 175.10 175.04 3hg7 n SER 170 N 2.01 -1.52 0.00 3.32 2.88 -0.80 -1.64 113.62 117.87 3hg7 n SER 170 Ca -0.17 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 3hg7 n SER 170 Cb 0.55 1.72 0.00 0.00 -0.75 0.00 0.00 64.21 65.73 3hg7 n SER 170 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 3hg7 n ARG 171 N -2.84 0.00 0.00 -1.46 0.63 -1.25 -4.47 116.66 107.27 3hg7 n ARG 171 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3hg7 n ARG 171 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 3hg7 n ARG 171 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 3hg7 n SER 172 N 0.00 0.00 0.00 6.15 7.64 -1.26 -4.91 113.62 121.24 3hg7 n SER 172 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3hg7 n SER 172 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3hg7 n SER 172 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hg7 n GLY 173 N 0.00 1.88 3.47 0.23 0.00 -1.26 -4.98 105.19 104.53 3hg7 n GLY 173 Ca 0.00 -0.13 -0.48 0.00 0.00 0.00 0.00 46.02 45.41 3hg7 n GLY 173 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3hg7 n ARG 174 N 0.00 0.47 -1.92 1.61 0.63 -1.26 -4.62 116.66 111.56 3hg7 n ARG 174 Ca 0.00 0.16 -0.42 0.00 -0.92 0.00 0.00 57.85 56.67 3hg7 n ARG 174 Cb 0.00 -1.33 -0.03 0.00 0.45 0.00 0.00 32.46 31.55 3hg7 n ARG 174 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 3hg7 s GLU 175 N -1.07 4.19 0.28 -0.14 0.41 -1.26 -4.79 118.70 116.32 3hg7 s GLU 175 Ca 0.64 2.32 0.11 0.00 -0.41 0.00 0.00 54.97 57.64 3hg7 s GLU 175 Cb -0.88 -3.76 -0.05 0.00 -1.78 0.00 0.00 34.13 27.67 3hg7 s GLU 175 CO 0.57 -0.78 -0.12 1.03 -0.49 0.00 0.00 175.26 175.46 3hg7 s ARG 176 N 3.19 1.89 0.33 1.61 3.00 -1.26 -5.08 118.95 122.63 3hg7 s ARG 176 Ca 0.75 -1.67 -0.29 0.00 0.00 0.00 0.00 55.73 54.52 3hg7 s ARG 176 Cb -0.38 -1.89 -0.11 0.00 0.00 0.00 0.00 34.95 32.56 3hg7 s ARG 176 CO 0.32 0.32 1.53 0.00 0.00 0.00 0.00 175.30 177.47 3hg7 s ALA 177 N -2.46 3.66 0.00 2.13 0.00 -1.26 -2.69 121.76 121.14 3hg7 s ALA 177 Ca 0.31 1.55 0.00 0.00 0.00 0.00 0.00 51.96 53.82 3hg7 s ALA 177 Cb -0.05 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.45 3hg7 s ALA 177 CO 0.17 -0.99 0.00 0.41 0.00 0.00 0.00 175.76 175.35 3hg7 n GLY 178 N 1.37 3.09 3.71 0.00 0.00 -1.26 -4.74 105.19 107.36 3hg7 n GLY 178 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 3hg7 n GLY 178 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hg7 s PHE 179 N -2.48 3.51 0.22 1.61 0.08 -1.09 -4.40 117.98 115.43 3hg7 s PHE 179 Ca 0.00 1.04 -0.09 0.00 0.12 0.00 0.00 56.93 58.00 3hg7 s PHE 179 Cb 0.00 -2.70 0.23 0.00 -0.57 0.00 0.00 43.02 39.99 3hg7 s PHE 179 CO 0.00 0.07 1.84 -0.44 -0.10 0.00 0.00 175.22 176.59 3hg7 h ASP 180 N 6.88 0.71 -4.36 1.36 3.32 -0.87 -3.45 116.42 120.01 3hg7 h ASP 180 Ca -0.39 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.56 3hg7 h ASP 180 Cb 1.18 -0.14 -0.22 0.00 0.22 0.00 0.00 39.33 40.37 3hg7 h ASP 180 CO 0.76 0.48 -0.16 -1.58 -1.72 0.00 0.00 179.24 177.01 3hg7 s GLN 181 N -6.10 0.64 -0.14 3.56 2.00 -1.21 -5.07 119.66 113.35 3hg7 s GLN 181 Ca -0.13 0.35 0.01 0.00 -2.00 0.00 0.00 55.36 53.59 3hg7 s GLN 181 Cb 0.16 0.30 -0.01 0.00 0.80 0.00 0.00 33.01 34.27 3hg7 s GLN 181 CO 0.77 -0.13 -0.17 0.08 -0.50 0.00 0.00 175.29 175.34 3hg7 s VAL 182 N -0.40 2.65 0.35 1.34 1.01 -1.26 -0.81 120.40 123.28 3hg7 s VAL 182 Ca -0.05 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.15 3hg7 s VAL 182 Cb -0.03 -2.09 0.01 0.00 0.00 0.00 0.00 36.38 34.27 3hg7 s VAL 182 CO 0.03 0.53 0.11 -1.22 0.00 0.00 0.00 175.10 174.55 3hg7 n TYR 183 N 3.78 0.08 -4.36 5.22 4.01 0.16 -4.84 117.16 121.22 3hg7 n TYR 183 Ca -0.19 -1.62 -0.18 0.00 -0.16 0.00 0.00 57.90 55.75 3hg7 n TYR 183 Cb 0.52 -0.25 -0.10 0.00 -0.31 0.00 0.00 39.34 39.20 3hg7 n TYR 183 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3hg7 s GLN 184 N -3.33 1.39 0.28 -0.72 1.11 -1.26 -1.90 119.66 115.22 3hg7 s GLN 184 Ca 0.09 -1.69 -0.00 0.00 0.01 0.00 0.00 55.36 53.76 3hg7 s GLN 184 Cb -0.01 -0.84 0.65 0.00 -1.01 0.00 0.00 33.01 31.81 3hg7 s GLN 184 CO 0.05 -0.02 1.62 1.25 0.01 0.00 0.00 175.29 178.21 3hg7 h LEU 185 N 2.43 -0.25 -1.18 2.90 6.46 -1.91 0.35 115.31 124.12 3hg7 h LEU 185 Ca -0.39 0.22 0.24 0.00 -0.12 0.00 0.00 57.88 57.84 3hg7 h LEU 185 Cb 1.22 0.36 -0.10 0.00 -0.73 0.00 0.00 40.66 41.41 3hg7 h LEU 185 CO 0.65 -0.23 0.63 -0.65 -0.62 0.00 0.00 178.44 178.22 3hg7 h PRO 186 N 0.11 0.52 0.00 5.25 0.11 -2.02 -0.03 132.00 135.95 3hg7 h PRO 186 Ca 0.53 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.61 3hg7 h PRO 186 Cb 1.05 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.05 3hg7 h PRO 186 CO -0.74 0.34 0.00 0.00 -0.21 0.00 0.00 178.00 177.39 3hg7 n ALA 187 N -2.39 2.43 0.08 -0.75 0.00 0.12 -4.33 120.51 115.67 3hg7 n ALA 187 Ca 0.25 -0.15 -0.12 0.00 0.00 0.00 0.00 53.44 53.42 3hg7 n ALA 187 Cb 0.76 -1.39 -0.05 0.00 0.00 0.00 0.00 19.45 18.76 3hg7 n ALA 187 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3hg7 