#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ng9 n SER 2 N 0.00 -6.25 -3.20 3.17 7.64 -1.26 -4.90 113.62 108.83 1ng9 n SER 2 Ca 0.00 1.37 -0.19 0.00 1.01 0.00 0.00 58.87 61.06 1ng9 n SER 2 Cb 0.00 -4.21 0.02 0.00 -1.01 0.00 0.00 64.21 59.01 1ng9 n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ng9 n ALA 3 N -2.60 -2.52 -1.61 -0.43 0.00 -1.26 -4.83 120.51 107.26 1ng9 n ALA 3 Ca -0.01 0.45 -0.44 0.00 0.00 0.00 0.00 53.44 53.45 1ng9 n ALA 3 Cb 0.37 -2.00 -0.04 0.00 0.00 0.00 0.00 19.45 17.79 1ng9 n ALA 3 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1ng9 n ILE 4 N 0.26 0.48 -2.50 0.00 5.41 -1.26 -4.86 119.36 116.89 1ng9 n ILE 4 Ca -0.01 -0.31 -0.32 0.00 1.00 0.00 0.00 62.75 63.11 1ng9 n ILE 4 Cb 0.51 -2.33 0.00 0.00 -0.71 0.00 0.00 39.64 37.11 1ng9 n ILE 4 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1ng9 n GLU 5 N 8.11 3.54 -0.89 0.38 1.02 -1.26 -4.92 120.64 126.63 1ng9 n GLU 5 Ca 0.27 -4.41 -0.29 0.00 -0.02 0.00 0.00 57.16 52.71 1ng9 n GLU 5 Cb 0.40 -2.28 0.19 0.00 -0.02 0.00 0.00 31.44 29.72 1ng9 n GLU 5 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1ng9 s ASN 6 N -2.66 2.31 0.21 1.62 4.22 -1.26 -4.92 114.94 114.46 1ng9 s ASN 6 Ca 0.48 1.53 -0.09 0.00 -2.14 0.00 0.00 52.86 52.64 1ng9 s ASN 6 Cb 0.35 -2.21 0.29 0.00 1.28 0.00 0.00 41.25 40.96 1ng9 s ASN 6 CO -0.22 -3.38 1.75 0.15 -2.04 0.00 0.00 177.10 173.36 1ng9 h PHE 7 N -2.06 0.44 0.00 1.54 3.57 -1.96 -2.70 116.94 115.78 1ng9 h PHE 7 Ca -0.54 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 60.90 1ng9 h PHE 7 Cb 1.31 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.93 1ng9 h PHE 7 CO 0.35 0.12 -0.41 -0.44 -2.23 0.00 0.00 178.31 175.70 1ng9 h ASP 8 N 0.44 0.00 0.56 0.41 3.32 -1.99 -2.62 116.42 116.54 1ng9 h ASP 8 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 1ng9 h ASP 8 Cb 0.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1ng9 h ASP 8 CO -0.30 0.41 0.00 0.00 -1.72 0.00 0.00 179.24 177.63 1ng9 n ALA 9 N -2.44 2.33 -2.61 3.45 0.00 -1.02 -4.82 120.51 115.39 1ng9 n ALA 9 Ca -0.02 -0.12 -0.28 0.00 0.00 0.00 0.00 53.44 53.02 1ng9 n ALA 9 Cb 0.45 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 1ng9 n ALA 9 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1ng9 s HIS 10 N -2.63 3.48 0.67 0.00 3.76 -0.99 -4.86 115.29 114.71 1ng9 s HIS 10 Ca 0.24 0.52 -0.11 0.00 -0.15 0.00 0.00 55.06 55.56 1ng9 s HIS 10 Cb 0.18 -2.00 -0.01 0.00 1.11 0.00 0.00 32.58 31.86 1ng9 s HIS 10 CO 0.42 0.25 1.05 0.95 -0.85 0.00 0.00 174.74 176.56 1ng9 s THR 11 N -2.01 4.28 0.36 1.30 -4.23 -1.26 -4.80 115.64 109.27 1ng9 s THR 11 Ca 0.42 0.74 0.12 0.00 -1.18 0.00 0.00 61.69 61.79 1ng9 s THR 11 Cb -0.11 -3.57 0.34 0.00 1.34 0.00 0.00 72.50 70.50 1ng9 s THR 11 CO 0.30 -0.97 1.79 -0.65 -0.54 0.00 0.00 174.62 174.55 1ng9 h PRO 12 N -0.57 0.55 -0.13 3.99 0.11 -1.98 -0.00 132.00 133.98 1ng9 h PRO 12 Ca -0.44 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1ng9 h PRO 12 Cb 1.20 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1ng9 h PRO 12 CO 0.59 0.37 0.03 1.98 -0.21 0.00 0.00 178.00 180.75 1ng9 h MET 13 N 0.57 0.20 -0.02 1.05 1.85 -1.98 -2.86 114.93 113.74 1ng9 h MET 13 Ca 0.57 -0.05 -0.17 0.00 -0.61 0.00 0.00 59.70 59.44 1ng9 h MET 13 Cb 1.15 -0.03 -0.01 0.00 0.43 0.00 0.00 31.60 33.14 1ng9 h MET 13 CO -0.32 0.37 -0.76 0.52 -0.40 0.00 0.00 176.91 176.32 1ng9 h MET 14 N -0.00 0.15 0.18 0.39 2.86 -1.81 -1.42 114.93 115.28 1ng9 h MET 14 Ca 0.04 -0.14 0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1ng9 h MET 14 Cb 0.26 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.92 1ng9 h MET 14 CO 0.00 0.84 -0.31 1.96 1.06 0.00 0.00 176.91 180.46 1ng9 h GLN 15 N 0.10 -0.55 -0.41 1.72 4.20 -1.02 0.32 115.11 119.48 1ng9 h GLN 15 Ca -0.02 0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1ng9 h GLN 15 Cb 1.33 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 29.22 1ng9 h GLN 15 CO 0.11 -0.37 0.14 0.37 -0.67 0.00 0.00 178.83 178.41 1ng9 h GLN 16 N -0.57 0.59 0.04 1.46 4.15 -1.48 -2.48 115.11 116.82 1ng9 h GLN 16 Ca 0.02 -0.08 -0.00 0.00 0.77 0.00 0.00 58.65 59.35 1ng9 h GLN 16 Cb 0.57 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.16 1ng9 h GLN 16 CO -0.15 0.51 -0.02 -0.92 -1.93 0.00 0.00 178.83 176.32 1ng9 h TYR 17 N 0.58 -0.05 -0.23 3.99 3.20 -0.81 -2.76 116.97 120.89 1ng9 h TYR 17 Ca 0.14 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 1ng9 h TYR 17 Cb 0.16 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 1ng9 h TYR 17 CO 0.01 0.42 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.78 1ng9 h LEU 18 N -0.54 0.35 -0.56 2.82 3.38 -0.90 0.20 115.31 120.05 1ng9 h LEU 18 Ca -0.01 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.93 1ng9 h LEU 18 Cb 0.49 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 1ng9 h LEU 18 CO 0.01 0.48 0.32 0.03 0.09 0.00 0.00 178.44 179.37 1ng9 h ARG 19 N 0.35 0.60 0.00 1.13 3.08 -1.45 0.90 114.38 118.99 1ng9 h ARG 19 Ca 0.07 -0.04 -0.19 0.00 0.07 0.00 0.00 59.98 59.90 1ng9 h ARG 19 Cb 0.39 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1ng9 h ARG 19 CO 0.02 0.39 -0.86 -0.07 -1.07 0.00 0.00 179.97 178.38 1ng9 h LEU 20 N 0.61 0.16 -0.87 3.04 3.38 -1.12 -3.17 115.31 117.34 1ng9 h LEU 20 Ca 0.24 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 1ng9 h LEU 20 Cb 0.10 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1ng9 h LEU 20 CO -0.14 0.94 -0.36 0.50 0.09 0.00 0.00 178.44 179.48 1ng9 h LYS 21 N 0.06 0.00 0.00 1.13 1.63 -0.69 -2.85 116.57 115.85 1ng9 h LYS 21 Ca -0.03 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.70 1ng9 h LYS 21 Cb 1.50 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.12 1ng9 h LYS 21 CO 0.12 0.36 -0.34 0.00 -3.45 0.00 0.00 179.45 176.14 1ng9 h ALA 22 N 1.64 1.03 0.00 5.00 0.00 -0.80 -1.92 119.26 124.21 1ng9 h ALA 22 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1ng9 h ALA 22 Cb 0.92 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1ng9 h ALA 22 CO 0.05 0.43 0.00 1.04 0.00 0.00 0.00 179.25 180.76 1ng9 n GLN 23 N -3.55 0.12 -3.19 0.00 6.02 -1.08 -4.03 117.38 111.67 1ng9 n GLN 23 Ca -0.00 0.17 -0.20 0.00 -0.01 0.00 0.00 57.00 56.96 1ng9 n GLN 23 Cb 0.48 -1.66 -0.04 0.00 1.02 0.00 0.00 30.24 30.04 1ng9 n GLN 23 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1ng9 n HIS 24 N -1.87 0.10 -0.11 1.08 8.25 -0.76 -5.02 115.22 116.88 1ng9 n HIS 24 Ca 0.05 -3.76 0.01 0.00 -0.26 0.00 0.00 57.72 53.76 1ng9 n HIS 24 Cb 0.33 -0.40 0.30 0.00 1.12 0.00 0.00 29.99 31.34 1ng9 n HIS 24 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1ng9 h PRO 25 N 3.24 0.77 -0.44 -0.41 0.13 -1.60 -3.15 132.00 130.55 1ng9 h PRO 25 Ca 0.09 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1ng9 h PRO 25 Cb 0.94 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.91 1ng9 h PRO 25 CO 0.49 0.56 0.00 0.39 -0.23 0.00 0.00 178.00 179.22 1ng9 n GLU 26 N -4.40 3.04 -4.18 0.86 -0.58 -1.26 -4.97 120.64 109.14 1ng9 n GLU 26 Ca 0.05 -2.44 -0.15 0.00 -0.42 0.00 0.00 57.16 54.20 1ng9 n GLU 26 Cb 0.09 -1.54 -0.11 0.00 -0.57 0.00 0.00 31.44 29.32 1ng9 n GLU 26 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 1ng9 s ILE 27 N -1.51 1.00 0.58 -3.67 -4.36 -1.19 -5.04 121.20 107.01 1ng9 s ILE 27 Ca 0.35 -1.64 -0.20 0.00 -0.26 0.00 0.00 60.65 58.90 1ng9 s ILE 27 Cb 0.22 -1.37 -0.04 0.00 1.25 0.00 0.00 42.46 42.52 1ng9 s ILE 27 CO 0.18 -0.53 1.31 0.18 0.24 0.00 0.00 174.94 176.33 1ng9 n LEU 28 N 0.58 5.57 -3.97 0.37 4.77 -1.24 -4.83 117.00 118.24 1ng9 n LEU 28 Ca -0.16 0.92 -0.31 0.00 -0.03 0.00 0.00 56.01 56.43 1ng9 n LEU 28 Cb 0.57 -1.56 -0.15 0.00 -2.33 0.00 0.00 43.42 39.95 1ng9 n LEU 28 CO 0.27 -0.81 -0.43 -0.22 -1.33 0.00 0.00 177.39 174.87 1ng9 s LEU 29 N -3.63 2.87 0.06 2.23 2.96 -1.26 -1.39 118.68 120.52 1ng9 s LEU 29 Ca 0.76 -1.28 -0.31 0.00 -0.22 0.00 0.00 54.13 53.08 1ng9 s LEU 29 Cb -0.41 -1.28 -0.06 0.00 0.50 0.00 0.00 46.19 44.94 1ng9 s LEU 29 CO 0.46 -0.23 1.26 -0.36 -1.32 0.00 0.00 176.35 176.16 1ng9 s PHE 30 N 1.31 3.32 -0.19 5.38 0.40 -0.29 -4.48 117.98 123.43 1ng9 s PHE 30 Ca -0.06 1.17 0.00 0.00 -0.60 0.00 0.00 56.93 57.44 1ng9 s PHE 30 Cb -0.19 -3.50 0.05 0.00 0.51 0.00 0.00 43.02 39.88 1ng9 s PHE 30 CO -0.06 -1.64 -0.06 -0.47 0.70 0.00 0.00 175.22 173.68 1ng9 s TYR 31 N 1.28 2.06 -0.13 0.36 5.04 -0.52 -1.89 117.35 123.56 1ng9 s TYR 31 Ca 0.60 -1.39 -0.29 0.00 -2.44 0.00 0.00 57.07 53.54 1ng9 s TYR 31 Cb -0.31 -1.46 -0.04 0.00 0.35 0.00 0.00 41.96 40.50 1ng9 s TYR 31 CO 0.29 -0.69 1.60 0.50 -1.34 0.00 0.00 175.55 175.91 1ng9 s ARG 32 N 1.51 4.04 -0.33 4.97 6.06 -1.11 -0.86 118.95 133.23 1ng9 s ARG 32 Ca -0.02 1.95 0.01 0.00 -2.50 0.00 0.00 55.73 55.17 1ng9 s ARG 32 Cb -0.17 -3.98 0.10 0.00 0.06 0.00 0.00 34.95 30.97 1ng9 s ARG 32 CO -0.07 -1.00 0.10 -1.64 -2.50 0.00 0.00 175.30 170.19 1ng9 s MET 33 N 4.23 0.96 7.68 5.12 -1.94 -0.10 -4.79 119.30 130.45 1ng9 s MET 33 Ca 0.71 -1.38 0.00 0.00 -1.71 0.00 0.00 55.69 53.31 1ng9 s MET 33 Cb -0.29 -2.32 0.00 0.00 2.01 0.00 0.00 34.83 34.23 1ng9 s MET 33 CO 0.28 -1.00 0.00 0.41 -0.01 0.00 0.00 175.02 174.70 1ng9 n GLY 34 N 4.55 3.90 1.48 -0.03 0.00 -1.26 -2.24 105.19 111.60 1ng9 n GLY 34 Ca 0.01 0.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 1ng9 n GLY 34 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ng9 n ASP 35 N 6.53 3.42 -3.97 1.61 9.92 -1.26 -4.86 116.55 127.94 1ng9 n ASP 35 Ca 0.00 -2.70 -0.11 0.00 -0.53 0.00 0.00 54.79 51.45 1ng9 n ASP 35 Cb 0.00 -0.65 -0.12 0.00 -0.64 0.00 0.00 41.12 39.71 1ng9 n ASP 35 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1ng9 s PHE 36 N -1.79 0.30 -0.22 1.24 0.08 -0.95 -1.49 117.98 115.15 1ng9 s PHE 36 Ca 0.29 -0.39 -0.11 0.00 0.12 0.00 0.00 56.93 56.84 1ng9 s PHE 36 Cb 0.24 -0.20 -0.05 0.00 -0.57 0.00 0.00 43.02 42.44 1ng9 s PHE 36 CO 0.07 -0.12 0.18 0.71 -0.10 0.00 0.00 175.22 175.95 1ng9 s TYR 37 N -1.08 3.35 0.11 0.36 2.02 -0.21 -0.93 117.35 120.98 1ng9 s TYR 37 Ca -0.11 0.30 0.10 0.00 -0.37 0.00 0.00 57.07 57.00 1ng9 s TYR 37 Cb -0.08 -2.27 -0.04 0.00 -0.40 0.00 0.00 41.96 39.18 1ng9 s TYR 37 CO -0.01 0.13 -0.26 -1.21 -1.57 0.00 0.00 175.55 172.64 1ng9 s GLU 38 N 0.87 1.54 0.25 -0.62 2.02 -0.04 -1.24 118.70 121.47 1ng9 s GLU 38 Ca 0.09 -1.28 0.11 0.00 0.02 0.00 0.00 54.97 53.91 1ng9 s GLU 38 Cb -0.13 -1.95 -0.05 0.00 0.10 0.00 0.00 34.13 32.10 1ng9 s GLU 38 CO 0.03 0.47 -0.19 -0.51 0.02 0.00 0.00 175.26 175.07 1ng9 s LEU 39 N -1.91 2.55 0.07 1.80 1.02 -0.14 -1.43 118.68 120.64 1ng9 s LEU 39 Ca 0.14 -1.00 0.01 0.00 0.02 0.00 0.00 54.13 53.30 1ng9 s LEU 39 Cb -0.10 -1.01 -0.04 0.00 0.02 0.00 0.00 46.19 45.06 1ng9 s LEU 39 CO 0.06 0.01 -0.05 -0.36 0.02 0.00 0.00 176.35 176.02 1ng9 s PHE 40 N -2.46 0.73 0.00 0.29 0.08 -1.26 -2.62 117.98 112.73 1ng9 s PHE 40 Ca 0.27 -0.90 0.00 0.00 0.12 0.00 0.00 56.93 56.41 1ng9 s PHE 40 Cb -0.05 -0.45 0.00 0.00 -0.57 0.00 0.00 43.02 41.95 1ng9 s PHE 40 CO 0.12 -0.21 0.00 0.66 -0.10 0.00 0.00 175.22 175.69 1ng9 n TYR 41 N 0.23 0.00 0.09 0.36 4.01 -0.96 -2.01 117.16 118.88 1ng9 n TYR 41 Ca -0.14 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.56 1ng9 n TYR 41 Cb 0.60 0.00 0.16 0.00 -0.31 0.00 0.00 39.34 39.79 1ng9 n TYR 41 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1ng9 h ASP 42 N 0.00 0.24 -0.66 7.72 5.19 -1.98 -2.69 116.42 124.25 1ng9 h ASP 42 Ca 0.00 -0.12 0.11 0.00 -0.62 0.00 0.00 57.03 56.39 1ng9 h ASP 42 Cb 0.00 -0.07 -0.08 0.00 0.18 0.00 0.00 39.33 39.36 1ng9 h ASP 42 CO 0.00 0.74 0.25 0.44 -3.12 0.00 0.00 179.24 177.55 1ng9 h ASP 43 N 0.17 0.25 -0.39 6.45 5.19 -1.80 -1.19 116.42 125.09 1ng9 h ASP 43 Ca 0.00 0.09 -0.09 0.00 -0.62 0.00 0.00 57.03 56.40 1ng9 h ASP 43 Cb 1.01 0.06 -0.02 0.00 0.18 0.00 0.00 39.33 40.57 1ng9 h ASP 43 CO 0.08 0.13 -0.09 0.00 -3.12 0.00 0.00 179.24 176.24 1ng9 h ALA 44 N 1.46 0.97 -0.29 3.45 0.00 -1.37 0.87 119.26 124.34 1ng9 h ALA 44 Ca 0.34 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1ng9 h ALA 44 Cb 0.44 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1ng9 h ALA 44 CO -0.33 0.61 -0.13 0.87 0.00 0.00 0.00 179.25 180.27 1ng9 h LYS 45 N 0.75 0.61 0.06 0.00 1.57 -1.19 -0.89 116.57 117.47 1ng9 h LYS 45 Ca 0.13 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1ng9 h LYS 45 Cb 0.59 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1ng9 h LYS 45 CO 0.04 0.83 -0.03 0.00 -0.57 0.00 0.00 179.45 179.72 1ng9 h ARG 46 N 0.36 -0.07 -0.95 3.15 3.08 -1.19 -2.84 114.38 115.92 1ng9 h ARG 46 Ca 0.07 0.01 0.16 0.00 0.07 0.00 0.00 59.98 60.28 1ng9 h ARG 46 Cb 0.64 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.63 1ng9 h ARG 46 CO 0.04 0.34 0.60 0.00 -1.07 0.00 0.00 179.97 179.89 1ng9 h ALA 47 N 0.39 1.77 -0.60 0.04 0.00 -0.85 0.73 119.26 120.74 1ng9 h ALA 47 Ca -0.01 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1ng9 h ALA 47 Cb 0.45 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1ng9 h ALA 47 CO 0.01 -0.05 0.36 1.03 0.00 0.00 0.00 179.25 180.60 1ng9 h SER 48 N 0.74 0.58 0.01 0.00 0.87 -1.04 -0.49 113.55 114.23 1ng9 h SER 48 Ca 0.50 0.01 -0.26 0.00 -1.23 0.00 0.00 61.79 60.80 1ng9 h SER 48 Cb 0.77 -0.12 0.02 0.00 -0.44 0.00 0.00 62.40 62.64 1ng9 h SER 48 CO -0.26 0.40 -1.03 1.56 -0.53 0.00 0.00 176.83 176.97 1ng9 h GLN 49 N 0.70 0.69 -0.01 2.24 4.20 -0.71 -2.15 115.11 120.07 1ng9 h GLN 49 Ca 0.24 -0.75 -0.08 0.00 0.06 0.00 0.00 58.65 58.13 1ng9 h GLN 49 Cb 0.04 0.21 0.01 0.00 0.30 0.00 0.00 27.48 28.04 1ng9 h GLN 49 CO -0.11 1.32 -0.30 -0.07 -0.67 0.00 0.00 178.83 178.99 1ng9 h LEU 50 N 0.36 0.29 0.00 1.46 3.38 -1.01 -3.32 115.31 116.47 1ng9 h LEU 50 Ca -0.13 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.09 1ng9 h LEU 50 Cb 1.69 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.35 1ng9 h LEU 50 CO 0.20 1.00 -0.24 -0.07 0.09 0.00 0.00 178.44 179.42 1ng9 h LEU 51 N -0.40 0.00 -2.28 1.67 3.38 -1.24 -3.49 115.31 112.96 1ng9 h LEU 51 Ca -0.04 -0.07 -0.23 0.00 0.09 0.00 0.00 57.88 57.64 1ng9 h LEU 51 Cb 1.04 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.95 1ng9 h LEU 51 CO 0.06 0.03 -0.69 -0.67 0.09 0.00 0.00 178.44 177.26 1ng9 n ASP 52 N -2.32 -4.66 -4.35 -0.43 2.03 -0.84 -5.05 116.55 100.94 1ng9 n ASP 52 Ca 0.04 -0.57 -0.18 0.00 0.52 0.00 0.00 54.79 54.61 1ng9 n ASP 52 Cb 0.45 -4.42 -0.10 0.00 -0.72 0.00 0.00 41.12 36.33 1ng9 n ASP 52 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1ng9 s ILE 53 N -3.32 1.02 0.22 5.18 -4.36 -1.03 -5.06 121.20 113.85 1ng9 s ILE 53 Ca 0.26 -2.03 -0.30 0.00 -0.26 0.00 0.00 60.65 58.32 1ng9 s ILE 53 Cb -0.03 -2.43 -0.09 0.00 1.25 0.00 0.00 42.46 41.16 1ng9 s ILE 53 CO 0.62 -0.25 1.25 -0.55 0.24 0.00 0.00 174.94 176.24 1ng9 s SER 54 N -3.33 6.99 -0.41 4.36 0.15 -1.26 -4.51 113.70 115.68 1ng9 s SER 54 Ca 0.30 2.36 -0.15 0.00 0.70 0.00 0.00 55.95 59.16 1ng9 s SER 54 Cb 0.06 -2.61 0.02 0.00 -1.71 0.00 0.00 66.02 61.78 1ng9 s SER 54 CO 0.10 -0.43 0.33 -0.22 1.20 0.00 0.00 173.24 174.21 1ng9 s LEU 55 N -0.47 5.03 0.00 3.45 2.96 -1.26 -4.46 118.68 123.93 1ng9 s LEU 55 Ca 0.53 -0.83 0.00 0.00 -0.22 0.00 0.00 54.13 53.61 1ng9 s LEU 55 Cb -0.35 -2.21 0.00 0.00 0.50 0.00 0.00 46.19 44.13 1ng9 s LEU 55 CO 0.40 -0.47 0.00 1.07 -1.32 0.00 0.00 176.35 176.03 1ng9 n THR 56 N 5.22 0.00 -3.65 3.68 5.66 -0.06 -4.95 114.28 120.19 1ng9 n THR 56 Ca -0.10 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.75 1ng9 n THR 56 Cb 0.47 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.17 1ng9 n THR 56 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 1ng9 s LYS 57 N 1.29 0.78 0.13 1.09 -2.85 -1.26 -1.46 119.74 117.46 1ng9 s LYS 57 Ca 0.00 0.56 -0.24 0.00 -1.00 0.00 0.00 55.97 55.29 1ng9 s LYS 57 Cb 0.00 0.37 -0.07 0.00 -2.06 0.00 0.00 37.83 36.07 1ng9 s LYS 57 CO 0.00 -0.15 0.74 0.50 0.10 0.00 0.00 175.35 176.53 1ng9 s ARG 58 N -0.25 4.49 0.81 1.78 3.52 -0.69 -4.93 118.95 123.69 1ng9 s ARG 58 Ca -0.04 1.07 -0.11 0.00 -0.13 0.00 0.00 55.73 56.51 1ng9 s ARG 58 Cb -0.03 -3.28 0.08 0.00 -1.56 0.00 0.00 34.95 30.16 1ng9 s ARG 58 CO 0.03 0.53 1.13 0.20 -0.81 0.00 0.00 175.30 176.39 1ng9 s GLY 59 N -0.95 1.81 -0.14 8.12 0.00 -1.26 -2.56 107.32 112.34 1ng9 s GLY 59 Ca 0.35 0.49 -0.11 0.00 0.00 0.00 0.00 44.72 45.45 1ng9 s GLY 59 CO 0.24 0.87 0.36 0.00 0.00 0.00 0.00 173.10 174.58 1ng9 s ALA 60 N -2.64 -0.89 0.01 3.20 0.00 -1.26 -4.81 121.76 115.36 1ng9 s ALA 60 Ca 0.65 1.14 0.07 0.00 0.00 0.00 0.00 51.96 53.82 1ng9 s ALA 60 Cb -0.21 -0.68 -0.23 0.00 0.00 0.00 0.00 23.12 22.00 1ng9 s ALA 60 CO 0.54 -0.20 0.86 1.03 0.00 0.00 0.00 175.76 177.99 1ng9 h SER 61 N 6.13 0.09 -3.11 0.00 0.87 -1.97 -3.43 113.55 112.14 1ng9 h SER 61 Ca -0.31 -0.15 -0.76 0.00 -1.23 0.00 0.00 61.79 59.35 1ng9 h SER 61 Cb 1.18 -0.03 -0.24 0.00 -0.44 0.00 0.00 62.40 62.87 1ng9 h SER 61 CO 0.29 1.12 -0.23 0.00 -0.53 0.00 0.00 176.83 177.49 1ng9 s ALA 62 N -2.63 3.64 0.00 6.23 0.00 -1.26 -5.02 121.76 122.71 1ng9 s ALA 62 Ca -0.05 -2.52 0.00 0.00 0.00 0.00 0.00 51.96 49.39 1ng9 s ALA 62 Cb 0.08 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1ng9 s ALA 62 CO 0.83 -2.00 0.00 0.41 0.00 0.00 0.00 175.76 174.99 1ng9 n GLY 63 N 5.23 1.18 3.85 0.00 0.00 -1.26 -4.87 105.19 109.32 1ng9 n GLY 63 Ca -0.14 -0.67 -0.32 0.00 0.00 0.00 0.00 46.02 44.89 1ng9 n GLY 63 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ng9 s GLU 64 N 0.00 3.92 1.00 1.61 2.56 -1.26 -4.85 118.70 121.67 1ng9 s GLU 64 Ca 0.00 0.83 -0.15 0.00 0.00 0.00 0.00 54.97 55.65 1ng9 s GLU 64 Cb 0.00 -2.21 0.19 0.00 2.00 0.00 0.00 34.13 34.12 1ng9 s GLU 64 CO 0.00 -0.20 1.20 -1.25 -0.56 0.00 0.00 175.26 174.46 1ng9 s PRO 65 N -3.96 0.42 -0.27 4.30 0.05 -1.26 -4.80 135.00 129.47 1ng9 s PRO 65 Ca 0.57 -0.08 -0.04 0.00 0.05 0.00 0.00 61.00 61.50 1ng9 s PRO 65 Cb -0.10 -1.79 0.02 0.00 0.05 0.00 0.00 34.50 32.68 1ng9 s PRO 65 CO 0.30 -2.62 0.01 0.42 0.05 0.00 0.00 177.00 175.17 1ng9 s ILE 66 N -3.46 3.43 0.51 0.56 1.01 -1.06 -4.99 121.20 117.19 1ng9 s ILE 66 Ca 0.69 -0.83 -0.21 0.00 0.00 0.00 0.00 60.65 60.30 1ng9 s ILE 66 Cb -0.09 -2.75 -0.08 0.00 0.01 0.00 0.00 42.46 39.55 1ng9 s ILE 66 CO 0.54 0.15 0.93 -2.65 0.00 0.00 0.00 174.94 173.90 1ng9 n PRO 67 N 4.77 1.07 -3.67 2.79 -0.02 -1.26 -1.70 135.00 136.98 1ng9 n PRO 67 Ca -0.16 0.40 -0.14 0.00 -2.02 0.00 0.00 63.50 61.58 1ng9 n PRO 67 Cb 0.48 -2.04 -0.08 0.00 -0.02 0.00 0.00 33.50 31.83 1ng9 n PRO 67 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1ng9 s MET 68 N -2.29 0.73 0.29 -0.52 1.75 -0.53 -2.27 119.30 116.45 1ng9 s MET 68 Ca 0.68 0.43 -0.12 0.00 -1.25 0.00 0.00 55.69 55.44 1ng9 s MET 68 Cb -0.49 0.34 0.01 0.00 2.84 0.00 0.00 34.83 37.53 1ng9 s MET 68 CO 0.53 -0.15 0.54 0.00 -0.65 0.00 0.00 175.02 175.29 1ng9 s ALA 69 N -0.39 -0.21 0.00 4.11 0.00 -1.08 -0.88 121.76 123.31 1ng9 s ALA 69 Ca -0.05 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 50.98 1ng9 s ALA 69 Cb -0.03 1.01 0.00 0.00 0.00 0.00 0.00 23.12 24.10 1ng9 s ALA 69 CO 0.04 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.33 1ng9 n GLY 70 N -0.44 1.18 3.07 0.00 0.00 -1.26 -0.97 105.19 106.76 1ng9 n GLY 70 Ca -0.02 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 1ng9 n GLY 70 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ng9 s ILE 71 N -2.00 0.52 0.43 -0.61 -4.36 -0.38 -4.93 121.20 109.87 1ng9 s ILE 71 Ca 0.00 -1.18 -0.26 0.00 -0.26 0.00 0.00 60.65 58.95 1ng9 s ILE 71 Cb 0.00 -0.72 -0.09 0.00 1.25 0.00 0.00 42.46 42.90 1ng9 s ILE 71 CO 0.00 -0.46 1.46 -2.84 0.24 0.00 0.00 174.94 173.34 1ng9 s PRO 72 N -1.87 3.78 0.47 0.37 0.02 -1.26 -1.05 135.00 135.47 1ng9 s PRO 72 Ca -0.08 2.49 0.13 0.00 0.02 0.00 0.00 61.00 63.57 1ng9 s PRO 72 Cb -0.08 -2.74 1.09 0.00 0.02 0.00 0.00 34.50 32.79 1ng9 s PRO 72 CO -0.00 -0.77 2.08 0.10 -0.33 0.00 0.00 177.00 178.08 1ng9 h TYR 73 N 2.49 0.13 0.00 6.54 -0.00 -1.57 -1.43 116.97 123.13 1ng9 h TYR 73 Ca -0.51 -0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.22 1ng9 h TYR 73 Cb 1.26 -0.04 0.00 0.00 0.00 0.00 0.00 36.73 37.95 1ng9 h TYR 73 CO 0.51 0.13 0.00 -2.39 -0.00 0.00 0.00 178.16 176.41 1ng9 n HIS 74 N -4.46 0.00 -0.34 0.10 1.44 -1.26 -3.18 115.22 107.52 1ng9 n HIS 74 Ca -0.02 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.73 1ng9 n HIS 74 Cb 0.13 0.00 0.05 0.00 0.12 0.00 0.00 29.99 30.29 1ng9 n HIS 74 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1ng9 n ALA 75 N -0.95 2.10 -0.24 1.59 0.00 -0.54 -4.82 120.51 117.64 1ng9 n ALA 75 Ca 0.19 -1.51 0.00 0.00 0.00 0.00 0.00 53.44 52.12 1ng9 n ALA 75 Cb 0.09 -0.13 0.12 0.00 0.00 0.00 0.00 19.45 19.52 1ng9 n ALA 75 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1ng9 h VAL 76 N 0.08 0.90 -0.89 0.00 -1.51 -1.63 -3.02 116.25 110.17 1ng9 h VAL 76 Ca 0.00 -0.22 0.05 0.00 -1.23 0.00 0.00 66.70 65.30 1ng9 h VAL 76 Cb 0.67 0.20 -0.05 0.00 -2.13 0.00 0.00 31.29 29.98 1ng9 h VAL 76 CO 0.00 0.12 0.58 -0.08 -1.23 0.00 0.00 177.57 176.96 1ng9 h GLU 77 N 0.64 1.04 -0.65 5.19 4.81 -1.88 0.76 114.58 124.50 1ng9 h GLU 77 Ca 0.33 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 1ng9 h GLU 77 Cb 0.29 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1ng9 h GLU 77 CO -0.23 0.69 0.18 -0.91 -0.73 0.00 0.00 179.01 178.01 1ng9 h ASN 78 N 1.08 0.97 0.60 1.04 2.35 -1.92 -2.10 115.58 117.59 1ng9 h ASN 78 Ca 0.36 -0.22 -0.24 0.00 -0.55 0.00 0.00 56.30 55.65 1ng9 h ASN 78 Cb 0.09 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.20 1ng9 h ASN 78 CO -0.12 0.94 -1.09 1.88 -1.65 0.00 0.00 177.43 177.39 1ng9 h TYR 79 N 0.96 0.43 -0.78 1.19 0.05 -1.49 -2.86 116.97 114.47 1ng9 h TYR 79 Ca 0.21 -0.28 0.04 0.00 0.05 0.00 0.00 58.73 58.75 1ng9 h TYR 79 Cb 0.34 -0.03 -0.05 0.00 1.01 0.00 0.00 36.73 38.00 1ng9 h TYR 79 CO 0.03 1.17 0.51 -0.07 -1.05 0.00 0.00 178.16 178.74 1ng9 h LEU 80 N 0.10 0.80 0.11 3.88 3.38 -0.78 -1.82 115.31 120.98 1ng9 h LEU 80 Ca -0.09 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1ng9 h LEU 80 Cb 1.78 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.35 1ng9 h LEU 80 CO 0.17 0.54 -0.05 0.00 0.09 0.00 0.00 178.44 179.19 1ng9 h ALA 81 N 1.56 -0.14 -0.95 1.53 0.00 -1.32 -1.48 119.26 118.45 1ng9 h ALA 81 Ca 0.31 -0.15 0.21 0.00 0.00 0.00 0.00 54.91 55.29 1ng9 h ALA 81 Cb 0.09 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 1ng9 h ALA 81 CO -0.10 -0.44 0.62 0.87 0.00 0.00 0.00 179.25 180.20 1ng9 h LYS 82 N -0.41 0.48 0.00 0.00 1.57 -1.25 -1.19 116.57 115.77 1ng9 h LYS 82 Ca -0.01 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 1ng9 h LYS 82 Cb 0.34 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1ng9 h LYS 82 CO 0.02 0.32 -0.22 -0.07 -0.57 0.00 0.00 179.45 178.93 1ng9 h LEU 83 N 0.50 0.19 -1.26 2.94 3.38 -1.22 -3.32 115.31 116.52 1ng9 h LEU 83 Ca 0.52 -0.79 -0.07 0.00 0.09 0.00 0.00 57.88 57.63 1ng9 h LEU 83 Cb 1.16 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1ng9 h LEU 83 CO -0.24 0.96 -0.33 1.62 0.09 0.00 0.00 178.44 180.53 1ng9 h VAL 84 N -0.55 1.00 0.00 1.22 3.04 -0.62 -1.55 116.25 118.80 1ng9 h VAL 84 Ca -0.03 -1.24 -0.04 0.00 -1.01 0.00 0.00 66.70 64.38 1ng9 h VAL 84 Cb 0.99 1.72 -0.01 0.00 -2.01 0.00 0.00 31.29 31.99 1ng9 h VAL 84 CO 0.04 0.33 -0.17 0.78 -1.01 0.00 0.00 177.57 177.54 1ng9 h ASN 85 N 0.00 0.00 0.02 3.17 2.35 -1.37 -2.76 115.58 117.00 1ng9 h ASN 85 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1ng9 h ASN 85 Cb 0.69 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.06 1ng9 h ASN 85 CO 0.04 0.17 -0.30 0.00 -1.65 0.00 0.00 177.43 175.70 1ng9 n GLN 86 N -3.90 1.45 -0.27 0.81 6.02 -0.65 -4.97 117.38 115.87 1ng9 n GLN 86 Ca -0.02 -1.13 0.00 0.00 -0.01 0.00 0.00 57.00 55.84 1ng9 n GLN 86 Cb 0.26 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.04 1ng9 n GLN 86 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ng9 n GLY 87 N 1.37 0.86 3.71 1.08 0.00 -0.98 -5.01 105.19 106.22 1ng9 n GLY 87 Ca 0.12 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1ng9 n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ng9 s GLU 88 N -0.67 4.42 0.50 1.61 0.41 -0.80 -4.81 118.70 119.35 1ng9 s GLU 88 Ca 0.00 0.89 -0.15 0.00 -0.41 0.00 0.00 54.97 55.30 1ng9 s GLU 88 Cb 0.00 -3.46 -0.07 0.00 -1.78 0.00 0.00 34.13 28.82 1ng9 s GLU 88 CO 0.00 0.03 0.94 -1.12 -0.49 0.00 0.00 175.26 174.62 1ng9 s SER 89 N 0.84 6.58 -0.07 -0.19 0.01 -1.26 -4.04 113.70 115.57 1ng9 s SER 89 Ca 0.38 1.47 -0.03 0.00 1.31 0.00 0.00 55.95 59.08 1ng9 s SER 89 Cb -0.18 -2.47 0.04 0.00 0.21 0.00 0.00 66.02 63.63 1ng9 s SER 89 CO 0.18 -0.57 0.14 -0.69 0.41 0.00 0.00 173.24 172.71 1ng9 s VAL 90 N -2.61 -0.11 -0.12 3.43 1.01 -0.40 -3.69 120.40 117.91 1ng9 s VAL 90 Ca 0.57 0.24 -0.23 0.00 0.00 0.00 0.00 61.98 62.56 1ng9 s VAL 90 Cb -0.10 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 36.01 1ng9 s VAL 90 CO 0.33 0.10 0.72 0.00 0.00 0.00 0.00 175.10 176.25 1ng9 s ALA 91 N 1.52 3.42 -0.30 5.51 0.00 -0.48 -0.74 121.76 130.68 1ng9 s ALA 91 Ca -0.05 0.03 -0.13 0.00 0.00 0.00 0.00 51.96 51.81 1ng9 s ALA 91 Cb -0.12 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 19.94 1ng9 s ALA 91 CO -0.06 -0.33 0.25 0.42 0.00 0.00 0.00 175.76 176.05 1ng9 s ILE 92 N 1.36 5.27 -0.17 0.00 -1.09 -0.23 -1.14 121.20 125.19 1ng9 s ILE 92 Ca 0.36 0.09 -0.05 0.00 -2.23 0.00 0.00 60.65 58.82 1ng9 s ILE 92 Cb -0.17 -3.65 -0.03 0.00 -1.58 0.00 0.00 42.46 37.03 1ng9 s ILE 92 CO 0.15 0.12 0.00 0.00 -1.23 0.00 0.00 174.94 173.98 1ng9 s GLU 94 N 0.47 1.95 -0.08 0.00 0.41 -0.10 -2.74 118.70 118.61 1ng9 s GLU 94 Ca -0.01 -1.81 -0.22 0.00 -0.41 0.00 0.00 54.97 52.52 1ng9 s GLU 94 Cb -0.14 -1.84 -0.04 0.00 -1.78 0.00 0.00 34.13 30.34 1ng9 s GLU 94 CO 0.02 0.17 0.66 -0.65 -0.49 0.00 0.00 175.26 174.97 1ng9 s GLN 95 N -3.65 4.42 -0.22 1.61 -0.21 -1.26 -2.30 119.66 118.04 1ng9 s GLN 95 Ca 0.33 0.80 -0.00 0.00 0.02 0.00 0.00 55.36 56.51 1ng9 s GLN 95 Cb 0.00 -3.45 -0.19 0.00 1.00 0.00 0.00 33.01 30.37 1ng9 s GLN 95 CO 0.18 0.07 -0.07 -0.89 -2.12 0.00 0.00 175.29 172.46 1ng9 n ILE 96 N 3.78 1.57 -2.68 1.08 2.08 -0.56 -4.96 119.36 119.66 1ng9 n ILE 96 Ca -0.02 -0.59 -0.21 0.00 0.56 0.00 0.00 62.75 62.48 1ng9 n ILE 96 Cb 0.51 -1.51 0.06 0.00 -0.75 0.00 0.00 39.64 37.95 1ng9 n ILE 96 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1ng9 s GLY 97 N -6.26 1.81 -0.29 7.39 0.00 -1.24 -5.04 107.32 103.69 1ng9 s GLY 97 Ca -0.32 -1.54 -0.24 0.00 0.00 0.00 0.00 44.72 42.63 1ng9 s GLY 97 CO 0.64 -1.16 0.79 -0.35 0.00 0.00 0.00 173.10 173.02 1ng9 s ASP 98 N -4.53 6.70 0.54 1.64 2.15 -1.26 -4.89 116.67 117.01 1ng9 s ASP 98 Ca 0.60 0.75 0.21 0.00 0.43 0.00 0.00 52.55 54.54 1ng9 s ASP 98 Cb -0.08 -2.41 1.39 0.00 -0.30 0.00 0.00 42.92 41.52 1ng9 s ASP 98 CO 0.40 -0.58 2.13 -0.65 -0.17 0.00 0.00 175.17 176.29 1ng9 h PRO 99 N 8.01 0.00 0.00 4.34 0.11 -1.97 -2.48 132.00 140.00 1ng9 h PRO 99 Ca -0.24 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.84 1ng9 h PRO 99 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1ng9 h PRO 99 CO 0.88 0.00 -0.13 0.00 -0.21 0.00 0.00 178.00 178.54 1ng9 h ALA 100 N 1.93 1.13 -0.09 -0.75 0.00 -1.99 -3.08 119.26 116.40 1ng9 h ALA 100 Ca 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ng9 h ALA 100 Cb 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ng9 h ALA 100 CO -0.00 0.16 0.00 0.25 0.00 0.00 0.00 179.25 179.66 1ng9 n THR 101 N -3.43 1.68 -4.04 0.00 -2.24 -0.95 -4.98 114.28 100.32 1ng9 n THR 101 Ca -0.01 -1.76 -0.35 0.00 -2.27 0.00 0.00 64.05 59.66 1ng9 n THR 101 Cb 0.30 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.41 1ng9 n THR 101 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1ng9 s SER 102 N -2.05 4.84 0.04 3.42 0.01 -1.11 -5.00 113.70 113.85 1ng9 s SER 102 Ca 0.26 -0.21 -0.30 0.00 1.31 0.00 0.00 55.95 57.01 1ng9 s SER 102 Cb 0.21 -1.83 -0.17 