#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b8t n GLY 12 N 0.00 0.63 3.79 4.50 0.00 -1.26 -4.38 105.19 108.48 2b8t n GLY 12 Ca 0.00 -1.11 -0.04 0.00 0.00 0.00 0.00 46.02 44.87 2b8t n GLY 12 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2b8t s TRP 13 N 0.00 -0.13 -0.11 1.61 -2.14 -0.92 -4.78 118.94 112.46 2b8t s TRP 13 Ca 0.00 -0.23 0.03 0.00 2.66 0.00 0.00 56.10 58.57 2b8t s TRP 13 Cb 0.00 0.67 0.00 0.00 -3.10 0.00 0.00 33.47 31.04 2b8t s TRP 13 CO 0.00 -0.96 -0.23 0.42 -2.66 0.00 0.00 176.95 173.52 2b8t s ILE 14 N -3.40 2.04 -0.10 0.66 1.01 -1.26 -0.99 121.20 119.16 2b8t s ILE 14 Ca 0.12 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.77 2b8t s ILE 14 Cb -0.03 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.64 2b8t s ILE 14 CO 0.04 0.55 -0.05 -1.61 0.00 0.00 0.00 174.94 173.87 2b8t s GLU 15 N 0.50 3.08 -0.10 2.79 2.02 0.24 -0.80 118.70 126.43 2b8t s GLU 15 Ca -0.15 -0.52 0.03 0.00 0.02 0.00 0.00 54.97 54.35 2b8t s GLU 15 Cb -0.17 -2.71 0.01 0.00 0.10 0.00 0.00 34.13 31.35 2b8t s GLU 15 CO 0.05 0.53 -0.20 0.12 0.02 0.00 0.00 175.26 175.79 2b8t s PHE 16 N -0.44 2.28 -0.20 1.61 5.36 0.40 -0.63 117.98 126.36 2b8t s PHE 16 Ca 0.07 -1.00 -0.02 0.00 -0.96 0.00 0.00 56.93 55.02 2b8t s PHE 16 Cb -0.12 -1.57 0.00 0.00 -0.34 0.00 0.00 43.02 40.99 2b8t s PHE 16 CO 0.02 -0.45 -0.11 0.42 -1.46 0.00 0.00 175.22 173.65 2b8t s ILE 17 N 0.63 2.88 0.23 3.12 1.01 0.97 -0.71 121.20 129.32 2b8t s ILE 17 Ca -0.13 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 59.89 2b8t s ILE 17 Cb -0.16 -2.27 -0.01 0.00 0.01 0.00 0.00 42.46 40.02 2b8t s ILE 17 CO 0.04 0.47 0.23 1.07 0.00 0.00 0.00 174.94 176.75 2b8t n THR 18 N 4.62 0.00 0.00 2.92 5.66 0.39 -2.18 114.28 125.70 2b8t n THR 18 Ca -0.19 -1.52 0.00 0.00 -3.05 0.00 0.00 64.05 59.29 2b8t n THR 18 Cb 0.51 0.80 0.00 0.00 -1.55 0.00 0.00 70.33 70.09 2b8t n THR 18 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2b8t n GLY 19 N -0.42 1.27 3.68 1.09 0.00 -1.26 -0.15 105.19 109.40 2b8t n GLY 19 Ca 0.04 -2.12 -0.29 0.00 0.00 0.00 0.00 46.02 43.65 2b8t n GLY 19 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2b8t n PRO 20 N -1.47 -2.14 -1.52 1.61 -0.04 -1.26 -3.61 135.00 126.57 2b8t n PRO 20 Ca 0.00 -1.91 -0.33 0.00 -0.04 0.00 0.00 63.50 61.22 2b8t n PRO 20 Cb 0.00 -1.49 0.08 0.00 -0.04 0.00 0.00 33.50 32.05 2b8t n PRO 20 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2b8t s MET 21 N -5.70 2.38 -1.18 0.54 -1.94 -1.26 -3.48 119.30 108.65 2b8t s MET 21 Ca 0.73 1.54 0.00 0.00 -1.71 0.00 0.00 55.69 56.25 2b8t s MET 21 Cb -0.04 -1.88 0.00 0.00 2.01 0.00 0.00 34.83 34.91 2b8t s MET 21 CO 0.53 -1.61 0.00 1.19 -0.01 0.00 0.00 175.02 175.13 2b8t n PHE 22 N -2.73 0.00 1.01 -0.03 3.01 -1.26 -4.57 117.46 112.90 2b8t n PHE 22 Ca 0.12 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.69 2b8t n PHE 22 Cb 0.51 -2.20 0.05 0.00 -0.01 0.00 0.00 39.48 37.84 2b8t n PHE 22 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2b8t n ALA 23 N 1.21 4.16 -1.53 4.37 0.00 -1.23 -4.60 120.51 122.89 2b8t n ALA 23 Ca -0.11 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.84 2b8t n ALA 23 Cb 0.41 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.93 2b8t n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b8t n GLY 24 N 1.49 0.72 0.21 0.00 0.00 -1.26 -4.68 105.19 101.66 2b8t n GLY 24 Ca 0.05 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.26 2b8t n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b8t h LYS 25 N 0.00 -0.26 -0.64 1.61 1.57 -1.92 -1.19 116.57 115.75 2b8t h LYS 25 Ca 0.00 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2b8t h LYS 25 Cb 0.75 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.09 2b8t h LYS 25 CO 0.00 -0.17 0.36 1.15 -0.57 0.00 0.00 179.45 180.22 2b8t h THR 26 N -0.27 1.20 -0.75 -0.16 2.02 -1.97 0.21 112.91 113.20 2b8t h THR 26 Ca 0.06 -0.49 0.12 0.00 0.77 0.00 0.00 66.41 66.86 2b8t h THR 26 Cb 0.34 0.36 -0.08 0.00 -1.74 0.00 0.00 68.15 67.03 2b8t h THR 26 CO -0.16 0.22 0.35 0.00 0.37 0.00 0.00 175.52 176.30 2b8t h ALA 27 N 1.17 1.06 -0.46 6.16 0.00 -1.91 0.15 119.26 125.44 2b8t h ALA 27 Ca 0.23 0.08 -0.13 0.00 0.00 0.00 0.00 54.91 55.09 2b8t h ALA 27 Cb 0.03 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2b8t h ALA 27 CO -0.04 -0.11 -0.23 1.49 0.00 0.00 0.00 179.25 180.36 2b8t h GLU 28 N 0.55 0.97 0.08 0.00 4.57 -0.28 0.11 114.58 120.58 2b8t h GLU 28 Ca 0.39 -0.42 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2b8t h GLU 28 Cb 0.51 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.07 2b8t h GLU 28 CO -0.33 1.09 -0.09 1.25 -1.18 0.00 0.00 179.01 179.75 2b8t h LEU 29 N 0.81 -0.23 -0.45 1.64 5.85 -0.48 -0.34 115.31 122.12 2b8t h LEU 29 Ca 0.10 0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.93 2b8t h LEU 29 Cb 0.81 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.84 2b8t h LEU 29 CO 0.07 -0.13 -0.07 0.40 -0.34 0.00 0.00 178.44 178.36 2b8t h ILE 30 N -0.19 0.59 -0.26 4.05 2.04 -0.63 -1.20 117.51 121.90 2b8t h ILE 30 Ca 0.01 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 65.87 2b8t h ILE 30 Cb 0.19 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 2b8t h ILE 30 CO -0.03 0.01 0.13 -0.09 0.00 0.00 0.00 178.15 178.17 2b8t h ARG 31 N 0.04 0.27 -0.42 2.37 2.43 -0.50 0.12 114.38 118.68 2b8t h ARG 31 Ca 0.22 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 2b8t h ARG 31 Cb 0.33 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 2b8t h ARG 31 CO -0.43 0.18 0.21 0.00 -1.51 0.00 0.00 179.97 178.42 2b8t h ARG 32 N 0.27 0.61 -0.21 0.20 3.08 -0.70 -3.02 114.38 114.61 2b8t h ARG 32 Ca 0.11 -0.09 -0.15 0.00 0.07 0.00 0.00 59.98 59.92 2b8t h ARG 32 Cb 0.03 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2b8t h ARG 32 CO -0.07 0.52 -0.50 -0.07 -1.07 0.00 0.00 179.97 178.77 2b8t h LEU 33 N 0.55 0.64 -1.46 3.04 3.38 -1.10 -3.26 115.31 117.09 2b8t h LEU 33 Ca 0.15 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2b8t h LEU 33 Cb 0.10 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2b8t h LEU 33 CO -0.02 1.03 0.19 -0.74 0.09 0.00 0.00 178.44 178.99 2b8t h HIS 34 N 0.46 0.54 -0.82 1.13 2.76 -0.63 -2.37 115.15 116.21 2b8t h HIS 34 Ca 0.02 -0.01 0.19 0.00 -2.20 0.00 0.00 60.37 58.37 2b8t h HIS 34 Cb 1.04 -0.17 -0.05 0.00 1.55 0.00 0.00 27.41 29.77 2b8t h HIS 34 CO 0.04 0.40 0.55 0.00 -1.30 0.00 0.00 177.93 177.63 2b8t h ARG 35 N 0.55 0.31 -0.23 5.26 3.08 -1.58 -2.01 114.38 119.76 2b8t h ARG 35 Ca 0.14 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 2b8t h ARG 35 Cb 0.07 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2b8t h ARG 35 CO -0.02 0.20 0.10 -0.07 -1.07 0.00 0.00 179.97 179.12 2b8t h LEU 36 N 0.31 0.28 -1.95 3.04 3.38 -1.61 -3.05 115.31 115.71 2b8t h LEU 36 Ca 0.41 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.34 2b8t h LEU 36 Cb 1.12 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 2b8t h LEU 36 CO -0.12 0.25 -0.11 -0.33 0.09 0.00 0.00 178.44 178.22 2b8t h GLU 37 N 0.32 0.00 0.00 1.13 5.08 -1.51 -1.57 114.58 118.03 2b8t h GLU 37 Ca 0.08 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2b8t h GLU 37 Cb 0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2b8t h GLU 37 CO -0.01 0.11 -0.09 1.88 -1.00 0.00 0.00 179.01 179.91 2b8t h TYR 38 N 0.00 0.00 -0.52 4.33 0.05 -1.70 -3.14 116.97 116.00 2b8t h TYR 38 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2b8t h TYR 38 Cb 0.29 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.03 2b8t h TYR 38 CO 0.00 0.08 0.00 0.00 -1.05 0.00 0.00 178.16 177.19 2b8t n ALA 39 N -2.12 2.34 -3.46 3.88 0.00 -0.71 -4.97 120.51 115.47 2b8t n ALA 39 Ca 0.04 -1.15 -0.25 0.00 0.00 0.00 0.00 53.44 52.08 2b8t n ALA 39 Cb 0.56 -0.75 0.05 0.00 0.00 0.00 0.00 19.45 19.31 2b8t n ALA 39 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2b8t n ASP 40 N 1.27 -5.92 -4.46 0.00 8.00 -0.96 -4.98 116.55 109.49 2b8t n ASP 40 Ca 0.19 -0.49 -0.38 0.00 0.71 0.00 0.00 54.79 54.82 2b8t n ASP 40 Cb 0.55 -4.72 -0.12 0.00 -0.02 0.00 0.00 41.12 36.82 2b8t n ASP 40 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2b8t s VAL 41 N -3.25 4.64 0.30 2.53 1.01 -0.67 -5.03 120.40 119.92 2b8t s VAL 41 Ca 0.50 -0.30 -0.28 0.00 0.00 0.00 0.00 61.98 61.91 2b8t s VAL 41 Cb -0.23 -3.31 -0.09 0.00 0.00 0.00 0.00 36.38 32.75 2b8t s VAL 41 CO 0.62 0.14 1.01 -0.54 0.00 0.00 0.00 175.10 176.34 2b8t s LYS 42 N 1.63 4.59 0.07 2.72 -0.14 -1.26 -4.32 119.74 123.04 2b8t s LYS 42 Ca 0.05 1.55 0.01 0.00 -1.36 0.00 0.00 55.97 56.23 2b8t s LYS 42 Cb -0.17 -3.00 -0.04 0.00 -1.68 0.00 0.00 37.83 32.95 2b8t s LYS 42 CO 0.06 0.24 -0.06 1.52 -0.76 0.00 0.00 175.35 176.35 2b8t s TYR 43 N -1.37 0.75 -0.04 3.18 -0.85 -1.26 -3.60 117.35 114.16 2b8t s TYR 43 Ca 0.47 -0.80 0.01 0.00 -0.52 0.00 0.00 57.07 56.24 2b8t s TYR 43 Cb -0.25 -0.45 0.02 0.00 0.38 0.00 0.00 41.96 41.66 2b8t s TYR 43 CO 0.32 -0.16 -0.04 -1.17 -1.52 0.00 0.00 175.55 172.98 2b8t s LEU 44 N -2.54 1.38 -0.12 -3.49 2.96 -0.51 -5.01 118.68 111.35 2b8t s LEU 44 Ca 0.04 -0.11 -0.06 0.00 -0.22 0.00 0.00 54.13 53.78 2b8t s LEU 44 Cb 0.01 -0.39 -0.04 0.00 0.50 0.00 0.00 46.19 46.26 2b8t s LEU 44 CO -0.04 -0.05 0.10 -0.69 -1.32 0.00 0.00 176.35 174.35 2b8t s VAL 45 N 0.81 5.14 0.17 1.68 1.01 -1.26 -0.38 120.40 127.58 2b8t s VAL 45 Ca -0.10 0.07 0.10 0.00 0.00 0.00 0.00 61.98 62.05 2b8t s VAL 45 Cb -0.13 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 2b8t s VAL 45 CO -0.00 0.60 -0.18 -0.36 0.00 0.00 0.00 175.10 175.16 2b8t s PHE 46 N -0.86 2.45 0.00 5.22 0.08 0.03 -0.78 117.98 124.12 2b8t s PHE 46 Ca 0.14 -0.30 -0.08 0.00 0.12 0.00 0.00 56.93 56.81 2b8t s PHE 46 Cb -0.12 -1.23 0.00 0.00 -0.57 0.00 0.00 43.02 41.11 2b8t s PHE 46 CO 0.03 0.48 0.15 -1.59 -0.10 0.00 0.00 175.22 174.19 2b8t s LYS 47 N -2.61 0.50 0.78 0.44 -2.85 -0.02 -2.14 119.74 113.84 2b8t s LYS 47 Ca 0.21 -0.39 -0.11 0.00 -1.00 0.00 0.00 55.97 54.69 2b8t s LYS 47 Cb -0.09 0.21 0.06 0.00 -2.06 0.00 0.00 37.83 35.95 2b8t s LYS 47 CO 0.11 -0.12 1.09 -1.25 0.10 0.00 0.00 175.35 175.28 2b8t s PRO 48 N -1.38 2.18 -0.32 1.78 0.04 -1.26 -1.30 135.00 134.73 2b8t s PRO 48 Ca -0.15 0.99 -0.29 0.00 0.04 0.00 0.00 61.00 61.60 2b8t s PRO 48 Cb -0.07 -1.90 -0.00 0.00 0.04 0.00 0.00 34.50 32.56 2b8t s PRO 48 CO 0.02 -1.65 1.40 0.21 0.04 0.00 0.00 177.00 177.03 2b8t s LYS 49 N -4.97 3.78 -0.13 4.56 2.20 -0.90 -4.71 119.74 119.57 2b8t s LYS 49 Ca 0.61 1.25 0.02 0.00 -0.36 0.00 0.00 55.97 57.48 2b8t s LYS 49 Cb -0.16 -3.96 0.01 0.00 -1.51 0.00 0.00 37.83 32.21 2b8t s LYS 49 CO 0.56 -1.29 -0.19 0.42 -0.36 0.00 0.00 175.35 174.48 2b8t s ILE 50 N 4.89 1.85 -0.37 5.43 1.01 -1.26 -5.07 121.20 127.67 2b8t s ILE 50 Ca 0.61 -0.84 -0.04 0.00 0.00 0.00 0.00 60.65 60.38 2b8t s ILE 50 Cb -0.18 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.60 2b8t s ILE 50 CO 0.27 0.51 1.47 -0.67 0.00 0.00 0.00 174.94 176.52 2b8t n ASP 51 N 4.22 1.99 0.00 3.58 -0.08 -1.26 -5.23 116.55 119.77 2b8t n ASP 51 Ca -0.20 -2.16 0.00 0.00 -1.51 0.00 0.00 54.79 50.92 2b8t n ASP 51 Cb 0.51 -0.74 0.00 0.00 2.34 0.00 0.00 41.12 43.23 2b8t n ASP 51 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2b8t n SER 60 N 4.94 0.00 -4.47 1.67 7.64 -1.26 -4.96 113.62 117.18 2b8t n SER 60 Ca 0.20 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.82 2b8t n SER 60 Cb 0.08 0.00 0.14 0.00 -1.01 0.00 0.00 64.21 63.42 2b8t n SER 60 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2b8t s ARG 61 N -2.00 1.29 0.58 1.43 1.81 -1.26 -5.05 118.95 115.75 2b8t s ARG 61 Ca 0.00 -0.80 -0.20 0.00 -1.72 0.00 0.00 55.73 53.01 2b8t s ARG 61 Cb 0.00 -2.13 -0.03 0.00 -0.45 0.00 0.00 34.95 32.33 2b8t s ARG 61 CO 0.00 -1.82 1.29 0.95 -0.68 0.00 0.00 175.30 175.03 2b8t s THR 62 N -3.44 2.27 0.00 0.02 -4.23 -1.26 -4.96 115.64 104.04 2b8t s THR 62 Ca 0.69 0.18 0.00 0.00 -1.18 0.00 0.00 61.69 61.38 2b8t s THR 62 Cb -0.05 -3.08 0.00 0.00 1.34 0.00 0.00 72.50 70.71 2b8t s THR 62 CO 0.48 -0.02 0.00 0.61 -0.54 0.00 0.00 174.62 175.15 2b8t n GLY 63 N 0.71 4.09 3.51 3.99 0.00 -1.26 -5.11 105.19 111.12 2b8t n GLY 63 Ca 0.13 -1.26 -0.35 0.00 0.00 0.00 0.00 46.02 44.55 2b8t n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b8t s THR 64 N -2.00 4.16 0.60 2.61 2.01 -1.26 -5.11 115.64 116.65 2b8t s THR 64 Ca 0.00 -0.25 -0.09 0.00 0.31 0.00 0.00 61.69 61.66 2b8t s THR 64 Cb 0.00 -2.87 -0.02 0.00 0.01 0.00 0.00 72.50 69.62 2b8t s THR 64 CO 0.00 0.45 0.98 -0.94 -0.69 0.00 0.00 174.62 174.41 2b8t s SER 65 N 0.72 6.00 -0.18 3.53 1.04 -1.26 -5.01 113.70 118.54 2b8t s SER 65 Ca 0.01 1.18 -0.29 0.00 0.48 0.00 0.00 55.95 57.32 2b8t s SER 65 Cb -0.14 -2.23 -0.01 0.00 0.10 0.00 0.00 66.02 63.74 2b8t s SER 65 CO 0.02 -0.93 1.31 -0.76 0.98 0.00 0.00 173.24 173.86 2b8t s LEU 66 N -5.10 4.13 0.12 2.42 1.43 -1.26 -5.00 118.68 115.42 2b8t s LEU 66 Ca 0.54 1.65 -0.31 0.00 -1.03 0.00 0.00 54.13 54.98 2b8t s LEU 66 Cb -0.11 -3.54 -0.09 0.00 0.03 0.00 0.00 46.19 42.49 2b8t s LEU 66 CO 0.51 -0.84 1.52 -2.84 0.23 0.00 0.00 176.35 174.92 2b8t s PRO 67 N 3.68 4.25 -0.03 1.29 0.02 -1.26 -4.99 135.00 137.96 2b8t s PRO 67 Ca 0.57 2.24 -0.08 0.00 0.02 0.00 0.00 61.00 63.75 2b8t s PRO 67 Cb -0.22 -3.29 0.01 0.00 0.02 0.00 0.00 34.50 31.02 2b8t s PRO 67 CO 0.17 -0.57 0.17 -1.54 -0.33 0.00 0.00 177.00 174.90 2b8t s SER 68 N 1.40 -0.07 -0.06 2.53 1.04 -1.26 -4.42 113.70 112.86 2b8t s SER 68 Ca 0.69 0.03 -0.30 0.00 0.48 0.00 0.00 55.95 56.85 2b8t s SER 68 Cb -0.40 0.28 -0.02 0.00 0.10 0.00 0.00 66.02 65.98 2b8t s SER 68 CO 0.31 -0.26 1.04 -0.69 0.98 0.00 0.00 173.24 174.62 2b8t s VAL 69 N -0.83 4.68 -0.08 5.02 1.01 0.04 -4.84 120.40 125.40 2b8t s VAL 69 Ca -0.09 1.94 -0.24 0.00 0.00 0.00 0.00 61.98 63.59 2b8t s VAL 69 Cb -0.05 -4.