#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rgt n SER 27 N 0.00 0.00 -2.80 1.61 2.88 -1.26 -5.01 113.62 109.04 2rgt n SER 27 Ca 0.00 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.14 2rgt n SER 27 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 2rgt n SER 27 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2rgt n THR 28 N 0.00 0.00 -0.35 2.46 -1.04 -1.26 -4.85 114.28 109.24 2rgt n THR 28 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.72 2rgt n THR 28 Cb 0.00 -0.31 0.27 0.00 -1.82 0.00 0.00 70.33 68.48 2rgt n THR 28 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2rgt n PRO 29 N 3.45 -3.75 -3.59 -2.82 -0.04 -1.26 -5.08 135.00 121.91 2rgt n PRO 29 Ca 0.26 -1.09 -0.14 0.00 -0.04 0.00 0.00 63.50 62.48 2rgt n PRO 29 Cb -0.03 -1.99 -0.06 0.00 -0.04 0.00 0.00 33.50 31.38 2rgt n PRO 29 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2rgt s GLU 30 N -4.65 1.00 0.25 0.54 2.02 -1.26 -5.06 118.70 111.54 2rgt s GLU 30 Ca 0.66 -0.16 -0.31 0.00 0.02 0.00 0.00 54.97 55.18 2rgt s GLU 30 Cb -0.18 0.46 -0.12 0.00 0.10 0.00 0.00 34.13 34.40 2rgt s GLU 30 CO 0.60 -0.35 1.66 0.42 0.02 0.00 0.00 175.26 177.62 2rgt s ILE 31 N -2.16 2.04 0.55 -1.63 1.01 -1.26 -4.95 121.20 114.81 2rgt s ILE 31 Ca -0.07 0.03 -0.20 0.00 0.00 0.00 0.00 60.65 60.41 2rgt s ILE 31 Cb -0.01 -3.02 -0.06 0.00 0.01 0.00 0.00 42.46 39.38 2rgt s ILE 31 CO 0.01 0.00 1.03 -2.65 0.00 0.00 0.00 174.94 173.33 2rgt n PRO 32 N 3.13 1.12 -4.81 2.79 -0.02 -1.26 -4.81 135.00 131.13 2rgt n PRO 32 Ca 0.12 0.42 -0.33 0.00 -2.02 0.00 0.00 63.50 61.69 2rgt n PRO 32 Cb 0.36 -2.20 -0.14 0.00 -0.02 0.00 0.00 33.50 31.50 2rgt n PRO 32 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2rgt s MET 33 N -2.61 3.20 0.20 -0.52 -1.94 -1.26 -0.74 119.30 115.63 2rgt s MET 33 Ca 0.72 -0.69 -0.30 0.00 -1.71 0.00 0.00 55.69 53.71 2rgt s MET 33 Cb -0.45 -2.57 -0.08 0.00 2.01 0.00 0.00 34.83 33.74 2rgt s MET 33 CO 0.50 0.30 1.22 0.00 -0.01 0.00 0.00 175.02 177.02 2rgt h ALA 35 N 5.11 0.93 0.66 0.00 0.00 -1.38 -1.49 119.26 123.09 2rgt h ALA 35 Ca -0.45 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.05 2rgt h ALA 35 Cb 1.21 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.88 2rgt h ALA 35 CO 0.74 0.61 -0.31 0.78 0.00 0.00 0.00 179.25 181.07 2rgt h GLY 36 N 0.99 -0.92 -1.71 0.00 0.00 -1.85 -3.40 103.07 96.19 2rgt h GLY 36 Ca 0.08 0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.75 2rgt h GLY 36 CO 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 176.54 176.27 2rgt n ASP 38 N 1.16 -5.03 -4.54 0.00 8.00 -0.56 -4.97 116.55 110.60 2rgt n ASP 38 Ca 0.13 0.27 -0.28 0.00 0.71 0.00 0.00 54.79 55.62 2rgt n ASP 38 Cb 0.51 -4.36 -0.10 0.00 -0.02 0.00 0.00 41.12 37.15 2rgt n ASP 38 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2rgt s GLN 39 N -4.22 1.98 0.18 -1.24 -1.52 -1.26 -4.77 119.66 108.81 2rgt s GLN 39 Ca 0.00 -1.20 -0.33 0.00 -1.95 0.00 0.00 55.36 51.88 2rgt s GLN 39 Cb 0.00 -2.17 -0.14 0.00 -0.22 0.00 0.00 33.01 30.49 2rgt s GLN 39 CO 0.00 0.46 1.52 0.72 -0.25 0.00 0.00 175.29 177.75 2rgt n HIS 40 N 0.40 2.24 -2.98 0.91 8.25 -1.26 -0.07 115.22 122.71 2rgt n HIS 40 Ca -0.13 0.32 -0.43 0.00 -0.26 0.00 0.00 57.72 57.22 2rgt n HIS 40 Cb 0.54 -2.52 -0.05 0.00 1.12 0.00 0.00 29.99 29.09 2rgt n HIS 40 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2rgt s ILE 41 N 0.60 4.58 -0.86 1.59 1.01 0.08 -4.83 121.20 123.38 2rgt s ILE 41 Ca 0.76 -0.36 0.24 0.00 0.00 0.00 0.00 60.65 61.29 2rgt s ILE 41 Cb -0.67 -4.51 -0.05 0.00 0.01 0.00 0.00 42.46 37.24 2rgt s ILE 41 CO 0.42 -1.13 1.23 0.18 0.00 0.00 0.00 174.94 175.64 2rgt n LEU 42 N 6.97 0.62 -4.69 2.97 4.32 -1.26 -4.67 117.00 121.27 2rgt n LEU 42 Ca -0.04 -0.05 -0.31 0.00 -0.02 0.00 0.00 56.01 55.59 2rgt n LEU 42 Cb 0.45 -0.17 0.15 0.00 -1.62 0.00 0.00 43.42 42.24 2rgt n LEU 42 CO 0.60 0.10 0.68 -1.81 -1.22 0.00 0.00 177.39 175.74 2rgt s ASP 43 N -3.38 3.18 0.09 -1.43 1.01 -1.26 -4.97 116.67 109.91 2rgt s ASP 43 Ca 0.08 2.09 -0.16 0.00 0.71 0.00 0.00 52.55 55.28 2rgt s ASP 43 Cb 0.16 -2.55 -0.10 0.00 1.01 0.00 0.00 42.92 41.44 2rgt s ASP 43 CO 0.75 -2.92 1.39 -0.09 0.21 0.00 0.00 175.17 174.51 2rgt h ARG 44 N -1.74 0.66 -5.09 8.23 2.43 -1.93 -3.42 114.38 113.51 2rgt h ARG 44 Ca -0.44 -0.37 -0.62 0.00 -0.81 0.00 0.00 59.98 57.74 2rgt h ARG 44 Cb 1.26 0.03 -0.16 0.00 -0.42 0.00 0.00 29.97 30.68 2rgt h ARG 44 CO 0.44 0.98 -0.53 -0.06 -1.51 0.00 0.00 179.97 179.29 2rgt s PHE 45 N -4.25 3.26 -0.17 2.20 0.08 -1.26 -2.13 117.98 115.71 2rgt s PHE 45 Ca -0.12 0.10 -0.00 0.00 0.12 0.00 0.00 56.93 57.03 2rgt s PHE 45 Cb 0.08 -2.24 0.00 0.00 -0.57 0.00 0.00 43.02 40.29 2rgt s PHE 45 CO 0.83 0.01 -0.15 0.42 -0.10 0.00 0.00 175.22 176.22 2rgt s ILE 46 N 1.06 2.60 0.11 0.64 1.01 0.59 -4.61 121.20 122.59 2rgt s ILE 