h LEU 188 N 0.00 -0.61 -0.96 0.00 5.85 -1.07 0.93 115.31 119.45 3hg7 h LEU 188 Ca 0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 3hg7 h LEU 188 Cb 0.00 0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.23 3hg7 h LEU 188 CO 0.00 -0.29 0.60 0.78 -0.34 0.00 0.00 178.44 179.19 3hg7 h ASN 189 N -0.37 1.13 -0.61 1.25 4.21 -1.81 0.52 115.58 119.90 3hg7 h ASN 189 Ca 0.04 -0.05 -0.02 0.00 1.21 0.00 0.00 56.30 57.48 3hg7 h ASN 189 Cb 0.42 -0.29 -0.03 0.00 -1.12 0.00 0.00 38.32 37.31 3hg7 h ASN 189 CO -0.16 0.85 0.30 0.11 -1.29 0.00 0.00 177.43 177.24 3hg7 h LYS 190 N 1.31 0.88 -0.33 0.81 1.57 -1.77 -2.30 116.57 116.74 3hg7 h LYS 190 Ca 0.35 -0.13 -0.13 0.00 -1.87 0.00 0.00 60.65 58.87 3hg7 h LYS 190 Cb -0.09 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.05 3hg7 h LYS 190 CO -0.07 0.70 -0.34 0.52 -0.57 0.00 0.00 179.45 179.70 3hg7 h MET 191 N 0.84 0.73 -0.52 3.15 2.86 0.16 -3.17 114.93 118.98 3hg7 h MET 191 Ca 0.21 -0.35 -0.05 0.00 -2.06 0.00 0.00 59.70 57.45 3hg7 h MET 191 Cb 0.11 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 3hg7 h MET 191 CO -0.03 0.96 0.12 -0.07 1.06 0.00 0.00 176.91 178.96 3hg7 h LEU 192 N 0.62 0.74 -2.04 1.22 3.38 0.10 -2.81 115.31 116.52 3hg7 h LEU 192 Ca 0.06 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.92 3hg7 h LEU 192 Cb 0.87 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 3hg7 h LEU 192 CO 0.08 0.73 0.03 0.00 0.09 0.00 0.00 178.44 179.36 3hg7 h ALA 193 N 1.37 2.00 -0.49 1.53 0.00 -1.38 -1.38 119.26 120.91 3hg7 h ALA 193 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3hg7 h ALA 193 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3hg7 h ALA 193 CO -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.20 3hg7 n GLN 194 N -4.47 3.08 -3.30 0.00 10.64 -1.07 -4.89 117.38 117.36 3hg7 n GLN 194 Ca -0.02 -2.50 -0.39 0.00 -1.83 0.00 0.00 57.00 52.26 3hg7 n GLN 194 Cb 0.13 -1.57 -0.07 0.00 -0.86 0.00 0.00 30.24 27.87 3hg7 n GLN 194 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3hg7 s ALA 195 N -1.48 3.55 -0.05 2.61 0.00 -0.52 -4.59 121.76 121.28 3hg7 s ALA 195 Ca 0.38 -0.49 -0.03 0.00 0.00 0.00 0.00 51.96 51.82 3hg7 s ALA 195 Cb 0.23 -2.75 -0.27 0.00 0.00 0.00 0.00 23.12 20.33 3hg7 s ALA 195 CO 0.20 -0.44 0.65 -0.44 0.00 0.00 0.00 175.76 175.74 3hg7 h ASP 196 N 7.54 0.37 -3.86 0.00 3.32 -1.47 -3.44 116.42 118.88 3hg7 h ASP 196 Ca -0.34 -0.63 -0.49 0.00 0.02 0.00 0.00 57.03 55.59 3hg7 h ASP 196 Cb 1.16 -0.12 -0.31 0.00 0.22 0.00 0.00 39.33 40.28 3hg7 h ASP 196 CO 0.72 1.55 -0.81 -0.69 -1.72 0.00 0.00 179.24 178.29 3hg7 s VAL 197 N -2.59 1.07 -0.09 -1.35 1.01 -1.03 -1.46 120.40 115.96 3hg7 s VAL 197 Ca -0.13 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 61.36 3hg7 s VAL 197 Cb 0.07 -0.94 0.01 0.00 0.00 0.00 0.00 36.38 35.52 3hg7 s VAL 197 CO 0.82 0.32 -0.20 -0.63 0.00 0.00 0.00 175.10 175.41 3hg7 s ILE 198 N 0.12 1.77 -0.27 2.22 1.01 0.65 -0.99 121.20 125.71 3hg7 s ILE 198 Ca -0.03 -0.84 0.03 0.00 0.00 0.00 0.00 60.65 59.80 3hg7 s ILE 198 Cb -0.10 -1.55 0.07 0.00 0.01 0.00 0.00 42.46 40.88 3hg7 s ILE 198 CO 0.01 0.50 -0.08 -0.69 0.00 0.00 0.00 174.94 174.68 3hg7 s VAL 199 N 0.50 2.08 -0.35 2.92 1.01 0.58 0.13 120.40 127.28 3hg7 s VAL 199 Ca -0.16 -1.68 -0.22 0.00 0.00 0.00 0.00 61.98 59.92 3hg7 s VAL 199 Cb -0.17 -2.26 0.01 0.00 0.00 0.00 0.00 36.38 33.95 3hg7 s VAL 199 CO 0.06 -0.13 0.74 -0.55 0.00 0.00 0.00 175.10 175.23 3hg7 s SER 200 N 1.12 6.54 -0.37 3.32 0.15 0.28 -0.38 113.70 124.35 3hg7 s SER 200 Ca -0.06 0.36 0.12 0.00 0.70 0.00 0.00 55.95 57.07 3hg7 s SER 200 Cb -0.20 -2.38 0.44 0.00 -1.71 0.00 0.00 66.02 62.18 3hg7 s SER 200 CO -0.06 -0.67 1.03 0.52 1.20 0.00 0.00 173.24 175.26 3hg7 n VAL 201 N 5.69 1.67 -3.59 4.45 0.31 -0.04 -1.76 118.33 125.05 3hg7 n VAL 201 Ca 0.02 -3.94 -0.36 0.00 -0.01 0.00 0.00 64.34 60.05 3hg7 n VAL 201 Cb 0.48 -0.24 -0.06 0.00 -0.91 0.00 0.00 33.84 33.11 3hg7 n VAL 201 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3hg7 s LEU 202 N -3.34 4.40 0.57 7.52 1.43 -1.25 -4.59 118.68 123.41 3hg7 s LEU 202 Ca 0.37 0.81 -0.20 0.00 -1.03 0.00 0.00 54.13 54.08 3hg7 s LEU 202 Cb 0.43 -2.75 -0.04 0.00 0.03 0.00 0.00 46.19 43.86 3hg7 s LEU 202 CO -0.07 0.25 1.24 -2.16 0.23 0.00 0.00 176.35 175.85 3hg7 s PRO 203 N -1.54 3.09 -0.95 1.29 0.04 -1.26 -3.95 135.00 131.71 3hg7 s PRO 203 Ca 0.28 1.93 -0.22 0.00 0.04 0.00 0.00 61.00 63.03 3hg7 s PRO 203 Cb -0.15 -2.06 0.07 0.00 0.04 0.00 0.00 34.50 32.41 3hg7 s PRO 203 CO 0.15 -1.14 1.31 0.00 0.04 0.00 0.00 177.00 177.36 3hg7 s ALA 204 N -1.50 2.93 0.37 8.56 0.00 -1.26 -4.79 121.76 126.07 3hg7 s ALA 204 Ca 0.75 -2.32 0.07 0.00 0.00 0.00 0.00 51.96 50.46 3hg7 s ALA 204 Cb -0.33 -4.33 -0.00 0.00 0.00 0.00 0.00 23.12 18.46 3hg7 s ALA 204 CO 0.37 -3.35 0.48 0.99 0.00 0.00 0.00 175.76 174.25 3hg7 s THR 205 N 4.30 3.57 0.49 0.00 2.01 -1.26 -4.99 115.64 119.76 3hg7 s THR 205 Ca 0.40 -1.05 0.15 0.00 0.31 