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 2b8t s VAL 69 CO 0.01 0.05 0.73 -0.70 0.00 0.00 0.00 175.10 175.19 2b8t s GLU 70 N 1.76 4.41 0.05 2.72 2.12 -1.26 -0.84 118.70 127.66 2b8t s GLU 70 Ca 0.51 0.91 0.06 0.00 0.36 0.00 0.00 54.97 56.81 2b8t s GLU 70 Cb -0.21 -3.47 -0.02 0.00 0.26 0.00 0.00 34.13 30.69 2b8t s GLU 70 CO 0.22 -0.01 -0.17 0.14 -0.54 0.00 0.00 175.26 174.89 2b8t s VAL 71 N 1.04 1.39 -0.17 3.70 -7.23 -0.42 -4.96 120.40 113.75 2b8t s VAL 71 Ca 0.38 -1.16 0.17 0.00 -1.81 0.00 0.00 61.98 59.56 2b8t s VAL 71 Cb -0.18 -1.24 0.00 0.00 0.56 0.00 0.00 36.38 35.52 2b8t s VAL 71 CO 0.18 0.06 1.21 -0.33 -0.31 0.00 0.00 175.10 175.90 2b8t h GLU 72 N 4.76 0.00 -3.85 4.82 5.08 -1.95 -2.40 114.58 121.03 2b8t h GLU 72 Ca -0.41 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.86 2b8t h GLU 72 Cb 1.17 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.29 2b8t h GLU 72 CO 0.43 0.36 -0.37 -1.54 -1.00 0.00 0.00 179.01 176.89 2b8t s SER 73 N -6.12 0.11 0.15 1.42 1.04 -1.26 -4.80 113.70 104.24 2b8t s SER 73 Ca 0.01 -0.73 -0.16 0.00 0.48 0.00 0.00 55.95 55.55 2b8t s SER 73 Cb 0.08 0.36 0.03 0.00 0.10 0.00 0.00 66.02 66.60 2b8t s SER 73 CO 0.77 -0.77 1.78 0.00 0.98 0.00 0.00 173.24 176.00 2b8t h ALA 74 N 2.70 0.45 -0.50 5.32 0.00 -1.91 -2.03 119.26 123.30 2b8t h ALA 74 Ca -0.33 0.01 0.14 0.00 0.00 0.00 0.00 54.91 54.72 2b8t h ALA 74 Cb 1.21 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2b8t h ALA 74 CO 0.54 -0.17 0.49 -1.35 0.00 0.00 0.00 179.25 178.76 2b8t h PRO 75 N 0.40 0.00 0.00 0.00 0.11 -1.98 -1.38 132.00 129.14 2b8t h PRO 75 Ca 0.15 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 2b8t h PRO 75 Cb 0.04 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.15 2b8t h PRO 75 CO -0.09 0.00 -0.04 0.93 -0.21 0.00 0.00 178.00 178.59 2b8t h GLU 76 N 0.00 0.00 -0.19 1.05 5.08 -1.79 -2.22 114.58 116.51 2b8t h GLU 76 Ca 0.24 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 2b8t h GLU 76 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2b8t h GLU 76 CO -0.00 0.04 0.04 0.82 -1.00 0.00 0.00 179.01 178.90 2b8t h ILE 77 N 0.00 1.22 -0.50 3.13 2.04 -1.36 -1.61 117.51 120.43 2b8t h ILE 77 Ca -0.00 -0.71 -0.08 0.00 1.00 0.00 0.00 64.86 65.07 2b8t h ILE 77 Cb 0.25 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 2b8t h ILE 77 CO 0.01 0.22 0.01 -0.07 0.00 0.00 0.00 178.15 178.31 2b8t h LEU 78 N 0.11 0.86 -0.85 1.44 3.38 -1.56 -2.18 115.31 116.52 2b8t h LEU 78 Ca 0.06 -0.30 0.11 0.00 0.09 0.00 0.00 57.88 57.83 2b8t h LEU 78 Cb 0.30 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 40.74 2b8t h LEU 78 CO 0.00 0.96 0.48 0.78 0.09 0.00 0.00 178.44 180.75 2b8t h ASN 79 N 0.75 0.66 -0.47 -0.43 2.35 -1.43 -1.55 115.58 115.47 2b8t h ASN 79 Ca 0.14 0.06 -0.05 0.00 -0.55 0.00 0.00 56.30 55.90 2b8t h ASN 79 Cb 0.51 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 2b8t h ASN 79 CO 0.02 0.36 0.11 0.22 -1.65 0.00 0.00 177.43 176.49 2b8t h TYR 80 N 0.77 0.79 -0.39 1.19 3.20 -1.04 -2.57 116.97 118.92 2b8t h TYR 80 Ca 0.42 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 62.18 2b8t h TYR 80 Cb 0.44 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 2b8t h TYR 80 CO -0.06 0.72 0.16 0.82 -1.64 0.00 0.00 178.16 178.16 2b8t h ILE 81 N 0.63 1.15 0.00 1.81 2.04 -0.91 -1.93 117.51 120.30 2b8t h ILE 81 Ca 0.15 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.54 2b8t h ILE 81 Cb 0.33 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 2b8t h ILE 81 CO 0.00 0.18 0.00 0.23 0.00 0.00 0.00 178.15 178.56 2b8t n MET 82 N -4.39 0.04 -2.54 2.37 2.81 -0.63 -4.69 117.12 110.09 2b8t n MET 82 Ca 0.03 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.65 2b8t n MET 82 Cb 0.14 -1.50 0.02 0.00 -0.71 0.00 0.00 33.22 31.17 2b8t n MET 82 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2b8t s SER 83 N -2.96 5.81 0.22 7.83 1.04 -0.72 -4.97 113.70 119.95 2b8t s SER 83 Ca 0.15 0.71 0.18 0.00 0.48 0.00 0.00 55.95 57.47 2b8t s SER 83 Cb 0.19 -1.83 0.87 0.00 0.10 0.00 0.00 66.02 65.35 2b8t s SER 83 CO 0.52 -0.88 1.54 0.59 0.98 0.00 0.00 173.24 175.99 2b8t n ASN 84 N -2.42 0.44 0.15 7.02 3.02 -1.26 -2.25 115.26 119.96 2b8t n ASN 84 Ca 0.03 0.67 0.02 0.00 -0.03 0.00 0.00 54.58 55.26 2b8t n ASN 84 Cb 0.57 -0.74 0.19 0.00 -0.61 0.00 0.00 39.78 39.19 2b8t n ASN 84 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2b8t h SER 85 N 0.00 0.00 -3.36 6.41 0.02 -1.93 -3.44 113.55 111.24 2b8t h SER 85 Ca 0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.39 2b8t h SER 85 Cb 0.11 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.60 2b8t h SER 85 CO 0.00 0.55 0.20 0.12 -1.14 0.00 0.00 176.83 176.56 2b8t s PHE 86 N -3.41 3.55 -0.38 3.45 5.36 -0.95 -5.02 117.98 120.58 2b8t s PHE 86 Ca 0.00 1.31 -0.29 0.00 -0.96 0.00 0.00 56.93 57.00 2b8t s PHE 86 Cb 0.11 -2.90 0.02 0.00 -0.34 0.00 0.00 43.02 39.91 2b8t s PHE 86 CO 0.73 -0.01 1.09 1.21 -1.46 0.00 0.00 175.22 176.79 2b8t s ASN 87 N 0.92 6.81 0.00 6.13 3.84 -1.26 -4.92 114.94 126.46 2b8t s ASN 87 Ca 0.40 0.81 0.08 0.00 0.21 0.00 0.00 52.86 54.36 2b8t s ASN 87 Cb -0.18 -2.54 0.37 0.00 -0.55 0.00 0.00 41.25 38.35 2b8t s ASN 87 CO 0.18 -1.01 1.25 -0.90 -2.79 0.00 0.00 177.10 173.83 2b8t n ASP 88 N 7.21 0.00 0.06 -4.21 5.75 -1.26 -1.00 116.55 123.11 2b8t n ASP 88 Ca 0.12 0.44 0.12 0.00 -0.01 0.00 0.00 54.79 55.46 2b8t n ASP 88 Cb 0.48 -0.46 0.47 0.00 -1.03 0.00 0.00 41.12 40.57 2b8t n ASP 88 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2b8t n GLU 89 N -1.46 0.13 -2.46 0.11 1.02 -1.26 -4.77 120.64 111.95 2b8t n GLU 89 Ca 0.02 0.20 -0.43 0.00 -0.02 0.00 0.00 57.16 56.94 2b8t n GLU 89 Cb 0.09 -1.68 -0.02 0.00 -0.02 0.00 0.00 31.44 29.81 2b8t n GLU 89 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2b8t s THR 90 N -3.10 4.25 -0.00 2.62 2.01 -0.17 -4.66 115.64 116.58 2b8t s THR 90 Ca 0.10 1.44 0.00 0.00 0.31 0.00 0.00 61.69 63.54 2b8t s THR 90 Cb 0.13 -4.15 0.01 0.00 0.01 0.00 0.00 72.50 68.49 2b8t s THR 90 CO 0.48 -0.37 0.97 0.29 -0.69 0.00 0.00 174.62 175.29 2b8t n LYS 91 N 7.03 2.74 -4.80 4.92 4.76 -1.24 -4.98 118.16 126.59 2b8t n LYS 91 Ca 0.14 -1.45 -0.32 0.00 -2.87 0.00 0.00 58.31 53.81 2b8t n LYS 91 Cb 0.46 -0.98 -0.17 0.00 -1.84 0.00 0.00 35.03 32.51 2b8t n LYS 91 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2b8t s VAL 92 N -0.97 1.97 -0.17 -0.18 1.01 -1.24 -1.26 120.40 119.56 2b8t s VAL 92 Ca 0.01 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.04 