#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3htx s THR 8 N 0.00 3.30 0.26 1.59 2.01 -1.26 -4.89 115.64 116.65 3htx s THR 8 Ca 0.00 0.35 -0.12 0.00 0.31 0.00 0.00 61.69 62.23 3htx s THR 8 Cb 0.00 -3.26 0.37 0.00 0.01 0.00 0.00 72.50 69.63 3htx s THR 8 CO 0.00 -0.06 1.56 -0.65 -0.69 0.00 0.00 174.62 174.77 3htx h PRO 9 N 10.85 -0.00 -3.68 4.92 0.11 -2.08 -3.40 132.00 138.71 3htx h PRO 9 Ca -0.43 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.46 3htx h PRO 9 Cb 1.21 0.00 -0.27 0.00 0.11 0.00 0.00 31.00 32.04 3htx h PRO 9 CO 0.96 -0.00 -0.69 0.95 -0.21 0.00 0.00 178.00 179.01 3htx s THR 10 N -6.14 0.01 0.55 -1.15 -4.23 -1.26 -5.16 115.64 98.26 3htx s THR 10 Ca -0.15 -0.06 -0.12 0.00 -1.18 0.00 0.00 61.69 60.18 3htx s THR 10 Cb 0.24 -0.07 -0.05 0.00 1.34 0.00 0.00 72.50 73.96 3htx s THR 10 CO 0.75 -0.03 0.96 -2.16 -0.54 0.00 0.00 174.62 173.61 3htx s PRO 11 N -0.09 3.72 0.55 3.99 0.04 -1.26 -4.88 135.00 137.08 3htx s PRO 11 Ca -0.01 0.73 0.44 0.00 0.04 0.00 0.00 61.00 62.20 3htx s PRO 11 Cb -0.01 -2.16 1.66 0.00 0.04 0.00 0.00 34.50 34.03 3htx s PRO 11 CO -0.00 -0.39 1.68 0.87 0.04 0.00 0.00 177.00 179.21 3htx h LYS 12 N 0.28 0.00 0.00 4.56 1.79 -1.95 0.48 116.57 121.73 3htx h LYS 12 Ca -0.45 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 3htx h LYS 12 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 3htx h LYS 12 CO 0.62 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.99 3htx h ALA 13 N 1.19 1.00 0.04 3.86 0.00 -1.89 -2.72 119.26 120.75 3htx h ALA 13 Ca 0.77 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 55.34 3htx h ALA 13 Cb 3.08 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 20.83 3htx h ALA 13 CO -0.01 0.00 -1.85 -0.89 0.00 0.00 0.00 179.25 176.50 3htx n ILE 14 N -2.57 1.62 -0.23 0.00 5.41 0.15 -3.99 119.36 119.74 3htx n ILE 14 Ca 0.03 -0.36 0.03 0.00 1.00 0.00 0.00 62.75 63.45 3htx n ILE 14 Cb 0.35 -1.84 0.14 0.00 -0.71 0.00 0.00 39.64 37.58 3htx n ILE 14 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3htx h ILE 15 N -0.51 0.44 0.00 1.39 2.04 -1.57 1.23 117.51 120.53 3htx h ILE 15 Ca -0.46 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.35 3htx h ILE 15 Cb 1.67 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 3htx h ILE 15 CO -0.13 0.03 0.00 1.41 0.00 0.00 0.00 178.15 179.46 3htx n HIS 16 N -5.27 0.65 0.07 1.37 8.25 -1.03 -2.59 115.22 116.68 3htx n HIS 16 Ca 0.12 0.30 -0.05 0.00 -0.26 0.00 0.00 57.72 57.83 3htx n HIS 16 Cb 0.42 -0.99 -0.09 0.00 1.12 0.00 0.00 29.99 30.45 3htx n HIS 16 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 3htx h GLN 17 N 0.00 0.00 0.00 -0.41 4.15 0.14 -2.76 115.11 116.23 3htx h GLN 17 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3htx h GLN 17 Cb 0.15 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.84 3htx h GLN 17 CO 0.00 0.86 -0.62 1.17 -1.93 0.00 0.00 178.83 178.32 3htx n LYS 18 N -3.30 0.26 -0.03 1.69 3.00 -1.07 -4.14 118.16 114.57 3htx n LYS 18 Ca -0.01 0.07 -0.03 0.00 -0.00 0.00 0.00 58.31 58.34 3htx n LYS 18 Cb 0.91 -1.66 -0.01 0.00 0.00 0.00 0.00 35.03 34.26 3htx n LYS 18 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 3htx n PHE 19 N -2.04 0.00 -2.95 5.64 3.01 -1.16 -4.67 117.46 115.29 3htx n PHE 19 Ca 0.03 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.06 3htx n PHE 19 Cb 0.43 -0.18 -0.04 0.00 -0.01 0.00 0.00 39.48 39.68 3htx n PHE 19 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3htx s GLY 20 N -3.68 1.52 0.25 1.37 0.00 -1.04 -4.90 107.32 100.83 3htx s GLY 20 Ca -0.10 -1.86 -0.05 0.00 0.00 0.00 0.00 44.72 42.71 3htx s GLY 20 CO 0.15 1.88 1.90 0.00 0.00 0.00 0.00 173.10 177.03 3htx h ALA 21 N 9.38 1.28 -2.43 3.20 0.00 -1.78 -3.38 119.26 125.54 3htx h ALA 21 Ca -0.29 -0.04 -0.36 0.00 0.00 0.00 0.00 54.91 54.22 3htx h ALA 21 Cb 1.08 -0.34 -0.36 0.00 0.00 0.00 0.00 17.79 18.17 3htx h ALA 21 CO 1.13 0.50 -0.66 0.15 0.00 0.00 0.00 179.25 180.37 3htx s LYS 22 N -6.08 0.24 -0.01 0.00 1.02 -1.26 -4.90 119.74 108.75 3htx s LYS 22 Ca -0.13 -0.06 -0.04 0.00 0.02 0.00 0.00 55.97 55.76 3htx s LYS 22 Cb 0.19 -0.99 0.00 0.00 -0.52 0.00 0.00 37.83 36.51 3htx s LYS 22 CO 0.81 -0.87 0.08 0.00 -0.92 0.00 0.00 175.35 174.45 3htx s ALA 23 N 2.30 -0.19 -0.01 5.17 0.00 -1.26 -4.95 121.76 122.83 3htx s ALA 23 Ca 0.08 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.01 3htx s ALA 23 Cb -0.15 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 3htx s ALA 23 CO -0.25 -0.12 0.03 -1.54 0.00 0.00 0.00 175.76 173.88 3htx s SER 24 N -0.70 5.32 -0.21 0.00 1.04 -1.21 -4.97 113.70 112.96 3htx s SER 24 Ca -0.08 0.05 -0.12 0.00 0.48 0.00 0.00 55.95 56.28 3htx s SER 24 Cb -0.05 -1.44 -0.05 0.00 0.10 0.00 0.00 66.02 64.58 3htx s SER 24 CO 0.00 0.28 0.23 -0.31 0.98 0.00 0.00 173.24 174.43 3htx s TYR 25 N -1.11 3.37 -0.24 5.02 1.51 -1.26 -2.35 117.35 122.29 3htx s TYR 25 Ca 0.20 0.40 -0.06 0.00 -1.01 0.00 0.00 57.07 56.60 3htx s TYR 25 Cb -0.12 -2.32 -0.02 0.00 -0.11 0.00 0.00 41.96 39.40 3htx s TYR 25 CO 0.11 0.12 0.01 0.99 -1.11 0.00 0.00 175.55 175.68 3htx s THR 26 N 0.88 3.83 -0.41 -0.71 2.01 0.15 -4.96 115.64 116.44 3htx s THR 26 Ca 0.12 -0.34 -0.25 0.00 0.31 0.00 0.00 61.69 61.53 3htx s THR 26 Cb -0.13 -2.78 0.02 0.00 0.01 0.00 0.00 72.50 69.62 3htx s THR 26 CO 0.04 0.37 0.86 -0.69 -0.69 0.00 0.00 174.62 174.52 3htx s VAL 27 N 1.54 4.60 0.02 3.82 1.01 -1.26 -1.06 120.40 129.07 3htx s VAL 27 Ca 0.06 0.86 -0.01 0.00 0.00 0.00 0.00 61.98 62.88 3htx s VAL 27 Cb -0.15 -4.33 -0.04 0.00 0.00 0.00 0.00 36.38 31.87 3htx s VAL 27 CO 0.00 -0.62 0.19 -0.70 0.00 0.00 0.00 175.10 173.97 3htx s GLU 28 N 3.43 3.42 0.20 2.72 2.12 -0.84 -5.01 118.70 124.74 3htx s GLU 28 Ca 0.35 -0.38 0.10 0.00 0.36 0.00 0.00 54.97 55.40 3htx s GLU 28 Cb -0.12 -3.06 -0.04 0.00 0.26 0.00 0.00 34.13 31.17 3htx s GLU 28 CO 0.21 0.65 -0.13 -1.83 -0.54 0.00 0.00 175.26 173.62 3htx s GLU 29 N -2.18 1.92 -0.17 4.30 -1.05 -1.26 -1.63 118.70 118.63 3htx s GLU 29 Ca 0.30 -1.40 0.00 0.00 -0.15 0.00 0.00 54.97 53.73 3htx s GLU 29 Cb -0.13 -2.04 0.04 0.00 -0.44 0.00 0.00 34.13 31.56 3htx s GLU 29 CO 0.22 0.41 -0.09 0.08 0.95 0.00 0.00 175.26 176.84 3htx s VAL 30 N -1.85 1.39 -1.80 1.83 1.01 0.26 -4.92 120.40 116.32 3htx s VAL 30 Ca 0.25 -0.77 0.06 0.00 0.00 0.00 0.00 61.98 61.52 3htx s VAL 30 Cb -0.08 -1.48 0.19 0.00 0.00 0.00 0.00 36.38 35.02 3htx s VAL 30 CO 0.14 0.20 1.11 1.41 0.00 0.00 0.00 175.10 177.96 3htx n HIS 31 N 4.79 0.33 -3.41 5.22 8.25 -1.26 -0.11 115.22 129.03 3htx n HIS 31 Ca -0.14 -0.15 -0.38 0.00 -0.26 0.00 0.00 57.72 56.79 3htx n HIS 31 Cb 0.48 -0.04 -0.08 0.00 1.12 0.00 0.00 29.99 31.47 3htx n HIS 31 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3htx s ASP 32 N -0.87 6.41 0.00 0.41 1.01 -1.26 -4.93 116.67 117.43 3htx s ASP 32 Ca 0.14 0.48 0.00 0.00 0.71 0.00 0.00 52.55 53.88 3htx s ASP 32 Cb 0.08 -2.22 0.00 0.00 1.01 0.00 0.00 42.92 41.79 3htx s ASP 32 CO 0.09 -0.07 0.00 -1.54 0.21 0.00 0.00 175.17 173.86 3htx n SER 33 N 4.50 0.00 -2.26 0.27 3.41 -1.26 -4.68 113.62 113.60 3htx n SER 33 Ca -0.09 -0.90 -0.16 0.00 -0.26 0.00 0.00 58.87 57.47 3htx n SER 33 Cb 0.51 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.33 3htx n SER 33 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3htx n SER 34 N -1.24 5.48 -4.62 4.04 3.41 -1.26 -4.84 113.62 114.59 3htx n SER 34 Ca 0.00 -2.43 -0.36 0.00 -0.26 0.00 0.00 58.87 55.81 3htx n SER 34 Cb 0.00 -1.35 -0.10 0.00 -0.26 0.00 0.00 64.21 62.50 3htx n SER 34 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3htx s GLN 35 N 1.36 4.00 -0.13 4.33 -0.21 -1.26 -5.03 119.66 122.71 3htx s GLN 35 Ca 0.63 -0.31 -0.32 0.00 0.02 0.00 0.00 55.36 55.38 3htx s GLN 35 Cb 0.27 -3.49 -0.09 0.00 1.00 0.00 0.00 33.01 30.71 3htx s GLN 35 CO -0.01 0.03 2.04 -1.13 -2.12 0.00 0.00 175.29 174.10 3htx n SER 36 N 4.35 3.40 -4.53 5.90 3.41 -1.26 -4.85 113.62 120.04 3htx n SER 36 Ca -0.15 0.67 -0.42 0.00 -0.26 0.00 0.00 58.87 58.71 3htx n SER 36 Cb 0.52 -1.44 -0.03 0.00 -0.26 0.00 0.00 64.21 63.00 3htx n SER 36 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3htx s GLY 37 N 5.76 1.32 -0.15 5.00 0.00 -1.26 -4.97 107.32 113.02 3htx s GLY 37 Ca 0.96 -2.19 -0.19 0.00 0.00 0.00 0.00 44.72 43.30 3htx s GLY 37 CO 0.45 2.53 0.55 0.00 0.00 0.00 0.00 173.10 176.63 3htx s PRO 39 N 1.18 3.83 0.00 0.00 0.04 -1.26 -4.12 135.00 134.66 3htx s PRO 39 Ca 0.28 0.69 0.00 0.00 0.04 0.00 0.00 61.00 62.01 3htx s PRO 39 Cb -0.16 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.13 3htx s PRO 39 CO 0.11 -0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.37 3htx n GLY 40 N -1.57 0.14 3.77 0.56 0.00 -1.26 -4.95 105.19 101.87 3htx n GLY 40 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 3htx n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3htx s LEU 41 N 0.00 3.47 -0.03 0.99 1.43 -1.26 -4.57 118.68 118.71 3htx s LEU 41 Ca 0.00 2.05 0.04 0.00 -1.03 0.00 0.00 54.13 55.19 3htx s LEU 41 Cb 0.00 -4.56 0.06 0.00 0.03 0.00 0.00 46.19 41.72 3htx s LEU 41 CO 0.00 -1.55 1.01 0.00 0.23 0.00 0.00 176.35 176.04 3htx n ALA 42 N -2.17 2.02 -0.09 4.21 0.00 -0.84 -4.77 120.51 118.86 3htx n ALA 42 Ca 0.11 -1.32 0.00 0.00 0.00 0.00 0.00 53.44 52.23 3htx n ALA 42 Cb 0.52 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.52 3htx n ALA 42 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3htx n ILE 43 N -0.30 0.16 -0.23 0.00 5.41 -1.26 -5.04 119.36 118.10 3htx n ILE 43 Ca 0.03 -0.53 -0.09 0.00 1.00 0.00 0.00 62.75 63.16 3htx n ILE 43 Cb 0.68 0.99 -0.01 0.00 -0.71 0.00 0.00 39.64 40.59 3htx n ILE 43 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3htx n PRO 44 N -0.08 0.00 -4.72 0.38 -0.02 -1.26 -4.93 135.00 124.38 3htx n PRO 44 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.15 3htx n PRO 44 Cb 0.07 -0.22 -0.12 0.00 -0.02 0.00 0.00 33.50 33.20 3htx n PRO 44 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3htx s GLN 45 N 0.06 2.86 -0.47 -0.52 -0.21 -1.26 -5.06 119.66 115.05 3htx s GLN 45 Ca 0.14 -0.62 -0.29 0.00 0.02 0.00 0.00 55.36 54.62 3htx s GLN 45 Cb -0.19 -2.56 0.02 0.00 1.00 0.00 0.00 33.01 31.28 3htx s GLN 45 CO 0.09 0.54 1.35 0.21 -2.12 0.00 0.00 175.29 175.35 3htx s LYS 46 N -0.49 3.53 0.00 2.91 2.20 -1.26 -4.91 119.74 121.73 3htx s LYS 46 Ca 0.07 0.71 0.00 0.00 -0.36 0.00 0.00 55.97 56.39 3htx s LYS 46 Cb -0.12 -4.03 0.00 0.00 -1.51 0.00 0.00 37.83 32.18 3htx s LYS 46 CO 0.02 -1.63 0.00 0.41 -0.36 0.00 0.00 175.35 173.79 3htx n GLY 47 N 5.08 -0.05 3.02 5.54 0.00 -1.26 -5.07 105.19 112.45 3htx n GLY 47 Ca 0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 3htx n GLY 47 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3htx s PRO 48 N -0.17 0.25 -0.05 1.61 0.05 -1.26 -5.15 135.00 130.28 3htx s PRO 48 Ca 0.00 -0.08 0.05 0.00 0.05 0.00 0.00 61.00 61.01 3htx s PRO 48 Cb 0.00 0.11 -0.00 0.00 0.05 0.00 0.00 34.50 34.65 3htx s PRO 48 CO 0.00 -0.05 -0.19 0.00 0.05 0.00 0.00 177.00 176.82 3htx s LEU 50 N 0.02 3.77 0.26 0.00 1.43 0.85 -4.81 118.68 120.20 3htx s LEU 50 Ca -0.04 1.26 0.10 0.00 -1.03 0.00 0.00 54.13 54.42 3htx s LEU 50 Cb -0.12 -4.16 -0.05 0.00 0.03 0.00 0.00 46.19 41.89 3htx s LEU 50 CO 0.03 -0.45 -0.17 -0.31 0.23 0.00 0.00 176.35 175.68 3htx s TYR 51 N -2.44 2.10 0.04 0.29 1.51 -0.15 0.91 117.35 119.61 3htx s TYR 51 Ca 0.53 -0.44 0.01 0.00 -1.01 0.00 0.00 57.07 56.16 3htx s TYR 51 Cb -0.10 -0.97 -0.03 0.00 -0.11 0.00 0.00 41.96 40.75 3htx s TYR 51 CO 0.31 0.57 -0.05 -0.98 -1.11 0.00 0.00 175.55 174.30 3htx s ARG 52 N -3.57 0.47 0.03 -0.62 1.70 -0.64 -0.94 118.95 115.38 3htx s ARG 52 Ca 0.28 -0.82 0.08 0.00 -0.47 0.00 0.00 55.73 54.79 3htx s ARG 52 Cb -0.03 -0.01 -0.02 0.00 -0.57 0.00 0.00 34.95 34.32 3htx s ARG 52 CO 0.12 -0.03 -0.22 0.00 -1.08 0.00 0.00 175.30 174.09 3htx s HIS 54 N -0.76 3.19 -0.33 0.00 3.76 -0.23 -1.68 115.29 119.24 3htx s HIS 54 Ca 0.09 -0.65 -0.09 0.00 -0.15 0.00 0.00 55.06 54.25 3htx s HIS 54 Cb -0.09 -2.36 0.01 0.00 1.11 0.00 0.00 32.58 31.25 3htx s HIS 54 CO 0.01 -0.49 0.16 -1.17 -0.85 0.00 0.00 174.74 172.40 3htx s LEU 55 N 1.60 4.27 -0.19 0.89 2.96 0.69 0.33 118.68 129.23 3htx s LEU 55 Ca 0.04 -0.73 -0.06 0.00 -0.22 0.00 0.00 54.13 53.16 3htx s LEU 55 Cb -0.17 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.50 3htx s LEU 55 CO 0.06 -0.26 0.02 -1.10 -1.32 0.00 0.00 176.35 173.74 3htx s GLN 56 N 1.57 3.73 0.22 1.98 -0.21 -0.99 -0.53 119.66 125.43 3htx s GLN 56 Ca 0.03 -0.47 0.02 0.00 0.02 0.00 0.00 55.36 54.97 3htx s GLN 56 Cb -0.18 -3.10 -0.05 0.00 1.00 0.00 0.00 33.01 30.68 3htx s GLN 56 CO 0.06 0.12 0.03 -0.51 -2.12 0.00 0.00 175.29 172.87 3htx s LEU 57 N 0.72 1.99 0.29 2.90 1.43 -0.49 -3.36 118.68 122.15 3htx s LEU 57 Ca 0.01 -1.26 0.04 0.00 -1.03 0.00 0.00 54.13 51.88 3htx s LEU 57 Cb -0.14 -0.10 0.72 0.00 0.03 0.00 0.00 46.19 46.70 3htx s LEU 57 CO 0.02 -0.61 1.70 1.55 0.23 0.00 0.00 176.35 179.25 3htx h PRO 58 N 2.51 0.41 0.38 1.29 0.13 -1.99 -3.04 132.00 131.70 3htx h PRO 58 Ca -0.38 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.71 3htx h PRO 58 Cb 1.22 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3htx h PRO 58 CO 0.63 0.27 -0.18 1.49 -0.23 0.00 0.00 178.00 179.98 3htx h GLU 59 N 0.43 -0.49 0.00 0.86 4.22 -2.02 -3.49 114.58 114.09 3htx h GLU 59 Ca 0.56 0.03 0.00 0.00 0.08 0.00 0.00 59.36 60.03 3htx h GLU 59 Cb 1.04 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3htx h GLU 59 CO -0.51 -0.22 0.00 1.97 -2.18 0.00 0.00 179.01 178.07 3htx n PHE 60 N -5.13 0.00 -3.99 0.92 1.16 -1.15 -5.18 117.46 104.09 3htx n PHE 60 Ca -0.08 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.42 3htx n PHE 60 Cb 0.26 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.03 3htx n PHE 60 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 3htx s SER 61 N 1.82 0.31 0.07 5.98 1.04 -1.26 -1.40 113.70 120.26 3htx s SER 61 Ca 0.00 -0.72 0.03 0.00 0.48 0.00 0.00 55.95 55.74 3htx s SER 61 Cb 0.00 0.20 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 3htx s SER 61 CO 0.00 -0.53 -0.09 -0.69 0.98 0.00 0.00 173.24 172.91 3htx s VAL 62 N -3.04 0.78 -0.04 5.02 1.01 0.31 -4.98 120.40 119.45 3htx s VAL 62 Ca -0.01 -1.42 0.03 0.00 0.00 0.00 0.00 61.98 60.57 3htx s VAL 62 Cb 0.01 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.32 3htx s VAL 62 CO -0.07 -0.49 -0.11 -0.69 0.00 0.00 0.00 175.10 173.74 3htx s VAL 63 N -2.04 1.01 0.13 2.92 1.01 -1.26 -0.23 120.40 121.94 3htx s VAL 63 Ca -0.01 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.54 3htx s VAL 63 Cb -0.05 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 3htx s VAL 63 CO -0.00 0.31 0.28 -0.94 0.00 0.00 0.00 175.10 174.75 3htx s SER 64 N 0.40 6.35 0.89 3.32 1.04 -0.67 -4.98 113.70 120.05 3htx s SER 64 Ca -0.08 0.22 -0.12 0.00 0.48 0.00 0.00 55.95 56.45 3htx s SER 64 Cb -0.12 -1.93 0.13 0.00 0.10 0.00 0.00 66.02 64.19 3htx s SER 64 CO 0.02 0.07 1.11 0.54 0.98 0.00 0.00 173.24 175.95 3htx s ASN 65 N -3.05 3.60 0.28 7.02 4.22 -1.26 -3.58 114.94 122.17 3htx s ASN 65 Ca 0.35 1.23 -0.30 0.00 -2.14 0.00 0.00 52.86 52.00 3htx s ASN 65 Cb -0.11 -1.89 -0.11 0.00 1.28 0.00 0.00 41.25 40.41 3htx s ASN 65 CO 0.28 -2.52 1.51 -0.69 -2.04 0.00 0.00 177.10 173.65 3htx s VAL 66 N -3.10 2.34 0.23 3.54 1.01 -1.26 -4.69 120.40 118.47 3htx s VAL 66 Ca 0.63 0.29 0.05 0.00 0.00 0.00 0.00 61.98 62.95 3htx s VAL 66 Cb -0.16 -3.18 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 3htx s VAL 66 CO 0.55 0.05 -0.03 -0.36 0.00 0.00 0.00 175.10 175.31 3htx s PHE 67 N -0.10 1.65 -0.61 5.22 0.40 -0.11 -4.95 117.98 119.48 3htx s PHE 67 Ca 0.61 -0.83 0.24 0.00 -0.60 0.00 0.00 56.93 56.35 3htx s PHE 67 Cb -0.45 -0.93 0.35 0.00 0.51 0.00 0.00 43.02 42.49 3htx s PHE 67 CO 0.47 0.08 1.33 -0.22 0.70 0.00 0.00 175.22 177.58 3htx h LYS 68 N 2.45 0.00 -5.73 0.44 3.64 -1.93 -0.36 116.57 115.08 3htx h LYS 68 Ca -0.39 0.00 -0.67 0.00 -1.27 0.00 0.00 60.65 58.33 3htx h LYS 68 Cb 1.22 0.00 -0.24 0.00 -0.41 0.00 0.00 32.23 32.80 3htx h LYS 68 CO 0.65 0.00 -0.75 0.15 -2.27 0.00 0.00 179.45 177.24 3htx s LYS 69 N -3.18 3.07 0.15 1.90 1.02 -1.26 -4.78 119.74 116.66 3htx s LYS 69 Ca 0.06 -0.65 -0.17 0.00 0.02 0.00 0.00 55.97 55.23 3htx s LYS 69 Cb 0.13 -2.58 0.04 0.00 -0.52 0.00 0.00 37.83 34.89 3htx s LYS 69 CO 0.72 0.40 1.76 -0.22 -0.92 0.00 0.00 175.35 177.09 3htx h LYS 70 N 6.09 0.27 -0.44 1.68 3.64 -1.94 -2.89 116.57 122.98 3htx h LYS 70 Ca -0.36 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 58.87 3htx h LYS 70 Cb 1.19 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 3htx h LYS 70 CO 0.54 0.18 -0.25 -0.22 -2.27 0.00 0.00 179.45 177.44 3htx h LYS 71 N 0.28 0.93 0.00 1.90 3.64 -2.00 -2.80 116.57 118.52 3htx h LYS 71 Ca 0.15 -0.41 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 3htx h LYS 71 Cb 0.10 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 3htx h LYS 71 CO -0.14 1.07 0.00 -0.44 -2.27 0.00 0.00 179.45 177.67 3htx h ASP 72 N 0.80 0.00 0.03 4.20 5.19 -1.95 -2.31 116.42 122.38 3htx h ASP 72 Ca 0.10 0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 56.26 3htx h ASP 72 Cb 0.81 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.29 3htx h ASP 72 CO 0.07 0.00 -1.34 0.77 -3.12 0.00 0.00 179.24 175.62 3htx h SER 73 N 0.00 0.10 -0.06 6.45 4.64 -1.30 -3.25 113.55 120.13 3htx h SER 73 Ca 0.00 -0.63 0.02 0.00 -0.47 0.00 0.00 61.79 60.70 3htx h SER 73 Cb 0.14 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3htx h SER 73 CO 0.00 1.54 0.05 -0.33 -0.87 0.00 0.00 176.83 177.22 3htx h GLU 74 N -0.76 0.00 0.74 4.77 5.08 -1.31 -1.09 114.58 122.01 3htx h GLU 74 Ca -0.34 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.98 3htx h GLU 74 Cb 1.45 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.71 3htx h GLU 74 CO -0.13 0.00 -0.36 1.96 -1.00 0.00 0.00 179.01 179.48 3htx h GLN 75 N 0.00 -0.96 -0.82 2.33 1.08 -1.55 -2.27 115.11 112.92 3htx h GLN 75 Ca 0.03 0.07 0.20 0.00 -1.45 0.00 0.00 58.65 57.49 3htx h GLN 75 Cb 0.12 0.22 -0.13 0.00 -0.05 0.00 0.00 27.48 27.64 3htx h GLN 75 CO -0.00 -0.62 0.22 1.03 -0.95 0.00 0.00 178.83 178.50 3htx h SER 76 N -1.18 0.02 -0.49 1.46 0.87 -1.36 0.23 113.55 113.10 3htx h SER 76 Ca -0.10 0.17 0.07 0.00 -1.23 0.00 0.00 61.79 60.70 3htx h SER 76 Cb 0.79 0.23 -0.06 0.00 -0.44 0.00 0.00 62.40 62.92 3htx h SER 76 CO 0.17 -0.09 0.15 0.00 -0.53 0.00 0.00 176.83 176.53 3htx h ALA 77 N 1.71 0.59 -0.03 6.23 0.00 -1.06 -0.26 119.26 126.44 3htx h ALA 77 Ca 0.49 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.48 3htx h ALA 77 Cb 0.92 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 3htx h ALA 77 CO -0.59 -0.25 0.01 0.00 0.00 0.00 0.00 179.25 178.43 3htx h ALA 78 N 1.34 0.04 -0.63 0.00 0.00 -0.05 -2.63 119.26 117.33 3htx h ALA 78 Ca 0.24 -0.10 0.13 0.00 0.00 0.00 0.00 54.91 55.18 3htx h ALA 78 Cb 0.27 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.95 3htx h ALA 78 CO -0.26 -0.36 0.04 1.49 0.00 0.00 0.00 179.25 180.16 3htx h GLU 79 N -0.14 0.15 -0.46 0.00 4.81 -0.23 0.14 114.58 118.85 3htx h GLU 79 Ca 0.01 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 3htx h GLU 79 Cb 0.20 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 3htx h GLU 79 CO -0.00 0.10 0.17 -0.07 -0.73 0.00 0.00 179.01 178.48 3htx h LEU 80 N 0.16 0.59 -0.58 1.64 3.38 -0.96 0.04 115.31 119.58 3htx h LEU 80 Ca 0.34 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 3htx h LEU 80 Cb 0.55 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 3htx h LEU 80 CO -0.51 0.55 0.24 0.00 0.09 0.00 0.00 178.44 178.81 3htx h ALA 81 N 1.54 0.75 -0.24 1.53 0.00 -0.42 -0.78 119.26 121.64 3htx h ALA 81 Ca 0.16 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3htx h ALA 81 Cb 0.15 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3htx h ALA 81 CO -0.01 0.36 0.02 -0.07 0.00 0.00 0.00 179.25 179.54 3htx h LEU 82 N 0.80 0.40 0.29 0.00 3.38 -0.33 0.30 115.31 120.16 3htx h LEU 82 Ca 0.19 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3htx h LEU 82 Cb 0.19 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3htx h LEU 82 CO -0.02 0.59 -0.38 0.44 0.09 0.00 0.00 178.44 179.16 3htx h ASP 83 N 0.20 -1.08 -0.89 -0.43 3.32 -0.88 -0.50 116.42 116.16 3htx h ASP 83 Ca 0.07 0.10 0.10 0.00 0.02 0.00 0.00 57.03 57.31 3htx h ASP 83 Cb 0.37 0.37 -0.07 0.00 0.22 0.00 0.00 39.33 40.22 3htx h ASP 83 CO 0.01 -0.47 0.54 0.11 -1.72 0.00 0.00 179.24 177.70 3htx h LYS 84 N -0.69 0.87 0.00 3.56 1.57 -1.13 -1.84 116.57 118.90 3htx h LYS 84 Ca -0.03 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3htx h LYS 84 Cb 0.63 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3htx h LYS 84 CO -0.10 0.57 0.00 -0.07 -0.57 0.00 0.00 179.45 179.29 3htx h LEU 85 N 0.90 0.00 0.00 2.94 3.38 -0.07 -3.47 115.31 118.99 3htx h LEU 85 Ca 0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.40 3htx h LEU 85 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3htx h LEU 85 CO -0.24 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.90 3htx n GLY 86 N -0.22 0.75 2.83 0.83 0.00 -0.26 -5.01 105.19 104.10 3htx n GLY 86 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3htx n GLY 86 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3htx n ILE 87 N -1.87 5.62 -1.46 -0.61 5.41 -0.79 -4.95 119.36 120.70 3htx n ILE 87 Ca 0.00 -5.95 -0.29 0.00 1.00 0.00 0.00 62.75 57.51 3htx n ILE 87 Cb 0.00 -1.83 0.16 0.00 -0.71 0.00 0.00 39.64 37.26 3htx n ILE 87 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 3htx s ARG 88 N -3.50 0.58 0.00 0.38 3.52 -1.26 -4.70 118.95 113.97 3htx s ARG 88 Ca 0.35 0.17 0.05 0.00 -0.13 0.00 0.00 55.73 56.17 3htx s ARG 88 Cb 0.12 -1.79 0.26 0.00 -1.56 0.00 0.00 34.95 31.98 3htx s ARG 88 CO -0.00 -2.55 0.95 -0.35 -0.81 0.00 0.00 175.30 172.53 3htx n PRO 89 N -3.99 0.09 0.08 5.12 -0.04 -1.26 -2.06 135.00 132.94 3htx n PRO 89 Ca 0.08 0.19 0.12 0.00 -0.04 0.00 0.00 63.50 63.86 3htx n PRO 89 Cb 0.59 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.68 3htx n PRO 89 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 3htx h GLN 90 N 0.00 0.00 0.00 0.54 4.15 -1.98 -3.24 115.11 114.58 3htx h GLN 90 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3htx h GLN 90 Cb 0.04 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.73 3htx h GLN 90 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 178.83 175.19 3htx n ASN 91 N -2.31 0.13 0.11 -0.69 5.15 -0.87 -3.23 115.26 113.55 3htx n ASN 91 Ca 0.02 0.51 0.01 0.00 -0.60 0.00 0.00 54.58 54.53 3htx n ASN 91 Cb 0.47 -0.55 0.35 0.00 -0.53 0.00 0.00 39.78 39.53 3htx n ASN 91 CO 0.00 0.00 0.00 -0.78 1.40 0.00 0.00 177.26 177.88 3htx h ASP 92 N 0.00 0.23 -1.58 1.20 1.82 -1.72 -3.42 116.42 112.96 3htx h ASP 92 Ca 0.00 -0.06 -0.59 0.00 -0.39 0.00 0.00 57.03 55.99 3htx h ASP 92 Cb 0.53 -0.06 -0.01 0.00 0.68 0.00 0.00 39.33 40.47 3htx h ASP 92 CO 0.00 0.44 1.50 0.47 -1.61 0.00 0.00 179.24 180.05 3htx n ASP 93 N -4.22 2.66 -4.51 2.28 8.00 -1.20 -4.90 116.55 114.66 3htx n ASP 93 Ca -0.01 0.15 -0.40 0.00 0.71 0.00 0.00 54.79 55.24 3htx n ASP 93 Cb 0.31 -1.45 -0.11 0.00 -0.02 0.00 0.00 41.12 39.86 3htx n ASP 93 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3htx s LEU 94 N 8.67 4.45 0.51 0.64 1.43 -1.26 -5.05 118.68 128.07 3htx s LEU 94 Ca 1.04 -0.44 -0.23 0.00 -1.03 0.00 0.00 54.13 53.47 3htx s LEU 94 Cb -0.50 -2.11 -0.06 0.00 0.03 0.00 0.00 46.19 43.54 3htx s LEU 94 CO 0.39 -0.23 1.37 -0.89 0.23 0.00 0.00 176.35 177.21 3htx s THR 95 N 1.70 2.14 -0.11 5.49 2.01 -1.26 -4.80 115.64 120.81 3htx s THR 95 Ca 0.06 0.11 0.16 0.00 0.31 0.00 0.00 61.69 62.34 3htx s THR 95 Cb -0.17 -3.06 0.16 0.00 0.01 0.00 0.00 72.50 69.44 3htx s THR 95 CO 0.10 0.00 1.45 0.52 -0.69 0.00 0.00 174.62 176.00 3htx n VAL 96 N -0.73 0.84 -0.09 3.82 0.31 -1.26 -1.28 118.33 119.94 3htx n VAL 96 Ca 0.08 0.73 -0.21 0.00 -0.01 0.00 0.00 64.34 64.94 3htx n VAL 96 Cb 0.44 -1.73 -0.12 0.00 -0.91 0.00 0.00 33.84 31.52 3htx n VAL 96 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3htx n ASP 97 N -2.12 2.02 0.10 4.52 8.00 -1.26 -3.18 116.55 124.62 3htx n ASP 97 Ca -0.01 0.06 0.06 0.00 0.71 0.00 0.00 54.79 55.61 3htx n ASP 97 Cb 0.18 -0.64 0.52 0.00 -0.02 0.00 0.00 41.12 41.16 3htx n ASP 97 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3htx h GLU 98 N -0.15 0.31 -0.39 -1.24 5.08 -1.53 0.72 114.58 117.38 3htx h GLU 98 Ca -0.53 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 57.70 3htx h GLU 98 Cb 1.88 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 31.05 3htx h GLU 98 CO -0.08 0.21 -0.21 0.00 -1.00 0.00 0.00 179.01 177.93 3htx h ALA 99 N 1.84 0.55 0.00 3.43 0.00 -1.38 0.55 119.26 124.26 3htx h ALA 99 Ca 0.10 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.49 3htx h ALA 99 Cb -0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3htx h ALA 99 CO -0.02 0.52 -0.68 0.00 0.00 0.00 0.00 179.25 179.07 3htx h ARG 100 N 0.64 0.00 -0.28 0.00 3.08 -1.25 -2.43 114.38 114.14 3htx h ARG 100 Ca 0.09 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.09 3htx h ARG 100 Cb 0.77 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 3htx h ARG 100 CO 0.06 0.68 -0.01 0.22 -1.07 0.00 0.00 179.97 179.85 3htx h ASP 101 N 0.00 0.50 0.14 7.04 3.58 0.61 -2.08 116.42 126.20 3htx h ASP 101 Ca -0.01 -0.32 -0.01 0.00 0.42 0.00 0.00 57.03 57.12 3htx h ASP 101 Cb 1.22 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.13 3htx h ASP 101 CO 0.09 0.70 -0.07 -0.33 -2.88 0.00 0.00 179.24 176.75 3htx h GLU 102 N 0.29 -0.18 -0.58 0.28 4.39 -0.78 -0.89 114.58 117.11 3htx h GLU 102 Ca 0.08 0.01 0.10 0.00 0.34 0.00 0.00 59.36 59.89 3htx h GLU 102 Cb 0.44 0.04 -0.08 0.00 -0.10 0.00 0.00 28.75 29.06 3htx h GLU 102 CO 0.02 0.06 0.17 0.82 -1.16 0.00 0.00 179.01 178.91 3htx h ILE 103 N -0.40 0.72 -0.12 3.13 2.04 -1.48 0.56 117.51 121.96 3htx h ILE 103 Ca -0.02 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.75 3htx h ILE 103 Cb 0.32 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 3htx h ILE 103 CO 0.03 0.06 0.01 0.58 0.00 0.00 0.00 178.15 178.83 3htx h VAL 104 N 0.32 0.93 -0.30 1.67 2.07 -1.18 -0.58 116.25 119.17 3htx h VAL 104 Ca 0.29 -0.02 -0.06 0.00 0.82 0.00 0.00 66.70 67.73 3htx h VAL 104 Cb 0.39 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3htx h VAL 104 CO -0.34 0.01 -0.08 1.23 0.02 0.00 0.00 177.57 178.41 3htx h GLY 105 N 0.05 0.53 1.54 2.17 0.00 0.14 -1.85 103.07 105.65 3htx h GLY 105 Ca 0.05 -0.35 -0.19 0.00 0.00 0.00 0.00 47.33 46.85 3htx h GLY 105 CO -0.09 0.32 -0.76 -0.09 0.00 0.00 0.00 176.54 175.92 3htx h ARG 106 N 0.46 0.44 -0.40 4.80 9.65 0.39 -1.72 114.38 128.01 3htx h ARG 106 Ca 0.09 -0.38 -0.03 0.00 -1.10 0.00 0.00 59.98 58.57 3htx h ARG 106 Cb 0.43 0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 29.07 3htx h ARG 106 CO 0.02 1.02 0.14 0.82 2.80 0.00 0.00 179.97 184.77 3htx h ILE 107 N 0.30 1.21 -0.60 1.20 2.04 -0.82 -1.64 117.51 119.20 3htx h ILE 107 Ca -0.04 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 3htx h ILE 107 Cb 1.35 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 38.29 3htx h ILE 107 CO 0.13 0.24 0.25 0.07 0.00 0.00 0.00 178.15 178.85 3htx h LYS 108 N 0.51 0.87 -0.46 2.37 2.10 -1.24 -2.84 116.57 117.87 3htx h LYS 108 Ca 0.13 -0.13 -0.09 0.00 -2.00 0.00 0.00 60.65 58.56 3htx h LYS 108 Cb 0.23 -0.16 -0.01 0.00 -0.90 0.00 0.00 32.23 31.39 3htx h LYS 108 CO -0.01 0.70 -0.08 -0.92 -2.00 0.00 0.00 179.45 177.15 3htx h TYR 109 N 0.86 0.97 0.00 0.07 3.20 -0.78 -2.81 116.97 118.48 3htx h TYR 109 Ca 0.21 -0.20 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 3htx h TYR 109 Cb 0.15 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 3htx h TYR 109 CO 0.01 0.95 -0.05 0.82 -1.64 0.00 0.00 178.16 178.25 3htx h ILE 110 N 0.71 0.69 -0.53 1.81 2.04 -1.07 0.11 117.51 121.28 3htx h ILE 110 Ca 0.12 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.79 3htx h ILE 110 Cb 0.61 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 3htx h ILE 110 CO 0.04 0.05 0.00 0.49 0.00 0.00 0.00 178.15 178.73 3htx n PHE 111 N -3.99 0.69 -2.73 1.37 3.01 -1.12 -4.49 117.46 110.20 3htx n PHE 111 Ca -0.03 -0.35 -0.34 0.00 1.01 0.00 0.00 57.45 57.74 3htx n PHE 111 Cb 0.13 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.55 3htx n PHE 111 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3htx s SER 112 N -1.23 6.87 0.58 4.37 1.04 0.02 -4.94 113.70 120.41 3htx s SER 112 Ca 0.42 1.79 0.29 0.00 0.48 0.00 0.00 55.95 58.93 3htx s SER 112 Cb 0.23 -2.55 1.45 0.00 0.10 0.00 0.00 66.02 65.24 3htx s SER 112 CO 0.31 -0.41 1.86 0.44 0.98 0.00 0.00 173.24 176.41 3htx h ASP 113 N 2.09 0.00 -0.06 7.02 3.32 -1.90 -2.60 116.42 124.28 3htx h ASP 113 Ca -0.49 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.34 3htx h ASP 113 Cb 1.19 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.76 3htx h ASP 113 CO 0.61 0.00 -0.84 -0.33 -1.72 0.00 0.00 179.24 176.97 3htx h GLU 114 N 0.00 0.68 0.00 3.56 5.08 -1.92 -3.29 114.58 118.69 3htx h GLU 114 Ca 0.27 -0.65 -0.02 0.00 -1.00 0.00 0.00 59.36 57.96 3htx h GLU 114 Cb 1.38 0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.79 3htx h GLU 114 CO -0.00 1.25 -0.08 0.35 -1.00 0.00 0.00 179.01 179.53 3htx h PHE 115 N 0.35 0.00 0.00 4.33 3.57 -1.68 -3.11 116.94 120.40 3htx h PHE 115 Ca -0.09 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.41 3htx h PHE 115 Cb 1.49 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.23 3htx h PHE 115 CO 0.10 0.08 0.00 -0.11 -2.23 0.00 0.00 178.31 176.15 3htx n LEU 116 N -3.33 0.00 0.00 0.59 7.94 -1.24 -1.56 117.00 119.40 3htx n LEU 116 Ca -0.01 0.25 0.00 0.00 -1.11 0.00 0.00 56.01 55.14 3htx n LEU 116 Cb 0.26 -0.25 0.00 0.00 0.53 0.00 0.00 43.42 43.96 3htx n LEU 116 CO 0.28 -0.24 0.08 -1.54 -1.11 0.00 0.00 177.39 174.86 3htx n SER 117 N -1.25 0.33 -4.60 1.96 3.41 -1.17 -4.75 113.62 107.55 3htx n SER 117 Ca 0.00 -0.65 -0.42 0.00 -0.26 0.00 0.00 58.87 57.54 3htx n SER 117 Cb 0.01 0.50 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 3htx n SER 117 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3htx n ALA 118 N -0.50 0.05 1.10 7.33 0.00 -0.60 -4.83 120.51 123.06 3htx n ALA 118 Ca 0.00 0.28 0.02 0.00 0.00 0.00 0.00 53.44 53.73 3htx n ALA 118 Cb 0.02 -2.06 0.06 0.00 0.00 0.00 0.00 19.45 17.47 3htx n ALA 118 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3htx n GLU 119 N 0.35 1.49 -1.53 0.00 -0.58 -1.26 -4.47 120.64 114.64 3htx n GLU 119 Ca 0.09 -0.49 -0.31 0.00 -0.42 0.00 0.00 57.16 56.03 3htx n GLU 119 Cb 0.37 -1.39 0.06 0.00 -0.57 0.00 0.00 31.44 29.91 3htx n GLU 119 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 3htx s HIS 120 N -1.54 2.95 0.32 -0.32 2.46 -1.26 -1.94 115.29 115.96 3htx s HIS 120 Ca 0.09 1.47 -0.00 0.00 0.47 0.00 0.00 55.06 57.08 3htx s HIS 120 Cb 0.06 -2.94 0.51 0.00 -0.13 0.00 0.00 32.58 30.08 3htx s HIS 120 CO 0.04 -1.38 1.96 -1.35 -2.47 0.00 0.00 174.74 171.53 3htx h PRO 121 N -0.73 0.93 -0.96 2.88 0.11 -1.87 -3.25 132.00 129.11 3htx h PRO 121 Ca -0.44 -0.08 0.09 0.00 0.11 0.00 0.00 66.00 65.68 3htx h PRO 121 Cb 1.22 -0.20 -0.07 0.00 0.11 0.00 0.00 31.00 32.06 3htx h PRO 121 CO 0.55 0.66 0.60 -0.07 -0.21 0.00 0.00 178.00 179.53 3htx h LEU 122 N 0.95 0.91 -0.74 2.35 3.38 -1.91 -2.11 115.31 118.14 3htx h LEU 122 Ca 0.25 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 58.12 3htx h LEU 122 Cb -0.03 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3htx h LEU 122 CO -0.05 0.54 -0.60 1.23 0.09 0.00 0.00 178.44 179.66 3htx h GLY 123 N 1.02 0.00 1.02 0.83 0.00 -1.78 0.43 103.07 104.59 3htx h GLY 123 Ca 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.77 3htx h GLY 123 CO -0.22 0.00 0.51 0.00 0.00 0.00 0.00 176.54 176.83 3htx h ALA 124 N 1.40 1.10 0.31 3.60 0.00 -1.47 0.96 119.26 125.16 3htx h ALA 124 Ca -0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3htx h ALA 124 Cb 1.10 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3htx h ALA 124 CO 0.08 0.57 -0.15 0.45 0.00 0.00 0.00 179.25 180.20 3htx h HIS 125 N 1.19 -0.39 -0.73 0.00 -0.00 -1.01 -0.34 115.15 113.86 3htx h HIS 125 Ca 0.31 -0.01 0.07 0.00 -0.00 0.00 0.00 60.37 60.73 3htx h HIS 125 Cb -0.03 0.13 -0.09 0.00 -0.00 0.00 0.00 27.41 27.42 3htx h HIS 125 CO 0.00 -0.24 -0.43 1.28 -0.00 0.00 0.00 177.93 178.54 3htx n LEU 126 N -3.30 -0.78 -0.30 2.43 4.77 0.15 0.14 117.00 120.11 3htx n LEU 126 Ca -0.05 1.47 0.14 0.00 -0.03 0.00 0.00 56.01 57.54 3htx n LEU 126 Cb 0.16 -0.25 0.39 0.00 -2.33 0.00 0.00 43.42 41.39 3htx n LEU 126 CO 0.12 -1.15 1.21 0.03 -1.33 0.00 0.00 177.39 176.28 3htx h ARG 127 N 0.00 0.64 0.00 3.23 3.08 0.92 0.98 114.38 123.23 3htx h ARG 127 Ca 0.12 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 3htx h ARG 127 Cb 0.30 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3htx h ARG 127 CO -0.69 0.42 -0.17 0.00 -1.07 0.00 0.00 179.97 178.47 3htx h ALA 128 N 1.61 1.03 0.00 0.04 0.00 0.30 -2.56 119.26 119.68 3htx h ALA 128 Ca 0.51 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3htx h ALA 128 Cb 0.92 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3htx h ALA 128 CO -0.27 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.19 3htx h ALA 129 N 1.83 1.00 0.00 0.00 0.00 0.74 -2.92 119.26 119.91 3htx h ALA 129 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3htx h ALA 129 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3htx h ALA 129 CO 0.02 0.00 -0.43 1.28 0.00 0.00 0.00 179.25 180.12 3htx n LEU 130 N -2.76 0.58 -0.02 0.00 4.77 -0.83 -1.41 117.00 117.34 3htx n LEU 130 Ca 0.04 0.25 0.13 0.00 -0.03 0.00 0.00 56.01 56.40 3htx n LEU 130 Cb 0.43 -0.26 0.37 0.00 -2.33 0.00 0.00 43.42 41.62 3htx n LEU 130 CO 0.30 -0.02 0.61 0.54 -1.33 0.00 0.00 177.39 177.49 3htx n ARG 131 N -1.90 0.07 -2.06 3.23 1.74 -1.10 -4.57 116.66 112.07 3htx n ARG 131 Ca 0.05 -0.03 -0.39 0.00 -0.77 0.00 0.00 57.85 56.70 3htx n ARG 131 Cb 0.40 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 30.34 3htx n ARG 131 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3htx s ARG 132 N -2.95 3.94 0.27 5.56 0.52 -1.21 -4.59 118.95 120.49 3htx s ARG 132 Ca 0.13 2.14 -0.29 0.00 -0.52 0.00 0.00 55.73 57.19 3htx s ARG 132 Cb 0.18 -2.73 -0.09 0.00 0.52 0.00 0.00 34.95 32.83 3htx s ARG 132 CO 0.64 -0.51 0.94 0.34 0.02 0.00 0.00 175.30 176.73 3htx s ASP 133 N -0.78 7.53 0.95 0.23 2.15 -1.25 -3.41 116.67 122.09 3htx s ASP 133 Ca 0.58 1.91 0.00 0.00 0.43 0.00 0.00 52.55 55.46 3htx s ASP 133 Cb -0.38 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.65 3htx s ASP 133 CO 0.48 0.07 0.00 0.61 -0.17 0.00 0.00 175.17 176.17 3htx n GLY 134 N 1.14 1.78 0.37 2.66 0.00 -1.26 -3.08 105.19 106.80 3htx n GLY 134 Ca -0.01 -0.53 0.16 0.00 0.00 0.00 0.00 46.02 45.65 3htx n GLY 134 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3htx h GLU 135 N 0.00 0.00 0.00 1.61 5.08 -2.05 0.15 114.58 119.37 3htx h GLU 135 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3htx h GLU 135 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3htx h GLU 135 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 3htx h ARG 136 N 0.00 0.00 -6.80 2.33 3.08 -1.84 -3.46 114.38 107.70 3htx h ARG 136 Ca 0.11 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.63 3htx h ARG 136 Cb 1.21 0.00 0.08 0.00 0.08 0.00 0.00 29.97 31.34 3htx h ARG 136 CO -0.00 0.00 0.88 0.00 -1.07 0.00 0.00 179.97 179.78 3htx n GLY 138 N 2.22 0.78 3.56 0.00 0.00 -0.50 -5.01 105.19 106.25 3htx n GLY 138 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 3htx n GLY 138 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3htx s SER 139 N -2.57 4.96 -0.11 1.61 0.01 -0.88 -3.80 113.70 112.93 3htx s SER 139 Ca 0.00 -0.03 -0.00 0.00 1.31 0.00 0.00 55.95 57.23 3htx s SER 139 Cb 0.00 -1.66 -0.02 0.00 0.21 0.00 0.00 66.02 64.55 3htx s SER 139 CO 0.00 0.24 -0.10 -0.69 0.41 0.00 0.00 173.24 173.10 3htx s VAL 140 N -0.06 3.38 0.26 3.43 1.01 0.26 -4.79 120.40 123.89 3htx s VAL 140 Ca 0.02 -0.57 -0.30 0.00 0.00 0.00 0.00 61.98 61.13 3htx s VAL 140 Cb -0.13 -2.41 -0.11 0.00 0.00 0.00 0.00 36.38 33.73 3htx s VAL 140 CO 0.02 0.55 1.56 -2.84 0.00 0.00 0.00 175.10 174.39 3htx s PRO 141 N -0.10 4.17 0.15 2.72 0.02 -1.26 0.92 135.00 141.62 3htx s PRO 141 Ca -0.00 2.48 -0.16 0.00 0.02 0.00 0.00 61.00 63.34 3htx s PRO 141 Cb -0.13 -3.06 0.06 0.00 0.02 0.00 0.00 34.50 31.38 3htx s PRO 141 CO 0.03 -0.58 1.76 0.28 -0.33 0.00 0.00 177.00 178.16 3htx h VAL 142 N 3.53 0.92 -1.03 3.83 2.07 -1.89 -1.58 116.25 122.11 3htx h VAL 142 Ca -0.46 -0.10 0.26 0.00 0.82 0.00 0.00 66.70 67.22 3htx h VAL 142 Cb 1.22 0.59 -0.12 0.00 -1.52 0.00 0.00 31.29 31.46 3htx h VAL 142 CO 0.82 0.06 0.63 0.77 0.02 0.00 0.00 177.57 179.86 3htx h SER 143 N 0.30 0.58 -0.16 0.57 4.64 -1.86 0.21 113.55 117.83 3htx h SER 143 Ca 0.16 0.12 0.02 0.00 -0.47 0.00 0.00 61.79 61.62 3htx h SER 143 Cb 0.12 0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.23 3htx h SER 143 CO -0.15 0.08 0.05 0.58 -0.87 0.00 0.00 176.83 176.52 3htx h VAL 144 N 0.49 0.95 -0.17 0.95 2.07 -1.63 0.16 116.25 119.07 3htx h VAL 144 Ca 0.64 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 68.10 3htx h VAL 144 Cb 1.39 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 3htx h VAL 144 CO -0.42 0.02 0.05 0.40 0.02 0.00 0.00 177.57 177.65 3htx h ILE 145 N 0.13 1.18 0.00 4.57 1.08 -0.54 -1.67 117.51 122.26 3htx h ILE 145 Ca 0.07 -0.56 0.00 0.00 -0.39 0.00 0.00 64.86 63.98 3htx h ILE 145 Cb 0.05 1.24 0.00 0.00 -3.07 0.00 0.00 36.82 35.03 3htx h ILE 145 CO -0.08 0.17 0.00 0.00 -0.69 0.00 0.00 178.15 177.56 3htx n ALA 146 N -2.25 2.02 -0.12 1.87 0.00 -0.46 -3.50 120.51 118.08 3htx n ALA 146 Ca -0.04 0.02 -0.23 0.00 0.00 0.00 0.00 53.44 53.19 3htx n ALA 146 Cb 0.14 -1.43 -0.09 0.00 0.00 0.00 0.00 19.45 18.07 3htx n ALA 146 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3htx n THR 147 N -2.23 1.30 0.10 0.00 -1.04 0.54 -4.62 114.28 108.32 3htx n THR 147 Ca 0.04 -0.38 -0.15 0.00 -2.04 0.00 0.00 64.05 61.52 3htx n THR 147 Cb 0.34 -1.66 -0.11 0.00 -1.82 0.00 0.00 70.33 67.08 3htx n THR 147 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3htx h VAL 148 N -0.59 1.48 -2.96 12.58 2.07 -1.47 -3.44 116.25 123.92 3htx h VAL 148 Ca -0.57 -2.91 -0.57 0.00 0.82 0.00 0.00 66.70 63.47 3htx h VAL 148 Cb 1.61 2.81 -0.04 0.00 -1.52 0.00 0.00 31.29 34.14 3htx h VAL 148 CO -0.28 0.85 0.86 -0.62 0.02 0.00 0.00 177.57 178.41 3htx s ASP 149 N -7.12 6.98 0.05 0.57 -1.08 -1.23 -4.91 116.67 109.93 3htx s ASP 149 Ca -0.04 1.66 -0.24 0.00 -0.52 0.00 0.00 52.55 53.41 3htx s ASP 149 Cb 0.08 -2.54 -0.17 0.00 -1.46 0.00 0.00 42.92 38.83 3htx s ASP 149 CO 0.88 -0.73 1.56 0.00 0.52 0.00 0.00 175.17 177.40 3htx h ALA 150 N 8.01 0.02 -0.61 3.66 0.00 -1.92 -2.16 119.26 126.25 3htx h ALA 150 Ca -0.26 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.59 3htx h ALA 150 Cb 1.10 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 3htx h ALA 150 CO 0.96 -0.39 0.41 -0.22 0.00 0.00 0.00 179.25 180.01 3htx h LYS 151 N -0.17 0.66 -0.41 0.00 3.64 -1.99 0.38 116.57 118.68 3htx h LYS 151 Ca 0.00 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 3htx h LYS 151 Cb 0.19 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 3htx h LYS 151 CO -0.00 0.43 -0.00 0.82 -2.27 0.00 0.00 179.45 178.43 3htx h ILE 152 N 0.68 1.26 0.65 2.00 1.08 -1.87 -2.43 117.51 118.88 3htx h ILE 152 Ca 0.25 -1.02 -0.03 0.00 -0.39 0.00 0.00 64.86 63.67 3htx h ILE 152 Cb 0.16 1.12 0.01 0.00 -3.07 0.00 0.00 36.82 35.03 3htx h ILE 152 CO -0.07 0.35 -0.31 0.78 -0.69 0.00 0.00 178.15 178.20 3htx h ASN 153 N 0.55 -0.74 -0.73 1.72 2.35 -0.33 0.63 115.58 119.04 3htx h ASN 153 Ca 0.12 -0.01 0.05 0.00 -0.55 0.00 0.00 56.30 55.90 3htx h ASN 153 Cb 0.48 0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.99 3htx h ASN 153 CO 0.02 -0.45 0.44 0.77 -1.65 0.00 0.00 177.43 176.56 3htx h SER 154 N -0.99 0.70 0.00 5.81 4.64 -1.17 0.30 113.55 122.84 3htx h SER 154 Ca -0.09 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3htx h SER 154 Cb 0.70 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 3htx h SER 154 CO 0.15 0.46 -0.00 0.03 -0.87 0.00 0.00 176.83 176.60 3htx h ARG 155 N 0.83 -0.00 -0.66 4.77 2.47 -1.39 -2.90 114.38 117.50 3htx h ARG 155 Ca 0.31 0.00 0.06 0.00 -1.26 0.00 0.00 59.98 59.09 3htx h ARG 155 Cb 0.11 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.39 3htx h ARG 155 CO -0.15 0.13 0.43 0.00 0.56 0.00 0.00 179.97 180.95 3htx h LYS 157 N 0.69 0.25 -0.96 0.00 1.57 -0.24 -2.98 116.57 114.90 3htx h LYS 157 Ca 0.28 -0.03 0.11 0.00 -1.87 0.00 0.00 60.65 59.14 3htx h LYS 157 Cb 0.23 -0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.41 3htx h LYS 157 CO -0.09 0.25 0.60 0.82 -0.57 0.00 0.00 179.45 180.46 3htx h ILE 158 N 0.17 0.93 -0.94 1.86 2.04 -1.25 0.09 117.51 120.41 3htx h ILE 158 Ca 0.06 -0.33 0.13 0.00 1.00 0.00 0.00 64.86 65.71 3htx h ILE 158 Cb 0.08 -0.12 -0.09 0.00 -0.74 0.00 0.00 36.82 35.96 3htx h ILE 158 CO -0.01 0.18 0.56 0.40 0.00 0.00 0.00 178.15 179.28 3htx h ILE 159 N 0.97 0.87 -0.85 -0.67 2.04 -1.40 -3.39 117.51 115.08 3htx h ILE 159 Ca 0.47 -0.30 0.06 0.00 1.00 0.00 0.00 64.86 66.09 3htx h ILE 159 Cb 0.43 -0.08 -0.20 0.00 -0.74 0.00 0.00 36.82 36.22 3htx h ILE 159 CO -0.25 0.16 -0.31 0.21 0.00 0.00 0.00 178.15 177.95 3htx s ASN 160 N -5.60 -1.39 0.40 1.72 3.84 -0.56 -5.02 114.94 108.33 3htx s ASN 160 Ca -0.12 0.08 0.20 0.00 0.21 0.00 0.00 52.86 53.24 3htx s ASN 160 Cb 0.22 1.86 1.16 0.00 -0.55 0.00 0.00 41.25 43.95 3htx s ASN 160 CO 0.80 -0.24 1.73 -0.65 -2.79 0.00 0.00 177.10 175.94 3htx h PRO 161 N 7.74 0.32 -0.34 0.43 0.11 -1.23 -1.50 132.00 137.53 3htx h PRO 161 Ca -0.02 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 66.17 3htx h PRO 161 Cb 1.19 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3htx h PRO 161 CO 0.10 0.21 0.84 0.66 -0.21 0.00 0.00 178.00 179.60 3htx h SER 162 N 0.33 0.00 -0.93 -2.05 4.64 -1.95 -2.41 113.55 111.18 3htx h SER 162 Ca 0.66 0.00 0.23 0.00 -0.47 0.00 0.00 61.79 62.21 3htx h SER 162 Cb 1.74 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.77 3htx h SER 162 CO -0.36 0.00 0.63 0.58 -0.87 0.00 0.00 176.83 176.81 3htx h VAL 163 N 0.00 0.61 -0.57 0.95 2.07 -1.49 -2.46 116.25 115.37 3htx h VAL 163 Ca 0.16 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.62 3htx h VAL 163 Cb 1.84 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 3htx h VAL 163 CO -0.00 0.05 0.38 -0.33 0.02 0.00 0.00 177.57 177.69 3htx h GLU 164 N 0.29 0.63 0.34 1.57 5.08 -1.70 -2.74 114.58 118.04 3htx h GLU 164 Ca 0.48 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.79 3htx h GLU 164 Cb 1.39 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3htx h GLU 164 CO -0.15 0.41 -0.16 0.66 -1.00 0.00 0.00 179.01 178.77 3htx h SER 165 N 0.64 -0.38 -3.25 1.42 4.64 -1.70 -3.43 113.55 111.49 3htx h SER 165 Ca 0.23 -0.16 -0.63 0.00 -0.47 0.00 0.00 61.79 60.76 3htx h SER 165 Cb 0.12 0.10 -0.36 0.00 -0.31 0.00 0.00 62.40 61.95 3htx h SER 165 CO -0.06 0.05 -0.83 1.51 -0.87 0.00 0.00 176.83 176.63 3htx s ASP 166 N -5.08 3.14 0.40 4.97 3.84 -1.14 -1.78 116.67 121.02 3htx s ASP 166 Ca -0.12 -0.72 0.27 0.00 -0.00 0.00 0.00 52.55 51.98 3htx s ASP 166 Cb 0.01 -1.29 0.85 0.00 -1.38 0.00 0.00 42.92 41.11 3htx s ASP 166 CO 0.45 -0.08 1.77 1.55 -0.00 0.00 0.00 175.17 178.86 3htx h PRO 167 N 7.98 0.00 -0.46 2.11 0.13 -1.76 -3.34 132.00 136.67 3htx h PRO 167 Ca -0.35 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.91 3htx h PRO 167 Cb 1.12 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 3htx h PRO 167 CO 0.53 0.00 0.62 0.74 -0.23 0.00 0.00 178.00 179.66 3htx h PHE 168 N 0.00 0.00 -0.52 1.56 -1.00 -1.97 0.21 116.94 115.22 3htx h PHE 168 Ca 0.00 0.00 0.05 0.00 2.81 0.00 0.00 57.97 60.83 3htx h PHE 168 Cb 0.70 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.21 3htx h PHE 168 CO 0.00 0.00 0.24 -0.07 -1.61 0.00 0.00 178.31 176.87 3htx h LEU 169 N 0.00 0.33 -0.75 1.54 3.38 -1.90 -0.33 115.31 117.58 3htx h LEU 169 Ca 0.22 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.24 3htx h LEU 169 Cb 1.46 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 42.15 3htx h LEU 169 CO -0.00 0.22 0.50 0.00 0.09 0.00 0.00 178.44 179.25 3htx h ALA 170 N 1.30 0.95 -0.78 1.53 0.00 -0.89 0.33 119.26 121.71 3htx h ALA 170 Ca 0.24 -0.05 0.11 0.00 0.00 0.00 0.00 54.91 55.21 3htx h ALA 170 Cb 0.18 -0.30 -0.08 0.00 0.00 0.00 0.00 17.79 17.59 3htx h ALA 170 CO -0.19 0.36 0.40 0.82 0.00 0.00 0.00 179.25 180.65 3htx h ILE 171 N 1.01 0.81 -0.02 0.00 1.08 -1.08 0.16 117.51 119.48 3htx h ILE 171 Ca 0.27 -0.22 -0.20 0.00 -0.39 0.00 0.00 64.86 64.32 3htx h ILE 171 Cb -0.11 0.11 -0.01 0.00 -3.07 0.00 0.00 36.82 33.74 3htx h ILE 171 CO -0.06 0.12 -0.85 0.28 -0.69 0.00 0.00 178.15 176.94 3htx h SER 172 N 0.64 0.37 -0.36 1.72 0.02 0.27 -0.84 113.55 115.36 3htx h SER 172 Ca 0.40 -0.28 -0.05 0.00 -0.84 0.00 0.00 61.79 61.01 3htx h SER 172 Cb 0.47 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 3htx h SER 172 CO -0.30 1.06 0.06 1.88 -1.14 0.00 0.00 176.83 178.39 3htx h TYR 173 N 0.17 0.71 -0.10 3.45 -1.99 0.53 0.29 116.97 120.03 3htx h TYR 173 Ca -0.05 -0.07 -0.11 0.00 2.00 0.00 0.00 58.73 60.50 3htx h TYR 173 Cb 1.46 -0.21 0.00 0.00 2.00 0.00 0.00 36.73 39.99 3htx h TYR 173 CO 0.04 0.64 -0.37 0.28 -0.00 0.00 0.00 178.16 178.75 3htx h VAL 174 N 0.66 1.39 -0.48 -2.88 2.07 -0.63 -2.30 116.25 114.08 3htx h VAL 174 Ca 0.14 -1.71 0.04 0.00 0.82 0.00 0.00 66.70 66.00 3htx h VAL 174 Cb 0.32 2.18 -0.04 0.00 -1.52 0.00 0.00 31.29 32.23 3htx h VAL 174 CO 0.01 0.50 0.24 0.24 0.02 0.00 0.00 177.57 178.58 3htx h MET 175 N 0.01 0.46 -0.49 1.57 2.86 -0.79 0.26 114.93 118.81 3htx h MET 175 Ca -0.02 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 3htx h MET 175 Cb 1.00 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.54 3htx h MET 175 CO 0.08 0.30 0.13 0.87 1.06 0.00 0.00 176.91 179.35 3htx h LYS 176 N 0.47 0.74 -0.08 1.72 1.57 -0.98 -2.11 116.57 117.90 3htx h LYS 176 Ca 0.21 -0.14 -0.23 0.00 -1.87 0.00 0.00 60.65 58.62 3htx h LYS 176 Cb 0.12 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.32 3htx h LYS 176 CO -0.15 0.66 -0.85 0.00 -0.57 0.00 0.00 179.45 178.54 3htx h ALA 177 N 1.42 0.33 -0.60 3.86 0.00 -0.74 -2.91 119.26 120.62 3htx h ALA 177 Ca 0.16 -0.64 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 3htx h ALA 177 Cb 0.25 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3htx h ALA 177 CO -0.00 0.72 0.15 0.00 0.00 0.00 0.00 179.25 180.11 3htx h ALA 178 N 0.62 1.14 0.00 0.00 0.00 -0.79 -2.40 119.26 117.82 3htx h ALA 178 Ca -0.07 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 3htx h ALA 178 Cb 1.48 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3htx h ALA 178 CO 0.17 0.58 -0.28 0.00 0.00 0.00 0.00 179.25 179.72 3htx h ALA 179 N 1.27 1.24 0.00 0.00 0.00 -1.36 -2.29 119.26 118.13 3htx h ALA 179 Ca 0.19 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3htx h ALA 179 Cb 0.31 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3htx h ALA 179 CO -0.00 0.35 0.00 1.63 0.00 0.00 0.00 179.25 181.23 3htx n LYS 180 N -3.77 0.04 -3.91 0.00 5.02 -0.91 -3.73 118.16 110.90 3htx n LYS 180 Ca -0.01 0.14 -0.32 0.00 -2.02 0.00 0.00 58.31 56.10 3htx n LYS 180 Cb 0.38 -1.55 -0.13 0.00 -0.02 0.00 0.00 35.03 33.70 3htx n LYS 180 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3htx s LEU 181 N -3.24 4.69 -0.18 -0.35 2.96 -0.86 -4.96 118.68 116.74 3htx s LEU 181 Ca 0.10 -2.68 -0.08 0.00 -0.22 0.00 0.00 54.13 51.25 3htx s LEU 181 Cb 0.14 -1.70 -0.22 0.00 0.50 0.00 0.00 46.19 44.92 3htx s LEU 181 CO 0.43 -0.32 0.15 0.00 -1.32 0.00 0.00 176.35 175.29 3htx n ALA 182 N 3.60 1.01 0.29 5.97 0.00 -1.24 -3.18 120.51 126.96 3htx n ALA 182 Ca 0.05 -0.72 0.15 0.00 0.00 0.00 0.00 53.44 52.91 3htx n ALA 182 Cb 0.36 -0.47 0.70 0.00 0.00 0.00 0.00 19.45 20.05 3htx n ALA 182 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3htx h ASP 183 N -0.23 0.00 0.00 0.00 -0.00 -1.93 -3.27 116.42 110.99 3htx h ASP 183 Ca -0.47 0.00 -0.35 0.00 -0.00 0.00 0.00 57.03 56.21 3htx h ASP 183 Cb 1.84 0.00 -0.06 0.00 -0.00 0.00 0.00 39.33 41.11 3htx h ASP 183 CO -0.05 0.00 -2.28 -1.22 -0.00 0.00 0.00 179.24 175.69 3htx n TYR 184 N -2.56 0.00 -4.36 4.15 4.02 -1.26 -4.84 117.16 112.31 3htx n TYR 184 Ca -0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.64 3htx n TYR 184 Cb 0.15 -0.85 -0.12 0.00 -0.02 0.00 0.00 39.34 38.50 3htx n TYR 184 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3htx s ILE 185 N -2.44 2.04 -0.10 -0.72 1.01 -1.19 -2.02 121.20 117.79 3htx s ILE 185 Ca -0.31 -1.85 0.01 0.00 0.00 0.00 0.00 60.65 58.50 3htx s ILE 185 Cb 0.09 -1.90 0.02 0.00 0.01 0.00 0.00 42.46 40.69 3htx s ILE 185 CO 0.48 -0.13 -0.11 -0.69 0.00 0.00 0.00 174.94 174.49 3htx s VAL 186 N -1.57 1.18 -0.54 2.92 1.01 -0.50 -4.47 120.40 118.44 3htx s VAL 186 Ca 0.15 -0.42 -0.25 0.00 0.00 0.00 0.00 61.98 61.46 3htx s VAL 186 Cb -0.08 -1.13 0.04 0.00 0.00 0.00 0.00 36.38 35.20 3htx s VAL 186 CO 0.07 0.38 0.98 0.00 0.00 0.00 0.00 175.10 176.54 3htx s ALA 187 N 1.30 3.15 -0.19 5.51 0.00 -1.26 -0.30 121.76 129.97 3htx s ALA 187 Ca -0.02 -1.07 -0.05 0.00 0.00 0.00 0.00 51.96 50.82 3htx s ALA 187 Cb -0.14 -3.77 -0.03 0.00 0.00 0.00 0.00 23.12 19.19 3htx s ALA 187 CO -0.04 -2.36 0.00 0.45 0.00 0.00 0.00 175.76 173.81 3htx s SER 188 N 2.74 4.91 0.20 0.00 0.15 -0.80 -4.70 113.70 116.19 3htx s SER 188 Ca 0.34 -0.16 0.14 0.00 0.70 0.00 0.00 55.95 56.96 3htx s SER 188 Cb -0.11 -1.84 0.68 0.00 -1.71 0.00 0.00 66.02 63.04 3htx s SER 188 CO 0.22 0.09 0.74 -2.65 1.20 0.00 0.00 173.24 172.83 3htx n PRO 189 N 4.09 -0.02 0.31 5.44 -0.02 -1.26 0.35 135.00 143.88 3htx n PRO 189 Ca -0.17 0.61 0.19 0.00 -2.02 0.00 0.00 63.50 62.11 3htx n PRO 189 Cb 0.52 -1.16 0.97 0.00 -0.02 0.00 0.00 33.50 33.81 3htx n PRO 189 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3htx h HIS 190 N 0.00 0.00 0.00 6.00 3.86 -1.93 -3.45 115.15 119.62 3htx h HIS 190 Ca 0.41 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.62 3htx h HIS 190 Cb 1.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.71 3htx h HIS 190 CO -0.00 0.02 0.00 0.41 0.86 0.00 0.00 177.93 179.22 3htx n GLY 191 N -0.74 1.09 3.77 2.45 0.00 1.07 -4.27 105.19 108.56 3htx n GLY 191 Ca -0.02 -1.77 -0.38 0.00 0.00 0.00 0.00 46.02 43.85 3htx n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3htx s LEU 192 N 0.00 4.12 0.10 0.99 1.43 0.26 -1.91 118.68 123.67 3htx s LEU 192 Ca 0.00 2.29 0.03 0.00 -1.03 0.00 0.00 54.13 55.42 3htx s LEU 192 Cb 0.00 -4.13 -0.04 0.00 0.03 0.00 0.00 46.19 42.06 3htx s LEU 192 CO 0.00 -0.75 -0.09 -0.60 0.23 0.00 0.00 176.35 175.15 3htx s ARG 193 N -2.48 0.83 0.27 1.70 3.52 0.59 0.89 118.95 124.26 3htx s ARG 193 Ca 0.60 -1.19 -0.29 0.00 -0.13 0.00 0.00 55.73 54.71 3htx s ARG 193 Cb -0.29 -0.42 -0.09 0.00 -1.56 0.00 0.00 34.95 32.59 3htx s ARG 193 CO 0.36 0.05 1.11 0.50 -0.81 0.00 0.00 175.30 176.50 3htx s ARG 194 N -3.05 4.63 -0.09 5.12 3.00 -1.25 -1.40 118.95 125.90 3htx s ARG 194 Ca 0.07 1.81 -0.27 0.00 -1.00 0.00 0.00 55.73 56.33 3htx s ARG 194 Cb -0.01 -3.20 -0.23 0.00 0.00 0.00 0.00 34.95 31.51 3htx s ARG 194 CO -0.01 0.18 0.96 -0.22 0.00 0.00 0.00 175.30 176.21 3htx h LYS 195 N 3.98 -0.01 -5.29 5.12 3.64 -1.73 -3.44 116.57 118.84 3htx h LYS 195 Ca -0.46 0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.27 3htx h LYS 195 Cb 1.21 0.00 -0.23 0.00 -0.41 0.00 0.00 32.23 32.80 3htx h LYS 195 CO 0.68 0.77 -0.70 -0.80 -2.27 0.00 0.00 179.45 177.13 3htx s ASN 196 N -5.99 4.55 0.86 4.20 0.01 -1.26 -5.05 114.94 112.25 3htx s ASN 196 Ca -0.18 -0.20 -0.17 0.00 -0.71 0.00 0.00 52.86 51.61 3htx s ASN 196 Cb -0.01 -1.73 -0.11 0.00 0.41 0.00 0.00 41.25 39.80 3htx s ASN 196 CO 0.67 0.16 -0.36 0.00 -1.51 0.00 0.00 177.10 176.06 3htx n ALA 197 N 3.59 -4.19 -1.90 0.60 0.00 -1.26 -4.87 120.51 112.48 3htx n ALA 197 Ca -0.18 -0.49 -0.41 0.00 0.00 0.00 0.00 53.44 52.36 3htx n ALA 197 Cb 0.52 -1.36 -0.04 0.00 0.00 0.00 0.00 19.45 18.58 3htx n ALA 197 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3htx s TYR 198 N -2.04 3.46 0.27 0.00 1.51 -1.26 -4.92 117.35 114.37 3htx s TYR 198 Ca 0.49 1.55 -0.30 0.00 -1.01 0.00 0.00 57.07 57.79 3htx s TYR 198 Cb -0.27 -3.39 -0.13 0.00 -0.11 0.00 0.00 41.96 38.06 3htx s TYR 198 CO 0.75 -0.97 1.34 -0.35 -1.11 0.00 0.00 175.55 175.21 3htx n PRO 199 N 1.76 1.99 -0.30 -1.71 -0.04 -1.26 -4.83 135.00 130.60 3htx n PRO 199 Ca 0.01 0.70 -0.04 0.00 -0.04 0.00 0.00 63.50 64.13 3htx n PRO 199 Cb 0.44 -2.32 0.01 0.00 -0.04 0.00 0.00 33.50 31.59 3htx n PRO 199 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3htx h SER 200 N 3.61 -1.42 -0.82 3.54 0.87 -2.02 -2.08 113.55 115.23 3htx h SER 200 Ca -0.45 0.27 0.33 0.00 -1.23 0.00 0.00 61.79 60.72 3htx h SER 200 Cb 1.28 0.70 -0.15 0.00 -0.44 0.00 0.00 62.40 63.80 3htx h SER 200 CO 0.71 -0.30 0.40 -0.62 -0.53 0.00 0.00 176.83 176.49 3htx n GLU 201 N -5.43 -0.05 0.01 2.24 4.71 -1.26 -0.60 120.64 120.26 3htx n GLU 201 Ca 0.06 1.15 -0.12 0.00 -0.01 0.00 0.00 57.16 58.23 3htx n GLU 201 Cb 0.37 -2.03 -0.08 0.00 -1.01 0.00 0.00 31.44 28.68 3htx n GLU 201 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 3htx h ILE 202 N 0.00 1.20 -0.22 -3.67 2.04 -1.72 -2.73 117.51 112.40 3htx h ILE 202 Ca 0.68 -0.57 0.02 0.00 1.00 0.00 0.00 64.86 65.98 3htx h ILE 202 Cb 1.76 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 39.41 3htx h ILE 202 CO -0.65 0.15 0.15 0.58 0.00 0.00 0.00 178.15 178.38 3htx h VAL 203 N -0.24 1.02 -0.21 1.67 2.07 -0.96 -1.45 116.25 118.15 3htx h VAL 203 Ca 0.00 -0.08 -0.14 0.00 0.82 0.00 0.00 66.70 67.30 3htx h VAL 203 Cb 0.24 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 3htx h VAL 203 CO 0.00 0.04 -0.45 -0.33 0.02 0.00 0.00 177.57 176.85 3htx h GLU 204 N 0.23 0.53 -0.49 1.57 5.08 -1.36 -2.70 114.58 117.44 3htx h GLU 204 Ca 0.09 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 58.07 3htx h GLU 204 Cb 0.06 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3htx h GLU 204 CO -0.02 0.88 -0.06 0.00 -1.00 0.00 0.00 179.01 178.81 3htx h ALA 205 N 1.08 0.97 -0.65 3.43 0.00 -0.98 -2.92 119.26 120.20 3htx h ALA 205 Ca 0.03 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 3htx h ALA 205 Cb 0.96 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 3htx h ALA 205 CO 0.08 0.61 0.12 -0.07 0.00 0.00 0.00 179.25 180.00 3htx h LEU 206 N 0.79 1.00 0.00 0.00 3.38 -1.25 -2.99 115.31 116.24 3htx h LEU 206 Ca 0.14 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3htx h LEU 206 Cb 0.55 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3htx h LEU 206 CO 0.03 0.99 0.20 0.00 0.09 0.00 0.00 178.44 179.75 3htx n ALA 207 N -2.46 0.55 0.08 1.53 0.00 -1.03 0.11 120.51 119.28 3htx n ALA 207 Ca 0.04 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.55 3htx n ALA 207 Cb 0.28 -0.50 -0.02 0.00 0.00 0.00 0.00 19.45 19.20 3htx n ALA 207 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3htx h THR 208 N 0.00 0.24 -3.60 0.00 2.02 -1.68 -3.40 112.91 106.49 3htx h THR 208 Ca 0.00 -1.45 -0.67 0.00 0.77 0.00 0.00 66.41 65.05 3htx h THR 208 Cb 0.40 1.78 -0.34 0.00 -1.74 0.00 0.00 68.15 68.26 3htx h THR 208 CO 0.00 0.14 -0.77 -1.00 0.37 0.00 0.00 175.52 174.26 3htx s HIS 209 N -3.16 3.12 0.24 3.16 3.76 0.30 -5.09 115.29 117.62 3htx s HIS 209 Ca -0.01 -1.84 0.02 0.00 -0.15 0.00 0.00 55.06 53.07 3htx s HIS 209 Cb 0.09 -2.01 -0.04 0.00 1.11 0.00 0.00 32.58 31.73 3htx s HIS 209 CO 0.79 -0.80 0.18 0.08 -0.85 0.00 0.00 174.74 174.14 3htx s VAL 210 N 1.24 0.01 1.02 -0.90 1.01 -1.26 -4.86 120.40 116.67 3htx s VAL 210 Ca -0.03 -2.00 -0.11 0.00 0.00 0.00 0.00 61.98 59.84 3htx s VAL 210 Cb -0.18 -2.50 0.21 0.00 0.00 0.00 0.00 36.38 33.91 3htx s VAL 210 CO -0.05 0.00 1.09 -0.94 0.00 0.00 0.00 175.10 175.20 3htx s SER 211 N -3.23 2.06 -0.15 3.32 1.04 -1.26 -4.81 113.70 110.67 3htx s SER 211 Ca 0.39 1.88 -0.24 0.00 0.48 0.00 0.00 55.95 58.47 3htx s SER 211 Cb 0.06 -2.45 -0.21 0.00 0.10 0.00 0.00 66.02 63.52 3htx s SER 211 CO 0.17 -3.59 0.54 -0.78 0.98 0.00 0.00 173.24 170.56 3htx h ASP 212 N -2.20 0.00 -3.24 7.02 1.82 -2.01 -3.47 116.42 114.34 3htx h ASP 212 Ca -0.51 -0.76 -0.55 0.00 -0.39 0.00 0.00 57.03 54.82 3htx h ASP 212 Cb 1.30 0.00 -0.35 0.00 0.68 0.00 0.00 39.33 40.95 3htx h ASP 212 CO 0.46 1.03 -0.82 -0.55 -1.61 0.00 0.00 179.24 177.75 3htx s SER 213 N -6.25 2.22 -1.13 2.28 0.15 -1.26 -5.04 113.70 104.67 3htx s SER 213 Ca -0.18 -0.35 -0.04 0.00 0.70 0.00 0.00 55.95 56.07 3htx s SER 213 Cb -0.01 -0.94 0.27 0.00 -1.71 0.00 0.00 66.02 63.63 3htx s SER 213 CO 0.57 -0.05 1.74 0.18 1.20 0.00 0.00 173.24 176.89 3htx n LEU 214 N 4.52 6.90 -4.01 3.45 4.77 -1.26 -4.76 117.00 126.60 3htx n LEU 214 Ca -0.17 -5.13 -0.12 0.00 -0.03 0.00 0.00 56.01 50.57 3htx n LEU 214 Cb 0.51 -1.29 -0.04 0.00 -2.33 0.00 0.00 43.42 40.27 3htx n LEU 214 CO 0.21 1.77 0.21 -1.00 -1.33 0.00 0.00 177.39 177.25 3htx s HIS 215 N -2.47 0.66 -0.09 -1.77 3.76 -1.26 -5.04 115.29 109.08 3htx s HIS 215 Ca 0.37 -1.01 -0.30 0.00 -0.15 0.00 0.00 55.06 53.97 3htx s HIS 215 Cb 0.11 0.15 -0.03 0.00 1.11 0.00 0.00 32.58 33.92 3htx s HIS 215 CO 0.01 -1.14 1.29 -1.54 -0.85 0.00 0.00 174.74 172.51 3htx s SER 216 N -3.13 6.95 -0.09 1.40 1.04 -1.26 -4.66 113.70 113.94 3htx s SER 216 Ca 0.25 1.84 0.03 0.00 0.48 0.00 0.00 55.95 58.56 3htx s SER 216 Cb -0.01 -2.55 -0.01 0.00 0.10 0.00 0.00 66.02 63.55 3htx s SER 216 CO 0.15 -0.70 -0.19 -0.13 0.98 0.00 0.00 173.24 173.34 3htx s ARG 217 N 2.90 2.92 -0.25 4.02 0.52 -0.89 -5.00 118.95 123.18 3htx s ARG 217 Ca 0.58 -0.79 -0.06 0.00 -0.52 0.00 0.00 55.73 54.93 3htx s ARG 217 Cb -0.25 -2.38 -0.02 0.00 0.52 0.00 0.00 34.95 32.82 3htx s ARG 217 CO 0.20 0.33 0.04 -1.21 0.02 0.00 0.00 175.30 174.68 3htx s GLU 218 N 0.01 3.48 -0.07 3.54 2.02 -1.26 -1.12 118.70 125.31 3htx s GLU 218 Ca -0.07 -0.58 -0.00 0.00 0.02 0.00 0.00 54.97 54.34 3htx s GLU 218 Cb -0.15 -3.25 -0.03 0.00 0.10 0.00 0.00 34.13 30.80 3htx s GLU 218 CO 0.05 -0.24 -0.03 0.08 0.02 0.00 0.00 175.26 175.14 3htx s VAL 219 N 1.56 4.01 -0.30 2.63 1.01 -0.58 -4.97 120.40 123.76 3htx s VAL 219 Ca 0.06 -0.