0.00 0.21 0.00 0.00 66.02 64.44 1ng9 s SER 102 CO 0.05 0.05 1.36 0.50 0.41 0.00 0.00 173.24 175.61 1ng9 h LYS 103 N 7.57 -0.91 0.00 12.44 3.64 -1.93 -3.46 116.57 133.92 1ng9 h LYS 103 Ca -0.36 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1ng9 h LYS 103 Cb 1.18 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 33.20 1ng9 h LYS 103 CO 0.61 -0.58 0.00 0.41 -2.27 0.00 0.00 179.45 177.62 1ng9 n GLY 104 N -1.03 1.49 3.70 5.01 0.00 -1.26 -5.04 105.19 108.06 1ng9 n GLY 104 Ca -0.13 -1.82 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 1ng9 n GLY 104 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ng9 n PRO 105 N 0.00 2.25 -2.63 1.61 -0.02 -1.26 -4.98 135.00 129.96 1ng9 n PRO 105 Ca 0.00 0.79 -0.35 0.00 -2.02 0.00 0.00 63.50 61.93 1ng9 n PRO 105 Cb 0.00 -2.46 -0.05 0.00 -0.02 0.00 0.00 33.50 30.97 1ng9 n PRO 105 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ng9 s VAL 106 N -0.44 3.94 0.13 -1.45 1.01 -1.26 -4.96 120.40 117.37 1ng9 s VAL 106 Ca 0.62 1.34 -0.34 0.00 0.00 0.00 0.00 61.98 63.60 1ng9 s VAL 106 Cb -0.58 -3.62 -0.16 0.00 0.00 0.00 0.00 36.38 32.01 1ng9 s VAL 106 CO 0.54 -0.13 1.19 1.21 0.00 0.00 0.00 175.10 177.91 1ng9 n GLU 107 N -0.42 1.03 -3.79 2.72 2.13 -1.26 -4.88 120.64 116.17 1ng9 n GLU 107 Ca 0.07 0.37 -0.24 0.00 0.66 0.00 0.00 57.16 58.01 1ng9 n GLU 107 Cb 0.52 -1.90 -0.17 0.00 0.27 0.00 0.00 31.44 30.16 1ng9 n GLU 107 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1ng9 s ARG 108 N -0.09 0.78 0.09 5.31 0.52 -1.26 -1.50 118.95 122.79 1ng9 s ARG 108 Ca 0.78 -0.03 0.04 0.00 -0.52 0.00 0.00 55.73 56.00 1ng9 s ARG 108 Cb -0.92 -1.23 -0.04 0.00 0.52 0.00 0.00 34.95 33.28 1ng9 s ARG 108 CO 0.51 -0.34 0.03 0.15 0.02 0.00 0.00 175.30 175.66 1ng9 s LYS 109 N 1.91 2.66 -0.22 3.54 1.02 -0.97 -4.94 119.74 122.73 1ng9 s LYS 109 Ca 0.04 -0.80 -0.28 0.00 0.02 0.00 0.00 55.97 54.95 1ng9 s LYS 109 Cb -0.13 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.59 1ng9 s LYS 109 CO -0.06 0.54 0.97 0.08 -0.92 0.00 0.00 175.35 175.97 1ng9 s VAL 110 N -1.36 4.74 -0.12 3.17 1.01 -1.26 -0.92 120.40 125.65 1ng9 s VAL 110 Ca 0.27 1.89 0.19 0.00 0.00 0.00 0.00 61.98 64.33 1ng9 s VAL 110 Cb -0.12 -4.25 -0.23 0.00 0.00 0.00 0.00 36.38 31.78 1ng9 s VAL 110 CO 0.20 -0.13 0.49 1.33 0.00 0.00 0.00 175.10 176.98 1ng9 n VAL 111 N 5.23 0.88 -3.48 2.92 0.24 -0.59 -4.98 118.33 118.56 1ng9 n VAL 111 Ca 0.10 -0.68 -0.11 0.00 -2.04 0.00 0.00 64.34 61.60 1ng9 n VAL 111 Cb 0.47 -0.42 -0.03 0.00 -1.47 0.00 0.00 33.84 32.39 1ng9 n VAL 111 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ng9 s ARG 112 N -2.98 1.00 -0.17 7.34 1.70 -1.24 -4.42 118.95 120.19 1ng9 s ARG 112 Ca -0.07 -0.27 0.01 0.00 -0.47 0.00 0.00 55.73 54.93 1ng9 s ARG 112 Cb 0.09 0.46 0.02 0.00 -0.57 0.00 0.00 34.95 34.96 1ng9 s ARG 112 CO 0.85 -0.42 -0.18 0.42 -1.08 0.00 0.00 175.30 174.89 1ng9 s ILE 113 N -2.98 1.88 -0.51 4.99 1.01 0.99 -1.07 121.20 125.51 1ng9 s ILE 113 Ca 0.01 -0.83 -0.27 0.00 0.00 0.00 0.00 60.65 59.56 1ng9 s ILE 113 Cb -0.01 -1.72 0.03 0.00 0.01 0.00 0.00 42.46 40.77 1ng9 s ILE 113 CO -0.08 0.51 1.04 -0.69 0.00 0.00 0.00 174.94 175.73 1ng9 s VAL 114 N 1.33 4.29 0.23 2.92 1.01 0.08 -4.67 120.40 125.59 1ng9 s VAL 114 Ca 0.04 0.84 0.11 0.00 0.00 0.00 0.00 61.98 62.97 1ng9 s VAL 114 Cb -0.13 -4.56 -0.05 0.00 0.00 0.00 0.00 36.38 31.64 1ng9 s VAL 114 CO -0.12 -1.04 -0.21 0.42 0.00 0.00 0.00 175.10 174.16 1ng9 s THR 115 N 4.24 2.33 0.47 3.92 -4.23 -1.26 -1.27 115.64 119.84 1ng9 s THR 115 Ca 0.40 -2.22 0.22 0.00 -1.18 0.00 0.00 61.69 58.91 1ng9 s THR 115 Cb -0.09 -2.18 0.26 0.00 1.34 0.00 0.00 72.50 71.83 1ng9 s THR 115 CO 0.27 -0.30 2.09 -0.65 -0.54 0.00 0.00 174.62 175.48 1ng9 h PRO 116 N 2.71 0.00 -0.28 3.99 0.11 -1.88 -1.54 132.00 135.11 1ng9 h PRO 116 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1ng9 h PRO 116 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1ng9 h PRO 116 CO 0.55 0.11 0.00 0.41 -0.21 0.00 0.00 178.00 178.86 1ng9 n GLY 117 N -1.02 1.23 0.15 -0.55 0.00 -1.26 -4.30 105.19 99.44 1ng9 n GLY 117 Ca -0.02 -0.65 0.09 0.00 0.00 0.00 0.00 46.02 45.43 1ng9 n GLY 117 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ng9 n THR 118 N 1.15 1.68 -3.02 2.61 -2.24 -0.59 -3.36 114.28 110.52 1ng9 n THR 118 Ca 0.18 -2.05 -0.40 0.00 -2.27 0.00 0.00 64.05 59.51 1ng9 n THR 118 Cb 0.53 -0.15 -0.05 0.00 -2.10 0.00 0.00 70.33 68.56 1ng9 n THR 118 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1ng9 s ILE 119 N -2.55 4.64 0.00 2.28 -4.36 -1.19 -4.78 121.20 115.25 1ng9 s ILE 119 Ca 0.29 1.59 0.00 0.00 -0.26 0.00 0.00 60.65 62.27 1ng9 s ILE 119 Cb 0.25 -4.09 0.00 0.00 1.25 0.00 0.00 42.46 39.87 1ng9 s ILE 119 CO 0.02 0.43 0.15 -1.54 0.24 0.00 0.00 174.94 174.23 1ng9 n SER 120 N 2.39 0.29 -4.78 4.36 3.41 -1.26 -4.64 113.62 113.40 1ng9 n SER 120 Ca -0.04 -0.62 -0.37 0.00 -0.26 0.00 0.00 58.87 57.58 1ng9 n SER 120 Cb 0.50 0.41 -0.06 0.00 -0.26 0.00 0.00 64.21 64.80 1ng9 n SER 120 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1ng9 s ASP 121 N -0.41 7.26 0.35 4.04 1.01 -1.26 -4.79 116.67 122.87 1ng9 s ASP 121 Ca 0.00 1.90 0.04 0.00 0.71 0.00 0.00 52.55 55.21 1ng9 s ASP 121 Cb 0.00 -2.59 0.65 0.00 1.01 0.00 0.00 42.92 42.00 1ng9 s ASP 121 CO 0.00 -0.13 1.93 -0.08 0.21 0.00 0.00 175.17 177.10 1ng9 h GLU 122 N 3.16 0.57 -0.00 8.23 4.81 -1.97 -2.96 114.58 126.42 1ng9 h GLU 122 Ca -0.47 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 1ng9 h GLU 122 Cb 1.20 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1ng9 h GLU 122 CO 0.65 0.52 -0.09 0.00 -0.73 0.00 0.00 179.01 179.36 1ng9 n ALA 123 N -2.47 2.64 0.69 2.92 0.00 -1.26 -3.41 120.51 119.62 1ng9 n ALA 123 Ca 0.02 -0.19 0.07 0.00 0.00 0.00 0.00 53.44 53.35 1ng9 n ALA 123 Cb 0.18 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.21 1ng9 n ALA 123 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ng9 n LEU 124 N -1.28 1.36 -4.74 0.00 4.77 -1.12 -5.00 117.00 110.98 1ng9 n LEU 124 Ca 0.11 -0.70 -0.23 0.00 -0.03 0.00 0.00 56.01 55.16 1ng9 n LEU 124 Cb 0.29 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.32 1ng9 n LEU 124 CO 0.26 0.27 -0.18 -0.76 -1.33 0.00 0.00 177.39 175.65 1ng9 s LEU 125 N -2.18 3.28 -0.12 2.23 1.43 -1.22 -5.00 118.68 117.10 1ng9 s LEU 125 Ca 0.11 -0.77 -0.06 0.00 -1.03 0.00 0.00 54.13 52.38 1ng9 s LEU 125 Cb 0.12 -1.76 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 1ng9 s LEU 125 CO 0.45 -0.32 0.09 -1.10 0.23 0.00 0.00 176.35 175.69 1ng9 s GLN 126 N -3.87 3.39 0.10 1.70 -0.21 -1.26 -4.99 119.66 114.52 1ng9 s GLN 126 Ca 0.38 -0.24 -0.21 0.00 0.02 0.00 0.00 55.36 55.31 1ng9 s GLN 126 Cb -0.02 -3.08 -0.11 0.00 1.00 0.00 0.00 33.01 30.80 1ng9 s GLN 126 CO 0.23 0.68 1.73 0.93 -2.12 0.00 0.00 175.29 176.74 1ng9 h GLU 127 N 5.29 0.15 -0.54 2.91 5.08 -1.98 -3.18 114.58 122.30 1ng9 h GLU 127 Ca -0.51 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1ng9 h GLU 127 Cb 1.21 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1ng9 h GLU 127 CO 0.59 0.13 0.00 0.54 -1.00 0.00 0.00 179.01 179.27 1ng9 n ARG 128 N -4.99 3.52 -4.91 2.33 1.74 -1.26 -4.68 116.66 108.41 1ng9 n ARG 128 Ca -0.05 -2.77 -0.27 0.00 -0.77 0.00 0.00 57.85 53.99 1ng9 n ARG 128 Cb 0.04 -1.80 -0.16 0.00 -1.02 0.00 0.00 32.46 29.52 1ng9 n ARG 128 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1ng9 s GLN 129 N -1.90 1.94 0.57 5.56 -0.21 -1.20 -4.35 119.66 120.06 1ng9 s GLN 129 Ca 0.46 -0.66 -0.18 0.00 0.02 0.00 0.00 55.36 55.00 1ng9 s GLN 129 Cb 0.30 -1.67 -0.05 0.00 1.00 0.00 0.00 33.01 32.60 1ng9 s GLN 129 CO 0.21 0.26 1.10 -0.51 -2.12 0.00 0.00 175.29 174.23 1ng9 s ASP 130 N 0.02 5.69 -0.30 5.90 1.01 -1.26 -4.59 116.67 123.14 1ng9 s ASP 130 Ca -0.04 2.05 -0.01 0.00 0.71 0.00 0.00 52.55 55.26 1ng9 s ASP 130 Cb -0.12 -2.56 0.10 0.00 1.01 0.00 0.00 42.92 41.34 1ng9 s ASP 130 CO 0.03 -1.23 0.09 0.21 0.21 0.00 0.00 175.17 174.47 1ng9 s ASN 131 N -2.13 3.97 -0.14 0.27 2.47 -1.26 -4.98 114.94 113.15 1ng9 s ASN 131 Ca 0.69 -1.59 -0.03 0.00 0.42 0.00 0.00 52.86 52.35 1ng9 s ASN 131 Cb -0.21 -0.87 -0.03 0.00 -1.45 0.00 0.00 41.25 38.69 1ng9 s ASN 131 CO 0.30 -0.40 -0.02 -0.76 -3.72 0.00 0.00 177.10 172.50 1ng9 s LEU 132 N 1.61 3.35 0.47 3.21 1.43 -1.26 -4.57 118.68 122.91 1ng9 s LEU 132 Ca 0.09 -0.06 -0.19 0.00 -1.03 0.00 0.00 54.13 52.93 1ng9 s LEU 132 Cb -0.17 -1.80 -0.09 0.00 0.03 0.00 0.00 46.19 44.16 1ng9 s LEU 132 CO -0.23 0.22 0.98 -0.22 0.23 0.00 0.00 176.35 177.32 1ng9 s LEU 133 N 0.08 3.82 0.10 1.79 2.96 -0.13 -0.53 118.68 126.77 1ng9 s LEU 133 Ca 0.00 1.70 -0.07 0.00 -0.22 0.00 0.00 54.13 55.54 1ng9 s LEU 133 Cb -0.13 -4.53 -0.01 0.00 0.50 0.00 0.00 46.19 42.01 1ng9 s LEU 133 CO 0.02 -0.52 0.18 0.00 -1.32 0.00 0.00 176.35 174.71 1ng9 s ALA 134 N -2.28 -0.03 -0.02 5.97 0.00 -0.68 -0.67 121.76 124.05 1ng9 s ALA 134 Ca 0.62 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.80 1ng9 s ALA 134 Cb -0.11 0.57 0.02 0.00 0.00 0.00 0.00 23.12 23.59 1ng9 s ALA 134 CO 0.20 -0.52 -0.02 0.00 0.00 0.00 0.00 175.76 175.42 1ng9 s ALA 135 N -3.90 0.39 0.17 0.00 0.00 -0.68 -1.27 121.76 116.47 1ng9 s ALA 135 Ca 0.09 0.01 0.08 0.00 0.00 0.00 0.00 51.96 52.14 1ng9 s ALA 135 Cb 0.05 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 1ng9 s ALA 135 CO -0.08 -0.00 -0.16 -1.50 0.00 0.00 0.00 175.76 174.02 1ng9 s ILE 136 N 0.61 1.71 -0.25 0.00 2.07 0.46 -1.57 121.20 124.22 1ng9 s ILE 136 Ca -0.07 -1.96 -0.26 0.00 -1.41 0.00 0.00 60.65 56.95 1ng9 s ILE 136 Cb -0.10 -1.84 0.11 0.00 0.13 0.00 0.00 42.46 40.76 1ng9 s ILE 136 CO -0.01 -0.41 0.94 0.86 -1.91 0.00 0.00 174.94 174.41 1ng9 s TRP 137 N -2.31 -0.54 -0.00 3.50 -0.11 -0.83 -3.12 118.94 115.53 1ng9 s TRP 137 Ca 0.16 1.24 0.02 0.00 1.22 0.00 0.00 56.10 58.74 1ng9 s TRP 137 Cb -0.04 0.36 -0.01 0.00 -1.50 0.00 0.00 33.47 32.28 1ng9 s TRP 137 CO 0.06 -0.30 -0.07 -1.14 -4.62 0.00 0.00 176.95 170.88 1ng9 s GLN 138 N -0.04 0.57 0.36 5.86 0.74 -1.26 -1.18 119.66 124.71 1ng9 s GLN 138 Ca 0.01 -0.27 0.04 0.00 0.05 0.00 0.00 55.36 55.19 1ng9 s GLN 138 Cb -0.04 -0.54 -0.03 0.00 1.10 0.00 0.00 33.01 33.50 1ng9 s GLN 138 CO -0.02 0.15 0.16 0.16 -0.55 0.00 0.00 175.29 175.19 1ng9 s ASP 139 N -0.21 2.19 0.01 6.67 1.47 -0.85 -4.81 116.67 121.14 1ng9 s ASP 139 Ca 0.02 -1.64 -0.01 0.00 1.18 0.00 0.00 52.55 52.10 1ng9 s ASP 139 Cb -0.03 0.46 -0.00 0.00 -0.34 0.00 0.00 42.92 43.01 1ng9 s ASP 139 CO -0.00 -0.93 0.09 -1.54 0.68 0.00 0.00 175.17 173.46 1ng9 n SER 140 N -1.22 -0.04 0.01 2.11 3.41 -1.26 -2.46 113.62 114.17 1ng9 n SER 140 Ca -0.01 0.10 -0.18 0.00 -0.26 0.00 0.00 58.87 58.51 1ng9 n SER 140 Cb 0.64 -0.02 -0.14 0.00 -0.26 0.00 0.00 64.21 64.43 1ng9 n SER 140 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ng9 h LYS 141 N 0.00 0.21 0.00 4.33 1.57 -1.97 -3.50 116.57 117.21 1ng9 h LYS 141 Ca 0.01 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 1ng9 h LYS 141 Cb 0.02 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1ng9 h LYS 141 CO -0.04 1.17 0.00 0.41 -0.57 0.00 0.00 179.45 180.42 1ng9 n GLY 142 N 1.65 3.19 3.37 3.86 0.00 -1.03 -4.91 105.19 111.32 1ng9 n GLY 142 Ca -0.13 -0.46 -0.24 0.00 0.00 0.00 0.00 46.02 45.19 1ng9 n GLY 142 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ng9 s PHE 143 N -1.10 2.01 0.12 1.61 0.08 -1.19 -2.00 117.98 117.51 1ng9 s PHE 143 Ca 0.00 -0.42 0.08 0.00 0.12 0.00 0.00 56.93 56.70 1ng9 s PHE 143 Cb 0.00 -0.99 -0.04 0.00 -0.57 0.00 0.00 43.02 41.42 1ng9 s PHE 143 CO 0.00 0.41 -0.11 0.20 -0.10 0.00 0.00 175.22 175.61 1ng9 s GLY 144 N -2.70 1.76 -0.24 4.36 0.00 -0.33 -3.88 107.32 106.29 1ng9 s GLY 144 Ca 0.18 -1.30 -0.15 0.00 0.00 0.00 0.00 44.72 43.45 1ng9 s GLY 144 CO 0.08 -1.28 0.60 -0.47 0.00 0.00 0.00 173.10 172.03 1ng9 s TYR 145 N -1.27 -0.87 0.10 1.90 5.04 -0.69 -1.96 117.35 119.59 1ng9 s TYR 145 Ca 0.21 1.82 0.05 0.00 -2.44 0.00 0.00 57.07 56.71 1ng9 s TYR 145 Cb -0.11 0.47 -0.03 0.00 0.35 0.00 0.00 41.96 42.64 1ng9 s TYR 145 CO 0.13 -0.44 -0.13 0.00 -1.34 0.00 0.00 175.55 173.77 1ng9 s ALA 146 N 1.35 1.27 0.02 3.97 0.00 -0.61 -0.63 121.76 127.14 1ng9 s ALA 146 Ca -0.08 -1.17 0.04 0.00 0.00 0.00 0.00 51.96 50.75 1ng9 s ALA 146 Cb -0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.00 1ng9 s ALA 146 CO -0.14 0.08 -0.12 0.95 0.00 0.00 0.00 175.76 176.52 1ng9 s THR 147 N -1.96 0.96 -0.05 0.00 -4.23 -0.83 -1.68 115.64 107.86 1ng9 s THR 147 Ca 0.04 -0.81 0.04 0.00 -1.18 0.00 0.00 61.69 59.78 1ng9 s THR 147 Cb -0.06 -0.86 0.00 0.00 1.34 0.00 0.00 72.50 72.92 1ng9 s THR 147 CO 0.02 0.05 -0.15 -0.22 -0.54 0.00 0.00 174.62 173.78 1ng9 s LEU 148 N -0.85 1.85 -0.62 4.79 2.96 0.16 -1.31 118.68 125.65 1ng9 s LEU 148 Ca 0.01 -0.33 -0.12 0.00 -0.22 0.00 0.00 54.13 53.48 1ng9 s LEU 148 Cb -0.07 -0.90 0.16 0.00 0.50 0.00 0.00 46.19 45.89 1ng9 s LEU 148 CO 0.01 0.12 0.54 -0.62 -1.32 0.00 0.00 176.35 175.07 1ng9 s ASP 149 N 0.19 6.13 0.52 3.68 -1.08 -1.00 -0.96 116.67 124.15 1ng9 s ASP 149 Ca -0.06 -2.24 0.17 0.00 -0.52 0.00 0.00 52.55 49.90 1ng9 s ASP 149 Cb -0.12 -2.11 1.27 0.00 -1.46 0.00 0.00 42.92 40.50 1ng9 s ASP 149 CO 0.02 -0.66 2.12 -0.29 0.52 0.00 0.00 175.17 176.88 1ng9 h ILE 150 N 5.52 0.95 -0.53 4.11 6.09 -1.83 0.26 117.51 132.09 1ng9 h ILE 150 Ca -0.11 -0.01 -0.29 0.00 -1.37 0.00 0.00 64.86 63.08 1ng9 h ILE 150 Cb 1.06 0.92 -0.16 0.00 0.47 0.00 0.00 36.82 39.10 1ng9 h ILE 150 CO 0.86 0.01 0.37 -1.54 -3.07 0.00 0.00 178.15 174.78 1ng9 n SER 151 N -4.51 3.91 0.00 2.19 3.41 -1.26 -4.25 113.62 113.11 1ng9 n SER 151 Ca -0.00 -2.90 0.00 0.00 -0.26 0.00 0.00 58.87 55.70 1ng9 n SER 151 Cb 0.19 -0.74 0.00 0.00 -0.26 0.00 0.00 64.21 63.40 1ng9 n SER 151 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ng9 n SER 152 N -0.29 0.00 0.00 4.04 3.41 -0.82 -4.24 113.62 115.72 1ng9 n SER 152 Ca 0.32 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 1ng9 n SER 152 Cb 1.04 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.99 1ng9 n SER 152 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ng9 n GLY 153 N -0.41 0.62 3.55 5.00 0.00 0.02 -4.92 105.19 109.07 1ng9 n GLY 153 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1ng9 n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ng9 n ARG 154 N -2.00 1.24 -4.14 1.61 1.74 -1.25 -4.69 116.66 109.17 1ng9 n ARG 154 Ca 0.00 0.16 -0.34 0.00 -0.77 0.00 0.00 57.85 56.90 1ng9 n ARG 154 Cb 0.00 -3.23 -0.14 0.00 -1.02 0.00 0.00 32.46 28.06 1ng9 n ARG 154 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1ng9 s PHE 155 N 10.72 2.89 0.15 -1.55 2.19 -1.26 -2.38 117.98 128.74 1ng9 s PHE 155 Ca 1.02 -1.02 0.06 0.00 0.33 0.00 0.00 56.93 57.32 1ng9 s PHE 155 Cb -0.32 -2.01 -0.04 0.00 -1.31 0.00 0.00 43.02 39.34 1ng9 s PHE 155 CO 0.31 -0.53 -0.14 1.03 1.83 0.00 0.00 175.22 177.73 1ng9 s ARG 156 N 1.19 1.13 -0.06 10.12 1.81 -0.43 -2.10 118.95 130.63 1ng9 s ARG 156 Ca 0.02 -1.40 -0.04 0.00 -1.72 0.00 0.00 55.73 52.59 1ng9 s ARG 156 Cb -0.14 -0.93 0.02 0.00 -0.45 0.00 0.00 34.95 33.45 1ng9 s ARG 156 CO -0.03 0.16 0.14 -1.17 -0.68 0.00 0.00 175.30 173.72 1ng9 s LEU 157 N -2.87 1.20 0.15 2.53 0.20 -0.45 -1.95 118.68 117.48 1ng9 s LEU 157 Ca 0.15 0.29 -0.10 0.00 0.69 0.00 0.00 54.13 55.16 1ng9 s LEU 157 Cb -0.02 0.44 -0.00 0.00 -0.43 0.00 0.00 46.19 46.18 1ng9 s LEU 157 CO 0.04 -0.08 0.29 -0.94 -0.29 0.00 0.00 176.35 175.36 1ng9 s SER 158 N 0.46 0.02 -0.48 3.68 1.04 0.20 -0.86 113.70 117.76 1ng9 s SER 158 Ca -0.03 -0.76 0.08 0.00 0.48 0.00 0.00 55.95 55.71 1ng9 s SER 158 Cb -0.05 0.43 0.29 0.00 0.10 0.00 0.00 66.02 66.79 1ng9 s SER 158 CO -0.02 -0.86 0.70 -0.62 0.98 0.00 0.00 173.24 173.42 1ng9 n GLU 159 N -0.19 1.67 -1.63 4.02 1.02 -1.26 -1.71 120.64 122.57 1ng9 n GLU 159 Ca -0.10 -3.91 -0.47 0.00 -0.02 0.00 0.00 57.16 52.66 1ng9 n GLU 159 Cb 0.63 -1.77 -0.04 0.00 -0.02 0.00 0.00 31.44 30.24 1ng9 n GLU 159 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1ng9 n PRO 160 N 0.70 1.63 -0.09 3.49 -0.02 -1.25 -4.79 135.00 134.67 1ng9 n PRO 160 Ca 0.26 0.58 -0.12 0.00 -2.02 0.00 0.00 63.50 62.20 1ng9 n PRO 160 Cb 0.51 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.76 1ng9 n PRO 160 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ng9 h ALA 161 N 4.07 0.37 -2.55 3.55 0.00 -1.94 -3.14 119.26 119.62 1ng9 h ALA 161 Ca -0.44 -0.28 -0.36 0.00 0.00 0.00 0.00 54.91 53.83 1ng9 h ALA 161 Cb 1.30 -0.09 -0.14 0.00 0.00 0.00 0.00 17.79 18.86 1ng9 h ALA 161 CO 0.75 0.19 -0.57 0.16 0.00 0.00 0.00 179.25 179.78 1ng9 s ASP 162 N -6.13 1.05 0.31 0.00 1.47 -1.26 -4.62 116.67 107.49 1ng9 s ASP 162 Ca -0.13 -1.53 0.07 0.00 1.18 0.00 0.00 52.55 52.15 1ng9 s ASP 162 Cb 0.08 0.40 0.81 0.00 -0.34 0.00 0.00 42.92 43.86 1ng9 s ASP 162 CO 0.77 -0.89 1.75 -0.09 0.68 0.00 0.00 175.17 177.39 1ng9 h ARG 163 N 2.35 0.63 0.04 2.11 2.43 -1.98 -2.26 114.38 117.71 1ng9 h ARG 163 Ca -0.33 -0.04 -0.24 0.00 -0.81 0.00 0.00 59.98 58.56 1ng9 h ARG 163 Cb 1.25 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.63 1ng9 h ARG 163 CO 0.50 0.42 -1.15 0.93 -1.51 0.00 0.00 179.97 179.16 1ng9 h GLU 164 N 0.65 0.09 -0.19 0.20 3.07 -1.98 -1.22 114.58 115.20 1ng9 h GLU 164 Ca 0.61 -0.16 -0.17 0.00 -0.50 0.00 0.00 59.36 59.14 1ng9 h GLU 164 Cb 1.06 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.04 1ng9 h GLU 164 CO -0.44 1.04 -0.56 1.15 -1.40 0.00 0.00 179.01 178.80 1ng9 h THR 165 N 0.03 1.31 -0.76 1.13 2.02 -1.92 -1.38 112.91 113.33 1ng9 h THR 165 Ca -0.08 -1.78 0.00 0.00 0.77 0.00 0.00 66.41 65.32 1ng9 h THR 165 Cb 1.86 1.90 -0.04 0.00 -1.74 0.00 0.00 68.15 70.13 1ng9 h THR 165 CO 0.15 0.56 0.48 -0.03 0.37 0.00 0.00 175.52 177.05 1ng9 h MET 166 N 0.42 1.02 -0.26 6.66 -1.53 -1.41 0.19 114.93 120.03 1ng9 h MET 166 Ca -0.02 -0.08 -0.04 0.00 -3.44 0.00 0.00 59.70 56.13 1ng9 h MET 166 Cb 1.18 -0.22 -0.01 0.00 -0.55 0.00 0.00 31.60 31.99 1ng9 h MET 166 CO 0.12 0.69 0.02 0.00 0.14 0.00 0.00 176.91 177.89 1ng9 h ALA 167 N 1.49 0.35 0.00 0.39 0.00 -1.13 -2.16 119.26 118.19 1ng9 h ALA 167 Ca 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1ng9 h ALA 167 Cb -0.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1ng9 h ALA 167 CO -0.06 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1ng9 h ALA 168 N 0.84 1.00 0.19 0.00 0.00 -0.87 -2.15 119.26 118.27 1ng9 h ALA 168 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.69 1ng9 h ALA 168 Cb 0.37 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.18 1ng9 h ALA 168 CO 0.01 0.00 -1.41 0.93 0.00 0.00 0.00 179.25 178.78 1ng9 h GLU 169 N 0.00 0.40 -0.35 0.00 4.39 -0.71 -2.74 114.58 115.56 1ng9 h GLU 169 Ca 0.00 -0.68 0.03 0.00 0.34 0.00 0.00 59.36 59.05 1ng9 h GLU 169 Cb 0.43 0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 29.32 1ng9 h GLU 169 CO 0.00 1.32 0.24 -0.07 -1.16 0.00 0.00 179.01 179.34 1ng9 h LEU 170 N -0.06 0.32 -0.17 1.33 3.38 -1.26 -1.88 115.31 116.97 1ng9 h LEU 170 Ca -0.27 -0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.60 1ng9 h LEU 170 Cb 1.96 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.64 1ng9 h LEU 170 CO 0.18 0.22 -0.29 -0.61 0.09 0.00 0.00 178.44 178.04 1ng9 h GLN 171 N 0.38 0.50 -0.09 1.13 5.75 -1.43 -1.48 115.11 119.86 1ng9 h GLN 171 Ca 0.14 -0.30 -0.16 0.00 -0.15 0.00 0.00 58.65 58.18 1ng9 h GLN 171 Cb 0.11 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 1ng9 h GLN 171 CO -0.03 0.90 -0.63 -0.09 -2.65 0.00 0.00 178.83 176.34 1ng9 h ARG 172 N 0.14 0.33 0.02 1.69 2.43 -1.36 -3.31 114.38 114.31 1ng9 h ARG 172 Ca 0.01 -0.24 -0.35 0.00 -0.81 0.00 0.00 59.98 58.60 1ng9 h ARG 172 Cb 0.87 0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.40 1ng9 h ARG 172 CO 0.07 0.85 -2.12 0.25 -1.51 0.00 0.00 179.97 177.50 1ng9 n THR 173 N -3.88 1.54 -3.72 0.20 -2.24 -0.72 -5.01 114.28 100.45 1ng9 n THR 173 Ca -0.03 -0.76 -0.27 0.00 -2.27 0.00 0.00 64.05 60.72 1ng9 n THR 173 Cb 0.64 -0.99 0.03 0.00 -2.10 0.00 0.00 70.33 67.91 1ng9 n THR 173 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ng9 n ASN 174 N -3.03 -3.29 -4.75 3.42 5.15 -0.56 -4.81 115.26 107.40 1ng9 n ASN 174 Ca -0.30 -0.95 -0.37 0.00 -0.60 0.00 0.00 54.58 52.37 1ng9 n ASN 174 Cb 1.08 -3.59 0.04 0.00 -0.53 0.00 0.00 39.78 36.78 1ng9 n ASN 174 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1ng9 s PRO 175 N -6.00 2.98 0.07 1.20 0.04 -1.26 -4.70 135.00 127.33 1ng9 s PRO 175 Ca 0.26 2.03 0.12 0.00 0.04 0.00 0.00 61.00 63.45 1ng9 s PRO 175 Cb -0.08 -2.06 -0.16 0.00 0.04 0.00 0.00 34.50 32.23 1ng9 s PRO 175 CO 0.85 -1.26 0.99 0.00 0.04 0.00 0.00 177.00 177.62 1ng9 h ALA 176 N 1.09 0.61 -3.51 8.56 0.00 -1.14 -3.45 119.26 121.42 1ng9 h ALA 176 Ca -0.51 -1.03 -0.40 0.00 0.00 0.00 0.00 54.91 52.97 1ng9 h ALA 176 Cb 1.31 0.18 -0.33 0.00 0.00 0.00 0.00 17.79 18.94 1ng9 h ALA 176 CO 0.56 1.21 -0.77 -2.00 0.00 0.00 0.00 179.25 178.25 1ng9 s GLU 177 N -2.75 0.79 -0.26 0.00 2.12 -1.21 -3.65 118.70 113.74 1ng9 s GLU 177 Ca -0.01 -0.12 0.02 0.00 0.36 0.00 0.00 54.97 55.22 1ng9 s GLU 177 Cb 0.09 -0.79 0.06 0.00 0.26 0.00 0.00 34.13 33.75 1ng9 s GLU 177 CO 0.81 -0.05 -0.07 -1.17 -0.54 0.00 0.00 175.26 174.23 1ng9 s LEU 178 N 0.79 3.24 -0.08 2.70 2.96 0.17 -1.68 118.68 126.77 1ng9 s LEU 178 Ca -0.11 -1.40 -0.27 0.00 -0.22 0.00 0.00 54.13 52.14 1ng9 s LEU 178 Cb -0.13 -1.41 -0.02 0.00 0.50 0.00 0.00 46.19 45.12 1ng9 s LEU 178 CO 0.00 -0.23 0.88 -0.76 -1.32 0.00 0.00 176.35 174.92 1ng9 s LEU 179 N 1.20 4.28 0.01 -0.68 1.43 -0.39 -1.40 118.68 123.12 1ng9 s LEU 179 Ca -0.06 1.39 0.01 0.00 -1.03 0.00 0.00 54.13 54.45 1ng9 s LEU 179 Cb -0.19 -3.36 -0.01 0.00 0.03 0.00 0.00 46.19 42.66 1ng9 s LEU 179 CO -0.06 -0.31 -0.05 -0.72 0.23 0.00 0.00 176.35 175.44 1ng9 s TYR 180 N 1.49 0.45 0.38 0.29 -0.85 -0.95 -0.41 117.35 117.75 1ng9 s TYR 180 Ca 0.44 -0.18 -0.26 0.00 -0.52 0.00 0.00 57.07 56.55 1ng9 s TYR 180 Cb -0.18 -0.28 -0.09 0.00 0.38 0.00 0.00 41.96 41.78 1ng9 s TYR 180 CO 0.19 -0.03 1.18 0.00 -1.52 0.00 0.00 175.55 175.37 1ng9 s ALA 181 N -0.41 3.23 0.54 9.51 0.00 -1.18 -1.19 121.76 132.25 1ng9 s ALA 181 Ca -0.01 1.00 0.20 0.00 0.00 0.00 0.00 51.96 53.15 1ng9 s ALA 181 Cb -0.04 -3.39 1.42 0.00 0.00 0.00 0.00 23.12 21.11 1ng9 s ALA 181 CO -0.00 -0.50 2.17 1.05 0.00 0.00 0.00 175.76 178.47 1ng9 h GLU 182 N 2.87 0.00 -0.83 0.00 4.11 -1.60 -2.27 114.58 116.86 1ng9 h GLU 182 Ca -0.49 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.93 1ng9 h GLU 182 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1ng9 h GLU 182 CO 0.63 0.00 0.02 -0.40 0.07 0.00 0.00 179.01 179.34 1ng9 n ASP 183 N -4.35 3.13 -4.66 3.06 5.75 -1.26 -4.94 116.55 113.27 1ng9 n ASP 183 Ca -0.02 -2.44 -0.42 0.00 -0.01 0.00 0.00 54.79 51.89 1ng9 n ASP 183 Cb 0.11 -0.59 -0.03 0.00 -1.03 0.00 0.00 41.12 39.59 1ng9 n ASP 183 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1ng9 s PHE 184 N -1.76 1.92 -0.01 2.11 5.36 -0.86 -4.90 117.98 119.85 1ng9 s PHE 184 Ca 0.24 0.18 -0.20 0.00 -0.96 0.00 0.00 56.93 56.20 1ng9 s PHE 184 Cb 0.19 -3.95 -0.31 0.00 -0.34 0.00 0.00 43.02 38.62 1ng9 s PHE 184 CO 0.07 -3.90 0.98 0.00 -1.46 0.00 0.00 175.22 170.91 1ng9 h ALA 185 N 9.84 -0.07 -1.15 11.12 0.00 -1.91 -3.39 119.26 133.69 1ng9 h ALA 185 Ca -0.40 -0.71 -0.77 0.00 0.00 0.00 0.00 54.91 53.03 1ng9 h ALA 185 Cb 1.18 0.10 -0.18 0.00 0.00 0.00 0.00 17.79 18.89 1ng9 h ALA 185 CO 0.96 0.47 1.74 0.39 0.00 0.00 0.00 179.25 182.81 1ng9 n GLU 186 N -4.02 3.79 0.13 0.00 -0.58 -1.26 -4.76 120.64 113.93 1ng9 n GLU 186 Ca -0.14 -3.75 0.11 0.00 -0.42 0.00 0.00 57.16 52.96 1ng9 n GLU 186 Cb 0.87 -2.84 0.49 0.00 -0.57 0.00 0.00 31.44 29.39 1ng9 n GLU 186 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1ng9 n MET 187 N 3.41 0.17 0.26 3.49 2.81 -1.26 -2.62 117.12 123.38 1ng9 n MET 187 Ca 0.37 0.45 0.14 0.00 -1.81 0.00 0.00 57.70 56.84 1ng9 n MET 187 Cb 0.36 -1.86 0.69 0.00 -0.71 0.00 0.00 33.22 31.70 1ng9 n MET 187 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1ng9 h SER 188 N 0.00 0.00 1.00 7.83 4.64 -1.95 0.32 113.55 125.38 1ng9 h SER 188 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1ng9 h SER 188 Cb 0.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 1ng9 h SER 188 CO 0.00 0.12 -0.45 -0.07 -0.87 0.00 0.00 176.83 175.56 1ng9 h LEU 189 N 0.00 0.00 0.00 5.97 3.38 -1.92 -3.40 115.31 119.34 1ng9 h LEU 189 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 1ng9 h LEU 189 Cb 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1ng9 h LEU 189 CO 0.02 0.45 -1.50 -0.38 0.09 0.00 0.00 178.44 177.12 1ng9 n ILE 190 N -3.46 0.50 -1.72 1.22 -0.00 -0.80 -4.95 119.36 110.16 1ng9 n ILE 190 Ca 0.00 -0.29 -0.42 0.00 -0.00 0.00 0.00 62.75 62.04 1ng9 n ILE 190 Cb 0.59 -0.81 -0.01 0.00 -0.00 0.00 0.00 39.64 39.41 1ng9 n ILE 190 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1ng9 n GLU 191 N -2.35 2.25 -1.37 0.38 1.02 0.04 -2.60 120.64 118.01 1ng9 n GLU 191 Ca -0.12 0.79 -0.12 0.00 -0.02 0.00 0.00 57.16 57.69 1ng9 n GLU 191 Cb 0.72 -2.40 -0.05 0.00 -0.02 0.00 0.00 31.44 29.69 1ng9 n GLU 191 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ng9 n GLY 192 N 0.70 1.21 3.90 0.62 0.00 -1.26 -5.00 105.19 105.36 1ng9 n GLY 192 Ca 0.04 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 1ng9 n GLY 192 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ng9 s ARG 193 N -3.04 3.62 0.66 1.61 0.52 -1.07 -5.09 118.95 116.16 1ng9 s ARG 193 Ca 0.00 -0.08 -0.11 0.00 -0.52 0.00 0.00 55.73 55.02 1ng9 s ARG 193 Cb 0.00 -2.81 -0.01 0.00 0.52 0.00 0.00 34.95 32.65 1ng9 s ARG 193 CO 0.00 0.42 1.05 -0.98 0.02 0.00 0.00 175.30 175.81 1ng9 s ARG 194 N -2.86 3.25 -1.68 3.54 1.70 -1.26 -3.95 118.95 117.68 1ng9 s ARG 194 Ca 0.42 0.72 -0.18 0.00 -0.47 0.00 0.00 55.73 56.21 1ng9 s ARG 194 Cb -0.12 -2.04 0.15 0.00 -0.57 0.00 0.00 34.95 32.37 1ng9 s ARG 194 CO 0.25 -0.82 0.82 0.41 -1.08 0.00 0.00 175.30 174.89 1ng9 n GLY 195 N -2.64 -0.46 3.76 3.88 0.00 -1.24 -4.25 105.19 104.24 1ng9 n GLY 195 Ca 0.06 0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1ng9 n GLY 195 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ng9 s LEU 196 N -7.27 4.59 -0.31 0.99 2.96 -1.25 -0.66 118.68 117.73 1ng9 s LEU 196 Ca 0.74 2.09 -0.01 0.00 -0.22 0.00 0.00 54.13 56.73 1ng9 s LEU 196 Cb -0.40 -3.64 0.13 0.00 0.50 0.00 0.00 46.19 42.78 1ng9 s LEU 196 CO 0.91 0.01 0.24 -0.13 -1.32 0.00 0.00 176.35 176.06 1ng9 s ARG 197 N -1.35 0.37 0.16 1.98 1.81 -0.49 -4.90 118.95 116.52 1ng9 s ARG 197 Ca 0.43 -0.57 -0.31 0.00 -1.72 0.00 0.00 55.73 53.56 1ng9 s ARG 197 Cb -0.28 -0.93 -0.10 0.00 -0.45 0.00 0.00 34.95 33.18 1ng9 s ARG 197 CO 0.36 -1.08 1.66 0.50 -0.68 0.00 0.00 175.30 176.06 1ng9 s ARG 198 N 1.92 4.17 0.05 3.54 3.52 -1.26 -2.25 118.95 128.65 1ng9 s ARG 198 Ca 0.12 2.46 0.07 0.00 -0.13 0.00 0.00 55.73 58.25 1ng9 s ARG 198 Cb -0.16 -3.27 -0.03 0.00 -1.56 0.00 0.00 34.95 29.93 1ng9 s ARG 198 CO -0.24 -0.70 -0.19 1.03 -0.81 0.00 0.00 175.30 174.39 1ng9 s ARG 199 N 1.63 1.19 0.72 5.12 1.81 -0.33 -4.92 118.95 124.17 1ng9 s ARG 199 Ca 0.74 -0.94 -0.16 0.00 -1.72 0.00 0.00 55.73 53.65 1ng9 s ARG 199 Cb -0.45 -1.30 -0.00 0.00 -0.45 0.00 0.00 34.95 32.74 1ng9 s ARG 199 CO 0.32 0.32 0.89 -2.30 -0.68 0.00 0.00 175.30 173.85 1ng9 n PRO 200 N 1.69 0.46 -0.23 3.54 -0.02 -1.26 -1.73 135.00 137.45 1ng9 n PRO 200 Ca -0.18 0.21 -0.03 0.00 -2.02 0.00 0.00 63.50 61.48 1ng9 n PRO 200 Cb 0.54 -2.15 0.16 0.00 -0.02 0.00 0.00 33.50 32.03 1ng9 n PRO 200 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1ng9 h LEU 201 N -0.28 0.94 -2.55 2.45 5.85 -1.96 -3.11 115.31 116.64 1ng9 h LEU 201 Ca -0.47 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.14 1ng9 h LEU 201 Cb 1.34 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 1ng9 h LEU 201 CO 0.46 0.79 -0.01 4.11 -0.34 0.00 0.00 178.44 183.45 1ng9 h TRP 202 N 1.03 0.00 0.00 1.25 5.08 -2.01 -0.85 115.95 120.45 1ng9 h TRP 202 Ca 0.25 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.22 1ng9 h TRP 202 Cb 0.11 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.27 1ng9 h TRP 202 CO 0.01 0.01 0.00 0.39 -1.28 0.00 0.00 178.44 177.57 1ng9 n GLU 203 N -3.59 0.19 -0.29 0.12 1.02 -1.18 -2.38 120.64 114.53 1ng9 n GLU 203 Ca -0.03 0.16 0.09 0.00 -0.02 0.00 0.00 57.16 57.36 1ng9 n GLU 203 Cb 0.10 -1.50 0.20 0.00 -0.02 0.00 0.00 31.44 30.22 1ng9 n GLU 203 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1ng9 n PHE 204 N -1.27 0.51 -2.61 -0.32 3.72 -0.33 -2.71 117.46 114.46 1ng9 n PHE 204 Ca 0.06 -0.96 -0.41 0.00 -0.05 0.00 0.00 57.45 56.09 1ng9 n PHE 204 Cb 0.10 -0.25 -0.04 0.00 -0.94 0.00 0.00 39.48 38.35 1ng9 n PHE 204 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1ng9 s GLU 205 N -2.87 4.62 0.10 -1.08 -6.30 -1.00 -4.73 118.70 107.44 1ng9 s GLU 205 Ca 0.38 1.59 -0.17 0.00 -2.50 0.00 0.00 54.97 54.26 1ng9 s GLU 205 Cb 0.32 -3.34 -0.05 0.00 0.00 0.00 0.00 34.13 31.05 1ng9 s GLU 205 CO 0.06 0.09 1.55 0.97 0.02 0.00 0.00 175.26 177.95 1ng9 h ILE 206 N 4.03 1.25 -0.97 -3.70 6.09 -1.93 -2.77 117.51 119.50 1ng9 h ILE 206 Ca -0.43 -0.91 0.02 0.00 -1.37 0.00 0.00 64.86 62.17 1ng9 h ILE 206 Cb 1.21 1.23 -0.05 0.00 0.47 0.00 0.00 36.82 39.68 1ng9 h ILE 206 CO 0.73 0.30 0.64 0.44 -3.07 0.00 0.00 178.15 177.19 1ng9 h ASP 207 N 0.35 1.10 -0.41 2.19 3.32 -2.00 -1.75 116.42 119.22 1ng9 h ASP 207 Ca 0.09 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.01 1ng9 h ASP 207 Cb 0.41 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1ng9 h ASP 207 CO 0.01 0.78 -0.14 0.74 -1.72 0.00 0.00 179.24 178.91 1ng9 h THR 208 N 1.28 1.27 -0.22 0.35 2.02 -1.95 -2.39 112.91 113.27 1ng9 h THR 208 Ca 0.37 -1.26 -0.07 0.00 0.77 0.00 0.00 66.41 66.22 1ng9 h THR 208 Cb -0.09 1.