0.00 0.00 61.69 61.49 3hg7 s THR 205 Cb -0.03 -3.22 0.25 0.00 0.01 0.00 0.00 72.50 69.51 3hg7 s THR 205 CO -0.07 -0.09 2.11 0.03 -0.69 0.00 0.00 174.62 175.91 3hg7 h ARG 206 N 0.84 0.05 0.00 4.92 -0.00 -1.97 -2.10 114.38 116.13 3hg7 h ARG 206 Ca -0.43 -0.00 -0.08 0.00 -0.50 0.00 0.00 59.98 58.96 3hg7 h ARG 206 Cb 1.26 -0.01 -0.01 0.00 0.00 0.00 0.00 29.97 31.21 3hg7 h ARG 206 CO 0.51 0.07 -0.37 0.93 0.00 0.00 0.00 179.97 181.12 3hg7 h GLU 207 N 0.05 0.00 -0.02 0.04 4.39 -1.97 -3.04 114.58 114.04 3hg7 h GLU 207 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3hg7 h GLU 207 Cb 0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 3hg7 h GLU 207 CO 0.00 0.37 -0.09 0.25 -1.16 0.00 0.00 179.01 178.38 3hg7 n THR 208 N -3.27 0.00 -1.99 1.13 -2.24 -1.01 -4.75 114.28 102.16 3hg7 n THR 208 Ca 0.02 -0.35 -0.43 0.00 -2.27 0.00 0.00 64.05 61.02 3hg7 n THR 208 Cb 0.62 1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 69.84 3hg7 n THR 208 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3hg7 s HIS 209 N -2.12 1.87 -1.38 4.78 5.04 -0.82 -2.70 115.29 119.96 3hg7 s HIS 209 Ca 0.30 0.41 -0.08 0.00 -1.54 0.00 0.00 55.06 54.14 3hg7 s HIS 209 Cb 0.20 -4.01 0.03 0.00 0.04 0.00 0.00 32.58 28.84 3hg7 s HIS 209 CO 0.37 -3.44 1.06 0.72 -2.34 0.00 0.00 174.74 171.11 3hg7 n HIS 210 N 8.73 -2.54 -0.10 3.88 8.25 0.09 -4.91 115.22 128.63 3hg7 n HIS 210 Ca 0.20 0.96 -0.07 0.00 -0.26 0.00 0.00 57.72 58.55 3hg7 n HIS 210 Cb 0.45 -4.71 -0.01 0.00 1.12 0.00 0.00 29.99 26.84 3hg7 n HIS 210 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3hg7 h LEU 211 N -2.35 -0.93 -7.90 2.41 3.38 -1.11 -3.12 115.31 105.69 3hg7 h LEU 211 Ca -0.58 0.17 -0.67 0.00 0.09 0.00 0.00 57.88 56.89 3hg7 h LEU 211 Cb 1.37 0.45 -0.10 0.00 0.09 0.00 0.00 40.66 42.47 3hg7 h LEU 211 CO 0.58 -0.30 1.95 -0.36 0.09 0.00 0.00 178.44 180.41 3hg7 s PHE 212 N -6.05 2.81 0.24 1.13 0.08 -0.17 -4.84 117.98 111.19 3hg7 s PHE 212 Ca -0.15 -1.53 -0.19 0.00 0.12 0.00 0.00 56.93 55.19 3hg7 s PHE 212 Cb 0.13 -4.69 -0.08 0.00 -0.57 0.00 0.00 43.02 37.81 3hg7 s PHE 212 CO 0.68 -1.78 0.72 -0.08 -0.10 0.00 0.00 175.22 174.66 3hg7 s THR 213 N 4.07 4.60 0.00 0.64 -1.32 -1.18 -2.31 115.64 120.13 3hg7 s THR 213 Ca 0.51 1.21 0.00 0.00 -1.21 0.00 0.00 61.69 62.19 3hg7 s THR 213 Cb 0.02 -3.81 0.00 0.00 -1.51 0.00 0.00 72.50 67.21 3hg7 s THR 213 CO 0.03 0.13 0.00 0.00 -2.21 0.00 0.00 174.62 172.57 3hg7 n ALA 214 N 0.51 0.00 0.07 11.08 0.00 -1.26 -3.99 120.51 126.91 3hg7 n ALA 214 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3hg7 n ALA 214 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 3hg7 n ALA 214 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hg7 n SER 215 N 0.00 0.08 -0.27 0.00 7.64 -1.26 -4.47 113.62 115.35 3hg7 n SER 215 Ca 0.00 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.12 3hg7 n SER 215 Cb 0.00 0.13 0.05 0.00 -1.01 0.00 0.00 64.21 63.38 3hg7 n SER 215 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3hg7 n ARG 216 N -3.11 -0.14 0.02 1.43 1.74 -1.26 0.65 116.66 115.99 3hg7 n ARG 216 Ca 0.00 1.09 -0.13 0.00 -0.77 0.00 0.00 57.85 58.05 3hg7 n ARG 216 Cb 0.06 -1.62 -0.09 0.00 -1.02 0.00 0.00 32.46 29.78 3hg7 n ARG 216 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 3hg7 h PHE 217 N 0.00 -0.04 -0.00 -1.55 0.04 -1.89 -3.09 116.94 110.41 3hg7 h PHE 217 Ca 0.27 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.04 3hg7 h PHE 217 Cb 0.45 0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.61 3hg7 h PHE 217 CO -0.60 0.25 0.06 0.93 -0.60 0.00 0.00 178.31 178.35 3hg7 h GLU 218 N -0.34 0.00 -4.51 1.51 4.39 0.08 -3.10 114.58 112.61 3hg7 h GLU 218 Ca -0.00 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.20 3hg7 h GLU 218 Cb 0.31 0.00 0.08 0.00 -0.10 0.00 0.00 28.75 29.04 3hg7 h GLU 218 CO 0.01 0.00 1.76 0.72 -1.16 0.00 0.00 179.01 180.33 3hg7 n HIS 219 N -3.07 0.76 -2.74 4.33 8.25 -0.32 -4.39 115.22 118.04 3hg7 n HIS 219 Ca -0.03 -1.09 -0.06 0.00 -0.26 0.00 0.00 57.72 56.29 3hg7 n HIS 219 Cb 0.13 -1.14 0.04 0.00 1.12 0.00 0.00 29.99 30.14 3hg7 n HIS 219 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hg7 n LYS 221 N 2.14 0.00 -0.32 0.00 4.81 -1.24 -4.84 118.16 118.70 3hg7 n LYS 221 Ca 0.11 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.59 3hg7 n LYS 221 Cb 0.61 0.00 0.18 0.00 0.02 0.00 0.00 35.03 35.85 3hg7 n LYS 221 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 3hg7 h PRO 222 N 0.00 0.90 -0.15 1.64 0.13 -1.80 -3.12 132.00 129.60 3hg7 h PRO 222 Ca 0.00 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 3hg7 h PRO 222 Cb 0.00 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 30.93 3hg7 h PRO 222 CO 0.00 0.60 0.00 0.41 -0.23 0.00 0.00 178.00 178.78 3hg7 n GLY 223 N -1.33 4.22 3.79 1.56 0.00 -1.26 -2.44 105.19 109.73 3hg7 n GLY 223 Ca 0.15 -0.98 -0.34 0.00 0.00 0.00 0.00 46.02 44.85 3hg7 n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hg7 s ALA 224 N -2.62 