#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lme s LEU 29 N 0.00 4.17 -0.24 -3.43 0.05 -1.26 -4.60 118.68 113.37 3lme s LEU 29 Ca 0.00 1.22 0.01 0.00 0.05 0.00 0.00 54.13 55.41 3lme s LEU 29 Cb 0.00 -3.81 0.04 0.00 -2.05 0.00 0.00 46.19 40.37 3lme s LEU 29 CO 0.00 -0.09 -0.11 -0.75 -0.55 0.00 0.00 176.35 174.84 3lme s LYS 30 N -2.61 2.57 0.27 1.48 2.20 -0.01 -4.97 119.74 118.66 3lme s LYS 30 Ca 0.49 -1.13 -0.30 0.00 -0.36 0.00 0.00 55.97 54.66 3lme s LYS 30 Cb -0.12 -2.86 -0.11 0.00 -1.51 0.00 0.00 37.83 33.23 3lme s LYS 30 CO 0.19 -0.45 1.58 0.42 -0.36 0.00 0.00 175.35 176.73 3lme s ILE 31 N 1.21 2.19 -0.07 5.43 -1.09 -1.26 -0.10 121.20 127.51 3lme s ILE 31 Ca -0.03 0.16 -0.30 0.00 -2.23 0.00 0.00 60.65 58.25 3lme s ILE 31 Cb -0.18 -3.10 -0.05 0.00 -1.58 0.00 0.00 42.46 37.56 3lme s ILE 31 CO -0.06 0.02 1.52 -0.63 -1.23 0.00 0.00 174.94 174.56 3lme s ILE 32 N 0.22 3.76 0.01 2.92 1.01 -0.75 -4.87 121.20 123.51 3lme s ILE 32 Ca 0.64 0.96 -0.30 0.00 0.00 0.00 0.00 60.65 61.96 3lme s ILE 32 Cb -0.47 -3.62 -0.03 0.00 0.01 0.00 0.00 42.46 38.35 3lme s ILE 32 CO 0.44 -0.07 0.98 0.00 0.00 0.00 0.00 174.94 176.29 3lme s ALA 33 N 3.66 3.17 0.60 9.38 0.00 -1.26 -4.51 121.76 132.81 3lme s ALA 33 Ca 0.67 0.55 -0.18 0.00 0.00 0.00 0.00 51.96 53.01 3lme s ALA 33 Cb -0.30 -3.34 -0.07 0.00 0.00 0.00 0.00 23.12 19.41 3lme s ALA 33 CO 0.25 -0.22 0.58 -2.30 0.00 0.00 0.00 175.76 174.08 3lme n PRO 34 N 3.79 0.53 -4.19 0.00 -0.02 -1.26 -5.01 135.00 128.83 3lme n PRO 34 Ca 0.06 0.21 -0.12 0.00 -2.02 0.00 0.00 63.50 61.63 3lme n PRO 34 Cb 0.51 -1.78 -0.10 0.00 -0.02 0.00 0.00 33.50 32.11 3lme n PRO 34 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3lme s THR 35 N -1.72 0.15 -0.30 3.45 2.01 -1.26 -5.00 115.64 112.97 3lme s THR 35 Ca 0.69 -1.96 0.26 0.00 0.31 0.00 0.00 61.69 60.99 3lme s THR 35 Cb -0.43 -2.30 0.28 0.00 0.01 0.00 0.00 72.50 70.06 3lme s THR 35 CO 0.54 -0.22 1.78 -2.24 -0.69 0.00 0.00 174.62 173.79 3lme h ASP 36 N 2.70 0.00 -0.00 3.53 2.03 -1.96 -2.67 116.42 120.05 3lme h ASP 36 Ca -0.36 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 3lme h ASP 36 Cb 1.23 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.73 3lme h ASP 36 CO 0.57 0.00 -0.60 0.29 -1.03 0.00 0.00 179.24 178.47 3lme n LYS 37 N -2.44 1.72 -3.45 4.15 5.02 -1.26 -5.05 118.16 116.86 3lme n LYS 37 Ca 0.01 -0.31 -0.22 0.00 -2.02 0.00 0.00 58.31 55.77 3lme n LYS 37 Cb 0.22 -1.27 0.01 0.00 -0.02 0.00 0.00 35.03 33.98 3lme n LYS 37 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3lme s THR 38 N -2.29 2.15 0.79 -0.18 2.01 -1.01 -4.84 115.64 112.28 3lme s THR 38 Ca 0.09 -1.25 -0.11 0.00 0.31 0.00 0.00 61.69 60.73 3lme s THR 38 Cb 0.13 -2.40 0.08 0.00 0.01 0.00 0.00 72.50 70.32 3lme s THR 38 CO 0.56 0.00 1.15 -0.63 -0.69 0.00 0.00 174.62 175.01 3lme s ILE 39 N -2.64 2.06 -0.20 1.82 -1.09 -1.26 -4.64 121.20 115.26 3lme s ILE 39 Ca 0.48 -0.06 0.01 0.00 -2.23 0.00 0.00 60.65 58.85 3lme s ILE 39 Cb -0.04 -3.00 0.04 0.00 -1.58 0.00 0.00 42.46 37.88 3lme s ILE 39 CO 0.30 0.00 -0.09 -0.89 -1.23 0.00 0.00 174.94 173.03 3lme s THR 40 N -3.52 1.55 0.17 2.92 2.01 -1.26 -4.37 115.64 113.14 3lme s THR 40 Ca 0.62 -0.97 -0.31 0.00 0.31 0.00 0.00 61.69 61.34 3lme s THR 40 Cb -0.11 -1.66 -0.10 0.00 0.01 0.00 0.00 72.50 70.65 3lme s THR 40 CO 0.48 0.14 1.53 -2.84 -0.69 0.00 0.00 174.62 173.25 3lme s PRO 41 N 1.43 4.23 -0.22 4.92 0.02 -1.26 -4.93 135.00 139.20 3lme s PRO 41 Ca -0.01 2.33 0.15 0.00 0.02 0.00 0.00 61.00 63.49 3lme s PRO 41 Cb -0.16 -3.16 0.46 0.00 0.02 0.00 0.00 34.50 31.66 3lme s PRO 41 CO -0.08 -0.57 1.17 -1.13 -0.33 0.00 0.00 177.00 176.06 3lme n SER 42 N 3.75 2.68 0.00 2.53 3.41 -1.26 -5.04 113.62 119.69 3lme n SER 42 Ca 0.13 -3.01 0.00 0.00 -0.26 0.00 0.00 58.87 55.72 3lme n SER 42 Cb 0.39 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 3lme n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3lme n GLY 43 N -0.57 -0.70 2.49 5.00 0.00 -1.26 -5.04 105.19 105.12 3lme n GLY 43 Ca 0.22 -0.76 -0.40 0.00 0.00 0.00 0.00 46.02 45.08 3lme n GLY 43 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3lme n THR 44 N 2.20 4.14 -3.50 2.61 -2.24 -1.26 -4.81 114.28 111.41 3lme n THR 44 Ca 0.00 -2.98 -0.10 0.00 -2.27 0.00 0.00 64.05 58.71 3lme n THR 44 Cb 0.00 -2.55 -0.02 0.00 -2.10 0.00 0.00 70.33 65.66 3lme n THR 