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1ng9 h THR 208 CO -0.09 0.43 -0.15 0.00 0.37 0.00 0.00 175.52 176.08 1ng9 h ALA 209 N 1.05 0.31 -0.73 6.16 0.00 -1.16 -0.83 119.26 124.05 1ng9 h ALA 209 Ca 0.12 -0.32 0.07 0.00 0.00 0.00 0.00 54.91 54.78 1ng9 h ALA 209 Cb 0.66 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.32 1ng9 h ALA 209 CO 0.05 0.19 0.42 0.00 0.00 0.00 0.00 179.25 179.91 1ng9 h ARG 210 N 0.18 0.72 0.05 0.00 3.08 -1.36 0.34 114.38 117.40 1ng9 h ARG 210 Ca 0.04 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ng9 h ARG 210 Cb 0.66 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1ng9 h ARG 210 CO 0.04 0.48 -0.02 0.37 -1.07 0.00 0.00 179.97 179.76 1ng9 h GLN 211 N 0.75 -0.07 -0.61 0.04 -0.00 -1.26 -2.27 115.11 111.69 1ng9 h GLN 211 Ca 0.34 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.93 1ng9 h GLN 211 Cb 0.23 0.02 -0.03 0.00 0.00 0.00 0.00 27.48 27.70 1ng9 h GLN 211 CO -0.20 0.21 0.15 1.96 0.00 0.00 0.00 178.83 180.95 1ng9 h GLN 212 N -0.35 0.95 -0.04 1.69 1.08 -0.96 -1.82 115.11 115.67 1ng9 h GLN 212 Ca -0.01 -0.21 -0.22 0.00 -1.45 0.00 0.00 58.65 56.77 1ng9 h GLN 212 Cb 0.31 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 1ng9 h GLN 212 CO 0.01 0.84 -0.88 -0.07 -0.95 0.00 0.00 178.83 177.78 1ng9 h LEU 213 N 0.91 0.62 -0.83 1.46 3.38 -0.94 -1.27 115.31 118.64 1ng9 h LEU 213 Ca 0.20 -0.46 -0.10 0.00 0.09 0.00 0.00 57.88 57.60 1ng9 h LEU 213 Cb 0.32 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1ng9 h LEU 213 CO -0.00 1.25 -0.21 0.78 0.09 0.00 0.00 178.44 180.34 1ng9 h ASN 214 N 0.30 0.64 -0.03 -0.43 2.35 -1.38 -1.10 115.58 115.93 1ng9 h ASN 214 Ca -0.07 -0.22 -0.00 0.00 -0.55 0.00 0.00 56.30 55.46 1ng9 h ASN 214 Cb 1.51 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 39.70 1ng9 h ASN 214 CO 0.16 0.85 0.01 0.25 -1.65 0.00 0.00 177.43 177.05 1ng9 h LEU 215 N 0.56 0.05 -0.92 1.61 5.85 -1.17 -0.11 115.31 121.18 1ng9 h LEU 215 Ca 0.08 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.60 1ng9 h LEU 215 Cb 0.67 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.64 1ng9 h LEU 215 CO 0.05 0.25 0.60 -0.61 -0.34 0.00 0.00 178.44 178.39 1ng9 h GLN 216 N -0.16 1.17 -0.00 1.25 5.75 -1.10 -2.68 115.11 119.34 1ng9 h GLN 216 Ca 0.01 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1ng9 h GLN 216 Cb 0.22 -0.26 0.00 0.00 1.07 0.00 0.00 27.48 28.51 1ng9 h GLN 216 CO -0.00 0.78 -0.32 1.19 -2.65 0.00 0.00 178.83 177.82 1ng9 n PHE 217 N -4.47 0.00 -2.11 3.99 3.72 -0.43 -4.87 117.46 113.29 1ng9 n PHE 217 Ca 0.11 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.36 1ng9 n PHE 217 Cb 0.04 -0.27 -0.02 0.00 -0.94 0.00 0.00 39.48 38.29 1ng9 n PHE 217 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ng9 n GLY 218 N 1.45 0.11 3.73 1.37 0.00 -0.15 -5.00 105.19 106.69 1ng9 n GLY 218 Ca 0.08 -0.28 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 1ng9 n GLY 218 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ng9 s THR 219 N -2.70 3.94 -0.03 2.61 -4.23 -0.65 -5.03 115.64 109.54 1ng9 s THR 219 Ca 0.00 -1.59 -0.23 0.00 -1.18 0.00 0.00 61.69 58.69 1ng9 s THR 219 Cb 0.00 -3.09 -0.23 0.00 1.34 0.00 0.00 72.50 70.52 1ng9 s THR 219 CO 0.00 -0.31 1.07 0.03 -0.54 0.00 0.00 174.62 174.88 1ng9 h ARG 220 N 1.90 0.24 -4.82 3.99 3.08 -1.96 -3.41 114.38 113.40 1ng9 h ARG 220 Ca -0.46 -0.24 -0.36 0.00 0.07 0.00 0.00 59.98 58.99 1ng9 h ARG 220 Cb 1.23 0.06 -0.14 0.00 0.08 0.00 0.00 29.97 31.21 1ng9 h ARG 220 CO 0.60 0.94 -0.58 0.16 -1.07 0.00 0.00 179.97 180.02 1ng9 s ASP 221 N -6.39 1.13 -0.29 7.04 1.47 -1.26 -4.97 116.67 113.40 1ng9 s ASP 221 Ca -0.15 -1.48 0.11 0.00 1.18 0.00 0.00 52.55 52.21 1ng9 s ASP 221 Cb 0.02 0.33 0.77 0.00 -0.34 0.00 0.00 42.92 43.70 1ng9 s ASP 221 CO 0.76 -0.84 1.78 0.18 0.68 0.00 0.00 175.17 177.72 1ng9 n LEU 222 N -0.48 5.91 0.06 2.11 4.77 -1.26 -4.54 117.00 123.57 1ng9 n LEU 222 Ca 0.01 -3.13 -0.11 0.00 -0.03 0.00 0.00 56.01 52.75 1ng9 n LEU 222 Cb 0.65 -0.72 -0.04 0.00 -2.33 0.00 0.00 43.42 40.98 1ng9 n LEU 222 CO 0.35 0.75 0.70 0.58 -1.33 0.00 0.00 177.39 178.44 1ng9 h VAL 223 N 3.09 0.44 -0.19 4.08 2.07 -1.96 -2.62 116.25 121.15 1ng9 h VAL 223 Ca 0.17 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.74 1ng9 h VAL 223 Cb 2.19 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 1ng9 h VAL 223 CO 0.64 0.00 0.31 1.23 0.02 0.00 0.00 177.57 179.77 1ng9 h GLY 224 N -0.38 0.00 0.45 2.17 0.00 -2.03 -2.23 103.07 101.06 1ng9 h GLY 224 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1ng9 h GLY 224 CO -0.22 0.00 -0.48 0.69 0.00 0.00 0.00 176.54 176.53 1ng9 n PHE 225 N -3.43 0.00 -0.89 5.60 3.72 -0.99 -4.97 117.46 116.50 1ng9 n PHE 225 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1ng9 n PHE 225 Cb 0.42 -0.15 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 1ng9 n PHE 225 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ng9 n GLY 226 N 1.44 0.45 0.00 1.37 0.00 -0.84 -4.36 105.19 103.26 1ng9 n GLY 226 Ca 0.08 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1ng9 n GLY 226 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ng9 n VAL 227 N -2.89 0.12 -0.35 1.61 0.24 -1.22 -4.67 118.33 111.17 1ng9 n VAL 227 Ca 0.00 -0.41 0.01 0.00 -2.04 0.00 0.00 64.34 61.90 1ng9 n VAL 227 Cb 0.00 1.19 0.15 0.00 -1.47 0.00 0.00 33.84 33.71 1ng9 n VAL 227 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1ng9 h GLU 228 N 0.00 1.12 0.00 7.34 4.57 -1.84 -1.86 114.58 123.91 1ng9 h GLU 228 Ca 0.00 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1ng9 h GLU 228 Cb 0.24 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 1ng9 h GLU 228 CO 0.00 0.74 0.41 -0.91 -1.18 0.00 0.00 179.01 178.07 1ng9 h ASN 229 N 1.15 0.00 -2.19 1.04 2.35 -1.91 -3.40 115.58 112.62 1ng9 h ASN 229 Ca 0.40 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 55.56 1ng9 h ASN 229 Cb 0.10 0.00 -0.42 0.00 0.05 0.00 0.00 38.32 38.05 1ng9 h ASN 229 CO -0.15 0.00 -0.67 0.00 -1.65 0.00 0.00 177.43 174.95 1ng9 n ALA 230 N -1.73 3.99 -0.33 -0.83 0.00 -0.70 -4.93 120.51 115.97 1ng9 n ALA 230 Ca -0.01 -4.58 0.01 0.00 0.00 0.00 0.00 53.44 48.85 1ng9 n ALA 230 Cb 0.45 -0.85 0.14 0.00 0.00 0.00 0.00 19.45 19.18 1ng9 n ALA 230 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1ng9 h PRO 231 N 3.84 1.04 -0.34 0.00 0.11 -1.81 -1.10 132.00 133.73 1ng9 h PRO 231 Ca 0.17 -0.06 0.08 0.00 0.11 0.00 0.00 66.00 66.29 1ng9 h PRO 231 Cb 0.66 -0.23 -0.08 0.00 0.11 0.00 0.00 31.00 31.45 1ng9 h PRO 231 CO 0.79 0.69 -0.25 0.00 -0.21 0.00 0.00 178.00 179.01 1ng9 h ARG 232 N 1.07 -0.20 -0.12 1.05 3.08 -1.91 -0.16 114.38 117.18 1ng9 h ARG 232 Ca 0.38 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.43 1ng9 h ARG 232 Cb 0.11 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 1ng9 h ARG 232 CO -0.15 -0.13 0.02 0.78 -1.07 0.00 0.00 179.97 179.41 1ng9 h GLY 233 N -0.21 0.21 0.07 0.04 0.00 -1.70 -3.17 103.07 98.30 1ng9 h GLY 233 Ca 0.17 -0.15 0.20 0.00 0.00 0.00 0.00 47.33 47.55 1ng9 h GLY 233 CO -0.46 0.13 0.56 1.41 0.00 0.00 0.00 176.54 178.19 1ng9 h LEU 234 N -0.03 0.69 -0.59 3.11 3.38 -0.63 0.09 115.31 121.33 1ng9 h LEU 234 Ca 0.04 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1ng9 h LEU 234 Cb 0.30 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1ng9 h LEU 234 CO 0.00 0.21 0.33 0.00 0.09 0.00 0.00 178.44 179.08 1ng9 h ALA 236 N 1.15 0.30 -0.35 0.00 0.00 -1.28 -2.63 119.26 116.45 1ng9 h ALA 236 Ca 0.21 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1ng9 h ALA 236 Cb 0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1ng9 h ALA 236 CO -0.03 -0.11 0.24 0.00 0.00 0.00 0.00 179.25 179.35 1ng9 h ALA 237 N 0.93 2.11 0.24 0.00 0.00 -0.49 -0.90 119.26 121.14 1ng9 h ALA 237 Ca 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ng9 h ALA 237 Cb 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1ng9 h ALA 237 CO -0.01 -0.19 -0.11 0.78 0.00 0.00 0.00 179.25 179.72 1ng9 h GLY 238 N 0.17 -0.33 0.18 0.00 0.00 -0.18 -2.17 103.07 100.75 1ng9 h GLY 238 Ca 0.16 0.12 0.11 0.00 0.00 0.00 0.00 47.33 47.72 1ng9 h GLY 238 CO -0.02 -0.12 0.11 0.00 0.00 0.00 0.00 176.54 176.51 1ng9 h LEU 240 N 0.24 -0.35 -0.82 0.00 5.85 -1.18 -1.48 115.31 117.57 1ng9 h LEU 240 Ca 0.31 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 59.03 1ng9 h LEU 240 Cb 0.46 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 1ng9 h LEU 240 CO -0.40 -0.15 0.09 0.25 -0.34 0.00 0.00 178.44 177.89 1ng9 h LEU 241 N -0.12 0.93 -0.80 2.25 5.85 -1.02 -1.61 115.31 120.79 1ng9 h LEU 241 Ca 0.09 -0.21 -0.07 0.00 0.84 0.00 0.00 57.88 58.53 1ng9 h LEU 241 Cb 0.25 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1ng9 h LEU 241 CO -0.21 0.93 0.13 1.56 -0.34 0.00 0.00 178.44 180.51 1ng9 h GLN 242 N 0.92 1.03 -0.37 1.25 4.20 -0.94 -0.36 115.11 120.83 1ng9 h GLN 242 Ca 0.19 -0.25 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 1ng9 h GLN 242 Cb 0.41 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 1ng9 h GLN 242 CO 0.01 0.93 0.11 -0.92 -0.67 0.00 0.00 178.83 178.29 1ng9 h TYR 243 N 0.97 0.60 -0.12 2.96 3.20 -0.88 -1.49 116.97 122.22 1ng9 h TYR 243 Ca 0.20 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 1ng9 h TYR 243 Cb 0.38 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 1ng9 h TYR 243 CO 0.03 0.58 0.06 0.00 -1.64 0.00 0.00 178.16 177.19 1ng9 h ALA 244 N 0.96 0.15 -0.90 1.82 0.00 -0.90 -0.57 119.26 119.82 1ng9 h ALA 244 Ca 0.12 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1ng9 h ALA 244 Cb 0.26 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1ng9 h ALA 244 CO -0.00 -0.30 0.60 0.87 0.00 0.00 0.00 179.25 180.41 1ng9 h LYS 245 N 0.09 1.18 -0.59 0.00 1.57 -1.02 -1.69 116.57 116.11 1ng9 h LYS 245 Ca 0.04 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 1ng9 h LYS 245 Cb 0.08 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 1ng9 h LYS 245 CO -0.01 0.78 -0.02 0.22 -0.57 0.00 0.00 179.45 179.86 1ng9 h ASP 246 N 1.21 1.04 -0.07 0.86 3.58 -0.89 0.28 116.42 122.43 1ng9 h ASP 246 Ca 0.33 -0.30 -0.21 0.00 0.42 0.00 0.00 57.03 57.27 1ng9 h ASP 246 Cb -0.13 -0.28 0.01 0.00 1.72 0.00 0.00 39.33 40.64 1ng9 h ASP 246 CO -0.07 1.09 -0.75 0.71 -2.88 0.00 0.00 179.24 177.34 1ng9 h THR 247 N 0.96 1.30 0.14 2.25 1.35 -0.77 -3.36 112.91 114.77 1ng9 h THR 247 Ca 0.17 -1.99 -0.30 0.00 -0.55 0.00 0.00 66.41 63.74 1ng9 h THR 247 Cb 0.58 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1ng9 h THR 247 CO 0.03 0.62 -1.54 1.56 -0.25 0.00 0.00 175.52 175.95 1ng9 h GLN 248 N 0.50 0.29 -4.20 4.72 1.08 -1.32 0.28 115.11 116.46 1ng9 h GLN 248 Ca -0.04 -0.50 -0.39 0.00 -1.45 0.00 0.00 58.65 56.26 1ng9 h GLN 248 Cb 1.37 0.19 0.02 0.00 -0.05 0.00 0.00 27.48 29.00 1ng9 h GLN 248 CO 0.15 1.24 -0.56 0.54 -0.95 0.00 0.00 178.83 179.25 1ng9 n ARG 249 N -3.80 -3.73 -4.26 1.46 1.74 0.08 -4.58 116.66 103.58 1ng9 n ARG 249 Ca -0.25 0.85 -0.15 0.00 -0.77 0.00 0.00 57.85 57.54 1ng9 n ARG 249 Cb 0.96 -5.63 -0.10 0.00 -1.02 0.00 0.00 32.46 26.67 1ng9 n ARG 249 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1ng9 s THR 250 N -3.07 0.24 0.65 0.55 -4.23 -1.26 -5.02 115.64 103.50 1ng9 s THR 250 Ca 0.22 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.57 1ng9 s THR 250 Cb -0.10 -2.55 -0.01 0.00 1.34 0.00 0.00 72.50 71.18 1ng9 s THR 250 CO 0.27 0.00 1.15 0.42 -0.54 0.00 0.00 174.62 175.92 1ng9 s THR 251 N -3.93 2.93 -0.58 3.99 -4.23 -1.26 -4.96 115.64 107.59 1ng9 s THR 251 Ca 0.38 0.48 0.06 0.00 -1.18 0.00 0.00 61.69 61.44 1ng9 s THR 251 Cb 0.07 -3.05 0.26 0.00 1.34 0.00 0.00 72.50 71.12 1ng9 s THR 251 CO 0.14 -0.22 0.74 0.18 -0.54 0.00 0.00 174.62 174.91 1ng9 n LEU 252 N -2.19 3.16 0.24 4.79 4.77 -1.26 -4.78 117.00 121.74 1ng9 n LEU 252 Ca 0.12 -5.34 0.16 0.00 -0.03 0.00 0.00 56.01 50.92 1ng9 n LEU 252 Cb 0.51 -0.39 0.74 0.00 -2.33 0.00 0.00 43.42 41.96 1ng9 n LEU 252 CO 0.46 2.11 0.98 1.55 -1.33 0.00 0.00 177.39 181.16 1ng9 h PRO 253 N 3.95 0.00 0.00 3.23 0.13 -1.94 -2.37 132.00 135.00 1ng9 h PRO 253 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1ng9 h PRO 253 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 1ng9 h PRO 253 CO 0.76 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 176.14 1ng9 n HIS 254 N -2.76 0.00 -3.76 1.56 1.44 -1.26 -4.18 115.22 106.26 1ng9 n HIS 254 Ca -0.00 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.38 1ng9 n HIS 254 Cb 0.20 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.21 1ng9 n HIS 254 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1ng9 s ILE 255 N -2.00 3.63 -0.97 0.61 1.01 -0.89 -3.99 121.20 118.59 1ng9 s ILE 255 Ca 0.33 -3.74 0.10 0.00 0.00 0.00 0.00 60.65 57.35 1ng9 s ILE 255 Cb 0.15 -3.33 0.26 0.00 0.01 0.00 0.00 42.46 39.56 1ng9 s ILE 255 CO 0.26 -0.99 1.18 -2.11 0.00 0.00 0.00 174.94 173.27 1ng9 n ARG 256 N 2.56 2.47 -3.49 2.79 1.85 -1.26 -4.72 116.66 116.86 1ng9 n ARG 256 Ca 0.16 -1.88 -0.10 0.00 -1.00 0.00 0.00 57.85 55.04 1ng9 n ARG 256 Cb 0.36 -1.25 -0.02 0.00 -1.05 0.00 0.00 32.46 30.50 1ng9 n ARG 256 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1ng9 s SER 257 N -0.98 -0.43 -0.01 2.89 0.15 -1.26 -4.90 113.70 109.16 1ng9 s SER 257 Ca 0.21 -0.03 -0.05 0.00 0.70 0.00 0.00 55.95 56.78 1ng9 s SER 257 Cb 0.11 0.47 0.00 0.00 -1.71 0.00 0.00 66.02 64.90 1ng9 s SER 257 CO 0.15 -0.78 0.11 -0.51 1.20 0.00 0.00 173.24 173.41 1ng9 s ILE 258 N -3.38 0.06 -0.03 6.45 2.07 -1.26 -4.33 121.20 120.78 1ng9 s ILE 258 Ca 0.04 -0.47 0.03 0.00 -1.41 0.00 0.00 60.65 58.83 1ng9 s ILE 258 Cb -0.01 -0.32 0.00 0.00 0.13 0.00 0.00 42.46 42.27 1ng9 s ILE 258 CO -0.10 -0.26 -0.10 -0.89 -1.91 0.00 0.00 174.94 171.68 1ng9 s THR 259 N -0.87 0.87 0.21 4.00 2.01 -0.89 -4.78 115.64 116.19 1ng9 s THR 259 Ca -0.10 -0.39 -0.28 0.00 0.31 0.00 0.00 61.69 61.23 1ng9 s THR 259 Cb -0.06 -0.78 -0.09 0.00 0.01 0.00 0.00 72.50 71.59 1ng9 s THR 259 CO 0.01 0.27 0.87 -0.32 -0.69 0.00 0.00 174.62 174.76 1ng9 s MET 260 N 0.27 4.73 -0.37 4.92 1.75 -1.26 -1.35 119.30 128.00 1ng9 s MET 260 Ca -0.05 1.35 -0.06 0.00 -1.25 0.00 0.00 55.69 55.68 1ng9 s MET 260 Cb -0.10 -3.26 0.06 0.00 2.84 0.00 0.00 34.83 34.37 1ng9 s MET 260 CO 0.01 0.54 0.16 -1.21 -0.65 0.00 0.00 175.02 173.87 1ng9 s GLU 261 N -1.19 2.51 0.35 4.11 2.02 -0.04 -4.92 118.70 121.54 1ng9 s GLU 261 Ca 0.39 -1.38 -0.15 0.00 0.02 0.00 0.00 54.97 53.85 1ng9 s GLU 261 Cb -0.25 -3.57 -0.09 0.00 0.10 0.00 0.00 34.13 30.33 1ng9 s GLU 261 CO 0.29 -0.82 0.77 1.03 0.02 0.00 0.00 175.26 176.56 1ng9 s ARG 262 N 1.36 4.00 0.26 1.61 0.52 -1.26 -4.61 118.95 120.83 1ng9 s ARG 262 Ca 0.01 0.71 -0.02 0.00 -0.52 0.00 0.00 55.73 55.90 1ng9 s ARG 262 Cb -0.21 -2.38 0.49 0.00 0.52 0.00 0.00 34.95 33.37 1ng9 s ARG 262 CO 0.01 0.09 1.76 0.93 0.02 0.00 0.00 175.30 178.12 1ng9 h GLU 263 N 2.03 0.59 -0.01 3.54 5.08 -1.96 -2.72 114.58 121.13 1ng9 h GLU 263 Ca -0.48 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1ng9 h GLU 263 Cb 1.18 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1ng9 h GLU 263 CO 0.64 0.39 -0.20 1.04 -1.00 0.00 0.00 179.01 179.88 1ng9 n GLN 264 N -4.88 0.79 0.01 2.33 3.00 -1.26 -3.44 117.38 113.92 1ng9 n GLN 264 Ca 0.16 -0.40 0.13 0.00 -0.01 0.00 0.00 57.00 56.87 1ng9 n GLN 264 Cb 0.41 -1.49 0.38 0.00 0.00 0.00 0.00 30.24 29.54 1ng9 n GLN 264 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1ng9 n ASP 265 N -0.75 0.34 -3.99 1.08 8.00 -1.02 -4.77 116.55 115.44 1ng9 n ASP 265 Ca 0.13 0.07 -0.09 0.00 0.71 0.00 0.00 54.79 55.61 1ng9 n ASP 265 Cb 0.32 -0.06 -0.08 0.00 -0.02 0.00 0.00 41.12 41.29 1ng9 n ASP 265 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1ng9 s SER 266 N -3.11 0.18 -0.46 -2.24 1.04 -1.22 -2.03 113.70 105.86 1ng9 s SER 266 Ca 0.12 -0.89 -0.27 0.00 0.48 0.00 0.00 55.95 55.38 1ng9 s SER 266 Cb 0.18 0.34 0.03 0.00 0.10 0.00 0.00 66.02 66.67 1ng9 s SER 266 CO 0.64 -0.77 1.02 -0.63 0.98 0.00 0.00 173.24 174.47 1ng9 s ILE 267 N -3.95 4.37 -0.02 -1.02 1.01 -0.65 -4.88 121.20 116.07 1ng9 s ILE 267 Ca 0.14 0.99 -0.30 0.00 0.00 0.00 0.00 60.65 61.48 1ng9 s ILE 267 Cb 0.05 -4.50 -0.05 0.00 0.01 0.00 0.00 42.46 37.98 1ng9 s ILE 267 CO -0.04 -0.88 1.34 -0.63 0.00 0.00 0.00 174.94 174.73 1ng9 s ILE 268 N 4.02 3.87 -0.17 2.92 1.01 -1.01 -4.61 121.20 127.23 1ng9 s ILE 268 Ca 0.42 1.24 -0.02 0.00 0.00 0.00 0.00 60.65 62.29 1ng9 s ILE 268 Cb -0.09 -3.80 -0.01 0.00 0.01 0.00 0.00 42.46 38.57 1ng9 s ILE 268 CO 0.28 -0.00 -0.09 -0.04 0.00 0.00 0.00 174.94 175.09 1ng9 s MET 269 N 2.35 3.40 0.88 2.79 -1.94 -1.26 -1.49 119.30 124.03 1ng9 s MET 269 Ca 0.61 -0.64 -0.11 0.00 -1.71 0.00 0.00 55.69 53.84 1ng9 s MET 269 Cb -0.29 -2.82 0.12 0.00 2.01 0.00 0.00 34.83 33.85 1ng9 s MET 269 CO 0.25 0.03 1.15 0.16 -0.01 0.00 0.00 175.02 176.59 1ng9 s ASP 270 N 0.87 3.27 0.47 3.03 1.47 -1.13 -4.78 116.67 119.87 1ng9 s ASP 270 Ca -0.02 2.15 0.19 0.00 1.18 0.00 0.00 52.55 56.05 1ng9 s ASP 270 Cb -0.15 -2.56 1.18 0.00 -0.34 0.00 0.00 42.92 41.05 1ng9 s ASP 270 CO 0.01 -2.87 1.97 0.00 0.68 0.00 0.00 175.17 174.95 1ng9 h ALA 271 N -1.62 2.23 -0.32 2.11 0.00 -1.89 -2.01 119.26 117.76 1ng9 h ALA 271 Ca -0.44 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.29 1ng9 h ALA 271 Cb 1.27 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1ng9 h ALA 271 CO 0.44 -0.39 -0.48 0.00 0.00 0.00 0.00 179.25 178.82 1ng9 h ALA 272 N 1.70 0.54 0.09 0.00 0.00 -1.90 -3.03 119.26 116.67 1ng9 h ALA 272 Ca 0.29 -0.49 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1ng9 h ALA 272 Cb 0.81 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1ng9 h ALA 272 CO -0.06 0.68 -0.15 1.15 0.00 0.00 0.00 179.25 180.87 1ng9 h THR 273 N 0.69 0.64 -0.74 0.00 2.02 -1.62 0.11 112.91 114.01 1ng9 h THR 273 Ca 0.03 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.35 1ng9 h THR 273 Cb 1.07 0.64 -0.09 0.00 -1.74 0.00 0.00 68.15 68.03 1ng9 h THR 273 CO 0.11 0.00 0.30 0.03 0.37 0.00 0.00 175.52 176.33 1ng9 h ARG 274 N -0.31 0.44 -0.13 6.66 3.08 -1.54 0.16 114.38 122.75 1ng9 h ARG 274 Ca 0.02 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.92 1ng9 h ARG 274 Cb 0.32 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1ng9 h ARG 274 CO -0.08 0.29 -0.39 0.00 -1.07 0.00 0.00 179.97 178.71 1ng9 h ARG 275 N 0.45 0.49 0.00 0.04 2.47 -1.37 -2.57 114.38 113.90 1ng9 h ARG 275 Ca 0.40 -0.36 -0.07 0.00 -1.26 0.00 0.00 59.98 58.70 1ng9 h ARG 275 Cb 0.59 0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.96 1ng9 h ARG 275 CO -0.39 0.98 -0.31 -0.97 0.56 0.00 0.00 179.97 179.84 1ng9 h ASN 276 N 0.09 0.00 0.71 7.04 -1.24 -0.58 -2.68 115.58 118.92 1ng9 h ASN 276 Ca -0.01 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.00 1ng9 h ASN 276 Cb 1.02 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.07 1ng9 h ASN 276 CO 0.08 0.31 -0.58 0.18 -1.29 0.00 0.00 177.43 176.14 1ng9 n LEU 277 N -3.43 0.59 -3.59 0.34 4.77 0.52 -4.99 117.00 111.21 1ng9 n LEU 277 Ca 0.00 0.14 -0.23 0.00 -0.03 0.00 0.00 56.01 55.89 1ng9 n LEU 277 Cb 0.49 -0.22 0.05 0.00 -2.33 0.00 0.00 43.42 41.41 1ng9 n LEU 277 CO 0.35 0.02 -0.05 -0.62 -1.33 0.00 0.00 177.39 175.77 1ng9 n GLU 278 N -1.85 -3.09 0.12 3.23 1.02 -0.97 -4.63 120.64 114.47 1ng9 n GLU 278 Ca 0.04 0.62 -0.12 0.00 -0.02 0.00 0.00 57.16 57.69 1ng9 n GLU 278 Cb 0.40 -4.98 -0.07 0.00 -0.02 0.00 0.00 31.44 26.76 1ng9 n GLU 278 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1ng9 h ILE 279 N -1.70 0.65 -0.00 -3.67 2.04 -1.86 -1.35 117.51 111.62 1ng9 h ILE 279 Ca -0.63 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 64.40 1ng9 h ILE 279 Cb 1.35 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.46 1ng9 h ILE 279 CO 0.51 0.14 -0.01 0.35 0.00 0.00 0.00 178.15 179.14 1ng9 n THR 280 N -5.05 0.00 -3.72 -0.27 -2.24 -1.26 -1.47 114.28 100.27 1ng9 n THR 280 Ca -0.08 -0.50 -0.20 0.00 -2.27 0.00 0.00 64.05 61.00 1ng9 n THR 280 Cb 0.26 1.00 -0.18 0.00 -2.10 0.00 0.00 70.33 69.32 1ng9 n THR 280 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1ng9 s GLN 281 N -0.72 0.07 0.85 -0.78 0.74 -1.26 -4.62 119.66 113.95 1ng9 s GLN 281 Ca 0.00 0.28 -0.14 0.00 0.05 0.00 0.00 55.36 55.55 1ng9 s GLN 281 Cb 0.00 -0.55 0.20 0.00 1.10 0.00 0.00 33.01 33.76 1ng9 s GLN 281 CO 0.01 -0.29 0.95 0.27 -0.55 0.00 0.00 175.29 175.68 1ng9 n ASN 282 N 5.03 -0.82 0.20 6.67 0.23 -0.65 -4.36 115.26 121.57 1ng9 n ASN 282 Ca -0.09 -1.21 0.09 0.00 -0.53 0.00 0.00 54.58 52.84 1ng9 n ASN 282 Cb 0.50 -0.79 0.14 0.00 -2.08 0.00 0.00 39.78 37.55 1ng9 n ASN 282 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 1ng9 h LEU 283 N 0.00 0.00 -0.23 -4.53 3.38 -1.88 -2.80 115.31 109.25 1ng9 h LEU 283 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1ng9 h LEU 283 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1ng9 h LEU 283 CO 0.22 0.15 -0.02 0.00 0.09 0.00 0.00 178.44 178.89 1ng9 n ALA 284 N -2.14 2.66 0.00 1.53 0.00 -1.26 -4.94 120.51 116.36 1ng9 n ALA 284 Ca 0.03 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1ng9 n ALA 284 Cb 0.59 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1ng9 n ALA 284 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ng9 n GLY 285 N 1.10 2.63 3.03 0.00 0.00 -1.06 -5.07 105.19 105.82 1ng9 n GLY 285 Ca 0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 1ng9 n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ng9 n GLY 286 N -0.03 -2.13 0.62 -0.02 0.00 -1.26 -4.61 105.19 97.75 1ng9 n GLY 286 Ca 0.00 -1.59 0.09 0.00 0.00 0.00 0.00 46.02 44.53 1ng9 n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ng9 n ALA 287 N -4.16 2.79 -1.79 4.61 0.00 -1.26 -1.63 120.51 119.06 1ng9 n ALA 287 Ca -0.17 -0.62 -0.35 0.00 0.00 0.00 0.00 53.44 52.30 1ng9 n ALA 287 Cb 0.48 -0.64 -0.03 0.00 0.00 0.00 0.00 19.45 19.26 1ng9 n ALA 287 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1ng9 s GLU 288 N -1.77 3.91 -1.46 0.00 8.01 -1.26 -4.01 118.70 122.11 1ng9 s GLU 288 Ca 0.19 1.45 -0.09 0.00 0.01 0.00 0.00 54.97 56.53 1ng9 s GLU 288 Cb 0.15 -2.26 0.04 0.00 -4.31 0.00 0.00 34.13 27.75 1ng9 s GLU 288 CO 0.32 -0.35 0.88 0.09 0.01 0.00 0.00 175.26 176.21 1ng9 n ASN 289 N -0.64 -5.56 -4.98 -0.19 4.13 -1.26 -4.52 115.26 102.24 1ng9 n ASN 289 Ca 0.08 -0.52 -0.20 0.00 1.68 0.00 0.00 54.58 55.62 1ng9 n ASN 289 Cb 0.51 -4.45 0.07 0.00 -1.54 0.00 0.00 39.78 34.37 1ng9 n ASN 289 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1ng9 s THR 290 N -3.23 2.19 0.15 3.41 -4.23 -1.26 -4.87 115.64 107.81 1ng9 s THR 290 Ca 0.51 -0.94 -0.13 0.00 -1.18 0.00 0.00 61.69 59.95 1ng9 s THR 290 Cb -0.24 -2.25 0.03 0.00 1.34 0.00 0.00 72.50 71.38 1ng9 s THR 290 CO 0.63 0.00 1.64 0.25 -0.54 0.00 0.00 174.62 176.59 1ng9 h LEU 291 N 0.09 0.81 -1.10 4.79 5.85 -1.12 -3.12 115.31 121.52 1ng9 h LEU 291 Ca -0.31 -0.26 -0.09 0.00 0.84 0.00 0.00 57.88 58.05 1ng9 h LEU 291 Cb 1.28 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 1ng9 h LEU 291 CO 0.41 0.86 -0.40 0.00 -0.34 0.00 0.00 178.44 178.98 1ng9 h ALA 292 N 0.97 1.25 -0.62 1.25 0.00 -1.51 -1.35 119.26 119.25 1ng9 h ALA 292 Ca 0.15 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1ng9 h ALA 292 Cb 0.40 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1ng9 h ALA 292 CO 0.01 0.54 0.26 0.66 0.00 0.00 0.00 179.25 180.72 1ng9 h SER 293 N 0.09 0.82 0.17 0.00 4.64 -1.80 -0.63 113.55 116.84 1ng9 h SER 293 Ca 0.01 -0.10 -0.23 0.00 -0.47 0.00 0.00 61.79 60.99 1ng9 h SER 293 Cb 0.74 -0.21 0.02 0.00 -0.31 0.00 0.00 62.40 62.65 1ng9 h SER 293 CO 0.06 0.72 -1.04 0.58 -0.87 0.00 0.00 176.83 176.28 1ng9 h VAL 294 N 0.89 1.42 0.00 0.95 2.07 -1.51 -3.37 116.25 116.70 1ng9 h VAL 294 Ca 0.21 -2.57 0.00 0.00 0.82 0.00 0.00 66.70 65.16 1ng9 h VAL 294 Cb 0.15 3.13 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 1ng9 h VAL 294 CO -0.02 0.74 -0.40 -0.07 0.02 0.00 0.00 177.57 177.84 1ng9 h LEU 295 N -0.23 0.00 -7.76 2.57 3.38 -1.20 -3.44 115.31 108.64 1ng9 h LEU 295 Ca -0.18 -0.12 -0.77 0.00 0.09 0.00 0.00 57.88 56.89 1ng9 h LEU 295 Cb 1.80 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 42.27 1ng9 h LEU 295 CO 0.18 0.06 0.04 -0.62 0.09 0.00 0.00 178.44 178.19 1ng9 s ASP 296 N -4.47 6.52 -0.31 -0.43 2.15 -0.25 -4.76 116.67 115.13 1ng9 s ASP 296 Ca 0.07 -2.81 0.08 0.00 0.43 0.00 0.00 52.55 50.32 1ng9 s ASP 296 Cb 0.12 -2.14 0.46 0.00 -0.30 0.00 0.00 42.92 41.06 1ng9 s ASP 296 CO 0.68 -0.51 1.17 0.00 -0.17 0.00 0.00 175.17 176.35 1ng9 s THR 298 N -4.66 2.16 -1.48 0.00 -4.23 -1.26 -4.90 115.64 101.27 1ng9 s THR 298 Ca 0.49 0.08 0.17 0.00 -1.18 0.00 0.00 61.69 61.26 1ng9 s THR 298 Cb 0.40 -2.70 -0.03 0.00 1.34 0.00 0.00 72.50 71.51 1ng9 s THR 298 CO 0.01 -0.04 0.88 1.33 -0.54 0.00 0.00 174.62 176.26 1ng9 n VAL 299 N -2.69 0.00 -4.23 2.29 0.24 -1.26 -4.92 118.33 107.76 1ng9 n VAL 299 Ca 0.14 -0.28 -0.18 0.00 -2.04 0.00 0.00 64.34 61.97 1ng9 n VAL 299 Cb 0.50 1.17 -0.11 0.00 -1.47 0.00 0.00 33.84 33.93 1ng9 n VAL 299 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1ng9 s THR 300 N -2.11 1.31 0.21 3.34 -4.23 -1.26 -4.46 115.64 108.44 1ng9 s THR 300 Ca 0.13 -1.62 -0.09 0.00 -1.18 0.00 0.00 61.69 58.93 1ng9 s THR 300 Cb 0.14 -1.44 0.15 0.00 1.34 0.00 0.00 72.50 72.69 1ng9 s THR 300 CO 0.48 -0.35 1.81 -0.65 -0.54 0.00 0.00 174.62 175.37 1ng9 h PRO 301 N 3.72 0.69 -0.08 3.99 0.11 -1.87 -2.66 132.00 135.90 1ng9 h PRO 301 Ca -0.40 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 1ng9 h PRO 301 Cb 1.19 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1ng9 h PRO 301 CO 0.48 0.46 -0.29 0.00 -0.21 0.00 0.00 178.00 178.43 1ng9 h MET 302 N 0.71 0.15 -0.22 1.05 -0.00 -1.83 -2.33 114.93 112.46 1ng9 h MET 302 Ca 0.30 -0.05 -0.04 0.00 -0.00 0.00 0.00 59.70 59.91 1ng9 h MET 302 Cb 0.18 -0.01 -0.01 0.00 -0.00 0.00 0.00 31.60 31.77 1ng9 h MET 302 CO -0.18 0.43 -0.03 0.78 -0.00 0.00 0.00 176.91 177.92 1ng9 h GLY 303 N 0.99 0.44 0.67 -3.00 0.00 -1.71 -2.09 103.07 98.36 1ng9 h GLY 303 Ca 0.02 -0.34 0.03 