#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lul s THR 3 N 0.00 0.54 -0.16 0.52 2.01 -1.26 -1.09 115.64 116.20 3lul s THR 3 Ca 0.00 -0.04 -0.03 0.00 0.31 0.00 0.00 61.69 61.94 3lul s THR 3 Cb 0.00 -0.70 -0.02 0.00 0.01 0.00 0.00 72.50 71.79 3lul s THR 3 CO 0.00 0.24 -0.07 -0.60 -0.69 0.00 0.00 174.62 173.50 3lul s ARG 4 N 1.90 3.51 -0.17 4.92 3.52 0.22 -4.94 118.95 127.91 3lul s ARG 4 Ca 0.04 -0.60 -0.28 0.00 -0.13 0.00 0.00 55.73 54.77 3lul s ARG 4 Cb -0.13 -2.84 -0.01 0.00 -1.56 0.00 0.00 34.95 30.41 3lul s ARG 4 CO -0.06 0.13 0.94 0.08 -0.81 0.00 0.00 175.30 175.57 3lul s VAL 5 N 0.63 4.80 -0.31 7.11 1.01 -1.26 -0.54 120.40 131.84 3lul s VAL 5 Ca -0.04 1.86 -0.21 0.00 0.00 0.00 0.00 61.98 63.59 3lul s VAL 5 Cb -0.15 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 31.99 3lul s VAL 5 CO 0.03 -0.03 0.66 -0.63 0.00 0.00 0.00 175.10 175.12 3lul s ILE 6 N 2.38 4.90 0.43 2.22 1.01 -0.10 -4.92 121.20 127.12 3lul s ILE 6 Ca 0.43 0.87 0.06 0.00 0.00 0.00 0.00 60.65 62.00 3lul s ILE 6 Cb -0.17 -4.04 0.01 0.00 0.01 0.00 0.00 42.46 38.27 3lul s ILE 6 CO 0.13 -0.19 0.60 -1.61 0.00 0.00 0.00 174.94 173.86 3lul s GLU 7 N 2.69 2.85 0.51 2.79 0.41 -1.26 -4.64 118.70 122.05 3lul s GLU 7 Ca 0.26 -1.03 -0.22 0.00 -0.41 0.00 0.00 54.97 53.57 3lul s GLU 7 Cb -0.15 -2.70 -0.06 0.00 -1.78 0.00 0.00 34.13 29.45 3lul s GLU 7 CO 0.12 -0.30 1.28 -0.51 -0.49 0.00 0.00 175.26 175.37 3lul s ASP 8 N -4.32 5.66 0.00 -0.19 1.11 -1.26 -4.44 116.67 113.23 3lul s ASP 8 Ca 0.53 2.57 0.00 0.00 0.18 0.00 0.00 52.55 55.83 3lul s ASP 8 Cb -0.10 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.27 3lul s ASP 8 CO 0.34 -1.29 0.00 0.29 1.18 0.00 0.00 175.17 175.69 3lul n LYS 9 N -0.79 0.00 -1.49 8.23 5.02 -1.26 -5.01 118.16 122.87 3lul n LYS 9 Ca 0.09 0.00 -0.57 0.00 -2.02 0.00 0.00 58.31 55.81 3lul n LYS 9 Cb 0.46 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.40 3lul n LYS 9 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3lul n THR 13 N 0.00 0.31 -1.98 -0.18 -1.04 -1.26 -5.23 114.28 104.90 3lul n THR 13 Ca 0.00 -0.08 -0.31 0.00 -2.04 0.00 0.00 64.05 61.62 3lul n THR 13 Cb 0.24 -0.03 0.01 0.00 -1.82 0.00 0.00 70.33 68.72 3lul n THR 13 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3lul s PRO 14 N -0.14 3.62 0.28 -2.82 0.04 -1.26 -5.10 135.00 129.62 3lul s PRO 14 Ca 0.87 0.72 -0.03 0.00 0.04 0.00 0.00 61.00 62.59 3lul s PRO 14 Cb -1.21 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 31.24 3lul s PRO 14 CO 0.57 -0.51 0.43 0.45 0.04 0.00 0.00 177.00 177.97 3lul n SER 15 N -2.61 -1.20 -4.87 6.66 2.88 -1.26 -5.09 113.62 108.14 3lul n SER 15 Ca 0.06 -2.46 -0.36 0.00 -1.33 0.00 0.00 58.87 54.78 3lul n SER 15 Cb 0.54 2.18 -0.06 0.00 -0.75 0.00 0.00 64.21 66.12 3lul n SER 15 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 3lul s PHE 16 N -3.42 3.62 0.69 0.66 0.08 -1.26 -5.09 117.98 113.27 3lul s PHE 16 Ca 0.21 0.74 -0.11 0.00 0.12 0.00 0.00 56.93 57.89 3lul s PHE 16 Cb -0.01 -2.11 0.01 0.00 -0.57 0.00 0.00 43.02 40.33 3lul s PHE 16 CO 0.15 0.60 1.06 0.20 -0.10 0.00 0.00 175.22 177.14 3lul s GLY 17 N -1.49 1.66 0.52 4.36 0.00 -1.26 -4.95 107.32 106.16 3lul s GLY 17 Ca 0.27 0.01 0.30 0.00 0.00 0.00 0.00 44.72 45.30 3lul s GLY 17 CO 0.15 0.33 1.99 1.19 0.00 0.00 0.00 173.10 176.75 3lul h ILE 18 N -0.68 0.33 -0.00 0.90 6.09 -2.03 0.76 117.51 122.89 3lul h ILE 18 Ca -0.44 -0.67 0.00 0.00 -1.37 0.00 0.00 64.86 62.38 3lul h ILE 18 Cb 1.21 1.50 0.00 0.00 0.47 0.00 0.00 36.82 40.01 3lul h ILE 18 CO 0.58 0.10 -0.00 0.47 -3.07 0.00 0.00 178.15 176.23 3lul n ASP 19 N -3.34 0.06 -4.75 2.19 8.00 -1.26 -4.91 116.55 112.54 3lul n ASP 19 Ca -0.01 -0.71 -0.41 0.00 0.71 0.00 0.00 54.79 54.37 3lul n ASP 19 Cb 0.31 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.28 3lul n ASP 19 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3lul s ASP 20 N -2.21 7.06 0.00 -2.24 -1.08 0.26 -3.07 116.67 115.39 3lul s ASP 20 Ca 0.41 2.36 0.16 0.00 -0.52 0.00 0.00 52.55 54.96 3lul s ASP 20 Cb 0.21 -2.62 0.82 0.00 -1.46 0.00 0.00 42.92 39.87 3lul s ASP 20 CO 0.40 -0.35 1.47 0.54 0.52 0.00 0.00 175.17 177.76 3lul n ARG 21 N 1.73 0.22 0.17 4.34 1.74 -0.66 -2.29 116.66 121.91 3lul n ARG 21 Ca 0.02 0.14 0.13 0.00 -0.77 0.00 0.00 57.85 57.37 3lul n ARG 21 Cb 0.44 -1.50 0.69 0.00 -1.02 0.00 0.00 32.46 31.07 3lul n ARG 21 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 3lul h ILE 22 N 0.00 0.84 0.00 0.55 2.10 -1.83 -1.36 117.51 117.81 3lul h ILE 22 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 3lul h ILE 22 Cb 0.16 0.89 0.00 0.00 -1.09 0.00 0.00 36.82 36.78 3lul h ILE 22 CO 0.00 0.00 0.00 0.49 -1.08 0.00 0.00 178.15 177.56 3lul n PHE 23 N -4.38 0.00 0.99 2.19 3.72 -0.97 -1.26 117.46 117.75 3lul n PHE 23 Ca 0.02 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.54 3lul n PHE 23 Cb 0.29 -0.26 0.15 0.00 -0.94 0.00 0.00 39.48 38.72 3lul n PHE 23 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3lul n LEU 24 N -1.26 2.90 0.00 4.37 4.77 -0.59 -4.97 117.00 122.21 3lul n LEU 24 Ca 0.12 -0.99 0.00 0.00 -0.03 0.00 0.00 56.01 55.11 3lul n LEU 24 Cb 0.18 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3lul n LEU 24 CO 0.18 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 3lul n GLY 25 N 1.35 0.66 3.37 -0.72 0.00 -0.39 -5.01 105.19 104.44 3lul n GLY 25 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 3lul n GLY 25 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3lul n GLU 26 N -2.04 3.29 -3.64 1.61 2.13 -0.73 -4.55 120.64 116.72 3lul n GLU 26 Ca 0.00 -3.49 -0.15 0.00 0.66 0.00 0.00 57.16 54.18 3lul n GLU 26 Cb 0.00 -3.22 -0.08 0.00 0.27 0.00 0.00 31.44 28.42 3lul n GLU 26 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 3lul s GLY 27 N 3.13 -0.42 0.16 8.31 0.00 -1.26 -1.18 107.32 116.06 3lul s GLY 27 Ca 0.47 1.18 0.08 0.00 0.00 0.00 0.00 44.72 46.44 3lul s GLY 27 CO 0.02 0.90 -0.17 1.08 0.00 0.00 0.00 173.10 174.94 3lul s LEU 28 N -0.69 2.44 0.06 0.66 1.43 -0.22 -1.56 118.68 120.80 3lul s LEU 28 Ca -0.08 -0.86 -0.03 0.00 -1.03 0.00 0.00 54.13 52.13 3lul s LEU 28 Cb -0.03 -0.73 -0.03 0.00 0.03 0.00 0.00 46.19 45.43 3lul s LEU 28 CO 0.05 -0.08 0.02 0.72 0.23 0.00 0.00 176.35 177.29 3lul s PHE 29 N -2.16 0.41 0.00 0.29 -0.71 -1.26 -0.42 117.98 114.13 3lul s PHE 29 Ca 0.14 -0.91 0.03 0.00 -1.04 0.00 0.00 56.93 55.15 3lul s PHE 29 Cb -0.05 -0.30 -0.01 0.00 -1.21 0.00 0.00 43.02 41.45 3lul s PHE 29 CO 0.05 -0.40 -0.09 -1.21 -1.34 0.00 0.00 175.22 172.23 3lul s GLU 30 N -3.69 0.68 -0.23 1.99 0.41 -0.59 -4.81 118.70 112.44 3lul s GLU 30 Ca 0.05 -0.40 0.00 0.00 -0.41 0.00 0.00 54.97 54.21 3lul s GLU 30 Cb 0.06 -0.64 0.03 0.00 -1.78 0.00 0.00 34.13 31.81 3lul s GLU 30 CO -0.09 0.17 -0.11 0.99 -0.49 0.00 0.00 175.26 175.72 3lul s THR 31 N -0.40 2.45 -0.17 3.63 2.01 -1.26 -1.12 115.64 120.78 3lul s THR 31 Ca 0.02 -1.17 -0.01 0.00 0.31 0.00 0.00 61.69 60.83 3lul s THR 31 Cb -0.04 -2.24 -0.01 0.00 0.01 0.00 0.00 72.50 70.22 3lul s THR 31 CO -0.00 0.23 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.42 3lul s ILE 32 N 1.25 2.96 0.34 1.82 1.01 0.09 -4.85 121.20 123.83 3lul s ILE 32 Ca -0.01 -0.66 -0.26 0.00 0.00 0.00 0.00 60.65 59.71 3lul s ILE 32 Cb -0.17 -2.28 -0.09 0.00 0.01 0.00 0.00 42.46 39.93 3lul s ILE 32 CO -0.07 0.49 1.05 -0.60 0.00 0.00 0.00 174.94 175.81 3lul s ARG 33 N 0.91 4.40 -0.09 2.79 3.52 -1.26 -0.81 118.95 128.40 3lul s ARG 33 Ca -0.03 1.59 0.03 0.00 -0.13 0.00 0.00 55.73 57.19 3lul s ARG 33 Cb -0.15 -2.82 0.01 0.00 -1.56 0.00 0.00 34.95 30.42 3lul s ARG 33 CO -0.01 0.05 -0.20 0.08 -0.81 0.00 0.00 175.30 174.42 3lul s VAL 34 N -1.46 1.74 -0.12 7.11 1.01 0.58 -0.73 120.40 128.52 3lul s VAL 34 Ca 0.52 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 3lul s VAL 34 Cb -0.25 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.63 3lul s VAL 34 CO 0.32 0.49 -0.07 0.20 0.00 0.00 0.00 175.10 176.04 3lul s ASN 35 N 0.55 2.28 -1.55 3.32 -0.87 -0.53 -1.55 114.94 116.59 3lul s ASN 35 Ca -0.15 -0.36 -0.12 0.00 -1.57 0.00 0.00 52.86 50.65 3lul s ASN 35 Cb -0.17 -0.83 0.09 0.00 -0.02 0.00 0.00 41.25 40.32 3lul s ASN 35 CO 0.05 -0.14 0.81 -1.20 -2.57 0.00 0.00 177.10 174.06 3lul n SER 36 N 4.94 -3.31 0.00 -1.22 7.64 -0.34 -1.32 113.62 120.02 3lul n SER 36 Ca -0.12 -0.89 0.00 0.00 1.01 0.00 0.00 58.87 58.87 3lul n SER 36 Cb 0.50 -3.43 0.00 0.00 -1.01 0.00 0.00 64.21 60.26 3lul n SER 36 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3lul n SER 37 N -2.82 -1.12 -4.42 6.43 7.64 0.89 -5.01 113.62 115.21 3lul n SER 37 Ca -0.03 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.50 3lul n SER 37 Cb 0.55 -0.44 -0.13 0.00 -1.01 0.00 0.00 64.21 63.19 3lul n SER 37 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3lul s LYS 38 N -0.13 3.54 0.40 1.43 1.02 -0.43 -4.98 119.74 120.59 3lul s LYS 38 Ca 0.00 -0.57 -0.26 0.00 0.02 0.00 0.00 55.97 55.16 3lul s LYS 38 Cb 0.00 -2.93 -0.08 0.00 -0.52 0.00 0.00 37.83 34.29 3lul s LYS 38 CO 0.00 0.07 1.21 -1.25 -0.92 0.00 0.00 175.35 174.47 3lul s PRO 39 N 0.79 4.03 -0.16 -1.68 0.04 -1.26 -1.45 135.00 135.31 3lul s PRO 39 Ca -0.02 1.94 -0.11 0.00 0.04 0.00 0.00 61.00 62.86 3lul s PRO 39 Cb -0.15 -2.71 -0.05 0.00 0.04 0.00 0.00 34.50 31.63 3lul s PRO 39 CO 0.02 -0.37 0.21 -1.12 0.04 0.00 0.00 177.00 175.77 3lul s SER 40 N -1.00 6.36 -1.45 6.66 0.01 0.09 -4.49 113.70 119.88 3lul s SER 40 Ca 0.57 0.42 -0.09 0.00 1.31 0.00 0.00 55.95 58.16 3lul s SER 40 Cb -0.33 -2.13 0.05 0.00 0.21 0.00 0.00 66.02 63.82 3lul s SER 40 CO 0.42 0.21 0.87 0.49 0.41 0.00 0.00 173.24 175.64 3lul n PHE 41 N 3.13 -2.16 -0.19 2.43 3.72 -1.26 -4.56 117.46 118.57 3lul n PHE 41 Ca -0.15 0.88 0.03 0.00 -0.05 0.00 0.00 57.45 58.16 3lul n PHE 41 Cb 0.53 -4.12 0.30 0.00 -0.94 0.00 0.00 39.48 35.24 3lul n PHE 41 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3lul h ALA 42 N 0.93 1.57 0.00 4.37 0.00 -1.96 -2.38 119.26 121.79 3lul h ALA 42 Ca -0.59 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3lul h ALA 42 Cb 1.37 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3lul h ALA 42 CO 0.63 0.36 0.00 0.98 0.00 0.00 0.00 179.25 181.22 3lul n TYR 43 N -4.45 0.00 0.00 0.00 4.19 -1.26 -1.55 117.16 114.08 3lul n TYR 43 Ca 0.09 -0.07 0.00 0.00 3.31 0.00 0.00 57.90 61.23 3lul n TYR 43 Cb 0.12 -0.08 0.00 0.00 0.49 0.00 0.00 39.34 39.86 3lul n TYR 43 CO 0.00 0.00 0.00 0.72 0.91 0.00 0.00 176.86 178.49 3lul n HIS 45 N 0.59 0.00 -0.25 2.98 8.25 -0.90 -0.74 115.22 125.15 3lul n HIS 45 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.40 3lul n HIS 45 Cb 0.11 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.26 3lul n HIS 45 CO 0.00 0.00 0.00 2.35 0.64 0.00 0.00 176.34 179.33 3lul h TRP 46 N 0.00 0.98 -0.21 4.41 7.01 -1.56 -2.03 115.95 124.56 3lul h TRP 46 Ca 0.00 -0.05 -0.01 0.00 2.11 0.00 0.00 58.89 60.95 3lul h TRP 46 Cb 0.00 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 26.74 3lul h TRP 46 CO 0.00 0.73 0.11 1.49 -2.79 0.00 0.00 178.44 177.97 3lul h GLU 47 N 0.95 0.30 -0.10 2.65 4.81 -1.21 -1.30 114.58 120.69 3lul h GLU 47 Ca 0.24 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 3lul h GLU 47 Cb 0.11 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 3lul h GLU 47 CO -0.03 0.30 0.04 -0.09 -0.73 0.00 0.00 179.01 178.50 3lul h ARG 48 N 0.22 0.14 -0.65 1.92 2.43 -1.80 -1.02 114.38 115.62 3lul h ARG 48 Ca 0.07 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.27 3lul h ARG 48 Cb 0.10 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.57 3lul h ARG 48 CO -0.01 0.23 0.37 1.25 -1.51 0.00 0.00 179.97 180.30 3lul h LEU 49 N 0.02 0.56 -0.56 3.80 5.85 -1.33 -0.84 115.31 122.81 3lul h LEU 49 Ca 0.03 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3lul h LEU 49 Cb 0.14 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 3lul h LEU 49 CO -0.00 0.37 0.25 1.23 -0.34 0.00 0.00 178.44 179.95 3lul h GLY 50 N 0.69 0.88 0.98 3.75 0.00 -1.09 0.22 103.07 108.51 3lul h GLY 50 Ca 0.29 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.17 3lul h GLY 50 CO -0.16 0.43 0.10 3.43 0.00 0.00 0.00 176.54 180.33 3lul h ASN 51 N 0.76 0.17 -0.64 0.19 2.35 -0.82 -0.54 115.58 117.04 3lul h ASN 51 Ca 0.19 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.92 3lul h ASN 51 Cb 0.15 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.45 3lul h ASN 51 CO -0.02 0.13 0.32 0.28 -1.65 0.00 0.00 177.43 176.49 3lul h SER 52 N 0.21 0.83 -0.58 5.81 0.02 -1.05 -1.36 113.55 117.44 3lul h SER 52 Ca 0.06 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 3lul h SER 52 Cb -0.02 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.28 3lul h SER 52 CO -0.02 0.71 0.28 0.00 -1.14 0.00 0.00 176.83 176.66 3lul h ALA 53 N 1.15 0.75 -0.52 3.77 0.00 -0.77 -1.99 119.26 121.64 3lul h ALA 53 Ca 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3lul h ALA 53 Cb 0.09 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3lul h ALA 53 CO -0.03 0.31 0.33 0.00 0.00 0.00 0.00 179.25 179.86 3lul h ARG 54 N 0.79 0.70 -0.87 0.00 3.08 -0.98 -0.50 114.38 116.59 3lul h ARG 54 Ca 0.20 -0.05 0.10 0.00 0.07 0.00 0.00 59.98 60.30 3lul h ARG 54 Cb 0.11 -0.15 -0.06 0.00 0.08 0.00 0.00 29.97 29.95 3lul h ARG 54 CO -0.03 0.48 0.56 0.37 -1.07 0.00 0.00 179.97 180.28 3lul h GLN 55 N 0.71 0.80 -0.09 0.04 4.15 -0.92 -2.67 115.11 117.13 3lul h GLN 55 Ca 0.19 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.56 3lul h GLN 55 Cb -0.05 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.45 3lul h GLN 55 CO -0.04 0.53 0.00 1.28 -1.93 0.00 0.00 178.83 178.67 3lul n LEU 56 N -4.53 1.94 -1.05 -2.39 4.77 -0.78 -4.95 117.00 110.02 3lul n LEU 56 Ca 0.15 -0.71 -0.14 0.00 -0.03 0.00 0.00 56.01 55.28 3lul n LEU 56 Cb 0.33 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.31 3lul n LEU 56 CO 0.31 0.36 -0.13 0.61 -1.33 0.00 0.00 177.39 177.21 3lul n GLY 57 N 1.22 1.38 3.69 -0.72 0.00 -0.52 -5.00 105.19 105.23 3lul n GLY 57 Ca 0.17 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 3lul n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lul s ILE 58 N -2.36 4.88 0.32 -0.61 1.01 -0.31 -4.98 121.20 119.16 3lul s ILE 58 Ca 0.00 1.74 -0.29 0.00 0.00 0.00 0.00 60.65 62.09 3lul s ILE 58 Cb 0.00 -4.18 -0.11 0.00 0.01 0.00 0.00 42.46 38.18 3lul s ILE 58 CO 0.00 0.07 1.55 -2.65 0.00 0.00 0.00 174.94 173.91 3lul n PRO 59 N 4.82 2.67 -3.24 2.79 -0.02 -1.26 -4.17 135.00 136.58 3lul n PRO 59 Ca 0.05 0.94 -0.24 0.00 -2.02 0.00 0.00 63.50 62.23 3lul n PRO 59 Cb 0.49 -2.70 -0.07 0.00 -0.02 0.00 0.00 33.50 31.20 3lul n PRO 59 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3lul n PHE 60 N 1.55 -0.83 -3.19 6.00 7.35 -1.26 -4.63 117.46 122.45 3lul n PHE 60 Ca 0.06 -3.32 -0.43 0.00 -0.76 0.00 0.00 57.45 53.00 3lul n PHE 60 Cb 0.37 0.03 0.00 0.00 0.35 0.00 0.00 39.48 40.23 3lul n PHE 60 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 3lul n GLU 61 N 2.04 3.95 -3.84 -4.13 1.02 -1.26 -4.89 120.64 113.52 3lul n GLU 61 Ca 0.24 -4.51 -0.19 0.00 -0.02 0.00 0.00 57.16 52.67 3lul n GLU 61 Cb 0.51 -2.52 -0.17 0.00 -0.02 0.00 0.00 31.44 29.25 3lul n GLU 61 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 3lul s ILE 62 N -2.07 0.18 0.75 -3.67 2.07 -1.26 -4.68 121.20 112.52 3lul s ILE 62 Ca 0.31 0.16 -0.11 0.00 -1.41 0.00 0.00 60.65 59.61 3lul s ILE 62 Cb -0.02 -0.32 0.04 0.00 0.13 0.00 0.00 42.46 42.29 3lul s ILE 62 CO 0.01 0.19 1.08 -0.94 -1.91 0.00 0.00 174.94 173.37 3lul s SER 63 N 1.52 4.79 0.24 4.50 1.04 -1.26 -4.83 113.70 119.70 3lul s SER 63 Ca -0.03 1.68 -0.06 0.00 0.48 0.00 0.00 55.95 58.03 3lul s SER 63 Cb -0.13 -2.46 0.30 0.00 0.10 0.00 0.00 66.02 63.84 3lul s SER 63 CO -0.03 -1.83 1.88 0.15 0.98 0.00 0.00 173.24 174.40 3lul h PHE 64 N -0.99 1.11 -0.76 5.02 3.57 -1.99 -1.04 116.94 121.86 3lul h PHE 64 Ca -0.44 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.06 3lul h PHE 64 Cb 1.23 -0.37 -0.04 0.00 2.79 0.00 0.00 35.95 39.57 3lul h PHE 64 CO 0.58 0.63 0.39 -0.44 -2.23 0.00 0.00 178.31 177.23 3lul h ASP 65 N 1.14 0.98 -0.33 0.41 3.32 -1.99 0.46 116.42 120.40 3lul h ASP 65 Ca 0.37 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 3lul h ASP 65 Cb 0.04 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 3lul h ASP 65 CO -0.13 0.82 0.16 -0.78 -1.72 0.00 0.00 179.24 177.60 3lul h ASP 66 N 1.07 0.43 -0.22 6.45 3.58 -1.86 -1.28 116.42 124.59 3lul h ASP 66 Ca 0.26 -0.12 0.05 0.00 0.42 0.00 0.00 57.03 57.64 3lul h ASP 66 Cb 0.09 -0.11 -0.05 0.00 1.72 0.00 0.00 39.33 40.98 3lul h ASP 66 CO -0.04 0.42 -0.07 -0.25 -2.88 0.00 0.00 179.24 176.43 3lul h TRP 67 N 0.40 -0.16 -0.54 0.28 2.91 -0.67 -0.71 115.95 117.47 3lul h TRP 67 Ca 0.11 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.13 3lul h TRP 67 Cb 0.11 0.10 -0.02 0.00 -0.51 0.00 0.00 29.16 28.83 3lul h TRP 67 CO -0.02 -0.12 0.25 0.35 -1.03 0.00 0.00 178.44 177.87 3lul h PHE 68 N -0.02 0.78 -0.66 2.65 3.57 -0.79 -1.69 116.94 120.79 3lul h PHE 68 Ca 0.11 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.61 3lul h PHE 68 Cb 0.19 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.64 3lul h PHE 68 CO -0.25 0.62 0.39 1.49 -2.23 0.00 0.00 178.31 178.33 3lul h GLU 69 N 0.72 0.72 -0.74 1.11 4.57 -1.03 -0.84 114.58 119.09 3lul h GLU 69 Ca 0.18 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.34 3lul h GLU 69 Cb 0.14 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 28.52 3lul h GLU 69 CO -0.02 0.47 0.48 0.45 -1.18 0.00 0.00 179.01 179.21 3lul h HIS 70 N 0.74 0.89 -0.09 0.92 3.86 -0.63 -1.39 115.15 119.45 3lul h HIS 70 Ca 0.28 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.51 3lul h HIS 70 Cb 0.10 -0.30 -0.00 0.00 1.06 0.00 0.00 27.41 28.27 3lul h HIS 70 CO -0.06 0.53 0.06 -0.07 0.86 0.00 0.00 177.93 179.24 3lul h LEU 71 N 0.94 0.10 -0.69 2.43 3.38 -0.61 -1.90 115.31 118.96 3lul h LEU 71 Ca 0.29 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.19 3lul h LEU 71 Cb -0.03 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 3lul h LEU 71 CO -0.09 0.07 0.17 0.40 0.09 0.00 0.00 178.44 179.08 3lul h ILE 72 N 0.12 1.26 -0.57 1.22 1.08 -1.03 -1.28 117.51 118.31 3lul h ILE 72 Ca 0.03 -0.96 -0.04 0.00 -0.39 0.00 0.00 64.86 