46 Ca 0.06 -0.78 -0.27 0.00 0.00 0.00 0.00 60.65 59.67 2rgt s ILE 46 Cb -0.14 -2.11 -0.06 0.00 0.01 0.00 0.00 42.46 40.16 2rgt s ILE 46 CO 0.04 0.51 0.84 -0.76 0.00 0.00 0.00 174.94 175.57 2rgt s LEU 47 N 1.03 4.52 -0.14 2.97 1.43 -0.30 -0.52 118.68 127.66 2rgt s LEU 47 Ca -0.01 1.63 0.01 0.00 -1.03 0.00 0.00 54.13 54.73 2rgt s LEU 47 Cb -0.15 -3.38 -0.01 0.00 0.03 0.00 0.00 46.19 42.69 2rgt s LEU 47 CO -0.04 0.05 -0.16 -0.75 0.23 0.00 0.00 176.35 175.69 2rgt s LYS 48 N -0.41 3.25 -0.27 1.70 2.47 0.80 -0.39 119.74 126.88 2rgt s LYS 48 Ca 0.40 -0.74 -0.24 0.00 -1.56 0.00 0.00 55.97 53.83 2rgt s LYS 48 Cb -0.22 -2.59 0.08 0.00 -1.46 0.00 0.00 37.83 33.64 2rgt s LYS 48 CO 0.26 0.09 0.78 0.00 0.16 0.00 0.00 175.35 176.64 2rgt s ALA 49 N 0.63 -1.83 -1.16 3.13 0.00 -0.68 0.63 121.76 122.48 2rgt s ALA 49 Ca -0.08 2.04 -0.09 0.00 0.00 0.00 0.00 51.96 53.83 2rgt s ALA 49 Cb -0.16 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.68 2rgt s ALA 49 CO 0.03 -0.32 0.83 1.28 0.00 0.00 0.00 175.76 177.57 2rgt n LEU 50 N 2.76 -3.95 -2.38 0.00 7.99 -1.26 -2.02 117.00 118.13 2rgt n LEU 50 Ca -0.14 -0.83 -0.04 0.00 -0.01 0.00 0.00 56.01 54.98 2rgt n LEU 50 Cb 0.56 -2.79 -0.00 0.00 -0.11 0.00 0.00 43.42 41.07 2rgt n LEU 50 CO 0.02 0.32 -0.05 0.47 -1.51 0.00 0.00 177.39 176.65 2rgt n ASP 51 N -3.00 -1.84 -4.04 -1.43 8.00 -1.26 -4.88 116.55 108.10 2rgt n ASP 51 Ca -0.15 0.38 -0.09 0.00 0.71 0.00 0.00 54.79 55.63 2rgt n ASP 51 Cb 0.63 -1.69 -0.08 0.00 -0.02 0.00 0.00 41.12 39.95 2rgt n ASP 51 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2rgt s ARG 52 N -4.81 1.02 0.20 -1.24 1.81 -0.86 -5.17 118.95 109.89 2rgt s ARG 52 Ca 0.00 -1.28 0.07 0.00 -1.72 0.00 0.00 55.73 52.80 2rgt s ARG 52 Cb 0.00 0.31 -0.04 0.00 -0.45 0.00 0.00 34.95 34.77 2rgt s ARG 52 CO 0.00 -0.33 0.09 -1.01 -0.68 0.00 0.00 175.30 173.37 2rgt s HIS 53 N -4.00 2.99 -0.07 -0.53 3.76 -1.26 -1.68 115.29 114.50 2rgt s HIS 53 Ca 0.19 -0.10 -0.11 0.00 -0.15 0.00 0.00 55.06 54.90 2rgt s HIS 53 Cb 0.05 -1.41 0.02 0.00 1.11 0.00 0.00 32.58 32.36 2rgt s HIS 53 CO -0.00 0.53 0.28 -1.58 -0.85 0.00 0.00 174.74 173.12 2rgt s TRP 54 N -1.88 -0.25 0.39 1.40 0.52 0.48 -0.94 118.94 118.65 2rgt s TRP 54 Ca 0.30 0.56 -0.27 0.00 0.02 0.00 0.00 56.10 56.71 2rgt s TRP 54 Cb -0.09 0.09 -0.09 0.00 -1.15 0.00 0.00 33.47 32.22 2rgt s TRP 54 CO 0.22 -0.22 1.35 -1.01 0.02 0.00 0.00 176.95 177.31 2rgt s HIS 55 N -0.36 2.79 0.17 -1.98 3.76 -1.26 -1.15 115.29 117.26 2rgt s HIS 55 Ca -0.05 1.35 -0.16 0.00 -0.15 0.00 0.00 55.06 56.05 2rgt s HIS 55 Cb -0.03 -3.77 0.10 0.00 1.11 0.00 0.00 32.58 29.99 2rgt s HIS 55 CO 0.01 -2.30 1.69 0.66 -0.85 0.00 0.00 174.74 173.96 2rgt h SER 56 N 2.89 -0.21 0.00 1.40 4.64 -1.93 -0.62 113.55 119.71 2rgt h SER 56 Ca -0.50 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2rgt h SER 56 Cb 1.24 0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2rgt h SER 56 CO 0.63 -0.07 0.11 0.07 -0.87 0.00 0.00 176.83 176.71 2rgt h LYS 57 N 0.08 0.00 0.00 4.77 2.10 -1.98 -2.61 116.57 118.93 2rgt h LYS 57 Ca 0.19 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.84 2rgt h LYS 57 Cb 0.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 2rgt h LYS 57 CO -0.34 0.00 -1.50 0.00 -2.00 0.00 0.00 179.45 175.61 2rgt s LEU 59 N -4.17 4.93 0.22 0.00 2.96 -0.91 -4.74 118.68 116.96 2rgt s LEU 59 Ca -0.02 -2.41 0.02 0.00 -0.22 0.00 0.00 54.13 51.50 2rgt s LEU 59 Cb 0.14 -2.42 -0.05 0.00 0.50 0.00 0.00 46.19 44.36 2rgt s LEU 59 CO 0.87 -0.96 0.02 -1.59 -1.32 0.00 0.00 176.35 173.36 2rgt s LYS 60 N 2.42 1.28 0.09 1.98 -2.85 -1.26 -0.81 119.74 120.58 2rgt s LYS 60 Ca 0.38 -1.65 -0.31 0.00 -1.00 0.00 0.00 55.97 53.40 2rgt s LYS 60 Cb -0.03 -0.43 -0.07 0.00 -2.06 0.00 0.00 37.83 35.24 2rgt s LYS 60 CO -0.05 -0.15 1.34 0.00 0.10 0.00 0.00 175.35 176.59 2rgt n SER 62 N 4.08 0.13 -0.08 0.00 2.88 0.13 -0.68 113.62 120.08 2rgt n SER 62 Ca 0.11 0.53 -0.06 0.00 -1.33 0.00 0.00 58.87 58.12 2rgt n SER 62 Cb 0.43 -0.56 -0.02 0.00 -0.75 0.00 0.00 64.21 63.32 2rgt n SER 62 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2rgt n ASP 63 N -1.64 1.83 -0.57 -3.46 8.00 -1.26 -4.74 116.55 114.70 2rgt n ASP 63 Ca 0.03 0.52 0.09 0.00 0.71 0.00 0.00 54.79 56.14 2rgt n ASP 63 Cb 0.19 -0.82 0.04 0.00 -0.02 0.00 0.00 41.12 40.52 2rgt n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2rgt n HIS 65 N 0.53 -0.40 -2.39 0.00 8.25 0.14 -4.94 115.22 116.41 2rgt n HIS 65 Ca 0.09 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.13 2rgt n HIS 65 Cb 0.41 -3.67 -0.03 0.00 1.12 0.00 0.00 29.99 27.81 2rgt n HIS 65 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2rgt s VAL 66 N -2.88 3.93 0.15 1.59 0.11 -1.26 -4.57 120.40 117.47 2rgt s VAL 66 Ca 0.00 1.40 -0.31 0.00 -2.93 0.00 0.00 61.98 60.14 2rgt s VAL 66 Cb 0.00 -3.90 -0.09 0.00 -1.53 0.00 0.00 36.38 30.87 2rgt s VAL 66 CO 0.00 0.12 1.43 -2.84 -3.33 0.00 0.00 175.10 170.48 2rgt s PRO 67 N 0.98 4.30 -0.13 1.54 0.02 -1.26 0.80 135.00 141.25 2rgt s PRO 67 Ca 0.59 2.17 -0.22 0.00 0.02 0.00 0.00 61.00 63.56 2rgt s PRO 67 Cb -0.30 -3.20 -0.03 0.00 0.02 0.00 0.00 34.50 30.98 2rgt s PRO 67 CO 0.30 -0.45 0.66 -0.51 -0.33 0.00 0.00 177.00 176.66 2rgt s LEU 68 N 0.79 4.24 -0.10 -5.54 1.43 0.00 -4.88 118.68 114.62 2rgt s LEU 68 Ca 0.64 1.02 0.04 0.00 -1.03 0.00 0.00 54.13 54.80 2rgt s LEU 68 Cb -0.39 -2.98 -0.09 0.00 0.03 0.00 0.00 46.19 42.76 2rgt s LEU 68 CO 0.33 -0.18 -0.04 0.00 0.23 0.00 0.00 176.35 176.69 2rgt n ALA 69 N 4.35 1.77 0.00 4.21 0.00 -1.26 -4.87 120.51 124.71 2rgt n ALA 69 Ca -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2rgt n ALA 69 Cb 0.51 0.16 0.00 0.00 0.00 0.00 0.00 19.45 20.11 2rgt n ALA 69 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2rgt n GLU 70 N -2.59 2.77 -3.99 0.00 1.02 -1.26 -4.81 120.64 111.78 2rgt n GLU 70 Ca -0.17 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 56.88 2rgt n GLU 70 Cb 0.75 -0.91 -0.11 0.00 -0.02 0.00 0.00 31.44 31.15 2rgt n GLU 70 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2rgt s ARG 71 N -1.78 0.35 0.05 3.49 0.52 -1.26 -1.68 118.95 118.63 2rgt s ARG 71 Ca 0.00 -0.68 0.00 0.00 -0.52 0.00 0.00 55.73 54.54 2rgt s ARG 71 Cb 0.00 0.10 -0.03 0.00 0.52 0.00 0.00 34.95 35.54 2rgt s ARG 71 CO 0.00 -0.05 -0.04 0.00 0.02 0.00 0.00 175.30 175.22 2rgt s PHE 73 N -2.64 2.56 -0.02 0.00 0.08 -0.59 -0.95 117.98 116.42 2rgt s PHE 73 Ca -0.03 -0.63 0.04 0.00 0.12 0.00 0.00 56.93 56.44 2rgt s PHE 73 Cb -0.01 -1.66 -0.01 0.00 -0.57 0.00 0.00 43.02 40.77 2rgt s PHE 73 CO -0.04 -0.16 -0.16 0.45 -0.10 0.00 0.00 175.22 175.21 2rgt s SER 74 N -0.14 1.92 -0.06 1.36 0.15 -1.26 -0.77 113.70 114.90 2rgt s SER 74 Ca -0.03 -0.30 -0.02 0.00 0.70 0.00 0.00 55.95 56.29 2rgt s SER 74 Cb -0.14 -0.35 0.04 0.00 -1.71 0.00 0.00 66.02 63.85 2rgt s SER 74 CO 0.04 0.17 0.09 -0.60 1.20 0.00 0.00 173.24 174.13 2rgt s ARG 75 N -0.18 -0.05 6.89 5.44 3.00 -0.53 -5.03 118.95 128.50 2rgt s ARG 75 Ca 0.02 0.41 0.00 0.00 -1.00 0.00 0.00 55.73 55.15 2rgt s ARG 75 Cb -0.08 -0.50 0.00 0.00 0.00 0.00 0.00 34.95 34.36 2rgt s ARG 75 CO 0.00 -0.34 0.00 0.41 0.00 0.00 0.00 175.30 175.38 2rgt n GLY 76 N 5.31 2.81 0.29 8.12 0.00 -1.26 -1.52 105.19 118.94 2rgt n GLY 76 Ca -0.04 0.29 0.10 0.00 0.00 0.00 0.00 46.02 46.37 2rgt n GLY 76 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2rgt n GLU 77 N 6.83 1.11 -3.96 1.61 1.02 -1.26 -5.00 120.64 120.98 2rgt n GLU 77 Ca 0.00 -0.59 -0.28 0.00 -0.02 0.00 0.00 57.16 56.26 2rgt n GLU 77 Cb 0.00 -1.41 -0.04 0.00 -0.02 0.00 0.00 31.44 29.97 2rgt n GLU 77 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2rgt s SER 78 N -2.48 6.20 0.06 1.62 0.01 -0.57 -5.12 113.70 113.42 2rgt s SER 78 Ca 0.13 0.16 0.09 0.00 1.31 0.00 0.00 55.95 57.65 2rgt s SER 78 Cb 0.16 -1.85 -0.03 0.00 0.21 0.00 0.00 66.02 64.51 2rgt s SER 78 CO 0.62 0.10 -0.25 0.54 0.41 0.00 0.00 173.24 174.66 2rgt s VAL 79 N -1.63 2.03 0.05 3.43 0.11 -1.26 -1.45 120.40 121.66 2rgt s VAL 79 Ca 0.34 -1.43 -0.03 0.00 -2.93 0.00 0.00 61.98 57.93 2rgt s VAL 79 Cb -0.12 -1.76 -0.02 0.00 -1.53 0.00 0.00 36.38 32.95 2rgt s VAL 79 CO 0.27 0.25 0.04 -0.31 -3.33 0.00 0.00 175.10 172.02 2rgt s TYR 80 N -0.87 0.34 1.10 1.54 2.02 0.05 0.21 117.35 121.73 2rgt s TYR 80 Ca 0.11 -0.77 -0.15 0.00 -0.37 0.00 0.00 57.07 55.89 2rgt s TYR 80 Cb -0.10 -0.24 0.24 0.00 -0.40 0.00 0.00 41.96 41.46 2rgt s TYR 80 CO 0.03 -0.38 1.10 0.00 -1.57 0.00 0.00 175.55 174.72 2rgt h LYS 82 N -2.24 -0.15 -0.67 0.00 3.64 -1.96 -2.23 116.57 112.96 2rgt h LYS 82 Ca -0.51 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 58.81 2rgt h LYS 82 Cb 1.32 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.15 2rgt h LYS 82 CO 0.48 -0.08 0.14 -0.44 -2.27 0.00 0.00 179.45 177.27 2rgt h ASP 83 N -0.18 1.02 1.07 4.20 3.32 -1.98 0.16 116.42 124.03 2rgt h ASP 83 Ca -0.02 -0.22 -0.14 0.00 0.02 0.00 0.00 57.03 56.67 2rgt h ASP 83 Cb 0.14 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 2rgt h ASP 83 CO 0.03 0.99 -0.66 0.44 -1.72 0.00 0.00 179.24 178.31 2rgt h ASP 84 N 1.01 0.00 -0.18 6.45 3.32 -1.94 -0.16 116.42 124.91 2rgt h ASP 84 Ca 0.21 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.08 2rgt h ASP 84 Cb 0.39 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.94 2rgt h ASP 84 CO 0.01 0.66 -0.59 0.15 -1.72 0.00 0.00 179.24 177.75 2rgt h PHE 85 N 0.00 0.94 -0.70 4.55 3.57 -1.11 -2.75 116.94 121.44 2rgt h PHE 85 Ca -0.01 -0.38 -0.05 0.00 3.53 0.00 0.00 57.97 61.06 2rgt h PHE 85 Cb 1.38 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.93 2rgt h PHE 85 CO 0.00 1.19 0.25 0.35 -2.23 0.00 0.00 178.31 177.87 2rgt h