0.00 0.00 0.00 0.00 47.33 47.03 1ng9 h GLY 303 CO 0.04 0.31 -0.09 0.23 0.00 0.00 0.00 176.54 177.03 1ng9 h SER 304 N 0.15 -0.29 -0.95 0.19 0.87 -1.14 -0.36 113.55 112.03 1ng9 h SER 304 Ca 0.06 0.05 0.09 0.00 -1.23 0.00 0.00 61.79 60.77 1ng9 h SER 304 Cb 0.45 0.14 -0.07 0.00 -0.44 0.00 0.00 62.40 62.48 1ng9 h SER 304 CO 0.02 -0.13 0.59 0.03 -0.53 0.00 0.00 176.83 176.81 1ng9 h ARG 305 N -0.13 0.97 -0.59 2.24 3.08 -1.43 -2.20 114.38 116.32 1ng9 h ARG 305 Ca 0.06 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 1ng9 h ARG 305 Cb 0.21 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1ng9 h ARG 305 CO -0.15 0.64 0.08 1.98 -1.07 0.00 0.00 179.97 181.46 1ng9 h MET 306 N 1.00 0.98 -0.58 0.04 4.05 -0.77 -2.35 114.93 117.30 1ng9 h MET 306 Ca 0.45 -0.27 -0.02 0.00 -0.28 0.00 0.00 59.70 59.58 1ng9 h MET 306 Cb 0.34 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.00 1ng9 h MET 306 CO -0.23 0.94 0.30 1.25 0.23 0.00 0.00 176.91 179.40 1ng9 h LEU 307 N 0.88 0.75 -1.08 3.39 5.85 -0.58 -2.25 115.31 122.27 1ng9 h LEU 307 Ca 0.18 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 1ng9 h LEU 307 Cb 0.44 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1ng9 h LEU 307 CO 0.01 0.65 -0.29 0.11 -0.34 0.00 0.00 178.44 178.58 1ng9 h LYS 308 N 0.79 0.29 -0.71 1.25 1.57 -1.33 -1.05 116.57 117.38 1ng9 h LYS 308 Ca 0.20 -0.11 -0.06 0.00 -1.87 0.00 0.00 60.65 58.81 1ng9 h LYS 308 Cb 0.08 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 1ng9 h LYS 308 CO -0.03 0.56 0.21 0.00 -0.57 0.00 0.00 179.45 179.62 1ng9 h ARG 309 N 0.26 1.12 -0.06 3.15 3.08 -1.08 -2.07 114.38 118.78 1ng9 h ARG 309 Ca 0.04 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.82 1ng9 h ARG 309 Cb 0.65 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 1ng9 h ARG 309 CO 0.05 0.97 -0.03 -1.49 -1.07 0.00 0.00 179.97 178.40 1ng9 h TRP 310 N 1.06 0.15 -0.93 3.04 4.06 -0.83 -1.73 115.95 120.77 1ng9 h TRP 310 Ca 0.23 -0.04 0.12 0.00 2.06 0.00 0.00 58.89 61.26 1ng9 h TRP 310 Cb 0.32 -0.03 -0.07 0.00 -1.00 0.00 0.00 29.16 28.38 1ng9 h TRP 310 CO 0.03 0.50 0.59 -0.07 -3.56 0.00 0.00 178.44 175.93 1ng9 h LEU 311 N -0.24 0.79 -0.03 -4.49 3.38 -1.18 -0.84 115.31 112.70 1ng9 h LEU 311 Ca 0.01 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ng9 h LEU 311 Cb 0.45 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1ng9 h LEU 311 CO 0.01 0.43 -0.04 1.41 0.09 0.00 0.00 178.44 180.34 1ng9 n HIS 312 N -4.57 0.00 -3.07 1.13 8.25 -0.78 -4.42 115.22 111.76 1ng9 n HIS 312 Ca 0.17 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.46 1ng9 n HIS 312 Cb 0.38 -0.36 -0.04 0.00 1.12 0.00 0.00 29.99 31.09 1ng9 n HIS 312 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 1ng9 n MET 313 N -1.34 0.51 -2.04 -0.41 0.00 -0.33 -4.97 117.12 108.53 1ng9 n MET 313 Ca 0.11 -2.64 -0.41 0.00 -0.00 0.00 0.00 57.70 54.77 1ng9 n MET 313 Cb 0.29 -1.47 -0.02 0.00 0.00 0.00 0.00 33.22 32.02 1ng9 n MET 313 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 175.97 173.83 1ng9 s PRO 314 N 0.08 4.27 0.16 2.12 0.02 -1.18 -4.73 135.00 135.74 1ng9 s PRO 314 Ca 0.33 2.29 0.01 0.00 0.02 0.00 0.00 61.00 63.65 1ng9 s PRO 314 Cb 0.10 -3.02 -0.04 0.00 0.02 0.00 0.00 34.50 31.56 1ng9 s PRO 314 CO -0.15 -0.29 0.31 0.14 -0.33 0.00 0.00 177.00 176.68 1ng9 s VAL 315 N -1.15 5.29 -1.21 3.83 -7.23 0.42 -1.64 120.40 118.71 1ng9 s VAL 315 Ca 0.50 -0.55 0.15 0.00 -1.81 0.00 0.00 61.98 60.27 1ng9 s VAL 315 Cb -0.41 -3.73 -0.04 0.00 0.56 0.00 0.00 36.38 32.76 1ng9 s VAL 315 CO 0.55 -0.10 0.77 0.54 -0.31 0.00 0.00 175.10 176.55 1ng9 n ARG 316 N -0.51 1.88 -2.13 4.82 1.74 -0.86 -4.73 116.66 116.87 1ng9 n ARG 316 Ca -0.06 -0.59 -0.43 0.00 -0.77 0.00 0.00 57.85 56.00 1ng9 n ARG 316 Cb 0.54 -1.22 -0.02 0.00 -1.02 0.00 0.00 32.46 30.73 1ng9 n ARG 316 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ng9 s ASP 317 N -1.93 6.21 0.30 0.55 -1.08 -1.26 -4.89 116.67 114.58 1ng9 s ASP 317 Ca 0.11 1.33 0.00 0.00 -0.52 0.00 0.00 52.55 53.47 1ng9 s ASP 317 Cb 0.12 -2.53 0.51 0.00 -1.46 0.00 0.00 42.92 39.56 1ng9 s ASP 317 CO 0.43 -1.44 1.94 0.74 0.52 0.00 0.00 175.17 177.35 1ng9 h THR 318 N 6.44 1.12 -0.43 1.71 2.02 -2.00 -2.47 112.91 119.29 1ng9 h THR 318 Ca -0.32 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.47 1ng9 h THR 318 Cb 1.15 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 1ng9 h THR 318 CO 1.03 0.19 0.16 -0.09 0.37 0.00 0.00 175.52 177.18 1ng9 h ARG 319 N 1.04 0.66 -0.33 6.66 2.43 -2.00 -2.05 114.38 120.79 1ng9 h ARG 319 Ca 0.35 -0.13 -0.09 0.00 -0.81 0.00 0.00 59.98 59.30 1ng9 h ARG 319 Cb 0.08 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 1ng9 h ARG 319 CO -0.11 0.62 -0.18 0.28 -1.51 0.00 0.00 179.97 179.07 1ng9 h VAL 320 N 0.56 1.26 -0.18 0.20 2.07 -1.86 -1.91 116.25 116.38 1ng9 h VAL 320 Ca 0.14 -1.19 -0.17 0.00 0.82 0.00 0.00 66.70 66.31 1ng9 h VAL 320 Cb 0.22 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1ng9 h VAL 320 CO -0.01 0.39 -0.59 -0.07 0.02 0.00 0.00 177.57 177.32 1ng9 h LEU 321 N 0.54 0.65 -0.29 2.57 3.38 -1.40 -2.13 115.31 118.63 1ng9 h LEU 321 Ca 0.09 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1ng9 h LEU 321 Cb 0.61 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1ng9 h LEU 321 CO 0.04 1.09 -0.01 -0.07 0.09 0.00 0.00 178.44 179.58 1ng9 h LEU 322 N 0.43 0.51 -0.72 1.67 3.38 -1.14 -2.24 115.31 117.19 1ng9 h LEU 322 Ca 0.00 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1ng9 h LEU 322 Cb 1.14 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1ng9 h LEU 322 CO 0.11 0.70 0.42 -0.33 0.09 0.00 0.00 178.44 179.42 1ng9 h GLU 323 N 0.30 1.00 -0.77 1.13 5.08 -1.32 -1.63 114.58 118.37 1ng9 h GLU 323 Ca 0.08 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1ng9 h GLU 323 Cb 0.44 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 1ng9 h GLU 323 CO 0.02 0.73 0.42 0.00 -1.00 0.00 0.00 179.01 179.17 1ng9 h ARG 324 N 0.99 1.08 -0.65 2.33 3.08 -1.34 -2.12 114.38 117.75 1ng9 h ARG 324 Ca 0.26 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 60.12 1ng9 h ARG 324 Cb 0.00 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.82 1ng9 h ARG 324 CO -0.04 0.81 0.18 1.96 -1.07 0.00 0.00 179.97 181.80 1ng9 h GLN 325 N 1.07 1.02 -0.49 0.04 4.20 -0.94 -2.06 115.11 117.96 1ng9 h GLN 325 Ca 0.27 -0.24 -0.08 0.00 0.06 0.00 0.00 58.65 58.66 1ng9 h GLN 325 Cb 0.04 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 1ng9 h GLN 325 CO -0.04 0.91 -0.02 1.96 -0.67 0.00 0.00 178.83 180.97 1ng9 h GLN 326 N 0.95 0.87 -0.48 1.46 4.20 -1.14 -1.52 115.11 119.45 1ng9 h GLN 326 Ca 0.21 -0.29 0.01 0.00 0.06 0.00 0.00 58.65 58.64 1ng9 h GLN 326 Cb 0.33 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.02 1ng9 h GLN 326 CO -0.00 0.92 0.31 1.15 -0.67 0.00 0.00 178.83 180.54 1ng9 h THR 327 N 0.73 1.10 -0.67 -0.54 2.02 -1.25 0.16 112.91 114.46 1ng9 h THR 327 Ca 0.13 -0.21 0.02 0.00 0.77 0.00 0.00 66.41 67.12 1ng9 h THR 327 Cb 0.54 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.33 1ng9 h THR 327 CO 0.03 0.11 0.43 0.40 0.37 0.00 0.00 175.52 176.86 1ng9 h ILE 328 N 0.63 1.12 -0.13 3.11 2.04 -1.11 -1.87 117.51 121.30 1ng9 h ILE 328 Ca 0.18 -0.29 -0.19 0.00 1.00 0.00 0.00 64.86 65.56 1ng9 h ILE 328 Cb -0.04 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.23 1ng9 h ILE 328 CO -0.05 0.15 -0.71 1.23 0.00 0.00 0.00 178.15 178.77 1ng9 h GLY 329 N 0.85 0.62 1.73 5.37 0.00 -0.80 -3.10 103.07 107.75 1ng9 h GLY 329 Ca 0.26 -0.85 -0.17 0.00 0.00 0.00 0.00 47.33 46.57 1ng9 h GLY 329 CO -0.09 0.76 -0.73 0.00 0.00 0.00 0.00 176.54 176.48 1ng9 h ALA 330 N 0.82 0.67 -0.21 3.60 0.00 -0.53 -3.25 119.26 120.36 1ng9 h ALA 330 Ca -0.03 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1ng9 h ALA 330 Cb 1.29 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ng9 h ALA 330 CO 0.13 0.80 0.00 1.28 0.00 0.00 0.00 179.25 181.47 1ng9 n LEU 331 N -3.79 2.62 -0.10 0.00 4.77 -0.72 -4.53 117.00 115.26 1ng9 n LEU 331 Ca -0.03 -1.05 -0.01 0.00 -0.03 0.00 0.00 56.01 54.89 1ng9 n LEU 331 Cb 0.71 -0.13 0.25 0.00 -2.33 0.00 0.00 43.42 41.92 1ng9 n LEU 331 CO 0.46 0.52 1.04 -0.61 -1.33 0.00 0.00 177.39 177.48 1ng9 h GLN 332 N 3.61 0.76 0.00 3.23 4.15 -1.57 -2.38 115.11 122.90 1ng9 h GLN 332 Ca 0.00 -0.12 -0.03 0.00 0.77 0.00 0.00 58.65 59.27 1ng9 h GLN 332 Cb 0.79 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.34 1ng9 h GLN 332 CO 0.00 0.64 -0.13 -0.44 -1.93 0.00 0.00 178.83 176.97 1ng9 h ASP 333 N 0.75 0.00 -0.66 -0.69 3.32 -1.85 -3.29 116.42 113.99 1ng9 h ASP 333 Ca 0.18 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.96 1ng9 h ASP 333 Cb 0.18 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.57 1ng9 h ASP 333 CO -0.01 0.13 0.26 0.49 -1.72 0.00 0.00 179.24 178.39 1ng9 n PHE 334 N -3.16 2.12 0.01 4.55 3.72 -0.90 -4.60 117.46 119.20 1ng9 n PHE 334 Ca 0.03 -1.46 -0.13 0.00 -0.05 0.00 0.00 57.45 55.84 1ng9 n PHE 334 Cb 0.52 -0.67 -0.09 0.00 -0.94 0.00 0.00 39.48 38.30 1ng9 n PHE 334 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1ng9 h THR 335 N 1.67 1.26 0.00 4.37 2.02 -1.63 -2.72 112.91 117.88 1ng9 h THR 335 Ca 0.33 -1.06 -0.03 0.00 0.77 0.00 0.00 66.41 66.42 1ng9 h THR 335 Cb 2.22 1.95 -0.00 0.00 -1.74 0.00 0.00 68.15 70.58 1ng9 h THR 335 CO 0.70 0.26 -0.15 0.00 0.37 0.00 0.00 175.52 176.71 1ng9 h ALA 336 N 0.37 1.08 0.12 6.16 0.00 -1.89 -2.47 119.26 122.64 1ng9 h ALA 336 Ca -0.01 -0.14 -0.34 0.00 0.00 0.00 0.00 54.91 54.43 1ng9 h ALA 336 Cb 0.48 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1ng9 h ALA 336 CO 0.01 0.19 -1.81 0.78 0.00 0.00 0.00 179.25 178.42 1ng9 h GLY 337 N 1.67 0.29 2.00 0.00 0.00 -1.90 -3.39 103.07 101.74 1ng9 h GLY 337 Ca -0.00 -0.73 -0.15 0.00 0.00 0.00 0.00 47.33 46.45 1ng9 h GLY 337 CO 0.02 0.64 -0.71 1.41 0.00 0.00 0.00 176.54 177.90 1ng9 h LEU 338 N 0.07 0.00 -0.03 3.11 3.38 -1.31 -3.38 115.31 117.16 1ng9 h LEU 338 Ca -0.35 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.54 1ng9 h LEU 338 Cb 2.04 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.80 1ng9 h LEU 338 CO 0.12 0.71 -0.30 1.56 0.09 0.00 0.00 178.44 180.62 1ng9 h GLN 339 N 0.00 0.25 0.00 1.13 4.20 -1.63 -1.76 115.11 117.30 1ng9 h GLN 339 Ca -0.01 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.46 1ng9 h GLN 339 Cb 1.28 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.12 1ng9 h GLN 339 CO 0.09 0.92 -0.03 -1.35 -0.67 0.00 0.00 178.83 177.79 1ng9 h PRO 340 N -0.34 0.00 0.23 1.46 0.11 -1.78 -1.27 132.00 130.41 1ng9 h PRO 340 Ca -0.03 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.73 1ng9 h PRO 340 Cb 1.01 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.14 1ng9 h PRO 340 CO 0.06 0.03 -1.60 0.28 -0.21 0.00 0.00 178.00 176.55 1ng9 h VAL 341 N 0.00 1.13 -0.41 3.15 2.07 -1.70 -3.29 116.25 117.20 1ng9 h VAL 341 Ca -0.00 -2.62 -0.05 0.00 0.82 0.00 0.00 66.70 64.85 1ng9 h VAL 341 Cb 0.15 2.93 -0.02 0.00 -1.52 0.00 0.00 31.29 32.83 1ng9 h VAL 341 CO 0.00 0.83 0.05 -0.07 0.02 0.00 0.00 177.57 178.41 1ng9 h LEU 342 N 0.13 0.58 -1.45 2.57 3.38 -1.10 -2.72 115.31 116.70 1ng9 h LEU 342 Ca -0.30 -0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.62 1ng9 h LEU 342 Cb 2.14 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 42.70 1ng9 h LEU 342 CO 0.24 0.62 0.43 -0.09 0.09 0.00 0.00 178.44 179.72 1ng9 h ARG 343 N 0.60 0.67 0.00 1.13 2.43 -1.32 -1.73 114.38 116.16 1ng9 h ARG 343 Ca 0.13 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1ng9 h ARG 343 Cb 0.31 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1ng9 h ARG 343 CO 0.01 0.44 0.00 1.96 -1.51 0.00 0.00 179.97 180.87 1ng9 h GLN 344 N 0.69 0.00 -0.09 0.20 1.08 -1.55 -2.88 115.11 112.56 1ng9 h GLN 344 Ca 0.27 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.39 1ng9 h GLN 344 Cb 0.20 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.62 1ng9 h GLN 344 CO -0.08 0.00 -0.32 0.28 -0.95 0.00 0.00 178.83 177.76 1ng9 h VAL 345 N 0.00 1.26 -0.32 -0.54 2.07 -1.33 -3.38 116.25 114.02 1ng9 h VAL 345 Ca 0.00 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.26 1ng9 h VAL 345 Cb 0.66 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1ng9 h VAL 345 CO 0.00 0.37 0.00 0.61 0.02 0.00 0.00 177.57 178.57 1ng9 n GLY 346 N -0.44 -0.12 2.79 2.17 0.00 -1.09 -3.80 105.19 104.69 1ng9 n GLY 346 Ca -0.01 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.58 1ng9 n GLY 346 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ng9 n ASP 347 N -1.26 6.23 0.14 1.61 -0.08 -1.26 -4.62 116.55 117.30 1ng9 n ASP 347 Ca 0.00 -3.24 0.08 0.00 -1.51 0.00 0.00 54.79 50.12 1ng9 n ASP 347 Cb 0.00 -1.38 0.57 0.00 2.34 0.00 0.00 41.12 42.65 1ng9 n ASP 347 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1ng9 h LEU 348 N 6.50 0.16 -0.48 -2.67 5.85 -1.95 -2.86 115.31 119.86 1ng9 h LEU 348 Ca 0.43 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 59.18 1ng9 h LEU 348 Cb 0.53 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 1ng9 h LEU 348 CO 1.49 0.11 0.25 -0.08 -0.34 0.00 0.00 178.44 179.87 1ng9 h GLU 349 N 0.19 0.47 0.04 1.25 4.81 -1.90 -2.25 114.58 117.19 1ng9 h GLU 349 Ca 0.08 -0.03 -0.22 0.00 -0.13 0.00 0.00 59.36 59.06 1ng9 h GLU 349 Cb 0.11 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1ng9 h GLU 349 CO -0.02 0.31 -1.01 0.00 -0.73 0.00 0.00 179.01 177.57 1ng9 h ARG 350 N 0.49 0.19 -0.21 1.92 3.08 -1.68 -2.92 114.38 115.25 1ng9 h ARG 350 Ca 0.21 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1ng9 h ARG 350 Cb 0.11 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1ng9 h ARG 350 CO -0.14 1.05 0.14 0.82 -1.07 0.00 0.00 179.97 180.77 1ng9 h ILE 351 N 0.08 1.05 0.00 2.04 2.04 -1.42 -2.56 117.51 118.75 1ng9 h ILE 351 Ca -0.07 -0.10 -0.10 0.00 1.00 0.00 0.00 64.86 65.59 1ng9 h ILE 351 Cb 1.70 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 1ng9 h ILE 351 CO 0.15 0.05 -0.48 -0.07 0.00 0.00 0.00 178.15 177.81 1ng9 h LEU 352 N 0.29 0.00 -0.15 1.44 3.38 -1.24 -1.40 115.31 117.63 1ng9 h LEU 352 Ca 0.08 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1ng9 h LEU 352 Cb -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1ng9 h LEU 352 CO -0.02 0.48 -0.09 0.00 0.09 0.00 0.00 178.44 178.90 1ng9 h ALA 353 N 1.52 0.21 -0.35 1.53 0.00 -1.29 -1.74 119.26 119.14 1ng9 h ALA 353 Ca -0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1ng9 h ALA 353 Cb 1.35 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1ng9 h ALA 353 CO 0.06 0.03 0.09 0.00 0.00 0.00 0.00 179.25 179.44 1ng9 h ARG 354 N -0.02 0.51 -0.66 0.00 3.08 -1.44 -1.07 114.38 114.78 1ng9 h ARG 354 Ca 0.03 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1ng9 h ARG 354 Cb 0.58 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 1ng9 h ARG 354 CO 0.03 0.47 0.34 1.25 -1.07 0.00 0.00 179.97 180.99 1ng9 h LEU 355 N 0.51 0.83 -0.91 3.04 5.85 -1.10 -0.37 115.31 123.16 1ng9 h LEU 355 Ca 0.12 -0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.63 1ng9 h LEU 355 Cb 0.19 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1ng9 h LEU 355 CO -0.00 0.70 -0.34 0.00 -0.34 0.00 0.00 178.44 178.46 1ng9 h ALA 356 N 1.16 1.07 -0.01 1.25 0.00 -0.58 -2.58 119.26 119.58 1ng9 h ALA 356 Ca 0.23 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ng9 h ALA 356 Cb 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ng9 h ALA 356 CO -0.03 0.58 -0.01 1.28 0.00 0.00 0.00 179.25 181.07 1ng9 n LEU 357 N -4.07 1.15 -1.86 0.00 4.77 -0.48 -4.59 117.00 111.93 1ng9 n LEU 357 Ca -0.01 -0.38 -0.21 0.00 -0.03 0.00 0.00 56.01 55.39 1ng9 n LEU 357 Cb 0.45 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.47 1ng9 n LEU 357 CO 0.42 0.19 -0.22 0.54 -1.33 0.00 0.00 177.39 176.99 1ng9 n ARG 358 N -0.12 -1.51 -0.27 3.23 1.74 -0.63 -4.88 116.66 114.22 1ng9 n ARG 358 Ca 0.20 1.14 0.09 0.00 -0.77 0.00 0.00 57.85 58.52 1ng9 n ARG 358 Cb 0.30 -5.62 0.24 0.00 -1.02 0.00 0.00 32.46 26.36 1ng9 n ARG 358 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ng9 n THR 359 N -2.98 0.89 -2.00 0.55 -2.24 -0.24 -4.99 114.28 103.26 1ng9 n THR 359 Ca -0.22 -0.95 -0.42 0.00 -2.27 0.00 0.00 64.05 60.19 1ng9 n THR 359 Cb 0.68 0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 69.48 1ng9 n THR 359 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ng9 s ALA 360 N -1.06 3.64 0.64 6.98 0.00 -1.00 -4.95 121.76 126.01 1ng9 s ALA 360 Ca 0.37 1.05 -0.08 0.00 0.00 0.00 0.00 51.96 53.30 1ng9 s ALA 360 Cb 0.20 -3.70 0.01 0.00 0.00 0.00 0.00 23.12 19.62 1ng9 s ALA 360 CO 0.26 -1.20 0.99 1.03 0.00 0.00 0.00 175.76 176.84 1ng9 s ARG 361 N 3.20 2.93 0.46 0.00 0.52 -1.26 -4.91 118.95 119.88 1ng9 s ARG 361 Ca 0.72 0.22 0.17 0.00 -0.52 0.00 0.00 55.73 56.32 1ng9 s ARG 361 Cb -0.36 -2.16 1.13 0.00 0.52 0.00 0.00 34.95 34.08 1ng9 s ARG 361 CO 0.30 -0.83 1.97 -1.35 0.02 0.00 0.00 175.30 175.41 1ng9 h PRO 362 N -0.37 0.30 0.00 3.54 0.11 -1.80 -0.75 132.00 133.03 1ng9 h PRO 362 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ng9 h PRO 362 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ng9 h PRO 362 CO 0.62 0.20 0.00 0.00 -0.21 0.00 0.00 178.00 178.61 1ng9 h ARG 363 N 0.31 0.00 -0.13 1.05 3.08 -1.81 -2.43 114.38 114.44 1ng9 h ARG 363 Ca 0.29 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.31 1ng9 h ARG 363 Cb 0.74 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.78 1ng9 h ARG 363 CO -0.07 0.00 -0.05 -0.44 -1.07 0.00 0.00 179.97 178.34 1ng9 h ASP 364 N 0.00 0.27 0.65 7.04 3.32 -1.51 -2.66 116.42 123.54 1ng9 h ASP 364 Ca 0.00 -0.39 -0.10 0.00 0.02 0.00 0.00 57.03 56.56 1ng9 h ASP 364 Cb 0.79 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 1ng9 h ASP 364 CO 0.00 0.61 -0.46 -0.07 -1.72 0.00 0.00 179.24 177.59 1ng9 h LEU 365 N -0.06 0.00 -0.58 1.55 3.38 -1.43 -1.53 115.31 116.65 1ng9 h LEU 365 Ca 0.03 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1ng9 h LEU 365 Cb 0.50 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1ng9 h LEU 365 CO 0.02 0.46 0.01 0.00 0.09 0.00 0.00 178.44 179.02 1ng9 h ALA 366 N 1.54 0.78 0.00 1.53 0.00 -1.48 -1.79 119.26 119.83 1ng9 h ALA 366 Ca -0.00 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 1ng9 h ALA 366 Cb 0.92 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1ng9 h ALA 366 CO 0.06 0.61 -0.46 0.00 0.00 0.00 0.00 179.25 179.45 1ng9 h ARG 367 N 0.91 0.00 -0.38 0.00 3.08 -1.25 -1.34 114.38 115.40 1ng9 h ARG 367 Ca 0.16 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.10 1ng9 h ARG 367 Cb 0.54 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 1ng9 h ARG 367 CO 0.03 0.46 -0.24 1.98 -1.07 0.00 0.00 179.97 181.13 1ng9 h MET 368 N 0.00 0.76 -0.15 0.04 4.05 -1.22 -1.70 114.93 116.71 1ng9 h MET 368 Ca -0.00 -0.32 -0.18 0.00 -0.28 0.00 0.00 59.70 58.92 1ng9 h MET 368 Cb 1.29 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 32.05 1ng9 h MET 368 CO 0.06 0.93 -0.64 -0.09 0.23 0.00 0.00 176.91 177.39 1ng9 h ARG 369 N 0.66 0.57 -0.30 0.39 2.43 -1.17 -2.42 114.38 114.54 1ng9 h ARG 369 Ca 0.09 -0.41 -0.06 0.00 -0.81 0.00 0.00 59.98 58.80 1ng9 h ARG 369 Cb 0.75 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 1ng9 h ARG 369 CO 0.06 1.03 -0.05 1.25 -1.51 0.00 0.00 179.97 180.75 1ng9 h HIS 370 N 0.41 0.50 -0.27 2.20 2.76 -1.19 -2.63 115.15 116.93 1ng9 h HIS 370 Ca -0.01 -0.06 -0.14 0.00 -2.20 0.00 0.00 60.37 57.96 1ng9 h HIS 370 Cb 1.22 -0.14 -0.00 0.00 1.55 0.00 0.00 27.41 30.03 1ng9 h HIS 370 CO 0.05 0.53 -0.37 0.00 -1.30 0.00 0.00 177.93 176.85 1ng9 h ALA 371 N 1.50 0.41 -0.37 5.26 0.00 -1.14 -2.90 119.26 122.01 1ng9 h ALA 371 Ca 0.09 -0.44 0.03 0.00 0.00 0.00 0.00 54.91 54.59 1ng9 h ALA 371 Cb 0.38 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ng9 h ALA 371 CO 0.02 0.49 0.25 0.74 0.00 0.00 0.00 179.25 180.74 1ng9 h PHE 372 N 0.46 0.38 0.00 0.00 0.04 -1.31 -2.03 116.94 114.48 1ng9 h PHE 372 Ca 0.03 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1ng9 h PHE 372 Cb 0.96 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.98 1ng9 h PHE 372 CO 0.08 0.23 0.00 1.04 -0.60 0.00 0.00 178.31 179.05 1ng9 n GLN 373 N -4.48 0.06 0.03 1.51 6.02 -1.00 -2.56 117.38 116.95 1ng9 n GLN 373 Ca 0.03 0.22 0.11 0.00 -0.01 0.00 0.00 57.00 57.36 1ng9 n GLN 373 Cb 0.15 -1.60 -0.01 0.00 1.02 0.00 0.00 30.24 29.80 1ng9 n GLN 373 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1ng9 n GLN 374 N -1.71 0.35 -0.16 -1.09 1.13 -0.77 -4.59 117.38 110.55 1ng9 n GLN 374 Ca 0.04 -0.01 -0.09 0.00 -1.94 0.00 0.00 57.00 55.00 1ng9 n GLN 374 Cb 0.24 -1.60 0.00 0.00 0.11 0.00 0.00 30.24 28.99 1ng9 n GLN 374 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1ng9 h LEU 375 N 0.00 0.68 -1.01 1.08 3.38 -1.51 -2.39 115.31 115.54 1ng9 h LEU 375 Ca 0.00 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.69 1ng9 h LEU 375 Cb 0.78 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1ng9 h LEU 375 CO 0.00 0.72 0.00 -0.65 0.09 0.00 0.00 178.44 178.61 1ng9 h PRO 376 N 0.61 0.71 -0.46 1.13 0.11 -1.81 -0.39 132.00 131.91 1ng9 h PRO 376 Ca 0.15 -0.18 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 1ng9 h PRO 376 Cb 0.29 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.29 1ng9 h PRO 376 CO -0.00 0.73 0.05 1.49 -0.21 0.00 0.00 178.00 180.06 1ng9 h GLU 377 N 0.67 0.71 0.01 1.05 4.57 -1.80 -1.89 114.58 117.91 1ng9 h GLU 377 Ca 0.14 -0.16 -0.20 0.00 -1.18 0.00 0.00 59.36 57.96 1ng9 h GLU 377 Cb 0.41 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.88 1ng9 h GLU 377 CO 0.02 0.69 -0.92 -0.07 -1.18 0.00 0.00 179.01 177.55 1ng9 h LEU 378 N 0.68 0.10 -0.45 1.64 3.38 -1.06 -2.58 115.31 117.03 1ng9 h LEU 378 Ca 0.15 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 1ng9 h LEU 378 Cb 0.34 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1ng9 h LEU 378 CO 0.01 0.96 -0.28 0.03 0.09 0.00 0.00 178.44 179.25 1ng9 h ARG 379 N 0.03 0.98 -0.57 1.13 3.08 -0.94 -1.75 114.38 116.35 1ng9 h ARG 379 Ca -0.03 -0.46 -0.06 0.00 0.07 0.00 0.00 59.98 59.50 1ng9 h ARG 379 Cb 1.59 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.60 1ng9 h ARG 379 CO 0.13 1.13 0.12 0.00 -1.07 0.00 0.00 179.97 180.28 1ng9 h ALA 380 N 0.83 0.75 -0.06 0.04 0.00 -1.36 -1.96 119.26 117.50 1ng9 h ALA 380 Ca 0.09 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 1ng9 h ALA 380 Cb 0.87 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1ng9 h ALA 380 CO 0.08 0.47 -0.63 1.96 0.00 0.00 0.00 179.25 181.13 1ng9 h GLN 381 N 0.82 0.23 0.00 0.00 4.20 -1.38 -3.13 115.11 115.85 1ng9 h GLN 381 Ca 0.18 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1ng9 h GLN 381 Cb 0.37 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1ng9 h GLN 381 CO 0.01 0.79 -0.44 1.28 -0.67 0.00 0.00 178.83 179.79 1ng9 n LEU 382 N -3.85 0.45 -0.17 1.46 4.77 -0.67 -4.04 117.00 114.96 1ng9 n LEU 382 Ca -0.02 0.11 -0.08 0.00 -0.03 0.00 0.00 56.01 55.98 1ng9 n LEU 382 Cb 0.63 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 41.45 1ng9 n LEU 382 CO 0.45 0.08 0.94 -0.08 -1.33 0.00 0.00 177.39 177.45 1ng9 h GLU 383 N 0.00 0.72 0.00 3.23 4.81 -1.29 -3.08 114.58 118.97 1ng9 h GLU 383 Ca 0.00 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.04 1ng9 h GLU 383 Cb 0.53 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1ng9 h GLU 383 CO 0.00 0.66 -0.27 1.79 -0.73 0.00 0.00 179.01 180.46 1ng9 h THR 384 N 0.63 1.11 -2.74 0.32 1.35 -1.72 -3.42 112.91 108.43 1ng9 h THR 384 Ca 0.16 -0.95 -0.54 0.00 -0.55 0.00 0.00 66.41 64.53 1ng9 h THR 384 Cb 0.21 1.52 -0.05 0.00 -1.73 0.00 0.00 68.15 68.10 1ng9 h THR 384 CO -0.01 0.26 1.14 -0.69 -0.25 0.00 0.00 175.52 175.97 1ng9 s VAL 385 N -4.33 3.72 -1.02 6.82 1.01 -1.17 -4.93 120.40 120.50 1ng9 s VAL 385 Ca -0.03 0.62 -0.23 0.00 0.00 0.00 0.00 61.98 62.34 1ng9 s VAL 385 Cb 0.15 -4.31 0.04 0.00 0.00 0.00 0.00 36.38 32.26 1ng9 s VAL 385 CO 0.69 -1.06 1.50 -0.62 0.00 0.00 0.00 175.10 175.62 1ng9 s ASP 386 N 4.92 6.40 -0.22 3.32 2.15 -1.26 -4.73 116.67 127.24 1ng9 s ASP 386 Ca 0.57 -1.43 -0.09 0.00 0.43 0.00 0.00 52.55 52.03 1ng9 s ASP 386 Cb -0.12 -2.57 0.09 0.00 -0.30 0.00 0.00 42.92 40.02 1ng9 s ASP 386 CO 0.26 -1.60 0.50 -0.55 -0.17 0.00 0.00 175.17 173.60 1ng9 s SER 387 N 5.20 -0.56 0.15 -0.34 0.15 -1.26 -5.04 113.70 111.99 1ng9 s SER 387 Ca 0.48 1.16 -0.15 0.00 0.70 0.00 0.00 55.95 58.14 1ng9 s SER 387 Cb -0.00 1.49 0.02 0.00 -1.71 0.00 0.00 66.02 65.82 1ng9 s SER 387 CO -0.08 -0.22 1.74 0.00 1.20 0.00 0.00 173.24 175.87 1ng9 h ALA 388 N 7.88 0.57 -0.50 5.45 0.00 -1.99 -1.40 119.26 129.26 1ng9 h ALA 388 Ca -0.21 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ng9 h ALA 388 Cb 1.13 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1ng9 h ALA 388 CO 0.14 0.12 0.30 -1.35 0.00 0.00 0.00 179.25 178.46 1ng9 h PRO 389 N 0.57 0.67 -0.53 0.00 0.11 -1.98 -1.34 132.00 129.51 1ng9 h PRO 389 Ca 0.15 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.13 1ng9 h PRO 389 Cb 0.09 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.04 1ng9 h PRO 389 CO -0.02 0.47 0.01 0.28 -0.21 0.00 0.00 178.00 178.53 1ng9 h VAL 390 N 0.69 1.25 0.00 3.15 2.07 -1.72 -2.48 116.25 119.21 1ng9 h VAL 390 Ca 0.18 -1.04 -0.07 0.00 0.82 0.00 0.00 66.70 66.58 1ng9 h VAL 390 Cb -0.03 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1ng9 h VAL 390 CO -0.03 0.37 -0.34 1.56 0.02 0.00 0.00 177.57 179.15 1ng9 h GLN 391 N 0.82 0.00 -0.11 1.57 1.08 -0.93 -2.14 115.11 115.40 1ng9 h GLN 391 Ca 0.16 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.18 1ng9 h GLN 391 Cb 0.48 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.90 1ng9 h GLN 391 CO 0.02 0.34 -0.67 0.00 -0.95 0.00 0.00 178.83 177.57 1ng9 h ALA 392 N 1.66 0.62 -0.01 3.87 0.00 -1.13 -2.32 119.26 121.95 1ng9 h ALA 392 Ca -0.00 -0.57 -0.19 0.00 0.00 0.00 0.00 54.91 54.15 1ng9 h ALA 392 Cb 1.14 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1ng9 h ALA 392 CO 0.04 0.73 -0.83 -0.07 0.00 0.00 0.00 179.25 179.13 1ng9 h LEU 393 N 0.33 0.24 -1.06 0.00 3.38 -1.38 -2.11 115.31 114.71 1ng9 h LEU 393 Ca -0.02 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.72 1ng9 h LEU 393 Cb 1.23 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 1ng9 h LEU 393 CO 0.12 0.96 0.14 -0.09 0.09 0.00 0.00 178.44 179.66 1ng9 h ARG 394 N 0.11 0.81 -0.08 1.13 2.43 -1.34 -2.33 114.38 115.11 1ng9 h ARG 394 Ca -0.04 -0.16 -0.19 0.00 -0.81 0.00 0.00 59.98 58.78 1ng9 h ARG 394 Cb 1.44 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.86 1ng9 h ARG 394 CO 0.13 0.72 -0.75 1.49 -1.51 0.00 0.00 179.97 180.04 1ng9 h GLU 395 N 0.79 0.46 0.00 0.20 4.57 -1.35 -3.31 114.58 115.95 1ng9 h GLU 395 Ca 0.18 -0.39 -0.11 0.00 -1.18 0.00 0.00 59.36 57.85 1ng9 h GLU 395 Cb 0.27 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.93 1ng9 h GLU 395 CO -0.00 1.02 -0.54 -0.22 -1.18 0.00 0.00 179.01 178.09 1ng9 h LYS 396 N 0.31 0.00 0.00 1.92 3.64 -1.09 -2.92 116.57 118.43 1ng9 h LYS 396 Ca -0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1ng9 h LYS 396 Cb 1.34 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 1ng9 h LYS 396 CO 0.13 0.54 0.00 0.00 -2.27 0.00 0.00 179.45 177.85 1ng9 n MET 397 N -3.71 0.13 0.00 1.90 0.00 -0.90 -3.41 117.12 111.13 1ng9 n MET 397 Ca -0.01 0.16 0.00 0.00 0.00 0.00 0.00 57.70 57.85 1ng9 n MET 397 Cb 0.58 -1.67 0.00 0.00 0.00 0.00 0.00 33.22 32.13 1ng9 n MET 397 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ng9 n GLY 398 N 1.14 0.47 0.70 3.17 0.00 -1.11 -4.73 105.19 104.84 1ng9 n GLY 398 Ca 0.06 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1ng9 n GLY 398 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ng9 n GLU 399 N -0.12 0.00 -3.29 1.61 2.13 -1.26 -4.94 120.64 114.76 1ng9 n GLU 399 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 1ng9 n GLU 399 Cb 0.00 -0.31 0.03 0.00 0.27 0.00 0.00 31.44 31.43 1ng9 n GLU 399 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1ng9 n PHE 400 N -1.85 -2.54 -0.07 4.31 3.72 -1.26 -4.91 117.46 114.86 1ng9 n PHE 400 Ca 0.00 0.89 -0.13 0.00 -0.05 0.00 0.00 57.45 58.17 1ng9 n PHE 400 Cb 0.00 -3.90 -0.06 0.00 -0.94 0.00 0.00 39.48 34.59 1ng9 n PHE 400 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ng9 h ALA 401 N 0.39 0.30 0.00 4.37 0.00 -1.98 -2.87 119.26 119.47 1ng9 h ALA 401 Ca -0.39 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.12 1ng9 h ALA 401 Cb 1.