2b8t s VAL 92 Cb 0.01 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.65 2b8t s VAL 92 CO 0.00 0.54 -0.14 -0.63 0.00 0.00 0.00 175.10 174.87 2b8t s ILE 93 N 0.69 2.72 0.04 2.22 -1.09 0.53 -1.42 121.20 124.89 2b8t s ILE 93 Ca -0.11 -0.74 -0.04 0.00 -2.23 0.00 0.00 60.65 57.53 2b8t s ILE 93 Cb -0.16 -2.17 -0.05 0.00 -1.58 0.00 0.00 42.46 38.50 2b8t s ILE 93 CO 0.01 0.50 0.26 -0.83 -1.23 0.00 0.00 174.94 173.66 2b8t s GLY 94 N 1.03 2.22 -0.03 6.18 0.00 0.49 -0.75 107.32 116.46 2b8t s GLY 94 Ca -0.01 -0.66 -0.01 0.00 0.00 0.00 0.00 44.72 44.04 2b8t s GLY 94 CO -0.03 -0.54 0.05 -0.42 0.00 0.00 0.00 173.10 172.16 2b8t s ILE 95 N -1.42 -0.09 0.32 0.90 1.01 0.00 -0.79 121.20 121.13 2b8t s ILE 95 Ca 0.32 0.37 0.09 0.00 0.00 0.00 0.00 60.65 61.42 2b8t s ILE 95 Cb -0.13 -0.13 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 2b8t s ILE 95 CO 0.21 0.16 0.10 -0.62 0.00 0.00 0.00 174.94 174.78 2b8t s ASP 96 N 1.86 4.63 -1.61 3.58 2.15 -0.91 -0.21 116.67 126.16 2b8t s ASP 96 Ca 0.01 -0.74 -0.14 0.00 0.43 0.00 0.00 52.55 52.11 2b8t s ASP 96 Cb -0.12 -0.76 0.11 0.00 -0.30 0.00 0.00 42.92 41.85 2b8t s ASP 96 CO -0.03 -0.21 0.74 -0.62 -0.17 0.00 0.00 175.17 174.88 2b8t n GLU 97 N -1.07 -3.60 0.29 4.34 -0.58 -0.64 -4.30 120.64 115.08 2b8t n GLU 97 Ca -0.04 0.42 0.15 0.00 -0.42 0.00 0.00 57.16 57.27 2b8t n GLU 97 Cb 0.61 -5.04 0.89 0.00 -0.57 0.00 0.00 31.44 27.32 2b8t n GLU 97 CO 0.00 0.00 0.00 -0.24 -0.48 0.00 0.00 177.13 176.41 2b8t h VAL 98 N -1.67 0.47 0.00 2.62 3.04 -1.59 -2.25 116.25 116.86 2b8t h VAL 98 Ca -0.60 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 64.91 2b8t h VAL 98 Cb 1.38 1.12 0.00 0.00 -2.01 0.00 0.00 31.29 31.78 2b8t h VAL 98 CO 0.73 0.04 0.00 0.06 -1.01 0.00 0.00 177.57 177.39 2b8t h GLN 99 N 0.00 0.00 0.00 4.17 -0.00 -1.85 -1.26 115.11 116.18 2b8t h GLN 99 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2b8t h GLN 99 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.60 2b8t h GLN 99 CO 0.00 0.00 -0.14 1.19 -0.00 0.00 0.00 178.83 179.88 2b8t n PHE 100 N -2.66 0.17 -1.52 0.06 3.72 -0.84 -4.27 117.46 112.11 2b8t n PHE 100 Ca -0.01 0.05 -0.29 0.00 -0.05 0.00 0.00 57.45 57.15 2b8t n PHE 100 Cb 0.11 -0.52 0.12 0.00 -0.94 0.00 0.00 39.48 38.25 2b8t n PHE 100 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2b8t s PHE 101 N -3.03 2.58 0.00 1.38 0.08 -0.48 -5.00 117.98 113.52 2b8t s PHE 101 Ca 0.12 0.95 0.00 0.00 0.12 0.00 0.00 56.93 58.13 2b8t s PHE 101 Cb 0.17 -3.30 0.00 0.00 -0.57 0.00 0.00 43.02 39.32 2b8t s PHE 101 CO 0.59 -2.22 0.00 -0.40 -0.10 0.00 0.00 175.22 173.09 2b8t n ASP 102 N -3.69 0.01 0.05 1.36 5.68 -1.26 -4.31 116.55 114.39 2b8t n ASP 102 Ca 0.07 -0.84 0.19 0.00 -0.50 0.00 0.00 54.79 53.71 2b8t n ASP 102 Cb 0.58 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 41.28 2b8t n ASP 102 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 2b8t h ASP 103 N 0.00 0.00 0.25 -1.12 3.58 -1.94 -2.72 116.42 114.47 2b8t h ASP 103 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2b8t h ASP 103 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2b8t h ASP 103 CO 0.00 0.00 0.00 0.03 -2.88 0.00 0.00 179.24 176.39 2b8t h ARG 104 N 0.00 0.00 -0.36 0.28 3.08 -1.99 -2.57 114.38 112.82 2b8t h ARG 104 Ca 0.21 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.26 2b8t h ARG 104 Cb 0.90 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.93 2b8t h ARG 104 CO -0.00 0.00 0.22 0.97 -1.07 0.00 0.00 179.97 180.09 2b8t h ILE 105 N 0.00 1.10 -0.03 2.04 6.09 -1.86 -2.88 117.51 121.97 2b8t h ILE 105 Ca 0.00 -0.22 -0.00 0.00 -1.37 0.00 0.00 64.86 63.27 2b8t h ILE 105 Cb 0.13 0.59 -0.00 0.00 0.47 0.00 0.00 36.82 38.01 2b8t h ILE 105 CO 0.00 0.10 0.01 0.00 -3.07 0.00 0.00 178.15 175.19 2b8t h GLU 107 N -0.19 0.86 0.18 0.00 4.81 -1.76 -0.55 114.58 117.93 2b8t h GLU 107 Ca 0.01 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2b8t h GLU 107 Cb 0.26 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.44 2b8t h GLU 107 CO 0.00 0.57 -0.09 0.28 -0.73 0.00 0.00 179.01 179.04 2b8t h VAL 108 N 0.88 0.84 -0.44 0.32 2.07 -1.25 -1.47 116.25 117.19 2b8t h VAL 108 Ca 0.33 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.79 2b8t h VAL 108 Cb 0.13 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 2b8t h VAL 108 CO -0.16 0.02 0.27 0.00 0.02 0.00 0.00 177.57 177.72 2b8t h ALA 109 N 0.53 0.56 -0.49 1.67 0.00 -0.91 -1.36 119.26 119.25 2b8t h ALA 109 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2b8t h ALA 109 Cb 0.22 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2b8t h ALA 109 CO 0.04 -0.05 0.25 -0.91 0.00 0.00 0.00 179.25 178.59 2b8t h ASN 110 N 0.54 0.63 -0.28 0.00 2.35 -1.04 -1.26 115.58 116.52 2b8t h ASN 110 Ca 0.17 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 2b8t h ASN 110 Cb -0.00 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.19 2b8t h ASN 110 CO -0.07 0.56 0.08 0.40 -1.65 0.00 0.00 177.43 176.75 2b8t h ILE 111 N 0.65 1.21 -0.30 2.81 2.04 -1.11 0.80 117.51 123.61 2b8t h ILE 111 Ca 0.17 -0.67 0.06 0.00 1.00 0.00 0.00 64.86 65.42 2b8t h ILE 111 Cb 0.09 1.12 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 2b8t h ILE 111 CO -0.02 0.22 -0.11 -0.07 0.00 0.00 0.00 178.15 178.17 2b8t h LEU 112 N 0.28 -0.38 -0.98 1.44 3.38 -1.18 -1.91 115.31 115.96 2b8t h LEU 112 Ca 0.09 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 2b8t h LEU 112 Cb 0.26 0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2b8t h LEU 112 CO -0.00 -0.14 0.23 0.00 0.09 0.00 0.00 178.44 178.62 2b8t h ALA 113 N 1.23 1.19 0.00 1.53 0.00 -0.92 -1.67 119.26 120.62 2b8t h ALA 113 Ca 0.15 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2b8t h ALA 113 Cb 0.28 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2b8t h ALA 113 CO -0.34 0.58 0.00 0.93 0.00 0.00 0.00 179.25 180.42 2b8t h GLU 114 N 0.94 0.00 -0.32 0.00 5.08 -0.58 -3.22 114.58 116.48 2b8t h GLU 114 Ca 0.22 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.44 2b8t h GLU 114 Cb 0.22 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.39 2b8t h GLU 114 CO -0.01 0.00 -0.05 0.09 -1.00 0.00 0.00 179.01 178.04 2b8t n ASN 115 N -2.64 2.83 0.00 1.42 4.13 -0.74 -4.95 115.26 115.31 2b8t n ASN 115 Ca 0.01 -3.56 0.00 0.00 1.68 0.00 0.00 54.58 52.71 2b8t n ASN 115 Cb 0.26 -0.61 0.00 0.00 -1.54 0.00 0.00 39.78 37.89 2b8t n ASN 115 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2b8t n GLY 116 N -0.99 0.67 3.83 7.41 0.00 -1.19 -5.02 105.19 109.91 2b8t n GLY 116 Ca 0.30 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.95 2b8t n GLY 116 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2b8t s PHE 117 N -2.50 3.70 -0.16 1.61 0.08 -0.70 -4.28 117.98 115.73 