#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lf9 s ILE 12 N 0.00 5.32 -0.29 2.46 -4.36 -1.26 -5.06 121.20 118.01 1lf9 s ILE 12 Ca 0.00 0.07 -0.17 0.00 -0.26 0.00 0.00 60.65 60.29 1lf9 s ILE 12 Cb 0.00 -3.34 -0.03 0.00 1.25 0.00 0.00 42.46 40.35 1lf9 s ILE 12 CO 0.00 0.56 0.46 -0.75 0.24 0.00 0.00 174.94 175.45 1lf9 s LYS 13 N -1.18 3.93 -0.15 0.37 2.20 -1.26 -4.94 119.74 118.71 1lf9 s LYS 13 Ca 0.17 0.08 -0.02 0.00 -0.36 0.00 0.00 55.97 55.85 1lf9 s LYS 13 Cb -0.12 -3.69 -0.02 0.00 -1.51 0.00 0.00 37.83 32.49 1lf9 s LYS 13 CO 0.06 -0.39 -0.09 0.42 -0.36 0.00 0.00 175.35 174.99 1lf9 s ILE 14 N 2.23 3.29 -0.29 5.43 1.01 -1.26 -0.44 121.20 131.18 1lf9 s ILE 14 Ca 0.18 -0.56 0.02 0.00 0.00 0.00 0.00 60.65 60.28 1lf9 s ILE 14 Cb -0.16 -2.42 0.08 0.00 0.01 0.00 0.00 42.46 39.97 1lf9 s ILE 14 CO 0.10 0.50 0.00 -1.81 0.00 0.00 0.00 174.94 173.73 1lf9 s ASP 15 N 0.59 4.24 0.08 3.58 1.11 -0.56 -4.95 116.67 120.76 1lf9 s ASP 15 Ca -0.06 -1.60 -0.11 0.00 0.18 0.00 0.00 52.55 50.96 1lf9 s ASP 15 Cb -0.15 -1.30 -0.06 0.00 1.07 0.00 0.00 42.92 42.48 1lf9 s ASP 15 CO 0.03 -0.31 0.42 -0.60 1.18 0.00 0.00 175.17 175.89 1lf9 s ARG 16 N 1.25 3.80 -0.12 8.23 3.52 -1.26 -2.14 118.95 132.22 1lf9 s ARG 16 Ca 0.02 0.23 -0.11 0.00 -0.13 0.00 0.00 55.73 55.74 1lf9 s ARG 16 Cb -0.19 -3.00 0.03 0.00 -1.56 0.00 0.00 34.95 30.23 1lf9 s ARG 16 CO -0.10 0.56 0.33 -0.59 -0.81 0.00 0.00 175.30 174.68 1lf9 s PHE 17 N -1.39 -0.37 -0.61 5.12 -0.71 -1.24 -5.05 117.98 113.73 1lf9 s PHE 17 Ca 0.33 0.89 0.04 0.00 -1.04 0.00 0.00 56.93 57.16 1lf9 s PHE 17 Cb -0.14 0.13 0.16 0.00 -1.21 0.00 0.00 43.02 41.96 1lf9 s PHE 17 CO 0.18 -0.18 0.42 1.21 -1.34 0.00 0.00 175.22 175.50 1lf9 s ASN 18 N 0.28 4.06 -0.06 1.98 2.47 -1.26 -4.63 114.94 117.78 1lf9 s ASN 18 Ca -0.01 -3.51 -0.19 0.00 0.42 0.00 0.00 52.86 49.57 1lf9 s ASN 18 Cb -0.03 -1.37 -0.30 0.00 -1.45 0.00 0.00 41.25 38.10 1lf9 s ASN 18 CO -0.01 -0.13 0.77 0.78 -3.72 0.00 0.00 177.10 174.79 1lf9 h ASN 19 N 5.69 0.46 -3.09 -4.21 -0.26 -1.97 -3.45 115.58 108.75 1lf9 h ASN 19 Ca 0.13 -0.91 -0.48 0.00 -0.56 0.00 0.00 56.30 54.48 1lf9 h ASN 19 Cb 0.81 -0.15 -0.41 0.00 -1.06 0.00 0.00 38.32 37.52 1lf9 h ASN 19 CO 0.63 1.51 -0.76 -0.63 -1.06 0.00 0.00 177.43 177.13 1lf9 s ILE 20 N -2.46 0.09 0.14 2.81 1.01 -1.26 -5.05 121.20 116.47 1lf9 s ILE 20 Ca -0.16 -0.34 -0.26 0.00 0.00 0.00 0.00 60.65 59.90 1lf9 s ILE 20 Cb 0.03 -0.74 -0.07 0.00 0.01 0.00 0.00 42.46 41.68 1lf9 s ILE 20 CO 0.81 -0.31 0.81 -0.44 0.00 0.00 0.00 174.94 175.81 1lf9 s SER 21 N 2.05 7.39 0.47 3.58 0.01 -1.26 -0.81 113.70 125.13 1lf9 s SER 21 Ca 0.02 1.64 -0.25 0.00 1.31 0.00 0.00 55.95 58.68 1lf9 s SER 21 Cb -0.16 -2.51 -0.08 0.00 0.21 0.00 0.00 66.02 63.48 1lf9 s SER 21 CO -0.11 0.13 1.42 0.00 0.41 0.00 0.00 173.24 175.09 1lf9 s ALA 22 N -0.78 3.16 0.39 1.44 0.00 0.11 -4.93 121.76 121.14 1lf9 s ALA 22 Ca 0.38 1.46 0.08 0.00 0.00 0.00 0.00 51.96 53.88 1lf9 s ALA 22 Cb -0.23 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.26 1lf9 s ALA 22 CO 0.26 -1.26 0.23 0.14 0.00 0.00 0.00 175.76 175.14 1lf9 s VAL 23 N -1.21 2.69 -1.33 0.00 -7.23 -1.26 -4.76 120.40 107.29 1lf9 s VAL 23 Ca 0.63 -1.58 -0.06 0.00 -1.81 0.00 0.00 61.98 59.16 1lf9 s VAL 23 Cb -0.44 -3.00 0.02 0.00 0.56 0.00 0.00 36.38 33.52 1lf9 s VAL 23 CO 0.55 -0.07 1.03 0.59 -0.31 0.00 0.00 175.10 176.90 1lf9 n ASN 24 N -1.30 -4.09 -2.70 4.85 3.02 -1.26 -4.82 115.26 108.97 1lf9 n ASN 24 Ca -0.00 -0.64 -0.08 0.00 -0.03 0.00 0.00 54.58 53.83 1lf9 n ASN 24 Cb 0.63 -4.77 0.06 0.00 -0.61 0.00 0.00 39.78 35.09 1lf9 n ASN 24 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lf9 n GLY 25 N -1.63 -2.12 0.70 7.41 0.00 -1.26 -4.37 105.19 103.91 1lf9 n GLY 25 Ca -0.12 -1.53 0.09 0.00 0.00 0.00 0.00 46.02 44.46 1lf9 n GLY 25 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1lf9 n PRO 26 N -2.19 1.89 0.00 1.61 -0.04 -1.26 -5.04 135.00 129.97 1lf9 n PRO 26 Ca 0.04 -1.37 0.00 0.00 -0.04 0.00 0.00 63.50 62.13 1lf9 n PRO 26 Cb 0.16 -1.37 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 1lf9 n PRO 26 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1lf9 n GLY 27 N 1.17 1.70 3.78 0.55 0.00 -1.26 -0.81 105.19 110.33 1lf9 n GLY 27 Ca 0.15 -1.76 -0.32 0.00 0.00 0.00 0.00 46.02 44.09 1lf9 n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lf9 s GLU 28 N -3.60 2.77 0.59 1.61 0.41 -0.67 -4.66 118.70 115.15 1lf9 s GLU 28 Ca 0.00 1.26 -0.19 0.00 -0.41 0.00 0.00 54.97 55.63 1lf9 s GLU 28 Cb 0.00 -1.96 -0.03 0.00 -1.78 0.00 0.00 34.13 30.36 1lf9 s GLU 28 CO 0.00 -1.26 1.24 -1.21 -0.49 0.00 0.00 175.26 173.54 1lf9 s GLU 29 N -4.38 2.95 0.51 1.61 2.02 -1.26 -4.75 118.70 115.40 1lf9 s GLU 29 Ca 0.64 1.91 0.00 0.00 0.02 0.00 0.00 54.97 57.55 1lf9 s GLU 29 Cb -0.18 -1.97 -0.00 0.00 0.10 0.00 0.00 34.13 32.08 1lf9 s GLU 29 CO 0.46 -1.25 0.01 -3.47 0.02 0.00 0.00 175.26 171.03 1lf9 n ASP 30 N -1.53 3.24 -1.41 -0.19 -0.08 -1.26 -5.05 116.55 110.27 1lf9 n ASP 30 Ca 0.13 -3.27 0.00 0.00 -1.51 0.00 0.00 54.79 50.14 1lf9 n ASP 30 Cb 0.49 0.43 0.00 0.00 2.34 0.00 0.00 41.12 44.37 1lf9 n ASP 30 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1lf9 n THR 31 N -1.26 0.00 -2.87 5.18 -2.24 -1.26 -1.25 114.28 110.57 1lf9 n THR 31 Ca -0.20 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.55 1lf9 n THR 31 Cb 0.65 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.89 1lf9 n THR 31 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1lf9 n TRP 32 N 0.00 -2.99 -2.85 4.78 7.02 -0.24 -4.53 117.44 118.63 1lf9 n TRP 32 Ca 0.00 -0.25 -0.19 0.00 -1.02 0.00 0.00 57.50 56.04 1lf9 n TRP 32 Cb 0.00 -0.07 0.03 0.00 -2.42 0.00 0.00 31.31 28.85 1lf9 n TRP 32 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1lf9 s ALA 33 N -2.22 4.26 0.36 6.99 0.00 -1.26 -2.85 121.76 127.05 1lf9 s ALA 33 Ca 0.07 -1.56 -0.28 0.00 0.00 0.00 0.00 51.96 50.20 1lf9 s ALA 33 Cb -0.01 -1.81 -0.11 0.00 0.00 0.00 0.00 23.12 21.19 1lf9 s ALA 33 CO 0.05 -0.53 1.48 0.45 0.00 0.00 0.00 175.76 177.20 1lf9 s SER 34 N -4.41 6.40 0.07 0.00 0.15 -1.26 -2.25 113.70 112.39 1lf9 s SER 34 Ca 0.57 3.00 0.28 0.00 0.70 0.00 0.00 55.95 60.49 1lf9 s SER 34 Cb -0.10 -2.66 1.09 0.00 -1.71 0.00 0.00 66.02 62.64 1lf9 s SER 34 CO 0.36 -0.84 1.88 0.00 1.20 0.00 0.00 173.24 175.84 1lf9 n ALA 35 N 0.68 2.32 -2.60 5.45 0.00 -1.26 -4.69 120.51 120.41 1lf9 n ALA 35 Ca 0.02 -0.08 -0.43 0.00 0.00 0.00 0.00 53.44 52.95 1lf9 n ALA 35 Cb 0.39 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 18.35 1lf9 n ALA 35 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1lf9 s GLN 36 N -3.03 3.77 -0.11 0.00 2.00 -1.26 -2.99 119.66 118.04 1lf9 s GLN 36 Ca 0.13 0.62 -0.04 0.00 -2.00 0.00 0.00 55.36 54.07 1lf9 s GLN 36 Cb 0.17 -3.87 -0.04 0.00 0.80 0.00 0.00 33.01 30.07 1lf9 s GLN 36 CO 0.55 -1.26 0.06 0.15 -0.50 0.00 0.00 175.29 174.29 1lf9 s LYS 37 N 4.19 3.27 0.34 1.67 -0.14 -1.26 -4.58 119.74 123.22 1lf9 s LYS 37 Ca 0.46 -0.31 0.22 0.00 -1.36 0.00 0.00 55.97 54.99 1lf9 s LYS 37 Cb -0.09 -2.98 0.19 0.00 -1.68 0.00 0.00 37.83 33.28 1lf9 s LYS 37 CO 0.28 0.67 1.37 1.96 -0.76 0.00 0.00 175.35 178.87 1lf9 h GLN 38 N 5.31 0.00 -1.13 1.68 4.20 -1.10 -3.45 115.11 120.61 1lf9 h GLN 38 Ca -0.50 0.00 0.33 0.00 0.06 0.00 0.00 58.65 58.53 1lf9 h GLN 38 Cb 1.20 0.00 -0.19 0.00 0.30 0.00 0.00 27.48 28.79 1lf9 h GLN 38 CO 0.58 0.02 0.95 0.20 -0.67 0.00 0.00 178.83 179.90 1lf9 s GLY 39 N -4.29 -0.26 0.05 3.46 0.00 -1.24 -4.14 107.32 100.89 1lf9 s GLY 39 Ca 0.04 1.69 -0.05 0.00 0.00 0.00 0.00 44.72 46.40 1lf9 s GLY 39 CO 0.72 0.54 0.07 -1.34 0.00 0.00 0.00 173.10 173.10 1lf9 s VAL 40 N -2.12 0.15 0.09 1.40 -7.23 -1.26 -0.56 120.40 110.87 1lf9 s VAL 40 Ca 0.12 -1.26 -0.26 0.00 -1.81 0.00 0.00 61.98 58.77 1lf9 s VAL 40 Cb 0.00 -1.06 0.09 0.00 0.56 0.00 0.00 36.38 35.97 1lf9 s VAL 40 CO -0.03 -0.69 1.12 -0.83 -0.31 0.00 0.00 175.10 174.35 1lf9 s GLY 41 N -2.37 -0.20 -0.22 2.32 0.00 -0.60 -4.90 107.32 101.34 1lf9 s GLY 41 Ca -0.01 0.19 -0.36 0.00 0.00 0.00 0.00 44.72 44.54 1lf9 s GLY 41 CO -0.07 1.15 1.27 -1.08 0.00 0.00 0.00 173.10 174.37 1lf9 s THR 42 N -2.63 0.00 0.44 0.90 -1.32 -1.26 -1.56 115.64 110.21 1lf9 s THR 42 Ca 0.17 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.41 1lf9 s THR 42 Cb 0.00 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.92 1lf9 s THR 42 CO 0.01 0.00 1.20 0.00 -2.21 0.00 0.00 174.62 173.62 1lf9 s ALA 43 N -2.23 3.06 -1.41 11.08 0.00 -1.26 -4.89 121.76 126.11 1lf9 s ALA 43 Ca 0.10 1.02 -0.10 0.00 0.00 0.00 0.00 51.96 52.98 1lf9 s ALA 43 Cb -0.01 -3.41 0.07 0.00 0.00 0.00 0.00 23.12 19.77 1lf9 s ALA 43 CO -0.04 -0.70 2.31 -1.71 0.00 0.00 0.00 175.76 175.61 1lf9 n ASN 44 N -0.26 6.12 -3.61 0.00 5.15 -1.26 -4.80 115.26 116.60 1lf9 n ASN 44 Ca 0.06 -2.93 -0.08 0.00 -0.60 0.00 0.00 54.58 51.03 1lf9 n ASN 44 Cb 0.47 -1.52 -0.02 0.00 -0.53 0.00 0.00 39.78 38.18 1lf9 n ASN 44 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1lf9 s ASN 45 N 1.68 -0.38 0.00 1.20 6.03 -1.26 -4.93 114.94 117.28 1lf9 s ASN 45 Ca 0.51 -0.22 0.26 0.00 -1.03 0.00 0.00 52.86 52.38 1lf9 s ASN 45 Cb 0.14 0.56 0.72 0.00 -3.03 0.00 0.00 41.25 39.65 1lf9 s ASN 45 CO -0.06 -0.97 1.54 -1.22 -2.03 0.00 0.00 177.10 174.37 1lf9 n TYR 46 N -0.39 0.00 0.08 1.54 4.02 -1.26 -4.32 117.16 116.83 1lf9 n TYR 46 Ca -0.10 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.69 1lf9 n TYR 46 Cb 0.62 -0.12 -0.07 0.00 -0.02 0.00 0.00 39.34 39.75 1lf9 n TYR 46 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1lf9 h VAL 47 N 1.20 0.65 -1.51 -0.72 2.07 -1.92 -3.41 116.25 112.60 1lf9 h VAL 47 Ca 0.00 -1.03 -0.55 0.00 0.82 0.00 0.00 66.70 65.95 1lf9 h VAL 47 Cb 0.51 1.09 -0.09 0.00 -1.52 0.00 0.00 31.29 31.29 1lf9 h VAL 47 CO 0.00 0.17 1.28 -0.55 0.02 0.00 0.00 177.57 178.49 1lf9 s SER 48 N -5.37 6.20 -1.44 0.57 0.15 -1.26 -4.84 113.70 107.72 1lf9 s SER 48 Ca -0.11 -0.97 -0.08 0.00 0.70 0.00 0.00 55.95 55.49 1lf9 s SER 48 Cb 0.00 -2.56 0.04 0.00 -1.71 0.00 0.00 66.02 61.79 1lf9 s SER 48 CO 0.41 -1.77 2.57 0.29 1.20 0.00 0.00 173.24 175.94 1lf9 n LYS 49 N 9.06 4.17 -3.79 5.44 5.02 -1.26 -4.58 118.16 132.22 1lf9 n LYS 49 Ca 0.24 -2.97 -0.15 0.00 -2.02 0.00 0.00 58.31 53.40 1lf9 n LYS 49 Cb 0.50 -2.73 -0.16 0.00 -0.02 0.00 0.00 35.03 32.62 1lf9 n LYS 49 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1lf9 s VAL 50 N 0.27 -0.03 0.04 -0.18 1.01 -1.26 -4.41 120.40 115.84 1lf9 s VAL 50 Ca 0.59 0.20 0.08 0.00 0.00 0.00 0.00 61.98 62.85 1lf9 s VAL 50 Cb 0.18 -0.10 -0.03 0.00 0.00 0.00 0.00 36.38 36.43 1lf9 s VAL 50 CO -0.08 0.09 -0.23 0.26 0.00 0.00 0.00 175.10 175.15 1lf9 s TRP 51 N 1.03 1.97 0.15 5.22 0.51 -0.61 -4.39 118.94 122.83 1lf9 s TRP 51 Ca -0.09 -0.39 0.04 0.00 -2.12 0.00 0.00 56.10 53.55 1lf9 s TRP 51 Cb -0.13 -1.18 -0.04 0.00 -0.81 0.00 0.00 33.47 31.31 1lf9 s TRP 51 CO -0.03 0.10 -0.09 -0.59 -0.51 0.00 0.00 176.95 175.83 1lf9 s PHE 52 N -0.80 1.26 0.05 -1.98 -0.71 -0.60 0.26 117.98 115.47 1lf9 s PHE 52 Ca 0.09 -0.78 0.00 0.00 -1.04 0.00 0.00 56.93 55.20 1lf9 s PHE 52 Cb -0.09 -0.65 -0.03 0.00 -1.21 0.00 0.00 43.02 41.03 1lf9 s PHE 52 CO 0.02 0.06 -0.05 0.95 -1.34 0.00 0.00 175.22 174.86 1lf9 s THR 53 N -3.35 0.34 0.00 -4.49 -4.23 -0.83 -1.56 115.64 101.52 1lf9 s THR 53 Ca 0.17 -1.49 0.07 0.00 -1.18 0.00 0.00 61.69 59.26 1lf9 s THR 53 Cb 0.03 -1.09 -0.02 0.00 1.34 0.00 0.00 72.50 72.76 1lf9 s THR 53 CO 0.01 -0.75 -0.21 -0.76 -0.54 0.00 0.00 174.62 172.37 1lf9 s LEU 54 N -2.36 2.07 -0.24 4.79 1.43 0.27 -0.26 118.68 124.39 1lf9 s LEU 54 Ca -0.01 -0.42 -0.21 0.00 -1.03 0.00 0.00 54.13 52.47 1lf9 s LEU 54 Cb -0.00 -1.05 0.06 0.00 0.03 0.00 0.00 46.19 45.23 1lf9 s LEU 54 CO -0.05 0.23 0.63 0.00 0.23 0.00 0.00 176.35 177.40 1lf9 s ALA 55 N -0.57 -1.59 -1.50 4.21 0.00 0.11 -0.38 121.76 122.04 1lf9 s ALA 55 Ca 0.08 1.88 -0.13 0.00 0.00 0.00 0.00 51.96 53.79 1lf9 s ALA 55 Cb -0.08 -1.10 0.07 0.00 0.00 0.00 0.00 23.12 22.01 1lf9 s ALA 55 CO -0.00 -0.31 1.03 0.09 0.00 0.00 0.00 175.76 176.57 1lf9 n ASN 56 N 3.05 -5.21 0.00 0.00 5.03 -1.26 -1.61 115.26 115.26 1lf9 n ASN 56 Ca -0.15 -0.72 0.00 0.00 0.87 0.00 0.00 54.58 54.58 1lf9 n ASN 56 Cb 0.56 -4.14 0.00 0.00 -1.02 0.00 0.00 39.78 35.18 1lf9 n ASN 56 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1lf9 n GLY 57 N -1.76 0.51 3.24 7.41 0.00 -1.26 -4.09 105.19 109.23 1lf9 n GLY 57 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 1lf9 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lf9 s ALA 58 N -2.23 0.45 0.18 4.61 0.00 -0.64 -4.94 121.76 119.19 1lf9 s ALA 58 Ca 0.00 -1.19 -0.31 0.00 0.00 0.00 0.00 51.96 50.46 1lf9 s ALA 58 Cb 0.00 0.86 -0.10 0.00 0.00 0.00 0.00 23.12 23.88 1lf9 s ALA 58 CO 0.00 -0.56 1.55 0.42 0.00 0.00 0.00 175.76 177.17 1lf9 s ILE 59 N -4.01 2.61 0.00 0.00 1.01 -1.20 0.10 121.20 119.71 1lf9 s ILE 59 Ca 0.21 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.30 1lf9 s ILE 59 Cb 0.05 -3.29 0.00 0.00 0.01 0.00 0.00 42.46 39.24 1lf9 s ILE 59 CO 0.01 0.04 0.00 -1.54 0.00 0.00 0.00 174.94 173.45 1lf9 n SER 60 N 3.66 0.00 -4.77 3.58 3.41 0.64 -2.04 113.62 118.10 1lf9 n SER 60 Ca 0.13 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.35 1lf9 n SER 60 Cb 0.39 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 1lf9 n SER 60 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1lf9 s GLU 61 N 3.00 4.19 -0.04 4.33 8.01 -1.13 -3.78 118.70 133.28 1lf9 s GLU 61 Ca 0.00 1.87 0.04 0.00 0.01 0.00 0.00 54.97 56.90 1lf9 s GLU 61 Cb 0.00 -2.81 -0.00 0.00 -4.31 0.00 0.00 34.13 27.01 1lf9 s GLU 61 CO 0.00 -0.21 -0.17 0.08 0.01 0.00 0.00 175.26 174.97 1lf9 s VAL 62 N -1.35 1.39 -0.00 2.63 1.01 -1.22 -1.97 120.40 120.90 1lf9 s VAL 62 Ca 0.54 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.86 1lf9 s VAL 62 Cb -0.32 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.83 1lf9 s VAL 62 CO 0.41 0.40 -0.10 -0.31 0.00 0.00 0.00 175.10 175.50 1lf9 s TYR 63 N 0.06 2.81 -0.29 5.22 2.02 0.14 -0.58 117.35 126.72 1lf9 s TYR 63 Ca -0.04 -0.09 -0.26 0.00 -0.37 0.00 0.00 57.07 56.32 1lf9 s TYR 63 Cb -0.11 -1.59 0.18 0.00 -0.40 0.00 0.00 41.96 40.03 1lf9 s TYR 63 CO 0.02 0.32 1.35 -0.47 -1.57 0.00 0.00 175.55 175.20 1lf9 s TYR 64 N -0.93 -0.14 -2.22 2.71 6.14 -0.34 -1.57 117.35 121.00 1lf9 s TYR 64 Ca 0.15 0.32 0.28 0.00 0.64 0.00 0.00 57.07 58.46 1lf9 s TYR 64 Cb -0.11 0.46 0.99 0.00 0.42 0.00 0.00 41.96 43.72 1lf9 s TYR 64 CO 0.06 -0.07 1.71 -0.35 0.64 0.00 0.00 175.55 177.53 1lf9 n PRO 65 N 1.53 1.35 -4.46 4.97 -0.04 -1.26 -4.75 135.00 132.33 1lf9 n PRO 65 Ca -0.09 -0.76 -0.23 0.00 -0.04 0.00 0.00 63.50 62.37 1lf9 n PRO 65 Cb 0.57 -1.48 -0.10 0.00 -0.04 0.00 0.00 33.50 32.44 1lf9 n PRO 65 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1lf9 s THR 66 N -2.18 2.32 -1.61 0.52 -4.23 -1.26 -4.83 115.64 104.37 1lf9 s THR 66 Ca 0.34 -2.34 0.17 0.00 -1.18 0.00 0.00 61.69 58.68 1lf9 s THR 66 Cb 0.20 -2.32 0.37 0.00 1.34 0.00 0.00 72.50 72.09 1lf9 s THR 66 CO 0.40 -0.39 1.50 0.00 -0.54 0.00 0.00 174.62 175.58 1lf9 n ILE 67 N -0.61 0.34 -0.74 2.99 3.06 -1.26 -2.06 119.36 121.07 1lf9 n ILE 67 Ca -0.05 0.08 0.07 0.00 -2.50 0.00 0.00 62.75 60.35 1lf9 n ILE 67 Cb 0.61 -0.80 0.19 0.00 0.54 0.00 0.00 39.64 40.17 1lf9 n ILE 67 CO 0.00 0.00 0.00 -0.90 -2.50 0.00 0.00 176.55 173.15 1lf9 n ASP 68 N -1.19 3.21 -3.92 9.51 5.75 -1.26 -4.84 116.55 123.81 1lf9 n ASP 68 Ca 0.10 -2.72 -0.30 0.00 -0.01 0.00 0.00 54.79 51.86 1lf9 n ASP 68 Cb 0.11 -0.41 -0.14 0.00 -1.03 0.00 0.00 41.12 39.66 1lf9 n ASP 68 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1lf9 s THR 69 N -2.28 2.40 0.13 2.12 2.01 -0.88 -4.94 115.64 114.20 1lf9 s THR 69 Ca 0.32 -3.19 -0.29 0.00 0.31 0.00 0.00 61.69 58.84 1lf9 s THR 69 Cb 0.25 -2.67 -0.06 0.00 0.01 0.00 0.00 72.50 70.02 1lf9 s THR 69 CO 0.08 -0.81 0.93 0.00 -0.69 0.00 0.00 174.62 174.13 1lf9 s ALA 70 N -0.17 3.29 0.00 7.40 0.00 -1.26 -1.20 121.76 129.81 1lf9 s ALA 70 Ca 0.17 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.67 1lf9 s ALA 70 Cb -0.26 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1lf9 s ALA 70 CO -0.00 0.04 0.30 -0.25 0.00 0.00 0.00 175.76 175.85 1lf9 n ASP 71 N 2.48 0.59 -3.98 0.00 9.92 0.25 0.13 116.55 125.95 1lf9 n ASP 71 Ca 0.01 -0.82 -0.10 0.00 -0.53 0.00 0.00 54.79 53.34 1lf9 n ASP 71 Cb 0.49 0.27 -0.11 0.00 -0.64 0.00 0.00 41.12 41.12 1lf9 n ASP 71 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1lf9 s VAL 72 N -0.27 0.15 -0.25 2.53 1.01 -1.19 -0.13 120.40 122.25 1lf9 s VAL 72 Ca 0.00 -0.82 -0.13 0.00 0.00 0.00 0.00 61.98 61.02 1lf9 s VAL 72 Cb 0.00 -0.28 -0.11 0.00 0.00 0.00 0.00 36.38 36.00 1lf9 s VAL 72 CO 0.00 -0.42 -0.34 1.17 0.00 0.00 0.00 175.10 175.51 1lf9 n LYS 73 N 1.76 0.55 -3.82 2.72 4.81 -0.21 -3.38 118.16 120.59 1lf9 n LYS 73 Ca -0.22 0.24 -0.10 0.00 -0.87 0.00 0.00 58.31 57.36 1lf9 n LYS 73 Cb 0.56 -1.42 -0.05 0.00 0.02 0.00 0.00 35.03 34.13 1lf9 n LYS 73 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1lf9 s GLU 74 N -2.51 1.21 -0.28 1.64 2.02 -1.21 -2.85 118.70 116.71 1lf9 s GLU 74 Ca -0.36 -0.97 0.00 0.00 0.02 0.00 0.00 54.97 53.66 1lf9 s GLU 74 Cb 0.13 0.44 0.15 0.00 0.10 0.00 0.00 34.13 34.95 1lf9 s GLU 74 CO 0.45 -0.47 0.37 0.42 0.02 0.00 0.00 175.26 176.05 1lf9 s ILE 75 N -3.90 -0.56 0.23 -1.63 1.01 -0.87 -1.49 121.20 114.00 1lf9 s ILE 75 Ca 0.11 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.47 1lf9 s ILE 75 Cb 0.02 -0.95 -0.05 0.00 0.01 0.00 0.00 42.46 41.48 1lf9 s ILE 75 CO -0.04 -0.30 0.08 -1.59 0.00 0.00 0.00 174.94 173.09 1lf9 s LYS 76 N 2.49 1.32 -0.03 2.79 -2.85 -0.99 -3.25 119.74 119.22 1lf9 s LYS 76 Ca 0.10 -1.70 -0.00 0.00 -1.00 0.00 0.00 55.97 53.37 1lf9 s LYS 76 Cb -0.13 -0.18 -0.04 0.00 -2.06 0.00 0.00 37.83 35.42 1lf9 s LYS 76 CO -0.28 -0.28 0.01 -0.06 0.10 0.00 0.00 175.35 174.84 1lf9 s PHE 77 N -3.80 3.14 -0.13 1.78 0.08 -1.26 -0.59 117.98 117.20 1lf9 s PHE 77 Ca 0.35 0.15 0.02 0.00 0.12 0.00 0.00 56.93 57.57 1lf9 s PHE 77 Cb 0.07 -1.73 0.01 0.00 -0.57 0.00 0.00 43.02 40.81 1lf9 s PHE 77 CO 0.12 0.48 -0.19 0.42 -0.10 0.00 0.00 175.22 175.94 1lf9 s ILE 78 N -1.02 1.85 0.11 0.64 -1.09 0.13 -2.68 121.20 119.13 1lf9 s ILE 78 Ca 0.18 -0.85 0.08 0.00 -2.23 0.00 0.00 60.65 57.82 1lf9 s ILE 78 Cb -0.12 -1.65 -0.04 0.00 -1.58 0.00 0.00 42.46 39.07 1lf9 s ILE 78 CO 0.08 0.51 -0.13 0.54 -1.23 0.00 0.00 174.94 174.70 1lf9 s VAL 79 N 0.92 3.15 0.18 2.92 0.11 -0.95 -0.12 120.40 126.61 1lf9 s VAL 79 Ca -0.06 -1.35 -0.13 0.00 -2.93 0.00 0.00 61.98 57.51 1lf9 s VAL 79 Cb -0.15 -2.46 0.01 0.00 -1.53 0.00 0.00 36.38 32.25 1lf9 s VAL 79 CO -0.03 0.12 0.39 0.28 -3.33 0.00 0.00 175.10 172.53 1lf9 s THR 80 N -1.18 0.05 -2.03 5.04 -1.32 -0.56 -2.18 115.64 113.47 1lf9 s THR 80 Ca 0.20 -1.13 0.20 0.00 -1.21 0.00 0.00 61.69 59.75 1lf9 s THR 80 Cb -0.11 -1.74 0.41 0.00 -1.51 0.00 0.00 72.50 69.56 1lf9 s THR 80 CO 0.12 -0.22 1.35 -0.90 -2.21 0.00 0.00 174.62 172.76 1lf9 n ASP 81 N -0.27 3.34 -0.32 8.08 3.85 -1.24 0.52 116.55 130.50 1lf9 n ASP 81 Ca -0.08 -1.95 -0.04 0.00 -0.71 0.00 0.00 54.79 52.01 1lf9 n ASP 81 Cb 0.63 -0.27 -0.02 0.00 -1.35 0.00 0.00 41.12 40.11 1lf9 n ASP 81 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1lf9 n GLY 82 N 1.29 0.51 1.63 6.12 0.00 -1.24 -4.72 105.19 108.78 1lf9 n GLY 82 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1lf9 n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1lf9 n LYS 83 N -0.62 0.00 0.00 1.61 5.02 -1.26 -4.80 118.16 118.11 1lf9 n LYS 83 Ca -0.04 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.24 1lf9 n LYS 83 Cb 0.42 -0.19 -0.00 0.00 -0.02 0.00 0.00 35.03 35.23 1lf9 n LYS 83 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1lf9 n SER 84 N -3.34 0.27 -4.96 4.39 3.41 -1.26 -4.95 113.62 107.18 1lf9 n SER 84 Ca 0.00 0.04 -0.22 0.00 -0.26 0.00 0.00 58.87 58.42 1lf9 n SER 84 Cb 0.04 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 63.87 1lf9 n SER 84 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1lf9 s PHE 85 N -2.03 3.46 -0.42 7.33 -0.12 -1.26 -5.03 117.98 119.91 1lf9 s PHE 85 Ca -0.02 0.01 0.04 0.00 -0.05 0.00 0.00 56.93 56.92 1lf9 s PHE 85 Cb 0.01 -1.59 0.17 0.00 -0.63 0.00 0.00 43.02 40.97 1lf9 s PHE 85 CO 0.02 0.46 0.41 0.08 -0.05 0.00 0.00 175.22 176.14 1lf9 s VAL 86 N -1.92 -0.07 -0.02 -2.49 1.01 -1.26 -3.67 120.40 111.99 1lf9 s VAL 86 Ca 0.34 -1.92 -0.18 0.00 0.00 0.00 0.00 61.98 60.21 1lf9 s VAL 86 Cb -0.10 -0.89 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 1lf9 s VAL 86 CO 0.29 -0.85 0.52 -2.16 0.00 0.00 0.00 175.10 172.89 1lf9 s PRO 87 N 0.57 4.21 -0.25 2.72 0.04 -0.93 -4.94 135.00 136.43 1lf9 s PRO 87 Ca 0.28 0.59 -0.17 0.00 0.04 0.00 0.00 61.00 61.74 1lf9 s PRO 87 Cb -0.03 -3.32 -0.03 0.00 0.04 0.00 0.00 34.50 31.16 1lf9 s PRO 87 CO -0.12 0.44 0.47 0.34 0.04 0.00 0.00 177.00 178.17 1lf9 s ASP 88 N -0.34 6.41 0.52 6.66 3.68 -1.26 -2.25 116.67 130.09 1lf9 s ASP 88 Ca 0.28 0.49 0.22 0.00 2.13 0.00 0.00 52.55 55.66 1lf9 s ASP 88 Cb -0.17 -2.26 1.34 0.00 -1.45 0.00 0.00 42.92 40.37 1lf9 s ASP 88 CO 0.15 -0.23 2.05 1.05 0.13 0.00 0.00 175.17 178.31 1lf9 h GLU 89 N 7.92 0.02 0.00 4.34 4.11 -1.88 0.31 114.58 129.40 1lf9 h GLU 89 Ca -0.31 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 1lf9 h GLU 89 Cb 1.15 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1lf9 h GLU 89 CO 0.70 0.01 0.00 0.25 0.07 0.00 0.00 179.01 180.04 1lf9 n THR 90 N -4.43 0.54 -0.10 -1.06 -2.24 -1.26 -3.01 114.28 102.73 1lf9 n THR 90 Ca 0.06 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.97 1lf9 n THR 90 Cb 0.43 -0.81 0.00 0.00 -2.10 0.00 0.00 70.33 67.84 1lf9 n THR 90 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1lf9 n LYS 91 N -1.38 0.00 0.00 -0.78 2.85 -0.40 -4.87 118.16 113.58 1lf9 n LYS 91 Ca 0.07 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.33 1lf9 n LYS 91 Cb 0.18 -0.04 0.00 0.00 -0.65 0.00 0.00 35.03 34.52 1lf9 n LYS 91 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1lf9 n ASP 92 N 0.00 1.92 -4.08 -5.58 8.00 0.94 -4.99 116.55 112.76 1lf9 n ASP 92 Ca 0.00 -1.94 -0.16 0.00 0.71 0.00 0.00 54.79 53.40 1lf9 n ASP 92 Cb 0.02 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.00 1lf9 n ASP 92 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lf9 s ALA 93 N -0.94 0.78 -0.19 2.24 0.00 -1.16 -0.57 121.76 121.92 1lf9 s ALA 93 Ca 0.00 -0.72 -0.20 0.00 0.00 0.00 0.00 51.96 51.04 1lf9 s ALA 93 Cb 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.04 1lf9 s ALA 93 CO 0.00 0.09 0.60 0.42 0.00 0.00 0.00 175.76 176.87 1lf9 s ILE 94 N -1.02 5.05 -0.17 0.00 -1.09 0.07 -4.83 121.20 119.20 1lf9 s ILE 94 Ca -0.04 1.13 -0.07 0.00 -2.23 0.00 0.00 60.65 59.44 1lf9 s ILE 94 Cb -0.08 -3.92 -0.04 0.00 -1.58 0.00 0.00 42.46 36.84 1lf9 s ILE 94 CO 0.01 0.14 0.07 -0.55 -1.23 0.00 0.00 174.94 173.38 1lf9 s SER 95 N 1.14 5.72 -0.11 3.58 0.15 -1.26 -1.31 113.70 121.62 1lf9 s SER 95 Ca 0.28 0.13 0.02 0.00 0.70 0.00 0.00 55.95 57.08 1lf9 s SER 95 Cb -0.16 -1.95 -0.01 0.00 -1.71 0.00 0.00 66.02 62.19 1lf9 s SER 95 CO 0.11 0.21 -0.18 -0.54 1.20 0.00 0.00 173.24 174.03 1lf9 s LYS 96 N 0.16 3.16 0.14 5.44 -0.14 -0.75 -4.97 119.74 122.77 1lf9 s LYS 96 Ca 0.05 -0.78 0.10 0.00 -1.36 0.00 0.00 55.97 53.98 1lf9 s LYS 96 Cb -0.12 -2.45 -0.04 0.00 -1.68 0.00 0.00 37.83 33.54 1lf9 s LYS 96 CO 0.00 0.23 -0.22 0.54 -0.76 0.00 0.00 175.35 175.14 1lf9 s VAL 97 N 0.27 2.55 -0.08 3.17 0.11 -1.26 -1.37 120.40 123.78 1lf9 s VAL 97 Ca -0.13 -1.69 -0.27 