44 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3lme s TRP 45 N 2.09 -0.41 0.40 4.78 1.48 -1.26 -5.18 118.94 120.84 3lme s TRP 45 Ca 0.60 0.22 0.07 0.00 -1.06 0.00 0.00 56.10 55.92 3lme s TRP 45 Cb 0.16 0.56 -0.07 0.00 -1.16 0.00 0.00 33.47 32.96 3lme s TRP 45 CO -0.07 -0.74 0.03 -1.54 -4.06 0.00 0.00 176.95 170.57 3lme s SER 46 N -2.66 3.95 0.13 -2.66 1.04 -1.26 -4.73 113.70 107.51 3lme s SER 46 Ca 0.04 -1.30 -0.03 0.00 0.48 0.00 0.00 55.95 55.14 3lme s SER 46 Cb -0.01 -0.41 -0.11 0.00 0.10 0.00 0.00 66.02 65.58 3lme s SER 46 CO -0.09 -0.44 1.29 0.16 0.98 0.00 0.00 173.24 175.14 3lme h ILE 47 N 1.74 1.45 -2.16 -1.02 3.07 -1.96 -3.42 117.51 115.21 3lme h ILE 47 Ca -0.44 -2.63 0.22 0.00 1.55 0.00 0.00 64.86 63.57 3lme h ILE 47 Cb 1.24 2.55 -0.04 0.00 -0.27 0.00 0.00 36.82 40.30 3lme h ILE 47 CO 0.78 0.78 0.65 0.61 -1.05 0.00 0.00 178.15 179.91 3lme n GLY 48 N 1.06 0.46 3.28 0.16 0.00 -1.26 -0.71 105.19 108.18 3lme n GLY 48 Ca -0.06 -1.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 3lme n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lme s ALA 49 N -1.85 -0.95 -0.08 4.61 0.00 0.07 -1.81 121.76 121.75 3lme s ALA 49 Ca 0.23 1.00 -0.15 0.00 0.00 0.00 0.00 51.96 53.03 3lme s ALA 49 Cb -0.01 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.53 3lme s ALA 49 CO 0.02 -0.20 0.38 0.50 0.00 0.00 0.00 175.76 176.46 3lme s ARG 50 N -0.03 4.10 -0.22 0.00 3.52 0.86 -0.15 118.95 127.02 3lme s ARG 50 Ca -0.02 0.31 -0.04 0.00 -0.13 0.00 0.00 55.73 55.85 3lme s ARG 50 Cb -0.03 -3.33 0.09 0.00 -1.56 0.00 0.00 34.95 30.12 3lme s ARG 50 CO 0.01 0.44 0.15 0.00 -0.81 0.00 0.00 175.30 175.09 3lme s ALA 51 N -0.22 0.22 0.00 6.12 0.00 0.72 -0.83 121.76 127.78 3lme s ALA 51 Ca 0.22 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.80 3lme s ALA 51 Cb -0.15 -1.27 0.00 0.00 0.00 0.00 0.00 23.12 21.70 3lme s ALA 51 CO 0.10 -1.36 0.00 0.41 0.00 0.00 0.00 175.76 174.91 3lme n GLY 52 N 5.28 2.77 0.25 0.00 0.00 -1.26 -0.79 105.19 111.45 3lme n GLY 52 Ca -0.06 0.32 0.13 0.00 0.00 0.00 0.00 46.02 46.41 3lme n GLY 52 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3lme n ASP 53 N 6.18 1.02 -4.79 1.61 8.00 -1.26 -4.92 116.55 122.39 3lme n ASP 53 Ca 0.00 -0.91 -0.26 0.00 0.71 0.00 0.00 54.79 54.33 3lme n ASP 53 Cb 0.00 0.11 -0.05 0.00 -0.02 0.00 0.00 41.12 41.15 3lme n ASP 53 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3lme s PHE 54 N -2.46 3.12 -0.11 1.24 0.08 0.03 -1.72 117.98 118.16 3lme s PHE 54 Ca 0.26 -0.04 0.01 0.00 0.12 0.00 0.00 56.93 57.27 3lme s PHE 54 Cb 0.19 -1.48 0.02 0.00 -0.57 0.00 0.00 43.02 41.18 3lme s PHE 54 CO 0.50 0.52 -0.13 0.08 -0.10 0.00 0.00 175.22 176.10 3lme s VAL 55 N -1.81 1.34 -0.22 -0.44 1.01 0.50 -0.20 120.40 120.59 3lme s VAL 55 Ca 0.31 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.71 3lme s VAL 55 Cb -0.10 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 3lme s VAL 55 CO 0.23 0.41 0.00 -0.36 0.00 0.00 0.00 175.10 175.39 3lme s PHE 56 N 1.25 3.02 -0.15 5.22 0.08 0.79 -0.22 117.98 127.96 3lme s PHE 56 Ca -0.02 -0.61 -0.07 0.00 0.12 0.00 0.00 56.93 56.35 3lme s PHE 56 Cb -0.14 -2.13 -0.04 0.00 -0.57 0.00 0.00 43.02 40.14 3lme s PHE 56 CO -0.05 -0.37 0.11 0.42 -0.10 0.00 0.00 175.22 175.23 3lme s ILE 57 N 1.30 5.22 1.12 0.64 -1.09 -0.68 -0.75 121.20 126.96 3lme s ILE 57 Ca 0.04 0.11 -0.19 0.00 -2.23 0.00 0.00 60.65 58.38 3lme s ILE 57 Cb -0.15 -3.31 0.27 0.00 -1.58 0.00 0.00 42.46 37.70 3lme s ILE 57 CO 0.01 0.54 1.18 0.61 -1.23 0.00 0.00 174.94 176.04 3lme n GLY 58 N 2.69 -2.27 3.64 6.18 0.00 0.11 -3.93 105.19 111.62 3lme n GLY 58 Ca -0.18 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 3lme n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3lme s GLY 59 N -5.02 1.11 -0.07 -0.02 0.00 -1.26 -4.70 107.32 97.37 3lme s GLY 59 Ca 0.72 1.07 -0.08 0.00 0.00 0.00 0.00 44.72 46.43 3lme s GLY 59 CO 0.53 3.54 0.21 1.06 0.00 0.00 0.00 173.10 178.45 3lme s MET 60 N 5.12 3.54 0.45 2.90 -1.94 -0.69 -4.89 119.30 123.79 3lme s MET 60 Ca 0.91 -0.05 0.06 0.00 -1.71 0.00 0.00 55.69 54.89 3lme s MET 60 Cb -0.38 -3.16 -0.03 0.00 2.01 0.00 0.00 34.83 33.26 3lme s MET 60 CO 0.38 0.73 0.17 -1.01 -0.01 0.00 0.00 175.02 175.28 3lme s HIS 61 N -1.12 2.29 -1.01 -0.03 3.76 -1.26 -1.56 115.29 116.36 3lme s HIS 61 Ca 0.20 -0.71 -0.06 0.00 -0.15 0.00 0.00 