63.50 3lul h ILE 72 Cb -0.01 0.55 -0.03 0.00 -3.07 0.00 0.00 36.82 34.27 3lul h ILE 72 CO -0.01 0.37 0.19 1.56 -0.69 0.00 0.00 178.15 179.57 3lul h GLN 73 N 1.04 0.84 -0.20 2.37 1.08 -1.11 -0.96 115.11 118.17 3lul h GLN 73 Ca 0.22 -0.15 -0.16 0.00 -1.45 0.00 0.00 58.65 57.11 3lul h GLN 73 Cb 0.37 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 3lul h GLN 73 CO 0.00 0.72 -0.51 -0.22 -0.95 0.00 0.00 178.83 177.87 3lul h LYS 74 N 0.82 0.70 -0.21 1.46 1.63 -1.08 -0.87 116.57 119.03 3lul h LYS 74 Ca 0.19 -0.49 0.04 0.00 -0.85 0.00 0.00 60.65 59.55 3lul h LYS 74 Cb 0.21 0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.88 3lul h LYS 74 CO -0.01 1.11 -0.04 0.82 -3.45 0.00 0.00 179.45 177.88 3lul h ILE 75 N 0.41 0.81 0.08 2.00 2.04 -0.99 -1.63 117.51 120.23 3lul h ILE 75 Ca -0.01 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 3lul h ILE 75 Cb 1.12 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 3lul h ILE 75 CO 0.11 0.00 -0.05 1.56 0.00 0.00 0.00 178.15 179.77 3lul h GLN 76 N 0.02 -0.13 -0.93 2.37 4.20 -1.15 -0.85 115.11 118.64 3lul h GLN 76 Ca 0.10 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.85 3lul h GLN 76 Cb 0.15 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.90 3lul h GLN 76 CO -0.20 -0.09 0.61 -0.22 -0.67 0.00 0.00 178.83 178.26 3lul h LYS 77 N -0.13 1.15 -0.15 1.46 3.64 -0.97 -2.68 116.57 118.90 3lul h LYS 77 Ca -0.01 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3lul h LYS 77 Cb 0.11 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 3lul h LYS 77 CO 0.00 0.76 0.00 -0.25 -2.27 0.00 0.00 179.45 177.70 3lul n ASP 78 N -4.49 1.79 -3.78 4.20 8.00 -0.63 -4.95 116.55 116.70 3lul n ASP 78 Ca 0.12 -1.70 -0.29 0.00 0.71 0.00 0.00 54.79 53.64 3lul n ASP 78 Cb 0.08 -0.09 0.03 0.00 -0.02 0.00 0.00 41.12 41.12 3lul n ASP 78 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3lul n ASN 79 N 0.40 -5.05 -4.68 -2.24 3.02 -0.76 -4.93 115.26 101.02 3lul n ASN 79 Ca 0.17 -0.69 -0.43 0.00 -0.03 0.00 0.00 54.58 53.60 3lul n ASN 79 Cb 0.36 -4.03 -0.02 0.00 -0.61 0.00 0.00 39.78 35.48 3lul n ASN 79 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3lul s LEU 80 N -7.20 4.23 -0.03 3.41 2.96 -0.40 -4.92 118.68 116.74 3lul s LEU 80 Ca 0.62 1.55 -0.07 0.00 -0.22 0.00 0.00 54.13 56.01 3lul s LEU 80 Cb -0.31 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 42.81 3lul s LEU 80 CO 0.76 -0.50 -0.14 0.00 -1.32 0.00 0.00 176.35 175.16 3lul n TYR 81 N 5.22 0.00 -4.72 5.38 9.36 -1.26 -4.28 117.16 126.85 3lul n TYR 81 Ca 0.10 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 60.99 3lul n TYR 81 Cb 0.48 -0.20 -0.15 0.00 -0.63 0.00 0.00 39.34 38.84 3lul n TYR 81 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 3lul s HIS 82 N -2.21 2.77 -1.57 2.98 3.76 -1.26 -0.08 115.29 119.68 3lul s HIS 82 Ca -0.12 -0.85 0.00 0.00 -0.15 0.00 0.00 55.06 53.94 3lul s HIS 82 Cb 0.02 -1.85 0.00 0.00 1.11 0.00 0.00 32.58 31.86 3lul s HIS 82 CO 0.17 -0.34 0.00 0.41 -0.85 0.00 0.00 174.74 174.13 3lul n GLY 83 N 3.75 -0.56 3.10 -2.22 0.00 -0.60 -4.72 105.19 103.95 3lul n GLY 83 Ca -0.19 -0.49 -0.07 0.00 0.00 0.00 0.00 46.02 45.28 3lul n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3lul s GLY 84 N 0.00 0.50 -0.06 -0.02 0.00 0.04 -0.31 107.32 107.47 3lul s GLY 84 Ca 0.00 -1.20 0.02 0.00 0.00 0.00 0.00 44.72 43.54 3lul s GLY 84 CO 0.00 -1.30 -0.10 -1.50 0.00 0.00 0.00 173.10 170.21 3lul s ILE 85 N -3.93 0.93 -0.19 0.90 2.07 0.01 -1.07 121.20 119.92 3lul s ILE 85 Ca 0.08 -0.36 -0.07 0.00 -1.41 0.00 0.00 60.65 58.90 3lul s ILE 85 Cb 0.08 -0.87 -0.04 0.00 0.13 0.00 0.00 42.46 41.76 3lul s ILE 85 CO -0.09 0.31 0.05 -0.75 -1.91 0.00 0.00 174.94 172.54 3lul s LYS 86 N 0.73 3.86 -0.18 3.50 2.20 0.24 -0.73 119.74 129.36 3lul s LYS 86 Ca -0.14 -0.40 -0.04 0.00 -0.36 0.00 0.00 55.97 55.03 3lul s LYS 86 Cb -0.15 -3.18 -0.03 0.00 -1.51 0.00 0.00 37.83 32.96 3lul s LYS 86 CO 0.03 0.18 -0.02 0.00 -0.36 0.00 0.00 175.35 175.18 3lul s ALA 87 N 0.60 3.01 -0.15 3.13 0.00 -0.28 -1.05 121.76 127.02 3lul s ALA 87 Ca 0.02 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.08 3lul s ALA 87 Cb -0.13 -1.68 0.01 0.00 0.00 0.00 0.00 23.12 21.32 3lul s ALA 87 CO 0.02 -0.00 -0.21 0.42 0.00 0.00 0.00 175.76 175.99 3lul s ILE 88 N 0.74 2.17 -0.25 0.00 1.01 -0.25 -1.55 121.20 123.08 3lul s ILE 88 Ca -0.01 -0.94 -0.05 0.00 0.00 0.00 0.00 60.65 59.66 3lul s ILE 88 Cb -0.14 -1.88 -0.00 0.00 0.01 0.00 0.00 42.46 40.45 3lul s ILE 88 CO 0.02 0.54 -0.00 -0.22 0.00 0.00 0.00 174.94 175.28 3lul s LEU 89 N 0.85 3.24 0.18 2.97 2.96 0.44 -1.36 118.68 127.96 3lul s LEU 89 Ca -0.06 -0.51 0.04 0.00 -0.22 0.00 0.00 54.13 53.38 3lul s LEU 89 Cb -0.15 -1.79 -0.03 0.00 0.50 0.00 0.00 46.19 44.72 3lul s LEU 89 CO -0.02 -0.08 0.28 -0.94 -1.32 0.00 0.00 176.35 174.27 3lul s SER 90 N 1.48 6.20 0.48 3.68 1.04 0.34 -1.05 113.70 125.87 3lul s SER 90 Ca 0.04 0.09 0.17 0.00 0.48 0.00 0.00 55.95 56.73 3lul s SER 90 Cb -0.15 -1.82 1.15 0.00 0.10 0.00 0.00 66.02 65.29 3lul s SER 90 CO -0.01 0.02 2.05 1.23 0.98 0.00 0.00 173.24 177.50 3lul h GLY 91 N 1.87 0.00 0.00 7.32 0.00 -1.46 -2.72 103.07 108.07 3lul h GLY 91 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 3lul h GLY 91 CO 0.66 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.81 3lul n GLY 92 N -1.11 0.62 3.74 4.60 0.00 -1.26 -3.97 105.19 107.81 3lul n GLY 92 Ca -0.03 -1.97 -0.40 0.00 0.00 0.00 0.00 46.02 43.63 3lul n GLY 92 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3lul n PRO 93 N 0.83 2.13 -3.51 1.61 -0.02 -1.26 -1.65 135.00 133.13 3lul n PRO 93 Ca 0.00 0.76 -0.11 0.00 -2.02 0.00 0.00 63.50 62.13 3lul n PRO 93 Cb 0.00 -2.53 -0.02 0.00 -0.02 0.00 0.00 33.50 30.92 3lul n PRO 93 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3lul s ALA 94 N -1.19 -1.44 0.90 3.55 0.00 -1.17 -4.25 121.76 118.15 3lul s ALA 94 Ca 0.61 0.31 -0.11 0.00 0.00 0.00 0.00 51.96 52.77 3lul s ALA 94 Cb -0.47 0.86 0.13 0.00 0.00 0.00 0.00 23.12 23.64 3lul s ALA 94 CO 0.58 -0.78 1.10 -1.12 0.00 0.00 0.00 175.76 175.54 3lul s SER 95 N -2.78 3.29 0.30 0.00 0.01 -1.26 -4.88 113.70 108.38 3lul s SER 95 Ca 0.03 1.79 -0.29 0.00 1.31 0.00 0.00 55.95 58.79 3lul s SER 95 Cb -0.01 -2.40 -0.10 0.00 0.21 0.00 0.00 66.02 63.71 3lul s SER 95 CO -0.10 -2.80 1.42 -0.60 0.41 0.00 0.00 173.24 171.56 3lul s ARG 96 N -4.78 4.26 0.00 12.44 3.52 -1.26 -4.80 118.95 128.32 3lul s ARG 96 Ca 0.64 2.34 0.00 0.00 -0.13 0.00 0.00 55.73 58.59 3lul s ARG 96 Cb -0.20 -3.06 0.00 0.00 -1.56 0.00 0.00 34.95 30.13 3lul s ARG 96 CO 0.58 -0.38 0.00 0.41 -0.81 0.00 0.00 175.30 175.10 3lul n GLY 97 N 1.39 4.85 0.31 8.12 0.00 -1.26 -4.86 105.19 113.74 3lul n GLY 97 Ca 0.03 -0.88 -0.04 0.00 0.00 0.00 0.00 46.02 45.13 3lul n GLY 97 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3lul h LEU 98 N 0.00 0.84 -2.25 0.99 5.85 -2.04 -2.66 115.31 116.03 3lul h LEU 98 Ca 0.00 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3lul h LEU 98 Cb 0.00 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.81 3lul h LEU 98 CO 0.00 0.83 0.00 0.00 -0.34 0.00 0.00 178.44 178.93 3lul n ALA 99 N -2.46 2.40 -0.56 1.25 0.00 -1.26 -4.94 120.51 114.95 3lul n ALA 99 Ca 0.04 -1.07 -0.29 0.00 0.00 0.00 0.00 53.44 52.13 3lul n ALA 99 Cb 0.24 -0.95 0.26 0.00 0.00 0.00 0.00 19.45 19.00 3lul n ALA 99 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3lul s GLU 100 N -1.21 -1.33 -0.02 0.00 0.41 -1.01 -5.05 118.70 110.50 3lul s GLU 100 Ca 0.41 0.64 0.01 0.00 -0.41 0.00 0.00 54.97 55.62 3lul s GLU 100 Cb 0.22 -1.52 0.02 0.00 -1.78 0.00 0.00 34.13 31.06 3lul s GLU 100 CO 0.28 -3.94 -0.02 0.50 -0.49 0.00 0.00 175.26 171.59 3lul s ARG 101 N -4.61 0.39 -0.09 1.61 6.06 -1.26 -5.05 118.95 116.01 3lul s ARG 101 Ca 0.68 -0.01 -0.30 0.00 -2.50 0.00 0.00 55.73 53.61 3lul s ARG 101 Cb -0.22 -0.49 -0.04 0.00 0.06 0.00 0.00 34.95 34.26 3lul s ARG 101 CO 0.63 -0.07 1.38 0.20 -2.50 0.00 0.00 175.30 174.94 3lul s GLY 102 N 0.71 1.72 0.31 8.12 0.00 -1.25 -4.82 107.32 112.10 3lul s GLY 102 Ca -0.08 0.69 0.09 0.00 0.00 0.00 0.00 44.72 45.42 3lul s GLY 102 CO -0.01 2.59 1.70 1.46 0.00 0.00 0.00 173.10 178.85 3lul h GLN 103 N 8.33 0.12 -3.70 2.90 4.20 -1.81 -3.42 115.11 121.74 3lul h GLN 103 Ca -0.33 -0.06 -0.53 0.00 0.06 0.00 0.00 58.65 57.79 3lul h GLN 103 Cb 1.15 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 28.53 3lul h GLN 103 CO 0.94 0.56 -0.77 0.08 -0.67 0.00 0.00 178.83 178.98 3lul s VAL 104 N -4.01 0.69 0.67 -0.54 1.01 -1.26 -4.72 120.40 112.24 3lul s VAL 104 Ca -0.03 -0.62 -0.13 0.00 0.00 0.00 0.00 61.98 61.20 3lul s VAL 104 Cb 0.13 -1.13 -0.00 0.00 0.00 0.00 0.00 36.38 35.39 3lul s VAL 104 CO 0.76 -0.16 1.07 -0.94 0.00 0.00 0.00 175.10 175.83 3lul s SER 105 N 1.79 5.36 -0.01 3.32 1.04 -0.25 -4.35 113.70 120.60 3lul s SER 105 Ca -0.01 1.75 0.06 0.00 0.48 0.00 0.00 55.95 58.23 3lul s SER 105 Cb -0.17 -2.52 -0.02 0.00 0.10 0.00 0.00 66.02 63.42 3lul s SER 105 CO -0.08 -1.46 -0.21 -1.10 0.98 0.00 0.00 173.24 171.38 3lul s GLN 106 N -4.62 1.67 -0.06 4.02 -1.52 -1.03 -0.61 119.66 117.51 3lul