#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xdw s LEU 2 N 0.00 3.23 -0.07 -0.89 1.02 -1.26 -4.80 118.68 115.91 2xdw s LEU 2 Ca 0.00 -0.22 0.18 0.00 0.02 0.00 0.00 54.13 54.10 2xdw s LEU 2 Cb 0.00 -2.55 0.61 0.00 0.02 0.00 0.00 46.19 44.27 2xdw s LEU 2 CO 0.00 -2.08 1.52 -1.20 0.02 0.00 0.00 176.35 174.62 2xdw n SER 3 N 10.91 4.16 -4.46 2.29 7.64 -1.26 -4.93 113.62 127.97 2xdw n SER 3 Ca 0.14 -2.31 -0.22 0.00 1.01 0.00 0.00 58.87 57.49 2xdw n SER 3 Cb 0.50 -0.49 -0.11 0.00 -1.01 0.00 0.00 64.21 63.11 2xdw n SER 3 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2xdw s PHE 4 N -1.58 2.00 0.00 1.43 -0.12 -1.26 -5.15 117.98 113.30 2xdw s PHE 4 Ca 0.45 -0.88 0.08 0.00 -0.05 0.00 0.00 56.93 56.52 2xdw s PHE 4 Cb 0.27 -1.29 -0.02 0.00 -0.63 0.00 0.00 43.02 41.35 2xdw s PHE 4 CO 0.24 0.10 -0.26 1.14 -0.05 0.00 0.00 175.22 176.38 2xdw s GLN 5 N -3.85 1.98 0.43 1.99 -2.07 -1.26 -5.12 119.66 111.77 2xdw s GLN 5 Ca 0.35 -0.97 -0.24 0.00 -1.82 0.00 0.00 55.36 52.67 2xdw s GLN 5 Cb 0.08 -1.99 -0.08 0.00 -1.09 0.00 0.00 33.01 29.93 2xdw s GLN 5 CO 0.15 0.54 1.19 0.71 -1.32 0.00 0.00 175.29 176.56 2xdw s TYR 6 N -0.66 2.93 0.59 9.60 2.02 -1.26 -4.98 117.35 125.58 2xdw s TYR 6 Ca 0.10 1.52 -0.18 0.00 -0.37 0.00 0.00 57.07 58.15 2xdw s TYR 6 Cb -0.10 -3.44 -0.03 0.00 -0.40 0.00 0.00 41.96 37.98 2xdw s TYR 6 CO -0.00 -1.56 1.13 -1.25 -1.57 0.00 0.00 175.55 172.30 2xdw s PRO 7 N -2.47 3.09 0.20 -1.71 0.04 -1.26 -4.98 135.00 127.92 2xdw s PRO 7 Ca 0.60 1.57 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 2xdw s PRO 7 Cb -0.31 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.17 2xdw s PRO 7 CO 0.39 -1.05 1.32 -0.51 0.04 0.00 0.00 177.00 177.19 2xdw s ASP 8 N -2.03 6.87 -0.12 6.66 1.01 -1.26 -5.02 116.67 122.79 2xdw s ASP 8 Ca 0.71 2.43 -0.02 0.00 0.71 0.00 0.00 52.55 56.38 2xdw s ASP 8 Cb -0.24 -2.61 0.04 0.00 1.01 0.00 0.00 42.92 41.12 2xdw s ASP 8 CO 0.33 -0.55 0.02 -0.69 0.21 0.00 0.00 175.17 174.49 2xdw s VAL 9 N 0.11 0.38 0.24 -1.27 1.01 -1.26 -5.06 120.40 114.55 2xdw s VAL 9 Ca 0.57 -0.11 -0.31 0.00 0.00 0.00 0.00 61.98 62.13 2xdw s VAL 9 Cb -0.37 -0.69 -0.13 0.00 0.00 0.00 0.00 36.38 35.19 2xdw s VAL 9 CO 0.39 0.07 1.51 0.00 0.00 0.00 0.00 175.10 177.07 2xdw n TYR 10 N 5.13 2.43 -3.70 5.22 9.36 -1.26 -4.98 117.16 129.36 2xdw n TYR 10 Ca -0.08 0.33 -0.38 0.00 3.32 0.00 0.00 57.90 61.10 2xdw n TYR 10 Cb 0.49 -2.53 -0.12 0.00 -0.63 0.00 0.00 39.34 36.55 2xdw n TYR 10 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2xdw s ARG 11 N -0.15 3.45 -0.96 2.98 0.52 -1.26 -4.74 118.95 118.78 2xdw s ARG 11 Ca 0.69 -0.63 -0.22 0.00 -0.52 0.00 0.00 55.73 55.04 2xdw s ARG 11 Cb -0.60 -3.47 0.07 0.00 0.52 0.00 0.00 34.95 31.48 2xdw s ARG 11 CO 0.46 -0.33 1.34 0.34 0.02 0.00 0.00 175.30 177.13 2xdw s ASP 12 N 1.61 6.49 0.00 0.23 2.15 -0.06 -4.83 116.67 122.26 2xdw s ASP 12 Ca 0.05 -1.48 0.17 0.00 0.43 0.00 0.00 52.55 51.72 2xdw s ASP 12 Cb -0.16 -2.52 0.81 0.00 -0.30 0.00 0.00 42.92 40.75 2xdw s ASP 12 CO 0.05 -1.43 1.54 -0.62 -0.17 0.00 0.00 175.17 174.54 2xdw n GLU 13 N 8.33 0.12 0.05 4.34 -0.58 -1.26 -2.17 120.64 129.47 2xdw n GLU 13 Ca 0.27 0.16 0.13 0.00 -0.42 0.00 0.00 57.16 57.30 2xdw n GLU 13 Cb 0.50 -1.50 0.33 0.00 -0.57 0.00 0.00 31.44 30.20 2xdw n GLU 13 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2xdw n THR 14 N -1.40 0.30 -2.52 2.62 -2.24 -1.26 -4.77 114.28 105.01 2xdw n THR 14 Ca 0.06 -0.18 -0.40 0.00 -2.27 0.00 0.00 64.05 61.26 2xdw n THR 14 Cb 0.17 -0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 2xdw n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2xdw s ALA 15 N -3.09 2.68 -0.04 6.98 0.00 -0.92 -4.93 121.76 122.43 2xdw s ALA 15 Ca 0.10 -1.78 0.01 0.00 0.00 0.00 0.00 51.96 50.28 2xdw s ALA 15 Cb 0.15 -4.40 0.02 0.00 0.00 0.00 0.00 23.12 18.89 2xdw s ALA 15 CO 0.65 -3.52 -0.04 0.42 0.00 0.00 0.00 175.76 173.27 2xdw s ILE 16 N 5.63 0.48 -0.01 0.00 1.01 -1.26 -1.08 121.20 125.96 2xdw s ILE 16 Ca 0.43 -0.09 0.04 0.00 0.00 0.00 0.00 60.65 61.02 2xdw s ILE 16 Cb -0.04 -0.52 -0.01 0.00 0.01 0.00 0.00 42.46 41.90 2xdw s ILE 16 CO 0.03 0.21 -0.12 -1.58 0.00 0.00 0.00 174.94 173.48 2xdw s GLN 17 N 0.96 1.03 -0.23 2.79 0.74 -0.27 -4.97 119.66 119.71 2xdw s GLN 17 Ca -0.10 -0.42 -0.20 0.00 0.05 0.00 0.00 55.36 54.69 2xdw s GLN 17 Cb -0.14 -0.98 -0.02 0.00 1.10 0.00 0.00 33.01 32.97 2xdw s GLN 17 CO -0.00 0.23 0.59 0.34 -0.55 0.00 0.00 175.29 175.90 2xdw s ASP 18 N -0.17 6.59 -0.50 6.67 2.15 -1.26 -0.81 116.67 129.34 2xdw s ASP 18 Ca 0.03 0.71 -0.04 0.00 0.43 0.00 0.00 52.55 53.68 2xdw s ASP 18 Cb -0.06 -2.32 0.13 0.00 -0.30 0.00 0.00 42.92 40.37 2xdw s ASP 18 CO -0.00 -0.29 0.32 -0.31 -0.17 0.00 0.00 175.17 174.71 2xdw s TYR 19 N 2.12 3.51 -1.44 -5.34 1.51 0.13 -4.77 117.35 113.07 2xdw s TYR 19 Ca 0.26 -2.42 -0.10 0.00 -1.01 0.00 0.00 57.07 53.80 2xdw s TYR 19 Cb -0.16 -3.28 0.06 0.00 -0.11 0.00 0.00 41.96 38.47 2xdw s TYR 19 CO 0.09 -0.94 0.70 0.72 -1.11 0.00 0.00 175.55 175.02 2xdw n HIS 20 N 4.28 -2.04 -0.03 2.71 8.25 -1.26 -0.90 115.22 126.22 2xdw n HIS 20 Ca 0.00 0.64 0.00 0.00 -0.26 0.00 0.00 57.72 58.10 2xdw n HIS 20 Cb 0.40 -3.75 0.00 0.00 1.12 0.00 0.00 29.99 27.76 2xdw n HIS 20 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2xdw n GLY 21 N -1.46 0.56 3.51 -1.41 0.00 -1.26 -5.05 105.19 100.08 2xdw n GLY 21 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 2xdw n GLY 21 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2xdw s HIS 22 N -2.22 3.20 0.04 1.61 5.65 -0.08 -5.07 115.29 118.43 2xdw s HIS 22 Ca 0.00 -0.25 -0.25 0.00 0.25 0.00 0.00 55.06 54.80 2xdw s HIS 22 Cb 0.00 -2.40 -0.05 0.00 -1.18 0.00 0.00 32.58 28.95 2xdw s HIS 22 CO 0.00 -0.34 0.78 0.15 -0.65 0.00 0.00 174.74 174.68 2xdw s LYS 23 N 1.69 4.51 -0.10 2.88 -0.14 -1.26 0.20 119.74 127.52 2xdw s LYS 23 Ca 0.06 1.09 0.02 0.00 -1.36 0.00 0.00 55.97 55.78 2xdw s LYS 23 Cb -0.17 -3.37 0.01 0.00 -1.68 0.00 0.00 37.83 32.62 2xdw s LYS 23 CO 0.09 0.25 -0.15 0.08 -0.76 0.00 0.00 175.35 174.86 2xdw s VAL 24 N 0.04 1.45 -0.02 3.17 1.01 0.01 -4.97 120.40 121.09 2xdw s VAL 24 Ca 0.40 -0.62 -0.17 0.00 0.00 0.00 0.00 61.98 61.59 2xdw s VAL 24 Cb -0.21 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.79 2xdw s VAL 24 CO 0.23 0.43 0.48 0.00 0.00 0.00 0.00 175.10 176.24 2xdw n ASP 26 N 2.47 1.83 0.23 0.00 2.03 -0.24 -4.98 116.55 117.89 2xdw n ASP 26 Ca -0.10 -3.04 0.16 0.00 0.52 0.00 0.00 54.79 52.32 2xdw n ASP 26 Cb 0.52 -0.65 0.74 0.00 -0.72 0.00 0.00 41.12 41.00 2xdw n ASP 26 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2xdw h PRO 27 N 4.05 0.00 -0.46 -0.67 0.13 -1.79 -1.77 132.00 131.50 2xdw h PRO 27 Ca 0.13 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.23 2xdw h PRO 27 Cb 0.78 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.89 2xdw h PRO 27 CO 0.63 0.00 0.03 0.66 -0.23 0.00 0.00 178.00 179.09 2xdw n TYR 28 N -2.67 1.64 -0.10 1.56 4.01 -1.26 -0.88 117.16 119.46 2xdw n TYR 28 Ca -0.00 -0.87 0.24 0.00 -0.16 0.00 0.00 57.90 57.11 2xdw n TYR 28 Cb 0.17 -0.45 0.70 0.00 -0.31 0.00 0.00 39.34 39.44 2xdw n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2xdw h ALA 29 N 2.87 2.66 0.00 -0.72 0.00 -1.69 -0.81 119.26 121.57 2xdw h ALA 29 Ca 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2xdw h ALA 29 Cb 1.80 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 2xdw h ALA 29 CO 0.41 -0.87 -0.03 0.11 0.00 0.00 0.00 179.25 178.88 2xdw h TRP 30 N 0.02 0.00 0.00 0.00 5.08 -1.85 -0.82 115.95 118.38 2xdw h TRP 30 Ca 0.35 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.32 2xdw h TRP 30 Cb 1.36 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.52 2xdw h TRP 30 CO -0.00 0.03 0.00 1.28 -1.28 0.00 0.00 178.44 178.47 2xdw n LEU 31 N -3.50 0.00 0.17 0.11 4.77 -0.31 -2.51 117.00 115.72 2xdw n LEU 31 Ca -0.03 0.41 0.13 0.00 -0.03 0.00 0.00 56.01 56.49 2xdw n LEU 31 Cb 0.13 -0.41 0.56 0.00 -2.33 0.00 0.00 43.42 41.37 2xdw n LEU 31 CO 0.26 -0.22 0.89 -0.33 -1.33 0.00 0.00 177.39 176.65 2xdw h GLU 32 N 0.00 0.00 -4.70 3.23 5.08 -1.33 -3.41 114.58 113.45 2xdw h GLU 32 Ca 0.00 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 57.65 2xdw h GLU 32 Cb 0.18 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 29.24 2xdw h GLU 32 CO 0.00 0.00 -0.10 0.34 -1.00 0.00 0.00 179.01 178.25 2xdw s ASP 33 N -4.54 6.19 0.39 1.42 -1.08 -1.05 -4.93 116.67 113.09 2xdw s ASP 33 Ca 0.03 -1.09 0.28 0.00 -0.52 0.00 0.00 52.55 51.25 2xdw s ASP 33 Cb 0.09 -2.25 1.11 0.00 -1.46 0.00 0.00 42.92 40.41 2xdw s ASP 33 CO 0.40 -0.80 1.83 1.55 0.52 0.00 0.00 175.17 178.67 2xdw h PRO 34 N 8.90 0.00 -0.01 4.34 0.13 -1.86 -3.19 132.00 140.31 2xdw h PRO 34 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2xdw h PRO 34 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2xdw h PRO 34 CO 0.93 0.00 -0.56 -0.25 -0.23 0.00 0.00 178.00 177.90 2xdw n ASP 35 N -2.65 1.18 -4.81 1.44 8.00 -1.26 -4.59 116.55 113.87 2xdw n ASP 35 Ca 0.02 -0.95 -0.33 0.00 0.71 0.00 0.00 54.79 54.23 2xdw n ASP 35 Cb 0.29 0.47 -0.02 0.00 -0.02 0.00 0.00 41.12 41.84 2xdw n ASP 35 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2xdw s SER 36 N -2.73 6.30 0.32 -2.24 1.04 -1.21 -4.91 113.70 110.27 2xdw s SER 36 Ca 0.16 1.79 0.00 0.00 0.48 0.00 0.00 55.95 58.38 2xdw s SER 36 Cb 0.18 -2.54 0.53 0.00 0.10 0.00 0.00 66.02 64.29 2xdw s SER 36 CO 0.66 -0.81 1.98 -0.33 0.98 0.00 0.00 173.24 175.72 2xdw h GLU 37 N 1.12 0.95 -0.19 4.02 4.39 -1.93 -1.42 114.58 121.52 2xdw h GLU 37 Ca -0.48 -0.07 0.01 0.00 0.34 0.00 0.00 59.36 59.17 2xdw h GLU 37 Cb 1.21 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 29.63 2xdw h GLU 37 CO 0.59 0.64 0.08 1.96 -1.16 0.00 0.00 179.01 181.13 2xdw h GLN 38 N 0.97 0.18 -0.39 2.33 7.50 -1.95 0.09 115.11 123.84 2xdw h GLN 38 Ca 0.26 -0.01 -0.06 0.00 0.50 0.00 0.00 58.65 59.34 2xdw h GLN 38 Cb -0.08 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 27.39 2xdw h GLN 38 CO -0.05 0.12 0.02 1.15 -1.50 0.00 0.00 178.83 178.56 2xdw h THR 39 N 0.18 1.25 -0.88 -0.54 2.02 -1.76 -1.17 112.91 112.02 2xdw h THR 39 Ca 0.08 -0.96 -0.02 0.00 0.77 0.00 0.00 66.41 66.28 2xdw h THR 39 Cb 0.03 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 2xdw h THR 39 CO -0.06 0.33 0.48 0.11 0.37 0.00 0.00 175.52 176.74 2xdw h LYS 40 N 0.51 1.22 -0.30 6.66 1.57 -1.15 -1.30 116.57 123.77 2xdw h LYS 40 Ca 0.11 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2xdw h LYS 40 Cb 0.44 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2xdw h LYS 40 CO 0.02 0.89 -0.25 0.00 -0.57 0.00 0.00 179.45 179.53 2xdw h ALA 41 N 1.30 1.01 -0.04 3.86 0.00 -0.78 -1.64 119.26 122.96 2xdw h ALA 41 Ca 0.31 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2xdw h ALA 41 Cb 0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2xdw h ALA 41 CO -0.05 0.59 0.01 0.35 0.00 0.00 0.00 179.25 180.16 2xdw h PHE 42 N 0.51 0.03 -0.47 0.00 3.04 -0.76 -0.95 116.94 118.35 2xdw h PHE 42 Ca 0.07 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.03 2xdw h PHE 42 Cb 0.71 -0.01 -0.02 0.00 2.56 0.00 0.00 35.95 39.19 2xdw h PHE 42 CO 0.03 0.01 0.29 0.28 -2.02 0.00 0.00 178.31 176.91 2xdw h VAL 43 N 0.04 1.13 -0.52 1.41 2.07 -1.04 -1.20 116.25 118.15 2xdw h VAL 43 Ca 0.02 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 2xdw h VAL 43 Cb 0.01 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 2xdw h VAL 43 CO -0.02 0.13 0.25 -0.08 0.02 0.00 0.00 177.57 177.88 2xdw h GLU 44 N 0.63 0.74 -0.38 1.57 4.57 -1.18 -0.70 114.58 119.82 2xdw h GLU 44 Ca 0.17 -0.11 -0.08 0.00 -1.18 0.00 0.00 59.36 58.17 2xdw h GLU 44 Cb -0.04 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 2xdw h GLU 44 CO -0.03 0.61 -0.08 0.00 -1.18 0.00 0.00 179.01 178.33 2xdw h ALA 45 N 1.09 1.15 -0.10 2.92 0.00 -0.85 -0.78 119.26 122.69 2xdw h ALA 45 Ca 0.18 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2xdw h ALA 45 Cb 0.11 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2xdw h ALA 45 CO -0.02 0.54 -0.14 1.96 0.00 0.00 0.00 179.25 181.59 2xdw h GLN 46 N 0.60 0.27 -0.35 0.00 1.08 -0.93 -3.09 115.11 112.69 2xdw h GLN 46 Ca 0.11 -0.16 0.01 0.00 -1.45 0.00 0.00 58.65 57.17 2xdw h GLN 46 Cb 0.49 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 2xdw h GLN 46 CO 0.03 0.72 0.23 -0.91 -0.95 0.00 0.00 178.83 177.95 2xdw h ASN 47 N -0.16 0.36 0.11 1.46 2.35 -0.99 -1.58 115.58 117.14 2xdw h ASN 47 Ca 0.01 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 2xdw h ASN 47 Cb 0.69 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.96 2xdw h ASN 47 CO 0.03 0.26 -0.13 0.50 -1.65 0.00 0.00 177.43 176.44 2xdw h LYS 48 N 0.43 0.04 0.05 0.81 3.64 -1.06 -1.29 116.57 119.20 2xdw h LYS 48 Ca 0.14 -0.01 -0.33 0.00 -1.27 0.00 0.00 60.65 59.18 2xdw h LYS 48 Cb 0.02 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 2xdw h LYS 48 CO -0.03 0.18 -1.88 0.44 -2.27 0.00 0.00 179.45 175.88 2xdw n ILE 49 N -4.36 1.67 -0.06 2.00 -5.35 -0.90 -4.42 119.36 107.94 2xdw n ILE 49 Ca -0.02 -0.73 -0.14 0.00 -0.27 0.00 0.00 62.75 61.59 2xdw n ILE 49 Cb 0.22 -1.32 -0.06 0.00 -1.74 0.00 0.00 39.64 36.74 2xdw n ILE 49 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2xdw h THR 50 N 0.03 1.34 -0.41 7.28 2.02 -1.05 -3.16 112.91 118.96 2xdw h THR 50 Ca -0.36 -1.48 -0.03 0.00 0.77 0.00 0.00 66.41 65.30 2xdw h THR 50 Cb 2.03 1.84 -0.02 0.00 -1.74 0.00 0.00 68.15 70.27 2xdw h THR 50 CO 0.08 0.45 0.12 0.58 0.37 0.00 0.00 175.52 177.12 2xdw h VAL 51 N 0.18 1.22 -0.01 3.16 2.07 -1.47 -1.44 116.25 119.96 2xdw h VAL 51 Ca 0.02 -0.72 -0.05 0.00 0.82 0.00 0.00 66.70 66.77 2xdw h VAL 51 Cb 0.85 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2xdw h VAL 51 CO 0.06 0.25 -0.24 -0.65 0.02 0.00 0.00 177.57 177.02 2xdw h PRO 52 N 0.51 0.02 -0.37 1.57 0.11 -1.77 -0.47 132.00 131.60 2xdw h PRO 52 Ca 0.13 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.17 2xdw h PRO 52 Cb 0.27 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2xdw h PRO 52 CO -0.00 0.26 -0.04 0.35 -0.21 0.00 0.00 178.00 178.36 2xdw h PHE 53 N 0.02 0.75 -0.37 0.65 3.57 -1.36 -1.86 116.94 118.33 2xdw h PHE 53 Ca 0.00 -0.14 -0.16 0.00 3.53 0.00 0.00 57.97 61.20 2xdw h PHE 53 Cb 0.44 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2xdw h PHE 53 CO 0.00 0.80 -0.38 -0.07 -2.23 0.00 0.00 178.31 176.43 2xdw h LEU 54 N 0.48 0.98 0.00 0.59 3.38 -0.88 -3.27 115.31 116.59 2xdw h LEU 54 Ca 0.10 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2xdw h LEU 54 Cb 0.52 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2xdw h LEU 54 CO 0.03 1.24 -0.11 -0.62 0.09 0.00 0.00 178.44 179.07 2xdw n GLU 55 N -4.08 0.19 0.05 1.13 1.02 -0.22 -4.37 120.64 114.36 2xdw n GLU 55 Ca -0.02 0.13 -0.13 0.00 -0.02 0.00 0.00 57.16 57.12 2xdw n GLU 55 Cb 0.54 -1.70 -0.08 0.00 -0.02 0.00 0.00 31.44 30.18 2xdw n GLU 55 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 2xdw h GLN 56 N 0.00 -0.10 -6.26 3.49 4.15 -1.38 -3.43 115.11 111.57 2xdw h GLN 56 Ca 0.00 0.01 -0.55 0.00 0.77 0.00 0.00 58.65 58.88 2xdw h GLN 56 Cb 0.67 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.35 2xdw h GLN 56 CO 0.00 0.15 0.25 0.00 -1.93 0.00 0.00 178.83 177.30 2xdw h PRO 58 N 6.72 0.00 -0.60 0.00 0.11 -1.95 -1.92 132.00 134.36 2xdw h PRO 58 Ca -0.41 0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.78 2xdw h PRO 58 Cb 1.21 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 2xdw h PRO 58 CO 0.75 0.00 0.40 0.97 -0.21 0.00 0.00 178.00 179.91 2xdw h ILE 59 N 0.00 0.93 -0.57 4.15 2.10 -1.95 -1.78 117.51 120.39 2xdw h ILE 59 Ca 0.29 -0.16 0.01 0.00 1.08 0.00 0.00 64.86 66.08 2xdw h ILE 59 Cb 2.10 0.42 -0.03 0.00 -1.09 0.00 0.00 36.82 38.21 2xdw h ILE 59 CO -0.00 0.09 0.37 -0.09 -1.08 0.00 0.00 178.15 177.43 2xdw h ARG 60 N 0.47 0.72 -0.18 2.19 2.43 -1.64 0.45 114.38 118.83 2xdw h ARG 60 Ca 0.27 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.28 2xdw h ARG 60 Cb 0.45 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2xdw h ARG 60 CO -0.08 0.48 -0.40 0.78 -1.51 0.00 0.00 179.97 179.24 2xdw h GLY 61 N 0.75 0.44 0.95 2.80 0.00 -1.55 0.15 103.07 106.60 2xdw h GLY 61 Ca 0.22 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 2xdw h GLY 61 CO -0.06 0.39 0.10 1.41 0.00 0.00 0.00 176.54 178.38 2xdw h LEU 62 N 0.34 0.65 -0.13 3.11 3.38 -1.02 -1.14 115.31 120.50 2xdw h LEU 62 Ca 0.03 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 2xdw h LEU 62 Cb 0.85 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 2xdw h LEU 62 CO 0.07 0.71 -0.03 0.22 0.09 0.00 0.00 178.44 179.50 2xdw h TYR 63 N 0.56 0.27 -0.58 1.13 5.03 -0.64 -1.75 116.97 120.99 2xdw h TYR 63 Ca 0.13 -0.06 0.04 0.00 2.58 0.00 0.00 58.73 61.43 2xdw h TYR 63 Cb 0.32 -0.07 -0.04 0.00 1.55 0.00 0.00 36.73 38.48 2xdw h TYR 63 CO 0.02 0.53 0.33 -0.22 -1.32 0.00 0.00 178.16 177.50 2xdw h LYS 64 N -0.06 0.62 -0.43 1.82 3.64 -0.66 0.13 116.57 121.62 2xdw h LYS 64 Ca 0.03 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2xdw h LYS 64 Cb 0.44 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 2xdw h LYS 64 CO 0.01 0.41 0.26 1.49 -2.27 0.00 0.00 179.45 179.35 2xdw h GLU 65 N 0.63 0.58 -0.58 1.90 4.81 -1.12 -0.30 114.58 120.50 2xdw h GLU 65 Ca 0.25 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.34 2xdw h GLU 65 Cb 0.10 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 2xdw h GLU 65 CO -0.14 0.42 -0.00 -0.09 -0.73 0.00 0.00 179.01 178.47 2xdw h ARG 66 N 0.57 1.00 -0.49 1.92 9.65 -0.90 -1.48 114.38 124.65 2xdw h ARG 66 Ca 0.15 -0.31 -0.03 0.00 -1.10 0.00 0.00 59.98 58.70 2xdw h ARG 66 Cb -0.01 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.45 2xdw h ARG 66 CO -0.03 0.99 0.20 1.98 2.80 0.00 0.00 179.97 185.91 2xdw h MET 67 N 0.92 0.73 -0.74 0.20 4.05 -0.59 0.10 114.93 119.61 2xdw h MET 67 Ca 0.17 -0.13 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 2xdw h MET 67 Cb 0.54 -0.12 -0.04 0.00 -0.80 0.00 0.00 31.60 31.18 2xdw h MET 67 CO 0.03 0.65 0.47 1.15 0.23 0.00 0.00 176.91 179.44 2xdw h THR 68 N 0.65 1.20 0.05 -0.77 2.02 -0.86 0.22 112.91 115.41 2xdw h THR 68 Ca 0.16 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.95 2xdw h THR 68 Cb 0.19 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.73 2xdw h THR 68 CO -0.01 0.20 -0.03 -0.08 0.37 0.00 0.00 175.52 175.97 2xdw h GLU 69 N 1.00 -0.07 0.00 6.66 4.81 -1.06 -3.10 114.58 122.83 2xdw h GLU 69 Ca 0.27 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.35 2xdw h GLU 69 Cb -0.08 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 2xdw h GLU 69 CO -0.06 0.32 -0.73 -0.07 -0.73 0.00 0.00 179.01 177.74 2xdw h LEU 70 N -0.47 0.00 -0.03 1.64 3.38 -0.70 -2.96 115.31 116.17 2xdw h LEU 70 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2xdw h LEU 70 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2xdw h LEU 70 CO 0.01 0.73 0.00 0.00 0.09 0.00 0.00 178.44 179.27 2xdw n TYR 71 N -3.53 0.46 -2.50 1.13 9.36 0.06 -4.43 117.16 117.70 2xdw n TYR 71 Ca -0.00 0.14 -0.43 0.00 3.32 0.00 0.00 57.90 60.93 2xdw n TYR 71 Cb 0.74 -0.72 -0.00 0.00 -0.63 0.00 0.00 39.34 38.73 2xdw n TYR 71 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2xdw n ASP 72 N -1.88 4.84 -4.04 2.98 2.03 -1.12 -4.73 116.55 114.63 2xdw n ASP 72 Ca 0.06 -2.91 -0.10 0.00 0.52 0.00 0.00 54.79 52.36 2xdw n ASP 72 Cb 0.37 -1.74 -0.11 0.00 -0.72 0.00 0.00 41.12 38.92 2xdw n ASP 72 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 2xdw s TYR 73 N 4.17 0.48 0.22 -0.67 -0.85 -1.26 -4.97 117.35 114.48 2xdw s TYR 73 Ca 0.53 -0.65 -0.30 0.00 -0.52 0.00 0.00 57.07 56.13 2xdw s TYR 73 Cb 0.05 -0.32 -0.10 0.00 0.38 0.00 0.00 41.96 41.98 2xdw s TYR 73 CO 0.07 -0.19 1.43 -1.25 -1.52 0.00 0.00 175.55 174.08 2xdw s PRO 74 N -2.15 4.29 -0.21 -3.49 0.04 -1.24 -3.94 135.00 128.29 2xdw s PRO 74 Ca -0.08 2.25 0.01 0.00 0.04 0.00 0.00 61.00 63.23 2xdw s PRO 74 Cb -0.05 -3.14 0.04 0.00 0.04 0.00 0.00 34.50 31.39 2xdw s PRO 74 CO -0.03 -0.41 -0.14 0.15 0.04 0.00 0.00 177.00 176.62 2xdw s LYS 75 N -0.07 2.40 0.06 4.56 1.02 -0.35 -4.90 119.74 122.46 2xdw s LYS 75 Ca 0.60 -0.97 0.07 0.00 0.02 0.00 0.00 55.97 55.69 2xdw s LYS 75 Cb -0.41 -2.58 -0.04 0.00 -0.52 0.00 0.00 37.83 34.28 2xdw s LYS 75 CO 0.40 -0.39 -0.15 0.71 -0.92 0.00 0.00 175.35 175.00 2xdw s TYR 76 N 1.28 2.63 0.65 3.18 2.02 -1.26 -0.92 117.35 124.93 2xdw s TYR 76 Ca -0.01 -0.21 -0.04 0.00 -0.37 0.00 0.00 57.07 56.43 2xdw s TYR 76 Cb -0.16 -1.46 0.05 0.00 -0.40 0.00 0.00 41.96 39.99 2xdw s TYR 76 CO -0.09 0.33 0.93 -1.54 -1.57 0.00 0.00 175.55 173.61 2xdw s SER 77 N -1.70 5.04 0.49 2.29 1.04 -0.38 -4.99 113.70 115.49 2xdw s SER 77 Ca 0.17 0.36 -0.23 0.00 0.48 0.00 0.00 55.95 56.72 2xdw s SER 77 Cb -0.11 -1.12 -0.07 0.00 0.10 0.00 0.00 66.02 64.82 2xdw s SER 77 CO 0.08 -1.40 1.27 0.00 0.98 0.00 0.00 173.24 174.17 2xdw s HIS 79 N -1.27 2.33 -0.09 0.00 3.76 -1.26 -4.55 115.29 114.21 2xdw s HIS 79 Ca 0.66 1.50 -0.08 0.00 -0.15 0.00 0.00 55.06 57.00 2xdw s HIS 79 Cb -0.46 -3.54 0.03 0.00 1.11 0.00 0.00 32.58 29.72 2xdw s HIS 79 CO 0.54 -2.38 0.24 -0.59 -0.85 0.00 0.00 174.74 171.71 2xdw s PHE 80 N -1.54 -0.28 -0.03 1.40 -0.71 -0.00 -4.68 117.98 112.13 2xdw s PHE 80 Ca 0.78 0.67 -0.15 0.00 -1.04 0.00 0.00 56.93 57.19 2xdw s PHE 80 Cb -0.32 0.09 -0.05 0.00 -1.21 0.00 0.00 43.02 41.52 2xdw s PHE 80 CO 0.35 -0.14 0.39 0.21 -1.34 0.00 0.00 175.22 174.69 2xdw s LYS 81 N 0.26 3.98 -0.11 1.99 2.20 -1.26 -0.67 119.74 126.12 2xdw s LYS 81 Ca -0.01 0.36 -0.02 0.00 -0.36 0.00 0.00 55.97 55.94 2xdw s LYS 81 Cb -0.03 -3.26 0.04 0.00 -1.51 0.00 0.00 37.83 33.07 2xdw s LYS 81 CO -0.01 0.59 0.02 0.15 -0.36 0.00 0.00 175.35 175.74 2xdw s LYS 82 N -0.72 0.56 7.04 4.03 -0.14 -0.26 -4.99 119.74 125.25 2xdw s LYS 82 Ca 0.23 -0.03 0.00 0.00 -1.36 0.00 0.00 55.97 54.81 2xdw s LYS 82 Cb -0.16 -1.31 0.00 0.00 -1.68 0.00 0.00 37.83 34.69 2xdw s LYS 82 CO 0.12 -0.42 0.00 0.41 -0.76 0.00 0.00 175.35 174.70 2xdw n GLY 83 N 5.14 3.68 0.35 -3.33 0.00 -1.25 -2.24 105.19 107.54 2xdw n GLY 83 Ca -0.07 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.05 2xdw n GLY 83 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2xdw n LYS 84 N 14.00 1.47 -4.26 1.61 5.02 -1.26 -4.94 118.16 129.80 2xdw n LYS 84 Ca 0.00 -0.70 -0.17 0.00 -2.02 0.00 0.00 58.31 55.41 2xdw n LYS 84 Cb 0.00 -1.39 -0.11 0.00 -0.02 0.00 0.00 35.03 33.51 2xdw n LYS 84 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2xdw s ARG 85 N -1.90 1.08 0.02 1.97 0.52 -0.95 -4.77 118.95 114.92 2xdw s ARG 85 Ca 0.34 -1.34 -0.01 0.00 -0.52 0.00 0.00 55.73 54.19 2xdw s ARG 85 Cb 0.17 -0.88 -0.04 0.00 0.52 0.00 0.00 34.95 34.72 2xdw s ARG 85 CO 0.27 0.15 0.18 0.71 0.02 0.00 0.00 175.30 176.64 2xdw s TYR 86 N -2.52 3.51 0.11 -0.53 1.51 -0.00 -1.11 117.35 118.32 2xdw s TYR 86 Ca 0.13 0.29 0.05 0.00 -1.01 0.00 0.00 57.07 56.53 2xdw s TYR 86 Cb -0.03 -1.79 -0.04 0.00 -0.11 0.00 0.00 41.96 40.00 2xdw s TYR 86 CO 0.03 0.61 -0.13 -0.06 -1.11 0.00 0.00 175.55 174.89 2xdw s PHE 87 N -1.39 1.31 0.02 2.71 0.40 0.15 -0.72 117.98 120.45 2xdw s PHE 87 Ca 0.30 -0.58 -0.28 0.00 -0.60 0.00 0.00 56.93 55.77 2xdw s PHE 87 Cb -0.13 -0.69 0.07 0.00 0.51 0.00 0.00 43.02 42.78 2xdw s PHE 87 CO 0.22 0.11 0.67 1.52 0.70 0.00 0.00 175.22 178.43 2xdw s TYR 88 N -2.20 -0.61 0.18 0.36 1.13 -0.87 -0.82 117.35 114.51 2xdw s TYR 88 Ca 0.08 0.84 -0.12 0.00 -1.41 0.00 0.00 57.07 56.45 2xdw s TYR 88 Cb -0.04 0.46 -0.07 0.00 -1.10 0.00 0.00 41.96 41.21 2xdw s TYR 88 CO 0.02 -0.68 0.55 -0.06 -2.51 0.00 0.00 175.55 172.87 2xdw s PHE 89 N -2.06 3.53 -0.19 -3.49 0.08 -1.26 -0.58 117.98 114.01 2xdw s PHE 89 Ca -0.07 0.98 -0.14 0.00 0.12 0.00 0.00 56.93 57.83 2xdw s PHE 89 Cb -0.00 -2.32 0.06 0.00 -0.57 0.00 0.00 43.02 40.18 2xdw s PHE 89 CO 0.02 0.37 0.49 -0.47 -0.10 0.00 0.00 175.22 175.53 2xdw s TYR 90 N -1.60 -0.64 -0.13 0.36 5.04 -0.18 -1.24 117.35 118.94 2xdw s TYR 90 Ca 0.41 1.42 0.02 0.00 -2.44 0.00 0.00 57.07 56.49 2xdw s TYR 90 Cb -0.13 0.28 0.01 0.00 0.35 0.00 0.00 41.96 42.47 2xdw s TYR 90 CO 0.20 -0.33 -0.19 1.21 -1.34 0.00 0.00 175.55 175.10 2xdw s ASN 91 N 0.90 