#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b8t s GLY 12 N 0.00 1.69 0.31 3.28 0.00 -1.08 -4.83 107.32 106.70 2b8t s GLY 12 Ca 0.00 -2.22 -0.19 0.00 0.00 0.00 0.00 44.72 42.31 2b8t s GLY 12 CO 0.00 -1.71 0.82 0.66 0.00 0.00 0.00 173.10 172.87 2b8t s TRP 13 N -2.72 0.00 -0.11 1.90 -2.14 -0.90 -4.79 118.94 110.18 2b8t s TRP 13 Ca 0.63 -0.55 0.02 0.00 2.66 0.00 0.00 56.10 58.87 2b8t s TRP 13 Cb -0.05 0.77 -0.01 0.00 -3.10 0.00 0.00 33.47 31.08 2b8t s TRP 13 CO 0.40 -1.32 -0.19 0.42 -2.66 0.00 0.00 176.95 173.59 2b8t s ILE 14 N -2.85 2.49 -0.12 0.66 1.01 -1.26 -0.75 121.20 120.38 2b8t s ILE 14 Ca 0.15 -0.87 -0.01 0.00 0.00 0.00 0.00 60.65 59.92 2b8t s ILE 14 Cb -0.05 -1.99 -0.02 0.00 0.01 0.00 0.00 42.46 40.40 2b8t s ILE 14 CO 0.08 0.55 -0.08 -1.61 0.00 0.00 0.00 174.94 173.88 2b8t s GLU 15 N 0.31 3.33 -0.16 2.79 2.02 0.85 -1.55 118.70 126.29 2b8t s GLU 15 Ca -0.15 -0.59 0.01 0.00 0.02 0.00 0.00 54.97 54.26 2b8t s GLU 15 Cb -0.17 -2.72 0.02 0.00 0.10 0.00 0.00 34.13 31.36 2b8t s GLU 15 CO 0.07 0.34 -0.16 0.12 0.02 0.00 0.00 175.26 175.65 2b8t s PHE 16 N 0.06 2.33 -0.22 1.61 5.36 0.34 0.03 117.98 127.49 2b8t s PHE 16 Ca -0.02 -1.34 -0.06 0.00 -0.96 0.00 0.00 56.93 54.55 2b8t s PHE 16 Cb -0.14 -1.68 -0.03 0.00 -0.34 0.00 0.00 43.02 40.83 2b8t s PHE 16 CO 0.03 -0.71 0.04 0.42 -1.46 0.00 0.00 175.22 173.54 2b8t s ILE 17 N 1.43 4.18 0.12 3.12 1.01 0.14 -0.49 121.20 130.71 2b8t s ILE 17 Ca 0.05 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.48 2b8t s ILE 17 Cb -0.13 -2.92 -0.00 0.00 0.01 0.00 0.00 42.46 39.42 2b8t s ILE 17 CO -0.11 0.39 0.14 1.07 0.00 0.00 0.00 174.94 176.43 2b8t n THR 18 N 4.51 0.00 0.00 2.92 5.66 0.11 -1.71 114.28 125.77 2b8t n THR 18 Ca -0.17 -0.69 0.00 0.00 -3.05 0.00 0.00 64.05 60.14 2b8t n THR 18 Cb 0.52 0.39 0.00 0.00 -1.55 0.00 0.00 70.33 69.69 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 -0.21 1.01 3.73 1.09 0.00 -1.25 0.01 105.19 109.57 2b8t n GLY 19 Ca 0.01 -2.19 -0.28 0.00 0.00 0.00 0.00 46.02 43.56 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 -1.36 -1.20 -1.48 1.61 -0.04 -1.26 -3.40 135.00 127.86 2b8t n PRO 20 Ca 0.00 -2.02 -0.35 0.00 -0.04 0.00 0.00 63.50 61.09 2b8t n PRO 20 Cb 0.00 -1.29 0.09 0.00 -0.04 0.00 0.00 33.50 32.26 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 -5.78 2.19 -1.23 0.54 -1.94 -1.26 -3.33 119.30 108.49 2b8t s MET 21 Ca 0.72 1.84 0.00 0.00 -1.71 0.00 0.00 55.69 56.55 2b8t s MET 21 Cb -0.02 -1.83 0.00 0.00 2.01 0.00 0.00 34.83 34.99 2b8t s MET 21 CO 0.51 -1.82 0.00 1.19 -0.01 0.00 0.00 175.02 174.89 2b8t n PHE 22 N -2.56 0.00 1.00 -0.03 3.72 -1.26 -4.62 117.46 113.71 2b8t n PHE 22 Ca 0.14 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.65 2b8t n PHE 22 Cb 0.50 -2.17 0.07 0.00 -0.94 0.00 0.00 39.48 36.94 2b8t n PHE 22 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2b8t n ALA 23 N 1.22 4.12 -1.54 4.37 0.00 -1.21 -4.61 120.51 122.86 2b8t n ALA 23 Ca -0.12 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.85 2b8t n ALA 23 Cb 0.39 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.89 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 1.50 0.56 0.22 0.00 0.00 -1.26 -4.74 105.19 101.46 2b8t n GLY 24 Ca 0.05 -0.81 -0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 0.23 -0.42 1.61 1.57 -1.92 -1.54 116.57 116.10 2b8t h LYS 25 Ca 0.00 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.66 2b8t h LYS 25 Cb 0.67 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 2b8t h LYS 25 CO 0.00 0.15 -0.17 1.15 -0.57 0.00 0.00 179.45 180.02 2b8t h THR 26 N 0.24 1.27 -0.98 -0.16 2.02 -1.97 -1.70 112.91 111.62 2b8t h THR 26 Ca 0.29 -1.26 0.02 0.00 0.77 0.00 0.00 66.41 66.23 2b8t h THR 26 Cb 0.42 1.12 -0.05 0.00 -1.74 0.00 0.00 68.15 67.90 2b8t h THR 26 CO -0.38 0.43 0.65 0.00 0.37 0.00 0.00 175.52 176.58 2b8t h ALA 27 N 1.10 1.27 -0.48 6.16 0.00 -1.81 -0.22 119.26 125.28 2b8t h ALA 27 Ca 0.11 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2b8t h ALA 27 Cb 0.67 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2b8t h ALA 27 CO 0.05 0.59 -0.17 1.49 0.00 0.00 0.00 179.25 181.21 2b8t h GLU 28 N 1.29 0.96 -0.46 0.00 4.57 -0.89 -0.41 114.58 119.64 2b8t h GLU 28 Ca 0.37 -0.39 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 2b8t h GLU 28 Cb -0.09 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.44 2b8t h GLU 28 CO -0.10 1.06 0.29 1.25 -1.18 0.00 0.00 179.01 180.33 2b8t h LEU 29 N 0.81 0.54 -0.68 1.64 5.85 -0.94 -2.16 115.31 120.38 2b8t h LEU 29 Ca 0.12 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 2b8t h LEU 29 Cb 0.74 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 2b8t h LEU 29 CO 0.06 0.42 0.38 0.40 -0.34 0.00 0.00 178.44 179.36 2b8t h ILE 30 N 0.61 1.21 -0.41 4.05 2.04 -0.83 -1.42 117.51 122.77 2b8t h ILE 30 Ca 0.17 -0.50 0.07 0.00 1.00 0.00 0.00 64.86 65.60 2b8t h ILE 30 Cb -0.03 0.30 -0.06 0.00 -0.74 0.00 0.00 36.82 36.29 2b8t h ILE 30 CO -0.03 0.22 0.04 -0.09 0.00 0.00 0.00 178.15 178.29 2b8t h ARG 31 N 0.93 0.15 -0.36 2.37 2.43 -0.83 0.64 114.38 119.71 2b8t h ARG 31 Ca 0.24 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.31 2b8t h ARG 31 Cb 0.02 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 2b8t h ARG 31 CO -0.04 0.10 -0.14 0.00 -1.51 0.00 0.00 179.97 178.38 2b8t h ARG 32 N 0.15 0.64 -0.22 0.20 3.08 -0.93 -2.54 114.38 114.76 2b8t h ARG 32 Ca 0.20 -0.21 -0.20 0.00 0.07 0.00 0.00 59.98 59.84 2b8t h ARG 32 Cb 0.27 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2b8t h ARG 32 CO -0.30 0.76 -0.65 -0.07 -1.07 0.00 0.00 179.97 178.64 2b8t h LEU 33 N 0.58 0.93 -1.43 3.04 3.38 -0.92 -3.26 115.31 117.63 2b8t h LEU 33 Ca 0.10 -0.55 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 2b8t h LEU 33 Cb 0.58 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2b8t h LEU 33 CO 0.04 1.34 0.27 0.45 0.09 0.00 0.00 178.44 180.63 2b8t h HIS 34 N 0.59 0.63 0.00 1.13 3.86 -0.67 -2.14 115.15 118.55 2b8t h HIS 34 Ca -0.02 -0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.13 2b8t h HIS 34 Cb 1.26 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 29.52 2b8t h HIS 34 CO 0.08 0.44 -0.31 0.07 0.86 0.00 0.00 177.93 179.07 2b8t h ARG 35 N 0.66 0.00 -0.62 2.45 0.11 -1.50 -2.38 114.38 113.10 2b8t h ARG 35 Ca 0.17 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.20 2b8t h ARG 35 Cb 0.01 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.06 2b8t h ARG 35 CO -0.03 0.31 0.20 -0.07 0.10 0.00 0.00 179.97 180.48 2b8t h LEU 36 N 0.00 0.87 -1.52 0.08 3.38 -1.45 -3.09 115.31 113.58 2b8t h LEU 36 Ca -0.00 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2b8t h LEU 36 Cb 0.55 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2b8t h LEU 36 CO 0.04 0.81 0.28 -0.33 0.09 0.00 0.00 178.44 179.33 2b8t h GLU 37 