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1ng9 h ALA 401 CO 0.39 0.21 -0.32 0.93 0.00 0.00 0.00 179.25 180.45 1ng9 h GLU 402 N 0.17 0.00 0.06 0.00 5.08 -2.00 -2.65 114.58 115.25 1ng9 h GLU 402 Ca 0.04 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.10 1ng9 h GLU 402 Cb 0.70 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.92 1ng9 h GLU 402 CO 0.04 0.32 -1.59 -0.07 -1.00 0.00 0.00 179.01 176.72 1ng9 h LEU 403 N 0.00 0.21 -1.44 1.33 3.38 -1.95 -2.77 115.31 114.08 1ng9 h LEU 403 Ca -0.00 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1ng9 h LEU 403 Cb 0.66 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 1ng9 h LEU 403 CO 0.04 1.30 0.34 -0.09 0.09 0.00 0.00 178.44 180.12 1ng9 h ARG 404 N 0.04 0.72 -0.06 1.13 2.43 -1.41 -1.75 114.38 115.49 1ng9 h ARG 404 Ca -0.25 -0.05 -0.23 0.00 -0.81 0.00 0.00 59.98 58.63 1ng9 h ARG 404 Cb 1.99 -0.16 0.01 0.00 -0.42 0.00 0.00 29.97 31.39 1ng9 h ARG 404 CO 0.12 0.49 -0.90 0.22 -1.51 0.00 0.00 179.97 178.39 1ng9 h ASP 405 N 0.74 0.77 -0.57 -3.80 3.58 -1.56 -2.68 116.42 112.90 1ng9 h ASP 405 Ca 0.20 -0.57 -0.02 0.00 0.42 0.00 0.00 57.03 57.06 1ng9 h ASP 405 Cb -0.06 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 40.73 1ng9 h ASP 405 CO -0.04 1.36 0.26 0.25 -2.88 0.00 0.00 179.24 178.19 1ng9 h LEU 406 N 0.38 0.75 -0.51 2.28 5.85 -1.13 -2.39 115.31 120.54 1ng9 h LEU 406 Ca -0.08 -0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.39 1ng9 h LEU 406 Cb 1.53 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.35 1ng9 h LEU 406 CO 0.17 0.68 -0.52 -0.07 -0.34 0.00 0.00 178.44 178.37 1ng9 h LEU 407 N 0.77 0.00 -0.60 2.25 3.38 -1.39 -2.51 115.31 117.21 1ng9 h LEU 407 Ca 0.19 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.01 1ng9 h LEU 407 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1ng9 h LEU 407 CO -0.02 0.52 -0.65 -0.33 0.09 0.00 0.00 178.44 178.05 1ng9 h GLU 408 N 0.00 0.22 0.00 1.13 5.08 -1.24 -2.43 114.58 117.33 1ng9 h GLU 408 Ca -0.01 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1ng9 h GLU 408 Cb 1.18 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1ng9 h GLU 408 CO 0.07 0.79 -0.65 0.00 -1.00 0.00 0.00 179.01 178.21 1ng9 h ARG 409 N 0.15 0.00 0.00 2.33 3.08 -1.41 -3.39 114.38 115.14 1ng9 h ARG 409 Ca -0.01 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.79 1ng9 h ARG 409 Cb 1.17 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.17 1ng9 h ARG 409 CO 0.10 0.00 -1.99 0.00 -1.07 0.00 0.00 179.97 177.01 1ng9 n ALA 410 N -1.84 1.70 -2.36 0.04 0.00 -0.95 -4.19 120.51 112.91 1ng9 n ALA 410 Ca 0.03 -0.93 -0.30 0.00 0.00 0.00 0.00 53.44 52.24 1ng9 n ALA 410 Cb 0.44 -0.10 -0.14 0.00 0.00 0.00 0.00 19.45 19.66 1ng9 n ALA 410 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ng9 s ILE 411 N -2.41 2.21 0.89 0.00 -1.09 -0.92 -1.79 121.20 118.09 1ng9 s ILE 411 Ca -0.07 -1.46 -0.12 0.00 -2.23 0.00 0.00 60.65 56.76 1ng9 s ILE 411 Cb 0.05 -1.89 0.07 0.00 -1.58 0.00 0.00 42.46 39.10 1ng9 s ILE 411 CO 0.61 0.30 0.77 -0.38 -1.23 0.00 0.00 174.94 175.01 1ng9 n ILE 412 N 1.57 0.59 0.03 2.92 2.08 -0.84 -4.74 119.36 120.96 1ng9 n ILE 412 Ca -0.17 -0.17 -0.10 0.00 0.56 0.00 0.00 62.75 62.87 1ng9 n ILE 412 Cb 0.52 -0.84 -0.04 0.00 -0.75 0.00 0.00 39.64 38.53 1ng9 n ILE 412 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 1ng9 h ASP 413 N -1.40 -0.45 -3.31 4.38 5.19 -1.94 -3.36 116.42 115.53 1ng9 h ASP 413 Ca -0.44 0.07 -0.61 0.00 -0.62 0.00 0.00 57.03 55.44 1ng9 h ASP 413 Cb 1.29 0.20 -0.40 0.00 0.18 0.00 0.00 39.33 40.60 1ng9 h ASP 413 CO 0.39 -0.20 -0.75 0.42 -3.12 0.00 0.00 179.24 175.98 1ng9 s THR 414 N -6.14 1.40 0.86 0.35 -4.23 -1.26 -5.04 115.64 101.59 1ng9 s THR 414 Ca -0.14 -2.72 -0.13 0.00 -1.18 0.00 0.00 61.69 57.52 1ng9 s THR 414 Cb 0.09 -1.97 0.12 0.00 1.34 0.00 0.00 72.50 72.08 1ng9 s THR 414 CO 0.67 -0.95 1.23 -2.16 -0.54 0.00 0.00 174.62 172.87 1ng9 s PRO 415 N 0.16 1.49 1.04 3.99 0.04 -1.26 -5.06 135.00 135.40 1ng9 s PRO 415 Ca 0.20 -0.07 -0.16 0.00 0.04 0.00 0.00 61.00 61.02 1ng9 s PRO 415 Cb -0.19 -1.91 0.21 0.00 0.04 0.00 0.00 34.50 32.65 1ng9 s PRO 415 CO -0.04 -1.89 1.16 -2.14 0.04 0.00 0.00 177.00 174.12 1ng9 s PRO 416 N -5.68 0.06 0.28 0.56 0.02 -1.26 -4.81 135.00 124.17 1ng9 s PRO 416 Ca 0.66 0.06 0.04 0.00 0.02 0.00 0.00 61.00 61.78 1ng9 s PRO 416 Cb -0.09 -1.73 0.41 0.00 0.02 0.00 0.00 34.50 33.11 1ng9 s PRO 416 CO 0.50 -2.88 1.69 -0.39 -0.33 0.00 0.00 177.00 175.60 1ng9 h VAL 417 N -1.99 1.29 -2.97 3.83 -1.51 -1.98 -3.36 116.25 109.57 1ng9 h VAL 417 Ca -0.48 -1.44 -0.43 0.00 -1.23 0.00 0.00 66.70 63.12 1ng9 h VAL 417 Cb 1.30 1.55 -0.14 0.00 -2.13 0.00 0.00 31.29 31.87 1ng9 h VAL 417 CO 0.47 0.44 -0.69 -0.76 -1.23 0.00 0.00 177.57 175.80 1ng9 s LEU 418 N -8.43 2.43 0.02 4.19 1.43 -1.26 -4.25 118.68 112.81 1ng9 s LEU 418 Ca -0.06 -1.14 0.23 0.00 -1.03 0.00 0.00 54.13 52.13 1ng9 s LEU 418 Cb 0.13 -0.51 -0.00 0.00 0.03 0.00 0.00 46.19 45.84 1ng9 s LEU 418 CO 0.79 -0.35 0.99 0.55 0.23 0.00 0.00 176.35 178.56 1ng9 n VAL 419 N -0.45 0.09 -0.32 -1.59 3.14 -1.26 -4.50 118.33 113.44 1ng9 n VAL 419 Ca -0.06 -0.17 0.11 0.00 -2.96 0.00 0.00 64.34 61.26 1ng9 n VAL 419 Cb 0.62 0.42 0.28 0.00 -1.06 0.00 0.00 33.84 34.10 1ng9 n VAL 419 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 1ng9 h ARG 420 N 0.00 0.61 0.00 1.45 2.43 -1.98 -2.13 114.38 114.76 1ng9 h ARG 420 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1ng9 h ARG 420 Cb 0.66 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1ng9 h ARG 420 CO 0.00 0.41 -0.49 -0.25 -1.51 0.00 0.00 179.97 178.13 1ng9 n ASP 421 N -4.87 0.49 0.00 -3.80 8.00 -1.26 -5.07 116.55 110.04 1ng9 n ASP 421 Ca 0.21 -0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1ng9 n ASP 421 Cb 0.54 0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.86 1ng9 n ASP 421 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ng9 n GLY 422 N 1.49 -2.11 1.94 0.44 0.00 -0.80 -5.00 105.19 101.15 1ng9 n GLY 422 Ca 0.05 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1ng9 n GLY 422 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ng9 n GLY 423 N -0.10 0.40 0.14 -0.02 0.00 -1.26 -4.86 105.19 99.49 1ng9 n GLY 423 Ca 0.00 -1.04 -0.29 0.00 0.00 0.00 0.00 46.02 44.69 1ng9 n GLY 423 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ng9 n VAL 424 N -3.10 1.53 -2.72 1.61 0.31 -1.26 -4.46 118.33 110.24 1ng9 n VAL 424 Ca 0.00 -0.36 -0.41 0.00 -0.01 0.00 0.00 64.34 63.56 1ng9 n VAL 424 Cb 0.07 -1.90 -0.05 0.00 -0.91 0.00 0.00 33.84 31.05 1ng9 n VAL 424 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1ng9 s ILE 425 N -2.51 4.28 0.52 2.52 -1.09 -1.26 -1.99 121.20 121.68 1ng9 s ILE 425 Ca -0.38 2.04 -0.02 0.00 -2.23 0.00 0.00 60.65 60.06 1ng9 s ILE 425 Cb 0.14 -4.30 0.01 0.00 -1.58 0.00 0.00 42.46 36.73 1ng9 s ILE 425 CO 0.49 0.38 0.78 0.00 -1.23 0.00 0.00 174.94 175.37 1ng9 s ALA 426 N -0.46 3.59 0.21 9.38 0.00 -0.74 -4.80 121.76 128.93 1ng9 s ALA 426 Ca 0.45 -0.96 -0.30 0.00 0.00 0.00 0.00 51.96 51.14 1ng9 s ALA 426 Cb -0.25 -2.31 -0.09 0.00 0.00 0.00 0.00 23.12 20.46 1ng9 s ALA 426 CO 0.31 -0.62 1.38 -1.12 0.00 0.00 0.00 175.76 175.71 1ng9 s SER 427 N -4.29 6.78 0.00 0.00 0.01 -1.26 -3.24 113.70 111.70 1ng9 s SER 427 Ca 0.52 2.51 0.00 0.00 1.31 0.00 0.00 55.95 60.29 1ng9 s SER 427 Cb -0.10 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.52 1ng9 s SER 427 CO 0.41 -0.62 0.00 0.61 0.41 0.00 0.00 173.24 174.05 1ng9 n GLY 428 N 2.46 2.95 0.24 3.44 0.00 -1.26 -4.93 105.19 108.09 1ng9 n GLY 428 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.00 1ng9 n GLY 428 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1ng9 h TYR 429 N 0.00 0.83 -3.33 1.61 3.20 -1.71 -3.42 116.97 114.14 1ng9 h TYR 429 Ca 0.00 -0.25 -0.39 0.00 3.14 0.00 0.00 58.73 61.23 1ng9 h TYR 429 Cb 0.00 -0.18 -0.38 0.00 1.54 0.00 0.00 36.73 37.72 1ng9 h TYR 429 CO 0.00 0.99 -0.75 1.21 -1.64 0.00 0.00 178.16 177.97 1ng9 s ASN 430 N -6.85 1.13 0.24 -2.11 3.84 -1.26 -5.05 114.94 104.88 1ng9 s ASN 430 Ca -0.09 -0.00 -0.05 0.00 0.21 0.00 0.00 52.86 52.93 1ng9 s ASN 430 Cb 0.12 -0.26 0.26 0.00 -0.55 0.00 0.00 41.25 40.82 1ng9 s ASN 430 CO 0.85 -0.20 1.83 -0.33 -2.79 0.00 0.00 177.10 176.46 1ng9 h GLU 431 N 8.13 1.12 -0.39 0.43 5.08 -1.99 -2.73 114.58 124.23 1ng9 h GLU 431 Ca -0.22 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 57.90 1ng9 h GLU 431 Cb 1.12 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 1ng9 h GLU 431 CO 0.26 0.88 -0.04 1.49 -1.00 0.00 0.00 179.01 180.60 1ng9 h GLU 432 N 1.10 0.64 -0.27 2.33 4.81 -1.99 -2.90 114.58 118.30 1ng9 h GLU 432 Ca 0.26 -0.17 -0.09 0.00 -0.13 0.00 0.00 59.36 59.23 1ng9 h GLU 432 Cb 0.15 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1ng9 h GLU 432 CO -0.03 0.69 -0.21 1.25 -0.73 0.00 0.00 179.01 179.98 1ng9 h LEU 433 N 0.60 0.50 -0.57 1.64 5.85 -1.90 -2.41 115.31 119.02 1ng9 h LEU 433 Ca 0.12 -0.16 -0.16 0.00 0.84 0.00 0.00 57.88 58.52 1ng9 h LEU 433 Cb 0.44 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1ng9 h LEU 433 CO 0.02 0.72 -0.60 0.44 -0.34 0.00 0.00 178.44 178.68 1ng9 h ASP 434 N 0.45 0.43 1.26 1.25 3.32 -1.43 -1.94 116.42 119.77 1ng9 h ASP 434 Ca 0.07 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1ng9 h ASP 434 Cb 0.62 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1ng9 h ASP 434 CO 0.04 0.93 -0.13 -1.84 -1.72 0.00 0.00 179.24 176.53 1ng9 n GLU 435 N -3.90 0.22 0.08 3.56 0.28 -1.14 -2.74 120.64 117.00 1ng9 n GLU 435 Ca -0.03 0.15 0.12 0.00 -0.16 0.00 0.00 57.16 57.24 1ng9 n GLU 435 Cb 0.62 -1.73 0.17 0.00 1.43 0.00 0.00 31.44 31.94 1ng9 n GLU 435 CO 0.00 0.00 0.00 -1.49 -0.16 0.00 0.00 177.13 175.48 1ng9 h TRP 436 N 0.00 0.00 -0.00 -1.84 -0.00 -1.30 -3.29 115.95 109.51 1ng9 h TRP 436 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1ng9 h TRP 436 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.85 1ng9 h TRP 436 CO 0.00 0.00 -0.10 2.89 -0.00 0.00 0.00 178.44 181.23 1ng9 n ARG 437 N -2.26 0.51 -1.75 0.49 1.85 -0.74 -4.65 116.66 110.10 1ng9 n ARG 437 Ca 0.03 -0.14 -0.18 0.00 -1.00 0.00 0.00 57.85 56.56 1ng9 n ARG 437 Cb 0.46 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 30.30 1ng9 n ARG 437 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ng9 s ALA 438 N -2.58 0.99 0.00 2.89 0.00 -1.23 -1.80 121.76 120.02 1ng9 s ALA 438 Ca 0.26 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.93 1ng9 s ALA 438 Cb 0.20 -4.62 0.00 0.00 0.00 0.00 0.00 23.12 18.70 1ng9 s ALA 438 CO 0.49 -5.84 0.00 -0.11 0.00 0.00 0.00 175.76 170.30 1ng9 n LEU 439 N 17.36 0.00 -0.12 0.00 7.94 -1.26 -4.76 117.00 136.16 1ng9 n LEU 439 Ca 0.44 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 55.29 1ng9 n LEU 439 Cb 0.45 0.00 0.15 0.00 0.53 0.00 0.00 43.42 44.55 1ng9 n LEU 439 CO 0.58 0.00 0.88 0.00 -1.11 0.00 0.00 177.39 177.74 1ng9 h ALA 440 N 0.00 1.09 -0.22 1.96 0.00 -1.70 -0.11 119.26 120.27 1ng9 h ALA 440 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1ng9 h ALA 440 Cb 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ng9 h ALA 440 CO 0.00 0.58 0.00 -3.47 0.00 0.00 0.00 179.25 176.36 1ng9 n ASP 441 N -4.21 2.60 0.16 0.00 -0.08 -1.26 -4.17 116.55 109.58 1ng9 n ASP 441 Ca 0.03 -1.78 0.12 0.00 -1.51 0.00 0.00 54.79 51.65 1ng9 n ASP 441 Cb 0.30 -0.14 0.27 0.00 2.34 0.00 0.00 41.12 43.89 1ng9 n ASP 441 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1ng9 h GLY 442 N 2.42 0.00 -5.56 0.27 0.00 -1.75 -3.40 103.07 95.05 1ng9 h GLY 442 Ca 0.00 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.67 1ng9 h GLY 442 CO 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 176.54 175.98 1ng9 s ALA 443 N -3.17 3.54 0.00 3.60 0.00 -0.09 -2.86 121.76 122.78 1ng9 s ALA 443 Ca 0.08 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.31 1ng9 s ALA 443 Cb 0.09 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.46 1ng9 s ALA 443 CO 0.64 0.53 0.00 0.25 0.00 0.00 0.00 175.76 177.19 1ng9 n THR 444 N 2.32 0.00 0.38 0.00 -2.24 -1.26 -4.66 114.28 108.81 1ng9 n THR 444 Ca -0.19 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.43 1ng9 n THR 444 Cb 0.54 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.69 1ng9 n THR 444 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1ng9 h ASP 445 N 0.00 -0.83 0.20 3.42 3.58 -1.77 -3.23 116.42 117.79 1ng9 h ASP 445 Ca 0.00 0.00 -0.27 0.00 0.42 0.00 0.00 57.03 57.19 1ng9 h ASP 445 Cb 0.00 0.21 0.03 0.00 1.72 0.00 0.00 39.33 41.30 1ng9 h ASP 445 CO 0.00 -0.49 -1.16 0.22 -2.88 0.00 0.00 179.24 174.92 1ng9 h TYR 446 N -1.15 0.79 -0.11 0.28 3.20 -1.79 -3.20 116.97 114.99 1ng9 h TYR 446 Ca -0.10 -0.57 -0.12 0.00 3.14 0.00 0.00 58.73 61.08 1ng9 h TYR 446 Cb 0.77 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.00 1ng9 h TYR 446 CO -0.00 1.44 -0.47 -0.07 -1.64 0.00 0.00 178.16 177.42 1ng9 h LEU 447 N -0.08 0.30 -0.47 2.82 3.38 -1.81 -0.96 115.31 118.49 1ng9 h LEU 447 Ca -0.20 -0.14 -0.17 0.00 0.09 0.00 0.00 57.88 57.46 1ng9 h LEU 447 Cb 1.92 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.58 1ng9 h LEU 447 CO 0.22 0.73 -0.68 -0.08 0.09 0.00 0.00 178.44 178.72 1ng9 h GLU 448 N 0.22 0.40 -0.16 1.13 4.57 -1.69 -1.57 114.58 117.48 1ng9 h GLU 448 Ca 0.01 -0.30 -0.12 0.00 -1.18 0.00 0.00 59.36 57.77 1ng9 h GLU 448 Cb 0.92 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.55 1ng9 h GLU 448 CO 0.07 0.93 -0.40 0.00 -1.18 0.00 0.00 179.01 178.43 1ng9 h ARG 449 N 0.28 0.37 -0.01 1.92 3.08 -1.48 -2.16 114.38 116.39 1ng9 h ARG 449 Ca -0.02 -0.18 -0.15 0.00 0.07 0.00 0.00 59.98 59.70 1ng9 h ARG 449 Cb 1.23 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.26 1ng9 h ARG 449 CO 0.12 0.72 -0.70 1.25 -1.07 0.00 0.00 179.97 180.29 1ng9 h LEU 450 N 0.31 0.05 0.54 3.04 5.85 -1.11 -2.32 115.31 121.67 1ng9 h LEU 450 Ca 0.03 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1ng9 h LEU 450 Cb 0.85 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.87 1ng9 h LEU 450 CO 0.07 0.73 -0.26 -0.08 -0.34 0.00 0.00 178.44 178.56 1ng9 h GLU 451 N 0.03 -0.70 -0.80 1.25 4.81 -1.04 -2.54 114.58 115.58 1ng9 h GLU 451 Ca -0.01 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1ng9 h GLU 451 Cb 1.24 0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.74 1ng9 h GLU 451 CO 0.09 -0.46 0.51 -0.24 -0.73 0.00 0.00 179.01 178.19 1ng9 h VAL 452 N -1.18 1.21 -0.62 0.32 3.04 -1.49 0.20 116.25 117.73 1ng9 h VAL 452 Ca -0.07 -0.43 0.03 0.00 -1.01 0.00 0.00 66.70 65.21 1ng9 h VAL 452 Cb 0.57 0.07 -0.04 0.00 -2.01 0.00 0.00 31.29 29.88 1ng9 h VAL 452 CO 0.12 0.21 0.39 -0.09 -1.01 0.00 0.00 177.57 177.19 1ng9 h ARG 453 N 1.09 0.74 0.00 4.17 2.43 -1.50 -0.74 114.38 120.56 1ng9 h ARG 453 Ca 0.29 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.30 1ng9 h ARG 453 Cb -0.09 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.28 1ng9 h ARG 453 CO -0.06 0.49 -0.86 0.93 -1.51 0.00 0.00 179.97 178.96 1ng9 h GLU 454 N 0.76 0.00 -0.50 0.20 4.39 -1.16 -2.02 114.58 116.25 1ng9 h GLU 454 Ca 0.25 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.84 1ng9 h GLU 454 Cb 0.01 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 1ng9 h GLU 454 CO -0.10 0.34 -0.12 -0.09 -1.16 0.00 0.00 179.01 177.88 1ng9 h ARG 455 N 0.00 0.95 0.08 2.33 2.43 -0.32 -2.63 114.38 117.21 1ng9 h ARG 455 Ca -0.06 -0.35 -0.12 0.00 -0.81 0.00 0.00 59.98 58.64 1ng9 h ARG 455 Cb 1.40 -0.06 0.01 0.00 -0.42 0.00 0.00 29.97 30.90 1ng9 h ARG 455 CO 0.05 1.01 -0.53 0.93 -1.51 0.00 0.00 179.97 179.92 1ng9 h GLU 456 N 0.84 0.22 -0.75 0.20 5.08 -1.16 -1.96 114.58 117.06 1ng9 h GLU 456 Ca 0.13 -0.34 0.05 0.00 -1.00 0.00 0.00 59.36 58.20 1ng9 h GLU 456 Cb 0.67 0.12 -0.05 0.00 0.50 0.00 0.00 28.75 30.00 1ng9 h GLU 456 CO 0.05 1.13 0.49 -0.09 -1.00 0.00 0.00 179.01 179.60 1ng9 h ARG 457 N -0.51 0.82 0.00 2.33 2.43 -1.45 -2.97 114.38 115.04 1ng9 h ARG 457 Ca -0.09 -0.05 -0.17 0.00 -0.81 0.00 0.00 59.98 58.86 1ng9 h ARG 457 Cb 1.38 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.72 1ng9 h ARG 457 CO 0.10 0.54 -1.54 2.41 -1.51 0.00 0.00 179.97 179.97 1ng9 n THR 458 N -4.47 1.12 -1.05 0.20 -1.04 -0.99 -4.98 114.28 103.06 1ng9 n THR 458 Ca 0.10 -0.69 -0.02 0.00 -2.04 0.00 0.00 64.05 61.40 1ng9 n THR 458 Cb 0.18 -0.66 -0.01 0.00 -1.82 0.00 0.00 70.33 68.02 1ng9 n THR 458 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ng9 n GLY 459 N 1.42 0.51 3.27 3.41 0.00 -0.74 -5.00 105.19 108.06 1ng9 n GLY 459 Ca -0.11 -0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 1ng9 n GLY 459 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ng9 s LEU 460 N -0.43 5.71 0.47 0.99 1.43 -1.20 -4.98 118.68 120.68 1ng9 s LEU 460 Ca 0.00 -1.72 0.32 0.00 -1.03 0.00 0.00 54.13 51.70 1ng9 s LEU 460 Cb 0.00 -2.08 1.44 0.00 0.03 0.00 0.00 46.19 45.58 1ng9 s LEU 460 CO 0.00 -0.70 1.95 -2.24 0.23 0.00 0.00 176.35 175.59 1ng9 h ASP 461 N 8.60 0.00 1.15 2.29 2.03 -1.95 -2.46 116.42 126.09 1ng9 h ASP 461 Ca -0.25 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.05 1ng9 h ASP 461 Cb 1.09 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.59 1ng9 h ASP 461 CO 0.89 0.00 0.00 0.35 -1.03 0.00 0.00 179.24 179.45 1ng9 n THR 462 N -2.78 0.25 -1.68 1.15 -2.24 -1.26 -4.89 114.28 102.83 1ng9 n THR 462 Ca 0.00 -0.09 -0.43 0.00 -2.27 0.00 0.00 64.05 61.26 1ng9 n THR 462 Cb 0.22 -0.55 -0.03 0.00 -2.10 0.00 0.00 70.33 67.86 1ng9 n THR 462 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1ng9 n LEU 463 N -1.79 3.95 -4.24 3.22 0.00 -0.93 -4.64 117.00 112.58 1ng9 n LEU 463 Ca 0.06 0.97 -0.13 0.00 0.00 0.00 0.00 56.01 56.91 1ng9 n LEU 463 Cb 0.37 -1.52 -0.10 0.00 0.00 0.00 0.00 43.42 42.17 1ng9 n LEU 463 CO 0.28 0.13 -0.33 -1.59 0.00 0.00 0.00 177.39 175.88 1ng9 s LYS 464 N 3.13 1.10 -0.16 1.96 0.00 -0.74 -4.86 119.74 120.16 1ng9 s LYS 464 Ca 0.84 -1.53 0.01 0.00 0.00 0.00 0.00 55.97 55.30 1ng9 s LYS 464 Cb -0.51 -0.26 0.02 0.00 0.00 0.00 0.00 37.83 37.08 1ng9 s LYS 464 CO 0.40 -0.13 -0.20 0.08 0.00 0.00 0.00 175.35 175.50 1ng9 s VAL 465 N -3.66 2.01 0.29 1.79 1.01 -1.26 -0.96 120.40 119.62 1ng9 s VAL 465 Ca 0.24 -0.93 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1ng9 s VAL 465 Cb 0.06 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 1ng9 s VAL 465 CO 0.04 0.54 0.16 -0.83 0.00 0.00 0.00 175.10 175.00 1ng9 s GLY 466 N 1.14 1.96 0.13 4.51 0.00 -0.93 -4.99 107.32 109.13 1ng9 s GLY 466 Ca 0.01 -1.78 0.11 0.00 0.00 0.00 0.00 44.72 43.05 1ng9 s GLY 466 CO -0.09 -1.55 -0.25 -0.12 0.00 0.00 0.00 173.10 171.09 1ng9 s PHE 467 N -3.69 2.35 -0.08 1.90 5.36 -1.26 -1.09 117.98 121.47 1ng9 s PHE 467 Ca 0.37 -0.36 -0.04 0.00 -0.96 0.00 0.00 56.93 55.94 1ng9 s PHE 467 Cb 0.05 -1.26 0.04 0.00 -0.34 0.00 0.00 43.02 41.51 1ng9 s PHE 467 CO 0.17 0.36 0.19 1.21 -1.46 0.00 0.00 175.22 175.68 1ng9 s ASN 468 N -2.11 -0.18 0.33 6.13 3.04 -1.06 -4.97 114.94 116.12 1ng9 s ASN 468 Ca 0.15 0.39 0.04 0.00 0.04 0.00 0.00 52.86 53.48 1ng9 s ASN 468 Cb -0.10 0.30 0.67 0.00 -1.54 0.00 0.00 41.25 40.58 1ng9 s ASN 468 CO 0.07 -0.14 1.89 0.00 -3.04 0.00 0.00 177.10 175.88 1ng9 h ALA 469 N 6.92 1.65 0.16 1.71 0.00 -2.01 0.42 119.26 128.11 1ng9 h ALA 469 Ca -0.38 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.31 1ng9 h ALA 469 Cb 1.16 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.77 1ng9 h ALA 469 CO 0.40 0.16 -0.99 0.28 0.00 0.00 0.00 179.25 179.10 1ng9 h VAL 470 N 0.87 1.42 0.00 0.00 2.07 -2.05 -3.39 116.25 115.17 1ng9 h VAL 470 Ca 0.42 -2.54 0.00 0.00 0.82 0.00 0.00 66.70 65.39 1ng9 h VAL 470 Cb 0.44 3.12 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 1ng9 h VAL 470 CO -0.18 0.73 -1.31 1.41 0.02 0.00 0.00 177.57 178.24 1ng9 n HIS 471 N -4.04 0.00 -1.72 1.57 8.25 -1.19 -5.11 115.22 112.98 1ng9 n HIS 471 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.30 1ng9 n HIS 471 Cb 0.88 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 31.77 1ng9 n HIS 471 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ng9 n GLY 472 N 1.49 -1.81 3.76 -1.41 0.00 0.13 -4.96 105.19 102.39 1ng9 n GLY 472 Ca -0.00 -1.76 -0.36 0.00 0.00 0.00 0.00 46.02 43.90 1ng9 n GLY 472 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ng9 s TYR 473 N 0.00 2.47 0.13 1.61 2.02 -1.26 -2.55 117.35 119.78 1ng9 s TYR 473 Ca 0.00 1.52 -0.14 0.00 -0.37 0.00 0.00 57.07 58.07 1ng9 s TYR 473 Cb 0.00 -3.45 0.02 0.00 -0.40 0.00 0.00 41.96 38.13 1ng9 s TYR 473 CO 0.00 -2.08 0.37 1.52 -1.57 0.00 0.00 175.55 173.79 1ng9 s TYR 474 N -1.61 -0.06 -0.28 2.71 -0.85 -0.25 -4.81 117.35 112.19 1ng9 s TYR 474 Ca 0.75 -0.28 -0.05 0.00 -0.52 0.00 0.00 57.07 56.97 1ng9 s TYR 474 Cb -0.29 0.18 0.02 0.00 0.38 0.00 0.00 41.96 42.25 1ng9 s TYR 474 CO 0.32 -0.70 0.04 0.42 -1.52 0.00 0.00 175.55 174.11 1ng9 s ILE 475 N -3.84 3.64 -0.15 -3.49 1.01 -0.04 -2.19 121.20 116.14 1ng9 s ILE 475 Ca 0.06 -0.82 -0.11 0.00 0.00 0.00 0.00 60.65 59.77 1ng9 s ILE 475 Cb 0.02 -2.89 -0.05 0.00 0.01 0.00 0.00 42.46 39.56 1ng9 s ILE 475 CO -0.09 0.09 0.22 -1.58 0.00 0.00 0.00 174.94 173.58 1ng9 s GLN 476 N 1.44 4.04 0.15 2.79 0.74 -0.13 -0.88 119.66 127.80 1ng9 s GLN 476 Ca 0.01 -0.03 0.09 0.00 0.05 0.00 0.00 55.36 55.49 1ng9 s GLN 476 Cb -0.17 -3.36 -0.04 0.00 1.10 0.00 0.00 33.01 30.54 1ng9 s GLN 476 CO 0.01 0.41 -0.21 0.42 -0.55 0.00 0.00 175.29 175.36 1ng9 s ILE 477 N -0.00 1.94 0.73 -2.34 1.01 -0.44 -1.79 121.20 120.30 1ng9 s ILE 477 Ca 0.14 -1.80 -0.13 0.00 0.00 0.00 0.00 60.65 58.87 1ng9 s ILE 477 Cb -0.12 -1.82 0.03 0.00 0.01 0.00 0.00 42.46 40.56 1ng9 s ILE 477 CO 0.03 -0.14 1.11 -0.94 0.00 0.00 0.00 174.94 174.99 1ng9 s SER 478 N -2.34 4.67 0.16 3.58 1.04 -1.26 -1.49 113.70 118.05 1ng9 s SER 478 Ca 0.13 1.96 -0.16 0.00 0.48 0.00 0.00 55.95 58.37 1ng9 s SER 478 Cb -0.08 -2.54 0.08 0.00 0.10 0.00 0.00 66.02 63.58 1ng9 s SER 478 CO 0.06 -1.93 1.75 -0.09 0.98 0.00 0.00 173.24 174.02 1ng9 h ARG 479 N -0.58 0.29 0.00 4.02 2.43 -1.81 0.11 114.38 118.83 1ng9 h ARG 479 Ca -0.45 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1ng9 h ARG 479 Cb 1.24 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1ng9 h ARG 479 CO 0.52 0.19 0.00 0.78 -1.51 0.00 0.00 179.97 179.95 1ng9 h GLY 480 N 0.30 0.00 -0.81 2.80 0.00 -1.92 -2.16 103.07 101.28 1ng9 h GLY 480 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1ng9 h GLY 480 CO -0.18 0.00 -0.27 -1.06 0.00 0.00 0.00 176.54 175.03 1ng9 n GLN 481 N -3.05 1.64 0.22 4.80 6.02 -0.92 -4.72 117.38 121.36 1ng9 n GLN 481 Ca -0.01 -0.90 0.09 0.00 -0.01 0.00 0.00 57.00 56.17 1ng9 n GLN 481 Cb 0.16 -1.27 0.44 0.00 1.02 0.00 0.00 30.24 30.60 1ng9 n GLN 481 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1ng9 h SER 482 N 1.97 0.00 0.30 1.08 4.64 -0.10 -2.18 113.55 119.26 1ng9 h SER 482 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ng9 h SER 482 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1ng9 h SER 482 CO 0.00 0.24 0.00 0.00 -0.87 0.00 0.00 176.83 176.20 1ng9 n HIS 483 N -3.41 0.00 0.82 4.77 1.44 -1.26 -2.81 115.22 114.76 1ng9 n HIS 483 Ca 0.00 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 55.81 1ng9 n HIS 483 Cb 0.44 -0.24 0.05 0.00 0.12 0.00 0.00 29.99 30.36 1ng9 n HIS 483 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1ng9 n LEU 484 N -1.24 2.29 -4.79 2.39 4.77 -0.82 -5.02 117.00 114.58 1ng9 n LEU 484 Ca 0.10 -0.91 -0.33 0.00 -0.03 0.00 0.00 56.01 54.85 1ng9 n LEU 484 Cb 0.14 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.25 1ng9 n LEU 484 CO 0.14 0.41 0.73 0.00 -1.33 0.00 0.00 177.39 177.33 1ng9 s ALA 485 N -1.82 2.67 0.73 -1.18 0.00 -1.12 -4.98 121.76 116.06 1ng9 s ALA 485 Ca 0.20 0.47 -0.16 0.00 0.00 0.00 0.00 51.96 52.47 1ng9 s ALA 485 Cb 0.16 -3.26 0.01 0.00 0.00 0.00 0.00 23.12 20.03 1ng9 s ALA 485 CO 0.33 -0.91 0.98 -2.30 0.00 0.00 0.00 175.76 173.87 1ng9 n PRO 486 N -2.05 0.47 0.14 0.00 -0.02 -1.26 -4.90 135.00 127.39 1ng9 n PRO 486 Ca 0.09 0.22 0.12 0.00 -2.02 0.00 0.00 63.50 61.91 1ng9 n PRO 486 Cb 0.52 -2.24 0.23 0.00 -0.02 0.00 0.00 33.50 31.99 1ng9 n PRO 486 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 1ng9 h ILE 487 N -0.33 0.00 -0.37 4.25 3.07 -2.01 -3.00 117.51 119.13 1ng9 h ILE 487 Ca -0.47 -0.75 0.04 0.00 1.55 0.00 0.00 64.86 65.23 1ng9 h ILE 487 Cb 1.33 1.63 -0.02 0.00 -0.27 0.00 0.00 36.82 39.48 1ng9 h ILE 487 CO 0.47 0.00 0.25 0.78 -1.05 0.00 0.00 178.15 178.59 1ng9 h ASN 488 N 0.00 0.29 -2.41 2.16 2.35 -1.99 -3.43 115.58 112.54 1ng9 h ASN 488 Ca 0.00 -0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.19 1ng9 h ASN 488 Cb 0.88 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 39.16 1ng9 h ASN 488 CO 0.00 0.20 1.34 -0.31 -1.65 0.00 0.00 177.43 177.01 1ng9 s TYR 489 N -5.32 1.65 0.07 1.19 1.51 -1.14 -4.87 117.35 110.44 1ng9 s TYR 489 Ca -0.07 0.69 -0.30 0.00 -1.01 0.00 0.00 57.07 56.38 1ng9 s TYR 489 Cb 0.18 -4.06 -0.05 0.00 -0.11 0.00 0.00 41.96 37.92 1ng9 s TYR 489 CO 0.72 -3.01 1.07 -1.64 -1.11 0.00 0.00 175.55 171.58 1ng9 s MET 490 N 6.09 4.55 -0.16 -0.62 -1.94 -0.40 -4.86 119.30 121.96 1ng9 s MET 490 Ca 0.82 1.59 -0.29 0.00 -1.71 0.00 0.00 55.69 56.10 1ng9 s MET 490 Cb -0.22 -3.38 -0.01 0.00 2.01 0.00 0.00 34.83 33.23 1ng9 s MET 490 CO 0.32 -0.05 1.08 0.50 -0.01 0.00 0.00 175.02 176.86 1ng9 s ARG 491 N 0.61 4.32 -0.18 2.03 3.52 -1.26 -0.01 118.95 127.98 1ng9 s ARG 491 Ca 0.53 1.44 -0.08 0.00 -0.13 0.00 0.00 55.73 57.49 1ng9 s ARG 491 Cb -0.26 -3.61 -0.08 0.00 -1.56 0.00 0.00 34.95 29.44 1ng9 s ARG 491 CO 0.30 -0.51 -0.22 -2.13 -0.81 0.00 0.00 175.30 171.92 1ng9 n ARG 492 N 5.79 0.39 -3.69 5.12 0.63 -0.69 -4.89 116.66 119.32 1ng9 n ARG 492 Ca 0.11 0.16 -0.10 0.00 -0.92 0.00 0.00 57.85 57.10 1ng9 n ARG 492 Cb 0.47 -1.16 -0.10 0.00 0.45 0.00 0.00 32.46 32.11 1ng9 n ARG 492 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 1ng9 s GLN 493 N -2.33 0.40 -0.00 -0.14 0.74 -1.02 -5.01 119.66 112.30 1ng9 s GLN 493 Ca -0.25 0.84 0.01 0.00 0.05 0.00 0.00 55.36 56.01 1ng9 s GLN 493 Cb 0.09 0.02 -0.04 0.00 1.10 0.00 0.00 33.01 34.19 1ng9 s GLN 493 CO 0.32 -0.17 0.01 0.99 -0.55 0.00 0.00 175.29 175.90 1ng9 s THR 494 N 1.55 4.22 0.37 -0.34 2.01 -1.26 -0.72 115.64 121.48 1ng9 s THR 494 Ca -0.09 -0.57 0.05 0.00 0.31 0.00 0.00 61.69 61.39 1ng9 s THR 494 Cb -0.09 -2.89 -0.03 0.00 0.01 0.00 0.00 72.50 69.51 1ng9 s THR 494 CO -0.13 0.38 0.17 -0.76 -0.69 0.00 0.00 174.62 173.59 1ng9 s LEU 495 N -1.56 1.88 0.08 4.42 1.43 -0.43 -5.01 118.68 119.49 1ng9 s LEU 495 Ca 0.20 -1.68 -0.25 0.00 -1.03 0.00 0.00 54.13 51.37 1ng9 s LEU 495 Cb -0.12 0.11 -0.16 0.00 0.03 0.00 0.00 46.19 46.05 1ng9 s LEU 495 CO 0.10 -0.96 1.70 0.50 0.23 0.00 0.00 176.35 177.92 1ng9 h LYS 496 N 1.94 -0.21 -0.08 1.70 3.64 -2.04 -3.32 116.57 118.21 1ng9 h LYS 496 Ca -0.32 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.04 1ng9 h LYS 496 Cb 1.26 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.11 1ng9 h LYS 496 CO 0.51 -0.13 -0.28 0.09 -2.27 0.00 0.00 179.45 177.37 1ng9 n ASN 497 N -5.18 2.11 -3.63 4.20 3.02 -1.26 -4.94 115.26 109.59 1ng9 n ASN 497 Ca -0.09 -3.66 -0.09 0.00 -0.03 0.00 0.00 54.58 50.72 1ng9 n ASN 497 Cb 0.12 -0.53 -0.07 0.00 -0.61 0.00 0.00 39.78 38.69 1ng9 n ASN 497 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ng9 s ALA 498 N -3.14 -1.98 0.02 5.41 0.00 -1.25 -2.57 121.76 118.25 1ng9 s ALA 498 Ca 0.38 1.80 0.02 0.00 0.00 0.00 0.00 51.96 54.16 1ng9 s ALA 498 Cb 0.36 -1.