PHE 86 N 0.43 1.10 -0.21 0.41 3.57 -0.57 0.64 116.94 122.31 2rgt h PHE 86 Ca -0.02 -0.10 0.05 0.00 3.53 0.00 0.00 57.97 61.43 2rgt h PHE 86 Cb 1.21 -0.32 -0.07 0.00 2.79 0.00 0.00 35.95 39.55 2rgt h PHE 86 CO 0.09 0.87 -0.44 -0.22 -2.23 0.00 0.00 178.31 176.38 2rgt h LYS 87 N 1.02 -0.44 0.10 1.11 3.64 -1.02 -1.91 116.57 119.07 2rgt h LYS 87 Ca 0.23 0.03 -0.29 0.00 -1.27 0.00 0.00 60.65 59.35 2rgt h LYS 87 Cb 0.26 0.10 0.03 0.00 -0.41 0.00 0.00 32.23 32.20 2rgt h LYS 87 CO -0.01 -0.29 -1.18 0.00 -2.27 0.00 0.00 179.45 175.69 2rgt h ARG 88 N -0.45 0.63 0.00 1.90 3.08 -1.31 -3.41 114.38 114.83 2rgt h ARG 88 Ca 0.09 -0.81 0.00 0.00 0.07 0.00 0.00 59.98 59.33 2rgt h ARG 88 Cb 0.62 0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.93 2rgt h ARG 88 CO -0.45 1.36 0.00 1.19 -1.07 0.00 0.00 179.97 181.00 2rgt n PHE 89 N -3.83 0.00 -1.58 3.04 3.72 0.20 -5.09 117.46 113.93 2rgt n PHE 89 Ca -0.13 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 56.98 2rgt n PHE 89 Cb 0.96 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 39.66 2rgt n PHE 89 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2rgt s GLY 90 N -0.01 1.63 0.14 1.37 0.00 -0.72 -4.78 107.32 104.95 2rgt s GLY 90 Ca 0.00 -0.79 -0.35 0.00 0.00 0.00 0.00 44.72 43.59 2rgt s GLY 90 CO 0.00 -0.12 1.32 2.41 0.00 0.00 0.00 173.10 176.71 2rgt n THR 91 N -3.92 0.37 -4.97 0.90 -1.04 -0.82 -4.89 114.28 99.91 2rgt n THR 91 Ca 0.10 -0.09 -0.27 0.00 -2.04 0.00 0.00 64.05 61.74 2rgt n THR 91 Cb 0.59 -0.98 -0.16 0.00 -1.82 0.00 0.00 70.33 67.97 2rgt n THR 91 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2rgt s LYS 92 N 0.18 1.91 0.08 -2.82 -0.14 -1.26 -1.09 119.74 116.60 2rgt s LYS 92 Ca 0.79 -0.71 -0.31 0.00 -1.36 0.00 0.00 55.97 54.38 2rgt s LYS 92 Cb -0.86 -1.69 -0.09 0.00 -1.68 0.00 0.00 37.83 33.51 2rgt s LYS 92 CO 0.48 0.33 1.75 0.00 -0.76 0.00 0.00 175.35 177.15 2rgt h ALA 94 N 8.75 1.00 0.00 0.00 0.00 -1.56 0.52 119.26 127.96 2rgt h ALA 94 Ca -0.44 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.41 2rgt h ALA 94 Cb 1.21 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2rgt h ALA 94 CO 0.94 0.00 -0.69 0.00 0.00 0.00 0.00 179.25 179.50 2rgt n ALA 95 N -1.96 0.53 1.01 0.00 0.00 -1.26 -4.62 120.51 114.21 2rgt n ALA 95 Ca -0.01 -0.43 0.12 0.00 0.00 0.00 0.00 53.44 53.12 2rgt n ALA 95 Cb 0.16 -0.12 0.07 0.00 0.00 0.00 0.00 19.45 19.56 2rgt n ALA 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rgt n GLN 97 N 0.76 -1.34 -2.71 0.00 1.13 0.18 -4.96 117.38 110.43 2rgt n GLN 97 Ca 0.12 0.34 -0.35 0.00 -1.94 0.00 0.00 57.00 55.17 2rgt n GLN 97 Cb 0.54 -4.52 -0.06 0.00 0.11 0.00 0.00 30.24 26.32 2rgt n GLN 97 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2rgt s LEU 98 N 0.00 4.05 0.32 1.08 1.43 -1.26 -4.59 118.68 119.71 2rgt s LEU 98 Ca 0.00 1.83 -0.29 0.00 -1.03 0.00 0.00 54.13 54.64 2rgt s LEU 98 Cb 0.00 -4.35 -0.11 0.00 0.03 0.00 0.00 46.19 41.75 2rgt s LEU 98 CO 0.00 -0.39 1.57 -0.83 0.23 0.00 0.00 176.35 176.92 2rgt s GLY 99 N -1.90 2.36 -0.25 -3.19 0.00 -1.26 -0.84 107.32 102.25 2rgt s GLY 99 Ca 0.59 1.59 -0.05 0.00 0.00 0.00 0.00 44.72 46.85 2rgt s GLY 99 CO 0.19 2.48 -0.00 -0.42 0.00 0.00 0.00 173.10 175.35 2rgt s ILE 100 N -0.34 3.55 0.74 0.90 1.01 -0.25 -4.86 121.20 121.95 2rgt s ILE 100 Ca 0.60 -0.58 -0.11 0.00 0.00 0.00 0.00 60.65 60.56 2rgt s ILE 100 Cb -0.48 -2.70 0.04 0.00 0.01 0.00 0.00 42.46 39.32 2rgt s ILE 100 CO 0.53 0.29 1.08 -2.16 0.00 0.00 0.00 174.94 174.68 2rgt s PRO 101 N 1.48 2.55 0.04 2.79 0.04 -1.26 -4.44 135.00 136.20 2rgt s PRO 101 Ca 0.04 1.07 0.08 0.00 0.04 0.00 0.00 61.00 62.24 2rgt s PRO 101 Cb -0.15 -1.94 0.36 0.00 0.04 0.00 0.00 34.50 32.81 2rgt s PRO 101 CO -0.01 -1.41 1.26 -0.35 0.04 0.00 0.00 177.00 176.53 2rgt n PRO 102 N -3.35 0.02 0.00 0.56 -0.04 -1.26 -1.42 135.00 129.51 2rgt n PRO 102 Ca 0.08 0.42 0.14 0.00 -0.04 0.00 0.00 63.50 64.10 2rgt n PRO 102 Cb 0.53 -1.55 0.60 0.00 -0.04 0.00 0.00 33.50 33.04 2rgt n PRO 102 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2rgt n THR 103 N -1.60 0.05 -4.45 0.52 -2.24 -1.26 -4.55 114.28 100.75 2rgt n THR 103 Ca 0.01 0.01 -0.34 0.00 -2.27 0.00 0.00 64.05 61.47 2rgt n THR 103 Cb 0.08 -0.52 -0.14 0.00 -2.10 0.00 0.00 70.33 67.64 2rgt n THR 103 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2rgt s GLN 104 N -3.00 3.33 0.62 -0.78 0.74 -0.51 -5.11 119.66 114.95 2rgt s GLN 104 Ca 0.14 -0.69 -0.15 0.00 0.05 0.00 0.00 55.36 54.71 2rgt s GLN 104 Cb 0.19 -2.73 -0.02 0.00 1.10 0.00 0.00 33.01 31.54 2rgt s GLN 104 CO 0.52 0.04 1.07 0.14 -0.55 0.00 0.00 175.29 176.51 2rgt s VAL 105 N 0.80 3.69 0.43 1.34 -7.23 -1.26 -4.68 120.40 113.50 2rgt s VAL 105 Ca -0.04 0.77 0.04 0.00 -1.81 0.00 0.00 61.98 60.94 2rgt s VAL 105 Cb -0.15 -3.31 -0.05 0.00 0.56 0.00 0.00 36.38 33.43 2rgt s