N 0.91 0.60 0.00 1.13 5.08 -1.30 0.11 114.58 121.11 2b8t h GLU 37 Ca 0.21 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.45 2b8t h GLU 37 Cb 0.25 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 2b8t h GLU 37 CO -0.01 0.42 -0.34 1.88 -1.00 0.00 0.00 179.01 179.96 2b8t h TYR 38 N 0.62 0.00 -0.28 4.33 0.05 -1.54 -1.79 116.97 118.36 2b8t h TYR 38 Ca 0.16 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.94 2b8t h TYR 38 Cb -0.04 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.70 2b8t h TYR 38 CO 0.00 0.34 0.00 0.00 -1.05 0.00 0.00 178.16 177.45 2b8t n ALA 39 N -2.31 2.47 -3.78 3.88 0.00 -0.96 -4.95 120.51 114.86 2b8t n ALA 39 Ca -0.01 -0.76 -0.25 0.00 0.00 0.00 0.00 53.44 52.42 2b8t n ALA 39 Cb 0.46 -0.97 0.04 0.00 0.00 0.00 0.00 19.45 18.98 2b8t n ALA 39 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2b8t n ASP 40 N 0.95 -3.28 -4.68 0.00 2.03 -0.67 -4.98 116.55 105.92 2b8t n ASP 40 Ca 0.18 -0.77 -0.37 0.00 0.52 0.00 0.00 54.79 54.35 2b8t n ASP 40 Cb 0.48 -4.11 -0.08 0.00 -0.72 0.00 0.00 41.12 36.68 2b8t n ASP 40 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2b8t s VAL 41 N -3.46 5.29 0.27 5.18 1.01 0.30 -5.00 120.40 123.99 2b8t s VAL 41 Ca 0.35 0.45 -0.29 0.00 0.00 0.00 0.00 61.98 62.49 2b8t s VAL 41 Cb -0.17 -3.61 -0.09 0.00 0.00 0.00 0.00 36.38 32.51 2b8t s VAL 41 CO 0.81 0.32 0.96 -0.54 0.00 0.00 0.00 175.10 176.64 2b8t s LYS 42 N 1.05 4.74 0.12 2.72 -0.14 -1.26 -4.26 119.74 122.70 2b8t s LYS 42 Ca 0.13 1.47 -0.01 0.00 -1.36 0.00 0.00 55.97 56.20 2b8t s LYS 42 Cb -0.14 -3.10 -0.04 0.00 -1.68 0.00 0.00 37.83 32.87 2b8t s LYS 42 CO 0.05 0.40 0.04 1.52 -0.76 0.00 0.00 175.35 176.61 2b8t s TYR 43 N -1.33 0.82 -0.09 3.18 -0.85 -1.26 -3.09 117.35 114.73 2b8t s TYR 43 Ca 0.45 -1.21 -0.04 0.00 -0.52 0.00 0.00 57.07 55.75 2b8t s TYR 43 Cb -0.24 -0.47 0.04 0.00 0.38 0.00 0.00 41.96 41.67 2b8t s TYR 43 CO 0.30 -0.50 0.19 -1.17 -1.52 0.00 0.00 175.55 172.86 2b8t s LEU 44 N -3.03 0.47 -0.14 -3.49 2.96 -0.14 -4.98 118.68 110.33 2b8t s LEU 44 Ca 0.22 0.41 -0.06 0.00 -0.22 0.00 0.00 54.13 54.48 2b8t s LEU 44 Cb 0.08 0.52 -0.04 0.00 0.50 0.00 0.00 46.19 47.25 2b8t s LEU 44 CO 0.00 -0.17 0.07 -0.69 -1.32 0.00 0.00 176.35 174.25 2b8t s VAL 45 N 1.38 4.92 0.19 1.68 1.01 -1.26 -0.20 120.40 128.12 2b8t s VAL 45 Ca -0.08 -0.00 0.10 0.00 0.00 0.00 0.00 61.98 62.00 2b8t s VAL 45 Cb -0.11 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2b8t s VAL 45 CO -0.07 0.55 -0.17 -0.36 0.00 0.00 0.00 175.10 175.04 2b8t s PHE 46 N -0.39 2.45 -0.07 5.22 0.08 0.11 -0.46 117.98 124.92 2b8t s PHE 46 Ca 0.10 -0.30 -0.07 0.00 0.12 0.00 0.00 56.93 56.78 2b8t s PHE 46 Cb -0.12 -1.20 0.02 0.00 -0.57 0.00 0.00 43.02 41.15 2b8t s PHE 46 CO 0.02 0.51 0.20 0.21 -0.10 0.00 0.00 175.22 176.06 2b8t s LYS 47 N -2.78 0.26 0.28 0.44 2.20 -0.39 -1.67 119.74 118.08 2b8t s LYS 47 Ca 0.23 0.23 -0.29 0.00 -0.36 0.00 0.00 55.97 55.78 2b8t s LYS 47 Cb -0.08 0.12 -0.09 0.00 -1.51 0.00 0.00 37.83 36.27 2b8t s LYS 47 CO 0.12 -0.04 1.08 -1.25 -0.36 0.00 0.00 175.35 174.91 2b8t s PRO 48 N -0.01 4.65 -0.43 4.03 0.04 -1.26 -1.19 135.00 140.83 2b8t s PRO 48 Ca -0.01 1.77 -0.19 0.00 0.04 0.00 0.00 61.00 62.60 2b8t s PRO 48 Cb -0.02 -3.18 0.02 0.00 0.04 0.00 0.00 34.50 31.37 2b8t s PRO 48 CO 0.00 0.23 0.56 0.21 0.04 0.00 0.00 177.00 178.05 2b8t s LYS 49 N -1.46 3.21 0.35 4.56 2.20 0.30 -4.81 119.74 124.09 2b8t s LYS 49 Ca 0.45 -0.52 -0.28 0.00 -0.36 0.00 0.00 55.97 55.25 2b8t s LYS 49 Cb -0.31 -3.96 -0.11 0.00 -1.51 0.00 0.00 37.83 31.94 2b8t s LYS 49 CO 0.40 -0.95 1.43 0.42 -0.36 0.00 0.00 175.35 176.29 2b8t s ILE 50 N 2.55 2.30 -0.49 5.43 1.01 -1.26 -4.71 121.20 126.03 2b8t s ILE 50 Ca 0.18 0.29 -0.28 0.00 0.00 0.00 0.00 60.65 60.85 2b8t s ILE 50 Cb -0.15 -3.19 -0.01 0.00 0.01 0.00 0.00 42.46 39.12 2b8t s ILE 50 CO 0.17 0.07 1.69 -0.62 0.00 0.00 0.00 174.94 176.25 2b8t s ASP 51 N -0.20 5.77 0.30 3.58 -1.08 -1.26 -4.88 116.67 118.90 2b8t s ASP 51 Ca 0.52 0.67 0.24 0.00 -0.52 0.00 0.00 52.55 53.46 2b8t s ASP 51 Cb -0.44 -2.53 1.08 0.00 -1.46 0.00 0.00 42.92 39.56 2b8t s ASP 51 CO 0.58 -1.92 1.73 0.71 0.52 0.00 0.00 175.17 176.79 2b8t h THR 52 N 6.70 0.00 0.00 1.71 1.35 -1.95 -1.66 112.91 119.07 2b8t h THR 52 Ca -0.29 -0.20 -0.07 0.00 -0.55 0.00 0.00 66.41 65.30 2b8t h THR 52 Cb 1.14 0.91 -0.01 0.00 -1.73 0.00 0.00 68.15 68.46 2b8t h THR 52 CO 1.14 0.00 -0.34 0.03 -0.25 0.00 0.00 175.52 176.10 2b8t h ARG 53 N 0.00 0.00 -0.01 4.72 3.08 -2.02 -2.72 114.38 117.43 2b8t h ARG 53 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2b8t h ARG 53 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 2b8t h ARG 53 CO 0.00 0.34 -0.22 -1.13 -1.07 0.00 0.00 179.97 177.89 2b8t n SER 54 N -3.77 1.15 -4.69 7.04 3.41 -0.63 -4.84 113.62 111.29 2b8t n SER 54 Ca -0.01 -1.02 -0.41 0.00 -0.26 0.00 0.00 58.87 57.18 2b8t n SER 54 Cb 0.43 0.12 -0.04 0.00 -0.26 0.00 0.00 64.21 64.45 2b8t n SER 54 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2b8t s ILE 55 N -2.41 4.96 0.08 -1.33 1.01 -1.03 -4.99 121.20 117.48 2b8t s ILE 55 Ca 0.26 1.57 -0.35 0.00 0.00 0.00 0.00 60.65 62.13 2b8t s ILE 55 Cb 0.19 -4.10 -0.17 0.00 0.01 0.00 0.00 42.46 38.39 2b8t s ILE 55 CO 0.49 0.14 1.58 -0.09 0.00 0.00 0.00 174.94 177.06 2b8t h ARG 56 N 7.05 -0.98 -4.26 2.79 9.65 -1.86 -3.40 114.38 123.38 2b8t h ARG 56 Ca -0.35 0.07 -0.60 0.00 -1.10 0.00 0.00 59.98 57.99 2b8t h ARG 56 Cb 1.17 0.22 -0.38 0.00 -1.39 0.00 0.00 29.97 29.59 2b8t h ARG 56 CO 0.79 -0.65 -0.78 1.21 2.80 0.00 0.00 179.97 183.33 2b8t s ASN 57 N -4.35 3.75 0.07 -3.80 2.47 -1.26 -5.11 114.94 106.70 2b8t s ASN 57 Ca -0.18 -1.14 -0.30 0.00 0.42 0.00 0.00 52.86 51.66 2b8t s ASN 57 Cb 0.04 -1.11 -0.06 0.00 -1.45 0.00 0.00 41.25 38.68 2b8t s ASN 57 CO 0.61 -0.24 1.13 -0.63 -3.72 0.00 0.00 177.10 174.25 2b8t s ILE 58 N 1.45 4.16 -0.08 -5.21 1.01 -1.26 -4.91 121.20 116.37 2b8t s ILE 58 Ca -0.05 1.61 0.04 0.00 0.00 0.00 0.00 60.65 62.25 2b8t s ILE 58 Cb -0.19 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.24 2b8t s ILE 58 CO -0.06 0.16 -0.19 -1.10 0.00 0.00 0.00 174.94 173.74 2b8t s GLN 59 N 0.75 2.78 -0.34 2.79 -0.21 -1.26 -5.12 119.66 119.04 2b8t s GLN 59 Ca 0.55 -0.80 -0.18 0.00 0.02 0.00 0.00 55.36 54.96 2b8t s GLN 59 Cb -0.28 -2.34 -0.01 0.00 1.00 0.00 0.00 33.01 31.39 2b8t s GLN 59 CO 0.30 0.39 0.51 -1.12 -2.12 0.00 0.00 175.29 173.25 2b8t s SER 60 N -0.14 6.32 -0.24 5.90 0.01 -1.26 -5.02 113.70 119.27 2b8t s SER 60 Ca -0.03 0.01 -0.23 0.00 1.31 0.00 0.00 55.95 57.01 2b8t s SER 60 Cb -0.14 -2.27 0.06 0.00 0.21 0.00 0.00 66.02 63.89 2b8t s SER 60 CO 0.04 -0.46 0.67 -0.13 0.41 0.00 0.00 173.24 173.76 2b8t s ARG 61 N 2.38 0.79 0.00 12.44 0.52 -1.26 -5.08 118.95 128.74 2b8t s ARG 61 Ca 0.19 0.89 0.00 0.00 -0.52 0.00 0.00 55.73 56.29 2b8t