55.06 54.34 3lme s HIS 61 Cb -0.13 -1.87 -0.00 0.00 1.11 0.00 0.00 32.58 31.69 3lme s HIS 61 CO 0.09 0.11 2.80 0.41 -0.85 0.00 0.00 174.74 177.30 3lme n GLY 62 N -1.30 4.46 3.96 -2.22 0.00 -1.26 -3.66 105.19 105.17 3lme n GLY 62 Ca -0.05 -1.76 -0.23 0.00 0.00 0.00 0.00 46.02 43.98 3lme n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3lme s THR 63 N -0.27 5.26 -0.01 2.61 -4.23 -1.26 -2.10 115.64 115.64 3lme s THR 63 Ca 0.61 -0.81 -0.30 0.00 -1.18 0.00 0.00 61.69 60.01 3lme s THR 63 Cb 0.25 -3.82 -0.03 0.00 1.34 0.00 0.00 72.50 70.24 3lme s THR 63 CO -0.10 -0.28 1.02 -0.62 -0.54 0.00 0.00 174.62 174.10 3lme s ASP 64 N -3.72 7.31 0.60 3.99 -1.08 0.34 -4.87 116.67 119.23 3lme s ASP 64 Ca 0.35 1.69 0.29 0.00 -0.52 0.00 0.00 52.55 54.36 3lme s ASP 64 Cb -0.10 -2.57 1.53 0.00 -1.46 0.00 0.00 42.92 40.32 3lme s ASP 64 CO 0.30 -0.32 1.93 0.08 0.52 0.00 0.00 175.17 177.68 3lme h ARG 65 N 6.86 0.00 0.00 4.34 0.11 -1.91 0.11 114.38 123.88 3lme h ARG 65 Ca -0.40 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 59.53 3lme h ARG 65 Cb 1.21 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.26 3lme h ARG 65 CO 0.78 0.00 -1.17 0.28 0.10 0.00 0.00 179.97 179.96 3lme n VAL 66 N -3.60 1.49 0.09 0.08 0.31 -1.26 -4.36 118.33 111.07 3lme n VAL 66 Ca 0.06 0.02 -0.20 0.00 -0.01 0.00 0.00 64.34 64.21 3lme n VAL 66 Cb 0.57 -2.18 -0.12 0.00 -0.91 0.00 0.00 33.84 31.20 3lme n VAL 66 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 3lme h THR 67 N -1.00 1.32 0.00 2.52 1.35 -1.97 -3.48 112.91 111.65 3lme h THR 67 Ca -0.24 -2.50 0.00 0.00 -0.55 0.00 0.00 66.41 63.12 3lme h THR 67 Cb 1.04 2.65 0.00 0.00 -1.73 0.00 0.00 68.15 70.11 3lme h THR 67 CO -0.14 0.76 0.00 0.61 -0.25 0.00 0.00 175.52 176.49 3lme n GLY 68 N 1.30 0.72 3.87 5.82 0.00 0.36 -5.01 105.19 112.24 3lme n GLY 68 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 3lme n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3lme s LYS 69 N -0.41 3.86 -0.19 1.61 -0.14 -1.26 -4.65 119.74 118.55 3lme s LYS 69 Ca 0.00 0.42 -0.29 0.00 -1.36 0.00 0.00 55.97 54.74 3lme s LYS 69 Cb 0.00 -2.54 -0.01 0.00 -1.68 0.00 0.00 37.83 33.59 3lme s LYS 69 CO 0.00 0.22 1.30 -1.64 -0.76 0.00 0.00 175.35 174.47 3lme s MET 70 N -3.01 4.14 0.60 1.68 -1.94 -1.26 -0.51 119.30 119.00 3lme s MET 70 Ca 0.50 1.59 -0.18 0.00 -1.71 0.00 0.00 55.69 55.89 3lme s MET 70 Cb -0.11 -3.81 -0.06 0.00 2.01 0.00 0.00 34.83 32.86 3lme s MET 70 CO 0.21 -0.83 0.70 0.28 -0.01 0.00 0.00 175.02 175.37 3lme n VAL 71 N 5.61 2.84 -2.70 -6.03 0.31 -0.89 -4.95 118.33 112.51 3lme n VAL 71 Ca 0.14 -0.49 -0.39 0.00 -0.01 0.00 0.00 64.34 63.59 3lme n VAL 71 Cb 0.45 -0.87 -0.06 0.00 -0.91 0.00 0.00 33.84 32.45 3lme n VAL 71 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 3lme s ASP 72 N -1.25 7.48 0.01 4.52 1.11 -1.26 -4.64 116.67 122.64 3lme s ASP 72 Ca 0.72 1.98 0.00 0.00 0.18 0.00 0.00 52.55 55.43 3lme s ASP 72 Cb -0.42 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 40.96 3lme s ASP 72 CO 0.51 0.04 0.00 0.61 1.18 0.00 0.00 175.17 177.51 3lme n GLY 73 N 1.20 -3.38 0.01 0.21 0.00 -1.26 -4.47 105.19 97.50 3lme n GLY 73 Ca -0.01 -0.94 -0.00 0.00 0.00 0.00 0.00 46.02 45.07 3lme n GLY 73 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3lme n ASP 74 N -0.43 -0.03 0.13 1.61 8.00 -1.26 -1.61 116.55 122.96 3lme n ASP 74 Ca 0.00 0.16 -0.01 0.00 0.71 0.00 0.00 54.79 55.64 3lme n ASP 74 Cb 0.00 -0.06 0.21 0.00 -0.02 0.00 0.00 41.12 41.25 3lme n ASP 74 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 3lme h GLU 75 N 0.00 0.10 -0.18 -1.24 4.81 -1.97 -2.03 114.58 114.07 3lme h GLU 75 Ca 0.00 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.12 3lme h GLU 75 Cb 0.01 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 3lme h GLU 75 CO -0.02 0.60 -0.11 0.00 -0.73 0.00 0.00 179.01 178.75 3lme h ALA 76 N 1.39 0.26 -0.09 2.92 0.00 -1.52 -2.49 119.26 119.72 3lme h ALA 76 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3lme h ALA 76 Cb 0.95 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 3lme h ALA 76 CO 0.07 0.10 0.06 -0.09 0.00 0.00 0.00 179.25 179.39 3lme h ARG 77 N 0.07 0.12 -0.33 0.00 2.43 -0.98 0.32 114.38 116.01 3lme h ARG 77 Ca 0.04 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.15 3lme h ARG 77 Cb 0.60 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 