VAL 105 CO 0.01 -0.50 0.02 0.68 -0.31 0.00 0.00 175.10 175.00 2rgt s VAL 106 N -2.48 1.48 0.05 1.32 -7.23 -0.06 -4.55 120.40 108.93 2rgt s VAL 106 Ca 0.64 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.87 2rgt s VAL 106 Cb -0.17 -2.63 -0.03 0.00 0.56 0.00 0.00 36.38 34.11 2rgt s VAL 106 CO 0.40 0.00 -0.14 -0.13 -0.31 0.00 0.00 175.10 174.92 2rgt s ARG 107 N -3.79 2.19 -0.02 4.82 1.81 -0.39 -0.03 118.95 123.53 2rgt s ARG 107 Ca 0.24 -0.93 0.06 0.00 -1.72 0.00 0.00 55.73 53.37 2rgt s ARG 107 Cb 0.06 -2.29 -0.01 0.00 -0.45 0.00 0.00 34.95 32.26 2rgt s ARG 107 CO 0.12 0.55 -0.19 0.50 -0.68 0.00 0.00 175.30 175.60 2rgt s ARG 108 N -1.62 1.64 -0.26 3.54 3.52 -1.26 -0.05 118.95 124.46 2rgt s ARG 108 Ca 0.17 -0.68 -0.02 0.00 -0.13 0.00 0.00 55.73 55.06 2rgt s ARG 108 Cb -0.11 -1.54 0.09 0.00 -1.56 0.00 0.00 34.95 31.83 2rgt s ARG 108 CO 0.08 0.38 0.09 0.00 -0.81 0.00 0.00 175.30 175.03 2rgt s ALA 109 N -0.34 1.08 0.00 6.12 0.00 -0.75 -4.74 121.76 123.13 2rgt s ALA 109 Ca 0.05 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.84 2rgt s ALA 109 Cb -0.08 -1.40 0.00 0.00 0.00 0.00 0.00 23.12 21.63 2rgt s ALA 109 CO 0.00 -1.50 0.00 1.04 0.00 0.00 0.00 175.76 175.30 2rgt n GLN 110 N 5.04 0.00 0.00 0.00 6.02 -1.26 -1.76 117.38 125.42 2rgt n GLN 110 Ca -0.05 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.06 2rgt n GLN 110 Cb 0.44 0.00 0.26 0.00 1.02 0.00 0.00 30.24 31.95 2rgt n GLN 110 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2rgt n ASP 111 N 9.26 0.61 -4.83 1.08 8.00 -1.26 -4.90 116.55 124.51 2rgt n ASP 111 Ca 0.00 -0.38 -0.34 0.00 0.71 0.00 0.00 54.79 54.78 2rgt n ASP 111 Cb 0.00 0.26 -0.06 0.00 -0.02 0.00 0.00 41.12 41.30 2rgt n ASP 111 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2rgt s PHE 112 N -2.92 3.48 0.04 1.24 0.08 -0.72 -5.08 117.98 114.10 2rgt s PHE 112 Ca 0.13 1.39 0.04 0.00 0.12 0.00 0.00 56.93 58.61 2rgt s PHE 112 Cb 0.18 -2.65 -0.02 0.00 -0.57 0.00 0.00 43.02 39.95 2rgt s PHE 112 CO 0.68 0.14 -0.11 0.08 -0.10 0.00 0.00 175.22 175.90 2rgt s VAL 113 N -1.85 0.88 0.02 -0.44 1.01 -1.26 -1.81 120.40 116.96 2rgt s VAL 113 Ca 0.52 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.50 2rgt s VAL 113 Cb -0.13 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 2rgt s VAL 113 CO 0.18 -0.14 -0.05 -0.31 0.00 0.00 0.00 175.10 174.78 2rgt s TYR 114 N -1.01 0.47 0.49 5.22 2.02 0.93 -1.34 117.35 124.14 2rgt s TYR 114 Ca -0.02 -0.38 -0.21 0.00 -0.37 0.00 0.00 57.07 56.09 2rgt s TYR 114 Cb -0.08 -0.30 -0.10 0.00 -0.40 0.00 0.00 41.96 41.08 2rgt s TYR 114 CO 0.01 -0.09 0.71 0.72 -1.57 0.00 0.00 175.55 175.33 2rgt n HIS 115 N 1.93 0.02 -0.13 2.71 8.25 -1.26 -1.26 115.22 125.48 2rgt n HIS 115 Ca -0.20 0.52 -0.04 0.00 -0.26 0.00 0.00 57.72 57.73 2rgt n HIS 115 Cb 0.56 -2.06 0.04 0.00 1.12 0.00 0.00 29.99 29.65 2rgt n HIS 115 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2rgt h LEU 116 N 0.75 -0.04 -0.74 2.41 3.38 -1.93 -1.09 115.31 118.05 2rgt h LEU 116 Ca -0.44 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2rgt h LEU 116 Cb 1.38 0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.25 2rgt h LEU 116 CO 0.51 0.01 0.00 0.00 0.09 0.00 0.00 178.44 179.05 2rgt n HIS 117 N -5.13 0.55 1.03 1.13 1.44 -1.26 -1.65 115.22 111.33 2rgt n HIS 117 Ca 0.03 0.25 0.12 0.00 -2.01 0.00 0.00 57.72 56.11 2rgt n HIS 117 Cb 0.21 -0.90 0.11 0.00 0.12 0.00 0.00 29.99 29.53 2rgt n HIS 117 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2rgt s PHE 119 N -2.07 4.21 -0.03 0.00 5.36 -0.66 -4.83 117.98 119.96 2rgt s PHE 119 Ca 0.27 -2.61 -0.10 0.00 -0.96 0.00 0.00 56.93 53.53 2rgt s PHE 119 Cb 0.20 -3.83 0.01 0.00 -0.34 0.00 0.00 43.02 39.06 2rgt s PHE 119 CO 0.34 -0.95 0.21 0.00 -1.46 0.00 0.00 175.22 173.36 2rgt s ALA 120 N -1.09 -0.53 0.06 11.12 0.00 -1.26 -0.40 121.76 129.66 2rgt s ALA 120 Ca 0.29 0.22 -0.30 0.00 0.00 0.00 0.00 51.96 52.17 2rgt s ALA 120 Cb -0.10 -0.04 -0.10 0.00 0.00 0.00 0.00 23.12 22.88 2rgt s ALA 120 CO -0.08 -0.20 1.94 0.00 0.00 0.00 0.00 175.76 177.42 2rgt h VAL 122 N 5.37 0.00 0.00 0.00 3.04 -0.19 0.68 116.25 125.15 2rgt h VAL 122 Ca -0.49 0.00 -0.27 0.00 -1.01 0.00 0.00 66.70 64.93 2rgt h VAL 122 Cb 1.24 0.62 -0.04 0.00 -2.01 0.00 0.00 31.29 31.10 2rgt h VAL 122 CO 0.94 0.00 -1.53 0.52 -1.01 0.00 0.00 177.57 176.50 2rgt n VAL 123 N -2.56 1.52 0.58 1.51 0.31 -1.26 -4.53 118.33 113.91 2rgt n VAL 123 Ca -0.02 -0.09 0.06 0.00 -0.01 0.00 0.00 64.34 64.28 2rgt n VAL 123 Cb 0.15 -2.04 -0.03 0.00 -0.91 0.00 0.00 33.84 31.02 2rgt n VAL 123 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2rgt n LYS 125 N -0.57 -0.21 -1.98 0.00 4.76 0.23 -4.96 118.16 115.43 2rgt n LYS 125 Ca 0.04 0.05 -0.41 0.00 -2.87 0.00 0.00 58.31 55.12 2rgt n LYS 125 Cb 0.25 -3.57 -0.02 0.00 -1.84 0.00 0.00 35.03 29.85 