s ARG 61 Cb -0.15 0.38 0.00 0.00 0.52 0.00 0.00 34.95 35.70 2b8t s ARG 61 CO 0.13 -0.10 0.21 0.25 0.02 0.00 0.00 175.30 175.80 2b8t n THR 62 N 2.64 0.00 -1.73 0.02 -2.24 -1.26 -5.08 114.28 106.63 2b8t n THR 62 Ca -0.14 -0.33 -0.42 0.00 -2.27 0.00 0.00 64.05 60.89 2b8t n THR 62 Cb 0.55 1.21 -0.02 0.00 -2.10 0.00 0.00 70.33 69.98 2b8t n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b8t n GLY 63 N 0.25 1.22 3.34 3.38 0.00 -1.26 -5.01 105.19 107.10 2b8t n GLY 63 Ca 0.00 0.46 -0.15 0.00 0.00 0.00 0.00 46.02 46.33 2b8t n GLY 63 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2b8t s THR 64 N -0.11 0.03 -1.04 2.61 -1.32 -1.26 -5.05 115.64 109.51 2b8t s THR 64 Ca 0.64 -0.27 0.25 0.00 -1.21 0.00 0.00 61.69 61.10 2b8t s THR 64 Cb -0.52 -0.74 0.02 0.00 -1.51 0.00 0.00 72.50 69.75 2b8t s THR 64 CO 0.50 -0.15 1.42 -1.54 -2.21 0.00 0.00 174.62 172.64 2b8t n SER 65 N 1.37 0.53 -3.67 8.08 3.41 -1.26 -4.84 113.62 117.25 2b8t n SER 65 Ca -0.20 -0.29 -0.25 0.00 -0.26 0.00 0.00 58.87 57.87 2b8t n SER 65 Cb 0.56 0.25 -0.17 0.00 -0.26 0.00 0.00 64.21 64.59 2b8t n SER 65 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2b8t s LEU 66 N -2.97 0.54 0.13 1.04 2.96 -1.26 -5.11 118.68 114.01 2b8t s LEU 66 Ca 0.12 -0.51 -0.34 0.00 -0.22 0.00 0.00 54.13 53.18 2b8t s LEU 66 Cb 0.18 -0.33 -0.14 0.00 0.50 0.00 0.00 46.19 46.39 2b8t s LEU 66 CO 0.69 -0.31 1.57 -2.65 -1.32 0.00 0.00 176.35 174.33 2b8t n PRO 67 N 5.21 2.02 -3.61 0.98 -0.02 -1.26 -5.00 135.00 133.33 2b8t n PRO 67 Ca -0.07 0.73 -0.13 0.00 -2.02 0.00 0.00 63.50 62.01 2b8t n PRO 67 Cb 0.49 -2.49 -0.06 0.00 -0.02 0.00 0.00 33.50 31.42 2b8t n PRO 67 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2b8t s SER 68 N 1.06 -0.38 -0.24 2.55 1.04 -1.26 -4.65 113.70 111.82 2b8t s SER 68 Ca 0.80 0.10 -0.23 0.00 0.48 0.00 0.00 55.95 57.11 2b8t s SER 68 Cb -0.72 0.47 -0.01 0.00 0.10 0.00 0.00 66.02 65.86 2b8t s SER 68 CO 0.40 -0.70 0.75 -0.69 0.98 0.00 0.00 173.24 173.97 2b8t s VAL 69 N -2.48 4.90 0.15 5.02 1.01 0.39 -4.85 120.40 124.55 2b8t s VAL 69 Ca -0.05 1.40 -0.30 0.00 0.00 0.00 0.00 61.98 63.02 2b8t s VAL 69 Cb -0.01 -4.04 -0.07 0.00 0.00 0.00 0.00 36.38 32.26 2b8t s VAL 69 CO -0.02 -0.02 1.16 -1.61 0.00 0.00 0.00 175.10 174.61 2b8t s GLU 70 N 2.60 4.51 0.04 2.72 2.02 -1.26 -1.26 118.70 128.07 2b8t s GLU 70 Ca 0.32 1.79 0.06 0.00 0.02 0.00 0.00 54.97 57.16 2b8t s GLU 70 Cb -0.15 -3.28 -0.02 0.00 0.10 0.00 0.00 34.13 30.78 2b8t s GLU 70 CO 0.08 -0.07 -0.16 0.14 0.02 0.00 0.00 175.26 175.27 2b8t s VAL 71 N 0.14 1.31 0.18 2.63 -7.23 -0.33 -4.91 120.40 112.18 2b8t s VAL 71 Ca 0.53 -1.03 0.09 0.00 -1.81 0.00 0.00 61.98 59.76 2b8t s VAL 71 Cb -0.31 -1.16 -0.11 0.00 0.56 0.00 0.00 36.38 35.37 2b8t s VAL 71 CO 0.34 0.11 1.45 -0.33 -0.31 0.00 0.00 175.10 176.36 2b8t h GLU 72 N 5.00 0.00 -3.59 4.82 5.08 -1.88 0.86 114.58 124.87 2b8t h GLU 72 Ca -0.39 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.89 2b8t h GLU 72 Cb 1.17 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.27 2b8t h GLU 72 CO 0.44 0.79 -0.28 -1.54 -1.00 0.00 0.00 179.01 177.42 2b8t s SER 73 N -6.75 -0.01 0.23 1.42 1.04 -1.26 -4.71 113.70 103.65 2b8t s SER 73 Ca 0.00 -0.46 -0.07 0.00 0.48 0.00 0.00 55.95 55.91 2b8t s SER 73 Cb 0.11 0.37 0.32 0.00 0.10 0.00 0.00 66.02 66.91 2b8t s SER 73 CO 0.79 -0.71 1.82 0.00 0.98 0.00 0.00 173.24 176.12 2b8t h ALA 74 N 2.84 1.07 -0.05 5.32 0.00 -1.90 -2.29 119.26 124.25 2b8t h ALA 74 Ca -0.33 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.60 2b8t h ALA 74 Cb 1.21 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 2b8t h ALA 74 CO 0.51 0.14 0.08 -1.35 0.00 0.00 0.00 179.25 178.63 2b8t h PRO 75 N 0.81 0.00 0.00 0.00 0.11 -1.98 -2.11 132.00 128.83 2b8t h PRO 75 Ca 0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.46 2b8t h PRO 75 Cb 0.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.34 2b8t h PRO 75 CO -0.20 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 178.52 2b8t h GLU 76 N 0.00 0.00 -0.32 1.05 4.39 -1.84 -1.78 114.58 116.07 2b8t h GLU 76 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2b8t h GLU 76 Cb 0.18 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.81 2b8t h GLU 76 CO -0.00 0.00 0.20 0.82 -1.16 0.00 0.00 179.01 178.87 2b8t h ILE 77 N 0.00 1.10 -0.33 3.13 2.04 -1.53 -0.63 117.51 121.28 2b8t h ILE 77 Ca 0.00 -0.21 -0.11 0.00 1.00 0.00 0.00 64.86 65.54 2b8t h ILE 77 Cb 0.22 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2b8t h ILE 77 CO 0.00 0.10 -0.24 -0.07 0.00 0.00 0.00 178.15 177.93 2b8t h LEU 78 N 0.42 0.67 -0.66 1.44 3.38 -1.51 -2.00 115.31 117.06 2b8t h LEU 78 Ca 0.12 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 2b8t h LEU 78 Cb -0.02 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2b8t h LEU 78 CO -0.02 0.89 0.14 0.78 0.09 0.00 0.00 178.44 180.32 2b8t h ASN 79 N 0.58 1.02 -0.56 -0.43 2.35 -1.37 -1.96 115.58 115.21 2b8t h ASN 79 Ca 0.08 -0.25 -0.00 0.00 -0.55 0.00 0.00 56.30 55.58 2b8t h ASN 79 Cb 0.72 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.79 2b8t h ASN 79 CO 0.06 1.00 0.33 0.22 -1.65 0.00 0.00 177.43 177.39 2b8t h TYR 80 N 0.99 0.74 0.00 1.19 3.20 -0.81 -1.67 116.97 120.62 2b8t h TYR 80 Ca 0.20 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.02 2b8t h TYR 80 Cb 0.40 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 2b8t h TYR 80 CO 0.03 0.52 -0.24 0.82 -1.64 0.00 0.00 178.16 177.64 2b8t h ILE 81 N 0.75 1.07 0.00 1.81 2.04 -1.21 -1.28 117.51 120.69 2b8t h ILE 81 Ca 0.20 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 65.19 2b8t h ILE 81 Cb -0.00 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 2b8t h ILE 81 CO -0.04 0.24 -0.13 0.23 0.00 0.00 0.00 178.15 178.46 2b8t n MET 82 N -4.10 0.15 -2.17 2.37 2.81 -0.75 -4.81 117.12 110.62 2b8t n MET 82 Ca -0.02 0.10 -0.26 0.00 -1.81 0.00 0.00 57.70 55.71 2b8t n MET 82 Cb 0.31 -1.65 0.08 0.00 -0.71 0.00 0.00 33.22 31.24 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 -3.81 4.64 0.53 7.83 1.04 -0.48 -4.99 113.70 118.46 2b8t s SER 83 Ca 0.11 0.43 0.32 0.00 0.48 0.00 0.00 55.95 57.29 2b8t s SER 83 Cb 0.15 -1.01 1.30 0.00 0.10 0.00 0.00 66.02 66.57 2b8t s SER 83 CO 0.60 -1.72 1.97 0.78 0.98 0.00 0.00 173.24 175.84 2b8t h ASN 84 N -0.71 0.00 0.83 7.02 4.21 -1.92 -3.03 115.58 121.98 2b8t h ASN 84 Ca -0.44 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.07 2b8t h ASN 84 Cb 1.31 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.51 2b8t h ASN 84 CO 0.58 0.05 0.00 0.28 -1.29 0.00 0.00 177.43 177.05 2b8t h SER 85 N 0.00 0.00 -3.37 5.81 0.02 -1.94 -3.44 113.55 110.62 2b8t h SER 85 Ca -0.00 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 2b8t h SER 85 Cb 0.54 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.00 2b8t h SER 85 CO 0.01 