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.45 3htx s VAL 219 Cb -0.15 -2.68 -0.01 0.00 0.00 0.00 0.00 36.38 33.53 3htx s VAL 219 CO 0.02 0.57 0.56 0.00 0.00 0.00 0.00 175.10 176.24 3htx s ALA 220 N -0.88 3.54 0.35 5.51 0.00 -1.26 -1.23 121.76 127.79 3htx s ALA 220 Ca 0.14 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.42 3htx s ALA 220 Cb -0.11 -3.00 -0.05 0.00 0.00 0.00 0.00 23.12 19.96 3htx s ALA 220 CO 0.03 -0.98 0.07 0.00 0.00 0.00 0.00 175.76 174.88 3htx s ALA 221 N 2.45 2.51 -0.07 0.00 0.00 -0.04 -0.34 121.76 126.26 3htx s ALA 221 Ca 0.22 -1.83 0.05 0.00 0.00 0.00 0.00 51.96 50.41 3htx s ALA 221 Cb -0.15 0.68 -0.01 0.00 0.00 0.00 0.00 23.12 23.64 3htx s ALA 221 CO 0.11 -0.31 -0.24 0.08 0.00 0.00 0.00 175.76 175.40 3htx s VAL 222 N -3.29 1.97 -0.45 0.00 1.01 0.09 0.40 120.40 120.13 3htx s VAL 222 Ca 0.33 -1.01 -0.21 0.00 0.00 0.00 0.00 61.98 61.09 3htx s VAL 222 Cb 0.07 -1.68 0.03 0.00 0.00 0.00 0.00 36.38 34.80 3htx s VAL 222 CO 0.15 0.55 0.69 -0.47 0.00 0.00 0.00 175.10 176.01 3htx s TYR 223 N 0.01 3.03 -0.07 5.22 5.04 0.12 -0.02 117.35 130.69 3htx s TYR 223 Ca -0.08 -0.06 -0.18 0.00 -2.44 0.00 0.00 57.07 54.31 3htx s TYR 223 Cb -0.15 -3.48 -0.05 0.00 0.35 0.00 0.00 41.96 38.64 3htx s TYR 223 CO 0.05 -0.94 0.49 0.42 -1.34 0.00 0.00 175.55 174.22 3htx s ILE 224 N 2.97 5.09 0.11 3.14 1.01 0.44 -2.88 121.20 131.08 3htx s ILE 224 Ca 0.24 0.99 0.02 0.00 0.00 0.00 0.00 60.65 61.90 3htx s ILE 224 Cb -0.14 -3.82 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 3htx s ILE 224 CO 0.19 0.40 0.21 -2.16 0.00 0.00 0.00 174.94 173.58 3htx s PRO 225 N 0.05 3.27 0.07 2.79 0.04 -1.26 -2.22 135.00 137.74 3htx s PRO 225 Ca 0.26 -0.61 -0.37 0.00 0.04 0.00 0.00 61.00 60.33 3htx s PRO 225 Cb -0.16 -2.90 -0.20 0.00 0.04 0.00 0.00 34.50 31.28 3htx s PRO 225 CO 0.12 0.55 1.57 0.00 0.04 0.00 0.00 177.00 179.28 3htx s ILE 227 N -5.95 4.25 -0.03 0.00 1.01 -1.26 -4.41 121.20 114.81 3htx s ILE 227 Ca -0.19 1.56 0.19 0.00 0.00 0.00 0.00 60.65 62.20 3htx s ILE 227 Cb 0.03 -4.00 0.19 0.00 0.01 0.00 0.00 42.46 38.68 3htx s ILE 227 CO 0.60 -0.03 1.52 0.44 0.00 0.00 0.00 174.94 177.48 3htx h ASP 228 N 7.62 0.00 1.51 3.58 3.32 -1.97 -0.26 116.42 130.23 3htx h ASP 228 Ca -0.33 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.63 3htx h ASP 228 Cb 1.15 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 3htx h ASP 228 CO 0.90 0.00 -0.50 -0.33 -1.72 0.00 0.00 179.24 177.59 3htx h GLU 229 N 0.00 0.00 -6.97 3.56 5.08 -1.95 -3.46 114.58 110.84 3htx h GLU 229 Ca 0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.89 3htx h GLU 229 Cb 0.31 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 3htx h GLU 229 CO 0.00 0.43 0.37 -1.21 -1.00 0.00 0.00 179.01 177.61 3htx s GLU 230 N -2.99 4.27 0.19 2.33 2.02 -0.11 -5.03 118.70 119.38 3htx s GLU 230 Ca 0.04 1.36 -0.25 0.00 0.02 0.00 0.00 54.97 56.14 3htx s GLU 230 Cb 0.07 -2.50 -0.08 0.00 0.10 0.00 0.00 34.13 31.72 3htx s GLU 230 CO 0.74 -0.02 0.79 0.08 0.02 0.00 0.00 175.26 176.87 3htx s VAL 231 N -1.79 4.37 0.38 2.63 1.01 -1.26 -4.89 120.40 120.85 3htx s VAL 231 Ca 0.57 1.67 -0.26 0.00 0.00 0.00 0.00 61.98 63.96 3htx s VAL 231 Cb -0.18 -4.10 -0.09 0.00 0.00 0.00 0.00 36.38 32.02 3htx s VAL 231 CO 0.23 0.45 1.12 -0.69 0.00 0.00 0.00 175.10 176.20 3htx s VAL 232 N -1.24 3.38 0.17 2.92 1.01 -1.26 -4.80 120.40 120.57 3htx s VAL 232 Ca 0.38 1.16 0.05 0.00 0.00 0.00 0.00 61.98 63.58 3htx s VAL 232 Cb -0.22 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 3htx s VAL 232 CO 0.26 0.11 -0.10 -1.61 0.00 0.00 0.00 175.10 173.75 3htx s GLU 233 N -2.22 1.14 -0.34 2.72 2.02 -1.14 -5.00 118.70 115.88 3htx s GLU 233 Ca 0.55 -1.50 -0.25 0.00 0.02 0.00 0.00 54.97 53.79 3htx s GLU 233 Cb -0.28 -0.73 0.01 0.00 0.10 0.00 0.00 34.13 33.23 3htx s GLU 233 CO 0.36 0.09 0.86 -1.17 0.02 0.00 0.00 175.26 175.41 3htx s LEU 234 N -3.21 4.05 -0.11 1.80 2.96 -1.26 -0.70 118.68 122.21 3htx s LEU 234 Ca 0.19 0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 54.68 3htx s LEU 234 Cb 0.02 -3.17 -0.03 0.00 0.50 0.00 0.00 46.19 43.51 3htx s LEU 234 CO 0.03 -0.75 -0.05 -0.62 -1.32 0.00 0.00 176.35 173.64 3htx s ASP 235 N 1.76 4.77 -0.22 3.68 -1.08 0.16 -4.89 116.67 120.86 3htx s ASP 235 Ca 0.35 -0.05 -0.08 0.00 -0.52 0.00 0.00 52.55 52.25 3htx s ASP 235 Cb -0.13 -1.47 -0.04 0.00 -1.46 0.00 0.00 42.92 39.83 3htx s ASP 235 CO 0.16 0.28 0.09 -0.89 0.52 0.00 0.00 175.17 175.34 3htx s THR 236 N -0.33 4.78 0.01 1.71 2.01 -1.26 -0.86 115.64 121.69 3htx s THR 236 Ca 0.05 -0.02 -0.22 0.00 0.31 0.00 0.00 61.69 61.81 3htx s THR 236 Cb -0.12 -3.20 -0.05 0.00 0.01 0.00 0.00 72.50 69.13 3htx s THR 236 CO 0.02 0.38 0.64 -0.76 -0.69 0.00 0.00 174.62 174.21 3htx s LEU 237 N 1.00 4.42 -0.34 4.42 1.43 -0.36 -4.93 118.68 124.31 3htx s LEU 237 Ca 0.05 1.23 -0.06 0.00 -1.03 0.00 0.00 54.13 54.31 3htx s LEU 237 Cb -0.14 -3.00 0.04 0.00 0.03 0.00 0.00 46.19 43.13 3htx s LEU 237 CO 0.03 0.08 0.11 -0.31 0.23 0.00 0.00 176.35 176.49 3htx s TYR 238 N -0.14 3.26 -0.10 0.29 1.51 -1.26 -1.53 117.35 119.39 3htx s TYR 238 Ca 0.33 -1.44 -0.02 0.00 -1.01 0.00 0.00 57.07 54.93 3htx s TYR 238 Cb -0.19 -2.30 -0.03 0.00 -0.11 0.00 0.00 41.96 39.33 3htx s TYR 238 CO 0.18 -0.74 -0.01 0.42 -1.11 0.00 0.00 175.55 174.30 3htx s ILE 239 N 1.40 4.18 0.13 2.71 1.01 -0.28 -4.79 121.20 125.56 3htx s ILE 239 Ca -0.02 -0.29 0.04 0.00 0.00 0.00 0.00 60.65 60.39 3htx s ILE 239 Cb -0.20 -2.77 -0.04 0.00 0.01 0.00 0.00 42.46 39.47 3htx s ILE 239 CO 0.03 0.58 -0.11 -0.44 0.00 0.00 0.00 174.94 175.00 3htx s SER 240 N -0.64 1.71 0.45 3.58 0.01 -1.26 -2.10 113.70 115.46 3htx s SER 240 Ca 0.10 -0.91 0.19 0.00 1.31 0.00 0.00 55.95 56.65 3htx s SER 240 Cb -0.12 -0.01 1.08 0.00 0.21 0.00 0.00 66.02 67.18 3htx s SER 240 CO 0.02 -0.27 1.96 0.77 0.41 0.00 0.00 173.24 176.13 3htx h SER 241 N 3.18 0.00 0.72 2.44 4.64 -1.85 -2.70 113.55 119.98 3htx h SER 241 Ca -0.37 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.84 3htx h SER 241 Cb 1.19 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.27 3htx h SER 241 CO 0.57 0.22 -0.50 -0.55 -0.87 0.00 0.00 176.83 175.70 3htx h ASN 242 N 0.00 0.00 -3.39 4.97 7.08 -1.95 -3.43 115.58 118.86 3htx h ASN 242 Ca -0.00 0.00 -0.66 0.00 -3.08 0.00 0.00 56.30 52.56 3htx h ASN 242 Cb 0.46 0.00 -0.29 0.00 -2.08 0.00 0.00 38.32 36.41 3htx h ASN 242 CO 0.03 0.50 -0.73 -0.60 -2.08 0.00 0.00 177.43 174.55 3htx s ARG 243 N -3.62 3.28 0.28 4.14 3.52 -1.02 -3.31 118.95 122.23 3htx s ARG 243 Ca -0.01 -0.68 -0.29 0.00 -0.13 0.00 0.00 55.73 54.62 3htx s ARG 243 Cb 0.12 -2.98 -0.14 0.00 -1.56 0.00 0.00 34.95 30.39 3htx s ARG 243 CO 0.73 -0.23 1.12 1.58 -0.81 0.00 0.00 175.30 177.69 3htx n HIS 244 N 4.77 1.55 0.09 5.12 -0.00 -1.26 -4.24 115.22 121.26 3htx n HIS 244 Ca -0.18 0.65 0.05 0.00 -0.00 0.00 0.00 57.72 58.24 3htx n HIS 244 Cb 0.50 -2.31 0.27 0.00 -0.00 0.00 0.00 29.99 28.46 3htx n HIS 244 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.34 178.82 3htx n TYR 245 N 0.55 0.33 0.06 1.57 0.18 -1.26 0.18 117.16 118.77 3htx n TYR 245 Ca 0.09 0.17 0.04 0.00 1.88 0.00 0.00 57.90 60.09 3htx n TYR 245 Cb 0.32 -0.67 -0.05 0.00 -0.38 0.00 0.00 39.34 38.56 3htx n TYR 245 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3htx n LEU 246 N -1.83 0.86 0.34 -3.48 4.77 -1.26 -3.80 117.00 112.60 3htx n LEU 246 Ca -0.01 0.36 -0.17 0.00 -0.03 0.00 0.00 56.01 56.17 3htx n LEU 246 Cb 0.15 0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.18 3htx n LEU 246 CO 0.04 0.02 0.59 0.44 -1.33 0.00 0.00 177.39 177.15 3htx h ASP 247 N 0.00 -0.72 -0.42 -1.43 3.32 -0.58 -2.38 116.42 114.20 3htx h ASP 247 Ca -0.10 -0.01 0.07 0.00 0.02 0.00 0.00 57.03 57.02 3htx h ASP 247 Cb 1.36 0.19 -0.06 0.00 0.22 0.00 0.00 39.33 41.03 3htx h ASP 247 CO 0.03 -0.44 0.04 0.77 -1.72 0.00 0.00 179.24 177.91 3htx h SER 248 N -0.95 -0.09 -0.79 6.45 4.64 -1.71 -0.71 113.55 120.38 3htx h SER 248 Ca -0.09 0.09 0.16 0.00 -0.47 0.00 0.00 61.79 61.48 3htx h SER 248 Cb 0.68 0.14 -0.10 0.00 -0.31 0.00 0.00 62.40 62.81 3htx h SER 248 CO 0.14 -0.01 0.32 0.40 -0.87 0.00 0.00 176.83 176.81 3htx h ILE 249 N 0.15 0.62 -0.81 0.95 2.04 -1.64 0.11 117.51 118.92 3htx h ILE 249 Ca 0.21 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.92 3htx h ILE 249 Cb 0.28 0.14 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 3htx h ILE 249 CO -0.31 0.08 0.51 0.00 0.00 0.00 0.00 178.15 178.43 3htx h ALA 250 N 1.58 1.38 -0.06 1.87 0.00 -0.60 0.52 119.26 123.95 3htx h ALA 250 Ca 0.44 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 3htx h ALA 250 Cb 0.71 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3htx h ALA 250 CO -0.43 0.56 -0.03 0.93 0.00 0.00 0.00 179.25 180.27 3htx h GLU 251 N 1.11 0.13 0.00 0.00 5.08 -0.33 1.28 114.58 121.85 3htx h GLU 251 Ca 0.29 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 3htx h GLU 251 Cb -0.09 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 3htx h GLU 251 CO -0.06 0.52 0.00 0.54 -1.00 0.00 0.00 179.01 179.01 3htx n ARG 252 N -4.78 0.57 -0.05 2.33 5.12 0.01 -1.83 116.66 118.04 3htx n ARG 252 Ca -0.07 0.02 -0.03 0.00 -1.93 0.00 0.00 57.85 55.84 3htx n ARG 252 Cb 0.26 -1.50 -0.09 0.00 -1.16 0.00 0.00 32.46 29.97 3htx n ARG 252 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 3htx n LEU 253 N -1.06 0.00 0.00 0.55 7.94 0.14 -5.05 117.00 119.53 3htx n LEU 253 Ca 0.14 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.04 3htx n LEU 253 Cb 0.09 0.22 0.00 0.00 0.53 0.00 0.00 43.42 44.26 3htx n LEU 253 CO 0.12 0.22 0.00 0.61 -1.11 0.00 0.00 177.39 177.23 3htx n GLY 254 N 2.19 1.78 0.00 -3.96 0.00 0.39 -4.97 105.19 100.63 3htx n GLY 254 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3htx n GLY 254 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3htx n LEU 255 N 0.00 0.00 -0.00 0.99 4.77 0.14 -4.99 117.00 117.91 3htx n LEU 255 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.04 3htx n LEU 255 Cb 0.00 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 3htx n LEU 255 CO 0.00 -0.16 -0.58 1.17 -1.33 0.00 0.00 177.39 176.49 3htx n LYS 256 N -0.32 0.63 -3.73 3.23 4.81 -1.26 -4.38 118.16 117.13 3htx n LYS 256 Ca 0.00 -0.10 -0.14 0.00 -0.87 0.00 0.00 58.31 57.20 3htx n LYS 256 Cb 0.00 -1.26 -0.08 0.00 0.02 0.00 0.00 35.03 33.71 3htx n LYS 256 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 3htx s ASP 257 N -3.24 -0.26 0.22 3.14 -1.08 -1.26 -5.01 116.67 109.17 3htx s ASP 257 Ca -0.04 0.20 0.21 0.00 -0.52 0.00 0.00 52.55 52.40 3htx s ASP 257 Cb 0.08 0.37 0.91 0.00 -1.46 0.00 0.00 42.92 42.82 3htx s ASP 257 CO 0.49 -0.45 1.63 0.61 0.52 0.00 0.00 175.17 177.98 3htx n GLY 258 N 1.33 -1.13 0.00 2.66 0.00 -1.26 -1.77 105.19 105.02 3htx n GLY 258 Ca -0.21 0.08 0.05 0.00 0.00 0.00 0.00 46.02 45.95 3htx n GLY 258 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3htx n ASN 259 N -2.10 0.00 -0.04 1.61 5.15 -1.26 -1.67 115.26 116.95 3htx n ASN 259 Ca 0.02 0.27 0.10 0.00 -0.60 0.00 0.00 54.58 54.37 3htx n ASN 259 Cb 0.18 -0.37 -0.06 0.00 -0.53 0.00 0.00 39.78 39.00 3htx n ASN 259 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3htx n GLN 260 N -1.37 0.11 -2.85 1.20 6.02 -0.73 -4.51 117.38 115.25 3htx n GLN 260 Ca 0.04 -0.09 -0.36 0.00 -0.01 0.00 0.00 57.00 56.58 3htx n GLN 260 Cb 0.10 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 29.80 3htx n GLN 260 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3htx s VAL 261 N -2.95 4.33 -0.09 5.09 1.01 -0.67 0.35 120.40 127.46 3htx s VAL 261 Ca 0.09 1.63 0.02 0.00 0.00 0.00 0.00 61.98 63.72 3htx s VAL 261 Cb 0.16 -3.87 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 3htx s VAL 261 CO 0.82 0.03 -0.15 -0.32 0.00 0.00 0.00 175.10 175.47 3htx s MET 262 N -2.35 2.99 -0.32 2.72 1.75 0.61 -4.47 119.30 120.23 3htx s MET 262 Ca 0.52 -0.72 -0.12 0.00 -1.25 0.00 0.00 55.69 54.12 3htx s MET 262 Cb -0.16 -2.48 -0.03 0.00 2.84 0.00 0.00 34.83 35.00 3htx s MET 262 CO 0.20 0.37 0.22 0.42 -0.65 0.00 0.00 175.02 175.59 3htx s ILE 263 N -0.07 5.26 0.75 10.11 1.01 -1.26 -1.64 121.20 135.36 3htx s ILE 263 Ca -0.03 -0.12 -0.12 0.00 0.00 0.00 0.00 60.65 60.39 3htx s ILE 263 Cb -0.14 -3.65 0.04 0.00 0.01 0.00 0.00 42.46 38.72 3htx s ILE 263 CO 0.04 0.07 1.12 -0.94 0.00 0.00 0.00 174.94 175.23 3htx s SER 264 N 1.73 5.07 0.79 3.58 1.04 -1.14 -4.97 113.70 119.80 3htx s SER 264 Ca 0.06 1.05 -0.14 0.00 0.48 0.00 0.00 55.95 57.40 3htx s SER 264 Cb -0.17 -1.75 0.06 0.00 0.10 0.00 0.00 66.02 64.26 3htx s SER 264 CO 0.10 -1.57 1.14 -2.11 0.98 0.00 0.00 173.24 171.78 3htx n ARG 265 N -3.14 0.27 -3.29 4.02 1.85 -1.26 -4.53 116.66 110.58 3htx n ARG 265 Ca 0.07 0.16 -0.39 0.00 -1.00 0.00 0.00 57.85 56.70 3htx n ARG 265 Cb 0.58 -2.39 -0.06 0.00 -1.05 0.00 0.00 32.46 29.55 3htx n ARG 265 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3htx s MET 266 N -3.92 4.18 0.22 2.89 0.23 -1.25 -4.55 119.30 117.09 3htx s MET 266 Ca 0.73 0.71 -0.19 0.00 -1.03 0.00 0.00 55.69 55.92 3htx s MET 266 Cb -0.30 -3.23 0.03 0.00 -1.53 0.00 0.00 34.83 29.79 3htx s MET 266 CO 0.51 0.64 0.58 -0.59 -2.03 0.00 0.00 175.02 174.13 3htx s PHE 267 N -1.11 -0.13 0.00 3.16 -0.12 0.65 -4.85 117.98 115.58 3htx s PHE 267 Ca 0.29 -0.23 0.00 0.00 -0.05 0.00 0.00 56.93 56.93 3htx s PHE 267 Cb -0.19 0.48 0.00 0.00 -0.63 0.00 0.00 43.02 42.68 3htx s PHE 267 CO 0.19 -1.01 0.00 0.41 -0.05 0.00 0.00 175.22 174.75 3htx n GLY 268 N -0.38 1.52 0.34 1.99 0.00 -1.26 0.03 105.19 107.42 3htx n GLY 268 Ca -0.08 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 3htx n GLY 268 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3htx h LYS 269 N 2.23 -0.23 -0.19 1.61 3.64 -1.92 0.42 116.57 122.13 3htx h LYS 269 Ca 0.00 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.42 3htx h LYS 269 Cb 0.00 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.83 3htx h LYS 269 CO 0.00 -0.16 -0.35 0.00 -2.27 0.00 0.00 179.45 176.68 3htx h ALA 270 N 0.77 -0.64 0.15 5.00 0.00 -1.94 0.73 119.26 123.32 3htx h ALA 270 Ca 0.18 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.77 3htx h ALA 270 Cb 0.54 0.93 0.03 0.00 0.00 0.00 0.00 17.79 19.29 3htx h ALA 270 CO -0.57 -0.80 -1.29 0.66 0.00 0.00 0.00 179.25 177.26 3htx h SER 271 N -0.29 0.79 0.51 0.00 4.64 -1.84 -3.37 113.55 114.00 3htx h SER 271 Ca 0.04 -0.77 -0.24 0.00 -0.47 0.00 0.00 61.79 60.35 3htx h SER 271 Cb 0.39 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 62.19 3htx h SER 271 CO -0.34 1.58 -1.67 0.00 -0.87 0.00 0.00 176.83 175.54 3htx n GLY 273 N 1.50 0.75 3.34 0.00 0.00 0.25 -4.99 105.19 106.04 3htx n GLY 273 Ca -0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 3htx n GLY 273 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3htx s SER 274 N -2.42 -0.52 0.17 1.61 0.01 -1.25 -4.93 113.70 106.38 3htx s SER 274 Ca 0.00 0.95 -0.32 0.00 1.31 0.00 0.00 55.95 57.89 3htx s SER 274 Cb 0.00 0.90 -0.11 0.00 0.21 0.00 0.00 66.02 67.03 3htx s SER 274 CO 0.00 -0.18 1.64 -1.61 0.41 0.00 0.00 173.24 173.50 3htx s GLU 275 N 0.71 4.18 0.21 12.44 2.02 -1.26 -3.48 118.70 133.52 3htx s GLU 275 Ca -0.04 2.45 0.08 0.00 0.02 0.00 0.00 54.97 57.49 3htx s GLU 275 Cb -0.05 -3.17 -0.05 0.00 0.10 0.00 0.00 34.13 30.96 3htx s GLU 275 CO -0.05 -0.67 -0.16 0.00 0.02 0.00 0.00 175.26 174.40 3htx s ARG 277 N -3.53 0.39 -0.39 0.00 0.52 -0.60 -0.25 118.95 115.09 3htx s ARG 277 Ca 0.23 -0.09 -0.13 0.00 -0.52 0.00 0.00 55.73 55.21 3htx s ARG 277 Cb -0.02 0.17 0.02 0.00 0.52 0.00 0.00 34.95 35.64 3htx s ARG 277 CO 0.08 -0.08 0.26 -1.17 0.02 0.00 0.00 175.30 174.40 3htx s LEU 278 N -0.74 4.88 -0.43 2.53 2.96 -1.26 -1.97 118.68 124.64 3htx s LEU 278 Ca -0.08 -0.87 -0.22 0.00 -0.22 0.00 0.00 54.13 52.74 3htx s LEU 278 Cb -0.05 -2.11 0.02 0.00 0.50 0.00 0.00 46.19 44.56 3htx s LEU 278 CO 0.01 -0.40 0.72 -0.31 -1.32 0.00 0.00 176.35 175.06 3htx s TYR 279 N 1.64 3.04 0.20 5.38 1.51 0.78 -2.90 117.35 127.00 3htx s TYR 279 Ca 0.04 0.13 0.08 0.00 -1.01 0.00 0.00 57.07 56.30 3htx s TYR 279 Cb -0.19 -3.49 -0.05 0.00 -0.11 0.00 0.00 41.96 38.13 3htx s TYR 279 CO 0.09 -0.90 -0.14 -1.54 -1.11 0.00 0.00 175.55 171.94 3htx s SER 280 N 2.04 2.55 0.31 2.29 1.04 -0.65 -0.55 113.70 120.73 3htx s SER 280 Ca 0.27 -1.01 -0.29 0.00 0.48 0.00 0.00 55.95 55.40 3htx s SER 280 Cb -0.13 -0.13 -0.10 0.00 0.10 0.00 0.00 66.02 65.75 3htx s SER 280 CO 0.20 -0.17 1.35 -1.83 0.98 0.00 0.00 173.24 173.78 3htx s GLU 281 N -3.59 4.32 -0.20 4.02 -1.05 -1.26 0.23 118.70 121.16 3htx s GLU 281 Ca 0.22 2.25 -0.09 0.00 -0.15 0.00 0.00 54.97 57.20 3htx s GLU 281 Cb -0.01 -3.08 -0.05 0.00 -0.44 0.00 0.00 34.13 30.56 3htx s GLU 281 CO 0.07 -0.27 0.12 0.42 0.95 0.00 0.00 175.26 176.54 3htx s ILE 282 N -0.83 5.20 0.10 1.83 1.01 0.15 -4.75 121.20 123.91 3htx s ILE 282 Ca 0.52 0.12 -0.35 0.00 0.00 0.00 0.00 60.65 60.93 3htx s ILE 282 Cb -0.41 -3.38 -0.15 0.00 0.01 0.00 0.00 42.46 38.54 3htx s ILE 282 CO 0.51 0.42 1.50 -0.81 0.00 0.00 0.00 174.94 176.56 3htx n PRO 283 N 3.72 1.69 0.00 2.79 -0.04 -1.26 -4.76 135.00 137.13 3htx n PRO 283 Ca -0.16 0.61 0.00 0.00 -0.04 0.00 0.00 63.50 63.91 3htx n PRO 283 Cb 0.52 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.66 3htx n PRO 283 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3htx n LYS 284 N 3.29 0.24 -0.10 0.54 5.02 -1.26 -1.90 118.16 124.01 3htx n LYS 284 Ca 0.18 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.35 3htx n LYS 284 Cb 0.24 -1.08 -0.15 0.00 -0.02 0.00 0.00 35.03 34.02 3htx n LYS 284 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3htx n LYS 285 N 0.10 0.68 0.03 1.97 4.76 -1.26 -3.70 118.16 120.74 3htx n LYS 285 Ca 0.00 0.06 0.12 0.00 -2.87 0.00 0.00 58.31 55.61 3htx n LYS 285 Cb 0.04 -1.55 0.13 0.00 -1.84 0.00 0.00 35.03 31.81 3htx n LYS 285 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 3htx n TYR 286 N -2.90 0.29 -0.09 2.13 4.02 -0.80 -4.35 117.16 115.47 3htx n TYR 286 Ca -0.34 0.08 -0.12 0.00 -0.01 0.00 0.00 57.90 57.51 3htx n TYR 286 Cb 1.11 -0.45 -0.05 0.00 -0.02 0.00 0.00 39.34 39.94 3htx n TYR 286 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3htx n LEU 287 N -1.88 1.89 0.05 7.72 4.77 -1.25 -4.67 117.00 123.63 3htx n LEU 287 Ca 0.03 0.44 -0.13 0.00 -0.03 0.00 0.00 56.01 56.33 3htx n LEU 287 Cb 0.41 -0.82 -0.08 0.00 -2.33 0.00 0.00 43.42 40.60 3htx n LEU 287 CO 0.38 -0.15 0.78 0.44 -1.33 0.00 0.00 177.39 177.51 3htx h ASP 288 N -1.00 -0.05 -0.97 -1.43 3.32 -1.79 -2.99 116.42 111.51 3htx h ASP 288 Ca -0.15 -0.13 0.16 0.00 0.02 0.00 0.00 57.03 56.93 3htx h ASP 288 Cb 0.97 0.01 -0.16 0.00 0.22 0.00 0.00 39.33 40.37 3htx h ASP 288 CO -0.09 0.10 -0.34 0.59 -1.72 0.00 0.00 179.24 177.78 3htx n ASN 289 N -5.05 -0.55 -1.56 6.45 3.02 -1.26 -0.96 115.26 115.35 3htx n ASN 289 Ca -0.08 1.68 0.08 0.00 -0.03 0.00 0.00 54.58 56.23 3htx n ASN 289 Cb 0.11 -0.42 0.36 0.00 -0.61 0.00 0.00 39.78 39.22 3htx n ASN 289 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3htx n SER 290 N -5.47 5.10 0.00 6.41 3.41 -1.25 -5.20 113.62 116.63 3htx n SER 290 Ca 0.11 -2.90 0.00 0.00 -0.26 0.00 0.00 58.87 55.82 3htx n SER 290 Cb 0.41 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 3htx n SER 290 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3htx n SER 291 N 0.35 0.00 -3.32 4.04 3.41 -0.13 -4.83 113.62 113.13 3htx n SER 291 Ca 0.26 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.68 3htx n SER 291 Cb 1.08 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.85 3htx n SER 291 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3htx n ILE 304 N -2.31 -2.28 -2.18 -1.33 5.41 -1.26 -4.88 119.36 110.53 3htx n ILE 304 Ca 0.00 0.00 -0.43 0.00 1.00 0.00 0.00 62.75 63.32 3htx n ILE 304 Cb 0.00 -2.04 -0.02 0.00 -0.71 0.00 0.00 39.64 36.87 3htx n ILE 304 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3htx s VAL 305 N -2.46 3.72 0.83 1.39 1.01 -1.26 -4.97 120.40 118.67 3htx s VAL 305 Ca 0.04 0.75 -0.12 0.00 0.00 0.00 0.00 61.98 62.65 3htx s VAL 305 Cb -0.00 -3.91 0.09 0.00 0.00 0.00 0.00 36.38 32.55 3htx s VAL 305 CO 0.62 -0.54 1.14 -0.54 0.00 0.00 0.00 175.10 175.77 3htx s LYS 306 N 5.13 1.80 0.70 2.72 1.02 -1.26 -5.01 119.74 124.84 3htx s LYS 306 Ca 0.70 0.33 -0.15 0.00 0.02 0.00 0.00 55.97 56.86 3htx s LYS 306 Cb -0.19 -1.91 0.02 0.00 -0.52 0.00 0.00 37.83 35.23 3htx s LYS 306 CO 0.32 -1.75 1.19 0.45 -0.92 0.00 0.00 175.35 174.64 3htx s SER 307 N -4.21 4.50 0.46 2.83 0.15 -1.26 -4.37 113.70 111.80 3htx s SER 307 Ca 0.62 2.28 -0.25 0.00 0.70 0.00 0.00 55.95 59.31 3htx s SER 307 Cb -0.13 -2.58 -0.08 0.00 -1.71 0.00 0.00 66.02 61.51 3htx s SER 307 CO 0.52 -2.05 1.34 -1.14 1.20 0.00 0.00 173.24 173.11 3htx n ARG 308 N -2.53 1.99 -2.91 5.44 0.63 -1.26 -2.53 116.66 115.48 3htx n ARG 308 Ca 0.13 0.71 -0.43 0.00 -0.92 0.00 0.00 57.85 57.33 3htx n ARG 308 Cb 0.51 -2.50 -0.04 0.00 0.45 0.00 0.00 32.46 30.87 3htx n ARG 308 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3htx s ASN 309 N -0.59 6.26 0.13 6.15 3.84 -1.05 -4.79 114.94 124.89 3htx s ASN 309 Ca 0.63 -1.26 -0.28 0.00 0.21 0.00 0.00 52.86 52.16 3htx s ASN 309 Cb -0.47 -2.39 -0.05 0.00 -0.55 0.00 0.00 41.25 37.79 3htx s ASN 309 CO 0.56 -1.32 1.60 0.00 -2.79 0.00 0.00 177.10 175.15 3htx h ALA 310 N 9.37 -0.52 -0.52 1.71 0.00 -1.87 0.65 119.26 128.07 3htx h ALA 310 Ca -0.21 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 3htx h ALA 310 Cb 1.06 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 19.49 3htx h ALA 310 CO 1.15 -0.87 0.30 0.00 0.00 0.00 0.00 179.25 179.83 3htx h ARG 311 N -0.49 0.72 -0.01 0.00 -0.00 -1.91 -2.44 114.38 110.26 3htx h ARG 311 Ca 0.07 -0.08 0.02 0.00 -0.50 0.00 0.00 59.98 59.49 3htx h ARG 311 Cb 0.59 -0.14 -0.02 0.00 0.00 0.00 0.00 29.97 30.40 3htx h ARG 311 CO -0.32 0.55 -0.09 0.00 0.00 0.00 0.00 179.97 180.11 3htx h ALA 312 N 1.13 -0.09 -0.21 0.04 0.00 -1.86 -1.71 119.26 116.56 3htx h ALA 312 Ca 0.19 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3htx h ALA 312 Cb 0.03 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3htx h ALA 312 CO -0.03 -0.58 0.12 0.77 0.00 0.00 0.00 179.25 179.53 3htx h SER 313 N -0.15 0.25 0.60 0.00 0.02 -0.75 -3.00 113.55 110.52 3htx h SER 313 Ca 0.04 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 3htx h SER 313 Cb 0.19 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 62.68 3htx h SER 313 CO -0.09 0.21 -0.29 0.22 -1.14 0.00 0.00 176.83 175.74 3htx h TYR 314 N 0.29 -0.74 -1.10 3.45 3.20 -0.91 -2.65 116.97 118.51 3htx h TYR 314 Ca 0.08 -0.02 0.32 0.00 3.14 0.00 0.00 58.73 62.25 3htx h TYR 314 Cb 0.01 0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.48 3htx h TYR 314 CO 0.00 -0.46 0.79 0.82 -1.64 0.00 0.00 178.16 177.67 3htx h ILE 315 N -1.03 0.45 0.13 1.81 1.08 -1.24 -2.60 117.51 116.11 3htx h ILE 315 Ca -0.08 -0.01 -0.35 0.00 -0.39 0.00 0.00 64.86 64.03 3htx h ILE 315 Cb 0.61 0.42 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 3htx h ILE 315 CO 0.13 0.01 -1.82 0.00 -0.69 0.00 0.00 178.15 175.77 3htx n GLY 317 N 1.86 2.94 3.98 0.00 0.00 -0.98 -4.94 105.19 108.05 3htx n GLY 317 Ca -0.26 -0.39 -0.21 0.00 0.00 0.00 0.00 46.02 45.15 3htx n GLY 317 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3htx s GLN 318 N 0.00 2.40 0.16 1.61 -0.21 -1.25 -4.98 119.66 117.39 3htx s GLN 318 Ca 0.00 -0.87 -0.25 0.00 0.02 0.00 0.00 55.36 54.27 3htx s GLN 318 Cb 0.00 -2.47 -0.08 0.00 1.00 0.00 0.00 33.01 31.46 3htx s GLN 318 CO 0.00 -0.83 0.76 0.34 -2.12 0.00 0.00 175.29 173.44 3htx s ASP 319 