2.83 -0.16 4.61 0.00 -1.18 -4.57 121.76 120.67 3hg7 s ALA 224 Ca 0.35 0.64 0.00 0.00 0.00 0.00 0.00 51.96 52.95 3hg7 s ALA 224 Cb 0.28 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 20.13 3hg7 s ALA 224 CO 0.07 -0.44 -0.15 0.42 0.00 0.00 0.00 175.76 175.66 3hg7 s ILE 225 N -1.96 2.67 -0.19 0.00 1.01 -0.54 -0.62 121.20 121.57 3hg7 s ILE 225 Ca 0.68 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 60.52 3hg7 s ILE 225 Cb -0.18 -2.13 -0.02 0.00 0.01 0.00 0.00 42.46 40.14 3hg7 s ILE 225 CO 0.22 0.51 -0.02 -0.22 0.00 0.00 0.00 174.94 175.44 3hg7 s LEU 226 N 0.87 3.21 -0.14 2.97 2.96 -0.56 -0.26 118.68 127.74 3hg7 s LEU 226 Ca -0.04 -0.20 -0.05 0.00 -0.22 0.00 0.00 54.13 53.61 3hg7 s LEU 226 Cb -0.15 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 3hg7 s LEU 226 CO -0.01 0.09 0.06 -0.36 -1.32 0.00 0.00 176.35 174.80 3hg7 s PHE 227 N 0.85 3.29 -0.23 5.38 0.08 0.12 -0.56 117.98 126.91 3hg7 s PHE 227 Ca 0.00 0.20 0.02 0.00 0.12 0.00 0.00 56.93 57.27 3hg7 s PHE 227 Cb -0.14 -1.95 0.05 0.00 -0.57 0.00 0.00 43.02 40.41 3hg7 s PHE 227 CO 0.02 0.38 -0.11 1.21 -0.10 0.00 0.00 175.22 176.62 3hg7 s ASN 228 N -0.36 3.95 0.00 1.36 2.47 -0.50 -0.56 114.94 121.31 3hg7 s ASN 228 Ca 0.09 -1.16 0.00 0.00 0.42 0.00 0.00 52.86 52.21 3hg7 s ASN 228 Cb -0.12 -1.41 0.00 0.00 -1.45 0.00 0.00 41.25 38.27 3hg7 s ASN 228 CO 0.02 -0.16 0.75 1.33 -3.72 0.00 0.00 177.10 175.32 3hg7 n VAL 229 N 4.55 0.57 0.00 -5.21 0.24 -0.72 -1.66 118.33 116.09 3hg7 n VAL 229 Ca -0.15 -0.68 0.00 0.00 -2.04 0.00 0.00 64.34 61.48 3hg7 n VAL 229 Cb 0.44 0.78 0.00 0.00 -1.47 0.00 0.00 33.84 33.59 3hg7 n VAL 229 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hg7 n GLY 230 N -0.28 1.47 3.06 7.63 0.00 -1.11 -4.92 105.19 111.05 3hg7 n GLY 230 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3hg7 n GLY 230 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hg7 s ARG 231 N 0.05 0.53 0.55 1.61 1.81 -1.25 -4.94 118.95 117.30 3hg7 s ARG 231 Ca 0.00 -0.77 0.38 0.00 -1.72 0.00 0.00 55.73 53.62 3hg7 s ARG 231 Cb 0.00 -0.26 1.57 0.00 -0.45 0.00 0.00 34.95 35.81 3hg7 s ARG 231 CO 0.00 0.04 1.78 0.78 -0.68 0.00 0.00 175.30 177.22 3hg7 h GLY 232 N 4.45 0.00 1.59 -3.53 0.00 -1.77 -2.43 103.07 101.39 3hg7 h GLY 232 Ca -0.36 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.01 3hg7 h GLY 232 CO 0.42 0.00 0.17 3.43 0.00 0.00 0.00 176.54 180.56 3hg7 h ASN 233 N 0.00 0.00 0.51 0.19 -0.26 -1.93 -2.67 115.58 111.42 3hg7 h ASN 233 Ca 0.60 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 56.33 3hg7 h ASN 233 Cb 2.41 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 39.67 3hg7 h ASN 233 CO -0.01 0.00 -0.05 0.00 -1.06 0.00 0.00 177.43 176.31 3hg7 h ALA 234 N 1.77 1.10 -3.32 -0.83 0.00 -1.60 0.30 119.26 116.68 3hg7 h ALA 234 Ca 0.06 -0.05 -0.57 0.00 0.00 0.00 0.00 54.91 54.35 3hg7 h ALA 234 Cb 0.40 -0.01 -0.34 0.00 0.00 0.00 0.00 17.79 17.84 3hg7 h ALA 234 CO -0.00 0.07 -0.83 0.42 0.00 0.00 0.00 179.25 178.90 3hg7 s ILE 235 N -3.99 1.44 -0.38 0.00 1.01 -1.00 -1.00 121.20 117.28 3hg7 s ILE 235 Ca -0.02 -0.63 -0.29 0.00 0.00 0.00 0.00 60.65 59.71 3hg7 s ILE 235 Cb 0.12 -1.30 0.02 0.00 0.01 0.00 0.00 42.46 41.30 3hg7 s ILE 235 CO 0.53 0.43 1.17 0.21 0.00 0.00 0.00 174.94 177.27 3hg7 s ASN 236 N 0.82 6.73 0.21 3.58 3.84 -0.98 -4.86 114.94 124.28 3hg7 s ASN 236 Ca -0.10 0.87 -0.05 0.00 0.21 0.00 0.00 52.86 53.79 3hg7 s ASN 236 Cb -0.16 -2.54 0.17 0.00 -0.55 0.00 0.00 41.25 38.17 3hg7 s ASN 236 CO 0.01 -1.09 1.62 -0.33 -2.79 0.00 0.00 177.10 174.52 3hg7 h GLU 237 N 8.94 0.79 -0.76 0.43 5.08 -1.91 -1.56 114.58 125.59 3hg7 h GLU 237 Ca -0.23 -0.32 0.04 0.00 -1.00 0.00 0.00 59.36 57.85 3hg7 h GLU 237 Cb 1.07 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.24 3hg7 h GLU 237 CO 1.07 0.94 0.50 0.78 -1.00 0.00 0.00 179.01 181.30 3hg7 h GLY 238 N 0.96 1.06 0.89 -3.84 0.00 -1.99 -1.47 103.07 98.67 3hg7 h GLY 238 Ca 0.09 -0.36 -0.12 0.00 0.00 0.00 0.00 47.33 46.94 3hg7 h GLY 238 CO 0.06 0.30 -1.38 1.22 0.00 0.00 0.00 176.54 176.74 3hg7 n ASP 239 N -4.46 0.77 -0.17 0.19 10.43 -1.04 -3.11 116.55 119.16 3hg7 n ASP 239 Ca 0.10 0.33 -0.06 0.00 2.57 0.00 0.00 54.79 57.72 3hg7 n ASP 239 Cb 0.14 0.38 0.03 0.00 1.84 0.00 0.00 41.12 43.51 3hg7 n ASP 239 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 3hg7 h LEU 240 N 0.00 0.57 0.02 0.64 5.85 -1.03 -2.10 115.31 119.27 3hg7 h LEU 240 Ca -0.13 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.61 3hg7 h LEU 240 Cb 1.42 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.28 3hg7 h LEU 240 CO 0.03 0.41 -0.23 0.25 -0.34 0.00 0.00 178.44 178.55 3hg7 h LEU 241 N 0.68 -0.68 -0.96 2.25 6.46 -1.30 -1.31 115.31 120.45 3hg7 h LEU 241 Ca 0.20 0.09 -0.04 0.00 -0.12 0.00 0.00 57.88 58.01 3hg7 h LEU 241 Cb -0.05 0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 40.12 3hg7 h LEU 241 CO -0.06 -0.30 0.27 0.74 -0.62 0.00 0.00 178.44 178.47 3hg7 h THR 242 N -0.38 1.24 -0.49 