3lme h ARG 77 CO 0.03 0.10 -0.00 0.82 -1.51 0.00 0.00 179.97 179.41 3lme h ILE 78 N 0.11 1.19 -0.32 1.20 5.03 -1.45 0.25 117.51 123.52 3lme h ILE 78 Ca 0.03 -0.76 -0.12 0.00 -0.12 0.00 0.00 64.86 63.89 3lme h ILE 78 Cb 0.01 0.95 -0.01 0.00 -3.03 0.00 0.00 36.82 34.74 3lme h ILE 78 CO -0.01 0.26 -0.31 -0.09 -0.68 0.00 0.00 178.15 177.32 3lme h ARG 79 N 0.48 0.67 0.18 2.37 9.65 -0.94 -2.57 114.38 124.23 3lme h ARG 79 Ca 0.11 -0.30 -0.01 0.00 -1.10 0.00 0.00 59.98 58.67 3lme h ARG 79 Cb 0.32 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.89 3lme h ARG 79 CO 0.01 0.90 -0.08 -0.09 2.80 0.00 0.00 179.97 183.51 3lme h ARG 80 N 0.57 -0.23 -0.82 0.20 9.65 0.76 1.00 114.38 125.51 3lme h ARG 80 Ca 0.07 0.02 0.10 0.00 -1.10 0.00 0.00 59.98 59.06 3lme h ARG 80 Cb 0.82 0.05 -0.12 0.00 -1.39 0.00 0.00 29.97 29.33 3lme h ARG 80 CO 0.07 0.11 -0.40 -0.12 2.80 0.00 0.00 179.97 182.43 3lme n MET 81 N -5.03 -0.28 -0.09 0.20 1.56 0.77 0.11 117.12 114.36 3lme n MET 81 Ca -0.09 1.25 -0.05 0.00 -0.27 0.00 0.00 57.70 58.54 3lme n MET 81 Cb 0.24 -1.85 0.15 0.00 2.15 0.00 0.00 33.22 33.91 3lme n MET 81 CO 0.00 0.00 0.00 0.74 -0.73 0.00 0.00 175.97 175.98 3lme h PHE 82 N 0.00 0.81 -0.45 1.12 0.04 -1.20 -1.87 116.94 115.39 3lme h PHE 82 Ca 0.21 -0.13 -0.03 0.00 2.80 0.00 0.00 57.97 60.82 3lme h PHE 82 Cb 0.41 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 38.33 3lme h PHE 82 CO -0.78 0.80 0.18 -0.44 -0.60 0.00 0.00 178.31 177.47 3lme h ASP 83 N 0.68 0.62 0.02 2.17 3.32 0.19 0.22 116.42 123.64 3lme h ASP 83 Ca 0.12 -0.16 0.02 0.00 0.02 0.00 0.00 57.03 57.03 3lme h ASP 83 Cb 0.54 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 3lme h ASP 83 CO 0.03 0.61 -0.13 0.78 -1.72 0.00 0.00 179.24 178.82 3lme h ASN 84 N 0.59 -0.36 -0.13 6.45 -0.26 -0.13 0.67 115.58 122.41 3lme h ASN 84 Ca 0.15 0.05 0.04 0.00 -0.56 0.00 0.00 56.30 55.98 3lme h ASN 84 Cb 0.19 0.15 -0.04 0.00 -1.06 0.00 0.00 38.32 37.55 3lme h ASN 84 CO -0.01 -0.18 -0.12 -0.03 -1.06 0.00 0.00 177.43 176.02 3lme h MET 85 N -0.22 -0.14 -0.32 0.81 4.05 -1.09 -2.07 114.93 115.94 3lme h MET 85 Ca 0.04 0.01 -0.10 0.00 -0.28 0.00 0.00 59.70 59.37 3lme h MET 85 Cb 0.27 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.09 3lme h MET 85 CO -0.11 -0.10 -0.23 -0.07 0.23 0.00 0.00 176.91 176.63 3lme h LEU 86 N -0.15 0.63 -0.49 3.39 3.38 -0.73 0.21 115.31 121.55 3lme h LEU 86 Ca 0.09 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.86 3lme h LEU 86 Cb 0.28 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 3lme h LEU 86 CO -0.22 0.85 0.30 0.00 0.09 0.00 0.00 178.44 179.46 3lme h ALA 87 N 1.20 0.63 -0.44 1.53 0.00 -0.60 0.33 119.26 121.91 3lme h ALA 87 Ca 0.08 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3lme h ALA 87 Cb 0.69 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 3lme h ALA 87 CO 0.05 0.00 0.21 0.00 0.00 0.00 0.00 179.25 179.51 3lme h ALA 88 N 1.21 0.57 -0.51 0.00 0.00 -0.74 -0.26 119.26 119.54 3lme h ALA 88 Ca 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3lme h ALA 88 Cb 0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3lme h ALA 88 CO -0.08 0.15 0.30 0.00 0.00 0.00 0.00 179.25 179.61 3lme h ALA 89 N 1.05 1.56 -0.46 0.00 0.00 -0.56 -2.58 119.26 118.27 3lme h ALA 89 Ca 0.15 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3lme h ALA 89 Cb 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3lme h ALA 89 CO -0.02 0.38 -0.22 1.49 0.00 0.00 0.00 179.25 180.88 3lme h GLU 90 N 0.71 0.96 0.00 0.00 4.22 0.33 0.28 114.58 121.06 3lme h GLU 90 Ca 0.18 -0.42 0.00 0.00 0.08 0.00 0.00 59.36 59.20 3lme h GLU 90 Cb -0.01 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3lme h GLU 90 CO -0.03 1.09 0.00 0.00 -2.18 0.00 0.00 179.01 177.88 3lme h ALA 91 N 0.85 1.00 -0.20 2.92 0.00 -0.65 -1.17 119.26 122.01 3lme h ALA 91 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3lme h ALA 91 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3lme h ALA 91 CO 0.07 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.32 3lme n ALA 92 N -1.89 2.31 -0.92 0.00 0.00 -0.90 -4.95 120.51 114.15 3lme n ALA 92 Ca -0.02 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.52 3lme n ALA 92 Cb 0.07 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.11 3lme n ALA 92 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3lme