#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a8k s GLN 2 N 0.00 4.36 0.10 0.00 -0.21 0.19 -4.81 119.66 119.29 3a8k s GLN 2 Ca 0.00 1.07 0.04 0.00 0.02 0.00 0.00 55.36 56.49 3a8k s GLN 2 Cb 0.00 -2.73 -0.04 0.00 1.00 0.00 0.00 33.01 31.24 3a8k s GLN 2 CO 0.00 0.28 0.05 -0.65 -2.12 0.00 0.00 175.29 172.85 3a8k s GLN 3 N -2.23 2.74 0.73 2.91 -0.21 -1.26 0.00 119.66 122.33 3a8k s GLN 3 Ca 0.49 -0.79 -0.07 0.00 0.02 0.00 0.00 55.36 55.01 3a8k s GLN 3 Cb -0.16 -2.63 0.08 0.00 1.00 0.00 0.00 33.01 31.29 3a8k s GLN 3 CO 0.21 0.54 1.04 0.95 -2.12 0.00 0.00 175.29 175.91 3a8k s THR 4 N -1.43 2.24 -1.21 -0.19 -4.23 -1.26 -4.96 115.64 104.60 3a8k s THR 4 Ca 0.28 -0.27 0.07 0.00 -1.18 0.00 0.00 61.69 60.59 3a8k s THR 4 Cb -0.12 -2.97 0.09 0.00 1.34 0.00 0.00 72.50 70.84 3a8k s THR 4 CO 0.21 0.00 1.15 -2.65 -0.54 0.00 0.00 174.62 172.79 3a8k n PRO 5 N -2.98 0.05 -0.14 3.99 -0.02 -1.26 -2.75 135.00 131.89 3a8k n PRO 5 Ca 0.09 0.30 0.11 0.00 -2.02 0.00 0.00 63.50 61.98 3a8k n PRO 5 Cb 0.60 -1.50 0.28 0.00 -0.02 0.00 0.00 33.50 32.86 3a8k n PRO 5 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3a8k n LEU 6 N -1.40 2.61 0.10 2.45 4.77 -1.26 -4.65 117.00 119.63 3a8k n LEU 6 Ca 0.02 -1.12 -0.12 0.00 -0.03 0.00 0.00 56.01 54.76 3a8k n LEU 6 Cb 0.07 -0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 40.92 3a8k n LEU 6 CO 0.06 0.56 0.73 0.22 -1.33 0.00 0.00 177.39 177.63 3a8k h TYR 7 N 3.38 -0.53 -0.34 -1.77 3.20 -1.90 -0.63 116.97 118.38 3a8k h TYR 7 Ca 0.00 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.92 3a8k h TYR 7 Cb 0.75 0.22 -0.04 0.00 1.54 0.00 0.00 36.73 39.20 3a8k h TYR 7 CO 0.19 -0.29 0.10 1.49 -1.64 0.00 0.00 178.16 178.00 3a8k h GLU 8 N -0.38 0.22 -0.70 1.82 4.81 -1.88 -1.61 114.58 116.87 3a8k h GLU 8 Ca 0.03 -0.01 0.15 0.00 -0.13 0.00 0.00 59.36 59.39 3a8k h GLU 8 Cb 0.40 -0.05 -0.10 0.00 0.63 0.00 0.00 28.75 29.63 3a8k h GLU 8 CO -0.12 0.15 0.16 1.96 -0.73 0.00 0.00 179.01 180.43 3a8k h GLN 9 N 0.23 0.26 -0.45 1.92 1.08 -1.71 0.01 115.11 116.44 3a8k h GLN 9 Ca 0.15 -0.02 0.01 0.00 -1.45 0.00 0.00 58.65 57.35 3a8k h GLN 9 Cb 0.15 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.49 3a8k h GLN 9 CO -0.18 0.17 0.29 0.45 -0.95 0.00 0.00 178.83 178.62 3a8k h HIS 10 N 0.26 0.55 -0.38 2.96 3.86 -0.24 -1.40 115.15 120.77 3a8k h HIS 10 Ca 0.39 0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.51 3a8k h HIS 10 Cb 0.64 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.91 3a8k h HIS 10 CO -0.26 0.34 -0.18 1.79 0.86 0.00 0.00 177.93 180.48 3a8k h THR 11 N 0.59 1.26 0.00 2.45 1.35 -0.63 -0.75 112.91 117.19 3a8k h THR 11 Ca 0.17 -1.25 -0.01 0.00 -0.55 0.00 0.00 66.41 64.77 3a8k h THR 11 Cb -0.05 1.17 -0.00 0.00 -1.73 0.00 0.00 68.15 67.54 3a8k h THR 11 CO -0.05 0.42 -0.04 -0.07 -0.25 0.00 0.00 175.52 175.53 3a8k h LEU 12 N 0.64 0.00 -1.41 3.87 