#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d46 s GLU 2 N 0.00 2.87 0.38 0.03 0.41 -1.26 -4.98 118.70 116.16 3d46 s GLU 2 Ca 0.00 1.46 -0.26 0.00 -0.41 0.00 0.00 54.97 55.76 3d46 s GLU 2 Cb 0.00 -1.95 -0.09 0.00 -1.78 0.00 0.00 34.13 30.31 3d46 s GLU 2 CO 0.00 -1.21 1.22 -0.80 -0.49 0.00 0.00 175.26 173.98 3d46 s ASN 3 N -2.39 6.56 0.79 -0.19 0.01 -1.26 -4.98 114.94 113.49 3d46 s ASN 3 Ca 0.69 2.47 -0.11 0.00 -0.71 0.00 0.00 52.86 55.20 3d46 s ASN 3 Cb -0.22 -2.63 0.07 0.00 0.41 0.00 0.00 41.25 38.89 3d46 s ASN 3 CO 0.39 -0.66 1.11 0.27 -1.51 0.00 0.00 177.10 176.70 3d46 s ILE 4 N -1.31 3.00 0.32 0.60 -4.36 -1.26 -4.94 121.20 113.25 3d46 s ILE 4 Ca 0.55 0.34 -0.29 0.00 -0.26 0.00 0.00 60.65 60.99 3d46 s ILE 4 Cb -0.34 -2.73 -0.12 0.00 1.25 0.00 0.00 42.46 40.52 3d46 s ILE 4 CO 0.44 -0.41 1.46 0.80 0.24 0.00 0.00 174.94 177.47 3d46 n MET 5 N -3.55 2.45 -2.92 0.37 0.00 -1.26 -4.95 117.12 107.26 3d46 n MET 5 Ca 0.10 0.86 -0.40 0.00 -0.00 0.00 0.00 57.70 58.27 3d46 n MET 5 Cb 0.53 -2.56 -0.06 0.00 0.00 0.00 0.00 33.22 31.12 3d46 n MET 5 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 3d46 s THR 6 N -0.59 4.30 -0.04 1.12 -4.23 -1.26 -5.06 115.64 109.88 3d46 s THR 6 Ca 0.59 1.81 0.07 0.00 -1.18 0.00 0.00 61.69 62.99 3d46 s THR 6 Cb -0.53 -4.19 -0.01 0.00 1.34 0.00 0.00 72.50 69.10 3d46 s THR 6 CO 0.56 0.51 -0.25 -0.76 -0.54 0.00 0.00 174.62 174.14 3d46 s LEU 7 N -1.11 2.05 0.69 4.79 1.43 -1.26 -5.08 118.68 120.20 3d46 s LEU 7 Ca 0.37 -0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 52.88 3d46 s LEU 7 Cb -0.24 -1.33 0.01 0.00 0.03 0.00 0.00 46.19 44.66 3d46 s LEU 7 CO 0.28 0.28 1.08 -2.16 0.23 0.00 0.00 176.35 176.05 3d46 s PRO 8 N -0.37 2.96 0.46 1.29 0.04 -1.26 -4.91 135.00 133.21 3d46 s PRO 8 Ca 0.03 0.48 -0.01 0.00 0.04 0.00 0.00 61.00 61.55 3d46 s PRO 8 Cb -0.12 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 3d46 s PRO 8 CO 0.01 -0.96 0.69 0.15 0.04 0.00 0.00 177.00 176.93 3d46 s LYS 9 N -5.32 3.13 -0.03 4.56 -0.14 -1.26 -2.60 119.74 118.08 3d46 s LYS 9 Ca 0.58 -0.36 -0.27 0.00 -1.36 0.00 0.00 55.97 54.55 3d46 s LYS 9 Cb -0.11 -2.52 -0.03 0.00 -1.68 0.00 0.00 37.83 33.48 3d46 s LYS 9 CO 0.52 -0.27 0.88 0.42 -0.76 0.00 0.00 175.35 176.14 3d46 s ILE 10 N -2.59 4.93 -0.24 2.17 1.01 0.21 -0.56 121.20 126.14 3d46 s ILE 10 Ca 0.48 1.83 -0.16 0.00 0.00 0.00 0.00 60.65 62.79 3d46 s ILE 10 Cb -0.10 -4.21 -0.13 0.00 0.01 0.00 0.00 42.46 38.03 3d46 s ILE 10 CO 0.39 0.19 -0.18 1.17 0.00 0.00 0.00 174.94 176.51 3d46 n LYS 11 N 3.91 0.57 -4.12 2.79 4.81 0.71 -0.74 118.16 126.09 3d46 n LYS 11 Ca 0.03 0.37 -0.11 0.00 -0.87 0.00 0.00 58.31 57.73 3d46 n LYS 11 Cb 0.51 -1.57 -0.11 0.00 0.02 0.00 0.00 35.03 33.88 3d46 n LYS 11 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 3d46 s HIS 12 N -2.50 0.76 -0.05 5.64 3.76 -0.76 -4.68 115.29 117.45 3d46 s HIS 12 Ca -0.33 -0.75 0.02 0.00 -0.15 0.00 0.00 55.06 53.84 3d46 s HIS 12 Cb 0.10 -0.45 0.02 0.00 1.11 0.00 0.00 32.58 33.36 3d46 s HIS 12 CO 0.49 -0.14 -0.08 0.54 -0.85 0.00 0.00 174.74 174.70 3d46 s VAL 13 N -2.69 0.82 0.08 -0.90 0.11 -1.26 -0.44 120.40 116.12 3d46 s VAL 13 Ca 0.02 -0.29 0.06 0.00 -2.93 0.00 0.00 61.98 58.84 3d46 s VAL 13 Cb -0.01 -0.79 -0.03 0.00 -1.53 0.00 0.00 36.38 34.02 3d46 s VAL 13 CO -0.03 0.29 -0.16 -0.13 -3.33 0.00 0.00 175.10 171.74 3d46 s ARG 14 N 0.79 0.89 -0.03 1.54 1.81 0.23 -4.94 118.95 119.24 3d46 s ARG 14 Ca -0.13 -1.00 0.02 0.00 -1.72 0.00 0.00 55.73 52.90 3d46 s ARG 14 Cb -0.15 -0.96 0.00 0.00 -0.45 0.00 0.00 34.95 33.39 3d46 s ARG 14 CO 0.02 0.22 -0.09 0.00 -0.68 0.00 0.00 175.30 174.76 3d46 s ALA 15 N -1.25 0.88 0.31 2.13 0.00 -1.26 -0.84 121.76 121.72 3d46 s ALA 15 Ca -0.00 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.65 3d46 s ALA 15 Cb -0.10 -0.33 -0.05 0.00 0.00 0.00 0.00 23.12 22.64 3d46 s ALA 15 CO 0.03 0.14 0.09 -1.58 0.00 0.00 0.00 175.76 174.43 3d46 s TRP 16 N 0.20 1.77 0.07 0.00 0.51 0.09 -4.62 118.94 116.97 3d46 s TRP 16 Ca -0.03 -1.10 -0.12 0.00 -2.12 0.00 0.00 56.10 52.73 3d46 s TRP 16 Cb -0.09 -1.10 0.01 0.00 -0.81 0.00 0.00 33.47 31.48 3d46 s TRP 16 CO 0.01 -0.18 0.27 -0.59 -0.51 0.00 0.00 176.95 175.94 3d46 s PHE 17 N -3.48 -0.01 0.04 -1.98 -0.12 -0.51 -0.42 117.98 111.50 3d46 s PHE 17 Ca 0.36 -0.28 -0.01 0.00 -0.05 0.00 0.00 56.93 56.94 3d46 s PHE 17 Cb 0.08 0.05 -0.03 0.00 -0.63 0.00 0.00 43.02 42.49 3d46 s PHE 17 CO 0.15 -0.55 -0.01 0.96 -0.05 0.00 0.00 175.22 175.73 3d46 s ILE 18 N -3.27 0.16 0.00 -4.49 -4.36 -1.00 -1.34 121.20 106.90 3d46 s ILE 18 Ca 0.00 -1.35 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 3d46 s ILE 18 Cb 0.02 -0.95 0.00 0.00 1.25 0.00 0.00 42.46 42.78 3d46 s ILE 18 CO -0.08 -0.74 0.00 0.61 0.24 0.00 0.00 174.94 174.97 3d46 n GLY 19 N 0.77 -1.07 0.00 6.27 0.00 -1.25 -0.87 105.19 109.04 3d46 n GLY 19 Ca -0.19 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3d46 n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d46 n GLY 20 N 0.00 -1.27 0.32 -0.02 0.00 -1.26 -3.66 105.19 99.30 3d46 n GLY 20 Ca 0.00 -1.60 0.21 0.00 0.00 0.00 0.00 46.02 44.63 3d46 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d46 h ALA 21 N 0.00 1.09 -0.44 4.61 0.00 -1.05 -2.43 119.26 121.03 3d46 h ALA 21 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3d46 h ALA 21 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3d46 h ALA 21 CO 0.00 0.01 0.00 0.25 0.00 0.00 0.00 179.25 179.51 3d46 n THR 22 N -3.22 1.66 -2.04 0.00 -2.24 -1.26 -4.98 114.28 102.20 3d46 n THR 22 Ca -0.02 -1.31 0.00 0.00 -2.27 0.00 0.00 64.05 60.44 3d46 n THR 22 Cb 0.11 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 3d46 n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d46 n ALA 23 N 0.49 0.00 -2.59 6.98 0.00 -0.92 -5.03 120.51 119.44 3d46 n ALA 23 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.22 3d46 n ALA 23 Cb 0.73 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.13 3d46 n ALA 23 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3d46 s GLU 24 N 1.94 3.78 0.36 0.00 2.12 -1.26 -4.75 118.70 120.90 3d46 s GLU 24 Ca 0.00 0.39 -0.28 0.00 0.36 0.00 0.00 54.97 55.43 3d46 s GLU 24 Cb 0.00 -3.80 -0.11 0.00 0.26 0.00 0.00 34.13 30.48 3d46 s GLU 24 CO 0.00 -0.87 1.49 0.15 -0.54 0.00 0.00 175.26 175.50 3d46 s LYS 25 N 3.18 4.12 0.00 4.30 -0.14 -1.26 -2.85 119.74 127.09 3d46 s LYS 25 Ca 0.33 2.56 0.00 0.00 -1.36 0.00 0.00 55.97 57.50 3d46 s LYS 25 Cb -0.13 -2.98 0.00 0.00 -1.68 0.00 0.00 37.83 33.04 3d46 s LYS 25 CO 0.17 -0.53 0.00 0.41 -0.76 0.00 0.00 175.35 174.64 3d46 n GLY 26 N 0.69 0.58 0.16 -3.33 0.00 -1.25 -4.91 105.19 97.14 3d46 n GLY 26 Ca 0.02 -0.58 0.13 0.00 0.00 0.00 0.00 46.02 45.59 3d46 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d46 h ALA 27 N 0.00 1.00 -0.71 4.61 0.00 -1.47 -3.42 119.26 119.28 3d46 h ALA 27 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d46 h ALA 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3d46 h ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3d46 n GLY 28 N -0.33 2.87 7.00 0.00 0.00 0.24 -4.49 105.19 110.48 3d46 n GLY 28 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3d46 n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d46 n GLY 29 N 0.00 2.55 0.25 -0.02 0.00 0.17 -3.18 105.19 104.96 3d46 n GLY 29 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 46.02 45.69 3d46 n GLY 29 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3d46 h GLY 30 N 0.00 0.51 -7.29 -0.02 0.00 -1.80 -3.40 103.07 91.07 3d46 h GLY 30 Ca 0.00 -0.38 -0.61 0.00 0.00 0.00 0.00 47.33 46.34 3d46 h GLY 30 CO 0.00 0.35 0.85 -0.35 0.00 0.00 0.00 176.54 177.39 3d46 s ASP 31 N -6.80 6.27 0.46 0.19 -1.08 -1.19 -4.44 116.67 110.09 3d46 s ASP 31 Ca -0.07 -1.03 0.26 0.00 -0.52 0.00 0.00 52.55 51.19 3d46 s ASP 31 Cb 0.14 -2.48 1.30 0.00 -1.46 0.00 0.00 42.92 40.43 3d46 s ASP 31 CO 0.78 -1.52 1.79 1.88 0.52 0.00 0.00 175.17 178.63 3d46 h TYR 32 N 9.63 0.36 -0.08 -5.34 0.05 -1.84 -0.87 116.97 118.88 3d46 h TYR 32 Ca -0.17 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.63 3d46 h TYR 32 Cb 1.05 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 38.69 3d46 h TYR 32 CO 1.08 0.03 0.00 0.72 -1.05 0.00 0.00 178.16 178.94 3d46 n HIS 33 N -4.44 0.09 -2.27 4.88 8.25 -1.26 -4.56 115.22 115.91 3d46 n HIS 33 Ca 0.25 -0.04 -0.42 0.00 -0.26 0.00 0.00 57.72 57.24 3d46 n HIS 33 Cb 1.02 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.13 3d46 n HIS 33 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3d46 n ASP 34 N 0.44 4.93 -4.86 0.41 2.03 -0.33 -4.60 116.55 114.55 3d46 n ASP 34 Ca 0.18 -3.07 -0.26 0.00 0.52 0.00 0.00 54.79 52.15 3d46 n ASP 34 Cb 0.39 -1.51 -0.03 0.00 -0.72 0.00 0.00 41.12 39.26 3d46 n ASP 34 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3d46 s GLN 35 N 0.80 2.27 0.00 -0.67 -1.52 -1.26 -0.59 119.66 118.69 3d46 s GLN 35 Ca 0.41 -1.99 0.00 0.00 -1.95 0.00 0.00 55.36 51.83 3d46 s GLN 35 Cb 0.10 -2.05 0.00 0.00 -0.22 0.00 0.00 33.01 30.84 3d46 s GLN 35 CO -0.01 -0.48 0.00 0.41 -0.25 0.00 0.00 175.29 174.96 3d46 n GLY 36 N -1.62 0.89 3.94 3.09 0.00 -1.26 -4.02 105.19 106.22 3d46 n GLY 36 Ca -0.03 -1.75 -0.25 0.00 0.00 0.00 0.00 46.02 43.99 3d46 n GLY 36 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d46 s GLY 37 N -0.53 1.73 -1.39 -0.02 0.00 -1.26 -4.33 107.32 101.52 3d46 s GLY 37 Ca 0.00 -1.12 -0.03 0.00 0.00 0.00 0.00 44.72 43.56 3d46 s GLY 37 CO 0.00 -0.68 0.28 0.70 0.00 0.00 0.00 173.10 173.41 3d46 n ASN 38 N -2.90 -4.87 -4.79 1.64 3.02 -1.26 -4.97 115.26 101.13 3d46 n ASN 38 Ca 0.10 -0.12 -0.36 0.00 -0.03 0.00 0.00 54.58 54.17 3d46 n ASN 38 Cb 0.60 -4.03 -0.07 0.00 -0.61 0.00 0.00 39.78 35.67 3d46 n ASN 38 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 3d46 s HIS 39 N -2.93 3.48 0.44 3.10 2.46 -1.26 -4.70 115.29 115.89 3d46 s HIS 39 Ca 0.18 0.41 0.14 0.00 0.47 0.00 0.00 55.06 56.26 3d46 s HIS 39 Cb -0.09 -2.05 1.05 0.00 -0.13 0.00 0.00 32.58 31.37 3d46 s HIS 39 CO 0.22 0.49 1.98 0.11 -2.47 0.00 0.00 174.74 175.07 3d46 h TRP 40 N 5.88 0.41 0.00 3.88 5.08 -1.49 -1.07 115.95 128.64 3d46 h TRP 40 Ca -0.47 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.51 3d46 h TRP 40 Cb 1.19 -0.13 0.00 0.00 -3.00 0.00 0.00 29.16 27.21 3d46 h TRP 40 CO 0.66 0.19 0.00 1.51 -1.28 0.00 0.00 178.44 179.52 3d46 n ILE 41 N -4.47 0.69 -0.69 0.12 3.06 -1.26 -1.75 119.36 115.06 3d46 n ILE 41 Ca 0.10 0.17 0.02 0.00 -2.50 0.00 0.00 62.75 60.54 3d46 n ILE 41 Cb 0.39 -0.99 0.03 0.00 0.54 0.00 0.00 39.64 39.61 3d46 n ILE 41 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 3d46 n ASP 42 N -1.27 1.31 -4.45 9.51 2.03 -0.42 -4.89 116.55 118.36 3d46 n ASP 42 Ca 0.05 -1.94 -0.44 0.00 0.52 0.00 0.00 54.79 52.99 3d46 n ASP 42 Cb 0.09 -0.10 -0.02 0.00 -0.72 0.00 0.00 41.12 40.36 3d46 n ASP 42 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3d46 s ASP 43 N -1.08 6.71 -1.37 1.67 2.15 -0.72 -4.37 116.67 119.65 3d46 s ASP 43 Ca 0.06 -2.21 -0.03 0.00 0.43 0.00 0.00 52.55 50.79 3d46 s ASP 43 Cb 0.05 -2.40 0.00 0.00 -0.30 0.00 0.00 42.92 40.27 3d46 s ASP 43 CO 0.01 -1.01 0.46 1.57 -0.17 0.00 0.00 175.17 176.03 3d46 n HIS 44 N 6.37 -1.66 -2.93 -5.34 -0.00 0.09 -4.93 115.22 106.83 3d46 n HIS 44 Ca 0.26 0.69 -0.40 0.00 -0.00 0.00 0.00 57.72 58.27 3d46 n HIS 44 Cb 0.48 -3.67 -0.04 0.00 -0.00 0.00 0.00 29.99 26.76 3d46 n HIS 44 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 3d46 s ILE 45 N -3.90 4.84 0.25 3.57 -1.09 -1.26 -4.35 121.20 119.26 3d46 s ILE 45 Ca 0.07 1.69 -0.30 0.00 -2.23 0.00 0.00 60.65 59.88 3d46 s ILE 45 Cb -0.03 -4.15 -0.10 0.00 -1.58 0.00 0.00 42.46 36.60 3d46 s ILE 45 CO 0.89 0.28 1.41 0.00 -1.23 0.00 0.00 174.94 176.29 3d46 s ALA 46 N 0.44 3.60 0.32 9.38 0.00 -0.52 -4.84 121.76 130.13 3d46 s ALA 46 Ca 0.42 1.29 -0.07 0.00 0.00 0.00 0.00 51.96 53.59 3d46 s ALA 46 Cb -0.20 -3.54 0.01 0.00 0.00 0.00 0.00 23.12 19.39 3d46 s ALA 46 CO 0.23 -0.70 0.52 0.95 0.00 0.00 0.00 175.76 176.76 3d46 s THR 47 N -0.10 0.00 -0.35 0.00 -4.23 -1.26 -4.57 115.64 105.13 3d46 s THR 47 Ca 0.58 -1.46 0.22 0.00 -1.18 0.00 0.00 61.69 59.85 3d46 s THR 47 Cb -0.41 -2.55 0.22 0.00 1.34 0.00 0.00 72.50 71.11 3d46 s THR 47 CO 0.43 0.00 1.67 -2.65 -0.54 0.00 0.00 174.62 173.53 3d46 n PRO 48 N -0.50 0.16 -0.00 3.99 -0.02 -1.26 -2.32 135.00 135.05 3d46 n PRO 48 Ca -0.01 0.53 0.08 0.00 -2.02 0.00 0.00 63.50 62.09 3d46 n PRO 48 Cb 0.61 -1.90 -0.11 0.00 -0.02 0.00 0.00 33.50 32.08 3d46 n PRO 48 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3d46 n MET 49 N -2.22 1.03 0.00 -0.52 2.81 -1.26 -4.52 117.12 112.43 3d46 n MET 49 Ca 0.00 -0.05 0.04 0.00 -1.81 0.00 0.00 57.70 55.88 3d46 n MET 49 Cb 0.12 -1.35 0.20 0.00 -0.71 0.00 0.00 33.22 31.48 3d46 n MET 49 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3d46 n SER 50 N -1.63 0.00 0.11 7.83 3.41 -0.98 -1.17 113.62 121.19 3d46 n SER 50 Ca 0.01 0.27 0.12 0.00 -0.26 0.00 0.00 58.87 59.01 3d46 n SER 50 Cb 0.33 -0.35 0.45 0.00 -0.26 0.00 0.00 64.21 64.38 3d46 n SER 50 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3d46 n LYS 51 N -1.35 0.22 -3.41 4.33 2.85 -1.26 -4.37 118.16 115.17 3d46 n LYS 51 Ca 0.03 0.31 -0.38 0.00 -1.05 0.00 0.00 58.31 57.22 3d46 n LYS 51 Cb 0.08 -1.83 -0.08 0.00 -0.65 0.00 0.00 35.03 32.55 3d46 n LYS 51 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3d46 s TYR 52 N -3.20 3.36 0.25 5.58 2.02 -0.32 -4.99 117.35 120.06 3d46 s TYR 52 Ca 0.08 0.57 -0.04 0.00 -0.37 0.00 0.00 57.07 57.30 3d46 s TYR 52 Cb 0.11 -2.51 0.49 0.00 -0.40 0.00 0.00 41.96 39.66 3d46 s TYR 52 CO 0.50 -0.02 1.68 -0.09 -1.57 0.00 0.00 175.55 176.04 3d46 h ARG 53 N 7.44 0.24 0.00 -0.62 2.43 -1.86 0.19 114.38 122.20 3d46 h ARG 53 Ca -0.36 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 3d46 h ARG 53 Cb 1.16 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 3d46 h ARG 53 CO 0.71 0.16 0.00 -0.25 -1.51 0.00 0.00 179.97 179.08 3d46 n ASP 54 N -5.18 0.50 -0.11 -3.80 8.00 -1.26 -3.10 116.55 111.59 3d46 n ASP 54 Ca 0.15 0.62 0.07 0.00 0.71 0.00 0.00 54.79 56.34 3d46 n ASP 54 Cb 0.49 -0.73 0.09 0.00 -0.02 0.00 0.00 41.12 40.96 3d46 n ASP 54 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3d46 n TYR 55 N -2.05 0.00 0.06 1.24 4.01 -0.04 -4.79 117.16 115.60 3d46 n TYR 55 Ca 0.03 -0.74 -0.20 0.00 -0.16 0.00 0.00 57.90 56.82 3d46 n TYR 55 Cb 0.22 -0.11 -0.15 0.00 -0.31 0.00 0.00 39.34 38.99 3d46 n TYR 55 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 3d46 h GLU 56 N 0.00 0.33 -0.12 -0.72 4.81 -1.24 -3.36 114.58 114.28 3d46 h GLU 56 Ca 0.00 -0.55 -0.20 0.00 -0.13 0.00 0.00 59.36 58.48 3d46 h GLU 56 Cb 0.96 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.55 3d46 h GLU 56 CO 0.00 1.26 -0.74 0.37 -0.73 0.00 0.00 179.01 179.17 3d46 h GLN 57 N -0.31 0.59 -4.40 1.92 5.75 -1.87 -3.40 115.11 113.39 3d46 h GLN 57 Ca -0.15 -0.48 -0.50 0.00 -0.15 0.00 0.00 58.65 57.38 3d46 h GLN 57 Cb 1.69 0.10 -0.34 0.00 1.07 0.00 0.00 27.48 29.99 3d46 h GLN 57 CO 0.16 1.10 -0.80 0.45 -2.65 0.00 0.00 178.83 177.09 3d46 s SER 58 N -7.03 1.68 0.27 -0.69 0.15 -1.26 -0.73 113.70 106.09 3d46 s SER 58 Ca -0.08 -0.27 0.10 0.00 0.70 0.00 0.00 55.95 56.41 3d46 s SER 58 Cb 0.10 -0.76 0.35 0.00 -1.71 0.00 0.00 66.02 64.00 3d46 s SER 58 CO 0.87 -0.01 1.61 0.03 1.20 0.00 0.00 173.24 176.94 3d46 h ARG 59 N 7.18 0.00 -0.46 5.44 3.08 -1.83 -2.56 114.38 125.23 3d46 h ARG 59 Ca -0.32 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.72 3d46 h ARG 59 Cb 1.