2.85 0.63 4.32 3.84 -0.10 -1.14 114.94 126.25 2xdw s ASN 91 Ca -0.05 -0.54 0.37 0.00 0.21 0.00 0.00 52.86 52.85 2xdw s ASN 91 Cb -0.06 -1.30 2.10 0.00 -0.55 0.00 0.00 41.25 41.44 2xdw s ASN 91 CO -0.08 0.04 2.31 0.71 -2.79 0.00 0.00 177.10 177.29 2xdw h THR 92 N 5.90 0.29 0.00 -5.21 1.35 -1.88 -0.92 112.91 112.43 2xdw h THR 92 Ca -0.33 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 2xdw h THR 92 Cb 1.18 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 2xdw h THR 92 CO 0.54 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.42 2xdw n GLY 93 N -1.19 0.56 0.10 5.82 0.00 -1.25 -3.69 105.19 105.53 2xdw n GLY 93 Ca -0.03 0.12 0.02 0.00 0.00 0.00 0.00 46.02 46.14 2xdw n GLY 93 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2xdw n LEU 94 N 0.00 2.19 -4.76 0.99 4.77 -1.26 -4.44 117.00 114.49 2xdw n LEU 94 Ca 0.00 -2.20 -0.39 0.00 -0.03 0.00 0.00 56.01 53.39 2xdw n LEU 94 Cb 0.00 -0.11 0.03 0.00 -2.33 0.00 0.00 43.42 41.01 2xdw n LEU 94 CO 0.00 0.56 1.00 -1.10 -1.33 0.00 0.00 177.39 176.52 2xdw s GLN 95 N -1.35 3.45 0.33 3.23 -0.21 -1.26 -4.82 119.66 119.03 2xdw s GLN 95 Ca 0.09 2.26 0.01 0.00 0.02 0.00 0.00 55.36 57.73 2xdw s GLN 95 Cb 0.07 -2.45 0.56 0.00 1.00 0.00 0.00 33.01 32.18 2xdw s GLN 95 CO 0.02 -0.96 1.99 -0.91 -2.12 0.00 0.00 175.29 173.32 2xdw h ASN 96 N 1.91 0.83 -4.26 5.90 2.35 -1.95 -3.40 115.58 116.96 2xdw h ASN 96 Ca -0.51 -0.02 -0.44 0.00 -0.55 0.00 0.00 56.30 54.78 2xdw h ASN 96 Cb 1.28 -0.20 -0.26 0.00 0.05 0.00 0.00 38.32 39.18 2xdw h ASN 96 CO 0.59 0.59 -0.80 -1.10 -1.65 0.00 0.00 177.43 175.07 2xdw s GLN 97 N -5.82 0.95 0.61 0.81 -1.52 -1.26 -1.76 119.66 111.68 2xdw s GLN 97 Ca -0.11 -0.62 -0.17 0.00 -1.95 0.00 0.00 55.36 52.51 2xdw s GLN 97 Cb 0.18 -0.94 -0.02 0.00 -0.22 0.00 0.00 33.01 32.01 2xdw s GLN 97 CO 0.78 0.24 1.15 -0.98 -0.25 0.00 0.00 175.29 176.23 2xdw s ARG 98 N -0.77 2.95 -0.07 2.91 1.70 -1.26 -4.76 118.95 119.65 2xdw s ARG 98 Ca 0.03 1.61 0.02 0.00 -0.47 0.00 0.00 55.73 56.91 2xdw s ARG 98 Cb -0.07 -1.95 -0.03 0.00 -0.57 0.00 0.00 34.95 32.34 2xdw s ARG 98 CO 0.00 -1.17 -0.10 0.08 -1.08 0.00 0.00 175.30 173.03 2xdw s VAL 99 N -1.93 3.44 -0.19 4.99 1.01 -0.29 -4.53 120.40 122.90 2xdw s VAL 99 Ca 0.72 -0.57 -0.20 0.00 0.00 0.00 0.00 61.98 61.92 2xdw s VAL 99 Cb -0.25 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 2xdw s VAL 99 CO 0.35 0.59 0.60 -0.22 0.00 0.00 0.00 175.10 176.42 2xdw s LEU 100 N -0.67 4.16 0.20 3.92 2.96 -0.17 -1.02 118.68 128.06 2xdw s LEU 100 Ca 0.10 0.82 0.07 0.00 -0.22 0.00 0.00 54.13 54.90 2xdw s LEU 100 Cb -0.11 -2.85 -0.04 0.00 0.50 0.00 0.00 46.19 43.68 2xdw s LEU 100 CO 0.01 -0.23 0.06 -0.31 -1.32 0.00 0.00 176.35 174.56 2xdw s TYR 101 N 1.74 2.93 0.03 5.38 1.51 0.25 -0.54 117.35 128.66 2xdw s TYR 101 Ca 0.28 -0.12 0.04 0.00 -1.01 0.00 0.00 57.07 56.26 2xdw s TYR 101 Cb -0.16 -1.38 -0.02 0.00 -0.11 0.00 0.00 41.96 40.29 2xdw s TYR 101 CO 0.11 0.54 -0.12 0.54 -1.11 0.00 0.00 175.55 175.50 2xdw s VAL 102 N -1.89 0.95 0.04 0.71 0.11 -0.15 -2.06 120.40 118.11 2xdw s VAL 102 Ca 0.30 -0.91 -0.05 0.00 -2.93 0.00 0.00 61.98 58.38 2xdw s VAL 102 Cb -0.09 -0.87 -0.01 0.00 -1.53 0.00 0.00 36.38 33.88 2xdw s VAL 102 CO 0.21 -0.03 0.08 0.00 -3.33 0.00 0.00 175.10 172.03 2xdw s GLN 103 N -1.06 0.60 0.14 1.54 -2.07 0.10 -0.72 119.66 118.18 2xdw s GLN 103 Ca 0.00 -0.81 0.26 0.00 -1.82 0.00 0.00 55.36 52.99 2xdw s GLN 103 Cb -0.07 0.23 0.68 0.00 -1.09 0.00 0.00 33.01 32.76 2xdw s GLN 103 CO 0.01 -0.15 1.61 -0.25 -1.32 0.00 0.00 175.29 175.19 2xdw n ASP 104 N 0.68 0.66 -3.72 12.60 8.00 -1.26 -0.82 116.55 132.68 2xdw n ASP 104 Ca -0.18 0.35 -0.09 0.00 0.71 0.00 0.00 54.79 55.58 2xdw n ASP 104 Cb 0.59 -0.36 -0.02 0.00 -0.02 0.00 0.00 41.12 41.31 2xdw n ASP 104 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2xdw s SER 105 N -4.14 -0.35 0.44 -2.24 1.04 -1.26 -4.74 113.70 102.46 2xdw s SER 105 Ca 0.10 -0.43 0.10 0.00 0.48 0.00 0.00 55.95 56.20 2xdw s SER 105 Cb 0.14 0.67 0.96 0.00 0.10 0.00 0.00 66.02 67.90 2xdw s SER 105 CO 0.64 -1.21 2.07 0.25 0.98 0.00 0.00 173.24 175.97 2xdw h LEU 106 N 2.03 0.31 -0.16 2.42 5.85 -2.00 -1.90 115.31 121.86 2xdw h LEU 106 Ca -0.24 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.46 2xdw h LEU 106 Cb 1.27 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2xdw h LEU 106 CO 0.29 0.25 -0.43 -0.62 -0.34 0.00 0.00 178.44 177.59 2xdw n GLU 107 N -4.47 0.27 -1.89 1.25 1.02 -1.26 -4.97 120.64 110.60 2xdw n GLU 107 Ca 0.01 -0.16 -0.31 0.00 -0.02 0.00 0.00 57.16 56.68 2xdw n GLU 107 Cb 0.09 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.03 2xdw n GLU 107 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2xdw s GLY 108 N -2.84 1.72 0.19 0.62 0.00 -0.72 -5.01 107.32 101.29 2xdw s GLY 108 Ca 0.15 -0.01 -0.31 0.00 0.00 0.00 0.00 44.72 44.55 2xdw s GLY 108 CO 0.64 0.27 1.51 1.85 0.00 0.00 0.00 173.10 177.37 2xdw s GLU 109 N -4.99 4.24 0.19 2.90 2.12 -1.26 -4.84 118.70 117.06 2xdw s GLU 109 Ca 0.56 2.32 -0.13 0.00 0.36 0.00 0.00 54.97 58.09 2xdw s GLU 109 Cb -0.12 -3.14 -0.07 0.00 0.26 0.00 0.00 34.13 31.06 2xdw s GLU 109 CO 0.51 -0.53 0.57 0.00 -0.54 0.00 0.00 175.26 175.27 2xdw s ALA 110 N 0.72 3.55 0.12 6.30 0.00 -1.26 -4.50 121.76 126.69 2xdw s ALA 110 Ca 0.66 -0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.49 2xdw s ALA 110 Cb -0.43 -2.51 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 2xdw s ALA 110 CO 0.36 0.46 -0.10 -0.98 0.00 0.00 0.00 175.76 175.50 2xdw s ARG 111 N -2.36 0.94 0.15 0.00 1.70 0.11 -4.96 118.95 114.53 2xdw s ARG 111 Ca 0.43 -1.30 -0.31 0.00 -0.47 0.00 0.00 55.73 54.07 2xdw s ARG 111 Cb -0.13 -0.56 -0.10 0.00 -0.57 0.00 0.00 34.95 33.58 2xdw s ARG 111 CO 0.20 0.08 1.63 0.08 -1.08 0.00 0.00 175.30 176.20 2xdw s VAL 112 N -2.89 2.57 -0.21 4.99 1.01 -1.26 -0.98 120.40 123.63 2xdw s VAL 112 Ca 0.11 0.35 -0.10 0.00 0.00 0.00 0.00 61.98 62.33 2xdw s VAL 112 Cb -0.00 -3.22 -0.09 0.00 0.00 0.00 0.00 36.38 33.07 2xdw s VAL 112 CO -0.00 0.02 -0.27 0.33 0.00 0.00 0.00 175.10 175.18 2xdw n PHE 113 N 4.35 0.00 -3.67 5.22 7.35 0.30 -4.82 117.46 126.19 2xdw n PHE 113 Ca 0.15 0.00 -0.18 0.00 -0.76 0.00 0.00 57.45 56.66 2xdw n PHE 113 Cb 0.38 -0.75 -0.16 0.00 0.35 0.00 0.00 39.48 39.30 2xdw n PHE 113 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 2xdw s LEU 114 N -7.11 -0.03 -0.45 -2.13 2.96 -0.60 -4.97 118.68 106.36 2xdw s LEU 114 Ca -0.29 0.27 -0.02 0.00 -0.22 0.00 0.00 54.13 53.87 2xdw s LEU 114 Cb 0.11 0.18 0.12 0.00 0.50 0.00 0.00 46.19 47.10 2xdw s LEU 114 CO 0.37 -0.25 0.23 -0.62 -1.32 0.00 0.00 176.35 174.76 2xdw s ASP 115 N 2.27 5.14 0.50 3.68 -1.08 -1.26 -1.00 116.67 124.92 2xdw s ASP 115 Ca 0.04 -2.26 0.34 0.00 -0.52 0.00 0.00 52.55 50.14 2xdw s ASP 115 Cb -0.12 -1.80 1.63 0.00 -1.46 0.00 0.00 42.92 41.18 2xdw s ASP 115 CO -0.05 -0.47 2.01 -0.65 0.52 0.00 0.00 175.17 176.53 2xdw h PRO 116 N 7.72 0.00 0.00 4.34 0.11 -1.91 -3.01 132.00 139.25 2xdw h PRO 116 Ca -0.09 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.99 2xdw h PRO 116 Cb 1.02 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 2xdw h PRO 116 CO 0.68 0.00 -0.10 -0.91 -0.21 0.00 0.00 178.00 177.45 2xdw h ASN 117 N 0.00 0.00 -0.01 -2.05 2.35 -1.87 -1.59 115.58 112.42 2xdw h ASN 117 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2xdw h ASN 117 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2xdw h ASN 117 CO 0.00 0.10 0.00 2.30 -1.65 0.00 0.00 177.43 178.18 2xdw n ILE 118 N -4.30 0.01 1.14 2.81 -5.35 -1.14 -3.39 119.36 109.14 2xdw n ILE 118 Ca -0.03 -0.04 0.13 0.00 -0.27 0.00 0.00 62.75 62.55 2xdw n ILE 118 Cb 0.18 -0.33 0.40 0.00 -1.74 0.00 0.00 39.64 38.15 2xdw n ILE 118 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2xdw n LEU 119 N -0.80 0.56 -3.48 7.28 4.77 -0.60 -4.92 117.00 119.80 2xdw n LEU 119 Ca 0.22 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 56.05 2xdw n LEU 119 Cb 0.13 -0.24 -0.04 0.00 -2.33 0.00 0.00 43.42 40.95 2xdw n LEU 119 CO 0.16 0.12 0.46 -0.94 -1.33 0.00 0.00 177.39 175.86 2xdw s SER 120 N -2.78 -0.59 0.29 -1.43 1.04 -1.22 -4.84 113.70 104.18 2xdw s SER 120 Ca 0.18 0.37 0.09 0.00 0.48 0.00 0.00 55.95 57.07 2xdw s SER 120 Cb 0.19 0.54 0.44 0.00 0.10 0.00 0.00 66.02 67.28 2xdw s SER 120 CO 0.59 -0.74 1.67 0.44 0.98 0.00 0.00 173.24 176.18 2xdw h ASP 121 N 2.51 0.11 -0.31 7.02 5.19 -1.91 -3.26 116.42 125.76 2xdw h ASP 121 Ca -0.29 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.07 2xdw h ASP 121 Cb 1.22 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.70 2xdw h ASP 121 CO 0.38 0.61 0.00 -0.90 -3.12 0.00 0.00 179.24 176.20 2xdw n ASP 122 N -3.93 2.82 -0.59 6.45 5.68 -1.26 -4.97 116.55 120.75 2xdw n ASP 122 Ca -0.02 -1.97 -0.07 0.00 -0.50 0.00 0.00 54.79 52.23 2xdw n ASP 122 Cb 0.54 -0.21 -0.03 0.00 -1.14 0.00 0.00 41.12 40.28 2xdw n ASP 122 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2xdw n GLY 123 N 0.47 0.82 1.23 6.12 0.00 -1.23 -4.85 105.19 107.75 2xdw n GLY 123 Ca 0.11 -0.71 0.11 0.00 0.00 0.00 0.00 46.02 45.53 2xdw n GLY 123 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2xdw n THR 124 N -2.95 0.87 -3.99 2.61 -2.24 -1.26 -4.08 114.28 103.22 2xdw n THR 124 Ca -0.07 -0.89 -0.35 0.00 -2.27 0.00 0.00 64.05 60.47 2xdw n THR 124 Cb 0.28 0.49 -0.12 0.00 -2.10 0.00 0.00 70.33 68.88 2xdw n THR 124 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2xdw s VAL 125 N -1.13 4.21 0.08 2.28 1.01 -1.26 -0.31 120.40 125.28 2xdw s VAL 125 Ca 0.45 -0.22 0.05 0.00 0.00 0.00 0.00 61.98 62.25 2xdw s VAL 125 Cb 0.23 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.67 2xdw s VAL 125 CO 0.31 0.41 -0.14 0.00 0.00 0.00 0.00 175.10 175.68 2xdw s ALA 126 N 1.02 1.23 0.25 5.51 0.00 -0.47 -4.80 121.76 124.51 2xdw s ALA 126 Ca 0.03 -1.08 -0.30 0.00 0.00 0.00 0.00 51.96 50.61 2xdw s ALA 126 Cb -0.14 -0.08 -0.10 0.00 0.00 0.00 0.00 23.12 22.80 2xdw s ALA 126 CO 0.02 0.13 1.44 -1.17 0.00 0.00 0.00 175.76 176.18 2xdw s LEU 127 N -1.97 4.39 -0.35 0.00 2.96 -1.26 -1.06 118.68 121.39 2xdw s LEU 127 Ca 0.01 2.67 0.00 0.00 -0.22 0.00 0.00 54.13 56.59 2xdw s LEU 127 Cb -0.08 -3.62 0.14 0.00 0.50 0.00 0.00 46.19 43.12 2xdw s LEU 127 CO 0.02 -0.70 0.24 -0.60 -1.32 0.00 0.00 176.35 173.99 2xdw s ARG 128 N -0.36 0.52 0.00 1.98 3.52 0.26 -4.84 118.95 120.03 2xdw s ARG 128 Ca 0.59 -1.11 0.00 0.00 -0.13 0.00 0.00 55.73 55.08 2xdw s ARG 128 Cb -0.42 -1.14 0.00 0.00 -1.56 0.00 0.00 34.95 31.83 2xdw s ARG 128 CO 0.43 -1.18 0.00 0.41 -0.81 0.00 0.00 175.30 174.15 2xdw n GLY 129 N 4.24 -0.82 3.60 8.12 0.00 -1.26 -3.76 105.19 115.31 2xdw n GLY 129 Ca 0.10 -1.42 -0.10 0.00 0.00 0.00 0.00 46.02 44.60 2xdw n GLY 129 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2xdw s TYR 130 N -2.57 -0.31 -0.24 1.61 -0.85 -1.26 -0.66 117.35 113.07 2xdw s TYR 130 Ca 0.00 -0.02 -0.12 0.00 -0.52 0.00 0.00 57.07 56.41 2xdw s TYR 130 Cb 0.00 0.57 0.08 0.00 0.38 0.00 0.00 41.96 42.99 2xdw s TYR 130 CO 0.00 -1.00 0.57 0.00 -1.52 0.00 0.00 175.55 173.59 2xdw s ALA 131 N -3.84 -1.55 0.26 9.51 0.00 0.05 -4.94 121.76 121.24 2xdw s ALA 131 Ca 0.06 2.04 -0.19 0.00 0.00 0.00 0.00 51.96 53.87 2xdw s ALA 131 Cb -0.03 -1.29 -0.09 0.00 0.00 0.00 0.00 23.12 21.72 2xdw s ALA 131 CO -0.04 -0.43 0.75 -0.06 0.00 0.00 0.00 175.76 175.98 2xdw s PHE 132 N 1.78 3.59 0.90 0.00 0.40 -1.26 -0.84 117.98 122.56 2xdw s PHE 132 Ca -0.09 1.40 -0.11 0.00 -0.60 0.00 0.00 56.93 57.53 2xdw s PHE 132 Cb -0.08 -2.64 0.10 0.00 0.51 0.00 0.00 43.02 40.92 2xdw s PHE 132 CO -0.17 0.27 0.94 -1.13 0.70 0.00 0.00 175.22 175.82 2xdw n SER 133 N 0.47 -0.27 -0.18 1.36 3.41 -0.19 -4.74 113.62 113.49 2xdw n SER 133 Ca -0.01 0.43 0.05 0.00 -0.26 0.00 0.00 58.87 59.08 2xdw n SER 133 Cb 0.51 -1.40 0.34 0.00 -0.26 0.00 0.00 64.21 63.40 2xdw n SER 133 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2xdw h GLU 134 N -1.61 0.77 -0.04 4.33 4.57 -1.88 -0.02 114.58 120.70 2xdw h GLU 134 Ca -0.44 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2xdw h GLU 134 Cb 1.28 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.70 2xdw h GLU 134 CO 0.40 0.51 0.00 -0.40 -1.18 0.00 0.00 179.01 178.34 2xdw n ASP 135 N -4.47 0.85 0.00 1.04 5.68 -1.26 -4.56 116.55 113.83 2xdw n ASP 135 Ca 0.10 -1.38 0.00 0.00 -0.50 0.00 0.00 54.79 53.01 2xdw n ASP 135 Cb 0.18 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 2xdw n ASP 135 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2xdw n GLY 136 N 1.06 0.61 0.02 6.12 0.00 -0.02 -3.97 105.19 109.01 2xdw n GLY 136 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.33 2xdw n GLY 136 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2xdw n GLU 137 N -2.04 0.17 -4.20 1.61 -0.58 -1.26 -4.75 120.64 109.59 2xdw n GLU 137 Ca 0.00 0.01 -0.14 0.00 -0.42 0.00 0.00 57.16 56.61 2xdw n GLU 137 Cb 0.05 -1.56 -0.11 0.00 -0.57 0.00 0.00 31.44 29.25 2xdw n GLU 137 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 2xdw s TYR 138 N -3.11 1.11 -0.10 -0.32 1.51 -1.26 -0.63 117.35 114.55 2xdw s TYR 138 Ca 0.07 -0.70 -0.04 0.00 -1.01 0.00 0.00 57.07 55.39 2xdw s TYR 138 Cb 0.15 -0.60 0.05 0.00 -0.11 0.00 0.00 41.96 41.46 2xdw s TYR 138 CO 0.77 0.01 0.21 0.12 -1.11 0.00 0.00 175.55 175.55 2xdw s PHE 139 N -2.75 -0.28 -0.07 2.71 5.36 -0.34 -1.02 117.98 121.58 2xdw s PHE 139 Ca 0.09 0.73 0.00 0.00 -0.96 0.00 0.00 56.93 56.79 2xdw s PHE 139 Cb -0.01 -0.09 -0.03 0.00 -0.34 0.00 0.00 43.02 42.55 2xdw s PHE 139 CO -0.00 -0.27 -0.04 0.00 -1.46 0.00 0.00 175.22 173.45 2xdw s ALA 140 N 1.86 3.09 -0.05 11.12 0.00 -0.02 -0.61 121.76 137.14 2xdw s ALA 140 Ca -0.03 -0.87 -0.08 0.00 0.00 0.00 0.00 51.96 50.97 2xdw s ALA 140 Cb -0.12 -1.31 0.02 0.00 0.00 0.00 0.00 23.12 21.72 2xdw s ALA 140 CO -0.07 0.58 0.21 1.52 0.00 0.00 0.00 175.76 178.00 2xdw s TYR 141 N -0.85 -0.16 -0.03 0.00 1.13 -0.25 -0.77 117.35 116.41 2xdw s TYR 141 Ca 0.13 0.37 -0.13 0.00 -1.41 0.00 0.00 57.07 56.04 2xdw s TYR 141 Cb -0.11 0.05 -0.05 0.00 -1.10 0.00 0.00 41.96 40.75 2xdw s TYR 141 CO 0.02 -0.19 0.34 0.20 -2.51 0.00 0.00 175.55 173.41 2xdw s GLY 142 N -0.43 2.40 -0.07 5.49 0.00 0.17 -0.73 107.32 114.15 2xdw s GLY 142 Ca -0.05 -0.32 0.05 0.00 0.00 0.00 0.00 44.72 44.40 2xdw s GLY 142 CO 0.01 0.01 -0.24 1.08 0.00 0.00 0.00 173.10 173.96 2xdw s LEU 143 N -1.09 2.13 -0.08 0.66 1.43 0.24 -0.57 118.68 121.39 2xdw s LEU 143 Ca 0.22 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.85 2xdw s LEU 143 Cb -0.16 -1.40 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 2xdw s LEU 143 CO 0.11 0.23 -0.16 -0.44 0.23 0.00 0.00 176.35 176.33 2xdw s SER 144 N -0.08 3.85 -0.11 2.29 0.01 -0.22 -1.31 113.70 118.13 2xdw s SER 144 Ca -0.06 -0.30 -0.05 0.00 1.31 0.00 0.00 55.95 56.85 2xdw s SER 144 Cb -0.14 -1.11 -0.04 0.00 0.21 0.00 0.00 66.02 64.94 2xdw s SER 144 CO 0.05 0.27 0.07 0.00 0.41 0.00 0.00 173.24 174.03 2xdw s ALA 145 N -0.25 3.56 -2.04 1.44 0.00 -1.26 -1.37 121.76 121.83 2xdw s ALA 145 Ca 0.01 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.24 2xdw s ALA 145 Cb -0.13 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.24 2xdw s ALA 145 CO 0.03 0.54 0.00 0.43 0.00 0.00 0.00 175.76 176.76 2xdw n SER 146 N 2.27 -5.62 0.00 0.00 7.64 0.58 -2.32 113.62 116.16 2xdw n SER 146 Ca -0.19 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2xdw n SER 146 Cb 0.54 -4.83 0.00 0.00 -1.01 0.00 0.00 64.21 58.91 2xdw n SER 146 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2xdw n GLY 147 N -0.64 0.74 3.76 0.23 0.00 -1.26 -2.44 105.19 105.57 2xdw n GLY 147 Ca -0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 2xdw n GLY 147 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2xdw s SER 148 N -2.46 5.15 0.58 1.61 0.15 -0.98 -3.90 113.70 113.84 2xdw s SER 148 Ca 0.00 2.24 0.36 0.00 0.70 0.00 0.00 55.95 59.25 2xdw s SER 148 Cb 0.00 -2.58 1.67 0.00 -1.71 0.00 0.00 66.02 63.40 2xdw s SER 148 CO 0.00 -1.61 2.10 0.44 1.20 0.00 0.00 173.24 175.37 2xdw h ASP 149 N 0.58 0.00 -3.96 5.45 3.32 -1.91 -3.42 116.42 116.48 2xdw h ASP 149 Ca -0.49 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.02 2xdw h ASP 149 Cb 1.28 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.93 2xdw h ASP 149 CO 0.54 0.02 0.69 0.26 -1.72 0.00 0.00 179.24 179.04 2xdw s TRP 150 N -3.87 2.63 0.02 4.55 0.52 -1.26 -4.58 118.94 116.95 2xdw s TRP 150 Ca -0.01 1.29 0.06 0.00 0.02 0.00 0.00 56.10 57.46 2xdw s TRP 150 Cb 0.11 -3.86 -0.02 0.00 -1.15 0.00 0.00 33.47 28.54 2xdw s TRP 150 CO 0.51 -2.65 -0.18 0.08 0.02 0.00 0.00 176.95 174.73 2xdw s VAL 151 N -1.19 1.44 -0.18 4.03 1.01 0.11 -4.36 120.40 121.25 2xdw s VAL 151 Ca 0.57 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 61.53 2xdw s VAL 151 Cb -0.43 -1.24 -0.02 0.00 0.00 0.00 0.00 36.38 34.69 2xdw s VAL 151 CO 0.56 0.24 -0.03 -0.89 0.00 0.00 0.00 175.10 174.97 2xdw s THR 152 N -0.65 3.72 -0.17 3.92 2.01 -0.43 -3.36 115.64 120.67 2xdw s THR 152 Ca 0.06 -0.40 -0.15 0.00 0.31 0.00 0.00 61.69 61.51 2xdw s THR 152 Cb -0.08 -2.66 -0.04 0.00 0.01 0.00 0.00 72.50 69.73 2xdw s THR 152 CO 0.01 0.45 0.33 -0.63 -0.69 0.00 0.00 174.62 174.09 2xdw s ILE 153 N 0.85 5.27 0.41 1.82 1.01 0.04 -0.60 121.20 130.01 2xdw s ILE 153 Ca -0.01 0.61 0.07 0.00 0.00 0.00 0.00 60.65 61.32 2xdw s ILE 153 Cb -0.14 -3.67 -0.08 0.00 0.01 0.00 0.00 42.46 38.58 2xdw s ILE 153 CO 0.02 0.34 0.03 -0.54 0.00 0.00 0.00 174.94 174.79 2xdw s LYS 154 N 0.77 2.00 0.03 2.79 1.02 0.09 -0.73 119.74 125.70 2xdw s LYS 154 Ca 0.18 -2.07 0.01 0.00 0.02 0.00 0.00 55.97 54.11 2xdw s LYS 154 Cb -0.14 -1.69 -0.02 0.00 -0.52 0.00 0.00 37.83 35.47 2xdw s LYS 154 CO 0.06 -0.06 -0.06 -0.06 -0.92 0.00 0.00 175.35 174.31 2xdw s PHE 155 N -2.69 0.50 0.03 3.18 0.40 -1.24 -1.09 117.98 117.07 2xdw s PHE 155 Ca 0.36 -0.39 0.02 0.00 -0.60 0.00 0.00 56.93 56.31 2xdw s PHE 155 Cb 0.09 -0.31 -0.02 0.00 0.51 0.00 0.00 43.02 43.29 2xdw s PHE 155 CO 0.19 -0.09 -0.06 -1.64 0.70 0.00 0.00 175.22 174.32 2xdw s MET 156 N -1.18 0.46 -0.06 0.44 -1.94 0.21 -1.64 119.30 115.61 2xdw s MET 156 Ca -0.08 -0.67 -0.26 0.00 -1.71 0.00 0.00 55.69 52.97 2xdw s MET 156 Cb -0.08 -0.21 -0.03 0.00 2.01 0.00 0.00 34.83 36.52 2xdw s MET 156 CO -0.00 0.03 0.81 0.21 -0.01 0.00 0.00 175.02 176.07 2xdw s LYS 157 N -1.42 4.46 0.07 2.03 2.20 0.02 -1.20 119.74 125.90 2xdw s LYS 157 Ca -0.10 1.08 -0.20 0.00 -0.36 0.00 0.00 55.97 56.39 2xdw s LYS 157 Cb -0.09 -3.47 -0.11 0.00 -1.51 0.00 0.00 37.83 32.65 2xdw s LYS 157 CO 0.00 -0.02 1.52 0.28 -0.36 0.00 0.00 175.35 176.76 2xdw h VAL 158 N 4.83 1.24 -2.46 4.02 2.07 -1.18 -1.41 116.25 123.36 2xdw h VAL 158 Ca -0.40 -0.81 -0.57 0.00 0.82 0.00 0.00 66.70 65.75 2xdw h VAL 158 Cb 1.20 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 2xdw h VAL 158 CO 0.76 0.25 1.28 -0.62 0.02 0.00 0.00 177.57 179.26 2xdw s ASP 159 N -5.79 6.01 0.00 0.57 2.15 -1.26 -1.23 116.67 117.12 2xdw s ASP 159 Ca -0.14 1.79 0.00 0.00 0.43 0.00 0.00 52.55 54.63 2xdw s ASP 159 Cb 0.06 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 2xdw s ASP 159 CO 0.72 -1.53 0.00 0.61 -0.17 0.00 0.00 175.17 174.80 2xdw n GLY 160 N 5.13 0.97 3.91 2.66 0.00 -1.26 -4.37 105.19 112.23 2xdw n GLY 160 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 2xdw n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdw n ALA 161 N 0.21 -2.26 -2.66 4.61 0.00 -0.36 -4.89 120.51 115.16 2xdw n ALA 161 Ca 0.00 -0.31 -0.40 0.00 0.00 0.00 0.00 53.44 52.73 2xdw n ALA 161 Cb 0.00 -2.42 -0.06 0.00 0.00 0.00 0.00 19.45 16.97 2xdw n ALA 161 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2xdw s LYS 162 N -6.54 4.19 0.23 0.00 -0.14 -0.54 -4.90 119.74 112.03 2xdw s LYS 162 Ca 0.21 0.54 -0.30 0.00 -1.36 0.00 0.00 55.97 55.06 2xdw s LYS 162 Cb -0.09 -3.58 -0.09 0.00 -1.68 0.00 0.00 37.83 32.39 2xdw s LYS 162 CO 0.90 -0.23 1.20 -1.21 -0.76 0.00 0.00 175.35 175.25 2xdw s GLU 163 N 1.90 4.50 0.31 1.68 0.41 -1.26 -0.80 118.70 125.44 2xdw s GLU 163 Ca 0.27 1.92 0.07 0.00 -0.41 0.00 0.00 54.97 56.82 2xdw s GLU 163 Cb -0.16 -3.20 -0.02 0.00 -1.78 0.00 0.00 34.13 28.97 2xdw s GLU 163 CO 0.10 -0.04 0.32 -0.51 -0.49 0.00 0.00 175.26 174.64 2xdw s LEU 164 N -0.72 3.78 0.34 1.80 1.43 -0.65 -4.88 118.68 119.77 2xdw s LEU 164 Ca 0.51 -0.34 0.26 0.00 -1.03 0.00 0.00 54.13 53.52 2xdw s LEU 164 Cb -0.34 -2.41 0.77 0.00 0.03 0.00 0.00 46.19 44.24 2xdw s LEU 164 CO 0.40 -0.30 1.74 -0.65 0.23 0.00 0.00 176.35 177.77 2xdw h PRO 165 N 1.20 0.00 -6.56 1.29 0.11 -1.96 -3.42 132.00 122.65 2xdw h PRO 165 Ca -0.46 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.12 2xdw h PRO 165 Cb 1.25 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.40 2xdw h PRO 165 CO 0.58 0.00 0.94 -0.51 -0.21 0.00 0.00 178.00 178.80 2xdw s ASP 166 N -5.17 6.56 -0.03 -2.05 1.11 -1.26 -5.00 116.67 110.84 2xdw s ASP 166 Ca 0.07 2.61 0.00 0.00 0.18 0.00 0.00 52.55 55.41 2xdw s ASP 166 Cb 0.09 -2.58 0.03 0.00 1.07 0.00 0.00 42.92 41.53 2xdw s ASP 166 CO 0.58 -0.87 0.00 -0.69 1.18 0.00 0.00 175.17 175.38 2xdw s VAL 167 N 1.70 0.15 -0.15 -1.27 1.01 -1.26 -3.71 120.40 116.87 2xdw s VAL 167 Ca 0.72 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.81 2xdw s VAL 167 Cb -0.43 -0.25 -0.00 0.00 0.00 0.00 0.00 36.38 35.69 2xdw s VAL 167 CO 0.32 0.14 -0.15 -0.76 0.00 0.00 0.00 175.10 174.65 2xdw s LEU 168 N 1.07 2.48 0.44 3.92 1.43 0.09 -4.57 118.68 123.54 2xdw s LEU 168 Ca -0.09 -0.47 0.07 0.00 -1.03 0.00 0.00 54.13 52.61 2xdw s LEU 168 Cb -0.13 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 2xdw s LEU 168 CO -0.02 0.09 0.31 -1.61 0.23 0.00 0.00 176.35 175.35 2xdw s GLU 169 N 0.80 2.37 -1.48 1.70 0.41 -1.26 -0.78 118.70 120.46 2xdw s GLU 169 Ca -0.05 -1.75 0.00 0.00 -0.41 0.00 0.00 54.97 52.76 2xdw s GLU 169 Cb -0.15 -2.18 0.00 0.00 -1.78 0.00 0.00 34.13 30.02 2xdw s GLU 169 CO 0.00 -0.25 0.00 0.54 -0.49 0.00 0.00 175.26 175.06 2xdw n ARG 170 N -1.48 -1.18 -3.19 1.61 1.74 -1.26 -4.89 116.66 108.01 2xdw n ARG 170 Ca 0.01 0.88 -0.39 0.00 -0.77 0.00 0.00 57.85 57.58 2xdw n ARG 170 Cb 0.63 -5.16 -0.06 0.00 -1.02 0.00 0.00 32.46 26.85 2xdw n ARG 170 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2xdw s VAL 171 N -2.69 5.11 -0.18 1.55 1.01 -1.21 -1.22 120.40 122.77 2xdw s VAL 171 Ca 0.00 1.16 -0.21 0.00 0.00 0.00 0.00 61.98 62.93 2xdw s VAL 171 Cb 0.00 -3.91 0.05 0.00 0.00 0.00 0.00 36.38 32.52 2xdw s VAL 171 CO 0.00 0.27 0.56 -0.75 0.00 0.00 0.00 175.10 175.18 2xdw s LYS 172 N 0.89 0.72 -1.36 2.72 2.20 -1.26 -0.72 119.74 122.94 2xdw s LYS 172 Ca 0.30 0.64 -0.03 0.00 -0.36 0.00 0.00 55.97 56.53 2xdw s LYS 172 Cb -0.16 0.35 -0.00 0.00 -1.51 0.00 0.00 37.83 36.50 2xdw s LYS 172 CO 0.13 -0.12 0.51 1.19 -0.36 0.00 0.00 175.35 176.70 2xdw n PHE 173 N 2.41 -1.71 -4.25 4.03 3.72 -1.26 -4.77 117.46 115.62 2xdw n PHE 173 Ca -0.15 0.72 -0.33 0.00 -0.05 0.00 0.00 57.45 57.64 2xdw n PHE 173 Cb 0.56 -3.80 -0.08 0.00 -0.94 0.00 0.00 39.48 35.21 2xdw n PHE 173 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2xdw s SER 174 N -4.26 5.26 0.79 4.37 0.15 -1.26 -4.92 113.70 113.83 2xdw s SER 174 Ca 0.06 0.05 -0.11 0.00 0.70 0.00 0.00 55.95 56.65 2xdw s SER 174 Cb -0.02 -1.42 0.06 0.00 -1.71 0.00 0.00 66.02 62.93 2xdw s SER 174 CO 0.87 0.29 1.09 0.00 1.20 0.00 0.00 173.24 176.69 2xdw s MET 176 N -5.08 0.19 -0.15 0.00 -1.94 -1.25 -4.05 119.30 107.03 2xdw s MET 176 Ca 0.61 0.15 -0.04 0.00 -1.71 0.00 0.00 55.69 54.69 2xdw s MET 176 Cb -0.15 -1.20 0.07 0.00 2.01 0.00 0.00 34.83 35.56 2xdw s MET 176 CO 0.55 -0.69 0.19 0.00 -0.01 0.00 0.00 175.02 175.06 2xdw s ALA 177 N 2.31 -0.21 0.18 3.03 0.00 -0.78 -4.81 121.76 121.50 2xdw s ALA 177 Ca 0.07 0.40 -0.30 0.00 0.00 0.00 0.00 51.96 52.13 2xdw s ALA 177 Cb -0.16 -1.08 -0.08 0.00 0.00 0.00 0.00 23.12 21.81 2xdw s ALA 177 CO -0.14 -0.91 0.95 -1.58 0.00 0.00 0.00 175.76 174.08 2xdw s TRP 178 N 2.31 3.91 0.53 0.00 0.52 -1.26 -0.46 118.94 124.48 2xdw s TRP 178 Ca 0.04 1.87 -0.21 0.00 0.02 0.00 0.00 56.10 57.82 2xdw s TRP 178 Cb -0.14 -3.01 -0.06 0.00 -1.15 0.00 0.00 33.47 29.11 2xdw s TRP 178 CO -0.09 0.35 1.22 0.95 0.02 0.00 0.00 176.95 179.40 2xdw s THR 179 