2rgt n LYS 125 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2rgt s ARG 126 N -0.59 4.25 -0.11 1.97 3.52 -1.26 -4.60 118.95 122.13 2rgt s ARG 126 Ca 0.00 2.34 -0.30 0.00 -0.13 0.00 0.00 55.73 57.65 2rgt s ARG 126 Cb 0.00 -3.10 -0.02 0.00 -1.56 0.00 0.00 34.95 30.27 2rgt s ARG 126 CO 0.00 -0.45 1.15 -1.14 -0.81 0.00 0.00 175.30 174.05 2rgt s GLN 127 N -0.38 4.33 0.14 5.12 0.74 -1.26 -0.14 119.66 128.22 2rgt s GLN 127 Ca 0.60 1.57 -0.30 0.00 0.05 0.00 0.00 55.36 57.28 2rgt s GLN 127 Cb -0.43 -3.60 -0.08 0.00 1.10 0.00 0.00 33.01 30.00 2rgt s GLN 127 CO 0.44 -0.49 1.27 -0.51 -0.55 0.00 0.00 175.29 175.44 2rgt s LEU 128 N 2.54 4.40 0.38 3.68 1.43 0.47 -4.94 118.68 126.64 2rgt s LEU 128 Ca 0.53 2.24 0.07 0.00 -1.03 0.00 0.00 54.13 55.94 2rgt s LEU 128 Cb -0.21 -3.60 -0.00 0.00 0.03 0.00 0.00 46.19 42.40 2rgt s LEU 128 CO 0.18 -0.49 0.48 0.00 0.23 0.00 0.00 176.35 176.74 2rgt s ALA 129 N 0.52 4.30 0.06 4.21 0.00 -1.26 -4.92 121.76 124.66 2rgt s ALA 129 Ca 0.58 -1.62 -0.34 0.00 0.00 0.00 0.00 51.96 50.58 2rgt s ALA 129 Cb -0.34 -1.52 -0.13 0.00 0.00 0.00 0.00 23.12 21.13 2rgt s ALA 129 CO 0.34 -0.16 1.72 2.41 0.00 0.00 0.00 175.76 180.07 2rgt n THR 130 N -1.69 0.26 0.00 0.00 -1.04 -1.26 -1.46 114.28 109.09 2rgt n THR 130 Ca 0.04 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 2rgt n THR 130 Cb 0.59 -1.71 0.00 0.00 -1.82 0.00 0.00 70.33 67.39 2rgt n THR 130 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2rgt n GLY 131 N 3.86 1.67 3.76 3.41 0.00 0.26 -4.98 105.19 113.17 2rgt n GLY 131 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2rgt n GLY 131 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2rgt s ASP 132 N -2.22 6.49 0.12 1.61 1.01 -0.54 -4.61 116.67 118.53 2rgt s ASP 132 Ca 0.00 2.86 -0.19 0.00 0.71 0.00 0.00 52.55 55.93 2rgt s ASP 132 Cb 0.00 -2.64 -0.07 0.00 1.01 0.00 0.00 42.92 41.22 2rgt s ASP 132 CO 0.00 -0.81 0.62 -1.61 0.21 0.00 0.00 175.17 173.58 2rgt s GLU 133 N -0.90 4.22 0.23 8.23 2.02 -1.26 -0.99 118.70 130.25 2rgt s GLU 133 Ca 0.59 0.77 -0.19 0.00 0.02 0.00 0.00 54.97 56.16 2rgt s GLU 133 Cb -0.45 -3.13 0.03 0.00 0.10 0.00 0.00 34.13 30.68 2rgt s GLU 133 CO 0.50 0.56 0.61 -0.59 0.02 0.00 0.00 175.26 176.36 2rgt s PHE 134 N -1.25 -0.16 -0.06 1.61 -0.71 0.11 -1.76 117.98 115.77 2rgt s PHE 134 Ca 0.34 -0.21 0.03 0.00 -1.04 0.00 0.00 56.93 56.04 2rgt s PHE 134 Cb -0.19 0.53 -0.03 0.00 -1.21 0.00 0.00 43.02 42.12 2rgt s PHE 134 CO 0.20 -1.05 -0.13 0.71 -1.34 0.00 0.00 175.22 173.62 2rgt s TYR 135 N -3.89 2.76 -0.15 3.49 2.02 -0.05 0.15 117.35 121.67 2rgt s TYR 135 Ca 0.10 -0.13 -0.08 0.00 -0.37 0.00 0.00 57.07 56.59 2rgt s TYR 135 Cb -0.03 -1.65 -0.04 0.00 -0.40 0.00 0.00 41.96 39.83 2rgt s TYR 135 CO 0.01 0.21 0.12 -1.17 -1.57 0.00 0.00 175.55 173.15 2rgt s LEU 136 N -0.71 4.22 0.23 -1.29 2.96 0.35 -1.93 118.68 122.51 2rgt s LEU 136 Ca 0.11 0.33 -0.03 0.00 -0.22 0.00 0.00 54.13 54.32 2rgt s LEU 136 Cb -0.11 -2.05 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 2rgt s LEU 136 CO 0.01 0.30 0.46 -0.04 -1.32 0.00 0.00 176.35 175.76 2rgt s MET 137 N -0.38 3.58 0.44 1.98 -1.94 -0.41 -2.09 119.30 120.47 2rgt s MET 137 Ca 0.11 -0.17 0.35 0.00 -1.71 0.00 0.00 55.69 54.27 2rgt s MET 137 Cb -0.12 -2.76 1.45 0.00 2.01 0.00 0.00 34.83 35.41 2rgt s MET 137 CO 0.01 0.33 1.44 -0.85 -0.01 0.00 0.00 175.02 175.94 2rgt n GLU 138 N -0.70 -0.02 -0.44 2.03 0.00 -1.26 -1.22 120.64 119.01 2rgt n GLU 138 Ca -0.03 1.11 0.10 0.00 0.00 0.00 0.00 57.16 58.34 2rgt n GLU 138 Cb 0.54 -2.29 0.31 0.00 0.00 0.00 0.00 31.44 29.99 2rgt n GLU 138 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 2rgt n ASP 139 N -4.32 4.12 0.00 -1.84 5.75 -1.26 -4.91 116.55 114.08 2rgt n ASP 139 Ca 0.38 -2.24 0.00 0.00 -0.01 0.00 0.00 54.79 52.92 2rgt n ASP 139 Cb 1.57 -0.49 0.00 0.00 -1.03 0.00 0.00 41.12 41.18 2rgt n ASP 139 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2rgt n SER 140 N 1.12 -0.59 -4.78 -1.12 3.41 -0.36 -5.05 113.62 106.24 2rgt n SER 140 Ca 0.23 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.46 2rgt n SER 140 Cb 0.72 -0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 64.54 2rgt n SER 140 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2rgt s ARG 141 N -0.29 4.16 -0.05 4.33 0.52 -1.26 -4.86 118.95 121.50 2rgt s ARG 141 Ca 0.00 1.64 0.05 0.00 -0.52 0.00 0.00 55.73 56.90 2rgt s ARG 141 Cb 0.00 -2.63 -0.01 0.00 0.52 0.00 0.00 34.95 32.83 2rgt s ARG 141 CO 0.00 -0.17 -0.22 -0.51 0.02 0.00 0.00 175.30 174.42 2rgt s LEU 142 N -2.50 2.01 -0.06 2.53 1.43 -1.26 -1.29 118.68 119.53 2rgt s LEU 142 Ca 0.57 -0.45 0.03 0.00 -1.03 0.00 0.00 54.13 53.26 2rgt s LEU 142 Cb -0.26 -1.21 0.00 0.00 0.03 0.00 0.00 46.19 44.76 2rgt s LEU 142 CO 0.32 0.21 -0.16 -0.69 0.23 0.00 0.00 176.35 176.25 2rgt s VAL 143 N -0.09 