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.20 3d46 h ARG 59 CO 0.46 0.62 0.25 1.96 -1.07 0.00 0.00 179.97 182.19 3d46 h GLN 60 N 0.00 0.63 -0.28 0.04 4.20 -1.92 -2.20 115.11 115.57 3d46 h GLN 60 Ca -0.01 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.65 3d46 h GLN 60 Cb 1.10 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.73 3d46 h GLN 60 CO 0.08 0.47 0.19 0.66 -0.67 0.00 0.00 178.83 179.56 3d46 h SER 61 N 0.64 0.31 0.05 1.46 4.64 -1.83 -0.78 113.55 118.04 3d46 h SER 61 Ca 0.16 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3d46 h SER 61 Cb 0.03 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 3d46 h SER 61 CO -0.03 0.22 -0.07 2.22 -0.87 0.00 0.00 176.83 178.30 3d46 n PHE 62 N -4.50 0.00 -0.06 4.77 1.16 -0.86 -4.95 117.46 113.03 3d46 n PHE 62 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.59 3d46 n PHE 62 Cb 0.09 -0.03 0.00 0.00 -1.61 0.00 0.00 39.48 37.93 3d46 n PHE 62 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3d46 n GLY 63 N 1.23 1.84 0.01 4.97 0.00 -0.30 -4.98 105.19 107.96 3d46 n GLY 63 Ca 0.17 -0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.24 3d46 n GLY 63 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3d46 n ILE 64 N -0.96 0.96 -0.39 -0.61 3.06 -1.00 -2.83 119.36 117.60 3d46 n ILE 64 Ca 0.00 0.24 0.06 0.00 -2.50 0.00 0.00 62.75 60.55 3d46 n ILE 64 Cb 0.01 -1.00 0.15 0.00 0.54 0.00 0.00 39.64 39.35 3d46 n ILE 64 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 3d46 n ASN 65 N -1.54 2.96 0.20 9.51 6.94 -1.26 -4.73 115.26 127.33 3d46 n ASN 65 Ca 0.04 -2.30 0.06 0.00 -0.02 0.00 0.00 54.58 52.35 3d46 n ASN 65 Cb 0.18 -0.28 0.39 0.00 -2.36 0.00 0.00 39.78 37.71 3d46 n ASN 65 CO 0.00 0.00 0.00 -0.37 -1.03 0.00 0.00 177.26 175.86 3d46 h VAL 66 N 1.51 0.90 0.04 3.53 -1.51 -1.90 -3.34 116.25 115.49 3d46 h VAL 66 Ca 0.00 -1.37 -0.14 0.00 -1.23 0.00 0.00 66.70 63.96 3d46 h VAL 66 Cb 0.87 1.82 0.01 0.00 -2.13 0.00 0.00 31.29 31.87 3d46 h VAL 66 CO 0.05 0.34 -0.58 -0.07 -1.23 0.00 0.00 177.57 176.08 3d46 h LEU 67 N 0.00 0.43 0.00 4.19 3.38 -1.85 0.59 115.31 122.06 3d46 h LEU 67 Ca -0.00 -0.83 0.00 0.00 0.09 0.00 0.00 57.88 57.13 3d46 h LEU 67 Cb 0.79 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3d46 h LEU 67 CO 0.04 1.22 0.00 0.61 0.09 0.00 0.00 178.44 180.40 3d46 n GLY 68 N 1.27 -1.32 3.77 0.83 0.00 -1.25 -2.95 105.19 105.54 3d46 n GLY 68 Ca -0.11 -1.25 -0.37 0.00 0.00 0.00 0.00 46.02 44.29 3d46 n GLY 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d46 s THR 69 N 0.00 5.29 -0.14 2.61 2.01 -0.05 -2.30 115.64 123.05 3d46 s THR 69 Ca 0.00 0.54 -0.07 0.00 0.31 0.00 0.00 61.69 62.48 3d46 s THR 69 Cb 0.00 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 3d46 s THR 69 CO 0.00 0.46 0.10 -0.22 -0.69 0.00 0.00 174.62 174.27 3d46 s LEU 70 N -0.04 4.08 -0.12 4.42 2.96 0.05 -2.37 118.68 127.66 3d46 s LEU 70 Ca 0.17 0.28 0.02 0.00 -0.22 0.00 0.00 54.13 54.38 3d46 s LEU 70 Cb -0.13 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.56 3d46 s LEU 70 CO 0.05 0.30 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.60 3d46 s ILE 71 N -0.40 1.56 -0.11 6.68 1.09 0.44 -1.38 121.20 129.06 3d46 s ILE 71 Ca 0.10 -0.67 0.03 0.00 -1.10 0.00 0.00 60.65 59.01 3d46 s ILE 71 Cb -0.12 -1.42 -0.00 0.00 -1.06 0.00 0.00 42.46 39.86 3d46 s ILE 71 CO 0.02 0.45 -0.21 -0.69 -0.10 0.00 0.00 174.94 174.41 3d46 s VAL 72 N 1.02 2.27 -0.07 2.92 1.01 -0.67 -0.73 120.40 126.15 3d46 s VAL 72 Ca -0.06 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 61.02 3d46 s VAL 72 Cb -0.15 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.34 3d46 s VAL 72 CO -0.02 0.55 -0.18 -0.70 0.00 0.00 0.00 175.10 174.75 3d46 s GLU 73 N 0.45 2.22 -0.13 2.72 2.12 -0.02 -1.85 118.70 124.20 3d46 s GLU 73 Ca -0.15 -0.63 -0.01 0.00 0.36 0.00 0.00 54.97 54.55 3d46 s GLU 73 Cb -0.17 -1.77 -0.02 0.00 0.26 0.00 0.00 34.13 32.43 3d46 s GLU 73 CO 0.06 0.13 -0.10 0.08 -0.54 0.00 0.00 175.26 174.89 3d46 s VAL 74 N 0.42 3.32 -0.13 3.70 1.01 0.21 -0.60 120.40 128.32 3d46 s VAL 74 Ca -0.14 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.28 3d46 s VAL 74 Cb -0.16 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 3d46 s VAL 74 CO 0.05 0.53 -0.16 -0.70 0.00 0.00 0.00 175.10 174.82 3d46 s GLU 75 N 0.20 3.28 0.65 2.72 2.12 0.42 -1.41 118.70 126.68 3d46 s GLU 75 Ca -0.06 -0.74 -0.07 0.00 0.36 0.00 0.00 54.97 54.46 3d46 s GLU 75 Cb -0.15 -2.57 0.03 0.00 0.26 0.00 0.00 34.13 31.70 3d46 s GLU 75 CO 0.04 0.16 0.97 0.00 -0.54 0.00 0.00 175.26 175.89 3d46 s ALA 76 N 0.47 3.19 0.60 6.30 0.00 0.10 -0.20 121.76 132.21 3d46 s ALA 76 Ca -0.11 -0.72 0.39 0.00 0.00 0.00 0.00 51.96 51.52 3d46 s ALA 76 Cb -0.16 -2.67 2.14 0.00 0.00 0.00 0.00 23.12 22.43 3d46 s ALA 76 CO 0.05 -1.02 2.30 0.93 0.00 0.00 0.00 175.76 178.02 3d46 h GLU 77 N -0.39 0.00 -0.59 0.00 4.39 -1.14 -0.29 114.58 116.56 3d46 h GLU 77 Ca -0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.25 3d46 h GLU 77 Cb 1.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 3d46 h GLU 77 CO 0.61 0.01 0.00 0.27 -1.16 0.00 0.00 179.01 178.74 3d46 n ASN 78 N -3.34 3.30 0.00 1.42 6.94 -1.26 -4.92 115.26 117.40 3d46 n ASN 78 Ca -0.03 -2.26 0.00 0.00 -0.02 0.00 0.00 54.58 52.27 3d46 n ASN 78 Cb 0.10 -0.46 0.00 0.00 -2.36 0.00 0.00 39.78 37.06 3d46 n ASN 78 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3d46 n ARG 79 N 0.74 0.00 -2.37 -3.83 3.00 -0.12 -5.01 116.66 109.07 3d46 n ARG 79 Ca 0.18 0.00 -0.34 0.00 -0.01 0.00 0.00 57.85 57.67 3d46 n ARG 79 Cb 0.62 -2.70 -0.01 0.00 0.00 0.00 0.00 32.46 30.36 3d46 n ARG 79 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 3d46 s GLN 80 N -0.16 3.55 0.19 5.56 -0.21 -1.26 -4.74 119.66 122.58 3d46 s GLN 80 Ca 0.00 1.46 0.05 0.00 0.02 0.00 0.00 55.36 56.89 3d46 s GLN 80 Cb 0.00 -2.05 -0.05 0.00 1.00 0.00 0.00 33.01 31.91 3d46 s GLN 80 CO 0.00 -0.66 -0.09 0.95 -2.12 0.00 0.00 175.29 173.37 3d46 s THR 81 N -1.93 1.33 0.03 -0.19 -4.23 -1.26 -0.72 115.64 108.66 3d46 s THR 81 Ca 0.69 -2.10 -0.03 0.00 -1.18 0.00 0.00 61.69 59.07 3d46 s THR 81 Cb -0.20 -2.06 -0.01 0.00 1.34 0.00 0.00 72.50 71.57 3d46 s THR 81 CO 0.25 -0.58 0.05 -0.83 -0.54 0.00 0.00 174.62 172.97 3d46 s GLY 82 N -3.26 0.20 0.27 3.99 0.00 -0.50 -4.60 107.32 103.42 3d46 s GLY 82 Ca 0.22 -0.55 -0.16 0.00 0.00 0.00 0.00 44.72 44.24 3d46 s GLY 82 CO 0.05 -0.66 0.59 -0.11 0.00 0.00 0.00 173.10 172.98 3d46 s PHE 83 N -2.08 0.17 0.21 1.90 -0.12 -1.25 -0.62 117.98 116.19 3d46 s PHE 83 Ca -0.10 -0.58 -0.22 0.00 -0.05 0.00 0.00 56.93 55.98 3d46 s PHE 83 Cb -0.05 0.42 0.05 0.00 -0.63 0.00 0.00 43.02 42.81 3d46 s PHE 83 CO -0.03 -1.14 0.64 0.00 -0.05 0.00 0.00 175.22 174.65 3d46 s ALA 84 N -3.81 -1.38 0.12 1.99 0.00 -0.77 -4.31 121.76 113.59 3d46 s ALA 84 Ca 0.18 0.09 0.05 0.00 0.00 0.00 0.00 51.96 52.28 3d46 s ALA 84 Cb -0.03 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.92 3d46 s ALA 84 CO 0.09 -0.88 -0.12 0.14 0.00 0.00 0.00 175.76 174.98 3d46 s VAL 85 N -3.83 1.18 0.00 0.00 -7.23 -1.26 -1.66 120.40 107.59 3d46 s VAL 85 Ca 0.06 -1.75 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 3d46 s VAL 85 Cb -0.03 -1.53 0.00 0.00 0.56 0.00 0.00 36.38 35.38 3d46 s VAL 85 CO -0.04 -0.52 0.00 -0.24 -0.31 0.00 0.00 175.10 173.99 3d46 n SER 86 N 0.41 0.00 -4.38 4.85 2.88 -0.48 -4.89 113.62 112.01 3d46 n SER 86 Ca -0.15 -0.79 -0.38 0.00 -1.33 0.00 0.00 58.87 56.22 3d46 n SER 86 Cb 0.58 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.92 3d46 n SER 86 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3d46 s THR 87 N -2.99 4.22 0.00 2.46 2.01 -1.26 -0.77 115.64 119.31 3d46 s THR 87 Ca 0.00 -0.61 0.00 0.00 0.31 0.00 0.00 61.69 61.39 3d46 s THR 87 Cb 0.00 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.33 3d46 s THR 87 CO 0.00 0.05 0.00 0.00 -0.69 0.00 0.00 174.62 173.98 3d46 n ALA 88 N 4.91 0.00 -0.80 7.40 0.00 -0.97 -4.71 120.51 126.34 3d46 n ALA 88 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 3d46 n ALA 88 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 3d46 n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d46 n GLY 89 N -0.16 2.72 0.23 0.00 0.00 -1.15 -3.03 105.19 103.80 3d46 n GLY 89 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 3d46 n GLY 89 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3d46 h GLU 90 N 0.00 0.36 -0.45 1.61 4.81 -1.85 -1.20 114.58 117.86 3d46 h GLU 90 Ca 0.00 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 3d46 h GLU 90 Cb 0.00 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 3d46 h GLU 90 CO 0.00 0.24 0.11 0.52 -0.73 0.00 0.00 179.01 179.15 3d46 h MET 91 N 0.37 0.68 -0.59 1.92 2.86 -1.91 -1.13 114.93 117.13 3d46 h MET 91 Ca 0.31 -0.12 -0.03 0.00 -2.06 0.00 0.00 59.70 57.80 3d46 h MET 91 Cb 0.40 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.92 3d46 h MET 91 CO -0.33 0.61 0.26 0.78 1.06 0.00 0.00 176.91 179.29 3d46 h GLY 92 N 0.87 0.90 1.15 8.32 0.00 -1.16 -1.97 103.07 111.19 3d46 h GLY 92 Ca 0.15 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 46.99 3d46 h GLY 92 CO -0.00 0.42 0.23 0.00 0.00 0.00 0.00 176.54 177.19 3d46 h PHE 94 N 1.04 -0.05 -0.46 0.00 3.57 -0.78 -0.01 116.94 120.25 3d46 h PHE 94 Ca 0.23 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.78 3d46 h PHE 94 Cb 0.27 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.99 3d46 h PHE 94 CO 0.02 -0.03 0.20 0.82 -2.23 0.00 0.00 178.31 177.09 3d46 h ILE 95 N -0.05 0.91 0.05 1.41 1.08 -1.14 0.19 117.51 119.96 3d46 h ILE 95 Ca 0.00 -0.14 -0.00 0.00 -0.39 0.00 0.00 64.86 64.33 3d46 h ILE 95 Cb 0.05 0.48 0.00 0.00 -3.07 0.00 0.00 36.82 34.28 3d46 h ILE 95 CO -0.01 0.07 -0.03 0.58 -0.69 0.00 0.00 178.15 178.08 3d46 h VAL 96 N 0.40 1.20 0.00 1.67 2.07 -1.15 -0.72 116.25 119.72 3d46 h VAL 96 Ca 0.21 -0.87 -0.13 0.00 0.82 0.00 0.00 66.70 66.73 3d46 h VAL 96 Cb 0.16 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 3d46 h VAL 96 CO -0.18 0.22 -0.61 -0.33 0.02 0.00 0.00 177.57 176.69 3d46 h GLU 97 N -0.46 0.00 -0.01 1.57 4.39 -0.92 -1.48 114.58 117.67 3d46 h GLU 97 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3d46 h GLU 97 Cb 0.41 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 3d46 h GLU 97 CO 0.01 0.61 -0.29 1.63 -1.16 0.00 0.00 179.01 179.81 3d46 n LYS 98 N -3.49 1.83 0.04 2.33 4.76 0.66 -4.67 118.16 119.61 3d46 n LYS 98 Ca 0.00 -0.73 0.00 0.00 -2.87 0.00 0.00 58.31 54.71 3d46 n LYS 98 Cb 0.68 -1.20 0.00 0.00 -1.84 0.00 0.00 35.03 32.67 3d46 n LYS 98 CO 0.00 0.00 0.00 1.58 -1.37 0.00 0.00 177.40 177.61 3d46 n HIS 99 N -0.17 -0.67 0.27 2.13 -0.00 -0.77 -4.94 115.22 111.06 3d46 n HIS 99 Ca 0.06 0.12 0.13 0.00 0.46 0.00 0.00 57.72 58.48 3d46 n HIS 99 Cb 0.29 0.44 0.78 0.00 -0.12 0.00 0.00 29.99 31.38 3d46 n HIS 99 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 3d46 h LEU 100 N 0.00 0.00 -1.88 0.27 3.38 -1.21 -2.99 115.31 112.88 3d46 h LEU 100 Ca 0.00 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.15 3d46 h LEU 100 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 3d46 h LEU 100 CO 0.00 0.07 0.48 -0.55 0.09 0.00 0.00 178.44 178.54 3d46 h ASN 101 N 0.00 0.11 0.39 -0.43 -1.07 -1.51 -1.05 115.58 112.02 3d46 h ASN 101 Ca -0.00 0.01 -0.02 0.00 0.07 0.00 0.00 56.30 56.36 3d46 h ASN 101 Cb 0.18 -0.01 -0.00 0.00 -2.07 0.00 0.00 38.32 36.42 3d46 h ASN 101 CO 0.01 0.05 -0.08 0.08 0.07 0.00 0.00 177.43 177.56 3d46 h ARG 102 N 0.11 0.00 0.00 4.14 0.11 -1.83 -2.04 114.38 114.87 3d46 h ARG 102 Ca 0.33 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.41 3d46 h ARG 102 Cb 1.