1.05 2.02 -1.54 0.16 112.91 114.97 3hg7 h THR 242 Ca 0.05 -0.75 0.07 0.00 0.77 0.00 0.00 66.41 66.55 3hg7 h THR 242 Cb 0.45 0.41 -0.06 0.00 -1.74 0.00 0.00 68.15 67.21 3hg7 h THR 242 CO -0.19 0.30 0.16 0.00 0.37 0.00 0.00 175.52 176.16 3hg7 h ALA 243 N 1.29 0.58 0.00 6.16 0.00 -1.01 -1.29 119.26 124.99 3hg7 h ALA 243 Ca 0.23 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 3hg7 h ALA 243 Cb 0.20 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3hg7 h ALA 243 CO -0.02 -0.24 -0.52 -0.07 0.00 0.00 0.00 179.25 178.40 3hg7 h LEU 244 N 0.32 0.00 -0.20 0.00 3.38 -0.62 0.10 115.31 118.29 3hg7 h LEU 244 Ca 0.24 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 3hg7 h LEU 244 Cb 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3hg7 h LEU 244 CO -0.26 0.52 -0.32 0.03 0.09 0.00 0.00 178.44 178.50 3hg7 h ARG 245 N 0.00 0.00 -0.08 1.13 3.08 -0.40 -3.35 114.38 114.76 3hg7 h ARG 245 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3hg7 h ARG 245 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.98 3hg7 h ARG 245 CO 0.07 0.32 0.00 0.25 -1.07 0.00 0.00 179.97 179.53 3hg7 n THR 246 N -3.22 2.00 -1.86 2.04 -2.24 -0.54 -4.98 114.28 105.48 3hg7 n THR 246 Ca 0.02 -2.15 -0.10 0.00 -2.27 0.00 0.00 64.05 59.55 3hg7 n THR 246 Cb 0.63 -0.24 -0.02 0.00 -2.10 0.00 0.00 70.33 68.60 3hg7 n THR 246 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hg7 n GLY 247 N -1.17 0.41 0.16 3.38 0.00 -1.14 -4.90 105.19 101.92 3hg7 n GLY 247 Ca 0.17 -0.49 0.09 0.00 0.00 0.00 0.00 46.02 45.80 3hg7 n GLY 247 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3hg7 h LYS 248 N 0.00 0.00 -3.09 1.61 1.63 -1.10 -3.41 116.57 112.21 3hg7 h LYS 248 Ca -0.23 0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.43 3hg7 h LYS 248 Cb 0.99 0.00 -0.22 0.00 -0.60 0.00 0.00 32.23 32.41 3hg7 h LYS 248 CO 0.30 0.11 -0.34 -1.17 -3.45 0.00 0.00 179.45 174.90 3hg7 s LEU 249 N -5.93 0.95 -0.13 5.20 2.96 -1.17 -3.73 118.68 116.84 3hg7 s LEU 249 Ca 0.03 0.23 -0.24 0.00 -0.22 0.00 0.00 54.13 53.93 3hg7 s LEU 249 Cb 0.07 1.10 -0.21 0.00 0.50 0.00 0.00 46.19 47.65 3hg7 s LEU 249 CO 0.74 -0.32 0.67 1.23 -1.32 0.00 0.00 176.35 177.35 3hg7 h GLY 250 N 4.56 -0.01 -3.63 7.98 0.00 -0.52 -3.41 103.07 108.04 3hg7 h GLY 250 Ca -0.29 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 3hg7 h GLY 250 CO 0.37 -0.00 -0.19 1.06 0.00 0.00 0.00 176.54 177.78 3hg7 s MET 251 N -2.23 0.89 -0.02 4.80 -1.94 -0.87 -4.88 119.30 115.04 3hg7 s MET 251 Ca -0.16 -0.53 0.04 0.00 -1.71 0.00 0.00 55.69 53.33 3hg7 s MET 251 Cb -0.02 0.39 -0.01 0.00 2.01 0.00 0.00 34.83 37.20 3hg7 s MET 251 CO 0.57 -0.30 -0.13 0.00 -0.01 0.00 0.00 175.02 175.14 3hg7 s ALA 252 N -2.83 1.17 -0.21 3.03 0.00 -0.63 -1.50 121.76 120.78 3hg7 s ALA 252 Ca -0.03 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 51.39 3hg7 s ALA 252 Cb 0.00 -0.35 0.04 0.00 0.00 0.00 0.00 23.12 22.82 3hg7 s ALA 252 CO -0.05 0.25 -0.14 0.08 0.00 0.00 0.00 175.76 175.89 3hg7 s VAL 253 N -0.13 2.02 -0.14 0.00 1.01 0.28 -0.61 120.40 122.83 3hg7 s VAL 253 Ca 0.02 -1.23 0.02 0.00 0.00 0.00 0.00 61.98 60.79 3hg7 s VAL 253 Cb -0.07 -1.99 0.01 0.00 0.00 0.00 0.00 36.38 34.33 3hg7 s VAL 253 CO 0.00 0.24 -0.19 -0.76 0.00 0.00 0.00 175.10 174.39 3hg7 s LEU 254 N 1.24 1.96 -0.02 3.92 1.43 -0.38 -1.41 118.68 125.42 3hg7 s LEU 254 Ca -0.02 -0.55 0.21 0.00 -1.03 0.00 0.00 54.13 52.75 3hg7 s LEU 254 Cb -0.16 -1.32 -0.29 0.00 0.03 0.00 0.00 46.19 44.45 3hg7 s LEU 254 CO -0.09 0.04 0.65 -0.67 0.23 0.00 0.00 176.35 176.51 3hg7 n ASP 255 N 4.23 0.47 -4.15 2.29 2.03 -0.67 -2.08 116.55 118.67 3hg7 n ASP 255 Ca -0.19 -0.42 -0.14 0.00 0.52 0.00 0.00 54.79 54.55 3hg7 n ASP 255 Cb 0.51 1.56 -0.11 0.00 -0.72 0.00 0.00 41.12 42.37 3hg7 n ASP 255 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3hg7 s VAL 256 N -3.27 0.85 0.05 5.18 -7.23 -1.24 -1.45 120.40 113.28 3hg7 s VAL 256 Ca -0.01 -1.54 -0.09 0.00 -1.81 0.00 0.00 61.98 58.53 3hg7 s VAL 256 Cb 0.15 -1.23 0.00 0.00 0.56 0.00 0.00 36.38 35.86 3hg7 s VAL 256 CO 0.88 -0.53 0.18 -0.36 -0.31 0.00 0.00 175.10 174.96 3hg7 s PHE 257 N -2.28 0.09 0.37 2.82 0.08 -1.26 -4.39 117.98 113.41 3hg7 s PHE 257 Ca 0.03 -0.35 0.09 0.00 0.12 0.00 0.00 56.93 56.82 3hg7 s PHE 257 Cb -0.04 -0.05 0.83 0.00 -0.57 0.00 0.00 43.02 43.19 3hg7 s PHE 257 CO -0.00 -0.44 1.90 1.49 -0.10 0.00 0.00 175.22 178.07 3hg7 h GLU 258 N 3.37 0.65 -4.39 0.44 4.81 -1.92 -3.33 114.58 114.22 3hg7 h GLU 258 Ca -0.32 -0.04 -0.52 0.00 -0.13 0.00 0.00 59.36 58.35 3hg7 h GLU 258 Cb 1.19 -0.15 -0.35 0.00 0.63 0.00 0.00 28.75 30.07 3hg7 h GLU 258 CO 0.50 0.43 -0.81 -1.14 -0.73 0.00 0.00 179.01 177.26 3hg7 s GLN 259 N -5.64 1.61 0.00 1.92 2.00 -1.26 -4.98 119.66 113.31 3hg7 s GLN 259 Ca -0.10 -0.33 0.04 0.00 -2.00 0.00 0.00 55.36 52.97 3hg7 s GLN 259 Cb 0.21 -1.49 -0.01 0.00 0.80 0.00 0.00 33.01 32.52 3hg7 s GLN 259 CO 0.78 -0.12 -0.12 -1.83 -0.50 0.00 0.00 175.29 173.50 3hg7 s GLU 260 N 