N -4.48 7.36 0.02 5.90 -1.08 -0.73 -4.51 116.67 119.14 3htx s ASP 319 Ca 0.59 1.62 0.01 0.00 -0.52 0.00 0.00 52.55 54.25 3htx s ASP 319 Cb -0.09 -2.49 -0.01 0.00 -1.46 0.00 0.00 42.92 38.86 3htx s ASP 319 CO 0.39 0.21 -0.05 -0.63 0.52 0.00 0.00 175.17 175.61 3htx s ILE 320 N -1.16 0.36 0.21 4.11 -1.09 -1.26 -4.86 121.20 117.51 3htx s ILE 320 Ca 0.36 -0.64 0.11 0.00 -2.23 0.00 0.00 60.65 58.25 3htx s ILE 320 Cb -0.23 -0.39 -0.05 0.00 -1.58 0.00 0.00 42.46 40.22 3htx s ILE 320 CO 0.26 -0.19 -0.22 -1.00 -1.23 0.00 0.00 174.94 172.55 3htx s HIS 321 N -0.82 2.21 0.00 3.97 3.76 -1.26 -2.52 115.29 120.63 3htx s HIS 321 Ca -0.06 -0.37 0.00 0.00 -0.15 0.00 0.00 55.06 54.48 3htx s HIS 321 Cb -0.06 -1.06 0.00 0.00 1.11 0.00 0.00 32.58 32.57 3htx s HIS 321 CO -0.00 0.52 0.00 0.41 -0.85 0.00 0.00 174.74 174.82 3htx n GLY 322 N 0.04 1.66 3.91 -2.22 0.00 -1.05 -4.44 105.19 103.09 3htx n GLY 322 Ca -0.11 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 3htx n GLY 322 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3htx s ASP 323 N -4.00 4.17 -0.11 1.61 1.01 -1.26 -4.06 116.67 114.04 3htx s ASP 323 Ca 0.00 0.65 -0.30 0.00 0.71 0.00 0.00 52.55 53.61 3htx s ASP 323 Cb 0.00 -1.03 0.10 0.00 1.01 0.00 0.00 42.92 43.00 3htx s ASP 323 CO 0.00 -2.11 0.85 0.00 0.21 0.00 0.00 175.17 174.12 3htx s ALA 324 N -3.65 -1.86 -0.10 5.23 0.00 -0.94 -4.25 121.76 116.19 3htx s ALA 324 Ca 0.65 1.46 -0.03 0.00 0.00 0.00 0.00 51.96 54.03 3htx s ALA 324 Cb -0.09 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 3htx s ALA 324 CO 0.50 -0.34 0.02 0.42 0.00 0.00 0.00 175.76 176.36 3htx s ILE 325 N -1.17 4.50 -0.23 0.00 -1.09 0.29 -0.42 121.20 123.07 3htx s ILE 325 Ca -0.06 -0.17 -0.08 0.00 -2.23 0.00 0.00 60.65 58.10 3htx s ILE 325 Cb -0.00 -2.91 -0.04 0.00 -1.58 0.00 0.00 42.46 37.92 3htx s ILE 325 CO 0.05 0.59 0.10 -0.22 -1.23 0.00 0.00 174.94 174.23 3htx s LEU 326 N -0.75 3.74 0.21 2.97 2.96 0.98 -0.15 118.68 128.63 3htx s LEU 326 Ca 0.12 -0.04 -0.20 0.00 -0.22 0.00 0.00 54.13 53.79 3htx s LEU 326 Cb -0.12 -1.99 0.03 0.00 0.50 0.00 0.00 46.19 44.62 3htx s LEU 326 CO 0.02 0.04 0.60 0.00 -1.32 0.00 0.00 176.35 175.70 3htx s ALA 327 N 1.17 -1.16 -0.50 5.97 0.00 -0.83 -0.73 121.76 125.67 3htx s ALA 327 Ca 0.05 -0.09 0.03 0.00 0.00 0.00 0.00 51.96 51.95 3htx s ALA 327 Cb -0.14 0.87 0.14 0.00 0.00 0.00 0.00 23.12 23.98 3htx s ALA 327 CO 0.04 -0.87 0.28 0.45 0.00 0.00 0.00 175.76 175.66 3htx s SER 328 N -2.86 3.97 0.12 0.00 0.15 -1.26 -1.56 113.70 112.26 3htx s SER 328 Ca 0.08 -2.93 -0.08 0.00 0.70 0.00 0.00 55.95 53.71 3htx s SER 328 Cb -0.02 -1.33 -0.01 0.00 -1.71 0.00 0.00 66.02 62.95 3htx s SER 328 CO -0.02 -0.23 0.22 0.68 1.20 0.00 0.00 173.24 175.10 3htx s VAL 329 N -0.12 0.11 -5.00 4.45 -7.23 -1.26 -0.96 120.40 110.39 3htx s VAL 329 Ca 0.19 -1.29 0.00 0.00 -1.81 0.00 0.00 61.98 59.06 3htx s VAL 329 Cb -0.22 -1.58 0.00 0.00 0.56 0.00 0.00 36.38 35.14 3htx s VAL 329 CO -0.02 -0.50 0.00 0.61 -0.31 0.00 0.00 175.10 174.88 3htx n GLY 330 N -0.13 -1.82 3.39 2.32 0.00 -0.47 -4.97 105.19 103.51 3htx n GLY 330 Ca -0.11 -1.30 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 3htx n GLY 330 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3htx s TYR 331 N -2.58 2.43 0.00 1.61 1.51 -1.26 -0.40 117.35 118.65 3htx s TYR 331 Ca 0.00 -0.34 0.00 0.00 -1.01 0.00 0.00 57.07 55.72 3htx s TYR 331 Cb 0.00 -1.43 0.00 0.00 -0.11 0.00 0.00 41.96 40.42 3htx s TYR 331 CO 0.00 0.18 0.00 0.54 -1.11 0.00 0.00 175.55 175.16 3htx n ARG 332 N 1.70 2.01 -3.41 -0.62 5.12 -1.26 -4.82 116.66 115.38 3htx n ARG 332 Ca -0.17 0.00 -0.20 0.00 -1.93 0.00 0.00 57.85 55.55 3htx n ARG 332 Cb 0.52 0.00 -0.00 0.00 -1.16 0.00 0.00 32.46 31.82 3htx n ARG 332 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 3htx s TRP 333 N 1.23 3.17 -1.64 -1.55 0.52 -1.26 -4.31 118.94 115.10 3htx s TRP 333 Ca 0.00 -0.10 -0.09 0.00 0.02 0.00 0.00 56.10 55.93 3htx s TRP 333 Cb 0.00 -2.02 0.08 0.00 -1.15 0.00 0.00 33.47 30.38 3htx s TRP 333 CO 0.00 -0.04 0.33 1.63 0.02 0.00 0.00 176.95 178.89 3htx n LYS 334 N -1.72 -1.57 -3.65 4.98 5.02 -0.82 -4.90 118.16 115.52 3htx n LYS 334 Ca -0.01 0.19 -0.01 0.00 -2.02 0.00 0.00 58.31 56.46 3htx n LYS 334 Cb 0.58 -4.24 -0.06 0.00 -0.02 0.00 0.00 35.03 31.28 3htx n LYS 334 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3htx s SER 335 N -3.94 -0.31 -0.12 4.39 1.04 -1.26 -5.02 113.70 108.49 3htx s SER 335 Ca 0.32 0.50 0.10 0.00 0.48 0.00 0.00 55.95 57.36 3htx s SER 335 Cb -0.18 1.01 0.50 0.00 0.10 0.00 0.00 66.02 67.45 3htx s SER 335 CO 0.98 -0.08 1.31 0.47 0.98 0.00 0.00 173.24 176.90 3htx n ASP 336 N 3.15 3.70 -4.77 7.02 8.00 -1.26 -4.54 116.55 127.85 3htx n ASP 336 Ca -0.17 -2.46 -0.36 0.00 0.71 0.00 0.00 54.79 52.52 3htx n ASP 336 Cb 0.57 -0.55 -0.08 0.00 -0.02 0.00 0.00 41.12 41.04 3htx n ASP 336 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3htx s ASP 337 N -0.62 6.14 -0.11 -2.24 1.01 -1.26 -4.71 116.67 114.89 3htx s ASP 337 Ca 0.34 0.29 -0.29 0.00 0.71 0.00 0.00 52.55 53.60 3htx s ASP 337 Cb 0.24 -2.04 -0.05 0.00 1.01 0.00 0.00 42.92 42.09 3htx s ASP 337 CO 0.13 0.27 1.77 -0.22 0.21 0.00 0.00 175.17 177.32 3htx s LEU 338 N -0.17 4.09 -0.10 1.23 2.96 -1.26 -4.50 118.68 120.93 3htx s LEU 338 Ca 0.10 2.07 -0.24 0.00 -0.22 0.00 0.00 54.13 55.84 3htx s LEU 338 Cb -0.12 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 3htx s LEU 338 CO 0.01 -1.19 0.73 -0.62 -1.32 0.00 0.00 176.35 173.96 3htx s ASP 339 N 4.45 6.96 0.27 3.68 2.15 0.46 -4.93 116.67 129.71 3htx s ASP 339 Ca 0.79 1.16 -0.21 0.00 0.43 0.00 0.00 52.55 54.73 3htx s ASP 339 Cb -0.32 -2.42 0.02 0.00 -0.30 0.00 0.00 42.92 39.90 3htx s ASP 339 CO 0.32 -0.20 0.70 -0.72 -0.17 0.00 0.00 175.17 175.10 3htx s TYR 340 N 1.23 -0.17 0.05 -5.34 -0.85 -1.26 -1.37 117.35 109.65 3htx s TYR 340 Ca 0.37 -0.28 -0.01 0.00 -0.52 0.00 0.00 57.07 56.63 3htx s TYR 340 Cb -0.17 0.67 -0.04 0.00 0.38 0.00 0.00 41.96 42.80 3htx s TYR 340 CO 0.16 -1.21 -0.02 -0.51 -1.52 0.00 0.00 175.55 172.46 3htx s ASP 341 N -2.92 0.47 -0.47 -0.18 1.01 -0.13 -4.99 116.67 109.45 3htx s ASP 341 Ca 0.11 -0.98 -0.23 0.00 0.71 0.00 0.00 52.55 52.16 3htx s ASP 341 Cb -0.05 0.21 0.03 0.00 1.01 0.00 0.00 42.92 44.11 3htx s ASP 341 CO 0.06 -0.60 0.83 -1.81 0.21 0.00 0.00 175.17 173.86 3htx s ASP 342 N -2.89 6.40 0.02 0.27 1.11 -1.26 -4.21 116.67 116.11 3htx s ASP 342 Ca 0.07 -0.17 -0.09 0.00 0.18 0.00 0.00 52.55 52.53 3htx s ASP 342 Cb 0.08 -2.40 -0.05 0.00 1.07 0.00 0.00 42.92 41.61 3htx s ASP 342 CO -0.10 -1.00 0.34 -0.69 1.18 0.00 0.00 175.17 174.90 3htx s VAL 343 N 3.45 5.18 0.25 -1.27 1.01 0.53 -4.96 120.40 124.60 3htx s VAL 343 Ca 0.30 0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.71 3htx s VAL 343 Cb -0.12 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 3htx s VAL 343 CO 0.22 0.40 0.18 0.42 0.00 0.00 0.00 175.10 176.32 3htx s THR 344 N -1.27 0.02 0.36 3.92 -4.23 -1.26 -3.33 115.64 109.84 3htx s THR 344 Ca 0.28 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.97 3htx s THR 344 Cb -0.14 -2.50 0.35 0.00 1.34 0.00 0.00 72.50 71.55 3htx s THR 344 CO 0.15 0.00 1.64 0.58 -0.54 0.00 0.00 174.62 176.46 3htx h VAL 345 N 2.44 0.22 0.13 2.29 2.07 -1.90 0.80 116.25 122.29 3htx h VAL 345 Ca -0.32 -0.08 -0.28 0.00 0.82 0.00 0.00 66.70 66.84 3htx h VAL 345 Cb 1.24 -0.03 0.01 0.00 -1.52 0.00 0.00 31.29 31.00 3htx h VAL 345 CO 0.47 0.04 -1.23 -0.55 0.02 0.00 0.00 177.57 176.33 3htx h ASN 346 N 0.23 0.57 -0.89 0.57 -1.07 -1.88 -3.14 115.58 109.96 3htx h ASN 346 Ca 0.77 -0.57 0.16 0.00 0.07 0.00 0.00 56.30 56.73 3htx h ASN 346 Cb 1.90 -0.18 -0.07 0.00 -2.07 0.00 0.00 38.32 37.89 3htx h ASN 346 CO -0.62 1.42 0.58 0.28 0.07 0.00 0.00 177.43 179.16 3htx h SER 347 N 0.14 0.60 0.64 6.14 0.02 0.19 0.30 113.55 121.57 3htx h SER 347 Ca -0.15 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.81 3htx h SER 347 Cb 1.93 -0.07 0.01 0.00 0.14 0.00 0.00 62.40 64.40 3htx h SER 347 CO 0.21 0.28 -0.31 0.15 -1.14 0.00 0.00 176.83 176.03 3htx h PHE 348 N 0.62 -0.79 -0.94 3.45 3.57 -1.06 -1.32 116.94 120.46 3htx h PHE 348 Ca 0.46 -0.02 0.17 0.00 3.53 0.00 0.00 57.97 62.11 3htx h PHE 348 Cb 0.84 0.26 -0.08 0.00 2.79 0.00 0.00 35.95 39.76 3htx h PHE 348 CO -0.00 -0.49 0.60 1.88 -2.23 0.00 0.00 178.31 178.06 3htx h TYR 349 N -0.92 0.87 0.00 0.41 -1.99 -1.28 0.16 116.97 114.21 3htx h TYR 349 Ca -0.09 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.64 3htx h TYR 349 Cb 0.66 -0.27 -0.00 0.00 2.00 0.00 0.00 36.73 39.11 3htx h TYR 349 CO 0.06 0.27 -0.12 -0.09 -0.00 0.00 0.00 178.16 178.28 3htx h ARG 350 N 0.69 0.00 0.03 4.88 2.43 -0.27 -2.06 114.38 120.08 3htx h ARG 350 Ca 0.50 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.41 3htx h ARG 350 Cb 0.84 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.41 3htx h ARG 350 CO -0.26 0.12 -1.05 0.82 -1.51 0.00 0.00 179.97 178.09 3htx h ILE 351 N 0.00 1.35 -0.67 1.20 1.08 0.48 -3.06 117.51 117.90 3htx h ILE 351 Ca -0.00 -2.44 -0.07 0.00 -0.39 0.00 0.00 64.86 61.96 3htx h ILE 351 Cb 0.21 2.50 -0.03 0.00 -3.07 0.00 0.00 36.82 36.43 3htx h ILE 351 CO 0.02 0.74 0.14 0.00 -0.69 0.00 0.00 178.15 178.35 3htx h GLY 354 N 0.97 0.16 0.81 0.00 0.00 -1.36 -0.95 103.07 102.70 3htx h GLY 354 Ca 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 3htx h GLY 354 CO 0.06 -0.03 -0.09 -0.33 0.00 0.00 0.00 176.54 176.15 3htx h MET 355 N 0.04 -0.25 -7.11 4.80 2.86 -1.57 -3.39 114.93 110.31 3htx h MET 355 Ca 0.61 0.02 -0.56 0.00 -2.06 0.00 0.00 59.70 57.71 3htx h MET 355 Cb 2.34 0.06 0.16 0.00 0.06 0.00 0.00 31.60 34.21 3htx h MET 355 CO -0.05 -0.01 0.52 -1.54 1.06 0.00 0.00 176.91 176.88 3htx s SER 356 N -5.14 4.63 0.12 1.22 1.04 -0.36 -4.87 113.70 110.35 3htx s SER 356 Ca -0.15 2.61 -0.12 0.00 0.48 0.00 0.00 55.95 58.78 3htx s SER 356 Cb 0.04 -2.62 -0.09 0.00 0.10 0.00 0.00 66.02 63.44 3htx s SER 356 CO 0.62 -1.99 1.40 1.55 0.98 0.00 0.00 173.24 175.80 3htx h PRO 357 N 0.57 0.85 -0.26 4.02 0.13 -1.86 -0.70 132.00 134.75 3htx h PRO 357 Ca -0.51 -0.54 -0.02 0.00 -0.87 0.00 0.00 66.00 64.07 3htx h PRO 357 Cb 1.34 0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.52 3htx h PRO 357 CO 0.53 1.17 0.10 -0.97 -0.23 0.00 0.00 178.00 178.60 3htx h ASN 358 N 0.62 0.36 -0.93 1.44 -0.00 -1.91 -2.17 115.58 113.01 3htx h ASN 358 Ca 0.02 -0.18 0.07 0.00 -0.00 0.00 0.00 56.30 56.20 3htx h ASN 358 Cb 1.13 -0.09 -0.06 0.00 -0.00 0.00 0.00 38.32 39.29 3htx h ASN 358 CO 0.12 0.44 0.59 1.23 -0.00 0.00 0.00 177.43 179.80 3htx h GLY 359 N 0.26 1.41 0.95 1.57 0.00 -1.70 -1.03 103.07 104.52 3htx h GLY 359 Ca 0.09 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 3htx h GLY 359 CO -0.01 0.29 0.06 -2.22 0.00 0.00 0.00 176.54 174.66 3htx h ILE 360 N 1.06 1.07 -0.43 2.60 2.04 -0.81 -1.79 117.51 121.24 3htx h ILE 360 Ca 0.40 -0.19 0.08 0.00 1.00 0.00 0.00 64.86 66.16 3htx h ILE 360 Cb 0.18 1.02 -0.07 0.00 -0.74 0.00 0.00 36.82 37.21 3htx h ILE 360 CO -0.18 0.06 -0.03 0.22 0.00 0.00 0.00 178.15 178.22 3htx h TYR 361 N 0.08 -0.08 -0.39 1.37 3.20 -0.94 -0.19 116.97 120.02 3htx h TYR 361 Ca 0.03 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.96 3htx h TYR 361 Cb 0.05 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 3htx h TYR 361 CO -0.05 -0.12 0.22 0.87 -1.64 0.00 0.00 178.16 177.44 3htx h LYS 362 N 0.08 0.43 -0.28 1.82 1.57 -0.94 -2.56 116.57 116.69 3htx h LYS 362 Ca 0.21 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.88 3htx h LYS 362 Cb 0.32 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3htx h LYS 362 CO -0.38 0.28 -0.20 0.82 -0.57 0.00 0.00 179.45 179.40 3htx h ILE 363 N 0.44 1.25 -0.08 1.86 2.04 -0.94 -2.84 117.51 119.24 3htx h ILE 363 Ca 0.16 -1.17 0.02 0.00 1.00 0.00 0.00 64.86 64.86 3htx h ILE 363 Cb 0.02 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 3htx h ILE 363 CO -0.08 0.38 -0.02 -1.28 0.00 0.00 0.00 178.15 177.14 3htx h SER 364 N 0.45 -0.08 -0.02 1.72 0.87 -0.64 -2.64 113.55 113.21 3htx h SER 364 Ca 0.07 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 3htx h SER 364 Cb 0.60 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 3htx h SER 364 CO 0.04 -0.03 0.00 0.54 -0.53 0.00 0.00 176.83 176.85 3htx n ARG 365 N -5.14 1.07 -1.66 2.24 1.74 -1.05 -4.90 116.66 108.97 3htx n ARG 365 Ca -0.05 -0.11 -0.15 0.00 -0.77 0.00 0.00 57.85 56.77 3htx n ARG 365 Cb 0.07 -1.18 -0.05 0.00 -1.02 0.00 0.00 32.46 30.28 3htx n ARG 365 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3htx n GLN 366 N -0.56 -1.49 -3.10 5.56 6.02 -0.99 -4.85 117.38 117.97 3htx n GLN 366 Ca 0.08 0.84 -0.24 0.00 -0.01 0.00 0.00 57.00 57.67 3htx n GLN 366 Cb 0.06 -5.20 -0.05 0.00 1.02 0.00 0.00 30.24 26.08 3htx n GLN 366 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3htx n ALA 367 N 0.06 3.70 -0.33 -1.58 0.00 -1.12 -4.96 120.51 116.28 3htx n ALA 367 Ca -0.16 -4.26 0.18 0.00 0.00 0.00 0.00 53.44 49.20 3htx n ALA 367 Cb 0.52 -0.81 0.39 0.00 0.00 0.00 0.00 19.45 19.54 3htx n ALA 367 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3htx h VAL 368 N 2.39 0.42 0.00 0.00 2.07 -1.87 0.90 116.25 120.16 3htx h VAL 368 Ca 0.13 -0.14 -0.27 0.00 0.82 0.00 0.00 66.70 67.23 3htx h VAL 368 Cb 0.68 -0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 3htx h VAL 368 CO 0.71 0.08 -1.75 -0.38 0.02 0.00 0.00 177.57 176.24 3htx n ILE 369 N -5.01 1.46 -0.02 4.57 5.41 -1.26 -4.55 119.36 119.96 3htx n ILE 369 Ca 0.27 -0.78 -0.05 0.00 1.00 0.00 0.00 62.75 63.19 3htx n ILE 369 Cb 0.80 -0.88 -0.13 0.00 -0.71 0.00 0.00 39.64 38.73 3htx n ILE 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3htx n ALA 370 N -2.54 1.70 -2.90 -1.39 0.00 -0.93 -4.62 120.51 109.82 3htx n ALA 370 Ca -0.17 -0.79 -0.28 0.00 0.00 0.00 0.00 53.44 52.19 3htx n ALA 370 Cb 1.01 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 19.68 3htx n ALA 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3htx s ALA 371 N -2.73 3.96 0.06 0.00 0.00 0.27 -2.03 121.76 121.29 3htx s ALA 371 Ca -0.05 -0.91 -0.00 0.00 0.00 0.00 0.00 51.96 50.99 3htx s ALA 371 Cb 0.08 -1.84 -0.04 0.00 0.00 0.00 0.00 23.12 21.32 3htx s ALA 371 CO 0.83 0.64 -0.04 -1.14 0.00 0.00 0.00 175.76 176.05 3htx s GLN 372 N -2.94 0.66 -0.06 0.00 0.74 -0.50 -4.65 119.66 112.91 3htx s GLN 372 Ca 0.35 -1.24 -0.30 0.00 0.05 0.00 0.00 55.36 54.22 3htx s GLN 372 Cb -0.12 0.13 -0.03 0.00 1.10 0.00 0.00 33.01 34.09 3htx s GLN 372 CO 0.28 -0.09 1.15 -1.17 -0.55 0.00 0.00 175.29 174.91 3htx s LEU 373 N -2.95 4.28 0.53 3.68 2.96 -1.26 -4.40 118.68 121.53 3htx s LEU 373 Ca 0.08 1.76 -0.19 0.00 -0.22 0.00 0.00 54.13 55.56 3htx s LEU 373 Cb 0.07 -3.56 -0.06 0.00 0.50 0.00 0.00 46.19 43.14 3htx s LEU 373 CO -0.09 -0.54 1.09 -2.84 -1.32 0.00 0.00 176.35 172.65 3htx s PRO 374 N 2.07 3.50 0.00 0.98 0.02 -1.24 -4.73 135.00 135.60 3htx s PRO 374 Ca 0.54 1.46 0.22 0.00 0.02 0.00 0.00 61.00 63.25 3htx s PRO 374 Cb -0.23 -2.04 0.28 0.00 0.02 0.00 0.00 34.50 32.53 3htx s PRO 374 CO 0.22 -0.70 1.28 1.97 -0.33 0.00 0.00 177.00 179.43 3htx n PHE 375 N -1.30 0.22 -3.76 6.54 1.16 -1.26 -4.90 117.46 114.16 3htx n PHE 375 Ca 0.10 -0.12 -0.13 0.00 -1.87 0.00 0.00 57.45 55.44 3htx n PHE 375 Cb 0.52 -0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.28 3htx n PHE 375 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3htx s ALA 376 N -1.67 -0.77 -0.38 1.98 0.00 -1.26 -4.98 121.76 114.68 3htx s ALA 376 Ca 0.31 0.93 -0.12 0.00 0.00 0.00 0.00 51.96 53.07 3htx s ALA 376 Cb 0.20 -0.55 0.02 0.00 0.00 0.00 0.00 23.12 22.80 3htx s ALA 376 CO 0.29 -0.16 0.23 0.12 0.00 0.00 0.00 175.76 176.24 3htx s PHE 377 N 0.32 3.24 0.00 0.00 5.36 -1.26 -4.96 117.98 120.68 3htx s PHE 377 Ca -0.01 -0.78 0.00 0.00 -0.96 0.00 0.00 56.93 55.18 3htx s PHE 377 Cb -0.03 -2.48 0.00 0.00 -0.34 0.00 0.00 43.02 40.17 3htx s PHE 377 CO -0.01 -0.60 0.00 2.41 -1.46 0.00 0.00 175.22 175.56 3htx n THR 378 N 5.05 0.00 -3.79 0.12 -1.04 -1.26 -4.83 114.28 108.54 3htx n THR 378 Ca -0.12 0.49 -0.13 0.00 -2.04 0.00 0.00 64.05 62.26 3htx n THR 378 Cb 0.47 -1.48 -0.12 0.00 -1.82 0.00 0.00 70.33 67.38 3htx n THR 378 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 3htx s THR 379 N -0.98 -0.01 0.60 12.58 2.01 -1.26 -5.02 115.64 123.56 3htx s THR 379 Ca 0.00 0.02 0.28 0.00 0.31 0.00 0.00 61.69 62.30 3htx s THR 379 Cb 0.00 -0.32 0.38 0.00 0.01 0.00 0.00 72.50 72.57 3htx s THR 379 CO 0.00 0.01 1.75 0.50 -0.69 0.00 0.00 174.62 176.19 3htx h LYS 380 N 5.99 0.00 0.07 4.92 3.64 -1.96 0.70 116.57 129.93 3htx h LYS 380 Ca -0.28 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 58.86 3htx h LYS 380 Cb 1.19 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 3htx h LYS 380 CO 0.37 0.00 -1.16 0.77 -2.27 0.00 0.00 179.45 177.16 3htx h SER 381 N 0.00 0.22 0.74 4.20 0.02 -2.01 -3.32 113.55 113.40 3htx h SER 381 Ca 0.27 -0.24 -0.25 0.00 -0.84 0.00 0.00 61.79 60.73 3htx h SER 381 Cb 1.58 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 64.01 3htx h SER 381 CO -0.00 1.19 -1.37 0.78 -1.14 0.00 0.00 176.83 176.29 3htx h ASN 382 N 0.04 0.00 -4.04 3.07 2.35 -0.14 -3.46 115.58 113.40 3htx h ASN 382 Ca -0.09 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 55.14 3htx h ASN 382 Cb 1.88 0.00 0.10 0.00 0.05 0.00 0.00 38.32 40.36 3htx h ASN 382 CO 0.17 0.96 0.53 0.86 -1.65 0.00 0.00 177.43 178.30 3htx s TRP 383 N -2.67 2.54 0.23 1.19 -0.11 0.33 -4.59 118.94 115.87 3htx s TRP 383 Ca -0.02 1.47 0.04 0.00 1.22 0.00 0.00 56.10 58.81 3htx s TRP 383 Cb 0.09 -3.57 -0.05 0.00 -1.50 0.00 0.00 33.47 28.43 3htx s TRP 383 CO 0.82 -2.21 -0.02 1.03 -4.62 0.00 0.00 176.95 171.95 3htx s ARG 384 N -2.90 1.35 5.84 5.86 1.81 -1.26 -4.94 118.95 124.71 3htx s ARG 384 Ca 0.69 -1.67 0.00 0.00 -1.72 0.00 0.00 55.73 53.03 3htx s ARG 384 Cb -0.34 -0.70 0.00 0.00 -0.45 0.00 0.00 34.95 33.46 3htx s ARG 384 CO 0.40 -0.06 0.00 0.41 -0.68 0.00 0.00 175.30 175.36 3htx n GLY 385 N -0.43 0.65 3.74 -3.53 0.00 -1.26 -4.77 105.19 99.59 3htx n GLY 385 Ca -0.05 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 3htx n GLY 385 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3htx s PRO 386 N 0.00 3.67 0.78 1.61 0.04 -1.26 -5.06 135.00 134.78 3htx s PRO 386 Ca 0.00 -0.26 -0.15 0.00 0.04 0.00 0.00 61.00 60.63 3htx s PRO 386 Cb 0.00 -3.17 -0.00 0.00 0.04 0.00 0.00 34.50 31.37 3htx s PRO 386 CO 0.00 0.51 0.67 1.28 0.04 0.00 0.00 177.00 179.50 3htx n LEU 387 N 2.79 1.54 -0.07 -3.56 4.77 -1.26 -4.76 117.00 116.45 3htx n LEU 387 Ca -0.18 0.55 -0.07 0.00 -0.03 0.00 0.00 56.01 56.28 3htx n LEU 387 Cb 0.53 -1.28 0.11 0.00 -2.33 0.00 0.00 43.42 40.44 3htx n LEU 387 CO 0.33 -2.85 0.71 1.55 -1.33 0.00 0.00 177.39 175.80 3htx h PRO 388 N -0.66 0.74 -0.72 3.23 0.13 -1.94 -1.69 132.00 131.09 3htx h PRO 388 Ca -0.45 -0.29 -0.03 0.00 -0.87 0.00 0.00 66.00 64.36 3htx h PRO 388 Cb 1.33 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.39 3htx h PRO 388 CO 0.42 0.89 0.34 -0.09 -0.23 0.00 0.00 178.00 179.33 3htx h ARG 389 N 0.65 1.04 -0.51 0.86 9.65 -1.86 0.11 114.38 124.31 3htx h ARG 389 Ca 0.09 -0.16 -0.07 0.00 -1.10 0.00 0.00 59.98 58.74 3htx h ARG 389 Cb 0.71 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 29.09 3htx h ARG 389 CO 0.05 0.82 0.04 0.93 2.80 0.00 0.00 179.97 184.62 3htx h GLU 390 N 1.01 0.88 -0.61 0.20 4.39 -1.86 -1.67 114.58 116.91 3htx h GLU 390 Ca 0.25 -0.26 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 3htx h GLU 390 Cb 0.13 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 3htx h GLU 390 CO -0.03 0.89 0.38 0.82 -1.16 0.00 0.00 179.01 179.91 3htx h ILE 391 N 0.75 1.17 -0.46 3.13 2.04 -0.94 -2.09 117.51 121.11 3htx h ILE 391 Ca 0.15 -0.36 0.07 0.00 1.00 0.00 0.00 64.86 65.72 3htx h ILE 391 Cb 0.47 0.32 -0.06 0.00 -0.74 0.00 0.00 36.82 36.80 3htx h ILE 391 CO 0.02 0.17 0.13 0.25 0.00 0.00 0.00 178.15 178.72 3htx h LEU 392 N 0.82 0.08 -1.04 1.44 5.85 -0.43 0.36 115.31 122.41 3htx h LEU 392 Ca 0.22 0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.95 3htx h LEU 392 Cb -0.05 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 3htx h LEU 392 CO -0.04 0.08 0.04 1.23 -0.34 0.00 0.00 178.44 179.41 3htx h GLY 393 N 0.28 0.79 1.08 3.75 0.00 -0.95 -2.14 103.07 105.87 3htx h GLY 393 Ca 0.22 -0.48 -0.12 0.00 0.00 0.00 0.00 47.33 46.95 3htx h GLY 393 CO -0.26 0.45 -0.19 1.41 0.00 0.00 0.00 176.54 177.95 3htx h LEU 394 N 0.69 0.98 -1.34 3.11 3.38 -0.61 -1.90 115.31 119.61 3htx h LEU 394 Ca 0.15 -0.39 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 3htx h LEU 394 Cb 0.37 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3htx h LEU 394 CO 0.01 1.15 -0.32 0.15 0.09 0.00 0.00 178.44 179.52 3htx h PHE 395 N 0.80 0.01 -0.02 1.13 3.57 -0.75 -1.13 116.94 120.55 3htx h PHE 395 Ca 0.11 -0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.38 3htx h PHE 395 Cb 0.76 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.50 3htx h PHE 395 CO 0.05 0.33 -0.91 0.00 -2.23 0.00 0.00 178.31 175.55 3htx h HIS 397 N 0.27 0.78 -0.78 0.00 -0.00 -1.05 -0.13 115.15 114.24 3htx h HIS 397 Ca -0.08 -0.47 0.00 0.00 -0.00 0.00 0.00 60.37 59.83 3htx h HIS 397 Cb 1.54 -0.07 -0.04 0.00 -0.00 0.00 0.00 27.41 28.84 3htx h HIS 397 CO 0.06 1.31 0.50 1.96 -0.00 0.00 0.00 177.93 181.76 3htx h GLN 398 N 0.24 1.04 -6.42 5.26 4.20 -1.28 -3.40 115.11 114.75 3htx h GLN 398 Ca -0.13 -0.07 -0.44 0.00 0.06 0.00 0.00 58.65 58.07 3htx h GLN 398 Cb 1.76 -0.23 0.01 0.00 0.30 0.00 0.00 27.48 29.33 3htx h GLN 398 CO 0.20 0.71 -0.27 -1.01 -0.67 0.00 0.00 178.83 177.78 3htx s HIS 399 N -5.85 3.09 -0.98 2.96 3.76 -1.12 -4.98 115.29 112.18 3htx s HIS 399 Ca -0.11 -0.15 -0.20 0.00 -0.15 0.00 0.00 55.06 54.45 3htx s HIS 399 Cb 0.18 -2.12 0.10 0.00 1.11 0.00 0.00 32.58 31.84 3htx s HIS 399 CO 0.79 -0.15 1.27 1.03 -0.85 0.00 0.00 174.74 176.82 3htx s ARG 400 N -4.29 3.62 0.06 1.40 0.52 -1.26 -4.71 118.95 114.30 3htx s ARG 400 Ca 0.47 -1.55 0.08 0.00 -0.52 0.00 0.00 55.73 54.21 3htx s ARG 400 Cb -0.10 -5.10 -0.03 0.00 0.52 0.00 0.00 34.95 30.25 3htx s ARG 400 CO 0.33 -1.95 -0.21 -0.51 0.02 0.00 0.00 175.30 172.98 3htx s LEU 401 N 3.54 2.21 -0.30 2.53 2.01 -0.06 -4.82 118.68 123.79 3htx s LEU 401 Ca 0.38 -0.57 -0.21 0.00 0.01 0.00 0.00 54.13 53.75 3htx s LEU 401 Cb -0.03 -0.95 -0.01 0.00 0.01 0.00 0.00 46.19 45.21 3htx s LEU 401 CO -0.09 0.13 0.64 0.00 1.01 0.00 0.00 176.35 178.04 3htx s ALA 402 N -0.91 3.53 -0.07 4.21 0.00 -0.55 -4.52 121.76 123.46 3htx s ALA 402 Ca 0.07 -0.62 -0.10 0.00 0.00 0.00 0.00 51.96 51.31 3htx s ALA 402 Cb -0.09 -3.11 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 3htx s ALA 402 CO 0.03 -1.07 0.32 -1.91 0.00 0.00 0.00 175.76 173.12 3htx n GLU 403 N 5.90 0.00 -1.40 0.00 2.13 -1.26 -4.07 120.64 121.94 3htx n GLU 403 Ca -0.01 0.00 -0.45 0.00 0.66 0.00 0.00 57.16 57.36 3htx n GLU 403 Cb 0.49 -0.34 -0.02 0.00 0.27 0.00 0.00 31.44 31.84 3htx n GLU 403 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3htx n PRO 404 N 0.71 0.23 -3.19 5.31 -0.04 -1.26 -4.84 135.00 131.92 3htx n PRO 404 Ca 0.06 0.08 -0.40 0.00 -0.04 0.00 0.00 63.50 63.21 3htx n PRO 404 Cb -0.00 -1.16 -0.07 0.00 -0.04 0.00 0.00 33.50 32.23 3htx n PRO 404 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3htx s ILE 405 N -1.26 5.06 -0.31 0.52 1.01 0.05 -5.02 121.20 121.25 3htx s ILE 405 Ca 0.62 1.04 0.04 0.00 0.00 0.00 0.00 60.65 62.34 3htx s ILE 405 Cb -0.78 -3.88 0.08 0.00 0.01 0.00 0.00 42.46 37.89 3htx s ILE 405 CO 0.59 0.12 -0.02 -0.22 0.00 0.00 0.00 174.94 175.41 3htx s LEU 406 N 1.93 4.19 -0.19 2.97 2.96 -1.26 -3.00 118.68 126.28 3htx s LEU 406 Ca 0.25 -1.83 0.01 0.00 -0.22 0.00 0.00 54.13 52.34 3htx s LEU 406 Cb -0.16 -1.59 0.04 0.00 0.50 0.00 0.00 46.19 44.98 3htx s LEU 406 CO 0.10 -0.30 -0.12 -0.94 -1.32 0.00 0.00 176.35 173.77 3htx s SER 407 N 0.99 3.33 0.02 3.68 1.04 -1.26 -5.09 113.70 116.41 3htx s SER 407 Ca 0.02 -0.84 0.02 0.00 0.48 0.00 0.00 55.95 55.63 3htx s SER 407 Cb -0.19 -1.26 -0.04 0.00 0.10 0.00 0.00 66.02 64.63 3htx s SER 407 CO -0.07 -0.12 0.02 -0.94 0.98 0.00 0.00 173.24 173.11 3htx s SER 408 N 1.39 5.21 -0.00 7.02 1.04 -1.26 -3.08 113.70 124.02 3htx s SER 408 Ca -0.00 -0.01 0.06 0.00 0.48 0.00 0.00 55.95 56.47 3htx s SER 408 Cb -0.16 -1.37 -0.08 0.00 0.10 0.00 0.00 66.02 64.52 3htx s SER 408 CO -0.09 0.26 0.19 -1.54 0.98 0.00 0.00 173.24 173.03 3htx n SER 409 N 1.17 2.02 0.00 7.02 3.41 -1.26 -5.03 113.62 120.96 3htx n SER 409 Ca -0.13 -0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.17 3htx n SER 409 Cb 0.52 1.14 0.00 0.00 -0.26 0.00 0.00 64.21 65.62 3htx n SER 409 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3htx n ARG 453 N -1.43 0.00 -3.85 4.33 0.00 -1.04 -5.06 116.66 109.60 3htx n ARG 453 Ca -0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 57.85 57.59 3htx n ARG 453 Cb 0.12 0.00 -0.00 0.00 -0.00 0.00 0.00 32.46 32.58 3htx n ARG 453 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3htx s GLU 455 N -4.29 0.91 0.04 0.00 2.56 -1.26 -4.77 118.70 111.89 3htx s GLU 455 Ca 0.35 0.09 0.03 0.00 0.00 0.00 0.00 54.97 55.44 3htx s GLU 455 Cb -0.02 0.42 -0.02 0.00 2.00 0.00 0.00 34.13 36.51 3htx s GLU 455 CO 0.22 -0.27 -0.10 0.08 -0.56 0.00 0.00 175.26 174.63 3htx s VAL 456 N -1.24 0.74 -0.05 3.70 1.01 -1.18 -3.52 120.40 119.86 3htx s VAL 456 Ca -0.12 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 3htx s VAL 456 Cb -0.02 -0.73 0.03 0.00 0.00 0.00 0.00 36.38 35.66 3htx s VAL 456 CO 0.08 -0.18 0.01 -0.54 0.00 0.00 0.00 175.10 174.46 3htx s LYS 457 N -1.25 0.45 -0.00 2.72 -0.14 0.27 -4.11 119.74 117.67 3htx s LYS 457 Ca -0.04 0.13 -0.06 0.00 -1.36 0.00 0.00 55.97 54.63 3htx s LYS 457 Cb -0.08 -0.77 0.00 0.00 -1.68 0.00 0.00 37.83 35.29 3htx s LYS 457 CO 0.01 -0.25 0.12 0.96 -0.76 0.00 0.00 175.35 175.43 3htx s ILE 458 N 1.69 0.07 0.27 2.17 -4.36 -1.16 0.13 121.20 120.01 3htx s ILE 458 Ca 0.00 -0.60 0.12 0.00 -0.26 0.00 0.00 60.65 59.90 3htx s ILE 458 Cb -0.13 -0.38 -0.05 0.00 1.25 0.00 0.00 42.46 43.16 3htx s ILE 458 CO -0.04 -0.33 -0.19 -0.36 0.24 0.00 0.00 174.94 174.26 3htx s PHE 459 N -1.16 2.32 -0.14 1.37 0.40 -0.50 -0.77 117.98 119.50 3htx s PHE 459 Ca -0.12 -0.32 -0.05 0.00 -0.60 0.00 0.00 56.93 55.83 3htx s PHE 459 Cb -0.07 -1.02 0.07 0.00 0.51 0.00 0.00 43.02 42.51 3htx s PHE 459 CO 0.01 0.69 0.28 0.99 0.70 0.00 0.00 175.22 177.89 3htx s THR 460 N -2.41 -0.44 -0.31 0.64 2.01 -1.26 0.37 115.64 114.24 3htx s THR 460 Ca 0.29 0.27 -0.10 0.00 0.31 0.00 0.00 61.69 62.46 3htx s THR 460 Cb -0.05 -0.47 -0.01 0.00 0.01 0.00 0.00 72.50 71.97 3htx s THR 460 CO 0.15 0.11 0.17 -0.54 -0.69 0.00 0.00 174.62 173.82 3htx s LYS 461 N 2.44 3.45 -1.20 4.92 1.02 0.18 -1.48 119.74 129.07 3htx s LYS 461 Ca 0.01 -0.65 -0.14 0.00 0.02 0.00 0.00 55.97 55.21 3htx s LYS 461 Cb -0.12 -3.61 -0.01 0.00 -0.52 0.00 0.00 37.83 33.57 3htx s LYS 461 CO -0.09 -0.38 0.73 0.43 -0.92 0.00 0.00 175.35 175.11 3htx n SER 462 N 5.01 -3.96 0.00 2.83 7.64 -1.26 -1.51 113.62 122.37 3htx n SER 462 Ca -0.14 -0.97 0.00 0.00 1.01 0.00 0.00 58.87 58.77 3htx n SER 462 Cb 0.50 -3.54 0.00 0.00 -1.01 0.00 0.00 64.21 60.16 3htx n SER 462 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3htx n GLN 463 N -4.17 -0.53 -4.91 