0.00 -2.93 0.00 0.00 61.98 56.96 1lf9 s VAL 97 Cb -0.16 -2.16 0.06 0.00 -1.53 0.00 0.00 36.38 32.58 1lf9 s VAL 97 CO 0.07 0.06 0.63 -1.83 -3.33 0.00 0.00 175.10 170.69 1lf9 s GLU 98 N -2.21 0.95 0.37 1.54 -1.05 -0.65 -4.73 118.70 112.93 1lf9 s GLU 98 Ca 0.17 0.32 -0.08 0.00 -0.15 0.00 0.00 54.97 55.23 1lf9 s GLU 98 Cb -0.10 0.45 -0.06 0.00 -0.44 0.00 0.00 34.13 33.98 1lf9 s GLU 98 CO 0.09 -0.27 0.69 0.15 0.95 0.00 0.00 175.26 176.87 1lf9 s LYS 99 N -0.93 3.71 0.25 -4.83 1.02 -1.26 -0.45 119.74 117.25 1lf9 s LYS 99 Ca -0.09 0.28 -0.04 0.00 0.02 0.00 0.00 55.97 56.14 1lf9 s LYS 99 Cb -0.02 -2.48 0.45 0.00 -0.52 0.00 0.00 37.83 35.26 1lf9 s LYS 99 CO 0.08 0.05 1.75 0.74 -0.92 0.00 0.00 175.35 177.04 1lf9 h PHE 100 N 1.34 0.61 -3.48 3.18 0.05 -1.39 -3.45 116.94 113.81 1lf9 h PHE 100 Ca -0.47 0.03 -0.03 0.00 3.82 0.00 0.00 57.97 61.32 1lf9 h PHE 100 Cb 1.19 -0.15 -0.09 0.00 2.00 0.00 0.00 35.95 38.90 1lf9 h PHE 100 CO 0.59 0.13 -0.04 0.95 -0.18 0.00 0.00 178.31 179.77 1lf9 s THR 101 N -6.01 0.01 -1.05 -1.55 -4.23 -1.26 -5.03 115.64 96.52 1lf9 s THR 101 Ca -0.12 -1.20 0.10 0.00 -1.18 0.00 0.00 61.69 59.29 1lf9 s THR 101 Cb 0.20 -2.01 0.10 0.00 1.34 0.00 0.00 72.50 72.13 1lf9 s THR 101 CO 0.77 -0.05 1.32 0.47 -0.54 0.00 0.00 174.62 176.59 1lf9 n ASP 102 N -0.38 0.00 -1.24 3.99 10.43 -1.26 -2.89 116.55 125.20 1lf9 n ASP 102 Ca -0.04 0.46 -0.02 0.00 2.57 0.00 0.00 54.79 57.75 1lf9 n ASP 102 Cb 0.62 -0.48 0.12 0.00 1.84 0.00 0.00 41.12 43.22 1lf9 n ASP 102 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1lf9 n LYS 103 N -1.48 1.90 -3.74 -1.24 5.02 -1.26 -4.50 118.16 112.87 1lf9 n LYS 103 Ca 0.03 -3.36 -0.13 0.00 -2.02 0.00 0.00 58.31 52.82 1lf9 n LYS 103 Cb 0.12 -1.56 -0.09 0.00 -0.02 0.00 0.00 35.03 33.47 1lf9 n LYS 103 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1lf9 s SER 104 N -3.20 -0.32 -0.76 4.39 1.04 -1.14 -1.91 113.70 111.81 1lf9 s SER 104 Ca 0.40 0.46 -0.02 0.00 0.48 0.00 0.00 55.95 57.26 1lf9 s SER 104 Cb 0.38 0.56 0.27 0.00 0.10 0.00 0.00 66.02 67.33 1lf9 s SER 104 CO -0.05 -0.30 2.22 0.18 0.98 0.00 0.00 173.24 176.26 1lf9 n LEU 105 N 2.03 7.26 -4.66 2.42 4.77 -1.26 -4.55 117.00 123.02 1lf9 n LEU 105 Ca -0.17 -4.65 -0.32 0.00 -0.03 0.00 0.00 56.01 50.83 1lf9 n LEU 105 Cb 0.57 -1.12 -0.09 0.00 -2.33 0.00 0.00 43.42 40.45 1lf9 n LEU 105 CO 0.18 1.76 -0.34 -0.83 -1.33 0.00 0.00 177.39 176.83 1lf9 s GLY 106 N -0.71 1.85 0.06 -0.72 0.00 -1.26 -4.64 107.32 101.90 1lf9 s GLY 106 Ca 0.54 -0.99 0.06 0.00 0.00 0.00 0.00 44.72 44.32 1lf9 s GLY 106 CO -0.36 -0.87 -0.15 -0.19 0.00 0.00 0.00 173.10 171.53 1lf9 s TYR 107 N -1.09 1.32 -0.14 1.90 2.02 -0.49 -1.17 117.35 119.70 1lf9 s TYR 107 Ca 0.20 -0.42 0.02 0.00 -0.37 0.00 0.00 57.07 56.50 1lf9 s TYR 107 Cb -0.11 -0.75 0.01 0.00 -0.40 0.00 0.00 41.96 40.70 1lf9 s TYR 107 CO 0.10 0.07 -0.20 0.21 -1.57 0.00 0.00 175.55 174.16 1lf9 s LYS 108 N -1.54 2.86 -0.08 -0.62 2.20 0.41 -0.26 119.74 122.71 1lf9 s LYS 108 Ca 0.01 -0.79 0.04 0.00 -0.36 0.00 0.00 55.97 54.86 1lf9 s LYS 108 Cb -0.09 -2.34 -0.02 0.00 -1.51 0.00 0.00 37.83 33.87 1lf9 s LYS 108 CO 0.02 -0.04 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.28 1lf9 s LEU 109 N 0.89 2.47 -0.25 5.43 1.43 -0.21 -1.63 118.68 126.81 1lf9 s LEU 109 Ca -0.06 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 1lf9 s LEU 109 Cb -0.15 -1.50 0.07 0.00 0.03 0.00 0.00 46.19 44.64 1lf9 s LEU 109 CO -0.03 0.25 -0.03 -0.69 0.23 0.00 0.00 176.35 176.08 1lf9 s VAL 110 N -0.20 1.55 -0.32 -1.59 1.01 -0.47 0.14 120.40 120.52 1lf9 s VAL 110 Ca -0.01 -1.35 -0.09 0.00 0.00 0.00 0.00 61.98 60.54 1lf9 s VAL 110 Cb -0.13 -1.87 0.01 0.00 0.00 0.00 0.00 36.38 34.38 1lf9 s VAL 110 CO 0.03 -0.19 0.14 0.20 0.00 0.00 0.00 175.10 175.27 1lf9 s ASN 111 N 1.36 5.43 -0.28 3.32 0.01 0.15 -1.80 114.94 123.14 1lf9 s ASN 111 Ca -0.03 -0.69 -0.06 0.00 -0.71 0.00 0.00 52.86 51.37 1lf9 s ASN 111 Cb -0.19 -1.96 -0.00 0.00 0.41 0.00 0.00 41.25 39.51 1lf9 s ASN 111 CO -0.08 -0.23 0.06 -0.89 -1.51 0.00 0.00 177.10 174.45 1lf9 s THR 112 N 1.56 3.95 0.17 1.60 2.01 -0.42 -0.74 115.64 123.77 1lf9 s THR 112 Ca 0.03 -0.56 -0.31 0.00 0.31 0.00 0.00 61.69 61.16 1lf9 s THR 112 Cb -0.18 -2.97 -0.17 0.00 0.01 0.00 0.00 72.50 69.20 1lf9 s THR 112 CO 0.05 0.18 0.81 -0.67 -0.69 0.00 0.00 174.62 174.30 1lf9 n ASP 113 N 4.87 -0.15 0.26 3.53 2.03 -0.80 -0.75 116.55 125.53 1lf9 n ASP 113 Ca -0.15 1.15 0.10 0.00 0.52 0.00 0.00 54.79 56.40 1lf9 n ASP 113 Cb 0.49 -1.05 0.69 0.00 -0.72 0.00 0.00 41.12 40.53 1lf9 n ASP 113 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1lf9 h LYS 114 N 1.95 0.00 -0.61 -0.67 1.57 -1.18 -0.96 116.57 116.67 1lf9 h LYS 114 Ca -0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 1lf9 h LYS 114 Cb 1.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1lf9 h LYS 114 CO 0.61 0.09 0.00 1.63 -0.57 0.00 0.00 179.45 181.22 1lf9 n LYS 115 N -4.05 2.97 -3.55 3.15 5.02 -1.26 -4.96 118.16 115.48 1lf9 n LYS 115 Ca -0.02 -2.19 -0.26 0.00 -2.02 0.00 0.00 58.31 53.81 1lf9 n LYS 115 Cb 0.18 -1.69 0.01 0.00 -0.02 0.00 0.00 35.03 33.51 1lf9 n LYS 115 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lf9 n GLY 116 N 1.05 -0.49 0.12 0.72 0.00 -0.37 -4.89 105.19 101.33 1lf9 n GLY 116 Ca 0.20 0.13 -0.15 0.00 0.00 0.00 0.00 46.02 46.20 1lf9 n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lf9 n ARG 117 N -4.13 0.67 -4.22 1.61 1.74 -1.26 -4.08 116.66 106.99 1lf9 n ARG 117 Ca -0.00 0.11 -0.13 0.00 -0.77 0.00 0.00 57.85 57.07 1lf9 n ARG 117 Cb 0.54 -1.54 -0.10 0.00 -1.02 0.00 0.00 32.46 30.34 1lf9 n ARG 117 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 1lf9 s TYR 118 N -2.52 1.14 -0.07 -1.55 1.13 -1.26 0.16 117.35 114.39 1lf9 s TYR 118 Ca -0.25 -1.16 -0.03 0.00 -1.41 0.00 0.00 57.07 54.22 1lf9 s TYR 118 Cb 0.08 -0.64 0.04 0.00 -1.10 0.00 0.00 41.96 40.34 1lf9 s TYR 118 CO 0.69 -0.38 0.14 0.50 -2.51 0.00 0.00 175.55 174.00 1lf9 s ARG 119 N -4.01 0.06 -0.16 -3.49 3.52 0.86 -1.90 118.95 113.84 1lf9 s ARG 119 Ca 0.28 0.43 0.01 0.00 -0.13 0.00 0.00 55.73 56.32 1lf9 s ARG 119 Cb 0.07 -0.22 0.01 0.00 -1.56 0.00 0.00 34.95 33.25 1lf9 s ARG 119 CO 0.06 -0.22 -0.18 0.42 -0.81 0.00 0.00 175.30 174.57 1lf9 s ILE 120 N 1.56 2.37 -0.10 4.11 1.01 0.09 -0.25 121.20 129.99 1lf9 s ILE 120 Ca -0.05 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.75 1lf9 s ILE 120 Cb -0.12 -1.99 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 1lf9 s ILE 120 CO -0.06 0.53 -0.15 -0.89 0.00 0.00 0.00 174.94 174.37 1lf9 s THR 121 N 0.91 2.90 0.11 2.92 2.01 -0.90 0.31 115.64 123.91 1lf9 s THR 121 Ca -0.04 -0.73 0.08 0.00 0.31 0.00 0.00 61.69 61.30 1lf9 s THR 121 Cb -0.15 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.14 1lf9 s THR 121 CO -0.03 0.55 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.72 1lf9 s LYS 122 N 0.08 1.10 -0.15 4.92 1.02 0.12 -1.86 119.74 124.96 1lf9 s LYS 122 Ca -0.06 -1.20 0.00 0.00 0.02 0.00 0.00 55.97 54.73 1lf9 s LYS 122 Cb -0.15 -1.23 0.03 0.00 -0.52 0.00 0.00 37.83 35.96 1lf9 s LYS 122 CO 0.05 0.27 -0.12 -0.51 -0.92 0.00 0.00 175.35 174.12 1lf9 s ASP 123 N -2.13 2.73 -0.03 2.83 1.11 -0.02 -1.05 116.67 120.11 1lf9 s ASP 123 Ca 0.08 -0.54 0.04 0.00 0.18 0.00 0.00 52.55 52.31 1lf9 s ASP 123 Cb -0.08 -1.11 -0.00 0.00 1.07 0.00 0.00 42.92 42.79 1lf9 s ASP 123 CO 0.04 -0.09 -0.14 -0.63 1.18 0.00 0.00 175.17 175.53 1lf9 s ILE 124 N 1.52 1.14 -0.00 0.77 1.01 0.64 -1.14 121.20 125.14 1lf9 s ILE 124 Ca 0.04 -0.58 -0.28 0.00 0.00 0.00 0.00 60.65 59.83 1lf9 s ILE 124 Cb -0.13 -0.98 0.10 0.00 0.01 0.00 0.00 42.46 41.45 1lf9 s ILE 124 CO -0.10 0.33 1.27 0.72 0.00 0.00 0.00 174.94 177.16 1lf9 s PHE 125 N -0.05 0.02 0.45 3.97 -0.12 -1.06 -1.40 117.98 119.80 1lf9 s PHE 125 Ca -0.00 -0.16 0.06 0.00 -0.05 0.00 0.00 56.93 56.78 1lf9 s PHE 125 Cb -0.09 0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 42.85 1lf9 s PHE 125 CO 0.01 -0.32 0.21 0.95 -0.05 0.00 0.00 175.22 176.02 1lf9 s THR 126 N -2.08 2.02 -0.37 -4.49 -4.23 -1.26 -0.85 115.64 104.38 1lf9 s THR 126 Ca 0.27 -1.68 -0.24 0.00 -1.18 0.00 0.00 61.69 58.86 1lf9 s THR 126 Cb -0.00 -2.70 0.01 0.00 1.34 0.00 0.00 72.50 71.15 1lf9 s THR 126 CO -0.01 0.00 0.85 -0.62 -0.54 0.00 0.00 174.62 174.30 1lf9 s ASP 127 N -3.99 6.60 0.66 3.99 3.68 -0.96 -4.85 116.67 121.81 1lf9 s ASP 127 Ca 0.35 0.43 0.43 0.00 2.13 0.00 0.00 52.55 55.89 1lf9 s ASP 127 Cb 0.02 -2.43 2.34 0.00 -1.45 0.00 0.00 42.92 41.41 1lf9 s ASP 127 CO 0.20 -0.80 2.35 -0.37 0.13 0.00 0.00 175.17 176.68 1lf9 h VAL 128 N 5.80 0.06 0.00 1.11 -1.51 -1.92 -2.84 116.25 116.95 1lf9 h VAL 128 Ca -0.24 0.00 -0.12 0.00 -1.23 0.00 0.00 66.70 65.11 1lf9 h VAL 128 Cb 1.09 0.98 -0.02 0.00 -2.13 0.00 0.00 31.29 31.21 1lf9 h VAL 128 CO 0.94 0.00 -2.10 0.29 -1.23 0.00 0.00 177.57 175.48 1lf9 n LYS 129 N -3.16 0.69 -4.26 5.19 5.02 -1.26 -4.19 118.16 116.20 1lf9 n LYS 129 Ca -0.03 -0.13 -0.14 0.00 -2.02 0.00 0.00 58.31 55.99 1lf9 n LYS 129 Cb 0.09 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.49 1lf9 n LYS 129 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1lf9 s ARG 130 N -3.12 1.23 -1.35 1.97 0.52 -1.07 -4.73 118.95 112.40 1lf9 s ARG 130 Ca -0.08 -1.63 -0.15 0.00 -0.52 0.00 0.00 55.73 53.35 1lf9 s ARG 130 Cb 0.11 -0.19 0.09 0.00 0.52 0.00 0.00 34.95 35.47 1lf9 s ARG 130 CO 0.85 -0.23 1.90 0.09 0.02 0.00 0.00 175.30 177.94 1lf9 n ASN 131 N -0.33 4.60 -3.78 0.23 3.02 -1.26 -4.24 115.26 113.50 1lf9 n ASN 131 Ca -0.03 -2.92 -0.13 0.00 -0.03 0.00 0.00 54.58 51.47 1lf9 n ASN 131 Cb 0.65 -1.65 -0.09 0.00 -0.61 0.00 0.00 39.78 38.08 1lf9 n ASN 131 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1lf9 s SER 132 N 3.19 -0.15 -0.11 6.41 1.04 -1.26 -1.26 113.70 121.55 1lf9 s SER 132 Ca 0.48 0.01 -0.05 0.00 0.48 0.00 0.00 55.95 56.87 1lf9 s SER 132 Cb 0.08 0.30 -0.04 0.00 0.10 0.00 0.00 66.02 66.46 1lf9 s SER 132 CO -0.00 -0.46 0.08 -0.22 0.98 0.00 0.00 173.24 173.62 1lf9 s LEU 133 N -1.42 4.03 -0.04 2.42 2.96 0.23 -2.26 118.68 124.61 1lf9 s LEU 133 Ca -0.13 0.32 0.07 0.00 -0.22 0.00 0.00 54.13 54.17 1lf9 s LEU 133 Cb -0.05 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.66 1lf9 s LEU 133 CO 0.03 0.39 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.57 1lf9 s ILE 134 N -0.92 2.01 -0.17 6.68 1.01 -0.03 -0.85 121.20 128.93 1lf9 s ILE 134 Ca 0.14 -1.07 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 1lf9 s ILE 134 Cb -0.12 -1.69 0.06 0.00 0.01 0.00 0.00 42.46 40.73 1lf9 s ILE 134 CO 0.03 0.56 0.10 -0.32 0.00 0.00 0.00 174.94 175.32 1lf9 s MET 135 N -0.38 0.07 -0.03 2.79 1.75 0.05 -2.56 119.30 120.99 1lf9 s MET 135 Ca 0.03 -0.06 -0.18 0.00 -1.25 0.00 0.00 55.69 54.24 1lf9 s MET 135 Cb -0.12 -1.78 -0.05 0.00 2.84 0.00 0.00 34.83 35.72 1lf9 s MET 135 CO 0.01 -0.67 0.49 0.21 -0.65 0.00 0.00 175.02 174.41 1lf9 s LYS 136 N 2.16 4.19 0.01 4.11 2.20 -0.29 -0.44 119.74 131.66 1lf9 s LYS 136 Ca 0.02 0.52 -0.01 0.00 -0.36 0.00 0.00 55.97 56.14 1lf9 s LYS 136 Cb -0.16 -3.32 -0.01 0.00 -1.51 0.00 0.00 37.83 32.82 1lf9 s LYS 136 CO -0.09 0.43 0.01 0.00 -0.36 0.00 0.00 175.35 175.34 1lf9 s ALA 137 N -0.30 0.00 -0.01 3.13 0.00 0.03 -0.84 121.76 123.77 1lf9 s ALA 137 Ca 0.26 -0.35 0.01 0.00 0.00 0.00 0.00 51.96 51.88 1lf9 s ALA 137 Cb -0.17 0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.05 1lf9 s ALA 137 CO 0.14 -0.13 -0.04 -1.59 0.00 0.00 0.00 175.76 174.14 1lf9 s LYS 138 N -1.09 0.39 -0.15 0.00 -2.85 -0.78 -0.29 119.74 114.99 1lf9 s LYS 138 Ca -0.12 -0.11 -0.06 0.00 -1.00 0.00 0.00 55.97 54.68 1lf9 s LYS 138 Cb -0.07 -0.42 -0.04 0.00 -2.06 0.00 0.00 37.83 35.24 1lf9 s LYS 138 CO -0.00 0.03 0.08 0.12 0.10 0.00 0.00 175.35 175.67 1lf9 s PHE 139 N 0.22 3.34 -0.02 1.78 2.19 0.37 -2.12 117.98 123.74 1lf9 s PHE 139 Ca -0.02 0.24 0.05 0.00 0.33 0.00 0.00 56.93 57.53 1lf9 s PHE 139 Cb -0.05 -1.99 -0.01 0.00 -1.31 0.00 0.00 43.02 39.66 1lf9 s PHE 139 CO -0.00 0.39 -0.17 -1.21 1.83 0.00 0.00 175.22 176.05 1lf9 s GLU 140 N -0.27 1.49 -0.46 10.12 2.02 0.66 -4.86 118.70 127.41 1lf9 s GLU 140 Ca 0.09 -0.61 -0.17 0.00 0.02 0.00 0.00 54.97 54.29 1lf9 s GLU 140 Cb -0.12 -1.40 0.04 0.00 0.10 0.00 0.00 34.13 32.75 1lf9 s GLU 140 CO 0.01 0.34 0.47 0.00 0.02 0.00 0.00 175.26 176.10 1lf9 s ALA 141 N -0.28 3.45 0.33 5.21 0.00 -1.26 -0.10 121.76 129.10 1lf9 s ALA 141 Ca 0.04 -1.73 0.08 0.00 0.00 0.00 0.00 51.96 50.35 1lf9 s ALA 141 Cb -0.08 -3.14 0.57 0.00 0.00 0.00 0.00 23.12 20.47 1lf9 s ALA 141 CO 0.00 -1.73 1.78 -0.07 0.00 0.00 0.00 175.76 175.73 1lf9 h LEU 142 N 9.15 0.24 -7.79 0.00 3.38 -0.53 -3.44 115.31 116.32 1lf9 h LEU 142 Ca -0.27 -0.08 -0.20 0.00 0.09 0.00 0.00 57.88 57.41 1lf9 h LEU 142 Cb 1.11 -0.07 -0.25 0.00 0.09 0.00 0.00 40.66 41.54 1lf9 h LEU 142 CO 0.86 0.55 -0.68 -1.83 0.09 0.00 0.00 178.44 177.43 1lf9 s GLU 143 N -4.35 0.14 1.36 1.13 -1.05 -1.11 -4.97 118.70 109.86 1lf9 s GLU 143 Ca -0.05 -0.18 0.00 0.00 -0.15 0.00 0.00 54.97 54.59 1lf9 s GLU 143 Cb 0.14 0.05 0.00 0.00 -0.44 0.00 0.00 34.13 33.88 1lf9 s GLU 143 CO 0.76 -0.02 0.00 0.41 0.95 0.00 0.00 175.26 177.35 1lf9 n GLY 144 N 2.53 -1.79 3.73 -3.83 0.00 -1.26 -4.90 105.19 99.68 1lf9 n GLY 144 Ca -0.16 -1.44 -0.31 0.00 0.00 0.00 0.00 46.02 44.11 1lf9 n GLY 144 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1lf9 s SER 145 N -4.00 5.32 0.58 1.61 0.15 -1.26 -4.92 113.70 111.18 1lf9 s SER 145 Ca 0.00 -0.05 0.27 0.00 0.70 0.00 0.00 55.95 56.88 1lf9 s SER 145 Cb 0.00 -1.38 1.57 0.00 -1.71 0.00 0.00 66.02 64.49 1lf9 s SER 145 CO 0.00 0.20 2.05 -0.29 1.20 0.00 0.00 173.24 176.40 1lf9 h ILE 146 N 2.86 0.52 0.00 6.45 2.10 -1.90 0.49 117.51 128.03 1lf9 h ILE 146 Ca -0.47 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.47 1lf9 h ILE 146 Cb 1.17 0.80 0.00 0.00 -1.09 0.00 0.00 36.82 37.69 1lf9 h ILE 146 CO 0.62 0.00 0.00 1.41 -1.08 0.00 0.00 178.15 179.10 1lf9 n HIS 147 N -3.92 0.43 1.36 2.19 8.25 -1.26 -2.11 115.22 120.17 1lf9 n HIS 147 Ca 0.04 0.18 0.13 0.00 -0.26 0.00 0.00 57.72 57.81 1lf9 n HIS 147 Cb 0.41 -0.78 0.46 0.00 1.12 0.00 0.00 29.99 31.20 1lf9 n HIS 147 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1lf9 n ASP 148 N -1.90 1.07 -4.41 0.41 8.00 0.17 -4.91 116.55 114.98 1lf9 n ASP 148 Ca 0.02 -1.03 -0.28 0.00 0.71 0.00 0.00 54.79 54.21 1lf9 n ASP 148 Cb 0.18 0.06 -0.12 0.00 -0.02 0.00 0.00 41.12 41.22 1lf9 n ASP 148 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1lf9 s TYR 149 N -2.34 2.33 -0.07 1.24 2.02 -0.90 -4.28 117.35 115.35 1lf9 s TYR 149 Ca 0.29 -0.36 0.05 0.00 -0.37 0.00 0.00 57.07 56.68 1lf9 s TYR 149 Cb 0.20 -1.22 -0.01 0.00 -0.40 0.00 0.00 41.96 40.54 1lf9 s TYR 149 CO 0.46 0.40 -0.24 0.15 -1.57 0.00 0.00 175.55 174.75 1lf9 s LYS 150 N -2.30 2.71 -0.17 -0.62 3.01 0.18 -4.97 119.74 117.59 1lf9 s LYS 150 Ca 0.17 -0.88 -0.03 0.00 -1.01 0.00 0.00 55.97 54.22 1lf9 s LYS 150 Cb -0.09 -2.19 -0.02 0.00 -1.01 0.00 0.00 37.83 34.52 1lf9 s LYS 150 CO 0.08 0.29 -0.07 -1.17 0.51 0.00 0.00 175.35 174.99 1lf9 s LEU 151 N 0.05 2.93 0.04 3.17 2.96 -1.26 -1.49 118.68 125.08 1lf9 s LEU 151 Ca -0.10 -0.30 0.08 0.00 -0.22 0.00 0.00 54.13 53.59 1lf9 s LEU 151 Cb -0.15 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.80 1lf9 s LEU 151 CO 0.06 0.09 -0.23 -0.31 -1.32 0.00 0.00 176.35 174.63 1lf9 s TYR 152 N 0.82 2.06 -0.10 5.38 1.51 0.83 -0.28 117.35 127.57 1lf9 s TYR 152 Ca -0.02 -0.39 -0.01 0.00 -1.01 0.00 0.00 57.07 55.63 1lf9 s TYR 152 Cb -0.15 -1.24 -0.03 0.00 -0.11 0.00 0.00 41.96 40.43 1lf9 s TYR 152 CO 0.01 0.09 -0.04 -1.17 -1.11 0.00 0.00 175.55 173.33 1lf9 s LEU 153 N -1.12 3.29 -0.26 -1.29 2.96 0.69 0.20 118.68 123.16 1lf9 s LEU 153 Ca 0.09 -0.02 0.01 0.00 -0.22 0.00 0.00 54.13 54.00 1lf9 s LEU 153 Cb -0.09 -1.75 0.07 0.00 0.50 0.00 0.00 46.19 44.92 1lf9 s LEU 153 CO 0.02 0.31 -0.03 0.00 -1.32 0.00 0.00 176.35 175.32 1lf9 s ALA 154 N -0.46 2.15 -0.26 5.97 0.00 0.24 -1.45 121.76 127.95 1lf9 s ALA 154 Ca 0.07 -1.62 -0.11 0.00 0.00 0.00 0.00 51.96 50.30 1lf9 s ALA 154 Cb -0.12 -1.55 -0.05 0.00 0.00 0.00 0.00 23.12 21.40 1lf9 s ALA 154 CO 0.02 -1.31 0.19 -0.47 0.00 0.00 0.00 175.76 174.19 1lf9 s TYR 155 N 1.30 3.27 -0.59 0.00 5.04 0.30 -2.35 117.35 124.31 1lf9 s TYR 155 Ca -0.02 0.19 -0.03 0.00 -2.44 0.00 0.00 57.07 54.77 1lf9 s TYR 155 Cb -0.19 -2.35 0.15 0.00 0.35 0.00 0.00 41.96 39.93 1lf9 s TYR 155 CO -0.08 -0.06 0.40 0.34 -1.34 0.00 0.00 175.55 174.80 1lf9 s ASP 156 N 1.44 5.24 0.40 4.32 3.68 -0.55 -0.33 116.67 130.86 1lf9 s ASP 156 Ca 0.08 -2.71 -0.24 0.00 2.13 0.00 0.00 52.55 51.81 1lf9 s ASP 156 Cb -0.15 -1.85 -0.09 0.00 -1.45 0.00 0.00 42.92 39.38 1lf9 s ASP 156 CO 0.08 -0.40 1.06 -2.16 0.13 0.00 0.00 175.17 173.88 1lf9 s PRO 157 N 0.16 4.17 -0.35 4.34 0.04 -1.26 -1.05 135.00 141.04 1lf9 s PRO 157 Ca 0.15 1.53 0.14 0.00 0.04 0.00 0.00 61.00 62.87 1lf9 s PRO 157 Cb -0.21 -2.56 0.41 0.00 0.04 0.00 0.00 34.50 32.18 1lf9 s PRO 157 CO -0.03 -0.14 0.96 0.72 0.04 0.00 0.00 177.00 178.54 1lf9 n HIS 158 N -0.04 0.12 -1.63 0.56 8.25 0.82 -4.73 115.22 118.58 1lf9 n HIS 158 Ca 0.05 -2.90 -0.48 0.00 -0.26 0.00 0.00 57.72 54.12 1lf9 n HIS 158 Cb 0.49 0.02 -0.04 0.00 1.12 0.00 0.00 29.99 31.58 1lf9 n HIS 158 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1lf9 n ILE 159 N -0.01 0.32 -3.53 1.59 5.41 -0.80 -2.83 119.36 119.51 1lf9 n ILE 159 Ca 0.11 -0.08 -0.20 0.00 1.00 0.00 0.00 62.75 63.58 1lf9 n ILE 159 Cb 0.77 -1.16 0.06 0.00 -0.71 0.00 0.00 39.64 38.60 1lf9 n ILE 159 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1lf9 n LYS 160 N 2.57 -4.04 -2.47 0.38 5.02 -1.19 -3.26 118.16 115.18 1lf9 n LYS 160 Ca 0.16 0.71 -0.20 0.00 -2.02 0.00 0.00 58.31 56.95 1lf9 n LYS 160 Cb 0.25 -5.32 -0.01 0.00 -0.02 0.00 0.00 35.03 29.93 1lf9 n LYS 160 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1lf9 n ASN 161 N -3.06 -5.76 -3.66 4.39 3.02 0.12 -4.95 115.26 105.37 1lf9 n ASN 161 Ca -0.21 -0.03 -0.10 0.00 -0.03 0.00 0.00 54.58 54.22 1lf9 n ASN 161 Cb 0.65 -4.79 -0.08 0.00 -0.61 0.00 0.00 39.78 34.95 1lf9 n ASN 161 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lf9 s GLN 162 N -5.11 0.65 0.06 3.52 -2.07 -1.13 -2.43 119.66 113.16 1lf9 s GLN 162 Ca 0.03 1.03 -0.07 0.00 -1.82 0.00 0.00 55.36 54.53 1lf9 s GLN 162 Cb -0.01 0.17 -0.30 0.00 -1.09 0.00 0.00 33.01 31.78 1lf9 s GLN 162 CO 0.04 -0.13 1.09 0.78 -1.32 0.00 0.00 175.29 175.75 1lf9 h GLY 163 N 6.46 0.39 -1.59 2.60 0.00 -1.41 -3.18 103.07 106.35 1lf9 h GLY 163 Ca -0.31 -1.00 -0.51 0.00 0.00 0.00 0.00 47.33 45.51 1lf9 h GLY 163 CO 0.17 0.87 0.36 -1.35 0.00 0.00 0.00 176.54 176.59 1lf9 s SER 164 N -7.26 4.86 -1.52 0.19 1.04 -1.26 -3.92 113.70 105.84 1lf9 s SER 164 Ca -0.05 1.97 -0.13 0.00 0.48 0.00 0.00 55.95 58.22 1lf9 s SER 164 Cb 0.06 -2.54 0.08 0.00 0.10 0.00 0.00 66.02 63.72 1lf9 s SER 164 CO 0.90 -1.80 0.95 0.00 0.98 0.00 0.00 173.24 174.28 1lf9 n TYR 165 N -2.77 -2.26 -3.24 5.02 9.36 -1.13 -4.85 117.16 117.29 1lf9 n TYR 165 Ca 0.10 0.90 -0.39 0.00 3.32 0.00 0.00 57.90 61.83 1lf9 n TYR 165 Cb 0.52 -4.00 -0.06 0.00 -0.63 0.00 0.00 39.34 35.18 1lf9 n TYR 165 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 1lf9 s ASN 166 N -3.41 6.99 -0.20 2.98 0.02 0.65 -4.55 114.94 117.43 1lf9 s ASN 166 Ca 0.60 1.18 -0.11 0.00 -1.02 0.00 0.00 52.86 53.51 1lf9 s ASN 166 Cb -0.30 -2.36 -0.05 0.00 0.02 0.00 0.00 41.25 38.56 1lf9 s ASN 166 CO 0.83 0.16 0.17 -0.70 0.02 0.00 0.00 177.10 177.58 1lf9 s GLU 167 N -0.48 4.20 0.03 -0.60 2.12 -0.09 -0.91 118.70 122.97 1lf9 s GLU 167 Ca 0.30 -0.15 0.06 0.00 0.36 0.00 0.00 54.97 55.54 1lf9 s GLU 167 Cb -0.18 -3.43 -0.02 0.00 0.26 0.00 0.00 34.13 30.75 1lf9 s GLU 167 CO 0.17 0.26 -0.19 0.20 -0.54 0.00 0.00 175.26 175.17 1lf9 s GLY 168 N 0.45 1.00 0.30 -1.50 0.00 0.63 -0.10 107.32 108.08 1lf9 s GLY 168 Ca 0.10 -0.94 -0.19 0.00 0.00 0.00 0.00 44.72 43.69 1lf9 s GLY 168 CO -0.00 -0.86 0.85 -2.52 0.00 0.00 0.00 173.10 170.56 1lf9 s TYR 169 N -0.71 0.02 -0.02 1.90 -0.85 -0.72 -1.58 117.35 115.40 1lf9 s TYR 169 Ca 0.06 -0.56 0.06 0.00 -0.52 0.00 0.00 57.07 56.11 1lf9 s TYR 169 Cb -0.08 0.77 -0.01 0.00 0.38 0.00 0.00 41.96 43.01 1lf9 s TYR 169 CO 0.01 -1.30 -0.20 0.08 -1.52 0.00 0.00 175.55 172.62 1lf9 s VAL 170 N -2.69 1.61 0.26 -3.49 1.01 -1.19 0.22 120.40 116.13 1lf9 s VAL 170 Ca 0.16 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.30 1lf9 s VAL 170 Cb -0.04 -1.35 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 1lf9 s VAL 170 CO 0.08 0.46 0.11 2.30 0.00 0.00 0.00 175.10 178.05 1lf9 n ILE 171 N 2.66 0.00 -3.57 2.22 -5.35 -0.82 -3.70 119.36 110.80 1lf9 n ILE 171 Ca -0.16 -1.55 -0.23 0.00 -0.27 0.00 0.00 62.75 60.54 1lf9 n ILE 171 Cb 0.53 0.59 -0.16 0.00 -1.74 0.00 0.00 39.64 38.86 1lf9 n ILE 171 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1lf9 s LYS 172 N -2.99 0.10 -0.37 6.28 2.20 -0.91 -1.91 119.74 122.14 1lf9 s LYS 172 Ca 0.15 0.05 -0.12 0.00 -0.36 0.00 0.00 55.97 55.70 1lf9 s LYS 172 Cb 0.01 -1.52 0.02 0.00 -1.51 0.00 0.00 37.83 34.82 1lf9 s LYS 172 CO 0.11 -0.64 0.22 0.00 -0.36 0.00 0.00 175.35 174.68 1lf9 s ALA 173 N 2.21 3.33 -1.22 3.13 0.00 -0.44 -1.49 121.76 127.27 1lf9 s ALA 173 Ca 0.04 -1.65 -0.05 0.00 0.00 0.00 0.00 51.96 50.29 1lf9 s ALA 173 Cb -0.16 -2.63 -0.01 0.00 0.00 0.00 0.00 23.12 20.32 1lf9 s ALA 173 CO -0.10 -1.31 0.77 0.09 0.00 0.00 0.00 175.76 175.21 1lf9 n ASN 174 N 5.04 -2.97 -2.72 0.00 4.13 0.42 -1.66 115.26 117.49 1lf9 n ASN 174 Ca -0.12 -0.84 -0.21 0.00 1.68 0.00 0.00 54.58 55.10 1lf9 n ASN 174 Cb 0.47 -4.15 0.01 0.00 -1.54 0.00 0.00 39.78 34.57 1lf9 n ASN 174 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1lf9 n ASN 175 N -3.01 -5.60 -3.96 6.41 3.02 -1.26 -4.97 115.26 105.90 1lf9 n ASN 175 Ca -0.22 -0.13 -0.31 0.00 -0.03 0.00 0.00 54.58 53.90 1lf9 n ASN 175 Cb 0.65 -4.61 -0.15 0.00 -0.61 0.00 0.00 39.78 35.06 1lf9 n ASN 175 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1lf9 s ASN 176 N -2.35 4.03 -0.30 6.41 3.84 -0.66 -5.09 114.94 120.82 1lf9 s ASN 176 Ca 0.15 -1.31 -0.29 0.00 0.21 0.00 0.00 52.86 51.62 1lf9 s ASN 176 Cb -0.07 -1.26 -0.02 0.00 -0.55 0.00 0.00 41.25 39.35 1lf9 s ASN 176 CO 0.18 -0.25 1.79 -1.61 -2.79 0.00 0.00 177.10 174.43 1lf9 s GLU 177 N 1.32 3.42 -0.07 0.43 2.02 -1.26 -1.33 118.70 123.23 1lf9 s GLU 177 Ca -0.04 1.52 0.04 0.00 0.02 0.00 0.00 54.97 56.51 1lf9 s GLU 177 Cb -0.19 -4.18 -0.01 0.00 0.10 0.00 0.00 34.13 29.85 1lf9 s GLU 177 CO -0.07 -1.75 -0.20 -1.64 0.02 0.00 0.00 175.26 171.62 1lf9 s MET 178 N 5.49 2.75 -0.26 1.61 -1.94 -0.80 -4.63 119.30 121.52 1lf9 s MET 178 Ca 0.80 -0.80 -0.24 0.00 -1.71 0.00 0.00 55.69 53.73 1lf9 s MET 178 Cb -0.24 -2.33 -0.00 0.00 2.01 0.00 0.00 34.83 34.27 1lf9 s MET 178 CO 0.33 0.39 0.80 -0.51 -0.01 0.00 0.00 175.02 176.03 1lf9 s LEU 179 N -0.16 4.08 0.09 -0.03 1.02 -0.20 -1.95 118.68 121.52 1lf9 s LEU 179 Ca -0.02 0.89 0.01 0.00 0.02 0.00 0.00 54.13 55.03 1lf9 s LEU 179 Cb -0.14 -3.13 -0.04 0.00 0.02 0.00 0.00 46.19 42.91 1lf9 s LEU 179 CO 0.04 -0.54 0.20 -0.04 0.02 0.00 0.00 176.35 176.03 1lf9 s MET 180 N 2.86 3.31 -0.09 1.70 -1.94 0.13 -0.57 119.30 124.70 1lf9 s MET 180 Ca 0.33 -0.55 -0.08 0.00 -1.71 0.00 0.00 55.69 53.69 1lf9 s MET 180 Cb -0.15 -2.94 0.03 0.00 2.01 0.00 0.00 34.83 33.78 1lf9 s MET 180 CO 0.09 0.57 0.24 0.00 -0.01 0.00 0.00 175.02 175.92 1lf9 s ALA 181 N -1.56 -0.59 0.06 3.03 0.00 -0.74 -1.76 121.76 120.21 1lf9 s ALA 181 Ca 0.34 0.74 -0.14 0.00 0.00 0.00 0.00 51.96 52.90 1lf9 s ALA 181 Cb -0.12 -0.44 