3.38 -0.71 -2.87 115.31 118.22 3a8k h LEU 12 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3a8k h LEU 12 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3a8k h LEU 12 CO 0.05 0.04 0.00 0.00 0.09 0.00 0.00 178.44 178.62 3a8k n GLY 14 N 1.17 0.74 3.77 0.00 0.00 -1.07 -4.87 105.19 104.94 3a8k n GLY 14 Ca 0.15 -0.46 -0.40 0.00 0.00 0.00 0.00 46.02 45.31 3a8k n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a8k s ALA 15 N -2.00 3.44 -0.48 4.61 0.00 -0.36 -4.15 121.76 122.82 3a8k s ALA 15 Ca 0.00 1.27 -0.19 0.00 0.00 0.00 0.00 51.96 53.04 3a8k s ALA 15 Cb 0.00 -3.49 0.04 0.00 0.00 0.00 0.00 23.12 19.68 3a8k s ALA 15 CO 0.00 -0.71 0.59 0.50 0.00 0.00 0.00 175.76 176.14 3a8k s ARG 16 N -1.93 3.15 -0.08 0.00 3.52 -0.49 -4.80 118.95 118.33 3a8k s ARG 16 Ca 0.51 -0.76 -0.25 0.00 -0.13 0.00 0.00 55.73 55.10 3a8k s ARG 16 Cb -0.40 -4.04 -0.03 0.00 -1.56 0.00 0.00 34.95 28.92 3a8k s ARG 16 CO 0.52 -1.11 0.78 -1.64 -0.81 0.00 0.00 175.30 173.05 3a8k s MET 17 N 2.57 4.43 0.16 5.12 -1.94 -1.26 -0.29 119.30 128.08 3a8k s MET 17 Ca 0.16 1.00 0.10 0.00 -1.71 0.00 0.00 55.69 55.25 3a8k s MET 17 Cb -0.18 -3.48 -0.04 0.00 2.01 0.00 0.00 34.83 33.14 3a8k s MET 17 CO 0.14 -0.05 -0.21 0.14 -0.01 0.00 0.00 175.02 175.03 3a8k s VAL 18 N 1.14 2.60 -0.24 -6.03 -7.23 0.14 -4.87 120.40 105.91 3a8k s VAL 18 Ca 0.40 -1.81 -0.29 0.00 -1.81 0.00 0.00 61.98 58.48 3a8k s VAL 18 Cb -0.18 -2.23 -0.03 0.00 0.56 0.00 0.00 36.38 34.50 3a8k s VAL 18 CO 0.19 -0.04 1.74 -0.62 -0.31 0.00 0.00 175.10 176.06 3a8k s ASP 19 N -2.49 6.16 -0.32 4.85 -1.08 -1.26 -0.43 116.67 122.09 3a8k s ASP 19 Ca 0.20 1.59 0.03 0.00 -0.52 0.00 0.00 52.55 53.84 3a8k s ASP 19 Cb -0.09 -2.53 0.09 0.00 -1.46 0.00 0.00 42.92 38.93 3a8k s ASP 19 CO 0.10 -1.45 0.02 0.12 0.52 0.00 0.00 175.17 174.49 3a8k s PHE 20 N 5.93 3.59 -1.52 -5.34 5.36 0.46 -4.69 117.98 121.78 3a8k s PHE 20 Ca 0.77 -2.71 -0.09 0.00 -0.96 0.00 0.00 56.93 53.94 3a8k s PHE 20 Cb -0.26 -2.65 0.07 0.00 -0.34 0.00 0.00 43.02 39.84 3a8k s PHE 20 CO 0.32 -0.93 0.70 0.72 -1.46 0.00 0.00 175.22 174.58 3a8k n HIS 21 N 4.35 -1.87 -0.81 10.12 8.25 -1.26 -1.10 115.22 132.90 3a8k n HIS 21 Ca -0.02 0.81 0.00 0.00 -0.26 0.00 0.00 57.72 58.25 3a8k n HIS 21 Cb 0.42 -3.62 0.00 0.00 1.12 0.00 0.00 29.99 27.91 3a8k n HIS 21 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3a8k n GLY 22 N -1.69 0.57 3.04 -1.41 0.00 -1.26 -4.89 105.19 99.56 3a8k n GLY 22 Ca -0.10 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.47 3a8k n GLY 22 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3a8k s TRP 23 N -2.00 1.56 -0.32 1.61 0.52 -0.26 0.53 118.94 120.58 3a8k s TRP 23 Ca 0.00 -0.58 -0.29 0.00 0.02 0.00 0.00 56.10 55.25 3a8k s TRP 23 Cb 0.00 -1.13 -0.01 0.00 -1.15 0.00 0.00 33.47 31.18 3a8k s TRP 23 CO 0.00 -0.29 1.68 -1.64 0.02 0.00 0.00 176.95 176.73 3a8k s MET 24 N 