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.23 3d46 h ARG 102 CO -0.04 0.08 -1.39 1.19 0.10 0.00 0.00 179.97 179.92 3d46 n PHE 103 N -3.48 0.38 -0.08 4.08 3.72 -0.41 -4.59 117.46 117.07 3d46 n PHE 103 Ca -0.02 0.11 -0.12 0.00 -0.05 0.00 0.00 57.45 57.37 3d46 n PHE 103 Cb 0.22 -0.61 -0.06 0.00 -0.94 0.00 0.00 39.48 38.08 3d46 n PHE 103 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 3d46 h ILE 104 N 0.00 0.48 -3.33 4.37 2.04 -1.28 -3.45 117.51 116.34 3d46 h ILE 104 Ca 0.00 -1.57 -0.53 0.00 1.00 0.00 0.00 64.86 63.77 3d46 h ILE 104 Cb 0.91 1.11 0.05 0.00 -0.74 0.00 0.00 36.82 38.15 3d46 h ILE 104 CO 0.00 0.16 0.74 -1.61 0.00 0.00 0.00 178.15 177.44 3d46 s GLU 105 N -2.24 4.29 0.00 2.37 2.02 -0.82 -2.73 118.70 121.59 3d46 s GLU 105 Ca -0.20 2.25 0.00 0.00 0.02 0.00 0.00 54.97 57.04 3d46 s GLU 105 Cb 0.03 -3.13 0.00 0.00 0.10 0.00 0.00 34.13 31.13 3d46 s GLU 105 CO 0.38 -0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.68 3d46 n GLY 106 N 2.38 2.29 3.88 -1.39 0.00 0.08 -4.95 105.19 107.47 3d46 n GLY 106 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 3d46 n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d46 s LYS 107 N -0.89 2.54 0.48 1.61 -0.14 -1.11 -4.63 119.74 117.60 3d46 s LYS 107 Ca 0.00 0.39 -0.19 0.00 -1.36 0.00 0.00 55.97 54.82 3d46 s LYS 107 Cb 0.00 -1.99 -0.09 0.00 -1.68 0.00 0.00 37.83 34.07 3d46 s LYS 107 CO 0.00 -1.24 0.98 0.00 -0.76 0.00 0.00 175.35 174.32 3d46 h VAL 109 N 1.38 0.00 -0.01 0.00 -1.51 -1.81 -1.32 116.25 112.98 3d46 h VAL 109 Ca -0.48 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 64.89 3d46 h VAL 109 Cb 1.19 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 31.11 3d46 h VAL 109 CO 0.61 0.00 -0.35 -1.54 -1.23 0.00 0.00 177.57 175.06 3d46 n SER 110 N -2.43 0.86 -1.68 4.19 3.41 -1.26 -4.39 113.62 112.32 3d46 n SER 110 Ca -0.01 -0.69 -0.03 0.00 -0.26 0.00 0.00 58.87 57.89 3d46 n SER 110 Cb 0.11 0.19 -0.04 0.00 -0.26 0.00 0.00 64.21 64.21 3d46 n SER 110 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3d46 n ASP 111 N -0.94 4.91 0.11 4.04 8.00 -0.50 -4.56 116.55 127.61 3d46 n ASP 111 Ca 0.10 -2.33 -0.13 0.00 0.71 0.00 0.00 54.79 53.13 3d46 n ASP 111 Cb 0.34 -1.12 -0.08 0.00 -0.02 0.00 0.00 41.12 40.25 3d46 n ASP 111 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3d46 h ILE 112 N 1.36 0.91 -0.43 0.53 2.04 -1.82 -2.09 117.51 118.01 3d46 h ILE 112 Ca 0.05 -0.41 -0.04 0.00 1.00 0.00 0.00 64.86 65.47 3d46 h ILE 112 Cb 1.06 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 3d46 h ILE 112 CO 0.07 0.09 0.12 0.11 0.00 0.00 0.00 178.15 178.54 3d46 h LYS 113 N -0.44 0.63 0.00 2.37 1.57 -1.98 -0.59 116.57 118.13 3d46 h LYS 113 Ca -0.02 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 3d46 h LYS 113 Cb 0.34 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3d46 h LYS 113 CO 0.04 0.56 -0.00 1.25 -0.57 0.00 0.00 179.45 180.73 3d46 h LEU 114 N 0.61 -0.00 -0.86 2.94 5.85 -1.90 -1.14 115.31 120.82 3d46 h LEU 114 Ca 0.14 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.63 3d46 h LEU 114 Cb 0.21 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 3d46 h LEU 114 CO -0.01 0.25 0.57 0.40 -0.34 0.00 0.00 178.44 179.31 3d46 h ILE 115 N -0.26 1.20 -0.25 4.05 2.04 -1.13 -1.54 117.51 121.61 3d46 h ILE 115 Ca -0.00 -0.39 0.03 0.00 1.00 0.00 0.00 64.86 65.49 3d46 h ILE 115 Cb 0.25 -0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.26 3d46 h ILE 115 CO 0.00 0.21 0.09 -0.74 0.00 0.00 0.00 178.15 177.71 3d46 h HIS 116 N 1.14 0.16 -0.62 1.37 2.76 -0.91 0.27 115.15 119.33 3d46 h HIS 116 Ca 0.33 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.46 3d46 h HIS 116 Cb -0.09 -0.03 -0.03 0.00 1.55 0.00 0.00 27.41 28.81 3d46 h HIS 116 CO -0.01 0.07 0.18 0.22 -1.30 0.00 0.00 177.93 177.09 3d46 h ASP 117 N 0.20 0.88 -0.11 3.26 3.58 -0.80 -1.88 116.42 121.55 3d46 h ASP 117 Ca 0.11 -0.15 -0.13 0.00 0.42 0.00 0.00 57.03 57.27 3d46 h ASP 117 Cb 0.08 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 40.89 3d46 h ASP 117 CO -0.11 0.83 -0.38 1.56 -2.88 0.00 0.00 179.24 178.26 3d46 h GLN 118 N 0.91 0.63 -0.44 0.28 4.20 -0.79 -0.45 115.11 119.45 3d46 h GLN 118 Ca 0.20 -0.31 -0.05 0.00 0.06 0.00 0.00 58.65 58.56 3d46 h GLN 118 Cb 0.28 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 3d46 h GLN 118 CO -0.01 0.90 0.10 0.52 -0.67 0.00 0.00 178.83 179.67 3d46 h MET 119 N 0.52 0.71 -0.24 1.46 2.86 -0.61 -0.52 114.93 119.10 3d46 h MET 119 Ca 0.05 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.49 3d46 h MET 119 Cb 0.89 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 3d46 h MET 119 CO 0.08 0.72 0.07 -0.07 1.06 0.00 0.00 176.91 178.76 3d46 h LEU 120 N 0.57 0.36 -0.75 1.22 3.38 -1.21 -2.36 115.31 116.52 3d46 h LEU 120 Ca 0.14 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 3d46 h LEU 120 Cb 0.34 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3d46 h LEU 120 CO 0.00 0.48 0.04 1.23 0.09 0.00 0.00 178.44 180.29 3d46 h GLY 121 N 0.21 1.07 2.00 0.83 0.00 -1.00 -1.82 103.07 104.36 3d46 h GLY 121 Ca 0.08 -0.73 -0.04 0.00 0.00 0.00 0.00 47.33 46.63 3d46 h GLY 121 CO -0.00 0.68 -0.21 0.00 0.00 0.00 0.00 176.54 177.01 3d46 h ALA 122 N 1.11 0.93 -0.05 3.60 0.00 -1.05 -3.24 119.26 120.56 3d46 h ALA 122 Ca 0.18 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3d46 h ALA 122 Cb 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3d46 h ALA 122 CO 0.02 0.26 0.00 0.25 0.00 0.00 0.00 179.25 179.78 3d46 n THR 123 N -3.24 0.07 -0.26 0.00 -2.24 -0.89 -4.62 114.28 103.09 3d46 n THR 123 Ca 0.02 -0.53 0.19 0.00 -2.27 0.00 0.00 64.05 61.45 3d46 n THR 123 Cb 0.51 1.26 0.50 0.00 -2.10 0.00 0.00 70.33 70.50 3d46 n THR 123 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 3d46 h MET 124 N 3.00 0.41 0.00 -0.78 4.05 -1.36 0.15 114.93 120.41 3d46 h MET 124 Ca 0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 3d46 h MET 124 Cb 0.65 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.36 3d46 h MET 124 CO 0.00 0.27 0.00 2.48 0.23 0.00 0.00 176.91 179.89 3d46 n TYR 125 N -4.53 0.29 -1.05 1.39 0.18 -1.26 -3.78 117.16 108.40 3d46 n TYR 125 Ca 0.20 0.11 0.00 0.00 1.88 0.00 0.00 57.90 60.10 3d46 n TYR 125 Cb 0.72 -0.68 0.00 0.00 -0.38 0.00 0.00 39.34 38.99 3d46 n TYR 125 CO 0.00 0.00 0.00 2.48 -2.08 0.00 0.00 176.86 177.26 3d46 n TYR 126 N -1.76 0.00 0.17 -3.48 0.18 -0.10 -4.88 117.16 107.28 3d46 n TYR 126 Ca 0.03 0.00 0.06 0.00 1.88 0.00 0.00 57.90 59.87 3d46 n TYR 126 Cb 0.19 0.00 0.08 0.00 -0.38 0.00 0.00 39.34 39.24 3d46 n TYR 126 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 3d46 h SER 127 N 0.00 0.00 -0.74 9.48 4.64 -0.88 -3.48 113.55 122.57 3d46 h SER 127 Ca 0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.00 3d46 h SER 127 Cb 0.69 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.65 3d46 h SER 127 CO 0.00 0.31 -0.29 0.61 -0.87 0.00 0.00 176.83 176.59 3d46 n GLY 128 N 1.18 1.54 2.64 -0.77 0.00 -1.26 -2.94 105.19 105.57 3d46 n GLY 128 Ca 0.03 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.80 3d46 n GLY 128 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d46 n SER 129 N -0.92 -5.24 0.00 1.61 3.41 -1.26 -4.85 113.62 106.37 3d46 n SER 129 Ca -0.16 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 3d46 n SER 129 Cb 0.57 -4.07 0.00 0.00 -0.26 0.00 0.00 64.21 60.46 3d46 n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d46 n GLY 130 N 0.10 -0.85 7.00 5.00 0.00 -1.15 -3.20 105.19 112.10 3d46 n GLY 130 Ca -0.12 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.84 3d46 n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d46 n GLY 131 N -0.21 -0.34 0.26 -0.02 0.00 -1.26 -4.16 105.19 99.46 3d46 n GLY 131 Ca 0.00 -1.06 -0.06 0.00 0.00 0.00 0.00 46.02 44.90 3d46 n GLY 131 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3d46 n LEU 132 N 0.00 -0.63 -0.25 0.99 7.94 -1.26 -0.57 117.00 123.22 3d46 n LEU 132 Ca 0.00 1.12 -0.07 0.00 -1.11 0.00 0.00 56.01 55.95 3d46 n LEU 132 Cb 0.00 -0.16 0.05 0.00 0.53 0.00 0.00 43.42 43.83 3d46 n LEU 132 CO 0.00 -0.92 0.98 0.58 -1.11 0.00 0.00 177.39 176.92 3d46 h VAL 133 N 0.00 1.25 -0.14 1.96 2.07 -1.82 -2.10 116.25 117.47 3d46 h VAL 133 Ca 0.12 -0.86 -0.11 0.00 0.82 0.00 0.00 66.70 66.67 3d46 h VAL 133 Cb 0.28 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3d46 h VAL 133 CO -0.60 0.34 -0.40 -0.03 0.02 0.00 0.00 177.57 176.90 3d46 h MET 134 N 1.01 0.32 -0.82 1.57 1.85 -1.16 -1.73 114.93 115.98 3d46 h MET 134 Ca 0.23 -0.15 -0.02 0.00 -0.61 0.00 0.00 59.70 59.14 3d46 h MET 134 Cb 0.28 -0.00 -0.04 0.00 0.43 0.00 0.00 31.60 32.27 3d46 h MET 134 CO -0.01 0.68 0.43 -0.91 -0.40 0.00 0.00 176.91 176.70 3d46 h ASN 135 N 0.27 1.04 -0.27 1.39 2.35 -0.46 0.66 115.58 120.57 3d46 h ASN 135 Ca 0.03 -0.10 -0.06 0.00 -0.55 0.00 0.00 56.30 55.61 3d46 h ASN 135 Cb 0.83 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 3d46 h ASN 135 CO 0.07 0.85 -0.07 0.74 -1.65 0.00 0.00 177.43 177.37 3d46 h THR 136 N 1.16 1.28 -0.59 2.81 2.02 -0.92 -1.26 112.91 117.41 3d46 h THR 136 Ca 0.29 -1.09 -0.00 0.00 0.77 0.00 0.00 66.41 66.37 3d46 h THR 136 Cb 0.06 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 3d46 h THR 136 CO -0.04 0.34 0.35 0.40 0.37 0.00 0.00 175.52 176.94 3d46 h ILE 137 N 0.27 1.18 -0.74 3.11 2.04 -1.04 -2.08 117.51 120.25 3d46 h ILE 137 Ca 0.07 -0.41 0.02 0.00 1.00 0.00 0.00 64.86 65.54 3d46 h ILE 137 Cb 0.54 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 3d46 h ILE 137 CO 0.03 0.19 0.48 0.28 0.00 0.00 0.00 178.15 179.13 3d46 h SER 138 N 0.80 0.82 -0.84 1.72 0.02 -0.73 -1.06 113.55 114.27 3d46 h SER 138 Ca 0.21 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.12 3d46 h SER 138 Cb -0.01 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.30 3d46 h SER 138 CO -0.04 0.58 0.41 0.00 -1.14 0.00 0.00 176.83 176.64 3d46 h VAL 140 N 1.20 1.25 -0.64 0.00 2.07 -0.91 -1.55 116.25 117.67 3d46 h VAL 140 Ca 0.29 -0.83 0.08 0.00 0.82 0.00 0.00 66.70 67.06 3d46 h VAL 140 Cb 0.11 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 3d46 h VAL 140 CO -0.04 0.25 0.31 -0.78 0.02 0.00 0.00 177.57 177.33 3d46 h ASP 141 N 0.12 0.40 -0.46 0.57 3.58 -0.85 -0.26 116.42 119.51 3d46 h ASP 141 Ca 0.06 0.05 -0.10 0.00 0.42 0.00 0.00 57.03 57.46 3d46 h ASP 141 Cb 0.37 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.39 3d46 h ASP 141 CO 0.01 0.25 -0.09 -0.07 -2.88 0.00 0.00 179.24 176.46 3d46 h LEU 142 N 0.55 0.92 -1.04 2.28 3.38 -1.08 -1.55 115.31 118.77 3d46 h LEU 142 Ca 0.31 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3d46 h LEU 142 Cb 0.29 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 3d46 h LEU 142 CO -0.24 1.02 0.18 0.00 0.09 0.00 0.00 178.44 179.49 3d46 h ALA 143 N 1.06 1.23 -0.33 1.53 0.00 -0.41 -0.18 119.26 122.16 3d46 h ALA 143 Ca 0.14 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 3d46 h ALA 143 Cb 0.61 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3d46 h ALA 143 CO 0.04 0.55 -0.10 -0.07 0.00 0.00 0.00 179.25 179.67 3d46 h LEU 144 N 0.85 0.65 -0.94 0.00 3.38 -0.69 -0.75 115.31 117.80 3d46 h LEU 144 Ca 0.19 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 3d46 h LEU 144 Cb 0.25 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3d46 h LEU 144 CO -0.01 0.88 0.09 -0.50 0.09 0.00 0.00 178.44 178.99 3d46 h TRP 145 N 0.42 0.90 -0.20 1.13 4.06 -1.01 -0.66 115.95 120.59 3d46 h TRP 145 Ca 0.08 -0.10 -0.01 0.00 2.06 0.00 0.00 58.89 60.92 3d46 h TRP 145 Cb 0.60 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 28.49 3d46 h TRP 145 CO 0.05 0.78 0.08 0.22 -3.56 0.00 0.00 178.44 176.01 3d46 h ASP 146 N 0.82 0.28 -0.26 -3.49 3.58 -0.81 -1.00 116.42 115.54 3d46 h ASP 146 Ca 0.17 -0.16 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 3d46 h ASP 146 Cb 0.36 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 3d46 h ASP 146 CO 0.01 0.36 0.13 0.25 -2.88 0.00 0.00 179.24 177.11 3d46 h LEU 147 N 0.18 0.33 -0.48 2.28 5.85 -0.93 -0.87 115.31 121.67 3d46 h LEU 147 Ca 0.07 -0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.71 3d46 h LEU 147 Cb 0.17 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 3d46 h LEU 147 CO -0.01 0.34 0.26 0.15 -0.34 0.00 0.00 178.44 178.85 3d46 h PHE 148 N 0.29 0.48 -0.75 1.25 3.57 -1.02 0.12 116.94 120.88 3d46 h PHE 148 Ca 0.09 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 3d46 h PHE 148 Cb 0.10 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 3d46 h PHE 148 CO -0.03 0.26 0.28 0.78 -2.23 0.00 0.00 178.31 177.37 3d46 h GLY 149 N 0.52 1.21 1.72 2.40 0.00 -0.98 -0.62 103.07 107.32 3d46 h GLY 149 Ca 0.20 -0.67 -0.14 0.00 0.00 0.00 0.00 47.33 46.73 3d46 h GLY 149 CO -0.12 0.63 -0.54 0.50 0.00 0.00 0.00 176.54 177.00 3d46 h LYS 150 N 1.10 0.30 -0.18 4.80 1.57 -0.58 0.22 116.57 123.80 3d46 h LYS 150 Ca 0.25 -0.18 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 3d46 h LYS 150 Cb 0.23 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 3d46 h LYS 150 CO -0.02 0.76 -0.16 0.28 -0.57 0.00 0.00 179.45 179.74 3d46 h VAL 151 N 0.23 1.33 -0.03 0.50 2.07 -0.47 -3.19 116.25 116.69 3d46 h VAL 151 Ca 0.00 -1.31 -0.13 0.00 0.82 0.00 0.00 66.70 66.08 3d46 h VAL 151 Cb 1.03 1.