0.02 0.00 0.00 0.00 0.00 23.12 22.58 1lf9 s ALA 181 CO 0.27 -0.13 0.33 -1.59 0.00 0.00 0.00 175.76 174.64 1lf9 s LYS 182 N 0.35 0.89 -0.29 0.00 0.00 0.85 -0.71 119.74 120.82 1lf9 s LYS 182 Ca -0.02 -0.57 -0.14 0.00 0.00 0.00 0.00 55.97 55.24 1lf9 s LYS 182 Cb -0.03 0.38 0.11 0.00 0.00 0.00 0.00 37.83 38.29 1lf9 s LYS 182 CO -0.01 -0.30 0.73 0.50 0.00 0.00 0.00 175.35 176.27 1lf9 s ARG 183 N -2.93 0.60 5.46 1.78 3.52 -0.94 -0.91 118.95 125.52 1lf9 s ARG 183 Ca -0.02 1.20 0.00 0.00 -0.13 0.00 0.00 55.73 56.78 1lf9 s ARG 183 Cb 0.00 0.39 0.00 0.00 -1.56 0.00 0.00 34.95 33.79 1lf9 s ARG 183 CO -0.06 -0.15 0.00 -0.25 -0.81 0.00 0.00 175.30 174.03 1lf9 n ASP 184 N 4.66 0.00 -1.26 -2.12 8.00 -1.26 -1.66 116.55 122.91 1lf9 n ASP 184 Ca -0.16 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.42 1lf9 n ASP 184 Cb 0.55 0.00 0.28 0.00 -0.02 0.00 0.00 41.12 41.93 1lf9 n ASP 184 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1lf9 n ASN 185 N 4.31 3.67 -4.40 -2.24 0.23 -1.26 -4.89 115.26 110.68 1lf9 n ASN 185 Ca 0.00 -2.23 -0.34 0.00 -0.53 0.00 0.00 54.58 51.48 1lf9 n ASN 185 Cb 0.00 -0.48 -0.14 0.00 -2.08 0.00 0.00 39.78 37.09 1lf9 n ASN 185 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1lf9 s VAL 186 N -1.59 3.37 0.06 3.53 1.01 -0.66 -4.20 120.40 121.92 1lf9 s VAL 186 Ca 0.41 -0.53 0.08 0.00 0.00 0.00 0.00 61.98 61.93 1lf9 s VAL 186 Cb 0.25 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 1lf9 s VAL 186 CO 0.22 0.50 -0.23 -0.31 0.00 0.00 0.00 175.10 175.28 1lf9 s TYR 187 N 0.56 1.96 0.03 5.22 2.02 0.67 -2.20 117.35 125.61 1lf9 s TYR 187 Ca -0.06 -0.39 0.05 0.00 -0.37 0.00 0.00 57.07 56.31 1lf9 s TYR 187 Cb -0.15 -1.15 -0.02 0.00 -0.40 0.00 0.00 41.96 40.24 1lf9 s TYR 187 CO 0.03 0.14 -0.16 0.95 -1.57 0.00 0.00 175.55 174.94 1lf9 s THR 188 N -0.88 1.25 -0.13 -0.71 -4.23 0.11 -1.43 115.64 109.61 1lf9 s THR 188 Ca 0.09 -0.94 0.01 0.00 -1.18 0.00 0.00 61.69 59.66 1lf9 s THR 188 Cb -0.09 -1.10 0.02 0.00 1.34 0.00 0.00 72.50 72.67 1lf9 s THR 188 CO 0.03 0.14 -0.13 0.00 -0.54 0.00 0.00 174.62 174.11 1lf9 s ALA 189 N -0.70 1.74 -0.25 3.99 0.00 0.88 -1.79 121.76 125.63 1lf9 s ALA 189 Ca 0.04 -0.81 -0.09 0.00 0.00 0.00 0.00 51.96 51.11 1lf9 s ALA 189 Cb -0.07 -0.97 -0.04 0.00 0.00 0.00 0.00 23.12 22.03 1lf9 s ALA 189 CO 0.01 -0.31 0.11 -1.17 0.00 0.00 0.00 175.76 174.41 1lf9 s LEU 190 N 1.39 3.72 0.09 0.00 0.20 0.26 -0.94 118.68 123.40 1lf9 s LEU 190 Ca 0.02 -0.09 0.02 0.00 0.69 0.00 0.00 54.13 54.77 1lf9 s LEU 190 Cb -0.13 -2.01 -0.04 0.00 -0.43 0.00 0.00 46.19 43.58 1lf9 s LEU 190 CO -0.08 -0.01 -0.07 -0.94 -0.29 0.00 0.00 176.35 174.97 1lf9 s SER 191 N 1.48 1.10 -0.04 3.68 1.04 -0.47 -1.03 113.70 119.45 1lf9 s SER 191 Ca 0.06 -0.96 0.05 0.00 0.48 0.00 0.00 55.95 55.58 1lf9 s SER 191 Cb -0.15 0.09 -0.01 0.00 0.10 0.00 0.00 66.02 66.05 1lf9 s SER 191 CO 0.06 -0.44 -0.19 -0.55 0.98 0.00 0.00 173.24 173.09 1lf9 s SER 192 N -2.90 2.37 0.59 7.02 0.15 -1.26 -1.43 113.70 118.24 1lf9 s SER 192 Ca 0.10 -0.38 0.37 0.00 0.70 0.00 0.00 55.95 56.73 1lf9 s SER 192 Cb 0.04 -0.52 1.79 0.00 -1.71 0.00 0.00 66.02 65.62 1lf9 s SER 192 CO -0.04 0.20 2.15 -0.55 1.20 0.00 0.00 173.24 176.20 1lf9 h ASN 193 N 6.00 0.00 -0.16 5.45 -1.07 -1.63 -1.84 115.58 122.33 1lf9 h ASN 193 Ca -0.35 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.02 1lf9 h ASN 193 Cb 1.16 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.41 1lf9 h ASN 193 CO 0.48 0.03 0.00 2.30 0.07 0.00 0.00 177.43 180.30 1lf9 n ILE 194 N -3.20 1.32 -2.66 6.14 -5.35 -1.26 -5.00 119.36 109.35 1lf9 n ILE 194 Ca -0.01 -1.31 0.03 0.00 -0.27 0.00 0.00 62.75 61.19 1lf9 n ILE 194 Cb 0.20 0.28 -0.01 0.00 -1.74 0.00 0.00 39.64 38.38 1lf9 n ILE 194 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1lf9 n GLY 195 N -0.28 -1.91 3.42 3.28 0.00 -0.69 -4.88 105.19 104.13 1lf9 n GLY 195 Ca 0.09 -1.34 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 1lf9 n GLY 195 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1lf9 s TRP 196 N -0.61 2.70 -0.41 1.61 0.52 -1.26 -4.74 118.94 116.75 1lf9 s TRP 196 Ca 0.00 -0.35 0.26 0.00 0.02 0.00 0.00 56.10 56.04 1lf9 s TRP 196 Cb 0.00 -1.68 0.93 0.00 -1.15 0.00 0.00 33.47 31.57 1lf9 s TRP 196 CO 0.00 0.04 1.78 -0.22 0.02 0.00 0.00 176.95 178.56 1lf9 h LYS 197 N 5.77 0.00 -1.03 4.98 3.64 -1.19 -3.46 116.57 125.29 1lf9 h LYS 197 Ca -0.39 0.00 0.25 0.00 -1.27 0.00 0.00 60.65 59.23 1lf9 h LYS 197 Cb 1.17 0.00 -0.28 0.00 -0.41 0.00 0.00 32.23 32.71 1lf9 h LYS 197 CO 0.51 0.00 0.97 0.20 -2.27 0.00 0.00 179.45 178.86 1lf9 s GLY 198 N -3.79 0.13 0.16 5.01 0.00 -1.21 -4.91 107.32 102.71 1lf9 s GLY 198 Ca 0.06 2.94 0.01 0.00 0.00 0.00 0.00 44.72 47.72 1lf9 s GLY 198 CO 0.52 1.18 0.01 -2.52 0.00 0.00 0.00 173.10 172.29 1lf9 s TYR 199 N -0.93 1.13 -0.29 1.90 -0.85 -1.26 -0.00 117.35 117.05 1lf9 s TYR 199 Ca 0.09 -1.06 -0.22 0.00 -0.52 0.00 0.00 57.07 55.36 1lf9 s TYR 199 Cb -0.01 -0.65 0.15 0.00 0.38 0.00 0.00 41.96 41.83 1lf9 s TYR 199 CO -0.09 -0.27 1.14 0.45 -1.52 0.00 0.00 175.55 175.25 1lf9 s SER 200 N -3.15 -0.33 -0.38 -0.18 0.15 0.24 -4.46 113.70 105.59 1lf9 s SER 200 Ca 0.24 0.60 -0.00 0.00 0.70 0.00 0.00 55.95 57.49 1lf9 s SER 200 Cb 0.06 0.80 0.11 0.00 -1.71 0.00 0.00 66.02 65.28 1lf9 s SER 200 CO 0.03 -0.10 0.15 -0.63 1.20 0.00 0.00 173.24 173.89 1lf9 s ILE 201 N 0.54 2.90 0.45 6.45 1.01 0.66 -0.53 121.20 132.69 1lf9 s ILE 201 Ca 0.00 -2.17 0.06 0.00 0.00 0.00 0.00 60.65 58.54 1lf9 s ILE 201 Cb -0.04 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.35 1lf9 s ILE 201 CO -0.11 -0.66 0.18 -0.83 0.00 0.00 0.00 174.94 173.52 1lf9 s GLY 202 N 1.47 2.47 -0.02 6.18 0.00 -0.98 -4.46 107.32 111.98 1lf9 s GLY 202 Ca 0.09 -1.71 -0.23 0.00 0.00 0.00 0.00 44.72 42.87 1lf9 s GLY 202 CO -0.06 -1.98 0.70 -0.19 0.00 0.00 0.00 173.10 171.57 1lf9 s TYR 203 N -2.68 3.65 -0.12 1.90 2.02 -1.26 -1.23 117.35 119.62 1lf9 s TYR 203 Ca 0.34 1.31 -0.39 0.00 -0.37 0.00 0.00 57.07 57.96 1lf9 s TYR 203 Cb 0.03 -2.77 -0.17 0.00 -0.40 0.00 0.00 41.96 38.65 1lf9 s TYR 203 CO 0.19 0.20 1.51 0.98 -1.57 0.00 0.00 175.55 176.86 1lf9 n TYR 204 N 3.24 1.68 -1.67 2.71 9.36 0.92 -1.21 117.16 132.18 1lf9 n TYR 204 Ca -0.03 0.68 -0.21 0.00 3.32 0.00 0.00 57.90 61.66 1lf9 n TYR 204 Cb 0.51 -2.35 -0.08 0.00 -0.63 0.00 0.00 39.34 36.78 1lf9 n TYR 204 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1lf9 n LYS 205 N 3.75 -1.48 0.06 2.98 5.02 -1.26 -1.68 118.16 125.56 1lf9 n LYS 205 Ca 0.23 1.21 0.00 0.00 -2.02 0.00 0.00 58.31 57.73 1lf9 n LYS 205 Cb 0.13 -5.63 0.00 0.00 -0.02 0.00 0.00 35.03 29.52 1lf9 n LYS 205 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1lf9 n VAL 206 N -2.52 0.82 -2.37 -0.18 0.31 -0.35 -4.86 118.33 109.17 1lf9 n VAL 206 Ca -0.21 0.27 0.01 0.00 -0.01 0.00 0.00 64.34 64.40 1lf9 n VAL 206 Cb 0.69 -1.27 -0.00 0.00 -0.91 0.00 0.00 33.84 32.35 1lf9 n VAL 206 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1lf9 n ASN 207 N -3.33 0.44 -4.42 4.52 0.23 -0.91 -4.88 115.26 106.91 1lf9 n ASN 207 Ca 0.00 -2.00 -0.29 0.00 -0.53 0.00 0.00 54.58 51.75 1lf9 n ASN 207 Cb 0.00 -0.13 0.16 0.00 -2.08 0.00 0.00 39.78 37.73 1lf9 n ASN 207 CO 0.00 0.00 0.00 1.51 -0.93 0.00 0.00 177.26 177.84 1lf9 s ASP 208 N -1.75 3.27 0.24 0.53 3.84 -1.12 -4.45 116.67 117.23 1lf9 s ASP 208 Ca 0.24 0.59 -0.05 0.00 -0.00 0.00 0.00 52.55 53.33 1lf9 s ASP 208 Cb 0.28 -0.88 0.40 0.00 -1.38 0.00 0.00 42.92 41.34 1lf9 s ASP 208 CO -0.12 -2.67 1.77 -0.29 -0.00 0.00 0.00 175.17 173.86 1lf9 h ILE 209 N -1.59 0.79 -0.08 2.11 6.09 -1.89 0.19 117.51 123.13 1lf9 h ILE 209 Ca -0.46 -0.20 0.02 0.00 -1.37 0.00 0.00 64.86 62.84 1lf9 h ILE 209 Cb 1.29 0.15 -0.01 0.00 0.47 0.00 0.00 36.82 38.72 1lf9 h ILE 209 CO 0.50 0.11 -0.01 -0.03 -3.07 0.00 0.00 178.15 175.64 1lf9 h MET 210 N 0.58 0.01 -0.45 2.19 4.05 -1.97 -0.07 114.93 119.27 1lf9 h MET 210 Ca 0.39 -0.00 -0.13 0.00 -0.28 0.00 0.00 59.70 59.68 1lf9 h MET 210 Cb 0.48 -0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.26 1lf9 h MET 210 CO -0.31 0.01 -0.21 1.15 0.23 0.00 0.00 176.91 177.77 1lf9 h THR 211 N 0.01 1.27 -0.73 -0.77 2.02 -1.82 -2.10 112.91 110.79 1lf9 h THR 211 Ca 0.04 -1.37 0.05 0.00 0.77 0.00 0.00 66.41 65.90 1lf9 h THR 211 Cb 0.05 1.18 -0.05 0.00 -1.74 0.00 0.00 68.15 67.59 1lf9 h THR 211 CO -0.08 0.47 0.43 -0.78 0.37 0.00 0.00 175.52 175.93 1lf9 h ASP 212 N 0.79 0.67 0.64 4.18 -0.00 -0.71 -1.44 116.42 120.55 1lf9 h ASP 212 Ca 0.10 0.02 -0.10 0.00 -0.00 0.00 0.00 57.03 57.05 1lf9 h ASP 212 Cb 0.79 -0.12 -0.01 0.00 -0.00 0.00 0.00 39.33 39.99 1lf9 h ASP 212 CO 0.07 0.44 -0.47 -0.07 -0.00 0.00 0.00 179.24 179.21 1lf9 h LEU 213 N 0.81 0.00 -0.37 2.28 3.38 -0.86 -0.59 115.31 119.95 1lf9 h LEU 213 Ca 0.31 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.20 1lf9 h LEU 213 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1lf9 h LEU 213 CO -0.16 0.47 -0.42 0.44 0.09 0.00 0.00 178.44 178.86 1lf9 h ASP 214 N 0.00 0.00 0.37 -0.43 3.45 -0.65 0.47 116.42 119.62 1lf9 h ASP 214 Ca -0.00 0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.30 1lf9 h ASP 214 Cb 0.91 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.65 1lf9 h ASP 214 CO 0.06 0.42 -1.77 1.21 -1.57 0.00 0.00 179.24 177.59 1lf9 n GLU 215 N -3.31 0.65 0.00 3.56 2.13 -0.62 -4.59 120.64 118.46 1lf9 n GLU 215 Ca 0.01 0.04 0.00 0.00 0.66 0.00 0.00 57.16 57.87 1lf9 n GLU 215 Cb 0.64 -1.66 0.00 0.00 0.27 0.00 0.00 31.44 30.69 1lf9 n GLU 215 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1lf9 n ASN 216 N -2.66 0.10 -1.19 4.31 3.02 -0.25 -5.00 115.26 113.60 1lf9 n ASN 216 Ca -0.13 -0.41 -0.16 0.00 -0.03 0.00 0.00 54.58 53.86 1lf9 n ASN 216 Cb 0.81 0.45 -0.07 0.00 -0.61 0.00 0.00 39.78 40.37 1lf9 n ASN 216 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1lf9 n LYS 217 N -0.45 -1.33 -3.61 3.52 4.76 0.16 -4.89 118.16 116.32 1lf9 n LYS 217 Ca 0.00 1.04 -0.05 0.00 -2.87 0.00 0.00 58.31 56.43 1lf9 n LYS 217 Cb 0.02 -5.31 -0.04 0.00 -1.84 0.00 0.00 35.03 27.86 1lf9 n LYS 217 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 1lf9 s GLN 218 N -3.28 0.30 0.11 1.97 -2.07 -1.26 -3.65 119.66 111.78 1lf9 s GLN 218 Ca 0.00 -0.00 -0.32 0.00 -1.82 0.00 0.00 55.36 53.22 1lf9 s GLN 218 Cb 0.00 0.14 -0.11 0.00 -1.09 0.00 0.00 33.01 31.95 1lf9 s GLN 218 CO 0.00 -0.11 1.81 -1.33 -1.32 0.00 0.00 175.29 174.34 1lf9 n MET 219 N 0.34 2.65 -0.01 9.60 2.81 -1.26 -4.46 117.12 126.80 1lf9 n MET 219 Ca -0.03 0.97 -0.02 0.00 -1.81 0.00 0.00 57.70 56.81 1lf9 n MET 219 Cb 0.58 -2.84 -0.01 0.00 -0.71 0.00 0.00 33.22 30.24 1lf9 n MET 219 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1lf9 n THR 220 N 4.60 0.12 -3.18 2.03 -1.04 -1.26 -5.04 114.28 110.51 1lf9 n THR 220 Ca 0.18 -0.04 -0.33 0.00 -2.04 0.00 0.00 64.05 61.83 1lf9 n THR 220 Cb 0.35 -0.92 -0.06 0.00 -1.82 0.00 0.00 70.33 67.88 1lf9 n THR 220 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1lf9 s LYS 221 N -2.04 3.99 -0.31 -2.82 3.01 -1.26 -5.01 119.74 115.29 1lf9 s LYS 221 Ca -0.03 0.62 0.18 0.00 -1.01 0.00 0.00 55.97 55.74 1lf9 s LYS 221 Cb 0.01 -2.48 0.47 0.00 -1.01 0.00 0.00 37.83 34.81 1lf9 s LYS 221 CO 0.04 0.19 0.99 0.72 0.51 0.00 0.00 175.35 177.81 1lf9 n HIS 222 N -0.28 1.03 -1.94 3.18 8.25 -1.26 -4.72 115.22 119.48 1lf9 n HIS 222 Ca 0.03 -2.65 -0.39 0.00 -0.26 0.00 0.00 57.72 54.45 1lf9 n HIS 222 Cb 0.53 -0.28 0.02 0.00 1.12 0.00 0.00 29.99 31.38 1lf9 n HIS 222 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1lf9 s TYR 223 N -3.10 2.56 -0.13 4.41 2.02 -1.26 -4.78 117.35 117.07 1lf9 s TYR 223 Ca 0.27 1.39 0.15 0.00 -0.37 0.00 0.00 57.07 58.50 1lf9 s TYR 223 Cb 0.44 -3.72 0.31 0.00 -0.40 0.00 0.00 41.96 38.59 1lf9 s TYR 223 CO 0.02 -2.47 1.16 -0.40 -1.57 0.00 0.00 175.55 172.29 1lf9 n ASP 224 N -0.45 1.70 -3.64 2.29 3.85 0.01 -0.24 116.55 120.06 1lf9 n ASP 224 Ca 0.07 -3.13 -0.06 0.00 -0.71 0.00 0.00 54.79 50.96 1lf9 n ASP 224 Cb 0.44 -0.42 -0.07 0.00 -1.35 0.00 0.00 41.12 39.72 1lf9 n ASP 224 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 1lf9 s SER 225 N -2.69 -0.46 -0.09 -1.12 0.15 -1.25 -3.18 113.70 105.06 1lf9 s SER 225 Ca 0.30 0.81 -0.31 0.00 0.70 0.00 0.00 55.95 57.46 1lf9 s SER 225 Cb 0.29 1.00 0.12 0.00 -1.71 0.00 0.00 66.02 65.72 1lf9 s SER 225 CO -0.03 -0.13 1.01 0.00 1.20 0.00 0.00 173.24 175.29 1lf9 s ALA 226 N 0.75 -1.92 -0.15 5.45 0.00 -0.61 0.05 121.76 125.32 1lf9 s ALA 226 Ca -0.02 1.28 -0.07 0.00 0.00 0.00 0.00 51.96 53.15 1lf9 s ALA 226 Cb -0.04 0.09 0.07 0.00 0.00 0.00 0.00 23.12 23.23 1lf9 s ALA 226 CO -0.11 -0.61 0.34 0.50 0.00 0.00 0.00 175.76 175.88 1lf9 s ARG 227 N -2.65 0.27 0.00 0.00 3.52 -1.26 -0.27 118.95 118.57 1lf9 s ARG 227 Ca 0.06 0.78 0.00 0.00 -0.13 0.00 0.00 55.73 56.44 1lf9 s ARG 227 Cb -0.01 0.04 0.00 0.00 -1.56 0.00 0.00 34.95 33.42 1lf9 s ARG 227 CO -0.06 -0.22 0.00 0.41 -0.81 0.00 0.00 175.30 174.62 1lf9 n GLY 228 N 4.81 0.45 3.48 8.12 0.00 -0.08 -4.77 105.19 117.21 1lf9 n GLY 228 Ca -0.16 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.24 1lf9 n GLY 228 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lf9 s ASN 229 N -4.00 6.21 0.29 1.61 -0.87 0.01 -0.25 114.94 117.95 1lf9 s ASN 229 Ca 0.00 -0.78 0.10 0.00 -1.57 0.00 0.00 52.86 50.62 1lf9 s ASN 229 Cb 0.00 -2.44 -0.05 0.00 -0.02 0.00 0.00 41.25 38.74 1lf9 s ASN 229 CO 0.00 -1.43 -0.08 0.27 -2.57 0.00 0.00 177.10 173.30 1lf9 s ILE 230 N 4.20 2.81 -0.05 0.60 -4.36 -1.26 -0.06 121.20 123.07 1lf9 s ILE 230 Ca 0.25 -2.13 -0.01 0.00 -0.26 0.00 0.00 60.65 58.51 1lf9 s ILE 230 Cb -0.15 -2.62 0.03 0.00 1.25 0.00 0.00 42.46 40.97 1lf9 s ILE 230 CO 0.13 -0.33 0.00 -0.63 0.24 0.00 0.00 174.94 174.35 1lf9 s ILE 231 N -2.46 0.30 -0.44 8.37 1.01 -0.37 -4.23 121.20 123.39 1lf9 s ILE 231 Ca 0.32 0.12 -0.20 0.00 0.00 0.00 0.00 60.65 60.89 1lf9 s ILE 231 Cb -0.04 -0.44 0.03 0.00 0.01 0.00 0.00 42.46 42.02 1lf9 s ILE 231 CO 0.18 0.22 0.58 -1.61 0.00 0.00 0.00 174.94 174.31 1lf9 s GLU 232 N 1.64 3.21 0.11 2.79 2.02 0.55 -2.32 118.70 126.70 1lf9 s GLU 232 Ca -0.00 -0.52 0.05 0.00 0.02 0.00 0.00 54.97 54.51 1lf9 s GLU 232 Cb -0.13 -3.97 -0.04 0.00 0.10 0.00 0.00 34.13 30.09 1lf9 s GLU 232 CO -0.03 -0.98 0.02 0.20 0.02 0.00 0.00 175.26 174.48 1lf9 s GLY 233 N 2.00 1.88 -0.20 -1.39 0.00 0.31 -0.54 107.32 109.37 1lf9 s GLY 233 Ca 0.19 -1.15 -0.18 0.00 0.00 0.00 0.00 44.72 43.58 1lf9 s GLY 233 CO 0.17 -1.14 0.54 0.00 0.00 0.00 0.00 173.10 172.67 1lf9 s ALA 234 N -1.42 -1.35 0.01 3.20 0.00 -0.53 -0.59 121.76 121.08 1lf9 s ALA 234 Ca 0.27 1.57 -0.17 0.00 0.00 0.00 0.00 51.96 53.63 1lf9 s ALA 234 Cb -0.11 -0.92 -0.06 0.00 0.00 0.00 0.00 23.12 22.03 1lf9 s ALA 234 CO 0.19 -0.26 0.48 -2.00 0.00 0.00 0.00 175.76 174.17 1lf9 s GLU 235 N 0.42 4.10 -0.17 0.00 2.12 1.00 -0.22 118.70 125.95 1lf9 s GLU 235 Ca -0.01 0.55 -0.16 0.00 0.36 0.00 0.00 54.97 55.71 1lf9 s GLU 235 Cb -0.04 -3.27 -0.04 0.00 0.26 0.00 0.00 34.13 31.04 1lf9 s GLU 235 CO -0.01 0.57 0.38 0.42 -0.54 0.00 0.00 175.26 176.08 1lf9 s ILE 236 N -0.77 5.23 -0.84 -3.70 -1.09 0.61 -0.60 121.20 120.05 1lf9 s ILE 236 Ca 0.26 0.71 -0.25 0.00 -2.23 0.00 0.00 60.65 59.14 1lf9 s ILE 236 Cb -0.17 -3.72 0.02 0.00 -1.58 0.00 0.00 42.46 37.00 1lf9 s ILE 236 CO 0.15 0.32 1.54 -0.62 -1.23 0.00 0.00 174.94 175.09 1lf9 s ASP 237 N 0.75 5.96 0.29 3.58 -1.08 -1.26 -4.40 116.67 120.52 1lf9 s ASP 237 Ca 0.20 -0.68 0.03 0.00 -0.52 0.00 0.00 52.55 51.58 1lf9 s ASP 237 Cb -0.14 -2.56 0.46 0.00 -1.46 0.00 0.00 42.92 39.22 1lf9 s ASP 237 CO 0.07 -1.97 1.75 -0.07 0.52 0.00 0.00 175.17 175.47 1lf9 h LEU 238 N 14.29 0.45 -1.75 -1.34 3.38 -1.94 -2.53 115.31 125.87 1lf9 h LEU 238 Ca -0.06 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 1lf9 h LEU 238 Cb 1.05 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 1lf9 h LEU 238 CO 1.31 0.69 -0.16 0.71 0.09 0.00 0.00 178.44 181.07 1lf9 h THR 239 N 0.40 0.89 0.04 0.22 1.35 -1.95 -1.81 112.91 112.06 1lf9 h THR 239 Ca 0.06 -0.61 -0.23 0.00 -0.55 0.00 0.00 66.41 65.08 1lf9 h THR 239 Cb 0.63 1.35 -0.00 0.00 -1.73 0.00 0.00 68.15 68.40 1lf9 h THR 239 CO 0.04 0.16 -1.02 0.50 -0.25 0.00 0.00 175.52 174.96 1lf9 h LYS 240 N 0.00 0.30 -1.05 4.72 3.64 -1.86 -3.46 116.57 118.85 1lf9 h LYS 240 Ca -0.00 -0.38 0.21 0.00 -1.27 0.00 0.00 60.65 59.21 1lf9 h LYS 240 Cb 0.34 0.12 -0.33 0.00 -0.41 0.00 0.00 32.23 31.94 1lf9 h LYS 240 CO 0.02 1.10 0.76 1.21 -2.27 0.00 0.00 179.45 180.27 1lf9 s ASN 241 N -7.05 -0.05 0.05 4.20 3.84 -0.69 -5.02 114.94 110.22 1lf9 s ASN 241 Ca -0.04 0.08 0.27 0.00 0.21 0.00 0.00 52.86 53.38 1lf9 s ASN 241 Cb 0.09 1.01 0.82 0.00 -0.55 0.00 0.00 41.25 42.62 1lf9 s ASN 241 CO 0.86 -0.01 1.66 -1.54 -2.79 0.00 0.00 177.10 175.28 1lf9 n SER 242 N 3.05 0.39 -4.15 -4.21 3.41 -1.19 -4.21 113.62 106.71 1lf9 n SER 242 Ca -0.17 0.24 -0.30 0.00 -0.26 0.00 0.00 58.87 58.37 1lf9 n SER 242 Cb 0.56 -0.23 -0.17 0.00 -0.26 0.00 0.00 64.21 64.11 1lf9 n SER 242 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1lf9 s GLU 243 N -3.04 2.69 0.31 4.33 2.12 -1.26 -0.48 118.70 123.37 1lf9 s GLU 243 Ca 0.11 -0.75 -0.04 0.00 0.36 0.00 0.00 54.97 54.66 1lf9 s GLU 243 Cb 0.17 -2.11 -0.00 0.00 0.26 0.00 0.00 34.13 32.45 1lf9 s GLU 243 CO 0.62 0.08 0.44 -0.59 -0.54 0.00 0.00 175.26 175.27 1lf9 s PHE 244 N 0.57 0.96 -0.11 5.30 -0.71 0.61 -4.99 117.98 119.61 1lf9 s PHE 244 Ca -0.14 -1.20 0.01 0.00 -1.04 0.00 0.00 56.93 54.55 1lf9 s PHE 244 Cb -0.17 -0.10 0.02 0.00 -1.21 0.00 0.00 43.02 41.56 1lf9 s PHE 244 CO 0.05 -1.05 -0.13 -2.00 -1.34 0.00 0.00 175.22 170.74 1lf9 s GLU 245 N -3.36 2.05 -0.12 1.99 2.12 -1.26 -0.79 118.70 119.33 1lf9 s GLU 245 Ca 0.30 -0.49 -0.03 0.00 0.36 0.00 0.00 54.97 55.11 1lf9 s GLU 245 Cb 0.00 -1.82 -0.03 0.00 0.26 0.00 0.00 34.13 32.54 1lf9 s GLU 245 CO 0.17 -0.12 -0.02 0.42 -0.54 0.00 0.00 175.26 175.18 1lf9 s ILE 246 N 1.17 4.12 -0.05 -3.70 -1.09 0.41 -1.39 121.20 120.67 1lf9 s ILE 246 Ca -0.03 -0.30 0.04 0.00 -2.23 0.00 0.00 60.65 58.13 1lf9 s ILE 246 Cb -0.14 -2.77 0.00 0.00 -1.58 0.00 0.00 42.46 37.97 1lf9 s ILE 246 CO -0.04 0.54 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.36 1lf9 s VAL 247 N -0.20 1.34 -0.21 2.92 1.01 -0.52 -0.77 120.40 123.98 1lf9 s VAL 247 Ca 0.04 -0.65 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 1lf9 s VAL 247 Cb -0.13 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 35.11 1lf9 s VAL 247 CO 0.02 0.39 -0.14 -0.22 0.00 0.00 0.00 175.10 175.16 1lf9 s LEU 248 N 0.16 2.62 0.14 3.92 2.96 -0.03 -1.37 118.68 127.08 1lf9 s LEU 248 Ca -0.06 -0.75 0.09 0.00 -0.22 0.00 0.00 54.13 53.20 1lf9 s LEU 248 Cb -0.12 -1.56 -0.04 0.00 0.50 0.00 0.00 46.19 44.96 1lf9 s LEU 248 CO 0.02 -0.05 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.40 1lf9 s SER 249 N 1.30 3.93 0.24 3.68 0.01 -0.12 0.78 113.70 123.54 1lf9 s SER 249 Ca 0.02 -0.60 0.11 0.00 1.31 0.00 0.00 55.95 56.79 1lf9 s SER 249 Cb -0.15 -0.56 -0.05 0.00 0.21 0.00 0.00 66.02 65.48 1lf9 s SER 249 CO -0.09 0.15 -0.15 -0.36 0.41 0.00 0.00 173.24 173.20 1lf9 s PHE 250 N -1.37 2.42 -0.03 2.43 0.08 -0.39 -0.08 117.98 121.05 1lf9 s PHE 250 Ca 0.20 -0.30 -0.31 0.00 0.12 0.00 0.00 56.93 56.65 1lf9 s PHE 250 Cb -0.10 -1.10 0.12 0.00 -0.57 0.00 0.00 43.02 41.37 1lf9 s PHE 250 CO 0.11 0.62 1.31 0.20 -0.10 0.00 0.00 175.22 177.37 1lf9 s GLY 251 N -3.27 -0.42 -0.02 4.36 0.00 -0.52 -4.18 107.32 103.29 1lf9 s GLY 251 Ca 0.28 0.70 0.15 0.00 0.00 0.00 0.00 44.72 45.85 1lf9 s GLY 251 CO 0.15 0.34 1.36 -0.18 0.00 0.00 0.00 173.10 174.78 1lf9 n GLN 252 N -0.51 2.32 -3.64 2.90 7.27 -1.26 -0.24 117.38 124.22 1lf9 n GLN 252 Ca -0.08 -1.83 -0.05 0.00 0.07 0.00 0.00 57.00 55.10 1lf9 n GLN 252 Cb 0.63 -1.46 -0.02 0.00 2.41 0.00 0.00 30.24 31.80 1lf9 n GLN 252 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 1lf9 s SER 253 N -0.95 -0.25 0.11 1.69 1.04 -1.26 -4.79 113.70 109.29 1lf9 s SER 253 Ca 0.34 -0.21 -0.24 0.00 0.48 0.00 0.00 55.95 56.32 1lf9 s SER 253 Cb 0.19 0.43 -0.08 0.00 0.10 0.00 0.00 66.02 66.65 1lf9 s SER 253 CO 0.21 -0.75 1.69 0.44 0.98 0.00 0.00 173.24 175.81 1lf9 h ASP 254 N 2.00 -0.35 -0.06 7.02 3.45 -1.96 -1.71 116.42 124.81 1lf9 h ASP 254 Ca -0.23 0.05 0.04 0.00 0.43 0.00 0.00 57.03 57.32 1lf9 h ASP 254 Cb 1.23 0.15 -0.05 0.00 -0.56 0.00 0.00 39.33 40.11 1lf9 h ASP 254 CO 0.28 -0.17 -0.21 -1.28 -1.57 0.00 0.00 179.24 176.29 1lf9 h SER 255 N -0.20 -0.62 0.47 6.45 0.87 -1.99 -0.31 113.55 118.22 1lf9 h SER 255 Ca 0.04 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1lf9 h SER 255 Cb 0.26 0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 1lf9 h SER 255 CO -0.12 -0.27 -0.45 -0.08 -0.53 0.00 0.00 176.83 175.39 1lf9 h GLU 256 N -0.30 -0.89 -0.30 2.24 4.81 -1.91 0.50 114.58 118.72 1lf9 h GLU 256 Ca 0.08 0.06 0.07 0.00 -0.13 0.00 0.00 59.36 59.44 1lf9 h GLU 256 Cb 0.41 0.20 -0.08 0.00 0.63 0.00 0.00 28.75 29.91 1lf9 h GLU 256 CO -0.24 -0.59 -0.24 0.00 -0.73 0.00 0.00 179.01 177.21 1lf9 h ALA 257 N -0.66 -0.09 -0.53 2.92 0.00 -1.16 0.62 119.26 120.37 1lf9 h ALA 257 Ca -0.05 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1lf9 h ALA 257 Cb 0.81 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 1lf9 h ALA 257 CO -0.05 -0.65 0.20 0.00 0.00 0.00 0.00 179.25 178.75 1lf9 h ALA 258 N 0.87 0.69 -0.64 0.00 0.00 -0.95 -1.70 119.26 117.54 1lf9 h ALA 258 Ca 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1lf9 h ALA 258 Cb 0.46 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1lf9 h ALA 258 CO -0.43 0.32 0.36 -0.22 0.00 0.00 0.00 179.25 179.29 1lf9 h LYS 259 N 0.72 0.88 -0.50 0.00 3.64 -0.47 -1.02 116.57 119.82 1lf9 h LYS 259 Ca 0.17 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1lf9 h LYS 259 Cb 0.23 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1lf9 h LYS 259 CO -0.01 0.65 0.17 1.15 -2.27 0.00 0.00 179.45 179.14 1lf9 h THR 260 N 0.86 1.19 -0.43 1.00 2.02 -0.62 -1.03 112.91 115.90 1lf9 h THR 260 Ca 0.23 -0.63 -0.10 0.00 0.77 0.00 0.00 66.41 66.68 1lf9 h THR 260 Cb 0.01 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 1lf9 h THR 260 CO -0.04 0.24 -0.12 0.00 0.37 0.00 0.00 175.52 175.97 1lf9 h ALA 261 N 1.48 0.60 -0.71 6.16 0.00 -0.56 -2.28 119.26 123.95 1lf9 h ALA 261 Ca 0.17 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1lf9 h ALA 261 Cb 0.18 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1lf9 h ALA 261 CO -0.01 0.50 0.22 -0.07 0.00 0.00 0.00 179.25 179.89 1lf9 h LEU 262 N 0.67 1.03 -0.59 0.00 3.38 -0.66 -1.39 115.31 117.77 1lf9 h LEU 262 Ca 0.11 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1lf9 h LEU 262 Cb 0.66 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 1lf9 h LEU 262 CO 0.05 0.97 0.22 -0.33 0.09 0.00 0.00 178.44 179.43 1lf9 h GLU 263 N 1.05 0.89 -0.47 1.13 5.08 -1.10 0.55 114.58 121.71 1lf9 h GLU 263 Ca 0.23 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1lf9 h GLU 263 Cb 0.30 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1lf9 h GLU 263 CO -0.01 0.77 -0.02 1.15 -1.00 0.00 0.00 179.01 179.91 1lf9 h THR 264 N 0.81 1.26 -0.07 1.13 2.02 -1.22 -2.82 112.91 114.02 1lf9 h THR 264 Ca 0.19 -1.08 -0.08 0.00 0.77 0.00 0.00 66.41 66.21 1lf9 h THR 264 Cb 0.22 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1lf9 h THR 264 CO -0.01 0.38 -0.32 -0.07 0.37 0.00 0.00 175.52 175.87 1lf9 h LEU 265 N 0.68 0.14 -0.08 2.58 3.38 -1.05 -2.39 115.31 118.57 1lf9 h LEU 265 Ca 0.13 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1lf9 h LEU 265 Cb 0.53 