0.62 3.50 0.01 4.98 -1.94 0.10 0.17 119.30 126.74 3a8k s MET 24 Ca -0.15 1.40 0.04 0.00 -1.71 0.00 0.00 55.69 55.27 3a8k s MET 24 Cb -0.16 -4.13 -0.01 0.00 2.01 0.00 0.00 34.83 32.54 3a8k s MET 24 CO 0.04 -1.66 -0.12 -1.64 -0.01 0.00 0.00 175.02 171.63 3a8k s MET 25 N 5.28 0.87 -0.01 2.03 -1.94 0.42 -4.48 119.30 121.46 3a8k s MET 25 Ca 0.74 -0.55 -0.30 0.00 -1.71 0.00 0.00 55.69 53.88 3a8k s MET 25 Cb -0.21 -0.84 -0.08 0.00 2.01 0.00 0.00 34.83 35.71 3a8k s MET 25 CO 0.33 0.22 1.92 -2.14 -0.01 0.00 0.00 175.02 175.34 3a8k s PRO 26 N -0.68 4.04 0.17 2.03 0.02 -1.26 0.24 135.00 139.56 3a8k s PRO 26 Ca 0.02 2.45 -0.08 0.00 0.02 0.00 0.00 61.00 63.41 3a8k s PRO 26 Cb -0.06 -4.15 0.05 0.00 0.02 0.00 0.00 34.50 30.36 3a8k s PRO 26 CO 0.00 -1.06 1.55 1.25 -0.33 0.00 0.00 177.00 178.42 3a8k h LEU 27 N 11.03 0.95 -7.74 -5.54 5.85 -0.98 0.01 115.31 118.88 3a8k h LEU 27 Ca -0.46 -0.38 0.22 0.00 0.84 0.00 0.00 57.88 58.10 3a8k h LEU 27 Cb 1.22 -0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.92 3a8k h LEU 27 CO 0.95 1.15 0.65 -1.38 -0.34 0.00 0.00 178.44 179.47 3a8k s HIS 28 N -4.58 -0.01 -0.23 1.25 -3.43 -1.25 -1.24 115.29 105.81 3a8k s HIS 28 Ca -0.11 -0.27 0.11 0.00 -0.80 0.00 0.00 55.06 53.99 3a8k s HIS 28 Cb 0.12 0.64 0.43 0.00 -1.43 0.00 0.00 32.58 32.34 3a8k s HIS 28 CO 0.86 -0.69 1.21 0.66 -2.00 0.00 0.00 174.74 174.78 3a8k n TYR 29 N -0.63 0.86 0.00 0.38 4.02 -1.26 -1.39 117.16 119.14 3a8k n TYR 29 Ca -0.04 -1.69 0.00 0.00 -0.01 0.00 0.00 57.90 56.16 3a8k n TYR 29 Cb 0.60 -0.27 0.00 0.00 -0.02 0.00 0.00 39.34 39.65 3a8k n TYR 29 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3a8k n GLY 30 N -0.91 3.74 2.83 2.72 0.00 -1.26 -4.69 105.19 107.62 3a8k n GLY 30 Ca 0.26 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 45.16 3a8k n GLY 30 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3a8k s SER 31 N 0.00 1.05 0.33 1.61 0.15 -1.26 -5.01 113.70 110.57 3a8k s SER 31 Ca 0.00 -0.53 0.03 0.00 0.70 0.00 0.00 55.95 56.16 3a8k s SER 31 Cb 0.00 0.79 0.64 0.00 -1.71 0.00 0.00 66.02 65.74 3a8k s SER 31 CO 0.00 -0.37 1.94 -0.61 1.20 0.00 0.00 173.24 175.40 3a8k h GLN 32 N 8.22 0.86 -0.34 5.44 4.15 -1.95 -2.19 115.11 129.28 3a8k h GLN 32 Ca -0.12 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.24 3a8k h GLN 32 Cb 1.10 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.58 3a8k h GLN 32 CO 0.30 0.57 0.16 0.82 -1.93 0.00 0.00 178.83 178.74 3a8k h ILE 33 N 0.88 1.17 -0.01 2.39 1.08 -1.99 -1.41 117.51 119.61 3a8k h ILE 33 Ca 0.35 -0.49 -0.06 0.00 -0.39 0.00 0.00 64.86 64.27 3a8k h ILE 33 Cb 0.23 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 34.84 3a8k h ILE 33 CO -0.12 0.18 -0.26 0.44 -0.69 0.00 0.00 178.15 177.70 3a8k h ASP 34 N 0.42 0.02 -0.23 1.72 3.32 -1.89 -0.22 116.42 119.55 3a8k h ASP 34 Ca 0.12 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.08 