2b8t s PHE 117 Ca 0.00 1.11 -0.19 0.00 0.12 0.00 0.00 56.93 57.97 2b8t s PHE 117 Cb 0.00 -2.39 -0.04 0.00 -0.57 0.00 0.00 43.02 40.03 2b8t s PHE 117 CO 0.00 0.53 0.53 0.08 -0.10 0.00 0.00 175.22 176.26 2b8t s VAL 118 N -1.26 5.12 -0.21 -0.44 1.01 -0.39 -2.17 120.40 122.06 2b8t s VAL 118 Ca 0.32 1.02 -0.01 0.00 0.00 0.00 0.00 61.98 63.31 2b8t s VAL 118 Cb -0.17 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.37 2b8t s VAL 118 CO 0.18 0.23 -0.12 -0.69 0.00 0.00 0.00 175.10 174.70 2b8t s VAL 119 N 1.21 2.60 -0.24 2.92 1.01 -0.16 -0.34 120.40 127.40 2b8t s VAL 119 Ca 0.26 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.36 2b8t s VAL 119 Cb -0.16 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.05 2b8t s VAL 119 CO 0.11 0.42 -0.06 -0.63 0.00 0.00 0.00 175.10 174.94 2b8t s ILE 120 N 1.34 3.04 -0.07 2.22 1.01 0.08 -0.59 121.20 128.23 2b8t s ILE 120 Ca 0.04 -0.83 0.05 0.00 0.00 0.00 0.00 60.65 59.91 2b8t s ILE 120 Cb -0.14 -2.48 -0.01 0.00 0.01 0.00 0.00 42.46 39.84 2b8t s ILE 120 CO -0.08 0.29 -0.24 -0.63 0.00 0.00 0.00 174.94 174.27 2b8t s ILE 121 N 1.38 2.03 -0.02 2.92 1.01 0.20 -0.82 121.20 127.90 2b8t s ILE 121 Ca 0.03 -1.04 0.06 0.00 0.00 0.00 0.00 60.65 59.70 2b8t s ILE 121 Cb -0.16 -1.72 -0.01 0.00 0.01 0.00 0.00 42.46 40.58 2b8t s ILE 121 CO -0.04 0.56 -0.21 -0.55 0.00 0.00 0.00 174.94 174.70 2b8t s SER 122 N -0.02 2.43 -0.20 3.58 0.15 0.71 -0.02 113.70 120.32 2b8t s SER 122 Ca -0.08 -0.38 -0.36 0.00 0.70 0.00 0.00 55.95 55.84 2b8t s SER 122 Cb -0.15 -0.32 0.15 0.00 -1.71 0.00 0.00 66.02 63.99 2b8t s SER 122 CO 0.05 0.25 1.36 -0.83 1.20 0.00 0.00 173.24 175.26 2b8t s GLY 123 N -0.43 -0.30 0.26 9.45 0.00 -0.93 -1.62 107.32 113.75 2b8t s GLY 123 Ca 0.07 1.53 -0.30 0.00 0.00 0.00 0.00 44.72 46.02 2b8t s GLY 123 CO -0.00 0.47 1.30 1.08 0.00 0.00 0.00 173.10 175.94 2b8t s LEU 124 N -2.36 4.43 0.11 0.66 1.43 -1.26 -4.04 118.68 117.66 2b8t s LEU 124 Ca 0.12 2.51 0.10 0.00 -1.03 0.00 0.00 54.13 55.83 2b8t s LEU 124 Cb 0.02 -3.63 -0.17 0.00 0.03 0.00 0.00 46.19 42.44 2b8t s LEU 124 CO -0.04 -0.50 1.18 -2.24 0.23 0.00 0.00 176.35 174.98 2b8t h ASP 125 N 4.46 0.00 -4.31 2.29 2.03 -1.93 -3.42 116.42 115.53 2b8t h ASP 125 Ca -0.47 0.00 -0.54 0.00 -0.73 0.00 0.00 57.03 55.29 2b8t h ASP 125 Cb 1.22 0.00 -0.28 0.00 -0.83 0.00 0.00 39.33 39.44 2b8t h ASP 125 CO 0.72 0.90 -0.83 -0.54 -1.03 0.00 0.00 179.24 178.46 2b8t s LYS 126 N -2.74 1.36 0.77 4.15 1.02 -1.26 -1.99 119.74 121.04 2b8t s LYS 126 Ca 0.00 -0.70 -0.13 0.00 0.02 0.00 0.00 55.97 55.16 2b8t s LYS 126 Cb 0.09 -1.35 0.18 0.00 -0.52 0.00 0.00 37.83 36.23 2b8t s LYS 126 CO 0.81 0.36 1.04 0.27 -0.92 0.00 0.00 175.35 176.91 2b8t n ASN 127 N 2.41 0.09 0.31 2.83 0.23 0.33 -4.73 115.26 116.73 2b8t n ASN 127 Ca -0.16 -1.39 0.18 0.00 -0.53 0.00 0.00 54.58 52.69 2b8t n ASN 127 Cb 0.54 -0.80 1.03 0.00 -2.08 0.00 0.00 39.78 38.47 2b8t n ASN 127 CO 0.00 0.00 0.00 2.19 -0.93 0.00 0.00 177.26 178.52 2b8t h PHE 128 N -1.59 0.00 0.00 -2.53 -5.15 -1.88 -1.45 116.94 104.33 2b8t h PHE 128 Ca -0.34 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.43 2b8t h PHE 128 Cb 0.93 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.10 2b8t h PHE 128 CO 0.00 0.00 0.00 1.63 -2.00 0.00 0.00 178.31 177.94 2b8t n LYS 129 N -3.49 0.16 -0.94 6.09 5.02 -1.26 -4.67 118.16 119.07 2b8t n LYS 129 Ca -0.03 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2b8t n LYS 129 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.62 2b8t n LYS 129 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b8t n GLY 130 N 1.11 0.46 3.79 0.72 0.00 -0.55 -4.94 105.19 105.78 2b8t n GLY 130 Ca 0.09 -0.66 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 2b8t n GLY 130 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b8t s GLU 131 N -1.22 2.72 0.26 1.61 2.02 -1.26 -4.86 118.70 117.98 2b8t s GLU 131 Ca 0.00 -1.22 -0.31 0.00 0.02 0.00 0.00 54.97 53.47 2b8t s GLU 131 Cb 0.00 -2.44 -0.13 0.00 0.10 0.00 0.00 34.13 31.67 2b8t s GLU 131 CO 0.00 0.30 1.47 -2.30 0.02 0.00 0.00 175.26 174.76 2b8t n PRO 132 N -1.17 2.29 -2.96 0.39 -0.02 -1.26 -0.52 135.00 131.75 2b8t n PRO 132 Ca -0.06 0.81 -0.43 0.00 -2.02 0.00 0.00 63.50 61.80 2b8t n PRO 132 Cb 0.59 -2.51 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 2b8t n PRO 132 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2b8t s PHE 133 N -0.08 2.99 0.00 6.00 5.99 -0.84 -4.56 117.98 127.47 2b8t s PHE 133 Ca 0.66 0.15 0.00 0.00 0.00 0.00 0.00 56.93 57.74 2b8t s PHE 133 Cb -0.59 -3.67 0.00 0.00 0.00 0.00 0.00 43.02 38.76 2b8t s PHE 133 CO 0.50 -0.99 0.00 0.41 -0.00 0.00 0.00 175.22 175.13 2b8t n GLY 134 N 4.99 3.80 0.85 13.12 0.00 -1.26 -2.30 105.19 124.39 2b8t n GLY 134 Ca 0.02 -0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2b8t n GLY 134 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2b8t n PRO 135 N 13.83 2.09 -0.32 1.61 -0.04 -1.26 -4.64 135.00 146.27 2b8t n PRO 135 Ca 0.00 -1.67 0.06 0.00 -0.04 0.00 0.00 63.50 61.85 2b8t n PRO 135 Cb 0.00 -1.41 0.22 0.00 -0.04 0.00 0.00 33.50 32.26 2b8t n PRO 135 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2b8t h ILE 136 N 3.01 0.85 -0.74 0.52 1.08 -1.81 -3.00 117.51 117.42 2b8t h ILE 136 Ca 0.00 -0.28 0.09 0.00 -0.39 0.00 0.00 64.86 64.28 2b8t h ILE 136 Cb 0.67 -0.03 -0.07 0.00 -3.07 0.00 0.00 36.82 34.32 2b8t h ILE 136 CO 0.00 0.15 0.38 0.00 -0.69 0.00 0.00 178.15 177.99 2b8t h ALA 137 N 1.52 1.03 -0.16 1.87 0.00 -1.83 -1.56 119.26 120.13 2b8t h ALA 137 Ca 0.46 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.35 2b8t h ALA 137 Cb 0.52 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2b8t h ALA 137 CO -0.29 -0.01 -0.21 0.87 0.00 0.00 0.00 179.25 179.61 2b8t h LYS 138 N 0.65 0.28 -0.13 0.00 1.57 -1.91 -3.03 116.57 113.99 2b8t h LYS 138 Ca 0.36 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 59.01 2b8t h LYS 138 Cb 0.37 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2b8t h LYS 138 CO -0.26 0.48 -0.15 -0.07 -0.57 0.00 0.00 179.45 178.87 2b8t h LEU 139 N 0.25 0.19 -0.78 2.94 3.38 -1.37 -1.79 115.31 118.13 2b8t h LEU 139 Ca 0.04 -0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2b8t h LEU 139 Cb 0.52 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 2b8t h LEU 139 CO 0.03 0.37 0.46 -0.26 0.09 0.00 0.00 178.44 179.13 2b8t h PHE 140 N 0.19 0.85 -0.38 1.13 0.04 -1.47 0.81 116.94 118.11 2b8t h PHE 140 Ca 0.04 0.03 -0.15 0.00 2.80 0.00 0.00 57.97 60.68 2b8t h PHE 140 Cb 0.39 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 38.27 2b8t h PHE 140 CO 0.01 0.40 -0.35 1.79 -0.60 0.00 0.00 178.31 179.55 2b8t h THR 141 N 0.83 1.28 0.00 -1.55 1.35 -1.45 -3.24 112.91 110.12 2b8t h THR 141 Ca 0.35 -1.52 0.00 0.00 -0.55 