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1lf9 h LEU 265 CO 0.03 0.45 0.00 0.61 0.09 0.00 0.00 178.44 179.62 1lf9 n GLY 266 N -0.49 -1.31 3.90 0.83 0.00 0.17 -4.80 105.19 103.48 1lf9 n GLY 266 Ca -0.01 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 1lf9 n GLY 266 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1lf9 s GLU 267 N -3.05 3.57 -0.13 1.61 2.12 -0.90 -5.02 118.70 116.89 1lf9 s GLU 267 Ca 0.10 0.31 -0.29 0.00 0.36 0.00 0.00 54.97 55.44 1lf9 s GLU 267 Cb 0.14 -2.33 -0.01 0.00 0.26 0.00 0.00 34.13 32.18 1lf9 s GLU 267 CO 0.42 -0.25 1.12 0.34 -0.54 0.00 0.00 175.26 176.35 1lf9 s ASP 268 N -4.04 7.10 0.13 -1.70 -1.08 -1.26 -4.95 116.67 110.87 1lf9 s ASP 268 Ca 0.49 1.61 -0.29 0.00 -0.52 0.00 0.00 52.55 53.84 1lf9 s ASP 268 Cb -0.10 -2.55 -0.05 0.00 -1.46 0.00 0.00 42.92 38.76 1lf9 s ASP 268 CO 0.45 -0.59 1.58 0.22 0.52 0.00 0.00 175.17 177.35 1lf9 h TYR 269 N 7.48 -1.20 -0.58 -5.34 3.20 -1.92 -1.45 116.97 117.16 1lf9 h TYR 269 Ca -0.28 0.05 0.06 0.00 3.14 0.00 0.00 58.73 61.69 1lf9 h TYR 269 Cb 1.12 0.55 -0.03 0.00 1.54 0.00 0.00 36.73 39.91 1lf9 h TYR 269 CO 0.74 -0.47 0.38 -0.91 -1.64 0.00 0.00 178.16 176.26 1lf9 h ASN 270 N -0.47 0.49 -0.16 -2.11 2.35 -1.99 -1.06 115.58 112.63 1lf9 h ASN 270 Ca 0.08 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 1lf9 h ASN 270 Cb 0.62 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 1lf9 h ASN 270 CO -0.41 0.33 0.03 -1.13 -1.65 0.00 0.00 177.43 174.60 1lf9 h ASN 271 N 0.57 0.24 -0.55 5.81 -0.73 -1.75 -0.66 115.58 118.51 1lf9 h ASN 271 Ca 0.25 -0.24 -0.01 0.00 1.87 0.00 0.00 56.30 58.17 1lf9 h ASN 271 Cb 0.25 -0.06 -0.03 0.00 0.27 0.00 0.00 38.32 38.75 1lf9 h ASN 271 CO -0.07 0.42 0.31 -0.07 -0.37 0.00 0.00 177.43 177.65 1lf9 h LEU 272 N 0.05 0.68 -0.08 0.34 3.38 -0.58 -1.53 115.31 117.57 1lf9 h LEU 272 Ca 0.05 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1lf9 h LEU 272 Cb 0.28 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1lf9 h LEU 272 CO 0.00 0.57 0.03 0.50 0.09 0.00 0.00 178.44 179.63 1lf9 h LYS 273 N 0.74 0.12 -0.83 1.13 3.64 -1.15 -1.81 116.57 118.42 1lf9 h LYS 273 Ca 0.19 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1lf9 h LYS 273 Cb 0.03 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 1lf9 h LYS 273 CO -0.03 0.25 0.49 -0.91 -2.27 0.00 0.00 179.45 176.97 1lf9 h ASN 274 N -0.03 1.01 -0.73 4.20 2.35 -1.01 -0.81 115.58 120.57 1lf9 h ASN 274 Ca 0.03 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.67 1lf9 h ASN 274 Cb 0.17 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 1lf9 h ASN 274 CO -0.00 0.79 0.33 0.78 -1.65 0.00 0.00 177.43 177.68 1lf9 h ASN 275 N 1.14 0.99 -0.27 5.81 -0.26 -1.18 0.21 115.58 122.03 1lf9 h ASN 275 Ca 0.30 -0.13 -0.02 0.00 -0.56 0.00 0.00 56.30 55.89 1lf9 h ASN 275 Cb -0.02 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 36.97 1lf9 h ASN 275 CO -0.05 0.85 0.08 0.22 -1.06 0.00 0.00 177.43 177.47 1lf9 h TYR 276 N 1.07 0.43 -0.22 1.19 3.20 -0.65 -2.28 116.97 119.71 1lf9 h TYR 276 Ca 0.25 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 1lf9 h TYR 276 Cb 0.15 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1lf9 h TYR 276 CO 0.01 0.48 0.05 0.82 -1.64 0.00 0.00 178.16 177.88 1lf9 h ILE 277 N 0.26 1.22 -0.47 1.81 2.04 -0.80 -2.99 117.51 118.58 1lf9 h ILE 277 Ca 0.08 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 1lf9 h ILE 277 Cb 0.26 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1lf9 h ILE 277 CO -0.00 0.22 0.27 0.44 0.00 0.00 0.00 178.15 179.08 1lf9 h ASP 278 N 0.17 0.56 -0.65 1.72 3.32 -0.54 0.26 116.42 121.26 1lf9 h ASP 278 Ca 0.07 -0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.00 1lf9 h ASP 278 Cb 0.29 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1lf9 h ASP 278 CO 0.00 0.44 0.07 -0.08 -1.72 0.00 0.00 179.24 177.96 1lf9 h GLU 279 N 0.65 1.09 -0.01 3.56 4.81 -1.32 0.35 114.58 123.71 1lf9 h GLU 279 Ca 0.17 -0.31 -0.21 0.00 -0.13 0.00 0.00 59.36 58.88 1lf9 h GLU 279 Cb -0.01 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.25 1lf9 h GLU 279 CO -0.03 1.02 -0.88 -1.49 -0.73 0.00 0.00 179.01 176.90 1lf9 h TRP 280 N 1.01 0.51 -0.55 0.92 4.06 -1.24 -2.91 115.95 117.75 1lf9 h TRP 280 Ca 0.19 -0.27 -0.08 0.00 2.06 0.00 0.00 58.89 60.80 1lf9 h TRP 280 Cb 0.48 -0.06 -0.02 0.00 -1.00 0.00 0.00 29.16 28.56 1lf9 h TRP 280 CO 0.04 1.07 0.04 1.15 -3.56 0.00 0.00 178.44 177.18 1lf9 h THR 281 N 0.20 1.26 -0.41 1.49 2.02 0.21 -1.37 112.91 116.31 1lf9 h THR 281 Ca -0.06 -1.04 0.05 0.00 0.77 0.00 0.00 66.41 66.12 1lf9 h THR 281 Cb 1.50 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 68.73 1lf9 h THR 281 CO 0.15 0.37 0.15 0.50 0.37 0.00 0.00 175.52 177.06 1lf9 h LYS 282 N 0.82 0.31 -0.31 6.66 3.64 -0.93 -0.91 116.57 125.86 1lf9 h LYS 282 Ca 0.16 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1lf9 h LYS 282 Cb 0.48 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1lf9 h LYS 282 CO 0.02 0.20 0.17 -0.92 -2.27 0.00 0.00 179.45 176.65 1lf9 h TYR 283 N 0.32 0.42 -0.81 1.91 5.03 -1.27 -2.88 116.97 119.69 1lf9 h TYR 283 Ca 0.19 -0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.51 1lf9 h TYR 283 Cb 0.16 -0.13 -0.05 0.00 1.55 0.00 0.00 36.73 38.26 1lf9 h TYR 283 CO -0.14 0.34 0.53 0.00 -1.32 0.00 0.00 178.16 177.56 1lf9 n ASN 285 N -4.56 0.00 0.00 0.00 3.02 -0.39 -1.69 115.26 111.64 1lf9 n ASN 285 Ca 0.09 -1.04 0.11 0.00 -0.03 0.00 0.00 54.58 53.71 1lf9 n ASN 285 Cb 0.06 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.14 1lf9 n ASN 285 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1lf9 n THR 286 N -0.73 0.04 -2.89 3.41 5.66 -0.41 -4.98 114.28 114.38 1lf9 n THR 286 Ca 0.07 -0.19 -0.23 0.00 -3.05 0.00 0.00 64.05 60.66 1lf9 n THR 286 Cb 0.03 0.53 0.02 0.00 -1.55 0.00 0.00 70.33 69.36 1lf9 n THR 286 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1lf9 s LEU 287 N -3.62 3.56 0.27 1.09 1.43 -0.68 -4.86 118.68 115.87 1lf9 s LEU 287 Ca 0.03 0.28 -0.30 0.00 -1.03 0.00 0.00 54.13 53.11 1lf9 s LEU 287 Cb 0.15 -3.15 -0.10 0.00 0.03 0.00 0.00 46.19 43.12 1lf9 s LEU 287 CO 0.86 -0.79 1.34 0.20 0.23 0.00 0.00 176.35 178.19 1lf9 s ASN 288 N -4.25 6.78 0.00 2.29 0.01 -0.15 -4.91 114.94 114.71 1lf9 s ASN 288 Ca 0.50 2.59 0.13 0.00 -0.71 0.00 0.00 52.86 55.37 1lf9 s ASN 288 Cb -0.10 -2.63 0.22 0.00 0.41 0.00 0.00 41.25 39.15 1lf9 s ASN 288 CO 0.39 -0.57 1.09 -0.46 -1.51 0.00 0.00 177.10 176.03 1lf9 n ASN 289 N 1.81 2.56 -3.81 -1.22 0.23 -1.26 -4.86 115.26 108.71 1lf9 n ASN 289 Ca 0.04 -1.75 -0.36 0.00 -0.53 0.00 0.00 54.58 51.97 1lf9 n ASN 289 Cb 0.42 -0.12 0.04 0.00 -2.08 0.00 0.00 39.78 38.03 1lf9 n ASN 289 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1lf9 n PHE 290 N 0.76 -1.75 -3.81 -2.53 3.01 -1.26 -0.25 117.46 111.64 1lf9 n PHE 290 Ca 0.11 0.33 -0.26 0.00 1.01 0.00 0.00 57.45 58.64 1lf9 n PHE 290 Cb 0.39 -3.20 0.03 0.00 -0.01 0.00 0.00 39.48 36.69 1lf9 n PHE 290 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1lf9 n ASN 291 N -2.48 -3.44 -0.03 4.37 3.02 -1.26 -1.05 115.26 114.39 1lf9 n ASN 291 Ca -0.10 -0.78 -0.00 0.00 -0.03 0.00 0.00 54.58 53.67 1lf9 n ASN 291 Cb 0.58 -4.03 -0.00 0.00 -0.61 0.00 0.00 39.78 35.72 1lf9 n ASN 291 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lf9 n GLY 292 N -1.66 0.42 0.12 7.41 0.00 -0.65 -4.91 105.19 105.91 1lf9 n GLY 292 Ca -0.10 -0.07 0.02 0.00 0.00 0.00 0.00 46.02 45.87 1lf9 n GLY 292 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lf9 h LYS 293 N 0.72 0.00 -6.27 1.61 1.57 0.11 -3.46 116.57 110.84 1lf9 h LYS 293 Ca -0.01 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 58.10 1lf9 h LYS 293 Cb 0.22 0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.57 1lf9 h LYS 293 CO 0.01 0.38 0.68 0.00 -0.57 0.00 0.00 179.45 179.95 1lf9 n ALA 294 N -2.30 -0.28 -3.46 3.86 0.00 0.05 -4.97 120.51 113.41 1lf9 n ALA 294 Ca -0.03 0.45 -0.25 0.00 0.00 0.00 0.00 53.44 53.60 1lf9 n ALA 294 Cb 0.78 -2.19 0.03 0.00 0.00 0.00 0.00 19.45 18.07 1lf9 n ALA 294 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1lf9 n ASN 295 N 3.79 2.36 -0.28 0.00 2.04 -1.26 -5.00 115.26 116.91 1lf9 n ASN 295 Ca 0.21 -2.64 -0.05 0.00 -0.44 0.00 0.00 54.58 51.65 1lf9 n ASN 295 Cb 0.20 -0.22 0.06 0.00 -2.53 0.00 0.00 39.78 37.29 1lf9 n ASN 295 CO 0.00 0.00 0.00 0.77 -0.44 0.00 0.00 177.26 177.59 1lf9 h SER 296 N 0.36 0.96 -0.02 0.53 4.64 -1.93 -2.38 113.55 115.71 1lf9 h SER 296 Ca -0.30 -0.10 -0.03 0.00 -0.47 0.00 0.00 61.79 60.89 1lf9 h SER 296 Cb 1.20 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 63.04 1lf9 h SER 296 CO 0.45 0.79 -0.06 0.25 -0.87 0.00 0.00 176.83 177.38 1lf9 h LEU 297 N 1.05 0.20 0.04 5.97 5.85 -1.95 0.32 115.31 126.80 1lf9 h LEU 297 Ca 0.27 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 1lf9 h LEU 297 Cb 0.05 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1lf9 h LEU 297 CO -0.04 0.30 -0.02 0.22 -0.34 0.00 0.00 178.44 178.56 1lf9 h TYR 298 N 0.21 -0.05 -0.38 1.25 3.20 -1.83 0.39 116.97 119.76 1lf9 h TYR 298 Ca 0.05 -0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.77 1lf9 h TYR 298 Cb 0.25 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 1lf9 h TYR 298 CO 0.00 0.13 -0.34 1.88 -1.64 0.00 0.00 178.16 178.20 1lf9 h TYR 299 N -0.23 1.01 -0.30 -3.82 0.05 -1.08 -1.62 116.97 110.98 1lf9 h TYR 299 Ca -0.01 -0.28 0.00 0.00 0.05 0.00 0.00 58.73 58.49 1lf9 h TYR 299 Cb 0.21 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.71 1lf9 h TYR 299 CO -0.02 1.07 0.19 -0.97 -1.05 0.00 0.00 178.16 177.39 1lf9 h ASN 300 N 0.72 0.35 -0.09 3.88 -0.00 -0.31 -0.29 115.58 119.83 1lf9 h ASN 300 Ca 0.07 -0.03 -0.00 0.00 -0.00 0.00 0.00 56.30 56.34 1lf9 h ASN 300 Cb 0.91 -0.09 -0.00 0.00 -0.00 0.00 0.00 38.32 39.13 1lf9 h ASN 300 CO 0.08 0.27 0.05 0.28 -0.00 0.00 0.00 177.43 178.12 1lf9 h SER 301 N 0.39 0.10 -0.46 1.15 0.02 -0.80 -0.64 113.55 113.32 1lf9 h SER 301 Ca 0.11 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 1lf9 h SER 301 Cb -0.02 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 1lf9 h SER 301 CO -0.02 0.11 0.15 0.24 -1.14 0.00 0.00 176.83 176.17 1lf9 h MET 302 N 0.09 0.77 -0.24 3.45 2.86 -1.14 -0.33 114.93 120.39 1lf9 h MET 302 Ca 0.03 -0.14 -0.06 0.00 -2.06 0.00 0.00 59.70 57.47 1lf9 h MET 302 Cb 0.03 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1lf9 h MET 302 CO -0.01 0.68 -0.08 0.52 1.06 0.00 0.00 176.91 179.08 1lf9 h MET 303 N 0.75 0.47 -0.97 1.72 2.07 -0.82 -0.55 114.93 117.60 1lf9 h MET 303 Ca 0.17 -0.19 0.04 0.00 -2.07 0.00 0.00 59.70 57.65 1lf9 h MET 303 Cb 0.24 -0.02 -0.06 0.00 -1.87 0.00 0.00 31.60 29.89 1lf9 h MET 303 CO -0.01 0.72 0.63 0.82 1.07 0.00 0.00 176.91 180.14 1lf9 h ILE 304 N 0.20 1.16 -0.30 -1.22 2.04 -0.78 0.17 117.51 118.78 1lf9 h ILE 304 Ca 0.06 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 65.46 1lf9 h ILE 304 Cb 0.56 -0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 1lf9 h ILE 304 CO 0.03 0.22 0.03 -0.07 0.00 0.00 0.00 178.15 178.36 1lf9 h LEU 305 N 1.22 0.49 -1.68 1.44 3.38 -0.86 -2.61 115.31 116.69 1lf9 h LEU 305 Ca 0.39 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1lf9 h LEU 305 Cb 0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1lf9 h LEU 305 CO -0.13 0.64 -0.02 0.50 0.09 0.00 0.00 178.44 179.53 1lf9 h LYS 306 N 0.32 0.18 -0.00 1.13 3.11 -0.30 -1.21 116.57 119.79 1lf9 h LYS 306 Ca 0.09 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.91 1lf9 h LYS 306 Cb 0.37 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.57 1lf9 h LYS 306 CO 0.01 0.21 -0.02 0.00 -2.81 0.00 0.00 179.45 176.85 1lf9 n ALA 307 N -2.51 2.66 -0.65 5.00 0.00 0.54 -3.80 120.51 121.74 1lf9 n ALA 307 Ca -0.01 -0.28 0.09 0.00 0.00 0.00 0.00 53.44 53.24 1lf9 n ALA 307 Cb 0.17 -1.39 0.37 0.00 0.00 0.00 0.00 19.45 18.60 1lf9 n ALA 307 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1lf9 n SER 308 N -0.66 4.95 -4.88 0.00 7.64 -0.46 -4.88 113.62 115.33 1lf9 n SER 308 Ca 0.21 -2.51 -0.36 0.00 1.01 0.00 0.00 58.87 57.21 1lf9 n SER 308 Cb 0.21 -0.60 -0.06 0.00 -1.01 0.00 0.00 64.21 62.75 1lf9 n SER 308 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1lf9 s GLU 309 N -1.98 3.54 0.54 1.43 2.12 -1.25 -2.05 118.70 121.05 1lf9 s GLU 309 Ca 0.52 -0.06 -0.19 0.00 0.36 0.00 0.00 54.97 55.60 1lf9 s GLU 309 Cb 0.35 -3.16 -0.06 0.00 0.26 0.00 0.00 34.13 31.51 1lf9 s GLU 309 CO 0.24 0.73 1.11 0.34 -0.54 0.00 0.00 175.26 177.14 1lf9 s ASP 310 N -1.26 5.82 0.00 -1.70 2.15 -0.60 -4.91 116.67 116.19 1lf9 s ASP 310 Ca 0.20 2.12 0.26 0.00 0.43 0.00 0.00 52.55 55.55 1lf9 s ASP 310 Cb -0.13 -2.57 0.58 0.00 -0.30 0.00 0.00 42.92 40.49 1lf9 s ASP 310 CO 0.09 -1.14 1.46 0.29 -0.17 0.00 0.00 175.17 175.70 1lf9 n LYS 311 N -1.28 1.19 -0.08 4.34 5.02 -1.26 -4.06 118.16 122.02 1lf9 n LYS 311 Ca 0.11 -0.81 -0.17 0.00 -2.02 0.00 0.00 58.31 55.42 1lf9 n LYS 311 Cb 0.51 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.98 1lf9 n LYS 311 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1lf9 n THR 312 N -0.20 1.06 -3.27 -0.18 -1.04 -1.26 -4.75 114.28 104.65 1lf9 n THR 312 Ca 0.13 -0.16 -0.45 0.00 -2.04 0.00 0.00 64.05 61.52 1lf9 n THR 312 Cb 0.40 -1.81 -0.01 0.00 -1.82 0.00 0.00 70.33 67.09 1lf9 n THR 312 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1lf9 s ASN 313 N -6.49 7.08 0.47 8.00 0.01 -1.26 -5.03 114.94 117.72 1lf9 s ASN 313 Ca -0.24 -3.15 -0.24 0.00 -0.71 0.00 0.00 52.86 48.52 1lf9 s ASN 313 Cb 0.08 -2.24 -0.08 0.00 0.41 0.00 0.00 41.25 39.42 1lf9 s ASN 313 CO 0.31 -0.48 1.35 0.29 -1.51 0.00 0.00 177.10 177.06 1lf9 n LYS 314 N 3.68 1.96 0.00 -0.60 5.02 -1.26 -2.45 118.16 124.51 1lf9 n LYS 314 Ca 0.22 0.70 0.00 0.00 -2.02 0.00 0.00 58.31 57.22 1lf9 n LYS 314 Cb 0.43 -2.52 0.00 0.00 -0.02 0.00 0.00 35.03 32.91 1lf9 n LYS 314 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lf9 n GLY 315 N 0.72 2.67 3.56 0.72 0.00 -1.26 -4.56 105.19 107.05 1lf9 n GLY 315 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1lf9 n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lf9 s ALA 316 N -2.56 2.70 -0.22 4.61 0.00 -1.03 -4.29 121.76 120.98 1lf9 s ALA 316 Ca 0.00 -2.28 -0.16 0.00 0.00 0.00 0.00 51.96 49.52 1lf9 s ALA 316 Cb 0.00 -4.54 -0.04 0.00 0.00 0.00 0.00 23.12 18.54 1lf9 s ALA 316 CO 0.00 -3.67 0.40 0.71 0.00 0.00 0.00 175.76 173.20 1lf9 s TYR 317 N 5.25 3.34 0.70 0.00 2.02 -1.26 -1.55 117.35 125.85 1lf9 s TYR 317 Ca 0.48 0.57 -0.08 0.00 -0.37 0.00 0.00 57.07 57.67 1lf9 s TYR 317 Cb -0.00 -2.55 0.04 0.00 -0.40 0.00 0.00 41.96 39.06 1lf9 s TYR 317 CO -0.08 -0.08 1.04 0.96 -1.57 0.00 0.00 175.55 175.83 1lf9 s ILE 318 N 1.54 2.76 0.14 2.71 -4.36 -0.87 -4.48 121.20 118.63 1lf9 s ILE 318 Ca 0.18 -0.01 -0.01 0.00 -0.26 0.00 0.00 60.65 60.55 1lf9 s ILE 318 Cb -0.15 -3.19 -0.18 0.00 1.25 0.00 0.00 42.46 40.19 1lf9 s ILE 318 CO 0.08 -0.22 1.32 0.00 0.24 0.00 0.00 174.94 176.36 1lf9 h ALA 319 N -0.61 0.40 -1.33 2.27 0.00 -0.98 -3.46 119.26 115.56 1lf9 h ALA 319 Ca -0.45 -0.74 0.14 0.00 0.00 0.00 0.00 54.91 53.86 1lf9 h ALA 319 Cb 1.29 -0.04 -0.30 0.00 0.00 0.00 0.00 17.79 18.74 1lf9 h ALA 319 CO 0.62 0.89 0.62 0.45 0.00 0.00 0.00 179.25 181.82 1lf9 s SER 320 N -7.01 -0.27 -1.49 0.00 0.15 -0.69 -1.56 113.70 102.82 1lf9 s SER 320 Ca -0.04 0.48 -0.09 0.00 0.70 0.00 0.00 55.95 57.00 1lf9 s SER 320 Cb 0.09 0.78 0.01 0.00 -1.71 0.00 0.00 66.02 65.19 1lf9 s SER 320 CO 0.85 -0.08 2.61 -0.11 1.20 0.00 0.00 173.24 177.71 1lf9 n LEU 321 N 2.60 8.16 -3.77 3.45 7.94 -1.26 -2.51 117.00 131.61 1lf9 n LEU 321 Ca -0.14 -4.52 -0.08 0.00 -1.11 0.00 0.00 56.01 50.15 1lf9 n LEU 321 Cb 0.57 -1.50 -0.02 0.00 0.53 0.00 0.00 43.42 42.99 1lf9 n LEU 321 CO 0.03 1.90 0.45 -0.94 -1.11 0.00 0.00 177.39 177.72 1lf9 s SER 322 N 1.64 -0.32 -0.38 1.96 1.04 -1.26 -4.77 113.70 111.60 1lf9 s SER 322 Ca 0.60 -0.49 0.03 0.00 0.48 0.00 0.00 55.95 56.58 1lf9 s SER 322 Cb 0.17 0.70 0.11 0.00 0.10 0.00 0.00 66.02 67.10 1lf9 s SER 322 CO -0.07 -1.26 0.12 -0.63 0.98 0.00 0.00 173.24 172.37 1lf9 s ILE 323 N -3.89 2.11 0.18 -1.02 1.01 -1.26 -2.36 121.20 115.97 1lf9 s ILE 323 Ca 0.09 -2.46 -0.32 0.00 0.00 0.00 0.00 60.65 57.96 1lf9 s ILE 323 Cb -0.05 -2.53 -0.16 0.00 0.01 0.00 0.00 42.46 39.73 1lf9 s ILE 323 CO 0.03 -0.68 1.06 -0.81 0.00 0.00 0.00 174.94 174.54 1lf9 n PRO 324 N 4.02 0.98 -2.45 2.79 -0.04 -1.26 0.12 135.00 139.15 1lf9 n PRO 324 Ca 0.04 0.35 -0.10 0.00 -0.04 0.00 0.00 63.50 63.75 1lf9 n PRO 324 Cb 0.39 -1.76 -0.00 0.00 -0.04 0.00 0.00 33.50 32.08 1lf9 n PRO 324 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1lf9 n TRP 325 N 1.11 -1.53 -0.14 0.54 8.01 -0.08 -4.80 117.44 120.56 1lf9 n TRP 325 Ca 0.15 0.00 0.09 0.00 -1.31 0.00 0.00 57.50 56.43 1lf9 n TRP 325 Cb 0.25 -2.41 0.42 0.00 -2.01 0.00 0.00 31.31 27.56 1lf9 n TRP 325 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.69 177.46 1lf9 h GLY 326 N 0.00 0.80 0.33 6.99 0.00 -0.34 0.22 103.07 111.07 1lf9 h GLY 326 Ca -0.24 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1lf9 h GLY 326 CO 0.28 0.16 0.00 2.09 0.00 0.00 0.00 176.54 179.07 1lf9 n ASP 327 N -4.48 0.00 0.00 0.19 5.75 -0.96 -1.08 116.55 115.97 1lf9 n ASP 327 Ca 0.10 -0.94 0.00 0.00 -0.01 0.00 0.00 54.79 53.95 1lf9 n ASP 327 Cb 0.30 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.39 1lf9 n ASP 327 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1lf9 n GLY 328 N 0.08 -0.61 3.62 6.12 0.00 0.06 -4.82 105.19 109.64 1lf9 n GLY 328 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1lf9 n GLY 328 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1lf9 s GLN 329 N -0.09 2.51 0.72 1.61 -1.52 -0.65 -5.03 119.66 117.20 1lf9 s GLN 329 Ca 0.00 -0.78 -0.15 0.00 -1.95 0.00 0.00 55.36 52.49 1lf9 s GLN 329 Cb 0.00 -2.49 0.03 0.00 -0.22 0.00 0.00 33.01 30.33 1lf9 s GLN 329 CO 0.00 0.58 1.18 0.50 -0.25 0.00 0.00 175.29 177.30 1lf9 s ARG 330 N -1.70 2.25 0.00 2.91 3.52 -1.26 -3.07 118.95 121.60 1lf9 s ARG 330 Ca 0.19 1.65 0.00 0.00 -0.13 0.00 0.00 55.73 57.44 1lf9 s ARG 330 Cb -0.11 -1.86 0.00 0.00 -1.56 0.00 0.00 34.95 31.42 1lf9 s ARG 330 CO 0.10 -1.73 0.98 -0.40 -0.81 0.00 0.00 175.30 173.45 1lf9 n ASP 331 N -2.73 2.74 -4.71 -2.12 5.68 -0.38 -4.62 116.55 110.40 1lf9 n ASP 331 Ca 0.13 -1.62 -0.29 0.00 -0.50 0.00 0.00 54.79 52.50 1lf9 n ASP 331 Cb 0.51 -0.53 0.12 0.00 -1.14 0.00 0.00 41.12 40.07 1lf9 n ASP 331 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1lf9 s ASP 332 N 1.47 4.02 -0.05 -1.12 1.01 -1.26 -1.21 116.67 119.53 1lf9 s ASP 332 Ca 0.00 0.70 -0.30 0.00 0.71 0.00 0.00 52.55 53.67 1lf9 s ASP 332 Cb 0.00 -1.12 -0.06 0.00 1.01 0.00 0.00 42.92 42.76 1lf9 s ASP 332 CO 0.00 -2.20 1.66 0.21 0.21 0.00 0.00 175.17 175.05 1lf9 s ASN 333 N -4.55 6.66 0.01 0.27 2.47 -1.02 -4.68 114.94 114.11 1lf9 s ASN 333 Ca 0.65 2.24 -0.03 0.00 0.42 0.00 0.00 52.86 56.15 1lf9 s ASN 333 Cb -0.10 -2.53 -0.01 0.00 -1.45 0.00 0.00 41.25 37.15 1lf9 s ASN 333 CO 0.51 -0.93 0.03 -0.89 -3.72 0.00 0.00 177.10 172.10 1lf9 s THR 334 N 4.04 0.10 -0.46 -5.21 2.01 -1.26 -5.04 115.64 109.82 1lf9 s THR 334 Ca 0.74 -0.83 0.23 0.00 0.31 0.00 0.00 61.69 62.15 1lf9 s THR 334 Cb -0.33 -0.32 0.12 0.00 0.01 0.00 0.00 72.50 71.98 1lf9 s THR 334 CO 0.30 -0.45 1.33 1.23 -0.69 0.00 0.00 174.62 176.33 1lf9 h GLY 335 N 4.53 0.00 0.00 4.40 0.00 -1.93 -3.49 103.07 106.58 1lf9 h GLY 335 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1lf9 h GLY 335 CO 0.41 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.56 1lf9 n GLY 336 N 1.23 2.91 0.65 4.60 0.00 -1.26 -1.36 105.19 111.95 1lf9 n GLY 336 Ca 0.02 -0.16 0.07 0.00 0.00 0.00 0.00 46.02 45.95 1lf9 n GLY 336 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1lf9 n TYR 337 N 14.00 0.27 -1.83 1.61 4.02 -1.00 -4.65 117.16 129.59 1lf9 n TYR 337 Ca 0.00 -0.24 -0.40 0.00 -0.01 0.00 0.00 57.90 57.25 1lf9 n TYR 337 Cb 0.00 -0.01 -0.01 0.00 -0.02 0.00 0.00 39.34 39.30 1lf9 n TYR 337 CO 0.00 0.00 0.00 -2.39 -1.01 0.00 0.00 176.86 173.46 1lf9 n HIS 338 N 0.74 2.58 -4.19 -0.72 1.44 -0.46 -1.70 115.22 112.90 1lf9 n HIS 338 Ca 0.11 -2.90 -0.12 0.00 -2.01 0.00 0.00 57.72 52.81 1lf9 n HIS 338 Cb 0.40 -2.03 -0.10 0.00 0.12 0.00 0.00 29.99 28.38 1lf9 n HIS 338 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1lf9 s LEU 339 N -1.35 2.06 -0.25 2.39 1.02 -1.26 -4.57 118.68 116.72 1lf9 s LEU 339 Ca 0.57 -1.16 -0.10 0.00 0.02 0.00 0.00 54.13 53.47 1lf9 s LEU 339 Cb 0.18 0.08 -0.05 0.00 0.02 0.00 0.00 46.19 46.42 1lf9 s LEU 339 CO -0.08 -0.62 0.15 -0.69 0.02 0.00 0.00 176.35 175.13 1lf9 s VAL 340 N -3.80 5.11 -0.16 -1.59 1.01 0.39 -1.94 120.40 119.42 1lf9 s VAL 340 Ca 0.22 0.10 -0.02 0.00 0.00 0.00 0.00 61.98 62.28 1lf9 s VAL 340 Cb 0.07 -3.