3a8k h ASP 34 Cb 0.14 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 3a8k h ASP 34 CO -0.01 0.28 -0.18 -0.33 -1.72 0.00 0.00 179.24 177.27 3a8k h GLU 35 N 0.02 0.52 -0.49 3.56 5.08 -1.08 0.20 114.58 122.39 3a8k h GLU 35 Ca 0.00 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.08 3a8k h GLU 35 Cb 0.47 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 3a8k h GLU 35 CO 0.03 0.83 0.22 1.25 -1.00 0.00 0.00 179.01 180.35 3a8k h HIS 36 N 0.22 0.72 -0.84 4.33 2.76 -1.07 -2.12 115.15 119.16 3a8k h HIS 36 Ca 0.04 -0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 3a8k h HIS 36 Cb 0.71 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 29.41 3a8k h HIS 36 CO 0.07 0.58 0.39 1.25 -1.30 0.00 0.00 177.93 178.92 3a8k h HIS 37 N 0.65 1.21 -0.82 5.26 -0.00 -0.79 -2.48 115.15 118.19 3a8k h HIS 37 Ca 0.17 -0.06 0.03 0.00 -0.00 0.00 0.00 60.37 60.50 3a8k h HIS 37 Cb 0.14 -0.37 -0.05 0.00 -0.00 0.00 0.00 27.41 27.13 3a8k h HIS 37 CO -0.00 0.88 0.53 0.00 -0.00 0.00 0.00 177.93 179.33 3a8k h ALA 38 N 1.23 1.07 -0.04 5.26 0.00 0.03 -1.45 119.26 125.36 3a8k h ALA 38 Ca 0.29 -0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.96 3a8k h ALA 38 Cb 0.13 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3a8k h ALA 38 CO -0.03 0.36 -0.81 0.28 0.00 0.00 0.00 179.25 179.05 3a8k h VAL 39 N 1.03 1.41 0.00 0.00 2.07 -1.24 0.60 116.25 120.12 3a8k h VAL 39 Ca 0.32 -2.31 -0.10 0.00 0.82 0.00 0.00 66.70 65.44 3a8k h VAL 39 Cb -0.02 2.26 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 3a8k h VAL 39 CO -0.10 0.69 -0.45 0.03 0.02 0.00 0.00 177.57 177.75 3a8k h ARG 40 N 0.23 0.00 0.00 1.57 2.47 -1.04 -3.36 114.38 114.24 3a8k h ARG 40 Ca -0.05 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 3a8k h ARG 40 Cb 1.41 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.73 3a8k h ARG 40 CO 0.14 0.45 -0.18 0.25 0.56 0.00 0.00 179.97 181.19 3a8k n THR 41 N -3.77 0.00 0.00 2.04 -2.24 -0.58 -4.21 114.28 105.52 3a8k n THR 41 Ca -0.01 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 3a8k n THR 41 Cb 0.51 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 3a8k n THR 41 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3a8k n ASP 42 N -1.09 0.00 -3.69 3.42 2.03 0.10 -4.79 116.55 112.53 3a8k n ASP 42 Ca 0.00 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.21 3a8k n ASP 42 Cb 0.01 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 3a8k n ASP 42 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3a8k s ALA 43 N -1.18 -1.16 0.18 -1.67 0.00 -0.61 -1.07 121.76 116.25 3a8k s ALA 43 Ca 0.00 1.61 0.05 0.00 0.00 0.00 0.00 51.96 53.62 3a8k s ALA 43 Cb 0.00 -0.97 -0.05 0.00 0.00 0.00 0.00 23.12 22.10 3a8k s ALA 43 CO 0.00 -0.27 -0.08 0.20 0.00 0.00 0.00 175.76 175.61 3a8k s GLY 44 N 1.29 1.24 0.04 0.00 0.00 0.77 -2.10 107.32 108.56 3a8k s GLY 44 Ca -0.08 -1.59 0.00 0.00 0.00 0.00 0.00 44.72 43.05 3a8k s GLY 44 CO -0.12 -1.63 -0.04 -3.16 0.00 0.00 0.00 173.10 168.14 3a8k s MET 45 N -3.77 0.45 -0.07 2.90 0.23 0.10 -0.28 119.30 118.87 3a8k s MET 45 Ca 0.21 -0.81 0.04 0.00 -1.03 0.00 0.00 55.69 54.10 3a8k s MET 45 Cb 0.03 0.02 -0.00 0.00 -1.53 0.00 0.00 34.83 33.35 3a8k s MET 45 CO 0.03 -0.04 -0.21 -0.06 -2.03 0.00 0.00 175.02 172.72 3a8k s PHE 46 N -2.06 2.12 -0.30 3.16 0.40 0.01 -0.11 117.98 121.21 3a8k s PHE 46 Ca -0.08 -0.72 -0.29 0.00 -0.60 0.00 0.00 56.93 55.24 3a8k s PHE 46 Cb -0.06 -1.43 -0.02 0.00 0.51 0.00 0.00 43.02 42.03 3a8k s PHE 46 CO -0.03 -0.27 1.72 0.34 0.70 0.00 0.00 175.22 177.69 3a8k s ASP 47 N 0.15 6.07 -0.22 1.36 2.15 -1.26 -0.60 116.67 124.32 3a8k s ASP 47 Ca -0.10 1.38 0.11 0.00 0.43 0.00 0.00 52.55 54.38 3a8k s ASP 47 Cb -0.15 -2.53 0.43 0.00 -0.30 0.00 0.00 42.92 40.38 3a8k s ASP 47 CO 0.05 -1.55 1.26 1.33 -0.17 0.00 0.00 175.17 176.09 3a8k n VAL 48 N 7.10 2.26 0.46 1.11 0.24 0.01 -4.73 118.33 124.78 3a8k n VAL 48 Ca 0.21 -3.09 0.05 0.00 -2.04 0.00 0.00 64.34 59.47 3a8k n VAL 48 Cb 0.46 -0.26 0.25 0.00 -1.47 0.00 0.00 33.84 32.83 3a8k n VAL 48 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3a8k n SER 49 N -1.13 0.00 -0.00 -1.34 7.64 -0.98 -2.24 113.62 115.56 3a8k n SER 49 Ca 0.22 0.22 0.14 0.00 1.01 0.00 0.00 58.87 60.45 3a8k n SER 49 Cb 0.75 -0.33 0.59 0.00 -1.01 0.00 0.00 64.21 64.21 3a8k n SER 49 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3a8k n HIS 50 N -1.33 0.00 -1.90 1.43 1.44 -1.26 -4.76 115.22 108.83 3a8k n HIS 50 Ca 0.04 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.46 3a8k n HIS 50 Cb 0.09 -0.48 0.07 0.00 0.12 0.00 0.00 29.99 29.79 3a8k n HIS 50 CO 0.00 0.00 0.00 -1.64 -2.81 0.00 0.00 176.34 171.89 3a8k s MET 51 N -2.99 2.44 -0.05 -1.40 -1.94 -0.95 -3.60 119.30 110.80 3a8k s MET 51 Ca 0.14 0.29 0.06 0.00 -1.71 0.00 0.00 55.69 54.47 3a8k s MET 51 Cb 0.19 -1.99 -0.01 0.00 2.01 0.00 0.00 34.83 35.03 3a8k s MET 51 CO 0.54 -1.30 -0.22 0.99 -0.01 0.00 0.00 175.02 175.03 3a8k s THR 52 N -3.46 1.81 -0.13 2.05 2.01 0.77 -4.90 115.64 113.79 3a8k s THR 52 Ca 0.60 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 61.63 3a8k s THR 52 Cb -0.11 -1.54 -0.03 0.00 0.01 0.00 0.00 72.50 70.83 3a8k s THR 52 CO 0.50 0.51 -0.01 -0.63 -0.69 0.00 0.00 174.62 174.30 3a8k s ILE 53 N -0.11 4.16 -0.13 1.82 1.01 -1.26 -0.15 121.20 126.54 3a8k s ILE 53 Ca -0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.34 3a8k s ILE 53 Cb -0.13 -2.80 0.03 0.00 0.01 0.00 0.00 42.46 39.58 3a8k s ILE 53 CO 0.03 0.53 -0.05 -0.69 0.00 0.00 0.00 174.94 174.76 3a8k s VAL 54 N -0.11 0.95 -0.01 2.92 1.01 0.01 -0.85 120.40 124.32 3a8k s VAL 54 Ca 0.04 -0.37 -0.15 0.00 0.00 0.00 0.00 61.98 61.49 3a8k s VAL 54 Cb -0.13 -1.07 -0.06 0.00 0.00 0.00 0.00 36.38 35.13 3a8k s VAL 54 CO 0.02 0.24 0.42 -1.81 0.00 