1.18 0.93 0.60 1.67 -1.05 -1.26 -2.90 118.70 117.87 3hg7 s GLU 260 Ca -0.05 -0.48 -0.19 0.00 -0.15 0.00 0.00 54.97 54.09 3hg7 s GLU 260 Cb -0.14 -0.90 -0.03 0.00 -0.44 0.00 0.00 34.13 32.61 3hg7 s GLU 260 CO -0.02 0.24 1.24 -0.35 0.95 0.00 0.00 175.26 177.32 3hg7 n PRO 261 N 2.61 1.25 -1.66 -4.83 -0.04 -1.26 -5.05 135.00 126.02 3hg7 n PRO 261 Ca -0.15 0.48 -0.42 0.00 -0.04 0.00 0.00 63.50 63.37 3hg7 n PRO 261 Cb 0.56 -2.46 -0.03 0.00 -0.04 0.00 0.00 33.50 31.53 3hg7 n PRO 261 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 3hg7 n LEU 262 N -1.32 4.13 -4.65 1.53 7.94 -1.14 -4.89 117.00 118.61 3hg7 n LEU 262 Ca 0.14 0.90 -0.43 0.00 -1.11 0.00 0.00 56.01 55.51 3hg7 n LEU 262 Cb 0.47 -1.52 -0.01 0.00 0.53 0.00 0.00 43.42 42.89 3hg7 n LEU 262 CO 0.50 0.19 0.74 -2.65 -1.11 0.00 0.00 177.39 175.06 3hg7 n PRO 263 N 7.50 1.75 0.14 1.96 -0.02 -1.26 -4.81 135.00 140.26 3hg7 n PRO 263 Ca 0.20 0.62 0.08 0.00 -2.02 0.00 0.00 63.50 62.38 3hg7 n PRO 263 Cb 0.40 -2.11 0.45 0.00 -0.02 0.00 0.00 33.50 32.22 3hg7 n PRO 263 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hg7 n ALA 264 N 0.22 0.95 0.11 3.55 0.00 -1.26 -1.08 120.51 123.00 3hg7 n ALA 264 Ca 0.07 0.15 -0.02 0.00 0.00 0.00 0.00 53.44 53.64 3hg7 n ALA 264 Cb 0.35 -1.16 0.19 0.00 0.00 0.00 0.00 19.45 18.83 3hg7 n ALA 264 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3hg7 h ASP 265 N 0.00 0.18 -2.30 0.00 3.45 -2.01 -3.48 116.42 112.26 3hg7 h ASP 265 Ca 0.00 -0.09 -0.60 0.00 0.43 0.00 0.00 57.03 56.78 3hg7 h ASP 265 Cb 0.12 -0.05 0.06 0.00 -0.56 0.00 0.00 39.33 38.90 3hg7 h ASP 265 CO 0.00 0.66 0.69 -0.24 -1.57 0.00 0.00 179.24 178.78 3hg7 n SER 266 N -3.94 2.77 0.22 6.45 2.88 -0.24 -4.85 113.62 116.91 3hg7 n SER 266 Ca -0.02 1.11 0.15 0.00 -1.33 0.00 0.00 58.87 58.78 3hg7 n SER 266 Cb 0.55 -1.39 0.71 0.00 -0.75 0.00 0.00 64.21 63.32 3hg7 n SER 266 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3hg7 h PRO 267 N 5.21 0.00 -0.56 -1.46 0.11 -1.92 -3.00 132.00 130.37 3hg7 h PRO 267 Ca -0.45 0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.73 3hg7 h PRO 267 Cb 1.27 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.32 3hg7 h PRO 267 CO 0.83 0.00 0.25 -0.07 -0.21 0.00 0.00 178.00 178.80 3hg7 h LEU 268 N 0.00 0.31 -0.72 2.35 3.38 -1.96 -3.04 115.31 115.62 3hg7 h LEU 268 Ca 0.00 0.05 0.16 0.00 0.09 0.00 0.00 57.88 58.18 3hg7 h LEU 268 Cb 0.25 0.01 -0.12 0.00 0.09 0.00 0.00 40.66 40.88 3hg7 h LEU 268 CO 0.00 0.20 0.00 -0.50 0.09 0.00 0.00 178.44 178.23 3hg7 h TRP 269 N 0.46 -0.05 0.00 1.13 4.06 -1.91 -2.55 115.95 117.09 3hg7 h TRP 269 Ca 0.27 0.05 0.00 0.00 2.06 0.00 0.00 58.89 61.27 3hg7 h TRP 269 Cb 0.25 0.14 0.00 0.00 -1.00 0.00 0.00 29.16 28.55 3hg7 h TRP 269 CO -0.13 -0.22 -0.04 0.41 -3.56 0.00 0.00 178.44 174.89 3hg7 n GLY 270 N -1.41 -1.62 3.66 1.49 0.00 -1.15 -4.88 105.19 101.28 3hg7 n GLY 270 Ca 0.12 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3hg7 n GLY 270 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hg7 s GLN 271 N -3.07 4.16 0.48 1.61 2.00 -0.96 -4.91 119.66 118.96 3hg7 s GLN 271 Ca 0.11 2.12 0.13 0.00 -2.00 0.00 0.00 55.36 55.72 3hg7 s GLN 271 Cb 0.14 -3.98 1.12 0.00 0.80 0.00 0.00 33.01 31.10 3hg7 s GLN 271 CO 0.59 -0.87 2.11 -1.35 -0.50 0.00 0.00 175.29 175.27 3hg7 h PRO 272 N 9.54 0.20 -0.64 1.67 0.11 -1.90 -2.25 132.00 138.73 3hg7 h PRO 272 Ca -0.38 -0.01 -0.38 0.00 0.11 0.00 0.00 66.00 65.34 3hg7 h PRO 272 Cb 1.17 -0.05 -0.22 0.00 0.11 0.00 0.00 31.00 32.02 3hg7 h PRO 272 CO 0.96 0.13 0.13 0.27 -0.21 0.00 0.00 178.00 179.29 3hg7 n ASN 273 N -4.51 3.80 -4.14 -2.05 6.94 -1.26 -4.89 115.26 109.15 3hg7 n ASN 273 Ca -0.00 -3.75 -0.29 0.00 -0.02 0.00 0.00 54.58 50.51 3hg7 n ASN 273 Cb 0.09 -0.70 -0.17 0.00 -2.36 0.00 0.00 39.78 36.64 3hg7 n ASN 273 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3hg7 s LEU 274 N -3.39 1.90 -0.08 -4.53 0.20 -0.85 -1.61 118.68 110.32 3hg7 s LEU 274 Ca 0.51 -0.45 0.02 0.00 0.69 0.00 0.00 54.13 54.90 3hg7 s LEU 274 Cb 0.44 -1.17 -0.02 0.00 -0.43 0.00 0.00 46.19 45.01 3hg7 s LEU 274 CO 0.02 0.11 -0.12 -0.63 -0.29 0.00 0.00 176.35 175.44 3hg7 s ILE 275 N 0.49 3.18 -0.09 6.68 1.01 0.22 -4.84 121.20 127.85 3hg7 s ILE 275 Ca -0.17 -0.66 0.04 0.00 0.00 0.00 0.00 60.65 59.86 3hg7 s ILE 275 Cb -0.17 -2.29 0.00 0.00 0.01 0.00 0.00 42.46 40.02 3hg7 s ILE 275 CO 0.07 0.57 -0.22 -0.63 0.00 0.00 0.00 174.94 174.73 3hg7 s ILE 276 N -0.41 1.87 0.07 2.92 1.01 -1.26 -1.25 121.20 124.14 3hg7 s ILE 276 Ca 0.05 -0.91 0.08 0.00 0.00 0.00 0.00 60.65 59.87 3hg7 s ILE 276 Cb -0.12 -1.62 -0.03 0.00 0.01 0.00 0.00 42.46 40.70 3hg7 s ILE 276 CO 0.02 0.52 -0.23 0.42 0.00 0.00 0.00 174.94 175.67 3hg7 s THR 277 N 0.36 1.87 -1.47 2.92 -4.23 -0.88 -5.00 115.64 109.21 3hg7 s THR 277 Ca -0.17 -1.39 -0.10 0.00 -1.18 0.00 0.00 61.69 58.85 3hg7 s THR 277 Cb -0.17 -1.63 0.02 0.00 1.34 0.00 0.00 72.50 72.06 3hg7 s THR 277 CO 0.07 0.18 2.49 -0.81 -0.54 0.00 0.00 174.62 