#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d47 s GLU 2 N 0.00 3.10 0.59 0.03 8.01 -1.26 -5.00 118.70 124.18 3d47 s GLU 2 Ca 0.00 1.18 -0.19 0.00 0.01 0.00 0.00 54.97 55.97 3d47 s GLU 2 Cb 0.00 -2.00 -0.04 0.00 -4.31 0.00 0.00 34.13 27.78 3d47 s GLU 2 CO 0.00 -0.98 1.20 -0.80 0.01 0.00 0.00 175.26 174.69 3d47 s ASN 3 N -2.99 5.24 0.78 -0.19 0.01 -1.26 -4.98 114.94 111.55 3d47 s ASN 3 Ca 0.63 2.36 -0.11 0.00 -0.71 0.00 0.00 52.86 55.03 3d47 s ASN 3 Cb -0.16 -2.60 0.06 0.00 0.41 0.00 0.00 41.25 38.96 3d47 s ASN 3 CO 0.42 -1.55 1.08 0.27 -1.51 0.00 0.00 177.10 175.81 3d47 s ILE 4 N -1.63 3.34 0.27 0.60 -4.36 -1.26 -4.97 121.20 113.19 3d47 s ILE 4 Ca 0.77 0.43 -0.30 0.00 -0.26 0.00 0.00 60.65 61.29 3d47 s ILE 4 Cb -0.29 -3.06 -0.11 0.00 1.25 0.00 0.00 42.46 40.24 3d47 s ILE 4 CO 0.32 -0.57 1.61 -0.32 0.24 0.00 0.00 174.94 176.23 3d47 s MET 5 N -5.01 4.13 0.25 0.37 -2.45 -1.26 -4.96 119.30 110.38 3d47 s MET 5 Ca 0.61 2.56 -0.28 0.00 -1.25 0.00 0.00 55.69 57.33 3d47 s MET 5 Cb -0.16 -3.04 -0.09 0.00 1.25 0.00 0.00 34.83 32.79 3d47 s MET 5 CO 0.55 -0.65 0.91 0.95 1.05 0.00 0.00 175.02 177.84 3d47 s THR 6 N 0.26 4.16 -0.04 10.11 -4.23 -1.26 -5.06 115.64 119.59 3d47 s THR 6 Ca 0.66 1.94 0.06 0.00 -1.18 0.00 0.00 61.69 63.17 3d47 s THR 6 Cb -0.48 -4.20 -0.01 0.00 1.34 0.00 0.00 72.50 69.15 3d47 s THR 6 CO 0.44 0.39 -0.23 -0.76 -0.54 0.00 0.00 174.62 173.92 3d47 s LEU 7 N -1.44 2.04 0.67 4.79 1.43 -1.26 -5.08 118.68 119.82 3d47 s LEU 7 Ca 0.43 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 52.96 3d47 s LEU 7 Cb -0.23 -1.27 -0.01 0.00 0.03 0.00 0.00 46.19 44.71 3d47 s LEU 7 CO 0.29 0.25 1.05 -2.16 0.23 0.00 0.00 176.35 176.01 3d47 s PRO 8 N -0.26 3.17 0.38 1.29 0.04 -1.26 -4.91 135.00 133.46 3d47 s PRO 8 Ca 0.01 0.76 -0.00 0.00 0.04 0.00 0.00 61.00 61.80 3d47 s PRO 8 Cb -0.12 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 3d47 s PRO 8 CO 0.02 -0.88 0.61 0.15 0.04 0.00 0.00 177.00 176.94 3d47 s LYS 9 N -5.17 3.42 -0.02 4.56 -0.14 -1.26 -2.79 119.74 118.34 3d47 s LYS 9 Ca 0.57 -0.28 -0.30 0.00 -1.36 0.00 0.00 55.97 54.60 3d47 s LYS 9 Cb -0.12 -2.60 -0.03 0.00 -1.68 0.00 0.00 37.83 33.40 3d47 s LYS 9 CO 0.54 0.02 1.04 0.42 -0.76 0.00 0.00 175.35 176.61 3d47 s ILE 10 N -2.42 4.67 -0.25 2.17 1.01 0.13 -0.49 121.20 126.02 3d47 s ILE 10 Ca 0.42 1.93 -0.13 0.00 0.00 0.00 0.00 60.65 62.87 3d47 s ILE 10 Cb -0.10 -4.24 -0.15 0.00 0.01 0.00 0.00 42.46 37.99 3d47 s ILE 10 CO 0.38 0.10 -0.19 1.17 0.00 0.00 0.00 174.94 176.40 3d47 n LYS 11 N 4.32 0.60 -4.06 2.79 4.81 0.70 -0.58 118.16 126.73 3d47 n LYS 11 Ca 0.08 0.31 -0.08 0.00 -0.87 0.00 0.00 58.31 57.74 3d47 n LYS 11 Cb 0.49 -1.56 -0.10 0.00 0.02 0.00 0.00 35.03 33.88 3d47 n LYS 11 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 3d47 s HIS 12 N -2.48 0.50 -0.05 5.64 3.76 -0.53 -4.72 115.29 117.40 3d47 s HIS 12 Ca -0.36 -0.85 0.01 0.00 -0.15 0.00 0.00 55.06 53.71 3d47 s HIS 12 Cb 0.12 -0.35 0.02 0.00 1.11 0.00 0.00 32.58 33.48 3d47 s HIS 12 CO 0.54 -0.28 -0.04 0.54 -0.85 0.00 0.00 174.74 174.65 3d47 s VAL 13 N -2.98 0.56 0.12 -0.90 0.11 -1.26 -0.39 120.40 115.66 3d47 s VAL 13 Ca -0.00 -0.11 0.07 0.00 -2.93 0.00 0.00 61.98 59.00 3d47 s VAL 13 Cb 0.01 -0.60 -0.04 0.00 -1.53 0.00 0.00 36.38 34.23 3d47 s VAL 13 CO -0.06 0.24 -0.16 -0.13 -3.33 0.00 0.00 175.10 171.66 3d47 s ARG 14 N 1.07 1.06 -0.00 1.54 0.52 -0.21 -4.92 118.95 118.01 3d47 s ARG 14 Ca -0.09 -1.23 0.03 0.00 -0.52 0.00 0.00 55.73 53.93 3d47 s ARG 14 Cb -0.14 -1.04 -0.01 0.00 0.52 0.00 0.00 34.95 34.28 3d47 s ARG 14 CO -0.01 0.21 -0.09 0.00 0.02 0.00 0.00 175.30 175.44 3d47 s ALA 15 N -1.88 0.73 0.25 2.13 0.00 -1.26 -1.33 121.76 120.40 3d47 s ALA 15 Ca 0.09 -0.40 0.01 0.00 0.00 0.00 0.00 51.96 51.66 3d47 s ALA 15 Cb -0.06 -0.18 -0.05 0.00 0.00 0.00 0.00 23.12 22.83 3d47 s ALA 15 CO 0.04 0.17 0.10 -1.58 0.00 0.00 0.00 175.76 174.49 3d47 s TRP 16 N -0.26 1.50 0.08 0.00 0.51 -0.15 -4.67 118.94 115.96 3d47 s TRP 16 Ca 0.03 -1.19 -0.11 0.00 -2.12 0.00 0.00 56.10 52.70 3d47 s TRP 16 Cb -0.04 -0.87 0.01 0.00 -0.81 0.00 0.00 33.47 31.77 3d47 s TRP 16 CO -0.00 -0.36 0.25 -0.59 -0.51 0.00 0.00 176.95 175.74 3d47 s PHE 17 N -3.79 0.02 0.04 -1.98 -0.12 -0.55 -0.63 117.98 110.97 3d47 s PHE 17 Ca 0.38 -0.33 -0.03 0.00 -0.05 0.00 0.00 56.93 56.90 3d47 s PHE 17 Cb 0.08 0.03 -0.02 0.00 -0.63 0.00 0.00 43.02 42.48 3d47 s PHE 17 CO 0.13 -0.54 0.03 0.96 -0.05 0.00 0.00 175.22 175.75 3d47 s ILE 18 N -3.35 0.15 0.00 -4.49 -4.36 -0.96 -1.09 121.20 107.11 3d47 s ILE 18 Ca 0.01 -1.22 0.00 0.00 -0.26 0.00 0.00 60.65 59.18 3d47 s ILE 18 Cb 0.02 -0.86 0.00 0.00 1.25 0.00 0.00 42.46 42.87 3d47 s ILE 18 CO -0.08 -0.67 0.00 0.61 0.24 0.00 0.00 174.94 175.04 3d47 n GLY 19 N 0.86 -0.89 0.00 6.27 0.00 -1.26 -1.30 105.19 108.88 3d47 n GLY 19 Ca -0.19 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.72 3d47 n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d47 n GLY 20 N 0.00 -1.30 0.34 -0.02 0.00 -1.26 -3.55 105.19 99.40 3d47 n GLY 20 Ca 0.00 -1.59 0.22 0.00 0.00 0.00 0.00 46.02 44.65 3d47 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d47 h ALA 21 N 0.00 1.05 -0.39 4.61 0.00 -1.09 -2.23 119.26 121.22 3d47 h ALA 21 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d47 h ALA 21 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3d47 h ALA 21 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.50 3d47 n THR 22 N -3.15 1.52 -1.54 0.00 -2.24 -1.26 -5.00 114.28 102.60 3d47 n THR 22 Ca -0.03 -1.29 0.00 0.00 -2.27 0.00 0.00 64.05 60.46 3d47 n THR 22 Cb 0.07 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 3d47 n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d47 n ALA 23 N 0.37 0.00 -2.62 6.98 0.00 -0.84 -5.02 120.51 119.37 3d47 n ALA 23 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.20 3d47 n ALA 23 Cb 0.65 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.05 3d47 n ALA 23 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3d47 s GLU 24 N 2.69 4.04 0.31 0.00 2.12 -1.26 -4.75 118.70 121.83 3d47 s GLU 24 Ca 0.00 0.71 -0.29 0.00 0.36 0.00 0.00 54.97 55.75 3d47 s GLU 24 Cb 0.00 -3.70 -0.11 0.00 0.26 0.00 0.00 34.13 30.58 3d47 s GLU 24 CO 0.00 -0.64 1.51 0.21 -0.54 0.00 0.00 175.26 175.80 3d47 s LYS 25 N 2.95 4.17 0.00 4.30 2.36 -1.26 -2.64 119.74 129.62 3d47 s LYS 25 Ca 0.34 2.49 0.00 0.00 -2.55 0.00 0.00 55.97 56.24 3d47 s LYS 25 Cb -0.14 -3.03 0.00 0.00 -1.05 0.00 0.00 37.83 33.60 3d47 s LYS 25 CO 0.11 -0.53 0.00 0.41 1.55 0.00 0.00 175.35 176.89 3d47 n GLY 26 N 1.66 0.52 0.20 5.54 0.00 -1.26 -4.90 105.19 106.95 3d47 n GLY 26 Ca 0.05 -0.74 0.14 0.00 0.00 0.00 0.00 46.02 45.48 3d47 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d47 h ALA 27 N 0.00 1.00 -0.81 4.61 0.00 -1.49 -3.42 119.26 119.16 3d47 h ALA 27 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d47 h ALA 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3d47 h ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3d47 n GLY 28 N -0.62 2.91 7.00 0.00 0.00 0.51 -4.54 105.19 110.45 3d47 n GLY 28 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3d47 n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d47 n GLY 29 N 0.00 2.12 0.21 -0.02 0.00 -0.45 -3.37 105.19 103.67 3d47 n GLY 29 Ca 0.00 -0.38 -0.06 0.00 0.00 0.00 0.00 46.02 45.58 3d47 n GLY 29 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3d47 h GLY 30 N 0.00 0.46 -7.29 -0.02 0.00 -1.81 -3.40 103.07 91.01 3d47 h GLY 30 Ca 0.00 -0.49 -0.62 0.00 0.00 0.00 0.00 47.33 46.22 3d47 h GLY 30 CO 0.00 0.44 0.95 -0.35 0.00 0.00 0.00 176.54 177.58 3d47 s ASP 31 N -6.88 6.36 0.49 0.19 -1.08 -1.22 -4.46 116.67 110.07 3d47 s ASP 31 Ca -0.06 -1.24 0.31 0.00 -0.52 0.00 0.00 52.55 51.05 3d47 s ASP 31 Cb 0.12 -2.48 1.42 0.00 -1.46 0.00 0.00 42.92 40.52 3d47 s ASP 31 CO 0.81 -1.45 1.76 1.88 0.52 0.00 0.00 175.17 178.68 3d47 h TYR 32 N 9.55 0.26 -0.02 -5.34 0.05 -1.85 0.12 116.97 119.73 3d47 h TYR 32 Ca -0.06 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.73 3d47 h TYR 32 Cb 1.04 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.71 3d47 h TYR 32 CO 1.12 -0.01 -0.02 0.72 -1.05 0.00 0.00 178.16 178.93 3d47 n HIS 33 N -4.36 0.00 -2.48 4.88 8.25 -1.26 -4.60 115.22 115.66 3d47 n HIS 33 Ca 0.28 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.31 3d47 n HIS 33 Cb 1.21 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 32.32 3d47 n HIS 33 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3d47 n ASP 34 N 0.17 5.00 -4.77 0.41 2.03 0.03 -4.63 116.55 114.79 3d47 n ASP 34 Ca 0.18 -3.03 -0.26 0.00 0.52 0.00 0.00 54.79 52.20 3d47 n ASP 34 Cb 0.37 -1.54 -0.06 0.00 -0.72 0.00 0.00 41.12 39.16 3d47 n ASP 34 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3d47 s GLN 35 N 1.24 2.23 0.00 -0.67 -1.52 -1.26 -0.36 119.66 119.32 3d47 s GLN 35 Ca 0.42 -1.93 0.00 0.00 -1.95 0.00 0.00 55.36 51.90 3d47 s GLN 35 Cb 0.06 -1.95 0.00 0.00 -0.22 0.00 0.00 33.01 30.90 3d47 s GLN 35 CO -0.00 -0.22 0.00 0.41 -0.25 0.00 0.00 175.29 175.23 3d47 n GLY 36 N -1.32 0.27 3.94 3.09 0.00 -1.26 -4.09 105.19 105.83 3d47 n GLY 36 Ca -0.03 -1.57 -0.24 0.00 0.00 0.00 0.00 46.02 44.18 3d47 n GLY 36 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d47 s GLY 37 N -0.44 1.66 -1.52 -0.02 0.00 -1.26 -4.38 107.32 101.36 3d47 s GLY 37 Ca 0.00 -1.01 -0.03 0.00 0.00 0.00 0.00 44.72 43.68 3d47 s GLY 37 CO 0.00 -0.75 0.31 0.70 0.00 0.00 0.00 173.10 173.37 3d47 n ASN 38 N -2.40 -5.42 -4.83 1.64 3.02 -1.26 -4.98 115.26 101.02 3d47 n ASN 38 Ca 0.05 -0.14 -0.37 0.00 -0.03 0.00 0.00 54.58 54.08 3d47 n ASN 38 Cb 0.59 -4.46 -0.06 0.00 -0.61 0.00 0.00 39.78 35.23 3d47 n ASN 38 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 3d47 s HIS 39 N -3.02 3.59 0.35 3.10 2.46 -1.26 -4.78 115.29 115.73 3d47 s HIS 39 Ca 0.18 0.64 0.07 0.00 0.47 0.00 0.00 55.06 56.41 3d47 s HIS 39 Cb -0.08 -2.11 0.75 0.00 -0.13 0.00 0.00 32.58 31.01 3d47 s HIS 39 CO 0.22 0.60 1.91 0.11 -2.47 0.00 0.00 174.74 175.11 3d47 h TRP 40 N 5.32 0.82 0.00 3.88 5.08 -1.53 -0.76 115.95 128.76 3d47 h TRP 40 Ca -0.51 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.48 3d47 h TRP 40 Cb 1.21 -0.27 0.00 0.00 -3.00 0.00 0.00 29.16 27.10 3d47 h TRP 40 CO 0.71 0.37 0.00 1.51 -1.28 0.00 0.00 178.44 179.75 3d47 n ILE 41 N -4.52 1.16 -0.60 0.12 3.06 -1.26 -1.40 119.36 115.93 3d47 n ILE 41 Ca 0.14 0.29 0.01 0.00 -2.50 0.00 0.00 62.75 60.69 3d47 n ILE 41 Cb 0.34 -1.24 0.01 0.00 0.54 0.00 0.00 39.64 39.30 3d47 n ILE 41 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 3d47 n ASP 42 N -1.33 1.17 -4.44 9.51 2.03 -0.31 -4.88 116.55 118.30 3d47 n ASP 42 Ca 0.01 -1.74 -0.44 0.00 0.52 0.00 0.00 54.79 53.14 3d47 n ASP 42 Cb 0.03 -0.05 -0.02 0.00 -0.72 0.00 0.00 41.12 40.36 3d47 n ASP 42 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3d47 s ASP 43 N -0.82 6.77 -1.51 1.67 2.15 -0.49 -4.31 116.67 120.13 3d47 s ASP 43 Ca 0.03 -2.37 -0.13 0.00 0.43 0.00 0.00 52.55 50.51 3d47 s ASP 43 Cb 0.03 -2.38 0.07 0.00 -0.30 0.00 0.00 42.92 40.34 3d47 s ASP 43 CO 0.00 -0.92 0.99 1.57 -0.17 0.00 0.00 175.17 176.64 3d47 n HIS 44 N 6.00 -2.34 -2.65 -5.34 -0.00 0.41 -4.94 115.22 106.34 3d47 n HIS 44 Ca 0.26 0.92 -0.42 0.00 -0.00 0.00 0.00 57.72 58.48 3d47 n HIS 44 Cb 0.47 -4.11 -0.04 0.00 -0.00 0.00 0.00 29.99 26.32 3d47 n HIS 44 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 3d47 s ILE 45 N -3.32 4.54 0.22 3.57 1.01 -1.26 -4.41 121.20 121.55 3d47 s ILE 45 Ca 0.62 1.93 -0.30 0.00 0.00 0.00 0.00 60.65 62.90 3d47 s ILE 45 Cb -0.31 -4.24 -0.10 0.00 0.01 0.00 0.00 42.46 37.83 3d47 s ILE 45 CO 0.82 0.21 1.46 0.00 0.00 0.00 0.00 174.94 177.43 3d47 s ALA 46 N 0.59 3.65 0.31 9.38 0.00 -0.41 -4.87 121.76 130.41 3d47 s ALA 46 Ca 0.51 1.32 -0.05 0.00 0.00 0.00 0.00 51.96 53.74 3d47 s ALA 46 Cb -0.24 -3.57 -0.00 0.00 0.00 0.00 0.00 23.12 19.31 3d47 s ALA 46 CO 0.29 -0.73 0.44 0.95 0.00 0.00 0.00 175.76 176.71 3d47 s THR 47 N 0.28 0.00 -0.80 0.00 -4.23 -1.26 -4.55 115.64 105.07 3d47 s THR 47 Ca 0.62 -1.60 0.12 0.00 -1.18 0.00 0.00 61.69 59.65 3d47 s THR 47 Cb -0.42 -2.53 0.11 0.00 1.34 0.00 0.00 72.50 71.01 3d47 s THR 47 CO 0.40 0.00 1.37 -2.65 -0.54 0.00 0.00 174.62 173.20 3d47 n PRO 48 N -0.49 0.05 -0.00 3.99 -0.02 -1.26 -2.21 135.00 135.05 3d47 n PRO 48 Ca 0.00 0.42 0.07 0.00 -2.02 0.00 0.00 63.50 61.97 3d47 n PRO 48 Cb 0.62 -1.63 -0.09 0.00 -0.02 0.00 0.00 33.50 32.38 3d47 n PRO 48 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3d47 n MET 49 N -1.73 1.62 0.00 -0.52 2.81 -1.26 -4.53 117.12 113.51 3d47 n MET 49 Ca 0.01 -0.05 0.03 0.00 -1.81 0.00 0.00 57.70 55.89 3d47 n MET 49 Cb 0.10 -1.24 0.16 0.00 -0.71 0.00 0.00 33.22 31.53 3d47 n MET 49 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3d47 n SER 50 N -1.57 0.00 0.17 7.83 3.41 -0.94 -1.12 113.62 121.41 3d47 n SER 50 Ca 0.01 0.46 0.13 0.00 -0.26 0.00 0.00 58.87 59.21 3d47 n SER 50 Cb 0.28 -0.47 0.51 0.00 -0.26 0.00 0.00 64.21 64.27 3d47 n SER 50 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 3d47 h LYS 51 N 0.00 0.00 -5.63 4.33 2.10 -1.80 -3.39 116.57 112.19 3d47 h LYS 51 Ca 0.00 0.00 -0.58 0.00 -2.00 0.00 0.00 60.65 58.07 3d47 h LYS 51 Cb 0.12 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 31.36 3d47 h LYS 51 CO 0.00 0.00 -0.20 0.71 -2.00 0.00 0.00 179.45 177.96 3d47 s TYR 52 N -3.37 3.48 0.16 0.07 2.02 -0.27 -5.00 117.35 114.43 3d47 s TYR 52 Ca 0.04 0.77 -0.26 0.00 -0.37 0.00 0.00 57.07 57.25 3d47 s TYR 52 Cb 0.09 -2.49 0.01 0.00 -0.40 0.00 0.00 41.96 39.18 3d47 s TYR 52 CO 0.48 0.17 1.58 -0.09 -1.57 0.00 0.00 175.55 176.11 3d47 h ARG 53 N 6.79 -0.29 0.00 -0.62 9.65 -1.86 -0.96 114.38 127.09 3d47 h ARG 53 Ca -0.40 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.50 3d47 h ARG 53 Cb 1.17 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.82 3d47 h ARG 53 CO 0.75 -0.19 0.00 -0.25 2.80 0.00 0.00 179.97 183.08 3d47 n ASP 54 N -5.41 0.56 -0.09 -3.80 8.00 -1.26 -2.83 116.55 111.72 3d47 n ASP 54 Ca -0.00 0.71 0.05 0.00 0.71 0.00 0.00 54.79 56.26 3d47 n ASP 54 Cb 0.35 -0.80 0.08 0.00 -0.02 0.00 0.00 41.12 40.72 3d47 n ASP 54 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3d47 n TYR 55 N -2.20 0.00 0.05 1.24 4.01 -0.46 -4.78 117.16 115.03 3d47 n TYR 55 Ca 0.00 -0.69 -0.20 0.00 -0.16 0.00 0.00 57.90 56.85 3d47 n TYR 55 Cb 0.11 -0.10 -0.13 0.00 -0.31 0.00 0.00 39.34 38.91 3d47 n TYR 55 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 3d47 h GLU 56 N 0.00 0.52 -0.15 -0.72 4.81 -1.14 -3.37 114.58 114.53 3d47 h GLU 56 Ca 0.00 -0.66 -0.19 0.00 -0.13 0.00 0.00 59.36 58.38 3d47 h GLU 56 Cb 0.89 0.21 0.01 0.00 0.63 0.00 0.00 28.75 30.50 3d47 h GLU 56 CO 0.00 1.27 -0.63 0.37 -0.73 0.00 0.00 179.01 179.30 3d47 h GLN 57 N 0.06 0.69 -4.82 1.92 5.75 -1.86 -3.41 115.11 113.45 3d47 h GLN 57 Ca -0.14 -0.54 -0.50 0.00 -0.15 0.00 0.00 58.65 57.31 3d47 h GLN 57 Cb 1.68 0.11 -0.32 0.00 1.07 0.00 0.00 27.48 30.02 3d47 h GLN 57 CO 0.19 1.16 -0.81 0.45 -2.65 0.00 0.00 178.83 177.17 3d47 s SER 58 N -6.90 1.70 0.17 -0.69 0.15 -1.26 -0.45 113.70 106.42 3d47 s SER 58 Ca -0.11 -0.28 0.05 0.00 0.70 0.00 0.00 55.95 56.31 3d47 s SER 58 Cb 0.08 -0.56 0.01 0.00 -1.71 0.00 0.00 66.02 63.83 3d47 s SER 58 CO 0.87 0.09 1.39 0.03 1.20 0.00 0.00 173.24 176.82 3d47 h ARG 59 N 6.51 0.12 -0.58 5.44 3.08 -1.83 -2.80 114.38 124.32 3d47 h ARG 59 Ca -0.32 -0.14 0.05 0.00 0.07 0.00 0.00 59.98 59.64 3d47 h ARG 59 Cb 1.18 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 31.23 3d47 h ARG 59 CO 0.48 0.91 0.39 1.96 -1.07 0.00 0.00 179.97 182.63 3d47 h GLN 60 N 0.07 0.58 -0.23 0.04 4.20 -1.93 -1.38 115.11 116.46 3d47 h GLN 60 Ca -0.03 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 3d47 h GLN 60 Cb 1.50 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 29.14 3d47 h GLN 60 CO 0.13 0.38 0.10 0.66 -0.67 0.00 0.00 178.83 179.42 3d47 h SER 61 N 0.60 0.28 -0.01 1.46 4.64 -1.87 -0.85 113.55 117.79 3d47 h SER 61 Ca 0.25 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3d47 h SER 61 Cb 0.22 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3d47 h SER 61 CO -0.07 0.26 -0.01 2.22 -0.87 0.00 0.00 176.83 178.36 3d47 n PHE 62 N -4.45 0.00 -0.33 4.77 1.16 -0.55 -4.94 117.46 113.11 3d47 n PHE 62 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 3d47 n PHE 62 Cb 0.12 -0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.99 3d47 n PHE 62 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3d47 n GLY 63 N 1.20 1.53 0.00 4.97 0.00 -0.32 -4.98 105.19 107.59 3d47 n GLY 63 Ca 0.18 -0.13 0.09 0.00 0.00 0.00 0.00 46.02 46.16 3d47 n GLY 63 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3d47 n ILE 64 N -1.15 0.57 -0.34 -0.61 3.06 -1.00 -2.91 119.36 116.97 3d47 n ILE 64 Ca 0.00 0.14 0.04 0.00 -2.50 0.00 0.00 62.75 60.44 3d47 n ILE 64 Cb 0.08 -0.84 0.10 0.00 0.54 0.00 0.00 39.64 39.52 3d47 n ILE 64 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 3d47 n ASN 65 N -1.37 2.60 0.22 9.51 6.94 -1.26 -4.75 115.26 127.15 3d47 n ASN 65 Ca 0.07 -2.29 0.09 0.00 -0.02 0.00 0.00 54.58 52.43 3d47 n ASN 65 Cb 0.17 -0.21 0.44 0.00 -2.36 0.00 0.00 39.78 37.82 3d47 n ASN 65 CO 0.00 0.00 0.00 -0.37 -1.03 0.00 0.00 177.26 175.86 3d47 h VAL 66 N 0.90 0.64 0.06 3.53 -1.51 -1.91 -3.34 116.25 114.62 3d47 h VAL 66 Ca 0.00 -1.19 -0.09 0.00 -1.23 0.00 0.00 66.70 64.19 3d47 h VAL 66 Cb 0.77 1.78 0.01 0.00 -2.13 0.00 0.00 31.29 31.72 3d47 h VAL 66 CO 0.03 0.25 -0.39 -0.07 -1.23 0.00 0.00 177.57 176.16 3d47 h LEU 67 N 0.00 0.24 0.00 4.19 3.38 -1.85 0.40 115.31 121.67 3d47 h LEU 67 Ca -0.00 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 57.04 3d47 h LEU 67 Cb 0.76 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.43 3d47 h LEU 67 CO 0.03 1.15 0.00 0.61 0.09 0.00 0.00 178.44 180.33 3d47 n GLY 68 N 1.50 -1.38 3.73 0.83 0.00 -1.25 -2.93 105.19 105.68 3d47 n GLY 68 Ca -0.11 -1.28 -0.35 0.00 0.00 0.00 0.00 46.02 44.27 3d47 n GLY 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d47 s THR 69 N 0.00 5.39 -0.16 2.61 2.01 -0.42 -2.33 115.64 122.74 3d47 s THR 69 Ca 0.00 0.18 -0.08 0.00 0.31 0.00 0.00 61.69 62.10 3d47 s THR 69 Cb 0.00 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 69.00 3d47 s THR 69 CO 0.00 0.44 0.13 -0.22 -0.69 0.00 0.00 174.62 174.28 3d47 s LEU 70 N 0.38 4.26 -0.12 4.42 2.96 0.45 -2.26 118.68 128.76 3d47 s LEU 70 Ca 0.08 0.33 0.02 0.00 -0.22 0.00 0.00 54.13 54.34 3d47 s LEU 70 Cb -0.11 -2.07 0.01 0.00 0.50 0.00 0.00 46.19 44.52 3d47 s LEU 70 CO -0.02 0.28 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.49 3d47 s ILE 71 N -0.27 1.71 -0.13 6.68 1.01 0.20 -1.41 121.20 128.99 3d47 s ILE 71 Ca 0.11 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 60.01 3d47 s ILE 71 Cb -0.12 -1.54 0.01 0.00 0.01 0.00 0.00 42.46 40.82 3d47 s ILE 71 CO 0.01 0.48 -0.22 -0.69 0.00 0.00 0.00 174.94 174.52 3d47 s VAL 72 N 0.86 2.14 -0.09 2.92 1.01 -0.66 -0.97 120.40 125.61 3d47 s VAL 72 Ca -0.08 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 60.96 3d47 s VAL 72 Cb -0.15 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.39 3d47 s VAL 72 CO -0.01 0.55 -0.18 -0.70 0.00 0.00 0.00 175.10 174.77 3d47 s GLU 73 N 0.68 2.38 -0.16 2.72 2.12 -0.44 -1.80 118.70 124.20 3d47 s GLU 73 Ca -0.10 -0.64 -0.03 0.00 0.36 0.00 0.00 54.97 54.56 3d47 s GLU 73 Cb -0.16 -1.88 -0.02 0.00 0.26 0.00 0.00 34.13 32.33 3d47 s GLU 73 CO 0.01 0.07 -0.06 0.08 -0.54 0.00 0.00 175.26 174.83 3d47 s VAL 74 N 0.59 3.59 -0.18 3.70 1.01 0.32 -1.04 120.40 128.38 3d47 s VAL 74 Ca -0.15 -0.46 -0.03 0.00 0.00 0.00 0.00 61.98 61.34 3d47 s VAL 74 Cb -0.17 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.63 3d47 s VAL 74 CO 0.05 0.49 -0.05 -0.70 0.00 0.00 0.00 175.10 174.88 3d47 s GLU 75 N 0.58 3.50 0.63 2.72 2.12 0.48 -1.55 118.70 127.17 3d47 s GLU 75 Ca -0.04 -0.59 -0.07 0.00 0.36 0.00 0.00 54.97 54.63 3d47 s GLU 75 Cb -0.15 -2.91 0.02 0.00 0.26 0.00 0.00 34.13 31.35 3d47 s GLU 75 CO 0.03 0.05 0.96 0.00 -0.54 0.00 0.00 175.26 175.75 3d47 s ALA 76 N 0.85 3.20 0.56 6.30 0.00 0.03 -0.22 121.76 132.48 3d47 s ALA 76 Ca -0.01 -0.67 0.25 0.00 0.00 0.00 0.00 51.96 51.52 3d47 s ALA 76 Cb -0.15 -2.68 1.52 0.00 0.00 0.00 0.00 23.12 21.82 3d47 s ALA 76 CO 0.01 -0.95 2.11 0.93 0.00 0.00 0.00 175.76 177.86 3d47 h GLU 77 N -0.33 0.00 -0.49 0.00 4.39 -1.10 0.04 114.58 117.08 3d47 h GLU 77 Ca -0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.25 3d47 h GLU 77 Cb 1.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 3d47 h GLU 77 CO 0.61 0.00 0.00 0.27 -1.16 0.00 0.00 179.01 178.73 3d47 n ASN 78 N -4.12 2.38 0.00 1.42 6.94 -1.26 -4.91 115.26 115.71 3d47 n ASN 78 Ca 0.02 -2.13 0.00 0.00 -0.02 0.00 0.00 54.58 52.44 3d47 n ASN 78 Cb 0.31 -0.35 0.00 0.00 -2.36 0.00 0.00 39.78 37.38 3d47 n ASN 78 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3d47 n ARG 79 N 0.50 0.00 -2.18 -3.83 1.74 0.00 -5.02 116.66 107.87 3d47 n ARG 79 Ca 0.13 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.87 3d47 n ARG 79 Cb 0.43 -2.04 0.01 0.00 -1.02 0.00 0.00 32.46 29.83 3d47 n ARG 79 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3d47 s GLN 80 N -0.03 3.32 0.15 5.56 -0.21 -1.26 -4.74 119.66 122.46 3d47 s GLN 80 Ca 0.00 1.47 0.03 0.00 0.02 0.00 0.00 55.36 56.88 3d47 s GLN 80 Cb 0.00 -2.01 -0.05 0.00 1.00 0.00 0.00 33.01 31.95 3d47 s GLN 80 CO 0.00 -0.85 -0.06 0.95 -2.12 0.00 0.00 175.29 173.21 3d47 s THR 81 N -2.01 0.94 0.02 -0.19 -4.23 -1.26 -0.79 115.64 108.12 3d47 s THR 81 Ca 0.69 -2.01 -0.01 0.00 -1.18 0.00 0.00 61.69 59.18 3d47 s THR 81 Cb -0.21 -1.95 -0.02 0.00 1.34 0.00 0.00 72.50 71.66 3d47 s THR 81 CO 0.30 -0.65 -0.02 -0.83 -0.54 0.00 0.00 174.62 172.88 3d47 s GLY 82 N -3.16 0.25 0.25 3.99 0.00 -0.60 -4.58 107.32 103.47 3d47 s GLY 82 Ca 0.19 -0.63 -0.13 0.00 0.00 0.00 0.00 44.72 44.15 3d47 s GLY 82 CO 0.01 -0.71 0.49 -0.11 0.00 0.00 0.00 173.10 172.79 3d47 s PHE 83 N -1.75 0.33 0.17 1.90 -0.12 -1.25 -0.52 117.98 116.74 3d47 s PHE 83 Ca -0.13 -0.70 -0.23 0.00 -0.05 0.00 0.00 56.93 55.82 3d47 s PHE 83 Cb -0.08 0.22 0.06 0.00 -0.63 0.00 0.00 43.02 42.59 3d47 s PHE 83 CO -0.02 -1.01 0.68 0.00 -0.05 0.00 0.00 175.22 174.82 3d47 s ALA 84 N -4.01 -1.54 0.12 1.99 0.00 -0.74 -4.28 121.76 113.31 3d47 s ALA 84 Ca 0.22 0.34 0.05 0.00 0.00 0.00 0.00 51.96 52.58 3d47 s ALA 84 Cb -0.01 0.81 -0.04 0.00 0.00 0.00 0.00 23.12 23.88 3d47 s ALA 84 CO 0.09 -0.84 -0.13 0.14 0.00 0.00 0.00 175.76 175.02 3d47 s VAL 85 N -3.69 1.25 0.05 0.00 -7.23 -1.26 -1.65 120.40 107.87 3d47 s VAL 85 Ca 0.04 -1.77 -0.02 0.00 -1.81 0.00 0.00 61.98 58.42 3d47 s VAL 85 Cb -0.02 -1.56 0.01 0.00 0.56 0.00 0.00 36.38 35.36 3d47 s VAL 85 CO -0.07 -0.50 0.11 -0.24 -0.31 0.00 0.00 175.10 174.10 3d47 n SER 86 N 0.40 -0.29 -4.45 4.85 2.88 -0.50 -4.89 113.62 111.61 3d47 n SER 86 Ca -0.14 -1.20 -0.39 0.00 -1.33 0.00 0.00 58.87 55.81 3d47 n SER 86 Cb 0.58 0.49 -0.12 0.00 -0.75 0.00 0.00 64.21 64.41 3d47 n SER 86 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3d47 s THR 87 N -2.81 4.65 0.00 2.46 2.01 -1.26 -0.41 115.64 120.27 3d47 s THR 87 Ca 0.02 -0.40 0.00 0.00 0.31 0.00 0.00 61.69 61.63 3d47 s THR 87 Cb -0.01 -3.37 0.00 0.00 0.01 0.00 0.00 72.50 69.14 3d47 s THR 87 CO 0.01 0.07 0.00 0.00 -0.69 0.00 0.00 174.62 174.01 3d47 n ALA 88 N 4.99 0.00 -0.63 7.40 0.00 -0.99 -4.70 120.51 126.59 3d47 n ALA 88 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 3d47 n ALA 88 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 3d47 n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d47 n GLY 89 N -0.04 2.41 0.26 0.00 0.00 -1.15 -3.00 105.19 103.67 3d47 n GLY 89 Ca 0.00 -0.32 0.03 0.00 0.00 0.00 0.00 46.02 45.74 3d47 n GLY 89 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3d47 h GLU 90 N 0.00 0.41 -0.42 1.61 4.81 -1.86 -1.20 114.58 117.92 3d47 h GLU 90 Ca 0.00 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 3d47 h GLU 90 Cb 0.00 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 3d47 h GLU 90 CO 0.00 0.27 -0.00 0.52 -0.73 0.00 0.00 179.01 179.07 3d47 h MET 91 N 0.42 0.69 -0.38 1.92 2.86 -1.91 -1.40 114.93 117.13 3d47 h MET 91 Ca 0.37 -0.17 -0.02 0.00 -2.06 0.00 0.00 59.70 57.83 3d47 h MET 91 Cb 0.54 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.09 3d47 h MET 91 CO -0.38 0.70 0.15 0.78 1.06 0.00 0.00 176.91 179.23 3d47 h GLY 92 N 0.93 0.57 1.12 8.32 0.00 -1.14 -1.84 103.07 111.03 3d47 h GLY 92 Ca 0.13 -0.26 -0.09 0.00 0.00 0.00 0.00 47.33 47.10 3d47 h GLY 92 CO 0.02 0.25 0.01 0.00 0.00 0.00 0.00 176.54 176.82 3d47 h PHE 94 N 0.97 -0.02 -0.78 0.00 3.57 -0.81 0.18 116.94 120.06 3d47 h PHE 94 Ca 0.17 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.71 3d47 h PHE 94 Cb 0.54 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.25 3d47 h PHE 94 CO 0.04 -0.02 0.49 0.82 -2.23 0.00 0.00 178.31 177.42 3d47 h ILE 95 N -0.01 1.12 -0.00 1.41 2.04 -1.20 0.15 117.51 121.01 3d47 h ILE 95 Ca 0.01 -0.33 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 3d47 h ILE 95 Cb 0.02 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.17 3d47 h ILE 95 CO -0.02 0.18 -0.01 0.58 0.00 0.00 0.00 178.15 178.88 3d47 h VAL 96 N 0.96 1.44 0.00 1.67 2.07 -1.11 -1.27 116.25 120.02 3d47 h VAL 96 Ca 0.31 -1.32 -0.10 0.00 0.82 0.00 0.00 66.70 66.41 3d47 h VAL 96 Cb 0.01 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 3d47 h VAL 96 CO -0.11 0.34 -0.47 -0.33 0.02 0.00 0.00 177.57 177.02 3d47 h GLU 97 N -0.54 0.00 -0.01 1.57 4.39 -0.89 -2.13 114.58 116.96 3d47 h GLU 97 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3d47 h GLU 97 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 3d47 h GLU 97 CO 0.00 0.47 -0.08 1.63 -1.16 0.00 0.00 179.01 179.87 3d47 n LYS 98 N -3.47 1.12 0.04 2.33 4.76 0.52 -4.64 118.16 118.83 3d47 n LYS 98 Ca 0.00 -0.93 0.00 0.00 -2.87 0.00 0.00 58.31 54.51 3d47 n LYS 98 Cb 0.60 -1.16 0.00 0.00 -1.84 0.00 0.00 35.03 32.63 3d47 n LYS 98 CO 0.00 0.00 0.00 1.58 -1.37 0.00 0.00 177.40 177.61 3d47 n HIS 99 N 0.27 -0.79 0.30 2.13 -0.00 -0.89 -4.94 115.22 111.30 3d47 n HIS 99 Ca 0.05 0.14 0.18 0.00 0.46 0.00 0.00 57.72 58.55 3d47 n HIS 99 Cb 0.25 0.51 0.94 0.00 -0.12 0.00 0.00 29.99 31.57 3d47 n HIS 99 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 3d47 h LEU 100 N 0.00 0.00 -2.05 0.27 3.38 -1.32 -3.02 115.31 112.57 3d47 h LEU 100 Ca 0.00 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 3d47 h LEU 100 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3d47 h LEU 100 CO 0.00 0.04 0.20 -0.55 0.09 0.00 0.00 178.44 178.21 3d47 h ASN 101 N 0.00 0.00 0.65 -0.43 -1.07 -1.62 -1.68 115.58 111.43 3d47 h ASN 101 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 56.30 56.35 3d47 h ASN 101 Cb 0.17 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.42 3d47 h ASN 101 CO 0.00 0.00 -0.09 0.08 0.07 0.00 0.00 177.43 177.50 3d47 h ARG 102 N 0.00 0.00 0.00 4.14 0.11 -1.84 -2.11 114.38 114.68 3d47 h ARG 102 Ca 0.12 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.20 3d47 h ARG 102 Cb 0.52 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.60 3d47 h ARG 102 CO -0.00 0.09 -1.46 1.19 0.10 0.00 0.00 179.97 179.88 3d47 n PHE 103 N -3.33 0.34 -0.07 4.08 3.72 -0.65 -4.62 117.46 116.94 3d47 n PHE 103 Ca -0.01 0.10 -0.07 0.00 -0.05 0.00 0.00 57.45 57.42 3d47 n PHE 103 Cb 