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.14 1ng9 s ALA 498 CO -0.03 -0.24 0.03 -1.21 0.00 0.00 0.00 175.76 174.31 1ng9 s GLU 499 N -0.09 2.82 0.05 0.00 0.41 -0.56 -1.31 118.70 120.04 1ng9 s GLU 499 Ca 0.02 -0.63 0.08 0.00 -0.41 0.00 0.00 54.97 54.04 1ng9 s GLU 499 Cb -0.04 -2.70 -0.03 0.00 -1.78 0.00 0.00 34.13 29.58 1ng9 s GLU 499 CO -0.05 0.61 -0.23 1.03 -0.49 0.00 0.00 175.26 176.12 1ng9 s ARG 500 N -1.81 1.53 0.21 1.61 0.52 0.10 -1.33 118.95 119.78 1ng9 s ARG 500 Ca 0.22 -1.06 0.00 0.00 -0.52 0.00 0.00 55.73 54.38 1ng9 s ARG 500 Cb -0.12 -1.71 -0.05 0.00 0.52 0.00 0.00 34.95 33.59 1ng9 s ARG 500 CO 0.14 0.44 0.08 0.71 0.02 0.00 0.00 175.30 176.68 1ng9 s TYR 501 N -0.85 1.27 0.08 -0.53 2.02 -0.06 -1.70 117.35 117.58 1ng9 s TYR 501 Ca 0.10 -1.21 0.06 0.00 -0.37 0.00 0.00 57.07 55.64 1ng9 s TYR 501 Cb -0.09 -0.70 -0.03 0.00 -0.40 0.00 0.00 41.96 40.73 1ng9 s TYR 501 CO 0.02 -0.42 -0.16 -1.50 -1.57 0.00 0.00 175.55 171.92 1ng9 s ILE 502 N -3.89 1.32 0.07 2.71 1.10 0.99 -0.86 121.20 122.63 1ng9 s ILE 502 Ca 0.33 -1.41 0.04 0.00 -0.51 0.00 0.00 60.65 59.11 1ng9 s ILE 502 Cb 0.07 -1.25 -0.03 0.00 0.15 0.00 0.00 42.46 41.40 1ng9 s ILE 502 CO 0.10 -0.18 -0.12 0.27 -2.11 0.00 0.00 174.94 172.89 1ng9 s ILE 503 N -1.29 0.94 0.49 2.00 -4.36 -1.26 -1.28 121.20 116.44 1ng9 s ILE 503 Ca 0.01 -1.28 0.37 0.00 -0.26 0.00 0.00 60.65 59.49 1ng9 s ILE 503 Cb -0.10 -0.98 0.58 0.00 1.25 0.00 0.00 42.46 43.21 1ng9 s ILE 503 CO 0.03 -0.31 1.64 -0.65 0.24 0.00 0.00 174.94 175.90 1ng9 h PRO 504 N 4.26 0.05 -0.09 0.37 0.11 -1.99 -0.84 132.00 133.87 1ng9 h PRO 504 Ca -0.39 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.63 1ng9 h PRO 504 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1ng9 h PRO 504 CO 0.42 0.04 -0.30 1.49 -0.21 0.00 0.00 178.00 179.44 1ng9 h GLU 505 N 0.06 0.35 -0.02 1.05 4.81 -1.99 -2.71 114.58 116.12 1ng9 h GLU 505 Ca 0.81 -0.26 -0.14 0.00 -0.13 0.00 0.00 59.36 59.63 1ng9 h GLU 505 Cb 2.88 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 32.29 1ng9 h GLU 505 CO -0.21 0.89 -0.64 1.25 -0.73 0.00 0.00 179.01 179.57 1ng9 h LEU 506 N -0.11 0.11 -0.77 1.64 5.85 -1.59 -2.47 115.31 117.96 1ng9 h LEU 506 Ca -0.01 -0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.54 1ng9 h LEU 506 Cb 0.92 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 1ng9 h LEU 506 CO 0.06 0.72 -0.16 0.50 -0.34 0.00 0.00 178.44 179.22 1ng9 h LYS 507 N 0.07 0.76 -0.45 1.25 3.11 -1.47 -0.53 116.57 119.30 1ng9 h LYS 507 Ca -0.01 -0.28 -0.11 0.00 -2.81 0.00 0.00 60.65 57.44 1ng9 h LYS 507 Cb 1.14 -0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 32.31 1ng9 h LYS 507 CO 0.09 0.88 -0.17 1.49 -2.81 0.00 0.00 179.45 178.92 1ng9 h GLU 508 N 0.68 0.88 -0.11 1.90 4.81 -1.35 -1.81 114.58 119.58 1ng9 h GLU 508 Ca 0.11 -0.34 -0.12 0.00 -0.13 0.00 0.00 59.36 58.87 1ng9 h GLU 508 Cb 0.65 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1ng9 h GLU 508 CO 0.05 0.98 -0.48 -0.92 -0.73 0.00 0.00 179.01 177.91 1ng9 h TYR 509 N 0.78 0.35 -0.45 0.92 3.20 -1.30 -2.71 116.97 117.75 1ng9 h TYR 509 Ca 0.11 -0.11 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 1ng9 h TYR 509 Cb 0.71 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 1ng9 h TYR 509 CO 0.04 0.71 0.02 1.49 -1.64 0.00 0.00 178.16 178.79 1ng9 h GLU 510 N 0.23 0.78 -0.31 1.82 4.81 -0.83 -1.40 114.58 119.69 1ng9 h GLU 510 Ca 0.01 -0.24 -0.12 0.00 -0.13 0.00 0.00 59.36 58.88 1ng9 h GLU 510 Cb 0.93 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.22 1ng9 h GLU 510 CO 0.08 0.83 -0.32 -0.44 -0.73 0.00 0.00 179.01 178.43 1ng9 h ASP 511 N 0.64 0.69 0.42 1.04 3.32 -1.27 -2.84 116.42 118.41 1ng9 h ASP 511 Ca 0.13 -0.28 -0.31 0.00 0.02 0.00 0.00 57.03 56.59 1ng9 h ASP 511 Cb 0.47 -0.19 0.02 0.00 0.22 0.00 0.00 39.33 39.84 1ng9 h ASP 511 CO 0.02 0.96 -1.44 0.07 -1.72 0.00 0.00 179.24 177.12 1ng9 h LYS 512 N 0.57 0.38 -0.68 3.56 2.10 -1.48 -2.25 116.57 118.77 1ng9 h LYS 512 Ca 0.06 -0.65 -0.05 0.00 -2.00 0.00 0.00 60.65 58.01 1ng9 h LYS 512 Cb 0.82 0.24 -0.03 0.00 -0.90 0.00 0.00 32.23 32.36 1ng9 h LYS 512 CO 0.07 1.29 0.22 -0.24 -2.00 0.00 0.00 179.45 178.79 1ng9 h VAL 513 N 0.10 1.25 0.03 0.07 3.04 -1.29 -2.17 116.25 117.28 1ng9 h VAL 513 Ca -0.22 -0.84 -0.26 0.00 -1.01 0.00 0.00 66.70 64.36 1ng9 h VAL 513 Cb 2.07 0.49 -0.03 0.00 -2.01 0.00 0.00 31.29 31.81 1ng9 h VAL 513 CO 0.22 0.33 -1.37 -0.07 -1.01 0.00 0.00 177.57 175.67 1ng9 h LEU 514 N 1.00 0.09 -0.50 3.16 3.38 -1.57 -1.78 115.31 119.10 1ng9 h LEU 514 Ca 0.22 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 1ng9 h LEU 514 Cb 0.27 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1ng9 h LEU 514 CO -0.01 1.11 -0.24 0.71 0.09 0.00 0.00 178.44 180.10 1ng9 h THR 515 N 0.02 1.27 0.00 0.22 1.35 -1.40 -2.42 112.91 111.94 1ng9 h THR 515 Ca -0.16 -1.40 -0.09 0.00 -0.55 0.00 0.00 66.41 64.20 1ng9 h THR 515 Cb 1.91 1.16 -0.01 0.00 -1.73 0.00 0.00 68.15 69.48 1ng9 h THR 515 CO 0.12 0.48 -0.44 0.77 -0.25 0.00 0.00 175.52 176.20 1ng9 h SER 516 N 0.83 0.00 0.35 5.36 4.64 -1.44 -1.44 113.55 121.85 1ng9 h SER 516 Ca 0.10 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.24 1ng9 h SER 516 Cb 0.82 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.90 1ng9 h SER 516 CO 0.07 0.44 -0.75 0.50 -0.87 0.00 0.00 176.83 176.22 1ng9 h LYS 517 N 0.00 0.33 -0.10 4.77 3.64 -1.27 -0.94 116.57 123.00 1ng9 h LYS 517 Ca -0.00 -0.28 -0.14 0.00 -1.27 0.00 0.00 60.65 58.96 1ng9 h LYS 517 Cb 1.11 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.98 1ng9 h LYS 517 CO 0.06 0.94 -0.55 0.78 -2.27 0.00 0.00 179.45 178.41 1ng9 h GLY 518 N 1.43 0.31 1.60 5.01 0.00 -1.33 -2.24 103.07 107.86 1ng9 h GLY 518 Ca -0.03 -0.36 -0.18 0.00 0.00 0.00 0.00 47.33 46.76 1ng9 h GLY 518 CO 0.12 0.32 -0.72 0.50 0.00 0.00 0.00 176.54 176.76 1ng9 h LYS 519 N 0.22 0.39 0.00 4.80 1.79 -1.14 -2.59 116.57 120.05 1ng9 h LYS 519 Ca 0.00 -0.32 -0.14 0.00 -2.18 0.00 0.00 60.65 58.01 1ng9 h LYS 519 Cb 1.03 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.73 1ng9 h LYS 519 CO 0.09 0.96 -0.68 0.00 -1.08 0.00 0.00 179.45 178.74 1ng9 h ALA 520 N 0.95 0.78 0.19 3.86 0.00 -1.10 -2.55 119.26 121.38 1ng9 h ALA 520 Ca -0.03 -0.61 -0.31 0.00 0.00 0.00 0.00 54.91 53.95 1ng9 h ALA 520 Cb 1.29 -0.11 0.03 0.00 0.00 0.00 0.00 17.79 19.01 1ng9 h ALA 520 CO 0.12 0.84 -1.36 1.25 0.00 0.00 0.00 179.25 180.11 1ng9 h LEU 521 N 0.00 0.77 -0.64 0.00 5.85 -1.42 -2.63 115.31 117.24 1ng9 h LEU 521 Ca -0.01 -0.78 -0.10 0.00 0.84 0.00 0.00 57.88 57.83 1ng9 h LEU 521 Cb 1.28 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1ng9 h LEU 521 CO 0.09 1.60 -0.02 0.00 -0.34 0.00 0.00 178.44 179.77 1ng9 h ALA 522 N 0.30 0.85 -0.24 1.25 0.00 -1.48 -2.42 119.26 117.51 1ng9 h ALA 522 Ca -0.21 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.25 1ng9 h ALA 522 Cb 2.05 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.62 1ng9 h ALA 522 CO 0.25 0.67 -0.39 1.25 0.00 0.00 0.00 179.25 181.03 1ng9 h LEU 523 N 0.95 0.77 -0.95 0.00 5.85 -1.54 -2.26 115.31 118.12 1ng9 h LEU 523 Ca 0.17 -0.52 0.10 0.00 0.84 0.00 0.00 57.88 58.47 1ng9 h LEU 523 Cb 0.57 -0.22 -0.08 0.00 0.37 0.00 0.00 40.66 41.31 1ng9 h LEU 523 CO 0.03 1.14 0.59 -0.08 -0.34 0.00 0.00 178.44 179.78 1ng9 h GLU 524 N 0.42 0.93 0.00 1.25 4.81 -1.44 0.21 114.58 120.76 1ng9 h GLU 524 Ca 0.02 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.06 1ng9 h GLU 524 Cb 0.98 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 1ng9 h GLU 524 CO 0.09 0.62 -0.65 0.87 -0.73 0.00 0.00 179.01 179.20 1ng9 h LYS 525 N 0.96 0.00 -0.24 1.92 1.57 -1.35 -1.43 116.57 118.00 1ng9 h LYS 525 Ca 0.46 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 59.09 1ng9 h LYS 525 Cb 0.41 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1ng9 h LYS 525 CO -0.25 0.65 -0.48 0.37 -0.57 0.00 0.00 179.45 179.18 1ng9 h GLN 526 N 0.00 0.63 0.00 3.15 4.15 -0.75 -2.28 115.11 120.01 1ng9 h GLN 526 Ca -0.01 -0.36 -0.14 0.00 0.77 0.00 0.00 58.65 58.91 1ng9 h GLN 526 Cb 1.22 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.92 1ng9 h GLN 526 CO 0.08 0.97 -0.67 -0.07 -1.93 0.00 0.00 178.83 177.21 1ng9 h LEU 527 N 0.50 0.00 0.22 -2.39 3.38 -0.80 -2.19 115.31 114.02 1ng9 h LEU 527 Ca 0.03 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.67 1ng9 h LEU 527 Cb 1.02 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.80 1ng9 h LEU 527 CO 0.09 0.67 -1.42 0.22 0.09 0.00 0.00 178.44 178.10 1ng9 h TYR 528 N 0.00 0.93 -0.12 1.13 3.20 -1.23 -2.41 116.97 118.47 1ng9 h TYR 528 Ca -0.01 -0.66 -0.04 0.00 3.14 0.00 0.00 58.73 61.16 1ng9 h TYR 528 Cb 1.24 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.46 1ng9 h TYR 528 CO 0.00 1.51 -0.10 0.93 -1.64 0.00 0.00 178.16 178.87 1ng9 h GLU 529 N 0.16 0.18 0.00 1.82 4.39 -1.47 -2.61 114.58 117.05 1ng9 h GLU 529 Ca -0.23 -0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.35 1ng9 h GLU 529 Cb 2.11 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 30.72 1ng9 h GLU 529 CO 0.26 0.29 -0.43 0.93 -1.16 0.00 0.00 179.01 178.90 1ng9 h GLU 530 N 0.17 0.00 -0.70 2.33 5.08 -1.21 -2.76 114.58 117.49 1ng9 h GLU 530 Ca 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1ng9 h GLU 530 Cb 0.29 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1ng9 h GLU 530 CO 0.02 0.43 0.41 -0.07 -1.00 0.00 0.00 179.01 178.80 1ng9 h LEU 531 N 0.00 0.84 -0.56 1.33 3.38 -1.03 -1.89 115.31 117.38 1ng9 h LEU 531 Ca -0.00 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1ng9 h LEU 531 Cb 0.76 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1ng9 h LEU 531 CO 0.06 0.66 0.22 -0.26 0.09 0.00 0.00 178.44 179.20 1ng9 h PHE 532 N 0.97 0.86 -0.69 1.13 0.04 -1.52 -1.50 116.94 116.23 1ng9 h PHE 532 Ca 0.25 -0.07 0.08 0.00 2.80 0.00 0.00 57.97 61.03 1ng9 h PHE 532 Cb -0.02 -0.26 -0.04 0.00 2.20 0.00 0.00 35.95 37.83 1ng9 h PHE 532 CO 0.00 0.70 0.46 -0.44 -0.60 0.00 0.00 178.31 178.43 1ng9 h ASP 533 N 0.78 0.57 0.71 2.17 3.32 -1.16 -1.09 116.42 121.71 1ng9 h ASP 533 Ca 0.19 0.01 -0.20 0.00 0.02 0.00 0.00 57.03 57.05 1ng9 h ASP 533 Cb 0.21 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 1ng9 h ASP 533 CO -0.01 0.35 -1.41 -0.07 -1.72 0.00 0.00 179.24 176.38 1ng9 h LEU 534 N 0.64 0.00 0.21 1.55 3.38 -1.33 -3.38 115.31 116.38 1ng9 h LEU 534 Ca 0.31 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.95 1ng9 h LEU 534 Cb 0.38 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.15 1ng9 h LEU 534 CO -0.10 0.69 -1.49 -0.07 0.09 0.00 0.00 178.44 177.56 1ng9 h LEU 535 N 0.00 0.69 -1.10 1.67 3.38 -1.04 -3.40 115.31 115.51 1ng9 h LEU 535 Ca -0.18 -0.79 0.02 0.00 0.09 0.00 0.00 57.88 57.02 1ng9 h LEU 535 Cb 1.68 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 42.16 1ng9 h LEU 535 CO 0.06 1.63 0.61 -0.07 0.09 0.00 0.00 178.44 180.76 1ng9 h LEU 536 N 0.12 1.03 -1.88 1.67 3.38 -1.37 -2.12 115.31 116.14 1ng9 h LEU 536 Ca -0.25 -0.02 0.25 0.00 0.09 0.00 0.00 57.88 57.95 1ng9 h LEU 536 Cb 2.11 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 42.57 1ng9 h LEU 536 CO 0.24 0.74 0.63 1.55 0.09 0.00 0.00 178.44 181.68 1ng9 h PRO 537 N 1.22 0.09 -0.85 1.13 0.13 -1.77 -2.02 132.00 129.93 1ng9 h PRO 537 Ca 0.35 -0.01 -0.15 0.00 -0.87 0.00 0.00 66.00 65.32 1ng9 h PRO 537 Cb -0.09 -0.02 -0.09 0.00 0.13 0.00 0.00 31.00 30.93 1ng9 h PRO 537 CO -0.09 0.06 0.19 0.72 -0.23 0.00 0.00 178.00 178.65 1ng9 n HIS 538 N -4.33 1.64 -0.15 1.56 8.25 -0.80 -4.61 115.22 116.79 1ng9 n HIS 538 Ca 0.19 -0.87 -0.11 0.00 -0.26 0.00 0.00 57.72 56.67 1ng9 n HIS 538 Cb 0.90 -0.52 -0.01 0.00 1.12 0.00 0.00 29.99 31.48 1ng9 n HIS 538 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1ng9 h LEU 539 N 1.91 0.86 0.27 2.41 5.85 -1.49 -2.36 115.31 122.76 1ng9 h LEU 539 Ca 0.18 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 1ng9 h LEU 539 Cb 1.80 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.60 1ng9 h LEU 539 CO 0.50 1.04 -0.13 -0.08 -0.34 0.00 0.00 178.44 179.43 1ng9 h GLU 540 N 0.68 -0.35 -0.09 1.25 4.81 -1.84 0.03 114.58 119.06 1ng9 h GLU 540 Ca 0.10 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 1ng9 h GLU 540 Cb 0.68 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1ng9 h GLU 540 CO 0.05 -0.23 -0.05 0.00 -0.73 0.00 0.00 179.01 178.05 1ng9 h ALA 541 N 0.37 1.75 -0.16 2.92 0.00 -1.91 -0.39 119.26 121.84 1ng9 h ALA 541 Ca -0.04 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 1ng9 h ALA 541 Cb 0.28 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ng9 h ALA 541 CO 0.06 0.19 -0.44 -0.07 0.00 0.00 0.00 179.25 178.99 1ng9 h LEU 542 N 0.13 0.66 -1.18 0.00 3.38 -0.98 -1.69 115.31 115.64 1ng9 h LEU 542 Ca 0.03 -0.59 -0.04 0.00 0.09 0.00 0.00 57.88 57.38 1ng9 h LEU 542 Cb 0.18 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1ng9 h LEU 542 CO 0.01 1.13 0.16 1.56 0.09 0.00 0.00 178.44 181.39 1ng9 h GLN 543 N 0.22 0.74 -0.33 1.13 4.20 -0.40 -1.66 115.11 119.01 1ng9 h GLN 543 Ca -0.01 -0.12 -0.09 0.00 0.06 0.00 0.00 58.65 58.49 1ng9 h GLN 543 Cb 1.06 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.70 1ng9 h GLN 543 CO 0.09 0.64 -0.17 1.96 -0.67 0.00 0.00 178.83 180.69 1ng9 h GLN 544 N 0.72 0.61 -0.02 1.46 4.20 -0.96 -2.35 115.11 118.77 1ng9 h GLN 544 Ca 0.17 -0.21 -0.12 0.00 0.06 0.00 0.00 58.65 58.55 1ng9 h GLN 544 Cb 0.21 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 1ng9 h GLN 544 CO -0.01 0.75 -0.55 1.03 -0.67 0.00 0.00 178.83 179.38 1ng9 h SER 545 N 0.55 0.07 -0.13 1.46 0.87 -0.63 -0.65 113.55 115.10 1ng9 h SER 545 Ca 0.09 -0.04 -0.18 0.00 -1.23 0.00 0.00 61.79 60.43 1ng9 h SER 545 Cb 0.60 -0.02 0.01 0.00 -0.44 0.00 0.00 62.40 62.55 1ng9 h SER 545 CO 0.04 0.61 -0.64 0.00 -0.53 0.00 0.00 176.83 176.31 1ng9 h ALA 546 N 1.40 0.25 -0.38 6.23 0.00 -1.14 -1.65 119.26 123.97 1ng9 h ALA 546 Ca -0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 1ng9 h ALA 546 Cb 0.99 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1ng9 h ALA 546 CO 0.08 0.53 0.07 1.03 0.00 0.00 0.00 179.25 180.96 1ng9 h SER 547 N 0.33 0.60 -0.23 0.00 0.87 -1.28 0.20 113.55 114.04 1ng9 h SER 547 Ca -0.04 -0.25 -0.05 0.00 -1.23 0.00 0.00 61.79 60.22 1ng9 h SER 547 Cb 1.28 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 63.06 1ng9 h SER 547 CO 0.13 0.69 -0.01 0.00 -0.53 0.00 0.00 176.83 177.11 1ng9 h ALA 548 N 0.93 1.35 -0.12 6.23 0.00 -1.14 -0.69 119.26 125.82 1ng9 h ALA 548 Ca 0.12 -0.21 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 1ng9 h ALA 548 Cb 0.34 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ng9 h ALA 548 CO 0.00 0.45 -0.75 -0.07 0.00 0.00 0.00 179.25 178.88 1ng9 h LEU 549 N 0.51 0.69 -0.37 0.00 3.38 -0.76 -1.51 115.31 117.24 1ng9 h LEU 549 Ca 0.11 -0.45 -0.12 0.00 0.09 0.00 0.00 57.88 57.51 1ng9 h LEU 549 Cb 0.35 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1ng9 h LEU 549 CO 0.01 1.22 -0.22 0.00 0.09 0.00 0.00 178.44 179.54 1ng9 h ALA 550 N 0.77 0.53 -0.37 1.53 0.00 -0.39 -2.16 119.26 119.17 1ng9 h ALA 550 Ca -0.04 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 1ng9 h ALA 550 Cb 1.34 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1ng9 h ALA 550 CO 0.14 0.50 -0.21 1.49 0.00 0.00 0.00 179.25 181.18 1ng9 h GLU 551 N 0.61 0.72 -0.51 0.00 4.81 -1.12 -1.58 114.58 117.50 1ng9 h GLU 551 Ca 0.08 -0.28 0.03 0.00 -0.13 0.00 0.00 59.36 59.06 1ng9 h GLU 551 Cb 0.78 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.09 1ng9 h GLU 551 CO 0.06 0.87 0.30 1.25 -0.73 0.00 0.00 179.01 180.76 1ng9 h LEU 552 N 0.63 0.48 -0.73 1.64 7.12 -1.19 -1.23 115.31 122.03 1ng9 h LEU 552 Ca 0.09 0.01 -0.04 0.00 0.13 0.00 0.00 57.88 58.07 1ng9 h LEU 552 Cb 0.69 -0.09 -0.03 0.00 -0.53 0.00 0.00 40.66 40.70 1ng9 h LEU 552 CO 0.05 0.34 0.29 -0.78 -0.13 0.00 0.00 178.44 178.21 1ng9 h ASP 553 N 0.59 1.02 -0.45 1.25 3.58 -0.99 0.11 116.42 121.53 1ng9 h ASP 553 Ca 0.21 -0.18 -0.03 0.00 0.42 0.00 0.00 57.03 57.45 1ng9 h ASP 553 Cb 0.03 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.80 1ng9 h ASP 553 CO -0.10 0.92 0.18 0.58 -2.88 0.00 0.00 179.24 177.94 1ng9 h VAL 554 N 1.06 1.20 0.19 2.25 2.07 -0.88 -1.27 116.25 120.87 1ng9 h VAL 554 Ca 0.24 -0.63 -0.29 0.00 0.82 0.00 0.00 66.70 66.85 1ng9 h VAL 554 Cb 0.22 0.78 0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1ng9 h VAL 554 CO -0.02 0.23 -1.23 -0.07 0.02 0.00 0.00 177.57 176.50 1ng9 h LEU 555 N 0.58 0.76 -1.40 2.57 3.38 -0.88 -0.55 115.31 119.76 1ng9 h LEU 555 Ca 0.15 -0.90 0.01 0.00 0.09 0.00 0.00 57.88 57.23 1ng9 h LEU 555 Cb 0.19 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1ng9 h LEU 555 CO -0.01 1.60 0.41 0.58 0.09 0.00 0.00 178.44 181.10 1ng9 h VAL 556 N 0.04 1.15 0.18 1.22 2.07 -0.85 -0.73 116.25 119.32 1ng9 h VAL 556 Ca -0.21 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1ng9 h VAL 556 Cb 1.95 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.98 1ng9 h VAL 556 CO 0.23 0.15 -0.08 -1.13 0.02 0.00 0.00 177.57 176.76 1ng9 h ASN 557 N 0.82 -0.20 0.43 0.57 -1.24 -0.95 -2.45 115.58 112.56 1ng9 h ASN 557 Ca 0.23 -0.09 -0.05 0.00 0.71 0.00 0.00 56.30 57.10 1ng9 h ASN 557 Cb -0.07 0.05 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 1ng9 h ASN 557 CO -0.05 -0.03 -0.24 -0.07 -1.29 0.00 0.00 177.43 175.75 1ng9 h LEU 558 N -0.36 0.00 -0.06 0.34 3.38 -0.65 -1.57 115.31 116.39 1ng9 h LEU 558 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1ng9 h LEU 558 Cb 0.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1ng9 h LEU 558 CO 0.04 0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.81 1ng9 h ALA 559 N 1.76 0.08 -0.89 1.53 0.00 -1.07 -1.61 119.26 119.06 1ng9 h ALA 559 Ca -0.00 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1ng9 h ALA 559 Cb 0.52 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1ng9 h ALA 559 CO 0.03 -0.25 0.58 1.49 0.00 0.00 0.00 179.25 181.10 1ng9 h GLU 560 N -0.19 1.18 -0.30 0.00 4.22 -0.90 -2.28 114.58 116.31 1ng9 h GLU 560 Ca 0.02 -0.08 -0.08 0.00 0.08 0.00 0.00 59.36 59.29 1ng9 h GLU 560 Cb 0.33 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1ng9 h GLU 560 CO 0.00 0.79 -0.14 0.00 -2.18 0.00 0.00 179.01 177.48 1ng9 h ARG 561 N 1.21 0.63 -0.82 1.92 2.47 -1.30 0.35 114.38 118.84 1ng9 h ARG 561 Ca 0.33 -0.27 0.10 0.00 -1.26 0.00 0.00 59.98 58.87 1ng9 h ARG 561 Cb -0.12 -0.02 -0.06 0.00 -1.65 0.00 0.00 29.97 28.12 1ng9 h ARG 561 CO -0.07 0.86 0.54 0.00 0.56 0.00 0.00 179.97 181.85 1ng9 h ALA 562 N 0.76 1.73 0.29 0.04 0.00 -1.06 0.20 119.26 121.22 1ng9 h ALA 562 Ca 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ng9 h ALA 562 Cb 0.66 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ng9 h ALA 562 CO 0.04 0.10 -0.14 -0.92 0.00 0.00 0.00 179.25 178.34 1ng9 h TYR 563 N 0.77 -0.36 -0.52 0.00 3.20 -1.22 0.23 116.97 119.07 1ng9 h TYR 563 Ca 0.38 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.26 1ng9 h TYR 563 Cb 0.45 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.81 1ng9 h TYR 563 CO -0.00 -0.22 0.35 1.15 -1.64 0.00 0.00 178.16 177.79 1ng9 h THR 564 N -1.04 1.09 -0.48 1.81 2.02 -0.64 -2.23 112.91 113.45 1ng9 h THR 564 Ca -0.04 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1ng9 h THR 564 Cb 0.30 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1ng9 h THR 564 CO 0.06 0.12 0.00 0.18 0.37 0.00 0.00 175.52 176.25 1ng9 n LEU 565 N -4.47 3.78 -3.37 2.58 4.77 0.68 -5.00 117.00 115.97 1ng9 n LEU 565 Ca 0.05 -2.31 -0.18 0.00 -0.03 0.00 0.00 56.01 53.54 1ng9 n LEU 565 Cb 0.10 -0.42 0.07 0.00 -2.33 0.00 0.00 43.42 40.83 1ng9 n LEU 565 CO 0.35 0.78 0.02 -3.20 -1.33 0.00 0.00 177.39 174.01 1ng9 n ASN 566 N 0.68 -5.56 -4.88 -1.43 5.15 -0.84 -4.98 115.26 103.40 1ng9 n ASN 566 Ca 0.19 -0.76 -0.26 0.00 -0.60 0.00 0.00 54.58 53.15 1ng9 n ASN 566 Cb 0.67 -4.83 -0.04 0.00 -0.53 0.00 0.00 39.78 35.05 1ng9 n ASN 566 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 1ng9 s TYR 567 N -3.42 3.33 0.27 1.20 2.02 0.06 -4.40 117.35 116.41 1ng9 s TYR 567 Ca 0.38 0.06 0.12 0.00 -0.37 0.00 0.00 57.07 57.26 1ng9 s TYR 567 Cb -0.07 -1.60 -0.05 0.00 -0.40 0.00 0.00 41.96 39.84 1ng9 s TYR 567 CO 0.76 0.52 -0.20 -0.08 -1.57 0.00 0.00 175.55 174.98 1ng9 s THR 568 N -1.73 2.42 -0.12 -0.71 -1.32 -0.49 -4.76 115.64 108.94 1ng9 s THR 568 Ca 0.33 -2.35 -0.29 0.00 -1.21 0.00 0.00 61.69 58.17 1ng9 s THR 568 Cb -0.11 -2.26 -0.01 0.00 -1.51 0.00 0.00 72.50 68.61 1ng9 s THR 568 CO 0.26 -0.38 0.98 0.00 -2.21 0.00 0.00 174.62 173.27 1ng9 s PRO 570 N 2.07 3.98 0.28 0.00 0.04 -1.26 -4.65 135.00 135.46 1ng9 s PRO 570 Ca 0.47 1.17 0.09 0.00 0.04 0.00 0.00 61.00 62.77 1ng9 s PRO 570 Cb -0.18 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 1ng9 s PRO 570 CO 0.17 -0.26 0.06 0.95 0.04 0.00 0.00 177.00 177.96 1ng9 s THR 571 N -2.22 3.47 -0.04 1.26 -4.23 -0.73 -5.03 115.64 108.12 1ng9 s THR 571 Ca 0.63 -1.78 0.06 0.00 -1.18 0.00 0.00 61.69 59.42 1ng9 s THR 571 Cb -0.12 -2.96 -0.02 0.00 1.34 0.00 0.00 72.50 70.74 1ng9 s THR 571 CO 0.20 -0.32 -0.21 -0.36 -0.54 0.00 0.00 174.62 173.40 1ng9 s PHE 572 N -2.33 2.51 0.39 3.99 0.08 -1.26 -1.33 117.98 120.03 1ng9 s PHE 572 Ca 0.33 -0.39 0.08 0.00 0.12 0.00 0.00 56.93 57.07 1ng9 s PHE 572 Cb -0.06 -1.58 -0.04 0.00 -0.57 0.00 0.00 43.02 40.77 1ng9 s PHE 572 CO 0.21 0.01 0.21 0.96 -0.10 0.00 0.00 175.22 176.51 1ng9 s ILE 573 N -0.53 2.61 0.14 0.64 -4.36 -0.85 -4.89 121.20 113.95 1ng9 s ILE 573 Ca 0.07 -1.63 0.17 0.00 -0.26 0.00 0.00 60.65 59.01 1ng9 s ILE 573 Cb -0.11 -2.99 0.10 0.00 1.25 0.00 0.00 42.46 40.71 1ng9 s ILE 573 CO 0.01 -0.06 1.68 0.44 0.24 0.00 0.00 174.94 177.24 1ng9 h ASP 574 N 1.39 0.00 -2.73 4.36 3.32 -1.99 -3.38 116.42 117.40 1ng9 h ASP 574 Ca -0.43 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.10 1ng9 h ASP 574 Cb 1.26 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.66 1ng9 h ASP 574 CO 0.65 0.43 -0.73 -0.54 -1.72 0.00 0.00 179.24 177.33 1ng9 s LYS 575 N -3.51 1.52 0.30 3.56 1.02 -1.26 -4.74 119.74 116.64 1ng9 s LYS 575 Ca 0.00 -1.71 -0.26 0.00 0.02 0.00 0.00 55.97 54.02 1ng9 s LYS 575 Cb 0.11 -1.39 -0.15 0.00 -0.52 0.00 0.00 37.83 35.88 1ng9 s LYS 575 CO 0.70 0.20 0.65 -2.30 -0.92 0.00 0.00 175.35 173.69 1ng9 n PRO 576 N -0.53 0.58 0.00 -1.68 -0.02 -1.26 -4.03 135.00 128.06 1ng9 n PRO 576 Ca -0.06 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1ng9 n PRO 576 Cb 0.61 -1.40 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 1ng9 n PRO 576 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ng9 n GLY 577 N 1.72 3.88 2.74 -1.23 0.00 -1.26 -4.14 105.19 106.90 1ng9 n GLY 577 Ca 0.13 -0.64 -0.21 0.00 0.00 0.00 0.00 46.02 45.30 1ng9 n GLY 577 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ng9 s ILE 578 N -1.83 0.16 -0.28 -0.61 1.01 -0.17 -0.28 121.20 119.19 1ng9 s ILE 578 Ca 0.00 0.23 0.03 0.00 0.00 0.00 0.00 60.65 60.91 1ng9 s ILE 578 Cb 0.00 -0.34 0.07 0.00 0.01 0.00 0.00 42.46 42.20 1ng9 s ILE 578 CO 0.00 0.21 -0.05 -0.13 0.00 0.00 0.00 174.94 174.97 1ng9 s ARG 579 N 1.86 1.88 -0.09 2.79 0.52 0.25 -1.17 118.95 124.99 1ng9 s ARG 579 Ca 0.02 -1.42 -0.00 0.00 -0.52 0.00 0.00 55.73 53.81 1ng9 s ARG 579 Cb -0.12 -2.89 -0.03 0.00 0.52 0.00 0.00 34.95 32.42 1ng9 s ARG 579 CO -0.04 -0.69 -0.07 0.42 0.02 0.00 0.00 175.30 174.95 1ng9 s ILE 580 N 1.11 3.71 -0.16 1.52 1.01 -0.30 -1.43 121.20 126.66 1ng9 s ILE 580 Ca -0.02 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.17 1ng9 s ILE 580 Cb -0.19 -2.54 0.01 0.00 0.01 0.00 0.00 42.46 39.74 1ng9 s ILE 580 CO -0.07 0.57 -0.18 -0.89 0.00 0.00 0.00 174.94 174.37 1ng9 s THR 581 N -0.47 2.36 -1.25 2.92 2.01 -0.24 -2.17 115.64 118.80 1ng9 s THR 581 Ca 0.07 -0.87 -0.20 0.00 0.31 0.00 0.00 61.69 61.00 1ng9 s THR 581 Cb -0.12 -1.98 0.01 0.00 0.01 0.00 0.00 72.50 70.42 1ng9 s THR 581 CO 0.02 0.53 0.62 -0.62 -0.69 0.00 0.00 174.62 174.48 1ng9 n GLU 582 N 4.21 -1.22 -3.15 4.92 -0.58 -1.26 -0.99 120.64 122.57 1ng9 n GLU 582 Ca -0.20 0.28 -0.31 0.00 -0.42 0.00 0.00 57.16 56.52 1ng9 n GLU 582 Cb 0.51 -3.59 -0.04 0.00 -0.57 0.00 0.00 31.44 27.75 1ng9 n GLU 582 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1ng9 s GLY 583 N -3.73 2.11 0.09 0.62 0.00 -0.85 -2.99 107.32 102.58 1ng9 s GLY 583 Ca 0.36 -0.22 0.02 0.00 0.00 0.00 0.00 44.72 44.88 1ng9 s GLY 583 CO 0.92 -0.06 -0.07 0.50 0.00 0.00 0.00 173.10 174.39 1ng9 s ARG 584 N -3.32 0.80 -0.39 2.90 3.00 -0.26 -1.61 118.95 120.08 1ng9 s ARG 584 Ca 0.50 -1.23 -0.29 0.00 0.00 0.00 0.00 55.73 54.71 1ng9 s ARG 584 Cb -0.11 -0.28 0.01 0.00 0.00 0.00 0.00 34.95 34.58 1ng9 s ARG 584 CO 0.25 0.01 1.24 -1.58 0.00 0.00 0.00 175.30 175.22 1ng9 s HIS 585 N -3.10 2.73 0.65 -0.53 5.65 -1.26 -4.77 115.29 114.66 1ng9 s HIS 585 Ca 0.08 0.83 0.40 0.00 0.25 0.00 0.00 55.06 56.61 1ng9 s HIS 585 Cb 0.02 -4.14 2.22 0.00 -1.18 0.00 0.00 32.58 29.50 1ng9 s HIS 585 CO -0.03 -1.48 2.30 -1.00 -0.65 0.00 0.00 174.74 173.88 1ng9 h PRO 586 N 9.42 0.00 0.00 2.88 0.13 -1.92 -1.90 132.00 140.61 1ng9 h PRO 586 Ca -0.25 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.47 1ng9 h PRO 586 Cb 1.08 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.15 1ng9 h PRO 586 CO 1.08 0.00 -2.32 0.28 -0.23 0.00 0.00 178.00 176.81 1ng9 n VAL 587 N -3.25 1.53 0.21 1.56 0.31 -1.26 -4.23 118.33 113.21 1ng9 n VAL 587 Ca -0.03 -0.35 0.06 0.00 -0.01 0.00 0.00 64.34 64.01 1ng9 n VAL 587 Cb 0.11 -1.86 0.55 0.00 -0.91 0.00 0.00 33.84 31.74 1ng9 n VAL 587 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1ng9 h VAL 588 N -0.88 1.07 -0.05 2.52 2.07 -1.91 -1.66 116.25 117.41 1ng9 h VAL 588 Ca -0.63 -0.30 -0.09 0.00 0.82 0.00 0.00 66.70 66.50 1ng9 h VAL 588 Cb 1.60 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.45 1ng9 h VAL 588 CO -0.35 0.09 -0.40 1.05 0.02 0.00 0.00 177.57 177.98 1ng9 h GLU 589 N 0.06 0.10 0.10 1.57 4.11 -1.56 -2.10 114.58 116.86 1ng9 h GLU 589 Ca 0.02 -0.04 -0.21 0.00 0.07 0.00 0.00 59.36 59.19 1ng9 h GLU 589 Cb 0.14 -0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.41 1ng9 h GLU 589 CO 0.01 0.49 -0.89 1.96 0.07 0.00 0.00 179.01 180.65 1ng9 h GLN 590 N 0.09 0.43 0.00 1.06 1.08 -1.49 -3.36 115.11 112.92 1ng9 h GLN 590 Ca 0.01 -0.59 -0.02 0.00 -1.45 0.00 0.00 58.65 56.59 1ng9 h GLN 590 Cb 0.75 0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 28.37 1ng9 h GLN 590 CO 0.06 1.24 -0.13 -0.39 -0.95 0.00 0.00 178.83 178.66 1ng9 h VAL 591 N -0.10 0.17 -3.11 -0.54 -1.51 -1.43 -3.45 116.25 106.27 1ng9 h VAL 591 Ca -0.14 -1.24 -0.55 0.00 -1.23 0.00 0.00 66.70 63.54 1ng9 h VAL 591 Cb 1.63 2.07 -0.02 0.00 -2.13 0.00 0.00 31.29 32.84 1ng9 h VAL 591 CO 0.17 0.10 0.68 -0.22 -1.23 0.00 0.00 177.57 177.06 1ng9 s LEU 592 N -6.24 4.28 -1.23 4.19 2.96 -0.79 -4.94 118.68 116.91 1ng9 s LEU 592 Ca 0.06 1.79 -0.13 0.00 -0.22 0.00 0.00 54.13 55.63 1ng9 s LEU 592 Cb 0.06 -3.56 0.17 0.00 0.50 0.00 0.00 46.19 43.35 1ng9 s LEU 592 CO 0.69 -0.56 1.52 0.59 -1.32 0.00 0.00 176.35 177.27 1ng9 n ASN 593 N 5.11 5.18 0.00 3.68 5.03 -1.26 -4.79 115.26 128.21 1ng9 n ASN 593 Ca 0.11 -2.99 0.00 0.00 0.87 0.00 0.00 54.58 52.56 1ng9 n ASN 593 Cb 0.47 -1.57 0.00 0.00 -1.02 0.00 0.00 39.78 37.66 1ng9 n ASN 593 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 1ng9 n GLU 594 N 5.52 0.00 -2.65 3.52 0.28 -1.26 -5.14 120.64 120.90 1ng9 n GLU 594 Ca 0.38 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.96 1ng9 n GLU 594 Cb 0.42 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 33.26 1ng9 n GLU 594 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1ng9 s PRO 595 N -2.46 4.56 0.00 3.44 0.04 -1.26 -4.98 135.00 134.33 1ng9 