1.43 6.02 -1.26 -4.99 117.38 108.96 3htx n GLN 463 Ca -0.16 0.13 -0.33 0.00 -0.01 0.00 0.00 57.00 56.64 3htx n GLN 463 Cb 0.62 -3.77 -0.14 0.00 1.02 0.00 0.00 30.24 27.98 3htx n GLN 463 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3htx s ASP 464 N -2.24 3.87 0.27 1.08 1.01 -0.57 -5.10 116.67 115.00 3htx s ASP 464 Ca 0.00 -0.29 -0.30 0.00 0.71 0.00 0.00 52.55 52.67 3htx s ASP 464 Cb 0.00 -1.10 -0.11 0.00 1.01 0.00 0.00 42.92 42.72 3htx s ASP 464 CO 0.00 0.27 1.51 -0.76 0.21 0.00 0.00 175.17 176.39 3htx s LEU 465 N -0.27 4.37 -0.18 1.23 1.43 -1.26 0.49 118.68 124.47 3htx s LEU 465 Ca 0.01 2.80 -0.02 0.00 -1.03 0.00 0.00 54.13 55.89 3htx s LEU 465 Cb -0.13 -3.63 -0.10 0.00 0.03 0.00 0.00 46.19 42.36 3htx s LEU 465 CO 0.03 -0.80 -0.19 0.52 0.23 0.00 0.00 176.35 176.14 3htx n VAL 466 N 2.17 1.03 -3.49 -1.59 0.31 0.16 -4.76 118.33 112.15 3htx n VAL 466 Ca 0.07 -0.35 -0.09 0.00 -0.01 0.00 0.00 64.34 63.96 3htx n VAL 466 Cb 0.39 -1.34 -0.02 0.00 -0.91 0.00 0.00 33.84 31.96 3htx n VAL 466 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 3htx s LEU 467 N -6.37 -0.41 -0.04 7.52 2.96 -1.23 -4.92 118.68 116.18 3htx s LEU 467 Ca -0.25 0.03 0.03 0.00 -0.22 0.00 0.00 54.13 53.72 3htx s LEU 467 Cb 0.08 2.14 0.01 0.00 0.50 0.00 0.00 46.19 48.92 3htx s LEU 467 CO 0.38 -0.68 -0.11 -1.61 -1.32 0.00 0.00 176.35 173.01 3htx s GLU 468 N -3.13 1.37 -0.03 1.98 2.02 -1.26 -1.41 118.70 118.24 3htx s GLU 468 Ca 0.04 -0.38 -0.05 0.00 0.02 0.00 0.00 54.97 54.59 3htx s GLU 468 Cb -0.01 -1.20 0.01 0.00 0.10 0.00 0.00 34.13 33.03 3htx s GLU 468 CO -0.09 0.09 0.13 0.00 0.02 0.00 0.00 175.26 175.40 3htx s SER 470 N -0.47 -0.37 0.12 0.00 1.04 -1.26 0.97 113.70 113.73 3htx s SER 470 Ca -0.05 0.70 0.06 0.00 0.48 0.00 0.00 55.95 57.13 3htx s SER 470 Cb -0.04 0.67 -0.04 0.00 0.10 0.00 0.00 66.02 66.72 3htx s SER 470 CO 0.01 -0.14 0.01 -2.16 0.98 0.00 0.00 173.24 171.94 3htx s PRO 471 N 0.53 2.53 0.00 4.02 0.04 -1.23 -5.03 135.00 135.86 3htx s PRO 471 Ca -0.03 -0.92 0.26 0.00 0.04 0.00 0.00 61.00 60.36 3htx s PRO 471 Cb -0.04 -2.50 0.70 0.00 0.04 0.00 0.00 34.50 32.70 3htx s PRO 471 CO -0.03 0.51 1.54 0.54 0.04 0.00 0.00 177.00 179.61 3htx n ARG 472 N 0.31 1.69 -3.53 4.56 1.74 -1.26 -4.59 116.66 115.59 3htx n ARG 472 Ca -0.10 -1.15 -0.42 0.00 -0.77 0.00 0.00 57.85 55.41 3htx n ARG 472 Cb 0.53 -1.48 -0.09 0.00 -1.02 0.00 0.00 32.46 30.41 3htx n ARG 472 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3htx s LYS 473 N -2.11 2.64 -0.04 5.56 1.02 -1.26 -5.06 119.74 120.49 3htx s LYS 473 Ca 0.32 -1.59 -0.30 0.00 0.02 0.00 0.00 55.97 54.42 3htx s LYS 473 Cb 0.20 -3.93 -0.05 0.00 -0.52 0.00 0.00 37.83 33.53 3htx s LYS 473 CO 0.37 -1.09 1.57 -0.06 -0.92 0.00 0.00 175.35 175.21 3htx s PHE 474 N 1.44 2.27 0.32 3.18 0.40 -1.26 -4.97 117.98 119.37 3htx s PHE 474 Ca 0.04 0.40 -0.06 0.00 -0.60 0.00 0.00 56.93 56.71 3htx s PHE 474 Cb -0.25 -3.83 -0.05 0.00 0.51 0.00 0.00 43.02 39.39 3htx s PHE 474 CO 0.02 -3.38 0.61 0.71 0.70 0.00 0.00 175.22 173.88 3htx s TYR 475 N 3.54 3.48 -0.02 0.36 1.51 0.66 -4.97 117.35 121.90 3htx s TYR 475 Ca 0.70 0.74 -0.21 0.00 -1.01 0.00 0.00 57.07 57.29 3htx s TYR 475 Cb -0.32 -2.19 -0.14 0.00 -0.11 0.00 0.00 41.96 39.20 3htx s TYR 475 CO 0.28 0.09 0.91 0.93 -1.11 0.00 0.00 175.55 176.65 3htx h GLU 476 N 1.53 -0.43 -5.89 -0.62 5.08 -1.92 -2.76 114.58 109.56 3htx h GLU 476 Ca -0.48 0.03 -0.63 0.00 -1.00 0.00 0.00 59.36 57.29 3htx h GLU 476 Cb 1.19 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.48 3htx h GLU 476 CO 0.65 -0.12 -0.28 0.21 -1.00 0.00 0.00 179.01 178.47 3htx s LYS 477 N -3.84 3.80 0.42 2.33 2.20 -1.26 -4.47 119.74 118.92 3htx s LYS 477 Ca -0.12 0.26 0.08 0.00 -0.36 0.00 0.00 55.97 55.83 3htx s LYS 477 Cb 0.01 -3.22 0.89 0.00 -1.51 0.00 0.00 37.83 34.00 3htx s LYS 477 CO 0.41 0.70 2.06 0.93 -0.36 0.00 0.00 175.35 179.09 3htx h GLU 478 N 4.85 0.51 -0.10 4.03 4.39 -1.98 -2.14 114.58 124.15 3htx h GLU 478 Ca -0.52 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.14 3htx h GLU 478 Cb 1.22 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 29.75 3htx h GLU 478 CO 0.61 0.34 0.04 -0.97 -1.16 0.00 0.00 179.01 177.86 3htx h ASN 479 N 0.53 0.13 0.00 1.42 -1.24 -1.99 -1.97 115.58 112.47 3htx h ASN 479 Ca 0.16 -0.17 0.00 0.00 0.71 0.00 0.00 56.30 57.00 3htx h ASN 479 Cb -0.00 -0.03 0.00 0.00 0.73 0.00 0.00 38.32 39.01 3htx h ASN 479 CO -0.04 0.27 0.00 0.47 -1.29 0.00 0.00 177.43 176.84 3htx n ASP 480 N -4.92 0.00 -0.07 1.15 9.92 -0.95 -2.04 116.55 119.64 3htx n ASP 480 Ca -0.06 -0.74 -0.21 0.00 -0.53 0.00 0.00 54.79 53.25 3htx n ASP 480 Cb 0.12 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.48 3htx n ASP 480 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3htx h ALA 481 N 3.43 0.28 0.81 2.24 0.00 -0.74 -3.34 119.26 121.93 3htx h ALA 481 Ca 0.00 -1.20 -0.04 0.00 0.00 0.00 0.00 54.91 53.67 3htx h ALA 481 Cb 0.00 0.69 0.01 0.00 0.00 0.00 0.00 17.79 18.48 3htx h ALA 481 CO 0.00 0.79 -0.39 0.82 0.00 0.00 0.00 179.25 180.47 3htx h ILE 482 N -0.76 0.00 -0.89 0.00 2.04 -1.19 -3.30 117.51 113.42 3htx h ILE 482 Ca -0.34 -0.13 0.14 0.00 1.00 0.00 0.00 64.86 65.53 3htx h ILE 482 Cb 1.45 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 37.39 3htx h ILE 482 CO -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 178.15 177.69 3htx n GLN 483 N -5.26 -0.19 0.10 2.37 1.13 -0.86 0.15 117.38 114.82 3htx n GLN 483 Ca -0.13 1.37 0.08 0.00 -1.94 0.00 0.00 57.00 56.38 3htx n GLN 483 Cb 0.43 -2.03 0.40 0.00 0.11 0.00 0.00 30.24 29.14 3htx n GLN 483 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3htx n ASN 484 N -5.33 0.39 -0.09 1.08 2.85 -1.25 -1.50 115.26 111.42 3htx n ASN 484 Ca 0.10 0.65 -0.18 0.00 -0.11 0.00 0.00 54.58 55.04 3htx n ASN 484 Cb 0.37 -0.71 -0.13 0.00 1.24 0.00 0.00 39.78 40.55 3htx n ASN 484 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3htx n ALA 485 N -1.68 1.32 0.23 5.20 0.00 0.41 -3.49 120.51 122.49 3htx n ALA 485 Ca 0.00 -1.00 0.08 0.00 0.00 0.00 0.00 53.44 52.52 3htx n ALA 485 Cb 0.09 -0.27 0.56 0.00 0.00 0.00 0.00 19.45 19.83 3htx n ALA 485 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3htx h SER 486 N 0.02 0.00 0.59 0.00 0.02 -0.38 -2.19 113.55 111.61 3htx h SER 486 Ca -0.53 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.20 3htx h SER 486 Cb 1.97 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.51 3htx h SER 486 CO -0.03 0.20 -0.99 0.25 -1.14 0.00 0.00 176.83 175.12 3htx h LEU 487 N 0.00 0.32 0.70 5.07 6.46 -1.42 -2.63 115.31 123.81 3htx h LEU 487 Ca -0.00 -0.29 -0.03 0.00 -0.12 0.00 0.00 57.88 57.44 3htx h LEU 487 Cb 0.43 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 40.26 3htx h LEU 487 CO 0.03 1.13 -0.43 0.50 -0.62 0.00 0.00 178.44 179.05 3htx h LYS 488 N 0.11 -1.02 -0.08 1.25 1.63 -1.44 0.66 116.57 117.69 3htx h LYS 488 Ca -0.07 0.07 0.03 0.00 -0.85 0.00 0.00 60.65 59.83 3htx h LYS 488 Cb 1.66 0.23 -0.06 0.00 -0.60 0.00 0.00 32.23 33.46 3htx h LYS 488 CO 0.16 -0.68 -0.50 0.00 -3.45 0.00 0.00 179.45 174.97 3htx h ALA 489 N -0.86 -0.82 -1.05 5.00 0.00 -1.56 0.12 119.26 120.09 3htx h ALA 489 Ca -0.09 -0.05 0.30 0.00 0.00 0.00 0.00 54.91 55.06 3htx h ALA 489 Cb 0.85 0.92 -0.12 0.00 0.00 0.00 0.00 17.79 19.44 3htx h ALA 489 CO 0.10 -1.05 0.64 -0.07 0.00 0.00 0.00 179.25 178.87 3htx h LEU 490 N -0.59 0.51 -0.57 0.00 3.38 -1.31 0.39 115.31 117.12 3htx h LEU 490 Ca 0.04 0.14 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 3htx h LEU 490 Cb 0.68 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 3htx h LEU 490 CO -0.39 -0.01 0.02 -0.07 0.09 0.00 0.00 178.44 178.08 3htx h LEU 491 N 0.39 0.97 -0.76 1.67 3.38 0.16 -2.54 115.31 118.58 3htx h LEU 491 Ca 0.68 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 58.27 3htx h LEU 491 Cb 1.61 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 42.07 3htx h LEU 491 CO -0.46 1.03 0.04 -0.25 0.09 0.00 0.00 178.44 178.89 3htx h TRP 492 N 0.88 1.05 -0.59 1.13 7.01 0.97 -1.94 115.95 124.47 3htx h TRP 492 Ca 0.16 -0.15 0.05 0.00 2.11 0.00 0.00 58.89 61.06 3htx h TRP 492 Cb 0.52 -0.28 -0.03 0.00 -2.10 0.00 0.00 29.16 27.26 3htx h TRP 492 CO 0.04 0.92 0.39 0.74 -2.79 0.00 0.00 178.44 177.73 3htx h PHE 493 N 0.91 0.59 0.00 2.65 0.05 -0.93 -1.54 116.94 118.67 3htx h PHE 493 Ca 0.17 0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.98 3htx h PHE 493 Cb 0.48 -0.20 0.00 0.00 2.00 0.00 0.00 35.95 38.23 3htx h PHE 493 CO 0.03 0.33 0.00 0.43 -0.18 0.00 0.00 178.31 178.92 3htx n SER 494 N -4.47 0.00 0.05 2.17 7.64 -0.73 -1.11 113.62 117.18 3htx n SER 494 Ca 0.08 0.48 0.11 0.00 1.01 0.00 0.00 58.87 60.54 3htx n SER 494 Cb 0.21 -0.48 0.44 0.00 -1.01 0.00 0.00 64.21 63.37 3htx n SER 494 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3htx n LYS 495 N -1.48 0.10 0.06 1.43 5.02 -0.58 -3.06 118.16 119.65 3htx n LYS 495 Ca 0.00 0.24 0.11 0.00 -2.02 0.00 0.00 58.31 56.65 3htx n LYS 495 Cb 0.02 -1.66 0.03 0.00 -0.02 0.00 0.00 35.03 33.40 3htx n LYS 495 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3htx n PHE 496 N -1.84 0.58 -4.18 2.13 0.99 -0.27 -4.90 117.46 109.98 3htx n PHE 496 Ca 0.04 0.17 -0.11 0.00 -0.00 0.00 0.00 57.45 57.55 3htx n PHE 496 Cb 0.27 -0.69 -0.10 0.00 -1.00 0.00 0.00 39.48 37.96 3htx n PHE 496 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.76 176.70 3htx s PHE 497 N -3.28 0.94 -0.26 1.38 0.40 -1.17 -4.91 117.98 111.08 3htx s PHE 497 Ca 0.02 -0.86 -0.02 0.00 -0.60 0.00 0.00 56.93 55.47 3htx s PHE 497 Cb 0.12 -0.53 0.08 0.00 0.51 0.00 0.00 43.02 43.20 3htx s PHE 497 CO 0.79 -0.11 0.08 0.00 0.70 0.00 0.00 175.22 176.68 3htx s ALA 498 N -3.42 1.18 0.06 5.36 0.00 -1.26 -4.84 121.76 118.83 3htx s ALA 498 Ca 0.11 -1.18 0.06 0.00 0.00 0.00 0.00 51.96 50.95 3htx s ALA 498 Cb 0.04 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.73 3htx s ALA 498 CO -0.04 -1.46 -0.17 -0.51 0.00 0.00 0.00 175.76 173.59 3htx s ASP 499 N 1.79 1.99 0.00 0.00 1.01 -1.26 -5.04 116.67 115.16 3htx s ASP 499 Ca 0.05 -0.56 0.00 0.00 0.71 0.00 0.00 52.55 52.75 3htx s ASP 499 Cb -0.17 -0.11 0.00 0.00 1.01 0.00 0.00 42.92 43.65 3htx s ASP 499 CO -0.20 0.03 0.00 -0.11 0.21 0.00 0.00 175.17 175.10 3htx n LEU 500 N 1.54 0.00 -3.25 1.23 0.00 -1.26 -5.03 117.00 110.23 3htx n LEU 500 Ca -0.19 0.00 0.04 0.00 0.00 0.00 0.00 56.01 55.85 3htx n LEU 500 Cb 0.54 0.00 -0.03 0.00 0.00 0.00 0.00 43.42 43.93 3htx n LEU 500 CO 0.22 0.00 0.68 -0.44 0.00 0.00 0.00 177.39 177.85 3htx s SER 520 N 0.00 -0.40 0.22 1.96 0.01 -1.26 -5.05 113.70 109.19 3htx s SER 520 Ca 0.00 0.42 0.24 0.00 1.31 0.00 0.00 55.95 57.91 3htx s SER 520 Cb 0.00 1.40 0.27 0.00 0.21 0.00 0.00 66.02 67.90 3htx s SER 520 CO 0.00 -0.08 1.33 1.55 0.41 0.00 0.00 173.24 176.45 3htx h PRO 521 N 7.59 0.00 0.00 12.44 0.13 -2.04 -3.46 132.00 146.65 3htx h PRO 521 Ca -0.14 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.50 3htx h PRO 521 Cb 1.14 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.18 3htx h PRO 521 CO 0.01 0.00 -0.35 0.09 -0.23 0.00 0.00 178.00 177.52 3htx n ASN 522 N -2.53 3.02 -4.27 1.44 3.02 -1.26 -5.14 115.26 109.53 3htx n ASN 522 Ca 0.02 -2.63 -0.33 0.00 -0.03 0.00 0.00 54.58 51.62 3htx n ASN 522 Cb 0.50 0.25 -0.16 0.00 -0.61 0.00 0.00 39.78 39.76 3htx n ASN 522 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3htx s VAL 523 N -2.34 2.49 -0.30 2.41 1.01 -1.26 -5.07 120.40 117.34 3htx s VAL 523 Ca 0.01 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 3htx s VAL 523 Cb -0.00 -2.01 0.18 0.00 0.00 0.00 0.00 36.38 34.56 3htx s VAL 523 CO 0.00 0.54 0.70 0.72 0.00 0.00 0.00 175.10 177.06 3htx s PHE 524 N 0.48 -1.37 -0.20 5.22 -0.12 -1.26 -5.15 117.98 115.58 3htx s PHE 524 Ca -0.13 1.52 -0.08 0.00 -0.05 0.00 0.00 56.93 58.20 3htx s PHE 524 Cb -0.17 0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 42.69 3htx s PHE 524 CO 0.05 -0.75 0.08 0.00 -0.05 0.00 0.00 175.22 174.55 3htx s ALA 525 N 2.87 3.42 0.30 1.99 0.00 -1.26 -5.07 121.76 124.01 3htx s ALA 525 Ca 0.15 -0.81 -0.28 0.00 0.00 0.00 0.00 51.96 51.02 3htx s ALA 525 Cb -0.14 -2.01 -0.09 0.00 0.00 0.00 0.00 23.12 20.88 3htx s ALA 525 CO -0.19 0.05 1.06 0.00 0.00 0.00 0.00 175.76 176.68 3htx s ALA 526 N 0.60 3.33 -1.80 0.00 0.00 -1.26 -4.99 121.76 117.64 3htx s ALA 526 Ca 0.04 0.81 0.21 0.00 0.00 0.00 0.00 51.96 53.01 3htx s ALA 526 Cb -0.13 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.67 3htx s ALA 526 CO 0.01 -0.10 1.01 -0.35 0.00 0.00 0.00 175.76 176.32 3htx n PRO 527 N 0.97 1.27 0.00 0.00 -0.04 -1.26 -5.01 135.00 130.93 3htx n PRO 527 Ca 0.00 -0.87 0.00 0.00 -0.04 0.00 0.00 63.50 62.59 3htx n PRO 527 Cb 0.46 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 3htx n PRO 527 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3htx n PRO 528 N -0.17 0.00 0.00 0.54 -0.04 -1.26 -4.93 135.00 129.14 3htx n PRO 528 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 3htx n PRO 528 Cb 0.42 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.88 3htx n PRO 528 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3htx n SER 535 N 0.00 0.00 -3.78 3.54 3.41 -1.25 -5.12 113.62 110.42 3htx n SER 535 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.32 3htx n SER 535 Cb 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.80 3htx n SER 535 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3htx s SER 536 N 0.00 3.75 -0.16 4.04 1.04 -1.26 -5.03 113.70 116.08 3htx s SER 536 Ca 0.00 -1.38 -0.29 0.00 0.48 0.00 0.00 55.95 54.76 3htx s SER 536 Cb 0.00 -0.88 -0.04 0.00 0.10 0.00 0.00 66.02 65.20 3htx s SER 536 CO 0.00 -0.36 1.70 -0.70 0.98 0.00 0.00 173.24 174.86 3htx s GLU 537 N 1.61 3.86 -0.18 4.02 2.12 -1.26 -3.90 118.70 124.96 3htx s GLU 537 Ca 0.04 1.88 -0.02 0.00 0.36 0.00 0.00 54.97 57.23 3htx s GLU 537 Cb -0.18 -4.06 0.06 0.00 0.26 0.00 0.00 34.13 30.21 3htx s GLU 537 CO -0.17 -1.23 0.02 -1.54 -0.54 0.00 0.00 175.26 171.80 3htx s SER 538 N 4.36 2.84 0.00 -1.70 1.04 -0.84 -5.00 113.70 114.40 3htx s SER 538 Ca 0.75 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 56.42 3htx s SER 538 Cb -0.29 -0.63 0.00 0.00 0.10 0.00 0.00 66.02 65.20 3htx s SER 538 CO 0.30 -0.28 0.00 1.17 0.98 0.00 0.00 173.24 175.41 3htx n LYS 539 N 5.03 0.00 0.00 4.02 4.81 -1.26 -2.89 118.16 127.86 3htx n LYS 539 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.35 3htx n LYS 539 Cb 0.47 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.52 3htx n LYS 539 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3htx n GLU 547 N 0.00 0.00 -0.08 1.64 1.02 -1.26 -5.00 120.64 116.96 3htx n GLU 547 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 3htx n GLU 547 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.32 3htx n GLU 547 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3htx n LYS 548 N 0.00 1.08 -0.08 3.49 -0.00 -1.26 -2.95 118.16 118.45 3htx n LYS 548 Ca 0.00 0.05 -0.14 0.00 -0.00 0.00 0.00 58.31 58.22 3htx n LYS 548 Cb 0.00 -1.36 -0.11 0.00 -0.00 0.00 0.00 35.03 33.56 3htx n LYS 548 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3htx h ARG 549 N 0.00 0.00 0.01 -1.58 3.08 -1.96 -3.21 114.38 110.72 3htx h ARG 549 Ca -0.39 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.61 3htx h ARG 549 Cb 1.75 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.80 3htx h ARG 549 CO -0.02 0.85 -0.20 0.28 -1.07 0.00 0.00 179.97 179.82 3htx h VAL 550 N -1.00 1.62 0.00 2.04 2.07 -1.98 -3.41 116.25 115.59 3htx h VAL 550 Ca -0.09 -2.07 -0.14 0.00 0.82 0.00 0.00 66.70 65.22 3htx h VAL 550 Cb 0.95 2.97 -0.02 0.00 -1.52 0.00 0.00 31.29 33.67 3htx h VAL 550 CO -0.05 0.56 -0.89 1.56 0.02 0.00 0.00 177.57 178.76 3htx h GLN 551 N -0.66 0.00 -6.46 1.57 4.20 -1.80 -3.43 115.11 108.53 3htx h GLN 551 Ca -0.03 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.15 3htx h GLN 551 Cb 1.02 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.82 3htx h GLN 551 CO 0.04 0.74 1.02 -1.12 -0.67 0.00 0.00 178.83 178.84 3htx s SER 552 N -6.48 6.57 0.60 1.46 0.01 -0.22 -4.04 113.70 111.61 3htx s SER 552 Ca -0.23 2.53 -0.06 0.00 1.31 0.00 0.00 55.95 59.50 3htx s SER 552 Cb 0.04 -2.56 0.02 0.00 0.21 0.00 0.00 66.02 63.72 3htx s SER 552 CO 0.50 -0.91 0.91 -0.63 0.41 0.00 0.00 173.24 173.52 3htx s ILE 553 N 2.69 3.39 0.63 1.44 1.01 -0.96 -4.15 121.20 125.25 3htx s ILE 553 Ca 0.75 -0.08 -0.15 0.00 0.00 0.00 0.00 60.65 61.17 3htx s ILE 553 Cb -0.41 -3.36 -0.02 0.00 0.01 0.00 0.00 42.46 38.68 3htx s ILE 553 CO 0.33 -0.37 1.07 -0.89 0.00 0.00 0.00 174.94 175.09 3htx s THR 554 N -3.01 3.64 0.12 2.92 2.01 -1.26 -4.95 115.64 115.10 3htx s THR 554 Ca 0.55 0.74 -0.17 0.00 0.31 0.00 0.00 61.69 63.12 3htx s THR 554 Cb -0.11 -3.28 -0.03 0.00 0.01 0.00 0.00 72.50 69.09 3htx s THR 554 CO 0.45 -0.49 1.64 0.78 -0.69 0.00 0.00 174.62 176.30 3htx h ASN 555 N 0.17 0.48 0.34 3.53 2.35 -1.96 -2.94 115.58 117.55 3htx h ASN 555 Ca -0.46 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.09 3htx h ASN 555 Cb 1.23 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.47 3htx h ASN 555 CO 0.56 0.55 0.00 0.61 -1.65 0.00 0.00 177.43 177.50 3htx n GLY 556 N -0.67 -0.97 3.76 2.83 0.00 -1.26 0.45 105.19 109.33 3htx n GLY 556 Ca -0.01 0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 3htx n GLY 556 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3htx s SER 557 N -3.72 5.21 -0.32 1.61 0.01 -1.11 -4.19 113.70 111.19 3htx s SER 557 Ca 0.02 2.32 -0.04 0.00 1.31 0.00 0.00 55.95 59.56 3htx s SER 557 Cb 0.07 -2.59 0.05 0.00 0.21 0.00 0.00 66.02 63.76 3htx s SER 557 CO 0.24 -1.58 0.05 -0.69 0.41 0.00 0.00 173.24 171.68 3htx s VAL 558 N -1.71 3.33 0.12 3.43 1.01 -0.51 -0.88 120.40 125.20 3htx s VAL 558 Ca 0.76 -1.32 -0.23 0.00 0.00 0.00 0.00 61.98 61.19 3htx s VAL 558 Cb -0.28 -2.92 -0.07 0.00 0.00 0.00 0.00 36.38 33.10 3htx s VAL 558 CO 0.33 -0.17 0.69 -0.69 0.00 0.00 0.00 175.10 175.26 3htx s VAL 559 N 1.31 4.53 -0.46 2.92 1.01 -0.51 -1.97 120.40 127.24 3htx s VAL 559 Ca -0.03 1.49 -0.04 0.00 0.00 0.00 0.00 61.98 63.40 3htx s VAL 559 Cb -0.20 -4.04 0.12 0.00 0.00 0.00 0.00 36.38 32.27 3htx s VAL 559 CO 0.00 0.53 0.27 -0.55 0.00 0.00 0.00 175.10 175.36 3htx s SER 560 N -1.11 5.34 0.16 3.32 0.15 -1.19 -0.10 113.70 120.28 3htx s SER 560 Ca 0.33 -2.15 0.10 0.00 0.70 0.00 0.00 55.95 54.93 3htx s SER 560 Cb -0.22 -1.87 -0.04 0.00 -1.71 0.00 0.00 66.02 62.19 3htx s SER 560 CO 0.23 -0.54 -0.18 0.27 1.20 0.00 0.00 173.24 174.22 3htx s ILE 561 N 0.98 2.73 -0.32 6.45 -4.36 0.14 -0.89 121.20 125.93 3htx s ILE 561 Ca 0.09 -1.75 -0.04 0.00 -0.26 0.00 0.00 60.65 58.69 3htx s ILE 561 Cb -0.23 -2.30 0.05 0.00 1.25 0.00 0.00 42.46 41.23 3htx s ILE 561 CO -0.04 -0.04 0.06 0.00 0.24 0.00 0.00 174.94 175.16 3htx s TYR 563 N 1.32 1.90 -0.30 0.00 -0.85 -1.04 0.14 117.35 118.52 3htx s TYR 563 Ca -0.03 -0.73 -0.05 0.00 -0.52 0.00 0.00 57.07 55.74 3htx s TYR 563 Cb -0.20 -2.03 0.19 0.00 0.38 0.00 0.00 41.96 40.30 3htx s TYR 563 CO 0.01 -0.47 0.87 -1.54 -1.52 0.00 0.00 175.55 172.89 3htx s SER 564 N -4.29 -0.88 -0.10 -0.18 1.04 -0.12 -2.91 113.70 106.26 3htx s SER 564 Ca 0.42 0.21 -0.15 0.00 0.48 0.00 0.00 55.95 56.90 3htx s SER 564 Cb -0.03 1.60 -0.05 0.00 0.10 0.00 0.00 66.02 67.65 3htx s SER 564 CO 0.26 -0.16 0.39 -0.22 0.98 0.00 0.00 173.24 174.48 3htx s LEU 565 N 2.91 4.33 -0.02 2.42 2.96 -0.53 -2.16 118.68 128.58 3htx s LEU 565 Ca 0.17 0.75 0.05 0.00 -0.22 0.00 0.00 54.13 54.88 3htx s LEU 565 Cb -0.07 -2.54 -0.01 0.00 0.50 0.00 0.00 46.19 44.07 3htx s LEU 565 CO -0.22 0.14 -0.16 -0.55 -1.32 0.00 0.00 176.35 174.24 3htx s SER 566 N 0.03 1.89 -0.05 3.68 0.15 0.70 -2.07 113.70 118.03 3htx s SER 566 Ca 0.22 -0.29 0.04 0.00 0.70 0.00 0.00 55.95 56.62 3htx s SER 566 Cb -0.15 -0.30 -0.02 0.00 -1.71 0.00 0.00 66.02 63.84 3htx s SER 566 CO 0.09 0.18 -0.18 -0.22 1.20 0.00 0.00 173.24 174.30 3htx s LEU 567 N -0.25 2.48 -0.09 3.45 2.96 0.01 0.20 118.68 127.44 3htx s LEU 567 Ca 0.03 -0.32 -0.33 0.00 -0.22 0.00 0.00 54.13 53.30 3htx s LEU 567 Cb -0.07 -1.49 0.14 0.00 0.50 0.00 0.00 46.19 45.27 3htx s LEU 567 CO 0.00 0.30 1.36 0.00 -1.32 0.00 0.00 176.35 176.70 3htx s ALA 568 N -0.48 -2.35 -0.24 5.97 0.00 -0.52 -1.60 121.76 122.54 3htx s ALA 568 Ca 0.06 1.00 -0.29 0.00 0.00 0.00 0.00 51.96 52.73 3htx s ALA 568 Cb -0.12 0.19 0.01 0.00 0.00 0.00 0.00 23.12 23.20 3htx s ALA 568 CO 0.01 -0.98 1.11 0.08 0.00 0.00 0.00 175.76 175.99 3htx s VAL 569 N -2.20 4.52 -0.05 0.00 1.01 -1.26 -1.87 120.40 120.56 3htx s VAL 569 Ca 0.14 1.82 0.00 0.00 0.00 0.00 0.00 61.98 63.94 3htx s VAL 569 Cb 0.05 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 3htx s VAL 569 CO -0.05 -0.26 -0.04 0.47 0.00 0.00 0.00 175.10 175.22 3htx n ASP 570 N 6.59 3.39 -3.27 3.32 8.00 -1.26 -4.73 116.55 128.59 3htx n ASP 570 Ca 0.13 -0.02 -0.25 0.00 0.71 0.00 0.00 54.79 55.36 3htx n ASP 570 Cb 0.46 -0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.45 3htx n ASP 570 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 3htx n PRO 571 N -2.68 1.49 0.10 -0.24 -0.04 -1.26 -4.54 135.00 127.84 3htx n PRO 571 Ca -0.08 -1.37 0.17 0.00 -0.04 0.00 0.00 63.50 62.18 3htx n PRO 571 Cb 0.59 -2.49 0.72 0.00 -0.04 0.00 0.00 33.50 32.27 3htx n PRO 571 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3htx h GLU 572 N 7.16 0.00 0.00 0.54 5.08 -1.96 -3.49 114.58 121.92 3htx h GLU 572 Ca 0.38 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.74 3htx h GLU 572 Cb 0.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3htx h GLU 572 CO 1.53 0.00 -0.18 0.66 -1.00 0.00 0.00 179.01 180.02 3htx n TYR 573 N -4.24 0.00 0.00 4.33 4.02 -1.26 -5.19 117.16 114.82 3htx n TYR 573 Ca 0.05 -0.95 0.00 0.00 -0.01 0.00 0.00 57.90 56.99 3htx n TYR 573 Cb 0.44 -0.16 0.00 0.00 -0.02 0.00 0.00 39.34 39.61 3htx n TYR 573 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 3htx n GLU 599 N -1.16 0.00 0.00 -0.72 0.00 -1.26 -5.23 120.64 112.27 3htx n GLU 599 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.31 3htx n GLU 599 Cb 0.67 0.00 0.03 0.00 0.00 0.00 0.00 31.44 32.14 3htx n GLU 599 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 3htx n SER 600 N -1.85 0.00 -0.07 -1.84 3.41 -1.26 -2.91 113.62 109.10 3htx n SER 600 Ca 0.00 0.08 -0.07 0.00 -0.26 0.00 0.00 58.87 58.62 3htx n SER 600 Cb 0.00 -0.11 -0.10 0.00 -0.26 0.00 0.00 64.21 63.74 3htx n SER 600 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3htx n SER 601 N -1.11 1.81 -3.52 4.04 3.41 -1.26 -4.53 113.62 112.46 3htx n SER 601 Ca 0.01 -0.01 -0.08 0.00 -0.26 0.00 0.00 58.87 58.52 3htx n SER 601 Cb 0.00 0.72 -0.09 0.00 -0.26 0.00 0.00 64.21 64.59 3htx n SER 601 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3htx s VAL 602 N -2.32 -0.64 -0.10 -3.33 1.01 -1.15 -4.09 120.40 109.79 3htx s VAL 602 Ca -0.08 0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.98 3htx s VAL 602 Cb 0.04 -0.73 0.02 0.00 0.00 0.00 0.00 36.38 35.71 3htx s VAL 602 CO 0.53 -0.01 -0.13 -0.70 0.00 0.00 0.00 175.10 174.80 3htx s GLU 603 N 2.59 1.91 0.20 2.72 2.12 -0.63 -4.78 118.70 122.85 3htx s GLU 603 Ca 0.05 -0.45 -0.30 0.00 0.36 0.00 0.00 54.97 54.63 3htx s GLU 603 Cb -0.13 -1.67 -0.08 0.00 0.26 0.00 0.00 34.13 32.50 3htx s GLU 603 CO -0.14 -0.08 1.18 -1.25 -0.54 0.00 0.00 175.26 174.42 3htx s PRO 604 N 1.05 4.52 0.00 4.30 0.04 -1.26 -0.81 135.00 142.84 3htx s PRO 604 Ca -0.06 1.86 0.00 0.00 0.04 0.00 0.00 61.00 62.84 3htx s PRO 604 Cb -0.15 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.16 3htx s PRO 604 CO -0.01 -0.03 0.00 -0.89 0.04 0.00 0.00 177.00 176.11 3htx n ILE 605 N 2.23 0.00 -4.09 0.56 5.41 -0.88 -4.87 119.36 117.71 3htx n ILE 605 Ca 0.03 0.16 -0.14 0.00 1.00 0.00 0.00 62.75 63.80 3htx n ILE 605 Cb 0.45 -1.10 -0.12 0.00 -0.71 0.00 0.00 39.64 38.16 3htx n ILE 605 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 3htx s GLU 606 N -0.42 0.60 -0.18 0.38 -1.05 -1.24 -4.58 118.70 112.21 3htx s GLU 606 Ca 0.00 -0.79 -0.13 0.00 -0.15 0.00 0.00 54.97 53.89 3htx s GLU 606 Cb 0.00 -0.43 0.05 0.00 -0.44 0.00 0.00 34.13 33.31 3htx s GLU 606 CO 0.00 0.09 0.46 -1.54 0.95 0.00 0.00 175.26 175.21 3htx s SER 607 N -1.58 -0.53 -0.03 0.83 1.04 -1.26 -1.46 113.70 110.70 3htx s SER 607 Ca -0.08 0.96 0.06 0.00 0.48 0.00 0.00 55.95 57.37 3htx s SER 607 Cb -0.10 0.90 -0.02 0.00 0.10 0.00 0.00 66.02 66.90 3htx s SER 607 CO 0.01 -0.18 -0.21 0.20 0.98 0.00 0.00 173.24 174.04 3htx s ASN 608 N 0.85 3.44 0.06 7.02 0.01 -1.14 -4.98 114.94 120.19 3htx s ASN 608 Ca -0.05 -0.36 0.25 0.00 -0.71 0.00 0.00 52.86 51.99 3htx s ASN 608 Cb -0.06 -0.56 0.51 0.00 0.41 0.00 0.00 41.25 41.55 3htx s ASN 608 CO -0.07 0.33 1.43 -1.84 -1.51 0.00 0.00 177.10 175.44 3htx n GLU 609 N 2.41 0.13 -3.58 -0.60 0.28 -1.26 -2.49 120.64 115.53 3htx n GLU 609 Ca -0.17 0.04 -0.01 0.00 -0.16 0.00 0.00 57.16 56.86 3htx n GLU 609 Cb 0.51 -1.59 -0.05 0.00 1.43 0.00 0.00 31.44 31.75 3htx n GLU 609 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 3htx s GLU 610 N -3.08 0.49 -0.23 3.44 -6.30 -1.26 -4.48 118.70 107.29 3htx s GLU 610 Ca 0.09 1.10 -0.23 0.00 -2.50 0.00 0.00 54.97 53.44 3htx s GLU 610 Cb 0.16 0.52 0.06 0.00 0.00 0.00 0.00 34.13 34.87 3htx s GLU 610 CO 0.69 -0.15 0.64 0.42 0.02 0.00 0.00 175.26 176.88 3htx s ILE 611 N 2.35 0.00 -0.12 -3.70 1.01 -0.87 -5.00 121.20 114.87 3htx s ILE 611 Ca -0.06 -0.01 -0.03 0.00 0.00 0.00 0.00 60.65 60.55 3htx s ILE 611 Cb -0.08 -0.89 -0.03 0.00 0.01 0.00 0.00 42.46 41.47 3htx s ILE 611 CO -0.18 -0.00 -0.01 -1.61 0.00 0.00 0.00 174.94 173.14 3htx s GLU 612 N 0.26 3.34 -0.04 2.79 2.02 -1.25 -0.68 118.70 125.14 3htx s GLU 612 Ca -0.01 -0.45 0.02 0.00 0.02 0.00 0.00 54.97 54.56 3htx s GLU 612 Cb -0.04 -2.88 0.01 0.00 0.10 0.00 0.00 34.13 31.32 3htx s GLU 612 CO 0.01 0.48 -0.09 -0.06 0.02 0.00 0.00 175.26 175.62 3htx s PHE 613 N -0.27 1.05 0.60 1.61 0.40 0.86 -4.94 117.98 117.29 3htx s PHE 613 Ca 0.06 -0.31 -0.20 0.00 -0.60 0.00 0.00 56.93 55.89 3htx s PHE 613 Cb -0.12 -0.78 -0.03 0.00 0.51 0.00 0.00 43.02 42.60 3htx s PHE 613 CO 0.02 -0.16 1.32 -1.21 0.70 0.00 0.00 175.22 175.89 3htx s GLU 614 N 0.45 2.81 -0.04 0.44 2.02 -1.26 -1.42 118.70 121.69 3htx s GLU 614 Ca -0.08 2.12 0.19 0.00 0.02 0.00 0.00 54.97 57.23 3htx s GLU 614 Cb -0.12 -2.01 -0.30 0.00 0.10 0.00 0.00 34.13 31.81 3htx s GLU 614 CO 0.01 -1.41 0.39 0.28 0.02 0.00 0.00 175.26 174.55 3htx n VAL 615 N -1.54 0.11 0.05 2.63 0.31 -0.06 -4.45 118.33 115.39 3htx n VAL 615 Ca 0.14 -0.47 -0.20 0.00 -0.01 0.00 0.00 64.34 63.79 3htx n VAL 615 Cb 0.47 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.25 3htx n VAL 615 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3htx h GLY 616 N 3.56 0.35 -1.07 2.92 0.00 -0.25 -3.46 103.07 105.12 3htx h GLY 616 Ca -0.04 -0.88 -0.46 0.00 0.00 0.00 0.00 47.33 45.95 3htx h GLY 616 CO 0.00 0.77 0.26 -0.51 0.00 0.00 0.00 176.54 177.07 3htx s THR 617 N -2.43 2.19 0.00 4.70 -4.23 -1.26 -4.92 115.64 109.69 3htx s THR 617 Ca -0.14 -0.24 -0.03 0.00 -1.18 0.00 0.00 61.69 60.10 3htx s THR 617 Cb 0.01 -2.94 -0.15 0.00 1.34 0.00 0.00 72.50 70.76 3htx s THR 617 CO 0.83 0.00 2.43 0.61 -0.54 0.00 0.00 174.62 177.95 3htx n GLY 618 N -3.09 2.32 0.29 3.99 0.00 -1.26 -4.44 105.19 103.00 3htx n GLY 