0.00 0.04 0.12 -1.14 0.00 0.00 176.83 175.86 2b8t s PHE 86 N -3.66 3.48 -0.12 3.45 5.36 -1.15 -5.04 117.98 120.30 2b8t s PHE 86 Ca 0.01 1.02 -0.30 0.00 -0.96 0.00 0.00 56.93 56.71 2b8t s PHE 86 Cb 0.09 -2.74 -0.02 0.00 -0.34 0.00 0.00 43.02 40.02 2b8t s PHE 86 CO 0.49 0.00 1.17 1.21 -1.46 0.00 0.00 175.22 176.64 2b8t s ASN 87 N 0.91 7.05 0.13 6.13 3.84 -1.26 -4.93 114.94 126.81 2b8t s ASN 87 Ca 0.31 1.68 0.18 0.00 0.21 0.00 0.00 52.86 55.24 2b8t s ASN 87 Cb -0.16 -2.55 0.76 0.00 -0.55 0.00 0.00 41.25 38.75 2b8t s ASN 87 CO 0.13 -0.63 1.54 0.47 -2.79 0.00 0.00 177.10 175.82 2b8t n ASP 88 N 5.74 0.32 -0.16 -4.21 9.92 -1.26 -1.95 116.55 124.94 2b8t n ASP 88 Ca 0.12 0.59 0.13 0.00 -0.53 0.00 0.00 54.79 55.09 2b8t n ASP 88 Cb 0.46 -0.65 0.35 0.00 -0.64 0.00 0.00 41.12 40.64 2b8t n ASP 88 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2b8t n GLU 89 N -1.87 0.57 -2.17 -1.24 1.02 -1.26 -4.88 120.64 110.82 2b8t n GLU 89 Ca 0.02 -0.33 -0.42 0.00 -0.02 0.00 0.00 57.16 56.41 2b8t n GLU 89 Cb 0.17 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.07 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 -2.65 3.82 -0.10 2.62 2.01 -0.82 -4.61 115.64 115.90 2b8t s THR 90 Ca 0.21 1.02 0.01 0.00 0.31 0.00 0.00 61.69 63.24 2b8t s THR 90 Cb 0.19 -3.66 0.00 0.00 0.01 0.00 0.00 72.50 69.04 2b8t s THR 90 CO 0.57 -0.08 0.35 0.29 -0.69 0.00 0.00 174.62 175.06 2b8t n LYS 91 N 6.76 1.94 -5.22 4.92 4.76 -1.18 -4.99 118.16 125.15 2b8t n LYS 91 Ca 0.16 -0.36 -0.32 0.00 -2.87 0.00 0.00 58.31 54.92 2b8t n LYS 91 Cb 0.43 -0.85 -0.17 0.00 -1.84 0.00 0.00 35.03 32.61 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 -0.46 2.07 -0.24 -0.18 1.01 -1.21 -1.58 120.40 119.80 2b8t s VAL 92 Ca 0.01 -1.02 -0.03 0.00 0.00 0.00 0.00 61.98 60.95 2b8t s VAL 92 Cb 0.01 -1.78 0.02 0.00 0.00 0.00 0.00 36.38 34.62 2b8t s VAL 92 CO 0.02 0.56 -0.05 -0.63 0.00 0.00 0.00 175.10 175.00 2b8t s ILE 93 N 0.34 3.05 0.04 2.22 -1.09 0.16 -0.97 121.20 124.96 2b8t s ILE 93 Ca -0.19 -0.88 -0.09 0.00 -2.23 0.00 0.00 60.65 57.27 2b8t s ILE 93 Cb -0.18 -2.51 -0.05 0.00 -1.58 0.00 0.00 42.46 38.14 2b8t s ILE 93 CO 0.09 0.25 0.34 -0.83 -1.23 0.00 0.00 174.94 173.55 2b8t s GLY 94 N 1.37 2.31 -0.11 6.18 0.00 0.72 -0.35 107.32 117.44 2b8t s GLY 94 Ca 0.02 -0.46 -0.03 0.00 0.00 0.00 0.00 44.72 44.25 2b8t s GLY 94 CO -0.04 -0.24 0.06 -0.42 0.00 0.00 0.00 173.10 172.46 2b8t s ILE 95 N -1.32 0.02 0.18 0.90 1.01 0.37 0.07 121.20 122.42 2b8t s ILE 95 Ca 0.29 0.06 0.04 0.00 0.00 0.00 0.00 60.65 61.05 2b8t s ILE 95 Cb -0.14 -0.45 -0.04 0.00 0.01 0.00 0.00 42.46 41.84 2b8t s ILE 95 CO 0.16 -0.04 0.22 -0.62 0.00 0.00 0.00 174.94 174.67 2b8t s ASP 96 N 2.10 5.89 -1.52 3.58 2.15 -0.67 0.40 116.67 128.61 2b8t s ASP 96 Ca 0.03 -0.02 -0.09 0.00 0.43 0.00 0.00 52.55 52.90 2b8t s ASP 96 Cb -0.14 -1.64 0.07 0.00 -0.30 0.00 0.00 42.92 40.90 2b8t s ASP 96 CO -0.06 0.03 0.69 -0.62 -0.17 0.00 0.00 175.17 175.04 2b8t n GLU 97 N -0.64 -3.92 0.31 4.34 -0.58 -0.72 -4.24 120.64 115.20 2b8t n GLU 97 Ca -0.08 0.46 0.18 0.00 -0.42 0.00 0.00 57.16 57.30 2b8t n GLU 97 Cb 0.55 -4.99 1.00 0.00 -0.57 0.00 0.00 31.44 27.43 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 -1.79 0.33 0.00 2.62 3.04 -1.40 -2.75 116.25 116.30 2b8t h VAL 98 Ca -0.61 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.00 2b8t h VAL 98 Cb 1.38 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.71 2b8t h VAL 98 CO 0.68 0.01 0.00 0.06 -1.01 0.00 0.00 177.57 177.31 2b8t h GLN 99 N 0.00 0.00 -0.00 4.17 -0.00 -1.85 -1.58 115.11 115.85 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 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.54 2b8t h GLN 99 CO 0.00 0.00 -0.17 1.19 -0.00 0.00 0.00 178.83 179.86 2b8t n PHE 100 N -2.56 0.00 -1.42 0.06 3.72 -1.04 -4.34 117.46 111.89 2b8t n PHE 100 Ca -0.00 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.10 2b8t n PHE 100 Cb 0.14 -0.40 0.13 0.00 -0.94 0.00 0.00 39.48 38.42 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 -2.96 2.50 0.00 1.38 0.08 -0.60 -4.94 117.98 113.44 2b8t s PHE 101 Ca 0.14 1.03 0.00 0.00 0.12 0.00 0.00 56.93 58.23 2b8t s PHE 101 Cb 0.19 -3.25 0.00 0.00 -0.57 0.00 0.00 43.02 39.39 2b8t s PHE 101 CO 0.58 -2.29 0.00 -0.40 -0.10 0.00 0.00 175.22 173.01 2b8t n ASP 102 N -3.76 0.00 0.01 1.36 5.68 -1.26 -4.32 116.55 114.26 2b8t n ASP 102 Ca 0.06 -0.82 0.21 0.00 -0.50 0.00 0.00 54.79 53.75 2b8t n ASP 102 Cb 0.57 0.00 0.72 0.00 -1.14 0.00 0.00 41.12 41.27 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 0.00 -1.12 3.58 -1.93 -2.72 116.42 114.22 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 0.14 0.03 -2.88 0.00 0.00 179.24 176.53 2b8t h ARG 104 N 0.00 0.00 -0.11 0.28 3.08 -1.99 -2.36 114.38 113.28 2b8t h ARG 104 Ca 0.25 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.24 2b8t h ARG 104 Cb 1.09 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 2b8t h ARG 104 CO -0.00 0.00 -0.22 0.97 -1.07 0.00 0.00 179.97 179.64 2b8t h ILE 105 N 0.00 1.21 0.28 2.04 6.09 -1.85 -3.12 117.51 122.17 2b8t h ILE 105 Ca 0.00 -0.99 -0.01 0.00 -1.37 0.00 0.00 64.86 62.48 2b8t h ILE 105 Cb 0.28 1.38 0.00 0.00 0.47 0.00 0.00 36.82 38.95 2b8t h ILE 105 CO 0.00 0.30 -0.14 0.00 -3.07 0.00 0.00 178.15 175.24 2b8t h GLU 107 N -0.39 0.92 0.22 0.00 4.81 -1.76 -1.32 114.58 117.06 2b8t h GLU 107 Ca -0.04 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2b8t h GLU 107 Cb 0.30 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 2b8t h GLU 107 CO 0.06 0.61 -0.26 0.28 -0.73 0.00 0.00 179.01 178.97 2b8t h VAL 108 N 0.94 0.45 -0.60 0.32 2.07 -1.43 -1.06 116.25 116.95 2b8t h VAL 108 Ca 0.26 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.82 2b8t h VAL 108 Cb -0.10 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.07 2b8t h VAL 108 CO -0.06 0.00 0.34 0.00 0.02 0.00 0.00 177.57 177.87 2b8t h ALA 109 N 0.14 0.78 -0.00 1.67 0.00 -0.80 -1.86 119.26 119.19 2b8t h ALA 109 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2b8t h ALA 109 Cb 0.50 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2b8t h ALA 109 CO -0.08 0.04 -0.03 -0.91 0.00 0.00 0.00 179.25 178.28 2b8t h ASN 110 N 0.66 -0.08 -0.87 0.00 2.35 -1.09 -1.52 115.58 115.03 2b8t h ASN 110 Ca 0.25 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 56.04 2b8t h ASN 110 Cb 0.09 0.04 -0.05 0.00 0.05 0.00 0.00 38.32 38.45 2b8t h ASN 110 CO -0.14 -0.04 0.57 0.40 -1.65 0.00 0.00 177.43 176.57 2b8t h ILE 111 N -0.05 1.18 0.18 2.81 2.04 -1.04 0.25 117.51 122.89 2b8t h ILE 111 Ca 0.01 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.49 2b8t h ILE 111 Cb 0.07 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.08 2b8t h ILE 111 CO -0.03 0.21 -0.19 -0.07 0.00 0.00 0.00 178.15 178.07 2b8t h LEU 112 N 1.13 -0.50 -0.80 1.44 3.38 -1.19 -1.60 115.31 117.17 2b8t h LEU 112 Ca 0.33 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.39 2b8t h LEU 112 Cb -0.06 0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2b8t h LEU 112 CO -0.09 -0.28 0.51 0.00 0.09 0.00 0.00 178.44 178.67 2b8t h ALA 113 N 0.37 1.07 0.00 1.53 0.00 -0.84 -1.46 119.26 119.92 2b8t h ALA 113 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2b8t h ALA 113 Cb 0.38 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2b8t h ALA 113 CO -0.05 0.30 0.00 0.93 0.00 0.00 0.00 179.25 180.43 2b8t h GLU 114 N 0.97 0.00 -0.38 0.00 5.08 -0.27 -2.82 114.58 117.16 2b8t h GLU 114 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2b8t h GLU 114 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2b8t h GLU 114 CO -0.13 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 177.97 2b8t n ASN 115 N -3.02 3.99 0.00 1.42 4.13 -0.61 -4.88 115.26 116.30 2b8t n ASN 115 Ca -0.01 -2.67 0.00 0.00 1.68 0.00 0.00 54.58 53.58 2b8t n ASN 115 Cb 0.19 -0.49 0.00 0.00 -1.54 0.00 0.00 39.78 37.94 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 0.13 0.47 3.81 7.41 0.00 -1.10 -4.94 105.19 110.96 2b8t n GLY 116 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.00 3.71 -0.21 1.61 0.40 -0.85 -4.22 117.98 116.41 2b8t s PHE 117 Ca 0.00 1.43 -0.19 0.00 -0.60 0.00 0.00 56.93 57.57 2b8t s PHE 117 Cb 0.00 -2.64 -0.03 0.00 0.51 0.00 0.00 43.02 40.86 2b8t s PHE 117 CO 0.00 0.38 0.56 0.08 0.70 0.00 0.00 175.22 176.94 2b8t s VAL 118 N -1.43 5.07 -0.26 -0.44 1.01 -0.61 -2.12 120.40 121.62 2b8t s VAL 118 Ca 0.41 1.03 -0.05 0.00 0.00 0.00 0.00 61.98 63.37 2b8t s VAL 118 Cb -0.18 -3.88 -0.00 0.00 0.00 0.00 0.00 36.38 32.32 2b8t s VAL 118 CO 0.22 0.14 0.03 -0.69 0.00 0.00 0.00 175.10 174.80 2b8t s VAL 119 N 1.81 3.71 -0.31 2.92 1.01 0.07 -0.66 120.40 128.95 2b8t s VAL 119 Ca 0.25 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.58 2b8t s VAL 119 Cb -0.16 -2.82 0.03 0.00 0.00 0.00 0.00 36.38 33.43 2b8t s VAL 119 CO 0.10 0.24 0.08 -0.63 0.00 0.00 0.00 175.10 174.88 2b8t s ILE 120 N 1.49 3.75 -0.10 2.22 1.01 0.53 -0.10 121.20 130.00 2b8t s ILE 120 Ca 0.04 -0.97 0.01 0.00 0.00 0.00 0.00 60.65 59.73 2b8t s ILE 120 Cb -0.16 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.25 2b8t s ILE 120 CO 0.00 -0.05 -0.13 -0.63 0.00 0.00 0.00 174.94 174.13 2b8t s ILE 121 N 1.43 3.11 -0.01 2.92 1.01 0.10 -0.48 121.20 129.28 2b8t s ILE 121 Ca -0.00 -0.67 0.07 0.00 0.00 0.00 0.00 60.65 60.05 2b8t s ILE 121 Cb -0.18 -2.27 -0.02 0.00 0.01 0.00 0.00 42.46 40.00 2b8t s ILE 121 CO 0.02 0.55 -0.22 -0.55 0.00 0.00 0.00 174.94 174.74 2b8t s SER 122 N -0.12 2.57 -0.23 3.58 0.15 0.16 0.24 113.70 120.05 2b8t s SER 122 Ca -0.01 -0.40 -0.37 0.00 0.70 0.00 0.00 55.95 55.87 2b8t s SER 122 Cb -0.14 -0.28 0.15 0.00 -1.71 0.00 0.00 66.02 64.04 2b8t s SER 122 CO 0.03 0.27 1.39 -0.83 1.20 0.00 0.00 173.24 175.30 2b8t s GLY 123 N -0.54 -0.29 0.16 9.45 0.00 -0.70 -1.19 107.32 114.20 2b8t s GLY 123 Ca 0.08 1.62 -0.30 0.00 0.00 0.00 0.00 44.72 46.12 2b8t s GLY 123 CO -0.01 0.50 1.29 1.08 0.00 0.00 0.00 173.10 175.96 2b8t s LEU 124 N -2.31 4.41 0.12 0.66 1.43 -1.26 -3.97 118.68 117.76 2b8t s LEU 124 Ca 0.13 2.30 0.06 0.00 -1.03 0.00 0.00 54.13 55.59 2b8t s LEU 124 Cb 0.02 -3.60 -0.19 0.00 0.03 0.00 0.00 46.19 42.45 2b8t s LEU 124 CO -0.04 -0.52 1.28 -2.24 0.23 0.00 0.00 176.35 175.07 2b8t h ASP 125 N 5.88 0.04 -4.37 2.29 2.03 -1.93 -3.42 116.42 116.93 2b8t h ASP 125 Ca -0.44 -0.04 -0.60 0.00 -0.73 0.00 0.00 57.03 55.23 2b8t h ASP 125 Cb 1.21 -0.01 -0.28 0.00 -0.83 0.00 0.00 39.33 39.42 2b8t h ASP 125 CO 0.79 1.01 -0.85 -0.54 -1.03 0.00 0.00 179.24 178.63 2b8t s LYS 126 N -2.75 1.57 0.95 4.15 1.02 -1.26 -2.05 119.74 121.38 2b8t s LYS 126 Ca 0.00 -0.81 -0.16 0.00 0.02 0.00 0.00 55.97 55.02 2b8t s LYS 126 Cb 0.10 -1.58 0.22 0.00 -0.52 0.00 0.00 37.83 36.05 2b8t s LYS 126 CO 0.82 0.42 1.30 0.27 -0.92 0.00 0.00 175.35 177.24 2b8t n ASN 127 N 2.32 0.12 0.25 2.83 0.23 -0.24 -4.75 115.26 116.02 2b8t n ASN 127 Ca -0.16 -1.48 0.18 0.00 -0.53 0.00 0.00 54.58 52.59 2b8t n ASN 127 Cb 0.53 -0.99 0.91 0.00 -2.08 0.00 0.00 39.78 38.15 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 -1.74 0.00 0.00 -2.53 -5.15 -1.86 -0.14 116.94 105.52 2b8t h PHE 128 Ca -0.42 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.35 2b8t h PHE 128 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.33 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 -3.57 0.26 -0.96 6.09 5.02 -1.26 -4.65 118.16 119.10 2b8t n LYS 129 Ca -0.00 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2b8t n LYS 129 Cb 0.26 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 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 1.03 0.54 3.98 0.72 0.00 -0.06 -4.96 105.19 106.44 2b8t n GLY 130 Ca 0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.04 3.24 0.32 1.61 2.02 -1.26 -4.84 118.70 119.75 2b8t s GLU 131 Ca 0.00 -0.82 -0.29 0.00 0.02 0.00 0.00 54.97 53.88 2b8t s GLU 131 Cb 0.00 -2.80 -0.12 0.00 0.10 0.00 0.00 34.13 31.31 2b8t s GLU 131 CO 0.00 0.15 1.48 -2.30 0.02 0.00 0.00 175.26 174.61 2b8t n PRO 132 N -1.63 2.49 -2.94 0.39 -0.02 -1.26 -1.08 135.00 130.95 2b8t n PRO 132 Ca -0.03 0.88 -0.43 0.00 -2.02 0.00 0.00 63.50 61.90 2b8t n PRO 132 Cb 0.58 -2.59 -0.05 0.00 -0.02 0.00 0.00 33.50 31.41 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 -0.53 2.90 0.00 6.00 5.99 -0.87 -4.58 117.98 126.89 2b8t s PHE 133 Ca 0.60 -0.10 0.00 0.00 0.00 0.00 0.00 56.93 57.43 2b8t s PHE 133 Cb -0.53 -3.85 0.00 0.00 0.00 0.00 0.00 43.02 38.64 2b8t s PHE 133 CO 0.56 -1.19 0.00 0.41 -0.00 0.00 0.00 175.22 174.99 2b8t n GLY 134 N 5.10 3.95 1.00 13.12 0.00 -1.26 -2.46 105.19 124.64 2b8t n GLY 134 Ca -0.00 0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.22 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 14.00 2.26 0.20 1.61 -0.04 -1.26 -4.46 135.00 147.32 2b8t n PRO 135 Ca 0.00 -1.95 0.06 0.00 -0.04 0.00 0.00 63.50 61.57 2b8t n PRO 135 Cb 0.00 -1.44 0.43 0.00 -0.04 0.00 0.00 33.50 32.45 2b8t n PRO 135 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 2b8t h ILE 136 N 3.33 0.98 -0.07 0.52 -0.00 -1.84 -2.86 117.51 117.57 2b8t h ILE 136 Ca 0.00 -1.21 0.03 0.00 -0.00 0.00 0.00 64.86 63.68 2b8t h ILE 136 Cb 0.75 1.70 -0.03 0.00 -0.00 0.00 0.00 36.82 39.24 2b8t h ILE 136 CO 0.00 0.31 -0.11 0.00 -0.00 0.00 0.00 178.15 178.35 2b8t h ALA 137 N 1.68 -0.07 -0.50 0.16 0.00 -1.83 -1.55 119.26 117.16 2b8t h ALA 137 Ca -0.00 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2b8t h ALA 137 Cb 0.68 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2b8t h ALA 137 CO 0.04 -0.58 0.19 0.87 0.00 0.00 0.00 179.25 179.77 2b8t h LYS 138 N -0.16 0.73 -0.78 0.00 1.57 -1.87 -2.92 116.57 113.15 2b8t h LYS 138 Ca 0.07 