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.58 3d46 h VAL 151 CO 0.09 0.39 -0.58 0.58 0.02 0.00 0.00 177.57 178.07 3d46 h VAL 152 N 0.08 1.40 0.00 2.57 2.07 -1.06 -3.48 116.25 117.84 3d46 h VAL 152 Ca 0.03 -1.97 0.00 0.00 0.82 0.00 0.00 66.70 65.58 3d46 h VAL 152 Cb 0.70 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 3d46 h VAL 152 CO 0.04 0.57 0.00 0.61 0.02 0.00 0.00 177.57 178.81 3d46 n GLY 153 N 0.18 1.29 3.13 2.17 0.00 0.66 -5.09 105.19 107.53 3d46 n GLY 153 Ca -0.02 -0.38 -0.15 0.00 0.00 0.00 0.00 46.02 45.48 3d46 n GLY 153 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d46 s LEU 154 N 0.00 2.30 0.53 0.99 1.43 -0.42 -4.81 118.68 118.69 3d46 s LEU 154 Ca 0.00 -0.64 -0.20 0.00 -1.03 0.00 0.00 54.13 52.26 3d46 s LEU 154 Cb 0.00 -0.31 -0.06 0.00 0.03 0.00 0.00 46.19 45.85 3d46 s LEU 154 CO 0.00 -0.18 1.14 -2.84 0.23 0.00 0.00 176.35 174.70 3d46 s PRO 155 N -1.94 3.44 0.31 1.29 0.02 -1.22 -1.25 135.00 135.65 3d46 s PRO 155 Ca -0.03 1.64 0.02 0.00 0.02 0.00 0.00 61.00 62.65 3d46 s PRO 155 Cb -0.08 -2.09 0.58 0.00 0.02 0.00 0.00 34.50 32.93 3d46 s PRO 155 CO 0.01 -0.78 1.91 0.28 -0.33 0.00 0.00 177.00 178.09 3d46 h VAL 156 N 1.34 1.04 0.00 3.83 2.07 -1.38 -1.77 116.25 121.39 3d46 h VAL 156 Ca -0.50 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 3d46 h VAL 156 Cb 1.26 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3d46 h VAL 156 CO 0.58 0.18 -0.03 0.10 0.02 0.00 0.00 177.57 178.41 3d46 h TYR 157 N 0.97 0.00 0.14 1.57 -0.00 -1.84 -1.46 116.97 116.35 3d46 h TYR 157 Ca 0.38 0.00 -0.28 0.00 0.00 0.00 0.00 58.73 58.83 3d46 h TYR 157 Cb 0.24 0.00 0.01 0.00 0.00 0.00 0.00 36.73 36.98 3d46 h TYR 157 CO -0.00 0.03 -1.30 0.87 -0.00 0.00 0.00 178.16 177.77 3d46 h LYS 158 N 0.00 0.30 -0.32 0.10 1.57 -1.65 -1.07 116.57 115.50 3d46 h LYS 158 Ca -0.00 -0.52 -0.03 0.00 -1.87 0.00 0.00 60.65 58.24 3d46 h LYS 158 Cb 0.06 0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 3d46 h LYS 158 CO 0.00 1.24 0.08 -0.07 -0.57 0.00 0.00 179.45 180.14 3d46 h LEU 159 N 0.08 0.42 0.00 2.94 3.38 -1.00 -2.34 115.31 118.79 3d46 h LEU 159 Ca -0.16 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.76 3d46 h LEU 159 Cb 2.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.64 3d46 h LEU 159 CO 0.21 0.42 0.00 0.18 0.09 0.00 0.00 178.44 179.34 3d46 n LEU 160 N -4.36 0.00 0.00 1.67 4.77 -0.64 -4.84 117.00 113.60 3d46 n LEU 160 Ca 0.02 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 3d46 n LEU 160 Cb 0.17 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 3d46 n LEU 160 CO 0.37 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 3d46 n GLY 161 N 0.78 1.64 0.00 -0.72 0.00 -0.88 -5.08 105.19 100.92 3d46 n GLY 161 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3d46 n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d46 n GLY 162 N 0.00 -2.05 3.78 -0.02 0.00 -0.41 -4.95 105.19 101.54 3d46 n GLY 162 Ca 0.00 -1.50 -0.36 0.00 0.00 0.00 0.00 46.02 44.15 3d46 n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d46 s ALA 163 N -2.60 3.05 -0.99 4.61 0.00 -1.26 -4.30 121.76 120.26 3d46 s ALA 163 Ca 0.00 0.75 0.10 0.00 0.00 0.00 0.00 51.96 52.82 3d46 s ALA 163 Cb 0.00 -3.30 0.23 0.00 0.00 0.00 0.00 23.12 20.05 3d46 s ALA 163 CO 0.00 -0.33 1.13 1.33 0.00 0.00 0.00 175.76 177.89 3d46 n VAL 164 N -0.23 0.73 -3.67 0.00 0.24 0.58 -4.93 118.33 111.05 3d46 n VAL 164 Ca 0.06 -0.86 -0.15 0.00 -2.04 0.00 0.00 64.34 61.34 3d46 n VAL 164 Cb 0.49 0.70 -0.08 0.00 -1.47 0.00 0.00 33.84 33.48 3d46 n VAL 164 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d46 s ARG 165 N -0.97 0.80 0.43 7.34 1.70 -1.25 -5.02 118.95 121.99 3d46 s ARG 165 Ca 0.19 0.03 0.27 0.00 -0.47 0.00 0.00 55.73 55.75 3d46 s ARG 165 Cb 0.11 0.37 0.75 0.00 -0.57 0.00 0.00 34.95 35.60 3d46 s ARG 165 CO 0.14 -0.23 1.75 -0.44 -1.08 0.00 0.00 175.30 175.44 3d46 h ASP 166 N 3.66 0.00 -5.04 -2.89 3.32 -1.93 -3.45 116.42 110.08 3d46 h ASP 166 Ca -0.29 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.69 3d46 h ASP 166 Cb 1.16 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.55 3d46 h ASP 166 CO 0.38 0.00 -0.11 -1.83 -1.72 0.00 0.00 179.24 175.96 3d46 s GLU 167 N -3.34 0.94 -0.20 3.56 -1.05 -1.26 -0.65 118.70 116.70 3d46 s GLU 167 Ca 0.06 -0.42 -0.11 0.00 -0.15 0.00 0.00 54.97 54.34 3d46 s GLU 167 Cb 0.07 0.42 -0.05 0.00 -0.44 0.00 0.00 34.13 34.13 3d46 s GLU 167 CO 0.60 -0.33 0.17 0.42 0.95 0.00 0.00 175.26 177.08 3d46 s ILE 168 N -2.69 5.38 -0.13 1.83 1.01 -0.19 -4.93 121.20 121.48 3d46 s ILE 168 Ca -0.04 0.27 -0.06 0.00 0.00 0.00 0.00 60.65 60.82 3d46 s ILE 168 Cb -0.00 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 3d46 s ILE 168 CO -0.04 0.42 0.09 0.00 0.00 0.00 0.00 174.94 175.41 3d46 s GLN 169 N 0.46 3.48 0.18 2.79 -2.07 -1.26 -1.56 119.66 121.67 3d46 s GLN 169 Ca 0.10 -0.25 0.09 0.00 -1.82 0.00 0.00 55.36 53.48 3d46 s GLN 169 Cb -0.12 -3.11 -0.04 0.00 -1.09 0.00 0.00 33.01 28.65 3d46 s GLN 169 CO -0.00 0.63 -0.11 -0.06 -1.32 0.00 0.00 175.29 174.43 3d46 s PHE 170 N -0.62 2.60 0.16 9.60 0.08 -0.39 -1.02 117.98 128.39 3d46 s PHE 170 Ca 0.12 -0.23 0.09 0.00 0.12 0.00 0.00 56.93 57.02 3d46 s PHE 170 Cb -0.12 -1.28 -0.04 0.00 -0.57 0.00 0.00 43.02 41.01 3d46 s PHE 170 CO 0.02 0.51 -0.10 1.52 -0.10 0.00 0.00 175.22 177.07 3d46 s TYR 171 N -1.69 2.64 -0.07 0.36 -0.85 -0.59 -0.83 117.35 116.32 3d46 s TYR 171 Ca 0.24 -0.21 0.01 0.00 -0.52 0.00 0.00 57.07 56.59 3d46 s TYR 171 Cb -0.09 -1.32 -0.03 0.00 0.38 0.00 0.00 41.96 40.91 3d46 s TYR 171 CO 0.15 0.49 -0.08 0.00 -1.52 0.00 0.00 175.55 174.58 3d46 s ALA 172 N -1.57 2.90 -0.21 9.51 0.00 0.02 -1.80 121.76 130.61 3d46 s ALA 172 Ca 0.24 -0.90 -0.07 0.00 0.00 0.00 0.00 51.96 51.22 3d46 s ALA 172 Cb -0.09 -1.20 -0.03 0.00 0.00 0.00 0.00 23.12 21.79 3d46 s ALA 172 CO 0.14 0.53 0.06 0.99 0.00 0.00 0.00 175.76 177.49 3d46 s THR 173 N -0.67 4.51 -3.50 0.00 2.01 -0.41 -0.46 115.64 117.13 3d46 s THR 173 Ca 0.10 -0.12 0.00 0.00 0.31 0.00 0.00 61.69 61.98 3d46 s THR 173 Cb -0.11 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.33 3d46 s THR 173 CO 0.02 0.40 0.00 0.61 -0.69 0.00 0.00 174.62 174.96 3d46 n GLY 174 N 4.20 -2.05 0.07 4.40 0.00 -0.35 -1.44 105.19 110.02 3d46 n GLY 174 Ca -0.16 -1.19 0.15 0.00 0.00 0.00 0.00 46.02 44.81 3d46 n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d46 n ALA 175 N 0.00 2.64 -3.43 4.61 0.00 -1.26 -4.17 120.51 118.90 3d46 n ALA 175 Ca 0.00 -0.22 -0.27 0.00 0.00 0.00 0.00 53.44 52.96 3d46 n ALA 175 Cb 0.00 -1.42 -0.08 0.00 0.00 0.00 0.00 19.45 17.95 3d46 n ALA 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3d46 n ARG 176 N -1.04 2.03 0.09 0.00 5.12 -1.26 -4.89 116.66 116.70 3d46 n ARG 176 Ca 0.16 -4.33 0.11 0.00 -1.93 0.00 0.00 57.85 51.87 3d46 n ARG 176 Cb 0.24 -2.04 0.59 0.00 -1.16 0.00 0.00 32.46 30.08 3d46 n ARG 176 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 3d46 h PRO 177 N 4.33 0.17 -0.64 5.56 0.11 -1.92 -1.38 132.00 138.23 3d46 h PRO 177 Ca 0.17 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.21 3d46 h PRO 177 Cb 0.72 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.77 3d46 h PRO 177 CO 0.74 0.11 0.15 0.38 -0.21 0.00 0.00 178.00 179.17 3d46 h ASP 178 N 0.17 0.98 0.24 -2.05 2.03 -1.91 -0.70 116.42 115.18 3d46 h ASP 178 Ca 0.14 -0.24 -0.14 0.00 -0.73 0.00 0.00 57.03 56.06 3d46 h ASP 178 Cb 0.34 -0.26 -0.01 0.00 -0.83 0.00 0.00 39.33 38.57 3d46 h ASP 178 CO -0.02 0.96 -0.55 -0.07 -1.03 0.00 0.00 179.24 178.52 3d46 h LEU 179 N 0.95 0.38 -0.85 0.15 3.38 -1.63 -2.92 115.31 114.75 3d46 h LEU 179 Ca 0.20 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3d46 h LEU 179 Cb 0.37 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3d46 h LEU 179 CO 0.00 0.85 0.26 0.00 0.09 0.00 0.00 178.44 179.65 3d46 h ALA 180 N 1.15 1.08 -0.73 1.53 0.00 -0.90 -1.77 119.26 119.63 3d46 h ALA 180 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3d46 h ALA 180 Cb 1.05 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 3d46 h ALA 180 CO 0.09 0.64 0.46 -0.22 0.00 0.00 0.00 179.25 180.22 3d46 h LYS 181 N 1.07 0.97 -0.59 0.00 3.64 -0.97 -1.55 116.57 119.14 3d46 h LYS 181 Ca 0.24 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 3d46 h LYS 181 Cb 0.25 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 3d46 h LYS 181 CO -0.01 0.67 0.32 0.93 -2.27 0.00 0.00 179.45 179.09 3d46 h GLU 182 N 0.99 0.81 0.00 1.90 5.08 -1.24 -1.72 114.58 120.40 3d46 h GLU 182 Ca 0.26 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3d46 h GLU 182 Cb -0.07 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.02 3d46 h GLU 182 CO -0.05 0.59 0.00 -1.33 -1.00 0.00 0.00 179.01 177.22 3d46 n MET 183 N -4.39 0.04 0.00 2.33 2.81 -0.64 -4.90 117.12 112.37 3d46 n MET 183 Ca 0.05 0.12 0.00 0.00 -1.81 0.00 0.00 57.70 56.07 3d46 n MET 183 Cb 0.10 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.11 3d46 n MET 183 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d46 n GLY 184 N 0.73 0.70 3.75 3.03 0.00 -0.65 -2.89 105.19 109.87 3d46 n GLY 184 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 3d46 n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d46 s PHE 185 N -2.00 2.44 -1.42 1.61 0.08 -0.85 -3.98 117.98 113.87 3d46 s PHE 185 Ca 0.00 1.58 0.26 0.00 0.12 0.00 0.00 56.93 58.89 3d46 s PHE 185 Cb 0.00 -3.19 0.76 0.00 -0.57 0.00 0.00 43.02 40.02 3d46 s PHE 185 CO 0.00 -1.95 1.57 0.44 -0.10 0.00 0.00 175.22 175.19 3d46 n ILE 186 N -2.92 0.00 -3.75 0.64 -5.35 -0.01 -4.60 119.36 103.38 3d46 n ILE 186 Ca 0.11 -0.06 0.01 0.00 -0.27 0.00 0.00 62.75 62.53 3d46 n ILE 186 Cb 0.52 0.22 0.00 0.00 -1.74 0.00 0.00 39.64 38.64 3d46 n ILE 186 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3d46 s GLY 187 N -2.71 -0.28 -0.04 3.28 0.00 -1.26 -1.99 107.32 104.32 3d46 s GLY 187 Ca 0.20 0.40 -0.01 0.00 0.00 0.00 0.00 44.72 45.30 3d46 s GLY 187 CO 0.58 1.79 0.07 -0.32 0.00 0.00 0.00 173.10 175.22 3d46 s GLY 188 N -3.24 0.08 -0.20 0.20 0.00 0.59 -0.80 107.32 103.95 3d46 s GLY 188 Ca 0.19 0.40 -0.07 0.00 0.00 0.00 0.00 44.72 45.24 3d46 s GLY 188 CO -0.02 0.93 0.06 1.25 0.00 0.00 0.00 173.10 175.32 3d46 s LYS 189 N 1.32 3.85 0.09 2.90 2.20 0.40 -1.83 119.74 128.67 3d46 s LYS 189 Ca -0.06 -0.40 0.05 0.00 -0.36 0.00 0.00 55.97 55.20 3d46 s LYS 189 Cb -0.12 -3.24 -0.04 0.00 -1.51 0.00 0.00 37.83 32.91 3d46 s LYS 189 CO -0.04 0.11 -0.04 -1.64 -0.36 0.00 0.00 175.35 173.39 3d46 s MET 190 N 0.80 2.42 0.36 4.03 -1.94 -0.06 -1.21 119.30 123.70 3d46 s MET 190 Ca 0.03 -0.88 -0.17 0.00 -1.71 0.00 0.00 55.69 52.96 3d46 s MET 190 Cb -0.14 -2.47 -0.10 0.00 2.01 0.00 0.00 34.83 34.14 3d46 s MET 190 CO 0.02 0.54 0.80 -1.25 -0.01 0.00 0.00 175.02 175.12 3d46 s PRO 191 N -2.20 4.06 0.42 2.03 0.04 -1.26 -0.43 135.00 137.66 3d46 s PRO 191 Ca 0.24 0.80 -0.19 0.00 0.04 0.00 0.00 61.00 61.88 3d46 s PRO 191 Cb -0.11 -2.36 -0.10 0.00 0.04 0.00 0.00 34.50 31.97 3d46 s PRO 191 CO 0.16 0.10 0.91 0.95 0.04 0.00 0.00 177.00 179.15 3d46 s THR 192 N -2.05 4.48 -0.29 1.26 -4.23 -0.24 -4.83 115.64 109.74 3d46 s THR 192 Ca 0.56 1.32 0.09 0.00 -1.18 0.00 0.00 61.69 62.48 3d46 s THR 192 Cb -0.10 -3.62 -0.11 0.00 1.34 0.00 0.00 72.50 70.01 3d46 s THR 192 CO 0.16 -0.35 0.32 1.41 -0.54 0.00 0.00 174.62 175.63 3d46 n HIS 193 N -0.73 0.00 -4.41 3.99 8.25 -1.26 -1.44 115.22 119.62 3d46 n HIS 193 Ca 0.06 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.29 3d46 n HIS 193 Cb 0.54 -0.07 -0.11 0.00 1.12 0.00 0.00 29.99 31.47 3d46 n HIS 193 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3d46 s TRP 194 N -2.13 2.06 0.12 4.41 0.52 -1.26 -4.10 118.94 118.56 3d46 s TRP 194 Ca 0.01 -0.42 0.01 0.00 0.02 0.00 0.00 56.10 55.72 3d46 s TRP 194 Cb 0.07 -0.95 -0.00 0.00 -1.15 0.00 0.00 33.47 31.43 3d46 s TRP 194 CO 0.38 0.52 0.04 0.41 0.02 0.00 0.00 176.95 178.32 3d46 n GLY 195 N -0.24 3.86 0.32 0.98 0.00 -1.26 -4.80 105.19 104.05 3d46 n GLY 195 Ca -0.08 -2.00 0.17 0.00 0.00 0.00 0.00 46.02 44.11 3d46 n GLY 195 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3d46 h PRO 196 N 0.00 0.34 0.00 1.61 0.11 -1.93 0.33 132.00 132.46 3d46 h PRO 196 Ca -0.10 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.99 3d46 h PRO 196 Cb 0.37 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.40 3d46 h PRO 196 CO 0.15 0.23 0.00 1.12 -0.21 0.00 0.00 178.00 179.29 3d46 h HIS 197 N 0.35 0.00 -0.00 0.65 2.07 -1.96 -1.01 115.15 115.25 3d46 h HIS 197 Ca 0.63 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.15 3d46 h HIS 197 Cb 1.31 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.29 3d46 h HIS 197 CO -0.11 0.00 -0.52 -0.25 -3.07 0.00 0.00 177.93 173.98 3d46 n ASP 198 N -2.50 0.54 0.00 3.10 8.00 0.12 -5.03 116.55 120.77 3d46 n ASP 198 Ca -0.01 -0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.19 3d46 n ASP 198 Cb 0.12 0.28 0.00 0.00 -0.02 0.00 0.00 41.12 41.51 3d46 n ASP 198 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d46 n GLY 199 N 1.50 1.98 0.33 0.44 0.00 -0.39 -2.27 105.19 106.78 3d46 n GLY 199 Ca 0.06 -0.39 0.07 0.00 0.00 0.00 0.00 46.02 45.76 3d46 n GLY 199 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3d46 h ASP 200 N 5.83 0.41 -0.62 1.61 3.32 -1.94 -1.47 116.42 123.57 3d46 h ASP 200 Ca 0.00 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 3d46 h ASP 200 Cb 0.00 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 3d46 h ASP 200 CO 0.00 0.28 0.09 0.00 -1.72 0.00 0.00 179.24 177.89 3d46 h ALA 201 N 1.73 0.82 -0.53 3.45 0.00 -1.95 -0.36 119.26 122.42 3d46 h ALA 201 Ca 0.20 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3d46 h ALA 201 Cb 0.19 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3d46 h ALA 201 CO -0.05 0.59 0.18 0.78 0.00 0.00 0.00 179.25 180.75 3d46 h GLY 202 N 0.94 0.87 0.96 0.00 0.00 -0.84 -1.09 103.07 103.91 3d46 h GLY 202 Ca 0.19 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 3d46 h GLY 202 CO 0.01 0.47 0.15 -2.22 0.00 0.00 0.00 176.54 174.96 3d46 h ILE 203 N 0.72 1.22 -0.65 2.60 2.04 -1.19 -1.95 117.51 120.30 3d46 h ILE 203 Ca 0.17 -0.73 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 3d46 h ILE 203 Cb 0.26 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 3d46 h ILE 203 CO -0.01 0.26 0.40 -0.09 0.00 0.00 0.00 178.15 178.72 3d46 h ARG 204 N 0.62 0.87 -0.17 2.37 2.43 -0.84 -0.88 114.38 118.78 3d46 h ARG 204 Ca 0.15 