176.01 3hg7 n PRO 278 N 1.55 3.63 -3.88 3.99 -0.04 -1.26 -4.38 135.00 134.60 3hg7 n PRO 278 Ca -0.18 -2.74 -0.34 0.00 -0.04 0.00 0.00 63.50 60.20 3hg7 n PRO 278 Cb 0.53 -2.92 0.01 0.00 -0.04 0.00 0.00 33.50 31.08 3hg7 n PRO 278 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 3hg7 n HIS 279 N 3.97 -1.68 -2.14 0.54 -0.00 -0.53 -4.90 115.22 110.48 3hg7 n HIS 279 Ca 0.63 0.43 0.02 0.00 0.46 0.00 0.00 57.72 59.26 3hg7 n HIS 279 Cb 0.30 -3.30 0.02 0.00 -0.12 0.00 0.00 29.99 26.88 3hg7 n HIS 279 CO 0.00 0.00 0.00 0.27 0.46 0.00 0.00 176.34 177.07 3hg7 n ASN 280 N -2.63 0.54 0.13 0.26 6.94 -1.26 -4.87 115.26 114.37 3hg7 n ASN 280 Ca -0.16 -2.10 0.03 0.00 -0.02 0.00 0.00 54.58 52.33 3hg7 n ASN 280 Cb 0.61 -0.26 0.43 0.00 -2.36 0.00 0.00 39.78 38.20 3hg7 n ASN 280 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 3hg7 h SER 281 N 0.42 0.21 -1.83 0.53 4.64 -1.91 -3.37 113.55 112.23 3hg7 h SER 281 Ca -0.09 -0.03 -0.34 0.00 -0.47 0.00 0.00 61.79 60.86 3hg7 h SER 281 Cb 1.56 -0.05 -0.29 0.00 -0.31 0.00 0.00 62.40 63.31 3hg7 h SER 281 CO 0.04 0.33 -0.67 0.00 -0.87 0.00 0.00 176.83 175.65 3hg7 s ALA 282 N -4.83 -0.60 0.64 5.18 0.00 -1.26 -4.39 121.76 116.50 3hg7 s ALA 282 Ca -0.06 -0.94 -0.18 0.00 0.00 0.00 0.00 51.96 50.79 3hg7 s ALA 282 Cb 0.16 -2.13 -0.01 0.00 0.00 0.00 0.00 23.12 21.13 3hg7 s ALA 282 CO 0.72 -2.16 1.23 -0.47 0.00 0.00 0.00 175.76 175.09 3hg7 s TYR 283 N 1.35 2.23 -0.61 0.00 6.14 -1.26 -4.97 117.35 120.23 3hg7 s TYR 283 Ca 0.18 1.52 -0.21 0.00 0.64 0.00 0.00 57.07 59.20 3hg7 s TYR 283 Cb -0.13 -3.54 0.08 0.00 0.42 0.00 0.00 41.96 38.79 3hg7 s TYR 283 CO -0.04 -2.52 0.84 -1.12 0.64 0.00 0.00 175.55 173.36 3hg7 s SER 284 N -1.63 6.20 0.11 4.32 0.01 -1.26 -5.02 113.70 116.42 3hg7 s SER 284 Ca 0.78 -1.06 -0.30 0.00 1.31 0.00 0.00 55.95 56.68 3hg7 s SER 284 Cb -0.32 -2.37 -0.06 0.00 0.21 0.00 0.00 66.02 63.48 3hg7 s SER 284 CO 0.38 -1.25 0.98 -0.36 0.41 0.00 0.00 173.24 173.39 3hg7 s PHE 285 N 3.45 3.78 0.32 2.43 0.08 -1.26 -4.91 117.98 121.87 3hg7 s PHE 285 Ca 0.19 1.77 0.02 0.00 0.12 0.00 0.00 56.93 59.02 3hg7 s PHE 285 Cb -0.19 -3.08 0.53 0.00 -0.57 0.00 0.00 43.02 39.71 3hg7 s PHE 285 CO 0.10 0.10 1.89 -1.35 -0.10 0.00 0.00 175.22 175.85 3hg7 h PRO 286 N 5.63 0.71 -0.95 0.24 0.11 -1.97 -1.09 132.00 134.68 3hg7 h PRO 286 Ca -0.43 -0.12 0.12 0.00 0.11 0.00 0.00 66.00 65.68 3hg7 h PRO 286 Cb 1.21 -0.12 -0.08 0.00 0.11 0.00 0.00 31.00 32.12 3hg7 h PRO 286 CO 0.72 0.63 0.58 -0.44 -0.21 0.00 0.00 178.00 179.28 3hg7 h ASP 287 N 0.69 0.83 0.55 -2.05 5.19 -1.96 0.33 116.42 120.00 3hg7 h ASP 287 Ca 0.16 0.05 -0.29 0.00 -0.62 0.00 0.00 57.03 56.34 3hg7 h ASP 287 Cb 0.22 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 39.63 3hg7 h ASP 287 CO -0.01 0.43 -1.36 0.44 -3.12 0.00 0.00 179.24 175.63 3hg7 h ASP 288 N 0.90 0.44 -0.41 6.45 3.32 -1.65 -3.08 116.42 122.40 3hg7 h ASP 288 Ca 0.48 -0.51 -0.12 0.00 0.02 0.00 0.00 57.03 56.89 3hg7 h ASP 288 Cb 0.50 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 3hg7 h ASP 288 CO -0.28 1.41 -0.19 0.58 -1.72 0.00 0.00 179.24 179.04 3hg7 h VAL 289 N 0.08 1.27 -0.43 -1.35 2.07 -0.82 -2.53 116.25 114.53 3hg7 h VAL 289 Ca -0.18 -1.33 -0.05 0.00 0.82 0.00 0.00 66.70 65.96 3hg7 h VAL 289 Cb 2.00 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 32.87 3hg7 h VAL 289 CO 0.19 0.46 0.04 0.00 0.02 0.00 0.00 177.57 178.28 3hg7 h ALA 290 N 0.98 1.28 -0.71 1.67 0.00 -0.43 0.12 119.26 122.17 3hg7 h ALA 290 Ca 0.11 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3hg7 h ALA 290 Cb 0.74 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3hg7 h ALA 290 CO 0.06 0.49 0.33 0.37 0.00 0.00 0.00 179.25 180.50 3hg7 h GLN 291 N 0.64 1.03 -0.51 0.00 4.15 -1.43 0.44 115.11 119.43 3hg7 h GLN 291 Ca 0.14 -0.16 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 3hg7 h GLN 291 Cb 0.34 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.82 3hg7 h GLN 291 CO 0.01 0.81 0.24 0.82 -1.93 0.00 0.00 178.83 178.78 3hg7 h ILE 292 N 1.00 1.20 0.18 2.39 2.04 -0.90 -2.08 117.51 121.34 3hg7 h ILE 292 Ca 0.24 -0.58 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 3hg7 h ILE 292 Cb 0.13 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 3hg7 h ILE 292 CO -0.03 0.23 -0.09 0.15 0.00 0.00 0.00 178.15 178.41 3hg7 h PHE 293 N 0.68 -0.23 -0.54 1.37 3.57 -0.66 -1.32 116.94 119.81 3hg7 h PHE 293 Ca 0.17 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 3hg7 h PHE 293 Cb 0.14 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 3hg7 h PHE 293 CO -0.00 -0.14 0.06 0.28 -2.23 0.00 0.00 178.31 176.28 3hg7 h VAL 294 N -0.25 1.24 -0.45 1.41 2.07 -0.84 0.36 116.25 119.79 3hg7 h VAL 294 Ca -0.03 -0.97 -0.06 0.00 0.82 0.00 0.00 66.70 66.46 3hg7 h VAL 294 Cb 0.19 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 3hg7 h VAL 294 CO 0.04 0.35 0.03 0.03 0.02 0.00 0.00 177.57 178.04 3hg7 h ARG 295 N 0.83 0.78 -0.29 1.57 3.08 -1.31 -2.09 114.38 116.94 