N -0.67 2.72 -1.17 2.01 -4.23 -0.82 -4.80 115.64 108.68 2xdw s THR 179 Ca 0.44 0.51 0.22 0.00 -1.18 0.00 0.00 61.69 61.67 2xdw s THR 179 Cb -0.25 -3.24 0.26 0.00 1.34 0.00 0.00 72.50 70.62 2xdw s THR 179 CO 0.31 -0.04 1.70 1.41 -0.54 0.00 0.00 174.62 177.46 2xdw n HIS 180 N -1.00 0.00 1.27 3.99 -0.00 -1.26 -1.38 115.22 116.83 2xdw n HIS 180 Ca 0.10 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.94 2xdw n HIS 180 Cb 0.48 -0.41 0.65 0.00 -0.00 0.00 0.00 29.99 30.71 2xdw n HIS 180 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2xdw n ASP 181 N -1.41 0.00 0.00 0.41 5.68 -1.26 -4.87 116.55 115.10 2xdw n ASP 181 Ca 0.07 -0.25 0.00 0.00 -0.50 0.00 0.00 54.79 54.12 2xdw n ASP 181 Cb 0.22 -0.21 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 2xdw n ASP 181 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2xdw n GLY 182 N 0.74 0.35 0.14 6.12 0.00 -0.48 -4.90 105.19 107.17 2xdw n GLY 182 Ca 0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 2xdw n GLY 182 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2xdw h LYS 183 N 0.78 0.27 0.00 1.61 3.64 -1.91 -3.47 116.57 117.49 2xdw h LYS 183 Ca 0.00 -0.26 0.16 0.00 -1.27 0.00 0.00 60.65 59.28 2xdw h LYS 183 Cb 0.33 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 2xdw h LYS 183 CO 0.00 0.95 0.43 0.41 -2.27 0.00 0.00 179.45 178.97 2xdw n GLY 184 N 0.75 0.45 2.85 5.01 0.00 -1.26 -1.26 105.19 111.73 2xdw n GLY 184 Ca -0.04 -0.94 -0.13 0.00 0.00 0.00 0.00 46.02 44.91 2xdw n GLY 184 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2xdw s MET 185 N -2.01 0.01 0.39 1.61 1.75 0.31 -1.94 119.30 119.41 2xdw s MET 185 Ca 0.14 0.09 -0.24 0.00 -1.25 0.00 0.00 55.69 54.43 2xdw s MET 185 Cb -0.00 -0.08 -0.09 0.00 2.84 0.00 0.00 34.83 37.49 2xdw s MET 185 CO -0.00 -0.06 1.02 -0.06 -0.65 0.00 0.00 175.02 175.26 2xdw s PHE 186 N 0.40 3.36 0.27 4.11 0.08 0.39 -0.87 117.98 125.72 2xdw s PHE 186 Ca -0.03 1.67 -0.21 0.00 0.12 0.00 0.00 56.93 58.48 2xdw s PHE 186 Cb -0.05 -3.06 0.03 0.00 -0.57 0.00 0.00 43.02 39.37 2xdw s PHE 186 CO -0.01 -0.40 0.75 1.52 -0.10 0.00 0.00 175.22 176.98 2xdw s TYR 187 N -1.70 -0.16 0.09 0.36 1.13 -0.51 -1.86 117.35 114.70 2xdw s TYR 187 Ca 0.56 -0.30 0.07 0.00 -1.41 0.00 0.00 57.07 56.00 2xdw s TYR 187 Cb -0.20 0.71 -0.04 0.00 -1.10 0.00 0.00 41.96 41.33 2xdw s TYR 187 CO 0.25 -1.22 -0.12 -0.80 -2.51 0.00 0.00 175.55 171.16 2xdw s ASN 188 N -2.94 4.28 0.05 -0.18 -0.87 -1.26 -0.89 114.94 113.14 2xdw s ASN 188 Ca 0.12 -0.39 -0.08 0.00 -1.57 0.00 0.00 52.86 50.93 2xdw s ASN 188 Cb -0.05 -0.79 -0.00 0.00 -0.02 0.00 0.00 41.25 40.38 2xdw s ASN 188 CO 0.07 0.20 0.16 0.00 -2.57 0.00 0.00 177.10 174.96 2xdw s ALA 189 N -1.15 -0.24 0.08 0.60 0.00 -0.93 -4.03 121.76 116.08 2xdw s ALA 189 Ca 0.20 -0.43 0.01 0.00 0.00 0.00 0.00 51.96 51.73 2xdw s ALA 189 Cb -0.11 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.28 2xdw s ALA 189 CO 0.12 -0.38 0.21 0.71 0.00 0.00 0.00 175.76 176.42 2xdw s TYR 190 N -2.85 3.48 0.77 0.00 2.02 -0.35 -1.15 117.35 119.27 2xdw s TYR 190 Ca -0.03 0.21 -0.12 0.00 -0.37 0.00 0.00 57.07 56.76 2xdw s TYR 190 Cb 0.00 -1.73 0.06 0.00 -0.40 0.00 0.00 41.96 39.89 2xdw s TYR 190 CO -0.05 0.57 1.11 -2.14 -1.57 0.00 0.00 175.55 173.47 2xdw s PRO 191 N -2.62 2.13 0.49 -1.71 0.02 -1.26 -4.89 135.00 127.16 2xdw s PRO 191 Ca 0.34 1.32 -0.22 0.00 0.02 0.00 0.00 61.00 62.46 2xdw s PRO 191 Cb -0.13 -1.87 -0.08 0.00 0.02 0.00 0.00 34.50 32.44 2xdw s PRO 191 CO 0.27 -1.76 1.07 1.04 -0.33 0.00 0.00 177.00 177.30 2xdw n GLN 192 N -3.39 1.34 -4.12 5.54 1.13 -1.26 -5.02 117.38 111.60 2xdw n GLN 192 Ca 0.10 0.49 -0.11 0.00 -1.94 0.00 0.00 57.00 55.54 2xdw n GLN 192 Cb 0.52 -2.19 -0.11 0.00 0.11 0.00 0.00 30.24 28.58 2xdw n GLN 192 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 2xdw s GLN 193 N -2.37 0.70 0.53 -1.09 -2.07 -1.26 -5.14 119.66 108.95 2xdw s GLN 193 Ca 0.68 -1.09 -0.20 0.00 -1.82 0.00 0.00 55.36 52.92 2xdw s GLN 193 Cb -0.49 -0.21 -0.06 0.00 -1.09 0.00 0.00 33.01 31.16 2xdw s GLN 193 CO 0.53 0.00 1.16 -0.51 -1.32 0.00 0.00 175.29 175.15 2xdw s ASP 194 N -2.44 5.76 0.01 12.60 1.01 -1.26 -4.84 116.67 127.51 2xdw s ASP 194 Ca 0.03 2.26 0.00 0.00 0.71 0.00 0.00 52.55 55.54 2xdw s ASP 194 Cb -0.01 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.33 2xdw s ASP 194 CO -0.03 -1.20 0.00 0.61 0.21 0.00 0.00 175.17 174.76 2xdw n GLY 195 N 0.30 -1.58 3.83 0.21 0.00 -1.26 -4.92 105.19 101.77 2xdw n GLY 195 Ca 0.11 -1.33 -0.33 0.00 0.00 0.00 0.00 46.02 44.48 2xdw n GLY 195 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2xdw s LYS 196 N 0.00 4.11 -0.43 1.61 1.02 -1.26 -5.02 119.74 119.77 2xdw s LYS 196 Ca 0.00 1.02 0.10 0.00 0.02 0.00 0.00 55.97 57.10 2xdw s LYS 196 Cb 0.00 -2.19 0.34 0.00 -0.52 0.00 0.00 37.83 35.46 2xdw s LYS 196 CO 0.00 -0.09 0.78 0.43 -0.92 0.00 0.00 175.35 175.55 2xdw n SER 197 N -0.94 1.86 0.00 2.83 7.64 -1.26 -4.68 113.62 119.06 2xdw n SER 197 Ca 0.06 -3.19 0.00 0.00 1.01 0.00 0.00 58.87 56.75 2xdw n SER 197 Cb 0.54 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 2xdw n SER 197 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2xdw n ASP 198 N 0.19 0.85 0.00 6.43 5.75 -1.26 -4.98 116.55 123.53 2xdw n ASP 198 Ca 0.27 -1.04 0.00 0.00 -0.01 0.00 0.00 54.79 54.01 2xdw n ASP 198 Cb 0.58 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.67 2xdw n ASP 198 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2xdw n GLY 199 N -0.02 0.22 0.01 6.12 0.00 -1.26 -4.76 105.19 105.50 2xdw n GLY 199 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 2xdw n GLY 199 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2xdw n THR 200 N -1.90 0.03 -2.00 2.61 -2.24 -1.26 -3.77 114.28 105.74 2xdw n THR 200 Ca 0.00 -0.05 -0.29 0.00 -2.27 0.00 0.00 64.05 61.44 2xdw n THR 200 Cb 0.00 0.58 0.05 0.00 -2.10 0.00 0.00 70.33 68.86 2xdw n THR 200 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2xdw s GLU 201 N -3.04 2.75 0.00 -0.78 1.03 -1.26 -4.78 118.70 112.62 2xdw s GLU 201 Ca 0.08 0.30 0.10 0.00 0.03 0.00 0.00 54.97 55.48 2xdw s GLU 201 Cb 0.16 -2.07 0.08 0.00 -0.80 0.00 0.00 34.13 31.50 2xdw s GLU 201 CO 0.80 -1.03 0.81 0.25 -1.33 0.00 0.00 175.26 174.76 2xdw n THR 202 N -2.95 0.00 -1.67 1.83 -2.24 -1.26 -4.89 114.28 103.10 2xdw n THR 202 Ca 0.07 -0.50 -0.45 0.00 -2.27 0.00 0.00 64.05 60.90 2xdw n THR 202 Cb 0.58 1.21 -0.03 0.00 -2.10 0.00 0.00 70.33 69.99 2xdw n THR 202 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2xdw n SER 203 N 0.54 2.67 -4.77 3.42 7.64 -1.26 -1.01 113.62 120.86 2xdw n SER 203 Ca 0.06 1.15 -0.39 0.00 1.01 0.00 0.00 58.87 60.70 2xdw n SER 203 Cb 0.25 -1.42 -0.00 0.00 -1.01 0.00 0.00 64.21 62.03 2xdw n SER 203 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2xdw s THR 204 N -0.14 2.64 -0.39 0.44 -1.32 -1.26 -2.75 115.64 112.86 2xdw s THR 204 Ca 0.67 0.55 -0.11 0.00 -1.21 0.00 0.00 61.69 61.59 2xdw s THR 204 Cb -0.65 -3.31 0.03 0.00 -1.51 0.00 0.00 72.50 67.06 2xdw s THR 204 CO 0.51 0.06 0.23 0.20 -2.21 0.00 0.00 174.62 173.40 2xdw s ASN 205 N -0.87 5.78 0.20 8.08 0.02 -0.25 -4.82 114.94 123.08 2xdw s ASN 205 Ca 0.60 -1.05 0.04 0.00 -1.02 0.00 0.00 52.86 51.42 2xdw s ASN 205 Cb -0.37 -2.04 -0.05 0.00 0.02 0.00 0.00 41.25 38.81 2xdw s ASN 205 CO 0.46 -0.42 -0.03 -0.76 0.02 0.00 0.00 177.10 176.37 2xdw s LEU 206 N 1.56 2.29 -1.19 0.60 1.43 -1.26 -4.88 118.68 117.23 2xdw s LEU 206 Ca 0.02 -1.15 -0.07 0.00 -1.03 0.00 0.00 54.13 51.91 2xdw s LEU 206 Cb -0.20 -0.28 0.01 0.00 0.03 0.00 0.00 46.19 45.75 2xdw s LEU 206 CO 0.07 -0.46 0.88 1.41 0.23 0.00 0.00 176.35 178.48 2xdw n HIS 207 N -0.33 -2.25 -1.88 0.29 8.25 -0.03 -4.58 115.22 114.69 2xdw n HIS 207 Ca -0.07 0.76 -0.41 0.00 -0.26 0.00 0.00 57.72 57.74 2xdw n HIS 207 Cb 0.63 -4.30 -0.01 0.00 1.12 0.00 0.00 29.99 27.42 2xdw n HIS 207 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2xdw s GLN 208 N -5.96 4.18 0.29 -0.41 0.74 -1.26 -4.40 119.66 112.84 2xdw s GLN 208 Ca 0.44 2.47 0.10 0.00 0.05 0.00 0.00 55.36 58.42 2xdw s GLN 208 Cb -0.19 -3.03 -0.06 0.00 1.10 0.00 0.00 33.01 30.83 2xdw s GLN 208 CO 0.54 -0.50 -0.14 0.15 -0.55 0.00 0.00 175.29 174.79 2xdw s LYS 209 N -1.15 1.68 -0.24 1.67 1.02 -0.30 -4.66 119.74 117.75 2xdw s LYS 209 Ca 0.57 -1.81 -0.08 0.00 0.02 0.00 0.00 55.97 54.67 2xdw s LYS 209 Cb -0.45 -1.60 -0.04 0.00 -0.52 0.00 0.00 37.83 35.22 2xdw s LYS 209 CO 0.52 0.21 0.10 -1.17 -0.92 0.00 0.00 175.35 174.09 2xdw s LEU 210 N -3.52 3.65 0.28 3.17 2.96 -0.49 -2.19 118.68 122.55 2xdw s LEU 210 Ca 0.30 -0.10 0.11 0.00 -0.22 0.00 0.00 54.13 54.22 2xdw s LEU 210 Cb -0.01 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.66 2xdw s LEU 210 CO 0.14 0.00 -0.13 -0.31 -1.32 0.00 0.00 176.35 174.74 2xdw s TYR 211 N 1.39 2.42 -0.16 5.38 2.02 -0.07 -0.78 117.35 127.56 2xdw s TYR 211 Ca 0.06 -0.32 0.01 0.00 -0.37 0.00 0.00 57.07 56.45 2xdw s TYR 211 Cb -0.15 -1.10 0.02 0.00 -0.40 0.00 0.00 41.96 40.34 2xdw s TYR 211 CO 0.05 0.67 -0.16 -0.47 -1.57 0.00 0.00 175.55 174.06 2xdw s TYR 212 N -2.47 2.40 -0.27 2.71 5.04 0.20 -1.43 117.35 123.53 2xdw s TYR 212 Ca 0.31 -1.38 -0.11 0.00 -2.44 0.00 0.00 57.07 53.45 2xdw s TYR 212 Cb -0.05 -1.72 -0.05 0.00 0.35 0.00 0.00 41.96 40.50 2xdw s TYR 212 CO 0.17 -0.72 0.18 -1.58 -1.34 0.00 0.00 175.55 172.25 2xdw s HIS 213 N 1.40 3.24 -0.14 4.97 5.65 -0.05 -1.36 115.29 129.01 2xdw s HIS 213 Ca 0.05 0.13 -0.29 0.00 0.25 0.00 0.00 55.06 55.20 2xdw s HIS 213 Cb -0.13 -2.34 -0.01 0.00 -1.18 0.00 0.00 32.58 28.92 2xdw s HIS 213 CO -0.11 -0.10 0.98 0.08 -0.65 0.00 0.00 174.74 174.93 2xdw s VAL 214 N 1.56 4.78 0.27 0.89 1.01 -1.26 -0.53 120.40 127.11 2xdw s VAL 214 Ca 0.07 1.96 -0.30 0.00 0.00 0.00 0.00 61.98 63.71 2xdw s VAL 214 Cb -0.15 -4.28 -0.11 0.00 0.00 0.00 0.00 36.38 31.84 2xdw s VAL 214 CO 0.09 -0.03 1.56 -0.22 0.00 0.00 0.00 175.10 176.50 2xdw s LEU 215 N 2.26 4.36 0.00 3.92 2.96 -0.39 -2.53 118.68 129.26 2xdw s LEU 215 Ca 0.46 2.84 0.00 0.00 -0.22 0.00 0.00 54.13 57.21 2xdw s LEU 215 Cb -0.17 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 42.89 2xdw s LEU 215 CO 0.15 -0.85 0.00 0.61 -1.32 0.00 0.00 176.35 174.93 2xdw n GLY 216 N 2.42 0.83 3.55 7.98 0.00 -1.26 -4.99 105.19 113.73 2xdw n GLY 216 Ca 0.09 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 2xdw n GLY 216 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2xdw s THR 217 N -2.00 1.81 0.44 2.61 -4.23 -1.05 -5.09 115.64 108.13 2xdw s THR 217 Ca 0.00 -2.04 -0.21 0.00 -1.18 0.00 0.00 61.69 58.26 2xdw s THR 217 Cb 0.00 -2.85 -0.11 0.00 1.34 0.00 0.00 72.50 70.88 2xdw s THR 217 CO 0.00 -0.06 0.96 -1.81 -0.54 0.00 0.00 174.62 173.17 2xdw s ASP 218 N -3.62 6.90 0.49 3.99 1.01 -1.26 -4.84 116.67 119.34 2xdw s ASP 218 Ca 0.34 1.69 0.19 0.00 0.71 0.00 0.00 52.55 55.48 2xdw s ASP 218 Cb 0.08 -2.54 1.23 0.00 1.01 0.00 0.00 42.92 42.70 2xdw s ASP 218 CO 0.17 -0.39 2.03 -0.61 0.21 0.00 0.00 175.17 176.58 2xdw h GLN 219 N 1.82 0.15 -0.00 8.23 4.15 -1.96 -0.93 115.11 126.56 2xdw h GLN 219 Ca -0.49 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.92 2xdw h GLN 219 Cb 1.18 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.84 2xdw h GLN 219 CO 0.61 0.10 0.06 0.66 -1.93 0.00 0.00 178.83 178.32 2xdw h SER 220 N 0.15 0.00 0.18 -0.69 4.64 -1.96 -1.18 113.55 114.70 2xdw h SER 220 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2xdw h SER 220 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 2xdw h SER 220 CO -0.03 0.00 -0.22 -0.62 -0.87 0.00 0.00 176.83 175.09 2xdw n GLU 221 N -3.06 1.00 -1.75 4.77 1.02 -0.35 -4.98 120.64 117.30 2xdw n GLU 221 Ca -0.03 -0.60 -0.39 0.00 -0.02 0.00 0.00 57.16 56.12 2xdw n GLU 221 Cb 0.12 -1.49 0.04 0.00 -0.02 0.00 0.00 31.44 30.09 2xdw n GLU 221 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2xdw n ASP 222 N -0.48 2.86 -4.72 1.62 9.92 -0.45 -4.96 116.55 120.35 2xdw n ASP 222 Ca 0.13 1.01 -0.39 0.00 -0.53 0.00 0.00 54.79 55.02 2xdw n ASP 222 Cb 0.36 -1.59 -0.05 0.00 -0.64 0.00 0.00 41.12 39.20 2xdw n ASP 222 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2xdw s ILE 223 N -1.26 5.08 -0.25 0.53 -1.09 -0.46 -4.86 121.20 118.88 2xdw s ILE 223 Ca 0.69 1.28 -0.27 0.00 -2.23 0.00 0.00 60.65 60.12 2xdw s ILE 223 Cb -0.42 -3.97 0.01 0.00 -1.58 0.00 0.00 42.46 36.50 2xdw s ILE 223 CO 0.51 0.29 0.96 -0.22 -1.23 0.00 0.00 174.94 175.25 2xdw s LEU 224 N 0.66 4.07 -0.08 2.97 2.96 -1.26 -0.63 118.68 127.36 2xdw s LEU 224 Ca 0.34 1.19 0.10 0.00 -0.22 0.00 0.00 54.13 55.53 2xdw s LEU 224 Cb -0.17 -3.40 -0.15 0.00 0.50 0.00 0.00 46.19 42.97 2xdw s LEU 224 CO 0.16 -0.65 0.10 0.00 -1.32 0.00 0.00 176.35 174.64 2xdw s ALA 226 N -2.41 -1.21 0.10 0.00 0.00 -1.11 -2.84 121.76 114.29 2xdw s ALA 226 Ca -0.05 1.25 -0.16 0.00 0.00 0.00 0.00 51.96 53.00 2xdw s ALA 226 Cb 0.04 -0.63 0.03 0.00 0.00 0.00 0.00 23.12 22.56 2xdw s ALA 226 CO 0.46 -0.25 0.40 -1.83 0.00 0.00 0.00 175.76 174.54 2xdw s GLU 227 N -0.05 1.03 -0.48 0.00 -1.05 -1.26 -1.40 118.70 115.49 2xdw s GLU 227 Ca -0.03 -0.63 0.07 0.00 -0.15 0.00 0.00 54.97 54.24 2xdw s GLU 227 Cb -0.03 0.45 0.25 0.00 -0.44 0.00 0.00 34.13 34.36 2xdw s GLU 227 CO 0.02 -0.39 0.61 1.19 0.95 0.00 0.00 175.26 177.64 2xdw n PHE 228 N -0.04 1.15 0.28 4.83 3.72 -1.26 -4.98 117.46 121.16 2xdw n PHE 228 Ca -0.17 -3.79 0.12 0.00 -0.05 0.00 0.00 57.45 53.57 2xdw n PHE 228 Cb 0.63 -0.43 0.79 0.00 -0.94 0.00 0.00 39.48 39.53 2xdw n PHE 228 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2xdw h PRO 229 N 4.03 0.00 -0.05 -1.08 0.13 -1.99 -0.49 132.00 132.55 2xdw h PRO 229 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2xdw h PRO 229 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 2xdw h PRO 229 CO 0.60 0.01 0.00 -0.25 -0.23 0.00 0.00 178.00 178.13 2xdw n ASP 230 N -4.13 1.76 -3.33 1.44 8.00 -1.26 -4.50 116.55 114.53 2xdw n ASP 230 Ca -0.03 -1.61 -0.26 0.00 0.71 0.00 0.00 54.79 53.61 2xdw n ASP 230 Cb 0.10 -0.02 -0.09 0.00 -0.02 0.00 0.00 41.12 41.09 2xdw n ASP 230 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2xdw n GLU 231 N 0.37 0.64 0.31 -1.24 -0.58 -0.19 -5.00 120.64 114.95 2xdw n GLU 231 Ca 0.18 -3.35 0.21 0.00 -0.42 0.00 0.00 57.16 53.78 2xdw n GLU 231 Cb 0.39 -1.53 1.09 0.00 -0.57 0.00 0.00 31.44 30.82 2xdw n GLU 231 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 2xdw h PRO 232 N 4.80 0.00 -0.00 3.49 0.11 -1.79 -1.57 132.00 137.04 2xdw h PRO 232 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2xdw h PRO 232 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2xdw h PRO 232 CO 0.46 0.00 -0.48 1.63 -0.21 0.00 0.00 178.00 179.40 2xdw n LYS 233 N -2.98 0.15 -2.29 1.05 5.02 -1.26 -0.85 118.16 117.00 2xdw n LYS 233 Ca -0.02 -0.09 -0.37 0.00 -2.02 0.00 0.00 58.31 55.80 2xdw n LYS 233 Cb 0.09 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.59 2xdw n LYS 233 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2xdw s TRP 234 N -2.91 2.97 -0.12 2.13 0.52 -0.59 -4.62 118.94 116.32 2xdw s TRP 234 Ca 0.13 1.55 -0.02 0.00 0.02 0.00 0.00 56.10 57.78 2xdw s TRP 234 Cb 0.18 -3.37 0.04 0.00 -1.15 0.00 0.00 33.47 29.17 2xdw s TRP 234 CO 0.68 -1.38 0.00 -1.64 0.02 0.00 0.00 176.95 174.63 2xdw s MET 235 N -2.54 0.78 -0.33 4.98 -1.94 -0.22 -4.34 119.30 115.69 2xdw s MET 235 Ca 0.61 -0.14 -0.08 0.00 -1.71 0.00 0.00 55.69 54.36 2xdw s MET 235 Cb -0.29 -1.48 0.02 0.00 2.01 0.00 0.00 34.83 35.09 2xdw s MET 235 CO 0.36 -0.42 0.14 0.20 -0.01 0.00 0.00 175.02 175.29 2xdw s GLY 236 N 1.88 1.86 -0.09 -0.03 0.00 -1.26 -0.60 107.32 109.08 2xdw s GLY 236 Ca 0.03 -1.61 -0.05 0.00 0.00 0.00 0.00 44.72 43.09 2xdw s GLY 236 CO -0.07 0.75 0.10 -0.32 0.00 0.00 0.00 173.10 173.57 2xdw s GLY 237 N 1.51 2.07 0.04 0.20 0.00 -0.46 -4.67 107.32 106.01 2xdw s GLY 237 Ca 0.01 -0.71 0.03 0.00 0.00 0.00 0.00 44.72 44.05 2xdw s GLY 237 CO 0.04 -0.48 0.01 0.00 0.00 0.00 0.00 173.10 172.67 2xdw s ALA 238 N -1.03 3.31 0.03 3.20 0.00 -1.26 -0.61 121.76 125.39 2xdw s ALA 238 Ca 0.16 -1.02 -0.04 0.00 0.00 0.00 0.00 51.96 51.06 2xdw s ALA 238 Cb -0.12 -1.29 -0.01 0.00 0.00 0.00 0.00 23.12 21.70 2xdw s ALA 238 CO 0.06 0.68 0.07 -1.83 0.00 0.00 0.00 175.76 174.73 2xdw s GLU 239 N -1.93 0.52 0.05 0.00 -1.05 -0.60 -4.59 118.70 111.10 2xdw s GLU 239 Ca 0.23 -0.71 -0.15 0.00 -0.15 0.00 0.00 54.97 54.20 2xdw s GLU 239 Cb -0.12 0.20 -0.06 0.00 -0.44 0.00 0.00 34.13 33.72 2xdw s GLU 239 CO 0.14 -0.12 0.46 -0.51 0.95 0.00 0.00 175.26 176.18 2xdw s LEU 240 N -1.95 4.44 0.83 1.83 2.01 -1.26 -0.37 118.68 124.22 2xdw s LEU 240 Ca -0.08 1.01 -0.13 0.00 0.01 0.00 0.00 54.13 54.94 2xdw s LEU 240 Cb -0.03 -2.81 0.07 0.00 0.01 0.00 0.00 46.19 43.43 2xdw s LEU 240 CO -0.03 0.26 1.01 -1.54 1.01 0.00 0.00 176.35 177.05 2xdw n SER 241 N 1.50 0.24 0.16 2.29 3.41 0.11 -4.87 113.62 116.46 2xdw n SER 241 Ca -0.11 0.53 0.12 0.00 -0.26 0.00 0.00 58.87 59.15 2xdw n SER 241 Cb 0.52 -1.43 0.65 0.00 -0.26 0.00 0.00 64.21 63.69 2xdw n SER 241 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2xdw h ASP 242 N -1.07 0.01 -0.00 4.04 3.32 -1.92 0.11 116.42 120.90 2xdw h ASP 242 Ca -0.45 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2xdw h ASP 242 Cb 1.30 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 2xdw h ASP 242 CO 0.43 0.01 -0.01 -0.90 -1.72 0.00 0.00 179.24 177.05 2xdw n ASP 243 N -4.48 1.27 0.00 6.45 5.68 -1.26 -4.94 116.55 119.27 2xdw n ASP 243 Ca 0.02 -1.41 0.00 0.00 -0.50 0.00 0.00 54.79 52.90 2xdw n ASP 243 Cb 0.27 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.25 2xdw n ASP 243 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2xdw n GLY 244 N 1.15 1.86 0.10 6.12 0.00 0.03 -4.90 105.19 109.55 2xdw n GLY 244 Ca 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 2xdw n GLY 244 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2xdw h ARG 245 N 2.59 0.14 -6.19 1.61 2.43 -1.92 -3.44 114.38 109.60 2xdw h ARG 245 Ca 0.00 -0.19 -0.66 0.00 -0.81 0.00 0.00 59.98 58.32 2xdw h ARG 245 Cb 0.00 0.06 -0.30 0.00 -0.42 0.00 0.00 29.97 29.31 2xdw h ARG 245 CO 0.00 1.01 -0.87 0.71 -1.51 0.00 0.00 179.97 179.31 2xdw s TYR 246 N -2.95 2.15 -0.19 2.20 1.51 -1.26 -0.60 117.35 118.21 2xdw s TYR 246 Ca -0.02 -0.47 -0.19 0.00 -1.01 0.00 0.00 57.07 55.38 2xdw s TYR 246 Cb 0.10 -1.39 -0.03 0.00 -0.11 0.00 0.00 41.96 40.52 2xdw s TYR 246 CO 0.83 -0.08 0.52 0.08 -1.11 0.00 0.00 175.55 175.79 2xdw s VAL 247 N -0.42 5.11 -0.21 0.71 1.01 -0.21 -0.71 120.40 125.68 2xdw s VAL 247 Ca 0.05 0.97 -0.08 0.00 0.00 0.00 0.00 61.98 62.92 2xdw s VAL 247 Cb -0.10 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 2xdw s VAL 247 CO 0.00 0.20 0.10 -0.76 0.00 0.00 0.00 175.10 174.64 2xdw s LEU 248 N 1.48 3.88 -0.29 3.92 1.43 0.50 -0.82 118.68 128.77 2xdw s LEU 248 Ca 0.25 0.06 -0.07 0.00 -1.03 0.00 0.00 54.13 53.34 2xdw s LEU 248 Cb -0.15 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 44.06 2xdw s LEU 248 CO 0.10 0.11 0.08 -0.22 0.23 0.00 0.00 176.35 176.65 2xdw s LEU 249 N 0.75 3.81 -0.37 1.79 2.96 0.42 -1.55 118.68 126.49 2xdw s LEU 249 Ca 0.05 -0.65 -0.12 0.00 -0.22 0.00 0.00 54.13 53.19 2xdw s LEU 249 Cb -0.13 -1.89 0.01 0.00 0.50 0.00 0.00 46.19 44.68 2xdw s LEU 249 CO 0.02 -0.18 0.23 -0.44 -1.32 0.00 0.00 176.35 174.67 2xdw s SER 250 N 1.52 5.89 -0.24 3.68 0.01 0.22 -1.22 113.70 123.56 2xdw s SER 250 Ca 0.03 -0.76 -0.11 0.00 1.31 0.00 0.00 55.95 56.42 2xdw s SER 250 Cb -0.17 -2.09 -0.05 0.00 0.21 0.00 0.00 66.02 63.92 2xdw s SER 250 CO 0.03 -0.34 0.18 -0.63 0.41 0.00 0.00 173.24 172.89 2xdw s ILE 251 N 1.64 5.34 0.08 1.44 1.01 -0.53 -1.36 121.20 128.82 2xdw s ILE 251 Ca 0.04 0.23 0.05 0.00 0.00 0.00 0.00 60.65 60.97 2xdw s ILE 251 Cb -0.18 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 2xdw s ILE 251 CO 0.08 0.33 -0.05 -0.13 0.00 0.00 0.00 174.94 175.17 2xdw s ARG 252 N 1.13 2.38 -0.30 2.79 1.81 0.23 -1.29 118.95 125.70 2xdw s ARG 252 Ca 0.08 -0.89 -0.03 0.00 -1.72 0.00 0.00 55.73 53.17 2xdw s ARG 252 Cb -0.14 -2.44 0.10 0.00 -0.45 0.00 0.00 34.95 32.03 2xdw s ARG 252 CO 0.05 0.54 0.13 -2.00 -0.68 0.00 0.00 175.30 173.34 2xdw s GLU 253 N -2.11 0.37 0.23 3.54 2.12 -1.26 -1.05 118.70 120.53 2xdw s GLU 253 Ca 0.22 -0.75 0.00 0.00 0.36 0.00 0.00 54.97 54.81 2xdw s GLU 253 Cb -0.11 -1.40 0.00 0.00 0.26 0.00 0.00 34.13 32.87 2xdw s GLU 253 CO 0.15 -1.03 0.00 0.41 -0.54 0.00 0.00 175.26 174.25 2xdw n GLY 254 N 5.04 -1.78 0.68 -1.50 0.00 -1.26 -4.70 105.19 101.68 2xdw n GLY 254 Ca -0.04 -1.93 0.08 0.00 0.00 0.00 0.00 46.02 44.14 2xdw n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdw s ASP 256 N -1.29 4.89 -1.37 0.00 1.01 -1.26 -4.89 116.67 113.76 2xdw s ASP 256 Ca 0.21 2.27 -0.15 0.00 0.71 0.00 0.00 52.55 55.58 2xdw s ASP 256 Cb 0.14 -2.58 0.07 0.00 1.01 0.00 0.00 42.92 41.55 2xdw s ASP 256 CO 0.20 -1.79 1.96 -0.81 0.21 0.00 0.00 175.17 174.94 2xdw n PRO 257 N -2.13 3.07 -3.85 8.23 -0.04 -1.26 -4.82 135.00 134.20 2xdw n PRO 257 Ca 0.13 -3.01 -0.10 0.00 -0.04 0.00 0.00 63.50 60.48 2xdw n PRO 257 Cb 0.50 -3.35 -0.08 0.00 -0.04 0.00 0.00 33.50 30.54 2xdw n PRO 257 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2xdw s VAL 258 N 3.41 0.13 -0.14 0.52 -7.23 -1.26 -3.35 120.40 112.48 2xdw s VAL 258 Ca 0.49 -1.04 -0.29 0.00 -1.81 0.00 0.00 61.98 59.33 2xdw s VAL 258 Cb 0.09 -1.13 0.08 0.00 0.56 0.00 0.00 36.38 35.98 2xdw s VAL 258 CO -0.01 -0.58 0.77 0.54 -0.31 0.00 0.00 175.10 175.52 2xdw s ASN 259 N -2.48 -0.62 0.65 4.85 4.22 -0.25 -4.76 114.94 116.55 2xdw s ASN 259 Ca 0.00 0.86 -0.14 0.00 -2.14 0.00 0.00 52.86 51.43 2xdw s ASN 259 Cb 0.02 0.75 -0.00 0.00 1.28 0.00 0.00 41.25 43.30 2xdw s ASN 259 CO -0.07 -0.44 1.09 -0.13 -2.04 0.00 0.00 177.10 175.50 2xdw s ARG 260 N -0.69 2.91 -0.19 3.55 0.52 -0.41 -4.61 118.95 120.04 2xdw s ARG 260 Ca -0.06 1.27 -0.03 0.00 -0.52 0.00 0.00 55.73 56.39 2xdw s ARG 260 Cb -0.02 -1.97 0.06 0.00 0.52 0.00 0.00 34.95 33.54 2xdw s ARG 260 CO 0.05 -1.14 0.03 -1.17 0.02 0.00 0.00 175.30 173.09 2xdw s LEU 261 N -4.93 1.15 0.24 2.53 1.98 -0.26 -1.46 118.68 117.94 2xdw s LEU 261 Ca 0.64 -0.79 0.09 0.00 -2.89 0.00 0.00 54.13 51.19 2xdw s LEU 261 Cb -0.18 -0.59 -0.04 0.00 0.66 0.00 0.00 46.19 46.04 2xdw s LEU 261 CO 0.43 -0.30 -0.04 0.26 -1.89 0.00 0.00 176.35 174.81 2xdw s TRP 262 N 1.86 2.67 0.07 5.38 0.51 -0.36 -1.24 118.94 127.83 2xdw s TRP 262 Ca -0.01 -0.22 0.02 0.00 -2.12 0.00 0.00 56.10 53.77 2xdw s TRP 262 Cb -0.17 -1.22 -0.03 0.00 -0.81 0.00 0.00 33.47 31.24 2xdw s TRP 262 CO -0.08 0.60 -0.07 1.52 -0.51 0.00 0.00 176.95 178.40 2xdw s TYR 263 N -2.15 0.78 -0.13 -1.98 -0.85 -0.20 -0.43 117.35 112.38 2xdw s TYR 263 Ca 0.30 -0.69 0.01 0.00 -0.52 0.00 0.00 57.07 56.16 2xdw s TYR 263 Cb -0.07 -0.46 0.02 0.00 0.38 0.00 0.00 41.96 41.83 2xdw s TYR 263 CO 0.18 -0.11 -0.13 0.00 -1.52 0.00 0.00 175.55 173.97 2xdw s ASP 265 N 1.40 6.39 0.55 0.00 -1.08 -1.26 -1.04 116.67 121.62 2xdw s ASP 265 Ca 0.02 0.23 0.24 0.00 -0.52 0.00 0.00 52.55 52.53 2xdw s ASP 265 Cb -0.13 -2.55 1.54 0.00 -1.46 0.00 0.00 42.92 40.32 2xdw s ASP 265 CO -0.08 -1.51 2.17 -0.07 0.52 0.00 0.00 175.17 176.21 2xdw h LEU 266 N 12.14 0.00 -1.86 -1.34 3.38 -1.20 0.16 115.31 126.59 2xdw h LEU 266 Ca -0.25 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 2xdw h LEU 266 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 2xdw h LEU 266 CO 1.17 0.04 -0.05 -0.61 0.09 0.00 0.00 178.44 179.09 2xdw h GLN 267 N 0.00 0.00 -0.01 1.13 4.15 -1.91 -2.43 115.11 116.04 2xdw h GLN 267 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2xdw h GLN 267 Cb 0.09 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.78 2xdw h GLN 267 CO 0.01 0.05 -0.09 1.04 -1.93 0.00 0.00 178.83 177.91 2xdw n GLN 268 N -3.23 1.31 -2.19 1.69 1.13 0.04 -4.87 117.38 111.27 2xdw n GLN 268 Ca -0.01 -0.72 -0.39 0.00 -1.94 0.00 0.00 57.00 53.94 2xdw n GLN 268 Cb 0.25 -1.48 -0.01 0.00 0.11 0.00 0.00 30.24 29.10 2xdw n GLN 268 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2xdw s GLU 269 N -2.19 4.08 0.25 -1.09 0.41 -0.92 -4.93 118.70 114.32 2xdw s GLU 269 Ca 0.34 2.01 -0.01 0.00 -0.41 0.00 0.00 54.97 56.89 2xdw s GLU 269 Cb 0.20 -2.78 0.31 0.00 -1.78 0.00 0.00 34.13 30.08 2xdw s GLU 269 CO 0.40 -0.35 1.70 0.77 -0.49 0.00 0.00 175.26 177.30 2xdw h SER 270 N 2.80 0.67 -0.46 -0.19 0.02 -1.90 -3.39 113.55 111.12 2xdw h SER 270 Ca -0.49 -0.21 -0.29 0.00 -0.84 0.00 0.00 61.79 59.96 2xdw h SER 270 Cb 1.24 -0.18 -0.23 0.00 0.14 0.00 0.00 62.40 63.36 2xdw h SER 270 CO 0.63 0.85 -0.65 -3.20 -1.14 0.00 0.00 176.83 173.32 2xdw n ASN 271 N -4.15 -1.04 -0.23 3.07 5.15 -1.26 -5.14 115.26 111.65 2xdw n ASN 271 Ca 0.01 -2.94 0.00 0.00 -0.60 0.00 0.00 54.58 51.05 2xdw n ASN 271 Cb 0.38 0.77 0.00 0.00 -0.53 0.00 0.00 39.78 40.40 2xdw n ASN 271 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2xdw n GLY 272 N -0.11 -0.77 3.52 8.20 0.00 -1.26 -4.62 105.19 110.14 2xdw n GLY 272 Ca 0.06 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 2xdw n GLY 272 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2xdw s ILE 273 N 0.00 4.25 0.00 -0.61 1.01 -1.26 -4.79 121.20 119.80 2xdw s ILE 273 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.91 2xdw s ILE 273 Cb 0.00 -4.64 0.00 0.00 0.01 0.00 0.00 42.46 37.83 2xdw s ILE 273 CO 0.00 -1.30 0.08 0.35 0.00 0.00 0.00 174.94 174.07 2xdw n THR 274 N 6.23 0.00 -1.94 2.92 -2.24 -1.26 -5.01 114.28 112.98 2xdw n THR 274 Ca 0.02 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 2xdw n THR 274 Cb 0.47 1.10 0.00 0.00 -2.10 0.00 0.00 70.33 69.80 2xdw n THR 274 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2xdw n GLY 275 N 0.47 1.21 3.69 3.38 0.00 -1.26 -4.94 105.19 107.74 2xdw n GLY 275 Ca 0.00 -0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 2xdw n GLY 275 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2xdw n ILE 276 N 0.00 0.27 -1.66 -0.61 2.08 -1.09 -4.39 119.36 113.97 2xdw n ILE 276 Ca 0.00 -0.05 -0.31 0.00 0.56 0.00 0.00 62.75 62.95 2xdw n ILE 276 Cb 0.00 -2.01 0.05 0.00 -0.75 0.00 0.00 39.64 36.93 2xdw n ILE 276 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2xdw s LEU 277 N 2.34 2.98 -1.44 1.39 1.43 -1.13 -4.92 118.68 119.32 2xdw s LEU 277 Ca 0.81 1.44 -0.14 0.00 -1.03 0.00 0.00 54.13 55.21 2xdw s LEU 277 Cb -0.53 -4.27 0.03 0.00 0.03 0.00 0.00 46.19 41.46 2xdw s LEU 277 CO 0.38 -1.47 2.23 0.29 0.23 0.00 0.00 176.35 178.01 2xdw n LYS 278 N -3.13 2.83 -1.94 1.70 5.02 -1.26 -4.96 118.16 116.42 2xdw n LYS 278 Ca 0.07 -2.58 -0.41 0.00 -2.02 0.00 0.00 58.31 53.37 2xdw n LYS 278 Cb 0.55 -3.27 -0.02 0.00 -0.02 0.00 0.00 35.03 32.26 2xdw n LYS 278 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2xdw s TRP 279 N 3.23 2.92 -0.24 2.13 0.52 -1.26 -4.67 118.94 121.57 2xdw s TRP 279 Ca 0.48 0.99 -0.06 0.00 0.02 0.00 0.00 56.10 57.53 2xdw s TRP 279 Cb 0.14 -3.89 -0.02 0.00 -1.15 0.00 0.00 33.47 28.55 2xdw s TRP 279 CO -0.08 -2.88 0.04 0.08 0.02 0.00 0.00 176.95 174.13 2xdw s VAL 280 N -0.14 4.05 -1.24 4.03 1.01 0.69 -4.94 120.40 123.86 2xdw s VAL 280 Ca 0.59 -0.27 -0.10 0.00 0.00 0.00 0.00 61.98 62.20 2xdw s VAL 280 Cb -0.44 -2.89 0.18 0.00 0.00 0.00 0.00 36.38 33.24 2xdw s VAL 280 CO 0.46 0.36 1.67 0.29 0.00 0.00 0.00 175.10 177.88 2xdw n LYS 281 N 4.89 3.60 0.11 2.72 5.02 -1.26 -1.03 118.16 132.21 2xdw n LYS 281 Ca -0.17 -3.75 -0.13 0.00 -2.02 0.00 0.00 58.31 52.25 2xdw n LYS 281 Cb 0.51 -2.92 -0.06 0.00 -0.02 0.00 0.00 35.03 32.55 2xdw n LYS 281 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2xdw h LEU 282 N 8.25 -0.71 -7.71 -0.35 5.85 -1.87 -3.36 115.31 115.41 2xdw h LEU 282 Ca 0.35 0.08 -0.65 0.00 0.84 0.00 0.00 57.88 58.50 2xdw h LEU 282 Cb 0.72 0.27 -0.38 0.00 0.37 0.00 0.00 40.66 41.63 2xdw h LEU 282 CO 1.46 -0.34 -0.77 -0.63 -0.34 0.00 0.00 178.44 177.82 2xdw s ILE 283 N -6.07 1.96 -0.59 4.05 -1.09 -0.37 -5.01 121.20 114.08 2xdw s ILE 283 Ca -0.15 -1.73 0.03 0.00 -2.23 0.00 0.00 60.65 56.57 2xdw s ILE 283 Cb 0.08 -2.24 0.38 0.00 -1.58 0.00 0.00 42.46 39.10 2xdw s ILE 283 CO 0.65 -0.26 1.29 -0.67 -1.23 0.00 0.00 174.94 174.72 2xdw n ASP 284 N 4.46 5.36 -3.29 3.58 2.03 -1.26 -1.10 116.55 126.34 2xdw n ASP 284 Ca -0.07 -3.73 -0.08 0.00 0.52 0.00 0.00 54.79 51.42 2xdw n ASP 284 Cb 0.42 -0.64 0.01 0.00 -0.72 0.00 0.00 41.12 40.19 2xdw n ASP 284 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2xdw s ASN 285 N -2.93 -0.10 -0.38 1.67 2.20 -1.26 -5.07 114.94 109.08 2xdw s ASN 285 Ca 0.48 -0.94 0.06 0.00 -0.94 0.00 0.00 52.86 51.52 2xdw s ASN 285 Cb 0.37 0.80 0.49 0.00 -2.00 0.00 0.00 41.25 40.91 2xdw s ASN 285 CO -0.22 -1.56 1.52 0.49 -2.94 0.00 0.00 177.10 174.40 2xdw n PHE 286 N -0.50 2.12 0.39 1.54 3.72 -1.26 -3.28 117.46 120.18 2xdw n PHE 286 Ca -0.07 -2.10 0.12 0.00 -0.05 0.00 0.00 57.45 55.35 2xdw n PHE 286 Cb 0.60 -0.67 0.20 0.00 -0.94 0.00 0.00 39.48 38.67 2xdw n PHE 286 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2xdw h GLU 287 N 1.56 0.00 -3.25 -1.08 5.08 -1.97 -3.44 114.58 111.48 2xdw h GLU 287 Ca 0.37 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.70 2xdw h GLU 287 Cb 1.50 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.64 2xdw h GLU 287 CO 0.78 0.00 0.05 0.20 -1.00 0.00 0.00 179.01 179.05 2xdw s GLY 288 N -3.94 -0.23 0.03 -3.84 0.00 -1.26 -4.86 107.32 93.22 2xdw s GLY 288 Ca 0.06 -0.05 -0.18 0.00 0.00 0.00 0.00 44.72 44.55 2xdw s GLY 288 CO 0.68 -0.18 0.51 1.85 0.00 0.00 0.00 173.10 175.96 2xdw s GLU 289 N -3.84 4.12 -0.26 2.90 2.12 -1.21 -1.09 118.70 121.44 2xdw s GLU 289 Ca 0.06 0.61 -0.02 0.00 0.36 0.00 0.00 54.97 55.99 2xdw s GLU 289 Cb -0.01 -3.25 0.08 0.00 0.26 0.00 0.00 34.13 31.21 2xdw s GLU 289 CO -0.06 0.61 0.06 0.71 -0.54 0.00 0.00 175.26 176.04 2xdw s TYR 290 N -0.93 1.46 -0.32 5.30 1.51 -1.26 -3.45 117.35 119.67 2xdw s TYR 290 Ca 0.27 -1.38 -0.08 0.00 -1.01 0.00 0.00 57.07 54.87 2xdw s TYR 290 Cb -0.18 -1.41 0.01 0.00 -0.11 0.00 0.00 41.96 40.27 2xdw s TYR 290 CO 0.16 -0.77 0.12 0.34 -1.11 0.00 0.00 175.55 174.30 2xdw s ASP 291 N 1.71 5.36 0.17 2.29 2.15 -0.13 -4.96 116.67 123.26 2xdw s ASP 291 Ca 0.04 -0.74 -0.32 0.00 0.43 0.00 0.00 52.55 51.97 2xdw s ASP 291 Cb -0.17 -1.94 -0.11 0.00 -0.30 0.00 0.00 42.92 40.40 2xdw s ASP 291 CO -0.18 -0.24 1.77 -0.47 -0.17 0.00 0.00 175.17 175.89 2xdw s TYR 292 N 1.53 2.57 -0.15 -5.34 5.04 -1.26 -1.03 117.35 118.71 2xdw s TYR 292 Ca 0.03 0.17 -0.13 0.00 -2.44 0.00 0.00 57.07 54.70 2xdw s TYR 292 Cb -0.18 -4.16 -0.06 0.00 0.35 0.00 0.00 41.96 37.91 2xdw s TYR 292 CO 0.04 -4.58 -0.28 0.28 -1.34 0.00 0.00 175.55 169.67 2xdw n VAL 293 N 4.31 1.39 -3.82 3.14 0.31 0.18 -4.89 118.33 118.95 2xdw n VAL 293 Ca 0.17 0.07 -0.05 0.00 -0.01 0.00 0.00 64.34 64.52 2xdw n VAL 293 Cb 0.36 -2.09 0.00 0.00 -0.91 0.00 0.00 33.84 31.20 2xdw n VAL 293 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2xdw s THR 294 N -2.64 0.00 0.05 2.52 -1.32 -1.16 -4.47 115.64 108.62 2xdw s THR 294 Ca -0.25 -0.80 -0.02 0.00 -1.21 0.00 0.00 61.69 59.41 2xdw s THR 294 Cb 0.05 -2.46 -0.03 0.00 -1.51 0.00 0.00 72.50 68.56 2xdw s THR 294 CO 0.35 0.00 0.01 0.54 -2.21 0.00 0.00 174.62 173.31 2xdw s ASN 295 N -3.09 0.41 -0.29 8.08 4.22 -1.26 -0.50 114.94 122.51 2xdw s ASN 295 Ca 0.15 -0.89 -0.01 0.00 -2.14 0.00 0.00 52.86 49.97 2xdw s ASN 295 Cb -0.04 0.21 0.09 0.00 1.28 0.00 0.00 41.25 42.80 2xdw s ASN 295 CO 0.06 -0.59 0.07 -1.61 -2.04 0.00 0.00 177.10 173.00 2xdw s GLU 296 N -3.66 0.81 7.39 3.55 0.41 -0.21 -4.92 118.70 122.07 2xdw s GLU 296 Ca 0.04 -0.99 0.00 0.00 -0.41 0.00 0.00 54.97 53.61 2xdw s GLU 296 Cb 0.06 -2.10 0.00 0.00 -1.78 0.00 0.00 34.13 30.31 2xdw s GLU 296 CO -0.09 -0.90 0.00 0.41 -0.49 0.00 0.00 175.26 174.19 2xdw n GLY 297 N 4.84 3.62 0.21 -1.39 0.00 -1.26 -1.77 105.19 109.44 2xdw n GLY 297 Ca -0.04 -0.06 0.15 0.00 0.00 0.00 0.00 46.02 46.07 2xdw n GLY 297 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2xdw n THR 298 N 0.00 0.00 -3.21 2.61 -2.24 -1.26 -4.74 114.28 105.43 2xdw n THR 298 Ca 0.00 -0.11 -0.43 0.00 -2.27 0.00 0.00 64.05 61.25 2xdw n THR 298 Cb 0.00 -0.06 -0.08 0.00 -2.10 0.00 0.00 70.33 68.09 2xdw n THR 298 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2xdw s VAL 299 N -2.04 4.96 -0.21 2.28 1.01 -0.73 -0.94 120.40 124.74 2xdw s VAL 299 Ca 0.42 -0.03 -0.07 0.00 0.00 0.00 0.00 61.98 62.31 2xdw s VAL 299 Cb 0.21 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 2xdw s VAL 299 CO 0.36 -0.46 0.05 -0.36 0.00 0.00 0.00 175.10 174.69 2xdw s PHE 300 N 2.48 3.15 -0.21 5.22 0.40 0.01 -1.04 117.98 127.99 2xdw s PHE 300 Ca 0.18 -0.17 -0.17 0.00 -0.60 0.00 0.00 56.93 56.17 2xdw s PHE 300 Cb -0.15 -2.13 -0.04 0.00 0.51 0.00 0.00 43.02 41.21 2xdw s PHE 300 CO 0.16 -0.08 0.45 0.99 0.70 0.00 0.00 175.22 177.43 2xdw s THR 301 N 0.90 5.16 -0.00 0.64 2.01 0.34 -0.31 115.64 124.38 2xdw s THR 301 Ca 0.03 0.79 0.07 0.00 0.31 0.00 0.00 61.69 62.89 2xdw s THR 301 Cb -0.14 -3.77 -0.02 0.00 0.01 0.00 0.00 72.50 68.58 2xdw s THR 301 CO 0.02 0.21 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.59 2xdw s PHE 302 N 1.55 1.91 0.01 4.92 0.08 -0.03 -0.65 117.98 125.77 2xdw s PHE 302 Ca 0.21 -0.37 -0.30 0.00 0.12 0.00 0.00 56.93 56.59 2xdw s PHE 302 Cb -0.15 -1.21 -0.03 0.00 -0.57 0.00 0.00 43.02 41.06 2xdw s PHE 302 CO 0.09 -0.00 1.02 0.21 -0.10 0.00 0.00 175.22 176.43 2xdw s LYS 303 N -0.66 4.54 0.08 0.44 2.20 -0.20 -1.05 119.74 125.08 2xdw s LYS 303 Ca 0.08 1.47 0.01 0.00 -0.36 0.00 0.00 55.97 57.18 2xdw s LYS 303 Cb -0.08 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.75 2xdw s LYS 303 CO -0.00 -0.09 -0.06 -0.08 -0.36 0.00 0.00 175.35 174.75 2xdw s THR 304 N 1.05 0.58 -0.44 3.43 -1.32 -0.22 -0.96 115.64 117.76 2xdw s THR 304 Ca 0.53 -1.69 0.11 0.00 -1.21 0.00 0.00 61.69 59.43 2xdw s THR 304 Cb -0.22 -1.36 0.30 0.00 -1.51 0.00 0.00 72.50 69.70 2xdw s THR 304 CO 0.28 -0.76 1.23 -0.46 -2.21 0.00 0.00 174.62 172.70 2xdw n ASN 305 N 0.38 2.92 -4.61 8.08 0.23 -1.22 -1.49 115.26 119.55 2xdw n ASN 305 Ca -0.15 -2.40 -0.43 0.00 -0.53 0.00 0.00 54.58 51.07 2xdw n ASN 305 Cb 0.59 -0.29 -0.03 0.00 -2.08 0.00 0.00 39.78 37.97 2xdw n ASN 305 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 2xdw s ARG 306 N -1.71 3.34 -1.11 -3.83 6.06 -1.26 -1.24 118.95 119.20 2xdw s ARG 306 Ca 0.24 1.97 -0.05 0.00 -2.50 0.00 0.00 55.73 55.40 2xdw s ARG 306 Cb 0.17 -4.29 0.04 0.00 0.06 0.00 0.00 34.95 30.93 2xdw s ARG 306 CO 0.09 -1.86 0.26 0.72 -2.50 0.00 0.00 175.30 172.00 2xdw n HIS 307 N 10.71 -1.65 -3.03 5.12 8.25 -1.26 -4.90 115.22 128.46 2xdw n HIS 307 Ca 0.27 0.25 -0.15 0.00 -0.26 0.00 0.00 57.72 57.82 2xdw n HIS 307 Cb 0.45 -2.78 -0.03 0.00 1.12 0.00 0.00 29.99 28.74 2xdw n HIS 307 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2xdw n SER 308 N -2.04 -2.01 0.20 0.41 3.41 -0.37 -5.02 113.62 108.20 2xdw n SER 308 Ca -0.07 -2.74 0.14 0.00 -0.26 0.00 0.00 58.87 55.95 2xdw n SER 308 Cb 0.57 0.71 0.65 0.00 -0.26 0.00 0.00 64.21 65.88 2xdw n SER 308 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2xdw h PRO 309 N 5.05 0.00 -0.15 4.33 0.13 -1.91 0.24 132.00 139.69 2xdw h PRO 309 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2xdw h PRO 309 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2xdw h PRO 309 CO 0.21 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.07 2xdw n ASN 310 N -2.53 2.30 -0.28 1.44 3.02 -1.26 -0.81 115.26 117.15 2xdw n ASN 310 Ca 0.00 -1.78 0.01 0.00 -0.03 0.00 0.00 54.58 52.78 2xdw n ASN 310 Cb 0.17 -0.09 -0.01 0.00 -0.61 0.00 0.00 39.78 39.25 2xdw n ASN 310 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2xdw n TYR 311 N 0.76 -0.75 -3.87 3.10 4.02 0.07 -0.94 117.16 119.55 2xdw n TYR 311 Ca 0.17 0.41 -0.08 0.00 -0.01 0.00 0.00 57.90 58.39 2xdw n TYR 311 Cb 0.46 -0.89 -0.03 0.00 -0.02 0.00 0.00 39.34 38.86 2xdw n TYR 311 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 176.86 174.87 2xdw s ARG 312 N -3.84 1.71 -0.16 -0.72 1.70 -0.56 -4.24 118.95 112.85 2xdw s ARG 312 Ca 0.00 -1.03 -0.06 0.00 -0.47 0.00 0.00 55.73 54.18 2xdw s ARG 312 Cb 0.00 0.58 -0.04 0.00 -0.57 0.00 0.00 34.95 34.92 2xdw s ARG 312 CO 0.00 -0.77 0.03 -0.51 -1.08 0.00 0.00 175.30 172.97 2xdw s LEU 313 N -2.93 3.64 0.15 -1.89 1.43 -0.47 -1.06 118.68 117.55 2xdw s LEU 313 Ca 0.13 0.04 0.09 0.00 -1.03 0.00 0.00 54.13 53.36 2xdw s LEU 313 Cb -0.05 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2xdw s LEU 313 CO 0.07 0.20 -0.20 0.27 0.23 0.00 0.00 176.35 176.92 2xdw s ILE 314 N 0.18 1.89 -0.21 -0.59 -4.36 -0.22 -0.83 121.20 117.06 2xdw s ILE 314 Ca 0.02 -1.81 -0.05 0.00 -0.26 0.00 0.00 60.65 58.56 2xdw s ILE 314 Cb -0.13 -1.81 -0.02 0.00 1.25 0.00 0.00 42.46 41.76 2xdw s ILE 314 CO 0.01 -0.18 -0.01 0.20 0.24 0.00 0.00 174.94 175.19 2xdw s ASN 315 N -2.40 4.65 -0.20 4.36 0.01 0.48 -0.85 114.94 120.98 2xdw s ASN 315 Ca 0.13 -0.27 -0.05 0.00 -0.71 0.00 0.00 52.86 51.97 2xdw s ASN 315 Cb -0.08 -1.80 -0.02 0.00 0.41 0.00 0.00 41.25 39.77 2xdw s ASN 315 CO 0.06 0.03 -0.01 -0.63 -1.51 0.00 0.00 177.10 175.04 2xdw s ILE 316 N 1.18 3.78 -0.28 0.60 1.01 0.58 -1.60 121.20 126.48 2xdw s ILE 316 Ca 0.03 -0.37 -0.19 0.00 0.00 0.00 0.00 60.65 60.12 2xdw s ILE 316 Cb -0.15 -2.71 -0.02 0.00 0.01 0.00 0.00 42.46 39.60 2xdw s ILE 316 CO 0.01 0.43 0.57 -0.62 0.00 0.00 0.00 174.94 175.32 2xdw s ASP 317 N 1.09 6.47 0.65 3.58 -1.08 -1.26 -0.81 116.67 125.31 2xdw s ASP 317 Ca 0.02 0.49 0.43 0.00 -0.52 0.00 0.00 52.55 52.96 2xdw s ASP 317 Cb -0.14 -2.30 2.29 0.00 -1.46 0.00 0.00 42.92 41.30 2xdw s ASP 317 CO 0.01 -0.37 2.33 -0.26 0.52 0.00 0.00 175.17 177.39 2xdw h PHE 318 N 8.08 0.00 -0.01 -5.34 0.04 -1.44 -0.51 116.94 117.76 2xdw h PHE 318 Ca -0.28 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.49 2xdw h PHE 318 Cb 1.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.28 2xdw h PHE 318 CO 0.75 0.00 -0.13 0.25 -0.60 0.00 0.00 178.31 178.59 2xdw n THR 319 N -3.14 0.00 -2.90 -1.55 -2.24 -1.26 -4.28 114.28 98.91 2xdw n THR 319 Ca -0.03 -0.11 -0.13 0.00 -2.27 0.00 0.00 64.05 61.51 2xdw n THR 319 Cb 0.10 0.15 0.03 0.00 -2.10 0.00 0.00 70.33 68.50 2xdw n THR 319 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2xdw n ASP 320 N -0.65 -1.54 -0.17 3.42 2.03 -0.23 -5.04 116.55 114.37 2xdw n ASP 320 Ca 0.15 -3.28 0.14 0.00 0.52 0.00 0.00 54.79 52.32 2xdw n ASP 320 Cb 0.30 1.01 0.52 0.00 -0.72 0.00 0.00 41.12 42.23 2xdw n ASP 320 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2xdw n PRO 321 N 0.96 0.75 -1.70 -0.67 -0.04 -1.01 -4.43 135.00 128.86 2xdw n PRO 321 Ca 0.13 -0.34 -0.41 0.00 -0.04 0.00 0.00 63.50 62.84 2xdw n PRO 321 Cb 0.64 -1.49 0.01 0.00 -0.04 0.00 0.00 33.50 32.61 2xdw n PRO 321 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2xdw n GLU 322 N -0.83 1.94 -0.12 0.54 1.02 -1.26 -4.90 120.64 117.04 2xdw n GLU 322 Ca 0.14 0.69 0.04 0.00 -0.02 0.00 0.00 57.16 58.00 2xdw n GLU 322 Cb 0.31 -2.35 0.35 0.00 -0.02 0.00 0.00 31.44 29.73 2xdw n GLU 322 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2xdw h GLU 323 N 2.16 0.73 0.00 3.49 4.81 -1.99 -0.24 114.58 123.53 2xdw h GLU 323 Ca -0.47 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 2xdw h GLU 323 Cb 1.29 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.51 2xdw h GLU 323 CO 0.60 0.48 0.00 0.66 -0.73 0.00 0.00 179.01 180.02 2xdw h SER 324 N 0.75 0.00 0.23 1.04 4.64 -1.97 -2.19 113.55 116.05 2xdw h SER 324 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2xdw h SER 324 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2xdw h SER 324 CO -0.06 0.00 -0.74 0.29 -0.87 0.00 0.00 176.83 175.44 2xdw n LYS 325 N -2.58 0.05 -1.85 4.77 4.76 -0.10 -4.97 118.16 118.25 2xdw n LYS 325 Ca -0.01 -0.04 -0.40 0.00 -2.87 0.00 0.00 58.31 54.98 2xdw n LYS 325 Cb 0.10 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 2xdw n LYS 325 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2xdw s TRP 326 N -2.97 2.60 -0.07 2.13 0.51 -0.83 -4.93 118.94 115.38 2xdw s TRP 326 Ca 0.10 1.24 -0.12 0.00 -2.12 0.00 0.00 56.10 55.20 2xdw s TRP 326 Cb 0.17 -3.94 -0.05 0.00 -0.81 0.00 0.00 33.47 28.84 2xdw s TRP 326 CO 0.78 -2.82 0.31 0.15 -0.51 0.00 0.00 176.95 174.86 2xdw s LYS 327 N -2.20 3.83 -0.59 4.98 -0.14 -0.63 -4.94 119.74 120.06 2xdw s LYS 327 Ca 0.55 0.19 -0.21 0.00 -1.36 0.00 0.00 55.97 55.15 2xdw s LYS 327 Cb -0.44 -3.25 0.07 0.00 -1.68 0.00 0.00 37.83 32.53 2xdw s LYS 327 CO 0.59 0.63 0.80 0.08 -0.76 0.00 0.00 175.35 176.69 2xdw s VAL 328 N -0.77 4.62 -0.04 3.17 1.01 -1.26 -0.39 120.40 126.74 2xdw s VAL 328 Ca 0.20 -0.52 -0.24 0.00 0.00 0.00 0.00 61.98 61.41 2xdw s VAL 328 Cb -0.15 -4.52 -0.22 0.00 0.00 0.00 0.00 36.38 31.49 2xdw s VAL 328 CO 0.09 -1.16 1.07 0.25 0.00 0.00 0.00 175.10 175.35 2xdw h LEU 329 N 10.48 0.23 -7.32 3.92 5.85 -1.31 -3.41 115.31 123.73 2xdw h LEU 329 Ca -0.28 -0.73 -0.59 0.00 0.84 0.00 0.00 57.88 57.11 2xdw h LEU 329 Cb 1.08 -0.07 -0.40 0.00 0.37 0.00 0.00 40.66 41.65 2xdw h LEU 329 CO 1.10 0.93 -0.76 -0.69 -0.34 0.00 0.00 178.44 178.68 2xdw s VAL 330 N -3.30 1.14 0.92 1.05 1.01 -0.93 -4.31 120.40 115.99 2xdw s VAL 330 Ca -0.16 -1.41 -0.10 0.00 0.00 0.00 0.00 61.98 60.31 2xdw s VAL 330 Cb 0.01 -1.76 0.15 0.00 0.00 0.00 0.00 36.38 34.78 2xdw s VAL 330 CO 0.74 -0.52 1.15 -2.84 0.00 0.00 0.00 175.10 173.63 2xdw s PRO 331 N 1.50 0.97 0.40 2.72 0.02 -1.26 -1.36 135.00 137.99 2xdw s PRO 331 Ca 0.06 1.56 -0.27 0.00 0.02 0.00 0.00 61.00 62.38 2xdw s PRO 331 Cb -0.18 -1.72 -0.09 0.00 0.02 0.00 0.00 34.50 32.53 2xdw s PRO 331 CO -0.18 -2.67 1.40 -2.00 -0.33 0.00 0.00 177.00 173.23 2xdw s GLU 332 N -4.64 3.97 0.34 5.54 2.12 -1.26 -4.80 118.70 119.96 2xdw s GLU 332 Ca 0.67 2.38 -0.13 0.00 0.36 0.00 0.00 54.97 58.25 2xdw s GLU 332 Cb -0.23 -2.83 -0.08 0.00 0.26 0.00 0.00 34.13 31.25 2xdw s GLU 332 CO 0.58 -0.58 0.72 -1.58 -0.54 0.00 0.00 175.26 173.87 2xdw s HIS 333 N -1.18 3.41 0.40 5.30 5.65 -1.26 -5.00 115.29 122.61 2xdw s HIS 333 Ca 0.56 1.11 0.12 0.00 0.25 0.00 0.00 55.06 57.11 2xdw s HIS 333 Cb -0.43 -2.47 0.83 0.00 -1.18 0.00 0.00 32.58 29.34 2xdw s HIS 333 CO 0.56 0.05 1.91 1.49 -0.65 0.00 0.00 174.74 178.10 2xdw h GLU 334 N 1.96 0.08 0.00 2.88 4.81 -1.99 -3.39 114.58 118.93 2xdw h GLU 334 Ca -0.48 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2xdw h GLU 334 Cb 1.18 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.55 2xdw h GLU 334 CO 0.65 0.31 -0.36 1.17 -0.73 0.00 0.00 179.01 180.06 2xdw n LYS 335 N -4.23 0.43 -2.58 1.92 4.81 -1.26 -5.03 118.16 112.22 2xdw n LYS 335 Ca -0.02 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.01 2xdw n LYS 335 Cb 0.31 -0.68 -0.04 0.00 0.02 0.00 0.00 35.03 34.64 2xdw n LYS 335 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2xdw s ASP 336 N -2.87 7.32 -0.16 3.14 1.01 -1.26 -4.85 116.67 118.99 2xdw s ASP 336 Ca 0.00 1.95 -0.19 0.00 0.71 0.00 0.00 52.55 55.02 2xdw s ASP 336 Cb 0.00 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.30 2xdw s ASP 336 CO 0.00 -0.22 0.54 -0.69 0.21 0.00 0.00 175.17 175.02 2xdw s VAL 337 N 0.13 5.11 -0.65 -1.27 1.01 -0.82 -4.37 120.40 119.55 2xdw s VAL 337 Ca 0.50 1.05 -0.27 0.00 0.00 0.00 0.00 61.98 63.25 2xdw s VAL 337 Cb -0.27 -3.87 0.02 0.00 0.00 0.00 0.00 36.38 32.26 2xdw s VAL 337 CO 0.32 0.22 1.36 -0.22 0.00 0.00 0.00 175.10 176.79 2xdw s LEU 338 N 1.25 3.29 -0.04 3.92 2.96 -0.12 -0.46 118.68 129.48 2xdw s LEU 338 Ca 0.27 -0.07 -0.23 0.00 -0.22 0.00 0.00 54.13 53.89 2xdw s LEU 338 Cb -0.16 -2.80 -0.26 0.00 0.50 0.00 0.00 46.19 43.48 2xdw s LEU 338 CO 0.11 -1.80 1.00 -0.33 -1.32 0.00 0.00 176.35 174.01 2xdw h GLU 339 N 10.74 0.27 -2.98 1.98 5.08 -1.16 -3.45 114.58 125.07 2xdw h GLU 339 Ca -0.27 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 57.74 2xdw h GLU 339 Cb 1.07 0.11 -0.11 0.00 0.50 0.00 0.00 28.75 30.32 2xdw h GLU 339 CO 1.23 1.07 0.22 1.67 -1.00 0.00 0.00 179.01 182.20 2xdw s TRP 340 N -2.90 -0.50 -0.03 4.33 1.48 -1.19 -5.03 118.94 115.10 2xdw s TRP 340 Ca -0.15 0.27 -0.03 0.00 -1.06 0.00 0.00 56.10 55.14 2xdw s TRP 340 Cb 0.01 0.57 0.01 0.00 -1.16 0.00 0.00 33.47 32.91 2xdw s TRP 340 CO 0.79 -0.87 0.09 0.08 -4.06 0.00 0.00 176.95 172.98 2xdw s VAL 341 N -3.74 -0.00 0.09 -0.66 1.01 -1.26 -1.41 120.40 114.42 2xdw s VAL 341 Ca 0.02 0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.07 2xdw s VAL 341 Cb -0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 36.38 36.19 2xdw s VAL 341 CO -0.11 0.00 -0.16 0.00 0.00 0.00 0.00 175.10 174.83 2xdw s ALA 342 N 0.08 1.40 -0.14 5.51 0.00 -0.50 -4.90 121.76 123.21 2xdw s ALA 342 Ca -0.00 -1.13 -0.04 0.00 0.00 0.00 0.00 51.96 50.78 2xdw s ALA 342 Cb -0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 2xdw s ALA 342 CO -0.00 0.19 0.01 0.00 0.00 0.00 0.00 175.76 175.96 2xdw s VAL 344 N -0.00 0.10 -1.37 0.00 0.11 -0.34 -1.98 120.40 116.91 2xdw s VAL 344 Ca 0.03 -0.80 -0.03 0.00 -2.93 0.00 0.00 61.98 58.25 2xdw s VAL 344 Cb -0.13 -0.44 0.02 0.00 -1.53 0.00 0.00 36.38 34.30 2xdw s VAL 344 CO 0.02 -0.44 0.73 -1.14 -3.33 0.00 0.00 175.10 170.94 2xdw n ARG 345 N 1.40 -4.82 0.00 1.54 0.63 -0.18 -1.80 116.66 113.43 2xdw n ARG 345 Ca -0.23 0.58 0.00 0.00 -0.92 0.00 0.00 57.85 57.29 2xdw n ARG 345 Cb 0.56 -5.16 0.00 0.00 0.45 0.00 0.00 32.46 28.30 2xdw n ARG 345 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2xdw n SER 346 N -2.99 0.00 -0.43 6.15 7.64 0.08 -4.02 113.62 120.05 2xdw n SER 346 Ca -0.22 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.71 2xdw n SER 346 Cb 0.64 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.93 2xdw n SER 346 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2xdw n ASN 347 N 1.59 1.32 -4.75 6.43 6.94 -1.23 -5.01 115.26 120.55 2xdw n ASN 347 Ca 0.00 -2.71 -0.29 0.00 -0.02 0.00 0.00 54.58 51.57 2xdw n ASN 347 Cb 0.00 -0.35 -0.07 0.00 -2.36 0.00 0.00 39.78 37.00 2xdw n ASN 347 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 2xdw s PHE 348 N -1.64 3.10 -0.05 -2.53 0.08 -0.74 -1.17 117.98 115.03 2xdw s PHE 348 Ca 0.22 0.00 0.06 0.00 0.12 0.00 0.00 56.93 57.33 2xdw s PHE 348 Cb 0.21 -1.54 -0.01 0.00 -0.57 0.00 0.00 43.02 41.10 2xdw s PHE 348 CO -0.01 0.51 -0.24 -0.51 -0.10 0.00 0.00 175.22 174.87 2xdw s LEU 349 N -2.68 2.05 -0.26 -0.37 1.43 0.03 -1.20 118.68 117.68 2xdw s LEU 349 Ca 0.29 -0.48 -0.09 0.00 -1.03 0.00 0.00 54.13 52.82 2xdw s LEU 349 Cb -0.11 -1.30 -0.04 0.00 0.03 0.00 0.00 46.19 44.77 2xdw s LEU 349 CO 0.21 0.25 0.12 -0.69 0.23 0.00 0.00 176.35 176.47 2xdw s VAL 350 N -0.23 4.74 -0.13 -1.59 1.01 0.52 0.03 120.40 124.75 2xdw s VAL 350 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 2xdw s VAL 350 Cb -0.13 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.00 2xdw s VAL 350 CO 0.02 0.31 -0.12 -0.76 0.00 0.00 0.00 175.10 174.55 2xdw s LEU 351 N 1.61 2.77 -0.23 3.92 1.43 0.35 -1.41 118.68 127.13 2xdw s LEU 351 Ca 0.06 -0.31 -0.04 0.00 -1.03 0.00 0.00 54.13 52.82 2xdw s LEU 351 Cb -0.15 -1.63 -0.00 0.00 0.03 0.00 0.00 46.19 44.44 2xdw s LEU 351 CO 0.06 0.16 -0.04 0.00 0.23 0.00 0.00 176.35 176.77 2xdw s TYR 353 N 1.46 3.26 -0.25 0.00 2.02 -0.58 -0.56 117.35 122.70 2xdw s TYR 353 Ca 0.05 -0.03 -0.03 0.00 -0.37 0.00 0.00 57.07 56.68 2xdw s TYR 353 Cb -0.15 -1.51 0.01 0.00 -0.40 0.00 0.00 41.96 39.91 2xdw s TYR 353 CO -0.03 0.50 -0.03 -1.17 -1.57 0.00 0.00 175.55 173.25 2xdw s LEU 354 N -3.60 3.23 -0.28 -1.29 2.96 0.39 -1.38 118.68 118.71 2xdw s LEU 354 Ca 0.33 -0.68 -0.00 0.00 -0.22 0.00 0.00 54.13 53.55 2xdw s LEU 354 Cb -0.09 -1.73 0.05 0.00 0.50 0.00 0.00 46.19 44.92 2xdw s LEU 354 CO 0.26 -0.11 -0.05 -2.28 -1.32 0.00 0.00 176.35 172.85 2xdw s HIS 355 N 1.41 3.23 -1.52 5.38 5.65 0.28 -1.94 115.29 127.79 2xdw s HIS 355 Ca 0.03 -1.99 -0.02 0.00 0.25 0.00 0.00 55.06 53.33 2xdw s HIS 355 Cb -0.16 -2.04 0.02 0.00 -1.18 0.00 0.00 32.58 29.23 2xdw s HIS 355 CO -0.03 -0.82 0.23 -0.25 -0.65 0.00 0.00 174.74 173.22 2xdw n ASP 356 N 4.56 0.10 -0.74 9.88 8.00 -1.26 -1.67 116.55 135.42 2xdw n ASP 356 Ca -0.14 -1.16 -0.09 0.00 0.71 0.00 0.00 54.79 54.12 2xdw n ASP 356 Cb 0.43 -2.22 -0.03 0.00 -0.02 0.00 0.00 41.12 39.29 2xdw n ASP 356 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2xdw n VAL 357 N -4.48 -0.11 -4.51 2.53 0.31 -1.26 -5.01 118.33 105.80 2xdw n VAL 357 Ca -0.28 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 