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 3d46 h ARG 204 Cb 0.25 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 3d46 h ARG 204 CO -0.01 0.61 -0.01 0.87 -1.51 0.00 0.00 179.97 179.92 3d46 h LYS 205 N 0.88 0.31 -0.10 0.20 1.57 -1.01 -0.28 116.57 118.13 3d46 h LYS 205 Ca 0.23 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 58.79 3d46 h LYS 205 Cb -0.05 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3d46 h LYS 205 CO -0.05 0.55 -0.47 -0.44 -0.57 0.00 0.00 179.45 178.47 3d46 h ASP 206 N 0.04 0.28 -0.17 0.86 3.32 -1.31 -1.56 116.42 117.88 3d46 h ASP 206 Ca 0.05 -0.13 -0.12 0.00 0.02 0.00 0.00 57.03 56.85 3d46 h ASP 206 Cb 0.42 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 3d46 h ASP 206 CO 0.01 0.71 -0.28 0.00 -1.72 0.00 0.00 179.24 177.96 3d46 h ALA 207 N 1.30 0.91 -0.35 3.45 0.00 -1.09 -2.15 119.26 121.32 3d46 h ALA 207 Ca 0.01 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.45 3d46 h ALA 207 Cb 0.92 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3d46 h ALA 207 CO 0.07 0.62 -0.15 0.00 0.00 0.00 0.00 179.25 179.79 3d46 h ALA 208 N 1.12 1.08 -0.58 0.00 0.00 -0.74 0.13 119.26 120.27 3d46 h ALA 208 Ca 0.07 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3d46 h ALA 208 Cb 0.77 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 3d46 h ALA 208 CO 0.06 0.56 0.33 1.98 0.00 0.00 0.00 179.25 182.19 3d46 h MET 209 N 0.57 0.80 -0.26 0.00 -1.53 -0.91 -0.52 114.93 113.09 3d46 h MET 209 Ca 0.10 -0.09 -0.04 0.00 -3.44 0.00 0.00 59.70 56.23 3d46 h MET 209 Cb 0.59 -0.16 -0.01 0.00 -0.55 0.00 0.00 31.60 31.47 3d46 h MET 209 CO 0.04 0.60 0.00 0.28 0.14 0.00 0.00 176.91 177.97 3d46 h VAL 210 N 0.79 1.25 -0.86 -5.77 2.07 -0.89 -2.53 116.25 110.31 3d46 h VAL 210 Ca 0.21 -0.90 0.05 0.00 0.82 0.00 0.00 66.70 66.88 3d46 h VAL 210 Cb 0.02 1.34 -0.06 0.00 -1.52 0.00 0.00 31.29 31.07 3d46 h VAL 210 CO -0.04 0.28 0.54 0.00 0.02 0.00 0.00 177.57 178.38 3d46 h ALA 211 N 0.82 1.16 -0.29 1.67 0.00 -0.72 -0.20 119.26 121.69 3d46 h ALA 211 Ca 0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3d46 h ALA 211 Cb 0.41 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3d46 h ALA 211 CO 0.01 0.33 0.17 0.22 0.00 0.00 0.00 179.25 179.97 3d46 h ASP 212 N 1.01 0.36 0.32 0.00 3.58 -0.99 -1.72 116.42 118.98 3d46 h ASP 212 Ca 0.36 -0.07 -0.09 0.00 0.42 0.00 0.00 57.03 57.64 3d46 h ASP 212 Cb 0.10 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 3d46 h ASP 212 CO -0.15 0.33 -0.39 0.24 -2.88 0.00 0.00 179.24 176.39 3d46 h MET 213 N 0.36 0.10 -0.63 0.28 2.86 -0.99 -1.68 114.93 115.24 3d46 h MET 213 Ca 0.10 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.61 3d46 h MET 213 Cb 0.04 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 3d46 h MET 213 CO -0.02 0.49 0.04 -0.09 1.06 0.00 0.00 176.91 178.39 3d46 h ARG 214 N 0.09 1.08 -0.38 1.72 9.65 -0.74 0.26 114.38 126.07 3d46 h ARG 214 Ca 0.01 -0.32 -0.02 0.00 -1.10 0.00 0.00 59.98 58.55 3d46 h ARG 214 Cb 0.74 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 29.19 3d46 h ARG 214 CO 0.06 1.03 0.17 1.49 2.80 0.00 0.00 179.97 185.51 3d46 h GLU 215 N 1.00 0.56 -0.03 0.20 4.22 -0.95 -1.24 114.58 118.34 3d46 h GLU 215 Ca 0.18 -0.09 -0.16 0.00 0.08 0.00 0.00 59.36 59.37 3d46 h GLU 215 Cb 0.51 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 3d46 h GLU 215 CO 0.02 0.51 -0.71 0.87 -2.18 0.00 0.00 179.01 177.52 3d46 h LYS 216 N 0.47 0.19 0.00 1.92 1.57 -1.00 -3.34 116.57 116.37 3d46 h LYS 216 Ca 0.13 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3d46 h LYS 216 Cb 0.15 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3d46 h LYS 216 CO -0.01 0.82 -1.14 0.00 -0.57 0.00 0.00 179.45 178.55 3d46 n GLY 218 N 1.43 -0.59 0.13 0.00 0.00 -0.47 -4.39 105.19 101.30 3d46 n GLY 218 Ca 0.02 -1.73 -0.01 0.00 0.00 0.00 0.00 46.02 44.30 3d46 n GLY 218 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d46 h PRO 219 N 0.00 0.00 0.00 1.61 0.13 -1.96 -3.35 132.00 128.43 3d46 h PRO 219 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 3d46 h PRO 219 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 3d46 h PRO 219 CO 0.00 0.64 -0.61 -0.44 -0.23 0.00 0.00 178.00 177.37 3d46 h ASP 220 N 0.00 0.00 -3.03 1.44 3.32 -1.98 -3.44 116.42 112.73 3d46 h ASP 220 Ca -0.01 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.47 3d46 h ASP 220 Cb 1.24 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.74 3d46 h ASP 220 CO 0.08 0.02 0.81 0.12 -1.72 0.00 0.00 179.24 178.56 3d46 s PHE 221 N -3.29 3.14 0.52 4.55 5.36 -1.26 -4.97 117.98 122.03 3d46 s PHE 221 Ca 0.02 1.26 -0.21 0.00 -0.96 0.00 0.00 56.93 57.05 3d46 s PHE 221 Cb 0.08 -3.38 -0.06 0.00 -0.34 0.00 0.00 43.02 39.32 3d46 s PHE 221 CO 0.74 -1.05 1.20 -1.58 -1.46 0.00 0.00 175.22 173.07 3d46 s TRP 222 N 3.11 2.64 -0.03 10.12 0.51 -0.84 -4.89 118.94 129.56 3d46 s TRP 222 Ca 0.50 1.51 0.03 0.00 -2.12 0.00 0.00 56.10 56.01 3d46 s TRP 222 Cb -0.19 -3.46 0.00 0.00 -0.81 0.00 0.00 33.47 29.02 3d46 s TRP 222 CO 0.12 -1.90 -0.10 -0.51 -0.51 0.00 0.00 176.95 174.05 3d46 s LEU 223 N -3.46 1.80 0.09 2.99 1.43 -1.26 -0.30 118.68 119.97 3d46 s LEU 223 Ca 0.69 -0.21 -0.00 0.00 -1.03 0.00 0.00 54.13 53.58 3d46 s LEU 223 Cb -0.30 -0.61 -0.04 0.00 0.03 0.00 0.00 46.19 45.26 3d46 s LEU 223 CO 0.35 0.08 -0.01 -0.04 0.23 0.00 0.00 176.35 176.96 3d46 s MET 224 N 0.19 0.77 -0.08 1.70 -1.94 -0.76 -0.87 119.30 118.31 3d46 s MET 224 Ca -0.04 -1.32 0.05 0.00 -1.71 0.00 0.00 55.69 52.67 3d46 s MET 224 Cb -0.09 0.11 -0.00 0.00 2.01 0.00 0.00 34.83 36.86 3d46 s MET 224 CO 0.01 -0.14 -0.22 -0.51 -0.01 0.00 0.00 175.02 174.15 3d46 s LEU 225 N -2.99 2.02 -0.20 -0.03 1.43 -0.95 -0.88 118.68 117.07 3d46 s LEU 225 Ca 0.14 -0.50 -0.07 0.00 -1.03 0.00 0.00 54.13 52.67 3d46 s LEU 225 Cb 0.07 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.97 3d46 s LEU 225 CO -0.05 0.17 0.05 -0.62 0.23 0.00 0.00 176.35 176.13 3d46 s ASP 226 N 0.18 5.32 0.00 2.29 -1.08 0.43 -0.23 116.67 123.58 3d46 s ASP 226 Ca -0.12 -0.06 0.13 0.00 -0.52 0.00 0.00 52.55 51.98 3d46 s ASP 226 Cb -0.16 -1.92 0.24 0.00 -1.46 0.00 0.00 42.92 39.63 3d46 s ASP 226 CO 0.06 0.10 1.13 0.00 0.52 0.00 0.00 175.17 176.97 3d46 n TRP 228 N 0.74 -0.69 -1.16 0.00 -0.00 -1.21 -0.74 117.44 114.37 3d46 n TRP 228 Ca 0.11 0.06 -0.09 0.00 -0.00 0.00 0.00 57.50 57.58 3d46 n TRP 228 Cb 0.40 -1.33 -0.04 0.00 -0.00 0.00 0.00 31.31 30.34 3d46 n TRP 228 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 177.69 176.36 3d46 n MET 229 N -2.80 -1.63 0.00 5.87 2.81 0.13 -4.39 117.12 117.10 3d46 n MET 229 Ca -0.06 0.70 0.14 0.00 -1.81 0.00 0.00 57.70 56.67 3d46 n MET 229 Cb 0.28 -4.88 0.58 0.00 -0.71 0.00 0.00 33.22 28.49 3d46 n MET 229 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3d46 n SER 230 N -0.49 0.86 -1.78 7.83 3.41 0.08 -4.01 113.62 119.52 3d46 n SER 230 Ca -0.09 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.52 3d46 n SER 230 Cb 0.46 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 3d46 n SER 230 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d46 n GLN 231 N -0.53 2.11 -4.37 4.33 6.02 0.01 -4.46 117.38 120.48 3d46 n GLN 231 Ca 0.17 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.97 3d46 n GLN 231 Cb 0.30 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.46 3d46 n GLN 231 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 3d46 s ASP 232 N -0.80 1.70 0.17 1.08 1.47 -1.26 -4.61 116.67 114.43 3d46 s ASP 232 Ca 0.00 -1.44 -0.14 0.00 1.18 0.00 0.00 52.55 52.14 3d46 s ASP 232 Cb 0.00 0.18 0.14 0.00 -0.34 0.00 0.00 42.92 42.90 3d46 s ASP 232 CO 0.00 -0.75 1.71 0.58 0.68 0.00 0.00 175.17 177.39 3d46 h VAL 233 N 2.23 0.73 -0.09 2.11 2.07 -1.93 -1.55 116.25 119.81 3d46 h VAL 233 Ca -0.38 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 3d46 h VAL 233 Cb 1.25 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 31.55 3d46 h VAL 233 CO 0.61 0.03 0.05 -1.13 0.02 0.00 0.00 177.57 177.15 3d46 h ASN 234 N 0.18 0.12 -0.50 0.57 -1.24 -1.99 -0.09 115.58 112.64 3d46 h ASN 234 Ca 0.22 -0.08 -0.02 0.00 0.71 0.00 0.00 56.30 57.13 3d46 h ASN 234 Cb 0.29 -0.03 -0.02 0.00 0.73 0.00 0.00 38.32 39.29 3d46 h ASN 234 CO -0.31 0.17 0.25 0.22 -1.29 0.00 0.00 177.43 176.47 3d46 h TYR 235 N 0.06 0.71 -0.87 0.67 3.20 -1.94 -0.70 116.97 118.09 3d46 h TYR 235 Ca 0.03 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 3d46 h TYR 235 Cb 0.08 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 3d46 h TYR 235 CO -0.04 0.55 0.45 0.00 -1.64 0.00 0.00 178.16 177.47 3d46 h ALA 236 N 1.09 1.16 -0.23 1.82 0.00 -1.16 -0.01 119.26 121.92 3d46 h ALA 236 Ca 0.17 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3d46 h ALA 236 Cb 0.10 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3d46 h ALA 236 CO -0.02 0.66 0.07 1.15 0.00 0.00 0.00 179.25 181.11 3d46 h THR 237 N 1.22 1.19 -0.57 0.00 2.02 -0.60 -0.40 112.91 115.77 3d46 h THR 237 Ca 0.30 -0.60 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 3d46 h THR 237 Cb 0.07 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 3d46 h THR 237 CO -0.04 0.19 0.32 0.11 0.37 0.00 0.00 175.52 176.47 3d46 h LYS 238 N 0.20 0.80 -0.43 6.66 1.57 -0.77 -1.99 116.57 122.62 3d46 h LYS 238 Ca 0.07 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 3d46 h LYS 238 Cb 0.23 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 3d46 h LYS 238 CO -0.00 0.61 0.11 1.25 -0.57 0.00 0.00 179.45 180.85 3d46 h LEU 239 N 0.77 0.64 -0.46 2.94 5.85 -0.86 -0.76 115.31 123.44 3d46 h LEU 239 Ca 0.20 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.72 3d46 h LEU 239 Cb 0.04 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 3d46 h LEU 239 CO -0.03 0.69 0.26 0.00 -0.34 0.00 0.00 178.44 179.02 3d46 h ALA 240 N 0.97 0.58 -0.13 1.25 0.00 -0.89 -1.11 119.26 119.93 3d46 h ALA 240 Ca 0.13 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 3d46 h ALA 240 Cb 0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3d46 h ALA 240 CO -0.00 -0.06 -0.38 0.45 0.00 0.00 0.00 179.25 179.26 3d46 h HIS 241 N 0.53 0.31 0.00 0.00 3.86 -1.22 -1.74 115.15 116.88 3d46 h HIS 241 Ca 0.19 -0.08 -0.05 0.00 -1.16 0.00 0.00 60.37 59.27 3d46 h HIS 241 Cb 0.03 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.42 3d46 h HIS 241 CO -0.07 0.61 -0.22 0.00 0.86 0.00 0.00 177.93 179.11 3d46 h ALA 242 N 1.38 1.15 -0.01 2.45 0.00 -0.47 -2.85 119.26 120.91 3d46 h ALA 242 Ca 0.02 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3d46 h ALA 242 Cb 0.77 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3d46 h ALA 242 CO 0.06 0.28 -0.56 0.00 0.00 0.00 0.00 179.25 179.03 3d46 h ALA 244 N 3.53 1.38 -0.00 0.00 0.00 -1.08 -1.85 119.26 121.22 3d46 h ALA 244 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d46 h ALA 244 Cb 0.61 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 3d46 h ALA 244 CO 0.00 0.33 0.03 -1.35 0.00 0.00 0.00 179.25 178.26 3d46 h PRO 245 N 1.06 0.00 -0.60 0.00 0.11 -1.78 -1.29 132.00 129.51 3d46 h PRO 245 Ca 0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.55 3d46 h PRO 245 Cb 0.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.38 3d46 h PRO 245 CO -0.21 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.77 3d46 n PHE 246 N -3.11 1.04 -3.71 0.65 3.72 -0.70 -4.98 117.46 110.36 3d46 n PHE 246 Ca -0.03 -0.56 -0.22 0.00 -0.05 0.00 0.00 57.45 56.59 3d46 n PHE 246 Cb 0.10 -0.10 0.03 0.00 -0.94 0.00 0.00 39.48 38.57 3d46 n PHE 246 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3d46 n ASN 247 N 1.12 -1.40 -4.69 4.37 5.15 -0.49 -4.89 115.26 114.43 3d46 n ASN 247 Ca 0.22 -0.85 -0.42 0.00 -0.60 0.00 0.00 54.58 52.93 3d46 n ASN 247 Cb 0.69 -3.94 -0.03 0.00 -0.53 0.00 0.00 39.78 35.96 3d46 n ASN 247 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3d46 s LEU 248 N -6.66 4.38 0.14 1.20 2.96 -1.22 -4.70 118.68 114.78 3d46 s LEU 248 Ca 0.04 2.62 -0.14 0.00 -0.22 0.00 0.00 54.13 56.43 3d46 s LEU 248 Cb -0.01 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.12 3d46 s LEU 248 CO 0.82 -0.93 1.61 0.50 -1.32 0.00 0.00 176.35 177.02 3d46 h LYS 249 N 8.30 0.77 -2.99 1.98 3.64 -1.35 -3.44 116.57 123.48 3d46 h LYS 249 Ca -0.44 -0.22 -0.03 0.00 -1.27 0.00 0.00 60.65 58.69 3d46 h LYS 249 Cb 1.21 -0.08 -0.13 0.00 -0.41 0.00 0.00 32.23 32.82 3d46 h LYS 249 CO 0.94 0.81 0.17 1.67 -2.27 0.00 0.00 179.45 180.76 3d46 s TRP 250 N -5.11 -0.50 -0.17 1.91 -2.14 -1.26 -1.77 118.94 109.90 3d46 s TRP 250 Ca -0.13 0.32 0.01 0.00 2.66 0.00 0.00 56.10 58.96 3d46 s TRP 250 Cb 0.11 0.51 0.02 0.00 -3.10 0.00 0.00 33.47 31.01 3d46 s TRP 250 CO 0.80 -0.81 -0.20 -1.50 -2.66 0.00 0.00 176.95 172.58 3d46 s ILE 251 N -3.59 2.01 -0.08 0.66 2.07 -0.59 -2.25 121.20 119.43 3d46 s ILE 251 Ca 0.00 -0.92 -0.03 0.00 -1.41 0.00 0.00 60.65 58.30 3d46 s ILE 251 Cb -0.01 -1.81 -0.04 0.00 0.13 0.00 0.00 42.46 40.73 3d46 s ILE 251 CO -0.11 0.53 0.05 -0.70 -1.91 0.00 0.00 174.94 172.80 3d46 s GLU 252 N 1.22 3.11 -1.32 3.50 2.12 0.68 -2.25 118.70 125.76 3d46 s GLU 252 Ca 0.03 -0.35 -0.24 0.00 0.36 0.00 0.00 54.97 54.76 3d46 s GLU 252 Cb -0.13 -2.90 0.03 0.00 0.26 0.00 0.00 34.13 31.39 3d46 s GLU 252 CO -0.11 0.71 0.46 -1.91 -0.54 0.00 0.00 175.26 173.88 3d46 n GLU 253 N 1.96 -0.42 0.21 4.30 2.13 0.23 -0.64 120.64 128.40 3d46 n GLU 253 Ca -0.18 0.06 0.06 0.00 0.66 0.00 0.00 57.16 57.76 3d46 n GLU 253 Cb 0.54 -2.79 0.47 0.00 0.27 0.00 0.00 31.44 29.92 3d46 n GLU 253 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3d46 s LEU 255 N -7.95 2.50 0.70 0.00 1.43 -1.26 -0.81 118.68 113.29 3d46 s LEU 255 Ca -0.03 -0.94 -0.16 0.00 -1.03 0.00 0.00 54.13 51.97 3d46 s LEU 255 Cb 0.14 -0.94 0.00 0.00 0.03 0.00 0.00 46.19 