0.28 -0.60 -0.03 0.00 -0.94 0.00 0.00 39.48 38.18 3d47 n PHE 103 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 3d47 h ILE 104 N 0.00 0.25 -3.03 4.37 2.04 -1.29 -3.44 117.51 116.40 3d47 h ILE 104 Ca 0.00 -1.26 -0.53 0.00 1.00 0.00 0.00 64.86 64.07 3d47 h ILE 104 Cb 0.92 0.54 0.04 0.00 -0.74 0.00 0.00 36.82 37.58 3d47 h ILE 104 CO 0.00 0.08 0.79 -1.61 0.00 0.00 0.00 178.15 177.41 3d47 s GLU 105 N -2.11 4.27 0.00 2.37 2.02 -0.83 -2.76 118.70 121.66 3d47 s GLU 105 Ca -0.14 2.23 0.00 0.00 0.02 0.00 0.00 54.97 57.08 3d47 s GLU 105 Cb 0.02 -3.18 0.00 0.00 0.10 0.00 0.00 34.13 31.07 3d47 s GLU 105 CO 0.26 -0.49 0.00 0.41 0.02 0.00 0.00 175.26 175.46 3d47 n GLY 106 N 3.26 2.48 3.89 -1.39 0.00 0.25 -4.94 105.19 108.75 3d47 n GLY 106 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 3d47 n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d47 s LYS 107 N -0.85 2.87 0.47 1.61 -0.14 -1.11 -4.66 119.74 117.93 3d47 s LYS 107 Ca 0.00 0.31 -0.20 0.00 -1.36 0.00 0.00 55.97 54.72 3d47 s LYS 107 Cb 0.00 -2.10 -0.09 0.00 -1.68 0.00 0.00 37.83 33.95 3d47 s LYS 107 CO 0.00 -0.93 1.00 0.00 -0.76 0.00 0.00 175.35 174.66 3d47 h VAL 109 N 1.58 0.00 -0.00 0.00 -1.51 -1.84 -0.17 116.25 114.31 3d47 h VAL 109 Ca -0.49 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 3d47 h VAL 109 Cb 1.20 0.91 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 3d47 h VAL 109 CO 0.60 0.00 -0.30 -1.54 -1.23 0.00 0.00 177.57 175.10 3d47 n SER 110 N -2.94 0.65 -1.76 4.19 3.41 -1.26 -4.35 113.62 111.56 3d47 n SER 110 Ca -0.03 -0.48 -0.05 0.00 -0.26 0.00 0.00 58.87 58.05 3d47 n SER 110 Cb 0.06 0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 64.03 3d47 n SER 110 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3d47 n ASP 111 N -1.09 5.06 0.11 4.04 8.00 -0.08 -4.54 116.55 128.05 3d47 n ASP 111 Ca 0.10 -2.39 -0.13 0.00 0.71 0.00 0.00 54.79 53.07 3d47 n ASP 111 Cb 0.33 -1.21 -0.08 0.00 -0.02 0.00 0.00 41.12 40.14 3d47 n ASP 111 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3d47 h ILE 112 N 1.52 0.89 -0.33 0.53 2.04 -1.82 -2.25 117.51 118.10 3d47 h ILE 112 Ca 0.09 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.33 3d47 h ILE 112 Cb 1.19 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 3d47 h ILE 112 CO 0.11 0.13 0.14 0.11 0.00 0.00 0.00 178.15 178.65 3d47 h LYS 113 N -0.58 0.45 -0.09 2.37 1.57 -1.98 -1.19 116.57 117.12 3d47 h LYS 113 Ca -0.03 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 3d47 h LYS 113 Cb 0.43 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 3d47 h LYS 113 CO 0.05 0.37 -0.03 1.25 -0.57 0.00 0.00 179.45 180.52 3d47 h LEU 114 N 0.45 0.18 -1.01 2.94 5.85 -1.90 -1.52 115.31 120.31 3d47 h LEU 114 Ca 0.12 -0.38 -0.02 0.00 0.84 0.00 0.00 57.88 58.44 3d47 h LEU 114 Cb 0.07 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 3d47 h LEU 114 CO -0.01 0.51 0.40 0.40 -0.34 0.00 0.00 178.44 179.40 3d47 h ILE 115 N -0.16 1.24 0.13 4.05 2.04 -1.14 -1.69 117.51 121.98 3d47 h ILE 115 Ca 0.02 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 3d47 h ILE 115 Cb 0.44 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 3d47 h ILE 115 CO 0.01 0.28 -0.06 -0.74 0.00 0.00 0.00 178.15 177.63 3d47 h HIS 116 N 1.11 -0.16 -0.64 1.37 2.76 -1.10 -0.14 115.15 118.34 3d47 h HIS 116 Ca 0.27 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.43 3d47 h HIS 116 Cb 0.07 0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.05 3d47 h HIS 116 CO 0.01 -0.10 0.34 0.22 -1.30 0.00 0.00 177.93 177.10 3d47 h ASP 117 N -0.18 0.79 -0.14 3.26 3.58 -1.02 -1.54 116.42 121.16 3d47 h ASP 117 Ca -0.02 -0.06 -0.15 0.00 0.42 0.00 0.00 57.03 57.22 3d47 h ASP 117 Cb 0.14 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 40.98 3d47 h ASP 117 CO 0.03 0.64 -0.44 1.56 -2.88 0.00 0.00 179.24 178.16 3d47 h GLN 118 N 0.89 0.69 -0.49 0.28 4.20 -1.02 -0.98 115.11 118.67 3d47 h GLN 118 Ca 0.23 -0.38 -0.05 0.00 0.06 0.00 0.00 58.65 58.51 3d47 h GLN 118 Cb 0.04 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 3d47 h GLN 118 CO -0.04 0.99 0.12 0.52 -0.67 0.00 0.00 178.83 179.75 3d47 h MET 119 N 0.56 0.79 -0.29 1.46 2.86 -0.54 -0.10 114.93 119.67 3d47 h MET 119 Ca 0.04 -0.19 -0.02 0.00 -2.06 0.00 0.00 59.70 57.46 3d47 h MET 119 Cb 0.98 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.53 3d47 h MET 119 CO 0.09 0.77 0.09 -0.07 1.06 0.00 0.00 176.91 178.85 3d47 h LEU 120 N 0.67 0.42 -0.57 1.22 3.38 -1.19 -2.52 115.31 116.73 3d47 h LEU 120 Ca 0.15 -0.20 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 3d47 h LEU 120 Cb 0.33 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3d47 h LEU 120 CO 0.00 0.51 -0.17 1.23 0.09 0.00 0.00 178.44 180.11 3d47 h GLY 121 N 0.30 1.05 2.00 0.83 0.00 -1.08 -2.26 103.07 103.92 3d47 h GLY 121 Ca 0.09 -0.89 -0.04 0.00 0.00 0.00 0.00 47.33 46.49 3d47 h GLY 121 CO -0.00 0.81 -0.21 0.00 0.00 0.00 0.00 176.54 177.13 3d47 h ALA 122 N 0.95 0.98 -0.11 3.60 0.00 -0.98 -3.19 119.26 120.50 3d47 h ALA 122 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3d47 h ALA 122 Cb 0.73 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3d47 h ALA 122 CO 0.06 0.27 0.00 0.25 0.00 0.00 0.00 179.25 179.82 3d47 n THR 123 N -3.32 0.22 -0.19 0.00 -2.24 -0.95 -4.63 114.28 103.17 3d47 n THR 123 Ca 0.01 -0.61 0.20 0.00 -2.27 0.00 0.00 64.05 61.37 3d47 n THR 123 Cb 0.45 1.12 0.55 0.00 -2.10 0.00 0.00 70.33 70.36 3d47 n THR 123 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 3d47 h MET 124 N 2.74 0.31 0.00 -0.78 4.05 -1.39 0.12 114.93 119.97 3d47 h MET 124 Ca 0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 3d47 h MET 124 Cb 0.64 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.37 3d47 h MET 124 CO 0.00 0.20 0.00 2.48 0.23 0.00 0.00 176.91 179.82 3d47 n TYR 125 N -4.46 0.00 -1.15 1.39 0.18 -1.26 -3.78 117.16 108.07 3d47 n TYR 125 Ca 0.17 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.95 3d47 n TYR 125 Cb 0.69 -0.47 0.00 0.00 -0.38 0.00 0.00 39.34 39.17 3d47 n TYR 125 CO 0.00 0.00 0.00 2.48 -2.08 0.00 0.00 176.86 177.26 3d47 n TYR 126 N -1.47 0.00 0.13 -3.48 0.18 -0.14 -4.90 117.16 107.48 3d47 n TYR 126 Ca 0.05 0.00 0.03 0.00 1.88 0.00 0.00 57.90 59.86 3d47 n TYR 126 Cb 0.19 0.01 0.02 0.00 -0.38 0.00 0.00 39.34 39.19 3d47 n TYR 126 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 3d47 h SER 127 N 0.00 0.00 -0.60 9.48 4.64 -0.95 -3.48 113.55 122.64 3d47 h SER 127 Ca 0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 3d47 h SER 127 Cb 0.73 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.72 3d47 h SER 127 CO 0.00 0.46 -0.24 0.61 -0.87 0.00 0.00 176.83 176.79 3d47 n GLY 128 N 1.23 1.33 2.71 -0.77 0.00 -1.26 -3.03 105.19 105.40 3d47 n GLY 128 Ca 0.01 -0.31 -0.16 0.00 0.00 0.00 0.00 46.02 45.55 3d47 n GLY 128 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d47 n SER 129 N -0.35 -4.25 0.00 1.61 3.41 -1.26 -4.84 113.62 107.95 3d47 n SER 129 Ca -0.13 -0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 3d47 n SER 129 Cb 0.45 -3.56 0.00 0.00 -0.26 0.00 0.00 64.21 60.85 3d47 n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d47 n GLY 130 N -0.98 0.16 7.00 5.00 0.00 -1.17 -3.32 105.19 111.89 3d47 n GLY 130 Ca -0.12 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3d47 n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d47 n GLY 131 N -0.92 -0.70 0.32 -0.02 0.00 -1.26 -4.18 105.19 98.42 3d47 n GLY 131 Ca 0.00 -1.15 -0.01 0.00 0.00 0.00 0.00 46.02 44.86 3d47 n GLY 131 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3d47 n LEU 132 N 0.00 -0.53 -0.19 0.99 7.94 -1.26 -0.58 117.00 123.37 3d47 n LEU 132 Ca 0.00 1.43 -0.10 0.00 -1.11 0.00 0.00 56.01 56.23 3d47 n LEU 132 Cb 0.00 -0.33 0.01 0.00 0.53 0.00 0.00 43.42 43.64 3d47 n LEU 132 CO 0.00 -1.28 0.74 0.58 -1.11 0.00 0.00 177.39 176.32 3d47 h VAL 133 N 0.00 1.27 -0.06 1.96 2.07 -1.81 -2.31 116.25 117.37 3d47 h VAL 133 Ca 0.28 -1.28 -0.12 0.00 0.82 0.00 0.00 66.70 66.41 3d47 h VAL 133 Cb 0.49 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 3d47 h VAL 133 CO -0.81 0.45 -0.52 -0.03 0.02 0.00 0.00 177.57 176.68 3d47 h MET 134 N 0.93 0.15 -0.54 1.57 1.85 -1.29 -1.63 114.93 115.97 3d47 h MET 134 Ca 0.14 -0.09 -0.07 0.00 -0.61 0.00 0.00 59.70 59.07 3d47 h MET 134 Cb 0.69 0.01 -0.02 0.00 0.43 0.00 0.00 31.60 32.70 3d47 h MET 134 CO 0.05 0.64 0.05 -0.91 -0.40 0.00 0.00 176.91 176.34 3d47 h ASN 135 N 0.12 0.85 -0.27 1.39 2.35 -0.64 0.54 115.58 119.92 3d47 h ASN 135 Ca 0.00 -0.20 -0.07 0.00 -0.55 0.00 0.00 56.30 55.49 3d47 h ASN 135 Cb 0.96 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 3d47 h ASN 135 CO 0.08 0.88 -0.09 0.74 -1.65 0.00 0.00 177.43 177.39 3d47 h THR 136 N 0.84 1.29 -0.66 2.81 2.02 -1.03 -1.24 112.91 116.94 3d47 h THR 136 Ca 0.17 -1.14 -0.02 0.00 0.77 0.00 0.00 66.41 66.19 3d47 h THR 136 Cb 0.43 1.47 -0.03 0.00 -1.74 0.00 0.00 68.15 68.28 3d47 h THR 136 CO 0.01 0.36 0.35 0.40 0.37 0.00 0.00 175.52 177.01 3d47 h ILE 137 N 0.28 1.21 -0.91 3.11 2.04 -1.12 -2.38 117.51 119.75 3d47 h ILE 137 Ca 0.06 -0.55 0.01 0.00 1.00 0.00 0.00 64.86 65.38 3d47 h ILE 137 Cb 0.58 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 3d47 h ILE 137 CO 0.03 0.24 0.60 0.28 0.00 0.00 0.00 178.15 179.29 3d47 h SER 138 N 0.90 1.05 -0.75 1.72 0.02 -0.73 -1.35 113.55 114.40 3d47 h SER 138 Ca 0.23 -0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.09 3d47 h SER 138 Cb 0.06 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.31 3d47 h SER 138 CO -0.03 0.77 0.26 0.00 -1.14 0.00 0.00 176.83 176.69 3d47 h VAL 140 N 1.11 1.23 -0.66 0.00 2.07 -1.05 -1.53 116.25 117.41 3d47 h VAL 140 Ca 0.25 -0.72 0.09 0.00 0.82 0.00 0.00 66.70 67.14 3d47 h VAL 140 Cb 0.27 1.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.45 3d47 h VAL 140 CO -0.01 0.21 0.29 -0.78 0.02 0.00 0.00 177.57 177.30 3d47 h ASP 141 N -0.04 0.35 -0.57 0.57 3.58 -1.04 -0.03 116.42 119.23 3d47 h ASP 141 Ca 0.04 0.07 -0.08 0.00 0.42 0.00 0.00 57.03 57.47 3d47 h ASP 141 Cb 0.31 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.36 3d47 h ASP 141 CO 0.00 0.20 0.03 -0.07 -2.88 0.00 0.00 179.24 176.52 3d47 h LEU 142 N 0.51 0.97 -1.29 2.28 3.38 -1.10 -1.40 115.31 118.65 3d47 h LEU 142 Ca 0.33 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 3d47 h LEU 142 Cb 0.38 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3d47 h LEU 142 CO -0.29 1.02 -0.07 0.00 0.09 0.00 0.00 178.44 179.20 3d47 h ALA 143 N 0.98 1.42 -0.26 1.53 0.00 -0.52 0.18 119.26 122.59 3d47 h ALA 143 Ca 0.17 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.68 3d47 h ALA 143 Cb 0.51 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3d47 h ALA 143 CO 0.02 0.41 -0.57 -0.07 0.00 0.00 0.00 179.25 179.04 3d47 h LEU 144 N 0.38 0.92 -0.87 0.00 3.38 -0.65 -0.56 115.31 117.91 3d47 h LEU 144 Ca 0.08 -0.50 -0.11 0.00 0.09 0.00 0.00 57.88 57.44 3d47 h LEU 144 Cb 0.36 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3d47 h LEU 144 CO 0.02 1.29 -0.35 -0.50 0.09 0.00 0.00 178.44 178.98 3d47 h TRP 145 N 0.62 0.48 -0.05 1.13 4.06 -0.84 -1.43 115.95 119.91 3d47 h TRP 145 Ca 0.01 -0.12 -0.01 0.00 2.06 0.00 0.00 58.89 60.83 3d47 h TRP 145 Cb 1.17 -0.11 -0.00 0.00 -1.00 0.00 0.00 29.16 29.22 3d47 h TRP 145 CO 0.07 0.71 0.01 0.22 -3.56 0.00 0.00 178.44 175.89 3d47 h ASP 146 N 0.35 0.09 -0.36 -3.49 3.58 -0.74 -1.42 116.42 114.43 3d47 h ASP 146 Ca 0.04 -0.28 0.01 0.00 0.42 0.00 0.00 57.03 57.22 3d47 h ASP 146 Cb 0.78 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.79 3d47 h ASP 146 CO 0.06 0.35 0.22 0.25 -2.88 0.00 0.00 179.24 177.24 3d47 h LEU 147 N -0.17 0.37 -0.14 2.28 5.85 -1.01 -0.57 115.31 121.92 3d47 h LEU 147 Ca 0.02 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.76 3d47 h LEU 147 Cb 0.30 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 3d47 h LEU 147 CO 0.00 0.27 -0.01 0.15 -0.34 0.00 0.00 178.44 178.51 3d47 h PHE 148 N 0.45 -0.03 -0.98 1.25 3.57 -1.19 0.18 116.94 120.19 3d47 h PHE 148 Ca 0.14 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.67 3d47 h PHE 148 Cb -0.02 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.71 3d47 h PHE 148 CO -0.07 -0.03 0.64 0.78 -2.23 0.00 0.00 178.31 177.41 3d47 h GLY 149 N 0.03 1.39 1.75 2.40 0.00 -1.00 -0.07 103.07 107.57 3d47 h GLY 149 Ca 0.07 -0.50 -0.14 0.00 0.00 0.00 0.00 47.33 46.76 3d47 h GLY 149 CO -0.12 0.47 -0.55 0.50 0.00 0.00 0.00 176.54 176.84 3d47 h LYS 150 N 1.29 0.27 -0.20 4.80 1.57 -0.55 0.14 116.57 123.90 3d47 h LYS 150 Ca 0.37 -0.17 -0.10 0.00 -1.87 0.00 0.00 60.65 58.88 3d47 h LYS 150 Cb -0.10 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 3d47 h LYS 150 CO -0.09 0.75 -0.26 0.28 -0.57 0.00 0.00 179.45 179.55 3d47 h VAL 151 N 0.21 1.34 -0.09 0.50 2.07 -0.16 -3.21 116.25 116.90 3d47 h VAL 151 Ca 0.00 -1.46 -0.14 0.00 0.82 0.00 0.00 66.70 65.92 3d47 h VAL 151 Cb 1.03 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 3d47 h VAL 151 CO 0.09 0.45 -0.55 0.58 0.02 0.00 0.00 177.57 178.15 3d47 h VAL 152 N 0.19 1.36 -0.14 2.57 2.07 -0.97 -3.48 116.25 117.85 3d47 h VAL 152 Ca 0.02 -1.85 0.00 0.00 0.82 0.00 0.00 66.70 65.69 3d47 h VAL 152 Cb 0.83 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 3d47 h VAL 152 CO 0.06 0.55 0.00 0.61 0.02 0.00 0.00 177.57 178.81 3d47 n GLY 153 N 0.16 1.26 3.05 2.17 0.00 0.35 -5.09 105.19 107.09 3d47 n GLY 153 Ca -0.02 -0.26 -0.08 0.00 0.00 0.00 0.00 46.02 45.66 3d47 n GLY 153 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d47 s LEU 154 N -0.14 2.30 0.44 0.99 1.43 -0.43 -4.85 118.68 118.41 3d47 s LEU 154 Ca 0.00 -0.73 -0.23 0.00 -1.03 0.00 0.00 54.13 52.14 3d47 s LEU 