s PRO 595 Ca 0.00 1.50 -0.30 0.00 0.04 0.00 0.00 61.00 62.24 1ng9 s PRO 595 Cb 0.00 -3.42 -0.05 0.00 0.04 0.00 0.00 34.50 31.07 1ng9 s PRO 595 CO 0.00 -0.04 1.28 0.12 0.04 0.00 0.00 177.00 178.40 1ng9 s PHE 596 N 0.81 3.14 -0.42 0.56 5.36 -1.26 -4.98 117.98 121.19 1ng9 s PHE 596 Ca 0.52 1.08 -0.29 0.00 -0.96 0.00 0.00 56.93 57.29 1ng9 s PHE 596 Cb -0.23 -3.52 0.02 0.00 -0.34 0.00 0.00 43.02 38.95 1ng9 s PHE 596 CO 0.29 -1.76 1.22 0.42 -1.46 0.00 0.00 175.22 173.92 1ng9 s ILE 597 N 1.94 4.17 0.66 3.12 -1.09 -1.26 -5.01 121.20 123.73 1ng9 s ILE 597 Ca 0.60 1.23 -0.14 0.00 -2.23 0.00 0.00 60.65 60.11 1ng9 s ILE 597 Cb -0.29 -4.43 -0.00 0.00 -1.58 0.00 0.00 42.46 36.16 1ng9 s ILE 597 CO 0.26 -0.82 1.09 0.00 -1.23 0.00 0.00 174.94 174.23 1ng9 s ALA 598 N 4.58 2.54 -0.13 9.38 0.00 -1.26 -4.92 121.76 131.94 1ng9 s ALA 598 Ca 0.52 0.40 -0.12 0.00 0.00 0.00 0.00 51.96 52.76 1ng9 s ALA 598 Cb -0.10 -3.27 0.03 0.00 0.00 0.00 0.00 23.12 19.78 1ng9 s ALA 598 CO 0.29 -1.21 0.34 -0.80 0.00 0.00 0.00 175.76 174.38 1ng9 s ASN 599 N -2.93 -0.36 0.77 0.00 0.01 -0.63 -4.83 114.94 106.98 1ng9 s ASN 599 Ca 0.64 0.69 -0.10 0.00 -0.71 0.00 0.00 52.86 53.38 1ng9 s ASN 599 Cb -0.18 0.69 0.08 0.00 0.41 0.00 0.00 41.25 42.25 1ng9 s ASN 599 CO 0.44 -0.12 1.11 -2.16 -1.51 0.00 0.00 177.10 174.86 1ng9 s PRO 600 N 0.25 1.96 -0.22 -0.60 0.05 -1.26 -2.00 135.00 133.17 1ng9 s PRO 600 Ca -0.01 -0.12 -0.15 0.00 0.05 0.00 0.00 61.00 60.77 1ng9 s PRO 600 Cb -0.03 -2.05 0.07 0.00 0.05 0.00 0.00 34.50 32.54 1ng9 s PRO 600 CO -0.00 -1.50 0.57 -1.17 0.05 0.00 0.00 177.00 174.95 1ng9 s LEU 601 N -5.44 -0.44 -0.21 -3.56 2.96 -0.92 -4.93 118.68 106.14 1ng9 s LEU 601 Ca 0.62 1.21 0.02 0.00 -0.22 0.00 0.00 54.13 55.75 1ng9 s LEU 601 Cb -0.10 1.93 0.04 0.00 0.50 0.00 0.00 46.19 48.55 1ng9 s LEU 601 CO 0.47 -0.21 -0.16 0.21 -1.32 0.00 0.00 176.35 175.34 1ng9 s ASN 602 N 1.12 3.60 -0.03 3.68 2.47 -1.26 -1.14 114.94 123.38 1ng9 s ASN 602 Ca -0.07 -0.93 0.03 0.00 0.42 0.00 0.00 52.86 52.31 1ng9 s ASN 602 Cb -0.06 -1.47 0.00 0.00 -1.45 0.00 0.00 41.25 38.27 1ng9 s ASN 602 CO -0.11 -0.08 -0.11 -0.76 -3.72 0.00 0.00 177.10 172.32 1ng9 s LEU 603 N 1.24 1.82 0.32 3.21 1.43 -0.31 -4.95 118.68 121.44 1ng9 s LEU 603 Ca -0.00 -0.22 -0.16 0.00 -1.03 0.00 0.00 54.13 52.71 1ng9 s LEU 603 Cb -0.16 -0.64 0.03 0.00 0.03 0.00 0.00 46.19 45.45 1ng9 s LEU 603 CO -0.10 0.09 0.69 -0.94 0.23 0.00 0.00 176.35 176.32 1ng9 s SER 604 N 0.14 -0.02 0.54 2.29 1.04 -0.40 -1.00 113.70 116.29 1ng9 s SER 604 Ca -0.03 -0.95 0.29 0.00 0.48 0.00 0.00 55.95 55.74 1ng9 s SER 604 Cb -0.09 0.75 1.53 0.00 0.10 0.00 0.00 66.02 68.31 1ng9 s SER 604 CO 0.01 -1.44 2.10 -0.65 0.98 0.00 0.00 173.24 174.24 1ng9 h PRO 605 N 2.05 0.00 0.14 4.02 0.11 -1.97 -1.83 132.00 134.52 1ng9 h PRO 605 Ca -0.26 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.53 1ng9 h PRO 605 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1ng9 h PRO 605 CO 0.33 0.10 -1.61 1.96 -0.21 0.00 0.00 178.00 178.57 1ng9 h GLN 606 N 0.00 0.29 -2.53 1.05 7.50 -1.95 -3.40 115.11 116.07 1ng9 h GLN 606 Ca -0.00 -0.50 -0.65 0.00 0.50 0.00 0.00 58.65 58.00 1ng9 h GLN 606 Cb 0.29 0.19 -0.39 0.00 0.05 0.00 0.00 27.48 27.62 1ng9 h GLN 606 CO 0.01 1.17 -0.29 -2.13 -1.50 0.00 0.00 178.83 176.09 1ng9 n ARG 607 N -3.49 2.83 -0.01 1.46 0.63 -1.00 -3.83 116.66 113.25 1ng9 n ARG 607 Ca -0.19 -4.62 0.10 0.00 -0.92 0.00 0.00 57.85 52.22 1ng9 n ARG 607 Cb 1.05 -2.32 -0.14 0.00 0.45 0.00 0.00 32.46 31.50 1ng9 n ARG 607 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 1ng9 n ARG 608 N 1.19 0.51 -4.27 -0.14 1.85 -0.72 -1.28 116.66 113.80 1ng9 n ARG 608 Ca 0.27 -0.12 -0.23 0.00 -1.00 0.00 0.00 57.85 56.77 1ng9 n ARG 608 Cb 0.38 -1.48 -0.17 0.00 -1.05 0.00 0.00 32.46 30.15 1ng9 n ARG 608 CO 0.00 0.00 0.00 1.41 -0.01 0.00 0.00 177.63 179.03 1ng9 s MET 609 N -3.25 1.29 -0.18 2.89 0.00 -0.25 -0.24 119.30 119.56 1ng9 s MET 609 Ca -0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 55.69 55.39 1ng9 s MET 609 Cb 0.14 -1.21 -0.02 0.00 0.00 0.00 0.00 34.83 33.75 1ng9 s MET 609 CO 0.86 -0.08 -0.05 -0.51 0.00 0.00 0.00 175.02 175.23 1ng9 s LEU 610 N 1.01 3.04 -0.23 4.11 1.43 -0.56 -1.17 118.68 126.31 1ng9 s LEU 610 Ca -0.09 -0.26 -0.22 0.00 -1.03 0.00 0.00 54.13 52.53 1ng9 s LEU 610 Cb -0.15 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 1ng9 s LEU 610 CO -0.00 0.09 0.69 -0.63 0.23 0.00 0.00 176.35 176.73 1ng9 s ILE 611 N 0.81 4.95 -0.22 -0.59 -1.09 0.36 -1.60 121.20 123.82 1ng9 s ILE 611 Ca -0.02 1.29 -0.06 0.00 -2.23 0.00 0.00 60.65 59.63 1ng9 s ILE 611 Cb -0.15 -4.00 -0.03 0.00 -1.58 0.00 0.00 42.46 36.71 1ng9 s ILE 611 CO 0.02 0.03 0.03 -0.63 -1.23 0.00 0.00 174.94 173.16 1ng9 s ILE 612 N 2.35 4.10 0.38 2.92 1.01 -0.74 -0.61 121.20 130.61 1ng9 s ILE 612 Ca 0.30 -0.25 0.05 0.00 0.00 0.00 0.00 60.65 60.74 1ng9 s ILE 612 Cb -0.16 -2.88 -0.06 0.00 0.01 0.00 0.00 42.46 39.37 1ng9 s ILE 612 CO 0.09 0.39 0.04 0.42 0.00 0.00 0.00 174.94 175.89 1ng9 s THR 613 N 1.28 1.39 0.00 2.92 -4.23 -0.87 -2.29 115.64 113.83 1ng9 s THR 613 Ca 0.04 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 1ng9 s THR 613 Cb -0.15 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 70.95 1ng9 s THR 613 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 1ng9 n GLY 614 N -0.87 3.47 3.72 3.99 0.00 -1.26 -0.88 105.19 113.36 1ng9 n GLY 614 Ca -0.05 -1.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.04 1ng9 n GLY 614 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ng9 s PRO 615 N -2.26 1.50 0.21 1.61 0.04 -1.26 -4.85 135.00 129.98 1ng9 s PRO 615 Ca 0.00 1.08 -0.32 0.00 0.04 0.00 0.00 61.00 61.79 1ng9 s PRO 615 Cb 0.00 -1.82 -0.13 0.00 0.04 0.00 0.00 34.50 32.59 1ng9 s PRO 615 CO 0.00 -2.15 1.50 -1.71 0.04 0.00 0.00 177.00 174.68 1ng9 n ASN 616 N -3.85 2.99 -0.27 6.66 5.15 -1.26 -1.10 115.26 123.58 1ng9 n ASN 616 Ca 0.08 1.12 -0.03 0.00 -0.60 0.00 0.00 54.58 55.14 1ng9 n ASN 616 Cb 0.54 -1.44 -0.01 0.00 -0.53 0.00 0.00 39.78 38.33 1ng9 n ASN 616 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 1ng9 n MET 617 N 2.67 -0.68 0.21 1.20 2.81 -1.26 -4.92 117.12 117.16 1ng9 n MET 617 Ca 0.14 0.45 0.13 0.00 -1.81 0.00 0.00 57.70 56.60 1ng9 n MET 617 Cb 0.31 -4.14 0.26 0.00 -0.71 0.00 0.00 33.22 28.94 1ng9 n MET 617 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1ng9 h GLY 618 N 0.00 0.00 0.00 3.03 0.00 -1.44 -3.48 103.07 101.18 1ng9 h GLY 618 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1ng9 h GLY 618 CO 0.10 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.25 1ng9 n GLY 619 N 0.97 1.64 0.09 4.60 0.00 -1.26 -4.16 105.19 107.07 1ng9 n GLY 619 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 1ng9 n GLY 619 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ng9 h LYS 620 N 0.00 0.17 -0.61 1.61 1.57 -1.91 -2.63 116.57 114.76 1ng9 h LYS 620 Ca 0.00 -0.13 -0.09 0.00 -1.87 0.00 0.00 60.65 58.56 1ng9 h LYS 620 Cb 0.00 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1ng9 h LYS 620 CO 0.00 0.78 0.01 0.77 -0.57 0.00 0.00 179.45 180.44 1ng9 h SER 621 N -0.41 1.04 -0.72 0.86 0.02 -1.98 -2.80 113.55 109.56 1ng9 h SER 621 Ca -0.01 -0.30 0.02 0.00 -0.84 0.00 0.00 61.79 60.66 1ng9 h SER 621 Cb 0.80 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 63.02 1ng9 h SER 621 CO 0.03 1.08 0.47 0.74 -1.14 0.00 0.00 176.83 178.01 1ng9 h THR 622 N 0.96 1.15 -0.53 -2.27 2.02 -2.00 -1.91 112.91 110.32 1ng9 h THR 622 Ca 0.17 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 1ng9 h THR 622 Cb 0.54 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 1ng9 h THR 622 CO 0.03 0.17 0.32 0.22 0.37 0.00 0.00 175.52 176.63 1ng9 h TYR 623 N 0.93 0.69 0.18 3.16 3.20 -1.21 -1.90 116.97 122.02 1ng9 h TYR 623 Ca 0.27 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 1ng9 h TYR 623 Cb -0.05 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 37.99 1ng9 h TYR 623 CO -0.03 0.46 -0.09 0.52 -1.64 0.00 0.00 178.16 177.38 1ng9 h MET 624 N 0.73 -0.23 -0.57 1.82 2.86 -1.24 -3.11 114.93 115.18 1ng9 h MET 624 Ca 0.19 0.02 0.11 0.00 -2.06 0.00 0.00 59.70 57.96 1ng9 h MET 624 Cb -0.03 0.05 -0.11 0.00 0.06 0.00 0.00 31.60 31.57 1ng9 h MET 624 CO -0.04 0.18 -0.17 0.00 1.06 0.00 0.00 176.91 177.94 1ng9 h ARG 625 N -0.87 -0.03 0.00 1.72 3.08 -1.31 -1.78 114.38 115.19 1ng9 h ARG 625 Ca -0.02 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 1ng9 h ARG 625 Cb 0.52 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 1ng9 h ARG 625 CO 0.04 -0.02 -0.13 -0.56 -1.07 0.00 0.00 179.97 178.23 1ng9 h GLN 626 N -0.03 0.00 -0.08 0.04 3.07 -1.43 0.11 115.11 116.79 1ng9 h GLN 626 Ca 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 59.01 1ng9 h GLN 626 Cb 0.45 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.00 1ng9 h GLN 626 CO -0.60 0.13 0.03 1.15 0.09 0.00 0.00 178.83 179.63 1ng9 h THR 627 N 0.00 1.16 -0.11 1.86 2.02 -1.26 -2.27 112.91 114.31 1ng9 h THR 627 Ca -0.00 -0.48 -0.11 0.00 0.77 0.00 0.00 66.41 66.58 1ng9 h THR 627 Cb 0.36 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1ng9 h THR 627 CO 0.02 0.14 -0.44 0.00 0.37 0.00 0.00 175.52 175.60 1ng9 h ALA 628 N 0.85 1.05 -0.16 6.16 0.00 -0.74 -1.53 119.26 124.89 1ng9 h ALA 628 Ca 0.03 -0.43 -0.17 0.00 0.00 0.00 0.00 54.91 54.33 1ng9 h ALA 628 Cb 0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ng9 h ALA 628 CO -0.00 0.62 -0.61 -0.07 0.00 0.00 0.00 179.25 179.18 1ng9 h LEU 629 N 0.21 0.62 -0.86 0.00 3.38 -0.88 -0.05 115.31 117.72 1ng9 h LEU 629 Ca 0.02 -0.35 -0.10 0.00 0.09 0.00 0.00 57.88 57.53 1ng9 h LEU 629 Cb 0.87 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1ng9 h LEU 629 CO 0.07 1.08 -0.26 0.40 0.09 0.00 0.00 178.44 179.83 1ng9 h ILE 630 N 0.40 1.27 -0.09 1.22 2.04 -1.23 0.77 117.51 121.89 1ng9 h ILE 630 Ca -0.01 -1.31 -0.03 0.00 1.00 0.00 0.00 64.86 64.52 1ng9 h ILE 630 Cb 1.17 1.33 -0.00 0.00 -0.74 0.00 0.00 36.82 38.58 1ng9 h ILE 630 CO 0.11 0.42 -0.05 0.00 0.00 0.00 0.00 178.15 178.64 1ng9 h ALA 631 N 1.24 0.12 -0.13 1.87 0.00 -1.15 -1.86 119.26 119.36 1ng9 h ALA 631 Ca 0.07 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.78 1ng9 h ALA 631 Cb 0.70 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 1ng9 h ALA 631 CO 0.05 -0.11 -0.26 1.25 0.00 0.00 0.00 179.25 180.19 1ng9 h LEU 632 N -0.19 -0.79 -0.59 0.00 6.46 -0.90 -2.36 115.31 116.94 1ng9 h LEU 632 Ca 0.02 0.12 -0.05 0.00 -0.12 0.00 0.00 57.88 57.86 1ng9 h LEU 632 Cb 0.50 0.35 -0.02 0.00 -0.73 0.00 0.00 40.66 40.75 1ng9 h LEU 632 CO 0.01 -0.31 0.18 0.24 -0.62 0.00 0.00 178.44 177.95 1ng9 h MET 633 N -0.33 0.92 -0.51 1.25 2.86 -0.89 -2.10 114.93 116.13 1ng9 h MET 633 Ca 0.10 -0.20 0.05 0.00 -2.06 0.00 0.00 59.70 57.59 1ng9 h MET 633 Cb 0.48 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 1ng9 h MET 633 CO -0.31 0.82 0.34 0.00 1.06 0.00 0.00 176.91 178.82 1ng9 h ALA 634 N 1.05 1.85 -0.59 6.32 0.00 -1.22 -2.55 119.26 124.12 1ng9 h ALA 634 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ng9 h ALA 634 Cb 0.29 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ng9 h ALA 634 CO -0.01 0.07 0.00 0.66 0.00 0.00 0.00 179.25 179.97 1ng9 n TYR 635 N -4.47 1.66 0.54 0.00 4.02 -0.82 -3.05 117.16 115.04 1ng9 n TYR 635 Ca 0.06 -0.62 0.06 0.00 -0.01 0.00 0.00 57.90 57.40 1ng9 n TYR 635 Cb 0.21 -0.34 0.04 0.00 -0.02 0.00 0.00 39.34 39.23 1ng9 n TYR 635 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 176.86 176.29 1ng9 n ILE 636 N 0.89 0.00 -0.02 -0.72 -5.35 -1.03 -0.44 119.36 112.68 1ng9 n ILE 636 Ca 0.25 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 1ng9 n ILE 636 Cb 0.98 1.24 0.00 0.00 -1.74 0.00 0.00 39.64 40.12 1ng9 n ILE 636 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ng9 n GLY 637 N 0.80 0.34 3.84 3.28 0.00 -1.17 -4.98 105.19 107.29 1ng9 n GLY 637 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1ng9 n GLY 637 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ng9 s SER 638 N -2.41 6.24 0.98 1.61 0.15 -0.99 -3.69 113.70 115.59 1ng9 s SER 638 Ca 0.00 1.61 -0.12 0.00 0.70 0.00 0.00 55.95 58.13 1ng9 s SER 638 Cb 0.00 -2.51 0.18 0.00 -1.71 0.00 0.00 66.02 61.98 1ng9 s SER 638 CO 0.00 -0.85 1.11 -0.31 1.20 0.00 0.00 173.24 174.38 1ng9 s TYR 639 N -2.72 2.22 0.02 3.44 1.51 -1.26 -4.24 117.35 116.32 1ng9 s TYR 639 Ca 0.59 0.93 0.03 0.00 -1.01 0.00 0.00 57.07 57.61 1ng9 s TYR 639 Cb -0.12 -3.31 -0.01 0.00 -0.11 0.00 0.00 41.96 38.40 1ng9 s TYR 639 CO 0.39 -2.76 -0.10 0.08 -1.11 0.00 0.00 175.55 172.05 1ng9 s VAL 640 N -3.07 0.76 -1.22 0.71 1.01 -0.31 -4.79 120.40 113.49 1ng9 s VAL 640 Ca 0.65 -0.70 -0.20 0.00 0.00 0.00 0.00 61.98 61.73 1ng9 s VAL 640 Cb -0.17 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.50 1ng9 s VAL 640 CO 0.56 0.01 1.87 -0.81 0.00 0.00 0.00 175.10 176.73 1ng9 n PRO 641 N 2.28 2.37 -3.67 2.72 -0.04 -1.26 -1.39 135.00 136.01 1ng9 n PRO 641 Ca -0.17 -2.77 -0.04 0.00 -0.04 0.00 0.00 63.50 60.48 1ng9 n PRO 641 Cb 0.56 -3.53 -0.01 0.00 -0.04 0.00 0.00 33.50 30.47 1ng9 n PRO 641 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ng9 s ALA 642 N 7.07 -1.82 -0.07 0.55 0.00 -1.26 -1.10 121.76 125.13 1ng9 s ALA 642 Ca 0.60 0.51 0.24 0.00 0.00 0.00 0.00 51.96 53.32 1ng9 s ALA 642 Cb 0.04 0.49 0.73 0.00 0.00 0.00 0.00 23.12 24.38 1ng9 s ALA 642 CO 0.09 -0.94 1.74 0.37 0.00 0.00 0.00 175.76 177.03 1ng9 h GLN 643 N 2.00 0.00 -1.02 0.00 4.15 -0.96 -3.31 115.11 115.97 1ng9 h GLN 643 Ca -0.24 0.00 0.21 0.00 0.77 0.00 0.00 58.65 59.39 1ng9 h GLN 643 Cb 1.22 0.00 -0.34 0.00 0.21 0.00 0.00 27.48 28.58 1ng9 h GLN 643 CO 0.27 0.16 0.83 0.21 -1.93 0.00 0.00 178.83 178.37 1ng9 s LYS 644 N -3.43 0.02 -0.02 1.69 2.20 -1.16 -4.96 119.74 114.08 1ng9 s LYS 644 Ca 0.03 0.02 0.03 0.00 -0.36 0.00 0.00 55.97 55.70 1ng9 s LYS 644 Cb 0.08 0.00 -0.00 0.00 -1.51 0.00 0.00 37.83 36.40 1ng9 s LYS 644 CO 0.64 -0.00 -0.12 0.08 -0.36 0.00 0.00 175.35 175.59 1ng9 s VAL 645 N 0.71 0.96 -0.16 4.02 1.01 -1.26 -1.08 120.40 124.60 1ng9 s VAL 645 Ca -0.03 -0.48 -0.00 0.00 0.00 0.00 0.00 61.98 61.47 1ng9 s VAL 645 Cb -0.03 -0.83 0.04 0.00 0.00 0.00 0.00 36.38 35.56 1ng9 s VAL 645 CO -0.11 0.28 -0.08 -1.61 0.00 0.00 0.00 175.10 173.58 1ng9 s GLU 646 N -0.01 1.66 -0.03 2.72 2.02 -0.52 -1.78 118.70 122.77 1ng9 s GLU 646 Ca -0.00 -0.53 0.02 0.00 0.02 0.00 0.00 54.97 54.47 1ng9 s GLU 646 Cb -0.08 -2.02 0.01 0.00 0.10 0.00 0.00 34.13 32.14 1ng9 s GLU 646 CO 0.00 -0.38 -0.08 -1.50 0.02 0.00 0.00 175.26 173.33 1ng9 s ILE 647 N 1.59 0.71 0.80 -1.63 2.07 -0.44 -0.59 121.20 123.71 1ng9 s ILE 647 Ca 0.02 -0.31 -0.07 0.00 -1.41 0.00 0.00 60.65 58.88 1ng9 s ILE 647 Cb -0.15 -0.65 0.13 0.00 0.13 0.00 0.00 42.46 41.92 1ng9 s ILE 647 CO -0.08 0.23 1.11 -0.83 -1.91 0.00 0.00 174.94 173.46 1ng9 s GLY 648 N 0.33 1.75 0.24 1.50 0.00 0.61 -2.00 107.32 109.75 1ng9 s GLY 648 Ca -0.05 -1.35 -0.30 0.00 0.00 0.00 0.00 44.72 43.02 1ng9 s GLY 648 CO 0.01 -0.76 1.42 2.56 0.00 0.00 0.00 173.10 176.33 1ng9 s PRO 649 N -5.42 4.28 -0.06 2.90 0.04 -1.26 -4.77 135.00 130.71 1ng9 s PRO 649 Ca 0.67 2.27 0.05 0.00 0.04 0.00 0.00 61.00 64.03 1ng9 s PRO 649 Cb -0.06 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.34 1ng9 s PRO 649 CO 0.47 -0.40 -0.20 0.42 0.04 0.00 0.00 177.00 177.33 1ng9 s ILE 650 N 0.01 2.48 -0.17 0.56 1.01 -1.26 -4.58 121.20 119.25 1ng9 s ILE 650 Ca 0.59 -0.92 0.10 0.00 0.00 0.00 0.00 60.65 60.42 1ng9 s ILE 650 Cb -0.41 -1.94 -0.23 0.00 0.01 0.00 0.00 42.46 39.89 1ng9 s ILE 650 CO 0.43 0.57 0.16 -0.90 0.00 0.00 0.00 174.94 175.19 1ng9 n ASP 651 N 2.82 0.92 -3.67 3.58 5.75 -0.89 -4.70 116.55 120.36 1ng9 n ASP 651 Ca -0.17 0.08 -0.14 0.00 -0.01 0.00 0.00 54.79 54.55 1ng9 n ASP 651 Cb 0.52 0.21 -0.08 0.00 -1.03 0.00 0.00 41.12 40.74 1ng9 n ASP 651 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1ng9 s ARG 652 N -2.53 0.70 -0.13 0.11 0.52 -1.26 -2.42 118.95 113.94 1ng9 s ARG 652 Ca -0.16 0.84 -0.02 0.00 -0.52 0.00 0.00 55.73 55.86 1ng9 s ARG 652 Cb 0.07 0.34 -0.03 0.00 0.52 0.00 0.00 34.95 35.85 1ng9 s ARG 652 CO 0.77 -0.08 -0.05 0.42 0.02 0.00 0.00 175.30 176.37 1ng9 s ILE 653 N 0.34 3.79 -0.07 1.52 1.01 -0.56 -0.97 121.20 126.26 1ng9 s ILE 653 Ca -0.00 -0.41 0.05 0.00 0.00 0.00 0.00 60.65 60.29 1ng9 s ILE 653 Cb -0.04 -2.63 -0.01 0.00 0.01 0.00 0.00 42.46 39.79 1ng9 s ILE 653 CO 0.00 0.52 -0.24 -0.36 0.00 0.00 0.00 174.94 174.86 1ng9 s PHE 654 N 0.08 2.44 -0.11 3.97 0.08 -0.53 -2.82 117.98 121.09 1ng9 s PHE 654 Ca -0.01 -0.82 0.02 0.00 0.12 0.00 0.00 56.93 56.24 1ng9 s PHE 654 Cb -0.14 -1.61 0.01 0.00 -0.57 0.00 0.00 43.02 40.71 1ng9 s PHE 654 CO 0.03 -0.28 -0.18 0.99 -0.10 0.00 0.00 175.22 175.68 1ng9 s THR 655 N 0.01 1.73 -0.32 0.64 2.01 -1.26 -0.83 115.64 117.62 1ng9 s THR 655 Ca -0.09 -0.79 0.03 0.00 0.31 0.00 0.00 61.69 61.16 1ng9 s THR 655 Cb -0.15 -1.54 0.09 0.00 0.01 0.00 0.00 72.50 70.91 1ng9 s THR 655 CO 0.05 0.49 0.02 -0.60 -0.69 0.00 0.00 174.62 173.88 1ng9 s ARG 656 N 0.82 1.60 0.49 4.92 3.00 -0.49 -4.59 118.95 124.70 1ng9 s ARG 656 Ca -0.09 -1.69 0.05 0.00 -1.00 0.00 0.00 55.73 53.00 1ng9 s ARG 656 Cb -0.16 -3.05 -0.01 0.00 0.00 0.00 0.00 34.95 31.74 1ng9 s ARG 656 CO 0.00 -0.85 0.24 0.14 0.00 0.00 0.00 175.30 174.83 1ng9 s VAL 657 N 1.00 1.81 0.72 7.11 -7.23 -1.26 -0.71 120.40 121.84 1ng9 s VAL 657 Ca 0.06 -1.67 -0.12 0.00 -1.81 0.00 0.00 61.98 58.44 1ng9 s VAL 657 Cb -0.19 -2.47 0.03 0.00 0.56 0.00 0.00 36.38 34.30 1ng9 s VAL 657 CO -0.08 0.00 1.09 -0.83 -0.31 0.00 0.00 175.10 174.97 1ng9 s GLY 658 N -4.06 1.86 0.00 2.32 0.00 -1.13 -4.95 107.32 101.37 1ng9 s GLY 658 Ca 0.31 0.36 0.00 0.00 0.00 0.00 0.00 44.72 45.39 1ng9 s GLY 658 CO 0.18 0.71 0.00 0.00 0.00 0.00 0.00 173.10 173.99 1ng9 n ALA 659 N -3.04 0.00 0.00 3.20 0.00 -1.26 -5.09 120.51 114.31 1ng9 n ALA 659 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1ng9 n ALA 659 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1ng9 n ALA 659 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ng9 n GLY 666 N 5.00 2.70 0.15 0.00 0.00 -1.26 -4.84 105.19 106.95 1ng9 n GLY 666 Ca 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.94 1ng9 n GLY 666 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ng9 n ARG 667 N -1.14 0.00 -3.40 1.61 1.74 -1.26 -5.11 116.66 109.11 1ng9 n ARG 667 Ca 0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 1ng9 n ARG 667 Cb 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.35 1ng9 n ARG 667 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ng9 s SER 668 N 0.66 6.14 0.30 0.55 0.15 -1.26 -4.98 113.70 115.26 1ng9 s SER 668 Ca 0.00 -0.96 0.10 0.00 0.70 0.00 0.00 55.95 55.79 1ng9 s SER 668 Cb 0.00 -2.19 0.47 0.00 -1.71 0.00 0.00 66.02 62.59 1ng9 s SER 668 CO 0.00 -0.55 1.69 0.71 1.20 0.00 0.00 173.24 176.28 1ng9 h THR 669 N 5.69 1.36 0.04 6.45 1.35 -1.99 -2.58 112.91 123.23 1ng9 h THR 669 Ca -0.27 -1.74 -0.22 0.00 -0.55 0.00 0.00 66.41 63.63 1ng9 h THR 669 Cb 1.11 1.90 -0.01 0.00 -1.73 0.00 0.00 68.15 69.43 1ng9 h THR 669 CO 0.79 0.50 -1.00 0.15 -0.25 0.00 0.00 175.52 175.72 1ng9 h PHE 670 N 0.06 0.38 -0.06 4.73 3.57 -1.93 -2.47 116.94 121.22 1ng9 h PHE 670 Ca -0.00 -0.23 0.00 0.00 3.53 0.00 0.00 57.97 61.27 1ng9 h PHE 670 Cb 0.91 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 1ng9 h PHE 670 CO 0.01 1.09 0.03 1.98 -2.23 0.00 0.00 178.31 179.18 1ng9 h MET 671 N 0.11 0.06 -0.46 1.11 4.05 -1.92 -1.72 114.93 116.16 1ng9 h MET 671 Ca -0.07 -0.00 -0.14 0.00 -0.28 0.00 0.00 59.70 59.21 1ng9 h MET 671 Cb 1.67 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 32.44 1ng9 h MET 671 CO 0.16 0.04 -0.25 -0.39 0.23 0.00 0.00 176.91 176.70 1ng9 h VAL 672 N 0.06 1.27 -0.28 -5.77 -1.51 -1.49 -1.16 116.25 107.37 1ng9 h VAL 672 Ca 0.02 -1.42 -0.03 0.00 -1.23 0.00 0.00 66.70 64.05 1ng9 h VAL 672 Cb 0.00 1.18 -0.02 0.00 -2.13 0.00 0.00 31.29 30.33 1ng9 h VAL 672 CO -0.02 0.49 0.05 -0.33 -1.23 0.00 0.00 177.57 176.53 1ng9 h GLU 673 N 0.83 0.40 0.04 5.19 5.08 -1.42 -1.11 114.58 123.59 1ng9 h GLU 673 Ca 0.10 -0.06 -0.23 0.00 -1.00 0.00 0.00 59.36 58.17 1ng9 h GLU 673 Cb 0.84 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 1ng9 h GLU 673 CO 0.07 0.39 -1.02 0.52 -1.00 0.00 0.00 179.01 177.98 1ng9 h MET 674 N 0.39 0.28 -0.01 2.33 2.86 -0.87 -2.33 114.93 117.59 1ng9 h MET 674 Ca 0.09 -0.35 -0.15 0.00 -2.06 0.00 0.00 59.70 57.23 1ng9 h MET 674 Cb 0.19 0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 1ng9 h MET 674 CO -0.00 1.09 -0.71 1.79 1.06 0.00 0.00 176.91 180.14 1ng9 h THR 675 N 0.13 1.49 -0.04 2.22 1.35 -0.94 -1.92 112.91 115.21 1ng9 h THR 675 Ca -0.08 -2.37 -0.15 0.00 -0.55 0.00 0.00 66.41 63.25 1ng9 h THR 675 Cb 1.68 2.28 -0.01 0.00 -1.73 0.00 0.00 68.15 70.37 1ng9 h THR 675 CO 0.16 0.68 -0.67 -0.33 -0.25 0.00 0.00 175.52 175.11 1ng9 h GLU 676 N 0.04 0.17 -0.11 4.72 5.08 -1.22 -2.45 114.58 120.81 1ng9 h GLU 676 Ca -0.01 -0.13 -0.13 0.00 -1.00 0.00 0.00 59.36 58.09 1ng9 h GLU 676 Cb 1.25 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 1ng9 h GLU 676 CO 0.10 0.78 -0.50 1.15 -1.00 0.00 0.00 179.01 179.53 1ng9 h THR 677 N 0.12 1.34 -0.36 1.13 2.02 -1.31 -3.01 112.91 112.84 1ng9 h THR 677 Ca -0.01 -1.75 -0.10 0.00 0.77 0.00 0.00 66.41 65.32 1ng9 h THR 677 Cb 1.20 1.82 -0.01 0.00 -1.74 0.00 0.00 68.15 69.42 1ng9 h THR 677 CO 0.10 0.52 -0.17 0.00 0.37 0.00 0.00 175.52 176.35 1ng9 h ALA 678 N 1.24 0.50 -0.65 6.16 0.00 -1.12 -1.66 119.26 123.72 1ng9 h ALA 678 Ca 0.01 -0.35 0.08 0.00 0.00 0.00 0.00 54.91 54.65 1ng9 h ALA 678 Cb 0.97 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 1ng9 h ALA 678 CO 0.08 0.42 0.32 -0.97 0.00 0.00 0.00 179.25 179.10 1ng9 h ASN 679 N 0.53 0.41 -0.57 0.00 -1.24 -1.46 -0.25 115.58 113.00 1ng9 h ASN 679 Ca 0.08 0.05 -0.01 0.00 0.71 0.00 0.00 56.30 57.13 1ng9 h ASN 679 Cb 0.70 -0.02 -0.03 0.00 0.73 0.00 0.00 38.32 39.71 1ng9 h ASN 679 CO 0.05 0.25 0.31 0.40 -1.29 0.00 0.00 177.43 177.16 1ng9 h ILE 680 N 0.56 1.18 0.00 2.57 2.04 -1.35 -1.93 117.51 120.58 1ng9 h ILE 680 Ca 0.32 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.71 1ng9 h ILE 680 Cb 0.31 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1ng9 h ILE 680 CO -0.25 0.20 0.00 -0.07 0.00 0.00 0.00 178.15 178.03 1ng9 h LEU 681 N 0.76 0.00 0.00 1.44 3.38 -0.67 -2.19 115.31 118.03 1ng9 h LEU 681 Ca 0.20 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.96 1ng9 h LEU 681 Cb 0.04 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1ng9 h LEU 681 CO -0.03 0.00 -1.74 1.41 0.09 0.00 0.00 178.44 178.16 1ng9 n HIS 682 N -2.92 0.66 -0.03 1.13 8.25 -0.16 -4.58 115.22 117.56 1ng9 n HIS 682 Ca 0.03 0.22 0.00 0.00 -0.26 0.00 0.00 57.72 57.71 1ng9 n HIS 682 Cb 0.41 -1.02 0.00 0.00 1.12 0.00 0.00 29.99 30.50 1ng9 n HIS 682 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1ng9 n ASN 683 N -2.81 0.44 -4.85 0.41 3.02 -0.75 -5.04 115.26 105.69 1ng9 n ASN 683 Ca -0.15 -0.72 -0.32 0.00 -0.03 0.00 0.00 54.58 53.36 1ng9 n ASN 683 Cb 0.91 0.49 -0.04 0.00 -0.61 0.00 0.00 39.78 40.53 1ng9 n ASN 683 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ng9 s ALA 684 N -0.49 3.15 0.20 5.41 0.00 -0.83 -5.06 121.76 124.14 1ng9 s ALA 684 Ca 0.00 0.13 0.03 0.00 0.00 0.00 0.00 51.96 52.12 1ng9 s ALA 684 Cb 0.00 -3.00 -0.01 0.00 0.00 0.00 0.00 23.12 20.11 1ng9 s ALA 684 CO 0.00 -0.06 0.10 0.25 0.00 0.00 0.00 175.76 176.05 1ng9 n THR 685 N -1.21 0.00 0.58 0.00 -2.24 -1.26 -4.97 114.28 105.19 1ng9 n THR 685 Ca 0.05 -1.22 0.09 0.00 -2.27 0.00 0.00 64.05 60.70 1ng9 n THR 685 Cb 0.54 0.49 0.39 0.00 -2.10 0.00 0.00 70.33 69.65 1ng9 n THR 685 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ng9 n GLU 686 N -0.43 0.04 0.00 -0.78 1.02 -1.23 -2.83 120.64 116.43 1ng9 n GLU 686 Ca -0.01 0.23 0.09 0.00 -0.02 0.00 0.00 57.16 57.45 1ng9 n GLU 686 Cb 0.31 -1.56 0.04 0.00 -0.02 0.00 0.00 31.44 30.21 1ng9 n GLU 686 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1ng9 n TYR 687 N -1.63 0.00 -3.10 -0.32 4.01 -1.26 -4.56 117.16 110.29 1ng9 n TYR 687 Ca 0.04 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.41 1ng9 n TYR 687 Cb 0.22 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.19 1ng9 n TYR 687 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1ng9 s SER 688 N -1.81 7.10 -0.15 7.72 0.01 -1.13 -2.10 113.70 123.33 1ng9 s SER 688 Ca 0.19 1.43 -0.13 0.00 1.31 0.00 0.00 55.95 58.75 1ng9 s SER 688 Cb 0.15 -2.42 -0.05 0.00 0.21 0.00 0.00 66.02 63.91 1ng9 s SER 688 CO 0.34 0.07 0.27 -0.22 0.41 0.00 0.00 173.24 174.10 1ng9 s LEU 689 N -1.83 4.26 -0.17 2.44 2.96 -0.15 -1.74 118.68 124.46 1ng9 s LEU 689 Ca 0.41 0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 54.80 1ng9 s LEU 689 Cb -0.18 -2.33 0.05 0.00 0.50 0.00 0.00 46.19 44.23 1ng9 s LEU 689 CO 0.21 0.14 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.67 1ng9 s VAL 690 N 0.27 0.91 -0.35 1.68 1.01 0.19 -1.46 120.40 122.65 1ng9 s VAL 690 Ca 0.16 -0.58 -0.11 0.00 0.00 0.00 0.00 61.98 61.44 1ng9 s VAL 690 Cb -0.13 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.08 1ng9 s VAL 690 CO 0.04 0.03 0.21 -0.76 0.00 0.00 0.00 175.10 174.61 1ng9 s LEU 691 N 1.71 4.50 -0.32 3.92 1.43 -0.01 -1.30 118.68 128.61 1ng9 s LEU 691 Ca 0.00 -0.68 -0.06 0.00 -1.03 0.00 0.00 54.13 52.36 1ng9 s LEU 691 Cb -0.16 -2.06 0.04 0.00 0.03 0.00 0.00 46.19 44.04 1ng9 s LEU 691 CO -0.07 -0.29 0.08 -0.04 0.23 0.00 0.00 176.35 176.26 1ng9 s MET 692 N 1.63 2.66 0.54 1.70 -1.94 -0.25 -1.39 119.30 122.25 1ng9 s MET 692 Ca 0.04 -1.14 0.09 0.00 -1.71 0.00 0.00 55.69 52.97 1ng9 s MET 692 Cb -0.18 -3.39 0.07 0.00 2.01 0.00 0.00 34.83 33.34 1ng9 s MET 692 CO 0.08 -0.62 0.74 0.34 -0.01 0.00 0.00 175.02 175.55 1ng9 s ASP 693 N 1.39 5.23 0.50 3.03 3.68 0.11 -0.73 116.67 129.89 1ng9 s ASP 693 Ca -0.02 -0.70 -0.23 0.00 2.13 0.00 0.00 52.55 53.74 1ng9 s ASP 693 Cb -0.19 0.01 -0.06 0.00 -1.45 0.00 0.00 42.92 41.23 1ng9 s ASP 693 CO 0.02 -1.20 1.29 -1.61 0.13 0.00 0.00 175.17 173.80 1ng9 s GLU 694 N -4.60 3.43 0.40 4.34 2.02 -1.21 -4.73 118.70 118.34 1ng9 s GLU 694 Ca 0.60 2.09 0.04 0.00 0.02 0.00 0.00 54.97 57.71 1ng9 s GLU 694 Cb -0.07 -2.36 -0.03 0.00 0.10 0.00 0.00 34.13 31.77 1ng9 s GLU 694 CO 0.38 -0.91 0.11 0.96 0.02 0.00 0.00 175.26 175.82 1ng9 s ILE 695 N -1.38 0.70 0.87 -1.63 -4.36 -1.26 -2.83 121.20 111.31 1ng9 s ILE 695 Ca 0.67 -2.00 -0.10 0.00 -0.26 0.00 0.00 60.65 58.96 1ng9 s ILE 695 Cb -0.36 -2.40 0.12 0.00 1.25 0.00 0.00 42.46 41.06 1ng9 s ILE 695 CO 0.44 0.00 1.12 -0.83 0.24 0.00 0.00 174.94 175.91 1ng9 s GLY 696 N -3.60 1.68 0.79 6.27 0.00 -1.26 -5.03 107.32 106.17 1ng9 s GLY 696 Ca 0.25 0.44 -0.11 0.00 0.00 0.00 0.00 44.72 45.29 1ng9 s GLY 696 CO 0.14 0.84 1.10 0.00 0.00 0.00 0.00 173.10 175.18 1ng9 s ALA 697 N -2.74 2.26 0.86 3.20 0.00 -1.26 -4.97 121.76 119.11 1ng9 s ALA 697 Ca 0.65 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.41 1ng9 s ALA 697 Cb -0.21 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1ng9 s ALA 697 CO 0.57 -1.71 0.00 0.41 0.00 0.00 0.00 175.76 175.03 1ng9 n GLY 698 N -2.08 -0.65 0.26 0.00 0.00 -1.26 -4.92 105.19 96.53 1ng9 n GLY 698 Ca 0.07 -1.73 0.14 0.00 0.00 0.00 0.00 46.02 44.50 1ng9 n GLY 698 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1ng9 h THR 699 N -0.72 0.34 -3.60 2.61 1.35 -1.98 -3.46 112.91 107.45 1ng9 h THR 699 Ca 0.00 -0.72 -0.15 0.00 -0.55 0.00 0.00 66.41 64.99 1ng9 h THR 699 Cb 0.00 1.54 -0.03 0.00 -1.73 0.00 0.00 68.15 67.92 1ng9 h THR 699 CO 0.00 0.11 -0.12 -0.24 -0.25 0.00 0.00 175.52 175.02 1ng9 n SER 700 N -3.33 1.25 0.25 5.36 2.88 -1.26 -5.07 113.62 113.70 1ng9 n SER 700 Ca -0.00 -1.58 -0.15 0.00 -1.33 0.00 0.00 58.87 55.80 1ng9 n SER 700 Cb 0.32 0.24 -0.08 0.00 -0.75 0.00 0.00 64.21 63.94 1ng9 n SER 700 