45.42 3d46 s LEU 255 CO 0.68 -0.01 1.00 -2.65 0.23 0.00 0.00 176.35 175.61 3d46 n PRO 256 N -0.10 0.59 -0.18 1.29 -0.02 -1.26 -4.51 135.00 130.82 3d46 n PRO 256 Ca -0.10 0.26 0.14 0.00 -2.02 0.00 0.00 63.50 61.78 3d46 n PRO 256 Cb 0.58 -2.25 0.48 0.00 -0.02 0.00 0.00 33.50 32.29 3d46 n PRO 256 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3d46 h PRO 257 N -0.13 0.46 0.00 0.52 0.13 -1.95 -2.56 132.00 128.48 3d46 h PRO 257 Ca -0.48 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3d46 h PRO 257 Cb 1.34 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3d46 h PRO 257 CO 0.48 0.31 0.00 1.96 -0.23 0.00 0.00 178.00 180.51 3d46 h GLN 258 N 0.48 0.00 -2.93 0.86 7.50 -1.99 -3.37 115.11 115.65 3d46 h GLN 258 Ca 0.38 0.00 -0.61 0.00 0.50 0.00 0.00 58.65 58.92 3d46 h GLN 258 Cb 0.79 0.00 0.02 0.00 0.05 0.00 0.00 27.48 28.34 3d46 h GLN 258 CO -0.13 0.00 3.42 1.04 -1.50 0.00 0.00 178.83 181.66 3d46 n GLN 259 N -2.78 3.47 -0.24 1.46 6.02 -0.97 -4.63 117.38 119.71 3d46 n GLN 259 Ca 0.01 -2.05 -0.05 0.00 -0.01 0.00 0.00 57.00 54.90 3d46 n GLN 259 Cb 0.28 -2.71 0.05 0.00 1.02 0.00 0.00 30.24 28.89 3d46 n GLN 259 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.06 177.93 3d46 h TYR 260 N 4.89 0.85 -0.87 1.08 0.05 -1.86 -1.32 116.97 119.78 3d46 h TYR 260 Ca 0.80 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 59.59 3d46 h TYR 260 Cb 0.38 -0.29 -0.04 0.00 1.01 0.00 0.00 36.73 37.79 3d46 h TYR 260 CO 1.88 0.53 0.53 0.93 -1.05 0.00 0.00 178.16 180.98 3d46 h GLU 261 N 0.91 1.17 -0.53 4.88 3.07 -1.97 -1.30 114.58 120.80 3d46 h GLU 261 Ca 0.25 -0.10 -0.11 0.00 -0.50 0.00 0.00 59.36 58.90 3d46 h GLU 261 Cb -0.10 -0.25 -0.02 0.00 -0.84 0.00 0.00 28.75 27.54 3d46 h GLU 261 CO -0.06 0.82 -0.09 0.78 -1.40 0.00 0.00 179.01 179.06 3d46 h GLY 262 N 1.21 1.06 1.18 -3.84 0.00 -1.77 -2.41 103.07 98.50 3d46 h GLY 262 Ca 0.31 -0.83 -0.05 0.00 0.00 0.00 0.00 47.33 46.76 3d46 h GLY 262 CO -0.06 0.76 0.20 -0.97 0.00 0.00 0.00 176.54 176.47 3d46 h TYR 263 N 0.88 1.06 -0.44 5.60 -1.99 -0.61 0.92 116.97 122.39 3d46 h TYR 263 Ca 0.14 -0.10 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 3d46 h TYR 263 Cb 0.63 -0.31 -0.02 0.00 2.00 0.00 0.00 36.73 39.03 3d46 h TYR 263 CO 0.04 0.85 0.26 -0.09 -0.00 0.00 0.00 178.16 179.22 3d46 h ARG 264 N 0.99 0.61 -0.46 4.88 2.43 -1.06 -0.77 114.38 121.00 3d46 h ARG 264 Ca 0.22 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.23 3d46 h ARG 264 Cb 0.29 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 3d46 h ARG 264 CO -0.01 0.47 -0.07 1.49 -1.51 0.00 0.00 179.97 180.34 3d46 h GLU 265 N 0.58 0.87 -0.50 0.20 4.81 -1.04 -2.38 114.58 117.13 3d46 h GLU 265 Ca 0.16 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 3d46 h GLU 265 Cb 0.02 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3d46 h GLU 265 CO -0.03 0.95 0.32 1.25 -0.73 0.00 0.00 179.01 180.77 3d46 h LEU 266 N 0.71 0.58 -1.05 1.64 5.85 -0.61 -1.09 115.31 121.33 3d46 h LEU 266 Ca 0.12 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.81 3d46 h LEU 266 Cb 0.60 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 3d46 h LEU 266 CO 0.04 0.44 0.57 0.50 -0.34 0.00 0.00 178.44 179.64 3d46 h LYS 267 N 0.67 1.21 -0.19 1.25 1.63 -1.06 -0.90 116.57 119.18 3d46 h LYS 267 Ca 0.18 -0.09 -0.07 0.00 -0.85 0.00 0.00 60.65 59.81 3d46 h LYS 267 Cb -0.05 -0.26 -0.01 0.00 -0.60 0.00 0.00 32.23 31.30 3d46 h LYS 267 CO -0.04 0.83 -0.21 0.00 -3.45 0.00 0.00 179.45 176.58 3d46 h ARG 268 N 1.24 0.34 -0.00 1.90 3.08 -0.87 -2.88 114.38 117.18 3d46 h ARG 268 Ca 0.33 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.27 3d46 h ARG 268 Cb -0.09 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 29.93 3d46 h ARG 268 CO -0.07 0.54 -0.23 0.09 -1.07 0.00 0.00 179.97 179.23 3d46 n ASN 269 N -4.18 0.28 -4.76 7.04 3.02 -0.47 -4.95 115.26 111.25 3d46 n ASN 269 Ca -0.00 0.03 -0.38 0.00 -0.03 0.00 0.00 54.58 54.19 3d46 n ASN 269 Cb 0.35 -0.12 0.02 0.00 -0.61 0.00 0.00 39.78 39.42 3d46 n ASN 269 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3d46 s ALA 270 N -2.93 2.97 0.54 5.41 0.00 -0.44 -4.96 121.76 122.36 3d46 s ALA 270 Ca 0.15 1.21 -0.21 0.00 0.00 0.00 0.00 51.96 53.10 3d46 s ALA 270 Cb 0.18 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.74 3d46 s ALA 270 CO 0.60 -1.06 1.23 -2.30 0.00 0.00 0.00 175.76 174.22 3d46 n PRO 271 N -0.61 1.48 -1.66 0.00 -0.02 -1.26 -4.84 135.00 128.08 3d46 n PRO 271 Ca 0.08 0.55 -0.46 0.00 -2.02 0.00 0.00 63.50 61.64 3d46 n PRO 271 Cb 0.45 -2.41 -0.04 0.00 -0.02 0.00 0.00 33.50 31.48 3d46 n PRO 271 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d46 n ALA 272 N -1.10 1.19 0.00 3.55 0.00 -1.26 -1.59 120.51 121.30 3d46 n ALA 272 Ca 0.11 0.45 0.00 0.00 0.00 0.00 0.00 53.44 54.00 3d46 n ALA 272 Cb 0.44 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.56 3d46 n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d46 n GLY 273 N 3.36 2.72 3.73 0.00 0.00 -1.26 -5.01 105.19 108.73 3d46 n GLY 273 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 3d46 n GLY 273 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3d46 s MET 274 N -0.28 4.42 0.32 1.61 0.00 -0.62 -5.00 119.30 119.75 3d46 s MET 274 Ca 0.00 0.86 -0.08 0.00 0.00 0.00 0.00 55.69 56.47 3d46 s MET 274 Cb 0.00 -3.41 -0.06 0.00 0.00 0.00 0.00 34.83 31.36 3d46 s MET 274 CO 0.00 0.17 0.64 -1.64 0.00 0.00 0.00 175.02 174.19 3d46 s MET 275 N 0.43 3.73 -0.10 4.11 -1.94 -0.73 -4.71 119.30 120.08 3d46 s MET 275 Ca 0.36 0.24 0.04 0.00 -1.71 0.00 0.00 55.69 54.62 3d46 s MET 275 Cb -0.18 -2.54 0.00 0.00 2.01 0.00 0.00 34.83 34.11 3d46 s MET 275 CO 0.18 0.14 -0.24 0.08 -0.01 0.00 0.00 175.02 175.17 3d46 s VAL 276 N -2.15 2.04 0.26 -6.03 1.01 -1.26 -1.55 120.40 112.73 3d46 s VAL 276 Ca 0.47 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 61.48 3d46 s VAL 276 Cb -0.11 -1.77 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 3d46 s VAL 276 CO 0.29 0.56 0.03 0.42 0.00 0.00 0.00 175.10 176.39 3d46 s THR 277 N 0.39 0.96 -0.08 3.92 -4.23 -0.95 -1.41 115.64 114.24 3d46 s THR 277 Ca -0.18 -2.02 -0.28 0.00 -1.18 0.00 0.00 61.69 58.04 3d46 s THR 277 Cb -0.18 -2.51 0.09 0.00 1.34 0.00 0.00 72.50 71.24 3d46 s THR 277 CO 0.08 -0.18 1.23 -0.24 -0.54 0.00 0.00 174.62 174.97 3d46 n SER 278 N -0.49 -0.94 0.00 3.99 2.88 -1.14 -0.60 113.62 117.33 3d46 n SER 278 Ca -0.03 -1.05 0.00 0.00 -1.33 0.00 0.00 58.87 56.46 3d46 n SER 278 Cb 0.65 1.43 0.00 0.00 -0.75 0.00 0.00 64.21 65.54 3d46 n SER 278 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3d46 n GLY 279 N -0.89 1.84 0.31 0.46 0.00 -1.26 -0.35 105.19 105.29 3d46 n GLY 279 Ca 0.06 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.22 3d46 n GLY 279 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3d46 h GLU 280 N 0.00 0.00 -0.03 1.61 4.11 -1.63 -1.60 114.58 117.04 3d46 h GLU 280 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3d46 h GLU 280 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3d46 h GLU 280 CO 0.00 0.00 -0.06 0.72 0.07 0.00 0.00 179.01 179.74 3d46 n HIS 281 N -4.15 0.00 -2.54 2.06 8.25 -1.26 -4.11 115.22 113.46 3d46 n HIS 281 Ca -0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.15 3d46 n HIS 281 Cb 0.22 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.30 3d46 n HIS 281 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3d46 s HIS 282 N -2.06 3.49 0.02 4.41 3.76 -0.60 -4.43 115.29 119.87 3d46 s HIS 282 Ca 0.27 1.23 -0.06 0.00 -0.15 0.00 0.00 55.06 56.34 3d46 s HIS 282 Cb 0.20 -2.60 -0.01 0.00 1.11 0.00 0.00 32.58 31.28 3d46 s HIS 282 CO 0.34 -0.29 0.12 0.20 -0.85 0.00 0.00 174.74 174.25 3d46 s GLY 283 N -3.31 0.12 0.08 -2.22 0.00 -1.19 -4.29 107.32 96.50 3d46 s GLY 283 Ca 0.54 -0.37 0.00 0.00 0.00 0.00 0.00 44.72 44.89 3d46 s GLY 283 CO 0.35 -0.51 0.00 -1.30 0.00 0.00 0.00 173.10 171.64 3d46 n THR 284 N 1.05 -1.40 -0.34 0.90 -2.24 -0.75 -4.16 114.28 107.33 3d46 n THR 284 Ca -0.21 0.31 0.04 0.00 -2.27 0.00 0.00 64.05 61.93 3d46 n THR 284 Cb 0.57 -0.44 0.22 0.00 -2.10 0.00 0.00 70.33 68.58 3d46 n THR 284 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3d46 h LEU 285 N 0.20 0.96 -1.05 3.22 5.85 -1.92 -2.36 115.31 120.21 3d46 h LEU 285 Ca 0.00 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 3d46 h LEU 285 Cb 0.02 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 3d46 h LEU 285 CO 0.00 0.60 0.28 1.56 -0.34 0.00 0.00 178.44 180.54 3d46 h GLN 286 N 1.08 0.96 -0.50 1.25 7.50 -2.00 -1.16 115.11 122.24 3d46 h GLN 286 Ca 0.42 -0.15 -0.08 0.00 0.50 0.00 0.00 58.65 59.34 3d46 h GLN 286 Cb 0.24 -0.17 -0.02 0.00 0.05 0.00 0.00 27.48 27.58 3d46 h GLN 286 CO -0.17 0.77 -0.02 0.77 -1.50 0.00 0.00 178.83 178.68 3d46 h SER 287 N 0.95 0.82 0.70 1.46 0.02 -1.59 -2.26 113.55 113.65 3d46 h SER 287 Ca 0.23 -0.21 -0.07 0.00 -0.84 0.00 0.00 61.79 60.90 3d46 h SER 287 Cb 0.15 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 3d46 h SER 287 CO -0.02 0.90 -0.32 -0.26 -1.14 0.00 0.00 176.83 175.98 3d46 h PHE 288 N 0.79 0.00 -0.14 3.45 0.04 -1.20 0.65 116.94 120.53 3d46 h PHE 288 Ca 0.15 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.91 3d46 h PHE 288 Cb 0.49 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.64 3d46 h PHE 288 CO 0.03 0.32 0.05 -0.09 -0.60 0.00 0.00 178.31 178.02 3d46 h ARG 289 N 0.00 0.21 -0.42 1.51 2.43 -0.68 0.15 114.38 117.58 3d46 h ARG 289 Ca -0.00 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 3d46 h ARG 289 Cb 0.76 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.26 3d46 h ARG 289 CO 0.04 0.33 0.10 1.15 -1.51 0.00 0.00 179.97 180.08 3d46 h THR 290 N 0.05 1.23 -0.50 0.20 2.02 -1.06 -2.12 112.91 112.73 3d46 h THR 290 Ca 0.04 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 3d46 h THR 290 Cb 0.20 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 3d46 h THR 290 CO -0.00 0.29 0.27 0.25 0.37 0.00 0.00 175.52 176.70 3d46 h LEU 291 N 0.55 0.62 -1.12 2.58 5.85 -0.72 -2.62 115.31 120.45 3d46 h LEU 291 Ca 0.13 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.79 3d46 h LEU 291 Cb 0.33 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 3d46 h LEU 291 CO 0.00 0.53 0.60 0.00 -0.34 0.00 0.00 178.44 179.23 3d46 h ALA 292 N 1.11 1.40 0.00 1.25 0.00 -0.54 -1.93 119.26 120.56 3d46 h ALA 292 Ca 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3d46 h ALA 292 Cb 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.50 3d46 h ALA 292 CO -0.03 0.53 0.00 0.39 0.00 0.00 0.00 179.25 180.15 3d46 n GLU 293 N -4.42 0.13 0.16 0.00 1.02 -0.81 -1.94 120.64 114.77 3d46 n GLU 293 Ca 0.11 0.17 0.13 0.00 -0.02 0.00 0.00 57.16 57.55 3d46 n GLU 293 Cb 0.07 -1.50 0.43 0.00 -0.02 0.00 0.00 31.44 30.41 3d46 n GLU 293 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3d46 h THR 294 N 0.00 0.00 0.00 2.62 1.35 -1.26 -3.47 112.91 112.15 3d46 h THR 294 Ca 0.00 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 3d46 h THR 294 Cb 0.21 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.07 3d46 h THR 294 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3d46 n GLY 295 N 0.73 0.67 3.73 5.82 0.00 -0.82 -4.18 105.19 111.13 3d46 n GLY 295 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 3d46 n GLY 295 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3d46 s ILE 296 N -2.42 2.19 0.09 -0.61 -4.36 -1.26 -4.95 121.20 109.87 3d46 s ILE 296 Ca 0.00 0.10 -0.15 0.00 -0.26 0.00 0.00 60.65 60.34 3d46 s ILE 296 Cb 0.00 -2.88 -0.12 0.00 1.25 0.00 0.00 42.46 40.71 3d46 s ILE 296 CO 0.00 -0.04 1.34 0.44 0.24 0.00 0.00 174.94 176.93 3d46 h ASP 297 N 0.18 0.77 -3.55 4.36 3.32 -1.63 -3.46 116.42 116.41 3d46 h ASP 297 Ca -0.49 -0.55 -0.35 0.00 0.02 0.00 0.00 57.03 55.66 3d46 h ASP 297 Cb 1.32 -0.22 -0.33 0.00 0.22 0.00 0.00 39.33 40.32 3d46 h ASP 297 CO 0.52 1.18 -0.75 -0.63 -1.72 0.00 0.00 179.24 177.83 3d46 s ILE 298 N -4.04 0.27 -0.12 0.35 1.01 -1.24 -3.87 121.20 113.55 3d46 s ILE 298 Ca -0.12 0.00 -0.10 0.00 0.00 0.00 0.00 60.65 60.44 3d46 s ILE 298 Cb 0.08 -0.33 -0.05 0.00 0.01 0.00 0.00 42.46 42.18 3d46 s ILE 298 CO 0.85 0.15 0.20 -0.04 0.00 0.00 0.00 174.94 176.10 3d46 s MET 299 N 0.80 3.75 -0.55 2.79 -1.94 -1.21 -2.86 119.30 120.08 3d46 s MET 299 Ca -0.09 -0.03 0.06 0.00 -1.71 0.00 0.00 55.69 53.92 3d46 s MET 299 Cb -0.12 -3.27 0.34 0.00 2.01 0.00 0.00 34.83 33.79 3d46 s MET 299 CO -0.01 0.61 0.90 1.04 -0.01 0.00 0.00 175.02 177.55 3d46 n GLN 300 N 2.44 2.84 -1.90 2.03 6.02 0.52 -2.08 117.38 127.26 3d46 n GLN 300 Ca -0.17 -4.62 -0.36 0.00 -0.01 0.00 0.00 57.00 51.83 3d46 n GLN 300 Cb 0.54 -2.15 0.05 0.00 1.02 0.00 0.00 30.24 29.69 3d46 n GLN 300 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3d46 s PRO 301 N -3.25 2.82 -0.18 -1.09 0.04 -1.25 -1.61 135.00 130.48 3d46 s PRO 301 Ca 0.47 1.95 -0.14 0.00 0.04 0.00 0.00 61.00 63.31 3d46 s PRO 301 Cb 0.28 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.86 3d46 s PRO 301 CO -0.12 -1.35 0.31 0.34 0.04 0.00 0.00 177.00 176.21 3d46 s ASP 302 N -1.47 6.40 0.43 6.66 2.15 -1.26 -1.03 116.67 128.55 3d46 s ASP 302 Ca 0.79 0.46 0.13 0.00 0.43 0.00 0.00 52.55 54.36 3d46 s ASP 302 Cb -0.34 -2.19 0.99 0.00 -0.30 0.00 0.00 42.92 41.08 3d46 s ASP 302 CO 0.36 0.04 1.99 0.58 -0.17 0.00 0.00 175.17 177.97 3d46 h VAL 303 N 4.84 0.92 -0.01 1.11 2.07 -1.91 0.15 116.25 123.42 3d46 h VAL 303 Ca -0.39 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 66.97 3d46 h VAL 303 Cb 1.16 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 3d46 h VAL 303 CO 0.73 0.08 -0.01 0.61 0.02 0.00 0.00 177.57 179.00 3d46 n GLY 304 N -1.51 -0.40 0.00 2.17 0.00 -1.26 -2.40 105.19 101.80 3d46 n GLY 304 Ca 0.09 