154 Cb 0.00 0.21 -0.08 0.00 0.03 0.00 0.00 46.19 46.35 3d47 s LEU 154 CO 0.00 -0.46 1.08 -2.84 0.23 0.00 0.00 176.35 174.36 3d47 s PRO 155 N -2.74 3.93 0.26 1.29 0.02 -1.22 -0.67 135.00 135.87 3d47 s PRO 155 Ca -0.04 1.56 -0.02 0.00 0.02 0.00 0.00 61.00 62.52 3d47 s PRO 155 Cb -0.01 -2.38 0.46 0.00 0.02 0.00 0.00 34.50 32.59 3d47 s PRO 155 CO -0.06 -0.35 1.83 0.28 -0.33 0.00 0.00 177.00 178.36 3d47 h VAL 156 N 1.92 0.93 -0.07 3.83 2.07 -1.38 -1.39 116.25 122.15 3d47 h VAL 156 Ca -0.49 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 66.74 3d47 h VAL 156 Cb 1.23 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 3d47 h VAL 156 CO 0.61 0.17 0.05 0.10 0.02 0.00 0.00 177.57 178.52 3d47 h TYR 157 N 0.90 0.00 0.19 1.57 -0.00 -1.84 -1.02 116.97 116.78 3d47 h TYR 157 Ca 0.44 0.00 -0.31 0.00 0.00 0.00 0.00 58.73 58.86 3d47 h TYR 157 Cb 0.39 0.00 0.02 0.00 0.00 0.00 0.00 36.73 37.15 3d47 h TYR 157 CO -0.03 0.00 -1.39 0.87 -0.00 0.00 0.00 178.16 177.60 3d47 h LYS 158 N 0.00 0.41 -0.76 0.10 1.57 -1.59 -1.59 116.57 114.71 3d47 h LYS 158 Ca 0.03 -0.70 0.00 0.00 -1.87 0.00 0.00 60.65 58.11 3d47 h LYS 158 Cb 0.14 0.26 -0.04 0.00 0.08 0.00 0.00 32.23 32.67 3d47 h LYS 158 CO -0.00 1.33 0.48 -0.07 -0.57 0.00 0.00 179.45 180.62 3d47 h LEU 159 N 0.11 0.90 -0.80 2.94 3.38 -0.91 -2.03 115.31 118.89 3d47 h LEU 159 Ca -0.21 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.72 3d47 h LEU 159 Cb 2.08 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.60 3d47 h LEU 159 CO 0.24 0.67 0.00 -0.07 0.09 0.00 0.00 178.44 179.37 3d47 h LEU 160 N 1.04 0.00 0.00 1.67 3.38 -1.27 -3.45 115.31 116.68 3d47 h LEU 160 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3d47 h LEU 160 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3d47 h LEU 160 CO -0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.08 3d47 n GLY 161 N -0.08 1.49 0.00 0.83 0.00 -0.77 -5.09 105.19 101.57 3d47 n GLY 161 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3d47 n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d47 n GLY 162 N 0.00 -2.48 3.79 -0.02 0.00 -0.60 -4.96 105.19 100.93 3d47 n GLY 162 Ca 0.00 -1.46 -0.35 0.00 0.00 0.00 0.00 46.02 44.21 3d47 n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d47 s ALA 163 N -3.05 2.88 -0.81 4.61 0.00 -1.26 -4.36 121.76 119.77 3d47 s ALA 163 Ca 0.00 0.71 0.08 0.00 0.00 0.00 0.00 51.96 52.75 3d47 s ALA 163 Cb 0.00 -3.30 0.17 0.00 0.00 0.00 0.00 23.12 19.99 3d47 s ALA 163 CO 0.00 -0.44 1.03 1.33 0.00 0.00 0.00 175.76 177.67 3d47 n VAL 164 N -0.84 0.62 -3.66 0.00 0.24 0.14 -4.94 118.33 109.90 3d47 n VAL 164 Ca 0.09 -0.81 -0.15 0.00 -2.04 0.00 0.00 64.34 61.43 3d47 n VAL 164 Cb 0.51 0.75 -0.08 0.00 -1.47 0.00 0.00 33.84 33.55 3d47 n VAL 164 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d47 s ARG 165 N -0.88 0.76 0.48 7.34 1.70 -1.25 -5.02 118.95 122.07 3d47 s ARG 165 Ca 0.14 0.30 0.27 0.00 -0.47 0.00 0.00 55.73 55.98 3d47 s ARG 165 Cb 0.08 0.36 0.93 0.00 -0.57 0.00 0.00 34.95 35.75 3d47 s ARG 165 CO 0.11 -0.18 1.82 -0.44 -1.08 0.00 0.00 175.30 175.53 3d47 h ASP 166 N 4.18 0.00 -5.08 -2.89 3.32 -1.94 -3.45 116.42 110.56 3d47 h ASP 166 Ca -0.28 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.69 3d47 h ASP 166 Cb 1.16 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.56 3d47 h ASP 166 CO 0.31 0.09 -0.23 -1.83 -1.72 0.00 0.00 179.24 175.86 3d47 s GLU 167 N -3.52 0.88 -0.21 3.56 -1.05 -1.26 0.14 118.70 117.24 3d47 s GLU 167 Ca 0.02 -0.66 -0.09 0.00 -0.15 0.00 0.00 54.97 54.10 3d47 s GLU 167 Cb 0.08 0.38 -0.04 0.00 -0.44 0.00 0.00 34.13 34.11 3d47 s GLU 167 CO 0.61 -0.30 0.11 0.42 0.95 0.00 0.00 175.26 177.04 3d47 s ILE 168 N -3.16 4.98 -0.08 1.83 1.01 -0.42 -4.94 121.20 120.42 3d47 s ILE 168 Ca -0.01 0.04 -0.08 0.00 0.00 0.00 0.00 60.65 60.61 3d47 s ILE 168 Cb 0.01 -3.29 -0.04 0.00 0.01 0.00 0.00 42.46 39.15 3d47 s ILE 168 CO -0.07 0.40 0.19 0.00 0.00 0.00 0.00 174.94 175.46 3d47 s GLN 169 N 0.80 3.52 0.19 2.79 -2.07 -1.26 -1.89 119.66 121.73 3d47 s GLN 169 Ca 0.05 -0.07 0.11 0.00 -1.82 0.00 0.00 55.36 53.63 3d47 s GLN 169 Cb -0.13 -3.17 -0.04 0.00 -1.09 0.00 0.00 33.01 28.57 3d47 s GLN 169 CO 0.02 0.75 -0.20 -0.06 -1.32 0.00 0.00 175.29 174.48 3d47 s PHE 170 N -1.09 2.40 0.10 9.60 0.08 -0.56 -1.09 117.98 127.42 3d47 s PHE 170 Ca 0.19 -0.32 0.08 0.00 0.12 0.00 0.00 56.93 57.00 3d47 s PHE 170 Cb -0.13 -1.19 -0.04 0.00 -0.57 0.00 0.00 43.02 41.09 3d47 s PHE 170 CO 0.08 0.50 -0.16 1.52 -0.10 0.00 0.00 175.22 177.06 3d47 s TYR 171 N -1.65 2.60 -0.11 0.36 -0.85 -0.88 -0.46 117.35 116.36 3d47 s TYR 171 Ca 0.22 -0.23 -0.02 0.00 -0.52 0.00 0.00 57.07 56.52 3d47 s TYR 171 Cb -0.08 -1.38 -0.03 0.00 0.38 0.00 0.00 41.96 40.84 3d47 s TYR 171 CO 0.11 0.38 -0.03 0.00 -1.52 0.00 0.00 175.55 174.50 3d47 s ALA 172 N -1.14 3.13 -0.26 9.51 0.00 0.20 -2.12 121.76 131.08 3d47 s ALA 172 Ca 0.18 -0.83 -0.09 0.00 0.00 0.00 0.00 51.96 51.23 3d47 s ALA 172 Cb -0.11 -1.46 -0.04 0.00 0.00 0.00 0.00 23.12 21.52 3d47 s ALA 172 CO 0.10 0.45 0.13 0.99 0.00 0.00 0.00 175.76 177.43 3d47 s THR 173 N -0.44 4.81 -2.49 0.00 2.01 -0.24 -1.20 115.64 118.09 3d47 s THR 173 Ca 0.07 -0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.07 3d47 s THR 173 Cb -0.12 -3.27 0.00 0.00 0.01 0.00 0.00 72.50 69.12 3d47 s THR 173 CO 0.02 0.31 0.00 0.61 -0.69 0.00 0.00 174.62 174.87 3d47 n GLY 174 N 4.89 -1.63 0.16 4.40 0.00 -0.81 -1.02 105.19 111.18 3d47 n GLY 174 Ca -0.15 -1.08 0.14 0.00 0.00 0.00 0.00 46.02 44.93 3d47 n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d47 n ALA 175 N 0.00 2.71 -3.27 4.61 0.00 -1.26 -4.21 120.51 119.09 3d47 n ALA 175 Ca 0.00 -0.29 -0.26 0.00 0.00 0.00 0.00 53.44 52.89 3d47 n ALA 175 Cb 0.00 -1.34 -0.07 0.00 0.00 0.00 0.00 19.45 18.04 3d47 n ALA 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3d47 n ARG 176 N -0.74 2.19 0.30 0.00 5.12 -1.26 -4.87 116.66 117.40 3d47 n ARG 176 Ca 0.17 -4.33 0.16 0.00 -1.93 0.00 0.00 57.85 51.92 3d47 n ARG 176 Cb 0.26 -2.01 0.95 0.00 -1.16 0.00 0.00 32.46 30.50 3d47 n ARG 176 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3d47 h PRO 177 N 3.85 0.00 -0.44 5.56 0.13 -1.91 -0.55 132.00 138.64 3d47 h PRO 177 Ca 0.15 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.19 3d47 h PRO 177 Cb 0.70 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.81 3d47 h PRO 177 CO 0.74 0.01 -0.11 0.38 -0.23 0.00 0.00 178.00 178.79 3d47 h ASP 178 N 0.00 0.85 -0.21 1.44 2.03 -1.92 -0.08 116.42 118.53 3d47 h ASP 178 Ca -0.00 -0.36 -0.13 0.00 -0.73 0.00 0.00 57.03 55.81 3d47 h ASP 178 Cb 0.04 -0.23 -0.01 0.00 -0.83 0.00 0.00 39.33 38.30 3d47 h ASP 178 CO 0.00 1.02 -0.32 -0.07 -1.03 0.00 0.00 179.24 178.84 3d47 h LEU 179 N 0.68 0.75 -1.01 0.15 3.38 -1.51 -2.91 115.31 114.84 3d47 h LEU 179 Ca 0.11 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3d47 h LEU 179 Cb 0.65 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 3d47 h LEU 179 CO 0.04 1.01 0.59 0.00 0.09 0.00 0.00 178.44 180.18 3d47 h ALA 180 N 1.03 1.27 -0.89 1.53 0.00 -0.82 -1.10 119.26 120.27 3d47 h ALA 180 Ca 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3d47 h ALA 180 Cb 0.85 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 3d47 h ALA 180 CO 0.07 0.65 0.50 -0.22 0.00 0.00 0.00 179.25 180.25 3d47 h LYS 181 N 1.29 1.23 -0.78 0.00 3.64 -0.83 -1.93 116.57 119.20 3d47 h LYS 181 Ca 0.34 -0.14 0.05 0.00 -1.27 0.00 0.00 60.65 59.63 3d47 h LYS 181 Cb -0.09 -0.24 -0.05 0.00 -0.41 0.00 0.00 32.23 31.43 3d47 h LYS 181 CO -0.07 0.89 0.48 0.93 -2.27 0.00 0.00 179.45 179.41 3d47 h GLU 182 N 1.24 0.88 0.00 1.90 5.08 -1.07 -1.71 114.58 120.90 3d47 h GLU 182 Ca 0.31 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3d47 h GLU 182 Cb 0.01 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.06 3d47 h GLU 182 CO -0.05 0.58 0.00 -1.33 -1.00 0.00 0.00 179.01 177.21 3d47 n MET 183 N -4.65 0.11 0.00 2.33 2.81 -0.76 -4.88 117.12 112.07 3d47 n MET 183 Ca 0.10 0.32 0.00 0.00 -1.81 0.00 0.00 57.70 56.31 3d47 n MET 183 Cb 0.14 -1.70 0.00 0.00 -0.71 0.00 0.00 33.22 30.95 3d47 n MET 183 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d47 n GLY 184 N 0.11 0.87 3.75 3.03 0.00 -0.64 -2.95 105.19 109.36 3d47 n GLY 184 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3d47 n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d47 s PHE 185 N -2.00 2.43 -1.40 1.61 0.08 -0.97 -3.91 117.98 113.82 3d47 s PHE 185 Ca 0.00 1.53 0.25 0.00 0.12 0.00 0.00 56.93 58.83 3d47 s PHE 185 Cb 0.00 -3.09 0.44 0.00 -0.57 0.00 0.00 43.02 39.80 3d47 s PHE 185 CO 0.00 -2.00 1.36 0.44 -0.10 0.00 0.00 175.22 174.92 3d47 n ILE 186 N -3.66 0.00 -3.74 0.64 -5.35 0.39 -4.65 119.36 103.00 3d47 n ILE 186 Ca 0.09 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.50 3d47 n ILE 186 Cb 0.53 0.52 -0.00 0.00 -1.74 0.00 0.00 39.64 38.95 3d47 n ILE 186 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3d47 s GLY 187 N -2.75 -0.27 -0.04 3.28 0.00 -1.26 -1.96 107.32 104.32 3d47 s GLY 187 Ca 0.16 0.36 -0.01 0.00 0.00 0.00 0.00 44.72 45.24 3d47 s GLY 187 CO 0.64 1.30 0.03 -0.32 0.00 0.00 0.00 173.10 174.75 3d47 s GLY 188 N -3.17 0.25 -0.24 0.20 0.00 0.13 -0.63 107.32 103.87 3d47 s GLY 188 Ca 0.17 0.15 -0.09 0.00 0.00 0.00 0.00 44.72 44.95 3d47 s GLY 188 CO -0.01 1.02 0.13 1.25 0.00 0.00 0.00 173.10 175.49 3d47 s LYS 189 N 1.65 3.95 0.16 2.90 2.20 -0.34 -1.53 119.74 128.72 3d47 s LYS 189 Ca -0.01 -0.34 0.05 0.00 -0.36 0.00 0.00 55.97 55.32 3d47 s LYS 189 Cb -0.13 -3.45 -0.04 0.00 -1.51 0.00 0.00 37.83 32.70 3d47 s LYS 189 CO -0.03 0.01 0.09 -1.64 -0.36 0.00 0.00 175.35 173.42 3d47 s MET 190 N 1.15 2.74 0.32 4.03 -1.94 0.39 -1.92 119.30 124.06 3d47 s MET 190 Ca 0.06 -0.92 -0.10 0.00 -1.71 0.00 0.00 55.69 53.02 3d47 s MET 190 Cb -0.14 -2.57 -0.07 0.00 2.01 0.00 0.00 34.83 34.06 3d47 s MET 190 CO 0.05 0.49 0.66 -1.25 -0.01 0.00 0.00 175.02 174.95 3d47 s PRO 191 N -2.96 3.80 0.33 2.03 0.04 -1.26 -0.07 135.00 136.90 3d47 s PRO 191 Ca 0.30 0.36 -0.20 0.00 0.04 0.00 0.00 61.00 61.50 3d47 s PRO 191 Cb -0.10 -2.52 -0.09 0.00 0.04 0.00 0.00 34.50 31.83 3d47 s PRO 191 CO 0.22 0.14 0.83 0.95 0.04 0.00 0.00 177.00 179.18 3d47 s THR 192 N -2.09 4.49 -0.38 1.26 -4.23 -0.31 -4.83 115.64 109.54 3d47 s THR 192 Ca 0.49 1.34 0.11 0.00 -1.18 0.00 0.00 61.69 62.46 3d47 s THR 192 Cb -0.11 -3.74 -0.14 0.00 1.34 0.00 0.00 72.50 69.85 3d47 s THR 192 CO 0.26 -0.06 0.42 1.41 -0.54 0.00 0.00 174.62 176.10 3d47 n HIS 193 N 0.01 0.00 -4.41 3.99 8.25 -1.26 -1.29 115.22 120.51 3d47 n HIS 193 Ca 0.03 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.28 3d47 n HIS 193 Cb 0.52 -0.08 -0.10 0.00 1.12 0.00 0.00 29.99 31.45 3d47 n HIS 193 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3d47 s TRP 194 N -2.29 1.98 0.09 4.41 0.52 -1.26 -4.12 118.94 118.27 3d47 s TRP 194 Ca 0.02 -0.50 0.01 0.00 0.02 0.00 0.00 56.10 55.65 3d47 s TRP 194 Cb 0.08 -0.94 -0.00 0.00 -1.15 0.00 0.00 33.47 31.46 3d47 s TRP 194 CO 0.47 0.49 0.04 0.41 0.02 0.00 0.00 176.95 178.38 3d47 n GLY 195 N -0.51 3.89 0.34 0.98 0.00 -1.26 -4.80 105.19 103.83 3d47 n GLY 195 Ca -0.06 -1.92 0.18 0.00 0.00 0.00 0.00 46.02 44.22 3d47 n GLY 195 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3d47 h PRO 196 N 0.00 0.48 0.00 1.61 0.11 -1.93 0.13 132.00 132.40 3d47 h PRO 196 Ca -0.07 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.01 3d47 h PRO 196 Cb 0.27 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.27 3d47 h PRO 196 CO 0.11 0.32 0.00 1.12 -0.21 0.00 0.00 178.00 179.34 3d47 h HIS 197 N 0.50 0.00 0.00 0.65 2.07 -1.96 -1.71 115.15 114.69 3d47 h HIS 197 Ca 0.65 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.17 3d47 h HIS 197 Cb 1.29 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.27 3d47 h HIS 197 CO -0.03 0.00 -0.79 -0.25 -3.07 0.00 0.00 177.93 173.79 3d47 n ASP 198 N -2.69 0.70 0.00 3.10 8.00 0.44 -5.04 116.55 121.05 3d47 n ASP 198 Ca -0.01 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.56 3d47 n ASP 198 Cb 0.15 0.37 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 3d47 n ASP 198 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d47 n GLY 199 N 1.32 2.33 0.37 0.44 0.00 -0.65 -3.03 105.19 105.97 3d47 n GLY 199 Ca 0.02 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.74 3d47 n GLY 199 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3d47 h ASP 200 N 8.62 0.55 -0.51 1.61 3.32 -1.94 -1.23 116.42 126.84 3d47 h ASP 200 Ca 0.00 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 3d47 h ASP 200 Cb 0.00 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 3d47 h ASP 200 CO 0.00 0.31 0.07 0.00 -1.72 0.00 0.00 179.24 177.90 3d47 h ALA 201 N 1.62 0.68 -0.71 3.45 0.00 -1.97 -1.55 119.26 120.78 3d47 h ALA 201 Ca 0.37 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3d47 h ALA 201 Cb 0.60 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3d47 h ALA 201 CO -0.14 0.43 0.37 0.78 0.00 0.00 0.00 179.25 180.69 3d47 h GLY 202 N 0.74 1.08 0.97 0.00 0.00 -1.16 -1.31 103.07 103.38 3d47 h GLY 202 Ca 0.15 -0.51 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 3d47 h GLY 202 CO 0.01 0.49 0.13 -2.22 0.00 0.00 0.00 176.54 174.95 3d47 h ILE 203 N 0.98 1.23 -0.54 2.60 2.04 -1.20 -2.33 117.51 120.29 3d47 h ILE 203 Ca 0.25 -0.80 -0.02 0.00 1.00 0.00 0.00 64.86 65.28 3d47 h ILE 203 Cb 0.08 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 3d47 h ILE 203 CO -0.04 0.29 0.25 -0.09 0.00 0.00 0.00 178.15 178.56 3d47 h ARG 204 N 0.64 0.79 0.16 2.37 2.43 -0.98 -1.26 114.38 118.53 3d47 h ARG 204 Ca 0.15 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 3d47 h ARG 204 Cb 0.30 