63.84 2xdw n VAL 357 Cb 0.67 -1.22 -0.14 0.00 -0.91 0.00 0.00 33.84 32.24 2xdw n VAL 357 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2xdw s LYS 358 N -3.18 1.04 0.30 5.55 1.02 -0.67 -4.46 119.74 119.35 2xdw s LYS 358 Ca 0.00 -0.61 -0.19 0.00 0.02 0.00 0.00 55.97 55.19 2xdw s LYS 358 Cb 0.00 -1.02 -0.09 0.00 -0.52 0.00 0.00 37.83 36.19 2xdw s LYS 358 CO 0.00 0.27 0.79 -0.80 -0.92 0.00 0.00 175.35 174.69 2xdw s ASN 359 N -0.67 6.98 0.19 2.83 0.02 -0.24 -0.55 114.94 123.49 2xdw s ASN 359 Ca 0.04 1.47 0.08 0.00 -1.02 0.00 0.00 52.86 53.43 2xdw s ASN 359 Cb -0.06 -2.44 -0.04 0.00 0.02 0.00 0.00 41.25 38.72 2xdw s ASN 359 CO 0.00 -0.12 -0.15 0.42 0.02 0.00 0.00 177.10 177.27 2xdw s THR 360 N -1.79 1.72 -0.04 1.60 -4.23 -0.48 -4.79 115.64 107.64 2xdw s THR 360 Ca 0.51 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.92 2xdw s THR 360 Cb -0.14 -1.95 0.03 0.00 1.34 0.00 0.00 72.50 71.78 2xdw s THR 360 CO 0.19 -0.51 0.00 -0.22 -0.54 0.00 0.00 174.62 173.54 2xdw s LEU 361 N -3.08 1.03 0.03 4.79 1.98 -1.26 -1.53 118.68 120.65 2xdw s LEU 361 Ca 0.20 -0.03 0.03 0.00 -2.89 0.00 0.00 54.13 51.44 2xdw s LEU 361 Cb -0.02 -0.25 -0.02 0.00 0.66 0.00 0.00 46.19 46.56 2xdw s LEU 361 CO 0.06 -0.12 -0.10 -1.10 -1.89 0.00 0.00 176.35 173.20 2xdw s GLN 362 N 1.21 0.70 -0.19 1.98 -0.21 -0.23 -1.11 119.66 121.81 2xdw s GLN 362 Ca -0.07 -0.63 -0.08 0.00 0.02 0.00 0.00 55.36 54.59 2xdw s GLN 362 Cb -0.13 -0.63 -0.04 0.00 1.00 0.00 0.00 33.01 33.20 2xdw s GLN 362 CO -0.02 0.15 0.08 -1.17 -2.12 0.00 0.00 175.29 172.21 2xdw s LEU 363 N -1.05 3.90 0.21 2.90 2.96 0.57 -0.49 118.68 127.67 2xdw s LEU 363 Ca -0.02 0.11 0.09 0.00 -0.22 0.00 0.00 54.13 54.09 2xdw s LEU 363 Cb -0.07 -2.00 -0.05 0.00 0.50 0.00 0.00 46.19 44.58 2xdw s LEU 363 CO 0.01 0.17 -0.18 -1.00 -1.32 0.00 0.00 176.35 174.02 2xdw s HIS 364 N 0.43 1.96 0.08 5.38 3.76 0.10 -0.18 115.29 126.82 2xdw s HIS 364 Ca 0.04 -0.45 -0.30 0.00 -0.15 0.00 0.00 55.06 54.20 2xdw s HIS 364 Cb -0.12 -0.91 -0.05 0.00 1.11 0.00 0.00 32.58 32.60 2xdw s HIS 364 CO -0.00 0.46 1.07 0.34 -0.85 0.00 0.00 174.74 175.76 2xdw s ASP 365 N -3.11 7.28 0.22 1.40 2.15 0.00 -0.79 116.67 123.82 2xdw s ASP 365 Ca 0.22 1.89 -0.07 0.00 0.43 0.00 0.00 52.55 55.02 2xdw s ASP 365 Cb -0.04 -2.58 0.17 0.00 -0.30 0.00 0.00 42.92 40.16 2xdw s ASP 365 CO 0.09 -0.28 1.77 0.25 -0.17 0.00 0.00 175.17 176.83 2xdw h LEU 366 N 6.20 1.09 -0.63 -1.34 5.85 -1.45 0.17 115.31 125.20 2xdw h LEU 366 Ca -0.42 -0.18 -0.14 0.00 0.84 0.00 0.00 57.88 57.97 2xdw h LEU 366 Cb 1.21 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 2xdw h LEU 366 CO 0.76 0.98 -0.47 0.00 -0.34 0.00 0.00 178.44 179.36 2xdw h ALA 367 N 1.17 0.81 0.00 1.25 0.00 -1.94 -3.34 119.26 117.21 2xdw h ALA 367 Ca 0.25 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2xdw h ALA 367 Cb 0.25 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2xdw h ALA 367 CO -0.02 0.66 -1.03 0.25 0.00 0.00 0.00 179.25 179.12 2xdw n THR 368 N -3.99 0.00 -0.98 0.00 -2.24 -1.24 -5.00 114.28 100.83 2xdw n THR 368 Ca -0.02 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2xdw n THR 368 Cb 0.55 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 2xdw n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2xdw n GLY 369 N 1.94 0.94 3.76 3.38 0.00 0.61 -4.86 105.19 110.95 2xdw n GLY 369 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 2xdw n GLY 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdw s ALA 370 N -3.75 3.07 0.11 4.61 0.00 -1.25 -4.59 121.76 119.96 2xdw s ALA 370 Ca 0.00 1.15 -0.31 0.00 0.00 0.00 0.00 51.96 52.80 2xdw s ALA 370 Cb 0.00 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.57 2xdw s ALA 370 CO 0.00 -0.88 1.45 -1.17 0.00 0.00 0.00 175.76 175.16 2xdw s LEU 371 N -2.86 4.36 -0.13 0.00 2.96 -1.26 -0.82 118.68 120.93 2xdw s LEU 371 Ca 0.62 2.37 0.04 0.00 -0.22 0.00 0.00 54.13 56.94 2xdw s LEU 371 Cb -0.35 -3.58 -0.11 0.00 0.50 0.00 0.00 46.19 42.64 2xdw s LEU 371 CO 0.44 -0.72 -0.07 0.18 -1.32 0.00 0.00 176.35 174.86 2xdw n LEU 372 N 4.29 1.93 -3.64 -0.68 4.77 0.74 -4.91 117.00 119.51 2xdw n LEU 372 Ca 0.13 -0.05 -0.11 0.00 -0.03 0.00 0.00 56.01 55.94 2xdw n LEU 372 Cb 0.42 -0.23 -0.07 0.00 -2.33 0.00 0.00 43.42 41.20 2xdw n LEU 372 CO 0.59 0.58 0.39 -0.75 -1.33 0.00 0.00 177.39 176.87 2xdw s LYS 373 N -2.29 0.78 -0.19 3.23 2.47 -0.94 -4.98 119.74 117.81 2xdw s LYS 373 Ca -0.15 1.08 -0.12 0.00 -1.56 0.00 0.00 55.97 55.22 2xdw s LYS 373 Cb 0.04 0.30 -0.05 0.00 -1.46 0.00 0.00 37.83 36.67 2xdw s LYS 373 CO 0.39 -0.12 0.23 0.42 0.16 0.00 0.00 175.35 176.43 2xdw s ILE 374 N 0.88 5.33 -0.40 5.43 1.01 -1.26 -0.32 121.20 131.87 2xdw s ILE 374 Ca -0.04 0.39 -0.20 0.00 0.00 0.00 0.00 60.65 60.80 2xdw s ILE 374 Cb -0.05 -3.57 0.01 0.00 0.01 0.00 0.00 42.46 38.86 2xdw s ILE 374 CO -0.07 0.38 0.63 -0.36 0.00 0.00 0.00 174.94 175.52 2xdw s PHE 375 N 0.64 3.10 0.35 3.97 0.08 -0.27 -4.99 117.98 120.86 2xdw s PHE 375 Ca 0.13 0.10 -0.26 0.00 0.12 0.00 0.00 56.93 57.01 2xdw s PHE 375 Cb -0.13 -3.25 -0.09 0.00 -0.57 0.00 0.00 43.02 38.98 2xdw s PHE 375 CO 0.03 -0.77 1.07 -1.25 -0.10 0.00 0.00 175.22 174.20 2xdw s PRO 376 N 2.76 4.37 0.04 0.24 0.04 -1.26 -4.22 135.00 136.97 2xdw s PRO 376 Ca 0.23 1.65 0.02 0.00 0.04 0.00 0.00 61.00 62.94 2xdw s PRO 376 Cb -0.14 -2.84 -0.02 0.00 0.04 0.00 0.00 34.50 31.54 2xdw s PRO 376 CO 0.17 0.01 -0.07 -0.51 0.04 0.00 0.00 177.00 176.64 2xdw s LEU 377 N -2.10 2.24 1.08 -3.56 1.43 -1.26 -5.07 118.68 111.44 2xdw s LEU 377 Ca 0.52 -0.52 -0.17 0.00 -1.03 0.00 0.00 54.13 52.93 2xdw s LEU 377 Cb -0.27 -0.14 0.24 0.00 0.03 0.00 0.00 46.19 46.04 2xdw s LEU 377 CO 0.34 -0.20 1.18 -1.61 0.23 0.00 0.00 176.35 176.29 2xdw s GLU 378 N -1.48 -0.27 -0.11 1.70 0.41 -1.26 -4.96 118.70 112.73 2xdw s GLU 378 Ca -0.10 -0.09 -0.29 0.00 -0.41 0.00 0.00 54.97 54.07 2xdw s GLU 378 Cb -0.10 -1.71 -0.04 0.00 -1.78 0.00 0.00 34.13 30.51 2xdw s GLU 378 CO 0.00 -3.07 1.49 0.14 -0.49 0.00 0.00 175.26 173.33 2xdw s VAL 379 N -3.31 3.88 -2.50 2.63 -7.23 -1.26 -4.80 120.40 107.82 2xdw s VAL 379 Ca 0.71 1.07 0.00 0.00 -1.81 0.00 0.00 61.98 61.94 2xdw s VAL 379 Cb -0.09 -3.70 0.00 0.00 0.56 0.00 0.00 36.38 33.15 2xdw s VAL 379 CO 0.55 -0.10 0.00 0.61 -0.31 0.00 0.00 175.10 175.84 2xdw n GLY 380 N 3.93 -0.60 3.12 2.32 0.00 -1.26 -4.74 105.19 107.96 2xdw n GLY 380 Ca 0.16 -0.53 -0.20 0.00 0.00 0.00 0.00 46.02 45.44 2xdw n GLY 380 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2xdw s SER 381 N -4.00 1.59 -0.29 1.61 0.01 -0.01 -1.08 113.70 111.53 2xdw s SER 381 Ca 0.00 -0.38 -0.20 0.00 1.31 0.00 0.00 55.95 56.69 2xdw s SER 381 Cb 0.00 -0.13 -0.01 0.00 0.21 0.00 0.00 66.02 66.09 2xdw s SER 381 CO 0.00 0.08 0.61 -0.69 0.41 0.00 0.00 173.24 173.64 2xdw s VAL 382 N -0.65 4.97 -0.52 3.43 1.01 -1.26 -0.95 120.40 126.43 2xdw s VAL 382 Ca 0.03 0.90 0.05 0.00 0.00 0.00 0.00 61.98 62.95 2xdw s VAL 382 Cb -0.07 -3.96 0.07 0.00 0.00 0.00 0.00 36.38 32.42 2xdw s VAL 382 CO 0.01 -0.07 0.79 1.33 0.00 0.00 0.00 175.10 177.16 2xdw n VAL 383 N 5.32 0.32 -3.53 2.92 0.24 0.39 -5.01 118.33 118.98 2xdw n VAL 383 Ca -0.02 -0.66 -0.17 0.00 -2.04 0.00 0.00 64.34 61.45 2xdw n VAL 383 Cb 0.49 0.91 -0.06 0.00 -1.47 0.00 0.00 33.84 33.71 2xdw n VAL 383 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2xdw s GLY 384 N -0.58 -0.56 -0.17 7.63 0.00 -1.21 -4.94 107.32 107.48 2xdw s GLY 384 Ca 0.07 1.22 -0.24 0.00 0.00 0.00 0.00 44.72 45.76 2xdw s GLY 384 CO 0.06 0.87 0.62 -0.47 0.00 0.00 0.00 173.10 174.18 2xdw s TYR 385 N -1.35 -0.65 0.03 1.90 5.04 -1.26 -0.90 117.35 120.16 2xdw s TYR 385 Ca -0.10 1.44 0.01 0.00 -2.44 0.00 0.00 57.07 55.97 2xdw s TYR 385 Cb -0.00 0.28 -0.02 0.00 0.35 0.00 0.00 41.96 42.56 2xdw s TYR 385 CO 0.08 -0.42 -0.05 -1.54 -1.34 0.00 0.00 175.55 172.28 2xdw s SER 386 N -0.22 0.53 0.00 4.32 1.04 0.07 -4.98 113.70 114.46 2xdw s SER 386 Ca -0.04 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 55.90 2xdw s SER 386 Cb -0.03 0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.15 2xdw s SER 386 CO 0.04 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.63 2xdw n GLY 387 N 1.64 0.87 4.00 7.32 0.00 -1.26 -1.93 105.19 115.81 2xdw n GLY 387 Ca -0.23 0.22 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 2xdw n GLY 387 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2xdw s GLN 388 N 0.00 2.16 0.26 1.61 -2.07 -1.26 -4.38 119.66 115.97 2xdw s GLN 388 Ca 0.00 -1.18 -0.03 0.00 -1.82 0.00 0.00 55.36 52.33 2xdw s GLN 388 Cb 0.00 -2.49 0.41 0.00 -1.09 0.00 0.00 33.01 29.83 2xdw s GLN 388 CO 0.00 -1.01 1.84 -0.22 -1.32 0.00 0.00 175.29 174.59 2xdw h LYS 389 N -0.09 0.95 -0.00 9.60 3.64 -1.74 -0.63 116.57 128.30 2xdw h LYS 389 Ca -0.36 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 2xdw h LYS 389 Cb 1.28 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 2xdw h LYS 389 CO 0.44 0.63 -0.13 1.63 -2.27 0.00 0.00 179.45 179.74 2xdw n LYS 390 N -4.62 0.25 -2.42 1.90 5.02 -1.26 -0.74 118.16 116.29 2xdw n LYS 390 Ca 0.15 -0.07 -0.29 0.00 -2.02 0.00 0.00 58.31 56.08 2xdw n LYS 390 Cb 0.24 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 33.75 2xdw n LYS 390 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2xdw s ASP 391 N -2.79 6.28 -0.08 4.39 1.01 -0.24 -4.87 116.67 120.36 2xdw s ASP 391 Ca 0.20 1.10 0.12 0.00 0.71 0.00 0.00 52.55 54.67 2xdw s ASP 391 Cb 0.19 -2.32 0.18 0.00 1.01 0.00 0.00 42.92 41.98 2xdw s ASP 391 CO 0.54 -0.65 1.09 0.35 0.21 0.00 0.00 175.17 176.71 2xdw n THR 392 N -2.32 1.52 -3.83 -1.27 -2.24 -1.26 -1.01 114.28 103.87 2xdw n THR 392 Ca 0.02 -1.76 -0.09 0.00 -2.27 0.00 0.00 64.05 59.95 2xdw n THR 392 Cb 0.55 0.04 -0.07 0.00 -2.10 0.00 0.00 70.33 68.74 2xdw n THR 392 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2xdw s GLU 393 N -2.15 0.85 0.10 -0.78 -1.05 -1.26 -0.81 118.70 113.60 2xdw s GLU 393 Ca 0.20 -0.89 0.10 0.00 -0.15 0.00 0.00 54.97 54.23 2xdw s GLU 393 Cb 0.18 0.35 -0.04 0.00 -0.44 0.00 0.00 34.13 34.18 2xdw s GLU 393 CO 0.02 -0.28 -0.24 0.96 0.95 0.00 0.00 175.26 176.67 2xdw s ILE 394 N -3.69 2.01 0.10 1.83 -4.36 -0.45 -4.42 121.20 112.21 2xdw s ILE 394 Ca 0.03 -1.58 0.10 0.00 -0.26 0.00 0.00 60.65 58.94 2xdw s ILE 394 Cb 0.04 -1.78 -0.04 0.00 1.25 0.00 0.00 42.46 41.93 2xdw s ILE 394 CO -0.10 0.09 -0.25 -0.36 0.24 0.00 0.00 174.94 174.55 2xdw s PHE 395 N -1.03 2.19 -0.06 1.37 0.40 -0.82 -1.00 117.98 119.03 2xdw s PHE 395 Ca 0.11 -0.39 -0.14 0.00 -0.60 0.00 0.00 56.93 55.90 2xdw s PHE 395 Cb -0.10 -1.23 0.03 0.00 0.51 0.00 0.00 43.02 42.23 2xdw s PHE 395 CO 0.04 0.24 0.34 1.52 0.70 0.00 0.00 175.22 178.06 2xdw s TYR 396 N -0.99 -0.27 -0.15 0.36 1.13 -0.65 -0.75 117.35 116.04 2xdw s TYR 396 Ca 0.12 0.53 -0.01 0.00 -1.41 0.00 0.00 57.07 56.29 2xdw s TYR 396 Cb -0.10 0.12 -0.02 0.00 -1.10 0.00 0.00 41.96 40.86 2xdw s TYR 396 CO 0.04 -0.33 -0.10 -1.14 -2.51 0.00 0.00 175.55 171.52 2xdw s GLN 397 N -0.81 3.46 -0.05 -3.49 0.74 -0.08 -0.66 119.66 118.78 2xdw s GLN 397 Ca -0.09 -0.63 0.01 0.00 0.05 0.00 0.00 55.36 54.70 2xdw s GLN 397 Cb -0.04 -2.75 -0.03 0.00 1.10 0.00 0.00 33.01 31.29 2xdw s GLN 397 CO 0.03 0.18 -0.07 0.12 -0.55 0.00 0.00 175.29 175.00 2xdw s PHE 398 N 0.47 2.93 0.14 1.67 5.36 0.14 -0.46 117.98 128.23 2xdw s PHE 398 Ca -0.07 0.01 -0.01 0.00 -0.96 0.00 0.00 56.93 55.90 2xdw s PHE 398 Cb -0.15 -1.69 -0.04 0.00 -0.34 0.00 0.00 43.02 40.80 2xdw s PHE 398 CO 0.04 0.34 0.06 -0.08 -1.46 0.00 0.00 175.22 174.12 2xdw s THR 399 N -0.86 0.17 0.33 0.12 -1.32 -0.12 -1.42 115.64 112.53 2xdw s THR 399 Ca 0.14 -1.93 -0.07 0.00 -1.21 0.00 0.00 61.69 58.62 2xdw s THR 399 Cb -0.11 -2.10 0.03 0.00 -1.51 0.00 0.00 72.50 68.81 2xdw s THR 399 CO 0.03 -0.42 0.56 -1.54 -2.21 0.00 0.00 174.62 171.04 2xdw n SER 400 N -0.13 -1.59 0.24 8.08 3.41 -1.16 -0.83 113.62 121.63 2xdw n SER 400 Ca -0.05 -2.54 0.08 0.00 -0.26 0.00 0.00 58.87 56.11 2xdw n SER 400 Cb 0.64 2.78 0.59 0.00 -0.26 0.00 0.00 64.21 67.95 2xdw n SER 400 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 2xdw h PHE 401 N 1.88 0.00 -0.00 7.33 0.04 -1.85 -2.42 116.94 121.91 2xdw h PHE 401 Ca -0.27 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.50 2xdw h PHE 401 Cb 1.06 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.21 2xdw h PHE 401 CO 0.00 0.18 -0.25 1.28 -0.60 0.00 0.00 178.31 178.92 2xdw n LEU 402 N -3.96 0.52 -3.99 1.54 4.77 -1.26 -4.49 117.00 110.14 2xdw n LEU 402 Ca -0.02 -0.58 -0.19 0.00 -0.03 0.00 0.00 56.01 55.19 2xdw n LEU 402 Cb 0.27 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.21 2xdw n LEU 402 CO 0.34 0.12 -0.43 -0.55 -1.33 0.00 0.00 177.39 175.54 2xdw s SER 403 N -1.45 1.01 0.58 -1.43 0.15 -1.24 -4.71 113.70 106.62 2xdw s SER 403 Ca 0.03 -0.15 0.29 0.00 0.70 0.00 0.00 55.95 56.82 2xdw s SER 403 Cb 0.05 -0.21 1.75 0.00 -1.71 0.00 0.00 66.02 65.91 2xdw s SER 403 CO 0.24 0.07 2.23 -0.65 1.20 0.00 0.00 173.24 176.33 2xdw h PRO 404 N 6.21 0.00 0.00 5.44 0.11 -1.85 -3.07 132.00 138.85 2xdw h PRO 404 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2xdw h PRO 404 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2xdw h PRO 404 CO 0.49 0.02 0.00 0.41 -0.21 0.00 0.00 178.00 178.71 2xdw n GLY 405 N -1.25 -0.74 2.87 -0.55 0.00 -1.26 -4.75 105.19 99.51 2xdw n GLY 405 Ca -0.03 -2.22 -0.14 0.00 0.00 0.00 0.00 46.02 43.63 2xdw n GLY 405 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2xdw s ILE 406 N -0.31 -0.04 -0.25 -0.61 1.01 -0.51 -3.66 121.20 116.83 2xdw s ILE 406 Ca 0.00 0.15 -0.13 0.00 0.00 0.00 0.00 60.65 60.67 2xdw s ILE 406 Cb 0.00 -0.15 -0.04 0.00 0.01 0.00 0.00 42.46 42.28 2xdw s ILE 406 CO 0.00 0.06 0.27 -0.63 0.00 0.00 0.00 174.94 174.64 2xdw s ILE 407 N 0.87 5.27 0.11 2.92 1.01 0.09 -0.68 121.20 130.78 2xdw s ILE 407 Ca -0.07 0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.98 2xdw s ILE 407 Cb -0.09 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 2xdw s ILE 407 CO -0.03 0.26 0.25 -0.31 0.00 0.00 0.00 174.94 175.10 2xdw s TYR 408 N 1.53 3.50 0.01 3.97 2.02 0.17 0.10 117.35 128.65 2xdw s TYR 408 Ca 0.12 0.18 0.04 0.00 -0.37 0.00 0.00 57.07 57.04 2xdw s TYR 408 Cb -0.15 -1.71 -0.01 0.00 -0.40 0.00 0.00 41.96 39.69 2xdw s TYR 408 CO 0.08 0.55 -0.12 -1.58 -1.57 0.00 0.00 175.55 172.91 2xdw s HIS 409 N -1.63 1.02 -0.05 2.71 5.65 0.15 -1.63 115.29 121.51 2xdw s HIS 409 Ca 0.35 -0.26 -0.02 0.00 0.25 0.00 0.00 55.06 55.38 2xdw s HIS 409 Cb -0.12 -0.64 0.03 0.00 -1.18 0.00 0.00 32.58 30.68 2xdw s HIS 409 CO 0.28 -0.00 0.09 0.00 -0.65 0.00 0.00 174.74 174.46 2xdw s ASP 411 N 1.98 6.60 0.00 0.00 -1.08 -1.26 -1.35 116.67 121.56 2xdw s ASP 411 Ca 0.02 0.38 0.16 0.00 -0.52 0.00 0.00 52.55 52.58 2xdw s ASP 411 Cb -0.12 -2.53 0.62 0.00 -1.46 0.00 0.00 42.92 39.43 2xdw s ASP 411 CO -0.04 -1.23 1.44 0.18 0.52 0.00 0.00 175.17 176.04 2xdw n LEU 412 N 7.76 1.23 -0.03 -1.34 4.77 0.00 -3.23 117.00 126.17 2xdw n LEU 412 Ca 0.11 -0.55 0.14 0.00 -0.03 0.00 0.00 56.01 55.67 2xdw n LEU 412 Cb 0.49 -0.11 0.54 0.00 -2.33 0.00 0.00 43.42 42.01 2xdw n LEU 412 CO 0.71 0.28 0.82 0.35 -1.33 0.00 0.00 177.39 178.21 2xdw n THR 413 N 0.08 0.00 -3.21 -5.08 -2.24 -1.23 -4.89 114.28 97.72 2xdw n THR 413 Ca 0.13 -0.01 -0.35 0.00 -2.27 0.00 0.00 64.05 61.55 2xdw n THR 413 Cb 0.24 -0.23 -0.06 0.00 -2.10 0.00 0.00 70.33 68.18 2xdw n THR 413 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2xdw s LYS 414 N -2.85 4.09 0.16 -0.78 -0.14 -1.20 -4.98 119.74 114.05 2xdw s LYS 414 Ca 0.18 0.67 -0.10 0.00 -1.36 0.00 0.00 55.97 55.36 2xdw s LYS 414 Cb 0.19 -2.80 0.03 0.00 -1.68 0.00 0.00 37.83 33.57 2xdw s LYS 414 CO 0.55 0.37 1.59 0.93 -0.76 0.00 0.00 175.35 178.04 2xdw h GLU 415 N 3.18 0.99 -4.80 1.68 4.39 -1.91 -3.38 114.58 114.73 2xdw h GLU 415 Ca -0.48 -0.35 -0.68 0.00 0.34 0.00 0.00 59.36 58.19 2xdw h GLU 415 Cb 1.19 -0.07 -0.29 0.00 -0.10 0.00 0.00 28.75 29.48 2xdw h GLU 415 CO 0.66 1.03 -0.66 -1.21 -1.16 0.00 0.00 179.01 177.66 2xdw s GLU 416 N -4.90 2.82 0.06 2.33 0.41 -1.26 -5.08 118.70 113.09 2xdw s GLU 416 Ca -0.12 -1.02 -0.30 0.00 -0.41 0.00 0.00 54.97 53.12 2xdw s GLU 416 Cb 0.12 -3.26 -0.05 0.00 -1.78 0.00 0.00 34.13 29.17 2xdw s GLU 416 CO 0.85 -0.51 1.00 -0.51 -0.49 0.00 0.00 175.26 175.60 2xdw s LEU 417 N 1.39 4.43 -0.35 1.80 1.43 -1.26 -5.01 118.68 121.11 2xdw s LEU 417 Ca -0.00 1.77 0.00 0.00 -1.03 0.00 0.00 54.13 54.87 2xdw s LEU 417 Cb -0.18 -3.58 0.14 0.00 0.03 0.00 0.00 46.19 42.60 2xdw s LEU 417 CO 0.00 -0.19 0.24 -1.61 0.23 0.00 0.00 176.35 175.02 2xdw s GLU 418 N 0.49 0.52 0.35 1.70 2.02 -1.26 -5.12 118.70 117.41 2xdw s GLU 418 Ca 0.50 -1.11 -0.28 0.00 0.02 0.00 0.00 54.97 54.10 2xdw s GLU 418 Cb -0.23 -1.14 -0.10 0.00 0.10 0.00 0.00 34.13 32.76 2xdw s GLU 418 CO 0.29 -1.18 1.32 -1.25 0.02 0.00 0.00 175.26 174.46 2xdw s PRO 419 N 1.29 4.24 0.04 0.39 0.04 -1.26 -4.72 135.00 135.02 2xdw s PRO 419 Ca 0.17 2.22 0.03 0.00 0.04 0.00 0.00 61.00 63.46 2xdw s PRO 419 Cb -0.20 -2.99 -0.02 0.00 0.04 0.00 0.00 34.50 31.33 2xdw s PRO 419 CO -0.04 -0.28 -0.09 1.03 0.04 0.00 0.00 177.00 177.65 2xdw s ARG 420 N -1.93 0.61 0.10 4.56 0.52 0.02 -4.95 118.95 117.89 2xdw s ARG 420 Ca 0.51 -0.73 -0.31 0.00 -0.52 0.00 0.00 55.73 54.68 2xdw s ARG 420 Cb -0.40 -0.48 -0.09 0.00 0.52 0.00 0.00 34.95 34.51 2xdw s ARG 420 CO 0.53 0.10 1.67 0.08 0.02 0.00 0.00 175.30 177.70 2xdw s VAL 421 N -1.15 2.82 -0.21 3.52 1.01 -1.26 -0.67 120.40 124.45 2xdw s VAL 421 Ca -0.06 0.38 -0.02 0.00 0.00 0.00 0.00 61.98 62.27 2xdw s VAL 421 Cb -0.09 -3.24 -0.12 0.00 0.00 0.00 0.00 36.38 32.93 2xdw s VAL 421 CO 0.01 0.01 -0.22 0.33 0.00 0.00 0.00 175.10 175.23 2xdw n PHE 422 N 5.24 0.00 -3.83 5.22 7.35 0.11 -4.85 117.46 126.70 2xdw n PHE 422 Ca 0.16 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.72 2xdw n PHE 422 Cb 0.39 -0.80 -0.13 0.00 0.35 0.00 0.00 39.48 39.30 2xdw n PHE 422 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2xdw s ARG 423 N -2.41 0.14 -0.13 -4.13 0.52 -0.72 -4.99 118.95 107.23 2xdw s ARG 423 Ca -0.29 0.16 -0.06 0.00 -0.52 0.00 0.00 55.73 55.02 2xdw s ARG 423 Cb 0.09 0.07 0.05 0.00 0.52 0.00 0.00 34.95 35.68 2xdw s ARG 423 CO 0.45 -0.02 0.29 -2.00 0.02 0.00 0.00 175.30 174.05 2xdw s GLU 424 N 0.05 0.25 0.04 3.54 2.12 -1.26 -0.73 118.70 122.71 2xdw s GLU 424 Ca -0.00 0.63 0.08 0.00 0.36 0.00 0.00 54.97 56.03 2xdw s GLU 424 Cb -0.01 -0.08 -0.03 0.00 0.26 0.00 0.00 34.13 34.28 2xdw s GLU 424 CO 0.00 -0.18 -0.23 0.14 -0.54 0.00 0.00 175.26 174.46 2xdw s VAL 425 N 1.43 1.84 0.04 3.70 -7.23 -1.24 -5.08 120.40 113.86 2xdw s VAL 425 Ca -0.08 -1.25 0.09 0.00 -1.81 0.00 0.00 61.98 58.92 2xdw s VAL 425 Cb -0.10 -1.58 -0.03 0.00 0.56 0.00 0.00 36.38 35.23 2xdw s VAL 425 CO -0.10 0.28 -0.25 -0.89 -0.31 0.00 0.00 175.10 173.83 2xdw s THR 426 N -0.78 2.24 -0.34 5.32 2.01 -1.26 -4.39 115.64 118.44 2xdw s THR 426 Ca 0.09 -1.34 -0.15 0.00 0.31 0.00 0.00 61.69 60.60 2xdw s THR 426 Cb -0.09 -1.88 -0.02 0.00 0.01 0.00 0.00 72.50 70.53 2xdw s THR 426 CO 0.02 0.38 0.34 -0.69 -0.69 0.00 0.00 174.62 173.98 2xdw s VAL 427 N -0.81 5.19 0.02 3.82 1.01 -1.26 -5.00 120.40 123.36 2xdw s VAL 427 Ca 0.12 0.04 -0.23 0.00 0.00 0.00 0.00 61.98 61.91 2xdw s VAL 427 Cb -0.10 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 2xdw s VAL 427 CO 0.02 -0.06 0.70 -0.54 0.00 0.00 0.00 175.10 175.23 2xdw s LYS 428 N 1.97 4.43 0.00 2.72 1.02 -1.26 -3.36 119.74 125.26 2xdw s LYS 428 Ca 0.11 0.93 0.00 0.00 0.02 0.00 0.00 55.97 57.03 2xdw s LYS 428 Cb -0.17 -3.36 0.00 0.00 -0.52 0.00 0.00 37.83 33.78 2xdw s LYS 428 CO 0.11 0.29 0.00 0.41 -0.92 0.00 0.00 175.35 175.24 2xdw n GLY 429 N 2.48 0.62 3.09 -3.33 0.00 -1.26 -4.90 105.19 101.89 2xdw n GLY 429 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 2xdw n GLY 429 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2xdw s ILE 430 N -1.15 2.14 -0.58 -0.61 -1.09 -1.22 -5.08 121.20 113.63 2xdw s ILE 430 Ca 0.00 -1.41 -0.22 0.00 -2.23 0.00 0.00 60.65 56.80 2xdw s ILE 430 Cb 0.00 -2.15 0.06 0.00 -1.58 0.00 0.00 42.46 38.80 2xdw s ILE 430 CO 0.00 0.16 0.83 -0.62 -1.23 0.00 0.00 174.94 174.07 2xdw s ASP 431 N 1.16 6.24 0.42 3.58 -1.08 -1.26 -4.78 116.67 120.95 2xdw s ASP 431 Ca -0.04 -0.84 0.13 0.00 -0.52 0.00 0.00 52.55 51.27 2xdw s ASP 431 Cb -0.18 -2.37 0.99 0.00 -1.46 0.00 0.00 42.92 39.90 2xdw s ASP 431 CO -0.08 -1.18 1.96 0.00 0.52 0.00 0.00 175.17 176.39 2xdw h ALA 432 N 9.28 1.99 0.00 3.66 0.00 -1.93 -0.76 119.26 131.50 2xdw h ALA 432 Ca -0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2xdw h ALA 432 Cb 1.08 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2xdw h ALA 432 CO 1.08 -0.14 0.00 -1.13 0.00 0.00 0.00 179.25 179.06 2xdw n SER 433 N -4.48 0.58 0.05 0.00 3.41 -1.26 -1.76 113.62 110.16 2xdw n SER 433 Ca 0.11 0.71 0.12 0.00 -0.26 0.00 0.00 58.87 59.55 2xdw n SER 433 Cb 0.39 -0.81 0.47 0.00 -0.26 0.00 0.00 64.21 64.01 2xdw n SER 433 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2xdw n ASP 434 N -2.21 0.33 -4.42 4.04 8.00 -0.29 -4.90 116.55 117.10 2xdw n ASP 434 Ca 0.00 0.55 -0.21 0.00 0.71 0.00 0.00 54.79 55.84 2xdw n ASP 434 Cb 0.12 -0.63 -0.10 0.00 -0.02 0.00 0.00 41.12 40.48 2xdw n ASP 434 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2xdw s TYR 435 N -3.08 1.95 0.04 1.24 2.02 -0.72 -1.26 117.35 117.54 2xdw s TYR 435 Ca 0.10 -0.61 0.02 0.00 -0.37 0.00 0.00 57.07 56.20 2xdw s TYR 435 Cb 0.13 -1.03 -0.03 0.00 -0.40 0.00 0.00 41.96 40.64 2xdw s TYR 435 CO 0.47 0.37 -0.07 1.14 -1.57 0.00 0.00 175.55 175.89 2xdw s GLN 436 N -3.67 0.53 -0.17 -0.62 -2.07 -0.30 -4.78 119.66 108.57 2xdw s GLN 436 Ca 0.28 -0.81 -0.03 0.00 -1.82 0.00 0.00 55.36 52.98 2xdw s GLN 436 Cb 0.01 -0.20 -0.02 0.00 -1.09 0.00 0.00 33.01 31.71 2xdw s GLN 436 CO 0.11 0.02 -0.07 0.99 -1.32 0.00 0.00 175.29 175.03 2xdw s THR 437 N -1.70 3.50 0.11 3.63 2.01 -1.26 -1.96 115.64 119.97 2xdw s THR 437 Ca -0.08 -0.49 0.11 0.00 0.31 0.00 0.00 61.69 61.54 2xdw s THR 437 Cb -0.08 -2.