0.00 0.00 66.41 64.69 2b8t h THR 141 Cb 0.23 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 2b8t h THR 141 CO -0.20 0.51 -0.15 1.88 -0.25 0.00 0.00 175.52 177.32 2b8t h TYR 142 N 0.72 0.00 -2.98 4.73 0.05 -1.22 -3.45 116.97 114.82 2b8t h TYR 142 Ca 0.06 0.00 -0.55 0.00 0.05 0.00 0.00 58.73 58.29 2b8t h TYR 142 Cb 0.94 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.67 2b8t h TYR 142 CO 0.06 0.00 0.80 0.00 -1.05 0.00 0.00 178.16 177.97 2b8t s ALA 143 N -3.20 3.56 0.21 3.88 0.00 0.26 -4.72 121.76 121.74 2b8t s ALA 143 Ca 0.07 0.70 -0.09 0.00 0.00 0.00 0.00 51.96 52.63 2b8t s ALA 143 Cb 0.07 -3.57 0.16 0.00 0.00 0.00 0.00 23.12 19.78 2b8t s ALA 143 CO 0.67 -0.91 1.84 -0.44 0.00 0.00 0.00 175.76 176.92 2b8t h ASP 144 N 7.79 0.95 -3.59 0.00 3.32 -1.28 -3.43 116.42 120.18 2b8t h ASP 144 Ca -0.34 -0.08 -0.55 0.00 0.02 0.00 0.00 57.03 56.07 2b8t h ASP 144 Cb 1.16 -0.24 -0.33 0.00 0.22 0.00 0.00 39.33 40.14 2b8t h ASP 144 CO 0.91 0.76 -0.83 -0.75 -1.72 0.00 0.00 179.24 177.60 2b8t s LYS 145 N -5.90 1.90 -0.08 3.56 2.20 -0.88 -5.04 119.74 115.50 2b8t s LYS 145 Ca -0.13 -0.55 0.04 0.00 -0.36 0.00 0.00 55.97 54.98 2b8t s LYS 145 Cb 0.15 -1.57 -0.00 0.00 -1.51 0.00 0.00 37.83 34.90 2b8t s LYS 145 CO 0.80 0.13 -0.22 0.42 -0.36 0.00 0.00 175.35 176.12 2b8t s ILE 146 N 0.38 1.89 -0.25 5.43 1.01 -1.26 -0.46 121.20 127.95 2b8t s ILE 146 Ca -0.11 -0.94 0.02 0.00 0.00 0.00 0.00 60.65 59.61 2b8t s ILE 146 Cb -0.14 -1.63 0.06 0.00 0.01 0.00 0.00 42.46 40.76 2b8t s ILE 146 CO 0.04 0.53 -0.07 -0.89 0.00 0.00 0.00 174.94 174.55 2b8t s THR 147 N 0.22 1.77 -0.52 2.92 2.01 0.11 -4.98 115.64 117.17 2b8t s THR 147 Ca -0.13 -1.41 -0.19 0.00 0.31 0.00 0.00 61.69 60.27 2b8t s THR 147 Cb -0.16 -1.99 0.06 0.00 0.01 0.00 0.00 72.50 70.42 2b8t s THR 147 CO 0.06 -0.10 0.63 -0.75 -0.69 0.00 0.00 174.62 173.77 2b8t s LYS 148 N 1.28 3.11 0.47 4.92 2.20 -1.26 -0.46 119.74 130.00 2b8t s LYS 148 Ca -0.06 -0.95 -0.15 0.00 -0.36 0.00 0.00 55.97 54.45 2b8t s LYS 148 Cb -0.19 -4.12 -0.08 0.00 -1.51 0.00 0.00 37.83 31.93 2b8t s LYS 148 CO -0.06 -1.26 0.92 -0.51 -0.36 0.00 0.00 175.35 174.08 2b8t s LEU 149 N 2.62 3.71 0.06 5.43 1.43 0.79 -4.95 118.68 127.77 2b8t s LEU 149 Ca 0.14 1.45 0.07 0.00 -1.03 0.00 0.00 54.13 54.76 2b8t s LEU 149 Cb -0.20 -4.36 -0.04 0.00 0.03 0.00 0.00 46.19 41.62 2b8t s LEU 149 CO 0.11 -0.51 -0.14 0.42 0.23 0.00 0.00 176.35 176.46 2b8t s THR 150 N -2.52 3.08 0.00 5.49 -4.23 -1.26 -4.28 115.64 111.92 2b8t s THR 150 Ca 0.57 -1.19 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 2b8t s THR 150 Cb -0.10 -2.36 0.00 0.00 1.34 0.00 0.00 72.50 71.38 2b8t s THR 150 CO 0.30 0.25 0.00 0.00 -0.54 0.00 0.00 174.62 174.63 2b8t n ALA 151 N 1.22 0.00 -3.24 3.99 0.00 -0.50 -4.63 120.51 117.35 2b8t n ALA 151 Ca -0.15 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.96 2b8t n ALA 151 Cb 0.52 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.83 2b8t n ALA 151 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2b8t s ILE 152 N 0.94 2.92 0.06 0.00 -1.09 -1.26 -0.34 121.20 122.43 2b8t s ILE 152 Ca 0.00 -0.70 -0.31 0.00 -2.23 0.00 0.00 60.65 57.42 2b8t s ILE 152 Cb 0.00 -2.23 -0.08 0.00 -1.58 0.00 0.00 42.46 38.56 2b8t s ILE 152 CO 0.00 0.51 1.73 0.00 -1.23 0.00 0.00 174.94 175.95 2b8t h ASN 154 N 8.81 0.00 0.00 0.00 -1.24 -1.31 -0.79 115.58 121.05 2b8t h ASN 154 Ca -0.44 0.00 -0.22 0.00 0.71 0.00 0.00 56.30 56.35 2b8t h ASN 154 Cb 1.21 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 40.22 2b8t h ASN 154 CO 0.94 0.02 -1.33 -0.62 -1.29 0.00 0.00 177.43 175.14 2b8t n GLU 155 N -3.38 0.55 -0.00 6.67 -0.58 -1.26 -4.81 120.64 117.82 2b8t n GLU 155 Ca -0.02 0.49 0.02 0.00 -0.42 0.00 0.00 57.16 57.23 2b8t n GLU 155 Cb 0.12 -1.68 -0.03 0.00 -0.57 0.00 0.00 31.44 29.29 2b8t n GLU 155 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2b8t n GLY 157 N 1.60 1.22 3.46 0.00 0.00 -0.31 -4.98 105.19 106.18 2b8t n GLY 157 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2b8t n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b8t s ALA 158 N -2.53 -0.26 0.13 4.61 0.00 -1.26 -4.33 121.76 118.11 2b8t s ALA 158 Ca 0.00 -0.59 -0.31 0.00 0.00 0.00 0.00 51.96 51.06 2b8t s ALA 158 Cb 0.00 -3.04 -0.11 0.00 0.00 0.00 0.00 23.12 19.97 2b8t s ALA 158 CO 0.00 -4.00 1.84 0.39 0.00 0.00 0.00 175.76 173.98 2b8t n GLU 159 N -5.10 2.79 -3.60 0.00 1.02 -1.26 -0.82 120.64 113.67 2b8t n GLU 159 Ca 0.09 1.01 -0.37 0.00 -0.02 0.00 0.00 57.16 57.87 2b8t n GLU 159 Cb 0.58 -2.91 -0.07 0.00 -0.02 0.00 0.00 31.44 29.02 2b8t n GLU 159 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2b8t s ALA 160 N 2.67 3.66 0.00 0.62 0.00 0.54 -4.26 121.76 125.00 2b8t s ALA 160 Ca 0.82 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.32 2b8t s ALA 160 Cb -0.48 -2.31 0.00 0.00 0.00 0.00 0.00 23.12 20.33 2b8t s ALA 160 CO 0.37 0.25 0.00 0.25 0.00 0.00 0.00 175.76 176.63 2b8t n THR 161 N 3.00 0.00 -4.26 0.00 -2.24 -0.44 -1.41 114.28 108.94 2b8t n THR 161 Ca -0.14 -0.37 -0.22 0.00 -2.27 0.00 0.00 64.05 61.05 2b8t n THR 161 Cb 0.52 0.90 -0.12 0.00 -2.10 0.00 0.00 70.33 69.54 2b8t n THR 161 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2b8t s HIS 162 N -1.07 1.61 -0.19 4.78 3.76 -0.30 -4.31 115.29 119.57 2b8t s HIS 162 Ca 0.00 -0.45 -0.09 0.00 -0.15 0.00 0.00 55.06 54.37 2b8t s HIS 162 Cb 0.00 -0.87 -0.05 0.00 1.11 0.00 0.00 32.58 32.77 2b8t s HIS 162 CO 0.00 0.18 0.11 -1.12 -0.85 0.00 0.00 174.74 173.06 2b8t s SER 163 N -2.03 6.05 -0.12 1.40 0.01 -1.26 -1.26 113.70 116.48 2b8t s SER 163 Ca 0.06 0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.52 2b8t s SER 163 Cb -0.09 -2.05 -0.02 0.00 0.21 0.00 0.00 66.02 64.08 2b8t s SER 163 CO 0.04 0.20 -0.12 -0.22 0.41 0.00 0.00 173.24 173.54 2b8t s LEU 164 N 0.25 2.78 -0.17 2.44 2.96 0.15 -4.47 118.68 122.62 2b8t s LEU 164 Ca 0.07 -0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 53.64 2b8t s LEU 164 Cb -0.11 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 44.92 2b8t s LEU 164 CO -0.01 0.19 0.02 -0.60 -1.32 0.00 0.00 176.35 174.64 2b8t s ARG 165 N 0.18 3.81 -0.02 1.98 3.52 -1.26 -0.93 118.95 126.23 2b8t s ARG 165 Ca -0.07 -0.41 0.06 0.00 -0.13 0.00 0.00 55.73 55.18 2b8t s ARG 165 Cb -0.15 -3.08 -0.01 0.00 -1.56 0.00 0.00 34.95 30.15 2b8t s ARG 165 CO 0.05 0.29 -0.19 0.15 -0.81 0.00 0.00 175.30 174.78 2b8t s LYS 166 N 0.30 1.59 -0.14 5.12 1.02 0.69 -0.47 119.74 127.85 2b8t s LYS 166 Ca 0.01 -0.69 0.01 0.00 0.02 0.00 0.00 55.97 55.32 2b8t s LYS 166 Cb -0.13 -1.52 0.02 0.00 -0.52 0.00 0.00 37.83 35.68 2b8t s LYS 166 CO 0.01 0.40 -0.17 0.42 -0.92 0.00 0.00 175.35 175.10 2b8t s ILE 167 N -0.42 1.71 -1.55 2.17 1.09 0.33 -4.46 121.20 120.07 2b8t s ILE 167 Ca 0.07 -0.74 -0.14 0.00 -1.10 0.00 0.00 60.65 58.73 2b8t s ILE 167 Cb -0.08 -1.56 0.09 0.00 -1.06 0.00 0.00 42.46 39.86 2b8t s ILE 167 CO -0.00 0.48 0.97 -0.67 -0.10 0.00 0.00 174.94 175.62 2b8t n ASP 168 N 4.44 -4.76 0.00 3.58 -0.08 -1.26 -2.08 116.55 116.38 2b8t n ASP 168 Ca -0.19 -0.79 0.00 0.00 -1.51 0.00 0.00 54.79 52.30 2b8t n ASP 168 Cb 0.51 -3.80 0.00 0.00 2.34 0.00 0.00 41.12 40.16 2b8t n ASP 168 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2b8t n GLY 169 N -1.67 2.93 3.75 0.27 0.00 -1.26 -5.01 105.19 104.19 2b8t n GLY 169 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 2b8t n GLY 169 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b8t s LYS 170 N -0.18 4.51 0.26 1.61 1.02 -0.88 -4.98 119.74 121.09 2b8t s LYS 170 Ca 0.00 1.10 -0.31 0.00 0.02 0.00 0.00 55.97 56.78 2b8t s LYS 170 Cb 0.00 -3.35 -0.13 0.00 -0.52 0.00 0.00 37.83 33.83 2b8t s LYS 170 CO 0.00 0.33 1.41 0.72 -0.92 0.00 0.00 175.35 176.89 2b8t n HIS 171 N 2.60 2.24 -1.84 3.18 8.25 -1.26 -0.52 115.22 127.88 2b8t n HIS 171 Ca -0.03 0.43 -0.41 0.00 -0.26 0.00 0.00 57.72 57.45 2b8t n HIS 171 Cb 0.50 -2.47 -0.02 0.00 1.12 0.00 0.00 29.99 29.12 2b8t n HIS 171 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2b8t s ALA 172 N -0.20 3.72 0.54 -1.41 0.00 0.38 -4.81 121.76 119.97 2b8t s ALA 172 Ca 0.66 1.51 -0.20 0.00 0.00 0.00 0.00 51.96 53.93 2b8t s ALA 172 Cb -0.62 -3.63 -0.06 0.00 0.00 0.00 0.00 23.12 18.82 2b8t s ALA 172 CO 0.51 -0.92 1.17 0.34 0.00 0.00 0.00 175.76 176.86 2b8t s ASP 173 N 0.47 5.66 0.33 0.00 2.15 -1.26 -4.20 116.67 119.82 2b8t s ASP 173 Ca 0.62 2.30 0.11 0.00 0.43 0.00 0.00 52.55 56.01 2b8t s ASP 173 Cb -0.46 -2.59 0.92 0.00 -0.30 0.00 0.00 42.92 40.48 2b8t s ASP 173 CO 0.47 -1.27 1.74 0.22 -0.17 0.00 0.00 175.17 176.16 2b8t h TYR 174 N 1.34 0.96 -0.36 -5.34 3.20 -1.51 -2.16 116.97 113.09 2b8t h TYR 174 Ca -0.50 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.40 2b8t h TYR 174 Cb 1.27 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.26 2b8t h TYR 174 CO 0.50 0.07 0.00 0.09 -1.64 0.00 0.00 178.16 177.18 2b8t n ASN 175 N -4.84 1.96 -4.77 -2.11 5.03 -1.26 -4.90 115.26 104.36 2b8t n ASN 175 Ca 0.27 -2.00 -0.31 0.00 0.87 0.00 0.00 54.58 53.41 2b8t n ASN 175 Cb 0.76 -0.25 0.09 0.00 -1.02 0.00 0.00 39.78 39.37 2b8t n ASN 175 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2b8t s ASP 176 N -1.00 4.42 0.34 6.41 1.01 -0.81 -4.98 116.67 122.06 2b8t s ASP 176 Ca 0.24 1.63 -0.29 0.00 0.71 0.00 0.00 52.55 54.84 2b8t s ASP 176 Cb 0.13 -2.36 -0.11 0.00 1.01 0.00 0.00 42.92 41.59 2b8t s ASP 176 CO 0.16 -2.06 1.50 -1.81 0.21 0.00 0.00 175.17 173.17 2b8t s ASP 177 N -3.55 6.42 -0.03 0.27 1.01 -1.26 -4.96 116.67 114.57 2b8t s ASP 177 Ca 0.61 2.96 -0.25 0.00 0.71 0.00 0.00 52.55 56.58 2b8t s ASP 177 Cb -0.16 -2.65 -0.19 0.00 1.01 0.00 0.00 42.92 40.92 2b8t s ASP 177 CO 0.56 -0.84 1.16 0.40 0.21 0.00 0.00 175.17 176.66 2b8t h ILE 178 N 3.15 1.17 -3.09 0.77 2.04 -1.96 -3.42 117.51 116.18 2b8t h ILE 178 Ca -0.49 -1.10 -0.58 0.00 1.00 0.00 0.00 64.86 63.70 2b8t h ILE 178 Cb 1.23 1.86 -0.06 0.00 -0.74 0.00 0.00 36.82 39.12 2b8t h ILE 178 CO 0.70 0.26 0.84 -0.69 0.00 0.00 0.00 178.15 179.26 2b8t s VAL 179 N -4.06 4.53 -0.29 1.67 1.01 -1.26 -4.84 120.40 117.15 2b8t s VAL 179 Ca -0.15 1.82 0.03 0.00 0.00 0.00 0.00 61.98 63.68 2b8t s VAL 179 Cb 0.01 -4.26 0.18 0.00 0.00 0.00 0.00 36.38 32.31 2b8t s VAL 179 CO 0.61 -0.25 0.48 -0.75 0.00 0.00 0.00 175.10 175.19 2b8t s LYS 180 N 3.42 0.47 0.31 2.72 2.20 -1.26 -5.15 119.74 122.45 2b8t s LYS 180 Ca 0.47 0.31 -0.29 0.00 -0.36 0.00 0.00 55.97 56.11 2b8t s LYS 180 Cb -0.16 -0.09 -0.10 0.00 -1.51 0.00 0.00 37.83 35.98 2b8t s LYS 180 CO 0.11 -1.02 1.12 0.42 -0.36 0.00 0.00 175.35 175.62 2b8t s ILE 181 N 2.66 3.39 0.00 5.43 -1.09 -1.26 -4.96 121.20 125.36 2b8t s ILE 181 Ca 0.10 1.35 0.00 0.00 -2.23 0.00 0.00 60.65 59.87 2b8t s ILE 181 Cb -0.12 -3.84 0.00 0.00 -1.58 0.00 0.00 42.46 36.93 2b8t s ILE 181 CO -0.28 0.28 0.00 0.61 -1.23 0.00 0.00 174.94 174.32 2b8t n GLY 182 N 1.03 -0.16 0.00 6.18 0.00 -1.26 -5.06 105.19 105.92 2b8t n GLY 182 Ca -0.00 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.72 2b8t n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b8t n GLN 184 N 0.00 0.17 0.21 0.00 6.02 -1.26 -0.98 117.38 121.53 2b8t n GLN 184 Ca 0.00 0.37 0.05 0.00 -0.01 0.00 0.00 57.00 57.41 2b8t n GLN 184 Cb 0.00 -1.80 0.45 0.00 1.02 0.00 0.00 30.24 29.91 2b8t n GLN 184 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 2b8t h GLU 185 N 0.00 0.00 0.00 -1.09 9.09 -1.96 -3.33 114.58 117.29 2b8t h GLU 185 Ca 0.00 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 59.33 2b8t h GLU 185 Cb 0.39 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.47 2b8t h GLU 185 CO 0.00 0.29 -1.31 1.19 0.05 0.00 0.00 179.01 179.23 2b8t n PHE 186 N -3.97 0.00 -4.64 2.06 3.72 -1.08 -4.89 117.46 108.67 2b8t n PHE 186 Ca -0.02 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.08 2b8t n PHE 186 Cb 0.36 -0.22 -0.13 0.00 -0.94 0.00 0.00 39.48 38.55 2b8t n PHE 186 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 2b8t s TYR 187 N -2.14 2.44 0.07 1.38 2.02 -0.15 -0.22 117.35 120.75 2b8t s TYR 187 Ca -0.02 -0.33 -0.05 0.00 -0.37 0.00 0.00 57.07 56.30 2b8t s TYR 187 Cb 0.02 -1.39 -0.02 0.00 -0.40 0.00 0.00 41.96 40.17 2b8t s TYR 187 CO 0.19 0.25 0.08 -1.54 -1.57 0.00 0.00 175.55 172.96 2b8t s SER 188 N -1.59 0.30 -0.10 2.29 1.04 -0.11 -4.30 113.70 111.24 2b8t s SER 188 Ca 0.14 -0.81 -0.11 0.00 0.48 0.00 0.00 55.95 55.65 2b8t s SER 188 Cb -0.10 0.27 -0.05 0.00 0.10 0.00 0.00 66.02 66.24 2b8t s SER 188 CO 0.05 -0.65 0.26 0.00 0.98 0.00 0.00 173.24 173.88 2b8t s ALA 189 N -3.81 3.74 0.04 5.32 0.00 -1.26 0.30 121.76 126.10 2b8t s ALA 189 Ca 0.05 -0.46 -0.02 0.00 0.00 0.00 0.00 51.96 51.53 2b8t s ALA 189 Cb 0.06 -2.22 -0.03 0.00 0.00 0.00 0.00 23.12 20.93 2b8t s ALA 189 CO -0.10 0.42 -0.01 0.14 0.00 0.00 0.00 175.76 176.21 2b8t s VAL 190 N -0.60 0.18 1.00 0.00 -7.23 -0.39 -0.78 120.40 112.58 2b8t s VAL 190 Ca 0.18 -1.52 -0.15 0.00 -1.81 0.00 0.00 61.98 58.68 2b8t s VAL 190 Cb -0.14 -1.19 0.19 0.00 0.56 0.00 0.00 36.38 35.80 2b8t s VAL 190 CO 0.07 -0.84 1.16 0.00 -0.31 0.00 0.00 175.10 175.17 2b8t h ARG 192 N -1.82 0.15 0.00 0.00 2.43 -1.94 -2.43 114.38 110.78 2b8t h ARG 192 Ca -0.49 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.66 2b8t h ARG 192 Cb 1.31 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.82 2b8t h ARG 192 CO 0.51 0.10 -0.05 1.25 -1.51 0.00 0.00 179.97 180.27 2b8t h HIS 193 N 0.16 0.00 -0.65 2.20 2.76 -1.99 -2.40 115.15 115.24 2b8t h HIS 193 Ca 0.18 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 2b8t h HIS 193 Cb 0.23 