s GLN 106 Ca 0.61 -0.75 0.03 0.00 -1.95 0.00 0.00 55.36 53.30 3lul s GLN 106 Cb -0.16 -1.62 0.01 0.00 -0.22 0.00 0.00 33.01 31.02 3lul s GLN 106 CO 0.48 0.44 -0.14 -1.17 -0.25 0.00 0.00 175.29 174.66 3lul s LEU 107 N -0.51 1.74 -0.02 2.90 2.96 0.30 -0.50 118.68 125.56 3lul s LEU 107 Ca 0.08 -0.32 0.03 0.00 -0.22 0.00 0.00 54.13 53.70 3lul s LEU 107 Cb -0.08 -0.87 -0.00 0.00 0.50 0.00 0.00 46.19 45.73 3lul s LEU 107 CO -0.01 0.07 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.37 3lul s ILE 108 N 0.47 0.77 -0.06 6.68 1.01 -0.46 -0.92 121.20 128.69 3lul s ILE 108 Ca -0.12 -0.39 0.04 0.00 0.00 0.00 0.00 60.65 60.18 3lul s ILE 108 Cb -0.14 -0.66 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 3lul s ILE 108 CO 0.04 0.23 -0.17 -0.36 0.00 0.00 0.00 174.94 174.68 3lul s PHE 109 N -0.05 2.64 -0.01 3.97 0.08 -1.26 -1.09 117.98 122.27 3lul s PHE 109 Ca 0.01 -0.31 0.01 0.00 0.12 0.00 0.00 56.93 56.75 3lul s PHE 109 Cb -0.06 -1.64 0.00 0.00 -0.57 0.00 0.00 43.02 40.75 3lul s PHE 109 CO -0.00 0.06 -0.03 -0.65 -0.10 0.00 0.00 175.22 174.51 3lul s GLN 110 N -0.51 0.26 0.31 0.44 -1.52 -0.22 -4.99 119.66 113.43 3lul s GLN 110 Ca 0.07 -0.09 0.06 0.00 -1.95 0.00 0.00 55.36 53.45 3lul s GLN 110 Cb -0.12 -0.27 -0.01 0.00 -0.22 0.00 0.00 33.01 32.38 3lul s GLN 110 CO 0.01 0.04 0.44 0.95 -0.25 0.00 0.00 175.29 176.48 3lul s THR 111 N 0.06 4.38 -0.06 -0.19 -4.23 -1.26 -0.60 115.64 113.75 3lul s THR 111 Ca -0.00 -1.00 -0.31 0.00 -1.18 0.00 0.00 61.69 59.20 3lul s THR 111 Cb -0.03 -3.53 0.07 0.00 1.34 0.00 0.00 72.50 70.36 3lul s THR 111 CO -0.00 -0.20 0.70 0.72 -0.54 0.00 0.00 174.62 175.30 3lul s PHE 112 N -2.12 -0.64 0.37 3.99 -0.71 -0.23 -4.96 117.98 113.68 3lul s PHE 112 Ca 0.42 1.10 -0.08 0.00 -1.04 0.00 0.00 56.93 57.33 3lul s PHE 112 Cb -0.09 0.41 -0.06 0.00 -1.21 0.00 0.00 43.02 42.07 3lul s PHE 112 CO 0.30 -0.59 0.70 -0.80 -1.34 0.00 0.00 175.22 173.50 3lul s ASN 113 N -1.16 6.48 0.15 1.98 0.01 -1.26 -0.78 114.94 120.35 3lul s ASN 113 Ca -0.10 0.98 -0.12 0.00 -0.71 0.00 0.00 52.86 52.91 3lul s ASN 113 Cb -0.00 -2.26 0.01 0.00 0.41 0.00 0.00 41.25 39.41 3lul s ASN 113 CO 0.09 -0.35 0.35 -0.72 -1.51 0.00 0.00 177.10 174.96 3lul s TYR 114 N -2.31 0.14 -0.08 2.20 1.13 -1.26 -4.90 117.35 112.27 3lul s TYR 114 Ca 0.49 -0.50 -0.04 0.00 -1.41 0.00 0.00 57.07 55.60 3lul s TYR 114 Cb -0.10 0.11 -0.04 0.00 -1.10 0.00 0.00 41.96 40.82 3lul s TYR 114 CO 0.32 -0.74 0.11 -1.12 -2.51 0.00 0.00 175.55 171.60 3lul s SER 115 N -2.90 6.03 -0.18 -0.18 0.01 -1.26 -4.94 113.70 110.28 3lul s SER 115 Ca 0.11 0.33 -0.18 0.00 1.31 0.00 0.00 55.95 57.52 3lul s SER 115 Cb 0.02 -1.86 -0.04 0.00 0.21 0.00 0.00 66.02 64.35 3lul s SER 115 CO -0.04 0.36 0.49 -0.63 0.41 0.00 0.00 173.24 173.83 3lul s ILE 116 N -1.06 5.14 -0.19 1.44 1.01 -1.26 -5.03 121.20 121.25 3lul s ILE 116 Ca 0.17 0.92 -0.02 0.00 0.00 0.00 0.00 60.65 61.72 3lul s ILE 116 Cb -0.12 -3.82 -0.00 0.00 0.01 0.00 0.00 42.46 38.53 3lul s ILE 116 CO 0.07 0.23 -0.09 -1.10 0.00 0.00 0.00 174.94 174.05 3lul s GLN 117 N 1.30 3.31 -0.00 2.79 1.11 -1.26 -4.99 119.66 121.92 3lul s GLN 117 Ca 0.24 -0.68 0.10 0.00 0.01 0.00 0.00 55.36 55.03 3lul s GLN 117 Cb -0.15 -2.83 -0.11 0.00 -1.01 0.00 0.00 33.01 28.91 3lul s GLN 117 CO 0.10 -0.10 0.41 1.63 0.01 0.00 0.00 175.29 177.34 3lul n LYS 118 N 4.45 3.69 -1.92 2.91 5.02 -1.26 -5.01 118.16 126.05 3lul n LYS 118 Ca -0.19 -0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.69 3lul n LYS 118 Cb 0.51 -0.97 -0.02 0.00 -0.02 0.00 0.00 35.03 34.54 3lul n LYS 118 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 3lul s HIS 119 N -1.94 2.85 0.31 2.13 -3.43 -1.26 -4.78 115.29 109.17 3lul s HIS 119 Ca 0.04 1.05 -0.30 0.00 -0.80 0.00 0.00 55.06 55.05 3lul s HIS 119 Cb 0.07 -3.91 -0.12 0.00 -1.43 0.00 0.00 32.58 27.19 3lul s HIS 119 CO 0.40 -2.87 1.52 -2.30 -2.00 0.00 0.00 174.74 169.49 3lul n PRO 120 N 1.61 2.54 -3.30 -0.38 -0.02 -1.26 -4.78 135.00 129.41 3lul n PRO 120 Ca 0.05 0.90 -0.28 0.00 -2.02 0.00 0.00 63.50 62.14 3lul n PRO 120 Cb 0.39 -2.63 -0.03 0.00 -0.02 0.00 0.00 33.50 31.21 3lul n PRO 120 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3lul s VAL 121 N -0.33 5.01 -0.19 -1.45 -7.23 -0.16 -4.58 120.40 111.48 3lul s VAL 121 Ca 0.62 0.08 -0.06 0.00 -1.81 0.00 0.00 61.98 60.80 3lul s VAL 121 Cb -0.52 -3.74 -0.03 0.00 0.56 0.00 0.00 36.38 32.64 3lul s VAL 121 CO 0.53 -0.35 0.03 -0.13 -0.31 0.00 0.00 175.10 174.87 3lul s ARG 122 N -3.61 3.83 0.15 4.82 0.52 -1.26 -0.34 118.95 123.06 3lul s ARG 122 Ca 0.44 -0.42 0.05 0.00 -0.52 0.00 0.00 55.73 55.29 3lul s ARG 122 Cb -0.11 -3.15 -0.04 0.00 0.52 0.00 0.00 34.95 32.18 3lul s ARG 122 CO 0.30 0.18 0.08 -0.51 0.02 0.00 0.00 175.30 175.38 3lul s LEU 123 N 0.60 3.64 0.13 2.53 1.43 0.51 -0.57 118.68 126.96 3lul s LEU 123 Ca 0.01 -0.19 0.10 0.00 -1.03 0.00 0.00 54.13 53.02 3lul s LEU 123 Cb -0.13 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.77 3lul s LEU 123 CO 0.02 0.09 -0.24 0.27 0.23 0.00 0.00 176.35 176.72 3lul s ILE 124 N -1.68 2.46 0.09 -0.59 -4.36 -0.91 -0.94 121.20 115.28 3lul s ILE 124 Ca 0.29 -1.72 -0.26 0.00 -0.26 0.00 0.00 60.65 58.71 3lul s ILE 124 Cb -0.10 -2.11 -0.06 0.00 1.25 0.00 0.00 42.46 41.43 3lul s ILE 124 CO 0.22 0.06 0.80 -0.44 0.24 0.00 0.00 174.94 175.82 3lul s SER 125 N -2.17 7.31 0.08 4.36 0.01 -1.26 -0.40 113.70 121.63 3lul s SER 125 Ca 0.16 1.56 -0.19 0.00 1.31 0.00 0.00 55.95 58.79 3lul s SER 125 Cb -0.10 -2.49 -0.07 0.00 0.21 0.00 0.00 66.02 63.57 3lul s SER 125 CO 0.08 0.06 0.57 -0.63 0.41 0.00 0.00 173.24 173.73 3lul s ILE 126 N -0.39 4.75 0.13 1.44 -1.09 -0.46 -4.90 121.20 120.67 3lul s ILE 126 Ca 0.39 1.18 -0.03 0.00 -2.23 0.00 0.00 60.65 59.95 3lul s ILE 126 Cb -0.22 -3.88 -0.19 0.00 -1.58 0.00 0.00 42.46 36.59 3lul s ILE 126 CO 0.25 0.51 1.29 -0.55 -1.23 0.00 0.00 174.94 175.22 3lul h ASN 127 N 4.40 0.47 -3.95 3.58 -1.07 -1.97 -3.43 115.58 113.61 3lul h ASN 127 Ca -0.49 -0.40 -0.46 0.00 0.07 0.00 0.00 56.30 55.02 3lul h ASN 127 Cb 1.21 -0.15 -0.02 0.00 -2.07 0.00 0.00 38.32 37.29 3lul h ASN 127 CO 0.64 1.21 0.32 -1.66 0.07 0.00 0.00 177.43 178.00 3lul s TRP 128 N -3.17 3.48 0.13 4.14 -2.14 -1.26 -5.06 118.94 115.06 3lul s TRP 128 Ca -0.05 1.65 0.06 0.00 2.66 0.00 0.00 56.10 60.42 3lul s TRP 128 Cb 0.09 -2.85 -0.04 0.00 -3.10 0.00 0.00 33.47 27.56 3lul s TRP 128 CO 0.86 0.05 0.02 -0.51 -2.66 0.00 0.00 176.95 174.71 3lul s LEU 129 N -2.66 3.45 -0.10 -4.66 1.43 -1.26 -4.59 118.68 110.28 3lul s LEU 129 Ca 0.56 -0.24 -0.02 0.00 -1.03 0.00 0.00 54.13 53.40 3lul s LEU 129 Cb -0.13 -2.15 -0.03 0.00 0.03 0.00 0.00 46.19 43.91 3lul s LEU 129 CO 0.18 0.13 -0.02 -0.13 0.23 0.00 0.00 176.35 176.74 3lul s ARG 130 N -2.62 3.13 -0.01 1.70 0.52 -0.81 -4.80 118.95 116.06 3lul s ARG 130 Ca 0.27 -0.46 -0.30 0.00 -0.52 0.00 0.00 55.73 54.72 3lul s ARG 130 Cb -0.11 -2.80 -0.04 0.00 0.52 0.00 0.00 34.95 32.52 3lul s ARG 130 CO 0.19 0.58 1.16 0.34 0.02 0.00 0.00 175.30 177.59 3lul s ASP 131 N -0.55 7.11 0.58 0.23 -1.08 -1.26 -0.26 116.67 121.45 3lul s ASP 131 Ca 0.09 1.86 0.29 0.00 -0.52 0.00 0.00 52.55 54.27 3lul s ASP 131 Cb -0.12 -2.57 1.78 0.00 -1.46 0.00 0.00 42.92 40.56 3lul s ASP 131 CO 0.02 -0.49 2.24 0.07 0.52 0.00 0.00 175.17 177.53 3lul h LYS 132 N 7.11 0.00 0.00 4.34 2.10 -1.91 -1.20 116.57 127.01 3lul h LYS 132 Ca -0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 3lul h LYS 132 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 3lul h LYS 132 CO 0.84 0.01 0.00 0.00 -2.00 0.00 0.00 179.45 178.29 3lul n ALA 133 N -2.33 2.37 -2.63 0.07 0.00 -1.26 -4.47 120.51 112.26 3lul n ALA 133 Ca -0.03 -0.13 -0.43 0.00 0.00 0.00 0.00 53.44 52.85 3lul n ALA 133 Cb 0.09 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.08 3lul n ALA 133 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3lul s ASN 134 N -2.47 6.84 0.52 0.00 3.84 -0.45 -4.91 114.94 118.31 3lul s ASN 134 Ca 0.28 0.89 0.35 0.00 0.21 0.00 0.00 52.86 54.58 3lul s ASN 134 Cb 0.18 -2.52 1.64 0.00 -0.55 0.00 0.00 41.25 40.00 3lul s ASN 134 CO 0.39 -0.88 2.04 1.55 -2.79 0.00 0.00 177.10 177.41 3lul h PRO 135 N 8.25 0.00 -0.85 0.43 0.13 -1.88 -3.08 132.00 134.99 3lul h PRO 135 Ca -0.21 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.00 3lul h PRO 135 Cb 1.07 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.14 3lul h PRO 135 CO 1.02 0.00 0.56 -0.07 -0.23 0.00 0.00 178.00 179.27 3lul h LEU 136 N 0.00 0.78 0.00 1.56 -0.00 -1.95 -2.90 115.31 112.81 3lul h LEU 136 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 3lul h LEU 136 Cb 0.27 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 40.78 3lul h LEU 136 CO 0.00 0.48 0.00 -1.22 -0.00 0.00 0.00 178.44 177.70 3lul n TYR 137 N -4.51 0.00 0.70 1.13 4.01 -1.16 -1.89 117.16 115.44 3lul n TYR 137 Ca 0.14 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.99 3lul n TYR 137 Cb 0.27 -0.41 0.14 0.00 -0.31 0.00 0.00 39.34 39.03 3lul n TYR 137 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3lul n GLN 138 N -1.41 2.33 0.00 -0.72 6.02 -1.09 -2.49 117.38 120.01 3lul