618 Ca 0.10 -0.66 0.14 0.00 0.00 0.00 0.00 46.02 45.61 3htx n GLY 618 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3htx h SER 619 N 3.35 0.00 -5.40 1.61 0.87 -1.78 -3.28 113.55 108.92 3htx h SER 619 Ca 0.10 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.51 3htx h SER 619 Cb 1.00 0.00 -0.13 0.00 -0.44 0.00 0.00 62.40 62.83 3htx h SER 619 CO 0.23 0.03 -0.42 0.00 -0.53 0.00 0.00 176.83 176.14 3htx s MET 620 N -4.54 1.24 0.13 2.24 0.23 -1.26 -1.41 119.30 115.92 3htx s MET 620 Ca -0.04 -1.39 -0.35 0.00 -1.03 0.00 0.00 55.69 52.87 3htx s MET 620 Cb 0.15 0.34 -0.16 0.00 -1.53 0.00 0.00 34.83 33.63 3htx s MET 620 CO 0.56 -0.44 1.30 -1.71 -2.03 0.00 0.00 175.02 172.69 3htx n ASN 621 N -0.26 1.67 -0.05 -1.18 5.15 -0.86 -4.70 115.26 115.03 3htx n ASN 621 Ca -0.02 1.13 -0.14 0.00 -0.60 0.00 0.00 54.58 54.94 3htx n ASN 621 Cb 0.64 -1.22 -0.09 0.00 -0.53 0.00 0.00 39.78 38.57 3htx n ASN 621 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 3htx h PRO 622 N 4.21 -0.49 -0.76 1.20 0.11 -1.95 -1.44 132.00 132.88 3htx h PRO 622 Ca -0.46 0.03 0.22 0.00 0.11 0.00 0.00 66.00 65.91 3htx h PRO 622 Cb 1.33 0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.52 3htx h PRO 622 CO 0.76 -0.33 0.75 0.45 -0.21 0.00 0.00 178.00 179.42 3htx h HIS 623 N -0.51 0.00 -0.00 0.65 3.86 -2.02 0.74 115.15 117.87 3htx h HIS 623 Ca 0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 3htx h HIS 623 Cb 0.65 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.12 3htx h HIS 623 CO -0.62 0.00 -0.50 -0.89 0.86 0.00 0.00 177.93 176.77 3htx n ILE 624 N -3.69 0.00 0.04 2.45 5.41 -0.56 -4.28 119.36 118.72 3htx n ILE 624 Ca 0.16 -0.02 -0.22 0.00 1.00 0.00 0.00 62.75 63.66 3htx n ILE 624 Cb 1.01 0.35 -0.14 0.00 -0.71 0.00 0.00 39.64 40.14 3htx n ILE 624 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3htx h GLU 625 N 0.21 0.32 0.16 0.38 5.08 0.72 -3.20 114.58 118.25 3htx h GLU 625 Ca 0.00 -0.55 0.01 0.00 -1.00 0.00 0.00 59.36 57.81 3htx h GLU 625 Cb 0.50 0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 3htx h GLU 625 CO 0.00 1.27 -0.49 0.66 -1.00 0.00 0.00 179.01 179.45 3htx h SER 626 N 0.04 -1.44 0.04 1.42 4.64 -1.72 -1.08 113.55 115.45 3htx h SER 626 Ca -0.38 0.15 0.02 0.00 -0.47 0.00 0.00 61.79 61.11 3htx h SER 626 Cb 2.03 0.53 -0.03 0.00 -0.31 0.00 0.00 62.40 64.61 3htx h SER 626 CO 0.12 -0.53 -0.19 -0.33 -0.87 0.00 0.00 176.83 175.03 3htx h GLU 627 N -0.73 -0.32 -0.83 4.77 5.08 -1.76 -2.09 114.58 118.70 3htx h GLU 627 Ca -0.01 0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.53 3htx h GLU 627 Cb 0.72 0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.98 3htx h GLU 627 CO -0.24 -0.22 0.55 0.28 -1.00 0.00 0.00 179.01 178.39 3htx h VAL 628 N -0.34 0.77 0.00 3.13 2.07 -1.51 0.23 116.25 120.61 3htx h VAL 628 Ca 0.04 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 3htx h VAL 628 Cb 0.39 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 3htx h VAL 628 CO -0.15 0.09 -0.04 0.74 0.02 0.00 0.00 177.57 178.23 3htx h THR 629 N 0.47 0.09 -0.61 2.57 2.02 -0.53 -3.18 112.91 113.75 3htx h THR 629 Ca 0.42 -0.73 0.00 0.00 0.77 0.00 0.00 66.41 66.87 3htx h THR 629 Cb 0.92 1.67 0.00 0.00 -1.74 0.00 0.00 68.15 69.00 3htx h THR 629 CO -0.15 0.04 0.00 0.00 0.37 0.00 0.00 175.52 175.77 3htx n GLN 630 N -3.13 2.99 -3.86 6.66 10.64 0.80 -1.05 117.38 130.42 3htx n GLN 630 Ca 0.01 -2.57 -0.25 0.00 -1.83 0.00 0.00 57.00 52.36 3htx n GLN 630 Cb 0.38 -1.58 -0.03 0.00 -0.86 0.00 0.00 30.24 28.16 3htx n GLN 630 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 3htx s MET 631 N -1.25 2.32 -0.05 2.61 -1.94 -1.04 -4.81 119.30 115.14 3htx s MET 631 Ca 0.43 -1.87 0.02 0.00 -1.71 0.00 0.00 55.69 52.56 3htx s MET 631 Cb 0.24 -2.14 -0.03 0.00 2.01 0.00 0.00 34.83 34.91 3htx s MET 631 CO 0.26 -0.41 -0.09 0.99 -0.01 0.00 0.00 175.02 175.76 3htx s THR 632 N -2.66 3.55 -0.25 2.05 2.01 -1.26 -4.64 115.64 114.43 3htx s THR 632 Ca 0.39 -0.60 -0.34 0.00 0.31 0.00 0.00 61.69 61.44 3htx s THR 632 Cb -0.01 -2.46 -0.11 0.00 0.01 0.00 0.00 72.50 69.93 3htx s THR 632 CO 0.23 0.55 2.08 0.52 -0.69 0.00 0.00 174.62 177.31 3htx n VAL 633 N 2.08 0.33 0.00 3.82 0.31 -1.26 0.14 118.33 123.75 3htx n VAL 633 Ca -0.17 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 3htx n VAL 633 Cb 0.53 -1.84 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 3htx n VAL 633 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3htx n GLY 634 N 5.67 1.87 3.75 2.92 0.00 -0.37 -5.00 105.19 114.03 3htx n GLY 634 Ca 0.33 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.02 3htx n GLY 634 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3htx s GLU 635 N -0.15 2.53 0.06 1.61 2.12 0.36 -4.78 118.70 120.45 3htx s GLU 635 Ca 0.00 1.54 0.06 0.00 0.36 0.00 0.00 54.97 56.94 3htx s GLU 635 Cb 0.00 -1.90 -0.03 0.00 0.26 0.00 0.00 34.13 32.46 3htx s GLU 635 CO 0.00 -1.49 -0.18 -0.47 -0.54 0.00 0.00 175.26 172.58 3htx s TYR 636 N -2.19 1.55 0.06 5.30 5.04 -1.26 -1.61 117.35 124.24 3htx s TYR 636 Ca 0.70 -0.38 -0.08 0.00 -2.44 0.00 0.00 57.07 54.86 3htx s TYR 636 Cb -0.24 -0.91 -0.00 0.00 0.35 0.00 0.00 41.96 41.16 3htx s TYR 636 CO 0.43 0.09 0.18 0.00 -1.34 0.00 0.00 175.55 174.90 3htx s ALA 637 N -0.93 -0.25 -0.15 3.97 0.00 -0.76 -5.02 121.76 118.63 3htx s ALA 637 Ca 0.04 -0.46 -0.07 0.00 0.00 0.00 0.00 51.96 51.48 3htx s ALA 637 Cb -0.09 0.35 0.06 0.00 0.00 0.00 0.00 23.12 23.44 3htx s ALA 637 CO 0.02 -0.41 0.34 -1.54 0.00 0.00 0.00 175.76 174.17 3htx s SER 638 N -2.40 -0.22 0.06 0.00 1.04 -1.26 -1.62 113.70 109.30 3htx s SER 638 Ca -0.01 0.75 -0.01 0.00 0.48 0.00 0.00 55.95 57.15 3htx s SER 638 Cb 0.01 0.76 -0.04 0.00 0.10 0.00 0.00 66.02 66.85 3htx s SER 638 CO -0.07 -0.20 -0.02 0.72 0.98 0.00 0.00 173.24 174.65 3htx s PHE 639 N 1.78 0.54 -0.01 5.02 -0.12 -0.57 -4.77 117.98 119.86 3htx s PHE 639 Ca -0.06 -1.07 -0.00 0.00 -0.05 0.00 0.00 56.93 55.75 3htx s PHE 639 Cb -0.10 -0.39 0.01 0.00 -0.63 0.00 0.00 43.02 41.90 3htx s PHE 639 CO -0.11 -0.39 0.01 -1.59 -0.05 0.00 0.00 175.22 173.09 3htx s LYS 640 N -3.93 0.00 -0.39 1.99 -2.85 -1.14 0.31 119.74 113.74 3htx s LYS 640 Ca 0.08 0.04 -0.13 0.00 -1.00 0.00 0.00 55.97 54.96 3htx s LYS 640 Cb 0.08 -0.03 0.02 0.00 -2.06 0.00 0.00 37.83 35.84 3htx s LYS 640 CO -0.09 -0.03 0.25 -1.64 0.10 0.00 0.00 175.35 173.95 3htx s MET 641 N 0.16 2.96 0.41 1.78 -1.94 -0.97 -1.99 119.30 119.72 3htx s MET 641 Ca -0.01 -1.01 0.10 0.00 -1.71 0.00 0.00 55.69 53.06 3htx s MET 641 Cb -0.02 -3.86 0.92 0.00 2.01 0.00 0.00 34.83 33.89 3htx s MET 641 CO -0.00 -0.70 2.01 1.15 -0.01 0.00 0.00 175.02 177.47 3htx h THR 642 N 5.72 1.00 -3.55 2.05 2.02 -1.87 -2.63 112.91 115.64 3htx h THR 642 Ca -0.27 -0.18 -0.78 0.00 0.77 0.00 0.00 66.41 65.96 3htx h THR 642 Cb 1.12 0.44 -0.25 0.00 -1.74 0.00 0.00 68.15 67.72 3htx h THR 642 CO 0.69 0.09 0.28 -2.84 0.37 0.00 0.00 175.52 174.12 3htx s PRO 643 N -5.47 3.70 -0.17 6.66 0.02 -1.26 -4.23 135.00 134.25 3htx s PRO 643 Ca -0.08 -2.47 -0.04 0.00 0.02 0.00 0.00 61.00 58.42 3htx s PRO 643 Cb 0.19 -4.53 -0.04 0.00 0.02 0.00 0.00 34.50 30.13 3htx s PRO 643 CO 0.74 -1.36 0.44 -2.30 -0.33 0.00 0.00 177.00 174.19 3htx n PRO 644 N 4.20 0.00 -0.03 5.54 -0.02 -1.19 -3.78 135.00 139.72 3htx n PRO 644 Ca 0.17 0.00 0.23 0.00 -2.02 0.00 0.00 63.50 61.88 3htx n PRO 644 Cb 0.46 -0.23 0.72 0.00 -0.02 0.00 0.00 33.50 34.43 3htx n PRO 644 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 3htx h ASP 645 N 1.99 0.00 -2.88 2.55 2.03 -1.93 -3.42 116.42 114.76 3htx h ASP 645 Ca -0.00 0.00 -0.51 0.00 -0.73 0.00 0.00 57.03 55.79 3htx h ASP 645 Cb 0.21 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.71 3htx h ASP 645 CO 0.25 0.00 -0.25 0.00 -1.03 0.00 0.00 179.24 178.20 3htx s ALA 646 N -4.88 3.75 0.60 4.15 0.00 -1.26 -4.96 121.76 119.15 3htx s ALA 646 Ca -0.05 -0.81 -0.19 0.00 0.00 0.00 0.00 51.96 50.91 3htx s ALA 646 Cb 0.19 -2.09 -0.03 0.00 0.00 0.00 0.00 23.12 21.20 3htx s ALA 646 CO 0.69 0.25 1.26 0.00 0.00 0.00 0.00 175.76 177.95 3htx s ALA 647 N -2.05 2.53 0.37 0.00 0.00 -1.26 -4.84 121.76 116.51 3htx s ALA 647 Ca 0.40 1.12 0.08 0.00 0.00 0.00 0.00 51.96 53.56 3htx s ALA 647 Cb -0.10 -3.50 0.82 0.00 0.00 0.00 0.00 23.12 20.33 3htx s ALA 647 CO 0.31 -1.33 1.93 0.93 0.00 0.00 0.00 175.76 177.61 3htx h GLU 648 N 0.87 0.66 -0.86 0.00 4.39 -1.97 0.78 114.58 118.45 3htx h GLU 648 Ca -0.51 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.16 3htx h GLU 648 Cb 1.31 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 29.77 3htx h GLU 648 CO 0.55 0.43 0.57 0.00 -1.16 0.00 0.00 179.01 179.40 3htx h ALA 649 N 1.61 1.39 0.00 3.43 0.00 -1.99 0.30 119.26 124.01 3htx h ALA 649 Ca 0.36 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 3htx h ALA 649 Cb 0.48 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3htx h ALA 649 CO -0.13 0.56 -0.39 -0.07 0.00 0.00 0.00 179.25 179.22 3htx h LEU 650 N 1.16 0.00 0.10 0.00 3.38 -1.24 -2.66 115.31 116.05 3htx h LEU 650 Ca 0.32 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.00 3htx h LEU 650 Cb -0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3htx h LEU 650 CO -0.07 0.39 -1.37 0.40 0.09 0.00 0.00 178.44 177.88 3htx h ILE 651 N 0.00 1.33 0.00 1.22 2.04 -0.07 -3.31 117.51 118.73 3htx h ILE 651 Ca -0.00 -2.97 -0.11 0.00 1.00 0.00 0.00 64.86 62.78 3htx h ILE 651 Cb 1.16 2.82 -0.02 0.00 -0.74 0.00 0.00 36.82 40.05 3htx h ILE 651 CO 0.05 0.85 -0.54 -0.07 0.00 0.00 0.00 178.15 178.44 3htx h LEU 652 N 0.06 0.00 -0.83 1.44 3.38 -0.48 -2.60 115.31 116.27 3htx h LEU 652 Ca -0.18 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 3htx h LEU 652 Cb 1.97 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.72 3htx h LEU 652 CO 0.17 0.54 -0.01 0.00 0.09 0.00 0.00 178.44 179.23 3htx h ALA 653 N 1.46 1.00 0.00 1.53 0.00 -1.56 -3.28 119.26 118.41 3htx h ALA 653 Ca -0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3htx h ALA 653 Cb 1.19 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 3htx h ALA 653 CO 0.07 0.01 -1.81 0.28 0.00 0.00 0.00 179.25 177.80 3htx n VAL 654 N -3.10 0.34 -2.42 0.00 0.31 -1.22 -4.71 118.33 107.54 3htx n VAL 654 Ca 0.02 -0.45 -0.42 0.00 -0.01 0.00 0.00 64.34 63.49 3htx n VAL 654 Cb 0.41 -0.12 -0.03 0.00 -0.91 0.00 0.00 33.84 33.18 3htx n VAL 654 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 3htx s GLY 655 N -4.14 2.57 0.20 2.92 0.00 -0.98 -4.77 107.32 103.11 3htx s GLY 655 Ca -0.06 0.88 0.23 0.00 0.00 0.00 0.00 44.72 45.77 3htx s GLY 655 CO 0.63 1.91 1.15 1.48 0.00 0.00 0.00 173.10 178.28 3htx h SER 656 N 5.98 0.00 -2.32 1.64 4.64 -1.87 -3.38 113.55 118.23 3htx h SER 656 Ca -0.43 -0.06 -0.63 0.00 -0.47 0.00 0.00 61.79 60.20 3htx h SER 656 Cb 1.21 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.90 3htx h SER 656 CO 0.77 0.03 -0.43 -0.67 -0.87 0.00 0.00 176.83 175.66 3htx n ASP 657 N -2.55 4.04 -0.23 4.97 -0.08 -1.26 -4.95 116.55 116.49 3htx n ASP 657 Ca 0.01 -3.43 0.27 0.00 -1.51 0.00 0.00 54.79 50.13 3htx n ASP 657 Cb 0.52 -0.74 0.66 0.00 2.34 0.00 0.00 41.12 43.89 3htx n ASP 657 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 3htx h THR 658 N 3.26 0.55 0.00 5.18 2.02 -1.92 -1.85 112.91 120.16 3htx h THR 658 Ca 0.20 -0.05 -0.18 0.00 0.77 0.00 0.00 66.41 67.15 3htx h THR 658 Cb 0.66 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 3htx h THR 658 CO 0.89 0.02 -0.85 0.58 0.37 0.00 0.00 175.52 176.53 3htx h VAL 659 N 0.13 1.56 -0.24 3.16 2.07 -1.97 -1.08 116.25 119.89 3htx h VAL 659 Ca 0.48 -2.77 -0.14 0.00 0.82 0.00 0.00 66.70 65.08 3htx h VAL 659 Cb 1.66 2.52 -0.01 0.00 -1.52 0.00 0.00 31.29 33.94 3htx h VAL 659 CO -0.08 0.80 -0.43 0.03 0.02 0.00 0.00 177.57 177.90 3htx h ARG 660 N 0.04 0.58 -0.39 1.57 3.08 -1.78 -2.33 114.38 115.15 3htx h ARG 660 Ca -0.02 -0.31 -0.03 0.00 0.07 0.00 0.00 59.98 59.68 3htx h ARG 660 Cb 1.49 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.54 3htx h ARG 660 CO 0.12 0.91 0.12 0.82 -1.07 0.00 0.00 179.97 180.87 3htx h ILE 661 N 0.47 1.21 -0.66 2.04 2.04 -1.40 -0.95 117.51 120.27 3htx h ILE 661 Ca 0.03 -0.71 0.06 0.00 1.00 0.00 0.00 64.86 65.25 3htx h ILE 661 Cb 0.95 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 37.93 3htx h ILE 661 CO 0.09 0.25 0.43 0.03 0.00 0.00 0.00 178.15 178.95 3htx h ARG 662 N 0.49 0.65 -0.04 2.37 3.08 -0.96 -0.39 114.38 119.57 3htx h ARG 662 Ca 0.13 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.99 3htx h ARG 662 Cb 0.26 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.17 3htx h ARG 662 CO -0.00 0.43 -0.56 1.03 -1.07 0.00 0.00 179.97 179.80 3htx h SER 663 N 0.67 0.56 0.18 7.04 0.87 -1.03 -2.98 113.55 118.85 3htx h SER 663 Ca 0.28 -0.71 -0.05 0.00 -1.23 0.00 0.00 61.79 60.07 3htx h SER 663 Cb 0.25 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 3htx h SER 663 CO -0.09 1.19 -0.22 -0.07 -0.53 0.00 0.00 176.83 177.11 3htx h LEU 664 N -0.03 0.08 -0.59 2.23 3.38 -0.72 -2.71 115.31 116.96 3htx h LEU 664 Ca -0.06 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 3htx h LEU 664 Cb 1.24 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 3htx h LEU 664 CO 0.11 0.31 -0.67 -0.07 0.09 0.00 0.00 178.44 178.22 3htx h LEU 665 N 0.08 0.22 -0.36 1.67 3.38 -1.12 -3.27 115.31 115.91 3htx h LEU 665 Ca 0.01 -0.14 -0.16 0.00 0.09 0.00 0.00 57.88 57.68 3htx h LEU 665 Cb 0.44 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3htx h LEU 665 CO 0.03 0.82 -0.41 0.77 0.09 0.00 0.00 178.44 179.74 3htx h SER 666 N 0.13 0.99 -2.09 -0.43 4.64 -1.32 -3.43 113.55 112.05 3htx h SER 666 Ca -0.01 -0.48 -0.46 0.00 -0.47 0.00 0.00 61.79 60.36 3htx h SER 666 Cb 1.19 -0.28 0.07 0.00 -0.31 0.00 0.00 62.40 63.07 3htx h SER 666 CO 0.10 1.27 0.07 -1.83 -0.87 0.00 0.00 176.83 175.57 3htx s GLU 667 N -4.34 1.86 -0.31 4.77 -1.05 -1.15 -4.96 118.70 113.53 3htx s GLU 667 Ca -0.11 -1.11 -0.36 0.00 -0.15 0.00 0.00 54.97 53.24 3htx s GLU 667 Cb 0.11 -2.38 -0.12 0.00 -0.44 0.00 0.00 34.13 31.29 3htx s GLU 667 CO 0.88 -1.29 2.07 0.54 0.95 0.00 0.00 175.26 178.42 3htx n ARG 668 N -2.71 1.17 -3.94 -4.83 1.74 -1.26 -4.88 116.66 101.95 3htx n ARG 668 Ca 0.14 0.36 -0.26 0.00 -0.77 0.00 0.00 57.85 57.32 3htx n ARG 668 Cb 0.61 -2.38 -0.03 0.00 -1.02 0.00 0.00 32.46 29.64 3htx n ARG 668 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3htx s PRO 669 N 5.47 3.44 -0.20 5.56 0.04 -1.25 -4.28 135.00 143.78 3htx s PRO 669 Ca 1.06 -0.59 -0.14 0.00 0.04 0.00 0.00 61.00 61.36 3htx s PRO 669 Cb -0.91 -2.96 0.06 0.00 0.04 0.00 0.00 34.50 30.73 3htx s PRO 669 CO 0.53 0.52 0.50 0.00 0.04 0.00 0.00 177.00 178.59 3htx s LEU 671 N 0.91 4.30 -0.30 0.00 1.43 -1.00 -1.45 118.68 122.58 3htx s LEU 671 Ca -0.05 0.43 -0.03 0.00 -1.03 0.00 0.00 54.13 53.44 3htx s LEU 671 Cb -0.06 -2.19 0.04 0.00 0.03 0.00 0.00 46.19 44.02 3htx s LEU 671 CO -0.08 0.25 0.02 0.20 0.23 0.00 0.00 176.35 176.98 3htx s ASN 672 N -0.20 4.90 -0.29 2.29 0.01 0.52 -2.30 114.94 119.89 3htx s ASN 672 Ca 0.13 -1.09 -0.11 0.00 -0.71 0.00 0.00 52.86 51.08 3htx s ASN 672 Cb -0.12 -1.76 -0.04 0.00 0.41 0.00 0.00 41.25 39.73 3htx s ASN 672 CO 0.03 -0.24 0.19 -0.31 -1.51 0.00 0.00 177.10 175.25 3htx s TYR 673 N 1.33 3.21 -0.14 2.20 1.51 0.15 -0.22 117.35 125.40 3htx s TYR 673 Ca -0.02 0.03 0.00 0.00 -1.01 0.00 0.00 57.07 56.07 3htx s TYR 673 Cb -0.19 -2.38 -0.01 0.00 -0.11 0.00 0.00 41.96 39.27 3htx s TYR 673 CO -0.00 -0.20 -0.15 -0.80 -1.11 0.00 0.00 175.55 173.28 3htx s ASN 674 N 1.74 3.78 -0.02 2.29 0.01 -0.92 -1.52 114.94 120.30 3htx s ASN 674 Ca 0.07 -0.41 0.04 0.00 -0.71 0.00 0.00 52.86 51.85 3htx s ASN 674 Cb -0.16 -1.57 -0.01 0.00 0.41 0.00 0.00 41.25 39.92 3htx s ASN 674 CO 0.10 0.13 -0.13 0.27 -1.51 0.00 0.00 177.10 175.96 3htx s ILE 675 N 0.53 1.08 -0.18 0.60 -4.36 -0.64 -0.94 121.20 117.29 3htx s ILE 675 Ca -0.10 -0.56 -0.01 0.00 -0.26 0.00 0.00 60.65 59.73 3htx s ILE 675 Cb -0.16 -0.91 0.00 0.00 1.25 0.00 0.00 42.46 42.64 3htx s ILE 675 CO 0.04 0.31 -0.14 -0.22 0.24 0.00 0.00 174.94 175.17 3htx s LEU 676 N -0.15 2.46 -0.17 0.37 2.96 0.12 -1.82 118.68 122.44 3htx s LEU 676 Ca 0.02 -0.51 -0.29 0.00 -0.22 0.00 0.00 54.13 53.12 3htx s LEU 676 Cb -0.07 -1.58 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 3htx s LEU 676 CO 0.00 0.03 1.19 -0.22 -1.32 0.00 0.00 176.35 176.03 3htx s LEU 677 N 1.16 4.17 0.00 -0.68 2.96 -0.63 -1.44 118.68 124.21 3htx s LEU 677 Ca 0.01 1.61 0.13 0.00 -0.22 0.00 0.00 54.13 55.66 3htx s LEU 677 Cb -0.14 -3.54 0.20 0.00 0.50 0.00 0.00 46.19 43.21 3htx s LEU 677 CO -0.06 -0.72 1.06 0.18 -1.32 0.00 0.00 176.35 175.50 3htx n LEU 678 N 6.39 2.48 0.00 -0.68 4.77 -0.07 -1.24 117.00 128.65 3htx n LEU 678 Ca 0.13 -1.36 0.00 0.00 -0.03 0.00 0.00 56.01 54.76 3htx n LEU 678 Cb 0.45 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 3htx n LEU 678 CO 0.55 0.53 0.00 0.61 -1.33 0.00 0.00 177.39 177.75 3htx n GLY 679 N 0.75 -0.62 3.63 -0.72 0.00 -1.10 -4.90 105.19 102.23 3htx n GLY 679 Ca 0.10 -1.29 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 3htx n GLY 679 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3htx s VAL 680 N -2.00 0.00 -0.11 1.61 1.01 -1.26 -3.17 120.40 116.47 3htx s VAL 680 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 61.98 61.99 3htx s VAL 680 Cb 0.00 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.40 3htx s VAL 680 CO 0.00 0.00 -0.14 -0.54 0.00 0.00 0.00 175.10 174.42 3htx s LYS 681 N 0.48 2.10 0.96 2.72 1.02 -0.83 -4.98 119.74 121.21 3htx s LYS 681 Ca -0.00 -0.50 -0.11 0.00 0.02 0.00 0.00 55.97 55.37 3htx s LYS 681 Cb -0.05 -1.86 0.14 0.00 -0.52 0.00 0.00 37.83 35.55 3htx s LYS 681 CO -0.03 -0.12 0.95 0.41 -0.92 0.00 0.00 175.35 175.64 3htx n GLY 682 N 4.41 -0.97 3.71 -3.33 0.00 -1.26 -1.42 105.19 106.33 3htx n GLY 682 Ca -0.18 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 3htx n GLY 682 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3htx n PRO 683 N -3.75 2.13 -4.07 1.61 -0.04 -1.26 -4.73 135.00 124.89 3htx n PRO 683 Ca 0.10 0.75 -0.29 0.00 -0.04 0.00 0.00 63.50 64.02 3htx n PRO 683 Cb 0.53 -2.39 -0.06 0.00 -0.04 0.00 0.00 33.50 31.53 3htx n PRO 683 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3htx s SER 684 N -0.36 5.47 0.46 3.54 1.04 -1.26 -5.00 113.70 117.58 3htx s SER 684 Ca 0.57 -0.07 0.05 0.00 0.48 0.00 0.00 55.95 56.98 3htx s SER 684 Cb -0.53 -1.44 -0.04 0.00 0.10 0.00 0.00 66.02 64.11 3htx s SER 684 CO 0.61 0.13 0.07 -0.70 0.98 0.00 0.00 173.24 174.33 3htx s GLU 685 N -2.65 2.11 -0.15 4.02 2.12 -1.26 -5.08 118.70 117.81 3htx s GLU 685 Ca 0.30 -2.16 -0.02 0.00 0.36 0.00 0.00 54.97 53.45 3htx s GLU 685 Cb -0.11 -1.69 -0.02 0.00 0.26 0.00 0.00 34.13 32.56 3htx s GLU 685 CO 0.22 -0.21 -0.09 -2.00 -0.54 0.00 0.00 175.26 172.64 3htx s GLU 686 N -3.84 3.48 -0.54 4.30 2.12 -1.26 -5.06 118.70 117.90 3htx s GLU 686 Ca 0.26 -0.62 -0.27 0.00 0.36 0.00 0.00 54.97 54.70 3htx s GLU 686 Cb 0.05 -2.78 -0.01 0.00 0.26 0.00 0.00 34.13 31.64 3htx s GLU 686 CO 0.14 0.17 1.77 0.50 -0.54 0.00 0.00 175.26 177.30 3htx s ARG 687 N 0.51 2.89 -0.19 4.30 3.52 -1.26 -4.97 118.95 123.75 3htx s ARG 687 Ca -0.06 0.76 -0.06 0.00 -0.13 0.00 0.00 55.73 56.23 3htx s ARG 687 Cb -0.15 -4.30 -0.03 0.00 -1.56 0.00 0.00 34.95 28.90 3htx s ARG 687 CO 0.03 -2.41 0.04 -1.64 -0.81 0.00 0.00 175.30 170.51 3htx s MET 688 N 6.49 3.81 -0.13 5.12 -1.94 -1.26 -5.05 119.30 126.34 3htx s MET 688 Ca 0.67 -0.43 -0.29 0.00 -1.71 0.00 0.00 55.69 53.93 3htx s MET 688 Cb -0.14 -3.16 -0.01 0.00 2.01 0.00 0.00 34.83 33.52 3htx s MET 688 CO 0.24 0.14 1.12 -1.21 -0.01 0.00 0.00 175.02 175.30 3htx s GLU 689 N 0.70 4.33 -0.19 2.03 2.02 -1.26 -4.99 118.70 121.35 3htx s GLU 689 Ca 0.02 1.52 -0.03 0.00 0.02 0.00 0.00 54.97 56.50 3htx s GLU 689 Cb -0.14 -3.61 -0.01 0.00 0.10 0.00 0.00 34.13 30.47 3htx s GLU 689 CO 0.02 -0.49 -0.05 0.00 0.02 0.00 0.00 175.26 174.76 3htx s ALA 690 N 2.58 2.84 -1.04 5.21 0.00 -1.26 -5.04 121.76 125.05 3htx s ALA 690 Ca 0.51 -1.04 -0.23 0.00 0.00 0.00 0.00 51.96 51.20 3htx s ALA 690 Cb -0.20 -1.60 -0.02 0.00 0.00 0.00 0.00 23.12 21.30 3htx s ALA 690 CO 0.16 -0.16 1.80 0.00 0.00 0.00 0.00 175.76 177.56 3htx s ALA 691 N 1.02 2.14 0.18 0.00 0.00 -1.26 -4.88 121.76 118.96 3htx s ALA 691 Ca 0.00 -1.99 -0.21 0.00 0.00 0.00 0.00 51.96 49.76 3htx s ALA 691 Cb -0.15 -4.59 0.12 0.00 0.00 0.00 0.00 23.12 18.51 3htx s ALA 691 CO 0.00 -4.44 1.59 0.35 0.00 0.00 0.00 175.76 173.26 3htx h PHE 692 N 10.16 -0.89 -3.36 0.00 3.57 -1.99 -3.43 116.94 121.00 3htx h PHE 692 Ca 0.19 0.07 -0.55 0.00 3.53 0.00 0.00 57.97 61.20 3htx h PHE 692 Cb 0.98 0.47 -0.04 0.00 2.79 0.00 0.00 35.95 40.15 3htx h PHE 692 CO 1.26 -0.38 0.00 -0.06 -2.23 0.00 0.00 178.31 176.90 3htx s PHE 693 N -6.01 3.73 0.00 0.41 0.40 -1.26 -5.02 117.98 110.22 3htx s PHE 693 Ca -0.14 1.27 0.00 0.00 -0.60 0.00 0.00 56.93 57.46 3htx s PHE 693 Cb 0.16 -2.51 0.00 0.00 0.51 0.00 0.00 43.02 41.17 3htx s PHE 693 CO 0.69 0.48 0.77 1.63 0.70 0.00 0.00 175.22 179.49 3htx n LYS 694 N 1.24 0.00 -3.46 0.44 5.02 -1.26 -3.14 118.16 116.99 3htx n LYS 694 Ca -0.07 0.72 -0.37 0.00 -2.02 0.00 0.00 58.31 56.57 3htx n LYS 694 Cb 0.51 -1.27 -0.06 0.00 -0.02 0.00 0.00 35.03 34.19 3htx n LYS 694 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3htx s PRO 695 N -2.07 4.16 -0.04 1.97 0.04 -1.26 -4.99 135.00 132.81 3htx s PRO 695 Ca 0.00 0.30 -0.40 0.00 0.04 0.00 0.00 61.00 60.94 3htx s PRO 695 Cb 0.00 -3.36 -0.20 0.00 0.04 0.00 0.00 34.50 30.98 3htx s PRO 695 CO 0.00 0.36 1.08 -2.30 0.04 0.00 0.00 177.00 176.19 3htx n PRO 696 N 3.04 0.00 -0.20 0.56 -0.02 -1.19 -4.62 135.00 132.57 3htx n PRO 696 Ca -0.11 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.24 3htx n PRO 696 Cb 0.52 -1.46 -0.09 0.00 -0.02 0.00 0.00 33.50 32.44 3htx n PRO 696 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3htx h LEU 697 N 3.07 -1.88 -0.70 2.45 5.85 -1.94 0.62 115.31 122.78 3htx h LEU 697 Ca -0.49 0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.49 3htx h LEU 697 Cb 1.39 0.79 0.00 0.00 0.37 0.00 0.00 40.66 43.21 3htx h LEU 697 CO 0.66 -0.36 0.10 -0.24 -0.34 0.00 0.00 178.44 178.25 3htx n SER 698 N -5.36 0.27 0.04 1.25 2.88 -1.26 0.57 113.62 112.01 3htx n SER 698 Ca -0.02 0.57 0.11 0.00 -1.33 0.00 0.00 58.87 58.20 3htx n SER 698 Cb 0.33 -0.58 -0.06 0.00 -0.75 0.00 0.00 64.21 63.14 3htx n SER 698 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3htx n LYS 699 N -1.85 0.51 0.16 -1.46 5.02 0.21 -4.06 118.16 116.68 3htx n LYS 699 Ca -0.01 -0.04 0.11 0.00 -2.02 0.00 0.00 58.31 56.36 3htx n LYS 699 Cb 0.12 -1.64 0.08 0.00 -0.02 0.00 0.00 35.03 33.57 3htx n LYS 699 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 3htx h GLN 700 N 0.00 0.00 0.00 1.97 4.20 0.11 -3.28 115.11 118.11 3htx h GLN 700 Ca 0.00 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.58 3htx h GLN 700 Cb 0.91 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.67 3htx h GLN 700 CO 0.00 0.01 -0.61 0.00 -0.67 0.00 0.00 178.83 177.56 3htx h ARG 701 N 0.00 0.00 -0.41 1.46 3.08 -1.61 -2.68 114.38 114.22 3htx h ARG 701 Ca -0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 3htx h ARG 701 Cb 1.02 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.05 3htx h ARG 701 CO 0.00 0.61 -0.19 0.28 -1.07 0.00 0.00 179.97 179.61 3htx h VAL 702 N 0.00 1.27 0.51 2.04 2.07 -1.74 -1.60 116.25 118.79 3htx h VAL 702 Ca -0.01 -1.29 -0.02 0.00 0.82 0.00 0.00 66.70 66.20 3htx h VAL 702 Cb 1.12 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 32.04 3htx h VAL 702 CO 0.08 0.43 -0.28 -0.33 0.02 0.00 0.00 177.57 177.50 3htx h GLU 703 N 0.70 -0.71 -0.94 1.57 4.39 -1.59 0.05 114.58 118.05 3htx h GLU 703 Ca 0.10 0.05 0.10 0.00 0.34 0.00 0.00 59.36 59.95 3htx h GLU 703 Cb 0.69 0.16 -0.08 0.00 -0.10 0.00 0.00 28.75 29.43 3htx h GLU 703 CO 0.05 -0.47 0.58 -0.92 -1.16 0.00 0.00 179.01 177.09 3htx h TYR 704 N -0.73 1.05 0.31 4.33 3.20 -1.41 -0.54 116.97 123.18 3htx h TYR 704 Ca -0.06 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.82 3htx h TYR 704 Cb 0.58 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.52 3htx h TYR 704 CO -0.07 0.44 -0.15 0.00 -1.64 0.00 0.00 178.16 176.74 3htx h ALA 705 N 1.50 -0.42 -0.26 1.82 0.00 -0.96 -2.28 119.26 118.66 3htx h ALA 705 Ca 0.45 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 3htx h ALA 705 Cb 0.40 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3htx h ALA 705 CO -0.25 -0.61 -0.15 -0.07 0.00 0.00 0.00 179.25 178.17 3htx h LEU 706 N -0.67 0.44 -0.51 0.00 3.38 -0.74 0.36 115.31 117.57 3htx h LEU 706 Ca -0.04 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 3htx h LEU 706 Cb 0.47 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3htx h LEU 706 CO 0.07 0.62 0.21 0.11 0.09 0.00 0.00 178.44 179.54 3htx h LYS 707 N 0.42 0.75 -0.16 1.13 1.57 -1.12 0.30 116.57 119.47 3htx h LYS 707 Ca 0.08 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 3htx h LYS 707 Cb 0.51 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 3htx h LYS 707 CO 0.03 0.66 -0.06 0.45 -0.57 0.00 0.00 179.45 179.96 3htx h HIS 708 N 0.68 0.36 -0.80 -1.35 3.86 -0.81 -0.75 115.15 116.33 3htx h HIS 708 Ca 0.17 -0.08 0.02 0.00 -1.16 0.00 0.00 60.37 59.31 3htx h HIS 708 Cb 0.18 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.52 3htx h HIS 708 CO 0.00 0.62 0.53 0.82 0.86 0.00 0.00 177.93 180.76 3htx h ILE 709 N -0.00 1.18 0.00 2.45 2.04 0.02 -2.41 117.51 120.79 3htx h ILE 709 Ca 0.04 -0.36 -0.05 0.00 1.00 0.00 0.00 64.86 65.48 3htx h ILE 709 Cb 0.51 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 3htx h ILE 709 CO 0.02 0.19 -0.30 0.03 0.00 0.00 0.00 178.15 178.09 3htx h ARG 710 N 1.06 0.00 0.00 2.37 3.08 -0.42 -3.10 114.38 117.37 3htx h ARG 710 Ca 0.30 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.34 3htx h ARG 710 Cb -0.08 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 3htx h ARG 710 CO -0.08 0.23 -0.04 0.93 -1.07 0.00 0.00 179.97 179.94 3htx h GLU 711 N 0.00 0.00 -6.26 0.04 5.08 -0.62 -3.44 114.58 109.38 3htx h GLU 711 Ca -0.01 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 3htx h GLU 711 Cb 1.19 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.32 3htx h GLU 711 CO 0.03 0.04 -0.70 -1.54 -1.00 0.00 0.00 179.01 175.84 3htx s SER 712 N -5.68 4.16 0.06 1.42 1.04 -1.13 -5.08 113.70 108.49 3htx s SER 712 Ca -0.01 -0.76 -0.25 0.00 0.48 0.00 0.00 55.95 55.41 3htx s SER 712 Cb 0.11 -0.63 -0.06 0.00 0.10 0.00 0.00 66.02 65.54 3htx s SER 712 CO 0.52 0.03 0.76 -0.94 0.98 0.00 0.00 173.24 174.59 3htx s SER 713 N -3.45 7.22 -0.22 7.02 1.04 -1.26 -4.76 113.70 119.30 3htx s SER 713 Ca 0.30 1.46 -0.28 0.00 0.48 0.00 0.00 55.95 57.91 3htx s SER 713 Cb -0.06 -2.47 0.13 0.00 0.10 0.00 0.00 66.02 63.72 3htx s SER 713 CO 0.17 0.05 1.02 0.00 0.98 0.00 0.00 173.24 175.47 3htx s ALA 714 N -0.24 -1.96 -0.21 5.32 0.00 -1.26 -5.02 121.76 118.39 3htx s ALA 714 Ca 0.38 1.71 -0.14 0.00 0.00 0.00 0.00 51.96 53.91 3htx s ALA 714 Cb -0.21 -1.05 -0.08 0.00 0.00 0.00 0.00 23.12 21.78 3htx s ALA 714 CO 0.23 -0.27 -0.32 -1.13 0.00 0.00 0.00 175.76 174.27 3htx n SER 715 N 1.38 1.80 -4.97 0.00 3.41 -1.26 -1.90 113.62 112.08 3htx n SER 715 Ca -0.11 0.31 -0.21 0.00 -0.26 0.00 0.00 58.87 58.59 