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.76 3d46 n GLY 304 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3d46 n TRP 305 N -0.29 0.00 0.43 1.61 8.01 -0.22 -4.34 117.44 122.64 3d46 n TRP 305 Ca 0.20 0.00 0.13 0.00 -1.31 0.00 0.00 57.50 56.52 3d46 n TRP 305 Cb 0.27 0.00 0.44 0.00 -2.01 0.00 0.00 31.31 30.01 3d46 n TRP 305 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3d46 n GLY 307 N 0.66 0.53 0.00 0.00 0.00 -1.26 -1.81 105.19 103.31 3d46 n GLY 307 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3d46 n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d46 n GLY 308 N 0.00 -0.77 0.33 -0.02 0.00 -1.01 -3.97 105.19 99.75 3d46 n GLY 308 Ca 0.00 -2.24 -0.06 0.00 0.00 0.00 0.00 46.02 43.72 3d46 n GLY 308 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3d46 h LEU 309 N 0.00 1.06 -0.72 0.99 5.85 -1.85 -0.35 115.31 120.29 3d46 h LEU 309 Ca 0.00 -0.21 0.09 0.00 0.84 0.00 0.00 57.88 58.60 3d46 h LEU 309 Cb 0.00 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 40.68 3d46 h LEU 309 CO 0.00 1.00 0.37 0.74 -0.34 0.00 0.00 178.44 180.21 3d46 h THR 310 N 1.08 0.86 -0.10 1.05 2.02 -1.92 -1.01 112.91 114.89 3d46 h THR 310 Ca 0.23 -0.22 -0.21 0.00 0.77 0.00 0.00 66.41 66.98 3d46 h THR 310 Cb 0.33 0.18 0.01 0.00 -1.74 0.00 0.00 68.15 66.93 3d46 h THR 310 CO -0.00 0.11 -0.76 0.74 0.37 0.00 0.00 175.52 175.98 3d46 h THR 311 N 0.63 1.30 -0.63 3.16 2.02 -1.71 -3.21 112.91 114.47 3d46 h THR 311 Ca 0.35 -2.00 0.08 0.00 0.77 0.00 0.00 66.41 65.61 3d46 h THR 311 Cb 0.36 2.14 -0.06 0.00 -1.74 0.00 0.00 68.15 68.85 3d46 h THR 311 CO -0.26 0.62 0.29 0.25 0.37 0.00 0.00 175.52 176.80 3d46 h LEU 312 N 0.38 0.38 -1.31 2.58 5.85 -0.45 -0.00 115.31 122.73 3d46 h LEU 312 Ca -0.07 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 3d46 h LEU 312 Cb 1.40 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.40 3d46 h LEU 312 CO 0.15 0.23 0.30 0.58 -0.34 0.00 0.00 178.44 179.37 3d46 h VAL 313 N 0.53 1.17 -0.34 1.05 2.07 -1.26 -0.18 116.25 119.29 3d46 h VAL 313 Ca 0.30 -0.45 -0.15 0.00 0.82 0.00 0.00 66.70 67.22 3d46 h VAL 313 Cb 0.30 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 3d46 h VAL 313 CO -0.25 0.19 -0.39 -0.33 0.02 0.00 0.00 177.57 176.82 3d46 h GLU 314 N 0.78 0.87 -0.70 1.57 5.08 -1.22 -2.61 114.58 118.35 3d46 h GLU 314 Ca 0.20 -0.48 -0.04 0.00 -1.00 0.00 0.00 59.36 58.05 3d46 h GLU 314 Cb 0.03 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 3d46 h GLU 314 CO -0.03 1.12 0.29 0.82 -1.00 0.00 0.00 179.01 180.21 3d46 h ILE 315 N 0.66 1.23 -0.84 3.13 2.04 -0.38 -1.27 117.51 122.10 3d46 h ILE 315 Ca 0.05 -0.72 -0.02 0.00 1.00 0.00 0.00 64.86 65.17 3d46 h ILE 315 Cb 0.98 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 3d46 h ILE 315 CO 0.09 0.29 0.43 0.00 0.00 0.00 0.00 178.15 178.97 3d46 h ALA 316 N 1.32 1.08 -0.52 1.87 0.00 -0.90 -1.11 119.26 121.00 3d46 h ALA 316 Ca 0.24 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 3d46 h ALA 316 Cb 0.17 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3d46 h ALA 316 CO -0.02 0.62 -0.07 0.00 0.00 0.00 0.00 179.25 179.78 3d46 h ALA 317 N 1.23 0.71 0.11 0.00 0.00 -1.05 0.22 119.26 120.48 3d46 h ALA 317 Ca 0.29 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3d46 h ALA 317 Cb 0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3d46 h ALA 317 CO -0.04 0.59 -0.16 1.25 0.00 0.00 0.00 179.25 180.89 3d46 h LEU 318 N 0.83 -0.43 -0.59 0.00 5.85 -0.80 0.15 115.31 120.32 3d46 h LEU 318 Ca 0.14 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 3d46 h LEU 318 Cb 0.62 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 3d46 h LEU 318 CO 0.04 -0.23 0.32 0.00 -0.34 0.00 0.00 178.44 178.23 3d46 h ALA 319 N 0.52 0.76 -0.83 1.25 0.00 -1.10 -2.61 119.26 117.25 3d46 h ALA 319 Ca 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3d46 h ALA 319 Cb 0.33 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3d46 h ALA 319 CO -0.07 0.28 0.46 -0.22 0.00 0.00 0.00 179.25 179.70 3d46 h LYS 320 N 0.80 1.15 0.00 0.00 3.64 -0.62 0.30 116.57 121.85 3d46 h LYS 320 Ca 0.21 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 3d46 h LYS 320 Cb 0.05 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.64 3d46 h LYS 320 CO -0.03 0.84 -0.05 0.66 -2.27 0.00 0.00 179.45 178.60 3d46 h SER 321 N 1.16 0.00 -0.29 4.20 4.64 -0.32 -0.51 113.55 122.43 3d46 h SER 321 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3d46 h SER 321 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3d46 h SER 321 CO -0.05 0.05 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 3d46 n ARG 322 N -3.98 2.26 -1.77 4.77 1.74 -0.65 -4.94 116.66 114.09 3d46 n ARG 322 Ca -0.03 -1.90 -0.08 0.00 -0.77 0.00 0.00 57.85 55.07 3d46 n ARG 322 Cb 0.14 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.08 3d46 n ARG 322 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d46 n GLY 323 N 1.38 0.44 3.77 -0.13 0.00 -0.20 -5.03 105.19 105.43 3d46 n GLY 323 Ca 0.18 -0.60 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 3d46 n GLY 323 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d46 s GLN 324 N -3.69 2.23 0.17 1.61 -0.21 0.00 -5.00 119.66 114.78 3d46 s GLN 324 Ca 0.00 -1.94 0.04 0.00 0.02 0.00 0.00 55.36 53.48 3d46 s GLN 324 Cb 0.00 -1.95 -0.04 0.00 1.00 0.00 0.00 33.01 32.02 3d46 s GLN 324 CO 0.00 -0.23 0.24 -0.51 -2.12 0.00 0.00 175.29 172.66 3d46 s LEU 325 N -3.97 4.13 -0.11 2.90 1.43 -1.25 -3.79 118.68 118.02 3d46 s LEU 325 Ca 0.36 0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.50 3d46 s LEU 325 Cb 0.02 -2.71 0.02 0.00 0.03 0.00 0.00 46.19 43.56 3d46 s LEU 325 CO 0.20 0.04 -0.12 -0.69 0.23 0.00 0.00 176.35 176.01 3d46 s VAL 326 N -1.80 1.27 -0.35 -1.59 1.01 -0.65 -3.36 120.40 114.93 3d46 s VAL 326 Ca 0.33 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.84 3d46 s VAL 326 Cb -0.10 -1.21 0.11 0.00 0.00 0.00 0.00 36.38 35.18 3d46 s VAL 326 CO 0.27 0.40 0.15 -0.69 0.00 0.00 0.00 175.10 175.22 3d46 s VAL 327 N 1.28 1.08 0.71 2.92 1.01 -0.88 -4.24 120.40 122.28 3d46 s VAL 327 Ca -0.02 -1.83 -0.16 0.00 0.00 0.00 0.00 61.98 59.97 3d46 s VAL 327 Cb -0.14 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 3d46 s VAL 327 CO -0.05 -0.76 0.69 -2.65 0.00 0.00 0.00 175.10 172.33 3d46 n PRO 328 N 4.36 0.39 -3.01 2.72 -0.02 -1.26 -4.20 135.00 133.98 3d46 n PRO 328 Ca 0.02 0.18 -0.41 0.00 -2.02 0.00 0.00 63.50 61.27 3d46 n PRO 328 Cb 0.39 -1.96 -0.05 0.00 -0.02 0.00 0.00 33.50 31.86 3d46 n PRO 328 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3d46 s HIS 329 N -1.87 3.40 0.00 6.00 5.65 -0.20 -4.32 115.29 123.96 3d46 s HIS 329 Ca 0.68 1.09 0.00 0.00 0.25 0.00 0.00 55.06 57.09 3d46 s HIS 329 Cb -0.35 -2.90 0.00 0.00 -1.18 0.00 0.00 32.58 28.14 3d46 s HIS 329 CO 0.55 -0.20 0.00 0.41 -0.65 0.00 0.00 174.74 174.85 3d46 n GLY 330 N 3.61 2.37 3.28 1.59 0.00 -1.26 -4.42 105.19 110.36 3d46 n GLY 330 Ca 0.01 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.28 3d46 n GLY 330 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d46 n SER 331 N 2.29 0.00 0.00 1.61 7.64 -1.26 -4.71 113.62 119.19 3d46 n SER 331 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3d46 n SER 331 Cb 0.00 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.95 3d46 n SER 331 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3d46 n SER 332 N 0.00 0.00 0.07 6.43 2.88 -1.26 -1.74 113.62 120.00 3d46 n SER 332 Ca 0.00 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.71 3d46 n SER 332 Cb 0.00 0.00 0.68 0.00 -0.75 0.00 0.00 64.21 64.14 3d46 n SER 332 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 3d46 h VAL 333 N 0.00 0.79 0.00 2.46 -1.51 -1.92 -0.33 116.25 115.73 3d46 h VAL 333 Ca 0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 65.43 3d46 h VAL 333 Cb 0.00 0.80 -0.01 0.00 -2.13 0.00 0.00 31.29 29.96 3d46 h VAL 333 CO 0.00 0.00 -0.19 1.88 -1.23 0.00 0.00 177.57 178.03 3d46 h TYR 334 N 0.00 0.00 0.04 5.19 0.05 -1.69 -2.33 116.97 118.24 3d46 h TYR 334 Ca 0.19 0.00 -0.28 0.00 0.05 0.00 0.00 58.73 58.68 3d46 h TYR 334 Cb 0.75 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.47 3d46 h TYR 334 CO 0.00 0.19 -1.53 0.45 -1.05 0.00 0.00 178.16 176.22 3d46 n SER 335 N -3.98 1.95 -0.16 3.88 2.88 -0.27 -4.22 113.62 113.70 3d46 n SER 335 Ca -0.02 0.35 -0.05 0.00 -1.33 0.00 0.00 58.87 57.82 3d46 n SER 335 Cb 0.27 -0.93 0.02 0.00 -0.75 0.00 0.00 64.21 62.81 3d46 n SER 335 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 3d46 h HIS 336 N -0.64 -0.69 0.00 0.66 3.86 -1.03 0.23 115.15 117.53 3d46 h HIS 336 Ca -0.38 0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 58.88 3d46 h HIS 336 Cb 1.56 0.38 -0.00 0.00 1.06 0.00 0.00 27.41 30.41 3d46 h HIS 336 CO 0.09 -0.34 -0.06 0.45 0.86 0.00 0.00 177.93 178.93 3d46 h HIS 337 N -0.14 0.00 0.00 2.45 -0.00 -1.64 -2.09 115.15 113.72 3d46 h HIS 337 Ca 0.23 0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.56 3d46 h HIS 337 Cb 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.91 3d46 h HIS 337 CO -0.54 0.06 -0.51 0.00 -0.00 0.00 0.00 177.93 176.95 3d46 h ALA 338 N 1.94 0.05 0.00 2.45 0.00 -1.23 -3.31 119.26 119.15 3d46 h ALA 338 Ca -0.00 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 3d46 h ALA 338 Cb 0.17 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 3d46 h ALA 338 CO 0.01 0.41 -0.08 -0.39 0.00 0.00 0.00 179.25 179.20 3d46 h VAL 339 N -1.00 0.54 0.00 0.00 -1.51 -0.66 -1.19 116.25 112.44 3d46 h VAL 339 Ca -0.06 -0.37 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 3d46 h VAL 339 Cb 0.57 1.24 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 3d46 h VAL 339 CO -0.04 0.08 0.00 0.00 -1.23 0.00 0.00 177.57 176.38 3d46 n ILE 340 N -3.69 0.94 0.77 7.19 3.06 -0.79 -1.65 119.36 125.20 3d46 n ILE 340 Ca -0.02 0.29 0.09 0.00 -2.50 0.00 0.00 62.75 60.61 3d46 n ILE 340 Cb 0.19 -1.18 0.06 0.00 0.54 0.00 0.00 39.64 39.25 3d46 n ILE 340 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 3d46 n THR 341 N -2.01 0.00 -3.43 9.51 -2.24 -0.45 -0.31 114.28 115.35 3d46 n THR 341 Ca 0.02 -0.46 -0.39 0.00 -2.27 0.00 0.00 64.05 60.95 3d46 n THR 341 Cb 0.19 1.35 -0.09 0.00 -2.10 0.00 0.00 70.33 69.67 3d46 n THR 341 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3d46 s PHE 342 N -1.64 3.25 0.40 4.78 0.08 -0.66 -4.66 117.98 119.53 3d46 s PHE 342 Ca 0.20 0.38 0.20 0.00 0.12 0.00 0.00 56.93 57.83 3d46 s PHE 342 Cb 0.15 -2.53 1.12 0.00 -0.57 0.00 0.00 43.02 41.19 3d46 s PHE 342 CO 0.28 -0.20 1.97 1.79 -0.10 0.00 0.00 175.22 178.96 3d46 h THR 343 N 5.35 0.89 -0.85 0.64 1.35 -1.92 -2.88 112.91 115.50 3d46 h THR 343 Ca -0.32 -0.78 -0.41 0.00 -0.55 0.00 0.00 66.41 64.35 3d46 h THR 343 Cb 1.17 1.45 -0.24 0.00 -1.73 0.00 0.00 68.15 68.80 3d46 h THR 343 CO 0.63 0.20 0.52 -0.46 -0.25 0.00 0.00 175.52 176.16 3d46 n ASN 344 N -3.91 3.86 -3.36 5.36 6.94 -1.26 -4.43 115.26 118.45 3d46 n ASN 344 Ca -0.02 -3.36 -0.26 0.00 -0.02 0.00 0.00 54.58 50.92 3d46 n ASN 344 Cb 0.29 -0.79 -0.08 0.00 -2.36 0.00 0.00 39.78 36.84 3d46 n ASN 344 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 3d46 n THR 345 N -0.79 0.14 0.30 5.53 -1.04 -1.09 -1.64 114.28 115.70 3d46 n THR 345 Ca 0.50 -4.25 0.11 0.00 -2.04 0.00 0.00 64.05 58.36 3d46 n THR 345 Cb 1.50 -1.95 0.49 0.00 -1.82 0.00 0.00 70.33 68.55 3d46 n THR 345 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3d46 n PRO 346 N 1.65 0.15 -3.60 -2.82 -0.04 -1.26 -4.80 135.00 124.28 3d46 n PRO 346 Ca 0.25 0.49 -0.11 0.00 -0.04 0.00 0.00 63.50 64.09 3d46 n PRO 346 Cb 0.47 -1.86 -0.03 0.00 -0.04 0.00 0.00 33.50 32.04 3d46 n PRO 346 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3d46 s PHE 347 N -3.36 -0.29 0.31 0.54 -0.12 -1.26 -4.59 117.98 109.21 3d46 s PHE 347 Ca 0.02 -0.01 0.03 0.00 -0.05 0.00 0.00 56.93 56.92 3d46 s PHE 347 Cb 0.08 0.42 -0.05 0.00 -0.63 0.00 0.00 43.02 42.83 3d46 s PHE 347 CO 0.30 -0.84 0.08 -1.12 -0.05 0.00 0.00 175.22 173.59 3d46 s SER 348 N -2.81 1.98 -0.06 1.98 0.01 -0.19 -4.85 113.70 109.76 3d46 s SER 348 Ca 0.05 -1.42 -0.03 0.00 1.31 0.00 0.00 55.95 55.86 3d46 s SER 348 Cb -0.00 0.07 -0.04 0.00 0.21 0.00 0.00 66.02 66.26 3d46 s SER 348 CO -0.09 -0.69 0.07 -0.70 0.41 0.00 0.00 173.24 172.24 3d46 s GLU 349 N -3.92 3.14 -0.24 12.44 2.12 -1.26 -1.54 118.70 129.43 3d46 s GLU 349 Ca 0.36 -0.36 0.01 0.00 0.36 0.00 0.00 54.97 55.33 3d46 s GLU 349 Cb 0.08 -2.93 0.06 0.00 0.26 0.00 0.00 34.13 31.60 3d46 s GLU 349 CO 0.15 0.70 -0.05 0.12 -0.54 0.00 0.00 175.26 175.64 3d46 s PHE 350 N -1.05 2.50 -0.41 5.30 5.36 -0.74 -4.44 117.98 124.49 3d46 s PHE 350 Ca 0.18 -1.83 -0.22 0.00 -0.96 0.00 0.00 56.93 54.09 3d46 s PHE 350 Cb -0.12 -1.64 0.02 0.00 -0.34 0.00 0.00 43.02 40.94 3d46 s PHE 350 CO 0.07 -0.79 0.73 -1.17 -1.46 0.00 0.00 175.22 172.60 3d46 s LEU 351 N 1.36 4.28 -0.17 6.12 2.96 -1.26 -1.29 118.68 130.68 3d46 s LEU 351 Ca -0.06 -0.02 -0.34 0.00 -0.22 0.00 0.00 54.13 53.50 3d46 s LEU 351 Cb -0.19 -2.89 -0.11 0.00 0.50 0.00 0.00 46.19 43.50 3d46 s LEU 351 CO -0.06 -0.79 1.99 0.23 -1.32 0.00 0.00 176.35 176.39 3d46 n MET 352 N 6.44 1.89 0.00 1.98 2.81 -0.52 -4.80 117.12 124.92 3d46 n MET 352 Ca 0.01 0.65 0.10 0.00 -1.81 0.00 0.00 57.70 56.65 3d46 n MET 352 Cb 0.48 -2.67 -0.06 0.00 -0.71 0.00 0.00 33.22 30.27 3d46 n MET 352 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3d46 n THR 353 N 5.90 0.00 -2.04 2.03 -2.24 -1.26 -4.87 114.28 111.79 3d46 n THR 353 Ca 0.28 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.63 3d46 n THR 353 Cb 0.30 0.88 -0.03 0.00 -2.10 0.00 0.00 70.33 69.38 3d46 n THR 353 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3d46 s SER 354 N -2.99 6.70 0.31 3.42 