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.03 1lf9 s VAL 340 CO 0.01 0.32 -0.08 0.26 0.00 0.00 0.00 175.10 175.61 1lf9 s TRP 341 N 1.38 2.90 0.26 5.22 0.51 -1.26 -1.31 118.94 126.64 1lf9 s TRP 341 Ca 0.07 -0.64 -0.02 0.00 -2.12 0.00 0.00 56.10 53.39 1lf9 s TRP 341 Cb -0.15 -1.94 0.48 0.00 -0.81 0.00 0.00 33.47 31.05 1lf9 s TRP 341 CO 0.07 -0.26 1.80 1.03 -0.51 0.00 0.00 176.95 179.08 1lf9 h SER 342 N 7.07 0.69 0.88 2.95 0.87 -1.86 -0.31 113.55 123.84 1lf9 h SER 342 Ca -0.31 0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.27 1lf9 h SER 342 Cb 1.19 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 63.09 1lf9 h SER 342 CO 0.59 0.36 -0.43 -0.09 -0.53 0.00 0.00 176.83 176.73 1lf9 h ARG 343 N 0.79 -1.15 -0.95 2.24 2.43 -1.90 -0.25 114.38 115.59 1lf9 h ARG 343 Ca 0.44 0.08 0.06 0.00 -0.81 0.00 0.00 59.98 59.75 1lf9 h ARG 343 Cb 0.49 0.26 -0.06 0.00 -0.42 0.00 0.00 29.97 30.23 1lf9 h ARG 343 CO -0.29 -0.76 0.61 -0.44 -1.51 0.00 0.00 179.97 177.58 1lf9 h ASP 344 N -1.19 0.98 -0.67 -3.80 3.45 -1.91 -1.92 116.42 111.37 1lf9 h ASP 344 Ca -0.12 0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.32 1lf9 h ASP 344 Cb 0.92 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 39.45 1lf9 h ASP 344 CO 0.19 0.64 0.30 0.25 -1.57 0.00 0.00 179.24 179.05 1lf9 h LEU 345 N 1.12 0.89 -0.41 1.55 6.46 -0.97 0.14 115.31 124.10 1lf9 h LEU 345 Ca 0.40 -0.15 0.05 0.00 -0.12 0.00 0.00 57.88 58.07 1lf9 h LEU 345 Cb 0.12 -0.23 -0.05 0.00 -0.73 0.00 0.00 40.66 39.78 1lf9 h LEU 345 CO -0.16 0.79 0.14 0.22 -0.62 0.00 0.00 178.44 178.81 1lf9 h TYR 346 N 0.93 0.25 -0.40 1.25 3.20 -0.28 0.36 116.97 122.30 1lf9 h TYR 346 Ca 0.23 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.99 1lf9 h TYR 346 Cb 0.15 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1lf9 h TYR 346 CO 0.01 0.10 -0.26 0.45 -1.64 0.00 0.00 178.16 176.81 1lf9 h HIS 347 N 0.31 0.96 -0.44 -3.82 3.86 -1.06 -1.73 115.15 113.23 1lf9 h HIS 347 Ca 0.19 -0.24 -0.07 0.00 -1.16 0.00 0.00 60.37 59.09 1lf9 h HIS 347 Cb 0.17 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.40 1lf9 h HIS 347 CO -0.15 1.00 -0.03 0.28 0.86 0.00 0.00 177.93 179.89 1lf9 h VAL 348 N 0.72 1.24 -0.73 2.45 2.07 -0.38 -2.25 116.25 119.37 1lf9 h VAL 348 Ca 0.09 -1.01 -0.05 0.00 0.82 0.00 0.00 66.70 66.55 1lf9 h VAL 348 Cb 0.80 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 1lf9 h VAL 348 CO 0.07 0.35 0.25 0.00 0.02 0.00 0.00 177.57 178.26 1lf9 h ALA 349 N 1.29 0.95 -0.11 1.67 0.00 0.08 -2.02 119.26 121.11 1lf9 h ALA 349 Ca 0.13 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1lf9 h ALA 349 Cb 0.47 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1lf9 h ALA 349 CO 0.02 0.61 -0.16 -0.91 0.00 0.00 0.00 179.25 178.82 1lf9 h ASN 350 N 1.06 0.17 -0.12 0.00 2.35 -0.81 -0.77 115.58 117.47 1lf9 h ASN 350 Ca 0.24 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.93 1lf9 h ASN 350 Cb 0.27 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.59 1lf9 h ASN 350 CO -0.01 0.35 -0.02 0.00 -1.65 0.00 0.00 177.43 176.10 1lf9 h ALA 351 N 1.67 0.16 -0.88 -0.83 0.00 -0.83 -0.55 119.26 118.00 1lf9 h ALA 351 Ca 0.03 -0.21 0.08 0.00 0.00 0.00 0.00 54.91 54.81 1lf9 h ALA 351 Cb 0.39 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 1lf9 h ALA 351 CO 0.02 -0.12 0.54 0.74 0.00 0.00 0.00 179.25 180.43 1lf9 h PHE 352 N -0.08 0.99 0.28 0.00 0.04 -0.89 0.93 116.94 118.21 1lf9 h PHE 352 Ca 0.03 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.82 1lf9 h PHE 352 Cb 0.41 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 38.24 1lf9 h PHE 352 CO 0.04 0.47 -0.15 0.82 -0.60 0.00 0.00 178.31 178.89 1lf9 h ILE 353 N 0.95 0.69 -0.45 -0.55 1.08 -0.86 0.81 117.51 119.19 1lf9 h ILE 353 Ca 0.40 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.91 1lf9 h ILE 353 Cb 0.25 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 34.66 1lf9 h ILE 353 CO -0.20 0.00 0.30 0.00 -0.69 0.00 0.00 178.15 177.56 1lf9 h ALA 354 N 0.32 1.89 0.00 1.87 0.00 -0.36 -0.79 119.26 122.19 1lf9 h ALA 354 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1lf9 h ALA 354 Cb 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1lf9 h ALA 354 CO 0.05 0.04 -0.08 0.00 0.00 0.00 0.00 179.25 179.25 1lf9 n ALA 355 N -2.51 2.49 -0.09 0.00 0.00 0.25 -4.83 120.51 115.83 1lf9 n ALA 355 Ca 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1lf9 n ALA 355 Cb 0.21 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1lf9 n ALA 355 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lf9 n GLY 356 N 1.46 0.58 2.80 0.00 0.00 -0.30 -0.98 105.19 108.76 1lf9 n GLY 356 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1lf9 n GLY 356 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1lf9 n ASP 357 N 0.00 5.22 0.26 1.61 4.64 0.15 -4.71 116.55 123.73 1lf9 n ASP 357 Ca 0.00 -3.07 0.11 0.00 -1.38 0.00 0.00 54.79 50.45 1lf9 n ASP 357 Cb 0.00 -1.49 0.71 0.00 -1.04 0.00 0.00 41.12 39.30 1lf9 n ASP 357 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 1lf9 h VAL 358 N 3.66 0.69 -0.27 5.18 2.07 -1.87 -2.83 116.25 122.89 1lf9 h VAL 358 Ca 0.45 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.53 1lf9 h VAL 358 Cb 0.60 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1lf9 h VAL 358 CO 1.65 0.11 0.18 0.44 0.02 0.00 0.00 177.57 179.97 1lf9 h ASP 359 N 0.00 0.31 -0.66 0.57 3.45 -1.94 -1.33 116.42 116.83 1lf9 h ASP 359 Ca -0.00 -0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.41 1lf9 h ASP 359 Cb 0.26 -0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 38.92 1lf9 h ASP 359 CO 0.01 0.23 0.28 0.28 -1.57 0.00 0.00 179.24 178.47 1lf9 h SER 360 N 0.37 0.90 0.10 6.45 0.02 -1.90 -0.78 113.55 118.70 1lf9 h SER 360 Ca 0.10 -0.16 0.01 0.00 -0.84 0.00 0.00 61.79 60.90 1lf9 h SER 360 Cb -0.04 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.25 1lf9 h SER 360 CO -0.02 0.81 -0.16 0.00 -1.14 0.00 0.00 176.83 176.33 1lf9 h ALA 361 N 1.12 -0.27 -0.86 3.77 0.00 -1.46 -1.24 119.26 120.32 1lf9 h ALA 361 Ca 0.22 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.15 1lf9 h ALA 361 Cb 0.19 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 1lf9 h ALA 361 CO -0.02 -0.68 0.55 -0.91 0.00 0.00 0.00 179.25 178.19 1lf9 h ASN 362 N -0.31 0.90 -0.83 0.00 2.35 -1.02 -0.66 115.58 116.01 1lf9 h ASN 362 Ca 0.02 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1lf9 h ASN 362 Cb 0.33 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.46 1lf9 h ASN 362 CO -0.08 0.60 0.55 -0.09 -1.65 0.00 0.00 177.43 176.76 1lf9 h ARG 363 N 1.05 1.08 -0.26 0.81 2.43 -0.77 0.02 114.38 118.74 1lf9 h ARG 363 Ca 0.36 -0.06 -0.16 0.00 -0.81 0.00 0.00 59.98 59.30 1lf9 h ARG 363 Cb 0.06 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1lf9 h ARG 363 CO -0.14 0.71 -0.48 0.66 -1.51 0.00 0.00 179.97 179.22 1lf9 h SER 364 N 1.11 0.76 -0.37 -3.80 4.64 -0.00 -2.05 113.55 113.84 1lf9 h SER 364 Ca 0.31 -0.38 -0.02 0.00 -0.47 0.00 0.00 61.79 61.24 1lf9 h SER 364 Cb -0.10 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 61.76 1lf9 h SER 364 CO -0.07 1.11 0.17 0.25 -0.87 0.00 0.00 176.83 177.42 1lf9 h LEU 365 N 0.55 0.48 -1.87 5.97 5.85 -0.25 -1.29 115.31 124.76 1lf9 h LEU 365 Ca 0.03 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 1lf9 h LEU 365 Cb 1.03 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.93 1lf9 h LEU 365 CO 0.10 0.49 -0.10 0.44 -0.34 0.00 0.00 178.44 179.03 1lf9 h ASP 366 N 0.45 0.00 -0.32 1.25 3.45 -0.91 -0.52 116.42 119.82 1lf9 h ASP 366 Ca 0.12 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.53 1lf9 h ASP 366 Cb 0.13 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.89 1lf9 h ASP 366 CO -0.01 0.10 -0.03 0.22 -1.57 0.00 0.00 179.24 177.94 1lf9 h TYR 367 N 0.00 0.65 -0.67 4.55 3.20 -0.53 -1.69 116.97 122.48 1lf9 h TYR 367 Ca -0.00 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.74 1lf9 h TYR 367 Cb 0.18 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 1lf9 h TYR 367 CO 0.00 0.73 0.39 -0.07 -1.64 0.00 0.00 178.16 177.58 1lf9 h LEU 368 N 0.37 0.80 -0.79 2.82 3.38 -0.18 -0.46 115.31 121.26 1lf9 h LEU 368 Ca 0.09 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1lf9 h LEU 368 Cb 0.50 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1lf9 h LEU 368 CO 0.02 0.62 0.42 0.00 0.09 0.00 0.00 178.44 179.59 1lf9 h ALA 369 N 1.51 1.01 -0.19 1.53 0.00 -0.76 0.74 119.26 123.11 1lf9 h ALA 369 Ca 0.24 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1lf9 h ALA 369 Cb -0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1lf9 h ALA 369 CO -0.04 0.54 0.09 -0.22 0.00 0.00 0.00 179.25 179.62 1lf9 h LYS 370 N 1.10 0.27 -0.21 0.00 3.64 -0.36 -0.19 116.57 120.83 1lf9 h LYS 370 Ca 0.28 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.66 1lf9 h LYS 370 Cb 0.06 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 1lf9 h LYS 370 CO -0.04 0.31 -0.07 0.28 -2.27 0.00 0.00 179.45 177.66 1lf9 h VAL 371 N 0.17 0.76 -0.61 2.00 2.07 -0.57 0.08 116.25 120.14 1lf9 h VAL 371 Ca 0.06 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1lf9 h VAL 371 Cb 0.13 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1lf9 h VAL 371 CO -0.01 0.00 0.41 0.58 0.02 0.00 0.00 177.57 178.57 1lf9 h VAL 372 N -0.03 1.14 -0.23 2.57 2.07 -0.66 0.66 116.25 121.76 1lf9 h VAL 372 Ca 0.10 -0.28 -0.13 0.00 0.82 0.00 0.00 66.70 67.22 1lf9 h VAL 372 Cb 0.18 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 1lf9 h VAL 372 CO -0.23 0.15 -0.39 0.50 0.02 0.00 0.00 177.57 177.61 1lf9 h LYS 373 N 0.80 0.54 0.00 1.57 3.64 0.01 0.37 116.57 123.50 1lf9 h LYS 373 Ca 0.23 -0.27 -0.20 0.00 -1.27 0.00 0.00 60.65 59.14 1lf9 h LYS 373 Cb -0.05 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 1lf9 h LYS 373 CO -0.05 0.84 -1.03 -0.44 -2.27 0.00 0.00 179.45 176.50 1lf9 h ASP 374 N 0.45 0.00 -0.00 4.20 3.32 -0.11 -3.37 116.42 120.89 1lf9 h ASP 374 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1lf9 h ASP 374 Cb 0.88 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.43 1lf9 h ASP 374 CO 0.08 0.91 -0.13 0.59 -1.72 0.00 0.00 179.24 178.96 1lf9 n ASN 375 N -3.27 0.90 0.00 6.45 3.02 0.14 -4.98 115.26 117.51 1lf9 n ASN 375 Ca -0.02 -0.95 0.00 0.00 -0.03 0.00 0.00 54.58 53.58 1lf9 n ASN 375 Cb 0.92 0.50 0.00 0.00 -0.61 0.00 0.00 39.78 40.59 1lf9 n ASN 375 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lf9 n GLY 376 N 0.74 0.58 3.48 7.41 0.00 0.13 -4.86 105.19 112.67 1lf9 n GLY 376 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.07 1lf9 n GLY 376 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1lf9 n MET 377 N -1.91 0.18 -3.28 1.61 0.00 -1.22 -4.90 117.12 107.59 1lf9 n MET 377 Ca 0.00 -0.71 -0.43 0.00 0.00 0.00 0.00 57.70 56.56 1lf9 n MET 377 Cb 0.04 1.15 -0.08 0.00 0.00 0.00 0.00 33.22 34.33 1lf9 n MET 377 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 1lf9 s ILE 378 N -2.04 5.04 0.66 3.17 -1.09 -1.26 -4.23 121.20 121.45 1lf9 s ILE 378 Ca 0.26 -0.40 -0.12 0.00 -2.23 0.00 0.00 60.65 58.15 1lf9 s ILE 378 Cb -0.01 -4.11 -0.01 0.00 -1.58 0.00 0.00 42.46 36.76 1lf9 s ILE 378 CO -0.00 -0.52 1.06 -2.16 -1.23 0.00 0.00 174.94 172.09 1lf9 s PRO 379 N 2.23 3.05 0.17 2.79 0.04 -1.26 -4.79 135.00 137.23 1lf9 s PRO 379 Ca 0.13 1.04 -0.20 0.00 0.04 0.00 0.00 61.00 62.01 1lf9 s PRO 379 Cb -0.18 -2.00 0.09 0.00 0.04 0.00 0.00 34.50 32.45 1lf9 s PRO 379 CO 0.13 -1.01 1.32 0.94 0.04 0.00 0.00 177.00 178.42 1lf9 n GLN 380 N -2.77 -0.27 -3.72 4.56 7.27 -1.21 -4.72 117.38 116.51 1lf9 n GLN 380 Ca 0.08 1.30 -0.09 0.00 0.07 0.00 0.00 57.00 58.36 1lf9 n GLN 380 Cb 0.53 -1.93 -0.02 0.00 2.41 0.00 0.00 30.24 31.23 1lf9 n GLN 380 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1lf9 s ASN 381 N -5.36 -0.34 0.15 1.69 6.03 -1.26 -4.46 114.94 111.39 1lf9 s ASN 381 Ca -0.11 -0.43 -0.08 0.00 -1.03 0.00 0.00 52.86 51.21 1lf9 s ASN 381 Cb 0.14 0.67 -0.01 0.00 -3.03 0.00 0.00 41.25 39.02 1lf9 s ASN 381 CO 0.58 -1.20 0.24 0.42 -2.03 0.00 0.00 177.10 175.11 1lf9 s THR 382 N -3.87 0.08 0.91 0.54 -4.23 -0.43 -0.95 115.64 107.69 1lf9 s THR 382 Ca 0.08 -1.44 -0.13 0.00 -1.18 0.00 0.00 61.69 59.03 1lf9 s THR 382 Cb -0.04 -1.80 0.14 0.00 1.34 0.00 0.00 72.50 72.13 1lf9 s THR 382 CO 0.00 -0.37 1.15 0.26 -0.54 0.00 0.00 174.62 175.12 1lf9 s TRP 383 N -3.97 2.49 0.56 3.99 0.52 0.29 -0.46 118.94 122.37 1lf9 s TRP 383 Ca 0.17 0.81 0.37 0.00 0.02 0.00 0.00 56.10 57.46 1lf9 s TRP 383 Cb 0.04 -3.43 2.03 0.00 -1.15 0.00 0.00 33.47 30.95 1lf9 s TRP 383 CO -0.01 -2.33 2.27 -0.84 0.02 0.00 0.00 176.95 176.05 1lf9 h ILE 384 N -1.47 0.25 0.00 2.03 3.07 -1.89 -0.54 117.51 118.96 1lf9 h ILE 384 Ca -0.50 -0.12 0.00 0.00 1.55 0.00 0.00 64.86 65.80 1lf9 h ILE 384 Cb 1.33 1.09 0.00 0.00 -0.27 0.00 0.00 36.82 38.97 1lf9 h ILE 384 CO 0.61 0.02 0.00 0.77 -1.05 0.00 0.00 178.15 178.50 1lf9 h SER 385 N 0.00 0.00 0.00 2.16 4.64 -1.98 -3.46 113.55 114.91 1lf9 h SER 385 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1lf9 h SER 385 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1lf9 h SER 385 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1lf9 n GLY 386 N -0.12 0.21 3.69 -0.77 0.00 -0.21 -5.03 105.19 102.96 1lf9 n GLY 386 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1lf9 n GLY 386 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lf9 s LYS 387 N -0.87 4.28 0.41 1.61 2.20 -1.26 -4.74 119.74 121.36 1lf9 s LYS 387 Ca 0.00 1.96 -0.26 0.00 -0.36 0.00 0.00 55.97 57.31 1lf9 s LYS 387 Cb 0.00 -3.60 -0.10 0.00 -1.51 0.00 0.00 37.83 32.62 1lf9 s LYS 387 CO 0.00 -0.59 1.37 -0.35 -0.36 0.00 0.00 175.35 175.42 1lf9 n PRO 388 N 5.50 2.22 -0.10 4.03 -0.04 -1.26 -0.55 135.00 144.80 1lf9 n PRO 388 Ca 0.13 0.79 -0.14 0.00 -0.04 0.00 0.00 63.50 64.24 1lf9 n PRO 388 Cb 0.44 -2.51 -0.05 0.00 -0.04 0.00 0.00 33.50 31.34 1lf9 n PRO 388 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 1lf9 n TYR 389 N 0.03 0.00 -4.12 0.54 4.19 -0.13 -4.77 117.16 112.91 1lf9 n TYR 389 Ca 0.05 0.00 -0.23 0.00 3.31 0.00 0.00 57.90 61.02 1lf9 n TYR 389 Cb 0.39 -0.61 -0.07 0.00 0.49 0.00 0.00 39.34 39.54 1lf9 n TYR 389 CO 0.00 0.00 0.00 -1.58 0.91 0.00 0.00 176.86 176.19 1lf9 s TRP 390 N -2.81 2.68 -0.08 2.98 0.51 -1.25 -5.03 118.94 115.93 1lf9 s TRP 390 Ca -0.31 -0.42 0.12 0.00 -2.12 0.00 0.00 56.10 53.37 1lf9 s TRP 390 Cb 0.07 -1.68 0.19 0.00 -0.81 0.00 0.00 33.47 31.24 1lf9 s TRP 390 CO 0.44 0.32 1.08 -2.37 -0.51 0.00 0.00 176.95 175.92 1lf9 n THR 391 N -1.15 1.32 -1.18 2.01 5.66 -1.26 -3.86 114.28 115.82 1lf9 n THR 391 Ca -0.03 -1.57 -0.33 0.00 -3.05 0.00 0.00 64.05 59.07 1lf9 n THR 391 Cb 0.62 0.03 0.12 0.00 -1.55 0.00 0.00 70.33 69.55 1lf9 n THR 391 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1lf9 s GLY 392 N -2.20 2.04 -0.56 1.09 0.00 -1.26 -4.75 107.32 101.68 1lf9 s GLY 392 Ca 0.21 0.70 -0.15 0.00 0.00 0.00 0.00 44.72 45.48 1lf9 s GLY 392 CO 0.02 1.10 0.51 -0.42 0.00 0.00 0.00 173.10 174.31 1lf9 s ILE 393 N -2.33 5.12 -0.42 0.90 -1.09 -1.26 -3.32 121.20 118.80 1lf9 s ILE 393 Ca 0.70 -1.65 -0.11 0.00 -2.23 0.00 0.00 60.65 57.36 1lf9 s ILE 393 Cb -0.25 -4.28 0.06 0.00 -1.58 0.00 0.00 42.46 36.41 1lf9 s ILE 393 CO 0.51 -0.88 0.27 -1.10 -1.23 0.00 0.00 174.94 172.51 1lf9 s GLN 394 N 1.41 2.74 0.35 2.79 -0.21 -1.26 -1.14 119.66 124.34 1lf9 s GLN 394 Ca 0.05 -1.34 0.03 0.00 0.02 0.00 0.00 55.36 54.12 1lf9 s GLN 394 Cb -0.27 -3.84 0.65 0.00 1.00 0.00 0.00 33.01 30.54 1lf9 s GLN 394 CO 0.01 -0.91 2.00 -0.07 -2.12 0.00 0.00 175.29 174.20 1lf9 h LEU 395 N 8.49 0.73 -1.69 2.90 -0.00 -1.92 -1.67 115.31 122.14 1lf9 h LEU 395 Ca -0.25 -0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.60 1lf9 h LEU 395 Cb 1.09 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 41.57 1lf9 h LEU 395 CO 0.76 0.51 -0.03 -2.24 -0.00 0.00 0.00 178.44 177.44 1lf9 h ASP 396 N 0.85 0.13 1.43 -0.43 2.03 -1.88 -0.92 116.42 117.63 1lf9 h ASP 396 Ca 0.26 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.54 1lf9 h ASP 396 Cb -0.02 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.45 1lf9 h ASP 396 CO -0.06 0.20 0.00 -0.33 -1.03 0.00 0.00 179.24 178.01 1lf9 h GLU 397 N 0.15 0.00 0.00 4.15 5.08 -1.70 -1.13 114.58 121.13 1lf9 h GLU 397 Ca 0.04 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.16 1lf9 h GLU 397 Cb 0.16 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1lf9 h GLU 397 CO 0.01 0.00 -1.23 1.96 -1.00 0.00 0.00 179.01 178.75 1lf9 h GLN 398 N 0.00 0.00 0.17 2.33 1.08 -1.06 -3.38 115.11 114.25 1lf9 h GLN 398 Ca 0.00 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 56.87 1lf9 h GLN 398 Cb 0.72 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.15 1lf9 h GLN 398 CO 0.00 0.79 -1.64 0.00 -0.95 0.00 0.00 178.83 177.04 1lf9 h ALA 399 N 1.03 0.15 -0.70 3.87 0.00 -1.10 -3.39 119.26 119.12 1lf9 h ALA 399 Ca -0.10 -1.09 0.12 0.00 0.00 0.00 0.00 54.91 53.84 1lf9 h ALA 399 Cb 1.83 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 19.89 1lf9 h ALA 399 CO 0.11 1.02 0.27 -0.44 0.00 0.00 0.00 179.25 180.21 1lf9 h ASP 400 N 0.10 0.26 0.10 0.00 3.32 -1.38 -0.23 116.42 118.59 1lf9 h ASP 400 Ca -0.30 0.10 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 1lf9 h ASP 400 Cb 2.08 0.08 -0.00 0.00 0.22 0.00 0.00 39.33 41.71 1lf9 h ASP 400 CO 0.19 0.12 -0.04 1.55 -1.72 0.00 0.00 179.24 179.33 1lf9 h PRO 401 N 0.43 0.00 -0.10 3.56 0.13 -1.77 -0.21 132.00 134.05 1lf9 h PRO 401 Ca 0.37 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.38 1lf9 h PRO 401 Cb 0.53 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.66 1lf9 h PRO 401 CO -0.37 0.04 -0.44 0.82 -0.23 0.00 0.00 178.00 177.83 1lf9 h ILE 402 N 0.00 1.38 -0.38 -3.56 2.04 -1.27 -1.19 117.51 114.53 1lf9 h ILE 402 Ca -0.00 -1.78 -0.00 0.00 1.00 0.00 0.00 64.86 64.08 1lf9 h ILE 402 Cb 0.11 2.22 -0.02 0.00 -0.74 0.00 0.00 36.82 38.39 1lf9 h ILE 402 CO 0.01 0.53 0.23 0.40 0.00 0.00 0.00 178.15 179.32 1lf9 h ILE 403 N 0.04 1.12 -0.66 -0.67 2.04 -0.82 -1.56 117.51 117.00 1lf9 h ILE 403 Ca -0.03 -0.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.56 1lf9 h ILE 403 Cb 1.08 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 1lf9 h ILE 403 CO 0.09 0.12 0.34 0.25 0.00 0.00 0.00 178.15 178.95 1lf9 h LEU 404 N 0.50 0.83 -0.67 1.44 5.85 -1.02 -1.45 115.31 120.79 1lf9 h LEU 404 Ca 0.14 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1lf9 h LEU 404 Cb -0.01 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 1lf9 h LEU 404 CO -0.03 0.69 0.40 0.28 -0.34 0.00 0.00 178.44 179.45 1lf9 h SER 405 N 0.93 0.81 0.43 1.25 0.02 -0.63 -0.53 113.55 115.82 1lf9 h SER 405 Ca 0.23 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1lf9 h SER 405 Cb 0.06 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.40 1lf9 h SER 405 CO -0.03 0.64 -0.21 0.22 -1.14 0.00 0.00 176.83 176.31 1lf9 h TYR 406 N 0.92 -0.53 -0.37 3.45 5.03 -0.45 0.40 116.97 125.42 1lf9 h TYR 406 Ca 0.24 -0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.58 1lf9 h TYR 406 Cb -0.02 0.18 -0.02 0.00 1.55 0.00 0.00 36.73 38.42 1lf9 h TYR 406 CO -0.01 -0.27 0.25 0.00 -1.32 0.00 0.00 178.16 176.81 1lf9 h ARG 407 N -0.69 0.33 -0.01 1.82 3.08 -1.13 0.21 114.38 117.99 1lf9 h ARG 407 Ca -0.06 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1lf9 h ARG 407 Cb 0.50 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1lf9 h ARG 407 CO 0.10 0.22 -0.11 1.28 -1.07 0.00 0.00 179.97 180.38 1lf9 n LEU 408 N -4.48 0.94 -3.75 3.04 4.77 -0.22 -4.93 117.00 112.37 1lf9 n LEU 408 Ca 0.04 -0.25 -0.28 0.00 -0.03 0.00 0.00 56.01 55.49 1lf9 n LEU 408 Cb 0.20 -0.09 0.03 0.00 -2.33 0.00 0.00 43.42 41.23 1lf9 n LEU 408 CO 0.35 0.17 0.12 0.29 -1.33 0.00 0.00 177.39 176.98 1lf9 n LYS 409 N -0.49 -5.79 -2.35 3.23 5.02 0.74 -4.88 118.16 113.63 1lf9 n LYS 409 Ca 0.16 0.65 -0.42 0.00 -2.02 0.00 0.00 58.31 56.69 1lf9 n LYS 409 Cb 0.31 -5.57 0.00 0.00 -0.02 0.00 0.00 35.03 29.76 1lf9 n LYS 409 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1lf9 n ARG 410 N -4.63 4.12 0.00 1.97 5.12 -0.20 -4.72 116.66 118.32 1lf9 n ARG 410 Ca 0.02 -3.72 0.05 0.00 -1.93 0.00 0.00 57.85 52.27 1lf9 n ARG 410 Cb 0.54 -2.76 0.22 0.00 -1.16 0.00 0.00 32.46 29.30 1lf9 n ARG 410 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1lf9 n TYR 411 N 2.67 0.00 0.75 -1.55 4.01 -1.26 -1.64 117.16 120.15 1lf9 n TYR 411 Ca 0.44 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 58.30 1lf9 n TYR 411 Cb 0.32 -0.46 0.48 0.00 -0.31 0.00 0.00 39.34 39.38 1lf9 n TYR 411 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1lf9 n ASP 412 N -1.46 0.11 -1.23 7.72 5.68 -1.26 -2.88 116.55 123.23 1lf9 n ASP 412 Ca 0.03 0.52 0.11 0.00 -0.50 0.00 0.00 54.79 54.95 1lf9 n ASP 412 Cb 0.11 -0.54 0.29 0.00 -1.14 0.00 0.00 41.12 39.84 1lf9 n ASP 412 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1lf9 n LEU 413 N -1.61 3.59 0.05 -2.12 4.77 -0.65 -4.58 117.00 116.46 1lf9 n LEU 413 Ca 0.05 -1.76 -0.11 0.00 -0.03 0.00 0.00 56.01 54.16 1lf9 n LEU 413 Cb 0.28 -0.42 -0.04 0.00 -2.33 0.00 0.00 43.42 40.90 1lf9 n LEU 413 CO 0.22 0.88 0.70 0.22 -1.33 0.00 0.00 177.39 178.08 1lf9 h TYR 414 N 4.04 -0.64 -0.46 -1.77 3.20 -1.72 0.25 116.97 119.87 1lf9 h TYR 414 Ca 0.00 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.78 1lf9 h TYR 414 Cb 0.92 0.29 -0.02 0.00 1.54 0.00 0.00 36.73 39.46 1lf9 h TYR 414 CO 0.42 -0.33 -0.15 -0.44 -1.64 0.00 0.00 178.16 176.03 1lf9 h ASP 415 N -0.36 0.86 0.79 -2.11 3.32 -1.86 0.14 116.42 117.19 1lf9 h ASP 415 Ca 0.07 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.83 1lf9 h ASP 415 Cb 0.45 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1lf9 h ASP 415 CO -0.22 1.01 -1.18 -1.54 -1.72 0.00 0.00 179.24 175.58 1lf9 n SER 416 N -4.14 0.68 0.05 6.45 3.41 -1.17 -4.48 113.62 114.44 1lf9 n SER 416 Ca 0.01 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 1lf9 n SER 416 Cb 0.40 0.74 0.00 0.00 -0.26 0.00 0.00 64.21 65.09 1lf9 n SER 416 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1lf9 n LEU 417 N -2.57 0.59 0.39 1.04 7.94 0.83 -4.66 117.00 120.56 1lf9 n LEU 417 Ca -0.01 0.16 -0.19 0.00 -1.11 0.00 0.00 56.01 54.87 1lf9 n LEU 417 Cb 0.55 -0.12 -0.09 0.00 0.53 0.00 0.00 43.42 44.29 1lf9 n LEU 417 CO 0.41 -0.69 0.58 0.58 -1.11 0.00 0.00 177.39 177.16 1lf9 h VAL 418 N 0.00 0.13 0.32 1.96 2.07 -1.33 -2.44 116.25 116.97 1lf9 h VAL 418 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1lf9 h VAL 418 Cb 0.00 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 29.88 1lf9 h VAL 418 CO 0.00 0.00 -0.38 0.50 0.02 0.00 0.00 177.57 177.71 1lf9 h LYS 419 N -1.06 -0.71 -0.77 1.57 3.64 -1.00 0.18 116.57 118.42 1lf9 h LYS 419 Ca -0.09 0.05 0.11 0.00 -1.27 0.00 0.00 60.65 59.45 1lf9 h LYS 419 Cb 0.86 0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.78 1lf9 h LYS 419 CO 0.09 -0.47 0.51 -1.00 -2.27 0.00 0.00 179.45 176.31 1lf9 h PRO 420 N -0.74 0.62 0.05 1.90 0.13 -1.78 0.16 132.00 132.35 1lf9 h PRO 420 Ca -0.02 -0.04 -0.25 0.00 -0.87 0.00 0.00 66.00 64.83 1lf9 h PRO 420 Cb 0.68 -0.14 0.01 0.00 0.13 0.00 0.00 31.00 31.68 1lf9 h PRO 420 CO -0.10 0.41 -1.05 -0.07 -0.23 0.00 0.00 178.00 176.96 1lf9 h LEU 421 N 0.64 0.53 -0.33 1.56 3.38 -1.12 -2.53 115.31 117.44 1lf9 h LEU 421 Ca 0.36 -0.47 -0.11 0.00 0.09 0.00 0.00 57.88 57.76 1lf9 h LEU 421 Cb 0.54 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1lf9 h LEU 421 CO -0.14 1.29 -0.21 0.00 0.09 0.00 0.00 178.44 179.47 1lf9 h ALA 422 N 0.66 0.48 -0.65 1.53 0.00 0.07 -1.18 119.26 120.17 1lf9 h ALA 422 Ca -0.10 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 1lf9 h ALA 422 Cb 1.72 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.37 1lf9 h ALA 422 CO 0.18 0.43 0.21 -0.44 0.00 0.00 0.00 179.25 179.64 1lf9 h ASP 423 N 0.50 0.91 -0.09 0.00 3.32 -0.77 -1.71 116.42 118.59 1lf9 h ASP 423 Ca 0.07 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 1lf9 h ASP 423 Cb 0.76 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.07 1lf9 h ASP 423 CO 0.06 0.85 0.03 0.15 -1.72 0.00 0.00 179.24 178.61 1lf9 h PHE 424 N 0.95 0.14 -0.41 4.55 -0.00 -1.24 -2.22 116.94 118.71 1lf9 h PHE 424 Ca 0.21 -0.01 0.05 0.00 -0.00 0.00 0.00 57.97 58.23 1lf9 h PHE 424 Cb 0.26 -0.04 -0.05 0.00 -0.00 0.00 0.00 35.95 36.11 1lf9 h PHE 424 CO 0.02 0.26 0.13 0.82 -0.00 0.00 0.00 178.31 179.54 1lf9 h ILE 425 N -0.02 0.85 0.00 1.41 2.04 -0.92 -1.23 117.51 119.65 1lf9 h ILE 425 Ca 0.03 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1lf9 h ILE 425 Cb 0.18 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 1lf9 h ILE 425 CO -0.00 0.05 -0.16 0.40 0.00 0.00 0.00 178.15 178.44 1lf9 h ILE 426 N 0.28 0.65 0.00 -0.67 2.04 -1.24 0.48 117.51 119.05 1lf9 h ILE 426 Ca 0.19 -0.67 -0.13 0.00 1.00 0.00 0.00 64.86 65.25 1lf9 h ILE 426 Cb 0.19 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 1lf9 h ILE 426 CO -0.21 0.15 -0.63 0.50 0.00 0.00 0.00 178.15 177.97 1lf9 h LYS 427 N 0.00 0.00 0.00 2.37 3.64 -0.59 -3.38 116.57 118.61 1lf9 h LYS 427 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1lf9 h LYS 427 Cb 0.41 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1lf9 h LYS 427 CO 0.02 0.63 -0.86 0.44 -2.27 0.00 0.00 179.45 177.41 1lf9 n ILE 428 N -3.40 0.00 -1.03 2.00 -5.35 -0.97 -5.07 119.36 105.55 1lf9 n ILE 428 Ca 0.01 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.19 1lf9 n ILE 428 Cb 0.73 0.24 0.23 0.00 -1.74 0.00 0.00 39.64 39.10 1lf9 n ILE 428 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1lf9 s GLY 429 N -1.87 1.56 0.07 3.28 0.00 0.17 -4.08 107.32 106.45 1lf9 s GLY 429 Ca 0.00 -0.76 0.27 0.00 0.00 0.00 0.00 44.72 44.23 1lf9 s GLY 429 CO 0.00 0.06 1.78 -1.55 0.00 0.00 0.00 173.10 173.39 1lf9 n PRO 430 N -4.69 0.10 -2.18 2.90 -0.04 -1.26 -4.93 135.00 124.90 1lf9 n PRO 430 Ca 0.10 0.07 -0.37 0.00 -0.04 0.00 0.00 63.50 63.27 1lf9 n PRO 430 Cb 0.59 -1.60 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 1lf9 n PRO 430 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1lf9 s LYS 431 N -3.04 3.50 0.19 0.54 2.20 -1.26 -4.75 119.74 117.12 1lf9 s LYS 431 Ca 0.12 1.79 0.11 0.00 -0.36 0.00 0.00 55.97 57.63 1lf9 s LYS 431 Cb 0.16 -2.24 -0.04 0.00 -1.51 0.00 0.00 37.83 34.20 1lf9 s LYS 431 CO 0.58 -0.77 -0.23 -0.08 -0.36 0.00 0.00 175.35 174.49 1lf9 s THR 