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 3d47 h ARG 204 CO -0.00 0.66 -0.08 0.87 -1.51 0.00 0.00 179.97 179.91 3d47 h LYS 205 N 0.73 -0.21 -0.10 0.20 1.57 -1.11 0.12 116.57 117.78 3d47 h LYS 205 Ca 0.18 0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.88 3d47 h LYS 205 Cb 0.15 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 3d47 h LYS 205 CO -0.02 -0.05 -0.40 -0.44 -0.57 0.00 0.00 179.45 177.97 3d47 h ASP 206 N -0.33 0.22 -0.20 0.86 3.32 -1.43 -1.90 116.42 116.95 3d47 h ASP 206 Ca -0.02 -0.09 -0.14 0.00 0.02 0.00 0.00 57.03 56.80 3d47 h ASP 206 Cb 0.26 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 3d47 h ASP 206 CO 0.04 0.61 -0.36 0.00 -1.72 0.00 0.00 179.24 177.81 3d47 h ALA 207 N 1.41 0.77 -0.07 3.45 0.00 -1.10 -2.31 119.26 121.40 3d47 h ALA 207 Ca 0.02 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.43 3d47 h ALA 207 Cb 0.79 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3d47 h ALA 207 CO 0.06 0.65 -0.25 0.00 0.00 0.00 0.00 179.25 179.72 3d47 h ALA 208 N 0.99 1.45 -0.57 0.00 0.00 -0.43 -0.47 119.26 120.24 3d47 h ALA 208 Ca 0.06 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 3d47 h ALA 208 Cb 0.89 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3d47 h ALA 208 CO 0.08 0.40 -0.06 1.98 0.00 0.00 0.00 179.25 181.65 3d47 h MET 209 N 0.12 1.03 -0.29 0.00 -1.53 -0.93 -0.80 114.93 112.53 3d47 h MET 209 Ca 0.02 -0.35 -0.08 0.00 -3.44 0.00 0.00 59.70 55.85 3d47 h MET 209 Cb 0.51 -0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 31.47 3d47 h MET 209 CO 0.04 1.04 -0.11 0.28 0.14 0.00 0.00 176.91 178.29 3d47 h VAL 210 N 0.93 1.29 -0.38 -5.77 2.07 -0.83 -2.42 116.25 111.14 3d47 h VAL 210 Ca 0.16 -1.19 0.03 0.00 0.82 0.00 0.00 66.70 66.52 3d47 h VAL 210 Cb 0.61 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 3d47 h VAL 210 CO 0.04 0.38 0.19 0.00 0.02 0.00 0.00 177.57 178.20 3d47 h ALA 211 N 0.76 0.47 -0.37 1.67 0.00 -0.93 -0.52 119.26 120.34 3d47 h ALA 211 Ca 0.07 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3d47 h ALA 211 Cb 0.62 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3d47 h ALA 211 CO 0.04 -0.18 0.19 0.22 0.00 0.00 0.00 179.25 179.52 3d47 h ASP 212 N 0.38 0.28 0.24 0.00 3.58 -1.09 -1.59 116.42 118.22 3d47 h ASP 212 Ca 0.16 0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.54 3d47 h ASP 212 Cb 0.07 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 3d47 h ASP 212 CO -0.12 0.20 -0.35 0.24 -2.88 0.00 0.00 179.24 176.34 3d47 h MET 213 N 0.38 0.17 -0.49 0.28 2.86 -1.07 0.18 114.93 117.24 3d47 h MET 213 Ca 0.15 -0.07 -0.08 0.00 -2.06 0.00 0.00 59.70 57.65 3d47 h MET 213 Cb 0.06 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 3d47 h MET 213 CO -0.10 0.50 -0.02 -0.09 1.06 0.00 0.00 176.91 178.26 3d47 h ARG 214 N 0.14 0.82 -0.09 1.72 9.65 -0.63 0.56 114.38 126.55 3d47 h ARG 214 Ca 0.02 -0.23 -0.02 0.00 -1.10 0.00 0.00 59.98 58.64 3d47 h ARG 214 Cb 0.68 -0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 29.17 3d47 h ARG 214 CO 0.05 0.84 -0.03 1.49 2.80 0.00 0.00 179.97 185.12 3d47 h GLU 215 N 0.76 0.19 -0.40 0.20 4.57 -0.71 -1.13 114.58 118.05 3d47 h GLU 215 Ca 0.14 -0.07 -0.06 0.00 -1.18 0.00 0.00 59.36 58.19 3d47 h GLU 215 Cb 0.49 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 3d47 h GLU 215 CO 0.02 0.52 0.03 0.87 -1.18 0.00 0.00 179.01 179.27 3d47 h LYS 216 N -0.15 0.68 0.00 1.92 1.57 -0.68 -3.33 116.57 116.58 3d47 h LYS 216 Ca 0.02 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3d47 h LYS 216 Cb 0.45 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.69 3d47 h LYS 216 CO 0.01 0.75 -0.77 0.00 -0.57 0.00 0.00 179.45 178.87 3d47 n GLY 218 N 1.31 -3.64 0.11 0.00 0.00 -0.43 -4.43 105.19 98.11 3d47 n GLY 218 Ca 0.02 -1.98 0.03 0.00 0.00 0.00 0.00 46.02 44.10 3d47 n GLY 218 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d47 h PRO 219 N 0.00 0.00 0.00 1.61 0.13 -1.96 -3.37 132.00 128.41 3d47 h PRO 219 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.04 3d47 h PRO 219 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 3d47 h PRO 219 CO 0.00 0.25 -0.62 -0.44 -0.23 0.00 0.00 178.00 176.96 3d47 h ASP 220 N 0.00 0.00 -3.12 1.44 3.32 -1.97 -3.44 116.42 112.64 3d47 h ASP 220 Ca -0.09 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.40 3d47 h ASP 220 Cb 1.40 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.92 3d47 h ASP 220 CO 0.04 0.40 0.70 0.12 -1.72 0.00 0.00 179.24 178.77 3d47 s PHE 221 N -3.02 3.27 0.46 4.55 5.36 -1.26 -4.98 117.98 122.37 3d47 s PHE 221 Ca 0.03 1.35 -0.23 0.00 -0.96 0.00 0.00 56.93 57.12 3d47 s PHE 221 Cb 0.07 -3.33 -0.07 0.00 -0.34 0.00 0.00 43.02 39.35 3d47 s PHE 221 CO 0.75 -0.89 1.18 -1.58 -1.46 0.00 0.00 175.22 173.22 3d47 s TRP 222 N 2.44 2.84 -0.03 10.12 0.51 -0.83 -4.89 118.94 129.11 3d47 s TRP 222 Ca 0.52 1.52 0.03 0.00 -2.12 0.00 0.00 56.10 56.05 3d47 s TRP 222 Cb -0.21 -3.41 0.00 0.00 -0.81 0.00 0.00 33.47 29.04 3d47 s TRP 222 CO 0.18 -1.60 -0.10 -0.51 -0.51 0.00 0.00 176.95 174.40 3d47 s LEU 223 N -3.03 1.78 0.05 2.99 1.43 -1.26 0.22 118.68 120.86 3d47 s LEU 223 Ca 0.64 -0.22 -0.01 0.00 -1.03 0.00 0.00 54.13 53.51 3d47 s LEU 223 Cb -0.30 -0.62 -0.04 0.00 0.03 0.00 0.00 46.19 45.26 3d47 s LEU 223 CO 0.36 0.07 -0.03 -0.04 0.23 0.00 0.00 176.35 176.94 3d47 s MET 224 N 0.22 0.61 -0.10 1.70 -1.94 -0.58 -0.57 119.30 118.63 3d47 s MET 224 Ca -0.04 -1.22 0.03 0.00 -1.71 0.00 0.00 55.69 52.75 3d47 s MET 224 Cb -0.10 0.20 0.00 0.00 2.01 0.00 0.00 34.83 36.95 3d47 s MET 224 CO 0.01 -0.11 -0.22 -0.51 -0.01 0.00 0.00 175.02 174.18 3d47 s LEU 225 N -2.92 2.03 -0.22 -0.03 1.43 -1.02 -0.46 118.68 117.49 3d47 s LEU 225 Ca 0.07 -0.53 -0.09 0.00 -1.03 0.00 0.00 54.13 52.55 3d47 s LEU 225 Cb 0.08 -1.34 -0.04 0.00 0.03 0.00 0.00 46.19 44.92 3d47 s LEU 225 CO -0.10 0.13 0.11 -0.62 0.23 0.00 0.00 176.35 176.09 3d47 s ASP 226 N 0.48 5.72 0.00 2.29 -1.08 0.90 -0.34 116.67 124.64 3d47 s ASP 226 Ca -0.16 0.03 0.14 0.00 -0.52 0.00 0.00 52.55 52.03 3d47 s ASP 226 Cb -0.17 -2.01 0.25 0.00 -1.46 0.00 0.00 42.92 39.52 3d47 s ASP 226 CO 0.06 0.08 1.13 0.00 0.52 0.00 0.00 175.17 176.97 3d47 n TRP 228 N 0.78 -0.79 -1.20 0.00 -0.00 -1.22 -1.08 117.44 113.92 3d47 n TRP 228 Ca 0.11 0.02 -0.10 0.00 -0.00 0.00 0.00 57.50 57.54 3d47 n TRP 228 Cb 0.41 -1.59 -0.04 0.00 -0.00 0.00 0.00 31.31 30.09 3d47 n TRP 228 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 177.69 176.36 3d47 n MET 229 N -3.36 -1.58 0.00 5.87 2.81 0.14 -4.41 117.12 116.59 3d47 n MET 229 Ca -0.06 0.73 0.14 0.00 -1.81 0.00 0.00 57.70 56.70 3d47 n MET 229 Cb 0.32 -4.92 0.58 0.00 -0.71 0.00 0.00 33.22 28.50 3d47 n MET 229 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3d47 n SER 230 N -0.51 1.03 -2.35 7.83 3.41 -0.25 -4.05 113.62 118.73 3d47 n SER 230 Ca -0.10 -1.18 -0.04 0.00 -0.26 0.00 0.00 58.87 57.29 3d47 n SER 230 Cb 0.47 0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 64.42 3d47 n SER 230 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d47 n GLN 231 N -0.32 1.75 -4.38 4.33 6.02 -0.10 -4.46 117.38 120.22 3d47 n GLN 231 Ca 0.18 -0.47 -0.19 0.00 -0.01 0.00 0.00 57.00 56.51 3d47 n GLN 231 Cb 0.30 0.11 -0.10 0.00 1.02 0.00 0.00 30.24 31.57 3d47 n GLN 231 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 3d47 s ASP 232 N -1.37 1.79 0.18 1.08 1.47 -1.26 -4.60 116.67 113.95 3d47 s ASP 232 Ca 0.01 -1.36 -0.14 0.00 1.18 0.00 0.00 52.55 52.24 3d47 s ASP 232 Cb -0.00 0.03 0.15 0.00 -0.34 0.00 0.00 42.92 42.77 3d47 s ASP 232 CO 0.01 -0.64 1.71 0.58 0.68 0.00 0.00 175.17 177.50 3d47 h VAL 233 N 2.28 0.71 -0.08 2.11 2.07 -1.93 -1.19 116.25 120.22 3d47 h VAL 233 Ca -0.39 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 3d47 h VAL 233 Cb 1.24 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 3d47 h VAL 233 CO 0.65 0.03 0.04 -1.13 0.02 0.00 0.00 177.57 177.19 3d47 h ASN 234 N 0.18 0.10 -0.25 0.57 -1.24 -1.99 0.36 115.58 113.30 3d47 h ASN 234 Ca 0.22 -0.09 -0.00 0.00 0.71 0.00 0.00 56.30 57.14 3d47 h ASN 234 Cb 0.31 -0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.32 3d47 h ASN 234 CO -0.33 0.16 0.14 0.22 -1.29 0.00 0.00 177.43 176.33 3d47 h TYR 235 N 0.03 0.34 -0.88 0.67 3.20 -1.94 -0.45 116.97 117.94 3d47 h TYR 235 Ca 0.03 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.91 3d47 h TYR 235 Cb 0.08 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.20 3d47 h TYR 235 CO -0.04 0.29 0.58 0.00 -1.64 0.00 0.00 178.16 177.35 3d47 h ALA 236 N 1.03 1.39 -0.07 1.82 0.00 -1.12 0.80 119.26 123.10 3d47 h ALA 236 Ca 0.09 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3d47 h ALA 236 Cb 0.05 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 3d47 h ALA 236 CO -0.01 0.56 0.03 1.15 0.00 0.00 0.00 179.25 180.97 3d47 h THR 237 N 1.18 1.16 -0.60 0.00 2.02 -0.44 0.08 112.91 116.31 3d47 h THR 237 Ca 0.33 -0.49 -0.01 0.00 0.77 0.00 0.00 66.41 67.02 3d47 h THR 237 Cb -0.10 1.35 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 3d47 h THR 237 CO -0.08 0.14 0.35 0.11 0.37 0.00 0.00 175.52 176.41 3d47 h LYS 238 N -0.06 0.82 -0.47 6.66 1.57 -0.60 -1.87 116.57 122.61 3d47 h LYS 238 Ca 0.02 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 3d47 h LYS 238 Cb 0.20 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 3d47 h LYS 238 CO -0.00 0.59 0.18 1.25 -0.57 0.00 0.00 179.45 180.90 3d47 h LEU 239 N 0.81 0.66 -0.34 2.94 5.85 -0.72 -1.12 115.31 123.39 3d47 h LEU 239 Ca 0.21 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.78 3d47 h LEU 239 Cb -0.01 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 3d47 h LEU 239 CO -0.04 0.66 0.15 0.00 -0.34 0.00 0.00 178.44 178.87 3d47 h ALA 240 N 1.03 0.41 -0.05 1.25 0.00 -0.66 -1.90 119.26 119.34 3d47 h ALA 240 Ca 0.16 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 3d47 h ALA 240 Cb 0.22 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3d47 h ALA 240 CO -0.01 -0.23 -0.45 0.45 0.00 0.00 0.00 179.25 179.01 3d47 h HIS 241 N 0.32 0.12 0.00 0.00 3.86 -1.22 -1.92 115.15 116.30 3d47 h HIS 241 Ca 0.15 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.29 3d47 h HIS 241 Cb 0.08 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 28.52 3d47 h HIS 241 CO -0.11 0.54 -0.16 0.00 0.86 0.00 0.00 177.93 179.06 3d47 h ALA 242 N 1.46 1.05 -0.01 2.45 0.00 -0.72 -2.86 119.26 120.63 3d47 h ALA 242 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3d47 h ALA 242 Cb 0.83 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3d47 h ALA 242 CO 0.06 0.20 -0.64 0.00 0.00 0.00 0.00 179.25 178.87 3d47 h ALA 244 N 3.59 1.51 0.00 0.00 0.00 -1.12 -2.17 119.26 121.08 3d47 h ALA 244 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3d47 h ALA 244 Cb 0.67 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3d47 h ALA 244 CO 0.00 0.31 -0.03 -1.35 0.00 0.00 0.00 179.25 178.18 3d47 h PRO 245 N 1.03 0.00 -0.64 0.00 0.11 -1.79 -1.75 132.00 128.96 3d47 h PRO 245 Ca 0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.54 3d47 h PRO 245 Cb 0.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.42 3d47 h PRO 245 CO -0.19 0.03 0.00 1.19 -0.21 0.00 0.00 178.00 178.82 3d47 n PHE 246 N -3.39 0.85 -3.60 0.65 3.72 -0.82 -4.96 117.46 109.92 3d47 n PHE 246 Ca -0.02 -0.43 -0.20 0.00 -0.05 0.00 0.00 57.45 56.75 3d47 n PHE 246 Cb 0.14 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.73 3d47 n PHE 246 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3d47 n ASN 247 N 1.44 -1.59 -4.70 4.37 5.15 -0.66 -4.90 115.26 114.36 3d47 n ASN 247 Ca 0.22 -0.75 -0.42 0.00 -0.60 0.00 0.00 54.58 53.03 3d47 n ASN 247 Cb 0.56 -4.43 -0.03 0.00 -0.53 0.00 0.00 39.78 35.35 3d47 n ASN 247 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3d47 s LEU 248 N -6.54 4.38 0.07 1.20 2.96 -1.22 -4.71 118.68 114.82 3d47 s LEU 248 Ca 0.01 2.69 -0.21 0.00 -0.22 0.00 0.00 54.13 56.41 3d47 s LEU 248 Cb -0.00 -3.58 -0.11 0.00 0.50 0.00 0.00 46.19 43.00 3d47 s LEU 248 CO 0.78 -0.93 1.53 0.50 -1.32 0.00 0.00 176.35 176.91 3d47 h LYS 249 N 7.74 0.29 -3.10 1.98 3.64 -1.19 -3.44 116.57 122.49 3d47 h LYS 249 Ca -0.44 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 58.81 3d47 h LYS 249 Cb 1.21 -0.03 -0.14 0.00 -0.41 0.00 0.00 32.23 32.86 3d47 h LYS 249 CO 0.94 0.47 0.02 1.67 -2.27 0.00 0.00 179.45 180.28 3d47 s TRP 250 N -5.13 -0.35 -0.21 1.91 -2.14 -1.26 -1.80 118.94 109.96 3d47 s TRP 250 Ca -0.14 0.18 0.01 0.00 2.66 0.00 0.00 56.10 58.81 3d47 s TRP 250 Cb 0.06 0.35 0.03 0.00 -3.10 0.00 0.00 33.47 30.81 3d47 s TRP 250 CO 0.72 -0.71 -0.16 -1.50 -2.66 0.00 0.00 176.95 172.63 3d47 s ILE 251 N -3.33 2.22 -0.09 0.66 2.07 -0.47 -2.44 121.20 119.83 3d47 s ILE 251 Ca -0.00 -1.07 -0.07 0.00 -1.41 0.00 0.00 60.65 58.09 3d47 s ILE 251 Cb 0.00 -2.04 -0.04 0.00 0.13 0.00 0.00 42.46 40.51 3d47 s ILE 251 CO -0.09 0.38 0.17 -0.70 -1.91 0.00 0.00 174.94 172.80 3d47 s GLU 252 N 1.26 3.48 -1.25 3.50 2.12 0.54 -2.16 118.70 126.20 3d47 s GLU 252 Ca 0.02 -0.12 -0.25 0.00 0.36 0.00 0.00 54.97 54.97 3d47 s GLU 252 Cb -0.15 -3.17 0.03 0.00 0.26 0.00 0.00 34.13 31.11 3d47 s GLU 252 CO -0.10 0.75 0.48 -1.91 -0.54 0.00 0.00 175.26 173.94 3d47 n GLU 253 N 1.75 -0.41 0.21 4.30 2.13 0.36 -0.84 120.64 128.14 3d47 n GLU 253 Ca -0.18 0.04 0.05 0.00 0.66 0.00 0.00 57.16 57.73 3d47 n GLU 253 Cb 0.54 -2.58 0.44 0.00 0.27 0.00 0.00 31.44 30.12 3d47 n GLU 253 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3d47 s LEU 255 N -8.15 2.55 0.71 0.00 1.43 -1.26 -0.92 118.68 113.03 3d47 s LEU 255 Ca -0.03 -0.99 -0.16 0.00 -1.03 0.00 0.00 54.13 51.92 3d47 s LEU 255 Cb 0.14 -0.87 0.00 0.00 0.03 0.00 0.00 46.19 45.49 3d47 s LEU 255 