n GLY 93 N 0.56 1.18 3.24 0.00 0.00 -0.44 -5.03 105.19 104.69 3lme n GLY 93 Ca 0.09 -0.43 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 3lme n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lme s ALA 94 N -2.00 2.16 0.44 4.61 0.00 0.92 -4.87 121.76 123.02 3lme s ALA 94 Ca 0.00 -1.00 0.08 0.00 0.00 0.00 0.00 51.96 51.04 3lme s ALA 94 Cb 0.00 -0.76 0.02 0.00 0.00 0.00 0.00 23.12 22.38 3lme s ALA 94 CO 0.00 0.33 0.59 0.95 0.00 0.00 0.00 175.76 177.64 3lme s THR 95 N 0.16 2.93 0.59 0.00 -4.23 -1.26 -2.65 115.64 111.18 3lme s THR 95 Ca -0.14 -0.98 0.28 0.00 -1.18 0.00 0.00 61.69 59.68 3lme s THR 95 Cb -0.16 -2.95 0.36 0.00 1.34 0.00 0.00 72.50 71.09 3lme s THR 95 CO 0.07 0.00 2.10 0.07 -0.54 0.00 0.00 174.62 176.32 3lme h LYS 96 N 0.58 0.00 -0.13 3.99 2.10 -1.98 -1.30 116.57 119.83 3lme h LYS 96 Ca -0.39 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 3lme h LYS 96 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 3lme h LYS 96 CO 0.45 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.90 3lme n ALA 97 N -2.35 2.54 0.58 0.07 0.00 -1.26 -3.47 120.51 116.62 3lme n ALA 97 Ca 0.02 -0.42 0.11 0.00 0.00 0.00 0.00 53.44 53.14 3lme n ALA 97 Cb 0.32 -1.13 0.15 0.00 0.00 0.00 0.00 19.45 18.79 3lme n ALA 97 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3lme n ASP 98 N 0.06 3.09 -4.73 0.00 8.00 -0.49 -4.99 116.55 117.49 3lme n ASP 98 Ca 0.15 -1.94 -0.41 0.00 0.71 0.00 0.00 54.79 53.30 3lme n ASP 98 Cb 0.26 -0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.21 3lme n ASP 98 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3lme s ALA 99 N -1.61 3.46 -0.01 2.24 0.00 -1.23 -0.31 121.76 124.31 3lme s ALA 99 Ca 0.31 0.98 0.04 0.00 0.00 0.00 0.00 51.96 53.29 3lme s ALA 99 Cb 0.20 -3.44 -0.06 0.00 0.00 0.00 0.00 23.12 19.82 3lme s ALA 99 CO 0.28 -0.42 0.08 1.33 0.00 0.00 0.00 175.76 177.03 3lme n VAL 100 N 2.71 0.01 -3.67 0.00 0.24 0.35 -4.67 118.33 113.30 3lme n VAL 100 Ca 0.05 -0.09 -0.10 0.00 -2.04 0.00 0.00 64.34 62.16 3lme n VAL 100 Cb 0.44 0.34 -0.08 0.00 -1.47 0.00 0.00 33.84 33.07 3lme n VAL 100 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3lme s ARG 101 N -2.25 0.62 -0.16 7.34 3.52 -1.16 -4.33 118.95 122.54 3lme s ARG 101 Ca -0.01 0.96 0.01 0.00 -0.13 0.00 0.00 55.73 56.56 3lme s ARG 101 Cb 0.02 0.17 0.01 0.00 -1.56 0.00 0.00 34.95 33.60 3lme s ARG 101 CO 0.15 -0.13 -0.20 -0.51 -0.81 0.00 0.00 175.30 173.81 3lme s LEU 102 N 1.06 2.20 -0.33 -0.88 1.43 -0.60 -1.60 118.68 119.97 3lme s LEU 102 Ca -0.06 -0.59 -0.06 0.00 -1.03 0.00 0.00 54.13 52.39 3lme s LEU 102 Cb -0.06 -1.48 0.04 0.00 0.03 0.00 0.00 46.19 44.72 3lme s LEU 102 CO -0.10 0.06 0.09 -0.89 0.23 0.00 0.00 176.35 175.74 3lme s THR 103 N 0.97 3.72 -0.16 5.49 2.01 -0.43 -1.15 115.64 126.10 3lme s THR 103 Ca -0.03 -1.11 -0.08 0.00 0.31 0.00 0.00 61.69 60.78 3lme s THR 103 Cb -0.15 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 3lme s THR 103 CO -0.05 -0.14 0.11 -0.69 -0.69 0.00 0.00 174.62 173.16 3lme s VAL 104 N 1.40 5.24 -0.12 3.82 1.01 0.16 -1.82 120.40 130.09 3lme s VAL 104 Ca -0.02 0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.10 3lme s VAL 104 Cb -0.19 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 3lme s VAL 104 CO 0.02 0.52 -0.18 -0.36 0.00 0.00 0.00 175.10 175.11 3lme s PHE 105 N -0.25 2.70 0.17 5.22 0.08 -0.05 -1.80 117.98 124.05 3lme s PHE 105 Ca 0.10 -0.84 0.06 0.00 0.12 0.00 0.00 56.93 56.37 3lme s PHE 105 Cb -0.12 -1.79 -0.04 0.00 -0.57 0.00 0.00 43.02 40.50 3lme s PHE 105 CO 0.01 -0.32 -0.12 0.14 -0.10 0.00 0.00 175.22 174.83 3lme s VAL 106 N 0.38 1.40 0.05 -0.44 -7.23 -0.52 -1.07 120.40 112.96 3lme s VAL 106 Ca -0.14 -2.10 -0.17 0.00 -1.81 0.00 0.00 61.98 57.76 3lme s VAL 106 Cb -0.17 -1.91 -0.22 0.00 0.56 0.00 0.00 36.38 34.64 3lme s VAL 106 CO 0.07 -0.67 1.16 0.74 -0.31 0.00 0.00 175.10 176.09 3lme h THR 107 N 2.73 1.35 -3.16 5.32 2.02 -1.30 0.79 112.91 120.65 3lme h THR 107 Ca -0.37 -2.12 -0.49 0.00 0.77 0.00 0.00 66.41 64.20 3lme h THR 107 Cb 1.20 2.42 -0.40 0.00 -1.74 0.00 0.00 68.15 69.63 3lme h THR 107 CO 0.62 0.64 -0.76 -0.62 0.37 0.00 0.00 175.52 175.78 3lme s ASP 108 N -7.01 2.60 0.03 4.18 -1.08 -1.26 -4.52 116.67 109.61 3lme s ASP 108 Ca -0.11 -0.70 -0.24 0.00 -0.52 0.00 0.00 52.55 50.97 3lme s ASP 108 Cb 0.05 -0.41 -0.17 0.00 -1.46 0.00 0.00 