0.00 0.00 175.10 173.97 3a8k s ASP 55 N 1.72 6.81 -0.09 3.32 1.01 -0.24 -0.15 116.67 129.05 3a8k s ASP 55 Ca 0.03 0.96 0.01 0.00 0.71 0.00 0.00 52.55 54.27 3a8k s ASP 55 Cb -0.14 -2.26 0.02 0.00 1.01 0.00 0.00 42.92 41.55 3a8k s ASP 55 CO -0.08 0.30 -0.12 -0.76 0.21 0.00 0.00 175.17 174.73 3a8k s LEU 56 N -0.94 1.54 0.00 1.23 1.43 0.12 -0.71 118.68 121.35 3a8k s LEU 56 Ca 0.24 -0.33 0.04 0.00 -1.03 0.00 0.00 54.13 53.05 3a8k s LEU 56 Cb -0.17 -0.89 -0.01 0.00 0.03 0.00 0.00 46.19 45.16 3a8k s LEU 56 CO 0.13 -0.01 -0.11 -0.13 0.23 0.00 0.00 176.35 176.46 3a8k s ARG 57 N 1.02 0.88 0.00 1.70 0.52 -0.51 -1.36 118.95 121.19 3a8k s ARG 57 Ca -0.08 -0.49 0.00 0.00 -0.52 0.00 0.00 55.73 54.65 3a8k s ARG 57 Cb -0.15 -0.85 0.00 0.00 0.52 0.00 0.00 34.95 34.47 3a8k s ARG 57 CO -0.01 0.23 0.00 0.41 0.02 0.00 0.00 175.30 175.95 3a8k n GLY 58 N 2.55 4.17 0.27 -3.53 0.00 -0.08 -0.78 105.19 107.79 3a8k n GLY 58 Ca -0.15 -1.24 0.14 0.00 0.00 0.00 0.00 46.02 44.77 3a8k n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3a8k h SER 59 N 0.00 0.00 -0.47 1.61 4.64 -1.90 -2.02 113.55 115.41 3a8k h SER 59 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3a8k h SER 59 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3a8k h SER 59 CO 0.00 0.11 0.00 0.54 -0.87 0.00 0.00 176.83 176.61 3a8k n ARG 60 N -3.46 3.59 -0.11 4.77 1.74 -1.26 -4.63 116.66 117.28 3a8k n ARG 60 Ca -0.01 -2.80 -0.08 0.00 -0.77 0.00 0.00 57.85 54.18 3a8k n ARG 60 Cb 0.26 -1.86 -0.00 0.00 -1.02 0.00 0.00 32.46 29.84 3a8k n ARG 60 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3a8k h THR 61 N 3.08 1.08 -0.41 0.55 2.02 -1.64 0.00 112.91 117.59 3a8k h THR 61 Ca 0.00 -0.17 -0.03 0.00 0.77 0.00 0.00 66.41 66.98 3a8k h THR 61 Cb 1.44 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 68.38 3a8k h THR 61 CO 0.24 0.09 0.13 -0.09 0.37 0.00 0.00 175.52 176.26 3a8k h ARG 62 N 0.49 0.64 -0.95 6.66 2.43 -1.80 -0.73 114.38 121.11 3a8k h ARG 62 Ca 0.14 -0.14 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 3a8k h ARG 62 Cb -0.04 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.37 3a8k h ARG 62 CO -0.04 0.63 0.63 1.49 -1.51 0.00 0.00 179.97 181.17 3a8k h GLU 63 N 0.52 1.23 -0.28 0.20 4.81 -1.81 -1.08 114.58 118.17 3a8k h GLU 63 Ca 0.13 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 3a8k h GLU 63 Cb 0.26 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 3a8k h GLU 63 CO -0.00 0.81 0.12 0.35 -0.73 0.00 0.00 179.01 179.56 3a8k h PHE 64 N 1.26 0.41 -0.03 0.92 3.57 -0.58 -2.84 116.94 119.66 3a8k h PHE 64 Ca 0.36 -0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.71 3a8k h PHE 64 Cb -0.11 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.49 3a8k h PHE 64 CO -0.00 0.40 -0.54 -0.07 -2.23 0.00 0.00 178.31 175.88 3a8k h LEU 65 N 0.30 0.08 -1.92 0.59 3.38 -0.65 0.14 115.31 117.24 3a8k h LEU 65 