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1ng9 h THR 701 N 1.16 0.53 -0.35 2.46 2.02 -2.03 -3.26 112.91 113.43 1ng9 h THR 701 Ca -0.09 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1ng9 h THR 701 Cb 0.33 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1ng9 h THR 701 CO 0.14 0.04 0.00 -1.22 0.37 0.00 0.00 175.52 174.85 1ng9 n TYR 702 N -5.30 0.47 0.05 3.16 4.01 -1.26 -4.61 117.16 113.68 1ng9 n TYR 702 Ca -0.11 -0.46 -0.11 0.00 -0.16 0.00 0.00 57.90 57.06 1ng9 n TYR 702 Cb 0.29 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 39.25 1ng9 n TYR 702 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 1ng9 h ASP 703 N 2.26 -0.84 0.64 7.72 3.58 -1.93 -2.15 116.42 125.69 1ng9 h ASP 703 Ca 0.00 0.12 -0.27 0.00 0.42 0.00 0.00 57.03 57.29 1ng9 h ASP 703 Cb 0.74 0.35 -0.01 0.00 1.72 0.00 0.00 39.33 42.12 1ng9 h ASP 703 CO 0.00 -0.35 -1.33 1.23 -2.88 0.00 0.00 179.24 175.91 1ng9 h GLY 704 N -0.41 0.20 1.11 -0.78 0.00 -1.81 -3.31 103.07 98.06 1ng9 h GLY 704 Ca 0.07 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1ng9 h GLY 704 CO -0.26 0.45 0.50 -2.00 0.00 0.00 0.00 176.54 175.23 1ng9 h LEU 705 N 0.05 1.04 -0.57 3.11 5.85 -1.83 -1.05 115.31 121.90 1ng9 h LEU 705 Ca -0.16 -0.07 0.12 0.00 0.84 0.00 0.00 57.88 58.61 1ng9 h LEU 705 Cb 1.94 -0.26 -0.10 0.00 0.37 0.00 0.00 40.66 42.61 1ng9 h LEU 705 CO 0.16 0.81 -0.07 0.28 -0.34 0.00 0.00 178.44 179.29 1ng9 h SER 706 N 1.19 -0.39 0.80 1.25 0.02 -1.47 0.08 113.55 115.02 1ng9 h SER 706 Ca 0.31 0.16 -0.16 0.00 -0.84 0.00 0.00 61.79 61.25 1ng9 h SER 706 Cb -0.02 0.30 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 1ng9 h SER 706 CO -0.05 -0.15 -0.79 -0.07 -1.14 0.00 0.00 176.83 174.63 1ng9 h LEU 707 N 0.06 0.00 -0.58 5.07 3.38 -1.54 -0.83 115.31 120.86 1ng9 h LEU 707 Ca 0.29 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.11 1ng9 h LEU 707 Cb 0.45 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1ng9 h LEU 707 CO -0.54 0.79 -0.42 0.00 0.09 0.00 0.00 178.44 178.35 1ng9 h ALA 708 N 1.21 0.76 -0.12 1.53 0.00 -0.78 0.20 119.26 122.06 1ng9 h ALA 708 Ca -0.01 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 1ng9 h ALA 708 Cb 1.40 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ng9 h ALA 708 CO 0.10 0.66 -0.08 2.35 0.00 0.00 0.00 179.25 182.28 1ng9 h TRP 709 N 0.54 0.32 -0.20 0.00 2.91 -0.80 -1.10 115.95 117.63 1ng9 h TRP 709 Ca 0.04 -0.09 -0.08 0.00 1.13 0.00 0.00 58.89 59.90 1ng9 h TRP 709 Cb 0.95 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 29.52 1ng9 h TRP 709 CO 0.04 0.64 -0.22 0.00 -1.03 0.00 0.00 178.44 177.88 1ng9 h ALA 710 N 0.63 1.26 -0.06 2.65 0.00 -1.10 -1.73 119.26 120.92 1ng9 h ALA 710 Ca 0.03 -0.30 -0.20 0.00 0.00 0.00 0.00 54.91 54.43 1ng9 h ALA 710 Cb 0.57 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.26 1ng9 h ALA 710 CO 0.02 0.49 -0.76 0.00 0.00 0.00 0.00 179.25 179.00 1ng9 h ALA 712 N 0.44 1.33 0.02 0.00 0.00 -0.91 -1.66 119.26 118.48 1ng9 h ALA 712 Ca -0.08 -0.12 -0.24 0.00 0.00 0.00 0.00 54.91 54.47 1ng9 h ALA 712 Cb 1.42 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.94 1ng9 h ALA 712 CO 0.15 0.53 -1.01 1.49 0.00 0.00 0.00 179.25 180.41 1ng9 h GLU 713 N 0.96 0.46 -0.29 0.00 4.81 -1.33 -0.40 114.58 118.80 1ng9 h GLU 713 Ca 0.24 -0.53 -0.07 0.00 -0.13 0.00 0.00 59.36 58.87 1ng9 h GLU 713 Cb 0.06 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1ng9 h GLU 713 CO -0.04 1.18 -0.13 -0.97 -0.73 0.00 0.00 179.01 178.32 1ng9 h ASN 714 N 0.24 0.49 0.42 1.04 -0.73 -1.12 0.21 115.58 116.13 1ng9 h ASN 714 Ca -0.10 -0.13 -0.21 0.00 1.87 0.00 0.00 56.30 57.74 1ng9 h ASN 714 Cb 1.66 -0.13 -0.00 0.00 0.27 0.00 0.00 38.32 40.12 1ng9 h ASN 714 CO 0.18 0.64 -0.87 -0.07 -0.37 0.00 0.00 177.43 176.94 1ng9 h LEU 715 N 0.46 0.41 -0.01 0.34 3.38 -1.03 -1.90 115.31 116.97 1ng9 h LEU 715 Ca 0.09 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.66 1ng9 h LEU 715 Cb 0.50 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.13 1ng9 h LEU 715 CO 0.03 1.10 -0.31 0.00 0.09 0.00 0.00 178.44 179.35 1ng9 h ALA 716 N 0.88 0.05 0.03 1.53 0.00 -0.89 0.16 119.26 121.02 1ng9 h ALA 716 Ca -0.06 -0.48 -0.35 0.00 0.00 0.00 0.00 54.91 54.03 1ng9 h ALA 716 Cb 1.49 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.24 1ng9 h ALA 716 CO 0.14 0.13 -2.11 -1.71 0.00 0.00 0.00 179.25 175.71 1ng9 n ASN 717 N -4.46 1.23 -0.10 0.00 5.15 0.71 -4.02 115.26 113.78 1ng9 n ASN 717 Ca -0.10 0.15 -0.14 0.00 -0.60 0.00 0.00 54.58 53.89 1ng9 n ASN 717 Cb 0.52 -0.10 -0.05 0.00 -0.53 0.00 0.00 39.78 39.63 1ng9 n ASN 717 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1ng9 n LYS 718 N -3.14 0.54 0.06 1.20 4.01 -0.77 -4.74 118.16 115.32 1ng9 n LYS 718 Ca -0.31 0.24 -0.21 0.00 -0.51 0.00 0.00 58.31 57.52 1ng9 n LYS 718 Cb 1.06 -1.46 -0.12 0.00 -0.51 0.00 0.00 35.03 34.00 1ng9 n LYS 718 CO 0.00 0.00 0.00 0.82 -1.11 0.00 0.00 177.40 177.11 1ng9 h ILE 719 N -1.00 1.34 -2.88 -0.18 2.04 -1.56 -3.48 117.51 111.79 1ng9 h ILE 719 Ca -0.16 -2.36 -0.37 0.00 1.00 0.00 0.00 64.86 62.97 1ng9 h ILE 719 Cb 1.12 2.69 -0.01 0.00 -0.74 0.00 0.00 36.82 39.89 1ng9 h ILE 719 CO -0.10 0.71 -0.49 0.29 0.00 0.00 0.00 178.15 178.56 1ng9 n LYS 720 N -3.93 -1.94 -1.12 2.37 5.02 0.04 -3.48 118.16 115.12 1ng9 n LYS 720 Ca -0.13 0.90 -0.28 0.00 -2.02 0.00 0.00 58.31 56.77 1ng9 n LYS 720 Cb 0.89 -5.46 0.19 0.00 -0.02 0.00 0.00 35.03 30.63 1ng9 n LYS 720 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ng9 s ALA 721 N -2.96 0.76 -0.39 7.82 0.00 -1.21 -4.56 121.76 121.21 1ng9 s ALA 721 Ca 0.04 -0.39 -0.25 0.00 0.00 0.00 0.00 51.96 51.36 1ng9 s ALA 721 Cb -0.02 -3.11 0.02 0.00 0.00 0.00 0.00 23.12 20.01 1ng9 s ALA 721 CO 0.05 -2.99 0.88 -0.51 0.00 0.00 0.00 175.76 173.19 1ng9 s LEU 722 N -6.56 4.05 -0.13 0.00 1.43 -0.71 -4.62 118.68 112.14 1ng9 s LEU 722 Ca 0.66 0.38 0.01 0.00 -1.03 0.00 0.00 54.13 54.15 1ng9 s LEU 722 Cb -0.19 -3.17 0.02 0.00 0.03 0.00 0.00 46.19 42.88 1ng9 s LEU 722 CO 0.58 -0.87 -0.13 -0.89 0.23 0.00 0.00 176.35 175.28 1ng9 s THR 723 N 3.42 1.41 -0.08 5.49 2.01 0.67 -0.64 115.64 127.93 1ng9 s THR 723 Ca 0.36 -0.55 -0.14 0.00 0.31 0.00 0.00 61.69 61.67 1ng9 s THR 723 Cb -0.12 -1.33 -0.05 0.00 0.01 0.00 0.00 72.50 71.01 1ng9 s THR 723 CO 0.20 0.43 0.36 -0.76 -0.69 0.00 0.00 174.62 174.16 1ng9 s LEU 724 N 1.41 4.37 -0.44 4.42 1.43 -0.42 -1.49 118.68 127.96 1ng9 s LEU 724 Ca 0.02 0.76 0.03 0.00 -1.03 0.00 0.00 54.13 53.91 1ng9 s LEU 724 Cb -0.13 -2.48 0.16 0.00 0.03 0.00 0.00 46.19 43.76 1ng9 s LEU 724 CO -0.08 0.22 0.31 0.12 0.23 0.00 0.00 176.35 177.16 1ng9 s PHE 725 N -0.38 1.46 -0.01 0.29 5.36 -0.62 -1.09 117.98 122.99 1ng9 s PHE 725 Ca 0.21 -2.31 -0.30 0.00 -0.96 0.00 0.00 56.93 53.57 1ng9 s PHE 725 Cb -0.15 -1.30 -0.04 0.00 -0.34 0.00 0.00 43.02 41.19 1ng9 s PHE 725 CO 0.09 -0.79 1.20 0.00 -1.46 0.00 0.00 175.22 174.27 1ng9 s ALA 726 N 0.15 3.44 -0.02 11.12 0.00 0.10 -1.80 121.76 134.76 1ng9 s ALA 726 Ca 0.26 0.72 -0.13 0.00 0.00 0.00 0.00 51.96 52.80 1ng9 s ALA 726 Cb -0.08 -3.49 0.02 0.00 0.00 0.00 0.00 23.12 19.57 1ng9 s ALA 726 CO -0.11 -0.62 0.28 -0.08 0.00 0.00 0.00 175.76 175.23 1ng9 s THR 727 N 1.74 0.06 -1.40 0.00 -1.32 -0.97 -3.35 115.64 110.39 1ng9 s THR 727 Ca 0.57 -0.48 0.25 0.00 -1.21 0.00 0.00 61.69 60.83 1ng9 s THR 727 Cb -0.27 -0.58 0.12 0.00 -1.51 0.00 0.00 72.50 70.26 1ng9 s THR 727 CO 0.25 -0.26 1.45 0.00 -2.21 0.00 0.00 174.62 173.85 1ng9 n HIS 728 N 1.40 0.00 -2.40 9.09 1.44 -1.26 -4.55 115.22 118.93 1ng9 n HIS 728 Ca -0.21 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.10 1ng9 n HIS 728 Cb 0.56 -0.17 -0.03 0.00 0.12 0.00 0.00 29.99 30.47 1ng9 n HIS 728 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 1ng9 s TYR 729 N -2.74 2.12 0.58 -1.40 2.02 -1.26 -4.84 117.35 111.82 1ng9 s TYR 729 Ca 0.17 0.13 0.39 0.00 -0.37 0.00 0.00 57.07 57.40 1ng9 s TYR 729 Cb 0.18 -4.47 2.14 0.00 -0.40 0.00 0.00 41.96 39.41 1ng9 s TYR 729 CO 0.62 -2.12 2.29 0.35 -1.57 0.00 0.00 175.55 175.12 1ng9 h PHE 730 N 11.36 0.00 -0.63 2.71 3.57 -2.01 -2.38 116.94 129.56 1ng9 h PHE 730 Ca -0.23 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.28 1ng9 h PHE 730 Cb 1.08 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.78 1ng9 h PHE 730 CO 1.12 0.01 0.41 0.93 -2.23 0.00 0.00 178.31 178.55 1ng9 h GLU 731 N 0.00 0.84 0.00 1.11 3.07 -2.00 -2.06 114.58 115.54 1ng9 h GLU 731 Ca -0.00 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1ng9 h GLU 731 Cb 0.08 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 27.80 1ng9 h GLU 731 CO 0.00 0.57 0.00 1.28 -1.40 0.00 0.00 179.01 179.46 1ng9 n LEU 732 N -4.43 0.00 0.10 1.33 4.77 -0.90 -2.18 117.00 115.69 1ng9 n LEU 732 Ca 0.06 0.38 0.11 0.00 -0.03 0.00 0.00 56.01 56.54 1ng9 n LEU 732 Cb 0.05 -0.38 0.46 0.00 -2.33 0.00 0.00 43.42 41.21 1ng9 n LEU 732 CO 0.36 -0.23 0.85 0.35 -1.33 0.00 0.00 177.39 177.38 1ng9 n THR 733 N -1.38 0.78 0.52 -5.08 -2.24 -0.77 -2.39 114.28 103.72 1ng9 n THR 733 Ca 0.04 0.14 0.13 0.00 -2.27 0.00 0.00 64.05 62.10 1ng9 n THR 733 Cb 0.11 -1.02 0.40 0.00 -2.10 0.00 0.00 70.33 67.72 1ng9 n THR 733 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1ng9 h GLN 734 N 0.00 0.00 0.00 -0.78 4.20 -1.63 -3.38 115.11 113.52 1ng9 h GLN 734 Ca 0.00 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.74 1ng9 h GLN 734 Cb 0.41 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 1ng9 h GLN 734 CO 0.00 0.00 -0.21 -0.07 -0.67 0.00 0.00 178.83 177.88 1ng9 h LEU 735 N 0.00 -0.61 -0.91 1.46 3.38 -1.68 -2.59 115.31 114.37 1ng9 h LEU 735 Ca 0.00 0.09 0.23 0.00 0.09 0.00 0.00 57.88 58.29 1ng9 h LEU 735 Cb 0.71 0.25 -0.16 0.00 0.09 0.00 0.00 40.66 41.54 1ng9 h LEU 735 CO 0.00 -0.27 0.01 -0.65 0.09 0.00 0.00 178.44 177.62 1ng9 h PRO 736 N -0.33 0.05 -0.67 1.13 0.11 -1.76 0.56 132.00 131.09 1ng9 h PRO 736 Ca 0.06 -0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.31 1ng9 h PRO 736 Cb 0.41 -0.01 -0.11 0.00 0.11 0.00 0.00 31.00 31.39 1ng9 h PRO 736 CO -0.19 0.03 0.02 1.49 -0.21 0.00 0.00 178.00 179.14 1ng9 h GLU 737 N 0.05 0.13 0.00 1.05 4.81 -1.74 -3.09 114.58 115.79 1ng9 h GLU 737 Ca 0.53 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.61 1ng9 h GLU 737 Cb 1.02 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 1ng9 h GLU 737 CO -0.83 0.08 -1.23 0.87 -0.73 0.00 0.00 179.01 177.17 1ng9 h LYS 738 N 0.13 0.00 -4.52 1.92 1.79 -0.97 -3.47 116.57 111.45 1ng9 h LYS 738 Ca 0.36 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 58.31 1ng9 h LYS 738 Cb 0.60 0.00 -0.34 0.00 -1.58 0.00 0.00 32.23 30.91 1ng9 h LYS 738 CO -0.57 0.28 -0.81 -1.64 -1.08 0.00 0.00 179.45 175.62 1ng9 s MET 739 N -2.99 1.69 0.56 3.15 -1.94 -0.17 -5.12 119.30 114.49 1ng9 s MET 739 Ca -0.02 -0.40 -0.20 0.00 -1.71 0.00 0.00 55.69 53.36 1ng9 s MET 739 Cb 0.09 -1.43 -0.05 0.00 2.01 0.00 0.00 34.83 35.45 1ng9 s MET 739 CO 0.80 -0.00 1.22 -2.00 -0.01 0.00 0.00 175.02 175.03 1ng9 s GLU 740 N 0.77 3.15 0.00 2.03 -6.30 -1.26 -3.21 118.70 113.89 1ng9 s GLU 740 Ca -0.13 1.88 0.00 0.00 -2.50 0.00 0.00 54.97 54.22 1ng9 s GLU 740 Cb -0.15 -2.07 0.00 0.00 0.00 0.00 0.00 34.13 31.91 1ng9 s GLU 740 CO 0.02 -1.07 0.00 0.41 0.02 0.00 0.00 175.26 174.64 1ng9 n GLY 741 N 0.52 1.64 3.54 -1.50 0.00 -1.25 -4.79 105.19 103.35 1ng9 n GLY 741 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1ng9 n GLY 741 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ng9 s VAL 742 N -3.59 3.43 -0.03 1.61 1.01 -1.20 -1.10 120.40 120.54 1ng9 s VAL 742 Ca 0.00 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.27 1ng9 s VAL 742 Cb 0.00 -2.39 0.02 0.00 0.00 0.00 0.00 36.38 34.01 1ng9 s VAL 742 CO 0.00 0.58 0.25 0.00 0.00 0.00 0.00 175.10 175.93 1ng9 s ALA 743 N -0.79 -0.62 -0.17 5.51 0.00 -0.32 -4.38 121.76 121.00 1ng9 s ALA 743 Ca 0.12 0.30 -0.17 0.00 0.00 0.00 0.00 51.96 52.21 1ng9 s ALA 743 Cb -0.11 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 1ng9 s ALA 743 CO 0.01 -0.21 0.46 -0.80 0.00 0.00 0.00 175.76 175.22 1ng9 s ASN 744 N -0.98 6.57 0.34 0.00 0.01 -1.26 -0.48 114.94 119.13 1ng9 s ASN 744 Ca -0.11 0.68 0.06 0.00 -0.71 0.00 0.00 52.86 52.78 1ng9 s ASN 744 Cb -0.05 -2.27 -0.07 0.00 0.41 0.00 0.00 41.25 39.27 1ng9 s ASN 744 CO 0.02 -0.07 -0.00 0.68 -1.51 0.00 0.00 177.10 176.23 1ng9 s VAL 745 N 1.08 1.65 -0.01 1.60 -7.23 0.22 -0.87 120.40 116.84 1ng9 s VAL 745 Ca 0.23 -2.05 -0.25 0.00 -1.81 0.00 0.00 61.98 58.10 1ng9 s VAL 745 Cb -0.15 -2.75 0.05 0.00 0.56 0.00 0.00 36.38 34.09 1ng9 s VAL 745 CO 0.09 -0.10 0.55 -1.38 -0.31 0.00 0.00 175.10 173.96 1ng9 s HIS 746 N -2.98 -0.49 -0.20 2.82 -3.43 -0.48 -2.05 115.29 108.48 1ng9 s HIS 746 Ca 0.34 0.75 -0.13 0.00 -0.80 0.00 0.00 55.06 55.22 1ng9 s HIS 746 Cb 0.07 0.33 -0.05 0.00 -1.43 0.00 0.00 32.58 31.50 1ng9 s HIS 746 CO 0.15 -0.58 0.27 -0.51 -2.00 0.00 0.00 174.74 172.07 1ng9 s LEU 747 N -1.46 4.18 0.62 5.38 1.02 -0.05 -1.03 118.68 127.34 1ng9 s LEU 747 Ca -0.10 0.37 -0.13 0.00 0.02 0.00 0.00 54.13 54.30 1ng9 s LEU 747 Cb -0.01 -2.31 -0.03 0.00 0.02 0.00 0.00 46.19 43.86 1ng9 s LEU 747 CO 0.05 0.06 1.04 -0.62 0.02 0.00 0.00 176.35 176.89 1ng9 s ASP 748 N 0.75 5.97 -0.28 2.29 2.15 -0.82 -4.49 116.67 122.24 1ng9 s ASP 748 Ca 0.14 1.57 -0.17 0.00 0.43 0.00 0.00 52.55 54.52 1ng9 s ASP 748 Cb -0.13 -2.50 0.08 0.00 -0.30 0.00 0.00 42.92 40.07 1ng9 s ASP 748 CO 0.04 -1.04 0.68 0.00 -0.17 0.00 0.00 175.17 174.68 1ng9 s ALA 749 N -2.91 -1.84 -0.28 3.66 0.00 -1.26 -3.03 121.76 116.10 1ng9 s ALA 749 Ca 0.58 2.35 -0.13 0.00 0.00 0.00 0.00 51.96 54.76 1ng9 s ALA 749 Cb -0.13 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 1ng9 s ALA 749 CO 0.47 -0.37 0.30 -0.51 0.00 0.00 0.00 175.76 175.65 1ng9 s LEU 750 N 1.48 4.05 -0.18 0.00 1.43 -1.00 -4.96 118.68 119.50 1ng9 s LEU 750 Ca -0.09 0.15 -0.21 0.00 -1.03 0.00 0.00 54.13 52.95 1ng9 s LEU 750 Cb -0.05 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.83 1ng9 s LEU 750 CO -0.17 -0.14 0.63 -1.61 0.23 0.00 0.00 176.35 175.28 1ng9 s GLU 751 N 1.95 4.25 -0.15 1.70 2.02 -1.26 -1.84 118.70 125.37 1ng9 s GLU 751 Ca 0.12 0.63 -0.04 0.00 0.02 0.00 0.00 54.97 55.70 1ng9 s GLU 751 Cb -0.16 -3.55 0.06 0.00 0.10 0.00 0.00 34.13 30.58 1ng9 s GLU 751 CO 0.10 -0.17 0.10 -3.38 0.02 0.00 0.00 175.26 171.94 1ng9 s HIS 752 N 1.67 0.10 0.00 1.61 -3.43 -0.94 -5.04 115.29 109.26 1ng9 s HIS 752 Ca 0.29 -0.13 0.00 0.00 -0.80 0.00 0.00 55.06 54.42 1ng9 s HIS 752 Cb -0.16 -0.61 0.00 0.00 -1.43 0.00 0.00 32.58 30.39 1ng9 s HIS 752 CO 0.11 -0.46 0.00 0.41 -2.00 0.00 0.00 174.74 172.80 1ng9 n GLY 753 N 5.29 2.38 2.06 -1.38 0.00 -1.26 -3.14 105.19 109.14 1ng9 n GLY 753 Ca -0.06 -0.45 -0.24 0.00 0.00 0.00 0.00 46.02 45.27 1ng9 n GLY 753 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ng9 n ASP 754 N 2.89 6.79 -3.52 1.61 8.00 -1.26 -4.94 116.55 126.12 1ng9 n ASP 754 Ca 0.00 -3.35 -0.12 0.00 0.71 0.00 0.00 54.79 52.03 1ng9 n ASP 754 Cb 0.00 -1.01 -0.04 0.00 -0.02 0.00 0.00 41.12 40.06 1ng9 n ASP 754 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1ng9 s THR 755 N -3.29 0.03 -0.00 -3.53 -1.32 -1.19 -4.97 115.64 101.37 1ng9 s THR 755 Ca 0.45 -0.24 0.08 0.00 -1.21 0.00 0.00 61.69 60.77 1ng9 s THR 755 Cb 0.35 -1.05 -0.02 0.00 -1.51 0.00 0.00 72.50 70.27 1ng9 s THR 755 CO -0.00 -0.13 -0.25 -0.51 -2.21 0.00 0.00 174.62 171.51 1ng9 s ILE 756 N -3.45 2.02 -0.08 5.08 2.07 -1.26 -2.21 121.20 123.36 1ng9 s ILE 756 Ca 0.00 -1.15 0.04 0.00 -1.41 0.00 0.00 60.65 58.14 1ng9 s ILE 756 Cb 0.00 -1.69 -0.01 0.00 0.13 0.00 0.00 42.46 40.89 1ng9 s ILE 756 CO -0.10 0.51 -0.22 0.00 -1.91 0.00 0.00 174.94 173.23 1ng9 s ALA 757 N -0.64 2.29 -0.37 1.50 0.00 -0.76 -5.02 121.76 118.75 1ng9 s ALA 757 Ca 0.10 -1.00 -0.13 0.00 0.00 0.00 0.00 51.96 50.93 1ng9 s ALA 757 Cb -0.10 -0.82 0.00 0.00 0.00 0.00 0.00 23.12 22.21 1ng9 s ALA 757 CO -0.00 0.38 0.25 -0.06 0.00 0.00 0.00 175.76 176.33 1ng9 s PHE 758 N -0.02 3.23 -0.54 0.00 0.08 -1.26 -2.38 117.98 117.08 1ng9 s PHE 758 Ca -0.07 -0.47 0.24 0.00 0.12 0.00 0.00 56.93 56.75 1ng9 s PHE 758 Cb -0.15 -2.51 0.30 0.00 -0.57 0.00 0.00 43.02 40.09 1ng9 s PHE 758 CO 0.05 -0.49 1.31 0.52 -0.10 0.00 0.00 175.22 176.52 1ng9 h MET 759 N 8.53 0.00 -4.03 0.44 2.86 -1.85 -3.48 114.93 117.40 1ng9 h MET 759 Ca -0.29 0.00 -0.40 0.00 -2.06 0.00 0.00 59.70 56.94 1ng9 h MET 759 Cb 1.14 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.82 1ng9 h MET 759 CO 0.67 0.00 -0.57 0.72 1.06 0.00 0.00 176.91 178.79 1ng9 n HIS 760 N -2.33 -1.64 -4.57 -0.22 8.25 -1.26 -4.95 115.22 108.49 1ng9 n HIS 760 Ca 0.03 0.34 -0.32 0.00 -0.26 0.00 0.00 57.72 57.51 1ng9 n HIS 760 Cb 0.47 -4.22 -0.17 0.00 1.12 0.00 0.00 29.99 27.20 1ng9 n HIS 760 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1ng9 s SER 761 N -2.47 2.96 0.04 0.41 0.15 -1.26 -4.77 113.70 108.75 1ng9 s SER 761 Ca 0.20 -0.57 -0.28 0.00 0.70 0.00 0.00 55.95 56.01 1ng9 s SER 761 Cb -0.09 -1.36 -0.05 0.00 -1.71 0.00 0.00 66.02 62.81 1ng9 s SER 761 CO 0.25 0.06 0.88 -0.69 1.20 0.00 0.00 173.24 174.93 1ng9 s VAL 762 N 0.90 4.73 0.04 4.45 1.01 -1.26 -1.95 120.40 128.31 1ng9 s VAL 762 Ca -0.06 1.86 0.04 0.00 0.00 0.00 0.00 61.98 63.83 1ng9 s VAL 762 Cb -0.15 -4.23 -0.02 0.00 0.00 0.00 0.00 36.38 31.98 1ng9 s VAL 762 CO -0.03 0.28 -0.12 -1.10 0.00 0.00 0.00 175.10 174.14 1ng9 s GLN 763 N 0.33 0.81 0.40 2.72 -1.52 -0.19 -4.89 119.66 117.31 1ng9 s GLN 763 Ca 0.45 -0.70 -0.25 0.00 -1.95 0.00 0.00 55.36 52.91 1ng9 s GLN 763 Cb -0.21 -0.77 -0.09 0.00 -0.22 0.00 0.00 33.01 31.72 1ng9 s GLN 763 CO 0.26 0.19 1.12 -0.51 -0.25 0.00 0.00 175.29 176.09 1ng9 s ASP 764 N -1.12 6.61 0.00 5.90 1.01 -1.26 -1.38 116.67 126.43 1ng9 s ASP 764 Ca -0.00 2.21 0.00 0.00 0.71 0.00 0.00 52.55 55.47 1ng9 s ASP 764 Cb -0.08 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1ng9 s ASP 764 CO 0.01 -0.60 0.00 0.61 0.21 0.00 0.00 175.17 175.40 1ng9 n GLY 765 N 0.53 1.42 3.79 0.21 0.00 -0.05 -4.85 105.19 106.24 1ng9 n GLY 765 Ca 0.05 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.76 1ng9 n GLY 765 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ng9 s ALA 766 N -2.04 2.24 0.83 4.61 0.00 -1.26 -3.02 121.76 123.12 1ng9 s ALA 766 Ca 0.00 -0.06 -0.12 0.00 0.00 0.00 0.00 51.96 51.78 1ng9 s ALA 766 Cb 0.00 -3.16 0.10 0.00 0.00 0.00 0.00 23.12 20.06 1ng9 s ALA 766 CO 0.00 -1.71 1.18 0.00 0.00 0.00 0.00 175.76 175.23 1ng9 s ALA 767 N -3.06 1.79 0.10 0.00 0.00 -1.26 -4.88 121.76 114.44 1ng9 s ALA 767 Ca 0.61 0.74 -0.18 0.00 0.00 0.00 0.00 51.96 53.12 1ng9 s ALA 767 Cb -0.15 -3.46 -0.07 0.00 0.00 0.00 0.00 23.12 19.44 1ng9 s ALA 767 CO 0.55 -2.35 1.58 1.03 0.00 0.00 0.00 175.76 176.57 1ng9 h SER 768 N -1.14 0.42 -5.64 0.00 0.87 -1.99 -3.47 113.55 102.60 1ng9 h SER 768 Ca -0.45 -0.25 -0.33 0.00 -1.23 0.00 0.00 61.79 59.54 1ng9 h SER 768 Cb 1.28 -0.11 -0.10 0.00 -0.44 0.00 0.00 62.40 63.03 1ng9 h SER 768 CO 0.45 0.56 -0.33 -1.59 -0.53 0.00 0.00 176.83 175.39 1ng9 s LYS 769 N -5.23 1.77 0.18 2.24 -2.85 -1.26 -5.17 119.74 109.41 1ng9 s LYS 769 Ca -0.14 -1.81 0.02 0.00 -1.00 0.00 0.00 55.97 53.05 1ng9 s LYS 769 Cb 0.08 0.39 -0.04 0.00 -2.06 0.00 0.00 37.83 36.20 1ng9 s LYS 769 CO 0.74 -0.69 0.32 -1.54 0.10 0.00 0.00 175.35 174.27 1ng9 s SER 770 N -3.26 6.34 -0.28 0.03 1.04 -1.26 -4.93 113.70 111.38 1ng9 s SER 770 Ca 0.34 0.21 0.08 0.00 0.48 0.00 0.00 55.95 57.06 1ng9 s SER 770 Cb 0.01 -1.92 0.45 0.00 0.10 0.00 0.00 66.02 64.66 1ng9 s SER 770 CO 0.21 0.01 1.27 -1.22 0.98 0.00 0.00 173.24 174.49 1ng9 n TYR 771 N -0.71 1.67 0.04 5.02 4.01 -1.26 -4.81 117.16 121.12 1ng9 n TYR 771 Ca -0.07 -1.95 -0.12 0.00 -0.16 0.00 0.00 57.90 55.59 1ng9 n TYR 771 Cb 0.54 -0.38 -0.08 0.00 -0.31 0.00 0.00 39.34 39.12 1ng9 n TYR 771 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1ng9 h GLY 772 N 1.65 -0.04 1.34 2.72 0.00 -1.99 -1.61 103.07 105.15 1ng9 h GLY 772 Ca 0.24 0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.56 1ng9 h GLY 772 CO 0.50 -0.01 0.29 1.41 0.00 0.00 0.00 176.54 178.73 1ng9 h LEU 773 N -0.15 0.77 -0.33 3.11 3.38 -1.99 -1.97 115.31 118.12 1ng9 h LEU 773 Ca -0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1ng9 h LEU 773 Cb 0.13 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1ng9 h LEU 773 CO 0.01 0.66 0.15 0.00 0.09 0.00 0.00 178.44 179.34 1ng9 h ALA 774 N 1.47 0.43 -0.54 1.53 0.00 -1.85 -1.99 119.26 118.31 1ng9 h ALA 774 Ca 0.21 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1ng9 h ALA 774 Cb 0.09 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1ng9 h ALA 774 CO -0.03 0.01 0.06 0.28 0.00 0.00 0.00 179.25 179.57 1ng9 h VAL 775 N 0.40 1.24 -0.50 0.00 2.07 -1.08 -1.92 116.25 116.47 1ng9 h VAL 775 Ca 0.11 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.63 1ng9 h VAL 775 Cb 0.14 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1ng9 h VAL 775 CO -0.01 0.35 0.09 0.00 0.02 0.00 0.00 177.57 178.01 1ng9 h ALA 776 N 1.25 1.22 -0.06 1.67 0.00 -1.21 -1.94 119.26 120.20 1ng9 h ALA 776 Ca 0.17 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 1ng9 h ALA 776 Cb 0.40 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1ng9 h ALA 776 CO 0.01 0.53 -0.59 0.00 0.00 0.00 0.00 179.25 179.20 1ng9 h ALA 777 N 1.35 0.90 -0.06 0.00 0.00 -1.05 -2.71 119.26 117.69 1ng9 h ALA 777 Ca 0.16 -0.54 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 1ng9 h ALA 777 Cb 0.32 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ng9 h ALA 777 CO 0.00 0.73 -0.32 1.25 0.00 0.00 0.00 179.25 180.91 1ng9 h LEU 778 N 0.14 0.11 0.00 0.00 5.85 -0.91 -2.82 115.31 117.68 1ng9 h LEU 778 Ca -0.01 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1ng9 h LEU 778 Cb 1.08 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.08 1ng9 h LEU 778 CO 0.09 0.43 0.00 0.00 -0.34 0.00 0.00 178.44 178.62 1ng9 n ALA 779 N -2.48 2.52 -0.35 1.25 0.00 -0.77 -4.92 120.51 115.77 1ng9 n ALA 779 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1ng9 n ALA 779 Cb 0.38 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.35 1ng9 n ALA 779 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ng9 n GLY 780 N 1.08 0.79 3.72 0.00 0.00 -1.06 -5.06 105.19 104.65 1ng9 n GLY 780 Ca 0.18 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1ng9 n GLY 780 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ng9 s VAL 781 N -2.00 2.67 0.32 1.61 1.01 -1.13 -4.93 120.40 117.95 1ng9 s VAL 781 Ca 0.00 0.47 -0.25 0.00 0.00 0.00 0.00 61.98 62.20 1ng9 s VAL 781 Cb 0.00 -3.30 -0.14 0.00 0.00 0.00 0.00 36.38 32.93 1ng9 s VAL 781 CO 0.00 0.04 0.63 -2.65 0.00 0.00 0.00 175.10 173.12 1ng9 n PRO 782 N 4.03 0.58 -0.17 2.72 -0.02 -1.26 -4.76 135.00 136.11 1ng9 n PRO 782 Ca 0.14 0.21 -0.03 0.00 -2.02 0.00 0.00 63.50 61.79 1ng9 n PRO 782 Cb 0.39 -1.42 0.17 0.00 -0.02 0.00 0.00 33.50 32.62 1ng9 n PRO 782 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1ng9 h LYS 783 N 1.14 0.92 -0.76 -0.52 1.57 -1.99 -2.58 116.57 114.36 1ng9 h LYS 783 Ca -0.36 -0.17 0.05 0.00 -1.87 0.00 0.00 60.65 58.30 1ng9 h LYS 783 Cb 1.40 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 33.51 1ng9 h LYS 783 CO 0.55 0.78 0.50 1.05 -0.57 0.00 0.00 179.45 181.76 1ng9 h GLU 784 N 0.90 0.83 -0.24 3.15 4.11 -1.99 0.43 114.58 121.77 1ng9 h GLU 784 Ca 0.21 -0.05 -0.18 0.00 0.07 0.00 0.00 59.36 59.41 1ng9 h GLU 784 Cb 0.23 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 1ng9 h GLU 784 CO -0.01 0.55 -0.56 0.28 0.07 0.00 0.00 179.01 179.34 1ng9 h VAL 785 N 0.86 1.30 -0.22 -1.06 2.07 -1.82 -2.38 116.25 114.99 1ng9 h VAL 785 Ca 0.32 -1.77 -0.11 0.00 0.82 0.00 0.00 66.70 65.96 1ng9 h VAL 785 Cb 0.17 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1ng9 h VAL 785 CO -0.10 0.56 -0.33 0.40 0.02 0.00 0.00 177.57 178.12 1ng9 h ILE 786 N 0.56 1.29 -0.41 4.57 1.08 -1.11 -0.39 117.51 123.10 1ng9 h ILE 786 Ca 0.01 -1.42 -0.04 0.00 -0.39 0.00 0.00 64.86 63.02 1ng9 h ILE 786 Cb 1.14 1.48 -0.02 0.00 -3.07 0.00 0.00 36.82 36.35 1ng9 h ILE 786 CO 0.11 0.44 0.09 0.50 -0.69 0.00 0.00 178.15 178.61 1ng9 h LYS 787 N 0.40 0.67 -0.62 2.37 3.64 -0.89 -1.28 116.57 120.85 1ng9 h LYS 787 Ca 0.05 -0.17 -0.09 0.00 -1.27 0.00 0.00 60.65 59.17 1ng9 h LYS 787 Cb 0.77 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 1ng9 h LYS 787 CO 0.06 0.69 0.04 -0.09 -2.27 0.00 0.00 179.45 177.88 1ng9 h ARG 788 N 0.53 1.08 -0.20 1.90 9.65 -1.21 -2.10 114.38 124.03 1ng9 h ARG 788 Ca 0.13 -0.32 -0.08 0.00 -1.10 0.00 0.00 59.98 58.60 1ng9 h ARG 788 Cb 0.33 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.79 1ng9 h ARG 788 CO 0.00 1.03 -0.24 0.00 2.80 0.00 0.00 179.97 183.56 1ng9 h ALA 789 N 1.01 1.23 0.00 2.80 0.00 -0.97 -1.25 119.26 122.08 1ng9 h ALA 789 Ca 0.18 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 1ng9 h ALA 789 Cb 0.52 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ng9 h ALA 789 CO 0.02 0.51 -0.39 0.00 0.00 0.00 0.00 179.25 179.39 1ng9 h ARG 790 N 0.32 0.00 -0.01 0.00 3.08 -1.01 -0.70 114.38 116.05 1ng9 h ARG 790 Ca 0.05 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1ng9 h ARG 790 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1ng9 h ARG 790 CO 0.04 0.39 -0.13 0.37 -1.07 0.00 0.00 179.97 179.57 1ng9 h GLN 791 N 0.00 0.10 -0.38 0.04 4.15 -0.87 -2.87 115.11 115.29 1ng9 h GLN 791 Ca -0.00 -0.10 0.05 0.00 0.77 0.00 0.00 58.65 59.36 1ng9 h GLN 791 Cb 1.00 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.70 1ng9 h GLN 791 CO 0.05 0.81 0.26 -0.22 -1.93 0.00 0.00 178.83 177.80 1ng9 h LYS 792 N -0.57 0.31 -0.46 1.69 1.63 -1.16 -2.48 116.57 115.53 1ng9 h LYS 792 Ca -0.01 -0.02 -0.08 0.00 -0.85 0.00 0.00 60.65 59.69 1ng9 h LYS 792 Cb 0.85 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.39 1ng9 h LYS 792 CO 0.03 0.21 -0.01 1.25 -3.45 0.00 0.00 179.45 177.47 1ng9 h LEU 793 N 0.32 0.80 -0.68 5.20 5.85 -1.08 -2.75 115.31 122.97 1ng9 h LEU 793 Ca 0.16 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 1ng9 h LEU 793 Cb 0.24 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1ng9 h LEU 793 CO -0.04 0.92 0.39 0.03 -0.34 0.00 0.00 178.44 179.40 1ng9 h ARG 794 N 0.67 0.95 -0.65 1.25 3.08 -1.21 -0.06 114.38 118.40 1ng9 h ARG 794 Ca 0.13 -0.10 0.14 0.00 0.07 0.00 0.00 59.98 60.21 1ng9 h ARG 794 Cb 0.51 -0.19 -0.10 0.00 0.08 0.00 0.00 29.97 30.27 1ng9 h ARG 794 CO 0.03 0.70 0.06 0.93 -1.07 0.00 0.00 179.97 180.61 1ng9 h GLU 795 N 0.93 0.16 0.00 0.04 5.08 -1.45 -1.57 114.58 117.78 1ng9 h GLU 795 Ca 0.24 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.49 1ng9 h GLU 795 Cb 0.02 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1ng9 h GLU 795 CO -0.04 0.11 -0.47 -0.07 -1.00 0.00 0.00 179.01 177.53 1ng9 h LEU 796 N 0.17 0.00 0.00 1.33 3.38 -0.92 -2.97 115.31 116.30 1ng9 h LEU 796 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1ng9 h LEU 796 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1ng9 h LEU 796 CO -0.52 0.47 -0.21 -0.62 0.09 0.00 0.00 178.44 177.66 1ng9 n GLU 797 N -3.63 0.23 0.00 1.13 1.02 -0.16 -3.14 120.64 116.10 1ng9 n GLU 797 Ca -0.01 0.14 0.13 0.00 -0.02 0.00 0.00 57.16 57.41 1ng9 n GLU 797 Cb 0.56 -1.72 0.43 0.00 -0.02 0.00 0.00 31.44 30.69 1ng9 n GLU 797 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1ng9 n SER 798 N -2.09 0.35 -0.15 1.62 3.41 -0.64 -3.87 113.62 112.26 1ng9 n SER 798 Ca 0.05 -0.07 -0.03 0.00 -0.26 0.00 0.00 58.87 58.56 1ng9 n SER 798 Cb 0.42 -0.05 0.05 0.00 -0.26 0.00 0.00 64.21 64.37 1ng9 n SER 798 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1ng9 h ILE 799 N 0.13 0.65 0.00 -1.33 2.04 -1.60 -3.51 117.51 113.88 1ng9 h ILE 799 Ca 0.00 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1ng9 h ILE 799 Cb 0.48 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1ng9 h ILE 799 CO 0.00 0.03 0.00 -0.24 0.00 0.00 0.00 178.15 177.94