3htx n SER 715 Cb 0.57 -0.72 -0.02 0.00 -0.26 0.00 0.00 64.21 63.78 3htx n SER 715 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3htx s THR 716 N -2.61 5.25 -0.24 6.66 -4.23 -1.25 0.18 115.64 119.40 3htx s THR 716 Ca -0.31 -0.99 -0.13 0.00 -1.18 0.00 0.00 61.69 59.09 3htx s THR 716 Cb 0.09 -3.85 0.08 0.00 1.34 0.00 0.00 72.50 70.16 3htx s THR 716 CO 0.42 -0.32 0.57 -0.22 -0.54 0.00 0.00 174.62 174.53 3htx s LEU 717 N -3.96 -0.65 -0.13 4.79 2.96 0.13 -3.89 118.68 117.94 3htx s LEU 717 Ca 0.34 1.27 -0.02 0.00 -0.22 0.00 0.00 54.13 55.50 3htx s LEU 717 Cb -0.09 1.95 -0.03 0.00 0.50 0.00 0.00 46.19 48.53 3htx s LEU 717 CO 0.29 -0.22 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.35 3htx s VAL 718 N 1.72 3.70 -0.69 1.68 1.01 -0.78 -0.47 120.40 126.57 3htx s VAL 718 Ca -0.09 -0.44 -0.00 0.00 0.00 0.00 0.00 61.98 61.45 3htx s VAL 718 Cb -0.07 -2.58 0.17 0.00 0.00 0.00 0.00 36.38 33.90 3htx s VAL 718 CO -0.17 0.53 0.51 -0.62 0.00 0.00 0.00 175.10 175.35 3htx s ASP 719 N 0.04 5.22 -0.20 3.32 2.15 -0.40 -0.41 116.67 126.38 3htx s ASP 719 Ca -0.01 -3.29 -0.29 0.00 0.43 0.00 0.00 52.55 49.40 3htx s ASP 719 Cb -0.14 -1.80 -0.04 0.00 -0.30 0.00 0.00 42.92 40.64 3htx s ASP 719 CO 0.03 -0.25 1.98 -0.36 -0.17 0.00 0.00 175.17 176.40 3htx s PHE 720 N -0.69 1.49 0.00 -5.34 0.40 -0.97 -2.83 117.98 110.05 3htx s PHE 720 Ca 0.21 0.40 0.00 0.00 -0.60 0.00 0.00 56.93 56.95 3htx s PHE 720 Cb -0.15 -4.03 0.00 0.00 0.51 0.00 0.00 43.02 39.35 3htx s PHE 720 CO -0.07 -3.86 0.00 0.41 0.70 0.00 0.00 175.22 172.40 3htx n GLY 721 N 5.30 0.51 0.09 4.36 0.00 -0.03 -4.30 105.19 111.12 3htx n GLY 721 Ca 0.25 -0.31 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 3htx n GLY 721 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3htx n GLY 723 N -0.08 1.45 0.30 0.00 0.00 -1.26 -2.42 105.19 103.19 3htx n GLY 723 Ca -0.07 0.44 0.11 0.00 0.00 0.00 0.00 46.02 46.51 3htx n GLY 723 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3htx h SER 724 N 0.00 -0.12 0.00 1.61 4.64 -1.89 -3.36 113.55 114.43 3htx h SER 724 Ca 0.00 0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3htx h SER 724 Cb 0.00 0.31 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3htx h SER 724 CO 0.00 -0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.39 3htx n GLY 725 N -1.40 0.50 0.36 -0.77 0.00 -1.01 -3.84 105.19 99.04 3htx n GLY 725 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 3htx n GLY 725 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3htx h SER 726 N 0.00 -1.22 -0.46 1.61 4.64 -1.89 0.12 113.55 116.35 3htx h SER 726 Ca 0.00 0.21 0.08 0.00 -0.47 0.00 0.00 61.79 61.61 3htx h SER 726 Cb 0.00 0.56 -0.07 0.00 -0.31 0.00 0.00 62.40 62.58 3htx h SER 726 CO 0.00 -0.34 0.04 0.25 -0.87 0.00 0.00 176.83 175.92 3htx h LEU 727 N -0.27 -0.10 -1.16 5.97 5.85 -1.95 0.18 115.31 123.83 3htx h LEU 727 Ca 0.17 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 3htx h LEU 727 Cb 0.56 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.71 3htx h LEU 727 CO -0.57 -0.02 0.29 -0.07 -0.34 0.00 0.00 178.44 177.73 3htx h LEU 728 N 0.16 0.79 0.00 2.25 3.38 -1.81 -1.11 115.31 118.98 3htx h LEU 728 Ca 0.23 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3htx h LEU 728 Cb 0.32 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3htx h LEU 728 CO -0.34 0.68 0.00 -0.67 0.09 0.00 0.00 178.44 178.20 3htx n ASP 729 N -4.35 0.00 -0.47 -0.43 -0.08 0.36 -1.75 116.55 109.83 3htx n ASP 729 Ca 0.06 0.83 0.40 0.00 -1.51 0.00 0.00 54.79 54.56 3htx n ASP 729 Cb 0.13 -0.40 0.67 0.00 2.34 0.00 0.00 41.12 43.87 3htx n ASP 729 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 3htx n SER 730 N -1.69 0.20 0.15 1.67 7.64 0.42 -0.02 113.62 122.00 3htx n SER 730 Ca 0.00 1.35 -0.13 0.00 1.01 0.00 0.00 58.87 61.10 3htx n SER 730 Cb 0.00 -0.66 -0.08 0.00 -1.01 0.00 0.00 64.21 62.46 3htx n SER 730 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 3htx h LEU 731 N 0.00 -0.33 0.00 -3.43 5.85 -1.12 -2.81 115.31 113.47 3htx h LEU 731 Ca 0.87 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 59.42 3htx h LEU 731 Cb 2.81 0.09 0.00 0.00 0.37 0.00 0.00 40.66 43.93 3htx h LEU 731 CO -0.44 0.01 0.00 -0.11 -0.34 0.00 0.00 178.44 177.55 3htx n LEU 732 N -5.13 0.00 0.12 2.25 7.94 0.97 -2.92 117.00 120.23 3htx n LEU 732 Ca -0.10 0.27 0.04 0.00 -1.11 0.00 0.00 56.01 55.12 3htx n LEU 732 Cb 0.25 -0.27 0.02 0.00 0.53 0.00 0.00 43.42 43.95 3htx n LEU 732 CO 0.31 -0.18 0.29 0.44 -1.11 0.00 0.00 177.39 177.14 3htx h ASP 733 N 0.00 0.00 -3.59 1.96 3.32 -1.18 -3.44 116.42 113.48 3htx h ASP 733 Ca 0.00 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 56.63 3htx h ASP 733 Cb 0.09 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 39.31 3htx h ASP 733 CO 0.00 0.40 -0.78 -0.31 -1.72 0.00 0.00 179.24 176.84 3htx s TYR 734 N -3.02 0.86 0.35 4.55 1.51 -1.15 -5.12 117.35 115.33 3htx s TYR 734 Ca 0.02 -0.24 -0.18 0.00 -1.01 0.00 0.00 57.07 55.67 3htx s TYR 734 Cb 0.08 -0.68 -0.13 0.00 -0.11 0.00 0.00 41.96 41.11 3htx s TYR 734 CO 0.76 -0.16 0.06 -0.35 -1.11 0.00 0.00 175.55 174.74 3htx n PRO 735 N 3.70 0.00 -3.48 -1.71 -0.04 -1.26 -4.91 135.00 127.30 3htx n PRO 735 Ca -0.22 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.13 3htx n PRO 735 Cb 0.52 -0.85 -0.03 0.00 -0.04 0.00 0.00 33.50 33.11 3htx n PRO 735 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3htx s THR 736 N -1.45 0.00 -0.57 0.52 2.01 -1.26 -5.00 115.64 109.89 3htx s THR 736 Ca 0.50 0.00 0.17 0.00 0.31 0.00 0.00 61.69 62.67 3htx s THR 736 Cb -0.53 -1.00 0.17 0.00 0.01 0.00 0.00 72.50 71.15 3htx s THR 736 CO 0.54 0.00 1.53 -1.54 -0.69 0.00 0.00 174.62 174.45 3htx n SER 737 N -0.08 0.40 -4.70 3.53 3.41 -1.26 -4.67 113.62 110.26 3htx n SER 737 Ca -0.13 0.64 -0.43 0.00 -0.26 0.00 0.00 58.87 58.69 3htx n SER 737 Cb 0.62 -0.71 -0.01 0.00 -0.26 0.00 0.00 64.21 63.85 3htx n SER 737 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3htx n LEU 738 N -1.99 3.51 0.00 1.04 4.77 -0.80 -4.45 117.00 119.08 3htx n LEU 738 Ca 0.01 1.20 0.00 0.00 -0.03 0.00 0.00 56.01 57.19 3htx n LEU 738 Cb 0.11 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 39.73 3htx n LEU 738 CO 0.12 -0.47 -0.35 0.00 -1.33 0.00 0.00 177.39 175.37 3htx n GLN 739 N 0.81 1.17 -4.00 3.23 6.02 0.48 -3.13 117.38 121.96 3htx n GLN 739 Ca 0.06 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.74 3htx n GLN 739 Cb 0.35 -0.85 -0.15 0.00 1.02 0.00 0.00 30.24 30.62 3htx n GLN 739 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3htx s THR 740 N -1.69 1.85 -0.00 5.09 2.01 0.21 0.34 115.64 123.44 3htx s THR 740 Ca 0.00 -1.43 0.00 0.00 0.31 0.00 0.00 61.69 60.57 3htx s THR 740 Cb 0.00 -2.04 -0.04 0.00 0.01 0.00 0.00 72.50 70.43 3htx s THR 740 CO 0.00 -0.07 0.05 0.27 -0.69 0.00 0.00 174.62 174.18 3htx s ILE 741 N 1.25 4.47 0.01 1.82 -4.36 -0.54 0.22 121.20 124.07 3htx s ILE 741 Ca -0.07 -0.50 0.01 0.00 -0.26 0.00 0.00 60.65 59.82 3htx s ILE 741 Cb -0.19 -3.03 -0.01 0.00 1.25 0.00 0.00 42.46 40.48 3htx s ILE 741 CO -0.06 0.35 -0.03 -0.63 0.24 0.00 0.00 174.94 174.82 3htx s ILE 742 N -1.15 0.18 0.04 8.37 1.01 0.38 -1.41 121.20 128.63 3htx s ILE 742 Ca 0.22 -0.53 0.05 0.00 0.00 0.00 0.00 60.65 60.39 3htx s ILE 742 Cb -0.12 -0.24 -0.02 0.00 0.01 0.00 0.00 42.46 42.09 3htx s ILE 742 CO 0.12 -0.22 -0.15 -0.83 0.00 0.00 0.00 174.94 173.86 3htx s GLY 743 N -0.79 0.84 -0.02 6.18 0.00 -0.46 -1.28 107.32 111.80 3htx s GLY 743 Ca -0.07 -0.87 0.01 0.00 0.00 0.00 0.00 44.72 43.79 3htx s GLY 743 CO -0.00 -0.84 -0.02 0.14 0.00 0.00 0.00 173.10 172.38 3htx s VAL 744 N -0.86 0.27 0.10 1.40 1.01 -1.17 -0.30 120.40 120.85 3htx s VAL 744 Ca 0.02 -0.03 -0.26 0.00 0.00 0.00 0.00 61.98 61.71 3htx s VAL 744 Cb -0.08 -0.30 0.08 0.00 0.00 0.00 0.00 36.38 36.07 3htx s VAL 744 CO 0.01 0.13 0.93 -0.62 0.00 0.00 0.00 175.10 175.56 3htx s ASP 745 N 0.61 -0.24 0.00 3.32 -1.08 -1.08 -0.85 116.67 117.34 3htx s ASP 745 Ca -0.06 -0.27 0.03 0.00 -0.52 0.00 0.00 52.55 51.73 3htx s ASP 745 Cb -0.10 0.46 0.02 0.00 -1.46 0.00 0.00 42.92 41.84 3htx s ASP 745 CO -0.01 -0.81 0.55 2.30 0.52 0.00 0.00 175.17 177.72 3htx n ILE 746 N -0.40 0.00 -3.04 4.11 -6.64 -1.26 0.13 119.36 112.27 3htx n ILE 746 Ca -0.07 -0.50 -0.44 0.00 -1.77 0.00 0.00 62.75 59.97 3htx n ILE 746 Cb 0.61 1.05 -0.04 0.00 -1.44 0.00 0.00 39.64 39.83 3htx n ILE 746 CO 0.00 0.00 0.00 -0.55 -1.77 0.00 0.00 176.55 174.23 3htx s SER 747 N -0.29 6.32 0.22 7.28 0.15 -1.26 -4.93 113.70 121.19 3htx s SER 747 Ca 0.03 -1.58 -0.08 0.00 0.70 0.00 0.00 55.95 55.03 3htx s SER 747 Cb 0.02 -2.34 0.28 0.00 -1.71 0.00 0.00 66.02 62.28 3htx s SER 747 CO 0.04 -1.13 1.82 1.55 1.20 0.00 0.00 173.24 176.72 3htx h PRO 748 N 9.07 0.73 -0.71 5.44 0.13 -1.99 -1.40 132.00 143.26 3htx h PRO 748 Ca -0.17 -0.04 0.17 0.00 -0.87 0.00 0.00 66.00 65.09 3htx h PRO 748 Cb 1.07 -0.17 -0.04 0.00 0.13 0.00 0.00 31.00 31.99 3htx h PRO 748 CO 1.09 0.48 0.49 0.87 -0.23 0.00 0.00 178.00 180.71 3htx h LYS 749 N 0.75 0.20 0.00 0.86 1.57 -1.96 -1.42 116.57 116.58 3htx h LYS 749 Ca 0.33 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.08 3htx h LYS 749 Cb 0.21 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 3htx h LYS 749 CO -0.19 0.13 -0.11 0.78 -0.57 0.00 0.00 179.45 179.49 3htx h GLY 750 N 0.21 0.00 -0.31 3.86 0.00 -1.58 -3.26 103.07 101.99 3htx h GLY 750 Ca 0.35 0.00 0.19 0.00 0.00 0.00 0.00 47.33 47.87 3htx h GLY 750 CO -0.07 0.00 0.12 1.41 0.00 0.00 0.00 176.54 178.01 3htx h LEU 751 N -1.00 -0.14 -1.08 3.11 3.38 -0.95 0.14 115.31 118.78 3htx h LEU 751 Ca -0.02 0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.19 3htx h LEU 751 Cb 0.69 0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.66 3htx h LEU 751 CO -0.02 -0.13 0.62 0.00 0.09 0.00 0.00 178.44 179.00 3htx h ALA 752 N 1.70 1.44 -0.32 1.53 0.00 -1.40 -0.43 119.26 121.80 3htx h ALA 752 Ca 0.46 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 55.17 3htx h ALA 752 Cb 0.84 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3htx h ALA 752 CO -0.62 0.42 -0.46 0.00 0.00 0.00 0.00 179.25 178.59 3htx h ARG 753 N 1.12 0.85 -0.49 0.00 3.08 -0.86 -2.08 114.38 116.01 3htx h ARG 753 Ca 0.40 -0.49 0.02 0.00 0.07 0.00 0.00 59.98 59.99 3htx h ARG 753 Cb 0.15 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 3htx h ARG 753 CO -0.15 1.13 0.29 0.00 -1.07 0.00 0.00 179.97 180.17 3htx h ALA 754 N 0.79 0.62 -0.02 0.04 0.00 0.24 -0.98 119.26 119.95 3htx h ALA 754 Ca 0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3htx h ALA 754 Cb 1.05 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 3htx h ALA 754 CO 0.11 -0.02 -0.00 0.00 0.00 0.00 0.00 179.25 179.34 3htx h ALA 755 N 1.22 0.03 -0.98 0.00 0.00 -1.09 -1.85 119.26 116.60 3htx h ALA 755 Ca 0.20 -0.17 0.22 0.00 0.00 0.00 0.00 54.91 55.16 3htx h ALA 755 Cb 0.02 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.72 3htx h ALA 755 CO -0.09 -0.30 0.62 0.87 0.00 0.00 0.00 179.25 180.35 3htx h LYS 756 N -0.27 0.51 0.26 0.00 1.57 -1.11 0.30 116.57 117.83 3htx h LYS 756 Ca 0.01 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 3htx h LYS 756 Cb 0.33 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3htx h LYS 756 CO 0.00 0.34 -0.12 0.00 -0.57 0.00 0.00 179.45 179.10 3htx h MET 757 N 0.53 -0.33 -0.67 3.15 -0.00 -0.99 -3.30 114.93 113.31 3htx h MET 757 Ca 0.54 0.02 0.15 0.00 -0.00 0.00 0.00 59.70 60.41 3htx h MET 757 Cb 1.17 0.08 -0.04 0.00 -0.00 0.00 0.00 31.60 32.81 3htx h MET 757 CO -0.28 0.02 0.46 -0.07 -0.00 0.00 0.00 176.91 177.04 3htx h LEU 758 N -0.90 0.26 -1.13 -0.10 3.38 -0.43 -1.88 115.31 114.51 3htx h LEU 758 Ca -0.04 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.02 3htx h LEU 758 Cb 0.51 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 3htx h LEU 758 CO 0.06 0.14 0.60 -0.74 0.09 0.00 0.00 178.44 178.58 3htx h HIS 759 N 0.28 1.06 0.01 1.13 2.76 -1.06 0.31 115.15 119.64 3htx h HIS 759 Ca 0.33 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.52 3htx h HIS 759 Cb 0.88 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 29.49 3htx h HIS 759 CO -0.00 0.55 -0.00 0.28 -1.30 0.00 0.00 177.93 177.46 3htx h VAL 760 N 1.04 1.48 -0.51 5.26 2.07 -1.49 -3.31 116.25 120.79 3htx h VAL 760 Ca 0.40 -1.45 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 3htx h VAL 760 Cb 0.21 2.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 3htx h VAL 760 CO -0.15 0.37 0.30 0.11 0.02 0.00 0.00 177.57 178.22 3htx h LYS 761 N -0.63 0.69 0.00 1.57 1.79 -1.21 -3.04 116.57 115.75 3htx h LYS 761 Ca -0.00 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 3htx h LYS 761 Cb 0.62 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 3htx h LYS 761 CO 0.00 0.52 0.00 1.28 -1.08 0.00 0.00 179.45 180.17 3htx n LEU 762 N -4.68 0.00 -0.08 2.94 4.77 0.11 -0.96 117.00 119.10 3htx n LEU 762 Ca 0.02 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.83 3htx n LEU 762 Cb 0.06 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.02 3htx n LEU 762 CO 0.36 0.00 -1.11 0.59 -1.33 0.00 0.00 177.39 175.90 3htx n ASN 763 N -0.73 1.68 -0.12 -1.43 3.02 -1.15 -4.47 115.26 112.07 3htx n ASN 763 Ca 0.10 0.02 -0.24 0.00 -0.03 0.00 0.00 54.58 54.43 3htx n ASN 763 Cb 0.05 -0.33 -0.09 0.00 -0.61 0.00 0.00 39.78 38.80 3htx n ASN 763 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 3htx n LYS 764 N -3.24 0.53 -2.11 3.52 2.85 -1.19 -4.74 118.16 113.79 3htx n LYS 764 Ca -0.38 0.21 -0.34 0.00 -1.05 0.00 0.00 58.31 56.75 3htx n LYS 764 Cb 1.03 -1.39 0.03 0.00 -0.65 0.00 0.00 35.03 34.05 3htx n LYS 764 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3htx n GLU 765 N -3.89 3.05 -2.56 -1.58 1.02 -0.13 -4.89 120.64 111.66 3htx n GLU 765 Ca -0.46 -3.92 -0.41 0.00 -0.02 0.00 0.00 57.16 52.34 3htx n GLU 765 Cb 0.86 -2.26 -0.03 0.00 -0.02 0.00 0.00 31.44 29.99 3htx n GLU 765 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3htx s ALA 766 N -3.84 2.72 0.00 0.62 0.00 -1.25 -4.82 121.76 115.19 3htx s ALA 766 Ca 0.51 -2.01 0.00 0.00 0.00 0.00 0.00 51.96 50.46 3htx s ALA 766 Cb 0.43 -4.45 0.00 0.00 0.00 0.00 0.00 23.12 19.09 3htx s ALA 766 CO -0.29 -3.53 0.98 0.00 0.00 0.00 0.00 175.76 172.92 3htx n ASN 768 N -2.17 1.32 -4.64 0.00 2.85 -1.26 -5.06 115.26 106.30 3htx n ASN 768 Ca 0.00 -0.03 -0.47 0.00 -0.11 0.00 0.00 54.58 53.98 3htx n ASN 768 Cb 0.00 0.32 -0.04 0.00 1.24 0.00 0.00 39.78 41.30 3htx n ASN 768 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 3htx n VAL 769 N -0.45 0.54 0.00 3.44 0.31 -1.18 -4.60 118.33 116.39 3htx n VAL 769 Ca 0.00 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 3htx n VAL 769 Cb 0.00 -1.30 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 3htx n VAL 769 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3htx n LYS 770 N 2.44 2.79 -4.56 5.55 5.02 0.15 -4.89 118.16 124.66 3htx n LYS 770 Ca 0.15 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.19 3htx n LYS 770 Cb 0.28 -0.71 -0.17 0.00 -0.02 0.00 0.00 35.03 34.41 3htx n LYS 770 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3htx s SER 771 N -1.06 1.72 -0.24 4.39 0.15 -1.11 -1.24 113.70 116.31 3htx s SER 771 Ca 0.00 -0.29 -0.03 0.00 0.70 0.00 0.00 55.95 56.34 3htx s SER 771 Cb 0.00 -0.80 0.11 0.00 -1.71 0.00 0.00 66.02 63.63 3htx s SER 771 CO 0.00 0.03 0.26 0.00 1.20 0.00 0.00 173.24 174.73 3htx s ALA 772 N 0.67 -0.41 -0.00 5.45 0.00 -0.74 -1.47 121.76 125.26 3htx s ALA 772 Ca -0.14 0.08 0.07 0.00 0.00 0.00 0.00 51.96 51.97 3htx s ALA 772 Cb -0.16 -1.55 -0.02 0.00 0.00 0.00 0.00 23.12 21.39 3htx s ALA 772 CO 0.04 -1.42 -0.23 0.99 0.00 0.00 0.00 175.76 175.14 3htx s THR 773 N 2.36 2.37 -0.06 0.00 2.01 -0.50 -2.15 115.64 119.67 3htx s THR 773 Ca 0.09 -1.10 0.06 0.00 0.31 0.00 0.00 61.69 61.04 3htx s THR 773 Cb -0.15 -1.89 -0.01 0.00 0.01 0.00 0.00 72.50 70.46 3htx s THR 773 CO -0.21 0.50 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.22 3htx s LEU 774 N -0.88 2.10 0.36 4.42 1.43 -0.62 -1.35 118.68 124.13 3htx s LEU 774 Ca 0.11 -0.51 0.09 0.00 -1.03 0.00 0.00 54.13 52.79 3htx s LEU 774 Cb -0.10 -1.39 -0.05 0.00 0.03 0.00 0.00 46.19 44.68 3htx s LEU 774 CO 0.01 0.24 0.05 -0.31 0.23 0.00 0.00 176.35 176.56 3htx s TYR 775 N -0.11 2.56 -0.30 0.29 1.51 0.59 -1.23 117.35 120.67 3htx s TYR 775 Ca -0.05 -0.48 0.02 0.00 -1.01 0.00 0.00 57.07 55.56 3htx s TYR 775 Cb -0.14 -1.60 0.07 0.00 -0.11 0.00 0.00 41.96 40.18 3htx s TYR 775 CO 0.04 0.42 -0.03 0.34 -1.11 0.00 0.00 175.55 175.21 3htx s ASP 776 N -3.75 4.64 -0.27 2.29 -1.08 -1.07 -2.64 116.67 114.79 3htx s ASP 776 Ca 0.36 -1.63 -0.35 0.00 -0.52 0.00 0.00 52.55 50.41 3htx s ASP 776 Cb 0.01 -1.61 0.17 0.00 -1.46 0.00 0.00 42.92 40.03 3htx s ASP 776 CO 0.20 -0.27 1.34 -0.83 0.52 0.00 0.00 175.17 176.13 3htx s GLY 777 N 1.10 -0.12 0.21 2.66 0.00 0.34 -2.93 107.32 108.58 3htx s GLY 777 Ca -0.02 2.17 -0.30 0.00 0.00 0.00 0.00 44.72 46.57 3htx s GLY 777 CO -0.05 0.78 1.32 -0.45 0.00 0.00 0.00 173.10 174.70 3htx s SER 778 N -1.70 6.87 -0.01 1.64 0.15 -1.26 -3.62 113.70 115.77 3htx s SER 778 Ca 0.10 2.43 0.01 0.00 0.70 0.00 0.00 55.95 59.19 3htx s SER 778 Cb -0.01 -2.61 0.05 0.00 -1.71 0.00 0.00 66.02 61.74 3htx s SER 778 CO -0.04 -0.54 0.68 2.30 1.20 0.00 0.00 173.24 176.83 3htx n ILE 779 N 2.55 0.15 0.19 6.45 -5.35 -1.26 -1.47 119.36 120.62 3htx n ILE 779 Ca 0.06 -0.08 0.07 0.00 -0.27 0.00 0.00 62.75 62.53 3htx n ILE 779 Cb 0.43 -0.38 -0.10 0.00 -1.74 0.00 0.00 39.64 37.84 3htx n ILE 779 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3htx n LEU 780 N -0.04 0.20 -4.91 7.28 4.77 -1.26 -4.79 117.00 118.24 3htx n LEU 780 Ca 0.02 -0.15 -0.30 0.00 -0.03 0.00 0.00 56.01 55.55 3htx n LEU 780 Cb 0.25 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.31 3htx n LEU 780 CO 0.02 0.05 0.03 -1.61 -1.33 0.00 0.00 177.39 174.55 3htx s GLU 781 N -2.81 3.57 -0.13 3.23 0.41 -0.54 -4.92 118.70 117.51 3htx s GLU 781 Ca -0.02 -0.19 -0.06 0.00 -0.41 0.00 0.00 54.97 54.29 3htx s GLU 781 Cb 0.10 -2.84 -0.04 0.00 -1.78 0.00 0.00 34.13 29.57 3htx s GLU 781 CO 0.60 0.43 0.09 0.12 -0.49 0.00 0.00 175.26 176.01 3htx s PHE 782 N -1.76 3.42 -0.08 1.61 5.36 -1.26 -4.89 117.98 120.39 3htx s PHE 782 Ca 0.40 0.35 -0.01 0.00 -0.96 0.00 0.00 56.93 56.71 3htx s PHE 782 Cb -0.12 -1.95 0.03 0.00 -0.34 0.00 0.00 43.02 40.64 3htx s PHE 782 CO 0.27 0.53 -0.02 0.34 -1.46 0.00 0.00 175.22 174.88 3htx s ASP 783 N -0.63 1.63 0.47 6.13 2.15 -1.26 -4.46 116.67 120.70 3htx s ASP 783 Ca 0.12 -0.12 0.28 0.00 0.43 0.00 0.00 52.55 53.25 3htx s ASP 783 Cb -0.12 -0.51 1.34 0.00 -0.30 0.00 0.00 42.92 43.33 3htx s ASP 783 CO 0.02 -0.17 1.77 0.77 -0.17 0.00 0.00 175.17 177.39 3htx h SER 784 N 8.19 0.23 0.01 -0.34 4.64 -1.81 -2.70 113.55 121.77 3htx h SER 784 Ca -0.23 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3htx h SER 784 Cb 1.13 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3htx h SER 784 CO 0.30 0.02 0.00 0.54 -0.87 0.00 0.00 176.83 176.83 3htx n ARG 785 N -4.43 0.25 -2.27 4.77 1.74 -1.26 -3.16 116.66 112.30 3htx n ARG 785 Ca 0.27 0.02 -0.30 0.00 -0.77 0.00 0.00 57.85 57.07 3htx n ARG 785 Cb 1.11 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 31.06 3htx n ARG 785 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3htx n LEU 786 N -1.03 5.53 -4.76 0.55 4.77 -1.02 -5.04 117.00 116.00 3htx n LEU 786 Ca 0.06 -5.07 -0.41 0.00 -0.03 0.00 0.00 56.01 50.57 3htx n LEU 786 Cb 0.03 -0.62 -0.03 0.00 -2.33 0.00 0.00 43.42 40.47 3htx n LEU 786 CO 0.05 2.09 0.87 -1.38 -1.33 0.00 0.00 177.39 177.69 3htx s HIS 787 N -3.69 3.37 -1.65 -1.77 -3.43 -1.19 -4.07 115.29 102.87 3htx s HIS 787 Ca 0.50 1.57 -0.13 0.00 -0.80 0.00 0.00 55.06 56.19 3htx s HIS 787 Cb 0.41 -3.44 0.12 0.00 -1.43 0.00 0.00 32.58 28.23 3htx s HIS 787 CO -0.23 -1.10 0.58 -0.40 -2.00 0.00 0.00 174.74 171.59 3htx n ASP 788 N 1.18 -1.88 -4.67 7.38 5.75 -1.26 -4.92 116.55 118.13 3htx n ASP 788 Ca -0.00 -1.08 -0.35 0.00 -0.01 0.00 0.00 54.79 53.34 3htx n ASP 788 Cb 0.44 -2.51 0.09 0.00 -1.03 0.00 0.00 41.12 38.11 3htx n ASP 788 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 3htx n VAL 789 N -4.37 3.23 -0.09 2.12 0.31 -1.26 -4.91 118.33 113.35 3htx n VAL 789 Ca -0.06 -0.36 -0.14 0.00 -0.01 0.00 0.00 64.34 63.77 3htx n VAL 789 Cb 0.56 -1.24 -0.08 0.00 -0.91 0.00 0.00 33.84 32.16 3htx n VAL 789 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3htx n ASP 790 N -2.16 2.37 -4.27 4.52 8.00 -1.25 -3.19 116.55 120.56 3htx n ASP 790 Ca 0.14 -0.05 -0.30 0.00 0.71 0.00 0.00 54.79 55.29 3htx n ASP 790 Cb 0.49 -0.34 -0.16 0.00 -0.02 0.00 0.00 41.12 41.09 3htx n ASP 790 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3htx s ILE 791 N -2.37 1.96 -0.10 0.53 1.01 -1.25 -0.52 121.20 120.45 3htx s ILE 791 Ca -0.26 -1.04 -0.00 0.00 0.00 0.00 0.00 60.65 59.35 3htx s ILE 791 Cb 0.07 -1.64 0.02 0.00 0.01 0.00 0.00 42.46 40.93 3htx s ILE 791 CO 0.42 0.55 -0.07 -0.83 0.00 0.00 0.00 174.94 175.01 3htx s GLY 792 N -0.42 0.75 -0.25 6.18 0.00 -0.74 -1.87 107.32 110.97 3htx s GLY 792 Ca 0.05 -0.44 -0.02 0.00 0.00 0.00 0.00 44.72 44.31 3htx s GLY 792 CO 0.01 0.72 -0.04 -1.59 0.00 0.00 0.00 173.10 172.19 3htx s THR 793 N 1.52 3.03 -0.33 0.90 2.01 0.45 -0.94 115.64 122.27 3htx s THR 793 Ca 0.01 -0.95 0.04 0.00 0.31 0.00 0.00 61.69 61.09 3htx s THR 793 Cb -0.13 -2.53 0.10 0.00 0.01 0.00 0.00 72.50 69.95 3htx s THR 793 CO -0.05 0.20 0.03 0.00 -0.69 0.00 0.00 174.62 174.11 3htx s LEU 795 N 0.93 2.93 -1.35 0.00 1.43 -1.26 -1.66 118.68 119.70 3htx s LEU 795 Ca 0.09 -0.27 -0.06 0.00 -1.03 0.00 0.00 54.13 52.85 3htx s LEU 795 Cb -0.19 -1.69 0.02 0.00 0.03 0.00 0.00 46.19 44.36 3htx s LEU 795 CO -0.08 0.13 1.02 -0.62 0.23 0.00 0.00 176.35 177.03 3htx n GLU 796 N 3.77 -6.66 0.00 1.70 -0.58 -1.13 -4.90 120.64 112.84 3htx n GLU 796 Ca -0.18 0.75 0.00 0.00 -0.42 0.00 0.00 57.16 57.32 3htx n GLU 796 Cb 0.52 -5.69 0.00 0.00 -0.57 0.00 0.00 31.44 25.70 3htx n GLU 796 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3htx n VAL 797 N -4.60 0.00 0.15 2.62 0.31 -1.26 -4.80 118.33 110.75 3htx n VAL 797 Ca -0.11 0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.37 3htx n VAL 797 Cb 0.60 -1.16 0.50 0.00 -0.91 0.00 0.00 33.84 32.86 3htx n VAL 797 CO 0.00 0.00 0.00 0.16 -1.32 0.00 0.00 176.83 175.67 3htx h ILE 798 N 0.00 0.08 -0.01 2.52 3.07 -1.91 0.21 117.51 121.48 3htx h ILE 798 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 3htx h ILE 798 Cb 0.72 0.33 0.00 0.00 -0.27 0.00 0.00 36.82 37.60 3htx h ILE 798 CO 0.00 0.00 -0.29 -1.84 -1.05 0.00 0.00 178.15 174.97 3htx n GLU 799 N -3.05 1.01 -0.65 0.16 0.00 -1.26 -3.71 120.64 113.14 3htx n GLU 799 Ca 0.07 -0.67 0.04 0.00 0.00 0.00 0.00 57.16 56.59 3htx n GLU 799 Cb 0.87 -1.49 0.28 0.00 0.00 0.00 0.00 31.44 31.10 3htx n GLU 799 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 3htx n HIS 800 N -0.41 1.51 -3.90 -1.84 8.25 0.75 -0.99 115.22 118.59 3htx n HIS 800 Ca 0.12 -0.56 -0.11 0.00 -0.26 0.00 0.00 57.72 56.92 3htx n HIS 800 Cb 0.38 -0.41 -0.10 0.00 1.12 0.00 0.00 29.99 30.98 3htx n HIS 800 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3htx s MET 801 N -2.25 0.40 0.39 -0.41 0.23 -1.24 -4.89 119.30 111.52 3htx s MET 801 Ca 0.39 -0.42 -0.26 0.00 -1.03 0.00 0.00 55.69 54.37 3htx s MET 801 Cb 0.30 0.16 -0.11 0.00 -1.53 0.00 0.00 34.83 33.65 3htx s MET 801 CO 0.11 -0.09 1.20 0.39 -2.03 0.00 0.00 175.02 174.61 3htx n GLU 802 N 1.64 1.81 -0.29 3.16 1.02 -1.26 -4.61 120.64 122.10 3htx n GLU 802 Ca -0.22 0.64 0.33 0.00 -0.02 0.00 0.00 57.16 57.89 3htx n GLU 802 Cb 0.56 -2.26 0.61 0.00 -0.02 0.00 0.00 31.44 30.32 3htx n GLU 802 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 3htx h GLU 803 N 2.07 0.00 0.21 3.49 4.81 -1.95 0.40 114.58 123.61 3htx h GLU 803 Ca -0.46 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.45 3htx h GLU 803 Cb 1.30 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.71 3htx h GLU 803 CO 0.60 0.00 -1.40 -0.44 -0.73 0.00 0.00 179.01 177.04 3htx h ASP 804 N 0.00 0.73 -0.10 1.04 3.32 -1.98 -3.12 116.42 116.31 3htx h ASP 804 Ca 0.55 -0.77 -0.13 0.00 0.02 0.00 0.00 57.03 56.70 3htx h ASP 804 Cb 2.77 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 42.07 3htx h ASP 804 CO -0.01 1.60 -0.39 1.56 -1.72 0.00 0.00 179.24 180.28 3htx h GLN 805 N 0.13 0.62 -0.42 3.56 4.20 -0.57 -1.73 115.11 120.91 3htx h GLN 805 Ca -0.22 -0.31 0.08 0.00 0.06 0.00 0.00 58.65 58.26 3htx h GLN 805 Cb 2.10 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 29.81 3htx h GLN 805 CO 0.25 0.91 -0.03 0.00 -0.67 0.00 0.00 178.83 179.29 3htx h ALA 806 N 1.05 0.36 0.29 3.87 0.00 -1.32 1.35 119.26 124.88 3htx h ALA 806 Ca 0.05 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3htx h ALA 806 Cb 0.90 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3htx h ALA 806 CO 0.08 -0.41 -0.14 0.00 0.00 0.00 0.00 179.25 178.78 3htx h GLU 808 N -0.40 0.03 -0.75 0.00 4.81 -0.19 0.23 114.58 118.31 3htx h GLU 808 Ca -0.04 -0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.31 3htx h GLU 808 Cb 0.30 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.59 3htx h GLU 808 CO 0.07 0.02 0.35 0.35 -0.73 0.00 0.00 179.01 179.06 3htx h PHE 809 N 0.03 0.61 0.79 0.92 3.57 0.21 0.32 116.94 123.38 3htx h PHE 809 Ca 0.26 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.75 3htx h PHE 809 Cb 0.40 -0.16 0.01 0.00 2.79 0.00 0.00 35.95 38.99 3htx h PHE 809 CO -0.42 0.16 -0.39 0.78 -2.23 0.00 0.00 178.31 176.21 3htx h GLY 810 N 0.55 -1.13 0.27 2.40 0.00 0.69 0.19 103.07 106.04 3htx h GLY 810 Ca 0.39 0.42 0.00 0.00 0.00 0.00 0.00 47.33 48.15 3htx h GLY 810 CO -0.33 -0.41 -0.51 0.83 0.00 0.00 0.00 176.54 176.12 3htx h GLU 811 N -1.07 -0.80 -0.82 4.80 4.39 -0.08 -2.12 114.58 118.87 3htx h GLU 811 Ca -0.11 0.05 0.16 0.00 0.34 0.00 0.00 59.36 59.81 3htx h GLU 811 Cb 0.83 0.18 -0.10 0.00 -0.10 0.00 0.00 28.75 29.56 3htx h GLU 811 CO 0.17 -0.54 0.36 0.87 -1.16 0.00 0.00 179.01 178.72 3htx h LYS 812 N -0.83 0.48 0.60 2.33 1.57 -0.39 -2.25 116.57 118.08 3htx h LYS 812 Ca -0.03 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 3htx h LYS 812 Cb 0.78 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.99 3htx h LYS 812 CO -0.19 0.32 -0.29 0.28 -0.57 0.00 0.00 179.45 178.99 3htx h VAL 813 N 0.49 0.00 -0.62 0.50 2.07 -0.54 -2.47 116.25 115.68 3htx h VAL 813 Ca 0.46 0.00 0.08 0.00 0.82 0.00 0.00 66.70 68.06 3htx h VAL 813 Cb 0.74 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.44 3htx h VAL 813 CO -0.42 0.00 0.29 -0.07 0.02 0.00 0.00 177.57 177.39 3htx h LEU 814 N -0.81 0.37 -0.01 2.57 3.38 -1.16 1.06 115.31 120.71 3htx h LEU 814 Ca -0.08 0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 3htx h LEU 814 Cb 0.62 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.37 3htx h LEU 814 CO 0.13 0.23 -0.45 0.77 0.09 0.00 0.00 178.44 179.21 3htx h SER 815 N 0.52 0.42 0.29 -0.43 4.64 -1.49 -3.37 113.55 114.13 3htx h SER 815 Ca 0.30 -0.75 -0.33 0.00 -0.47 0.00 0.00 61.79 60.53 3htx h SER 815 Cb 0.29 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.22 3htx h SER 815 CO -0.24 1.11 -1.86 0.18 -0.87 0.00 0.00 176.83 175.14 3htx n LEU 816 N -4.34 1.88 -4.10 5.97 4.77 -0.94 -4.65 117.00 