432 N -1.58 2.28 0.27 3.43 -1.32 -0.45 -4.94 115.64 113.33 1lf9 s THR 432 Ca 0.68 -2.01 0.03 0.00 -1.21 0.00 0.00 61.69 59.18 1lf9 s THR 432 Cb -0.29 -2.08 0.04 0.00 -1.51 0.00 0.00 72.50 68.65 1lf9 s THR 432 CO 0.34 -0.13 1.68 1.23 -2.21 0.00 0.00 174.62 175.52 1lf9 h GLY 433 N 3.23 0.45 -3.93 6.08 0.00 -1.45 -1.30 103.07 106.14 1lf9 h GLY 433 Ca -0.46 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 46.41 1lf9 h GLY 433 CO 0.48 0.38 0.23 -0.86 0.00 0.00 0.00 176.54 176.76 1lf9 s GLN 434 N -4.29 1.04 0.52 4.80 -2.07 -0.90 -2.56 119.66 116.20 1lf9 s GLN 434 Ca -0.06 0.17 -0.05 0.00 -1.82 0.00 0.00 55.36 53.60 1lf9 s GLN 434 Cb 0.13 0.49 0.11 0.00 -1.09 0.00 0.00 33.01 32.65 1lf9 s GLN 434 CO 0.79 -0.34 0.70 -0.85 -1.32 0.00 0.00 175.29 174.28 1lf9 n GLU 435 N 0.76 -0.32 0.34 9.60 -0.00 -0.71 -4.31 120.64 126.00 1lf9 n GLU 435 Ca -0.18 -1.43 0.20 0.00 -0.00 0.00 0.00 57.16 55.76 1lf9 n GLU 435 Cb 0.58 -0.62 1.08 0.00 -0.00 0.00 0.00 31.44 32.48 1lf9 n GLU 435 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.13 177.20 1lf9 h ARG 436 N 0.00 0.00 -0.07 3.44 0.11 -1.97 0.18 114.38 116.07 1lf9 h ARG 436 Ca -0.23 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.85 1lf9 h ARG 436 Cb 0.72 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.80 1lf9 h ARG 436 CO 0.20 0.00 0.00 0.91 0.10 0.00 0.00 179.97 181.18 1lf9 n TRP 437 N -3.02 0.08 -3.08 4.08 5.03 -1.26 -4.92 117.44 114.35 1lf9 n TRP 437 Ca -0.03 -0.04 -0.23 0.00 3.03 0.00 0.00 57.50 60.24 1lf9 n TRP 437 Cb 0.18 0.00 0.03 0.00 -1.03 0.00 0.00 31.31 30.49 1lf9 n TRP 437 CO 0.00 0.00 0.00 0.39 -0.03 0.00 0.00 177.69 178.05 1lf9 n GLU 438 N -0.24 -4.78 0.00 -0.99 1.02 0.63 -4.89 120.64 111.38 1lf9 n GLU 438 Ca 0.17 0.85 0.00 0.00 -0.02 0.00 0.00 57.16 58.16 1lf9 n GLU 438 Cb 0.21 -5.70 0.00 0.00 -0.02 0.00 0.00 31.44 25.93 1lf9 n GLU 438 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1lf9 n GLU 439 N -4.02 2.39 -3.82 3.49 1.02 -1.26 -4.96 120.64 113.48 1lf9 n GLU 439 Ca -0.10 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 56.92 1lf9 n GLU 439 Cb 0.61 -0.85 -0.10 0.00 -0.02 0.00 0.00 31.44 31.09 1lf9 n GLU 439 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 1lf9 s ILE 440 N -1.57 0.06 0.47 -3.67 2.07 -1.26 -4.84 121.20 112.46 1lf9 s ILE 440 Ca 0.00 -0.52 0.06 0.00 -1.41 0.00 0.00 60.65 58.77 1lf9 s ILE 440 Cb 0.00 -0.48 0.02 0.00 0.13 0.00 0.00 42.46 42.13 1lf9 s ILE 440 CO 0.00 -0.29 0.65 -0.83 -1.91 0.00 0.00 174.94 172.56 1lf9 s GLY 441 N -1.15 1.90 0.00 1.50 0.00 -1.06 -1.73 107.32 106.78 1lf9 s GLY 441 Ca -0.12 -1.55 0.00 0.00 0.00 0.00 0.00 44.72 43.05 1lf9 s GLY 441 CO 0.02 -1.33 0.00 0.61 0.00 0.00 0.00 173.10 172.40 1lf9 n GLY 442 N -2.04 0.65 3.41 0.20 0.00 -0.49 -4.74 105.19 102.19 1lf9 n GLY 442 Ca 0.08 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.75 1lf9 n GLY 442 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lf9 s TYR 443 N -1.94 3.25 -0.15 1.61 1.51 -0.44 -1.34 117.35 119.84 1lf9 s TYR 443 Ca 0.00 -0.82 -0.03 0.00 -1.01 0.00 0.00 57.07 55.21 1lf9 s TYR 443 Cb 0.00 -2.64 -0.02 0.00 -0.11 0.00 0.00 41.96 39.19 1lf9 s TYR 443 CO 0.00 -0.66 -0.06 0.45 -1.11 0.00 0.00 175.55 174.18 1lf9 s SER 444 N 1.79 4.61 0.27 2.29 0.15 -1.26 -1.15 113.70 120.40 1lf9 s SER 444 Ca 0.04 -0.18 -0.03 0.00 0.70 0.00 0.00 55.95 56.47 1lf9 s SER 444 Cb -0.20 -1.74 0.36 0.00 -1.71 0.00 0.00 66.02 62.73 1lf9 s SER 444 CO 0.08 0.17 1.92 1.55 1.20 0.00 0.00 173.24 178.15 1lf9 h PRO 445 N 6.73 1.20 -0.26 5.44 0.13 -1.82 0.38 132.00 143.79 1lf9 h PRO 445 Ca -0.30 -0.07 -0.02 0.00 -0.87 0.00 0.00 66.00 64.74 1lf9 h PRO 445 Cb 1.20 -0.27 -0.01 0.00 0.13 0.00 0.00 31.00 32.04 1lf9 h PRO 445 CO 0.61 0.79 0.09 0.00 -0.23 0.00 0.00 178.00 179.26 1lf9 h ALA 446 N 1.43 0.35 -0.19 -0.56 0.00 -1.86 0.15 119.26 118.58 1lf9 h ALA 446 Ca 0.38 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1lf9 h ALA 446 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1lf9 h ALA 446 CO -0.11 -0.03 -0.03 1.15 0.00 0.00 0.00 179.25 180.22 1lf9 h THR 447 N 0.27 1.28 -0.85 0.00 2.02 -1.83 -2.24 112.91 111.55 1lf9 h THR 447 Ca 0.09 -0.98 0.03 0.00 0.77 0.00 0.00 66.41 66.32 1lf9 h THR 447 Cb 0.23 1.55 -0.05 0.00 -1.74 0.00 0.00 68.15 68.14 1lf9 h THR 447 CO -0.00 0.29 0.55 0.24 0.37 0.00 0.00 175.52 176.97 1lf9 h MET 448 N 0.07 1.04 -0.63 6.66 2.86 -0.18 0.27 114.93 125.03 1lf9 h MET 448 Ca 0.05 -0.06 0.07 0.00 -2.06 0.00 0.00 59.70 57.69 1lf9 h MET 448 Cb 0.46 -0.24 -0.06 0.00 0.06 0.00 0.00 31.60 31.83 1lf9 h MET 448 CO 0.02 0.69 0.32 0.00 1.06 0.00 0.00 176.91 179.00 1lf9 h ALA 449 N 1.35 0.84 -0.50 6.32 0.00 -0.57 -0.18 119.26 126.53 1lf9 h ALA 449 Ca 0.34 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 1lf9 h ALA 449 Cb -0.01 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1lf9 h ALA 449 CO -0.11 -0.04 0.01 0.00 0.00 0.00 0.00 179.25 179.11 1lf9 h ALA 450 N 1.36 1.08 -0.42 0.00 0.00 -0.65 -1.24 119.26 119.39 1lf9 h ALA 450 Ca 0.29 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1lf9 h ALA 450 Cb 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1lf9 h ALA 450 CO -0.21 0.58 -0.05 0.93 0.00 0.00 0.00 179.25 180.50 1lf9 h GLU 451 N 0.77 0.78 -0.52 0.00 5.08 -0.02 0.39 114.58 121.06 1lf9 h GLU 451 Ca 0.15 -0.27 -0.10 0.00 -1.00 0.00 0.00 59.36 58.13 1lf9 h GLU 451 Cb 0.45 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1lf9 h GLU 451 CO 0.02 0.87 -0.09 0.28 -1.00 0.00 0.00 179.01 179.10 1lf9 h VAL 452 N 0.60 1.27 -0.49 3.13 2.07 -0.92 0.29 116.25 122.20 1lf9 h VAL 452 Ca 0.11 -1.22 -0.13 0.00 0.82 0.00 0.00 66.70 66.28 1lf9 h VAL 452 Cb 0.56 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1lf9 h VAL 452 CO 0.03 0.43 -0.19 0.00 0.02 0.00 0.00 177.57 177.86 1lf9 h ALA 453 N 0.92 0.68 0.36 1.67 0.00 -1.11 -1.71 119.26 120.06 1lf9 h ALA 453 Ca 0.14 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1lf9 h ALA 453 Cb 0.64 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1lf9 h ALA 453 CO 0.04 0.65 -0.17 0.78 0.00 0.00 0.00 179.25 180.56 1lf9 h GLY 454 N 0.85 -0.50 1.35 0.00 0.00 -0.00 -1.93 103.07 102.84 1lf9 h GLY 454 Ca 0.12 0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.63 1lf9 h GLY 454 CO 0.06 -0.18 0.39 1.41 0.00 0.00 0.00 176.54 178.22 1lf9 h LEU 455 N -0.59 0.76 -0.31 3.11 3.38 -0.95 0.45 115.31 121.16 1lf9 h LEU 455 Ca -0.05 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1lf9 h LEU 455 Cb 0.44 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1lf9 h LEU 455 CO 0.08 0.58 0.13 0.74 0.09 0.00 0.00 178.44 180.06 1lf9 h THR 456 N 0.88 1.18 -0.52 0.22 2.02 -1.24 -0.49 112.91 114.96 1lf9 h THR 456 Ca 0.23 -0.54 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 1lf9 h THR 456 Cb -0.04 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 1lf9 h THR 456 CO -0.04 0.19 0.14 0.00 0.37 0.00 0.00 175.52 176.18 1lf9 h ALA 458 N 1.41 0.87 -0.45 0.00 0.00 -0.40 -1.36 119.26 119.32 1lf9 h ALA 458 Ca 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1lf9 h ALA 458 Cb 0.25 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1lf9 h ALA 458 CO -0.01 0.52 0.26 0.00 0.00 0.00 0.00 179.25 180.02 1lf9 h ALA 459 N 1.10 0.58 -0.64 0.00 0.00 -0.64 0.81 119.26 120.47 1lf9 h ALA 459 Ca 0.22 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1lf9 h ALA 459 Cb 0.25 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1lf9 h ALA 459 CO -0.01 0.09 0.41 -0.92 0.00 0.00 0.00 179.25 178.82 1lf9 h TYR 460 N 0.60 0.77 0.00 0.00 3.20 -1.07 -1.29 116.97 119.17 1lf9 h TYR 460 Ca 0.16 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.94 1lf9 h TYR 460 Cb 0.03 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 1lf9 h TYR 460 CO -0.02 0.46 -0.54 0.82 -1.64 0.00 0.00 178.16 177.23 1lf9 h ILE 461 N 0.81 1.37 -0.30 1.81 2.04 -0.83 -2.50 117.51 119.91 1lf9 h ILE 461 Ca 0.25 -1.87 -0.17 0.00 1.00 0.00 0.00 64.86 64.07 1lf9 h ILE 461 Cb -0.03 2.01 -0.00 0.00 -0.74 0.00 0.00 36.82 38.06 1lf9 h ILE 461 CO -0.08 0.53 -0.48 0.00 0.00 0.00 0.00 178.15 178.12 1lf9 h ALA 462 N 1.46 0.58 -0.62 1.87 0.00 -0.28 -2.45 119.26 119.82 1lf9 h ALA 462 Ca -0.01 -0.49 -0.06 0.00 0.00 0.00 0.00 54.91 54.36 1lf9 h ALA 462 Cb 0.97 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 1lf9 h ALA 462 CO 0.07 0.68 0.17 0.93 0.00 0.00 0.00 179.25 181.09 1lf9 h GLU 463 N 0.64 0.98 -0.09 0.00 5.08 -1.11 0.85 114.58 120.94 1lf9 h GLU 463 Ca 0.03 -0.23 0.03 0.00 -1.00 0.00 0.00 59.36 58.19 1lf9 h GLU 463 Cb 1.06 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.17 1lf9 h GLU 463 CO 0.11 0.88 0.07 1.96 -1.00 0.00 0.00 179.01 181.03 1lf9 h GLN 464 N 0.90 0.00 -0.66 2.33 1.08 -1.34 0.61 115.11 118.02 1lf9 h GLN 464 Ca 0.20 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.40 1lf9 h GLN 464 Cb 0.33 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.76 1lf9 h GLN 464 CO -0.00 0.00 0.00 0.09 -0.95 0.00 0.00 178.83 177.97 1lf9 n ASN 465 N -4.46 3.94 -2.90 1.46 3.02 -0.60 -4.93 115.26 110.77 1lf9 n ASN 465 Ca -0.01 -2.19 -0.22 0.00 -0.03 0.00 0.00 54.58 52.14 1lf9 n ASN 465 Cb 0.18 -0.49 0.02 0.00 -0.61 0.00 0.00 39.78 38.88 1lf9 n ASN 465 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1lf9 n LYS 466 N 1.25 -4.01 -3.02 3.52 5.02 0.21 -4.91 118.16 116.22 1lf9 n LYS 466 Ca 0.23 0.88 -0.38 0.00 -2.02 0.00 0.00 58.31 57.02 1lf9 n LYS 466 Cb 0.68 -5.68 -0.01 0.00 -0.02 0.00 0.00 35.03 30.00 1lf9 n LYS 466 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1lf9 n ASP 467 N -2.37 5.91 0.28 4.39 -0.08 0.28 -4.83 116.55 120.12 1lf9 n ASP 467 Ca -0.13 -3.49 0.13 0.00 -1.51 0.00 0.00 54.79 49.78 1lf9 n ASP 467 Cb 0.63 -1.07 0.83 0.00 2.34 0.00 0.00 41.12 43.84 1lf9 n ASP 467 CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 1lf9 h TYR 468 N 4.77 0.00 -0.05 -0.67 -1.99 -1.90 -0.73 116.97 116.40 1lf9 h TYR 468 Ca 0.26 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.97 1lf9 h TYR 468 Cb 0.56 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.29 1lf9 h TYR 468 CO 1.00 0.01 -0.01 0.93 -0.00 0.00 0.00 178.16 180.08 1lf9 h GLU 469 N 0.00 0.10 -0.51 4.88 5.08 -1.95 -1.26 114.58 120.92 1lf9 h GLU 469 Ca -0.00 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 1lf9 h GLU 469 Cb 0.01 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1lf9 h GLU 469 CO 0.00 0.44 -0.08 0.77 -1.00 0.00 0.00 179.01 179.14 1lf9 h SER 470 N -0.25 0.92 -0.18 1.42 0.02 -1.83 -1.97 113.55 111.69 1lf9 h SER 470 Ca 0.01 -0.28 0.01 0.00 -0.84 0.00 0.00 61.79 60.69 1lf9 h SER 470 Cb 0.41 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1lf9 h SER 470 CO 0.01 1.03 0.09 0.00 -1.14 0.00 0.00 176.83 176.81 1lf9 h ALA 471 N 1.06 0.21 -0.47 3.77 0.00 -1.09 0.23 119.26 122.97 1lf9 h ALA 471 Ca 0.14 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1lf9 h ALA 471 Cb 0.61 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1lf9 h ALA 471 CO 0.04 -0.34 0.29 0.37 0.00 0.00 0.00 179.25 179.62 1lf9 h GLN 472 N 0.19 0.63 -0.72 0.00 4.15 -1.11 -1.11 115.11 117.14 1lf9 h GLN 472 Ca 0.07 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 1lf9 h GLN 472 Cb 0.02 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.54 1lf9 h GLN 472 CO -0.05 0.44 0.44 -0.22 -1.93 0.00 0.00 178.83 177.51 1lf9 h LYS 473 N 0.63 0.98 -0.31 1.69 3.64 -0.98 -1.74 116.57 120.47 1lf9 h LYS 473 Ca 0.17 -0.09 -0.06 0.00 -1.27 0.00 0.00 60.65 59.41 1lf9 h LYS 473 Cb -0.03 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.57 1lf9 h LYS 473 CO -0.03 0.69 -0.03 1.88 -2.27 0.00 0.00 179.45 179.68 1lf9 h TYR 474 N 0.98 0.62 -0.16 1.91 0.99 -0.21 -2.83 116.97 118.29 1lf9 h TYR 474 Ca 0.26 -0.12 -0.17 0.00 2.00 0.00 0.00 58.73 60.69 1lf9 h TYR 474 Cb -0.04 -0.16 -0.00 0.00 1.00 0.00 0.00 36.73 37.53 1lf9 h TYR 474 CO -0.01 0.72 -0.62 1.96 -0.00 0.00 0.00 178.16 180.21 1lf9 h GLN 475 N 0.35 0.55 -0.40 4.88 1.08 -1.13 -1.77 115.11 118.67 1lf9 h GLN 475 Ca 0.08 -0.38 -0.01 0.00 -1.45 0.00 0.00 58.65 56.89 1lf9 h GLN 475 Cb 0.50 0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.97 1lf9 h GLN 475 CO 0.02 1.00 0.20 0.93 -0.95 0.00 0.00 178.83 180.03 1lf9 h GLU 476 N 0.41 0.57 -0.54 1.46 5.08 -1.37 0.16 114.58 120.34 1lf9 h GLU 476 Ca -0.01 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1lf9 h GLU 476 Cb 1.19 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 1lf9 h GLU 476 CO 0.12 0.49 0.26 -0.22 -1.00 0.00 0.00 179.01 178.66 1lf9 h LYS 477 N 0.50 0.78 -0.56 2.33 1.63 -1.47 -0.05 116.57 119.73 1lf9 h LYS 477 Ca 0.14 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 1lf9 h LYS 477 Cb 0.11 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 31.57 1lf9 h LYS 477 CO -0.02 0.64 0.36 0.00 -3.45 0.00 0.00 179.45 176.98 1lf9 h ALA 478 N 1.10 0.71 -0.38 5.00 0.00 -0.93 -0.61 119.26 124.15 1lf9 h ALA 478 Ca 0.19 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1lf9 h ALA 478 Cb 0.11 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1lf9 h ALA 478 CO -0.02 0.16 0.15 -0.44 0.00 0.00 0.00 179.25 179.09 1lf9 h ASP 479 N 0.76 0.52 0.80 0.00 3.45 -0.38 0.31 116.42 121.87 1lf9 h ASP 479 Ca 0.20 -0.17 -0.04 0.00 0.43 0.00 0.00 57.03 57.46 1lf9 h ASP 479 Cb -0.08 -0.14 -0.00 0.00 -0.56 0.00 0.00 39.33 38.56 1lf9 h ASP 479 CO -0.04 0.55 -0.45 -1.13 -1.57 0.00 0.00 179.24 176.59 1lf9 h ASN 480 N 0.46 -1.12 -0.96 6.45 -1.24 -0.69 -0.61 115.58 117.86 1lf9 h ASN 480 Ca 0.13 0.06 0.10 0.00 0.71 0.00 0.00 56.30 57.29 1lf9 h ASN 480 Cb 0.19 0.32 -0.07 0.00 0.73 0.00 0.00 38.32 39.49 1lf9 h ASN 480 CO -0.01 -0.72 0.62 -0.50 -1.29 0.00 0.00 177.43 175.53 1lf9 h TRP 481 N -1.16 1.09 -0.75 0.67 6.55 -1.11 -0.66 115.95 120.58 1lf9 h TRP 481 Ca -0.11 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.76 1lf9 h TRP 481 Cb 0.92 -0.35 -0.04 0.00 -0.86 0.00 0.00 29.16 28.83 1lf9 h TRP 481 CO -0.07 0.49 0.47 0.37 -1.05 0.00 0.00 178.44 178.65 1lf9 h GLN 482 N 1.00 1.00 0.00 0.49 -0.00 -0.66 -1.54 115.11 115.40 1lf9 h GLN 482 Ca 0.45 -0.08 0.00 0.00 -0.00 0.00 0.00 58.65 59.02 1lf9 h GLN 482 Cb 0.37 -0.22 0.00 0.00 0.00 0.00 0.00 27.48 27.63 1lf9 h GLN 482 CO -0.20 0.69 0.00 0.87 0.00 0.00 0.00 178.83 180.19 1lf9 h LYS 483 N 1.02 0.00 0.00 1.69 1.79 0.36 -3.07 116.57 118.36 1lf9 h LYS 483 Ca 0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.74 1lf9 h LYS 483 Cb -0.07 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.58 1lf9 h LYS 483 CO -0.05 0.00 -0.81 1.28 -1.08 0.00 0.00 179.45 178.78 1lf9 n LEU 484 N -2.94 0.74 -0.10 2.94 4.77 -0.64 -4.51 117.00 117.25 1lf9 n LEU 484 Ca 0.01 -0.23 -0.06 0.00 -0.03 0.00 0.00 56.01 55.70 1lf9 n LEU 484 Cb 0.30 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1lf9 n LEU 484 CO 0.26 0.17 0.73 0.40 -1.33 0.00 0.00 177.39 177.62 1lf9 h ILE 485 N 0.00 0.45 -0.34 -0.08 2.04 -1.29 0.15 117.51 118.44 1lf9 h ILE 485 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1lf9 h ILE 485 Cb 0.53 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1lf9 h ILE 485 CO 0.00 0.00 0.17 0.44 0.00 0.00 0.00 178.15 178.76 1lf9 h ASP 486 N -0.13 0.44 -0.26 1.72 3.45 -1.81 0.80 116.42 120.63 1lf9 h ASP 486 Ca 0.18 -0.11 -0.04 0.00 0.43 0.00 0.00 57.03 57.49 1lf9 h ASP 486 Cb 0.40 -0.11 -0.02 0.00 -0.56 0.00 0.00 39.33 39.04 1lf9 h ASP 486 CO -0.44 0.43 0.06 0.78 -1.57 0.00 0.00 179.24 178.49 1lf9 h ASN 487 N 0.42 0.48 0.52 6.45 4.21 -1.67 -0.61 115.58 125.38 1lf9 h ASN 487 Ca 0.12 -0.07 -0.29 0.00 1.21 0.00 0.00 56.30 57.27 1lf9 h ASN 487 Cb 0.10 -0.12 -0.04 0.00 -1.12 0.00 0.00 38.32 37.14 1lf9 h ASN 487 CO -0.02 0.50 -1.61 -0.07 -1.29 0.00 0.00 177.43 174.95 1lf9 h LEU 488 N 0.51 0.11 -0.25 1.61 3.38 -0.51 -3.37 115.31 116.78 1lf9 h LEU 488 Ca 0.12 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1lf9 h LEU 488 Cb 0.24 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1lf9 h LEU 488 CO 0.00 1.17 0.00 0.35 0.09 0.00 0.00 178.44 180.06 1lf9 n THR 489 N -3.21 0.00 -3.46 0.22 -2.24 0.26 -3.92 114.28 101.93 1lf9 n THR 489 Ca -0.16 -0.46 -0.41 0.00 -2.27 0.00 0.00 64.05 60.75 1lf9 n THR 489 Cb 1.03 1.02 -0.10 0.00 -2.10 0.00 0.00 70.33 70.19 1lf9 n THR 489 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1lf9 s TYR 490 N -0.67 3.22 0.26 4.78 6.14 -0.24 -1.47 117.35 129.37 1lf9 s TYR 490 Ca 0.00 -0.19 -0.09 0.00 0.64 0.00 0.00 57.07 57.43 1lf9 s TYR 490 Cb 0.00 -2.59 -0.07 0.00 0.42 0.00 0.00 41.96 39.72 1lf9 s TYR 490 CO 0.00 -0.44 0.57 -0.08 0.64 0.00 0.00 175.55 176.25 1lf9 s THR 491 N 1.86 4.93 -0.02 4.34 -1.32 -0.52 -4.77 115.64 120.15 1lf9 s THR 491 Ca 0.09 0.43 0.02 0.00 -1.21 0.00 0.00 61.69 61.02 1lf9 s THR 491 Cb -0.17 -3.65 0.04 0.00 -1.51 0.00 0.00 72.50 67.21 1lf9 s THR 491 CO 0.11 -0.15 0.83 -0.62 -2.21 0.00 0.00 174.62 172.58 1lf9 n GLU 492 N -0.37 1.26 -1.00 7.08 1.02 -1.22 -1.92 120.64 125.49 1lf9 n GLU 492 Ca 0.00 -1.19 0.04 0.00 -0.02 0.00 0.00 57.16 56.00 1lf9 n GLU 492 Cb 0.53 -0.81 0.08 0.00 -0.02 0.00 0.00 31.44 31.22 1lf9 n GLU 492 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1lf9 n ASN 493 N -0.36 1.13 -4.82 1.62 4.05 -0.94 -4.71 115.26 111.23 1lf9 n ASN 493 Ca 0.02 -2.58 -0.33 0.00 0.45 0.00 0.00 54.58 52.14 1lf9 n ASN 493 Cb 0.45 -0.35 -0.04 0.00 1.23 0.00 0.00 39.78 41.07 1lf9 n ASN 493 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 1lf9 s GLY 494 N -2.23 2.31 0.28 8.20 0.00 -0.10 -4.98 107.32 110.80 1lf9 s GLY 494 Ca 0.30 0.41 0.25 0.00 0.00 0.00 0.00 44.72 45.68 1lf9 s GLY 494 CO -0.10 0.71 1.74 -0.56 0.00 0.00 0.00 173.10 174.89 1lf9 h PRO 495 N 1.35 0.00 -6.41 2.90 0.13 -1.88 -3.30 132.00 124.78 1lf9 h PRO 495 Ca -0.48 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.10 1lf9 h PRO 495 Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 1lf9 h PRO 495 CO 0.60 0.00 -0.01 -0.51 -0.23 0.00 0.00 178.00 177.85 1lf9 s LEU 496 N -4.95 4.35 0.00 1.56 1.43 -1.26 -4.84 118.68 114.97 1lf9 s LEU 496 Ca 0.09 1.22 0.00 0.00 -1.03 0.00 0.00 54.13 54.41 1lf9 s LEU 496 Cb 0.10 -3.38 0.00 0.00 0.03 0.00 0.00 46.19 42.95 1lf9 s LEU 496 CO 0.59 0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.86 1lf9 n GLY 497 N 0.81 2.71 0.23 -3.19 0.00 -1.26 0.38 105.19 104.87 1lf9 n GLY 497 Ca -0.04 0.01 0.01 0.00 0.00 0.00 0.00 46.02 46.00 1lf9 n GLY 497 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1lf9 n ASN 498 N 1.59 0.63 -0.07 1.61 6.94 -1.26 -4.87 115.26 119.83 1lf9 n ASN 498 Ca 0.00 -2.01 -0.01 0.00 -0.02 0.00 0.00 54.58 52.54 1lf9 n ASN 498 Cb 0.00 -0.12 -0.00 0.00 -2.36 0.00 0.00 39.78 37.30 1lf9 n ASN 498 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1lf9 n GLY 499 N 0.59 0.25 3.10 4.83 0.00 0.16 -4.89 105.19 109.23 1lf9 n GLY 499 Ca 0.03 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1lf9 n GLY 499 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1lf9 s GLN 500 N -1.45 2.59 -0.28 1.61 -0.21 -1.26 -0.92 119.66 119.74 1lf9 s GLN 500 Ca 0.00 -1.11 -0.38 0.00 0.02 0.00 0.00 55.36 53.89 1lf9 s GLN 500 Cb 0.00 -2.75 0.16 0.00 1.00 0.00 0.00 33.01 31.42 1lf9 s GLN 500 CO 0.00 -0.41 1.37 1.52 -2.12 0.00 0.00 175.29 175.65 1lf9 s TYR 501 N 1.19 -0.02 0.19 0.91 1.13 -0.81 -4.30 117.35 115.64 1lf9 s TYR 501 Ca -0.03 0.01 -0.30 0.00 -1.41 0.00 0.00 57.07 55.35 1lf9 s TYR 501 Cb -0.17 0.50 -0.08 0.00 -1.10 0.00 0.00 41.96 41.12 1lf9 s TYR 501 CO -0.09 -0.04 1.14 0.71 -2.51 0.00 0.00 175.55 174.77 1lf9 s TYR 502 N -2.06 3.52 0.40 -3.49 1.51 -1.26 -1.43 117.35 114.54 1lf9 s TYR 502 Ca 0.11 1.54 0.03 0.00 -1.01 0.00 0.00 57.07 57.75 1lf9 s TYR 502 Cb -0.01 -3.34 -0.00 0.00 -0.11 0.00 0.00 41.96 38.50 1lf9 s TYR 502 CO -0.03 -0.84 0.58 0.96 -1.11 0.00 0.00 175.55 175.11 1lf9 s ILE 503 N -0.24 3.91 0.15 2.71 -4.36 -0.54 -4.69 121.20 118.13 1lf9 s ILE 503 Ca 0.50 -0.75 -0.18 0.00 -0.26 0.00 0.00 60.65 59.96 1lf9 s ILE 503 Cb -0.31 -3.40 0.00 0.00 1.25 0.00 0.00 42.46 40.01 1lf9 s ILE 503 CO 0.36 -0.22 1.73 -0.09 0.24 0.00 0.00 174.94 176.97 1lf9 h ARG 504 N 0.61 0.16 -1.80 0.37 2.43 -1.22 -3.42 114.38 111.51 1lf9 h ARG 504 Ca -0.45 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 58.72 1lf9 h ARG 504 Cb 1.26 -0.04 -0.24 0.00 -0.42 0.00 0.00 29.97 30.54 1lf9 h ARG 504 CO 0.54 0.11 0.27 -1.50 -1.51 0.00 0.00 179.97 177.89 1lf9 s ILE 505 N -6.17 0.00 -0.18 1.20 2.07 -1.26 -4.39 121.20 112.47 1lf9 s ILE 505 Ca -0.13 0.00 -0.15 0.00 -1.41 0.00 0.00 60.65 58.96 1lf9 s ILE 505 Cb 0.11 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.66 1lf9 s ILE 505 CO 0.70 0.00 0.34 0.00 -1.91 0.00 0.00 174.94 174.07 1lf9 s ALA 506 N 0.48 3.57 0.09 1.50 0.00 -0.30 -4.86 121.76 122.25 1lf9 s ALA 506 Ca -0.00 -0.51 0.24 0.00 0.00 0.00 0.00 51.96 51.69 1lf9 s ALA 506 Cb -0.05 -2.51 0.86 0.00 0.00 0.00 0.00 23.12 21.42 1lf9 s ALA 506 CO -0.05 -0.11 1.80 0.78 0.00 0.00 0.00 175.76 178.18 1lf9 h GLY 507 N 7.18 0.00 -2.06 0.00 0.00 -1.89 -1.18 103.07 105.12 1lf9 h GLY 507 Ca -0.39 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.66 1lf9 h GLY 507 CO 0.73 0.00 -0.36 0.48 0.00 0.00 0.00 176.54 177.39 1lf9 s LEU 508 N -6.72 1.14 0.00 3.11 0.05 -1.26 -4.88 118.68 110.12 1lf9 s LEU 508 Ca 0.01 -1.46 0.00 0.00 0.05 0.00 0.00 54.13 52.73 1lf9 s LEU 508 Cb 0.10 1.01 0.00 0.00 -2.05 0.00 0.00 46.19 45.24 1lf9 s LEU 508 CO 0.64 -1.10 0.55 -1.54 -0.55 0.00 0.00 176.35 174.34 1lf9 n SER 509 N -1.02 1.57 -3.31 1.48 3.41 -1.26 -4.42 113.62 110.07 1lf9 n SER 509 Ca 0.03 -1.06 -0.09 0.00 -0.26 0.00 0.00 58.87 57.49 1lf9 n SER 509 Cb 0.63 -0.29 -0.06 0.00 -0.26 0.00 0.00 64.21 64.23 1lf9 n SER 509 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1lf9 s ASP 510 N 1.22 0.33 0.00 4.04 2.15 -1.26 -4.83 116.67 118.33 1lf9 s ASP 510 Ca 0.00 -0.28 0.16 0.00 0.43 0.00 0.00 52.55 52.87 1lf9 s ASP 510 Cb 0.00 1.13 0.73 0.00 -0.30 0.00 0.00 42.92 44.48 1lf9 s ASP 510 CO 0.00 -0.34 1.51 -0.81 -0.17 0.00 0.00 175.17 175.36 1lf9 n PRO 511 N 5.36 0.06 0.04 4.34 -0.04 -1.25 -2.65 135.00 140.85 1lf9 n PRO 511 Ca 0.00 0.20 0.11 0.00 -0.04 0.00 0.00 63.50 63.77 1lf9 n PRO 511 Cb 0.49 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.40 1lf9 n PRO 511 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1lf9 n ASP 512 N -1.45 0.50 -4.85 3.54 8.00 -1.26 -4.55 116.55 116.48 1lf9 n ASP 512 Ca 0.05 0.01 -0.31 0.00 0.71 0.00 0.00 54.79 55.26 1lf9 n ASP 512 Cb 0.18 1.09 0.04 0.00 -0.02 0.00 0.00 41.12 42.40 1lf9 n ASP 512 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1lf9 s ALA 513 N -3.35 2.80 0.12 2.24 0.00 -1.09 -4.89 121.76 117.59 1lf9 s ALA 513 Ca -0.01 -0.14 -0.25 0.00 0.00 0.00 0.00 51.96 51.56 1lf9 s ALA 513 Cb 0.13 -3.09 -0.07 0.00 0.00 0.00 0.00 23.12 20.08 1lf9 s ALA 513 CO 0.84 -1.12 0.75 -0.51 0.00 0.00 0.00 175.76 175.72 1lf9 s ASP 514 N -4.09 7.31 -0.30 0.00 -0.00 -1.26 -4.82 116.67 113.51 1lf9 s ASP 514 Ca 0.58 1.55 -0.12 0.00 -0.00 0.00 0.00 52.55 54.56 1lf9 s ASP 514 Cb -0.12 -2.48 0.13 0.00 -0.00 0.00 0.00 42.92 40.45 1lf9 s ASP 514 CO 0.54 0.15 0.73 0.12 -0.00 0.00 0.00 175.17 176.71 1lf9 s PHE 515 N -0.80 -1.16 0.12 4.23 2.19 -1.26 -5.03 117.98 116.27 1lf9 s PHE 515 Ca 0.36 2.07 -0.26 0.00 0.33 0.00 0.00 56.93 59.43 1lf9 s PHE 515 Cb -0.22 0.70 -0.07 0.00 -1.31 0.00 0.00 43.02 42.12 1lf9 s PHE 515 CO 0.25 -0.58 0.79 -1.64 1.83 0.00 0.00 175.22 175.87 1lf9 s MET 516 N 2.56 4.56 0.06 10.12 -1.94 -1.26 -0.27 119.30 133.13 1lf9 s MET 516 Ca -0.06 1.15 0.06 0.00 -1.71 0.00 0.00 55.69 55.13 1lf9 s MET 516 Cb -0.10 -3.30 -0.03 