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2b8t h LYS 138 Cb 0.25 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 2b8t h LYS 138 CO -0.16 0.61 0.43 -0.07 -0.57 0.00 0.00 179.45 179.68 2b8t h LEU 139 N 0.72 0.96 -0.64 2.94 3.38 -1.13 -1.61 115.31 119.93 2b8t h LEU 139 Ca 0.17 -0.08 0.11 0.00 0.09 0.00 0.00 57.88 58.18 2b8t h LEU 139 Cb 0.16 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.59 2b8t h LEU 139 CO -0.01 0.77 0.20 -0.26 0.09 0.00 0.00 178.44 179.23 2b8t h PHE 140 N 1.08 0.34 -0.70 1.13 0.04 -1.11 0.22 116.94 117.93 2b8t h PHE 140 Ca 0.27 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 61.02 2b8t h PHE 140 Cb 0.02 -0.05 -0.03 0.00 2.20 0.00 0.00 35.95 38.09 2b8t h PHE 140 CO 0.01 0.03 0.20 1.79 -0.60 0.00 0.00 178.31 179.74 2b8t h THR 141 N 0.35 1.26 0.00 -1.55 1.35 -1.32 -3.15 112.91 109.85 2b8t h THR 141 Ca 0.34 -0.92 -0.04 0.00 -0.55 0.00 0.00 66.41 65.24 2b8t h THR 141 Cb 0.48 0.52 -0.01 0.00 -1.73 0.00 0.00 68.15 67.42 2b8t h THR 141 CO -0.38 0.36 -0.39 1.88 -0.25 0.00 0.00 175.52 176.74 2b8t h TYR 142 N 1.05 0.00 -3.08 4.73 0.05 -0.97 -3.46 116.97 115.29 2b8t h TYR 142 Ca 0.22 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 58.48 2b8t h TYR 142 Cb 0.33 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.10 2b8t h TYR 142 CO 0.03 0.16 0.72 0.00 -1.05 0.00 0.00 178.16 178.02 2b8t s ALA 143 N -3.15 3.59 0.14 3.88 0.00 0.02 -4.79 121.76 121.45 2b8t s ALA 143 Ca 0.04 1.13 -0.12 0.00 0.00 0.00 0.00 51.96 53.01 2b8t s ALA 143 Cb 0.07 -3.53 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 2b8t s ALA 143 CO 0.72 -0.61 1.54 -0.44 0.00 0.00 0.00 175.76 176.97 2b8t h ASP 144 N 6.47 0.88 -3.40 0.00 3.32 -1.61 -3.44 116.42 118.64 2b8t h ASP 144 Ca -0.43 -0.37 -0.53 0.00 0.02 0.00 0.00 57.03 55.72 2b8t h ASP 144 Cb 1.21 -0.24 -0.34 0.00 0.22 0.00 0.00 39.33 40.18 2b8t h ASP 144 CO 0.85 1.05 -0.82 -0.75 -1.72 0.00 0.00 179.24 177.84 2b8t s LYS 145 N -4.76 1.82 -0.07 3.56 2.20 -0.99 -5.05 119.74 116.44 2b8t s LYS 145 Ca -0.12 -0.45 0.04 0.00 -0.36 0.00 0.00 55.97 55.08 2b8t s LYS 145 Cb 0.11 -1.50 -0.02 0.00 -1.51 0.00 0.00 37.83 34.91 2b8t s LYS 145 CO 0.84 0.03 -0.19 0.42 -0.36 0.00 0.00 175.35 176.09 2b8t s ILE 146 N 0.69 2.62 -0.30 5.43 1.01 -1.26 -0.51 121.20 128.89 2b8t s ILE 146 Ca -0.14 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.67 2b8t s ILE 146 Cb -0.16 -2.02 0.09 0.00 0.01 0.00 0.00 42.46 40.38 2b8t s ILE 146 CO 0.04 0.57 0.04 -0.89 0.00 0.00 0.00 174.94 174.69 2b8t s THR 147 N -0.21 1.50 -0.48 2.92 2.01 0.36 -4.97 115.64 116.78 2b8t s THR 147 Ca -0.01 -1.65 -0.21 0.00 0.31 0.00 0.00 61.69 60.13 2b8t s THR 147 Cb -0.13 -2.02 0.04 0.00 0.01 0.00 0.00 72.50 70.39 2b8t s THR 147 CO 0.03 -0.49 0.70 -0.75 -0.69 0.00 0.00 174.62 173.42 2b8t s LYS 148 N 1.33 3.25 0.51 4.92 2.20 -1.26 -0.71 119.74 129.98 2b8t s LYS 148 Ca 0.06 -0.48 -0.14 0.00 -0.36 0.00 0.00 55.97 55.04 2b8t s LYS 148 Cb -0.18 -4.01 -0.07 0.00 -1.51 0.00 0.00 37.83 32.06 2b8t s LYS 148 CO -0.14 -1.15 0.95 -0.51 -0.36 0.00 0.00 175.35 174.14 2b8t s LEU 149 N 2.98 3.59 0.12 5.43 1.43 0.10 -4.92 118.68 127.42 2b8t s LEU 149 Ca 0.22 1.46 0.08 0.00 -1.03 0.00 0.00 54.13 54.86 2b8t s LEU 149 Cb -0.15 -4.41 -0.04 0.00 0.03 0.00 0.00 46.19 41.62 2b8t s LEU 149 CO 0.17 -0.60 -0.10 0.42 0.23 0.00 0.00 176.35 176.47 2b8t s THR 150 N -2.68 3.30 0.02 5.49 -4.23 -1.26 -4.25 115.64 112.04 2b8t s THR 150 Ca 0.57 -1.38 0.00 0.00 -1.18 0.00 0.00 61.69 59.70 2b8t s THR 150 Cb -0.10 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 71.17 2b8t s THR 150 CO 0.35 0.05 0.03 0.00 -0.54 0.00 0.00 174.62 174.52 2b8t n ALA 151 N 0.53 0.05 -2.93 3.99 0.00 -0.81 -4.61 120.51 116.73 2b8t n ALA 151 Ca -0.13 -0.09 -0.34 0.00 0.00 0.00 0.00 53.44 52.88 2b8t n ALA 151 Cb 0.53 0.03 -0.12 0.00 0.00 0.00 0.00 19.45 19.88 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 0.66 3.69 0.05 0.00 -1.09 -1.26 -0.62 121.20 122.64 2b8t s ILE 152 Ca 0.02 -0.44 -0.30 0.00 -2.23 0.00 0.00 60.65 57.70 2b8t s ILE 152 Cb -0.00 -2.59 -0.08 0.00 -1.58 0.00 0.00 42.46 38.20 2b8t s ILE 152 CO 0.02 0.51 1.71 0.00 -1.23 0.00 0.00 174.94 175.95 2b8t h ASN 154 N 8.84 0.00 0.02 0.00 -0.00 -1.41 -0.10 115.58 122.93 2b8t h ASN 154 Ca -0.43 0.00 -0.40 0.00 -0.00 0.00 0.00 56.30 55.47 2b8t h ASN 154 Cb 1.20 0.00 -0.06 0.00 -0.00 0.00 0.00 38.32 39.46 2b8t h ASN 154 CO 0.94 0.01 -2.36 -0.62 -0.00 0.00 0.00 177.43 175.40 2b8t n GLU 155 N -3.24 0.64 0.00 6.67 -0.58 -1.26 -4.80 120.64 118.06 2b8t n GLU 155 Ca -0.02 0.22 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 2b8t n GLU 155 Cb 0.13 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.45 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 1.59 0.86 3.71 0.00 0.00 -0.05 -4.97 105.19 106.33 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 -3.40 1.22 0.11 4.61 0.00 -1.26 -4.44 121.76 118.60 2b8t s ALA 158 Ca 0.00 -0.42 -0.34 0.00 0.00 0.00 0.00 51.96 51.20 2b8t s ALA 158 Cb 0.00 -3.09 -0.14 0.00 0.00 0.00 0.00 23.12 19.90 2b8t s ALA 158 CO 0.00 -2.66 1.63 0.39 0.00 0.00 0.00 175.76 175.12 2b8t n GLU 159 N -4.04 2.13 -3.84 0.00 1.02 -1.26 -0.58 120.64 114.06 2b8t n GLU 159 Ca 0.06 0.77 -0.35 0.00 -0.02 0.00 0.00 57.16 57.61 2b8t n GLU 159 Cb 0.58 -2.55 -0.08 0.00 -0.02 0.00 0.00 31.44 29.37 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 1.51 3.68 -0.07 0.62 0.00 0.21 -4.23 121.76 123.48 2b8t s ALA 160 Ca 0.82 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 52.10 2b8t s ALA 160 Cb -0.69 -2.05 -0.02 0.00 0.00 0.00 0.00 23.12 20.37 2b8t s ALA 160 CO 0.41 0.31 0.06 0.25 0.00 0.00 0.00 175.76 176.79 2b8t n THR 161 N 3.04 0.00 -4.31 0.00 -2.24 -0.50 -1.93 114.28 108.35 2b8t n THR 161 Ca -0.17 -0.45 -0.21 0.00 -2.27 0.00 0.00 64.05 60.94 2b8t n THR 161 Cb 0.53 0.99 -0.11 0.00 -2.10 0.00 0.00 70.33 69.64 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 -1.17 1.71 -0.19 4.78 3.76 -0.14 -4.40 115.29 119.65 2b8t s HIS 162 Ca 0.01 -0.49 -0.06 0.00 -0.15 0.00 0.00 55.06 54.37 2b8t s HIS 162 Cb 0.01 -0.87 -0.03 0.00 1.11 0.00 0.00 32.58 32.80 2b8t s HIS 162 CO 0.06 0.28 0.03 -1.12 -0.85 0.00 0.00 174.74 173.14 2b8t s SER 163 N -2.57 5.23 -0.19 1.40 0.01 -1.26 -1.12 113.70 115.19 2b8t s SER 163 Ca 0.14 -0.06 -0.03 0.00 1.31 0.00 0.00 55.95 57.30 2b8t s SER 163 Cb -0.06 -1.89 -0.02 0.00 0.21 0.00 0.00 66.02 64.26 2b8t s SER 163 CO 0.06 0.12 -0.05 -0.22 0.41 0.00 0.00 173.24 173.55 2b8t s LEU 164 N 0.67 2.98 -0.15 2.44 2.96 0.38 -4.49 118.68 123.47 2b8t s LEU 164 Ca 0.01 -0.30 -0.14 0.00 -0.22 0.00 0.00 54.13 53.49 2b8t s LEU 164 Cb -0.14 -1.73 -0.05 0.00 0.50 0.00 0.00 46.19 44.77 2b8t s LEU 164 CO 0.02 0.07 0.31 -0.60 -1.32 0.00 0.00 176.35 174.83 2b8t s ARG 165 N 0.95 4.24 -0.07 1.98 3.52 -1.26 -1.36 