42.92 40.93 3lme s ASP 108 CO 0.87 -0.33 1.50 1.62 0.52 0.00 0.00 175.17 179.35 3lme h VAL 109 N 6.47 1.21 -0.47 1.11 3.04 -1.92 -1.91 116.25 123.77 3lme h VAL 109 Ca -0.16 -0.61 0.09 0.00 -1.01 0.00 0.00 66.70 65.02 3lme h VAL 109 Cb 1.13 1.60 -0.09 0.00 -2.01 0.00 0.00 31.29 31.92 3lme h VAL 109 CO 0.31 0.16 -0.12 0.00 -1.01 0.00 0.00 177.57 176.91 3lme h ALA 110 N 0.75 0.30 -0.27 3.17 0.00 -2.00 0.56 119.26 121.77 3lme h ALA 110 Ca 0.00 0.18 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 3lme h ALA 110 Cb 0.26 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3lme h ALA 110 CO 0.00 -0.45 -0.21 -0.22 0.00 0.00 0.00 179.25 178.37 3lme h LYS 111 N -0.00 0.50 0.00 0.00 3.64 -2.00 -3.36 116.57 115.35 3lme h LYS 111 Ca 0.22 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3lme h LYS 111 Cb 0.35 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3lme h LYS 111 CO -0.48 0.69 -1.37 0.66 -2.27 0.00 0.00 179.45 176.68 3lme n TYR 112 N -4.15 0.00 -0.14 1.91 4.01 -0.72 -4.53 117.16 113.54 3lme n TYR 112 Ca -0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.70 3lme n TYR 112 Cb 0.38 -0.23 0.05 0.00 -0.31 0.00 0.00 39.34 39.23 3lme n TYR 112 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 3lme h ARG 113 N 0.00 0.27 -0.58 -0.72 2.43 -0.04 -1.50 114.38 114.24 3lme h ARG 113 Ca 0.00 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.23 3lme h ARG 113 Cb 0.52 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.95 3lme h ARG 113 CO 0.00 0.18 0.24 -1.35 -1.51 0.00 0.00 179.97 177.53 3lme h PRO 114 N 0.28 0.43 -0.22 0.20 0.11 -1.80 -1.29 132.00 129.71 3lme h PRO 114 Ca 0.22 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.31 3lme h PRO 114 Cb 0.24 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 3lme h PRO 114 CO -0.25 0.28 0.12 0.28 -0.21 0.00 0.00 178.00 178.22 3lme h VAL 115 N 0.44 1.01 -0.61 3.15 2.07 -1.60 0.55 116.25 121.26 3lme h VAL 115 Ca 0.28 -0.09 0.13 0.00 0.82 0.00 0.00 66.70 67.84 3lme h VAL 115 Cb 0.31 0.74 -0.10 0.00 -1.52 0.00 0.00 31.29 30.71 3lme h VAL 115 CO -0.26 0.05 -0.01 0.58 0.02 0.00 0.00 177.57 177.95 3lme h VAL 116 N 0.25 0.49 -0.25 2.57 2.07 -0.99 0.45 116.25 120.84 3lme h VAL 116 Ca 0.09 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.57 3lme h VAL 116 Cb 0.01 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 3lme h VAL 116 CO -0.05 0.02 0.16 0.78 0.02 0.00 0.00 177.57 178.50 3lme h ASN 117 N 0.11 0.28 -0.25 0.57 2.35 -0.00 0.24 115.58 118.89 3lme h ASN 117 Ca 0.32 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.06 3lme h ASN 117 Cb 0.51 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 3lme h ASN 117 CO -0.53 0.20 0.15 0.50 -1.65 0.00 0.00 177.43 176.11 3lme h LYS 118 N 0.33 0.34 -0.85 0.81 3.64 -0.33 -2.04 116.57 118.47 3lme h LYS 118 Ca 0.09 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.46 3lme h LYS 118 Cb -0.04 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 31.67 3lme h LYS 118 CO -0.02 0.26 0.56 0.28 -2.27 0.00 0.00 179.45 178.25 3lme h VAL 119 N 0.32 1.19 -0.03 2.00 2.07 0.38 -2.36 116.25 119.81 3lme h VAL 119 Ca 0.09 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 3lme h VAL 119 Cb 0.01 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.74 3lme h VAL 119 CO -0.02 0.20 -0.19 1.56 0.02 0.00 0.00 177.57 179.14 3lme h GLN 120 N 1.12 0.04 0.36 1.57 4.20 -0.45 -2.48 115.11 119.46 3lme h GLN 120 Ca 0.32 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 59.00 3lme h GLN 120 Cb -0.08 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.70 3lme h GLN 120 CO -0.08 0.24 -0.17 0.87 -0.67 0.00 0.00 178.83 179.01 3lme h LYS 121 N 0.04 -0.46 -0.69 1.46 1.57 -0.85 0.58 116.57 118.22 3lme h LYS 121 Ca 0.01 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 3lme h LYS 121 Cb 0.37 0.11 -0.10 0.00 0.08 0.00 0.00 32.23 32.69 3lme h LYS 121 CO 0.03 -0.21 -0.55 -0.44 -0.57 0.00 0.00 179.45 177.71 3lme h ASP 122 N -0.65 -1.94 -0.14 0.86 3.32 -1.32 0.10 116.42 116.64 3lme h ASP 122 Ca -0.05 0.28 -0.20 0.00 0.02 0.00 0.00 57.03 57.08 3lme h ASP 122 Cb 0.47 0.83 0.00 0.00 0.22 0.00 0.00 39.33 40.85 3lme h ASP 122 CO 0.08 -0.30 -0.67 0.40 -1.72 0.00 0.00 179.24 177.04 3lme h ILE 123 N -0.18 1.29 0.00 0.35 2.04 -1.33 -3.35 117.51 116.32 3lme h ILE 123 Ca 0.11 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 