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.19 2b8t h HIS 193 CO -0.22 0.05 0.00 0.72 -1.30 0.00 0.00 177.93 177.18 2b8t n HIS 194 N -4.35 0.86 -3.36 5.26 8.25 -0.95 -4.79 115.22 116.14 2b8t n HIS 194 Ca -0.03 -0.46 -0.41 0.00 -0.26 0.00 0.00 57.72 56.56 2b8t n HIS 194 Cb 0.13 -0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.15 2b8t n HIS 194 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2b8t s HIS 195 N -1.07 3.20 -0.07 4.41 5.04 -0.91 -4.86 115.29 121.04 2b8t s HIS 195 Ca 0.45 -0.08 0.02 0.00 -1.54 0.00 0.00 55.06 53.91 2b8t s HIS 195 Cb 0.24 -2.76 0.01 0.00 0.04 0.00 0.00 32.58 30.12 2b8t s HIS 195 CO 0.31 -0.51 -0.12 0.21 -2.34 0.00 0.00 174.74 172.30 2b8t s LYS 196 N 2.10 1.64 -0.26 2.88 2.36 -1.26 -4.99 119.74 122.21 2b8t s LYS 196 Ca 0.13 -0.39 -0.00 0.00 -2.55 0.00 0.00 55.97 53.16 2b8t s LYS 196 Cb -0.17 -1.38 0.04 0.00 -1.05 0.00 0.00 37.83 35.28 2b8t s LYS 196 CO 0.12 0.01 -0.07 0.08 1.55 0.00 0.00 175.35 177.05 2b8t s VAL 197 N 0.71 2.65 0.34 4.02 1.01 -1.26 -4.85 120.40 123.02 2b8t s VAL 197 Ca -0.14 -1.28 -0.28 0.00 0.00 0.00 0.00 61.98 60.28 2b8t s VAL 197 Cb -0.16 -2.44 -0.12 0.00 0.00 0.00 0.00 36.38 33.66 2b8t s VAL 197 CO 0.03 0.08 1.32 -2.65 0.00 0.00 0.00 175.10 173.88 2b8t n PRO 198 N 4.59 2.19 -1.99 2.72 -0.02 -1.26 -2.52 135.00 138.71 2b8t n PRO 198 Ca -0.15 0.77 -0.19 0.00 -2.02 0.00 0.00 63.50 61.90 2b8t n PRO 198 Cb 0.45 -2.37 -0.04 0.00 -0.02 0.00 0.00 33.50 31.51 2b8t n PRO 198 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2b8t n ASN 199 N 0.84 -5.43 -4.68 2.55 3.02 -1.26 -1.37 115.26 108.94 2b8t n ASN 199 Ca 0.05 0.21 -0.42 0.00 -0.03 0.00 0.00 54.58 54.39 2b8t n ASN 199 Cb 0.36 -4.54 -0.03 0.00 -0.61 0.00 0.00 39.78 34.96 2b8t n ASN 199 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2b8t s ARG 200 N -4.33 4.15 0.46 3.52 3.52 -1.05 -4.74 118.95 120.49 2b8t s ARG 200 Ca 0.00 2.51 -0.13 0.00 -0.13 0.00 0.00 55.73 57.98 2b8t s ARG 200 Cb 0.00 -3.84 -0.07 0.00 -1.56 0.00 0.00 34.95 29.48 2b8t s ARG 200 CO 0.00 -0.86 0.87 -1.25 -0.81 0.00 0.00 175.30 173.25 2b8t s PRO 201 N 3.48 3.84 -0.19 5.12 0.04 -1.26 -5.08 135.00 140.95 2b8t s PRO 201 Ca 0.81 0.68 -0.03 0.00 0.04 0.00 0.00 61.00 62.50 2b8t s PRO 201 Cb -0.42 -2.27 -0.01 0.00 0.04 0.00 0.00 34.50 31.83 2b8t s PRO 201 CO 0.37 -0.15 -0.05 0.71 0.04 0.00 0.00 177.00 177.91 2b8t s TYR 202 N -2.51 2.95 0.06 0.56 2.02 -1.26 -5.01 117.35 114.16 2b8t s TYR 202 Ca 0.54 -0.71 0.05 0.00 -0.37 0.00 0.00 57.07 56.58 2b8t s TYR 202 Cb -0.10 -2.02 -0.24 0.00 -0.40 0.00 0.00 41.96 39.20 2b8t s TYR 202 CO 0.32 -0.35 1.04 -0.07 -1.57 0.00 0.00 175.55 174.92 2b8t h LEU 203 N 7.50 0.13 -9.43 -1.29 3.38 -2.03 -3.45 115.31 110.12 2b8t h LEU 203 Ca -0.36 -0.17 -0.58 0.00 0.09 0.00 0.00 57.88 56.86 2b8t h LEU 203 Cb 1.18 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.82 2b8t h LEU 203 CO 0.60 1.14 -0.14 0.20 0.09 0.00 0.00 178.44 180.32 2b8t s ASN 204 N -6.68 6.74 0.53 -0.43 0.01 -1.26 -4.98 114.94 108.87 2b8t s ASN 204 Ca -0.03 0.88 0.34 0.00 -0.71 0.00 0.00 52.86 53.35 2b8t s ASN 204 Cb 0.09 -2.29 1.57 0.00 0.41 0.00 0.00 41.25 41.02 2b8t s ASN 204 CO 0.83 0.09 2.03 0.77 -1.51 0.00 0.00 177.10 179.31 2b8t h SER 205 N 6.12 0.00 -0.57 -1.22 4.64 -2.06 -2.54 113.55 117.92 2b8t h SER 205 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2b8t h SER 205 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2b8t h SER 205 CO 0.72 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.22 2b8t n ASN 206 N -2.93 3.62 -0.03 4.97 6.94 -1.26 -4.63 115.26 121.95 2b8t n ASN 206 Ca -0.00 -1.98 -0.13 0.00 -0.02 0.00 0.00 54.58 52.44 2b8t n ASN 206 Cb 0.22 -0.38 -0.09 0.00 -2.36 0.00 0.00 39.78 37.17 2b8t n ASN 206 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2b8t h SER 207 N 3.90 0.19 0.22 0.53 0.02 -1.87 -1.78 113.55 114.76 2b8t h SER 207 Ca 0.00 -0.56 -0.14 0.00 -0.84 0.00 0.00 61.79 60.26 2b8t h SER 207 Cb 0.93 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 2b8t h SER 207 CO 0.00 0.71 -0.51 -0.33 -1.14 0.00 0.00 176.83 175.55 2b8t h GLU 208 N -0.33 0.34 -0.52 3.45 5.08 -1.82 -2.11 114.58 118.67 2b8t h GLU 208 Ca 0.00 -0.20 0.04 0.00 -1.00 0.00 0.00 59.36 58.21 2b8t h GLU 208 Cb 0.67 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.90 2b8t h GLU 208 CO 0.02 0.77 0.27 1.49 -1.00 0.00 0.00 179.01 180.56 2b8t h GLU 209 N 0.26 0.50 -0.40 2.33 4.81 -1.82 -2.16 114.58 118.10 2b8t h GLU 209 Ca 0.01 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 2b8t h GLU 209 Cb 1.00 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.25 2b8t h GLU 209 CO 0.08 0.33 -0.02 0.35 -0.73 0.00 0.00 179.01 179.03 2b8t h PHE 210 N 0.52 0.79 -0.09 0.92 3.57 -1.04 -0.75 116.94 120.86 2b8t h PHE 210 Ca 0.23 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2b8t h PHE 210 Cb 0.13 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 2b8t h PHE 210 CO -0.10 0.81 0.05 0.82 -2.23 0.00 0.00 178.31 177.66 2b8t h ILE 211 N 0.55 1.00 -0.54 1.41 2.04 -1.32 0.43 117.51 121.08 2b8t h ILE 211 Ca 0.11 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.92 2b8t h ILE 211 Cb 0.51 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 2b8t h ILE 211 CO 0.02 0.02 0.29 0.11 0.00 0.00 0.00 178.15 178.59 2b8t h LYS 212 N 0.10 0.75 -0.21 2.37 1.57 -1.37 0.24 116.57 120.02 2b8t h LYS 212 Ca 0.04 -0.09 0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2b8t h LYS 212 Cb 0.00 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 2b8t h LYS 212 CO -0.02 0.59 0.04 0.35 -0.57 0.00 0.00 179.45 179.83 2b8t h PHE 213 N 0.72 0.07 -0.10 -1.35 3.57 -0.92 -2.95 116.94 115.98 2b8t h PHE 213 Ca 0.19 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.56 2b8t h PHE 213 Cb 0.06 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 2b8t h PHE 213 CO -0.01 0.02 -0.57 0.35 -2.23 0.00 0.00 178.31 175.87 2b8t h PHE 214 N 0.12 0.39 -0.76 0.41 3.57 -0.76 -3.14 116.94 116.77 2b8t h PHE 214 Ca 0.09 -0.14 0.17 0.00 3.53 0.00 0.00 57.97 61.62 2b8t h PHE 214 Cb 0.09 -0.07 -0.11 0.00 2.79 0.00 0.00 35.95 38.64 2b8t h PHE 214 CO -0.14 0.80 0.19 -0.22 -2.23 0.00 0.00 178.31 176.71 2b8t h LYS 215 N 0.23 0.26 -6.42 1.11 3.64 -0.77 -3.40 116.57 111.23 2b8t h LYS 215 Ca 0.00 -0.02 -0.54 0.00 -1.27 0.00 0.00 60.65 58.83 2b8t h LYS 215 Cb 1.06 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 32.84 2b8t h LYS 215 CO 0.09 0.17 0.96 -0.80 -2.27 0.00 0.00 179.45 177.61 2b8t s ASN 216 N -5.23 6.67 0.00 4.20 0.01 -1.19 -5.11 114.94 114.29 2b8t s ASN 216 Ca -0.13 2.38 0.20 0.00 -0.71 0.00 0.00 52.86 54.60 2b8t s ASN 216 Cb 0.22 -2.56 0.16 0.00 0.41 0.00 0.00 41.25 39.47 2b8t s ASN 216 CO 0.76 -0.85 1.12 0.29 -1.51 0.00 0.00 177.10 176.91