118.95 126.94 2b8t s ARG 165 Ca -0.00 0.14 0.03 0.00 -0.13 0.00 0.00 55.73 55.76 2b8t s ARG 165 Cb -0.15 -3.42 0.01 0.00 -1.56 0.00 0.00 34.95 29.84 2b8t s ARG 165 CO 0.01 0.25 -0.14 0.15 -0.81 0.00 0.00 175.30 174.76 2b8t s LYS 166 N 0.41 1.91 -0.27 5.12 1.02 -0.36 -1.64 119.74 125.93 2b8t s LYS 166 Ca 0.18 -0.49 -0.02 0.00 0.02 0.00 0.00 55.97 55.66 2b8t s LYS 166 Cb -0.13 -1.55 0.03 0.00 -0.52 0.00 0.00 37.83 35.66 2b8t s LYS 166 CO 0.05 0.06 -0.03 0.42 -0.92 0.00 0.00 175.35 174.93 2b8t s ILE 167 N 0.59 3.00 -1.56 2.17 -1.09 0.62 -4.59 121.20 120.35 2b8t s ILE 167 Ca -0.15 -1.14 -0.05 0.00 -2.23 0.00 0.00 60.65 57.09 2b8t s ILE 167 Cb -0.16 -2.61 0.01 0.00 -1.58 0.00 0.00 42.46 38.12 2b8t s ILE 167 CO 0.05 0.07 0.65 0.47 -1.23 0.00 0.00 174.94 174.95 2b8t n ASP 168 N 4.67 -6.20 0.00 3.58 8.00 -1.26 -2.10 116.55 123.24 2b8t n ASP 168 Ca -0.15 -0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.04 2b8t n ASP 168 Cb 0.46 -5.00 0.00 0.00 -0.02 0.00 0.00 41.12 36.56 2b8t n ASP 168 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b8t n GLY 169 N -1.57 3.08 3.75 0.44 0.00 -1.26 -5.02 105.19 104.60 2b8t n GLY 169 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 2b8t n GLY 169 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2b8t s LYS 170 N -0.36 4.47 0.38 1.61 2.20 -0.89 -4.98 119.74 122.17 2b8t s LYS 170 Ca 0.00 1.01 -0.28 0.00 -0.36 0.00 0.00 55.97 56.34 2b8t s LYS 170 Cb 0.00 -3.37 -0.11 0.00 -1.51 0.00 0.00 37.83 32.85 2b8t s LYS 170 CO 0.00 0.28 1.47 -1.01 -0.36 0.00 0.00 175.35 175.73 2b8t s HIS 171 N -0.02 2.61 0.39 4.03 3.76 -1.26 -0.27 115.29 124.52 2b8t s HIS 171 Ca 0.38 1.19 -0.26 0.00 -0.15 0.00 0.00 55.06 56.21 2b8t s HIS 171 Cb -0.20 -4.00 -0.09 0.00 1.11 0.00 0.00 32.58 29.40 2b8t s HIS 171 CO 0.22 -2.93 1.26 0.00 -0.85 0.00 0.00 174.74 172.44 2b8t s ALA 172 N -1.13 3.26 0.52 -1.40 0.00 -0.65 -4.81 121.76 117.55 2b8t s ALA 172 Ca 0.53 1.15 -0.18 0.00 0.00 0.00 0.00 51.96 53.46 2b8t s ALA 172 Cb -0.46 -3.45 -0.07 0.00 0.00 0.00 0.00 23.12 19.14 2b8t s ALA 172 CO 0.62 -0.70 1.02 0.34 0.00 0.00 0.00 175.76 177.04 2b8t s ASP 173 N -0.82 6.35 0.28 0.00 2.15 -1.26 -4.06 116.67 119.31 2b8t s ASP 173 Ca 0.55 1.76 0.03 0.00 0.43 0.00 0.00 52.55 55.32 2b8t s ASP 173 Cb -0.36 -2.54 0.66 0.00 -0.30 0.00 0.00 42.92 40.38 2b8t s ASP 173 CO 0.46 -0.77 1.74 0.22 -0.17 0.00 0.00 175.17 176.65 2b8t h TYR 174 N 1.12 0.81 -0.17 -5.34 3.20 -1.62 -2.20 116.97 112.78 2b8t h TYR 174 Ca -0.48 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.43 2b8t h TYR 174 Cb 1.20 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.25 2b8t h TYR 174 CO 0.60 0.11 0.00 0.09 -1.64 0.00 0.00 178.16 177.32 2b8t n ASN 175 N -4.91 1.06 -4.71 -2.11 5.03 -1.26 -4.92 115.26 103.44 2b8t n ASN 175 Ca 0.21 -1.85 -0.30 0.00 0.87 0.00 0.00 54.58 53.50 2b8t n ASN 175 Cb 0.55 -0.11 0.14 0.00 -1.02 0.00 0.00 39.78 39.34 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 -1.21 3.55 0.26 6.41 1.01 -0.83 -4.96 116.67 120.90 2b8t s ASP 176 Ca 0.20 1.72 -0.31 0.00 0.71 0.00 0.00 52.55 54.87 2b8t s ASP 176 Cb 0.10 -2.36 -0.13 0.00 1.01 0.00 0.00 42.92 41.54 2b8t s ASP 176 CO 0.15 -2.63 1.42 0.47 0.21 0.00 0.00 175.17 174.79 2b8t n ASP 177 N -3.90 2.88 0.16 0.27 8.00 -1.26 -4.95 116.55 117.75 2b8t n ASP 177 Ca 0.08 1.15 -0.14 0.00 0.71 0.00 0.00 54.79 56.59 2b8t n ASP 177 Cb 0.54 -1.45 -0.08 0.00 -0.02 0.00 0.00 41.12 40.11 2b8t n ASP 177 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2b8t h ILE 178 N 3.03 0.74 -3.36 0.53 1.08 -1.97 -3.42 117.51 114.15 2b8t h ILE 178 Ca -0.45 -0.47 -0.60 0.00 -0.39 0.00 0.00 64.86 62.95 2b8t h ILE 178 Cb 1.27 0.99 -0.09 0.00 -3.07 0.00 0.00 36.82 35.92 2b8t h ILE 178 CO 0.75 0.10 0.47 -0.69 -0.69 0.00 0.00 178.15 178.09 2b8t s VAL 179 N -5.04 4.79 -0.25 1.67 1.01 -1.26 -4.78 120.40 116.53 2b8t s VAL 179 Ca -0.15 1.41 -0.02 0.00 0.00 0.00 0.00 61.98 63.22 2b8t s VAL 179 Cb 0.03 -4.16 0.12 0.00 0.00 0.00 0.00 36.38 32.37 2b8t s VAL 179 CO 0.58 -0.19 0.26 -0.75 0.00 0.00 0.00 175.10 175.00 2b8t s LYS 180 N 2.97 0.26 0.19 2.72 2.20 -1.26 -4.73 119.74 122.09 2b8t s LYS 180 Ca 0.35 0.01 -0.30 0.00 -0.36 0.00 0.00 55.97 55.67 2b8t s LYS 180 Cb -0.14 -0.91 -0.08 0.00 -1.51 0.00 0.00 37.83 35.18 2b8t s LYS 180 CO 0.10 -0.85 1.12 0.42 -0.36 0.00 0.00 175.35 175.78 2b8t s ILE 181 N 2.34 3.76 0.00 5.43 -1.09 -1.26 -4.96 121.20 125.41 2b8t s ILE 181 Ca 0.09 1.54 0.00 0.00 -2.23 0.00 0.00 60.65 60.05 2b8t s ILE 181 Cb -0.15 -3.98 0.00 0.00 -1.58 0.00 0.00 42.46 36.75 2b8t s ILE 181 CO -0.24 0.28 0.00 0.61 -1.23 0.00 0.00 174.94 174.36 2b8t n GLY 182 N 1.96 0.46 0.00 6.18 0.00 -1.26 -5.01 105.19 107.52 2b8t n GLY 182 Ca 0.02 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.83 2b8t n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b8t h GLN 184 N 0.00 0.00 0.00 0.00 4.20 -2.03 0.34 115.11 117.62 2b8t h GLN 184 Ca 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2b8t h GLN 184 Cb 0.00 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 2b8t h GLN 184 CO 0.00 0.06 -0.04 1.05 -0.67 0.00 0.00 178.83 179.23 2b8t h GLU 185 N 0.00 0.00 0.00 1.46 9.09 -1.97 -3.24 114.58 119.91 2b8t h GLU 185 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2b8t h GLU 185 Cb 0.17 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.27 2b8t h GLU 185 CO 0.01 0.04 -0.89 1.19 0.05 0.00 0.00 179.01 179.40 2b8t n PHE 186 N -3.35 0.00 -4.43 2.06 3.72 -0.82 -4.92 117.46 109.72 2b8t n PHE 186 Ca -0.02 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.15 2b8t n PHE 186 Cb 0.17 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.57 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 -1.82 1.57 0.11 1.38 2.02 0.05 -1.23 117.35 119.43 2b8t s TYR 187 Ca 0.00 -0.38 0.03 0.00 -0.37 0.00 0.00 57.07 56.34 2b8t s TYR 187 Cb 0.00 -0.91 -0.04 0.00 -0.40 0.00 0.00 41.96 40.60 2b8t s TYR 187 CO 0.00 0.10 -0.08 -1.54 -1.57 0.00 0.00 175.55 172.46 2b8t s SER 188 N -1.37 1.34 -0.12 2.29 1.04 -0.47 -4.22 113.70 112.20 2b8t s SER 188 Ca 0.05 -1.01 -0.12 0.00 0.48 0.00 0.00 55.95 55.34 2b8t s SER 188 Cb -0.09 0.06 -0.05 0.00 0.10 0.00 0.00 66.02 66.05 2b8t s SER 188 CO 0.02 -0.43 0.27 0.00 0.98 0.00 0.00 173.24 174.08 2b8t s ALA 189 N -3.54 3.70 0.04 5.32 0.00 -1.26 -0.47 121.76 125.55 2b8t s ALA 189 Ca 0.13 -0.47 -0.01 0.00 0.00 0.00 0.00 51.96 51.62 2b8t s ALA 189 Cb 0.04 -2.26 -0.03 0.00 0.00 0.00 0.00 23.12 20.87 2b8t s ALA 189 CO -0.03 0.32 -0.02 0.14 0.00 0.00 0.00 175.76 176.17 2b8t s VAL 190 N -0.27 0.18 0.94 0.00 -7.23 -0.28 -0.99 120.40 112.75 2b8t s VAL 190 Ca 0.17 -1.51 -0.13 0.00 -1.81 0.00 0.00 61.98 58.70 2b8t s VAL 190 Cb -0.13 -1.13 0.16 0.00 0.56 0.00 0.00 36.38 35.83 2b8t s VAL 190 CO 0.06 -0.84 1.13 0.00 -0.31 0.00 0.00 175.10 175.14 2b8t