n GLN 138 Ca 0.08 -2.04 0.00 0.00 -0.01 0.00 0.00 57.00 55.03 3lul n GLN 138 Cb 0.23 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.02 3lul n GLN 138 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3lul n LEU 139 N 1.37 0.00 0.00 1.08 4.77 -0.79 -4.57 117.00 118.86 3lul n LEU 139 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3lul n LEU 139 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3lul n LEU 139 CO 0.15 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.67 3lul n SER 141 N 0.00 0.00 0.00 -1.43 3.41 -1.26 -5.00 113.62 109.34 3lul n SER 141 Ca 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.73 3lul n SER 141 Cb 0.00 0.00 0.74 0.00 -0.26 0.00 0.00 64.21 64.69 3lul n SER 141 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3lul n VAL 142 N -1.36 0.00 -1.97 -3.33 0.24 -0.60 -4.45 118.33 106.86 3lul n VAL 142 Ca 0.00 0.00 -0.40 0.00 -2.04 0.00 0.00 64.34 61.90 3lul n VAL 142 Cb 0.00 -0.52 -0.01 0.00 -1.47 0.00 0.00 33.84 31.85 3lul n VAL 142 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3lul n ASN 143 N -0.95 7.36 -1.66 -1.34 3.02 -1.26 -4.69 115.26 115.74 3lul n ASN 143 Ca 0.19 -3.05 0.07 0.00 -0.03 0.00 0.00 54.58 51.76 3lul n ASN 143 Cb 0.09 -1.42 0.37 0.00 -0.61 0.00 0.00 39.78 38.21 3lul n ASN 143 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3lul n TYR 144 N 2.59 1.82 -0.24 3.10 4.02 -1.26 -4.58 117.16 122.61 3lul n TYR 144 Ca 0.59 -0.76 -0.05 0.00 -0.01 0.00 0.00 57.90 57.67 3lul n TYR 144 Cb 0.27 -0.47 0.11 0.00 -0.02 0.00 0.00 39.34 39.24 3lul n TYR 144 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 3lul h LEU 145 N 3.49 1.00 -0.46 7.72 5.85 -1.99 -0.43 115.31 130.50 3lul h LEU 145 Ca 0.00 -0.16 0.08 0.00 0.84 0.00 0.00 57.88 58.64 3lul h LEU 145 Cb 1.86 -0.26 -0.07 0.00 0.37 0.00 0.00 40.66 42.56 3lul h LEU 145 CO 0.43 0.90 0.06 -0.08 -0.34 0.00 0.00 178.44 179.41 3lul h GLU 146 N 1.05 0.18 -0.53 1.25 4.81 -2.00 -0.70 114.58 118.64 3lul h GLU 146 Ca 0.24 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.41 3lul h GLU 146 Cb 0.23 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 3lul h GLU 146 CO -0.02 0.12 0.13 0.00 -0.73 0.00 0.00 179.01 178.51 3lul h ALA 147 N 1.38 0.70 -0.22 2.92 0.00 -1.75 -1.83 119.26 120.46 3lul h ALA 147 Ca 0.23 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.97 3lul h ALA 147 Cb 0.32 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 3lul h ALA 147 CO -0.33 0.40 -0.09 0.82 0.00 0.00 0.00 179.25 180.05 3lul h ILE 148 N 0.75 0.69 -0.32 0.00 2.04 -0.62 0.27 117.51 120.31 3lul h ILE 148 Ca 0.17 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.03 3lul h ILE 148 Cb 0.34 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 3lul h ILE 148 CO 0.00 0.00 0.21 0.40 0.00 0.00 0.00 178.15 178.76 3lul h ILE 149 N -0.06 1.08 -0.15 -0.67 2.04 -1.04 -0.69 117.51 118.01 3lul h ILE 149 Ca 0.12 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.83 3lul h ILE 149 Cb 0.24 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 3lul h ILE 149 CO -0.26 0.08 0.09 0.00 0.00 0.00 0.00 178.15 178.06 3lul h ALA 150 N 1.12 0.19 -0.10 1.87 0.00 -1.16 -1.62 119.26 119.56 3lul h ALA 150 Ca 0.12 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 3lul h ALA 150 Cb -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3lul h ALA 150 CO -0.03 -0.33 -0.37 0.37 0.00 0.00 0.00 179.25 178.89 3lul h GLN 151 N 0.20 0.21 -0.79 0.00 4.15 -0.67 -1.31 115.11 116.90 3lul h GLN 151 Ca 0.06 -0.09 -0.03 0.00 0.77 0.00 0.00 58.65 59.36 3lul h GLN 151 Cb -0.01 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.63 3lul h GLN 151 CO -0.02 0.56 0.38 0.00 -1.93 0.00 0.00 178.83 177.82 3lul h ARG 152 N 0.18 1.13 -0.82 1.69 3.08 -0.90 -0.68 114.38 118.07 3lul h ARG 152 Ca 0.02 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 59.88 3lul h ARG 152 Cb 0.74 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 3lul h ARG 152 CO 0.06 0.87 0.39 1.96 -1.07 0.00 0.00 179.97 182.18 3lul h GLN 153 N 1.12 1.18 -0.12 0.04 4.20 -0.70 -1.03 115.11 119.80 3lul h GLN 153 Ca 0.27 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 3lul h GLN 153 Cb 0.11 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 3lul h GLN 153 CO -0.03 0.91 0.04 0.00 -0.67 0.00 0.00 178.83 179.08 3lul h ALA 154 N 1.21 0.15 -0.53 3.87 0.00 -0.70 -2.96 119.26 120.31 3lul h ALA 154 Ca 0.28 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 3lul h ALA 154 Cb 0.12 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3lul h ALA 154 CO -0.04 -0.24 0.22 0.82 0.00 0.00 0.00 179.25 180.01 3lul h ILE 155 N 0.02 1.19 -0.42 0.00 2.04 -1.03 0.69 117.51 120.00 3lul h ILE 155 Ca 0.04 -0.58 0.04 0.00 1.00 0.00 0.00 64.86 65.36 3lul h ILE 155 Cb 0.19 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 3lul h ILE 155 CO -0.00 0.23 0.28 0.00 0.00 0.00 0.00 178.15 178.66 3lul h ALA 156 N 1.49 1.89 -0.56 1.87 0.00 -1.02 -1.48 119.26 121.45 3lul h ALA 156 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3lul h ALA 156 Cb 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3lul h ALA 156 CO -0.02 0.05 0.00 1.33 0.00 0.00 0.00 179.25 180.61 3lul n VAL 157 N -4.48 1.72 -0.96 0.00 0.24 -0.98 -4.96 118.33 108.92 3lul n VAL 157 Ca 0.05 -1.24 0.00 0.00 -2.04 0.00 0.00 64.34 61.11 3lul n VAL 157 Cb 0.19 0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 3lul n VAL 157 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3lul n GLY 158 N 0.87 0.44 3.96 7.63 0.00 -0.56 -5.05 105.19 112.49 3lul n GLY 158 Ca 0.23 -0.70 -0.22 0.00 0.00 0.00 0.00 46.02 45.33 3lul n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lul s ALA 159 N -2.00 3.86 -0.19 4.61 0.00 0.20 -4.95 121.76 123.29 3lul s ALA 159 Ca 0.00 -1.21 0.18 0.00 0.00 0.00 0.00 51.96 50.92 3lul s ALA 159 Cb 0.00 -2.08 -0.24 0.00 0.00 0.00 0.00 23.12 20.79 3lul s ALA 159 CO 0.00 -0.54 0.08 -0.25 0.00 0.00 0.00 175.76 175.05 3lul n ASP 160 N -2.19 0.17 -3.77 0.00 8.00 0.27 -3.29 116.55 115.74 3lul n ASP 160 Ca 0.05 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.46 3lul n ASP 160 Cb 0.59 1.02 -0.03 0.00 -0.02 0.00 0.00 41.12 42.68 3lul n ASP 160 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3lul s ASP 161 N -5.37 -0.30 -0.03 -2.24 -1.08 -1.09 -4.85 116.67 101.72 3lul s ASP 161 Ca -0.10 -0.51 0.05 0.00 -0.52 0.00 0.00 52.55 51.48 3lul s ASP 161 Cb 0.06 0.66 -0.01 0.00 -1.46 0.00 0.00 42.92 42.17 3lul s ASP 161 CO 0.80 -1.19 -0.18 0.00 0.52 0.00 0.00 175.17 175.12 3lul s ALA 162 N -3.89 1.57 -0.19 3.66 0.00 -1.26 -2.15 121.76 119.51 3lul s ALA 162 Ca 0.10 -0.78 -0.06 0.00 0.00 0.00 0.00 51.96 51.23 3lul s ALA 162 Cb -0.03 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 3lul s ALA 162 CO 0.01 0.35 0.02 -1.17 0.00 0.00 0.00 175.76 174.97 3lul s LEU 163 N -0.27 3.46 0.10 0.00 2.96 0.47 -2.75 118.68 122.64 3lul s LEU 163 Ca 0.03 -0.09 -0.00 0.00 -0.22 0.00 0.00 54.13 53.85 3lul s LEU 163 Cb -0.09 -1.87 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 3lul s LEU 163 CO 0.00 0.12 0.26 -0.36 -1.32 0.00 0.00 176.35 175.05 3lul s PHE 164 N 0.68 3.51 0.15 5.38 0.08 -0.40 -1.36 117.98 126.01 3lul s PHE 164 Ca 0.01 0.28 0.08 0.00 0.12 0.00 0.00 56.93 57.43 3lul s PHE 164 Cb -0.14 -1.79 -0.04 0.00 -0.57 0.00 0.00 43.02 40.48 3lul s PHE 164 CO 0.02 0.54 -0.19 -0.06 -0.10 0.00 0.00 175.22 175.43 3lul s PHE 165 N -1.59 1.82 0.67 0.36 0.40 -1.26 -1.51 117.98 116.86 3lul s PHE 165 Ca 0.36 -0.45 -0.01 0.00 -0.60 0.00 0.00 56.93 56.23 3lul s PHE 165 Cb -0.12 -0.93 0.09 0.00 0.51 0.00 0.00 43.02 42.57 3lul s PHE 165 CO 0.28 0.29 0.93 0.54 0.70 0.00 0.00 175.22 177.96 3lul s ASN 166 N -2.44 4.67 0.00 1.36 2.20 0.25 -1.93 114.94 119.05 3lul s ASN 166 Ca 0.13 -0.19 0.19 0.00 -0.94 0.00 0.00 52.86 52.06 3lul s ASN 166 Cb -0.07 -0.37 0.94 0.00 -2.00 0.00 0.00 41.25 39.75 3lul s ASN 166 CO 0.06 -1.62 1.61 0.35 -2.94 0.00 0.00 177.10 174.55 3lul n THR 167 N -2.69 0.49 -0.31 0.54 -2.24 0.65 -1.09 114.28 109.62 3lul n THR 167 Ca 0.12 0.12 0.06 0.00 -2.27 0.00 0.00 64.05 62.08 3lul n THR 167 Cb 0.60 -0.80 0.30 0.00 -2.10 0.00 0.00 70.33 68.33 3lul n THR 167 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3lul n GLU 168 N -1.34 3.64 -3.32 -0.78 1.02 -1.26 -4.94 120.64 113.65 3lul n GLU 168 Ca 0.08 -2.32 -0.24 0.00 -0.02 0.00 0.00 57.16 54.66 3lul n GLU 168 Cb 0.17 -1.96 0.03 0.00 -0.02 0.00 0.00 31.44 29.66 3lul n GLU 168 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3lul n ASN 169 N 0.61 -5.16 -4.65 1.62 4.13 -0.25 -5.00 115.26 106.55 3lul n ASN 169 Ca 0.21 -0.42 -0.34 0.00 1.68 0.00 0.00 54.58 55.71 3lul n ASN 169 Cb 0.87 -4.18 -0.10 0.00 -1.54 0.00 0.00 39.78 34.84 3lul n ASN 169 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 3lul s HIS 170 N -3.13 3.06 0.39 3.10 3.76 -1.25 -4.06 115.29 117.16 3lul s HIS 170 Ca 0.42 0.09 -0.28 0.00 -0.15 0.00 0.00 55.06 55.15 3lul s HIS 170 Cb -0.20 -1.71 -0.10 0.00 1.11 0.00 0.00 32.58 31.68 3lul s HIS 170 CO 0.52 0.43 1.47 0.08 -0.85 0.00 0.00 174.74 176.39 3lul s VAL 171 N -0.96 2.07 0.00 -0.90 1.01 -0.04 -0.58 