Ca 0.09 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3a8k h LEU 65 Cb 0.16 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 3a8k h LEU 65 CO -0.01 0.60 -0.09 0.03 0.09 0.00 0.00 178.44 179.06 3a8k h ARG 66 N 0.06 0.00 0.07 1.13 3.08 -1.04 -2.22 114.38 115.47 3a8k h ARG 66 Ca -0.00 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.69 3a8k h ARG 66 Cb 0.97 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.98 3a8k h ARG 66 CO 0.07 0.09 -2.07 0.98 -1.07 0.00 0.00 179.97 177.98 3a8k n TYR 67 N -3.44 0.90 -0.19 3.04 9.36 -0.82 -4.49 117.16 121.52 3a8k n TYR 67 Ca -0.01 0.22 -0.09 0.00 3.32 0.00 0.00 57.90 61.33 3a8k n TYR 67 Cb 0.24 -1.13 0.01 0.00 -0.63 0.00 0.00 39.34 37.84 3a8k n TYR 67 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 3a8k h LEU 68 N 0.04 0.87 -9.54 2.98 5.85 -0.58 -0.11 115.31 114.83 3a8k h LEU 68 Ca -0.44 -0.27 -0.59 0.00 0.84 0.00 0.00 57.88 57.41 3a8k h LEU 68 Cb 2.02 -0.23 -0.11 0.00 0.37 0.00 0.00 40.66 42.71 3a8k h LEU 68 CO 0.05 0.93 -0.65 -0.76 -0.34 0.00 0.00 178.44 177.67 3a8k s LEU 69 N -9.47 3.34 0.01 2.25 1.43 -0.85 -4.25 118.68 111.14 3a8k s LEU 69 Ca -0.12 -0.40 0.16 0.00 -1.03 0.00 0.00 54.13 52.73 3a8k s LEU 69 Cb 0.12 -1.97 -0.17 0.00 0.03 0.00 0.00 46.19 44.19 3a8k s LEU 69 CO 0.82 0.07 0.73 0.00 0.23 0.00 0.00 176.35 178.20 3a8k n ALA 70 N -0.25 1.80 -1.70 4.21 0.00 -0.95 -4.71 120.51 118.90 3a8k n ALA 70 Ca -0.09 -0.65 -0.29 0.00 0.00 0.00 0.00 53.44 52.41 3a8k n ALA 70 Cb 0.56 -0.88 0.11 0.00 0.00 0.00 0.00 19.45 19.24 3a8k n ALA 70 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3a8k s ASN 71 N -5.82 4.03 -0.24 0.00 3.84 -1.11 -1.49 114.94 114.14 3a8k s ASN 71 Ca -0.04 0.90 -0.02 0.00 0.21 0.00 0.00 52.86 53.91 3a8k s ASN 71 Cb 0.08 -1.45 0.02 0.00 -0.55 0.00 0.00 41.25 39.35 3a8k s ASN 71 CO 0.82 -2.22 -0.07 -0.62 -2.79 0.00 0.00 177.10 172.22 3a8k s ASP 72 N -4.27 4.21 0.28 -4.21 2.15 -1.26 -4.79 116.67 108.78 3a8k s ASP 72 Ca 0.63 -0.77 0.24 0.00 0.43 0.00 0.00 52.55 53.07 3a8k s ASP 72 Cb -0.13 -1.66 1.02 0.00 -0.30 0.00 0.00 42.92 41.85 3a8k s ASP 72 CO 0.51 -0.10 1.72 1.33 -0.17 0.00 0.00 175.17 178.46 3a8k n VAL 73 N 4.69 0.84 0.23 1.11 0.24 -1.26 -2.05 118.33 122.12 3a8k n VAL 73 Ca -0.17 0.28 0.14 0.00 -2.04 0.00 0.00 64.34 62.55 3a8k n VAL 73 Cb 0.48 -1.23 0.74 0.00 -1.47 0.00 0.00 33.84 32.36 3a8k n VAL 73 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3a8k h ALA 74 N 2.23 1.08 0.00 2.33 0.00 -1.94 -1.08 119.26 121.88 3a8k h ALA 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3a8k h ALA 74 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3a8k h ALA 74 CO 0.00 -0.08 0.00 1.63 0.00 0.00 0.00 179.25 180.80 3a8k n LYS 75 N -2.51 0.16 -3.34 0.00 5.02 -0.87 -4.56 118.16 112.06 3a8k n LYS 75 Ca -0.02 0.36 -0.42 0.00 -2.02 0.00 0.00 58.31 56.20 3a8k n LYS 75 Cb 0.14 -1.78 -0.09 