h ARG 192 N -1.64 0.16 -0.65 0.00 2.43 -1.94 -2.39 114.38 110.35 2b8t h ARG 192 Ca -0.51 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 58.72 2b8t h ARG 192 Cb 1.33 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.80 2b8t h ARG 192 CO 0.60 0.11 0.43 1.25 -1.51 0.00 0.00 179.97 180.84 2b8t h HIS 193 N 0.17 0.63 -0.63 2.20 2.76 -1.98 -2.09 115.15 116.20 2b8t h HIS 193 Ca 0.26 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.45 2b8t h HIS 193 Cb 0.39 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.15 2b8t h HIS 193 CO -0.28 0.33 0.00 0.72 -1.30 0.00 0.00 177.93 177.39 2b8t n HIS 194 N -4.48 1.52 -3.45 5.26 8.25 -0.93 -4.77 115.22 116.61 2b8t n HIS 194 Ca 0.10 -0.63 -0.43 0.00 -0.26 0.00 0.00 57.72 56.50 2b8t n HIS 194 Cb 0.26 -0.27 -0.09 0.00 1.12 0.00 0.00 29.99 31.02 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 -1.95 3.26 -0.07 4.41 5.04 -0.79 -4.84 115.29 120.35 2b8t s HIS 195 Ca 0.51 -1.01 0.05 0.00 -1.54 0.00 0.00 55.06 53.07 2b8t s HIS 195 Cb 0.34 -3.02 -0.01 0.00 0.04 0.00 0.00 32.58 29.92 2b8t s HIS 195 CO 0.23 -0.78 -0.24 0.15 -2.34 0.00 0.00 174.74 171.76 2b8t s LYS 196 N 1.60 2.68 -0.29 2.88 1.02 -1.26 -4.99 119.74 121.37 2b8t s LYS 196 Ca 0.04 -0.89 0.02 0.00 0.02 0.00 0.00 55.97 55.16 2b8t s LYS 196 Cb -0.23 -2.21 0.08 0.00 -0.52 0.00 0.00 37.83 34.95 2b8t s LYS 196 CO 0.06 0.34 -0.00 0.08 -0.92 0.00 0.00 175.35 174.91 2b8t s VAL 197 N -0.06 1.79 0.30 3.17 1.01 -1.26 -4.81 120.40 120.55 2b8t s VAL 197 Ca -0.07 -1.71 -0.29 0.00 0.00 0.00 0.00 61.98 59.92 2b8t s VAL 197 Cb -0.15 -2.16 -0.13 0.00 0.00 0.00 0.00 36.38 33.94 2b8t s VAL 197 CO 0.05 -0.35 1.19 -2.65 0.00 0.00 0.00 175.10 173.34 2b8t n PRO 198 N 4.51 1.77 -1.88 2.72 -0.02 -1.26 -2.56 135.00 138.29 2b8t n PRO 198 Ca -0.05 0.62 -0.15 0.00 -2.02 0.00 0.00 63.50 61.90 2b8t n PRO 198 Cb 0.43 -2.13 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 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 1.20 -4.61 -4.68 2.55 3.02 -1.26 -1.71 115.26 109.78 2b8t n ASN 199 Ca 0.08 0.16 -0.42 0.00 -0.03 0.00 0.00 54.58 54.37 2b8t n ASN 199 Cb 0.33 -3.60 -0.03 0.00 -0.61 0.00 0.00 39.78 35.88 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 -4.03 4.19 0.51 3.52 3.52 -1.06 -4.72 118.95 120.86 2b8t s ARG 200 Ca 0.00 2.32 -0.08 0.00 -0.13 0.00 0.00 55.73 57.84 2b8t s ARG 200 Cb 0.00 -3.80 -0.05 0.00 -1.56 0.00 0.00 34.95 29.54 2b8t s ARG 200 CO 0.00 -0.80 0.86 -1.25 -0.81 0.00 0.00 175.30 173.30 2b8t s PRO 201 N 3.33 3.63 -0.16 5.12 0.04 -1.26 -5.08 135.00 140.62 2b8t s PRO 201 Ca 0.76 0.45 -0.03 0.00 0.04 0.00 0.00 61.00 62.21 2b8t s PRO 201 Cb -0.38 -2.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.85 2b8t s PRO 201 CO 0.33 -0.27 -0.06 0.71 0.04 0.00 0.00 177.00 177.75 2b8t s TYR 202 N -2.78 2.97 -0.12 0.56 2.02 -1.26 -5.02 117.35 113.73 2b8t s TYR 202 Ca 0.51 -0.47 0.17 0.00 -0.37 0.00 0.00 57.07 56.90 2b8t s TYR 202 Cb -0.10 -1.96 -0.19 0.00 -0.40 0.00 0.00 41.96 39.30 2b8t s TYR 202 CO 0.44 -0.16 0.62 1.28 -1.57 0.00 0.00 175.55 176.15 2b8t n LEU 203 N 3.77 0.60 -4.81 -1.29 4.32 -1.26 -4.90 117.00 113.43 2b8t n LEU 203 Ca -0.18 0.27 -0.35 0.00 -0.02 0.00 0.00 56.01 55.73 2b8t n LEU 203 Cb 0.52 0.16 -0.07 0.00 -1.62 0.00 0.00 43.42 42.42 2b8t n LEU 203 CO 0.32 0.23 0.60 0.20 -1.22 0.00 0.00 177.39 177.52 2b8t s ASN 204 N -5.63 7.11 0.47 -1.43 0.01 -1.26 -4.98 114.94 109.22 2b8t s ASN 204 Ca -0.05 1.68 0.26 0.00 -0.71 0.00 0.00 52.86 54.05 2b8t s ASN 204 Cb 0.09 -2.53 0.85 0.00 0.41 0.00 0.00 41.25 40.07 2b8t s ASN 204 CO 0.83 -0.17 1.79 0.77 -1.51 0.00 0.00 177.10 178.81 2b8t h SER 205 N 2.67 0.00 -0.34 -1.22 4.64 -2.07 -3.25 113.55 113.98 2b8t h SER 205 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 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 0.64 0.11 0.00 -0.46 -0.87 0.00 0.00 176.83 176.25 2b8t n ASN 206 N -3.19 3.06 -0.04 4.97 6.94 -1.26 -4.70 115.26 121.04 2b8t n ASN 206 Ca 0.01 -2.13 -0.14 0.00 -0.02 0.00 0.00 54.58 52.30 2b8t n ASN 206 Cb 0.44 -0.27 -0.09 0.00 -2.36 0.00 0.00 39.78 37.50 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 2.01 0.30 0.36 0.53 0.02 -1.98 -2.13 113.55 112.66 2b8t h SER 207 Ca 0.00 -0.59 -0.13 0.00 -0.84 0.00 0.00 61.79 60.23 2b8t h SER 207 Cb 0.83 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 2b8t h SER 207 CO 0.03 0.84 -0.53 -0.33 -1.14 0.00 0.00 176.83 175.70 2b8t h GLU 208 N -0.23 0.19 -0.48 3.45 5.08 -1.84 -1.95 114.58 118.81 2b8t h GLU 208 Ca -0.00 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2b8t h GLU 208 Cb 0.80 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 2b8t h GLU 208 CO 0.04 0.68 0.31 1.49 -1.00 0.00 0.00 179.01 180.54 2b8t h GLU 209 N 0.15 0.63 -0.50 2.33 4.81 -1.85 -1.32 114.58 118.83 2b8t h GLU 209 Ca 0.00 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 2b8t h GLU 209 Cb 0.99 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.21 2b8t h GLU 209 CO 0.08 0.42 0.13 0.35 -0.73 0.00 0.00 179.01 179.26 2b8t h PHE 210 N 0.65 0.82 -0.63 0.92 3.57 -1.09 0.01 116.94 121.19 2b8t h PHE 210 Ca 0.17 -0.09 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 2b8t h PHE 210 Cb -0.07 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.41 2b8t h PHE 210 CO -0.04 0.73 0.29 0.82 -2.23 0.00 0.00 178.31 177.88 2b8t h ILE 211 N 0.68 1.22 -0.72 1.41 2.04 -1.27 -1.31 117.51 119.57 2b8t h ILE 211 Ca 0.16 -0.65 -0.04 0.00 1.00 0.00 0.00 64.86 65.33 2b8t h ILE 211 Cb 0.32 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 2b8t h ILE 211 CO 0.00 0.26 0.27 0.50 0.00 0.00 0.00 178.15 179.18 2b8t h LYS 212 N 0.87 1.08 -0.43 2.37 3.64 -1.09 -2.60 116.57 120.41 2b8t h LYS 212 Ca 0.22 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2b8t h LYS 212 Cb 0.14 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 2b8t h LYS 212 CO -0.02 0.90 0.29 0.35 -2.27 0.00 0.00 179.45 178.69 2b8t h PHE 213 N 1.03 0.55 0.00 1.91 3.57 -0.58 -1.53 116.94 121.89 2b8t h PHE 213 Ca 0.24 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.75 2b8t h PHE 213 Cb 0.23 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.79 2b8t h PHE 213 CO 0.02 0.35 0.00 0.74 -2.23 0.00 0.00 178.31 177.18 2b8t h PHE 214 N 0.59 0.00 0.00 0.41 -1.00 -1.19 -2.31 116.94 113.44 2b8t h PHE 214 Ca 0.16 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.94 2b8t h PHE 214 Cb -0.06 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.50 2b8t h PHE 214 CO -0.04 0.00 -0.43 1.17 -1.61 0.00 0.00 178.31 177.40 2b8t n LYS 215 N -2.85 0.09 -0.80 1.51 0.00 -0.99 -5.11 118.16 110.02 2b8t n LYS 215 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 58.31 58.39 2b8t n LYS 215 Cb 0.49 -1.57 0.00 0.00 0.00 0.00 0.00 35.03 33.95 2b8t n LYS 215 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49