120.40 120.99 3lul s VAL 171 Ca 0.16 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.21 3lul s VAL 171 Cb -0.11 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.22 3lul s VAL 171 CO 0.06 0.01 0.00 0.35 0.00 0.00 0.00 175.10 175.52 3lul n THR 172 N 0.34 0.00 -3.83 3.92 -2.24 -0.57 -4.71 114.28 107.19 3lul n THR 172 Ca 0.02 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.72 3lul n THR 172 Cb 0.40 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 3lul n THR 172 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3lul s GLU 173 N 0.00 1.99 0.00 -0.78 -1.05 -1.24 -4.45 118.70 113.17 3lul s GLU 173 Ca 0.00 -1.20 0.00 0.00 -0.15 0.00 0.00 54.97 53.62 3lul s GLU 173 Cb 0.00 0.61 0.00 0.00 -0.44 0.00 0.00 34.13 34.30 3lul s GLU 173 CO 0.00 -0.92 0.00 0.25 0.95 0.00 0.00 175.26 175.54 3lul n THR 174 N -0.50 0.00 0.79 1.83 -2.24 -0.26 -1.28 114.28 112.61 3lul n THR 174 Ca -0.06 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.83 3lul n THR 174 Cb 0.59 -1.35 0.50 0.00 -2.10 0.00 0.00 70.33 67.97 3lul n THR 174 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3lul n THR 175 N -0.06 0.40 -1.88 4.28 -2.24 -1.11 -4.32 114.28 109.35 3lul n THR 175 Ca 0.00 0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 3lul n THR 175 Cb 0.00 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.53 3lul n THR 175 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3lul s ALA 177 N 0.00 -1.38 0.70 0.00 0.00 -1.26 -4.75 121.76 115.07 3lul s ALA 177 Ca 0.00 1.00 -0.11 0.00 0.00 0.00 0.00 51.96 52.85 3lul s ALA 177 Cb 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.05 3lul s ALA 177 CO 0.00 -0.32 1.07 -0.80 0.00 0.00 0.00 175.76 175.71 3lul s ASN 178 N -1.07 5.46 -0.03 0.00 -0.87 -0.48 -1.11 114.94 116.84 3lul s ASN 178 Ca -0.11 1.32 0.06 0.00 -1.57 0.00 0.00 52.86 52.57 3lul s ASN 178 Cb -0.02 -2.19 -0.02 0.00 -0.02 0.00 0.00 41.25 39.00 3lul s ASN 178 CO 0.07 -1.36 -0.22 -0.22 -2.57 0.00 0.00 177.10 172.80 3lul s LEU 179 N -5.42 2.28 0.10 0.60 0.20 -1.26 -1.14 118.68 114.04 3lul s LEU 179 Ca 0.58 -0.38 0.06 0.00 0.69 0.00 0.00 54.13 55.08 3lul s LEU 179 Cb -0.12 -1.41 -0.03 0.00 -0.43 0.00 0.00 46.19 44.19 3lul s LEU 179 CO 0.53 0.33 -0.15 -0.36 -0.29 0.00 0.00 176.35 176.41 3lul s PHE 180 N -0.64 1.40 0.09 5.38 0.40 -0.07 -4.18 117.98 120.35 3lul s PHE 180 Ca 0.10 -0.50 0.03 0.00 -0.60 0.00 0.00 56.93 55.96 3lul s PHE 180 Cb -0.10 -0.76 -0.04 0.00 0.51 0.00 0.00 43.02 42.63 3lul s PHE 180 CO -0.00 0.13 -0.08 -0.48 0.70 0.00 0.00 175.22 175.48 3lul s LEU 181 N -2.11 2.44 -0.09 -0.37 0.05 0.26 -1.48 118.68 117.38 3lul s LEU 181 Ca 0.05 -0.87 0.03 0.00 0.05 0.00 0.00 54.13 53.38 3lul s LEU 181 Cb -0.08 -0.17 -0.01 0.00 -2.05 0.00 0.00 46.19 43.88 3lul s LEU 181 CO 0.03 -0.36 -0.19 -0.63 -0.55 0.00 0.00 176.35 174.65 3lul s ILE 182 N -2.90 2.56 -0.08 1.48 1.01 0.20 -0.42 121.20 123.04 3lul s ILE 182 Ca 0.07 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 59.82 3lul s ILE 182 Cb 0.00 -2.01 0.05 0.00 0.01 0.00 0.00 42.46 40.51 3lul s ILE 182 CO -0.02 0.56 0.17 -0.70 0.00 0.00 0.00 174.94 174.94 3lul s GLU 183 N 0.04 0.06 -1.40 2.79 2.12 -0.65 -0.28 118.70 121.38 3lul s GLU 183 Ca -0.07 0.53 -0.04 0.00 0.36 0.00 0.00 54.97 55.75 3lul s GLU 183 Cb -0.15 -0.23 0.03 0.00 0.26 0.00 0.00 34.13 34.04 3lul s GLU 183 CO 0.05 -0.27 0.72 0.09 -0.54 0.00 0.00 175.26 175.31 3lul n ASN 184 N 5.03 -1.95 -1.81 -1.70 3.02 -1.26 -1.74 115.26 114.86 3lul n ASN 184 Ca -0.10 -0.85 -0.20 0.00 -0.03 0.00 0.00 54.58 53.39 3lul n ASN 184 Cb 0.50 -3.77 -0.05 0.00 -0.61 0.00 0.00 39.78 35.85 3lul n ASN 184 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3lul n ASN 185 N -2.97 -5.47 -4.27 6.41 3.02 -1.26 -4.98 115.26 105.73 3lul n ASN 185 Ca -0.21 0.28 -0.31 0.00 -0.03 0.00 0.00 54.58 54.32 3lul n ASN 185 Cb 0.64 -4.62 -0.16 0.00 -0.61 0.00 0.00 39.78 35.02 3lul n ASN 185 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3lul s ILE 186 N -2.83 1.98 0.02 2.41 1.01 -0.71 -4.75 121.20 118.33 3lul s ILE 186 Ca 0.00 -1.04 -0.16 0.00 0.00 0.00 0.00 60.65 59.45 3lul s ILE 186 Cb 0.00 -1.66 -0.06 0.00 0.01 0.00 0.00 42.46 40.75 3lul s ILE 186 CO 0.00 0.55 0.45 -0.76 0.00 0.00 0.00 174.94 175.18 3lul s LEU 187 N -0.30 4.48 0.03 2.97 1.43 -0.61 -1.64 118.68 125.04 3lul s LEU 187 Ca 0.01 1.03 0.03 0.00 -1.03 0.00 0.00 54.13 54.17 3lul s LEU 187 Cb -0.12 -2.69 -0.02 0.00 0.03 0.00 0.00 46.19 43.39 3lul s LEU 187 CO 0.02 0.30 -0.09 -0.31 0.23 0.00 0.00 176.35 176.50 3lul s TYR 188 N -1.11 0.82 -0.06 0.29 1.51 0.44 0.06 117.35 119.30 3lul s TYR 188 Ca 0.26 -0.32 -0.17 0.00 -1.01 0.00 0.00 57.07 55.82 3lul s TYR 188 Cb -0.17 -0.50 0.04 0.00 -0.11 0.00 0.00 41.96 41.22 3lul s TYR 188 CO 0.15 -0.02 0.41 -0.08 -1.11 0.00 0.00 175.55 174.90 3lul s THR 189 N -0.80 0.03 0.52 -0.71 -1.32 -0.36 -0.58 115.64 112.42 3lul s THR 189 Ca -0.02 -0.25 -0.22 0.00 -1.21 0.00 0.00 61.69 59.99 3lul s THR 189 Cb -0.07 -0.67 -0.06 0.00 -1.51 0.00 0.00 72.50 70.19 3lul s THR 189 CO 0.00 -0.14 1.24 -2.65 -2.21 0.00 0.00 174.62 170.86 3lul n PRO 190 N 1.70 1.56 -2.01 7.08 -0.02 -1.25 -1.35 135.00 140.70 3lul n PRO 190 Ca -0.19 0.57 -0.34 0.00 -2.02 0.00 0.00 63.50 61.53 3lul n PRO 190 Cb 0.56 -2.41 0.02 0.00 -0.02 0.00 0.00 33.50 31.65 3lul n PRO 190 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3lul s ARG 191 N -2.65 3.11 0.40 -0.52 0.52 -1.21 -4.64 118.95 113.95 3lul s ARG 191 Ca 0.70 1.46 0.07 0.00 -0.52 0.00 0.00 55.73 57.43 3lul s ARG 191 Cb -0.45 -1.99 0.81 0.00 0.52 0.00 0.00 34.95 33.85 3lul s ARG 191 CO 0.51 -1.02 2.02 0.28 0.02 0.00 0.00 175.30 177.12 3lul h VAL 192 N 0.59 1.12 0.00 3.52 2.07 -1.93 -0.77 116.25 120.85 3lul h VAL 192 Ca -0.48 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 66.72 3lul h VAL 192 Cb 1.25 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3lul h VAL 192 CO 0.56 0.14 0.00 -0.33 0.02 0.00 0.00 177.57 177.95 3lul h GLU 193 N 0.53 0.00 0.00 1.57 3.07 -1.92 -1.14 114.58 116.69 3lul h GLU 193 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 3lul h GLU 193 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 3lul h GLU 193 CO -0.02 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.34 3lul n ASP 194 N -2.55 0.00 -0.47 1.42 8.00 -0.29 -4.87 116.55 117.79 3lul n ASP 194 Ca -0.00 0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3lul n ASP 194 Cb 0.14 -0.28 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 3lul n ASP 194 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3lul n GLY 195 N 0.36 0.77 3.38 0.44 0.00 -0.44 -4.57 105.19 105.12 3lul n GLY 195 Ca 0.09 -0.48 -0.20 0.00 0.00 0.00 0.00 46.02 45.44 3lul n GLY 195 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3lul s ILE 196 N -2.13 1.68 -0.02 -0.61 -4.36 -1.18 -4.79 121.20 109.79 3lul s ILE 196 Ca 0.00 -2.17 -0.30 0.00 -0.26 0.00 0.00 60.65 57.92 3lul s ILE 196 Cb 0.00 -2.22 -0.05 0.00 1.25 0.00 0.00 42.46 41.44 3lul s ILE 196 CO 0.00 -0.47 1.31 -0.22 0.24 0.00 0.00 174.94 175.80 3lul s LEU 197 N -3.37 4.31 -1.02 0.37 1.98 -1.04 -4.23 118.68 115.68 3lul s LEU 197 Ca 0.26 1.99 -0.23 0.00 -2.89 0.00 0.00 54.13 53.25 3lul s LEU 197 Cb 0.01 -3.56 -0.01 0.00 0.66 0.00 0.00 46.19 43.29 3lul s LEU 197 CO 0.09 -0.65 1.78 -2.16 -1.89 0.00 0.00 176.35 173.53 3lul s PRO 198 N 2.20 2.98 0.50 0.98 0.04 -1.26 -4.93 135.00 135.51 3lul s PRO 198 Ca 0.60 -0.84 -0.24 0.00 0.04 0.00 0.00 61.00 60.57 3lul s PRO 198 Cb -0.29 -5.22 -0.07 0.00 0.04 0.00 0.00 34.50 28.96 3lul s PRO 198 CO 0.25 -3.04 1.39 0.20 0.04 0.00 0.00 177.00 175.84 3lul s GLY 199 N 6.53 2.90 0.14 0.56 0.00 -1.26 -4.92 107.32 111.27 3lul s GLY 199 Ca 0.61 1.39 -0.12 0.00 0.00 0.00 0.00 44.72 46.60 3lul s GLY 199 CO -0.00 1.95 1.54 -2.22 0.00 0.00 0.00 173.10 174.37 3lul h ILE 200 N 1.88 1.27 -0.38 0.90 2.04 -1.97 -1.49 117.51 119.77 3lul h ILE 200 Ca -0.51 -1.28 -0.09 0.00 1.00 0.00 0.00 64.86 63.98 3lul h ILE 200 Cb 1.28 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 3lul h ILE 200 CO 0.59 0.44 -0.11 0.74 0.00 0.00 0.00 178.15 179.81 3lul h THR 201 N 0.71 1.28 -0.27 -0.27 2.02 -1.91 -0.31 112.91 114.16 3lul h THR 201 Ca 0.11 -1.20 0.06 0.00 0.77 0.00 0.00 66.41 66.14 3lul h THR 201 Cb 0.70 1.27 -0.06 0.00 -1.74 0.00 0.00 68.15 68.32 3lul h THR 201 CO 0.05 0.40 -0.12 -0.09 0.37 0.00 0.00 175.52 176.13 3lul h ARG 202 N 0.55 -0.07 -0.55 6.66 2.43 -1.87 -0.30 114.38 121.23 3lul h ARG 202 Ca 0.09 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3lul h ARG 202 Cb 0.64 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.18 3lul h ARG 202 CO 0.04 -0.05 0.24 0.00 -1.51 0.00 0.00 179.97 178.69 3lul h ALA 203 N 1.16 0.71 -0.90 2.80 0.00 -0.98 -1.61 119.26 120.43 3lul h ALA 203 Ca 0.14 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3lul h ALA 203 Cb 0.29 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 3lul h ALA 203 CO -0.32 0.30 0.57 0.00 0.00 0.00 0.00 179.25 179.80 3lul h ARG 204 N 0.74 1.03 -0.31 0.00 3.08 -0.70 -1.60 114.38 116.62 3lul h ARG 204 Ca 0.18 