1.43 0.70 -1.59 1.01 -0.81 0.60 120.40 121.64 2rgt s VAL 143 Ca -0.03 -0.68 -0.16 0.00 0.00 0.00 0.00 61.98 61.10 2rgt s VAL 143 Cb -0.13 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.02 2rgt s VAL 143 CO 0.03 0.42 1.25 0.00 0.00 0.00 0.00 175.10 176.79 2rgt n LYS 145 N -2.37 -0.16 -0.16 0.00 4.81 -0.72 -1.53 118.16 118.03 2rgt n LYS 145 Ca 0.15 1.25 -0.11 0.00 -0.87 0.00 0.00 58.31 58.72 2rgt n LYS 145 Cb 0.49 -1.86 -0.00 0.00 0.02 0.00 0.00 35.03 33.68 2rgt n LYS 145 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2rgt h ALA 146 N 1.23 0.66 0.00 3.14 0.00 -1.90 -2.03 119.26 120.35 2rgt h ALA 146 Ca 0.31 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2rgt h ALA 146 Cb 0.51 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2rgt h ALA 146 CO -0.81 0.63 0.00 -0.25 0.00 0.00 0.00 179.25 178.82 2rgt n ASP 147 N -4.14 0.46 -0.08 0.00 8.00 -1.04 -2.94 116.55 116.81 2rgt n ASP 147 Ca -0.00 0.56 -0.12 0.00 0.71 0.00 0.00 54.79 55.94 2rgt n ASP 147 Cb 0.45 -0.68 -0.08 0.00 -0.02 0.00 0.00 41.12 40.79 2rgt n ASP 147 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2rgt h TYR 148 N 0.00 0.00 0.00 1.24 3.20 -0.98 -3.20 116.97 117.23 2rgt h TYR 148 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2rgt h TYR 148 Cb 0.56 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.83 2rgt h TYR 148 CO 0.00 0.76 0.00 0.39 -1.64 0.00 0.00 178.16 177.67 2rgt n GLU 149 N -4.60 0.59 0.00 1.82 1.02 -0.79 -3.45 120.64 115.24 2rgt n GLU 149 Ca -0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 2rgt n GLU 149 Cb 0.40 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 2rgt n GLU 149 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2rgt n THR 150 N -0.88 0.00 0.00 2.62 -1.04 -1.15 -4.98 114.28 108.85 2rgt n THR 150 Ca 0.11 0.19 0.00 0.00 -2.04 0.00 0.00 64.05 62.30 2rgt n THR 150 Cb 0.05 -0.59 0.00 0.00 -1.82 0.00 0.00 70.33 67.97 2rgt n THR 150 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2rgt n ALA 151 N -1.11 1.92 -1.00 2.41 0.00 -1.22 -5.12 120.51 116.39 2rgt n ALA 151 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2rgt n ALA 151 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.52 2rgt n ALA 151 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2rgt n LYS 152 N -1.56 1.60 0.00 0.00 3.00 -1.21 -5.05 118.16 114.94 2rgt n LYS 152 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2rgt n LYS 152 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.11 2rgt n LYS 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2rgt n GLY 262 N 0.00 2.86 3.78 3.14 0.00 -1.26 -4.63 105.19 109.08 2rgt n GLY 262 Ca 0.00 -1.82 -0.38 0.00 0.00 0.00 0.00 46.02 43.82 2rgt n GLY 262 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rgt s THR 263 N -2.38 4.99 0.34 2.61 2.01 -0.89 -4.87 115.64 117.46 2rgt s THR 263 Ca 0.00 1.02 -0.27 0.00 0.31 0.00 0.00 61.69 62.75 2rgt s THR 263 Cb 0.00 -3.82 -0.09 0.00 0.01 0.00 0.00 72.50 68.60 2rgt s THR 263 CO 0.00 0.47 1.15 -2.16 -0.69 0.00 0.00 174.62 173.39 2rgt s PRO 264 N -0.44 4.33 0.17 4.92 0.04 -1.26 -0.49 135.00 142.27 2rgt s PRO 264 Ca 0.27 1.84 -0.06 0.00 0.04 0.00 0.00 61.00 63.09 2rgt s PRO 264 Cb -0.17 -2.91 -0.02 0.00 0.04 0.00 0.00 34.50 31.44 2rgt s PRO 264 CO 0.14 -0.08 0.21 -1.64 0.04 0.00 0.00 177.00 175.68 2rgt s MET 265 N -1.93 1.15 -0.02 4.56 -1.94 0.41 -4.89 119.30 116.63 2rgt s MET 265 Ca 0.51 -1.35 0.07 0.00 -1.71 0.00 0.00 55.69 53.22 2rgt s MET 265 Cb -0.31 0.33 -0.02 0.00 2.01 0.00 0.00 34.83 36.84 2rgt s MET 265 CO 0.40 -0.40 -0.24 0.08 -0.01 0.00 0.00 175.02 174.85 2rgt s VAL 266 N -4.03 1.93 -0.11 -6.03 1.01 -1.26 -0.71 120.40 111.20 2rgt s VAL 266 Ca 0.24 -1.04 -0.29 0.00 0.00 0.00 0.00 61.98 60.88 2rgt s VAL 266 Cb 0.05 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 2rgt s VAL 266 CO 0.04 0.55 1.44 0.00 0.00 0.00 0.00 175.10 177.12 2rgt s ALA 267 N -0.54 3.64 0.64 5.51 0.00 -0.17 -4.93 121.76 125.92 2rgt s ALA 267 Ca 0.08 0.69 -0.11 0.00 0.00 0.00 0.00 51.96 52.62 2rgt s ALA 267 Cb -0.10 -3.67 -0.02 0.00 0.00 0.00 0.00 23.12 19.33 2rgt s ALA 267 CO -0.01 -1.25 1.04 0.00 0.00 0.00 0.00 175.76 175.54 2rgt s ALA 268 N 3.66 2.92 0.63 0.00 0.00 -1.26 -0.58 121.76 127.13 2rgt s ALA 268 Ca 0.63 0.01 -0.17 0.00 0.00 0.00 0.00 51.96 52.43 2rgt s ALA 268 Cb -0.27 -3.13 -0.10 0.00 0.00 0.00 0.00 23.12 19.63 2rgt s ALA 268 CO 0.22 -0.87 0.24 0.43 0.00 0.00 0.00 175.76 175.77 2rgt n SER 269 N -2.80 -2.21 -4.72 0.00 7.64 -1.26 -4.67 113.62 105.60 2rgt n SER 269 Ca 0.07 0.63 -0.38 0.00 1.01 0.00 0.00 58.87 60.20 2rgt n SER 269 Cb 0.54 -1.06 0.06 0.00 -1.01 0.00 0.00 64.21 62.73 2rgt n SER 269 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2rgt n PRO 270 N 0.38 1.33 -5.30 1.43 -0.02 -1.26 -4.86 135.00 126.70 2rgt n PRO 270 Ca 0.09 0.51 -0.31 0.00 -2.02 0.00 0.00 63.50 61.77 2rgt n PRO 270 Cb 0.49 -2.50 -0.16 0.00 -0.02 0.00 0.00 33.50 31.31 2rgt n PRO 270 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2rgt s GLU 271 N -3.07 2.15 0.52 -0.52 2.02 0.95 -4.89 118.70 115.86 2rgt s GLU 271 Ca 0.77 -0.92 -0.21 0.00 0.02 0.00 0.00 54.97 54.63 2rgt s GLU 271 Cb -0.40 -2.05 -0.06 0.00 0.10 0.00 0.00 34.13 31.72 2rgt s GLU 271 CO 0.45 0.54 1.16 0.50 0.02 0.00 0.00 175.26 177.93 2rgt s ARG 272 N -0.56 3.42 0.20 1.61 3.52 -1.26 -0.88 118.95 124.99 2rgt s ARG 272 Ca 0.09 1.73 -0.07 0.00 -0.13 0.00 0.00 55.73 57.34 2rgt s ARG 272 Cb -0.10 -2.13 -0.02 0.00 -1.56 0.00 0.00 34.95 31.13 2rgt s ARG 272 CO -0.00 -0.82 0.28 -3.38 -0.81 0.00 0.00 175.30 170.56 2rgt s HIS 273 N -1.65 0.66 -2.22 5.12 -3.43 -1.26 -4.91 115.29 107.60 2rgt s HIS 273 Ca 0.70 -0.98 0.21 0.00 -0.80 0.00 0.00 55.06 54.19 2rgt s HIS 273 Cb -0.27 -0.17 0.53 0.00 -1.43 0.00 0.00 32.58 31.24 2rgt s HIS 273 CO 0.31 -0.77 1.45 -0.40 -2.00 0.00 0.00 174.74 173.33 2rgt n ASP 274 N -0.28 3.05 0.00 7.38 5.68 -1.26 -4.50 116.55 126.62 2rgt n ASP 274 Ca -0.02 -1.95 0.00 0.00 -0.50 0.00 0.00 54.79 52.32 2rgt n ASP 274 Cb 0.64 -0.30 0.00 0.00 -1.14 0.00 0.00 41.12 40.32 2rgt n ASP 274 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rgt n GLY 275 N 1.42 0.61 2.27 6.12 0.00 -1.26 -2.08 105.19 112.27 2rgt n GLY 275 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2rgt n GLY 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rgt n GLY 276 N -2.10 0.83 3.51 -0.02 0.00 -1.26 -1.95 105.19 104.20 2rgt n GLY 276 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2rgt n GLY 276 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2rgt s LEU 277 N 0.00 4.37 -0.39 0.99 1.43 -0.88 -4.76 118.68 119.44 2rgt s LEU 277 Ca 0.00 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 2rgt s LEU 277 Cb 0.00 -2.10 0.11 0.00 0.03 0.00 0.00 46.19 44.22 2rgt s LEU 277 CO 0.00 -0.21 0.13 -1.10 0.23 0.00 0.00 176.35 175.41 2rgt s GLN 278 N 1.70 1.74 0.19 1.70 1.11 -1.26 -4.94 119.66 119.90 2rgt s GLN 278 Ca 0.06 -1.92 -0.30 0.00 0.01 0.00 0.00 55.36 53.20 2rgt s GLN 278 Cb -0.17 -3.38 -0.09 0.00 -1.01 0.00 0.00 33.01 28.36 2rgt s GLN 278 CO 0.10 -1.01 1.38 0.00 0.01 0.00 0.00 175.29 175.76 2rgt s ALA 279 N 0.89 3.58 -0.13 6.09 0.00 -1.26 -4.60 121.76 126.34 2rgt s ALA 279 Ca 0.10 1.18 -0.04 0.00 0.00 0.00 0.00 51.96 53.21 2rgt s ALA 279 Cb -0.21 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.36 2rgt s ALA 279 CO -0.06 -0.62 0.01 -0.80 0.00 0.00 0.00 175.76 174.30 2rgt s ASN 280 N 0.57 5.29 0.50 0.00 0.01 -0.13 -4.96 114.94 116.22 2rgt s ASN 280 Ca 0.60 0.08 -0.20 0.00 -0.71 0.00 0.00 52.86 52.63 2rgt s ASN 280 Cb -0.38 -1.70 -0.07 0.00 0.41 0.00 0.00 41.25 39.50 2rgt s ASN 280 CO 0.37 0.28 1.10 -2.16 -1.51 0.00 0.00 177.10 175.18 2rgt s PRO 281 N -0.28 3.62 -0.20 -0.60 0.04 -1.26 -0.86 135.00 135.45 2rgt s PRO 281 Ca 0.07 1.54 -0.01 0.00 0.04 0.00 0.00 61.00 62.63 2rgt s PRO 281 Cb -0.12 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.31 2rgt s PRO 281 CO 0.02 -0.62 -0.13 0.08 0.04 0.00 0.00 177.00 176.39 2rgt s VAL 282 N -1.81 2.58 0.07 -0.36 1.01 -0.68 -4.41 120.40 116.79 2rgt s VAL 282 Ca 0.69 -0.80 0.06 0.00 0.00 0.00 0.00 61.98 61.93 2rgt s VAL 282 Cb -0.22 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2rgt s VAL 282 CO 0.25 0.47 -0.11 -1.61 0.00 0.00 0.00 175.10 174.10 2rgt s GLU 283 N 1.36 2.21 -0.26 2.72 2.02 0.21 -4.63 118.70 122.32 2rgt s GLU 283 Ca 0.05 -0.94 -0.17 0.00 0.02 0.00 0.00 54.97 53.93 2rgt s GLU 283 Cb -0.14 -2.32 -0.03 0.00 0.10 0.00 0.00 34.13 31.74 2rgt s GLU 283 CO -0.09 0.54 0.45 0.08 0.02 0.00 0.00 175.26 176.26 2rgt s VAL 284 N -1.09 5.12 0.04 2.63 1.01 -1.26 -0.14 120.40 126.70 2rgt s VAL 284 Ca 0.19 0.75 0.03 0.00 0.00 0.00 0.00 61.98 62.95 2rgt s VAL 284 Cb -0.11 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 2rgt s VAL 284 CO 0.10 0.13 -0.03 -1.10 0.00 0.00 0.00 175.10 174.20 2rgt s GLN 285 N 2.14 2.59 -0.09 2.72 -0.21 0.32 -4.98 119.66 122.15 2rgt s GLN 285 Ca 0.19 -0.75 0.04 0.00 0.02 0.00 0.00 55.36 54.85 2rgt s GLN 285 Cb -0.16 -2.55 -0.01 0.00 1.00 0.00 0.00 33.01 31.30 2rgt s GLN 285 CO 0.09 0.58 -0.21 -1.54 -2.12 0.00 0.00 175.29 172.10 2rgt s SER 286 N -1.79 3.41 0.03 5.90 1.04 -1.26 -0.30 113.70 120.73 2rgt s SER 286 Ca 0.21 -0.45 0.03 0.00 0.48 0.00 0.00 55.95 56.21 2rgt s SER 286 Cb -0.11 -1.24 -0.04 0.00 0.10 0.00 0.00 66.02 64.73 2rgt s SER 286 CO 0.12 0.20 -0.00 -0.31 0.98 0.00 0.00 173.24 174.23 2rgt s TYR 287 N 0.09 3.04 0.00 5.02 2.02 -0.91 -5.01 117.35 121.61 2rgt s TYR 287 Ca -0.10 0.04 0.00 0.00 -0.37 0.00 0.00 57.07 56.64 2rgt s TYR 287 Cb -0.16 -1.62 0.00 0.00 -0.40 0.00 0.00 41.96 39.78 2rgt s TYR 287 CO 0.06 0.46 0.00 0.00 -1.57 0.00 0.00 175.55 174.50