3hg7 h ARG 295 Ca 0.17 -0.23 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 3hg7 h ARG 295 Cb 0.41 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 3hg7 h ARG 295 CO 0.01 0.82 -0.13 -0.91 -1.07 0.00 0.00 179.97 178.69 3hg7 h ASN 296 N 0.63 0.48 -0.27 7.04 2.35 -0.86 -2.85 115.58 122.10 3hg7 h ASN 296 Ca 0.13 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3hg7 h ASN 296 Cb 0.45 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 3hg7 h ASN 296 CO 0.02 0.65 0.14 0.22 -1.65 0.00 0.00 177.43 176.80 3hg7 h TYR 297 N 0.46 0.37 -0.72 1.19 3.20 0.02 0.16 116.97 121.65 3hg7 h TYR 297 Ca 0.08 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.04 3hg7 h TYR 297 Cb 0.51 -0.12 -0.07 0.00 1.54 0.00 0.00 36.73 38.59 3hg7 h TYR 297 CO 0.02 0.33 0.36 0.82 -1.64 0.00 0.00 178.16 178.05 3hg7 h ILE 298 N 0.31 0.84 -0.26 1.81 1.08 -1.27 -1.29 117.51 118.73 3hg7 h ILE 298 Ca 0.09 -0.21 -0.04 0.00 -0.39 0.00 0.00 64.86 64.31 3hg7 h ILE 298 Cb 0.09 0.18 -0.01 0.00 -3.07 0.00 0.00 36.82 34.01 3hg7 h ILE 298 CO -0.01 0.11 0.00 0.03 -0.69 0.00 0.00 178.15 177.59 3hg7 h ARG 299 N 0.61 0.46 -0.43 2.37 3.08 -1.25 -3.10 114.38 116.11 3hg7 h ARG 299 Ca 0.36 -0.15 0.06 0.00 0.07 0.00 0.00 59.98 60.32 3hg7 h ARG 299 Cb 0.39 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.34 3hg7 h ARG 299 CO -0.28 0.62 0.12 0.35 -1.07 0.00 0.00 179.97 179.72 3hg7 h PHE 300 N 0.25 0.21 0.00 3.04 3.57 -0.12 -0.67 116.94 123.22 3hg7 h PHE 300 Ca 0.08 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.60 3hg7 h PHE 300 Cb 0.41 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.12 3hg7 h PHE 300 CO 0.03 0.05 0.00 0.44 -2.23 0.00 0.00 178.31 176.61 3hg7 n ILE 301 N -5.05 0.51 1.25 1.41 -5.35 -0.54 -1.85 119.36 109.75 3hg7 n ILE 301 Ca 0.03 0.02 0.13 0.00 -0.27 0.00 0.00 62.75 62.67 3hg7 n ILE 301 Cb 0.18 -0.74 0.31 0.00 -1.74 0.00 0.00 39.64 37.65 3hg7 n ILE 301 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3hg7 n ASP 302 N -1.82 2.15 -0.32 7.28 8.00 -0.75 -4.97 116.55 126.12 3hg7 n ASP 302 Ca 0.05 -1.69 -0.04 0.00 0.71 0.00 0.00 54.79 53.82 3hg7 n ASP 302 Cb 0.31 0.03 -0.02 0.00 -0.02 0.00 0.00 41.12 41.41 3hg7 n ASP 302 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hg7 n GLY 303 N 1.27 0.66 3.91 0.44 0.00 -0.77 -5.04 105.19 105.67 3hg7 n GLY 303 Ca 0.16 -0.34 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 3hg7 n GLY 303 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hg7 s GLN 304 N -1.76 3.59 0.29 1.61 -0.21 -0.33 -5.01 119.66 117.85 3hg7 s GLN 304 Ca 0.00 0.07 -0.30 0.00 0.02 0.00 0.00 55.36 55.15 3hg7 s GLN 304 Cb 0.00 -2.52 -0.12 0.00 1.00 0.00 0.00 33.01 31.37 3hg7 s GLN 304 CO 0.00 0.02 1.55 -2.30 -2.12 0.00 0.00 175.29 172.44 3hg7 n PRO 305 N -1.61 2.56 -2.92 2.91 -0.02 -1.26 -4.28 135.00 130.39 3hg7 n PRO 305 Ca -0.01 0.91 -0.35 0.00 -2.02 0.00 0.00 63.50 62.03 3hg7 n PRO 305 Cb 0.55 -2.66 -0.06 0.00 -0.02 0.00 0.00 33.50 31.30 3hg7 n PRO 305 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3hg7 s LEU 306 N -0.48 4.19 0.22 2.45 1.43 -1.26 -4.90 118.68 120.33 3hg7 s LEU 306 Ca 0.64 1.61 -0.15 0.00 -1.03 0.00 0.00 54.13 55.20 3hg7 s LEU 306 Cb -0.52 -4.06 -0.08 0.00 0.03 0.00 0.00 46.19 41.56 3hg7 s LEU 306 CO 0.50 -0.14 0.64 -0.62 0.23 0.00 0.00 176.35 176.96 3hg7 s ASP 307 N -1.88 6.85 -0.23 2.29 2.15 -1.26 -3.97 116.67 120.62 3hg7 s ASP 307 Ca 0.52 1.19 0.00 0.00 0.43 0.00 0.00 52.55 54.69 3hg7 s ASP 307 Cb -0.14 -2.33 0.00 0.00 -0.30 0.00 0.00 42.92 40.14 3hg7 s ASP 307 CO 0.19 -0.01 0.00 0.61 -0.17 0.00 0.00 175.17 175.79 3hg7 n GLY 308 N 0.39 0.55 3.75 2.66 0.00 -1.26 -4.74 105.19 106.54 3hg7 n GLY 308 Ca -0.02 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.72 3hg7 n GLY 308 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hg7 s LYS 309 N -2.00 4.39 -0.22 1.61 2.47 -1.25 -1.24 119.74 123.50 3hg7 s LYS 309 Ca 0.00 2.10 -0.11 0.00 -1.56 0.00 0.00 55.97 56.39 3hg7 s LYS 309 Cb 0.00 -3.16 -0.05 0.00 -1.46 0.00 0.00 37.83 33.17 3hg7 s LYS 309 CO 0.00 -0.22 0.20 0.42 0.16 0.00 0.00 175.35 175.91 3hg7 s ILE 310 N -0.29 5.35 -0.35 5.43 -1.09 0.24 -4.93 121.20 125.55 3hg7 s ILE 310 Ca 0.54 0.29 -0.23 0.00 -2.23 0.00 0.00 60.65 59.02 3hg7 s ILE 310 Cb -0.37 -3.54 0.01 0.00 -1.58 0.00 0.00 42.46 36.98 3hg7 s ILE 310 CO 0.42 0.36 0.75 -0.62 -1.23 0.00 0.00 174.94 174.63 3hg7 s ASP 311 N 0.81 6.54 0.49 3.58 2.15 -1.26 -4.63 116.67 124.34 3hg7 s ASP 311 Ca 0.10 0.36 0.13 0.00 0.43 0.00 0.00 52.55 53.58 3hg7 s ASP 311 Cb -0.13 -2.38 1.14 0.00 -0.30 0.00 0.00 42.92 41.25 3hg7 s ASP 311 CO 0.03 -0.68 2.12 -0.26 -0.17 0.00 0.00 175.17 176.21 3hg7 h PHE 312 N 8.41 0.15 -0.01 -5.34 0.04 -1.97 -3.53 116.94 114.69 3hg7 h PHE 312 Ca -0.25 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.52 3hg7 h PHE 312 Cb 1.10 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 39.20 3hg7 h PHE 312 CO 0.78 0.10 0.00 -0.25 -0.60 0.00 0.00 178.31 178.34