64.09 3lme h ILE 123 Cb 0.47 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 3lme h ILE 123 CO -0.74 0.60 -1.08 0.79 0.00 0.00 0.00 178.15 177.72 3lme n TRP 124 N -3.95 0.00 -4.10 1.37 8.01 0.20 -5.08 117.44 113.89 3lme n TRP 124 Ca -0.06 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.13 3lme n TRP 124 Cb 0.69 -0.12 0.00 0.00 -2.01 0.00 0.00 31.31 29.86 3lme n TRP 124 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3lme n GLY 125 N 1.44 0.23 0.53 6.99 0.00 0.34 -2.67 105.19 112.05 3lme n GLY 125 Ca 0.01 -0.96 0.06 0.00 0.00 0.00 0.00 46.02 45.13 3lme n GLY 125 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3lme n ASP 126 N 2.44 1.55 0.00 1.61 8.00 -1.26 -4.70 116.55 124.18 3lme n ASP 126 Ca 0.00 -1.94 0.00 0.00 0.71 0.00 0.00 54.79 53.56 3lme n ASP 126 Cb 0.00 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 40.92 3lme n ASP 126 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3lme n GLY 127 N 0.99 0.22 3.80 0.44 0.00 -1.09 -4.91 105.19 104.64 3lme n GLY 127 Ca 0.11 -2.30 -0.33 0.00 0.00 0.00 0.00 46.02 43.50 3lme n GLY 127 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3lme s PRO 128 N -0.64 3.43 0.18 1.61 0.04 -1.26 -5.07 135.00 133.28 3lme s PRO 128 Ca 0.00 1.25 0.04 0.00 0.04 0.00 0.00 61.00 62.33 3lme s PRO 128 Cb 0.00 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 3lme s PRO 128 CO 0.00 -0.73 0.22 0.71 0.04 0.00 0.00 177.00 177.24 3lme s TYR 129 N -2.33 3.29 0.49 0.56 2.02 -1.26 -4.99 117.35 115.11 3lme s TYR 129 Ca 0.65 0.01 -0.18 0.00 -0.37 0.00 0.00 57.07 57.18 3lme s TYR 129 Cb -0.16 -1.55 -0.09 0.00 -0.40 0.00 0.00 41.96 39.76 3lme s TYR 129 CO 0.33 0.51 0.97 -1.25 -1.57 0.00 0.00 175.55 174.54 3lme s PRO 130 N -3.34 4.03 0.38 -1.71 0.04 -1.26 -5.02 135.00 128.12 3lme s PRO 130 Ca 0.33 0.99 -0.28 0.00 0.04 0.00 0.00 61.00 62.08 3lme s PRO 130 Cb -0.10 -2.16 -0.11 0.00 0.04 0.00 0.00 34.50 32.17 3lme s PRO 130 CO 0.26 -0.19 1.44 -2.30 0.04 0.00 0.00 177.00 176.25 3lme n PRO 131 N -1.28 2.52 -4.05 0.56 -0.02 -1.26 -4.88 135.00 126.59 3lme n PRO 131 Ca 0.07 0.88 -0.10 0.00 -2.02 0.00 0.00 63.50 62.33 3lme n PRO 131 Cb 0.54 -2.60 -0.07 0.00 -0.02 0.00 0.00 33.50 31.36 3lme n PRO 131 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 3lme s ARG 132 N -2.10 1.44 -0.15 -0.52 1.70 -1.26 -1.56 118.95 116.51 3lme s ARG 132 Ca 0.54 -1.34 -0.11 0.00 -0.47 0.00 0.00 55.73 54.35 3lme s ARG 132 Cb -0.49 0.42 0.04 0.00 -0.57 0.00 0.00 34.95 34.35 3lme s ARG 132 CO 0.63 -0.57 0.37 -0.08 -1.08 0.00 0.00 175.30 174.57 3lme s THR 133 N -4.05 -0.01 -0.21 4.99 -1.32 -0.30 -4.95 115.64 109.79 3lme s THR 133 Ca 0.26 0.05 0.00 0.00 -1.21 0.00 0.00 61.69 60.79 3lme s THR 133 Cb 0.01 -0.54 0.05 0.00 -1.51 0.00 0.00 72.50 70.52 3lme s THR 133 CO 0.09 0.02 -0.06 -0.69 -2.21 0.00 0.00 174.62 171.78 3lme s VAL 134 N 0.71 1.36 0.08 5.08 1.01 -1.26 -0.66 120.40 126.71 3lme s VAL 134 Ca -0.04 -0.98 0.09 0.00 0.00 0.00 0.00 61.98 61.05 3lme s VAL 134 Cb -0.05 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 3lme s VAL 134 CO -0.05 -0.00 -0.24 -0.76 0.00 0.00 0.00 175.10 174.05 3lme s LEU 135 N 1.49 2.23 0.18 3.92 1.43 -0.75 -5.01 118.68 122.18 3lme s LEU 135 Ca -0.03 -0.63 -0.18 0.00 -1.03 0.00 0.00 54.13 52.26 3lme s LEU 135 Cb -0.17 -1.14 -0.08 0.00 0.03 0.00 0.00 46.19 44.83 3lme s LEU 135 CO -0.07 0.19 0.66 -1.58 0.23 0.00 0.00 176.35 175.77 3lme s GLN 136 N -1.54 4.18 -0.04 1.70 0.74 -1.26 -1.44 119.66 121.99 3lme s GLN 136 Ca 0.11 0.75 -0.09 0.00 0.05 0.00 0.00 55.36 56.18 3lme s GLN 136 Cb -0.10 -2.95 0.01 0.00 1.10 0.00 0.00 33.01 31.08 3lme s GLN 136 CO 0.03 0.45 0.20 0.54 -0.55 0.00 0.00 175.29 175.97 3lme s VAL 137 N -1.45 0.04 0.10 1.34 0.11 0.27 -4.88 120.40 115.93 3lme s VAL 137 Ca 0.40 -0.32 0.20 0.00 -2.93 0.00 0.00 61.98 59.32 3lme s VAL 137 Cb -0.17 -0.40 0.15 0.00 -1.53 0.00 0.00 36.38 34.43 3lme s VAL 137 CO 0.20 -0.18 1.71 1.55 -3.33 0.00 0.00 175.10 175.06 3lme h PRO 138 N 4.96 0.00 -2.34 1.54 0.13 -1.87 -3.38 132.00 131.05 3lme h PRO 138 Ca -0.28 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.80 3lme h PRO 138 Cb 1.19 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.15 3lme h PRO 138 CO 0.39 0.35 0.20 0.00 -0.23 0.00 0.00 178.00 178.70 3lme s ALA 139 N -3.52 -1.71 0.29 -0.56 0.00 -1.26 -4.99 121.76 110.02 