CO 0.70 -0.06 0.96 -2.65 0.23 0.00 0.00 176.35 175.53 3d47 n PRO 256 N -0.34 0.54 -0.04 1.29 -0.02 -1.26 -4.51 135.00 130.67 3d47 n PRO 256 Ca -0.08 0.24 0.15 0.00 -2.02 0.00 0.00 63.50 61.80 3d47 n PRO 256 Cb 0.60 -2.22 0.59 0.00 -0.02 0.00 0.00 33.50 32.45 3d47 n PRO 256 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3d47 h PRO 257 N -0.19 0.21 0.00 0.52 0.13 -1.95 -2.71 132.00 128.01 3d47 h PRO 257 Ca -0.47 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 3d47 h PRO 257 Cb 1.34 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.42 3d47 h PRO 257 CO 0.47 0.14 -0.06 1.96 -0.23 0.00 0.00 178.00 180.29 3d47 h GLN 258 N 0.22 0.00 -3.07 0.86 7.50 -1.99 -3.38 115.11 115.26 3d47 h GLN 258 Ca 0.26 0.00 -0.61 0.00 0.50 0.00 0.00 58.65 58.80 3d47 h GLN 258 Cb 0.74 0.00 0.03 0.00 0.05 0.00 0.00 27.48 28.30 3d47 h GLN 258 CO -0.05 0.06 3.61 1.04 -1.50 0.00 0.00 178.83 181.99 3d47 n GLN 259 N -3.16 3.41 -0.19 1.46 6.02 -1.02 -4.63 117.38 119.27 3d47 n GLN 259 Ca 0.01 -2.06 -0.07 0.00 -0.01 0.00 0.00 57.00 54.87 3d47 n GLN 259 Cb 0.37 -2.73 0.03 0.00 1.02 0.00 0.00 30.24 28.92 3d47 n GLN 259 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.06 177.93 3d47 h TYR 260 N 5.22 0.70 -0.58 1.08 0.05 -1.86 -1.48 116.97 120.10 3d47 h TYR 260 Ca 0.81 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 59.59 3d47 h TYR 260 Cb 0.27 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.75 3d47 h TYR 260 CO 1.90 0.46 0.32 0.93 -1.05 0.00 0.00 178.16 180.72 3d47 h GLU 261 N 0.74 0.79 -0.29 4.88 3.07 -1.97 -1.26 114.58 120.53 3d47 h GLU 261 Ca 0.20 -0.08 -0.12 0.00 -0.50 0.00 0.00 59.36 58.86 3d47 h GLU 261 Cb -0.06 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.68 3d47 h GLU 261 CO -0.04 0.58 -0.32 0.78 -1.40 0.00 0.00 179.01 178.61 3d47 h GLY 262 N 0.86 0.68 1.38 -3.84 0.00 -1.78 -2.52 103.07 97.86 3d47 h GLY 262 Ca 0.21 -0.62 -0.11 0.00 0.00 0.00 0.00 47.33 46.81 3d47 h GLY 262 CO -0.03 0.56 -0.22 -0.97 0.00 0.00 0.00 176.54 175.88 3d47 h TYR 263 N 0.53 0.80 -0.60 5.60 -1.99 -0.37 -0.60 116.97 120.35 3d47 h TYR 263 Ca 0.06 -0.18 -0.02 0.00 2.00 0.00 0.00 58.73 60.60 3d47 h TYR 263 Cb 0.81 -0.19 -0.03 0.00 2.00 0.00 0.00 36.73 39.31 3d47 h TYR 263 CO 0.03 0.87 0.31 -0.09 -0.00 0.00 0.00 178.16 179.28 3d47 h ARG 264 N 0.63 0.84 -0.34 4.88 2.43 -1.05 -0.59 114.38 121.18 3d47 h ARG 264 Ca 0.09 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 3d47 h ARG 264 Cb 0.70 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 3d47 h ARG 264 CO 0.05 0.66 -0.26 1.49 -1.51 0.00 0.00 179.97 180.40 3d47 h GLU 265 N 0.81 0.78 -0.55 0.20 4.81 -1.23 -2.62 114.58 116.78 3d47 h GLU 265 Ca 0.21 -0.38 -0.01 0.00 -0.13 0.00 0.00 59.36 59.05 3d47 h GLU 265 Cb 0.08 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 3d47 h GLU 265 CO -0.03 1.01 0.31 1.25 -0.73 0.00 0.00 179.01 180.82 3d47 h LEU 266 N 0.56 0.68 -0.98 1.64 5.85 -0.93 -1.45 115.31 120.68 3d47 h LEU 266 Ca 0.06 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3d47 h LEU 266 Cb 0.83 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.65 3d47 h LEU 266 CO 0.07 0.56 0.51 0.50 -0.34 0.00 0.00 178.44 179.73 3d47 h LYS 267 N 0.74 1.22 0.00 1.25 1.63 -1.07 -1.35 116.57 118.99 3d47 h LYS 267 Ca 0.20 -0.13 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 3d47 h LYS 267 Cb 0.02 -0.25 -0.00 0.00 -0.60 0.00 0.00 32.23 31.40 3d47 h LYS 267 CO -0.03 0.87 -0.04 0.07 -3.45 0.00 0.00 179.45 176.86 3d47 h ARG 268 N 1.23 0.00 -0.02 1.90 0.11 -1.07 -2.90 114.38 113.63 3d47 h ARG 268 Ca 0.31 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.39 3d47 h ARG 268 Cb -0.01 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.07 3d47 h ARG 268 CO -0.05 0.04 -0.02 0.09 0.10 0.00 0.00 179.97 180.13 3d47 n ASN 269 N -3.13 2.00 -4.77 0.08 4.13 -0.58 -4.97 115.26 108.01 3d47 n ASN 269 Ca 0.02 -1.64 -0.37 0.00 1.68 0.00 0.00 54.58 54.27 3d47 n ASN 269 Cb 0.42 0.02 -0.01 0.00 -1.54 0.00 0.00 39.78 38.66 3d47 n ASN 269 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3d47 s ALA 270 N -2.03 2.96 0.39 5.41 0.00 -0.58 -4.97 121.76 122.93 3d47 s ALA 270 Ca 0.34 0.87 -0.27 0.00 0.00 0.00 0.00 51.96 52.89 3d47 s ALA 270 Cb 0.21 -3.36 -0.11 0.00 0.00 0.00 0.00 23.12 19.86 3d47 s ALA 270 CO 0.34 -0.58 1.43 -2.30 0.00 0.00 0.00 175.76 174.65 3d47 n PRO 271 N -0.51 2.45 -1.63 0.00 -0.02 -1.26 -4.84 135.00 129.19 3d47 n PRO 271 Ca 0.07 0.86 -0.51 0.00 -2.02 0.00 0.00 63.50 61.91 3d47 n PRO 271 Cb 0.49 -2.59 -0.05 0.00 -0.02 0.00 0.00 33.50 31.32 3d47 n PRO 271 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d47 n ALA 272 N 0.23 -0.12 0.00 3.55 0.00 -1.26 -1.36 120.51 121.55 3d47 n ALA 272 Ca 0.03 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.94 3d47 n ALA 272 Cb 0.39 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.65 3d47 n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d47 n GLY 273 N 3.03 2.87 3.72 0.00 0.00 -1.26 -5.02 105.19 108.54 3d47 n GLY 273 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3d47 n GLY 273 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3d47 s MET 274 N -0.36 4.45 0.30 1.61 0.00 -0.46 -5.00 119.30 119.84 3d47 s MET 274 Ca 0.00 0.95 -0.08 0.00 0.00 0.00 0.00 55.69 56.56 3d47 s MET 274 Cb 0.00 -3.42 -0.06 0.00 0.00 0.00 0.00 34.83 31.34 3d47 s MET 274 CO 0.00 0.12 0.61 -1.64 0.00 0.00 0.00 175.02 174.11 3d47 s MET 275 N 0.58 3.74 -0.09 4.11 -1.94 -0.75 -4.71 119.30 120.24 3d47 s MET 275 Ca 0.38 0.23 0.04 0.00 -1.71 0.00 0.00 55.69 54.63 3d47 s MET 275 Cb -0.19 -2.58 -0.01 0.00 2.01 0.00 0.00 34.83 34.06 3d47 s MET 275 CO 0.20 0.19 -0.21 0.08 -0.01 0.00 0.00 175.02 175.27 3d47 s VAL 276 N -2.05 2.37 0.23 -6.03 1.01 -1.26 -1.36 120.40 113.30 3d47 s VAL 276 Ca 0.47 -0.93 0.03 0.00 0.00 0.00 0.00 61.98 61.55 3d47 s VAL 276 Cb -0.11 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.31 3d47 s VAL 276 CO 0.27 0.56 0.01 0.42 0.00 0.00 0.00 175.10 176.36 3d47 s THR 277 N 0.06 0.91 -0.05 3.92 -4.23 -0.92 -1.80 115.64 113.54 3d47 s THR 277 Ca -0.09 -2.02 -0.30 0.00 -1.18 0.00 0.00 61.69 58.10 3d47 s THR 277 Cb -0.15 -2.36 0.11 0.00 1.34 0.00 0.00 72.50 71.43 3d47 s THR 277 CO 0.06 -0.30 1.33 -0.55 -0.54 0.00 0.00 174.62 174.62 3d47 s SER 278 N -3.29 -0.00 0.00 3.99 0.15 -1.15 -0.48 113.70 112.91 3d47 s SER 278 Ca 0.29 -0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.82 3d47 s SER 278 Cb 0.06 0.09 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 3d47 s SER 278 CO 0.09 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.96 3d47 n GLY 279 N -0.84 1.08 0.37 9.45 0.00 -1.26 -0.80 105.19 113.19 3d47 n GLY 279 Ca 0.02 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.23 3d47 n GLY 279 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3d47 h GLU 280 N 0.00 0.00 -0.11 1.61 4.11 -1.53 -0.72 114.58 117.94 3d47 h GLU 280 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3d47 h GLU 280 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3d47 h GLU 280 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 179.01 179.80 3d47 n HIS 281 N -4.37 0.12 -2.65 2.06 8.25 -1.26 -4.14 115.22 113.23 3d47 n HIS 281 Ca 0.09 -0.06 -0.29 0.00 -0.26 0.00 0.00 57.72 57.20 3d47 n HIS 281 Cb 0.57 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.67 3d47 n HIS 281 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3d47 s HIS 282 N -1.88 3.52 0.03 4.41 3.76 -0.27 -4.53 115.29 120.32 3d47 s HIS 282 Ca 0.32 1.00 -0.07 0.00 -0.15 0.00 0.00 55.06 56.16 3d47 s HIS 282 Cb 0.21 -2.43 -0.00 0.00 1.11 0.00 0.00 32.58 31.46 3d47 s HIS 282 CO 0.31 -0.24 0.14 0.20 -0.85 0.00 0.00 174.74 174.29 3d47 s GLY 283 N -3.62 0.10 0.10 -2.22 0.00 -1.21 -4.28 107.32 96.19 3d47 s GLY 283 Ca 0.50 -0.38 0.00 0.00 0.00 0.00 0.00 44.72 44.85 3d47 s GLY 283 CO 0.39 -0.53 0.00 -1.30 0.00 0.00 0.00 173.10 171.66 3d47 n THR 284 N 0.88 -1.84 -0.28 0.90 -2.24 -0.75 -4.20 114.28 106.75 3d47 n THR 284 Ca -0.20 0.47 0.05 0.00 -2.27 0.00 0.00 64.05 62.11 3d47 n THR 284 Cb 0.58 -0.65 0.27 0.00 -2.10 0.00 0.00 70.33 68.43 3d47 n THR 284 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3d47 h LEU 285 N 0.32 0.84 -0.97 3.22 5.85 -1.92 -2.25 115.31 120.41 3d47 h LEU 285 Ca 0.00 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 3d47 h LEU 285 Cb 0.00 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 3d47 h LEU 285 CO 0.00 0.53 0.03 1.56 -0.34 0.00 0.00 178.44 180.22 3d47 h GLN 286 N 0.95 0.78 -0.60 1.25 7.50 -2.00 -1.95 115.11 121.03 3d47 h GLN 286 Ca 0.39 -0.19 -0.06 0.00 0.50 0.00 0.00 58.65 59.29 3d47 h GLN 286 Cb 0.27 -0.10 -0.03 0.00 0.05 0.00 0.00 27.48 27.68 3d47 h GLN 286 CO -0.15 0.77 0.14 0.77 -1.50 0.00 0.00 178.83 178.86 3d47 h SER 287 N 0.74 0.87 0.85 1.46 0.02 -1.58 -1.89 113.55 114.01 3d47 h SER 287 Ca 0.15 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 3d47 h SER 287 Cb 0.40 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 3d47 h SER 287 CO 0.01 0.85 -0.21 -0.26 -1.14 0.00 0.00 176.83 176.08 3d47 h PHE 288 N 0.89 0.00 -0.21 3.45 0.04 -1.27 -0.15 116.94 119.69 3d47 h PHE 288 Ca 0.19 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.91 3d47 h PHE 288 Cb 0.32 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.47 3d47 h PHE 288 CO 0.02 0.21 -0.07 -0.09 -0.60 0.00 0.00 178.31 177.78 3d47 h ARG 289 N 0.00 0.41 -0.68 1.51 1.12 -0.61 0.14 114.38 116.26 3d47 h ARG 289 Ca -0.00 -0.16 -0.05 0.00 -1.11 0.00 0.00 59.98 58.65 3d47 h ARG 289 Cb 0.69 -0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 30.60 3d47 h ARG 289 CO 0.03 0.67 0.23 1.15 -3.11 0.00 0.00 179.97 178.93 3d47 h THR 290 N 0.12 1.25 -0.32 0.20 2.02 -1.02 -2.00 112.91 113.16 3d47 h THR 290 Ca 0.05 -0.85 -0.05 0.00 0.77 0.00 0.00 66.41 66.34 3d47 h THR 290 Cb 0.53 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 3d47 h THR 290 CO 0.02 0.33 0.02 0.25 0.37 0.00 0.00 175.52 176.51 3d47 h LEU 291 N 0.99 0.54 -1.08 2.58 5.85 -0.90 -2.94 115.31 120.35 3d47 h LEU 291 Ca 0.22 -0.29 0.04 0.00 0.84 0.00 0.00 57.88 58.69 3d47 h LEU 291 Cb 0.28 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.11 3d47 h LEU 291 CO -0.01 0.70 0.62 0.00 -0.34 0.00 0.00 178.44 179.41 3d47 h ALA 292 N 0.86 1.41 0.00 1.25 0.00 -0.54 -1.48 119.26 120.76 3d47 h ALA 292 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3d47 h ALA 292 Cb 0.41 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3d47 h ALA 292 CO 0.01 0.48 0.00 0.39 0.00 0.00 0.00 179.25 180.13 3d47 n GLU 293 N -4.46 0.43 0.07 0.00 1.02 -0.77 -2.07 120.64 114.86 3d47 n GLU 293 Ca 0.13 0.06 0.13 0.00 -0.02 0.00 0.00 57.16 57.46 3d47 n GLU 293 Cb 0.13 -1.50 0.47 0.00 -0.02 0.00 0.00 31.44 30.51 3d47 n GLU 293 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3d47 n THR 294 N -1.15 0.39 -0.25 2.62 -2.24 -0.56 -4.92 114.28 108.17 3d47 n THR 294 Ca 0.11 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 3d47 n THR 294 Cb 0.11 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 67.80 3d47 n THR 294 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d47 n GLY 295 N 1.37 0.65 3.74 3.38 0.00 -0.88 -4.16 105.19 109.29 3d47 n GLY 295 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 3d47 n GLY 295 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3d47 s ILE 296 N -2.53 2.12 0.10 -0.61 -4.36 -1.26 -4.95 121.20 109.72 3d47 s ILE 296 Ca 0.00 0.08 -0.15 0.00 -0.26 0.00 0.00 60.65 60.32 3d47 s ILE 296 Cb 0.00 -3.03 -0.07 0.00 1.25 0.00 0.00 42.46 40.60 3d47 s ILE 296 CO 0.00 -0.02 1.45 0.44 0.24 0.00 0.00 174.94 177.05 3d47 h ASP 297 N 0.66 0.72 -3.60 4.36 3.32 -1.75 -3.46 116.42 116.68 3d47 h ASP 297 Ca -0.51 -0.44 -0.31 0.00 0.02 0.00 0.00 57.03 55.80 3d47 h ASP 297 Cb 1.33 -0.20 -0.32 0.00 0.22 0.00 0.00 39.33 40.36 3d47 h ASP 297 CO 0.54 1.01 -0.74 -0.63 -1.72 0.00 0.00 179.24 177.70 3d47 s ILE 298 N -4.49 0.11 -0.11 0.35 1.01 -1.24 -3.97 121.20 112.87 3d47 s ILE 298 Ca -0.13 0.06 -0.09 0.00 0.00 0.00 0.00 60.65 60.50 3d47 s ILE 298 Cb 0.09 -0.18 -0.04 0.00 0.01 0.00 0.00 42.46 42.33 3d47 s ILE 298 CO 0.82 0.10 0.19 -0.04 0.00 0.00 0.00 174.94 176.01 3d47 s MET 299 N 0.69 3.62 -0.53 2.79 -1.94 -1.23 -2.92 119.30 119.78 3d47 s MET 299 Ca -0.06 -0.03 0.07 0.00 -1.71 0.00 0.00 55.69 53.95 3d47 s MET 299 Cb -0.09 -3.22 0.34 0.00 2.01 0.00 0.00 34.83 33.86 3d47 s MET 299 CO -0.01 0.70 0.90 1.04 -0.01 0.00 0.00 175.02 177.63 3d47 n GLN 300 N 2.14 2.72 -1.94 2.03 6.02 0.02 -1.91 117.38 126.46 3d47 n GLN 300 Ca -0.18 -4.53 -0.36 0.00 -0.01 0.00 0.00 57.00 51.92 3d47 n GLN 300 Cb 0.54 -2.12 0.04 0.00 1.02 0.00 0.00 30.24 29.73 3d47 n GLN 300 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3d47 s PRO 301 N -3.22 2.86 -0.20 -1.09 0.04 -1.26 -1.31 135.00 130.82 3d47 s PRO 301 Ca 0.47 1.90 -0.14 0.00 0.04 0.00 0.00 61.00 63.26 3d47 s PRO 301 Cb 0.29 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.88 3d47 s PRO 301 CO -0.12 -1.31 0.33 0.34 0.04 0.00 0.00 177.00 176.27 3d47 s ASP 302 N -1.53 6.36 0.51 6.66 2.15 -1.26 -1.37 116.67 128.19 3d47 s ASP 302 Ca 0.79 0.42 0.21 0.00 0.43 0.00 0.00 52.55 54.40 3d47 s ASP 302 Cb -0.32 -2.20 1.28 0.00 -0.30 0.00 0.00 42.92 41.38 3d47 s ASP 302 CO 0.35 -0.02 2.02 0.58 -0.17 0.00 0.00 175.17 177.94 3d47 h VAL 303 N 4.97 0.83 -0.13 1.11 2.07 -1.91 0.16 116.25 123.35 3d47 h VAL 303 Ca -0.37 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.11 3d47 h VAL 303 Cb 1.16 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 3d47 h VAL 303 CO 0.71 0.02 0.00 0.61 0.02 0.00 0.00 177.57 178.93 3d47 n GLY 304 N -1.59 0.32 0.00 2.17 0.00 -1.26 -2.39 105.19 102.44 3d47 n GLY 304 Ca 0.07 