0.15 -1.26 -4.90 113.70 115.13 3d46 s SER 354 Ca 0.09 2.35 0.07 0.00 0.70 0.00 0.00 55.95 59.15 3d46 s SER 354 Cb 0.16 -2.56 0.82 0.00 -1.71 0.00 0.00 66.02 62.73 3d46 s SER 354 CO 0.84 -0.82 1.70 -0.65 1.20 0.00 0.00 173.24 175.51 3d46 h PRO 355 N 8.06 0.43 -0.28 5.44 0.11 -1.89 -1.67 132.00 142.19 3d46 h PRO 355 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3d46 h PRO 355 Cb 1.19 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3d46 h PRO 355 CO 0.92 0.28 0.00 -0.40 -0.21 0.00 0.00 178.00 178.59 3d46 n ASP 356 N -5.00 3.40 -2.60 -2.05 5.75 -1.26 -1.31 116.55 113.48 3d46 n ASP 356 Ca 0.25 -2.59 -0.18 0.00 -0.01 0.00 0.00 54.79 52.26 3d46 n ASP 356 Cb 0.73 -0.40 -0.00 0.00 -1.03 0.00 0.00 41.12 40.41 3d46 n ASP 356 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3d46 n SER 358 N -2.05 0.81 -4.32 0.00 3.41 -1.26 -4.74 113.62 105.47 3d46 n SER 358 Ca -0.17 -0.77 -0.17 0.00 -0.26 0.00 0.00 58.87 57.50 3d46 n SER 358 Cb 0.64 1.09 -0.10 0.00 -0.26 0.00 0.00 64.21 65.57 3d46 n SER 358 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3d46 s THR 359 N -2.58 0.80 -0.70 6.66 -4.23 -1.26 -5.06 115.64 109.27 3d46 s THR 359 Ca 0.05 -2.01 -0.03 0.00 -1.18 0.00 0.00 61.69 58.51 3d46 s THR 359 Cb 0.12 -2.45 0.15 0.00 1.34 0.00 0.00 72.50 71.66 3d46 s THR 359 CO 0.66 -0.20 2.50 0.18 -0.54 0.00 0.00 174.62 177.21 3d46 n LEU 360 N -0.43 6.99 -4.71 4.79 4.77 -1.26 -4.59 117.00 122.56 3d46 n LEU 360 Ca -0.03 -4.44 -0.43 0.00 -0.03 0.00 0.00 56.01 51.08 3d46 n LEU 360 Cb 0.65 -1.21 -0.03 0.00 -2.33 0.00 0.00 43.42 40.50 3d46 n LEU 360 CO 0.37 1.81 1.26 -1.14 -1.33 0.00 0.00 177.39 178.35 3d46 n ARG 361 N 0.62 2.57 -1.63 3.23 0.63 -1.26 -4.87 116.66 115.94 3d46 n ARG 361 Ca 0.52 0.92 -0.39 0.00 -0.92 0.00 0.00 57.85 57.97 3d46 n ARG 361 Cb 0.42 -2.71 0.03 0.00 0.45 0.00 0.00 32.46 30.65 3d46 n ARG 361 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 3d46 n PRO 362 N 3.02 1.23 -0.30 -0.14 -0.04 -1.26 -4.48 135.00 133.03 3d46 n PRO 362 Ca 0.13 0.45 0.12 0.00 -0.04 0.00 0.00 63.50 64.16 3d46 n PRO 362 Cb 0.34 -2.18 0.29 0.00 -0.04 0.00 0.00 33.50 31.91 3d46 n PRO 362 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 3d46 h GLN 363 N 1.10 0.36 -0.27 0.54 5.75 -1.87 -1.95 115.11 118.77 3d46 h GLN 363 Ca -0.47 -0.02 -0.11 0.00 -0.15 0.00 0.00 58.65 57.89 3d46 h GLN 363 Cb 1.34 -0.08 -0.07 0.00 1.07 0.00 0.00 27.48 29.74 3d46 h GLN 363 CO 0.54 0.24 -0.10 1.19 -2.65 0.00 0.00 178.83 178.05 3d46 n PHE 364 N -5.07 0.87 -1.63 3.99 3.72 -1.26 -4.89 117.46 113.18 3d46 n PHE 364 Ca 0.21 -1.40 -0.46 0.00 -0.05 0.00 0.00 57.45 55.74 3d46 n PHE 364 Cb 0.62 -0.41 -0.03 0.00 -0.94 0.00 0.00 39.48 38.72 3d46 n PHE 364 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3d46 n ASP 365 N -1.03 2.18 -0.58 4.37 2.03 -0.73 -1.92 116.55 120.87 3d46 n ASP 365 Ca 0.28 1.14 0.09 0.00 0.52 0.00 0.00 54.79 56.82 3d46 n ASP 365 Cb 0.94 -1.34 0.21 0.00 -0.72 0.00 0.00 41.12 40.21 3d46 n ASP 365 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3d46 n PRO 366 N 1.90 2.41 0.28 -0.67 -0.04 -1.26 -0.65 135.00 136.96 3d46 n PRO 366 Ca 0.13 -2.66 0.16 0.00 -0.04 0.00 0.00 63.50 61.10 3d46 n PRO 366 Cb 0.29 -1.67 0.75 0.00 -0.04 0.00 0.00 33.50 32.83 3d46 n PRO 366 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 3d46 h ILE 367 N 1.18 0.19 -3.60 0.52 6.09 -1.72 -3.43 117.51 116.74 3d46 h ILE 367 Ca 0.00 -0.53 -0.64 0.00 -1.37 0.00 0.00 64.86 62.32 3d46 h ILE 367 Cb 1.22 1.44 -0.22 0.00 0.47 0.00 0.00 36.82 39.73 3d46 h ILE 367 CO 0.13 0.06 -0.62 -0.76 -3.07 0.00 0.00 178.15 173.89 3d46 s LEU 368 N -6.46 3.49 0.19 2.19 1.02 -1.25 -1.31 118.68 116.55 3d46 s LEU 368 Ca -0.01 -0.17 -0.29 0.00 0.02 0.00 0.00 54.13 53.69 3d46 s LEU 368 Cb 0.11 -1.93 -0.08 0.00 0.02 0.00 0.00 46.19 44.31 3d46 s LEU 368 CO 0.54 -0.00 0.92 -0.76 0.02 0.00 0.00 176.35 177.07 3d46 s LEU 369 N 1.43 4.60 -1.45 1.79 1.43 0.88 -3.74 118.68 123.62 3d46 s LEU 369 Ca 0.05 1.86 -0.08 0.00 -1.03 0.00 0.00 54.13 54.93 3d46 s LEU 369 Cb -0.15 -3.56 0.02 0.00 0.03 0.00 0.00 46.19 42.54 3d46 s LEU 369 CO 0.04 0.10 0.91 0.47 0.23 0.00 0.00 176.35 178.10 3d46 n ASP 370 N 1.89 -5.97 -4.67 2.29 8.00 -1.26 -3.09 116.55 113.74 3d46 n ASP 370 Ca -0.01 -0.47 -0.43 0.00 0.71 0.00 0.00 54.79 54.59 3d46 n ASP 370 Cb 0.48 -4.76 -0.02 0.00 -0.02 0.00 0.00 41.12 36.80 3d46 n ASP 370 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3d46 s GLU 371 N -6.12 4.27 0.59 -1.24 2.12 -1.25 -4.85 118.70 112.23 3d46 s GLU 371 Ca 0.48 1.75 -0.17 0.00 0.36 0.00 0.00 54.97 57.39 3d46 s GLU 371 Cb -0.22 -3.69 -0.03 0.00 0.26 0.00 0.00 34.13 30.44 3d46 s GLU 371 CO 0.60 -0.62 1.12 -1.25 -0.54 0.00 0.00 175.26 174.56 3d46 s PRO 372 N 3.00 3.13 0.10 4.30 0.04 -1.26 -4.95 135.00 139.37 3d46 s PRO 372 Ca 0.58 1.50 0.04 0.00 0.04 0.00 0.00 61.00 63.16 3d46 s PRO 372 Cb -0.25 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 3d46 s PRO 372 CO 0.20 -1.00 -0.10 0.14 0.04 0.00 0.00 177.00 176.27 3d46 s VAL 373 N -2.03 0.96 0.44 -0.36 -7.23 -1.26 -4.80 120.40 106.13 3d46 s VAL 373 Ca 0.70 -1.67 -0.26 0.00 -1.81 0.00 0.00 61.98 58.94 3d46 s VAL 373 Cb -0.22 -1.40 -0.09 0.00 0.56 0.00 0.00 36.38 35.23 3d46 s VAL 373 CO 0.33 -0.57 1.45 -2.84 -0.31 0.00 0.00 175.10 173.16 3d46 s PRO 374 N -2.86 3.73 -0.20 4.82 0.02 -1.26 -4.87 135.00 134.39 3d46 s PRO 374 Ca 0.06 2.47 0.01 0.00 0.02 0.00 0.00 61.00 63.56 3d46 s PRO 374 Cb -0.02 -2.70 0.02 0.00 0.02 0.00 0.00 34.50 31.82 3d46 s PRO 374 CO 0.00 -0.80 -0.16 0.08 -0.33 0.00 0.00 177.00 175.79 3d46 s VAL 375 N -1.18 2.27 -1.49 3.83 1.01 0.94 -4.53 120.40 121.25 3d46 s VAL 375 Ca 0.60 -0.98 -0.07 0.00 0.00 0.00 0.00 61.98 61.53 3d46 s VAL 375 Cb -0.45 -2.02 0.02 0.00 0.00 0.00 0.00 36.38 33.94 3d46 s VAL 375 CO 0.58 0.44 0.73 -3.20 0.00 0.00 0.00 175.10 173.65 3d46 n ASN 376 N 4.62 -5.76 -0.36 3.32 5.15 -1.25 -1.70 115.26 119.28 3d46 n ASN 376 Ca -0.20 -0.38 -0.05 0.00 -0.60 0.00 0.00 54.58 53.36 3d46 n ASN 376 Cb 0.49 -4.64 -0.02 0.00 -0.53 0.00 0.00 39.78 35.08 3d46 n ASN 376 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3d46 n GLY 377 N -1.58 0.71 3.10 8.20 0.00 -1.14 -4.54 105.19 109.94 3d46 n GLY 377 Ca -0.07 -0.37 -0.08 0.00 0.00 0.00 0.00 46.02 45.50 3d46 n GLY 377 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d46 s ARG 378 N -1.86 0.62 -0.20 1.61 0.52 -0.69 -1.27 118.95 117.69 3d46 s ARG 378 Ca 0.00 -1.05 -0.00 0.00 -0.52 0.00 0.00 55.73 54.16 3d46 s ARG 378 Cb 0.00 0.23 0.05 0.00 0.52 0.00 0.00 34.95 35.75 3d46 s ARG 378 CO 0.00 -0.14 -0.04 0.42 0.02 0.00 0.00 175.30 175.56 3d46 s ILE 379 N -3.49 1.18 0.46 1.52 1.01 -0.60 -0.04 121.20 121.25 3d46 s ILE 379 Ca 0.03 -0.84 -0.22 0.00 0.00 0.00 0.00 60.65 59.61 3d46 s ILE 379 Cb 0.04 -1.44 -0.08 0.00 0.01 0.00 0.00 42.46 41.00 3d46 s ILE 379 CO -0.09 -0.00 1.12 -2.28 0.00 0.00 0.00 174.94 173.69 3d46 s HIS 380 N 1.58 2.95 0.52 3.97 5.65 -1.26 -1.03 115.29 127.67 3d46 s HIS 380 Ca -0.02 1.57 0.20 0.00 0.25 0.00 0.00 55.06 57.06 3d46 s HIS 380 Cb -0.17 -3.26 1.32 0.00 -1.18 0.00 0.00 32.58 29.29 3d46 s HIS 380 CO -0.07 -1.22 2.07 1.57 -0.65 0.00 0.00 174.74 176.44 3d46 h LYS 381 N 1.95 0.01 0.00 2.88 2.10 -1.20 -0.70 116.57 121.62 3d46 h LYS 381 Ca -0.49 -0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.14 3d46 h LYS 381 Cb 1.24 -0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.56 3d46 h LYS 381 CO 0.60 0.01 -0.06 0.66 -2.00 0.00 0.00 179.45 178.66 3d46 h SER 382 N 0.01 0.00 0.33 7.07 4.64 -1.92 -0.19 113.55 123.50 3d46 h SER 382 Ca 0.13 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.42 3d46 h SER 382 Cb 0.50 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3d46 h SER 382 CO -0.00 0.06 -0.17 0.58 -0.87 0.00 0.00 176.83 176.43 3d46 h VAL 383 N 0.00 0.78 -0.21 0.95 2.07 -1.49 -2.15 116.25 116.20 3d46 h VAL 383 Ca -0.00 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.87 3d46 h VAL 383 Cb 0.12 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3d46 h VAL 383 CO 0.01 0.16 0.00 0.18 0.02 0.00 0.00 177.57 177.94 3d46 n LEU 384 N -3.86 2.02 -3.47 2.57 4.77 -0.09 -4.69 117.00 114.26 3d46 n LEU 384 Ca -0.02 -0.86 -0.39 0.00 -0.03 0.00 0.00 56.01 54.72 3d46 n LEU 384 Cb 0.26 -0.14 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 3d46 n LEU 384 CO 0.33 0.43 2.95 0.47 -1.33 0.00 0.00 177.39 180.24 3d46 n ASP 385 N 0.56 6.16 -4.02 -1.43 8.00 -0.81 -4.77 116.55 120.24 3d46 n ASP 385 Ca 0.16 -2.65 -0.08 0.00 0.71 0.00 0.00 54.79 52.93 3d46 n ASP 385 Cb 0.38 -1.52 -0.10 0.00 -0.02 0.00 0.00 41.12 39.86 3d46 n ASP 385 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3d46 s LYS 386 N 2.87 0.49 0.41 -1.24 1.02 -1.26 -4.99 119.74 117.04 3d46 s LYS 386 Ca 0.58 -0.91 -0.26 0.00 0.02 0.00 0.00 55.97 55.39 3d46 s LYS 386 Cb 0.15 0.17 -0.10 0.00 -0.52 0.00 0.00 37.83 37.54 3d46 s LYS 386 CO -0.06 -0.09 1.32 -2.30 -0.92 0.00 0.00 175.35 173.31 3d46 n PRO 387 N 0.79 2.08 0.00 -1.68 -0.02 -1.26 -3.39 135.00 131.52 3d46 n PRO 387 Ca -0.19 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3d46 n PRO 387 Cb 0.58 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 3d46 n PRO 387 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d46 n GLY 388 N 0.73 3.38 0.85 -1.23 0.00 -0.38 -0.78 105.19 107.77 3d46 n GLY 388 Ca 0.06 -0.17 0.07 0.00 0.00 0.00 0.00 46.02 45.98 3d46 n GLY 388 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3d46 n PHE 389 N 13.91 0.64 -1.14 1.61 3.72 -1.26 -1.17 117.46 133.78 3d46 n PHE 389 Ca 0.00 -0.30 -0.05 0.00 -0.05 0.00 0.00 57.45 57.05 3d46 n PHE 389 Cb 0.00 -0.03 -0.02 0.00 -0.94 0.00 0.00 39.48 38.49 3d46 n PHE 389 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d46 n GLY 390 N 1.11 0.59 3.51 1.37 0.00 0.04 -4.90 105.19 106.91 3d46 n GLY 390 Ca 0.15 -0.11 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 3d46 n GLY 390 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d46 s VAL 391 N -1.71 1.36 0.15 1.61 -7.23 -1.26 -4.94 120.40 108.39 3d46 s VAL 391 Ca 0.00 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.25 3d46 s VAL 391 Cb 0.00 -2.79 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 3d46 s VAL 391 CO 0.00 0.00 -0.19 -1.61 -0.31 0.00 0.00 175.10 172.99 3d46 s GLU 392 N -3.83 1.22 -0.01 4.82 2.02 -1.18 -4.96 118.70 116.78 3d46 s GLU 392 Ca 0.34 -1.34 -0.30 0.00 0.02 0.00 0.00 54.97 53.69 3d46 s GLU 392 Cb 0.08 -1.32 -0.04 0.00 0.10 0.00 0.00 34.13 32.96 3d46 s GLU 392 CO 0.16 0.28 1.14 -1.17 0.02 0.00 0.00 175.26 175.69 3d46 s LEU 393 N -2.47 4.32 -0.89 1.80 2.96 -1.26 -0.08 118.68 123.05 3d46 s LEU 393 Ca 0.13 1.82 -0.24 0.00 -0.22 0.00 0.00 54.13 55.62 3d46 s LEU 393 Cb -0.07 -3.57 0.05 0.00 0.50 0.00 0.00 46.19 43.10 3d46 s LEU 393 CO 0.06 -0.48 1.35 0.21 -1.32 0.00 0.00 176.35 176.17 3d46 s ASN 394 N 1.23 6.36 0.00 3.68 3.84 -0.43 -4.82 114.94 124.81 3d46 s ASN 394 Ca 0.55 -1.07 0.10 0.00 0.21 0.00 0.00 52.86 52.65 3d46 s ASN 394 Cb -0.25 -2.55 0.57 0.00 -0.55 0.00 0.00 41.25 38.47 3d46 s ASN 394 CO 0.25 -1.61 1.30 0.54 -2.79 0.00 0.00 177.10 174.79 3d46 n ARG 395 N 8.91 0.92 0.03 0.43 1.74 -1.26 -2.67 116.66 124.76 3d46 n ARG 395 Ca 0.19 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.41 3d46 n ARG 395 Cb 0.50 -1.16 0.48 0.00 -1.02 0.00 0.00 32.46 31.25 3d46 n ARG 395 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3d46 n ASP 396 N -0.66 0.33 -4.80 0.55 8.00 -1.26 -4.74 116.55 113.96 3d46 n ASP 396 Ca 0.07 0.38 -0.34 0.00 0.71 0.00 0.00 54.79 55.62 3d46 n ASP 396 Cb 0.03 -0.41 -0.04 0.00 -0.02 0.00 0.00 41.12 40.68 3d46 n ASP 396 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d46 n HIS 398 N -0.93 3.98 -2.01 0.00 -0.00 -1.26 -4.95 115.22 110.05 3d46 n HIS 398 Ca 0.09 -2.93 -0.41 0.00 0.46 0.00 0.00 57.72 54.93 3d46 n HIS 398 Cb 0.53 -2.59 -0.02 0.00 -0.12 0.00 0.00 29.99 27.79 3d46 n HIS 398 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 3d46 s LEU 399 N 2.99 4.39 -0.05 0.27 1.02 -1.26 -4.79 118.68 121.26 3d46 s LEU 399 Ca 0.50 2.71 0.03 0.00 0.02 0.00 0.00 54.13 57.38 3d46 s LEU 399 Cb 0.10 -3.63 -0.03 0.00 0.02 0.00 0.00 46.19 42.65 3d46 s LEU 399 CO -0.02 -0.68 -0.11 -0.54 0.02 0.00 0.00 176.35 175.01 3d46 s LYS 400 N -0.79 2.56 -0.60 1.70 -0.14 -0.45 -4.92 119.74 117.09 3d46 s LYS 400 Ca 0.57 -0.66 0.04 0.00 -1.36 0.00 0.00 55.97 54.55 3d46 s LYS 400 Cb -0.42 -2.45 0.15 0.00 -1.68 0.00 0.00 37.83 33.43 3d46 s LYS 400 CO 0.47 0.63 0.37 0.50 -0.76 0.00 0.00 175.35 176.56 3d46 s ARG 401 N -0.87 2.23 0.47 1.68 3.52 -1.26 -1.42 118.95 123.30 3d46 s ARG 401 Ca 0.13 -2.89 0.21 0.00 -0.13 0.00 0.00 55.73 53.04 3d46 s ARG 401 Cb -0.11 -3.40 1.16 0.00 -1.56 0.00 0.00 34.95 31.04 3d46 s ARG 401 CO 0.02 -1.18 1.99 -1.00 -0.81 0.00 0.00 175.30 174.32 3d46 h PRO 402 N 6.14 0.00 -5.04 5.12 0.13 -1.95 -3.45 132.00 132.95 3d46 h PRO 402 Ca 0.01 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.81 3d46 h PRO 402 Cb 0.84 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.81 3d46 h PRO 402 CO 0.71 0.19 -0.73 0.71 -0.23 0.00 0.00 178.00 178.65 3d46 s TYR 403 N -4.29 1.16 0.16 1.56 2.02 -1.26 -5.09 117.35 111.62 3d46 s TYR 403 Ca -0.03 -0.70 -0.02 0.00 -0.37 0.00 0.00 57.07 55.96 3d46 s TYR 403 Cb 0.14 -0.62 -0.04 0.00 -0.40 0.00 0.00 41.96 41.05 3d46 s TYR 403 CO 0.64 0.04 0.11 -1.12 -1.57 0.00 0.00 175.55 173.65 3d46 s SER 404 N -2.74 0.22 0.00 2.29 0.01 -1.26 -4.87 113.70 107.34 3d46 s SER 404 Ca 0.10 -1.26 0.00 0.00 1.31 0.00 0.00 55.95 56.11 3d46 s SER 404 Cb -0.01 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.57 3d46 s SER 404 CO 0.00 -0.80 0.00 0.00 0.41 0.00 0.00 173.24 172.86