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.86 2xdw s THR 437 CO -0.01 0.48 -0.27 0.68 -0.69 0.00 0.00 174.62 174.82 2xdw s VAL 438 N 0.69 2.21 -0.13 3.82 -7.23 -0.12 -4.98 120.40 114.67 2xdw s VAL 438 Ca -0.03 -1.67 0.01 0.00 -1.81 0.00 0.00 61.98 58.47 2xdw s VAL 438 Cb -0.15 -1.95 -0.01 0.00 0.56 0.00 0.00 36.38 34.84 2xdw s VAL 438 CO 0.02 0.14 -0.16 -1.58 -0.31 0.00 0.00 175.10 173.21 2xdw s GLN 439 N -1.88 3.28 0.32 4.82 0.74 -1.26 -0.85 119.66 124.83 2xdw s GLN 439 Ca 0.13 -0.74 0.07 0.00 0.05 0.00 0.00 55.36 54.87 2xdw s GLN 439 Cb -0.10 -2.55 -0.06 0.00 1.10 0.00 0.00 33.01 31.40 2xdw s GLN 439 CO 0.05 0.18 -0.04 0.96 -0.55 0.00 0.00 175.29 175.90 2xdw s ILE 440 N 0.40 1.74 -0.14 -2.34 -5.25 -0.23 -4.98 121.20 110.40 2xdw s ILE 440 Ca -0.12 -2.10 0.00 0.00 -0.99 0.00 0.00 60.65 57.44 2xdw s ILE 440 Cb -0.16 -2.63 0.02 0.00 2.95 0.00 0.00 42.46 42.64 2xdw s ILE 440 CO 0.06 -0.19 -0.11 -0.36 -1.79 0.00 0.00 174.94 172.55 2xdw s PHE 441 N -2.94 1.92 0.08 1.37 0.40 -1.26 -0.91 117.98 116.64 2xdw s PHE 441 Ca 0.32 -1.06 0.07 0.00 -0.60 0.00 0.00 56.93 55.67 2xdw s PHE 441 Cb 0.05 -1.46 -0.04 0.00 0.51 0.00 0.00 43.02 42.09 2xdw s PHE 441 CO 0.14 -0.62 -0.15 1.52 0.70 0.00 0.00 175.22 176.82 2xdw s TYR 442 N 1.57 2.63 0.09 0.36 -0.85 -0.29 -4.82 117.35 116.05 2xdw s TYR 442 Ca 0.05 -0.21 -0.28 0.00 -0.52 0.00 0.00 57.07 56.11 2xdw s TYR 442 Cb -0.13 -1.43 -0.06 0.00 0.38 0.00 0.00 41.96 40.72 2xdw s TYR 442 CO -0.10 0.35 0.87 -1.25 -1.52 0.00 0.00 175.55 173.90 2xdw s PRO 443 N -1.85 4.61 0.69 -3.49 0.04 -1.26 -0.55 135.00 133.19 2xdw s PRO 443 Ca 0.18 1.28 -0.10 0.00 0.04 0.00 0.00 61.00 62.39 2xdw s PRO 443 Cb -0.11 -3.36 0.16 0.00 0.04 0.00 0.00 34.50 31.23 2xdw s PRO 443 CO 0.09 0.28 0.93 0.45 0.04 0.00 0.00 177.00 178.79 2xdw n SER 444 N 2.66 0.21 -0.32 6.66 2.88 0.40 -4.89 113.62 121.23 2xdw n SER 444 Ca -0.00 -1.42 0.05 0.00 -1.33 0.00 0.00 58.87 56.16 2xdw n SER 444 Cb 0.49 -0.70 0.20 0.00 -0.75 0.00 0.00 64.21 63.45 2xdw n SER 444 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2xdw h LYS 445 N 0.00 0.83 -0.17 -1.46 3.64 -1.89 -0.68 116.57 116.84 2xdw h LYS 445 Ca -0.30 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 2xdw h LYS 445 Cb 0.87 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 2xdw h LYS 445 CO 0.23 0.55 0.00 -0.40 -2.27 0.00 0.00 179.45 177.56 2xdw n ASP 446 N -4.71 1.34 0.00 4.20 5.68 -1.26 -4.91 116.55 116.89 2xdw n ASP 446 Ca 0.16 -1.75 0.00 0.00 -0.50 0.00 0.00 54.79 52.70 2xdw n ASP 446 Cb 0.32 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 2xdw n ASP 446 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2xdw n GLY 447 N 1.02 1.09 3.74 6.12 0.00 -0.26 -5.04 105.19 111.85 2xdw n GLY 447 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2xdw n GLY 447 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2xdw s THR 448 N -2.35 2.60 -0.19 2.61 2.01 -1.26 -4.51 115.64 114.56 2xdw s THR 448 Ca 0.00 0.49 -0.26 0.00 0.31 0.00 0.00 61.69 62.23 2xdw s THR 448 Cb 0.00 -3.31 -0.01 0.00 0.01 0.00 0.00 72.50 69.19 2xdw s THR 448 CO 0.00 0.07 0.87 -0.54 -0.69 0.00 0.00 174.62 174.33 2xdw s LYS 449 N -0.08 4.27 -0.15 4.92 -0.14 -1.26 -0.45 119.74 126.85 2xdw s LYS 449 Ca 0.62 1.07 -0.04 0.00 -1.36 0.00 0.00 55.97 56.26 2xdw s LYS 449 Cb -0.43 -3.60 -0.03 0.00 -1.68 0.00 0.00 37.83 32.10 2xdw s LYS 449 CO 0.41 -0.42 -0.03 0.42 -0.76 0.00 0.00 175.35 174.98 2xdw s ILE 450 N 2.45 3.99 0.46 2.17 -1.09 0.28 -4.87 121.20 124.60 2xdw s ILE 450 Ca 0.39 -0.33 -0.23 0.00 -2.23 0.00 0.00 60.65 58.26 2xdw s ILE 450 Cb -0.16 -2.75 -0.08 0.00 -1.58 0.00 0.00 42.46 37.90 2xdw s ILE 450 CO 0.11 0.50 1.13 -2.84 -1.23 0.00 0.00 174.94 172.61 2xdw s PRO 451 N 0.25 3.79 -0.07 2.79 0.02 -1.26 -1.14 135.00 139.38 2xdw s PRO 451 Ca -0.02 1.69 -0.03 0.00 0.02 0.00 0.00 61.00 62.66 2xdw s PRO 451 Cb -0.14 -2.37 0.04 0.00 0.02 0.00 0.00 34.50 32.05 2xdw s PRO 451 CO 0.03 -0.50 0.17 1.41 -0.33 0.00 0.00 177.00 177.77 2xdw s MET 452 N -2.75 0.12 0.08 5.54 1.75 -0.08 -0.65 119.30 123.31 2xdw s MET 452 Ca 0.64 0.41 -0.19 0.00 -1.25 0.00 0.00 55.69 55.30 2xdw s MET 452 Cb -0.26 -0.17 -0.07 0.00 2.84 0.00 0.00 34.83 37.17 2xdw s MET 452 CO 0.32 -0.17 0.57 -0.06 -0.65 0.00 0.00 175.02 175.03 2xdw s PHE 453 N 1.21 3.79 -0.07 4.11 0.08 -0.39 -1.07 117.98 125.64 2xdw s PHE 453 Ca -0.09 1.26 0.02 0.00 0.12 0.00 0.00 56.93 58.23 2xdw s PHE 453 Cb -0.11 -2.49 0.01 0.00 -0.57 0.00 0.00 43.02 39.86 2xdw s PHE 453 CO -0.07 0.57 -0.11 0.42 -0.10 0.00 0.00 175.22 175.93 2xdw s ILE 454 N -1.15 1.08 -0.13 0.64 1.01 -0.03 -1.05 121.20 121.56 2xdw s ILE 454 Ca 0.30 -0.43 0.02 0.00 0.00 0.00 0.00 60.65 60.54 2xdw s ILE 454 Cb -0.19 -1.00 0.00 0.00 0.01 0.00 0.00 42.46 41.28 2xdw s ILE 454 CO 0.19 0.34 -0.21 -0.69 0.00 0.00 0.00 174.94 174.57 2xdw s VAL 455 N 0.76 2.23 0.19 2.92 1.01 0.37 -0.94 120.40 126.94 2xdw s VAL 455 Ca -0.13 -0.94 -0.18 0.00 0.00 0.00 0.00 61.98 60.73 2xdw s VAL 455 Cb -0.15 -1.89 0.03 0.00 0.00 0.00 0.00 36.38 34.37 2xdw s VAL 455 CO 0.03 0.55 0.53 -1.38 0.00 0.00 0.00 175.10 174.82 2xdw s HIS 456 N 0.60 -0.16 0.27 5.22 -3.43 -0.83 -1.24 115.29 115.73 2xdw s HIS 456 Ca -0.12 -0.17 -0.30 0.00 -0.80 0.00 0.00 55.06 53.67 2xdw s HIS 456 Cb -0.16 0.40 -0.11 0.00 -1.43 0.00 0.00 32.58 31.28 2xdw s HIS 456 CO 0.03 -0.90 1.52 0.21 -2.00 0.00 0.00 174.74 173.60 2xdw s LYS 457 N -3.86 4.19 0.38 -0.38 2.20 -1.26 -1.15 119.74 119.86 2xdw s LYS 457 Ca 0.08 2.45 -0.28 0.00 -0.36 0.00 0.00 55.97 57.86 2xdw s LYS 457 Cb -0.01 -3.06 -0.11 0.00 -1.51 0.00 0.00 37.83 33.14 2xdw s LYS 457 CO -0.04 -0.53 1.49 0.15 -0.36 0.00 0.00 175.35 176.06 2xdw s LYS 458 N -0.48 4.08 0.00 4.03 1.02 -0.39 -3.34 119.74 124.66 2xdw s LYS 458 Ca 0.61 2.58 0.00 0.00 0.02 0.00 0.00 55.97 59.18 2xdw s LYS 458 Cb -0.45 -2.95 0.00 0.00 -0.52 0.00 0.00 37.83 33.91 2xdw s LYS 458 CO 0.46 -0.56 0.00 0.41 -0.92 0.00 0.00 175.35 174.74 2xdw n GLY 459 N 0.45 0.75 3.74 -3.33 0.00 -1.26 -5.02 105.19 100.53 2xdw n GLY 459 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 2xdw n GLY 459 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2xdw s ILE 460 N -2.80 2.40 -0.02 -0.61 -4.36 -1.21 -4.99 121.20 109.61 2xdw s ILE 460 Ca 0.00 0.24 -0.24 0.00 -0.26 0.00 0.00 60.65 60.40 2xdw s ILE 460 Cb 0.00 -3.07 -0.04 0.00 1.25 0.00 0.00 42.46 40.59 2xdw s ILE 460 CO 0.00 -0.06 0.71 -0.54 0.24 0.00 0.00 174.94 175.30 2xdw s LYS 461 N -3.39 4.44 -1.45 0.37 1.02 -1.26 -4.97 119.74 114.50 2xdw s LYS 461 Ca 0.79 0.93 -0.11 0.00 0.02 0.00 0.00 55.97 57.60 2xdw s LYS 461 Cb -0.33 -3.41 0.04 0.00 -0.52 0.00 0.00 37.83 33.61 2xdw s LYS 461 CO 0.36 0.17 2.37 1.28 -0.92 0.00 0.00 175.35 178.61 2xdw n LEU 462 N 3.35 7.45 -0.73 3.17 4.77 -1.26 -4.55 117.00 129.21 2xdw n LEU 462 Ca -0.02 -4.38 0.07 0.00 -0.03 0.00 0.00 56.01 51.64 2xdw n LEU 462 Cb 0.51 -1.57 0.19 0.00 -2.33 0.00 0.00 43.42 40.22 2xdw n LEU 462 CO 0.47 1.52 0.66 -0.90 -1.33 0.00 0.00 177.39 177.80 2xdw n ASP 463 N 4.52 3.27 0.00 -1.43 5.68 -1.00 -4.48 116.55 123.12 2xdw n ASP 463 Ca 0.58 -2.37 0.00 0.00 -0.50 0.00 0.00 54.79 52.49 2xdw n ASP 463 Cb 0.33 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 2xdw n ASP 463 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2xdw n GLY 464 N 0.13 0.74 0.49 6.12 0.00 0.51 -4.91 105.19 108.27 2xdw n GLY 464 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.31 2xdw n GLY 464 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2xdw n SER 465 N -0.03 1.56 -4.81 1.61 3.41 -1.26 -3.09 113.62 111.01 2xdw n SER 465 Ca 0.00 -1.49 -0.36 0.00 -0.26 0.00 0.00 58.87 56.76 2xdw n SER 465 Cb 0.01 0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 63.90 2xdw n SER 465 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2xdw s HIS 466 N -2.04 3.48 0.48 7.33 3.76 -1.24 -5.01 115.29 122.05 2xdw s HIS 466 Ca 0.36 0.41 -0.23 0.00 -0.15 0.00 0.00 55.06 55.45 2xdw s HIS 466 Cb 0.21 -1.97 -0.07 0.00 1.11 0.00 0.00 32.58 31.87 2xdw s HIS 466 CO 0.35 0.58 1.27 -2.14 -0.85 0.00 0.00 174.74 173.95 2xdw s PRO 467 N -0.67 3.55 0.08 8.40 0.02 -1.26 -4.31 135.00 140.81 2xdw s PRO 467 Ca 0.13 2.04 0.05 0.00 0.02 0.00 0.00 61.00 63.24 2xdw s PRO 467 Cb -0.12 -2.42 -0.03 0.00 0.02 0.00 0.00 34.50 31.96 2xdw s PRO 467 CO 0.02 -0.80 -0.14 0.00 -0.33 0.00 0.00 177.00 175.76 2xdw s ALA 468 N -1.39 1.23 -0.26 -1.55 0.00 -0.76 -0.73 121.76 118.29 2xdw s ALA 468 Ca 0.65 -1.06 0.01 0.00 0.00 0.00 0.00 51.96 51.56 2xdw s ALA 468 Cb -0.35 -0.09 0.07 0.00 0.00 0.00 0.00 23.12 22.76 2xdw s ALA 468 CO 0.43 0.14 -0.01 0.12 0.00 0.00 0.00 175.76 176.44 2xdw s PHE 469 N -1.50 2.44 -0.25 0.00 2.19 0.32 -0.99 117.98 120.19 2xdw s PHE 469 Ca 0.00 -1.92 -0.06 0.00 0.33 0.00 0.00 56.93 55.28 2xdw s PHE 469 Cb -0.09 -1.79 -0.02 0.00 -1.31 0.00 0.00 43.02 39.81 2xdw s PHE 469 CO 0.02 -0.81 0.04 -1.17 1.83 0.00 0.00 175.22 175.13 2xdw s LEU 470 N 1.37 3.36 -0.06 6.12 2.96 -0.10 -1.02 118.68 131.30 2xdw s LEU 470 Ca -0.00 -0.32 0.02 0.00 -0.22 0.00 0.00 54.13 53.60 2xdw s LEU 470 Cb -0.19 -1.87 -0.03 0.00 0.50 0.00 0.00 46.19 44.61 2xdw s LEU 470 CO -0.10 -0.05 -0.09 -0.47 -1.32 0.00 0.00 176.35 174.32 2xdw s TYR 471 N 1.56 2.85 0.23 5.38 5.04 -0.04 -1.31 117.35 131.07 2xdw s TYR 471 Ca 0.06 -0.04 -0.15 0.00 -2.44 0.00 0.00 57.07 54.50 2xdw s TYR 471 Cb -0.15 -1.68 0.01 0.00 0.35 0.00 0.00 41.96 40.49 2xdw s TYR 471 CO 0.02 0.29 0.50 0.20 -1.34 0.00 0.00 175.55 175.21 2xdw s GLY 472 N -0.82 0.27 0.00 8.97 0.00 -1.11 -1.98 107.32 112.65 2xdw s GLY 472 Ca 0.12 -0.62 0.00 0.00 0.00 0.00 0.00 44.72 44.22 2xdw s GLY 472 CO 0.01 -0.48 0.00 2.98 0.00 0.00 0.00 173.10 175.61 2xdw n TYR 473 N -0.36 0.00 -1.19 1.90 9.36 -1.26 -4.46 117.16 121.14 2xdw n TYR 473 Ca -0.05 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.17 2xdw n TYR 473 Cb 0.62 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.33 2xdw n TYR 473 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2xdw n GLY 474 N 2.73 0.52 0.00 2.98 0.00 -1.26 -4.20 105.19 105.95 2xdw n GLY 474 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 2xdw n GLY 474 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2xdw n GLY 475 N -1.03 1.21 2.45 -0.02 0.00 -1.09 -4.59 105.19 102.12 2xdw n GLY 475 Ca 0.00 -0.88 -0.17 0.00 0.00 0.00 0.00 46.02 44.96 2xdw n GLY 475 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2xdw n PHE 476 N -0.41 -0.20 -1.86 1.61 3.01 -1.02 -1.73 117.46 116.85 2xdw n PHE 476 Ca 0.00 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.26 2xdw n PHE 476 Cb 0.00 -3.06 -0.06 0.00 -0.01 0.00 0.00 39.48 36.35 2xdw n PHE 476 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2xdw n ASN 477 N -0.88 -5.58 -4.67 4.37 5.15 -0.96 -4.91 115.26 107.79 2xdw n ASN 477 Ca -0.18 0.33 -0.40 0.00 -0.60 0.00 0.00 54.58 53.74 2xdw n ASN 477 Cb 0.58 -4.78 -0.06 0.00 -0.53 0.00 0.00 39.78 34.99 2xdw n ASN 477 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2xdw s ILE 478 N -2.84 5.07 -0.12 -1.44 -1.09 -0.71 -3.37 121.20 116.70 2xdw s ILE 478 Ca 0.00 1.10 -0.15 0.00 -2.23 0.00 0.00 60.65 59.37 2xdw s ILE 478 Cb 0.00 -3.90 -0.05 0.00 -1.58 0.00 0.00 42.46 36.93 2xdw s ILE 478 CO 0.00 0.16 0.37 -0.44 -1.23 0.00 0.00 174.94 173.80 2xdw s SER 479 N 1.10 6.58 -0.75 3.58 0.01 -1.26 -2.44 113.70 120.52 2xdw s SER 479 Ca 0.27 0.69 -0.16 0.00 1.31 0.00 0.00 55.95 58.06 2xdw s SER 479 Cb -0.16 -2.22 0.17 0.00 0.21 0.00 0.00 66.02 64.02 2xdw s SER 479 CO 0.11 0.12 0.77 -0.63 0.41 0.00 0.00 173.24 174.01 2xdw s ILE 480 N 0.18 5.26 0.37 1.44 -1.09 -1.26 -4.97 121.20 121.12 2xdw s ILE 480 Ca 0.21 -1.89 0.07 0.00 -2.23 0.00 0.00 60.65 56.81 2xdw s ILE 480 Cb -0.14 -4.50 -0.02 0.00 -1.58 0.00 0.00 42.46 36.22 2xdw s ILE 480 CO 0.08 -1.10 0.36 0.42 -1.23 0.00 0.00 174.94 173.47 2xdw s THR 481 N 1.28 3.30 0.37 2.92 -4.23 -1.26 -4.93 115.64 113.08 2xdw s THR 481 Ca 0.17 -1.29 -0.28 0.00 -1.18 0.00 0.00 61.69 59.10 2xdw s THR 481 Cb -0.15 -3.14 -0.11 0.00 1.34 0.00 0.00 72.50 70.44 2xdw s THR 481 CO -0.04 -0.11 1.49 -2.84 -0.54 0.00 0.00 174.62 172.58 2xdw s PRO 482 N -4.08 4.12 0.01 3.99 0.02 -1.26 -5.00 135.00 132.80 2xdw s PRO 482 Ca 0.45 2.56 -0.09 0.00 0.02 0.00 0.00 61.00 63.94 2xdw s PRO 482 Cb -0.06 -2.98 0.01 0.00 0.02 0.00 0.00 34.50 31.49 2xdw s PRO 482 CO 0.28 -0.53 0.18 0.54 -0.33 0.00 0.00 177.00 177.14 2xdw s ASN 483 N -0.09 -0.00 -0.25 2.53 4.22 -1.26 -4.13 114.94 115.96 2xdw s ASN 483 Ca 0.54 -0.23 -0.22 0.00 -2.14 0.00 0.00 52.86 50.81 2xdw s ASN 483 Cb -0.46 0.25 -0.01 0.00 1.28 0.00 0.00 41.25 42.30 2xdw s ASN 483 CO 0.61 -0.45 0.71 -0.47 -2.04 0.00 0.00 177.10 175.46 2xdw s TYR 484 N -1.83 3.28 -0.22 1.54 5.04 -0.91 -3.82 117.35 120.42 2xdw s TYR 484 Ca -0.11 0.92 -0.01 0.00 -2.44 0.00 0.00 57.07 55.43 2xdw s TYR 484 Cb -0.05 -2.94 0.06 0.00 0.35 0.00 0.00 41.96 39.38 2xdw s TYR 484 CO -0.00 -0.37 -0.00 0.45 -1.34 0.00 0.00 175.55 174.28 2xdw s SER 485 N 1.44 3.44 0.28 4.32 0.15 -1.26 -4.99 113.70 117.07 2xdw s SER 485 Ca 0.30 -1.05 -0.02 0.00 0.70 0.00 0.00 55.95 55.88 2xdw s SER 485 Cb -0.15 -0.90 0.39 0.00 -1.71 0.00 0.00 66.02 63.65 2xdw s SER 485 CO 0.08 -0.28 1.86 0.58 1.20 0.00 0.00 173.24 176.68 2xdw h VAL 486 N 6.59 1.22 -0.76 4.45 2.07 -1.95 -2.10 116.25 125.77 2xdw h VAL 486 Ca -0.17 -0.70 0.04 0.00 0.82 0.00 0.00 66.70 66.69 2xdw h VAL 486 Cb 1.09 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 2xdw h VAL 486 CO 0.38 0.28 0.48 0.77 0.02 0.00 0.00 177.57 179.50 2xdw h SER 487 N 0.92 0.79 0.32 0.57 4.64 -1.97 0.15 113.55 118.97 2xdw h SER 487 Ca 0.22 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.36 2xdw h SER 487 Cb 0.18 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.09 2xdw h SER 487 CO -0.02 0.54 -0.74 0.03 -0.87 0.00 0.00 176.83 175.76 2xdw h ARG 488 N 0.93 0.35 -0.02 4.77 3.08 -1.94 -2.97 114.38 118.57 2xdw h ARG 488 Ca 0.31 -0.30 -0.07 0.00 0.07 0.00 0.00 59.98 59.99 2xdw h ARG 488 Cb 0.04 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2xdw h ARG 488 CO -0.12 0.95 -0.31 -0.07 -1.07 0.00 0.00 179.97 179.34 2xdw h LEU 489 N 0.24 0.04 -0.70 3.04 3.38 -0.79 -1.88 115.31 118.63 2xdw h LEU 489 Ca -0.03 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 2xdw h LEU 489 Cb 1.32 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 2xdw h LEU 489 CO 0.12 0.36 -0.12 0.40 0.09 0.00 0.00 178.44 179.30 2xdw h ILE 490 N 0.04 1.26 -0.77 1.22 2.04 -0.89 0.19 117.51 120.61 2xdw h ILE 490 Ca 0.00 -1.22 0.02 0.00 1.00 0.00 0.00 64.86 64.66 2xdw h ILE 490 Cb 0.58 1.02 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 2xdw h ILE 490 CO 0.04 0.42 0.50 0.15 0.00 0.00 0.00 178.15 179.27 2xdw h PHE 491 N 0.79 0.94 0.70 1.37 3.57 -1.24 0.30 116.94 123.37 2xdw h PHE 491 Ca 0.13 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.62 2xdw h PHE 491 Cb 0.64 -0.31 0.01 0.00 2.79 0.00 0.00 35.95 39.07 2xdw h PHE 491 CO 0.04 0.57 -0.33 0.28 -2.23 0.00 0.00 178.31 176.63 2xdw h VAL 492 N 1.00 0.20 -0.12 1.41 2.07 -1.04 -1.52 116.25 118.25 2xdw h VAL 492 Ca 0.29 -0.21 -0.09 0.00 0.82 0.00 0.00 66.70 67.51 2xdw h VAL 492 Cb -0.05 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 2xdw h VAL 492 CO -0.09 0.02 -0.28 -0.09 0.02 0.00 0.00 177.57 177.15 2xdw h ARG 493 N -1.10 0.41 -0.00 1.57 9.65 -0.90 -2.02 114.38 121.97 2xdw h ARG 493 Ca -0.10 -0.27 0.00 0.00 -1.10 0.00 0.00 59.98 58.51 2xdw h ARG 493 Cb 0.75 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.37 2xdw h ARG 493 CO 0.16 0.88 -0.72 0.72 2.80 0.00 0.00 179.97 183.80 2xdw n HIS 494 N -4.43 0.00 -0.16 2.20 8.25 0.10 -4.18 115.22 117.00 2xdw n HIS 494 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 2xdw n HIS 494 Cb 0.47 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.58 2xdw n HIS 494 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2xdw n MET 495 N -1.10 2.14 -1.44 -0.41 2.81 -0.74 -0.32 117.12 118.06 2xdw n MET 495 Ca 0.04 -1.24 -0.12 0.00 -1.81 0.00 0.00 57.70 54.58 2xdw n MET 495 Cb 0.30 -0.92 -0.05 0.00 -0.71 0.00 0.00 33.22 31.85 2xdw n MET 495 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2xdw n GLY 496 N -0.37 1.13 3.93 3.03 0.00 -0.78 -4.79 105.19 107.34 2xdw n GLY 496 Ca 0.00 -0.47 -0.25 0.00 0.00 0.00 0.00 46.02 45.29 2xdw n GLY 496 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2xdw s GLY 497 N -2.83 1.64 -0.12 -0.02 0.00 -0.65 -4.32 107.32 101.02 2xdw s GLY 497 Ca 0.00 -0.87 -0.01 0.00 0.00 0.00 0.00 44.72 43.84 2xdw s GLY 497 CO 0.00 -0.58 -0.09 0.14 0.00 0.00 0.00 173.10 172.58 2xdw s VAL 498 N -2.95 3.49 -0.12 1.40 1.01 0.09 -4.36 120.40 118.96 2xdw s VAL 498 Ca 0.55 -0.52 -0.06 0.00 0.00 0.00 0.00 61.98 61.95 2xdw s VAL 498 Cb -0.10 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 2xdw s VAL 498 CO 0.43 0.53 0.11 -0.22 0.00 0.00 0.00 175.10 175.95 2xdw s LEU 499 N 0.08 4.21 -0.01 3.92 2.96 -0.37 -0.52 118.68 128.94 2xdw s LEU 499 Ca -0.03 0.39 -0.01 0.00 -0.22 0.00 0.00 54.13 54.26 2xdw s LEU 499 Cb -0.14 -2.02 0.00 0.00 0.50 0.00 0.00 46.19 44.53 2xdw s LEU 499 CO 0.04 0.39 0.04 0.00 -1.32 0.00 0.00 176.35 175.49 2xdw s ALA 500 N -0.93 -0.09 -0.15 5.97 0.00 -0.19 -0.48 121.76 125.89 2xdw s ALA 500 Ca 0.14 0.06 -0.00 0.00 0.00 0.00 0.00 51.96 52.16 2xdw s ALA 500 Cb -0.12 -0.05 0.04 0.00 0.00 0.00 0.00 23.12 22.99 2xdw s ALA 500 CO 0.03 -0.03 -0.07 0.08 0.00 0.00 0.00 175.76 175.77 2xdw s VAL 501 N -0.12 1.18 -0.25 0.00 1.01 -0.22 -0.86 120.40 121.15 2xdw s VAL 501 Ca -0.01 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 2xdw s VAL 501 Cb -0.01 -1.29 -0.05 0.00 0.00 0.00 0.00 36.38 35.03 2xdw s VAL 501 CO 0.00 0.22 0.16 0.00 0.00 0.00 0.00 175.10 175.48 2xdw s ALA 502 N 1.61 3.57 -1.36 5.51 0.00 -0.84 -1.27 121.76 129.00 2xdw s ALA 502 Ca 0.02 -0.94 -0.08 0.00 0.00 0.00 0.00 51.96 50.96 2xdw s ALA 502 Cb -0.14 -2.34 0.11 0.00 0.00 0.00 0.00 23.12 20.74 2xdw s ALA 502 CO -0.08 -0.27 2.24 0.09 0.00 0.00 0.00 175.76 177.73 2xdw n ASN 503 N 4.46 6.55 -4.71 0.00 4.13 0.18 -4.60 115.26 121.27 2xdw n ASN 503 Ca -0.15 -3.03 -0.30 0.00 1.68 0.00 0.00 54.58 52.78 2xdw n ASN 503 Cb 0.52 -1.46 0.14 0.00 -1.54 0.00 0.00 39.78 37.44 2xdw n ASN 503 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2xdw s ILE 504 N 0.26 2.73 0.90 2.41 -4.36 -1.26 -4.45 121.20 117.44 2xdw s ILE 504 Ca 0.49 0.24 -0.11 0.00 -0.26 0.00 0.00 60.65 61.02 2xdw s ILE 504 Cb 0.14 -2.63 0.14 0.00 1.25 0.00 0.00 42.46 41.36 2xdw s ILE 504 CO -0.05 -0.31 1.11 -0.13 0.24 0.00 0.00 174.94 175.80 2xdw s ARG 505 N -4.85 1.15 0.00 0.37 0.52 -1.26 -3.24 118.95 111.64 2xdw s ARG 505 Ca 0.64 1.30 0.00 0.00 -0.52 0.00 0.00 55.73 57.14 2xdw s ARG 505 Cb -0.19 -1.76 0.00 0.00 0.52 0.00 0.00 34.95 33.52 2xdw s ARG 505 CO 0.57 -2.45 0.00 0.41 0.02 0.00 0.00 175.30 173.85 2xdw n GLY 506 N -0.24 2.96 3.62 -3.53 0.00 -0.22 -4.25 105.19 103.53 2xdw n GLY 506 Ca 0.10 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 2xdw n GLY 506 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2xdw s GLY 507 N -2.23 1.61 0.00 -0.02 0.00 -1.20 -2.25 107.32 103.23 2xdw s GLY 507 Ca 0.00 -1.07 0.20 0.00 0.00 0.00 0.00 44.72 43.86 2xdw s GLY 507 CO 0.00 -0.15 1.47 0.61 0.00 0.00 0.00 173.10 175.03 2xdw n GLY 508 N -1.22 1.94 0.26 0.20 0.00 -1.02 -1.80 105.19 103.55 2xdw n GLY 508 Ca 0.15 -0.69 0.02 0.00 0.00 0.00 0.00 46.02 45.49 2xdw n GLY 508 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2xdw h GLU 509 N 3.79 0.41 -0.88 1.61 3.07 -1.88 -1.17 114.58 119.53 2xdw h GLU 509 Ca 0.00 -0.08 -0.55 0.00 -0.50 0.00 0.00 59.36 58.23 2xdw h GLU 509 Cb 0.86 -0.06 -0.43 0.00 -0.84 0.00 0.00 28.75 28.28 2xdw h GLU 509 CO 0.00 0.45 -0.81 0.66 -1.40 0.00 0.00 179.01 177.91 2xdw n TYR 510 N -4.31 2.85 -4.14 4.33 4.01 -1.26 -4.73 117.16 113.91 2xdw n TYR 510 Ca 0.01 -2.37 0.00 0.00 -0.16 0.00 0.00 57.90 55.38 2xdw n TYR 510 Cb 0.22 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 38.96 2xdw n TYR 510 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2xdw n GLY 511 N -0.67 -1.39 0.22 2.72 0.00 -0.44 -3.38 105.19 102.25 2xdw n GLY 511 Ca 0.43 -1.28 0.07 0.00 0.00 0.00 0.00 46.02 45.24 2xdw n GLY 511 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2xdw h GLU 512 N 0.00 0.00 -0.47 1.61 4.57 -1.28 -1.33 114.58 117.68 2xdw h GLU 512 Ca 0.00 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.09 2xdw h GLU 512 Cb 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 2xdw h GLU 512 CO 0.00 0.25 -0.05 1.79 -1.18 0.00 0.00 179.01 179.82 2xdw h THR 513 N 0.00 1.25 -0.50 0.32 1.35 -1.81 0.15 112.91 113.66 2xdw h THR 513 Ca -0.00 -1.10 -0.05 0.00 -0.55 0.00 0.00 66.41 64.71 2xdw h THR 513 Cb 0.54 0.95 -0.02 0.00 -1.73 0.00 0.00 68.15 67.89 2xdw h THR 513 CO 0.03 0.38 0.12 -0.25 -0.25 0.00 0.00 175.52 175.56 2xdw h TRP 514 N 0.75 0.85 0.17 4.73 2.91 -1.27 -1.98 115.95 122.10 2xdw h TRP 514 Ca 0.13 -0.10 -0.01 0.00 1.13 0.00 0.00 58.89 60.05 2xdw h TRP 514 Cb 0.53 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 28.94 2xdw h TRP 514 CO 0.03 0.75 -0.08 1.25 -1.03 0.00 0.00 178.44 179.36 2xdw h HIS 515 N 0.69 -0.22 0.00 2.65 2.76 -0.72 -0.46 115.15 119.86 2xdw h HIS 515 Ca 0.16 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.32 2xdw h HIS 515 Cb 0.33 0.07 -0.00 0.00 1.55 0.00 0.00 27.41 29.36 2xdw h HIS 515 CO 0.02 -0.12 -0.03 0.87 -1.30 0.00 0.00 177.93 177.38 2xdw h LYS 516 N -0.26 0.00 0.00 5.26 1.57 -0.92 -0.91 116.57 121.31 2xdw h LYS 516 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2xdw h LYS 516 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2xdw h LYS 516 CO 0.04 0.03 0.00 0.41 -0.57 0.00 0.00 179.45 179.36 2xdw n GLY 517 N -0.50 -0.82 1.40 3.86 0.00 -0.75 -3.34 105.19 105.05 2xdw n GLY 517 Ca -0.01 -0.08 0.03 0.00 0.00 0.00 0.00 46.02 45.96 2xdw n GLY 517 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2xdw n GLY 518 N 0.09 2.55 3.32 -0.02 0.00 -0.35 -4.57 105.19 106.22 2xdw n GLY 518 Ca 0.08 -1.10 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 2xdw n GLY 518 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2xdw s ILE 519 N -1.55 1.11 0.00 -0.61 -4.36 -1.21 -4.46 121.20 110.12 2xdw s ILE 519 Ca 0.35 -2.05 0.00 0.00 -0.26 0.00 0.00 60.65 58.69 2xdw s ILE 519 Cb 0.38 -2.24 0.00 0.00 1.25 0.00 0.00 42.46 41.85 2xdw s ILE 519 CO -0.12 -0.41 0.00 0.18 0.24 0.00 0.00 174.94 174.83 2xdw n LEU 520 N -0.38 0.00 0.29 0.37 4.77 0.48 -0.71 117.00 121.82 2xdw n LEU 520 Ca -0.06 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.10 2xdw n LEU 520 Cb 0.63 0.00 0.87 0.00 -2.33 0.00 0.00 43.42 42.59 2xdw n LEU 520 CO 0.36 0.00 1.05 0.00 -1.33 0.00 0.00 177.39 177.47 2xdw h ALA 521 N -0.88 1.07 -0.68 -1.18 0.00 -1.91 -2.42 119.26 113.27 2xdw h ALA 521 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2xdw h ALA 521 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2xdw h ALA 521 CO 0.00 0.05 0.00 0.09 0.00 0.00 0.00 179.25 179.39 2xdw n ASN 522 N -3.23 4.63 -0.09 0.00 3.02 0.11 -4.48 115.26 115.22 2xdw n ASN 522 Ca -0.01 -2.35 0.12 0.00 -0.03 0.00 0.00 54.58 52.31 2xdw n ASN 522 Cb 0.21 -0.57 0.50 0.00 -0.61 0.00 0.00 39.78 39.32 2xdw n ASN 522 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2xdw h LYS 523 N 4.18 0.39 -0.02 3.52 1.63 -1.31 -0.55 116.57 124.41 2xdw h LYS 523 Ca 0.00 -0.02 0.01 0.00 -0.85 0.00 0.00 60.65 59.78 2xdw h LYS 523 Cb 1.36 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.91 2xdw h LYS 523 CO 0.18 0.26 0.04 0.37 -3.45 0.00 0.00 179.45 176.85 2xdw h GLN 524 N 0.40 0.00 -0.82 1.90 5.75 -1.85 0.20 115.11 120.69 2xdw h GLN 524 Ca 0.28 0.00 0.10 0.00 -0.15 0.00 0.00 58.65 58.88 2xdw h GLN 524 Cb 0.57 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 29.07 2xdw h GLN 524 CO -0.08 0.00 0.53 -0.91 -2.65 0.00 0.00 178.83 175.72 2xdw h ASN 525 N 0.00 0.68 -0.35 -0.69 2.35 -1.36 -0.71 115.58 115.50 2xdw h ASN 525 Ca 0.01 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 55.80 2xdw h ASN 525 Cb 0.08 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 2xdw h ASN 525 CO -0.00 0.40 0.18 0.00 -1.65 0.00 0.00 177.43 176.36 2xdw h PHE 527 N 0.37 1.05 -0.26 0.00 0.04 -1.47 -1.14 116.94 115.53 2xdw h PHE 527 Ca 0.15 -0.36 -0.00 0.00 2.80 0.00 0.00 57.97 60.55 2xdw h PHE 527 Cb 0.05 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 2xdw h PHE 527 CO -0.09 1.18 0.15 -0.44 -0.60 0.00 0.00 178.31 178.50 2xdw h ASP 528 N 0.63 0.31 -0.41 2.17 3.32 -0.99 -0.66 116.42 120.79 2xdw h ASP 528 Ca 0.02 -0.06 0.06 0.00 0.02 0.00 0.00 57.03 57.07 2xdw h ASP 528 Cb 1.08 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 40.50 2xdw h ASP 528 CO 0.11 0.29 0.10 0.44 -1.72 0.00 0.00 179.24 178.46 2xdw h ASP 529 N 0.32 0.05 -0.39 6.45 3.32 -0.56 -0.39 116.42 125.21 2xdw h ASP 529 Ca 0.09 0.06 -0.16 0.00 0.02 0.00 0.00 57.03 57.05 2xdw h ASP 529 Cb 0.04 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2xdw h ASP 529 CO -0.02 0.06 -0.38 0.15 -1.72 0.00 0.00 179.24 177.34 2xdw h PHE 530 N 0.24 1.14 -0.82 4.55 3.57 -0.99 -1.19 116.94 123.43 2xdw h PHE 530 Ca 0.20 -0.34 -0.01 0.00 3.53 0.00 0.00 57.97 61.35 2xdw h PHE 530 Cb 0.23 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 2xdw h PHE 530 CO -0.19 1.17 0.46 1.96 -2.23 0.00 0.00 178.31 179.48 2xdw h GLN 531 N 0.78 1.14 -0.05 1.11 4.20 -0.95 -2.19 115.11 119.14 2xdw h GLN 531 Ca 0.06 -0.12 -0.09 0.00 0.06 0.00 0.00 58.65 58.56 2xdw h GLN 531 Cb 0.97 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 2xdw h GLN 531 CO 0.09 0.82 -0.38 0.00 -0.67 0.00 0.00 178.83 178.70 2xdw h ALA 533 N 1.52 0.50 -0.41 0.00 0.00 -0.64 -0.28 119.26 119.94 2xdw h ALA 533 Ca 0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2xdw h ALA 533 Cb 0.72 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2xdw h ALA 533 CO 0.05 0.04 0.25 0.00 0.00 0.00 0.00 179.25 179.59 2xdw h ALA 534 N 1.05 0.53 -0.90 0.00 0.00 -1.00 -1.61 119.26 117.32 2xdw h ALA 534 Ca 0.13 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2xdw h ALA 534 Cb 0.09 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2xdw h ALA 534 CO -0.02 0.02 0.59 0.93 0.00 0.00 0.00 179.25 180.78 2xdw h GLU 535 N 0.54 1.11 0.16 0.00 5.08 -0.90 -1.64 114.58 