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.64 3d47 n GLY 304 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3d47 n TRP 305 N 0.39 0.00 0.48 1.61 8.01 -0.08 -4.30 117.44 123.55 3d47 n TRP 305 Ca 0.17 0.00 0.13 0.00 -1.31 0.00 0.00 57.50 56.49 3d47 n TRP 305 Cb 0.36 0.00 0.41 0.00 -2.01 0.00 0.00 31.31 30.07 3d47 n TRP 305 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3d47 n GLY 307 N 0.88 0.52 0.00 0.00 0.00 -1.26 -1.82 105.19 103.51 3d47 n GLY 307 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3d47 n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d47 n GLY 308 N 0.00 -1.40 0.35 -0.02 0.00 -1.00 -3.98 105.19 99.14 3d47 n GLY 308 Ca 0.00 -2.21 -0.05 0.00 0.00 0.00 0.00 46.02 43.76 3d47 n GLY 308 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3d47 h LEU 309 N 0.00 1.10 -0.64 0.99 5.85 -1.84 -0.13 115.31 120.63 3d47 h LEU 309 Ca 0.00 -0.13 0.07 0.00 0.84 0.00 0.00 57.88 58.66 3d47 h LEU 309 Cb 0.00 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.69 3d47 h LEU 309 CO 0.00 0.93 0.32 0.74 -0.34 0.00 0.00 178.44 180.09 3d47 h THR 310 N 1.19 0.90 -0.20 1.05 2.02 -1.92 -0.93 112.91 115.03 3d47 h THR 310 Ca 0.29 -0.20 -0.19 0.00 0.77 0.00 0.00 66.41 67.07 3d47 h THR 310 Cb 0.13 0.26 0.01 0.00 -1.74 0.00 0.00 68.15 66.80 3d47 h THR 310 CO -0.04 0.11 -0.64 0.74 0.37 0.00 0.00 175.52 176.07 3d47 h THR 311 N 0.59 1.29 -0.68 3.16 2.02 -1.71 -3.18 112.91 114.40 3d47 h THR 311 Ca 0.30 -1.84 0.07 0.00 0.77 0.00 0.00 66.41 65.71 3d47 h THR 311 Cb 0.26 1.87 -0.06 0.00 -1.74 0.00 0.00 68.15 68.48 3d47 h THR 311 CO -0.22 0.59 0.36 0.25 0.37 0.00 0.00 175.52 176.87 3d47 h LEU 312 N 0.52 0.52 -1.37 2.58 5.85 -0.35 -0.59 115.31 122.47 3d47 h LEU 312 Ca -0.02 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3d47 h LEU 312 Cb 1.26 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.21 3d47 h LEU 312 CO 0.14 0.33 0.27 0.58 -0.34 0.00 0.00 178.44 179.42 3d47 h VAL 313 N 0.66 1.16 -0.30 1.05 2.07 -1.22 -0.97 116.25 118.70 3d47 h VAL 313 Ca 0.31 -0.41 -0.16 0.00 0.82 0.00 0.00 66.70 67.26 3d47 h VAL 313 Cb 0.24 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 3d47 h VAL 313 CO -0.21 0.18 -0.43 -0.33 0.02 0.00 0.00 177.57 176.80 3d47 h GLU 314 N 0.71 0.82 -0.77 1.57 5.08 -1.19 -2.71 114.58 118.09 3d47 h GLU 314 Ca 0.18 -0.48 -0.04 0.00 -1.00 0.00 0.00 59.36 58.02 3d47 h GLU 314 Cb 0.03 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 3d47 h GLU 314 CO -0.03 1.12 0.34 0.82 -1.00 0.00 0.00 179.01 180.26 3d47 h ILE 315 N 0.59 1.25 -0.68 3.13 2.04 -0.64 -1.07 117.51 122.14 3d47 h ILE 315 Ca 0.03 -0.75 0.02 0.00 1.00 0.00 0.00 64.86 65.16 3d47 h ILE 315 Cb 1.03 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 37.37 3d47 h ILE 315 CO 0.10 0.31 0.44 0.00 0.00 0.00 0.00 178.15 179.00 3d47 h ALA 316 N 1.26 0.87 -0.69 1.87 0.00 -1.11 -0.44 119.26 121.03 3d47 h ALA 316 Ca 0.26 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 3d47 h ALA 316 Cb 0.16 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3d47 h ALA 316 CO -0.03 0.24 0.18 0.00 0.00 0.00 0.00 179.25 179.64 3d47 h ALA 317 N 1.27 1.01 0.11 0.00 0.00 -1.07 0.18 119.26 120.75 3d47 h ALA 317 Ca 0.26 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3d47 h ALA 317 Cb -0.05 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 3d47 h ALA 317 CO -0.08 0.65 -0.07 1.25 0.00 0.00 0.00 179.25 181.00 3d47 h LEU 318 N 1.03 -0.17 -0.46 0.00 5.85 -0.42 -0.73 115.31 120.42 3d47 h LEU 318 Ca 0.22 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 3d47 h LEU 318 Cb 0.35 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3d47 h LEU 318 CO -0.00 -0.11 0.28 0.00 -0.34 0.00 0.00 178.44 178.26 3d47 h ALA 319 N 0.72 0.59 -0.33 1.25 0.00 -0.85 -2.62 119.26 118.02 3d47 h ALA 319 Ca -0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3d47 h ALA 319 Cb 0.15 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3d47 h ALA 319 CO 0.01 0.08 0.11 -0.22 0.00 0.00 0.00 179.25 179.22 3d47 h LYS 320 N 0.61 0.46 0.00 0.00 3.64 -0.71 -0.24 116.57 120.33 3d47 h LYS 320 Ca 0.16 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3d47 h LYS 320 Cb -0.00 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 3d47 h LYS 320 CO -0.03 0.40 -0.12 0.66 -2.27 0.00 0.00 179.45 178.09 3d47 h SER 321 N 0.46 0.00 -0.53 4.20 4.64 -0.75 -0.76 113.55 120.81 3d47 h SER 321 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3d47 h SER 321 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3d47 h SER 321 CO -0.01 0.12 0.00 0.54 -0.87 0.00 0.00 176.83 176.61 3d47 n ARG 322 N -3.78 2.50 -1.54 4.77 1.74 -0.58 -4.93 116.66 114.85 3d47 n ARG 322 Ca -0.02 -2.30 -0.11 0.00 -0.77 0.00 0.00 57.85 54.65 3d47 n ARG 322 Cb 0.22 -1.52 -0.04 0.00 -1.02 0.00 0.00 32.46 30.11 3d47 n ARG 322 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d47 n GLY 323 N 1.53 0.90 3.98 -0.13 0.00 -0.29 -5.01 105.19 106.16 3d47 n GLY 323 Ca 0.21 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 3d47 n GLY 323 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d47 s GLN 324 N -3.32 2.23 0.17 1.61 -0.21 -0.21 -4.99 119.66 114.95 3d47 s GLN 324 Ca 0.00 -1.87 0.09 0.00 0.02 0.00 0.00 55.36 53.60 3d47 s GLN 324 Cb 0.00 -2.39 -0.04 0.00 1.00 0.00 0.00 33.01 31.58 3d47 s GLN 324 CO 0.00 -0.83 -0.10 -0.51 -2.12 0.00 0.00 175.29 171.73 3d47 s LEU 325 N -4.54 2.97 -0.11 2.90 1.43 -1.25 -4.00 118.68 116.08 3d47 s LEU 325 Ca 0.49 -0.56 0.02 0.00 -1.03 0.00 0.00 54.13 53.05 3d47 s LEU 325 Cb -0.04 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.53 3d47 s LEU 325 CO 0.31 0.11 -0.15 -0.69 0.23 0.00 0.00 176.35 176.16 3d47 s VAL 326 N -1.65 1.50 -0.37 -1.59 1.01 -0.39 -3.48 120.40 115.43 3d47 s VAL 326 Ca 0.24 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.59 3d47 s VAL 326 Cb -0.09 -1.37 0.12 0.00 0.00 0.00 0.00 36.38 35.03 3d47 s VAL 326 CO 0.15 0.44 0.15 -0.69 0.00 0.00 0.00 175.10 175.15 3d47 s VAL 327 N 1.01 1.19 0.73 2.92 1.01 -0.81 -4.22 120.40 122.24 3d47 s VAL 327 Ca -0.06 -1.95 -0.16 0.00 0.00 0.00 0.00 61.98 59.81 3d47 s VAL 327 Cb -0.15 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 3d47 s VAL 327 CO -0.02 -0.76 0.49 -2.65 0.00 0.00 0.00 175.10 172.15 3d47 n PRO 328 N 4.26 0.26 -3.12 2.72 -0.02 -1.26 -4.26 135.00 133.58 3d47 n PRO 328 Ca 0.03 0.13 -0.40 0.00 -2.02 0.00 0.00 63.50 61.24 3d47 n PRO 328 Cb 0.39 -1.80 -0.06 0.00 -0.02 0.00 0.00 33.50 32.01 3d47 n PRO 328 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3d47 s HIS 329 N -1.94 3.33 0.00 6.00 5.65 -0.47 -4.25 115.29 123.61 3d47 s HIS 329 Ca 0.65 0.86 0.00 0.00 0.25 0.00 0.00 55.06 56.82 3d47 s HIS 329 Cb -0.34 -2.81 0.00 0.00 -1.18 0.00 0.00 32.58 28.25 3d47 s HIS 329 CO 0.59 -0.25 0.00 0.41 -0.65 0.00 0.00 174.74 174.84 3d47 n GLY 330 N 3.98 2.18 3.69 1.59 0.00 -1.26 -4.41 105.19 110.97 3d47 n GLY 330 Ca -0.01 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.35 3d47 n GLY 330 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d47 n SER 331 N 2.55 0.00 0.00 1.61 7.64 -1.26 -4.66 113.62 119.50 3d47 n SER 331 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3d47 n SER 331 Cb 0.00 -0.57 0.00 0.00 -1.01 0.00 0.00 64.21 62.63 3d47 n SER 331 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3d47 n SER 332 N 0.00 0.00 0.08 6.43 2.88 -1.26 -1.93 113.62 119.82 3d47 n SER 332 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 3d47 n SER 332 Cb 0.00 0.00 0.60 0.00 -0.75 0.00 0.00 64.21 64.06 3d47 n SER 332 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 3d47 h VAL 333 N 0.00 0.91 0.00 2.46 -1.51 -1.91 -0.39 116.25 115.82 3d47 h VAL 333 Ca 0.00 -0.05 -0.02 0.00 -1.23 0.00 0.00 66.70 65.39 3d47 h VAL 333 Cb 0.00 0.75 -0.00 0.00 -2.13 0.00 0.00 31.29 29.90 3d47 h VAL 333 CO 0.00 0.03 -0.11 1.88 -1.23 0.00 0.00 177.57 178.14 3d47 h TYR 334 N 0.15 0.00 0.05 5.19 0.05 -1.74 -2.19 116.97 118.48 3d47 h TYR 334 Ca 0.15 0.00 -0.30 0.00 0.05 0.00 0.00 58.73 58.63 3d47 h TYR 334 Cb 0.40 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.11 3d47 h TYR 334 CO -0.00 0.11 -1.64 0.45 -1.05 0.00 0.00 178.16 176.03 3d47 n SER 335 N -3.81 1.97 -0.13 3.88 2.88 -0.31 -4.17 113.62 113.92 3d47 n SER 335 Ca -0.02 0.33 -0.08 0.00 -1.33 0.00 0.00 58.87 57.77 3d47 n SER 335 Cb 0.21 -0.91 -0.02 0.00 -0.75 0.00 0.00 64.21 62.74 3d47 n SER 335 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 3d47 h HIS 336 N -0.58 -0.96 0.00 0.66 3.86 -0.88 0.40 115.15 117.64 3d47 h HIS 336 Ca -0.40 0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 58.86 3d47 h HIS 336 Cb 1.61 0.48 -0.00 0.00 1.06 0.00 0.00 27.41 30.56 3d47 h HIS 336 CO 0.08 -0.39 -0.03 0.45 0.86 0.00 0.00 177.93 178.89 3d47 h HIS 337 N -0.25 0.00 0.00 2.45 -0.00 -1.62 -1.76 115.15 113.96 3d47 h HIS 337 Ca 0.17 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.53 3d47 h HIS 337 Cb 0.55 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.96 3d47 h HIS 337 CO -0.56 0.03 -0.33 0.00 -0.00 0.00 0.00 177.93 177.07 3d47 h ALA 338 N 1.97 0.01 0.00 2.45 0.00 -1.18 -3.32 119.26 119.20 3d47 h ALA 338 Ca -0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 3d47 h ALA 338 Cb 0.08 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3d47 h ALA 338 CO 0.00 0.30 -0.07 -0.39 0.00 0.00 0.00 179.25 179.09 3d47 h VAL 339 N -1.00 0.80 0.00 0.00 -1.51 -0.30 -0.68 116.25 113.57 3d47 h VAL 339 Ca -0.02 -0.28 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 3d47 h VAL 339 Cb 0.37 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 3d47 h VAL 339 CO -0.01 0.07 0.00 0.00 -1.23 0.00 0.00 177.57 176.40 3d47 n ILE 340 N -4.09 1.03 0.80 7.19 3.06 -0.67 -1.41 119.36 125.27 3d47 n ILE 340 Ca -0.03 0.39 0.09 0.00 -2.50 0.00 0.00 62.75 60.70 3d47 n ILE 340 Cb 0.16 -1.32 0.02 0.00 0.54 0.00 0.00 39.64 39.04 3d47 n ILE 340 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 3d47 n THR 341 N -2.05 0.00 -3.33 9.51 -2.24 -0.27 -0.68 114.28 115.22 3d47 n THR 341 Ca 0.01 -0.36 -0.39 0.00 -2.27 0.00 0.00 64.05 61.04 3d47 n THR 341 Cb 0.15 1.26 -0.08 0.00 -2.10 0.00 0.00 70.33 69.55 3d47 n THR 341 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3d47 s PHE 342 N -1.95 3.26 0.33 4.78 0.08 -0.50 -4.66 117.98 119.31 3d47 s PHE 342 Ca 0.17 0.50 0.32 0.00 0.12 0.00 0.00 56.93 58.04 3d47 s PHE 342 Cb 0.15 -2.63 1.53 0.00 -0.57 0.00 0.00 43.02 41.50 3d47 s PHE 342 CO 0.40 -0.24 2.06 1.79 -0.10 0.00 0.00 175.22 179.13 3d47 h THR 343 N 5.38 0.29 -0.86 0.64 1.35 -1.92 -2.87 112.91 114.93 3d47 h THR 343 Ca -0.31 -0.52 -0.40 0.00 -0.55 0.00 0.00 66.41 64.63 3d47 h THR 343 Cb 1.15 1.39 -0.24 0.00 -1.73 0.00 0.00 68.15 68.73 3d47 h THR 343 CO 0.67 0.08 0.48 -0.46 -0.25 0.00 0.00 175.52 176.04 3d47 n ASN 344 N -3.34 3.88 -3.32 5.36 6.94 -1.26 -4.51 115.26 119.01 3d47 n ASN 344 Ca -0.01 -3.53 -0.25 0.00 -0.02 0.00 0.00 54.58 50.77 3d47 n ASN 344 Cb 0.26 -0.79 -0.08 0.00 -2.36 0.00 0.00 39.78 36.80 3d47 n ASN 344 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 3d47 n THR 345 N -0.90 0.06 0.29 5.53 -1.04 -1.09 -1.26 114.28 115.88 3d47 n THR 345 Ca 0.52 -4.25 0.04 0.00 -2.04 0.00 0.00 64.05 58.32 3d47 n THR 345 Cb 1.53 -1.96 0.18 0.00 -1.82 0.00 0.00 70.33 68.26 3d47 n THR 345 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3d47 n PRO 346 N 1.53 0.00 -3.55 -2.82 -0.04 -1.26 -4.78 135.00 124.08 3d47 n PRO 346 Ca 0.24 0.35 -0.11 0.00 -0.04 0.00 0.00 63.50 63.95 3d47 n PRO 346 Cb 0.48 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.42 3d47 n PRO 346 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3d47 s PHE 347 N -2.99 -0.40 0.36 0.54 -0.12 -1.26 -4.59 117.98 109.52 3d47 s PHE 347 Ca 0.04 0.12 0.03 0.00 -0.05 0.00 0.00 56.93 57.08 3d47 s PHE 347 Cb 0.05 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.93 3d47 s PHE 347 CO 0.15 -0.90 0.10 -1.12 -0.05 0.00 0.00 175.22 173.40 3d47 s SER 348 N -2.80 2.40 -0.04 1.98 0.01 -0.25 -4.85 113.70 110.15 3d47 s SER 348 Ca 0.04 -1.53 -0.01 0.00 1.31 0.00 0.00 55.95 55.75 3d47 s SER 348 Cb -0.01 0.26 -0.04 0.00 0.21 0.00 0.00 66.02 66.44 3d47 s SER 348 CO -0.09 -0.80 0.04 -0.70 0.41 0.00 0.00 173.24 172.11 3d47 s GLU 349 N -3.82 3.02 -0.23 12.44 2.12 -1.26 -2.07 118.70 128.89 3d47 s GLU 349 Ca 0.30 -0.45 -0.00 0.00 0.36 0.00 0.00 54.97 55.18 3d47 s GLU 349 Cb 0.05 -2.83 0.06 0.00 0.26 0.00 0.00 34.13 31.68 3d47 s GLU 349 CO 0.15 0.67 -0.03 0.12 -0.54 0.00 0.00 175.26 175.63 3d47 s PHE 350 N -1.06 2.10 -0.37 5.30 5.36 -0.90 -4.43 117.98 123.98 3d47 s PHE 350 Ca 0.18 -1.58 -0.22 0.00 -0.96 0.00 0.00 56.93 54.36 3d47 s PHE 350 Cb -0.12 -1.48 0.01 0.00 -0.34 0.00 0.00 43.02 41.09 3d47 s PHE 350 CO 0.09 -0.74 0.72 -1.17 -1.46 0.00 0.00 175.22 172.65 3d47 s LEU 351 N 1.50 4.20 -0.19 6.12 2.96 -1.26 -1.07 118.68 130.93 3d47 s LEU 351 Ca -0.04 0.23 -0.32 0.00 -0.22 0.00 0.00 54.13 53.78 3d47 s LEU 351 Cb -0.18 -2.91 -0.09 0.00 0.50 0.00 0.00 46.19 43.51 3d47 s LEU 351 CO -0.07 -0.68 2.10 0.23 -1.32 0.00 0.00 176.35 176.61 3d47 n MET 352 N 6.26 1.91 0.00 1.98 2.81 -0.19 -4.79 117.12 125.11 3d47 n MET 352 Ca 0.01 0.61 0.11 0.00 -1.81 0.00 0.00 57.70 56.62 3d47 n MET 352 Cb 0.48 -2.87 0.05 0.00 -0.71 0.00 0.00 33.22 30.17 3d47 n MET 352 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3d47 n THR 353 N 6.68 0.03 -1.95 2.03 -2.24 -1.26 -4.86 114.28 112.72 3d47 n THR 353 Ca 0.30 -0.05 -0.42 0.00 -2.27 0.00 0.00 64.05 61.60 3d47 n THR 353 Cb 0.35 0.56 -0.03 0.00 -2.10 0.00 0.00 70.33 69.11 3d47 n THR 353 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3d47 s SER 354 N -3.19 6.62 0.42 3.42 0.15 -1.26 -4.88 113.70 