0.00 2.01 0.00 0.00 34.83 33.41 1lf9 s MET 516 CO -0.19 0.45 -0.16 0.96 -0.01 0.00 0.00 175.02 176.07 1lf9 s ILE 517 N -0.69 1.30 -0.24 2.53 -4.36 0.09 -4.89 121.20 114.94 1lf9 s ILE 517 Ca 0.38 -1.24 -0.10 0.00 -0.26 0.00 0.00 60.65 59.43 1lf9 s ILE 517 Cb -0.22 -1.20 -0.05 0.00 1.25 0.00 0.00 42.46 42.24 1lf9 s ILE 517 CO 0.25 -0.06 0.15 0.20 0.24 0.00 0.00 174.94 175.73 1lf9 s ASN 518 N -1.50 6.05 0.02 4.36 -0.87 -1.26 -2.16 114.94 119.58 1lf9 s ASN 518 Ca 0.02 0.09 -0.23 0.00 -1.57 0.00 0.00 52.86 51.17 1lf9 s ASN 518 Cb -0.09 -2.09 -0.05 0.00 -0.02 0.00 0.00 41.25 38.99 1lf9 s ASN 518 CO 0.02 0.06 0.69 -0.63 -2.57 0.00 0.00 177.10 174.67 1lf9 s ILE 519 N 1.10 4.81 1.27 0.60 -1.09 0.51 -4.96 121.20 123.45 1lf9 s ILE 519 Ca 0.07 1.47 -0.20 0.00 -2.23 0.00 0.00 60.65 59.76 1lf9 s ILE 519 Cb -0.14 -4.04 0.31 0.00 -1.58 0.00 0.00 42.46 37.02 1lf9 s ILE 519 CO 0.05 0.39 1.04 0.00 -1.23 0.00 0.00 174.94 175.18 1lf9 s ALA 520 N -0.11 0.06 -1.53 9.38 0.00 -1.26 -3.02 121.76 125.27 1lf9 s ALA 520 Ca 0.35 -0.84 -0.14 0.00 0.00 0.00 0.00 51.96 51.33 1lf9 s ALA 520 Cb -0.20 -2.93 0.11 0.00 0.00 0.00 0.00 23.12 20.10 1lf9 s ALA 520 CO 0.20 -3.95 0.78 0.09 0.00 0.00 0.00 175.76 172.89 1lf9 n ASN 521 N -5.07 -4.04 -0.62 0.00 3.02 -1.26 -0.65 115.26 106.64 1lf9 n ASN 521 Ca 0.12 -0.75 -0.08 0.00 -0.03 0.00 0.00 54.58 53.84 1lf9 n ASN 521 Cb 0.59 -3.28 -0.03 0.00 -0.61 0.00 0.00 39.78 36.45 1lf9 n ASN 521 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lf9 n GLY 522 N -1.44 0.93 0.17 7.41 0.00 -1.26 -3.62 105.19 107.39 1lf9 n GLY 522 Ca 0.04 -0.27 0.12 0.00 0.00 0.00 0.00 46.02 45.91 1lf9 n GLY 522 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1lf9 h GLY 523 N 0.00 0.00 0.00 -0.02 0.00 -0.80 -3.49 103.07 98.77 1lf9 h GLY 523 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.17 1lf9 h GLY 523 CO 0.24 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.39 1lf9 n GLY 524 N -0.92 -1.73 3.15 4.60 0.00 -1.24 -4.82 105.19 104.23 1lf9 n GLY 524 Ca -0.01 -2.05 -0.28 0.00 0.00 0.00 0.00 46.02 43.69 1lf9 n GLY 524 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lf9 s VAL 525 N 0.00 1.60 0.19 1.61 1.01 -1.26 -0.36 120.40 123.19 1lf9 s VAL 525 Ca 0.00 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.13 1lf9 s VAL 525 Cb 0.00 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 1lf9 s VAL 525 CO 0.00 0.46 0.26 -0.31 0.00 0.00 0.00 175.10 175.51 1lf9 s TYR 526 N 0.24 0.64 0.32 5.22 1.51 -0.92 -4.98 117.35 119.37 1lf9 s TYR 526 Ca -0.10 -0.97 -0.26 0.00 -1.01 0.00 0.00 57.07 54.73 1lf9 s TYR 526 Cb -0.14 -0.18 -0.10 0.00 -0.11 0.00 0.00 41.96 41.43 1lf9 s TYR 526 CO 0.04 -0.74 0.94 0.34 -1.11 0.00 0.00 175.55 175.02 1lf9 s ASP 527 N -3.04 7.35 0.37 2.29 -1.08 -1.26 -0.73 116.67 120.58 1lf9 s ASP 527 Ca 0.25 1.83 0.14 0.00 -0.52 0.00 0.00 52.55 54.24 1lf9 s ASP 527 Cb 0.04 -2.58 0.96 0.00 -1.46 0.00 0.00 42.92 39.88 1lf9 s ASP 527 CO 0.05 -0.05 1.81 0.06 0.52 0.00 0.00 175.17 177.56 1lf9 h GLN 528 N 3.24 0.52 0.00 4.34 3.07 -0.97 0.37 115.11 125.68 1lf9 h GLN 528 Ca -0.47 -0.03 0.00 0.00 0.09 0.00 0.00 58.65 58.24 1lf9 h GLN 528 Cb 1.19 -0.12 0.00 0.00 0.08 0.00 0.00 27.48 28.63 1lf9 h GLN 528 CO 0.65 0.34 0.00 1.63 0.09 0.00 0.00 178.83 181.55 1lf9 n LYS 529 N -4.62 0.10 0.10 0.06 5.02 -1.26 -2.56 118.16 115.00 1lf9 n LYS 529 Ca 0.22 0.36 0.12 0.00 -2.02 0.00 0.00 58.31 56.99 1lf9 n LYS 529 Cb 0.69 -1.70 0.23 0.00 -0.02 0.00 0.00 35.03 34.22 1lf9 n LYS 529 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1lf9 h GLU 530 N 0.00 0.00 -5.08 1.97 5.08 -1.29 -3.40 114.58 111.86 1lf9 h GLU 530 Ca 0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 1lf9 h GLU 530 Cb 0.29 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 29.33 1lf9 h GLU 530 CO 0.00 0.00 -0.61 0.42 -1.00 0.00 0.00 179.01 177.82 1lf9 s ILE 531 N -3.17 4.46 0.19 3.13 -1.09 -1.06 -4.94 121.20 118.72 1lf9 s ILE 531 Ca 0.07 -0.13 0.09 0.00 -2.23 0.00 0.00 60.65 58.45 1lf9 s ILE 531 Cb 0.12 -3.05 -0.04 0.00 -1.58 0.00 0.00 42.46 37.90 1lf9 s ILE 531 CO 0.68 0.38 -0.08 0.68 -1.23 0.00 0.00 174.94 175.38 1lf9 s VAL 532 N 1.14 3.28 -0.10 2.92 -7.23 -1.26 -0.80 120.40 118.36 1lf9 s VAL 532 Ca 0.04 -1.65 -0.05 0.00 -1.81 0.00 0.00 61.98 58.52 1lf9 s VAL 532 Cb -0.14 -2.64 0.05 0.00 0.56 0.00 0.00 36.38 34.21 1lf9 s VAL 532 CO 0.03 -0.13 0.22 -0.62 -0.31 0.00 0.00 175.10 174.29 1lf9 s ASP 533 N -2.92 -0.01 0.00 4.85 -1.08 -1.26 -3.76 116.67 112.50 1lf9 s ASP 533 Ca 0.26 0.48 0.02 0.00 -0.52 0.00 0.00 52.55 52.79 1lf9 s ASP 533 Cb -0.09 0.42 0.12 0.00 -1.46 0.00 0.00 42.92 41.91 1lf9 s ASP 533 CO 0.16 -0.19 0.97 -0.81 0.52 0.00 0.00 175.17 175.83 1lf9 n PRO 534 N 4.57 0.02 0.18 4.34 -0.04 -1.25 -2.07 135.00 140.76 1lf9 n PRO 534 Ca -0.20 0.35 0.13 0.00 -0.04 0.00 0.00 63.50 63.74 1lf9 n PRO 534 Cb 0.52 -1.50 0.65 0.00 -0.04 0.00 0.00 33.50 33.13 1lf9 n PRO 534 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1lf9 h SER 535 N 0.00 0.00 0.03 3.54 0.02 -1.95 -1.92 113.55 113.27 1lf9 h SER 535 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1lf9 h SER 535 Cb 0.03 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.57 1lf9 h SER 535 CO 0.00 0.00 -0.02 2.19 -1.14 0.00 0.00 176.83 177.86 1lf9 h PHE 536 N 0.00 0.00 0.00 3.45 -0.00 -1.80 -0.51 116.94 118.08 1lf9 h PHE 536 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1lf9 h PHE 536 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.07 1lf9 h PHE 536 CO 0.00 0.02 0.00 1.28 -0.00 0.00 0.00 178.31 179.61 1lf9 n LEU 537 N -4.20 0.11 0.28 2.10 4.77 -0.72 -0.75 117.00 118.58 1lf9 n LEU 537 Ca -0.03 0.55 0.15 0.00 -0.03 0.00 0.00 56.01 56.65 1lf9 n LEU 537 Cb 0.10 -0.56 0.80 0.00 -2.33 0.00 0.00 43.42 41.43 1lf9 n LEU 537 CO 0.31 -0.57 1.01 -0.33 -1.33 0.00 0.00 177.39 176.49 1lf9 h GLU 538 N 0.00 0.00 -0.36 3.23 4.39 -1.31 -0.92 114.58 119.61 1lf9 h GLU 538 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1lf9 h GLU 538 Cb 0.02 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 1lf9 h GLU 538 CO 0.00 0.08 0.23 -0.07 -1.16 0.00 0.00 179.01 178.10 1lf9 h LEU 539 N 0.00 0.42 0.20 1.33 3.38 -1.15 -1.17 115.31 118.31 1lf9 h LEU 539 Ca -0.00 -0.02 -0.32 0.00 0.09 0.00 0.00 57.88 57.63 1lf9 h LEU 539 Cb 0.30 -0.10 0.03 0.00 0.09 0.00 0.00 40.66 40.98 1lf9 h LEU 539 CO 0.01 0.31 -1.39 -0.37 0.09 0.00 0.00 178.44 177.09 1lf9 h VAL 540 N 0.48 1.30 -0.95 1.22 -1.51 -1.53 0.20 116.25 115.47 1lf9 h VAL 540 Ca 0.13 -2.66 0.17 0.00 -1.23 0.00 0.00 66.70 63.11 1lf9 h VAL 540 Cb -0.05 2.93 -0.10 0.00 -2.13 0.00 0.00 31.29 31.94 1lf9 h VAL 540 CO -0.03 0.80 0.55 -0.09 -1.23 0.00 0.00 177.57 177.57 1lf9 h ARG 541 N 0.18 0.71 -0.01 5.19 9.65 -1.04 0.12 114.38 129.18 1lf9 h ARG 541 Ca -0.22 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.61 1lf9 h ARG 541 Cb 2.08 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 30.50 1lf9 h ARG 541 CO 0.26 0.47 -0.07 1.28 2.80 0.00 0.00 179.97 184.71 1lf9 n LEU 542 N -4.80 1.20 -0.20 3.80 4.77 -0.46 -4.45 117.00 116.87 1lf9 n LEU 542 Ca 0.21 -0.37 -0.02 0.00 -0.03 0.00 0.00 56.01 55.80 1lf9 n LEU 542 Cb 0.51 -0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1lf9 n LEU 542 CO 0.21 0.21 -0.02 0.61 -1.33 0.00 0.00 177.39 177.07 1lf9 n GLY 543 N 1.21 0.31 0.09 -0.72 0.00 0.03 -4.39 105.19 101.72 1lf9 n GLY 543 Ca 0.17 -0.83 -0.09 0.00 0.00 0.00 0.00 46.02 45.27 1lf9 n GLY 543 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1lf9 n VAL 544 N -3.93 1.50 -4.07 1.61 0.31 0.64 -3.35 118.33 111.05 1lf9 n VAL 544 Ca -0.02 -0.83 -0.13 0.00 -0.01 0.00 0.00 64.34 63.35 1lf9 n VAL 544 Cb 0.48 -0.75 -0.12 0.00 -0.91 0.00 0.00 33.84 32.55 1lf9 n VAL 544 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1lf9 s LYS 545 N -2.54 0.52 0.56 5.55 -0.14 -0.75 -4.61 119.74 118.32 1lf9 s LYS 545 Ca -0.07 -0.72 -0.18 0.00 -1.36 0.00 0.00 55.97 53.64 1lf9 s LYS 545 Cb 0.07 -0.29 -0.05 0.00 -1.68 0.00 0.00 37.83 35.87 1lf9 s LYS 545 CO 0.83 0.05 1.08 -1.12 -0.76 0.00 0.00 175.35 175.42 1lf9 s SER 546 N -1.49 5.85 0.42 2.83 0.01 -1.26 -3.90 113.70 116.16 1lf9 s SER 546 Ca -0.09 1.96 0.19 0.00 1.31 0.00 0.00 55.95 59.32 1lf9 s SER 546 Cb -0.10 -2.55 0.93 0.00 0.21 0.00 0.00 66.02 64.51 1lf9 s SER 546 CO 0.00 -1.12 1.87 0.00 0.41 0.00 0.00 173.24 174.40 1lf9 h ALA 547 N 0.90 1.22 -0.02 1.44 0.00 -1.93 -2.74 119.26 118.14 1lf9 h ALA 547 Ca -0.48 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1lf9 h ALA 547 Cb 1.23 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1lf9 h ALA 547 CO 0.57 0.37 -0.08 -0.40 0.00 0.00 0.00 179.25 179.71 1lf9 n ASP 548 N -3.76 1.91 -4.66 0.00 5.68 -1.26 -4.68 116.55 109.77 1lf9 n ASP 548 Ca -0.01 -1.56 -0.52 0.00 -0.50 0.00 0.00 54.79 52.20 1lf9 n ASP 548 Cb 0.39 0.06 -0.06 0.00 -1.14 0.00 0.00 41.12 40.37 1lf9 n ASP 548 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1lf9 n ASP 549 N 0.38 2.52 0.11 -1.12 4.64 -1.03 -4.79 116.55 117.25 1lf9 n ASP 549 Ca 0.16 1.07 0.20 0.00 -1.38 0.00 0.00 54.79 54.83 1lf9 n ASP 549 Cb 0.43 -1.25 0.76 0.00 -1.04 0.00 0.00 41.12 40.02 1lf9 n ASP 549 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1lf9 h PRO 550 N 6.69 0.00 -0.13 -0.67 0.13 -1.92 0.11 132.00 136.21 1lf9 h PRO 550 Ca -0.47 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.49 1lf9 h PRO 550 Cb 1.30 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.43 1lf9 h PRO 550 CO 0.89 0.00 -0.64 0.87 -0.23 0.00 0.00 178.00 178.90 1lf9 h LYS 551 N 0.00 0.50 -0.12 0.86 1.57 -1.97 -1.14 116.57 116.27 1lf9 h LYS 551 Ca 0.18 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.58 1lf9 h LYS 551 Cb 0.95 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.31 1lf9 h LYS 551 CO -0.00 0.97 -0.00 0.82 -0.57 0.00 0.00 179.45 180.67 1lf9 h ILE 552 N 0.36 1.25 -0.89 1.86 1.08 -1.14 -2.02 117.51 118.01 1lf9 h ILE 552 Ca -0.01 -0.82 -0.00 0.00 -0.39 0.00 0.00 64.86 63.64 1lf9 h ILE 552 Cb 1.20 1.57 -0.04 0.00 -3.07 0.00 0.00 36.82 36.47 1lf9 h ILE 552 CO 0.12 0.24 0.55 -0.07 -0.69 0.00 0.00 178.15 178.29 1lf9 h LEU 553 N -0.06 1.05 -0.49 1.44 -0.00 -1.31 -0.26 115.31 115.69 1lf9 h LEU 553 Ca 0.03 -0.05 -0.04 0.00 -0.00 0.00 0.00 57.88 57.83 1lf9 h LEU 553 Cb 0.36 -0.27 -0.02 0.00 -0.00 0.00 0.00 40.66 40.74 1lf9 h LEU 553 CO 0.01 0.79 0.16 0.78 -0.00 0.00 0.00 178.44 180.18 1lf9 h ASN 554 N 1.22 0.70 -0.43 -0.43 -0.26 -1.11 -2.32 115.58 112.95 1lf9 h ASN 554 Ca 0.32 -0.20 -0.08 0.00 -0.56 0.00 0.00 56.30 55.78 1lf9 h ASN 554 Cb -0.08 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 36.98 1lf9 h ASN 554 CO -0.06 0.71 -0.03 0.74 -1.06 0.00 0.00 177.43 177.73 1lf9 h THR 555 N 0.65 1.25 -0.93 2.81 2.02 -0.95 -2.70 112.91 115.06 1lf9 h THR 555 Ca 0.16 -1.09 0.02 0.00 0.77 0.00 0.00 66.41 66.27 1lf9 h THR 555 Cb 0.26 0.91 -0.05 0.00 -1.74 0.00 0.00 68.15 67.52 1lf9 h THR 555 CO -0.01 0.38 0.61 0.25 0.37 0.00 0.00 175.52 177.13 1lf9 h LEU 556 N 0.79 1.04 -0.20 2.58 5.85 -0.79 0.18 115.31 124.76 1lf9 h LEU 556 Ca 0.14 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1lf9 h LEU 556 Cb 0.52 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1lf9 h LEU 556 CO 0.03 0.74 0.11 0.11 -0.34 0.00 0.00 178.44 179.09 1lf9 h LYS 557 N 1.22 0.28 -0.29 1.25 1.57 -1.10 -0.58 116.57 118.92 1lf9 h LYS 557 Ca 0.36 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 59.08 1lf9 h LYS 557 Cb -0.08 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1lf9 h LYS 557 CO -0.10 0.26 0.07 0.28 -0.57 0.00 0.00 179.45 179.39 1lf9 h VAL 558 N 0.22 1.22 -0.33 0.50 2.07 -1.30 -1.50 116.25 117.13 1lf9 h VAL 558 Ca 0.07 -0.72 0.03 0.00 0.82 0.00 0.00 66.70 66.90 1lf9 h VAL 558 Cb 0.06 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 1lf9 h VAL 558 CO -0.01 0.24 0.14 0.58 0.02 0.00 0.00 177.57 178.54 1lf9 h VAL 559 N 0.30 0.95 0.00 2.57 2.07 -0.83 -0.96 116.25 120.36 1lf9 h VAL 559 Ca 0.09 -0.10 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 1lf9 h VAL 559 Cb 0.29 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1lf9 h VAL 559 CO 0.00 0.06 -0.30 0.44 0.02 0.00 0.00 177.57 177.79 1lf9 h ASP 560 N 0.30 0.00 1.51 0.57 3.32 -1.01 0.06 116.42 121.18 1lf9 h ASP 560 Ca 0.14 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.13 1lf9 h ASP 560 Cb 0.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1lf9 h ASP 560 CO -0.12 0.30 -0.31 0.28 -1.72 0.00 0.00 179.24 177.66 1lf9 h SER 561 N 0.00 0.00 0.00 6.45 0.02 -0.65 -3.33 113.55 116.04 1lf9 h SER 561 Ca -0.00 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.77 1lf9 h SER 561 Cb 0.63 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.13 1lf9 h SER 561 CO 0.04 0.31 -1.66 0.35 -1.14 0.00 0.00 176.83 174.73 1lf9 n THR 562 N -3.22 0.66 -0.35 -2.27 -2.24 -0.42 -4.85 114.28 101.58 1lf9 n THR 562 Ca 0.02 -0.23 0.04 0.00 -2.27 0.00 0.00 64.05 61.60 1lf9 n THR 562 Cb 0.62 -1.05 0.07 0.00 -2.10 0.00 0.00 70.33 67.86 1lf9 n THR 562 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1lf9 n ILE 563 N -2.97 1.30 -3.44 2.28 -5.35 -0.02 -4.99 119.36 106.18 1lf9 n ILE 563 Ca -0.21 -1.38 -0.37 0.00 -0.27 0.00 0.00 62.75 60.52 1lf9 n ILE 563 Cb 0.71 0.27 -0.06 0.00 -1.74 0.00 0.00 39.64 38.82 1lf9 n ILE 563 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1lf9 s LYS 564 N -1.59 3.96 -0.02 6.28 2.20 -1.20 -1.85 119.74 127.52 1lf9 s LYS 564 Ca 0.13 0.46 0.01 0.00 -0.36 0.00 0.00 55.97 56.21 1lf9 s LYS 564 Cb 0.10 -3.13 0.02 0.00 -1.51 0.00 0.00 37.83 33.32 1lf9 s LYS 564 CO 0.03 0.61 -0.01 0.08 -0.36 0.00 0.00 175.35 175.71 1lf9 s VAL 565 N -1.22 0.21 -0.42 4.02 1.01 -0.04 -4.97 120.40 118.99 1lf9 s VAL 565 Ca 0.29 0.03 -0.17 0.00 0.00 0.00 0.00 61.98 62.13 1lf9 s VAL 565 Cb -0.16 -0.27 0.02 0.00 0.00 0.00 0.00 36.38 35.96 1lf9 s VAL 565 CO 0.17 0.13 0.45 -1.81 0.00 0.00 0.00 175.10 174.03 1lf9 s ASP 566 N 0.78 6.20 0.49 3.32 1.01 -1.26 -1.27 116.67 125.94 1lf9 s ASP 566 Ca -0.08 -0.63 0.04 0.00 0.71 0.00 0.00 52.55 52.59 1lf9 s ASP 566 Cb -0.11 -2.23 0.02 0.00 1.01 0.00 0.00 42.92 41.61 1lf9 s ASP 566 CO -0.01 -0.58 0.69 0.42 0.21 0.00 0.00 175.17 175.90 1lf9 s THR 567 N 2.17 2.93 -1.46 -1.27 -4.23 -0.12 -4.95 115.64 108.71 1lf9 s THR 567 Ca 0.13 -0.77 0.11 0.00 -1.18 0.00 0.00 61.69 59.98 1lf9 s THR 567 Cb -0.17 -3.05 0.20 0.00 1.34 0.00 0.00 72.50 70.81 1lf9 s THR 567 CO 0.14 -0.03 1.24 -0.81 -0.54 0.00 0.00 174.62 174.61 1lf9 n PRO 568 N -2.14 0.16 -0.00 3.99 -0.04 -1.26 -1.45 135.00 134.26 1lf9 n PRO 568 Ca 0.07 0.17 0.09 0.00 -0.04 0.00 0.00 63.50 63.80 1lf9 n PRO 568 Cb 0.59 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.43 1lf9 n PRO 568 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1lf9 n LYS 569 N -1.27 0.68 0.00 0.54 4.76 -1.26 -5.09 118.16 116.52 1lf9 n LYS 569 Ca 0.05 -0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 1lf9 n LYS 569 Cb 0.08 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 31.86 1lf9 n LYS 569 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1lf9 n GLY 570 N 1.43 0.96 3.80 0.72 0.00 -0.53 -4.53 105.19 107.04 1lf9 n GLY 570 Ca 0.02 -2.03 -0.35 0.00 0.00 0.00 0.00 46.02 43.66 1lf9 n GLY 570 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1lf9 s PRO 571 N -1.13 4.42 0.26 1.61 0.04 -1.26 -0.95 135.00 138.00 1lf9 s PRO 571 Ca 0.00 1.21 -0.12 0.00 0.04 0.00 0.00 61.00 62.13 1lf9 s PRO 571 Cb 0.00 -2.57 -0.00 0.00 0.04 0.00 0.00 34.50 31.96 1lf9 s PRO 571 CO 0.00 0.17 0.50 0.45 0.04 0.00 0.00 177.00 178.16 1lf9 s SER 572 N -1.84 -0.01 0.11 6.66 0.15 -0.39 -4.75 113.70 113.64 1lf9 s SER 572 Ca 0.54 -0.98 0.01 0.00 0.70 0.00 0.00 55.95 56.23 1lf9 s SER 572 Cb -0.15 0.61 -0.04 0.00 -1.71 0.00 0.00 66.02 64.73 1lf9 s SER 572 CO 0.20 -1.19 -0.04 0.26 1.20 0.00 0.00 173.24 173.67 1lf9 s TRP 573 N -3.86 0.94 0.47 3.44 0.51 -1.26 -0.86 118.94 118.31 1lf9 s TRP 573 Ca 0.22 -0.97 -0.03 0.00 -2.12 0.00 0.00 56.10 53.20 1lf9 s TRP 573 Cb -0.01 -0.54 -0.02 0.00 -0.81 0.00 0.00 33.47 32.08 1lf9 s TRP 573 CO 0.10 -0.21 0.74 0.71 -0.51 0.00 0.00 176.95 177.78 1lf9 s TYR 574 N -3.68 3.45 0.32 -1.98 2.02 -0.77 -1.90 117.35 114.80 1lf9 s TYR 574 Ca 0.15 0.60 0.12 0.00 -0.37 0.00 0.00 57.07 57.57 1lf9 s TYR 574 Cb 0.06 -2.29 0.55 0.00 -0.40 0.00 0.00 41.96 39.88 1lf9 s TYR 574 CO -0.03 -0.30 1.73 0.00 -1.57 0.00 0.00 175.55 175.38 1lf9 h ARG 575 N 0.29 0.00 0.00 -0.62 3.08 -1.92 -3.42 114.38 111.79 1lf9 h ARG 575 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1lf9 h ARG 575 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 1lf9 h ARG 575 CO 0.61 0.48 0.00 2.48 -1.07 0.00 0.00 179.97 182.47 1lf9 n TYR 576 N -3.94 0.00 -1.85 3.04 0.18 -1.26 -3.86 117.16 109.48 1lf9 n TYR 576 Ca -0.01 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.35 1lf9 n TYR 576 Cb 0.51 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.45 1lf9 n TYR 576 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1lf9 s ASN 577 N 0.00 6.44 -0.07 9.48 2.20 -1.25 -2.57 114.94 129.18 1lf9 s ASN 577 Ca 0.00 2.91 0.00 0.00 -0.94 0.00 0.00 52.86 54.83 1lf9 s ASN 577 Cb 0.00 -2.64 0.00 0.00 -2.00 0.00 0.00 41.25 36.61 1lf9 s ASN 577 CO 0.00 -0.84 0.00 1.41 -2.94 0.00 0.00 177.10 174.73 1lf9 n HIS 578 N 1.61 0.00 -1.82 1.54 8.25 -1.26 -4.91 115.22 118.62 1lf9 n HIS 578 Ca 0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.10 1lf9 n HIS 578 Cb 0.39 -0.39 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 1lf9 n HIS 578 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1lf9 s ASP 579 N -2.47 6.43 0.00 0.41 2.15 -1.06 -4.46 116.67 117.67 1lf9 s ASP 579 Ca 0.00 2.87 0.06 0.00 0.43 0.00 0.00 52.55 55.92 1lf9 s ASP 579 Cb 0.00 -2.63 0.14 0.00 -0.30 0.00 0.00 42.92 40.13 1lf9 s ASP 579 CO 0.00 -0.88 1.01 0.61 -0.17 0.00 0.00 175.17 175.74 1lf9 n GLY 580 N 2.46 1.76 3.58 2.66 0.00 -1.26 -0.86 105.19 113.53 1lf9 n GLY 580 Ca 0.09 -0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 1lf9 n GLY 580 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1lf9 s TYR 581 N -0.86 2.77 0.00 1.61 6.04 -1.26 -1.29 117.35 124.36 1lf9 s TYR 581 Ca 0.12 -1.61 0.00 0.00 0.04 0.00 0.00 57.07 55.62 1lf9 s TYR 581 Cb 0.06 -4.76 0.00 0.00 -1.04 0.00 0.00 41.96 36.23 1lf9 s TYR 581 CO 0.09 -1.81 0.00 0.41 -1.54 0.00 0.00 175.55 172.70 1lf9 n GLY 582 N 5.43 -0.74 3.72 8.97 0.00 -1.22 -4.01 105.19 117.34 1lf9 n GLY 582 Ca 0.49 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 1lf9 n GLY 582 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1lf9 n GLU 583 N -0.36 2.70 0.14 1.61 4.71 -1.21 -1.92 120.64 126.30 1lf9 n GLU 583 Ca 0.00 0.97 0.02 0.00 -0.01 0.00 0.00 57.16 58.14 1lf9 n GLU 583 Cb 0.00 -2.80 0.38 0.00 -1.01 0.00 0.00 31.44 28.01 1lf9 n GLU 583 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 1lf9 h PRO 584 N 6.28 0.18 -4.14 3.49 0.13 -1.82 -2.89 132.00 133.24 1lf9 h PRO 584 Ca -0.44 -0.05 -0.26 0.00 -0.87 0.00 0.00 66.00 64.38 1lf9 h PRO 584 Cb 1.21 -0.02 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 1lf9 h PRO 584 CO 0.92 0.38 -0.23 -1.54 -0.23 0.00 0.00 178.00 177.30 1lf9 s SER 585 N -6.90 0.79 0.52 1.44 1.04 -1.26 -4.61 113.70 104.72 1lf9 s SER 585 Ca -0.05 -1.43 0.29 0.00 0.48 0.00 0.00 55.95 55.24 1lf9 s SER 585 Cb 0.15 0.63 1.37 0.00 0.10 0.00 0.00 66.02 68.27 1lf9 s SER 585 CO 0.73 -1.24 2.01 0.50 0.98 0.00 0.00 173.24 176.22 1lf9 h LYS 586 N 2.16 0.00 -0.35 4.02 1.63 -2.03 -3.05 116.57 118.95 1lf9 h LYS 586 Ca -0.28 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.52 1lf9 h LYS 586 Cb 1.24 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 1lf9 h LYS 586 CO 0.39 0.12 0.00 0.25 -3.45 0.00 0.00 179.45 176.76 1lf9 n THR 587 N -3.40 1.18 -4.60 1.00 -2.24 -1.26 -4.99 114.28 99.98 1lf9 n THR 587 Ca -0.01 -1.12 -0.23 0.00 -2.27 0.00 0.00 64.05 60.43 1lf9 n THR 587 Cb 0.29 0.40 -0.14 0.00 -2.10 0.00 0.00 70.33 68.77 1lf9 n THR 587 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1lf9 s GLU 588 N -1.25 1.17 0.39 -0.78 2.02 -1.15 -5.14 118.70 113.96 1lf9 s GLU 588 Ca 0.27 -0.66 -0.05 0.00 0.02 0.00 0.00 54.97 54.54 1lf9 s GLU 588 Cb 0.16 -1.16 -0.05 0.00 0.10 0.00 0.00 34.13 33.18 1lf9 s GLU 588 CO 0.15 0.31 0.68 -0.51 0.02 0.00 0.00 175.26 175.91 1lf9 s LEU 589 N -0.70 3.85 0.15 1.80 1.43 -1.26 -4.12 118.68 119.84 1lf9 s LEU 589 Ca 0.05 0.82 -0.30 0.00 -1.03 0.00 0.00 54.13 53.67 1lf9 s LEU 589 Cb -0.07 -3.71 -0.08 0.00 0.03 0.00 0.00 46.19 42.37 1lf9 s LEU 589 CO 0.00 -0.39 1.23 -0.47 0.23 0.00 0.00 176.35 176.95 1lf9 s TYR 590 N -2.42 3.39 -0.04 0.29 5.04 -1.26 -4.63 117.35 117.72 1lf9 s TYR 590 Ca 0.46 1.33 0.23 0.00 -2.44 0.00 0.00 57.07 56.64 1lf9 s TYR 590 Cb -0.10 -3.47 0.42 0.00 0.35 0.00 0.00 41.96 39.16 1lf9 s TYR 590 CO 0.37 -1.41 1.18 0.72 -1.34 0.00 0.00 175.55 175.07 1lf9 n HIS 591 N 3.00 0.00 0.00 4.97 8.25 -1.26 -4.94 115.22 125.24 1lf9 n HIS 591 Ca 0.06 -0.69 0.00 0.00 -0.26 0.00 0.00 57.72 56.84 1lf9 n HIS 591 Cb 0.45 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.39 1lf9 n HIS 591 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lf9 n GLY 592 N 0.17 1.56 3.43 -1.41 0.00 -1.26 -5.07 105.19 102.61 1lf9 n GLY 592 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 1lf9 n GLY 592 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lf9 s ALA 593 N -1.50 -1.42 0.00 4.61 0.00 -1.26 -4.35 121.76 117.84 1lf9 s ALA 593 Ca 0.00 1.91 0.00 0.00 0.00 0.00 0.00 51.96 53.87 1lf9 s ALA 593 Cb 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.93 1lf9 s ALA 593 CO 0.00 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 175.79 1lf9 n GLY 594 N 4.43 2.10 2.96 0.00 0.00 -0.41 -4.61 105.19 109.66 1lf9 n GLY 594 Ca -0.20 0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 1lf9 n GLY 594 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lf9 s LYS 595 N 4.57 1.92 0.58 1.61 1.02 -0.81 -4.34 119.74 124.30 1lf9 s LYS 595 Ca 0.00 -0.44 -0.20 0.00 0.02 0.00 0.00 55.97 55.35 1lf9 s LYS 595 Cb 0.00 -1.90 -0.04 0.00 -0.52 0.00 0.00 37.83 35.37 1lf9 s LYS 595 CO 0.00 -0.27 1.29 0.20 -0.92 0.00 0.00 175.35 175.65 1lf9 s GLY 596 N 1.58 2.84 0.00 -3.33 0.00 -0.04 -3.35 107.32 105.02 1lf9 s GLY 596 Ca 0.04 1.20 0.00 0.00 0.00 0.00 0.00 44.72 45.97 1lf9 s GLY 596 CO -0.09 1.67 0.00 0.54 0.00 0.00 0.00 173.10 175.21 1lf9 n ARG 597 N -1.35 2.62 -2.78 2.90 5.12 -1.26 -4.88 116.66 117.03 1lf9 n ARG 597 Ca 0.12 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.64 1lf9 n ARG 597 Cb 0.47 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.72 1lf9 n ARG 597 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1lf9 s LEU 598 N 0.00 4.53 -0.38 0.55 1.02 -0.96 -4.57 118.68 118.87 1lf9 s LEU 598 Ca 0.00 1.78 -0.11 0.00 0.02 0.00 0.00 54.13 55.82 1lf9 s LEU 598 Cb 0.00 -3.53 0.04 0.00 0.02 0.00 0.00 46.19 42.72 1lf9 s LEU 598 CO 0.00 0.01 0.22 0.26 0.02 0.00 0.00 176.35 176.86 1lf9 s TRP 599 N -0.35 3.26 0.37 0.29 0.52 -0.80 -0.21 118.94 122.02 1lf9 s TRP 599 Ca 0.44 -1.07 0.37 0.00 0.02 0.00 0.00 56.10 55.86 1lf9 s TRP 599 Cb -0.24 -2.53 2.00 0.00 -1.15 0.00 0.00 33.47 31.55 1lf9 s TRP 599 CO 0.29 -0.69 2.13 -1.00 0.02 0.00 0.00 176.95 177.70 1lf9 h PRO 600 N 8.44 0.00 -0.75 4.98 0.13 -1.81 -0.01 132.00 142.98 1lf9 h PRO 600 Ca -0.25 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.87 1lf9 h PRO 600 Cb 1.10 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.19 1lf9 h PRO 600 CO 0.69 0.00 0.45 1.25 -0.23 0.00 0.00 178.00 180.16 1lf9 h LEU 601 