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.12 3lul h ARG 204 Cb 0.17 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3lul h ARG 204 CO -0.02 0.68 -0.02 1.25 -1.07 0.00 0.00 179.97 180.79 3lul h LEU 205 N 1.07 0.55 -0.65 3.04 5.85 -0.82 0.37 115.31 124.72 3lul h LEU 205 Ca 0.38 -0.33 0.07 0.00 0.84 0.00 0.00 57.88 58.85 3lul h LEU 205 Cb 0.12 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 3lul h LEU 205 CO -0.16 0.75 0.33 0.40 -0.34 0.00 0.00 178.44 179.42 3lul h ILE 206 N 0.34 0.90 -0.17 4.05 2.04 -1.07 0.64 117.51 124.23 3lul h ILE 206 Ca 0.08 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 3lul h ILE 206 Cb 0.48 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3lul h ILE 206 CO 0.02 0.11 0.09 -1.28 0.00 0.00 0.00 178.15 177.09 3lul h SER 207 N 0.60 0.23 -0.84 1.72 0.87 -0.91 -1.26 113.55 113.95 3lul h SER 207 Ca 0.31 -0.12 0.01 0.00 -1.23 0.00 0.00 61.79 60.76 3lul h SER 207 Cb 0.26 -0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.12 3lul h SER 207 CO -0.22 0.28 0.55 0.45 -0.53 0.00 0.00 176.83 177.36 3lul h HIS 208 N 0.16 1.05 -0.41 2.24 3.86 -0.50 -0.57 115.15 120.97 3lul h HIS 208 Ca 0.06 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 3lul h HIS 208 Cb 0.11 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.21 3lul h HIS 208 CO -0.03 0.65 0.26 0.00 0.86 0.00 0.00 177.93 179.67 3lul h GLN 210 N 0.55 0.73 -0.21 0.00 4.20 -0.88 -2.08 115.11 117.42 3lul h GLN 210 Ca 0.15 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 3lul h GLN 210 Cb -0.03 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 3lul h GLN 210 CO -0.03 0.48 0.07 1.96 -0.67 0.00 0.00 178.83 180.64 3lul h GLN 211 N 0.75 0.29 -0.45 1.46 4.20 -0.79 -2.91 115.11 117.66 3lul h GLN 211 Ca 0.21 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.88 3lul h GLN 211 Cb -0.08 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.64 3lul h GLN 211 CO -0.05 0.26 0.00 0.72 -0.67 0.00 0.00 178.83 179.09 3lul n HIS 212 N -4.43 1.55 -2.40 2.96 8.25 -0.61 -5.10 115.22 115.44 3lul n HIS 212 Ca 0.00 -0.78 -0.04 0.00 -0.26 0.00 0.00 57.72 56.64 3lul n HIS 212 Cb 0.13 -0.41 -0.04 0.00 1.12 0.00 0.00 29.99 30.80 3lul n HIS 212 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3lul n LYS 213 N 0.18 -4.13 -3.99 -0.41 5.02 -0.83 -5.03 118.16 108.97 3lul n LYS 213 Ca 0.25 3.15 -0.26 0.00 -2.02 0.00 0.00 58.31 59.42 3lul n LYS 213 Cb 1.04 -4.49 -0.17 0.00 -0.02 0.00 0.00 35.03 31.39 3lul n LYS 213 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3lul s SER 215 N -0.57 2.04 -0.12 4.39 0.01 -1.26 -5.03 113.70 113.16 3lul s SER 215 Ca -0.21 -0.28 -0.02 0.00 1.31 0.00 0.00 55.95 56.75 3lul s SER 215 Cb 0.01 -0.80 0.04 0.00 0.21 0.00 0.00 66.02 65.49 3lul s SER 215 CO 0.57 -0.10 0.02 0.54 0.41 0.00 0.00 173.24 174.68 3lul s VAL 216 N 1.56 0.40 -0.21 3.43 0.11 -1.26 -1.57 120.40 122.86 3lul s VAL 216 Ca 0.02 -0.11 -0.04 0.00 -2.93 0.00 0.00 61.98 58.92 3lul s VAL 216 Cb -0.13 -0.69 -0.01 0.00 -1.53 0.00 0.00 36.38 34.01 3lul s VAL 216 CO -0.06 0.08 -0.04 -1.10 -3.33 0.00 0.00 175.10 170.65 3lul s GLN 217 N 1.95 3.41 -0.53 1.54 -1.52 0.11 -4.98 119.66 119.65 3lul s GLN 217 Ca 0.03 -0.61 -0.19 0.00 -1.95 0.00 0.00 55.36 52.64 3lul s GLN 217 Cb -0.14 -3.00 0.07 0.00 -0.22 0.00 0.00 33.01 29.72 3lul s GLN 217 CO -0.06 -0.14 0.63 -1.21 -0.25 0.00 0.00 175.29 174.26 3lul s GLU 218 N 1.34 3.09 0.14 2.91 2.02 -1.26 -1.23 118.70 125.71 3lul s GLU 218 Ca 0.04 -1.02 -0.11 0.00 0.02 0.00 0.00 54.97 53.90 3lul s GLU 218 Cb -0.14 -4.14 0.00 0.00 0.10 0.00 0.00 34.13 29.95 3lul s GLU 218 CO -0.02 -1.29 0.29 0.96 0.02 0.00 0.00 175.26 175.22 3lul s ILE 219 N 2.58 0.09 0.18 -1.63 -4.36 -0.45 -4.65 121.20 112.96 3lul s ILE 219 Ca 0.14 -1.17 -0.30 0.00 -0.26 0.00 0.00 60.65 59.05 3lul s ILE 219 Cb -0.21 -1.58 -0.08 0.00 1.25 0.00 0.00 42.46 41.84 3lul s ILE 219 CO 0.10 -0.39 1.24 -0.44 0.24 0.00 0.00 174.94 175.70 3lul s SER 220 N -2.91 7.01 -0.12 4.36 0.01 -1.26 -3.35 113.70 117.44 3lul s SER 220 Ca 0.11 2.28 0.03 0.00 1.31 0.00 0.00 55.95 59.67 3lul s SER 220 Cb 0.03 -2.60 0.01 0.00 0.21 0.00 0.00 66.02 63.67 3lul s SER 220 CO -0.05 -0.45 -0.20 -0.76 0.41 0.00 0.00 173.24 172.19 3lul s LEU 221 N -0.02 1.97 0.79 2.44 1.43 -1.26 -5.04 118.68 118.98 3lul s LEU 221 Ca 0.55 -0.53 -0.12 0.00 -1.03 0.00 0.00 54.13 53.00 3lul s LEU 221 Cb -0.34 -1.31 0.06 0.00 0.03 0.00 0.00 46.19 44.64 3lul s LEU 221 CO 0.36 0.07 1.11 0.42 0.23 0.00 0.00 176.35 178.55 3lul s THR 222 N 0.78 2.91 0.36 5.49 -4.23 -1.26 -0.86 115.64 118.83 3lul s THR 222 Ca -0.09 0.30 0.05 0.00 -1.18 0.00 0.00 61.69 60.76 3lul s THR 222 Cb -0.16 -3.15 0.28 0.00 1.34 0.00 0.00 72.50 70.81 3lul s THR 222 CO 0.00 -0.39 1.99 0.50 -0.54 0.00 0.00 174.62 176.18 3lul h LYS 223 N -1.01 0.75 -0.68 3.99 3.64 -1.96 -2.39 116.57 118.91 3lul h LYS 223 Ca -0.47 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 58.84 3lul h LYS 223 Cb 1.28 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.90 3lul h LYS 223 CO 0.62 0.50 0.33 -0.22 -2.27 0.00 0.00 179.45 178.40 3lul h LYS 224 N 0.77 0.97 -0.93 1.90 3.64 -1.94 0.20 116.57 121.18 3lul h LYS 224 Ca 0.27 -0.13 0.03 0.00 -1.27 0.00 0.00 60.65 59.55 3lul h LYS 224 Cb 0.11 -0.18 -0.05 0.00 -0.41 0.00 0.00 32.23 31.69 3lul h LYS 224 CO -0.08 0.75 0.61 0.00 -2.27 0.00 0.00 179.45 178.46 3lul h ARG 225 N 0.97 1.17 -0.12 1.90 2.47 -1.80 -0.69 114.38 118.27 3lul h ARG 225 Ca 0.24 -0.07 -0.07 0.00 -1.26 0.00 0.00 59.98 58.82 3lul h ARG 225 Cb 0.10 -0.26 -0.00 0.00 -1.65 0.00 0.00 29.97 28.15 3lul h ARG 225 CO -0.03 0.77 -0.19 0.82 0.56 0.00 0.00 179.97 181.90 3lul h ILE 226 N 1.20 1.37 -0.75 2.04 2.04 -1.35 -2.75 117.51 119.31 3lul h ILE 226 Ca 0.36 -1.43 0.12 0.00 1.00 0.00 0.00 64.86 64.92 3lul h ILE 226 Cb -0.04 2.02 -0.05 0.00 -0.74 0.00 0.00 36.82 38.02 3lul h ILE 226 CO -0.11 0.41 0.49 -0.33 0.00 0.00 0.00 178.15 178.62 3lul h GLU 227 N -0.08 0.52 -0.18 2.37 5.08 -0.62 -1.20 114.58 120.47 3lul h GLU 227 Ca 0.01 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3lul h GLU 227 Cb 0.76 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3lul h GLU 227 CO 0.04 0.35 0.00 -0.25 -1.00 0.00 0.00 179.01 178.15 3lul n ASP 228 N -4.49 1.76 -4.80 1.42 8.00 -0.30 -4.99 116.55 113.15 3lul n ASP 228 Ca 0.13 -1.73 -0.34 0.00 0.71 0.00 0.00 54.79 53.57 3lul n ASP 228 Cb 0.43 -0.11 -0.02 0.00 -0.02 0.00 0.00 41.12 41.40 3lul n ASP 228 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3lul s ALA 229 N -1.77 2.81 0.13 2.24 0.00 -0.46 -4.96 121.76 119.74 3lul s ALA 229 Ca 0.32 0.57 -0.12 0.00 0.00 0.00 0.00 51.96 52.74 3lul s ALA 229 Cb 0.18 -3.26 -0.06 0.00 0.00 0.00 0.00 23.12 19.98 3lul s ALA 229 CO 0.26 -0.53 1.46 -0.44 0.00 0.00 0.00 175.76 176.51 3lul h ASP 230 N 1.17 0.93 -5.09 0.00 3.32 -0.98 -3.47 116.42 112.30 3lul h ASP 230 Ca -0.49 -0.47 -0.06 0.00 0.02 0.00 0.00 57.03 56.03 3lul h ASP 230 Cb 1.23 -0.26 -0.14 0.00 0.22 0.00 0.00 39.33 40.38 3lul h ASP 230 CO 0.58 1.21 -0.14 0.00 -1.72 0.00 0.00 179.24 179.18 3lul s ALA 231 N -4.38 -0.80 -0.00 3.45 0.00 -1.09 -4.18 121.76 114.75 3lul s ALA 231 Ca -0.11 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 51.73 3lul s ALA 231 Cb 0.10 0.61 0.00 0.00 0.00 0.00 0.00 23.12 23.83 3lul s ALA 231 CO 0.87 -0.59 0.00 0.08 0.00 0.00 0.00 175.76 176.12 3lul s VAL 232 N -3.64 0.00 0.13 0.00 1.01 -1.26 -0.63 120.40 116.02 3lul s VAL 232 Ca 0.02 0.01 -0.10 0.00 0.00 0.00 0.00 61.98 61.90 3lul s VAL 232 Cb 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 36.38 36.38 3lul s VAL 232 CO -0.11 0.01 0.28 0.72 0.00 0.00 0.00 175.10 176.00 3lul s PHE 233 N 0.05 0.19 0.25 5.22 -0.12 -0.55 -1.92 117.98 121.09 3lul s PHE 233 Ca -0.00 -0.57 0.11 0.00 -0.05 0.00 0.00 56.93 56.42 3lul s PHE 233 Cb -0.01 0.02 -0.05 0.00 -0.63 0.00 0.00 43.02 42.36 3lul s PHE 233 CO -0.00 -0.67 -0.14 -0.51 -0.05 0.00 0.00 175.22 173.85 3lul s LEU 234 N -2.90 2.77 -0.01 -1.99 1.43 0.63 -0.90 118.68 117.71 3lul s LEU 234 Ca 0.10 -0.86 0.01 0.00 -1.03 0.00 0.00 54.13 52.36 3lul s LEU 234 Cb 0.03 -1.33 0.00 0.00 0.03 0.00 0.00 46.19 44.93 3lul s LEU 234 CO -0.06 0.05 -0.04 0.42 0.23 0.00 0.00 176.35 176.95 3lul s THR 235 N -2.25 0.34 0.30 5.49 -4.23 -0.29 -0.61 115.64 114.38 3lul s THR 235 Ca 0.28 -0.15 -0.18 0.00 -1.18 0.00 0.00 61.69 60.47 3lul s THR 235 Cb -0.06 -0.31 0.02 0.00 1.34 0.00 0.00 72.50 73.49 3lul s THR 235 CO 0.16 0.11 0.68 0.54 -0.54 0.00 0.00 174.62 175.57 3lul s ASN 236 N 0.12 -0.13 0.19 3.99 2.20 -1.02 -1.38 114.94 118.91 3lul s ASN 236 Ca -0.01 -0.81 -0.08 0.00 -0.94 0.00 0.00 52.86 51.02 3lul s ASN 236 Cb -0.04 0.73 0.11 0.00 -2.00 0.00 0.00 41.25 40.04 3lul s ASN 236 CO -0.00 -1.38 1.64 0.28 -2.94 0.00 0.00 177.10 174.70 3lul h SER 237 N 2.05 0.99 0.32 3.54 0.02 -1.88 -0.67 113.55 117.93 3lul h SER 237 Ca -0.23 -0.30 -0.29 0.00 -0.84 0.00 0.00 61.79 60.13 3lul h SER 237 Cb 1.25 -0.27 0.02 0.00 0.14 0.00 0.00 62.40 63.54 3lul h SER 237 CO 0.29 1.07 -1.25 -0.07 -1.14 0.00 0.00 176.83 175.74 3lul h LEU 238 N 0.91 0.70 0.00 5.07 3.38 -1.97 -3.37 115.31 120.03 