115.59 3htx n LEU 816 Ca -0.10 0.31 -0.36 0.00 -0.03 0.00 0.00 56.01 55.83 3htx n LEU 816 Cb 0.60 -0.57 -0.11 0.00 -2.33 0.00 0.00 43.42 41.01 3htx n LEU 816 CO 0.44 0.65 -0.05 -0.36 -1.33 0.00 0.00 177.39 176.74 3htx s PHE 817 N -2.58 3.47 -0.47 -1.77 0.40 0.37 -4.90 117.98 112.49 3htx s PHE 817 Ca -0.14 -2.63 0.02 0.00 -0.60 0.00 0.00 56.93 53.58 3htx s PHE 817 Cb 0.07 -3.19 0.12 0.00 0.51 0.00 0.00 43.02 40.54 3htx s PHE 817 CO 0.80 -0.89 0.22 -3.38 0.70 0.00 0.00 175.22 172.67 3htx s HIS 818 N 0.38 3.42 0.09 0.36 -3.43 -1.24 -3.57 115.29 111.30 3htx s HIS 818 Ca 0.14 -3.00 -0.28 0.00 -0.80 0.00 0.00 55.06 51.11 3htx s HIS 818 Cb -0.21 -2.94 -0.06 0.00 -1.43 0.00 0.00 32.58 27.94 3htx s HIS 818 CO -0.04 -0.83 0.88 -1.25 -2.00 0.00 0.00 174.74 171.50 3htx s PRO 819 N 0.20 4.62 0.31 -0.38 0.04 -1.19 -4.59 135.00 134.01 3htx s PRO 819 Ca 0.15 1.30 0.25 0.00 0.04 0.00 0.00 61.00 62.74 3htx s PRO 819 Cb -0.23 -3.36 1.05 0.00 0.04 0.00 0.00 34.50 32.00 3htx s PRO 819 CO -0.03 0.26 1.76 0.87 0.04 0.00 0.00 177.00 179.90 3htx h LYS 820 N 5.51 0.00 -3.63 4.56 1.57 -1.38 -3.42 116.57 119.78 3htx h LYS 820 Ca -0.43 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.14 3htx h LYS 820 Cb 1.21 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 33.25 3htx h LYS 820 CO 0.71 0.00 -0.65 -1.17 -0.57 0.00 0.00 179.45 177.77 3htx s LEU 821 N -4.75 1.83 -0.05 2.94 2.96 0.32 -1.59 118.68 120.33 3htx s LEU 821 Ca 0.04 0.04 -0.04 0.00 -0.22 0.00 0.00 54.13 53.95 3htx s LEU 821 Cb 0.09 0.19 0.02 0.00 0.50 0.00 0.00 46.19 47.00 3htx s LEU 821 CO 0.41 -0.06 0.13 -0.22 -1.32 0.00 0.00 176.35 175.30 3htx s LEU 822 N -0.16 1.24 -0.20 -0.68 2.96 -0.76 -1.80 118.68 119.29 3htx s LEU 822 Ca -0.02 0.27 0.01 0.00 -0.22 0.00 0.00 54.13 54.17 3htx s LEU 822 Cb -0.02 0.41 0.04 0.00 0.50 0.00 0.00 46.19 47.12 3htx s LEU 822 CO 0.00 -0.08 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.20 3htx s ILE 823 N 0.45 1.72 0.05 6.68 1.01 -0.12 -1.02 121.20 129.96 3htx s ILE 823 Ca -0.03 -1.01 0.03 0.00 0.00 0.00 0.00 60.65 59.64 3htx s ILE 823 Cb -0.05 -1.75 -0.04 0.00 0.01 0.00 0.00 42.46 40.64 3htx s ILE 823 CO -0.02 0.22 -0.00 -0.69 0.00 0.00 0.00 174.94 174.44 3htx s VAL 824 N 1.37 4.04 0.05 2.92 1.01 -1.05 -0.70 120.40 128.04 3htx s VAL 824 Ca -0.01 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.16 3htx s VAL 824 Cb -0.16 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 3htx s VAL 824 CO -0.09 0.23 -0.07 -0.55 0.00 0.00 0.00 175.10 174.63 3htx s SER 825 N -1.98 0.83 -0.11 3.32 0.15 -0.67 -2.80 113.70 112.45 3htx s SER 825 Ca 0.23 -0.67 -0.30 0.00 0.70 0.00 0.00 55.95 55.91 3htx s SER 825 Cb -0.12 0.06 0.10 0.00 -1.71 0.00 0.00 66.02 64.36 3htx s SER 825 CO 0.15 -0.29 0.83 -0.89 1.20 0.00 0.00 173.24 174.23 3htx s THR 826 N -2.01 0.00 0.17 6.45 2.01 -0.95 -2.82 115.64 118.49 3htx s THR 826 Ca -0.05 0.00 -0.31 0.00 0.31 0.00 0.00 61.69 61.64 3htx s THR 826 Cb -0.06 -1.00 -0.09 0.00 0.01 0.00 0.00 72.50 71.36 3htx s THR 826 CO -0.01 0.00 1.40 -2.84 -0.69 0.00 0.00 174.62 172.47 3htx s PRO 827 N -1.11 4.32 -0.21 4.92 0.02 -1.26 -1.39 135.00 140.28 3htx s PRO 827 Ca -0.06 2.14 -0.29 0.00 0.02 0.00 0.00 61.00 62.81 3htx s PRO 827 Cb -0.00 -3.20 0.00 0.00 0.02 0.00 0.00 34.50 31.32 3htx s PRO 827 CO 0.06 -0.40 1.10 1.21 -0.33 0.00 0.00 177.00 178.64 3htx s ASN 828 N 0.75 7.06 0.04 2.53 3.84 0.45 -4.18 114.94 125.42 3htx s ASN 828 Ca 0.62 1.47 -0.23 0.00 0.21 0.00 0.00 52.86 54.92 3htx s ASN 828 Cb -0.38 -2.54 -0.16 0.00 -0.55 0.00 0.00 41.25 37.62 3htx s ASN 828 CO 0.35 -0.70 1.47 0.22 -2.79 0.00 0.00 177.10 175.66 3htx h TYR 829 N 7.66 0.11 -0.99 0.43 3.20 -0.19 -3.00 116.97 124.21 3htx h TYR 829 Ca -0.21 -0.02 0.31 0.00 3.14 0.00 0.00 58.73 61.95 3htx h TYR 829 Cb 1.07 -0.03 -0.15 0.00 1.54 0.00 0.00 36.73 39.16 3htx h TYR 829 CO 0.76 0.36 0.52 0.93 -1.64 0.00 0.00 178.16 179.09 3htx h GLU 830 N -0.17 0.29 -0.37 1.82 5.08 -1.90 -1.83 114.58 117.50 3htx h GLU 830 Ca 0.02 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 3htx h GLU 830 Cb 0.32 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 3htx h GLU 830 CO 0.00 0.19 -0.21 0.35 -1.00 0.00 0.00 179.01 178.35 3htx h PHE 831 N 0.30 0.92 0.00 4.33 3.57 -1.80 -3.12 116.94 121.14 3htx h PHE 831 Ca 0.71 -0.24 0.00 0.00 3.53 0.00 0.00 57.97 61.97 3htx h PHE 831 Cb 1.60 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 40.13 3htx h PHE 831 CO -0.05 0.99 0.00 0.27 -2.23 0.00 0.00 178.31 177.29 3htx n ASN 832 N -4.25 0.00 -0.34 0.41 0.23 -0.69 -0.46 115.26 110.16 3htx n ASN 832 Ca -0.02 -0.23 0.12 0.00 -0.53 0.00 0.00 54.58 53.92 3htx n ASN 832 Cb 0.43 0.00 0.11 0.00 -2.08 0.00 0.00 39.78 38.24 3htx n ASN 832 CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 3htx n THR 833 N -0.90 0.00 0.14 5.53 -1.04 -1.18 -3.18 114.28 113.66 3htx n THR 833 Ca 0.04 -0.18 0.09 0.00 -2.04 0.00 0.00 64.05 61.96 3htx n THR 833 Cb 0.02 0.92 -0.13 0.00 -1.82 0.00 0.00 70.33 69.31 3htx n THR 833 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3htx n ILE 834 N -0.45 0.00 0.03 12.58 5.41 0.40 -3.97 119.36 133.36 3htx n ILE 834 Ca 0.09 -0.36 -0.11 0.00 1.00 0.00 0.00 62.75 63.38 3htx n ILE 834 Cb 0.41 0.25 -0.13 0.00 -0.71 0.00 0.00 39.64 39.45 3htx n ILE 834 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3htx h LEU 835 N 0.00 0.11 -0.17 1.39 3.38 -1.63 -3.26 115.31 115.13 3htx h LEU 835 Ca 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3htx h LEU 835 Cb 0.76 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3htx h LEU 835 CO 0.00 1.14 0.00 1.56 0.09 0.00 0.00 178.44 181.23 3htx h GLN 836 N 0.02 0.00 0.09 1.13 4.20 -1.71 -2.49 115.11 116.35 3htx h GLN 836 Ca -0.18 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.21 3htx h GLN 836 Cb 1.93 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.69 3htx h GLN 836 CO 0.12 0.00 -1.67 0.00 -0.67 0.00 0.00 178.83 176.61 3htx h ARG 837 N 0.00 0.20 0.00 1.46 3.08 -1.69 -3.28 114.38 114.14 3htx h ARG 837 Ca 0.00 -0.33 -0.07 0.00 0.07 0.00 0.00 59.98 59.64 3htx h ARG 837 Cb 0.67 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.84 3htx h ARG 837 CO 0.00 1.00 -0.35 0.66 -1.07 0.00 0.00 179.97 180.21 3htx h SER 838 N 0.05 0.00 0.00 7.04 4.64 -1.57 -3.52 113.55 120.19 3htx h SER 838 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 3htx h SER 838 Cb 2.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.11 3htx h SER 838 CO 0.13 0.35 0.00 0.41 -0.87 0.00 0.00 176.83 176.85 3htx n THR 839 N -3.88 0.00 -2.51 2.95 -1.04 -0.95 -5.12 114.28 103.73 3htx n THR 839 Ca -0.01 0.73 -0.12 0.00 -2.04 0.00 0.00 64.05 62.61 3htx n THR 839 Cb 0.42 -1.53 -0.00 0.00 -1.82 0.00 0.00 70.33 67.39 3htx n THR 839 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3htx n LEU 852 N -1.50 -1.05 -4.58 -4.42 4.77 -1.26 -5.11 117.00 103.85 3htx n LEU 852 Ca 0.00 0.19 -0.43 0.00 -0.03 0.00 0.00 56.01 55.74 3htx n LEU 852 Cb 0.00 -2.02 -0.03 0.00 -2.33 0.00 0.00 43.42 39.04 3htx n LEU 852 CO 0.00 -0.09 0.86 -2.16 -1.33 0.00 0.00 177.39 174.66 3htx s PRO 853 N -5.09 3.62 0.00 3.23 0.04 -1.26 -5.03 135.00 130.50 3htx s PRO 853 Ca 0.03 0.34 0.00 0.00 0.04 0.00 0.00 61.00 61.40 3htx s PRO 853 Cb -0.01 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.61 3htx s PRO 853 CO 0.03 -1.27 0.00 1.63 0.04 0.00 0.00 177.00 177.43 3htx n LYS 854 N 7.41 -1.03 -4.66 4.56 4.76 -1.26 -5.04 118.16 122.90 3htx n LYS 854 Ca 0.08 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.23 3htx n LYS 854 Cb 0.49 0.00 -0.14 0.00 -1.84 0.00 0.00 35.03 33.54 3htx n LYS 854 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3htx s PHE 855 N -0.73 2.31 0.31 2.13 0.40 -1.26 -5.01 117.98 116.14 3htx s PHE 855 Ca 0.00 -0.40 0.09 0.00 -0.60 0.00 0.00 56.93 56.02 3htx s PHE 855 Cb 0.00 -1.32 0.89 0.00 0.51 0.00 0.00 43.02 43.09 3htx s PHE 855 CO 0.00 0.23 1.68 0.00 0.70 0.00 0.00 175.22 177.83 3htx h ARG 856 N 4.35 0.37 -4.33 0.44 3.08 -1.96 -3.41 114.38 112.92 3htx h ARG 856 Ca -0.49 -0.02 -0.25 0.00 0.07 0.00 0.00 59.98 59.29 3htx h ARG 856 Cb 1.16 -0.08 -0.23 0.00 0.08 0.00 0.00 29.97 30.89 3htx h ARG 856 CO 0.41 0.25 -0.73 1.21 -1.07 0.00 0.00 179.97 180.04 3htx s ASN 857 N -5.07 0.62 0.00 7.04 2.47 -1.26 -5.02 114.94 113.72 3htx s ASN 857 Ca -0.11 -0.44 0.17 0.00 0.42 0.00 0.00 52.86 52.90 3htx s ASN 857 Cb 0.27 0.03 0.82 0.00 -1.45 0.00 0.00 41.25 40.93 3htx s ASN 857 CO 0.79 -0.18 1.51 1.41 -3.72 0.00 0.00 177.10 176.91 3htx n HIS 858 N 1.81 0.00 -2.68 0.43 8.25 -1.26 -3.04 115.22 118.72 3htx n HIS 858 Ca -0.21 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 56.94 3htx n HIS 858 Cb 0.56 -0.35 -0.01 0.00 1.12 0.00 0.00 29.99 31.30 3htx n HIS 858 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3htx n ASP 859 N -1.35 5.50 -4.10 0.41 -0.08 -1.26 -4.93 116.55 110.73 3htx n ASP 859 Ca 0.07 -3.71 -0.17 0.00 -1.51 0.00 0.00 54.79 49.47 3htx n ASP 859 Cb 0.15 -0.73 -0.12 0.00 2.34 0.00 0.00 41.12 42.76 3htx n ASP 859 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 3htx s HIS 860 N -3.75 0.96 -0.23 -0.67 3.76 -1.17 -4.61 115.29 109.58 3htx s HIS 860 Ca 0.47 -0.40 -0.16 0.00 -0.15 0.00 0.00 55.06 54.82 3htx s HIS 860 Cb 0.30 -0.56 -0.11 0.00 1.11 0.00 0.00 32.58 33.31 3htx s HIS 860 CO -0.17 -0.00 -0.23 1.63 -0.85 0.00 0.00 174.74 175.11 3htx n LYS 861 N 1.70 0.56 -4.35 1.40 4.76 -0.16 -5.00 118.16 117.06 3htx n LYS 861 Ca -0.20 0.34 -0.18 0.00 -2.87 0.00 0.00 58.31 55.40 3htx n LYS 861 Cb 0.55 -1.55 -0.10 0.00 -1.84 0.00 0.00 35.03 32.09 3htx n LYS 861 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 3htx s PHE 862 N -2.55 1.64 -0.36 2.13 -0.12 -1.26 -5.05 117.98 112.41 3htx s PHE 862 Ca -0.32 -1.03 0.02 0.00 -0.05 0.00 0.00 56.93 55.55 3htx s PHE 862 Cb 0.09 -0.99 0.15 0.00 -0.63 0.00 0.00 43.02 41.64 3htx s PHE 862 CO 0.47 -0.14 0.30 -2.00 -0.05 0.00 0.00 175.22 173.80 3htx s GLU 863 N -3.93 0.58 0.94 1.99 2.12 -1.26 -4.87 118.70 114.26 3htx s GLU 863 Ca 0.34 -1.02 -0.10 0.00 0.36 0.00 0.00 54.97 54.54 3htx s GLU 863 Cb 0.07 -0.96 0.16 0.00 0.26 0.00 0.00 34.13 33.66 3htx s GLU 863 CO 0.12 -1.19 1.12 -1.58 -0.54 0.00 0.00 175.26 173.19 3htx s TRP 864 N 1.33 1.68 0.31 5.30 0.51 -1.26 -4.29 118.94 122.53 3htx s TRP 864 Ca 0.17 1.68 0.07 0.00 -2.12 0.00 0.00 56.10 55.89 3htx s TRP 864 Cb -0.18 -3.28 -0.02 0.00 -0.81 0.00 0.00 33.47 29.18 3htx s TRP 864 CO -0.03 -2.86 0.39 0.99 -0.51 0.00 0.00 176.95 174.93 3htx s THR 865 N -2.65 4.16 0.25 2.01 2.01 -1.26 0.45 115.64 120.60 3htx s THR 865 Ca 0.66 -1.11 -0.07 0.00 0.31 0.00 0.00 61.69 61.48 3htx s THR 865 Cb -0.22 -3.43 0.33 0.00 0.01 0.00 0.00 72.50 69.19 3htx s THR 865 CO 0.59 -0.20 1.61 0.03 -0.69 0.00 0.00 174.62 175.95 3htx h ARG 866 N 1.06 0.04 0.01 4.92 3.08 -1.93 -0.08 114.38 121.48 3htx h ARG 866 Ca -0.47 -0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.41 3htx h ARG 866 Cb 1.25 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 31.31 3htx h ARG 866 CO 0.56 0.03 -0.68 1.05 -1.07 0.00 0.00 179.97 179.85 3htx h GLU 867 N 0.04 0.44 -0.19 0.04 4.11 -1.98 -0.98 114.58 116.06 3htx h GLU 867 Ca 0.43 -0.49 0.04 0.00 0.07 0.00 0.00 59.36 59.41 3htx h GLU 867 Cb 0.74 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.10 3htx h GLU 867 CO -0.78 1.15 -0.03 1.96 0.07 0.00 0.00 179.01 181.38 3htx h GLN 868 N -0.07 0.02 -0.35 1.06 4.20 -1.80 0.38 115.11 118.55 3htx h GLN 868 Ca -0.09 -0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 3htx h GLN 868 Cb 1.40 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.16 3htx h GLN 868 CO 0.13 0.01 0.07 0.35 -0.67 0.00 0.00 178.83 178.72 3htx h PHE 869 N 0.02 0.60 -0.73 2.96 3.57 -1.12 -0.31 116.94 121.94 3htx h PHE 869 Ca 0.09 -0.08 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 3htx h PHE 869 Cb 0.13 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 3htx h PHE 869 CO -0.20 0.62 0.22 -0.97 -2.23 0.00 0.00 178.31 175.75 3htx h ASN 870 N 0.41 1.06 -0.02 0.41 -1.24 -0.80 -1.15 115.58 114.25 3htx h ASN 870 Ca 0.11 -0.20 -0.00 0.00 0.71 0.00 0.00 56.30 56.91 3htx h ASN 870 Cb 0.34 -0.28 -0.00 0.00 0.73 0.00 0.00 38.32 39.11 3htx h ASN 870 CO 0.00 0.99 0.01 1.56 -1.29 0.00 0.00 177.43 178.70 3htx h GLN 871 N 1.09 0.03 0.09 6.67 4.20 -0.12 -1.17 115.11 125.90 3htx h GLN 871 Ca 0.23 -0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.96 3htx h GLN 871 Cb 0.32 -0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.05 3htx h GLN 871 CO -0.01 0.17 -0.38 2.35 -0.67 0.00 0.00 178.83 180.29 3htx h TRP 872 N -0.12 -1.06 -0.64 2.96 7.01 -0.83 -1.49 115.95 121.77 3htx h TRP 872 Ca 0.01 0.03 0.07 0.00 2.11 0.00 0.00 58.89 61.11 3htx h TRP 872 Cb 0.16 0.46 -0.06 0.00 -2.10 0.00 0.00 29.16 27.61 3htx h TRP 872 CO -0.02 -0.48 0.33 0.00 -2.79 0.00 0.00 178.44 175.47 3htx h ALA 873 N -0.03 0.86 0.18 2.65 0.00 -1.12 -2.90 119.26 118.90 3htx h ALA 873 Ca 0.03 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3htx h ALA 873 Cb 0.64 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3htx h ALA 873 CO -0.24 -0.04 -0.16 0.77 0.00 0.00 0.00 179.25 179.58 3htx h SER 874 N 0.59 -0.41 -0.02 0.00 0.02 -0.87 0.13 113.55 113.00 3htx h SER 874 Ca 0.30 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 3htx h SER 874 Cb 0.26 0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.94 3htx h SER 874 CO -0.22 -0.24 0.01 0.11 -1.14 0.00 0.00 176.83 175.35 3htx h LYS 875 N -0.36 0.00 0.14 3.45 1.57 -1.12 0.44 116.57 120.70 3htx h LYS 875 Ca -0.00 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.46 3htx h LYS 875 Cb 0.33 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 3htx h LYS 875 CO -0.02 0.00 -1.58 1.25 -0.57 0.00 0.00 179.45 178.53 3htx h LEU 876 N 0.00 0.47 -0.81 2.94 5.85 -1.32 -2.64 115.31 119.80 3htx h LEU 876 Ca 0.01 -0.65 -0.12 0.00 0.84 0.00 0.00 57.88 57.95 3htx h LEU 876 Cb 0.04 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3htx h LEU 876 CO -0.00 1.54 -0.59 1.23 -0.34 0.00 0.00 178.44 180.28 3htx h GLY 877 N 1.36 0.02 1.73 3.75 0.00 0.32 -2.36 103.07 107.89 3htx h GLY 877 Ca -0.27 -0.02 -0.25 0.00 0.00 0.00 0.00 47.33 46.79 3htx h GLY 877 CO 0.17 0.02 -1.18 1.70 0.00 0.00 0.00 176.54 177.25 3htx h LYS 878 N 0.01 0.14 -0.54 4.80 3.64 -0.22 -3.04 116.57 121.36 3htx h LYS 878 Ca -0.01 -0.24 -0.02 0.00 -1.27 0.00 0.00 60.65 59.12 3htx h LYS 878 Cb 1.04 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 3htx h LYS 878 CO 0.08 1.08 0.26 -0.09 -2.27 0.00 0.00 179.45 178.51 3htx h ARG 879 N 0.04 0.77 -6.28 1.90 2.43 -1.38 -3.44 114.38 108.42 3htx h ARG 879 Ca -0.10 -0.11 -0.46 0.00 -0.81 0.00 0.00 59.98 58.50 3htx h ARG 879 Cb 1.89 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 31.29 3htx h ARG 879 CO 0.16 0.63 -0.34 -1.01 -1.51 0.00 0.00 179.97 177.90 3htx s HIS 880 N -5.73 2.80 0.00 2.20 3.76 -0.90 -4.97 115.29 112.46 3htx s HIS 880 Ca -0.13 -0.42 -0.01 0.00 -0.15 0.00 0.00 55.06 54.35 3htx s HIS 880 Cb 0.12 -2.19 -0.06 0.00 1.11 0.00 0.00 32.58 31.56 3htx s HIS 880 CO 0.77 -0.19 1.55 0.09 -0.85 0.00 0.00 174.74 176.12 3htx n ASN 881 N -1.64 2.95 -4.26 1.40 3.02 -1.26 -4.73 115.26 110.73 3htx n ASN 881 Ca 0.04 -1.89 -0.27 0.00 -0.03 0.00 0.00 54.58 52.43 3htx n ASN 881 Cb 0.60 -0.69 -0.15 0.00 -0.61 0.00 0.00 39.78 38.93 3htx n ASN 881 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3htx s TYR 882 N 1.28 1.95 0.04 3.10 1.51 -1.15 -1.51 117.35 122.56 3htx s TYR 882 Ca 0.15 -0.38 -0.09 0.00 -1.01 0.00 0.00 57.07 55.74 3htx s TYR 882 Cb 0.07 -1.20 -0.05 0.00 -0.11 0.00 0.00 41.96 40.67 3htx s TYR 882 CO 0.00 0.05 0.35 -1.54 -1.11 0.00 0.00 175.55 173.29 3htx s SER 883 N -0.91 6.60 -0.26 2.29 1.04 -0.96 -4.18 113.70 117.32 3htx s SER 883 Ca 0.09 0.72 0.03 0.00 0.48 0.00 0.00 55.95 57.27 3htx s SER 883 Cb -0.09 -2.15 0.06 0.00 0.10 0.00 0.00 66.02 63.94 3htx s SER 883 CO 0.01 0.23 -0.10 -0.69 0.98 0.00 0.00 173.24 173.66 3htx s VAL 884 N -1.30 2.21 -0.53 5.02 1.01 -1.26 -2.93 120.40 122.62 3htx s VAL 884 Ca 0.29 -1.63 -0.17 0.00 0.00 0.00 0.00 61.98 60.48 3htx s VAL 884 Cb -0.14 -2.30 0.10 0.00 0.00 0.00 0.00 36.38 34.04 3htx s VAL 884 CO 0.16 -0.03 0.51 -0.70 0.00 0.00 0.00 175.10 175.04 3htx s GLU 885 N 1.11 3.01 0.36 2.72 2.12 -0.83 -4.92 118.70 122.26 3htx s GLU 885 Ca -0.09 -1.48 -0.06 0.00 0.36 0.00 0.00 54.97 53.70 3htx s GLU 885 Cb -0.20 -4.23 -0.05 0.00 0.26 0.00 0.00 34.13 29.91 3htx s GLU 885 CO -0.05 -1.27 0.64 -0.06 -0.54 0.00 0.00 175.26 173.99 3htx s PHE 886 N 1.86 3.49 0.00 5.30 0.40 -1.26 -1.98 117.98 125.79 3htx s PHE 886 Ca 0.06 0.73 0.00 0.00 -0.60 0.00 0.00 56.93 57.12 3htx s PHE 886 Cb -0.27 -2.19 0.00 0.00 0.51 0.00 0.00 43.02 41.07 3htx s PHE 886 CO 0.05 0.02 0.00 -1.13 0.70 0.00 0.00 175.22 174.87 3htx n SER 887 N -1.35 0.00 -2.97 1.36 3.41 -0.93 -5.00 113.62 108.15 3htx n SER 887 Ca -0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.49 3htx n SER 887 Cb 0.54 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.50 3htx n SER 887 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3htx s GLY 888 N 0.00 0.78 0.11 5.00 0.00 -1.26 0.22 107.32 112.16 3htx s GLY 888 Ca 0.00 -1.03 0.10 0.00 0.00 0.00 0.00 44.72 43.79 3htx s GLY 888 CO 0.00 -0.55 -0.26 0.14 0.00 0.00 0.00 173.10 172.43 3htx s VAL 889 N -2.46 2.26 -0.02 1.40 1.01 0.15 -4.92 120.40 117.82 3htx s VAL 889 Ca 0.21 -1.64 -0.00 0.00 0.00 0.00 0.00 61.98 60.54 3htx s VAL 889 Cb -0.04 -1.97 0.00 0.00 0.00 0.00 0.00 36.38 34.38 3htx s VAL 889 CO 0.15 0.17 0.01 0.61 0.00 0.00 0.00 175.10 176.04 3htx n GLY 890 N 1.15 -2.03 0.00 4.51 0.00 -1.26 -1.09 105.19 106.47 3htx n GLY 890 Ca -0.18 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.71 3htx n GLY 890 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3htx n GLY 891 N -0.17 0.38 2.90 -0.02 0.00 -1.26 -0.28 105.19 106.73 3htx n GLY 891 Ca 0.00 -1.90 -0.12 0.00 0.00 0.00 0.00 46.02 44.00 3htx n GLY 891 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3htx s SER 892 N -4.00 -0.03 0.00 1.61 0.01 -0.86 -4.95 113.70 105.47 3htx s SER 892 Ca 0.00 0.08 0.13 0.00 1.31 0.00 0.00 55.95 57.46 3htx s SER 892 Cb 0.00 0.07 0.63 0.00 0.21 0.00 0.00 66.02 66.93 3htx s SER 892 CO 0.00 -0.03 1.31 0.61 0.41 0.00 0.00 173.24 175.55 3htx n GLY 893 N 3.17 -0.70 0.18 3.44 0.00 -1.26 -3.18 105.19 106.84 3htx n GLY 893 Ca -0.14 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 3htx n GLY 893 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3htx n GLU 894 N -1.28 0.56 -0.90 1.61 4.71 -1.26 -4.84 120.64 119.24 3htx n GLU 894 Ca 0.06 0.25 -0.35 0.00 -0.01 0.00 0.00 57.16 57.11 3htx n GLU 894 Cb 0.10 -1.45 0.08 0.00 -1.01 0.00 0.00 31.44 29.16 3htx n GLU 894 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 3htx n VAL 895 N -4.20 0.00 -0.29 2.62 0.31 -1.19 -4.81 118.33 110.76 3htx n VAL 895 Ca -0.51 -0.31 -0.00 0.00 -0.01 0.00 0.00 64.34 63.50 3htx n VAL 895 Cb 0.86 -0.27 0.06 0.00 -0.91 0.00 0.00 33.84 33.58 3htx n VAL 895 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3htx h GLU 896 N -1.30 -0.05 0.32 5.55 5.08 -1.96 -2.86 114.58 119.36 3htx h GLU 896 Ca -0.44 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.91 3htx h GLU 896 Cb 1.31 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.58 3htx h GLU 896 CO 0.28 -0.03 -0.15 -1.00 -1.00 0.00 0.00 179.01 177.11 3htx h PRO 897 N -0.05 -0.41 0.00 2.33 0.13 -1.89 -3.50 132.00 128.60 3htx h PRO 897 Ca 0.34 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.50 3htx h PRO 897 Cb 0.59 0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.82 3htx h PRO 897 CO -0.85 -0.08 0.00 0.41 -0.23 0.00 0.00 178.00 177.25 3htx n GLY 898 N -0.02 0.17 3.82 1.56 0.00 -1.08 -4.72 105.19 104.91 3htx n GLY 898 Ca -0.09 -1.35 -0.22 0.00 0.00 0.00 0.00 46.02 44.36 3htx n GLY 898 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3htx s PHE 899 N 0.00 2.72 -0.10 1.61 2.99 -1.25 -2.03 117.98 121.92 3htx s PHE 899 Ca 0.00 -0.46 -0.24 0.00 0.00 0.00 0.00 56.93 56.23 3htx s PHE 899 Cb 0.00 -1.97 -0.28 0.00 0.00 0.00 0.00 43.02 40.77 3htx s PHE 899 CO 0.00 0.08 0.78 0.00 -0.00 0.00 0.00 175.22 176.08 3htx h ALA 900 N 1.24 -0.01 -3.48 5.36 0.00 1.00 -3.42 119.26 119.95 3htx h ALA 900 Ca -0.43 -0.68 -0.63 0.00 0.00 0.00 0.00 54.91 53.18 3htx h ALA 900 Cb 1.26 0.12 -0.40 0.00 0.00 0.00 0.00 17.79 18.77 3htx h ALA 900 CO 0.61 0.28 -0.73 -1.12 0.00 0.00 0.00 179.25 178.29 3htx s SER 901 N -6.66 4.48 0.19 0.00 0.01 -0.51 -0.42 113.70 110.79 3htx s SER 901 Ca -0.17 -1.95 -0.30 0.00 1.31 0.00 0.00 55.95 54.84 3htx s SER 901 Cb -0.00 -1.33 -0.08 0.00 0.21 0.00 0.00 66.02 64.82 3htx s SER 901 CO 0.76 -0.39 1.16 0.00 0.41 0.00 0.00 173.24 175.17 3htx s GLN 902 N 1.18 4.53 -0.05 12.44 -2.07 -0.49 -0.68 119.66 134.54 3htx s GLN 902 Ca 0.10 1.82 0.00 0.00 -1.82 0.00 0.00 55.36 55.47 3htx s GLN 902 Cb -0.18 -3.24 0.02 0.00 -1.09 0.00 0.00 33.01 28.52 3htx s GLN 902 CO -0.15 -0.01 -0.03 0.96 -1.32 0.00 0.00 175.29 174.75 3htx s ILE 903 N -0.24 0.43 -0.24 3.63 -4.36 0.58 -2.23 121.20 118.77 3htx s ILE 903 Ca 0.51 -0.03 -0.13 0.00 -0.26 0.00 0.00 60.65 60.73 3htx s ILE 903 Cb -0.32 -0.49 -0.04 0.00 1.25 0.00 0.00 42.46 42.86 3htx s ILE 903 CO 0.37 0.21 0.28 0.00 0.24 0.00 0.00 174.94 176.04 3htx s ALA 904 N 1.11 3.57 -0.02 2.27 0.00 -1.12 -2.19 121.76 125.38 3htx s ALA 904 Ca -0.08 -0.79 -0.05 0.00 0.00 0.00 0.00 51.96 51.05 3htx s ALA 904 Cb -0.14 -2.52 -0.04 0.00 0.00 0.00 0.00 23.12 20.42 3htx s ALA 904 CO -0.01 -0.37 0.21 0.42 0.00 0.00 0.00 175.76 176.01 3htx s ILE 905 N 1.43 5.40 -0.03 0.00 1.01 -0.84 -2.53 121.20 125.64 3htx s ILE 905 Ca 0.13 0.02 0.05 0.00 0.00 0.00 0.00 60.65 60.85 3htx s ILE 905 Cb -0.15 -3.53 -0.01 0.00 0.01 0.00 0.00 42.46 38.78 3htx s ILE 905 CO 0.07 0.38 -0.19 -0.36 0.00 0.00 0.00 174.94 174.85 3htx s PHE 906 N -1.27 1.79 -0.06 3.97 0.40 -0.19 -1.96 117.98 120.65 3htx s PHE 906 Ca 0.26 -0.42 0.01 0.00 -0.60 0.00 0.00 56.93 56.17 3htx s PHE 906 Cb -0.13 -1.17 0.02 0.00 0.51 0.00 0.00 43.02 42.25 3htx s PHE 906 CO 0.16 -0.09 -0.06 1.03 0.70 0.00 0.00 175.22 176.96 3htx s ARG 907 N -0.26 1.04 0.97 0.44 0.52 -1.15 -1.83 118.95 118.69 3htx s ARG 907 Ca 0.03 -0.15 -0.12 0.00 -0.52 0.00 0.00 55.73 54.97 3htx s ARG 907 Cb -0.09 -1.05 0.17 0.00 0.52 0.00 0.00 34.95 34.50 3htx s ARG 907 CO 0.01 -0.12 1.08 0.50 0.02 0.00 0.00 175.30 176.79 3htx s ARG 908 N 1.12 0.61 0.00 3.54 3.52 -0.62 -2.27 118.95 124.86 3htx s ARG 908 Ca -0.07 0.84 0.00 0.00 -0.13 0.00 0.00 55.73 56.36 3htx s ARG 908 Cb -0.14 -1.73 0.00 0.00 -1.56 0.00 0.00 34.95 31.52 3htx s ARG 908 CO -0.01 -2.69 0.00 0.39 -0.81 0.00 0.00 175.30 172.18 3htx n GLU 909 N -4.19 2.54 0.00 5.12 -0.58 -0.57 -4.89 120.64 118.07 3htx n GLU 909 Ca 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 3htx n GLU 909 Cb 0.55 -0.78 0.00 0.00 -0.57 0.00 0.00 31.44 30.64 3htx n GLU 909 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 3htx n GLU 918 N -0.95 0.00 -0.26 3.49 2.13 -1.26 -5.03 120.64 118.75 3htx n GLU 918 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3htx n GLU 918 Cb 0.06 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.77 3htx n GLU 918 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 3htx n SER 919 N 0.00 0.00 -3.82 4.31 3.41 -1.26 -5.17 113.62 111.09 3htx n SER 919 Ca 0.00 -0.25 -0.22 0.00 -0.26 0.00 0.00 58.87 58.14 3htx n SER 919 Cb 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 63.78 3htx n SER 919 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3htx s SER 920 N 1.25 1.36 -0.28 4.04 1.04 -1.26 -4.73 113.70 115.11 3htx s SER 920 Ca 0.00 -0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.28 3htx s SER 920 Cb 0.00 -0.46 0.16 0.00 0.10 0.00 0.00 66.02 65.82 3htx s SER 920 CO 0.00 -0.14 0.56 0.00 0.98 0.00 0.00 173.24 174.64 3htx s MET 921 N 1.56 0.51 -0.45 4.02 0.23 -1.26 -4.95 119.30 118.97 3htx s MET 921 Ca -0.01 1.05 -0.12 0.00 -1.03 0.00 0.00 55.69 55.58 3htx s MET 921 Cb -0.13 0.45 0.08 0.00 -1.53 0.00 0.00 34.83 33.70 3htx s MET 921 CO -0.03 -0.49 0.32 -0.65 -2.03 0.00 0.00 175.02 172.14 3htx s GLN 922 N 2.79 2.73 0.07 3.16 -0.21 -1.26 -2.80 119.66 124.14 3htx s GLN 922 Ca 0.11 -1.46 0.17 0.00 0.02 0.00 0.00 55.36 54.20 3htx s GLN 922 Cb -0.14 -3.93 -0.13 0.00 1.00 0.00 0.00 33.01 29.81 3htx s GLN 922 CO -0.19 -1.01 0.83 -2.30 -2.12 0.00 0.00 175.29 170.50 3htx n PRO 923 N 5.02 0.62 -1.82 2.91 -0.02 -1.26 -4.93 135.00 135.52 3htx n PRO 923 Ca -0.11 0.22 -0.33 0.00 -2.02 0.00 0.00 63.50 61.26 3htx n PRO 923 Cb 0.43 -1.81 0.04 0.00 -0.02 0.00 0.00 33.50 32.14 3htx n PRO 923 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 3htx s TYR 924 N -2.94 2.73 -0.28 6.00 2.02 -1.26 -4.94 117.35 118.68 3htx s TYR 924 Ca -0.03 1.54 0.01 0.00 -0.37 0.00 0.00 57.07 58.22 3htx s TYR 924 Cb 0.09 -3.12 0.06 0.00 -0.40 0.00 0.00 41.96 38.59 3htx s TYR 924 CO 0.81 -1.53 -0.06 0.15 -1.57 0.00 0.00 175.55 173.35 3htx s LYS 925 N -4.12 2.31 0.05 -0.62 1.02 -1.15 -4.90 119.74 112.33 3htx s LYS 925 Ca 0.66 -1.32 -0.34 0.00 0.02 0.00 0.00 55.97 54.98 3htx s LYS 925 Cb -0.19 -3.01 -0.13 0.00 -0.52 0.00 0.00 37.83 33.97 3htx s LYS 925 CO 0.41 -0.60 1.68 0.28 -0.92 0.00 0.00 175.35 176.20 3htx n VAL 926 N 4.51 0.23 -0.12 3.17 0.31 -1.26 -2.59 118.33 122.57 3htx n VAL 926 Ca -0.13 -0.04 -0.17 0.00 -0.01 0.00 0.00 64.34 63.99 3htx n VAL 926 Cb 0.43 -1.61 -0.11 0.00 -0.91 0.00 0.00 33.84 31.64 3htx n VAL 926 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3htx n ILE 927 N 4.04 1.38 -3.75 2.52 5.41 -0.36 -4.93 119.36 123.67 3htx n ILE 927 Ca 0.19 -0.54 -0.13 0.00 1.00 0.00 0.00 62.75 63.28 3htx n ILE 927 Cb 0.28 -1.34 -0.13 0.00 -0.71 0.00 0.00 39.64 37.74 3htx n ILE 927 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 176.55 177.41 3htx s TRP 928 N -2.48 -0.27 0.02 1.39 -0.00 -1.23 -1.99 118.94 114.38 3htx s TRP 928 Ca -0.32 0.66 0.03 0.00 -0.00 0.00 0.00 56.10 56.47 3htx s TRP 928 Cb 0.08 0.02 -0.02 0.00 -0.00 0.00 0.00 33.47 33.56 3htx s TRP 928 CO 0.56 -0.19 -0.09 -2.00 -0.00 0.00 0.00 176.95 175.23 3htx s GLU 929 N 0.99 0.65 -0.25 5.86 2.12 -1.26 -1.59 118.70 125.22 3htx s GLU 929 Ca -0.07 -0.55 -0.03 0.00 0.36 0.00 0.00 54.97 54.68 3htx s GLU 929 Cb -0.09 -0.57 0.14 0.00 0.26 0.00 0.00 34.13 33.87 3htx s GLU 929 CO -0.06 0.14 0.43 -0.46 -0.54 0.00 0.00 175.26 174.77 3htx s TRP 930 N -0.73 -0.98 0.01 5.30 -0.00 -0.91 -5.02 118.94 116.61 3htx s TRP 930 Ca -0.02 1.14 0.03 0.00 -0.00 0.00 0.00 56.10 57.26 3htx s TRP 930 Cb -0.06 0.18 -0.03 0.00 -0.00 0.00 0.00 33.47 33.56 3htx s TRP 930 CO 0.00 -0.71 -0.06 0.15 -0.00 0.00 0.00 176.95 176.34 3htx s LYS 931 N 2.62 2.57 -0.41 5.86 1.02 -1.25 -1.79 119.74 128.36 3htx s LYS 931 Ca 0.12 -0.72 -0.20 0.00 0.02 0.00 0.00 55.97 55.18 3htx s LYS 931 Cb -0.15 -2.52 0.02 0.00 -0.52 0.00 0.00 37.83 34.66 3htx s LYS 931 CO -0.16 0.60 0.61 0.21 -0.92 0.00 0.00 175.35 175.68 3htx s LYS 932 N -1.50 3.39 0.00 1.68 2.36 -0.37 -5.01 119.74 120.29 3htx s LYS 932 Ca 0.18 -0.29 0.00 0.00 -2.55 0.00 0.00 55.97 53.31 3htx s LYS 932 Cb -0.11 -3.90 0.00 0.00 -1.05 0.00 0.00 37.83 32.76 3htx s LYS 932 CO 0.08 -0.89 0.42 0.39 1.55 0.00 0.00 175.35 176.90