3lme s ALA 139 Ca 0.01 1.04 0.02 0.00 0.00 0.00 0.00 51.96 53.02 3lme s ALA 139 Cb 0.10 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.51 3lme s ALA 139 CO 0.68 -0.50 0.05 1.28 0.00 0.00 0.00 175.76 177.27 3lme n LEU 140 N 0.48 0.00 -4.69 0.00 4.77 -1.26 -5.07 117.00 111.23 3lme n LEU 140 Ca -0.18 -2.05 -0.42 0.00 -0.03 0.00 0.00 56.01 53.33 3lme n LEU 140 Cb 0.60 0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 42.14 3lme n LEU 140 CO 0.20 -0.31 1.43 -0.62 -1.33 0.00 0.00 177.39 176.76 3lme s ASP 141 N -2.71 6.51 -1.74 -1.43 2.15 -1.26 -2.85 116.67 115.34 3lme s ASP 141 Ca 0.08 2.61 0.00 0.00 0.43 0.00 0.00 52.55 55.67 3lme s ASP 141 Cb 0.00 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.06 3lme s ASP 141 CO 0.05 -0.96 0.00 0.00 -0.17 0.00 0.00 175.17 174.09 3lme n GLN 142 N 5.95 -1.54 -1.12 4.34 10.64 -1.26 -3.11 117.38 131.27 3lme n GLN 142 Ca 0.17 0.99 -0.04 0.00 -1.83 0.00 0.00 57.00 56.29 3lme n GLN 142 Cb 0.40 -5.55 -0.02 0.00 -0.86 0.00 0.00 30.24 24.21 3lme n GLN 142 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3lme n GLY 143 N -0.95 0.69 3.30 2.61 0.00 -1.13 -5.02 105.19 104.69 3lme n GLY 143 Ca -0.23 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.05 3lme n GLY 143 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3lme n ASP 144 N 0.41 -3.19 -0.00 1.61 -0.08 -1.18 -4.93 116.55 109.18 3lme n ASP 144 Ca -0.04 -0.57 0.03 0.00 -1.51 0.00 0.00 54.79 52.70 3lme n ASP 144 Cb 0.20 -1.08 -0.03 0.00 2.34 0.00 0.00 41.12 42.54 3lme n ASP 144 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 3lme n ILE 145 N -5.43 0.00 -3.68 5.18 -5.35 -1.26 -4.45 119.36 104.37 3lme n ILE 145 Ca 0.08 -0.32 -0.14 0.00 -0.27 0.00 0.00 62.75 62.10 3lme n ILE 145 Cb 0.57 0.88 -0.08 0.00 -1.74 0.00 0.00 39.64 39.26 3lme n ILE 145 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3lme s ALA 146 N -1.70 -1.32 0.06 -1.28 0.00 -1.26 -1.13 121.76 115.13 3lme s ALA 146 Ca 0.01 1.33 0.02 0.00 0.00 0.00 0.00 51.96 53.33 3lme s ALA 146 Cb 0.04 -0.64 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 3lme s ALA 146 CO 0.24 -0.27 -0.08 -2.00 0.00 0.00 0.00 175.76 173.64 3lme s GLU 147 N -0.12 0.64 -0.01 0.00 2.12 -0.23 -4.48 118.70 116.61 3lme s GLU 147 Ca -0.03 -0.92 0.01 0.00 0.36 0.00 0.00 54.97 54.39 3lme s GLU 147 Cb -0.03 -0.33 0.00 0.00 0.26 0.00 0.00 34.13 34.03 3lme s GLU 147 CO 0.02 0.05 -0.03 -1.50 -0.54 0.00 0.00 175.26 173.26 3lme s ILE 148 N -1.91 0.27 -0.19 -3.70 2.07 -0.60 -0.87 121.20 116.27 3lme s ILE 148 Ca -0.04 -0.12 -0.05 0.00 -1.41 0.00 0.00 60.65 59.03 3lme s ILE 148 Cb -0.06 -0.25 -0.03 0.00 0.13 0.00 0.00 42.46 42.25 3lme s ILE 148 CO -0.01 0.09 -0.01 -1.81 -1.91 0.00 0.00 174.94 171.30 3lme s ASP 149 N 0.07 4.86 0.06 4.50 1.01 -0.75 -1.70 116.67 124.71 3lme s ASP 149 Ca -0.00 -0.17 0.08 0.00 0.71 0.00 0.00 52.55 53.17 3lme s ASP 149 Cb -0.03 -1.82 -0.03 0.00 1.01 0.00 0.00 42.92 42.05 3lme s ASP 149 CO -0.00 0.10 -0.18 -0.83 0.21 0.00 0.00 175.17 174.46 3lme s GLY 150 N 0.79 1.59 -0.04 0.21 0.00 -1.25 -1.31 107.32 107.31 3lme s GLY 150 Ca 0.00 -1.23 0.03 0.00 0.00 0.00 0.00 44.72 43.51 3lme s GLY 150 CO 0.02 -1.14 -0.10 -1.59 0.00 0.00 0.00 173.10 170.29 3lme s THR 151 N -0.97 0.89 0.06 0.90 2.01 -0.63 -1.69 115.64 116.22 3lme s THR 151 Ca 0.15 -0.40 0.05 0.00 0.31 0.00 0.00 61.69 61.80 3lme s THR 151 Cb -0.10 -0.80 -0.03 0.00 0.01 0.00 0.00 72.50 71.58 3lme s THR 151 CO 0.06 0.28 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.77 3lme s PHE 152 N 0.31 1.26 -0.28 4.92 0.40 0.69 -0.50 117.98 124.78 3lme s PHE 152 Ca -0.06 -0.42 0.00 0.00 -0.60 0.00 0.00 56.93 55.86 3lme s PHE 152 Cb -0.11 -0.72 0.05 0.00 0.51 0.00 0.00 43.02 42.76 3lme s PHE 152 CO 0.01 0.06 -0.06 -0.47 0.70 0.00 0.00 175.22 175.46 3lme s TYR 153 N -1.10 3.25 -0.42 0.36 5.04 0.57 -0.37 117.35 124.69 3lme s TYR 153 Ca -0.00 -2.06 0.05 0.00 -2.44 0.00 0.00 57.07 52.62 3lme s TYR 153 Cb -0.09 -2.02 0.19 0.00 0.35 0.00 0.00 41.96 40.39 3lme s TYR 153 CO 0.02 -0.83 0.40 0.00 -1.34 0.00 0.00 175.55 173.80 3lme n ALA 154 N 4.54 2.76 1.15 3.97 0.00 -0.70 -4.70 120.51 127.53 3lme n ALA 154 Ca -0.14 -3.25 0.09 0.00 0.00 0.00 0.00 53.44 50.14 3lme n ALA 154 Cb 0.43 -0.78 0.55 0.00 0.00 0.00 0.00 19.45 19.65 3lme n ALA 154 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15