3lul h LEU 238 Ca 0.15 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 57.44 3lul h LEU 238 Cb 0.60 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3lul h LEU 238 CO 0.04 1.51 -1.23 0.00 0.09 0.00 0.00 178.44 178.85 3lul n GLN 239 N -3.70 0.82 0.00 1.13 1.13 -1.24 -4.97 117.38 110.56 3lul n GLN 239 Ca -0.12 -0.06 0.00 0.00 -1.94 0.00 0.00 57.00 54.88 3lul n GLN 239 Cb 1.00 -1.39 0.00 0.00 0.11 0.00 0.00 30.24 29.96 3lul n GLN 239 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3lul n GLY 240 N 1.43 1.32 3.69 1.08 0.00 -0.26 -4.58 105.19 107.88 3lul n GLY 240 Ca 0.01 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 3lul n GLY 240 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lul s ILE 241 N 0.00 4.69 -0.15 -0.61 1.01 -1.26 -2.44 121.20 122.44 3lul s ILE 241 Ca 0.00 1.97 0.02 0.00 0.00 0.00 0.00 60.65 62.63 3lul s ILE 241 Cb 0.00 -4.26 0.01 0.00 0.01 0.00 0.00 42.46 38.21 3lul s ILE 241 CO 0.00 -0.01 -0.20 -0.60 0.00 0.00 0.00 174.94 174.14 3lul s ARG 242 N 2.11 3.08 0.52 2.79 6.06 0.22 -4.95 118.95 128.78 3lul s ARG 242 Ca 0.49 -0.82 -0.19 0.00 -2.50 0.00 0.00 55.73 52.72 3lul s ARG 242 Cb -0.19 -2.51 -0.07 0.00 0.06 0.00 0.00 34.95 32.24 3lul s ARG 242 CO 0.18 -0.02 1.06 1.03 -2.50 0.00 0.00 175.30 175.05 3lul s ARG 243 N 0.86 3.58 -0.20 5.12 0.52 -1.26 -0.27 118.95 127.31 3lul s ARG 243 Ca -0.05 1.37 -0.01 0.00 -0.52 0.00 0.00 55.73 56.52 3lul s ARG 243 Cb -0.15 -2.06 0.01 0.00 0.52 0.00 0.00 34.95 33.26 3lul s ARG 243 CO -0.02 -0.61 -0.13 0.08 0.02 0.00 0.00 175.30 174.64 3lul s VAL 244 N -2.06 2.68 0.02 3.52 1.01 -0.81 -0.98 120.40 123.78 3lul s VAL 244 Ca 0.67 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.84 3lul s VAL 244 Cb -0.18 -2.18 -0.31 0.00 0.00 0.00 0.00 36.38 33.72 3lul s VAL 244 CO 0.26 0.48 0.93 0.25 0.00 0.00 0.00 175.10 177.02 3lul h LEU 245 N 8.02 0.57 -7.16 3.92 5.85 -0.93 -3.42 115.31 122.16 3lul h LEU 245 Ca -0.44 -0.69 -0.07 0.00 0.84 0.00 0.00 57.88 57.52 3lul h LEU 245 Cb 1.15 -0.19 -0.18 0.00 0.37 0.00 0.00 40.66 41.81 3lul h LEU 245 CO 0.62 1.56 0.05 -0.94 -0.34 0.00 0.00 178.44 179.40 3lul s SER 246 N -7.25 -0.51 -0.19 1.25 1.04 -1.19 -0.32 113.70 106.53 3lul s SER 246 Ca -0.09 0.44 0.01 0.00 0.48 0.00 0.00 55.95 56.79 3lul s SER 246 Cb 0.06 0.48 0.04 0.00 0.10 0.00 0.00 66.02 66.70 3lul s SER 246 CO 0.89 -0.61 -0.10 -0.22 0.98 0.00 0.00 173.24 174.18 3lul s LEU 247 N -1.43 2.18 0.00 2.42 2.96 -0.18 -0.36 118.68 124.28 3lul s LEU 247 Ca -0.10 -0.85 0.00 0.00 -0.22 0.00 0.00 54.13 52.96 3lul s LEU 247 Cb -0.01 -1.20 0.00 0.00 0.50 0.00 0.00 46.19 45.48 3lul s LEU 247 CO 0.06 -0.15 0.00 0.47 -1.32 0.00 0.00 176.35 175.41 3lul n ASP 248 N 4.71 0.00 -0.40 3.68 8.00 -0.11 -1.23 116.55 131.19 3lul n ASP 248 Ca -0.14 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.49 3lul n ASP 248 Cb 0.47 0.00 0.51 0.00 -0.02 0.00 0.00 41.12 42.07 3lul n ASP 248 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3lul n ASN 249 N 5.43 1.31 -4.67 -2.24 6.94 -1.26 -4.86 115.26 115.92 3lul n ASN 249 Ca 0.00 -1.31 -0.40 0.00 -0.02 0.00 0.00 54.58 52.85 3lul n ASN 249 Cb 0.00 0.03 -0.06 0.00 -2.36 0.00 0.00 39.78 37.39 3lul n ASN 249 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3lul s ILE 250 N -2.13 5.05 -0.15 1.53 -1.09 -0.37 -5.06 121.20 118.99 3lul s ILE 250 Ca 0.35 1.12 -0.07 0.00 -2.23 0.00 0.00 60.65 59.82 3lul s ILE 250 Cb 0.21 -3.91 -0.04 0.00 -1.58 0.00 0.00 42.46 37.13 3lul s ILE 250 CO 0.38 0.15 0.09 -0.63 -1.23 0.00 0.00 174.94 173.70 3lul s ILE 251 N 1.72 5.03 0.07 2.92 1.01 -1.26 -1.01 121.20 129.67 3lul s ILE 251 Ca 0.28 0.04 0.04 0.00 0.00 0.00 0.00 60.65 61.00 3lul s ILE 251 Cb -0.16 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 39.06 3lul s ILE 251 CO 0.10 0.54 0.01 -0.36 0.00 0.00 0.00 174.94 175.23 3lul s PHE 252 N -0.33 3.04 0.17 3.97 0.08 0.56 -4.99 117.98 120.49 3lul s PHE 252 Ca 0.10 0.02 -0.31 0.00 0.12 0.00 0.00 56.93 56.85 3lul s PHE 252 Cb -0.12 -1.58 -0.10 0.00 -0.57 0.00 0.00 43.02 40.65 3lul s PHE 252 CO 0.01 0.48 1.49 -2.00 -0.10 0.00 0.00 175.22 175.11 3lul s GLU 253 N -2.14 4.25 0.23 0.44 2.56 -1.26 -4.80 118.70 117.99 3lul s GLU 253 Ca 0.25 2.28 0.22 0.00 0.00 0.00 0.00 54.97 57.72 3lul s GLU 253 Cb -0.12 -3.17 0.05 0.00 2.00 0.00 0.00 34.13 32.89 3lul s GLU 253 CO 0.17 -0.52 1.12 -0.39 -0.56 0.00 0.00 175.26 175.08 3lul h VAL 254 N 3.95 0.02 -3.69 3.70 -1.51 -1.88 -3.42 116.25 113.42 3lul h VAL 254 Ca -0.43 -1.04 -0.50 0.00 -1.23 0.00 0.00 66.70 63.50 3lul h VAL 254 Cb 1.21 1.59 -0.02 0.00 -2.13 0.00 0.00 31.29 31.94 3lul h VAL 254 CO 0.87 0.01 0.26 0.20 -1.23 0.00 0.00 177.57 177.68 3lul s ASN 255 N -5.51 7.38 -0.28 4.19 0.01 -1.26 -4.90 114.94 114.58 3lul s ASN 255 Ca 0.01 1.74 -0.23 0.00 -0.71 0.00 0.00 52.86 53.66 3lul s ASN 255 Cb 0.09 -2.54 0.10 0.00 0.41 0.00 0.00 41.25 39.31 3lul s ASN 255 CO 0.77 0.09 0.86 -2.28 -1.51 0.00 0.00 177.10 175.03 3lul s HIS 256 N -1.35 -0.69 0.46 2.20 2.46 -1.26 -4.94 115.29 112.17 3lul s HIS 256 Ca 0.42 1.60 0.18 0.00 0.47 0.00 0.00 55.06 57.73 3lul s HIS 256 Cb -0.21 0.36 1.14 0.00 -0.13 0.00 0.00 32.58 33.74 3lul s HIS 256 CO 0.26 -0.33 1.96 -1.35 -2.47 0.00 0.00 174.74 172.81 3lul h PRO 257 N 5.08 0.29 -0.55 2.88 0.11 -2.00 -1.00 132.00 136.80 3lul h PRO 257 Ca -0.29 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.72 3lul h PRO 257 Cb 1.18 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3lul h PRO 257 CO 0.10 0.19 -0.01 0.82 -0.21 0.00 0.00 178.00 178.89 3lul h ILE 258 N 0.30 1.26 -0.23 4.15 2.04 -1.99 -2.13 117.51 120.91 3lul h ILE 258 Ca 0.30 -1.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.02 3lul h ILE 258 Cb 0.77 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 3lul h ILE 258 CO -0.07 0.40 0.02 0.40 0.00 0.00 0.00 178.15 178.89 3lul h ILE 259 N 0.87 1.24 -0.65 -0.67 2.04 -1.60 -0.84 117.51 117.91 3lul h ILE 259 Ca 0.16 -0.83 0.09 0.00 1.00 0.00 0.00 64.86 65.28 3lul h ILE 259 Cb 0.52 1.34 -0.07 0.00 -0.74 0.00 0.00 36.82 37.88 3lul h ILE 259 CO 0.03 0.26 0.29 0.44 0.00 0.00 0.00 178.15 179.17 3lul h ASP 260 N 0.17 0.35 -0.32 1.72 3.32 -1.42 0.10 116.42 120.34 3lul h ASP 260 Ca 0.07 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 3lul h ASP 260 Cb 0.37 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 3lul h ASP 260 CO 0.01 0.21 0.09 0.50 -1.72 0.00 0.00 179.24 178.32 3lul h LYS 261 N 0.51 0.51 -0.58 3.56 3.64 -1.08 -1.89 116.57 121.25 3lul h LYS 261 Ca 0.32 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.52 3lul h LYS 261 Cb 0.36 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 3lul h LYS 261 CO -0.28 0.57 0.13 -0.07 -2.27 0.00 0.00 179.45 177.53 3lul h LEU 262 N 0.37 0.85 -0.51 5.20 3.38 -0.81 -0.91 115.31 122.87 3lul h LEU 262 Ca 0.10 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3lul h LEU 262 Cb 0.28 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3lul h LEU 262 CO -0.00 0.84 0.25 0.40 0.09 0.00 0.00 178.44 180.01 3lul h ILE 263 N 0.86 1.20 -0.13 1.22 2.04 -0.87 0.14 117.51 121.96 3lul h ILE 263 Ca 0.18 -0.55 0.03 0.00 1.00 0.00 0.00 64.86 65.52 3lul h ILE 263 Cb 0.33 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 3lul h ILE 263 CO 0.00 0.22 -0.04 0.15 0.00 0.00 0.00 178.15 178.48 3lul h PHE 264 N 0.68 -0.10 -0.42 1.37 3.57 -0.84 -1.36 116.94 119.85 3lul h PHE 264 Ca 0.18 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 3lul h PHE 264 Cb 0.12 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 3lul h PHE 264 CO -0.01 -0.07 0.20 -0.07 -2.23 0.00 0.00 178.31 176.13 3lul h LEU 265 N -0.02 0.55 -1.44 0.59 3.38 -0.92 -2.65 115.31 114.82 3lul h LEU 265 Ca 0.07 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3lul h LEU 265 Cb 0.12 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3lul h LEU 265 CO -0.15 0.53 -0.28 -0.07 0.09 0.00 0.00 178.44 178.57 3lul h LEU 266 N 0.54 0.01 -0.85 1.67 3.38 -0.85 -3.17 115.31 116.04 3lul h LEU 266 Ca 0.14 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 3lul h LEU 266 Cb 0.13 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3lul h LEU 266 CO -0.02 0.28 -0.44 0.78 0.09 0.00 0.00 178.44 179.14 3lul h ASN 267 N 0.01 0.00 -0.21 -0.43 2.35 -0.89 -2.65 115.58 113.76 3lul h ASN 267 Ca -0.00 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 3lul h ASN 267 Cb 0.49 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.84 3lul h ASN 267 CO 0.04 0.44 0.07 1.56 -1.65 0.00 0.00 177.43 177.89 3lul h GLN 268 N 0.00 0.17 -0.54 0.81 4.20 -1.48 -2.96 115.11 115.31 3lul h GLN 268 Ca -0.00 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.70 3lul h GLN 268 Cb 0.97 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.68 3lul h GLN 268 CO 0.06 0.11 0.36 -0.44 -0.67 0.00 0.00 178.83 178.25 3lul h ASP 269 N 0.17 0.62 -0.01 1.46 3.32 -1.57 -3.53 116.42 116.88 3lul h ASP 269 Ca 0.09 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3lul h ASP 269 Cb 0.05 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.45 3lul h ASP 269 CO -0.09 0.45 0.00 -0.62 -1.72 0.00 0.00 179.24 177.26