114.97 3d47 s SER 354 Ca 0.08 2.47 0.19 0.00 0.70 0.00 0.00 55.95 59.40 3d47 s SER 354 Cb 0.16 -2.57 1.12 0.00 -1.71 0.00 0.00 66.02 63.03 3d47 s SER 354 CO 0.79 -0.87 1.81 -0.65 1.20 0.00 0.00 173.24 175.52 3d47 h PRO 355 N 8.16 0.36 -0.06 5.44 0.11 -1.91 -1.99 132.00 142.11 3d47 h PRO 355 Ca -0.42 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3d47 h PRO 355 Cb 1.20 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3d47 h PRO 355 CO 0.93 0.24 0.00 -0.40 -0.21 0.00 0.00 178.00 178.56 3d47 n ASP 356 N -4.55 2.71 -4.07 -2.05 5.75 -1.26 -1.41 116.55 111.67 3d47 n ASP 356 Ca 0.23 -3.03 -0.34 0.00 -0.01 0.00 0.00 54.79 51.64 3d47 n ASP 356 Cb 0.83 -0.44 -0.01 0.00 -1.03 0.00 0.00 41.12 40.46 3d47 n ASP 356 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3d47 n SER 358 N -2.64 1.94 -4.36 0.00 3.41 -1.26 -4.73 113.62 105.99 3d47 n SER 358 Ca 0.06 -0.23 -0.18 0.00 -0.26 0.00 0.00 58.87 58.27 3d47 n SER 358 Cb 0.50 1.34 -0.10 0.00 -0.26 0.00 0.00 64.21 65.68 3d47 n SER 358 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3d47 s THR 359 N -2.50 1.21 -1.22 6.66 -4.23 -1.26 -5.07 115.64 109.23 3d47 s THR 359 Ca -0.02 -2.06 -0.05 0.00 -1.18 0.00 0.00 61.69 58.39 3d47 s THR 359 Cb 0.07 -2.36 0.13 0.00 1.34 0.00 0.00 72.50 71.68 3d47 s THR 359 CO 0.43 -0.33 2.38 0.18 -0.54 0.00 0.00 174.62 176.74 3d47 n LEU 360 N -0.46 7.86 -4.76 4.79 4.77 -1.26 -4.58 117.00 123.37 3d47 n LEU 360 Ca -0.05 -4.85 -0.41 0.00 -0.03 0.00 0.00 56.01 50.66 3d47 n LEU 360 Cb 0.64 -1.33 -0.02 0.00 -2.33 0.00 0.00 43.42 40.38 3d47 n LEU 360 CO 0.37 2.03 1.16 -0.60 -1.33 0.00 0.00 177.39 179.02 3d47 s ARG 361 N -1.47 4.19 0.45 3.23 3.52 -1.26 -4.90 118.95 122.70 3d47 s ARG 361 Ca 0.53 2.45 -0.24 0.00 -0.13 0.00 0.00 55.73 58.35 3d47 s ARG 361 Cb 0.20 -3.05 -0.09 0.00 -1.56 0.00 0.00 34.95 30.46 3d47 s ARG 361 CO -0.11 -0.51 1.16 -2.30 -0.81 0.00 0.00 175.30 172.74 3d47 n PRO 362 N 1.80 1.61 -0.28 5.12 -0.02 -1.26 -4.51 135.00 137.47 3d47 n PRO 362 Ca 0.06 0.58 0.09 0.00 -2.02 0.00 0.00 63.50 62.21 3d47 n PRO 362 Cb 0.39 -2.27 0.23 0.00 -0.02 0.00 0.00 33.50 31.83 3d47 n PRO 362 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3d47 h GLN 363 N 1.68 0.30 -0.37 -0.52 5.75 -1.86 -1.91 115.11 118.18 3d47 h GLN 363 Ca -0.47 -0.02 -0.17 0.00 -0.15 0.00 0.00 58.65 57.84 3d47 h GLN 363 Cb 1.32 -0.07 -0.10 0.00 1.07 0.00 0.00 27.48 29.70 3d47 h GLN 363 CO 0.58 0.20 -0.03 1.19 -2.65 0.00 0.00 178.83 178.12 3d47 n PHE 364 N -5.13 1.16 -1.68 3.99 3.72 -1.26 -4.88 117.46 113.38 3d47 n PHE 364 Ca 0.18 -1.49 -0.44 0.00 -0.05 0.00 0.00 57.45 55.64 3d47 n PHE 364 Cb 0.55 -0.48 -0.02 0.00 -0.94 0.00 0.00 39.48 38.58 3d47 n PHE 364 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3d47 n ASP 365 N -1.03 2.76 -0.68 4.37 2.03 -0.72 -1.86 116.55 121.42 3d47 n ASP 365 Ca 0.33 1.16 0.06 0.00 0.52 0.00 0.00 54.79 56.85 3d47 n ASP 365 Cb 1.04 -1.44 0.17 0.00 -0.72 0.00 0.00 41.12 40.17 3d47 n ASP 365 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3d47 n PRO 366 N 1.74 2.89 0.28 -0.67 -0.04 -1.26 -1.34 135.00 136.59 3d47 n PRO 366 Ca 0.10 -2.20 0.12 0.00 -0.04 0.00 0.00 63.50 61.48 3d47 n PRO 366 Cb 0.32 -1.38 0.78 0.00 -0.04 0.00 0.00 33.50 33.19 3d47 n PRO 366 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 3d47 h ILE 367 N 1.97 0.73 -3.65 0.52 6.09 -1.71 -3.42 117.51 118.05 3d47 h ILE 367 Ca 0.00 -0.11 -0.63 0.00 -1.37 0.00 0.00 64.86 62.75 3d47 h ILE 367 Cb 0.86 1.06 -0.17 0.00 0.47 0.00 0.00 36.82 39.04 3d47 h ILE 367 CO 0.04 0.03 -0.55 -0.76 -3.07 0.00 0.00 178.15 173.84 3d47 s LEU 368 N -8.16 3.89 0.17 2.19 1.02 -1.25 -1.29 118.68 115.24 3d47 s LEU 368 Ca -0.05 -0.00 -0.29 0.00 0.02 0.00 0.00 54.13 53.81 3d47 s LEU 368 Cb 0.16 -2.05 -0.07 0.00 0.02 0.00 0.00 46.19 44.25 3d47 s LEU 368 CO 0.60 0.03 0.92 -0.76 0.02 0.00 0.00 176.35 177.15 3d47 s LEU 369 N 1.28 4.57 -1.55 1.79 1.43 0.47 -3.69 118.68 122.98 3d47 s LEU 369 Ca 0.06 1.82 -0.02 0.00 -1.03 0.00 0.00 54.13 54.96 3d47 s LEU 369 Cb -0.14 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.54 3d47 s LEU 369 CO 0.06 0.07 0.21 -0.67 0.23 0.00 0.00 176.35 176.24 3d47 n ASP 370 N 2.09 -5.57 -4.68 2.29 2.03 -1.26 -3.18 116.55 108.28 3d47 n ASP 370 Ca -0.01 -0.11 -0.42 0.00 0.52 0.00 0.00 54.79 54.77 3d47 n ASP 370 Cb 0.48 -4.53 -0.03 0.00 -0.72 0.00 0.00 41.12 36.32 3d47 n ASP 370 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 3d47 s GLU 371 N -5.18 4.25 0.53 -0.67 2.12 -1.24 -4.88 118.70 113.61 3d47 s GLU 371 Ca 0.10 1.98 -0.19 0.00 0.36 0.00 0.00 54.97 57.22 3d47 s GLU 371 Cb -0.04 -3.71 -0.07 0.00 0.26 0.00 0.00 34.13 30.57 3d47 s GLU 371 CO 0.13 -0.67 1.08 -1.25 -0.54 0.00 0.00 175.26 174.00 3d47 s PRO 372 N 3.00 3.54 0.07 4.30 0.04 -1.26 -4.95 135.00 139.74 3d47 s PRO 372 Ca 0.65 1.44 0.03 0.00 0.04 0.00 0.00 61.00 63.16 3d47 s PRO 372 Cb -0.30 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 32.16 3d47 s PRO 372 CO 0.25 -0.66 -0.09 0.14 0.04 0.00 0.00 177.00 176.68 3d47 s VAL 373 N -1.96 0.74 0.37 -0.36 -7.23 -1.26 -4.79 120.40 105.90 3d47 s VAL 373 Ca 0.69 -1.36 -0.27 0.00 -1.81 0.00 0.00 61.98 59.23 3d47 s VAL 373 Cb -0.19 -0.99 -0.12 0.00 0.56 0.00 0.00 36.38 35.64 3d47 s VAL 373 CO 0.25 -0.47 1.21 -2.65 -0.31 0.00 0.00 175.10 173.14 3d47 n PRO 374 N 1.02 1.88 -4.09 4.82 -0.02 -1.26 -4.88 135.00 132.48 3d47 n PRO 374 Ca -0.20 0.66 -0.32 0.00 -2.02 0.00 0.00 63.50 61.63 3d47 n PRO 374 Cb 0.56 -2.25 -0.16 0.00 -0.02 0.00 0.00 33.50 31.63 3d47 n PRO 374 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3d47 s VAL 375 N -1.14 2.01 -1.35 -1.45 1.01 0.15 -4.52 120.40 115.09 3d47 s VAL 375 Ca 0.58 -1.10 -0.08 0.00 0.00 0.00 0.00 61.98 61.38 3d47 s VAL 375 Cb -0.56 -1.92 0.01 0.00 0.00 0.00 0.00 36.38 33.91 3d47 s VAL 375 CO 0.60 0.35 1.17 -3.20 0.00 0.00 0.00 175.10 174.02 3d47 n ASN 376 N 4.59 -6.03 -1.45 3.32 5.15 -1.25 -1.85 115.26 117.74 3d47 n ASN 376 Ca -0.18 -0.55 -0.17 0.00 -0.60 0.00 0.00 54.58 53.07 3d47 n ASN 376 Cb 0.48 -5.01 -0.06 0.00 -0.53 0.00 0.00 39.78 34.66 3d47 n ASN 376 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3d47 n GLY 377 N -1.94 1.29 3.19 8.20 0.00 -1.15 -4.63 105.19 110.14 3d47 n GLY 377 Ca -0.01 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 3d47 n GLY 377 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d47 s ARG 378 N -3.74 0.80 -0.19 1.61 0.52 -0.77 -1.50 118.95 115.67 3d47 s ARG 378 Ca 0.00 -0.98 -0.02 0.00 -0.52 0.00 0.00 55.73 54.21 3d47 s ARG 378 Cb 0.00 0.32 0.06 0.00 0.52 0.00 0.00 34.95 35.85 3d47 s ARG 378 CO 0.00 -0.24 0.01 0.42 0.02 0.00 0.00 175.30 175.51 3d47 s ILE 379 N -3.79 0.77 0.53 1.52 1.01 -0.79 0.33 121.20 120.77 3d47 s ILE 379 Ca 0.05 -0.67 -0.20 0.00 0.00 0.00 0.00 60.65 59.83 3d47 s ILE 379 Cb 0.05 -1.19 -0.06 0.00 0.01 0.00 0.00 42.46 41.27 3d47 s ILE 379 CO -0.10 -0.14 1.12 -2.28 0.00 0.00 0.00 174.94 173.54 3d47 s HIS 380 N 1.75 2.73 0.47 3.97 5.65 -1.26 -1.30 115.29 127.30 3d47 s HIS 380 Ca -0.02 1.55 0.15 0.00 0.25 0.00 0.00 55.06 56.99 3d47 s HIS 380 Cb -0.17 -3.27 1.14 0.00 -1.18 0.00 0.00 32.58 29.10 3d47 s HIS 380 CO -0.07 -1.47 2.05 1.57 -0.65 0.00 0.00 174.74 176.17 3d47 h LYS 381 N 1.32 0.23 -0.04 2.88 2.10 -0.62 -0.89 116.57 121.55 3d47 h LYS 381 Ca -0.50 -0.01 0.01 0.00 -2.00 0.00 0.00 60.65 58.15 3d47 h LYS 381 Cb 1.26 -0.05 -0.00 0.00 -0.90 0.00 0.00 32.23 32.53 3d47 h LYS 381 CO 0.57 0.15 0.06 0.66 -2.00 0.00 0.00 179.45 178.89 3d47 h SER 382 N 0.24 0.00 0.94 7.07 4.64 -1.92 0.12 113.55 124.64 3d47 h SER 382 Ca 0.16 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.47 3d47 h SER 382 Cb 0.32 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 3d47 h SER 382 CO -0.03 0.00 -0.04 0.58 -0.87 0.00 0.00 176.83 176.47 3d47 h VAL 383 N 0.00 0.10 -0.26 0.95 2.07 -1.52 -2.65 116.25 114.94 3d47 h VAL 383 Ca 0.02 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.96 3d47 h VAL 383 Cb 0.13 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 3d47 h VAL 383 CO -0.00 0.04 0.00 0.18 0.02 0.00 0.00 177.57 177.81 3d47 n LEU 384 N -3.15 3.12 -3.31 2.57 4.77 0.40 -4.73 117.00 116.66 3d47 n LEU 384 Ca 0.00 -1.25 -0.32 0.00 -0.03 0.00 0.00 56.01 54.41 3d47 n LEU 384 Cb 0.31 -0.16 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 3d47 n LEU 384 CO 0.28 0.63 2.74 0.47 -1.33 0.00 0.00 177.39 180.17 3d47 n ASP 385 N 1.31 5.98 -4.08 -1.43 8.00 -1.00 -4.76 116.55 120.57 3d47 n ASP 385 Ca 0.18 -2.49 -0.10 0.00 0.71 0.00 0.00 54.79 53.09 3d47 n ASP 385 Cb 0.57 -1.31 -0.10 0.00 -0.02 0.00 0.00 41.12 40.26 3d47 n ASP 385 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3d47 s LYS 386 N 3.11 0.58 0.25 -1.24 1.02 -1.26 -4.99 119.74 117.20 3d47 s LYS 386 Ca 0.53 -1.02 -0.31 0.00 0.02 0.00 0.00 55.97 55.19 3d47 s LYS 386 Cb 0.14 -0.01 -0.13 0.00 -0.52 0.00 0.00 37.83 37.30 3d47 s LYS 386 CO -0.03 -0.04 1.46 -2.30 -0.92 0.00 0.00 175.35 173.51 3d47 n PRO 387 N 0.67 2.20 0.00 -1.68 -0.02 -1.26 -3.44 135.00 131.47 3d47 n PRO 387 Ca -0.18 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 3d47 n PRO 387 Cb 0.58 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 3d47 n PRO 387 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d47 n GLY 388 N 2.21 3.14 0.88 -1.23 0.00 0.15 -1.10 105.19 109.24 3d47 n GLY 388 Ca 0.11 -0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.04 3d47 n GLY 388 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3d47 n PHE 389 N 13.58 0.61 -1.00 1.61 3.72 -1.26 -1.16 117.46 133.57 3d47 n PHE 389 Ca 0.00 -0.31 0.00 0.00 -0.05 0.00 0.00 57.45 57.09 3d47 n PHE 389 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 3d47 n PHE 389 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d47 n GLY 390 N 1.27 0.18 3.50 1.37 0.00 -0.26 -4.92 105.19 106.33 3d47 n GLY 390 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 3d47 n GLY 390 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d47 s VAL 391 N -1.37 1.57 0.22 1.61 -7.23 -1.26 -4.93 120.40 109.01 3d47 s VAL 391 Ca 0.00 -2.04 0.10 0.00 -1.81 0.00 0.00 61.98 58.23 3d47 s VAL 391 Cb 0.00 -2.77 -0.05 0.00 0.56 0.00 0.00 36.38 34.12 3d47 s VAL 391 CO 0.00 -0.07 -0.18 -1.61 -0.31 0.00 0.00 175.10 172.92 3d47 s GLU 392 N -3.79 1.46 -0.07 4.82 2.02 -1.19 -4.97 118.70 116.98 3d47 s GLU 392 Ca 0.34 -1.61 -0.28 0.00 0.02 0.00 0.00 54.97 53.45 3d47 s GLU 392 Cb 0.08 -1.47 -0.02 0.00 0.10 0.00 0.00 34.13 32.82 3d47 s GLU 392 CO 0.16 0.28 0.92 -1.17 0.02 0.00 0.00 175.26 175.46 3d47 s LEU 393 N -3.17 4.30 -1.00 1.80 2.96 -1.26 -0.40 118.68 121.91 3d47 s LEU 393 Ca 0.23 1.48 -0.23 0.00 -0.22 0.00 0.00 54.13 55.39 3d47 s LEU 393 Cb -0.04 -3.44 0.05 0.00 0.50 0.00 0.00 46.19 43.25 3d47 s LEU 393 CO 0.10 -0.31 1.46 0.21 -1.32 0.00 0.00 176.35 176.48 3d47 s ASN 394 N 1.02 6.43 0.00 3.68 3.84 -0.41 -4.81 114.94 124.68 3d47 s ASN 394 Ca 0.47 -1.35 0.12 0.00 0.21 0.00 0.00 52.86 52.30 3d47 s ASN 394 Cb -0.19 -2.57 0.56 0.00 -0.55 0.00 0.00 41.25 38.50 3d47 s ASN 394 CO 0.21 -1.58 1.31 0.54 -2.79 0.00 0.00 177.10 174.80 3d47 n ARG 395 N 8.92 0.11 0.22 0.43 5.12 -1.26 -2.20 116.66 128.00 3d47 n ARG 395 Ca 0.31 0.22 0.15 0.00 -1.93 0.00 0.00 57.85 56.61 3d47 n ARG 395 Cb 0.51 -1.50 0.56 0.00 -1.16 0.00 0.00 32.46 30.87 3d47 n ARG 395 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 3d47 h ASP 396 N 0.00 0.00 -4.09 0.55 3.32 -1.97 -3.43 116.42 110.80 3d47 h ASP 396 Ca 0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 3d47 h ASP 396 Cb 0.14 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.73 3d47 h ASP 396 CO 0.00 0.00 0.39 0.00 -1.72 0.00 0.00 179.24 177.91 3d47 n HIS 398 N -1.13 3.75 -1.90 0.00 8.25 -1.26 -4.97 115.22 117.95 3d47 n HIS 398 Ca 0.09 -2.94 -0.40 0.00 -0.26 0.00 0.00 57.72 54.21 3d47 n HIS 398 Cb 0.52 -2.38 -0.00 0.00 1.12 0.00 0.00 29.99 29.25 3d47 n HIS 398 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3d47 s LEU 399 N 1.93 4.26 0.02 2.41 1.02 -1.26 -4.81 118.68 122.25 3d47 s LEU 399 Ca 0.46 2.88 0.06 0.00 0.02 0.00 0.00 54.13 57.55 3d47 s LEU 399 Cb 0.09 -3.78 -0.03 0.00 0.02 0.00 0.00 46.19 42.49 3d47 s LEU 399 CO -0.02 -0.89 -0.17 -0.54 0.02 0.00 0.00 176.35 174.75 3d47 s LYS 400 N -2.16 2.18 -0.66 1.70 1.02 -0.25 -4.91 119.74 116.66 3d47 s LYS 400 Ca 0.55 -0.91 0.03 0.00 0.02 0.00 0.00 55.97 55.66 3d47 s LYS 400 Cb -0.43 -2.24 0.16 0.00 -0.52 0.00 0.00 37.83 34.80 3d47 s LYS 400 CO 0.57 0.56 0.45 0.50 -0.92 0.00 0.00 175.35 176.50 3d47 s ARG 401 N -1.29 2.42 0.41 1.68 6.06 -1.26 -1.48 118.95 125.49 3d47 s ARG 401 Ca 0.14 -3.01 0.19 0.00 -2.50 0.00 0.00 55.73 50.55 3d47 s ARG 401 Cb -0.11 -3.49 0.91 0.00 0.06 0.00 0.00 34.95 32.32 3d47 s ARG 401 CO 0.04 -1.21 1.86 -1.00 -2.50 0.00 0.00 175.30 172.50 3d47 h PRO 402 N 6.02 0.00 -4.86 5.12 0.13 -1.95 -3.45 132.00 133.00 3d47 h PRO 402 Ca 0.05 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.89 3d47 h PRO 402 Cb 0.83 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 31.79 3d47 h PRO 402 CO 0.73 0.30 -0.72 0.71 -0.23 0.00 0.00 178.00 178.79 3d47 s TYR 403 N -4.00 1.01 0.25 1.56 2.02 -1.26 -5.09 117.35 111.83 3d47 s TYR 403 Ca -0.02 -0.73 -0.09 0.00 -0.37 0.00 0.00 57.07 55.87 3d47 s TYR 403 Cb 0.13 -0.56 -0.01 0.00 -0.40 0.00 0.00 41.96 41.12 3d47 s TYR 403 CO 0.67 -0.04 0.39 -1.54 -1.57 0.00 0.00 175.55 173.47 3d47 s SER 404 N -2.64 0.09 0.00 2.29 1.04 -1.26 -4.85 113.70 108.37 3d47 s SER 404 Ca 0.07 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.39 3d47 s SER 404 Cb -0.00 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.66 3d47 s SER 404 CO -0.01 -1.08 0.00 0.00 0.98 0.00 0.00 173.24 173.13