118.94 2xdw h GLU 535 Ca 0.15 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2xdw h GLU 535 Cb 0.00 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.00 2xdw h GLU 535 CO -0.03 0.73 -0.08 -0.92 -1.00 0.00 0.00 179.01 177.72 2xdw h TYR 536 N 1.14 -0.20 -0.84 4.33 5.03 -0.66 0.11 116.97 125.89 2xdw h TYR 536 Ca 0.36 -0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.74 2xdw h TYR 536 Cb 0.01 0.07 -0.06 0.00 1.55 0.00 0.00 36.73 38.30 2xdw h TYR 536 CO -0.00 -0.06 0.54 -0.07 -1.32 0.00 0.00 178.16 177.25 2xdw h LEU 537 N -0.30 0.79 -0.02 2.82 3.38 -0.91 0.01 115.31 121.08 2xdw h LEU 537 Ca -0.02 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2xdw h LEU 537 Cb 0.23 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2xdw h LEU 537 CO 0.04 0.49 -0.10 0.40 0.09 0.00 0.00 178.44 179.36 2xdw h ILE 538 N 0.89 1.52 -0.93 1.22 2.04 -1.09 -0.57 117.51 120.59 2xdw h ILE 538 Ca 0.37 -1.68 -0.00 0.00 1.00 0.00 0.00 64.86 64.55 2xdw h ILE 538 Cb 0.28 2.59 -0.04 0.00 -0.74 0.00 0.00 36.82 38.91 2xdw h ILE 538 CO -0.14 0.45 0.56 0.50 0.00 0.00 0.00 178.15 179.52 2xdw h LYS 539 N -0.55 1.26 -0.00 2.37 3.64 -0.51 -1.87 116.57 120.91 2xdw h LYS 539 Ca -0.01 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2xdw h LYS 539 Cb 0.78 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2xdw h LYS 539 CO 0.02 0.88 -0.04 0.39 -2.27 0.00 0.00 179.45 178.43 2xdw n GLU 540 N -4.37 0.75 -0.70 1.90 -0.58 -0.03 -4.92 120.64 112.68 2xdw n GLU 540 Ca 0.10 -0.13 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 2xdw n GLU 540 Cb 0.06 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.43 2xdw n GLU 540 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2xdw n GLY 541 N 1.20 0.62 0.23 0.62 0.00 -0.70 -4.86 105.19 102.30 2xdw n GLY 541 Ca 0.17 -0.22 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 2xdw n GLY 541 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2xdw h TYR 542 N 0.00 0.39 -2.54 1.61 0.05 -1.34 0.16 116.97 115.30 2xdw h TYR 542 Ca 0.00 -0.07 -0.03 0.00 0.05 0.00 0.00 58.73 58.68 2xdw h TYR 542 Cb 0.00 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 37.64 2xdw h TYR 542 CO 0.00 0.56 0.11 -2.37 -1.05 0.00 0.00 178.16 175.41 2xdw n THR 543 N -4.16 0.00 -4.05 -2.88 5.66 -1.12 -3.65 114.28 104.09 2xdw n THR 543 Ca -0.01 -0.52 -0.08 0.00 -3.05 0.00 0.00 64.05 60.39 2xdw n THR 543 Cb 0.37 0.48 -0.10 0.00 -1.55 0.00 0.00 70.33 69.53 2xdw n THR 543 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 2xdw s SER 544 N -2.00 0.39 0.28 1.09 0.01 -1.18 -4.34 113.70 107.96 2xdw s SER 544 Ca 0.08 -0.82 0.02 0.00 1.31 0.00 0.00 55.95 56.54 2xdw s SER 544 Cb -0.02 0.17 0.65 0.00 0.21 0.00 0.00 66.02 67.04 2xdw s SER 544 CO 0.06 -0.51 1.71 -0.65 0.41 0.00 0.00 173.24 174.26 2xdw h PRO 545 N 3.61 0.42 0.00 12.44 0.11 -1.90 -0.07 132.00 146.61 2xdw h PRO 545 Ca -0.33 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2xdw h PRO 545 Cb 1.16 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2xdw h PRO 545 CO 0.58 0.28 0.00 0.36 -0.21 0.00 0.00 178.00 179.00 2xdw n LYS 546 N -5.02 0.15 -0.07 1.05 2.85 -1.26 -1.09 118.16 114.77 2xdw n LYS 546 Ca 0.20 0.41 0.06 0.00 -1.05 0.00 0.00 58.31 57.93 2xdw n LYS 546 Cb 0.58 -1.80 0.09 0.00 -0.65 0.00 0.00 35.03 33.25 2xdw n LYS 546 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2xdw n ARG 547 N -2.08 1.48 -3.66 -1.58 1.74 -0.08 -4.61 116.66 107.86 2xdw n ARG 547 Ca 0.02 -1.53 -0.36 0.00 -0.77 0.00 0.00 57.85 55.21 2xdw n ARG 547 Cb 0.19 -1.25 -0.08 0.00 -1.02 0.00 0.00 32.46 30.30 2xdw n ARG 547 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2xdw s LEU 548 N -0.99 4.17 -0.12 0.55 2.96 -0.90 -1.83 118.68 122.53 2xdw s LEU 548 Ca 0.18 0.23 -0.02 0.00 -0.22 0.00 0.00 54.13 54.30 2xdw s LEU 548 Cb 0.11 -2.15 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 2xdw s LEU 548 CO 0.15 0.11 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.36 2xdw s THR 549 N 0.72 3.86 0.06 3.68 2.01 -0.16 -0.66 115.64 125.14 2xdw s THR 549 Ca 0.09 -0.39 0.05 0.00 0.31 0.00 0.00 61.69 61.75 2xdw s THR 549 Cb -0.12 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.70 2xdw s THR 549 CO 0.02 0.54 -0.05 0.27 -0.69 0.00 0.00 174.62 174.71 2xdw s ILE 550 N -0.17 3.74 -0.01 1.82 -4.36 -0.42 -0.93 121.20 120.88 2xdw s ILE 550 Ca 0.03 -0.96 -0.05 0.00 -0.26 0.00 0.00 60.65 59.42 2xdw s ILE 550 Cb -0.13 -2.71 -0.00 0.00 1.25 0.00 0.00 42.46 40.87 2xdw s ILE 550 CO 0.02 0.23 0.09 0.21 0.24 0.00 0.00 174.94 175.73 2xdw s ASN 551 N -1.93 0.04 0.07 4.36 3.04 -0.42 -1.27 114.94 118.82 2xdw s ASN 551 Ca 0.21 -0.16 -0.26 0.00 0.04 0.00 0.00 52.86 52.69 2xdw s ASN 551 Cb -0.11 0.18 0.09 0.00 -1.54 0.00 0.00 41.25 39.87 2xdw s ASN 551 CO 0.13 -0.26 0.77 -0.83 -3.04 0.00 0.00 177.10 173.87 2xdw s GLY 552 N -1.00 -0.52 0.02 1.21 0.00 -1.15 -2.73 107.32 103.15 2xdw s GLY 552 Ca -0.11 0.77 0.06 0.00 0.00 0.00 0.00 44.72 45.44 2xdw s GLY 552 CO 0.01 0.25 -0.18 -0.32 0.00 0.00 0.00 173.10 172.86 2xdw s GLY 553 N -2.60 0.92 0.00 0.20 0.00 -1.26 -1.42 107.32 103.17 2xdw s GLY 553 Ca 0.04 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 43.88 2xdw s GLY 553 CO -0.10 -0.79 0.00 -1.26 0.00 0.00 0.00 173.10 170.94 2xdw n SER 554 N 2.17 0.00 0.29 1.64 2.88 0.31 -0.26 113.62 120.64 2xdw n SER 554 Ca -0.16 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.51 2xdw n SER 554 Cb 0.54 0.00 0.83 0.00 -0.75 0.00 0.00 64.21 64.83 2xdw n SER 554 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2xdw h ASN 555 N 0.00 0.00 1.01 -3.46 -1.24 -1.90 0.27 115.58 110.25 2xdw h ASN 555 Ca 0.00 0.00 -0.04 0.00 0.71 0.00 0.00 56.30 56.97 2xdw h ASN 555 Cb 0.00 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.04 2xdw h ASN 555 CO 0.00 0.01 -0.21 1.23 -1.29 0.00 0.00 177.43 177.17 2xdw h GLY 556 N 0.05 0.00 1.02 1.57 0.00 -0.80 -1.82 103.07 103.08 2xdw h GLY 556 Ca -0.00 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 2xdw h GLY 556 CO 0.00 0.00 -0.54 -1.33 0.00 0.00 0.00 176.54 174.67 2xdw h GLY 557 N 2.22 0.75 0.62 4.60 0.00 -0.97 -2.13 103.07 108.17 2xdw h GLY 557 Ca -0.00 -0.97 0.06 0.00 0.00 0.00 0.00 47.33 46.42 2xdw h GLY 557 CO 0.03 0.87 0.26 -2.00 0.00 0.00 0.00 176.54 175.70 2xdw h LEU 558 N 0.38 0.35 0.06 3.11 5.85 -1.32 -1.85 115.31 121.90 2xdw h LEU 558 Ca -0.02 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2xdw h LEU 558 Cb 1.16 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 2xdw h LEU 558 CO 0.12 0.23 -0.29 0.25 -0.34 0.00 0.00 178.44 178.41 2xdw h LEU 559 N 0.50 -0.85 -0.58 2.25 5.85 -1.12 -0.33 115.31 121.03 2xdw h LEU 559 Ca 0.26 0.11 -0.15 0.00 0.84 0.00 0.00 57.88 58.93 2xdw h LEU 559 Cb 0.21 0.34 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2xdw h LEU 559 CO -0.20 -0.37 -0.70 -0.37 -0.34 0.00 0.00 178.44 176.46 2xdw h VAL 560 N -0.48 1.47 -0.37 1.05 -1.51 -1.27 -1.55 116.25 113.59 2xdw h VAL 560 Ca 0.05 -2.32 -0.08 0.00 -1.23 0.00 0.00 66.70 63.12 2xdw h VAL 560 Cb 0.53 2.24 -0.01 0.00 -2.13 0.00 0.00 31.29 31.93 2xdw h VAL 560 CO -0.21 0.67 -0.08 0.00 -1.23 0.00 0.00 177.57 176.72 2xdw h ALA 561 N 1.23 0.51 -0.61 5.19 0.00 -1.10 -0.92 119.26 123.55 2xdw h ALA 561 Ca -0.01 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.53 2xdw h ALA 561 Cb 1.24 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2xdw h ALA 561 CO 0.10 0.35 0.12 1.15 0.00 0.00 0.00 179.25 180.97 2xdw h THR 562 N 0.51 1.26 -0.33 0.00 2.02 -0.96 -2.54 112.91 112.86 2xdw h THR 562 Ca 0.10 -0.96 -0.03 0.00 0.77 0.00 0.00 66.41 66.28 2xdw h THR 562 Cb 0.58 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 2xdw h THR 562 CO 0.03 0.36 0.06 0.00 0.37 0.00 0.00 175.52 176.34 2xdw h ALA 564 N 1.59 0.88 -0.48 0.00 0.00 -0.77 0.35 119.26 120.82 2xdw h ALA 564 Ca 0.11 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 2xdw h ALA 564 Cb 0.23 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2xdw h ALA 564 CO -0.00 0.52 -0.09 -0.91 0.00 0.00 0.00 179.25 178.76 2xdw h ASN 565 N 0.96 0.91 0.46 0.00 2.35 -1.01 -2.79 115.58 116.47 2xdw h ASN 565 Ca 0.22 -0.35 -0.30 0.00 -0.55 0.00 0.00 56.30 55.31 2xdw h ASN 565 Cb 0.25 -0.25 0.01 0.00 0.05 0.00 0.00 38.32 38.38 2xdw h ASN 565 CO -0.01 1.05 -1.44 1.56 -1.65 0.00 0.00 177.43 176.94 2xdw h GLN 566 N 0.76 0.32 -2.04 0.81 4.20 -0.80 -3.40 115.11 114.97 2xdw h GLN 566 Ca 0.12 -0.55 -0.53 0.00 0.06 0.00 0.00 58.65 57.75 2xdw h GLN 566 Cb 0.64 0.21 -0.40 0.00 0.30 0.00 0.00 27.48 28.23 2xdw h GLN 566 CO 0.04 1.23 -1.07 0.54 -0.67 0.00 0.00 178.83 178.91 2xdw n ARG 567 N -3.54 1.17 0.28 1.46 5.12 0.09 -4.94 116.66 116.30 2xdw n ARG 567 Ca -0.14 -3.54 0.14 0.00 -1.93 0.00 0.00 57.85 52.38 2xdw n ARG 567 Cb 1.05 -1.58 0.83 0.00 -1.16 0.00 0.00 32.46 31.60 2xdw n ARG 567 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2xdw h PRO 568 N 3.53 0.00 0.00 5.56 0.13 -1.64 -1.18 132.00 138.39 2xdw h PRO 568 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2xdw h PRO 568 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 2xdw h PRO 568 CO 0.54 0.07 0.00 -0.40 -0.23 0.00 0.00 178.00 177.97 2xdw n ASP 569 N -3.68 0.69 0.09 1.44 5.75 -1.26 -3.42 116.55 116.16 2xdw n ASP 569 Ca -0.02 0.69 0.12 0.00 -0.01 0.00 0.00 54.79 55.57 2xdw n ASP 569 Cb 0.17 -0.83 0.07 0.00 -1.03 0.00 0.00 41.12 39.50 2xdw n ASP 569 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2xdw h LEU 570 N 0.00 0.00 -8.28 -2.12 5.85 -1.57 -3.46 115.31 105.72 2xdw h LEU 570 Ca 0.00 -0.09 -0.50 0.00 0.84 0.00 0.00 57.88 58.13 2xdw h LEU 570 Cb 0.31 0.00 -0.28 0.00 0.37 0.00 0.00 40.66 41.05 2xdw h LEU 570 CO 0.00 0.04 -0.82 -0.36 -0.34 0.00 0.00 178.44 176.97 2xdw s PHE 571 N -3.28 1.38 -0.02 1.25 0.08 -1.22 -4.48 117.98 111.69 2xdw s PHE 571 Ca 0.02 -0.28 0.01 0.00 0.12 0.00 0.00 56.93 56.80 2xdw s PHE 571 Cb 0.11 -0.87 -0.26 0.00 -0.57 0.00 0.00 43.02 41.42 2xdw s PHE 571 CO 0.76 -0.01 0.75 0.78 -0.10 0.00 0.00 175.22 177.40 2xdw h GLY 572 N 5.56 0.21 -5.16 4.36 0.00 0.76 -3.40 103.07 105.41 2xdw h GLY 572 Ca -0.36 -0.53 -0.14 0.00 0.00 0.00 0.00 47.33 46.30 2xdw h GLY 572 CO 0.48 0.46 -0.33 0.00 0.00 0.00 0.00 176.54 177.15 2xdw s VAL 574 N -0.12 0.57 -0.25 0.00 1.01 0.22 -1.30 120.40 120.53 2xdw s VAL 574 Ca -0.03 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 61.89 2xdw s VAL 574 Cb -0.03 -0.63 0.05 0.00 0.00 0.00 0.00 36.38 35.77 2xdw s VAL 574 CO 0.01 0.26 -0.10 -0.63 0.00 0.00 0.00 175.10 174.63 2xdw s ILE 575 N 1.31 2.32 -0.31 2.22 1.01 -0.40 -1.00 121.20 126.35 2xdw s ILE 575 Ca -0.05 -1.46 -0.08 0.00 0.00 0.00 0.00 60.65 59.07 2xdw s ILE 575 Cb -0.14 -2.29 0.01 0.00 0.01 0.00 0.00 42.46 40.05 2xdw s ILE 575 CO -0.02 0.06 0.11 0.00 0.00 0.00 0.00 174.94 175.08 2xdw s ALA 576 N 1.17 3.12 -0.14 9.38 0.00 -0.34 -2.92 121.76 132.02 2xdw s ALA 576 Ca -0.06 -1.49 -0.14 0.00 0.00 0.00 0.00 51.96 50.28 2xdw s ALA 576 Cb -0.19 -2.24 -0.05 0.00 0.00 0.00 0.00 23.12 20.65 2xdw s ALA 576 CO -0.06 -0.99 0.32 -0.65 0.00 0.00 0.00 175.76 174.38 2xdw s GLN 577 N 1.52 4.18 -1.57 0.00 -0.21 -0.51 -1.46 119.66 121.61 2xdw s GLN 577 Ca 0.03 0.15 -0.02 0.00 0.02 0.00 0.00 55.36 55.54 2xdw s GLN 577 Cb -0.17 -3.39 0.02 0.00 1.00 0.00 0.00 33.01 30.46 2xdw s GLN 577 CO 0.03 0.31 0.06 1.33 -2.12 0.00 0.00 175.29 174.91 2xdw n VAL 578 N 3.30 -1.03 -3.29 1.09 0.24 0.83 -0.53 118.33 118.94 2xdw n VAL 578 Ca -0.12 -0.46 -0.34 0.00 -2.04 0.00 0.00 64.34 61.38 2xdw n VAL 578 Cb 0.52 -1.04 -0.06 0.00 -1.47 0.00 0.00 33.84 31.79 2xdw n VAL 578 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2xdw s GLY 579 N -4.31 2.41 -0.28 7.63 0.00 -1.26 -2.95 107.32 108.57 2xdw s GLY 579 Ca 0.06 -0.09 -0.24 0.00 0.00 0.00 0.00 44.72 44.45 2xdw s GLY 579 CO 1.00 0.15 0.81 0.14 0.00 0.00 0.00 173.10 175.21 2xdw s VAL 580 N -1.67 4.81 -0.03 1.40 1.01 -1.20 -4.44 120.40 120.28 2xdw s VAL 580 Ca 0.44 1.38 0.02 0.00 0.00 0.00 0.00 61.98 63.83 2xdw s VAL 580 Cb -0.13 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 2xdw s VAL 580 CO 0.20 -0.17 0.00 0.23 0.00 0.00 0.00 175.10 175.36 2xdw n MET 581 N 6.13 3.05 -3.16 2.72 2.81 -1.26 -4.13 117.12 123.29 2xdw n MET 581 Ca 0.05 0.00 -0.46 0.00 -1.81 0.00 0.00 57.70 55.48 2xdw n MET 581 Cb 0.48 -1.07 -0.03 0.00 -0.71 0.00 0.00 33.22 31.89 2xdw n MET 581 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2xdw s ASP 582 N -3.48 6.61 0.01 7.83 -1.08 -1.26 -1.66 116.67 123.63 2xdw s ASP 582 Ca -0.02 -2.24 0.20 0.00 -0.52 0.00 0.00 52.55 49.98 2xdw s ASP 582 Cb 0.01 -2.29 0.86 0.00 -1.46 0.00 0.00 42.92 40.04 2xdw s ASP 582 CO 0.11 -0.84 1.65 0.23 0.52 0.00 0.00 175.17 176.84 2xdw n MET 583 N 5.27 0.01 0.09 4.34 2.81 -1.26 -1.98 117.12 126.40 2xdw n MET 583 Ca 0.13 0.16 0.03 0.00 -1.81 0.00 0.00 57.70 56.20 2xdw n MET 583 Cb 0.47 -1.51 -0.02 0.00 -0.71 0.00 0.00 33.22 31.45 2xdw n MET 583 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 2xdw h LEU 584 N 0.00 0.00 -0.98 4.03 3.38 -1.93 -3.40 115.31 116.42 2xdw h LEU 584 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2xdw h LEU 584 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2xdw h LEU 584 CO 0.00 0.45 -0.00 0.29 0.09 0.00 0.00 178.44 179.27 2xdw n LYS 585 N -3.02 -0.76 0.16 1.13 5.02 -1.14 -4.60 118.16 114.96 2xdw n LYS 585 Ca -0.03 -0.49 0.14 0.00 -2.02 0.00 0.00 58.31 55.91 2xdw n LYS 585 Cb 0.75 -0.99 0.70 0.00 -0.02 0.00 0.00 35.03 35.47 2xdw n LYS 585 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2xdw h PHE 586 N 0.02 0.00 0.00 2.13 -5.15 -1.61 -1.22 116.94 111.11 2xdw h PHE 586 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 2xdw h PHE 586 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.17 2xdw h PHE 586 CO 0.00 0.00 0.00 -2.39 -2.00 0.00 0.00 178.31 173.92 2xdw n HIS 587 N -4.35 0.40 0.31 6.09 1.44 -1.26 -3.33 115.22 114.51 2xdw n HIS 587 Ca 0.02 0.14 0.14 0.00 -2.01 0.00 0.00 57.72 56.01 2xdw n HIS 587 Cb 0.31 -0.72 0.40 0.00 0.12 0.00 0.00 29.99 30.10 2xdw n HIS 587 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 2xdw h LYS 588 N 0.00 0.00 -6.59 -1.40 1.57 -1.56 -3.21 116.57 105.38 2xdw h LYS 588 Ca 0.00 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.09 2xdw h LYS 588 Cb 0.44 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.51 2xdw h LYS 588 CO 0.00 0.00 -0.83 0.71 -0.57 0.00 0.00 179.45 178.76 2xdw s TYR 589 N -3.36 2.49 0.00 -1.35 2.02 -1.21 -4.20 117.35 111.74 2xdw s TYR 589 Ca 0.05 -0.30 0.00 0.00 -0.37 0.00 0.00 57.07 56.45 2xdw s TYR 589 Cb 0.08 -1.47 0.00 0.00 -0.40 0.00 0.00 41.96 40.17 2xdw s TYR 589 CO 0.59 0.19 0.00 0.25 -1.57 0.00 0.00 175.55 175.01 2xdw n THR 590 N 1.78 0.00 -0.35 -0.71 -2.24 -0.18 -0.22 114.28 112.35 2xdw n THR 590 Ca -0.16 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.73 2xdw n THR 590 Cb 0.52 0.00 0.31 0.00 -2.10 0.00 0.00 70.33 69.06 2xdw n THR 590 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2xdw n ILE 591 N 0.00 1.00 0.13 2.28 0.13 -1.26 -1.09 119.36 120.55 2xdw n ILE 591 Ca 0.00 -1.00 0.18 0.00 -1.10 0.00 0.00 62.75 60.83 2xdw n ILE 591 Cb 0.00 0.50 0.76 0.00 -0.84 0.00 0.00 39.64 40.07 2xdw n ILE 591 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 2xdw h GLY 592 N 4.08 0.00 1.39 4.50 0.00 -0.78 -0.80 103.07 111.46 2xdw h GLY 592 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.40 2xdw h GLY 592 CO 0.00 0.00 0.24 1.12 0.00 0.00 0.00 176.54 177.90 2xdw h HIS 593 N 0.00 0.00 0.00 5.60 2.07 -1.74 -1.56 115.15 119.52 2xdw h HIS 593 Ca 0.15 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.67 2xdw h HIS 593 Cb 0.73 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.71 2xdw h HIS 593 CO 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 2xdw h ALA 594 N 1.77 1.00 -0.00 6.11 0.00 -1.50 -3.18 119.26 123.46 2xdw h ALA 594 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2xdw h ALA 594 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2xdw h ALA 594 CO -0.00 0.00 -0.08 0.91 0.00 0.00 0.00 179.25 180.07 2xdw n TRP 595 N -2.97 0.00 0.31 0.00 8.01 -0.59 -2.00 117.44 120.20 2xdw n TRP 595 Ca 0.02 0.00 0.20 0.00 -1.31 0.00 0.00 57.50 56.40 2xdw n TRP 595 Cb 0.34 -0.13 0.97 0.00 -2.01 0.00 0.00 31.31 30.48 2xdw n TRP 595 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.69 178.47 2xdw h THR 596 N 0.74 0.00 0.00 -0.99 1.35 -1.71 -1.46 112.91 110.84 2xdw h THR 596 Ca 0.00 -0.16 -0.05 0.00 -0.55 0.00 0.00 66.41 65.65 2xdw h THR 596 Cb 0.33 1.09 -0.01 0.00 -1.73 0.00 0.00 68.15 67.83 2xdw h THR 596 CO 0.00 0.00 -0.25 0.71 -0.25 0.00 0.00 175.52 175.73 2xdw h THR 597 N 0.00 0.90 0.07 6.82 1.35 -1.86 0.38 112.91 120.58 2xdw h THR 597 Ca 0.00 -0.94 -0.37 0.00 -0.55 0.00 0.00 66.41 64.55 2xdw h THR 597 Cb 0.16 1.55 -0.04 0.00 -1.73 0.00 0.00 68.15 68.10 2xdw h THR 597 CO 0.00 0.24 -2.16 0.47 -0.25 0.00 0.00 175.52 173.82 2xdw n ASP 598 N -3.85 1.94 -0.03 5.36 9.92 -0.61 -4.74 116.55 124.54 2xdw n ASP 598 Ca -0.02 0.09 0.01 0.00 -0.53 0.00 0.00 54.79 54.35 2xdw n ASP 598 Cb 0.34 -0.60 -0.15 0.00 -0.64 0.00 0.00 41.12 40.07 2xdw n ASP 598 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2xdw n TYR 599 N -3.36 0.18 -1.15 1.24 4.01 -0.81 -0.39 117.16 116.88 2xdw n TYR 599 Ca -0.36 0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.44 2xdw n TYR 599 Cb 1.03 -0.80 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 2xdw n TYR 599 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2xdw n GLY 600 N 1.46 -2.54 2.97 2.72 0.00 0.12 -4.55 105.19 105.37 2xdw n GLY 600 Ca -0.16 -1.69 -0.13 0.00 0.00 0.00 0.00 46.02 44.04 2xdw n GLY 600 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdw n SER 602 N 3.39 0.08 0.29 0.00 3.41 -1.26 -1.64 113.62 117.89 2xdw n SER 602 Ca -0.17 0.53 0.17 0.00 -0.26 0.00 0.00 58.87 59.13 2xdw n SER 602 Cb 0.57 -0.54 0.86 0.00 -0.26 0.00 0.00 64.21 64.84 2xdw n SER 602 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2xdw h ASP 603 N 0.00 0.00 -3.27 4.04 3.32 -1.96 -3.41 116.42 115.13 2xdw h ASP 603 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 2xdw h ASP 603 Cb 0.17 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.64 2xdw h ASP 603 CO 0.00 0.06 -0.15 -0.55 -1.72 0.00 0.00 179.24 176.87 2xdw s SER 604 N -5.78 6.71 0.23 6.45 0.15 -0.65 -4.99 113.70 115.82 2xdw s SER 604 Ca -0.03 0.85 -0.07 0.00 0.70 0.00 0.00 55.95 57.40 2xdw s SER 604 Cb 0.12 -2.28 0.25 0.00 -1.71 0.00 0.00 66.02 62.40 2xdw s SER 604 CO 0.53 0.07 1.89 0.50 1.20 0.00 0.00 173.24 177.42 2xdw h LYS 605 N 6.29 1.08 -0.23 5.44 3.64 -1.88 0.38 116.57 131.30 2xdw h LYS 605 Ca -0.43 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2xdw h LYS 605 Cb 1.19 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 2xdw h LYS 605 CO 0.73 0.72 0.14 0.37 -2.27 0.00 0.00 179.45 179.13 2xdw h GLN 606 N 1.12 0.32 -0.44 1.90 4.15 -1.94 -2.36 115.11 117.85 2xdw h GLN 606 Ca 0.34 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.61 2xdw h GLN 606 Cb -0.04 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 2xdw h GLN 606 CO -0.10 0.26 -0.19 0.45 -1.93 0.00 0.00 178.83 177.32 2xdw h HIS 607 N 0.29 0.99 -0.88 3.99 3.86 -1.73 -2.71 115.15 118.95 2xdw h HIS 607 Ca 0.08 -0.22 0.13 0.00 -1.16 0.00 0.00 60.37 59.20 2xdw h HIS 607 Cb 0.03 -0.24 -0.09 0.00 1.06 0.00 0.00 27.41 28.17 2xdw h HIS 607 CO -0.04 0.99 0.50 0.35 0.86 0.00 0.00 177.93 180.58 2xdw h PHE 608 N 0.77 0.90 -0.02 2.45 3.57 -0.77 -0.29 116.94 123.54 2xdw h PHE 608 Ca 0.11 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.58 2xdw h PHE 608 Cb 0.73 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 2xdw h PHE 608 CO 0.04 0.30 -0.29 0.93 -2.23 0.00 0.00 178.31 177.06 2xdw h GLU 609 N 0.77 0.04 0.16 1.11 4.39 -1.10 -0.11 114.58 119.84 2xdw h GLU 609 Ca 0.45 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 60.14 2xdw h GLU 609 Cb 0.54 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2xdw h GLU 609 CO -0.30 0.32 -0.08 -1.49 -1.16 0.00 0.00 179.01 176.30 2xdw h TRP 610 N 0.03 -0.21 -0.77 4.33 6.55 -1.19 -3.37 115.95 121.33 2xdw h TRP 610 Ca 0.00 -0.00 -0.00 0.00 0.95 0.00 0.00 58.89 59.83 2xdw h TRP 610 Cb 0.53 0.07 -0.04 0.00 -0.86 0.00 0.00 29.16 28.86 2xdw h TRP 610 CO 0.00 0.21 0.46 -0.07 -1.05 0.00 0.00 178.44 177.99 2xdw h LEU 611 N -0.71 0.92 -2.05 -4.49 3.38 -0.70 -2.73 115.31 108.93 2xdw h LEU 611 Ca -0.02 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2xdw h LEU 611 Cb 0.51 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 2xdw h LEU 611 CO 0.04 0.72 -0.09 -0.29 0.09 0.00 0.00 178.44 178.90 2xdw h ILE 612 N 1.05 0.61 0.00 1.22 6.09 -1.19 0.08 117.51 125.37 2xdw h ILE 612 Ca 0.28 -0.38 -0.04 0.00 -1.37 0.00 0.00 64.86 63.34 2xdw h ILE 612 Cb -0.04 1.24 -0.01 0.00 0.47 0.00 0.00 36.82 38.48 2xdw h ILE 612 CO -0.05 0.09 -0.20 0.11 -3.07 0.00 0.00 178.15 175.02 2xdw h LYS 613 N 0.00 0.00 0.00 2.19 1.57 -1.64 -3.36 116.57 115.33 2xdw h LYS 613 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2xdw h LYS 613 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2xdw h LYS 613 CO 0.01 0.20 -0.06 2.48 -0.57 0.00 0.00 179.45 181.51 2xdw n TYR 614 N -3.25 0.00 -1.67 -1.35 0.18 -0.90 -4.99 117.16 105.17 2xdw n TYR 614 Ca 0.01 0.00 -0.54 0.00 1.88 0.00 0.00 57.90 59.25 2xdw n TYR 614 Cb 0.49 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.39 2xdw n TYR 614 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2xdw n SER 615 N -0.65 2.67 -0.36 9.48 2.88 -0.03 -4.75 113.62 122.85 2xdw n SER 615 Ca 0.00 0.97 0.05 0.00 -1.33 0.00 0.00 58.87 58.56 2xdw n SER 615 Cb 0.00 -1.22 0.21 0.00 -0.75 0.00 0.00 64.21 62.45 2xdw n SER 615 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2xdw h PRO 616 N 8.37 1.04 0.00 -1.46 0.11 -1.87 -1.30 132.00 136.89 2xdw h PRO 616 Ca -0.45 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2xdw h PRO 616 Cb 1.31 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 2xdw h PRO 616 CO 0.97 0.69 -0.06 1.25 -0.21 0.00 0.00 178.00 180.64 2xdw h LEU 617 N 1.07 0.00 -2.25 2.35 5.85 -1.64 -2.79 115.31 117.90 2xdw h LEU 617 Ca 0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.19 2xdw h LEU 617 Cb 0.35 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.38 2xdw h LEU 617 CO -0.23 0.06 0.00 1.41 -0.34 0.00 0.00 178.44 179.34 2xdw n HIS 618 N -3.77 0.34 -1.80 1.25 8.25 -0.52 -4.47 115.22 114.50 2xdw n HIS 618 Ca -0.02 -0.26 0.05 0.00 -0.26 0.00 0.00 57.72 57.22 2xdw n HIS 618 Cb 0.15 -0.01 0.09 0.00 1.12 0.00 0.00 29.99 31.34 2xdw n HIS 618 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2xdw n ASN 619 N 0.89 1.20 -4.66 0.41 3.02 -1.05 -4.97 115.26 110.10 2xdw n ASN 619 Ca 0.13 -2.68 -0.43 0.00 -0.03 0.00 0.00 54.58 51.57 2xdw n ASN 619 Cb 0.44 -0.35 -0.02 0.00 -0.61 0.00 0.00 39.78 39.24 2xdw n ASN 619 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2xdw s VAL 620 N -1.42 4.23 -0.17 2.41 1.01 -1.24 -4.84 120.40 120.39 2xdw s VAL 620 Ca 0.25 1.49 -0.10 0.00 0.00 0.00 0.00 61.98 63.61 2xdw s VAL 620 Cb 0.25 -3.96 0.06 0.00 0.00 0.00 0.00 36.38 32.72 2xdw s VAL 620 CO -0.05 -0.13 0.41 -0.75 0.00 0.00 0.00 175.10 174.57 2xdw s LYS 621 N 3.55 0.40 0.16 2.72 2.20 -1.26 -5.03 119.74 122.47 2xdw s LYS 621 Ca 0.56 0.75 -0.34 0.00 -0.36 0.00 0.00 55.97 56.58 2xdw s LYS 621 Cb -0.22 0.02 -0.14 0.00 -1.51 0.00 0.00 37.83 35.97 2xdw s LYS 621 CO 0.16 -0.14 1.52 1.28 -0.36 0.00 0.00 175.35 177.80 2xdw n LEU 622 N 4.03 2.84 -4.77 5.43 4.77 -1.26 -4.90 117.00 123.12 2xdw n LEU 622 Ca -0.22 1.09 -0.41 0.00 -0.03 0.00 0.00 56.01 56.45 2xdw n LEU 622 Cb 0.55 -1.39 -0.01 0.00 -2.33 0.00 0.00 43.42 40.25 2xdw n LEU 622 CO 0.09 -0.44 1.06 -2.84 -1.33 0.00 0.00 177.39 173.93 2xdw s PRO 623 N 0.71 4.21 0.19 3.23 0.02 -1.26 -4.90 135.00 137.21 2xdw s PRO 623 Ca 0.79 2.41 -0.10 0.00 0.02 0.00 0.00 61.00 64.11 2xdw s PRO 623 Cb -0.72 -3.01 0.11 0.00 0.02 0.00 0.00 34.50 30.90 2xdw s PRO 623 CO 0.40 -0.38 1.75 0.93 -0.33 0.00 0.00 177.00 179.38 2xdw h GLU 624 N 3.16 1.01 -6.67 5.54 5.08 -1.90 -3.44 114.58 117.36 2xdw h GLU 624 Ca -0.50 -0.18 -0.52 0.00 -1.00 0.00 0.00 59.36 57.16 