N 0.00 0.91 -1.06 1.56 5.85 -1.86 -1.90 115.31 118.81 1lf9 h LEU 601 Ca 0.00 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 1lf9 h LEU 601 Cb 0.01 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 1lf9 h LEU 601 CO 0.00 0.71 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.54 1lf9 h LEU 602 N 1.03 0.00 -0.40 2.25 3.38 -1.34 -1.43 115.31 118.81 1lf9 h LEU 602 Ca 0.27 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.11 1lf9 h LEU 602 Cb -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1lf9 h LEU 602 CO -0.05 0.20 -0.27 0.74 0.09 0.00 0.00 178.44 179.15 1lf9 h THR 603 N 0.00 1.28 -0.47 0.22 2.02 -1.26 -1.49 112.91 113.21 1lf9 h THR 603 Ca -0.00 -1.42 -0.12 0.00 0.77 0.00 0.00 66.41 65.63 1lf9 h THR 603 Cb 0.76 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.47 1lf9 h THR 603 CO 0.03 0.48 -0.17 1.23 0.37 0.00 0.00 175.52 177.46 1lf9 h GLY 604 N 0.70 1.03 1.45 2.16 0.00 -0.99 -1.95 103.07 105.47 1lf9 h GLY 604 Ca 0.08 -0.88 -0.04 0.00 0.00 0.00 0.00 47.33 46.49 1lf9 h GLY 604 CO 0.07 0.81 0.12 0.83 0.00 0.00 0.00 176.54 178.37 1lf9 h GLU 605 N 0.80 0.69 -0.43 4.80 5.08 -1.13 -0.34 114.58 124.06 1lf9 h GLU 605 Ca 0.11 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 1lf9 h GLU 605 Cb 0.73 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 1lf9 h GLU 605 CO 0.06 0.62 -0.18 -0.09 -1.00 0.00 0.00 179.01 178.42 1lf9 h ARG 606 N 0.68 0.82 -0.83 2.33 9.65 -1.09 -1.56 114.38 124.38 1lf9 h ARG 606 Ca 0.16 -0.31 -0.02 0.00 -1.10 0.00 0.00 59.98 58.70 1lf9 h ARG 606 Cb 0.24 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.73 1lf9 h ARG 606 CO -0.00 0.93 0.42 0.78 2.80 0.00 0.00 179.97 184.90 1lf9 h GLY 607 N 0.96 1.26 1.92 2.80 0.00 -0.48 0.23 103.07 109.77 1lf9 h GLY 607 Ca 0.11 -0.60 -0.09 0.00 0.00 0.00 0.00 47.33 46.75 1lf9 h GLY 607 CO 0.05 0.57 -0.37 -0.33 0.00 0.00 0.00 176.54 176.46 1lf9 h MET 608 N 1.17 0.09 -0.20 4.80 2.86 -0.72 -1.90 114.93 121.03 1lf9 h MET 608 Ca 0.29 -0.04 -0.10 0.00 -2.06 0.00 0.00 59.70 57.80 1lf9 h MET 608 Cb 0.08 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.73 1lf9 h MET 608 CO -0.04 0.45 -0.25 -0.92 1.06 0.00 0.00 176.91 177.21 1lf9 h TYR 609 N 0.08 0.63 -0.93 -0.22 5.03 -0.26 -2.65 116.97 118.65 1lf9 h TYR 609 Ca 0.01 -0.20 0.09 0.00 2.58 0.00 0.00 58.73 61.20 1lf9 h TYR 609 Cb 0.70 -0.13 -0.07 0.00 1.55 0.00 0.00 36.73 38.78 1lf9 h TYR 609 CO 0.00 0.90 0.60 0.93 -1.32 0.00 0.00 178.16 179.27 1lf9 h GLU 610 N 0.18 0.96 -0.52 1.82 4.39 -0.67 -0.28 114.58 120.47 1lf9 h GLU 610 Ca 0.02 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.62 1lf9 h GLU 610 Cb 0.82 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 1lf9 h GLU 610 CO 0.06 0.64 0.12 0.82 -1.16 0.00 0.00 179.01 179.49 1lf9 h ILE 611 N 0.99 1.22 0.00 3.13 2.04 -1.23 0.31 117.51 123.97 1lf9 h ILE 611 Ca 0.42 -0.81 -0.06 0.00 1.00 0.00 0.00 64.86 65.41 1lf9 h ILE 611 Cb 0.32 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1lf9 h ILE 611 CO -0.18 0.30 -0.29 0.00 0.00 0.00 0.00 178.15 177.98 1lf9 h ALA 612 N 1.36 1.01 -0.28 1.87 0.00 -0.78 -2.06 119.26 120.38 1lf9 h ALA 612 Ca 0.17 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1lf9 h ALA 612 Cb 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1lf9 h ALA 612 CO -0.00 0.37 0.00 0.00 0.00 0.00 0.00 179.25 179.62 1lf9 n ALA 613 N -2.26 2.54 -3.00 0.00 0.00 -0.27 -4.73 120.51 112.79 1lf9 n ALA 613 Ca -0.00 -0.54 -0.19 0.00 0.00 0.00 0.00 53.44 52.71 1lf9 n ALA 613 Cb 0.46 -0.99 0.04 0.00 0.00 0.00 0.00 19.45 18.97 1lf9 n ALA 613 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lf9 n GLY 614 N 0.85 -0.30 3.62 0.00 0.00 -0.77 -5.02 105.19 103.57 1lf9 n GLY 614 Ca 0.10 -0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 1lf9 n GLY 614 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lf9 s LYS 615 N -5.63 1.96 -0.05 1.61 1.02 -0.02 -5.02 119.74 113.62 1lf9 s LYS 615 Ca 0.30 -2.12 -0.30 0.00 0.02 0.00 0.00 55.97 53.87 1lf9 s LYS 615 Cb -0.13 -1.58 -0.02 0.00 -0.52 0.00 0.00 37.83 35.57 1lf9 s LYS 615 CO 0.37 -0.08 1.01 0.34 -0.92 0.00 0.00 175.35 176.08 1lf9 s ASP 616 N -3.71 7.28 0.00 2.83 3.68 -1.26 -4.11 116.67 121.38 1lf9 s ASP 616 Ca 0.33 1.62 0.19 0.00 2.13 0.00 0.00 52.55 56.82 1lf9 s ASP 616 Cb 0.09 -2.56 0.38 0.00 -1.45 0.00 0.00 42.92 39.38 1lf9 s ASP 616 CO 0.17 -0.38 1.31 0.00 0.13 0.00 0.00 175.17 176.40 1lf9 n ALA 617 N 4.51 2.38 -0.21 3.66 0.00 -1.26 -4.64 120.51 124.95 1lf9 n ALA 617 Ca 0.08 -1.00 0.01 0.00 0.00 0.00 0.00 53.44 52.53 1lf9 n ALA 617 Cb 0.49 -0.73 0.11 0.00 0.00 0.00 0.00 19.45 19.32 1lf9 n ALA 617 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1lf9 h THR 618 N 3.74 0.45 -0.05 0.00 2.02 -1.95 0.14 112.91 117.26 1lf9 h THR 618 Ca 0.00 -0.03 0.01 0.00 0.77 0.00 0.00 66.41 67.16 1lf9 h THR 618 Cb 0.88 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1lf9 h THR 618 CO 0.00 0.02 0.04 1.55 0.37 0.00 0.00 175.52 177.50 1lf9 h PRO 619 N 0.10 0.00 -0.02 6.66 0.13 -2.00 -0.49 132.00 136.39 1lf9 h PRO 619 Ca 0.34 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 65.23 1lf9 h PRO 619 Cb 0.55 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.69 1lf9 h PRO 619 CO -0.56 0.00 -0.96 1.88 -0.23 0.00 0.00 178.00 178.13 1lf9 h TYR 620 N 0.00 0.82 -0.03 1.56 0.05 -1.10 -0.82 116.97 117.45 1lf9 h TYR 620 Ca 0.02 -0.43 -0.00 0.00 0.05 0.00 0.00 58.73 58.37 1lf9 h TYR 620 Cb 0.11 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 37.75 1lf9 h TYR 620 CO 0.00 1.26 0.01 0.28 -1.05 0.00 0.00 178.16 178.66 1lf9 h VAL 621 N 0.33 1.13 -0.98 -2.88 2.07 -0.31 -2.08 116.25 113.54 1lf9 h VAL 621 Ca -0.09 -0.40 0.01 0.00 0.82 0.00 0.00 66.70 67.04 1lf9 h VAL 621 Cb 1.59 1.35 -0.05 0.00 -1.52 0.00 0.00 31.29 32.67 1lf9 h VAL 621 CO 0.18 0.11 0.65 0.11 0.02 0.00 0.00 177.57 178.64 1lf9 h LYS 622 N -0.12 1.29 -0.19 1.57 1.79 -1.14 -1.92 116.57 117.86 1lf9 h LYS 622 Ca 0.01 -0.08 0.02 0.00 -2.18 0.00 0.00 60.65 58.42 1lf9 h LYS 622 Cb 0.16 -0.29 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 1lf9 h LYS 622 CO -0.00 0.85 0.06 0.00 -1.08 0.00 0.00 179.45 179.28 1lf9 h ALA 623 N 1.36 0.21 -0.77 3.86 0.00 -0.88 -0.91 119.26 122.14 1lf9 h ALA 623 Ca 0.36 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 1lf9 h ALA 623 Cb -0.15 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1lf9 h ALA 623 CO -0.08 -0.37 0.43 0.52 0.00 0.00 0.00 179.25 179.74 1lf9 h MET 624 N 0.14 1.06 -0.75 0.00 2.86 -1.06 -0.72 114.93 116.46 1lf9 h MET 624 Ca 0.08 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1lf9 h MET 624 Cb 0.06 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.47 1lf9 h MET 624 CO -0.10 0.77 0.35 0.93 1.06 0.00 0.00 176.91 179.93 1lf9 h GLU 625 N 1.07 1.08 0.00 1.72 5.08 -0.63 -2.10 114.58 120.79 1lf9 h GLU 625 Ca 0.27 -0.16 -0.11 0.00 -1.00 0.00 0.00 59.36 58.37 1lf9 h GLU 625 Cb 0.01 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 1lf9 h GLU 625 CO -0.05 0.84 -0.53 0.87 -1.00 0.00 0.00 179.01 179.14 1lf9 h LYS 626 N 1.07 0.00 0.00 2.33 1.57 -0.42 -2.94 116.57 118.18 1lf9 h LYS 626 Ca 0.26 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 1lf9 h LYS 626 Cb 0.12 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1lf9 h LYS 626 CO -0.03 0.53 -0.02 0.74 -0.57 0.00 0.00 179.45 180.09 1lf9 h PHE 627 N 0.00 0.00 -4.04 -1.35 0.05 -0.52 -3.44 116.94 107.64 1lf9 h PHE 627 Ca -0.01 0.00 -0.52 0.00 3.82 0.00 0.00 57.97 61.27 1lf9 h PHE 627 Cb 1.13 0.00 0.09 0.00 2.00 0.00 0.00 35.95 39.17 1lf9 h PHE 627 CO 0.00 0.02 0.49 0.00 -0.18 0.00 0.00 178.31 178.65 1lf9 s ALA 628 N -3.51 2.82 0.81 2.45 0.00 -0.88 -4.70 121.76 118.74 1lf9 s ALA 628 Ca 0.03 0.99 -0.05 0.00 0.00 0.00 0.00 51.96 52.93 1lf9 s ALA 628 Cb 0.08 -3.42 0.10 0.00 0.00 0.00 0.00 23.12 19.88 1lf9 s ALA 628 CO 0.59 -0.89 0.65 0.27 0.00 0.00 0.00 175.76 176.38 1lf9 n ASN 629 N -0.93 0.36 0.00 0.00 0.23 -0.38 -4.84 115.26 109.70 1lf9 n ASN 629 Ca 0.10 -1.42 0.18 0.00 -0.53 0.00 0.00 54.58 52.91 1lf9 n ASN 629 Cb 0.48 -0.47 0.65 0.00 -2.08 0.00 0.00 39.78 38.37 1lf9 n ASN 629 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1lf9 h GLU 630 N 0.00 0.07 -0.12 -3.83 4.81 -1.94 0.22 114.58 113.79 1lf9 h GLU 630 Ca -0.21 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 1lf9 h GLU 630 Cb 0.66 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.02 1lf9 h GLU 630 CO 0.18 0.04 0.00 0.41 -0.73 0.00 0.00 179.01 178.91 1lf9 n GLY 631 N -1.61 -0.02 2.07 1.92 0.00 -1.26 -4.84 105.19 101.44 1lf9 n GLY 631 Ca 0.09 -0.35 -0.02 0.00 0.00 0.00 0.00 46.02 45.74 1lf9 n GLY 631 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lf9 n GLY 632 N 1.05 0.54 3.74 -0.02 0.00 0.77 -4.87 105.19 106.41 1lf9 n GLY 632 Ca 0.16 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.95 1lf9 n GLY 632 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lf9 s ILE 633 N -2.06 5.39 -0.21 -0.61 1.01 -1.26 -4.75 121.20 118.72 1lf9 s ILE 633 Ca 0.00 0.27 -0.11 0.00 0.00 0.00 0.00 60.65 60.81 1lf9 s ILE 633 Cb 0.00 -3.50 -0.05 0.00 0.01 0.00 0.00 42.46 38.92 1lf9 s ILE 633 CO 0.00 0.45 0.18 -0.63 0.00 0.00 0.00 174.94 174.94 1lf9 s ILE 634 N 0.24 5.36 0.55 2.92 1.01 -1.26 -1.25 121.20 128.77 1lf9 s ILE 634 Ca 0.11 0.26 -0.01 0.00 0.00 0.00 0.00 60.65 61.01 1lf9 s ILE 634 Cb -0.12 -3.52 0.03 0.00 0.01 0.00 0.00 42.46 38.86 1lf9 s ILE 634 CO -0.00 0.38 0.80 -0.94 0.00 0.00 0.00 174.94 175.17 1lf9 s SER 635 N 0.75 5.39 0.22 3.58 1.04 -1.26 -0.60 113.70 122.81 1lf9 s SER 635 Ca 0.10 0.21 -0.04 0.00 0.48 0.00 0.00 55.95 56.70 1lf9 s SER 635 Cb -0.13 -1.17 0.20 0.00 0.10 0.00 0.00 66.02 65.02 1lf9 s SER 635 CO 0.02 -1.09 1.63 -0.08 0.98 0.00 0.00 173.24 174.70 1lf9 h GLU 636 N 0.03 0.73 -4.29 4.02 4.81 -1.18 -3.42 114.58 115.29 1lf9 h GLU 636 Ca -0.44 -0.30 -0.18 0.00 -0.13 0.00 0.00 59.36 58.30 1lf9 h GLU 636 Cb 1.28 -0.03 -0.18 0.00 0.63 0.00 0.00 28.75 30.45 1lf9 h GLU 636 CO 0.56 0.91 -0.70 -0.65 -0.73 0.00 0.00 179.01 178.40 1lf9 s GLN 637 N -4.55 0.54 0.06 1.92 -0.21 -1.26 -3.98 119.66 112.19 1lf9 s GLN 637 Ca -0.09 -0.96 0.02 0.00 0.02 0.00 0.00 55.36 54.35 1lf9 s GLN 637 Cb 0.13 0.01 -0.03 0.00 1.00 0.00 0.00 33.01 34.12 1lf9 s GLN 637 CO 0.83 -0.04 -0.08 0.14 -2.12 0.00 0.00 175.29 174.02 1lf9 s VAL 638 N -2.61 0.62 0.51 1.09 -7.23 0.71 -2.05 120.40 111.44 1lf9 s VAL 638 Ca -0.03 -1.39 -0.21 0.00 -1.81 0.00 0.00 61.98 58.54 1lf9 s VAL 638 Cb -0.02 -1.01 -0.06 0.00 0.56 0.00 0.00 36.38 35.85 1lf9 s VAL 638 CO -0.04 -0.55 1.16 0.26 -0.31 0.00 0.00 175.10 175.62 1lf9 s TRP 639 N -2.17 2.73 0.13 2.82 0.52 0.49 -2.26 118.94 121.20 1lf9 s TRP 639 Ca -0.02 1.53 -0.11 0.00 0.02 0.00 0.00 56.10 57.52 1lf9 s TRP 639 Cb -0.05 -3.36 -0.07 0.00 -1.15 0.00 0.00 33.47 28.84 1lf9 s TRP 639 CO -0.01 -1.63 1.43 0.93 0.02 0.00 0.00 176.95 177.68 1lf9 h GLU 640 N 1.58 0.90 -0.28 4.98 3.07 -1.96 -0.17 114.58 122.71 1lf9 h GLU 640 Ca -0.50 -0.54 -0.17 0.00 -0.50 0.00 0.00 59.36 57.65 1lf9 h GLU 640 Cb 1.26 0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 29.22 1lf9 h GLU 640 CO 0.58 1.19 -0.49 0.38 -1.40 0.00 0.00 179.01 179.27 1lf9 h ASP 641 N 0.71 0.85 0.00 1.42 2.03 -1.96 -3.38 116.42 116.09 1lf9 h ASP 641 Ca 0.03 -0.43 -0.11 0.00 -0.73 0.00 0.00 57.03 55.78 1lf9 h ASP 641 Cb 1.10 -0.24 -0.02 0.00 -0.83 0.00 0.00 39.33 39.34 1lf9 h ASP 641 CO 0.11 1.20 -1.56 0.35 -1.03 0.00 0.00 179.24 178.31 1lf9 n THR 642 N -4.01 0.43 -0.86 1.15 -2.24 -1.25 -4.57 114.28 102.93 1lf9 n THR 642 Ca -0.03 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 1lf9 n THR 642 Cb 0.59 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 1lf9 n THR 642 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lf9 n GLY 643 N 2.29 0.57 3.89 3.38 0.00 -0.07 -4.43 105.19 110.82 1lf9 n GLY 643 Ca -0.11 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 1lf9 n GLY 643 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lf9 s LEU 644 N 0.00 3.16 0.49 0.99 1.43 -1.26 -4.64 118.68 118.86 1lf9 s LEU 644 Ca 0.00 1.13 -0.23 0.00 -1.03 0.00 0.00 54.13 54.00 1lf9 s LEU 644 Cb 0.00 -4.03 -0.06 0.00 0.03 0.00 0.00 46.19 42.12 1lf9 s LEU 644 CO 0.00 -1.03 1.27 -2.84 0.23 0.00 0.00 176.35 173.97 1lf9 s PRO 645 N -5.15 3.51 0.00 1.29 0.02 -1.26 -0.38 135.00 133.03 1lf9 s PRO 645 Ca 0.55 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.59 1lf9 s PRO 645 Cb -0.11 -2.38 0.00 0.00 0.02 0.00 0.00 34.50 32.03 1lf9 s PRO 645 CO 0.50 -0.82 0.00 0.25 -0.33 0.00 0.00 177.00 176.60 1lf9 n THR 646 N -0.65 0.00 -0.45 0.99 -2.24 -0.87 -4.71 114.28 106.36 1lf9 n THR 646 Ca 0.08 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.83 1lf9 n THR 646 Cb 0.46 -1.30 0.23 0.00 -2.10 0.00 0.00 70.33 67.62 1lf9 n THR 646 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1lf9 n ASP 647 N -1.53 4.08 -4.44 3.42 2.03 -1.26 -4.63 116.55 114.23 1lf9 n ASP 647 Ca 0.00 -2.85 -0.29 0.00 0.52 0.00 0.00 54.79 52.16 1lf9 n ASP 647 Cb 0.00 -0.68 0.15 0.00 -0.72 0.00 0.00 41.12 39.88 1lf9 n ASP 647 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1lf9 s SER 648 N -0.59 3.40 0.23 1.67 1.04 -1.26 -0.90 113.70 117.29 1lf9 s SER 648 Ca 0.40 0.57 -0.31 0.00 0.48 0.00 0.00 55.95 57.09 1lf9 s SER 648 Cb 0.32 -0.85 -0.14 0.00 0.10 0.00 0.00 66.02 65.44 1lf9 s SER 648 CO 0.10 -2.58 1.31 0.00 0.98 0.00 0.00 173.24 173.05 1lf9 n ALA 649 N -3.72 0.53 -3.59 5.32 0.00 -1.26 -4.25 120.51 113.53 1lf9 n ALA 649 Ca 0.11 0.42 -0.13 0.00 0.00 0.00 0.00 53.44 53.85 1lf9 n ALA 649 Cb 0.60 -2.19 -0.07 0.00 0.00 0.00 0.00 19.45 17.78 1lf9 n ALA 649 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1lf9 s SER 650 N 0.12 -0.73 0.29 0.00 1.04 -1.16 -0.67 113.70 112.60 1lf9 s SER 650 Ca 0.68 1.36 -0.29 0.00 0.48 0.00 0.00 55.95 58.19 1lf9 s SER 650 Cb -0.70 1.36 -0.09 0.00 0.10 0.00 0.00 66.02 66.69 1lf9 s SER 650 CO 0.52 -0.23 1.03 -2.84 0.98 0.00 0.00 173.24 172.69 1lf9 s PRO 651 N 0.53 4.63 -0.61 4.02 0.02 -1.26 -4.38 135.00 137.94 1lf9 s PRO 651 Ca -0.01 1.63 -0.23 0.00 0.02 0.00 0.00 61.00 62.40 1lf9 s PRO 651 Cb -0.05 -3.09 0.05 0.00 0.02 0.00 0.00 34.50 31.44 1lf9 s PRO 651 CO -0.02 0.26 0.96 -1.17 -0.33 0.00 0.00 177.00 176.70 1lf9 s LEU 652 N -1.59 4.21 0.33 -5.54 2.96 0.23 -4.32 118.68 114.97 1lf9 s LEU 652 Ca 0.46 -0.68 0.10 0.00 -0.22 0.00 0.00 54.13 53.79 1lf9 s LEU 652 Cb -0.28 -2.60 0.87 0.00 0.50 0.00 0.00 46.19 44.68 1lf9 s LEU 652 CO 0.35 -1.35 1.77 0.78 -1.32 0.00 0.00 176.35 176.57 1lf9 h ASN 653 N 9.46 0.67 -0.92 3.68 2.35 -1.60 0.91 115.58 130.12 1lf9 h ASN 653 Ca -0.28 0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.57 1lf9 h ASN 653 Cb 1.07 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 39.39 1lf9 h ASN 653 CO 1.14 0.18 0.55 -0.25 -1.65 0.00 0.00 177.43 177.40 1lf9 h TRP 654 N 0.62 1.23 -0.28 1.19 7.01 -1.86 0.54 115.95 124.40 1lf9 h TRP 654 Ca 0.60 -0.01 -0.12 0.00 2.11 0.00 0.00 58.89 61.47 1lf9 h TRP 654 Cb 1.12 -0.40 -0.01 0.00 -2.10 0.00 0.00 29.16 27.77 1lf9 h TRP 654 CO -0.00 0.82 -0.32 0.00 -2.79 0.00 0.00 178.44 176.15 1lf9 h ALA 655 N 1.30 0.91 -0.41 2.65 0.00 -1.21 -0.33 119.26 122.18 1lf9 h ALA 655 Ca 0.33 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 1lf9 h ALA 655 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1lf9 h ALA 655 CO -0.06 0.62 -0.30 0.45 0.00 0.00 0.00 179.25 179.96 1lf9 h HIS 656 N 0.51 1.06 -0.51 0.00 3.86 -0.84 -0.76 115.15 118.47 1lf9 h HIS 656 Ca 0.06 -0.28 -0.00 0.00 -1.16 0.00 0.00 60.37 58.99 1lf9 h HIS 656 Cb 0.80 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 29.01 1lf9 h HIS 656 CO 0.03 1.09 0.31 0.00 0.86 0.00 0.00 177.93 180.22 1lf9 h ALA 657 N 0.89 0.65 -0.82 2.45 0.00 -0.66 -0.65 119.26 121.12 1lf9 h ALA 657 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1lf9 h ALA 657 Cb 0.87 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 1lf9 h ALA 657 CO 0.08 0.13 0.51 1.49 0.00 0.00 0.00 179.25 181.46 1lf9 h GLU 658 N 0.68 1.10 -0.61 0.00 4.57 -0.83 -1.23 114.58 118.27 1lf9 h GLU 658 Ca 0.18 -0.09 -0.03 0.00 -1.18 0.00 0.00 59.36 58.25 1lf9 h GLU 658 Cb -0.02 -0.24 -0.03 0.00 -0.16 0.00 0.00 28.75 28.31 1lf9 h GLU 658 CO -0.03 0.76 0.27 -0.92 -1.18 0.00 0.00 179.01 177.90 1lf9 h TYR 659 N 1.12 0.90 0.02 0.92 5.03 -0.46 0.91 116.97 125.41 1lf9 h TYR 659 Ca 0.30 -0.06 -0.00 0.00 2.58 0.00 0.00 58.73 61.55 1lf9 h TYR 659 Cb -0.07 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 37.93 1lf9 h TYR 659 CO -0.01 0.70 -0.01 0.28 -1.32 0.00 0.00 178.16 177.81 1lf9 h VAL 660 N 0.83 1.01 -0.52 1.81 2.07 -0.65 0.16 116.25 120.96 1lf9 h VAL 660 Ca 0.20 -0.06 -0.08 0.00 0.82 0.00 0.00 66.70 67.59 1lf9 h VAL 660 Cb 0.16 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1lf9 h VAL 660 CO -0.02 0.02 0.01 0.40 0.02 0.00 0.00 177.57 178.00 1lf9 h ILE 661 N -0.05 1.25 -0.27 4.57 2.04 -1.09 -0.92 117.51 123.03 1lf9 h ILE 661 Ca -0.00 -1.03 -0.07 0.00 1.00 0.00 0.00 64.86 64.76 1lf9 h ILE 661 Cb 0.04 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1lf9 h ILE 661 CO 0.00 0.37 -0.09 0.25 0.00 0.00 0.00 178.15 178.68 1lf9 h LEU 662 N 0.80 0.56 0.03 1.44 5.85 -0.65 0.19 115.31 123.53 1lf9 h LEU 662 Ca 0.15 -0.38 0.02 0.00 0.84 0.00 0.00 57.88 58.52 1lf9 h LEU 662 Cb 0.46 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1lf9 h LEU 662 CO 0.02 0.81 -0.18 0.15 -0.34 0.00 0.00 178.44 178.90 1lf9 h PHE 663 N 0.30 -0.48 -0.46 1.25 3.57 -0.43 0.73 116.94 121.43 1lf9 h PHE 663 Ca 0.07 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.51 1lf9 h PHE 663 Cb 0.58 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.51 1lf9 h PHE 663 CO 0.05 -0.26 0.02 0.00 -2.23 0.00 0.00 178.31 175.89 1lf9 h ALA 664 N 0.57 0.61 -0.80 2.41 0.00 -1.14 -2.98 119.26 117.94 1lf9 h ALA 664 Ca 0.05 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1lf9 h ALA 664 Cb 0.37 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1lf9 h ALA 664 CO -0.15 0.39 0.36 0.77 0.00 0.00 0.00 179.25 180.62 1lf9 h SER 665 N 0.64 1.05 0.45 0.00 0.02 -0.37 -0.14 113.55 115.21 1lf9 h SER 665 Ca 0.13 -0.14 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1lf9 h SER 665 Cb 0.46 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 1lf9 h SER 665 CO 0.02 0.90 -0.18 -1.13 -1.14 0.00 0.00 176.83 175.30 1lf9 h ASN 666 N 1.14 0.00 0.13 3.07 -0.00 -0.78 0.53 115.58 119.67 1lf9 h ASN 666 Ca 0.27 0.00 -0.20 0.00 -0.00 0.00 0.00 56.30 56.38 1lf9 h ASN 666 Cb 0.15 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 38.48 1lf9 h ASN 666 CO -0.03 0.18 -0.90 0.40 -0.00 0.00 0.00 177.43 177.08 1lf9 h ILE 667 N 0.00 1.42 0.00 2.57 2.04 -1.20 -3.31 117.51 119.03 1lf9 h ILE 667 Ca -0.00 -2.49 0.00 0.00 1.00 0.00 0.00 64.86 63.36 1lf9 h ILE 667 Cb 0.45 3.10 0.00 0.00 -0.74 0.00 0.00 36.82 39.63 1lf9 h ILE 667 CO 0.02 0.70 0.00 -0.62 0.00 0.00 0.00 178.15 178.25 1lf9 n GLU 668 N -4.11 0.13 -3.35 2.37 -0.58 -0.14 -4.94 120.64 110.02 1lf9 n GLU 668 Ca -0.16 0.15 -0.18 0.00 -0.42 0.00 0.00 57.16 56.54 1lf9 n GLU 668 Cb 0.82 -1.67 0.07 0.00 -0.57 0.00 0.00 31.44 30.10 1lf9 n GLU 668 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1lf9 n HIS 669 N -1.90 -2.22 -3.58 -0.32 8.25 0.18 -5.00 115.22 110.63 1lf9 n HIS 669 Ca 0.06 0.85 -0.08 0.00 -0.26 0.00 0.00 57.72 58.30 1lf9 n HIS 669 Cb 0.36 -4.61 -0.04 0.00 1.12 0.00 0.00 29.99 26.82 1lf9 n HIS 669 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1lf9 s LYS 670 N -5.67 0.48 -0.86 -0.41 -2.85 -0.91 -5.03 119.74 104.48 1lf9 s LYS 670 Ca 0.26 0.01 -0.25 0.00 -1.00 0.00 0.00 55.97 54.99 1lf9 s LYS 670 Cb -0.11 0.22 -0.02 0.00 -2.06 0.00 0.00 37.83 35.86 1lf9 s LYS 670 CO 0.64 -0.17 1.79 0.08 0.10 0.00 0.00 175.35 177.79 1lf9 s VAL 671 N -1.60 3.54 0.62 1.79 1.01 -1.26 -4.45 120.40 120.05 1lf9 s VAL 671 Ca 0.03 -0.30 0.35 0.00 0.00 0.00 0.00 61.98 62.07 1lf9 s VAL 671 Cb -0.01 -4.26 0.39 0.00 0.00 0.00 0.00 36.38 32.50 1lf9 s VAL 671 CO -0.03 -1.20 2.29 -0.07 0.00 0.00 0.00 175.10 176.09 1lf9 h LEU 672 N 16.30 0.00 -3.28 3.92 3.38 -1.92 -2.64 115.31 131.07 1lf9 h LEU 672 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1lf9 h LEU 672 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1lf9 h LEU 672 CO 1.26 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.89 1lf9 n ASP 673 N -3.55 4.30 -4.64 -0.43 5.75 -1.26 -4.96 116.55 111.77 1lf9 n ASP 673 Ca -0.03 -2.82 -0.40 0.00 -0.01 0.00 0.00 54.79 51.53 1lf9 n ASP 673 Cb 0.10 -0.55 -0.06 0.00 -1.03 0.00 0.00 41.12 39.58 1lf9 n ASP 673 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 1lf9 s MET 674 N -2.50 4.14 -0.19 0.11 1.75 -1.00 -4.98 119.30 116.63 1lf9 s MET 674 Ca 0.44 0.53 -0.29 0.00 -1.25 0.00 0.00 55.69 55.12 1lf9 s MET 674 Cb 0.33 -3.63 -0.04 0.00 2.84 0.00 0.00 34.83 34.33 1lf9 s MET 674 CO 0.13 -0.34 1.87 -1.25 -0.65 0.00 0.00 175.02 174.78 1lf9 s PRO 675 N 2.27 3.61 0.25 4.11 0.04 -1.26 -4.87 135.00 139.15 1lf9 s PRO 675 Ca 0.26 1.91 -0.03 0.00 0.04 0.00 0.00 61.00 63.18 1lf9 s PRO 675 Cb -0.16 -4.18 0.46 0.00 0.04 0.00 0.00 34.50 30.67 1lf9 s PRO 675 CO 0.09 -1.54 1.77 0.38 0.04 0.00 0.00 177.00 177.74 1lf9 h ASP 676 N 12.21 0.51 -0.91 6.66 -0.00 -1.94 -1.91 116.42 131.03 1lf9 h ASP 676 Ca -0.39 0.08 0.14 0.00 -0.00 0.00 0.00 57.03 56.86 1lf9 h ASP 676 Cb 1.19 -0.00 -0.09 0.00 -0.00 0.00 0.00 39.33 40.43 1lf9 h ASP 676 CO 0.98 0.24 0.52 0.40 -0.00 0.00 0.00 179.24 181.39 1lf9 h ILE 677 N 0.63 0.80 -0.11 4.15 1.08 -1.98 0.23 117.51 122.32 1lf9 h ILE 677 Ca 0.42 -0.26 -0.11 0.00 -0.39 0.00 0.00 64.86 64.52 1lf9 h ILE 677 Cb 0.55 -0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.26 1lf9 h ILE 677 CO -0.33 0.14 -0.38 0.58 -0.69 0.00 0.00 178.15 177.47 1lf9 h VAL 678 N 0.77 1.38 -0.10 1.67 2.07 -1.67 -3.00 116.25 117.37 1lf9 h VAL 678 Ca 0.48 -1.70 0.02 0.00 0.82 0.00 0.00 66.70 66.31 1lf9 h VAL 678 Cb 0.61 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.53 1lf9 h VAL 678 CO -0.32 0.51 -0.00 0.22 0.02 0.00 0.00 177.57 177.99 1lf9 h TYR 679 N 0.03 -0.01 0.00 1.57 3.20 -0.73 -1.47 116.97 119.55 1lf9 h TYR 679 Ca -0.02 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 1lf9 h TYR 679 Cb 1.01 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.29 1lf9 h TYR 679 CO 0.11 -0.02 -0.09 0.87 -1.64 0.00 0.00 178.16 177.40 1lf9 h LYS 680 N 0.03 0.00 0.00 1.82 1.57 -0.65 0.47 116.57 119.80 1lf9 h LYS 680 Ca 0.04 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.62 1lf9 h LYS 680 Cb 0.05 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.33 1lf9 h LYS 680 CO -0.08 0.09 -1.51 -2.13 -0.57 0.00 0.00 179.45 175.25 1lf9 n ARG 681 N -3.58 0.62 0.00 3.15 0.63 -0.97 -4.35 116.66 112.16 1lf9 n ARG 681 Ca -0.02 0.24 0.00 0.00 -0.92 0.00 0.00 57.85 57.15 1lf9 n ARG 681 Cb 0.22 -1.80 0.00 0.00 0.45 0.00 0.00 32.46 31.33 1lf9 n ARG 681 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1lf9 n TYR 682 N -2.93 0.00 -0.05 -0.14 4.01 -0.59 -4.90 117.16 112.56 1lf9 n TYR 682 Ca -0.12 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.55 1lf9 n TYR 682 Cb 0.90 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.87 1lf9 n TYR 682 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1lf9 n VAL 683 N -1.83 0.65 0.00 -0.72 0.31 0.76 -4.69 118.33 112.80 1lf9 n VAL 683 Ca 0.00 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1lf9 n VAL 683 Cb 0.35 -0.86 0.00 0.00 -0.91 0.00 0.00 33.84 32.42 1lf9 n VAL 683 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51