2xdw h GLU 624 Cb 1.23 -0.17 0.03 0.00 0.50 0.00 0.00 28.75 30.34 2xdw h GLU 624 CO 0.65 0.84 0.61 0.00 -1.00 0.00 0.00 179.01 180.10 2xdw s ALA 625 N -5.57 3.48 0.48 3.43 0.00 -1.26 -4.93 121.76 117.39 2xdw s ALA 625 Ca -0.13 1.03 0.14 0.00 0.00 0.00 0.00 51.96 53.01 2xdw s ALA 625 Cb 0.14 -3.45 1.15 0.00 0.00 0.00 0.00 23.12 20.96 2xdw s ALA 625 CO 0.81 -0.46 2.10 -0.44 0.00 0.00 0.00 175.76 177.77 2xdw h ASP 626 N 5.32 0.16 -0.03 0.00 3.32 -2.03 -2.16 116.42 121.00 2xdw h ASP 626 Ca -0.45 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2xdw h ASP 626 Cb 1.21 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2xdw h ASP 626 CO 0.76 0.11 0.00 -0.90 -1.72 0.00 0.00 179.24 177.49 2xdw n ASP 627 N -4.50 1.09 -4.31 6.45 5.75 -1.26 -4.82 116.55 114.94 2xdw n ASP 627 Ca 0.01 -1.41 -0.33 0.00 -0.01 0.00 0.00 54.79 53.05 2xdw n ASP 627 Cb 0.16 -0.02 -0.15 0.00 -1.03 0.00 0.00 41.12 40.08 2xdw n ASP 627 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2xdw s ILE 628 N -1.97 2.92 0.49 2.12 1.01 -0.81 -5.11 121.20 119.85 2xdw s ILE 628 Ca 0.39 -0.69 0.02 0.00 0.00 0.00 0.00 60.65 60.37 2xdw s ILE 628 Cb 0.20 -2.25 -0.02 0.00 0.01 0.00 0.00 42.46 40.40 2xdw s ILE 628 CO 0.33 0.51 0.01 0.00 0.00 0.00 0.00 174.94 175.78 2xdw s GLN 629 N 0.73 2.16 0.51 2.79 -2.07 -1.26 -4.53 119.66 117.98 2xdw s GLN 629 Ca -0.06 -2.36 -0.20 0.00 -1.82 0.00 0.00 55.36 50.93 2xdw s GLN 629 Cb -0.15 -1.52 -0.08 0.00 -1.09 0.00 0.00 33.01 30.17 2xdw s GLN 629 CO 0.01 -0.32 1.06 0.71 -1.32 0.00 0.00 175.29 175.43 2xdw s TYR 630 N -2.86 2.92 0.95 9.60 1.51 -1.26 -4.60 117.35 123.60 2xdw s TYR 630 Ca 0.10 1.57 -0.10 0.00 -1.01 0.00 0.00 57.07 57.62 2xdw s TYR 630 Cb 0.03 -3.11 0.17 0.00 -0.11 0.00 0.00 41.96 38.93 2xdw s TYR 630 CO 0.05 -1.02 1.13 -1.25 -1.11 0.00 0.00 175.55 173.35 2xdw s PRO 631 N -3.30 0.72 0.27 -1.71 0.04 -1.26 -4.66 135.00 125.10 2xdw s PRO 631 Ca 0.68 1.46 -0.31 0.00 0.04 0.00 0.00 61.00 62.88 2xdw s PRO 631 Cb -0.18 -1.70 -0.12 0.00 0.04 0.00 0.00 34.50 32.54 2xdw s PRO 631 CO 0.23 -2.81 1.63 -1.12 0.04 0.00 0.00 177.00 174.97 2xdw s SER 632 N -2.64 6.37 -0.04 6.66 0.01 -0.78 -4.81 113.70 118.47 2xdw s SER 632 Ca 0.67 2.93 0.03 0.00 1.31 0.00 0.00 55.95 60.88 2xdw s SER 632 Cb -0.23 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.38 2xdw s SER 632 CO 0.59 -0.93 -0.11 -0.04 0.41 0.00 0.00 173.24 173.16 2xdw s MET 633 N -0.00 1.27 -0.12 12.44 -1.94 -0.03 -0.61 119.30 130.30 2xdw s MET 633 Ca 0.67 -0.38 0.01 0.00 -1.71 0.00 0.00 55.69 54.28 2xdw s MET 633 Cb -0.48 -1.13 0.02 0.00 2.01 0.00 0.00 34.83 35.24 2xdw s MET 633 CO 0.43 0.11 -0.14 -1.17 -0.01 0.00 0.00 175.02 174.24 2xdw s LEU 634 N 0.30 1.68 -0.18 -0.03 2.96 -0.17 -0.70 118.68 122.55 2xdw s LEU 634 Ca -0.06 -0.44 -0.08 0.00 -0.22 0.00 0.00 54.13 53.32 2xdw s LEU 634 Cb -0.11 -1.11 -0.04 0.00 0.50 0.00 0.00 46.19 45.42 2xdw s LEU 634 CO 0.01 -0.02 0.09 -0.76 -1.32 0.00 0.00 176.35 174.36 2xdw s LEU 635 N 1.21 3.99 -0.16 -0.68 1.43 0.04 -1.20 118.68 123.31 2xdw s LEU 635 Ca -0.02 0.17 -0.00 0.00 -1.03 0.00 0.00 54.13 53.25 2xdw s LEU 635 Cb -0.14 -2.01 -0.00 0.00 0.03 0.00 0.00 46.19 44.06 2xdw s LEU 635 CO -0.05 0.20 -0.14 -0.76 0.23 0.00 0.00 176.35 175.83 2xdw s LEU 636 N 0.21 2.56 0.00 1.79 1.43 -0.54 -0.96 118.68 123.18 2xdw s LEU 636 Ca 0.06 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 2xdw s LEU 636 Cb -0.12 -1.59 -0.00 0.00 0.03 0.00 0.00 46.19 44.51 2xdw s LEU 636 CO -0.00 0.09 0.22 1.07 0.23 0.00 0.00 176.35 177.95 2xdw n THR 637 N 4.03 0.00 -3.69 5.49 5.66 -0.67 -0.12 114.28 124.98 2xdw n THR 637 Ca -0.19 -1.08 -0.12 0.00 -3.05 0.00 0.00 64.05 59.61 2xdw n THR 637 Cb 0.52 0.61 -0.07 0.00 -1.55 0.00 0.00 70.33 69.84 2xdw n THR 637 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2xdw s ALA 638 N -2.41 -0.92 -0.92 1.79 0.00 -1.26 -1.17 121.76 116.86 2xdw s ALA 638 Ca 0.18 0.23 0.22 0.00 0.00 0.00 0.00 51.96 52.58 2xdw s ALA 638 Cb 0.00 0.34 0.91 0.00 0.00 0.00 0.00 23.12 24.37 2xdw s ALA 638 CO 0.13 -0.44 1.70 -0.40 0.00 0.00 0.00 175.76 176.74 2xdw n ASP 639 N 0.53 0.14 -0.90 0.00 5.75 -0.38 -1.93 116.55 119.77 2xdw n ASP 639 Ca -0.19 0.52 0.02 0.00 -0.01 0.00 0.00 54.79 55.14 2xdw n ASP 639 Cb 0.60 -0.56 0.21 0.00 -1.03 0.00 0.00 41.12 40.34 2xdw n ASP 639 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2xdw n HIS 640 N -1.65 0.81 -2.46 2.11 8.25 0.03 -4.37 115.22 117.95 2xdw n HIS 640 Ca 0.05 -1.32 -0.38 0.00 -0.26 0.00 0.00 57.72 55.81 2xdw n HIS 640 Cb 0.26 -0.38 -0.03 0.00 1.12 0.00 0.00 29.99 30.97 2xdw n HIS 640 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2xdw s ASP 641 N -2.48 6.26 0.00 0.41 -1.08 -0.81 -4.03 116.67 114.94 2xdw s ASP 641 Ca 0.42 -1.45 0.28 0.00 -0.52 0.00 0.00 52.55 51.28 2xdw s ASP 641 Cb 0.37 -2.57 1.16 0.00 -1.46 0.00 0.00 42.92 40.42 2xdw s ASP 641 CO 0.02 -1.74 1.80 -0.90 0.52 0.00 0.00 175.17 174.88 2xdw n ASP 642 N 9.90 1.29 0.01 -0.34 5.75 -1.25 -3.13 116.55 128.79 2xdw n ASP 642 Ca 0.37 -1.44 -0.07 0.00 -0.01 0.00 0.00 54.79 53.64 2xdw n ASP 642 Cb 0.49 -0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.53 2xdw n ASP 642 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 2xdw h ARG 643 N 2.00 -0.14 -4.53 0.11 9.65 -1.93 -3.42 114.38 116.13 2xdw h ARG 643 Ca 0.00 0.01 -0.67 0.00 -1.10 0.00 0.00 59.98 58.21 2xdw h ARG 643 Cb 0.43 0.03 -0.38 0.00 -1.39 0.00 0.00 29.97 28.66 2xdw h ARG 643 CO 0.00 0.18 -0.63 0.08 2.80 0.00 0.00 179.97 182.40 2xdw s VAL 644 N -2.42 2.76 0.33 0.20 1.01 -1.25 -4.64 120.40 116.39 2xdw s VAL 644 Ca -0.08 -2.27 -0.28 0.00 0.00 0.00 0.00 61.98 59.34 2xdw s VAL 644 Cb -0.00 -2.95 -0.12 0.00 0.00 0.00 0.00 36.38 33.30 2xdw s VAL 644 CO 0.28 -0.65 1.34 1.33 0.00 0.00 0.00 175.10 177.40 2xdw n VAL 645 N 4.34 1.85 0.36 2.92 0.24 -1.18 -4.78 118.33 122.07 2xdw n VAL 645 Ca 0.01 -0.46 0.11 0.00 -2.04 0.00 0.00 64.34 61.96 2xdw n VAL 645 Cb 0.41 -1.63 0.48 0.00 -1.47 0.00 0.00 33.84 31.63 2xdw n VAL 645 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2xdw n PRO 646 N 0.76 0.16 -0.12 7.34 -0.04 -1.25 -1.94 135.00 139.91 2xdw n PRO 646 Ca 0.05 0.44 0.27 0.00 -0.04 0.00 0.00 63.50 64.22 2xdw n PRO 646 Cb 0.36 -1.84 0.72 0.00 -0.04 0.00 0.00 33.50 32.69 2xdw n PRO 646 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 2xdw h LEU 647 N 0.00 0.00 0.19 1.53 8.10 -1.88 -0.61 115.31 122.64 2xdw h LEU 647 Ca 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 57.99 2xdw h LEU 647 Cb 0.29 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.50 2xdw h LEU 647 CO 0.00 0.00 -0.12 0.45 -4.11 0.00 0.00 178.44 174.66 2xdw h HIS 648 N 0.00 -0.31 -0.17 0.17 3.86 -1.70 -0.70 115.15 116.29 2xdw h HIS 648 Ca 0.38 -0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.45 2xdw h HIS 648 Cb 1.66 0.11 -0.01 0.00 1.06 0.00 0.00 27.41 30.23 2xdw h HIS 648 CO 0.00 -0.19 -0.49 0.77 0.86 0.00 0.00 177.93 178.88 2xdw h SER 649 N -0.30 0.49 -0.13 2.45 0.02 -1.38 -2.42 113.55 112.27 2xdw h SER 649 Ca -0.02 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.69 2xdw h SER 649 Cb 0.26 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 2xdw h SER 649 CO 0.01 0.90 0.08 -0.07 -1.14 0.00 0.00 176.83 176.60 2xdw h LEU 650 N 0.36 0.17 -0.71 5.07 3.38 -0.95 -1.03 115.31 121.60 2xdw h LEU 650 Ca 0.02 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 2xdw h LEU 650 Cb 0.98 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 2xdw h LEU 650 CO 0.09 0.19 -0.20 0.11 0.09 0.00 0.00 178.44 178.72 2xdw h LYS 651 N 0.13 0.78 -0.29 1.13 1.57 -1.17 -2.18 116.57 116.54 2xdw h LYS 651 Ca 0.05 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.48 2xdw h LYS 651 Cb 0.06 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 2xdw h LYS 651 CO -0.01 0.92 0.02 0.35 -0.57 0.00 0.00 179.45 180.16 2xdw h PHE 652 N 0.69 0.55 -0.30 -1.35 3.57 -1.28 -1.95 116.94 116.86 2xdw h PHE 652 Ca 0.10 -0.09 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 2xdw h PHE 652 Cb 0.70 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.28 2xdw h PHE 652 CO 0.04 0.63 -0.16 0.97 -2.23 0.00 0.00 178.31 177.56 2xdw h ILE 653 N 0.31 1.24 -0.93 1.41 6.09 -1.11 0.25 117.51 124.78 2xdw h ILE 653 Ca 0.09 -1.11 -0.01 0.00 -1.37 0.00 0.00 64.86 62.46 2xdw h ILE 653 Cb 0.40 1.18 -0.04 0.00 0.47 0.00 0.00 36.82 38.83 2xdw h ILE 653 CO 0.01 0.36 0.54 0.00 -3.07 0.00 0.00 178.15 176.00 2xdw h ALA 654 N 1.35 1.18 -0.15 0.18 0.00 -1.25 -0.80 119.26 119.77 2xdw h ALA 654 Ca 0.08 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2xdw h ALA 654 Cb 0.56 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2xdw h ALA 654 CO 0.04 0.65 -0.11 1.15 0.00 0.00 0.00 179.25 180.97 2xdw h THR 655 N 1.28 1.33 -0.47 0.00 2.02 -0.84 -1.76 112.91 114.48 2xdw h THR 655 Ca 0.33 -1.23 0.04 0.00 0.77 0.00 0.00 66.41 66.32 2xdw h THR 655 Cb -0.03 1.81 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 2xdw h THR 655 CO -0.06 0.36 0.23 -0.07 0.37 0.00 0.00 175.52 176.36 2xdw h LEU 656 N -0.01 0.34 -1.00 2.58 3.38 -0.74 -0.32 115.31 119.55 2xdw h LEU 656 Ca 0.03 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 2xdw h LEU 656 Cb 0.62 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2xdw h LEU 656 CO 0.03 0.24 -0.23 1.56 0.09 0.00 0.00 178.44 180.13 2xdw h GLN 657 N 0.46 0.45 0.02 1.13 4.20 -1.07 -0.32 115.11 119.97 2xdw h GLN 657 Ca 0.20 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 2xdw h GLN 657 Cb 0.11 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2xdw h GLN 657 CO -0.15 0.65 -0.01 -0.92 -0.67 0.00 0.00 178.83 177.74 2xdw h TYR 658 N 0.40 -0.03 -0.09 2.96 3.20 -0.96 -2.04 116.97 120.42 2xdw h TYR 658 Ca 0.06 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.81 2xdw h TYR 658 Cb 0.63 0.01 0.01 0.00 1.54 0.00 0.00 36.73 38.91 2xdw h TYR 658 CO 0.02 0.70 -0.44 0.82 -1.64 0.00 0.00 178.16 177.62 2xdw h ILE 659 N -0.93 1.39 0.00 1.81 1.08 -1.11 -3.33 117.51 116.41 2xdw h ILE 659 Ca -0.00 -1.80 -0.36 0.00 -0.39 0.00 0.00 64.86 62.31 2xdw h ILE 659 Cb 0.74 2.26 -0.06 0.00 -3.07 0.00 0.00 36.82 36.68 2xdw h ILE 659 CO 0.00 0.53 -2.27 0.52 -0.69 0.00 0.00 178.15 176.24 2xdw n VAL 660 N -4.30 1.27 0.23 1.67 0.31 -0.31 -4.50 118.33 112.69 2xdw n VAL 660 Ca -0.08 -0.40 0.07 0.00 -0.01 0.00 0.00 64.34 63.92 2xdw n VAL 660 Cb 0.57 -1.56 0.57 0.00 -0.91 0.00 0.00 33.84 32.52 2xdw n VAL 660 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2xdw h GLY 661 N 0.37 0.05 2.00 2.92 0.00 -0.61 -1.76 103.07 106.04 2xdw h GLY 661 Ca -0.54 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 46.77 2xdw h GLY 661 CO -0.22 0.02 0.00 3.21 0.00 0.00 0.00 176.54 179.55 2xdw h ARG 662 N 0.05 0.00 -6.85 4.80 3.08 -1.50 -3.46 114.38 110.49 2xdw h ARG 662 Ca 0.01 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.57 2xdw h ARG 662 Cb 0.11 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.17 2xdw h ARG 662 CO 0.01 0.00 0.44 -1.54 -1.07 0.00 0.00 179.97 177.81 2xdw s SER 663 N -4.60 7.14 0.39 7.04 1.04 -0.66 -4.93 113.70 119.13 2xdw s SER 663 Ca 0.07 2.16 0.10 0.00 0.48 0.00 0.00 55.95 58.76 2xdw s SER 663 Cb 0.10 -2.61 0.81 0.00 0.10 0.00 0.00 66.02 64.42 2xdw s SER 663 CO 0.50 -0.23 1.92 0.03 0.98 0.00 0.00 173.24 176.44 2xdw h ARG 664 N 3.41 0.19 0.00 4.02 3.08 -1.89 -2.18 114.38 121.02 2xdw h ARG 664 Ca -0.47 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.53 2xdw h ARG 664 Cb 1.21 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.23 2xdw h ARG 664 CO 0.65 0.35 0.00 0.36 -1.07 0.00 0.00 179.97 180.26 2xdw n LYS 665 N -4.27 0.13 -2.83 0.04 2.85 -1.26 -4.64 118.16 108.18 2xdw n LYS 665 Ca -0.01 0.21 -0.43 0.00 -1.05 0.00 0.00 58.31 57.03 2xdw n LYS 665 Cb 0.27 -1.69 -0.04 0.00 -0.65 0.00 0.00 35.03 32.92 2xdw n LYS 665 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 2xdw s GLN 666 N -3.11 3.52 -0.00 -1.58 2.00 -0.82 -4.82 119.66 114.85 2xdw s GLN 666 Ca 0.09 0.14 0.07 0.00 -2.00 0.00 0.00 55.36 53.66 2xdw s GLN 666 Cb 0.13 -3.93 -0.09 0.00 0.80 0.00 0.00 33.01 29.92 2xdw s GLN 666 CO 0.48 -1.21 0.25 0.09 -0.50 0.00 0.00 175.29 174.39 2xdw n ASN 667 N 7.13 1.36 -4.74 6.67 4.13 -1.26 -4.88 115.26 123.67 2xdw n ASN 667 Ca 0.06 -0.44 -0.41 0.00 1.68 0.00 0.00 54.58 55.47 2xdw n ASN 667 Cb 0.48 1.11 -0.04 0.00 -1.54 0.00 0.00 39.78 39.80 2xdw n ASN 667 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 2xdw s ASN 668 N -2.06 7.32 0.57 6.41 0.01 -1.26 -4.73 114.94 121.19 2xdw s ASN 668 Ca 0.01 2.02 -0.18 0.00 -0.71 0.00 0.00 52.86 54.00 2xdw s ASN 668 Cb 0.05 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 39.06 2xdw s ASN 668 CO 0.29 -0.18 1.09 -2.16 -1.51 0.00 0.00 177.10 174.63 2xdw s PRO 669 N -0.26 3.32 -0.31 -0.60 0.04 -1.26 -4.78 135.00 131.15 2xdw s PRO 669 Ca 0.49 1.43 -0.00 0.00 0.04 0.00 0.00 61.00 62.96 2xdw s PRO 669 Cb -0.28 -2.02 0.10 0.00 0.04 0.00 0.00 34.50 32.34 2xdw s PRO 669 CO 0.33 -0.84 0.09 -0.51 0.04 0.00 0.00 177.00 176.11 2xdw s LEU 670 N -4.10 2.57 0.14 -3.56 1.43 -1.26 -0.85 118.68 113.05 2xdw s LEU 670 Ca 0.68 -1.68 0.07 0.00 -1.03 0.00 0.00 54.13 52.17 2xdw s LEU 670 Cb -0.20 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 2xdw s LEU 670 CO 0.30 -0.41 -0.16 -0.76 0.23 0.00 0.00 176.35 175.56 2xdw s LEU 671 N 1.52 2.41 0.06 1.79 1.43 0.12 -4.87 118.68 121.15 2xdw s LEU 671 Ca 0.09 -0.82 0.08 0.00 -1.03 0.00 0.00 54.13 52.45 2xdw s LEU 671 Cb -0.17 -0.68 -0.03 0.00 0.03 0.00 0.00 46.19 45.34 2xdw s LEU 671 CO -0.22 -0.09 -0.21 -0.51 0.23 0.00 0.00 176.35 175.55 2xdw s ILE 672 N -2.03 1.72 -0.11 -0.59 2.07 -1.26 -0.78 121.20 120.22 2xdw s ILE 672 Ca 0.11 -1.30 0.02 0.00 -1.41 0.00 0.00 60.65 58.07 2xdw s ILE 672 Cb -0.06 -1.51 0.01 0.00 0.13 0.00 0.00 42.46 41.04 2xdw s ILE 672 CO 0.04 0.16 -0.16 -2.28 -1.91 0.00 0.00 174.94 170.79 2xdw s HIS 673 N -0.88 2.02 -0.33 3.50 5.65 -0.13 -4.41 115.29 120.70 2xdw s HIS 673 Ca 0.08 -0.93 -0.06 0.00 0.25 0.00 0.00 55.06 54.40 2xdw s HIS 673 Cb -0.09 -1.44 0.04 0.00 -1.18 0.00 0.00 32.58 29.91 2xdw s HIS 673 CO 0.02 -0.46 0.09 0.08 -0.65 0.00 0.00 174.74 173.82 2xdw s VAL 674 N 0.90 3.71 0.65 0.89 1.01 -1.26 -1.68 120.40 124.63 2xdw s VAL 674 Ca -0.08 -1.13 -0.11 0.00 0.00 0.00 0.00 61.98 60.65 2xdw s VAL 674 Cb -0.15 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 2xdw s VAL 674 CO -0.00 -0.15 1.04 -0.62 0.00 0.00 0.00 175.10 175.37 2xdw s ASP 675 N 1.39 5.79 0.22 3.32 2.15 -0.32 -4.87 116.67 124.36 2xdw s ASP 675 Ca -0.02 1.55 0.07 0.00 0.43 0.00 0.00 52.55 54.58 2xdw s ASP 675 Cb -0.19 -2.49 -0.04 0.00 -0.30 0.00 0.00 42.92 39.90 2xdw s ASP 675 CO 0.02 -1.16 0.13 0.42 -0.17 0.00 0.00 175.17 174.41 2xdw s THR 676 N -3.04 4.23 -1.43 1.71 -4.23 -1.26 -1.25 115.64 110.38 2xdw s THR 676 Ca 0.57 -1.38 -0.06 0.00 -1.18 0.00 0.00 61.69 59.64 2xdw s THR 676 Cb -0.13 -3.23 0.03 0.00 1.34 0.00 0.00 72.50 70.51 2xdw s THR 676 CO 0.52 -0.25 0.50 0.29 -0.54 0.00 0.00 174.62 175.14 2xdw n LYS 677 N -0.77 -4.06 -3.88 3.99 5.02 -1.26 -4.93 118.16 112.27 2xdw n LYS 677 Ca -0.08 0.73 -0.09 0.00 -2.02 0.00 0.00 58.31 56.85 2xdw n LYS 677 Cb 0.57 -5.52 -0.07 0.00 -0.02 0.00 0.00 35.03 29.99 2xdw n LYS 677 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2xdw s ALA 678 N -3.05 -0.19 0.00 7.82 0.00 -1.02 -4.44 121.76 120.88 2xdw s ALA 678 Ca 0.31 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.58 2xdw s ALA 678 Cb -0.15 0.67 0.00 0.00 0.00 0.00 0.00 23.12 23.65 2xdw s ALA 678 CO 0.38 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 175.96 2xdw n GLY 679 N -0.15 5.54 0.22 0.00 0.00 -1.16 -0.79 105.19 108.86 2xdw n GLY 679 Ca -0.12 -1.12 0.05 0.00 0.00 0.00 0.00 46.02 44.84 2xdw n GLY 679 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2xdw h HIS 680 N 0.00 0.00 0.00 1.61 2.76 -1.77 -3.42 115.15 114.33 2xdw h HIS 680 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2xdw h HIS 680 Cb 0.00 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.96 2xdw h HIS 680 CO 0.00 0.21 0.00 0.41 -1.30 0.00 0.00 177.93 177.25 2xdw n GLY 681 N -0.91 1.92 3.75 5.26 0.00 -1.26 -4.94 105.19 109.00 2xdw n GLY 681 Ca -0.02 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 2xdw n GLY 681 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xdw s ALA 682 N 0.00 3.79 0.00 4.61 0.00 -1.26 -1.97 121.76 126.93 2xdw s ALA 682 Ca 0.00 1.59 0.00 0.00 0.00 0.00 0.00 51.96 53.55 2xdw s ALA 682 Cb 0.00 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.46 2xdw s ALA 682 CO 0.00 -0.99 0.00 0.41 0.00 0.00 0.00 175.76 175.18 2xdw n GLY 683 N 2.45 0.94 3.72 0.00 0.00 -1.26 -4.78 105.19 106.26 2xdw n GLY 683 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2xdw n GLY 683 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2xdw s LYS 684 N -0.08 4.12 0.58 1.61 2.20 -0.83 -4.76 119.74 122.58 2xdw s LYS 684 Ca 0.00 2.61 -0.19 0.00 -0.36 0.00 0.00 55.97 58.03 2xdw s LYS 684 Cb 0.00 -3.07 -0.04 0.00 -1.51 0.00 0.00 37.83 33.21 2xdw s LYS 684 CO 0.00 -0.74 1.18 -1.25 -0.36 0.00 0.00 175.35 174.18 2xdw s PRO 685 N 0.99 3.07 0.29 4.03 0.04 -1.26 -4.80 135.00 137.37 2xdw s PRO 685 Ca 0.74 1.73 0.02 0.00 0.04 0.00 0.00 61.00 63.53 2xdw s PRO 685 Cb -0.50 -1.95 0.73 0.00 0.04 0.00 0.00 34.50 32.82 2xdw s PRO 685 CO 0.34 -1.10 1.63 1.15 0.04 0.00 0.00 177.00 179.06 2xdw h THR 686 N 0.92 0.27 -0.88 1.26 2.02 -1.55 -0.79 112.91 114.16 2xdw h THR 686 Ca -0.50 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 66.62 2xdw h THR 686 Cb 1.28 0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.73 2xdw h THR 686 CO 0.55 0.03 0.55 0.00 0.37 0.00 0.00 175.52 177.03 2xdw h ALA 687 N 1.81 1.11 -0.22 6.16 0.00 -1.87 -0.86 119.26 125.39 2xdw h ALA 687 Ca 0.56 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 55.24 2xdw h ALA 687 Cb 1.15 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2xdw h ALA 687 CO -0.69 0.55 -0.50 0.87 0.00 0.00 0.00 179.25 179.48 2xdw h LYS 688 N 1.20 0.60 -0.39 0.00 1.57 -1.55 -2.22 116.57 115.79 2xdw h LYS 688 Ca 0.32 -0.36 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2xdw h LYS 688 Cb -0.09 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 2xdw h LYS 688 CO -0.06 0.96 0.22 0.28 -0.57 0.00 0.00 179.45 180.28 2xdw h VAL 689 N 0.48 1.03 -0.50 0.50 2.07 -0.65 -0.51 116.25 118.67 2xdw h VAL 689 Ca 0.02 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 2xdw h VAL 689 Cb 1.04 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2xdw h VAL 689 CO 0.10 0.08 0.28 0.40 0.02 0.00 0.00 177.57 178.45 2xdw h ILE 690 N 0.45 1.17 -0.75 4.57 2.04 -1.03 -1.41 117.51 122.56 2xdw h ILE 690 Ca 0.16 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.55 2xdw h ILE 690 Cb 0.02 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 2xdw h ILE 690 CO -0.08 0.18 0.34 -0.33 0.00 0.00 0.00 178.15 178.26 2xdw h GLU 691 N 0.66 1.09 -0.08 2.37 4.39 -1.13 -1.83 114.58 120.05 2xdw h GLU 691 Ca 0.18 -0.18 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 2xdw h GLU 691 Cb 0.05 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 28.50 2xdw h GLU 691 CO -0.03 0.87 0.04 1.49 -1.16 0.00 0.00 179.01 180.22 2xdw h GLU 692 N 1.06 0.12 -0.08 2.33 4.81 -0.66 -0.10 114.58 122.05 2xdw h GLU 692 Ca 0.25 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.37 2xdw h GLU 692 Cb 0.16 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 2xdw h GLU 692 CO -0.03 0.21 -0.37 -0.39 -0.73 0.00 0.00 179.01 177.70 2xdw h VAL 693 N -0.01 1.29 -0.50 0.32 -1.51 -1.24 -1.10 116.25 113.49 2xdw h VAL 693 Ca 0.03 -1.39 -0.08 0.00 -1.23 0.00 0.00 66.70 64.03 2xdw h VAL 693 Cb 0.14 1.65 -0.02 0.00 -2.13 0.00 0.00 31.29 30.92 2xdw h VAL 693 CO -0.00 0.41 0.02 0.28 -1.23 0.00 0.00 177.57 177.04 2xdw h SER 694 N 0.14 0.85 -0.44 4.19 0.02 -1.14 -1.05 113.55 116.12 2xdw h SER 694 Ca 0.01 -0.30 0.05 0.00 -0.84 0.00 0.00 61.79 60.71 2xdw h SER 694 Cb 0.73 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 63.00 2xdw h SER 694 CO 0.05 0.94 0.19 0.44 -1.14 0.00 0.00 176.83 177.32 2xdw h ASP 695 N 0.74 0.25 0.13 3.07 3.32 -0.60 -0.50 116.42 122.82 2xdw h ASP 695 Ca 0.14 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.22 2xdw h ASP 695 Cb 0.49 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 2xdw h ASP 695 CO 0.02 0.18 -0.06 0.24 -1.72 0.00 0.00 179.24 177.90 2xdw h MET 696 N 0.39 -0.16 0.00 3.56 2.86 -0.84 -1.25 114.93 119.49 2xdw h MET 696 Ca 0.20 0.01 -0.09 0.00 -2.06 0.00 0.00 59.70 57.76 2xdw h MET 696 Cb 0.15 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 2xdw h MET 696 CO -0.17 -0.02 -0.43 0.74 1.06 0.00 0.00 176.91 178.09 2xdw h PHE 697 N -0.27 0.00 -0.60 -0.22 0.04 -1.18 -1.87 116.94 112.84 2xdw h PHE 697 Ca -0.02 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.66 2xdw h PHE 697 Cb 0.22 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.35 2xdw h PHE 697 CO -0.04 0.43 0.02 0.00 -0.60 0.00 0.00 178.31 178.12 2xdw h ALA 698 N 1.57 0.80 -0.12 2.45 0.00 -1.01 -0.36 119.26 122.59 2xdw h ALA 698 Ca -0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2xdw h ALA 698 Cb 1.14 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2xdw h ALA 698 CO 0.06 0.63 0.05 0.35 0.00 0.00 0.00 179.25 180.34 2xdw h PHE 699 N 0.94 0.18 -0.26 0.00 3.57 -0.92 -0.49 116.94 119.96 2xdw h PHE 699 Ca 0.17 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.70 2xdw h PHE 699 Cb 0.53 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 2xdw h PHE 699 CO 0.04 0.26 0.02 0.82 -2.23 0.00 0.00 178.31 177.22 2xdw h ILE 700 N 0.06 0.85 -0.57 1.41 2.04 -1.24 -0.20 117.51 119.86 2xdw h ILE 700 Ca 0.04 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 2xdw h ILE 700 Cb 0.14 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 2xdw h ILE 700 CO -0.00 0.02 0.33 0.00 0.00 0.00 0.00 178.15 178.50 2xdw h ALA 701 N 1.21 0.72 -0.14 1.87 0.00 -0.84 -0.67 119.26 121.40 2xdw h ALA 701 Ca 0.12 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2xdw h ALA 701 Cb 0.14 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2xdw h ALA 701 CO -0.18 0.22 -0.18 -0.09 0.00 0.00 0.00 179.25 179.02 2xdw h ARG 702 N 0.76 0.38 -0.28 0.00 2.43 -0.86 0.62 114.38 117.45 2xdw h ARG 702 Ca 0.20 -0.21 -0.11 0.00 -0.81 0.00 0.00 59.98 59.05 2xdw h ARG 702 Cb 0.00 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2xdw h ARG 702 CO -0.04 0.78 -0.28 0.00 -1.51 0.00 0.00 179.97 178.92 2xdw n LEU 704 N -4.10 2.89 -3.64 0.00 4.77 -0.27 -5.00 117.00 111.65 2xdw n LEU 704 Ca -0.01 -0.96 -0.27 0.00 -0.03 0.00 0.00 56.01 54.74 2xdw n LEU 704 Cb 0.44 -0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.57 2xdw n LEU 704 CO 0.43 0.48 -0.07 -3.20 -1.33 0.00 0.00 177.39 173.70 2xdw n ASN 705 N 1.25 -4.54 -4.72 -1.43 5.15 0.08 -4.98 115.26 106.06 2xdw n ASN 705 Ca 0.14 -0.95 -0.36 0.00 -0.60 0.00 0.00 54.58 52.81 2xdw n ASN 705 Cb 0.58 -3.70 -0.07 0.00 -0.53 0.00 0.00 39.78 36.05 2xdw n ASN 705 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2xdw s ILE 706 N -3.52 5.33 0.31 -1.44 1.01 -0.42 -5.05 121.20 117.42 2xdw s ILE 706 Ca 0.37 0.45 -0.27 0.00 0.00 0.00 0.00 60.65 61.20 2xdw s ILE 706 Cb -0.12 -3.59 -0.09 0.00 0.01 0.00 0.00 42.46 38.67 2xdw s ILE 706 CO 0.84 0.39 0.99 -1.81 0.00 0.00 0.00 174.94 175.35 2xdw s ASP 707 N 0.50 7.29 0.34 3.58 1.01 -1.26 -4.84 116.67 123.29 2xdw s ASP 707 Ca 0.14 1.97 -0.28 0.00 0.71 0.00 0.00 52.55 55.09 2xdw s ASP 707 Cb -0.13 -2.60 -0.10 0.00 1.01 0.00 0.00 42.92 41.11 2xdw s ASP 707 CO 0.03 -0.10 1.28 0.86 0.21 0.00 0.00 175.17 177.44 2xdw s TRP 708 N -1.45 3.08 -0.36 4.23 -0.11 -1.26 -4.72 118.94 118.35 2xdw s TRP 708 Ca 0.48 1.45 -0.04 0.00 1.22 0.00 0.00 56.10 59.22 2xdw s TRP 708 Cb -0.23 -3.62 0.07 0.00 -1.50 0.00 0.00 33.47 28.19 2xdw s TRP 708 CO 0.29 -1.72 0.13 0.42 -4.62 0.00 0.00 176.95 171.46 2xdw s ILE 709 N -1.17 3.42 -2.00 5.86 1.01 0.57 -5.02 121.20 123.86 2xdw s ILE 709 Ca 0.50 -1.59 0.05 0.00 0.00 0.00 0.00 60.65 59.60 2xdw s ILE 709 Cb -0.38 -3.12 0.15 0.00 0.01 0.00 0.00 42.46 39.11 2xdw s ILE 709 CO 0.51 -0.40 0.78 -2.65 0.00 0.00 0.00 174.94 173.18