0.00 -0.02 0.00 0.00 35.03 33.28 3a8k n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3a8k s LEU 76 N -4.15 4.77 0.00 -0.35 1.43 -0.41 -4.84 118.68 115.14 3a8k s LEU 76 Ca 0.06 -0.57 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 3a8k s LEU 76 Cb 0.10 -2.38 0.00 0.00 0.03 0.00 0.00 46.19 43.94 3a8k s LEU 76 CO 0.39 -0.53 0.16 0.35 0.23 0.00 0.00 176.35 176.95 3a8k n THR 77 N 5.39 0.00 -4.03 5.49 -2.24 -1.26 -4.98 114.28 112.65 3a8k n THR 77 Ca -0.08 -0.39 -0.35 0.00 -2.27 0.00 0.00 64.05 60.97 3a8k n THR 77 Cb 0.48 1.09 -0.14 0.00 -2.10 0.00 0.00 70.33 69.67 3a8k n THR 77 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3a8k s LYS 78 N -0.45 3.43 0.14 -0.78 1.02 -1.26 -5.06 119.74 116.77 3a8k s LYS 78 Ca 0.00 -0.61 -0.34 0.00 0.02 0.00 0.00 55.97 55.04 3a8k s LYS 78 Cb 0.00 -2.99 -0.16 0.00 -0.52 0.00 0.00 37.83 34.17 3a8k s LYS 78 CO 0.00 -0.12 1.26 -1.13 -0.92 0.00 0.00 175.35 174.44 3a8k n SER 79 N 4.56 1.59 0.00 2.83 3.41 -1.26 -0.82 113.62 123.93 3a8k n SER 79 Ca -0.18 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.56 3a8k n SER 79 Cb 0.51 -1.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.24 3a8k n SER 79 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3a8k n GLY 80 N 2.28 2.33 3.77 5.00 0.00 0.16 -4.92 105.19 113.80 3a8k n GLY 80 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3a8k n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3a8k s LYS 81 N -0.58 4.29 0.13 1.61 2.47 0.00 0.18 119.74 127.84 3a8k s LYS 81 Ca 0.00 2.31 0.08 0.00 -1.56 0.00 0.00 55.97 56.80 3a8k s LYS 81 Cb 0.00 -3.05 -0.04 0.00 -1.46 0.00 0.00 37.83 33.28 3a8k s LYS 81 CO 0.00 -0.29 -0.19 0.00 0.16 0.00 0.00 175.35 175.03 3a8k s ALA 82 N -1.01 1.88 0.12 3.13 0.00 -0.27 -0.81 121.76 124.80 3a8k s ALA 82 Ca 0.51 -1.37 0.02 0.00 0.00 0.00 0.00 51.96 51.12 3a8k s ALA 82 Cb -0.42 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 3a8k s ALA 82 CO 0.54 0.28 -0.04 -0.48 0.00 0.00 0.00 175.76 176.06 3a8k s LEU 83 N -2.32 2.37 -0.07 0.00 0.05 -0.07 -4.86 118.68 113.78 3a8k s LEU 83 Ca 0.11 -1.06 -0.12 0.00 0.05 0.00 0.00 54.13 53.11 3a8k s LEU 83 Cb -0.08 -0.05 -0.05 0.00 -2.05 0.00 0.00 46.19 43.97 3a8k s LEU 83 CO 0.05 -0.51 0.30 -0.47 -0.55 0.00 0.00 176.35 175.18 3a8k s TYR 84 N -3.65 3.64 -0.09 3.48 5.04 -1.26 -1.55 117.35 122.96 3a8k s TYR 84 Ca 0.16 0.77 -0.11 0.00 -2.44 0.00 0.00 57.07 55.45 3a8k s TYR 84 Cb 0.06 -2.19 0.03 0.00 0.35 0.00 0.00 41.96 40.20 3a8k s TYR 84 CO -0.02 0.60 0.29 0.45 -1.34 0.00 0.00 175.55 175.53 3a8k s SER 85 N -0.77 -0.27 0.47 4.32 0.15 -0.17 -4.79 113.70 112.65 3a8k s SER 85 Ca 0.20 0.47 -0.20 0.00 0.70 0.00 0.00 55.95 57.11 3a8k s SER 85 Cb -0.14 0.53 -0.09 0.00 -1.71 0.00 0.00 66.02 64.61 3a8k s SER 85 CO 0.09 -0.18 1.01 -0.83 1.20 0.00 0.00 173.24 174.53 3a8k s GLY 86 N -0.18 2.45 -0.17 9.45 0.00 -1.26 -0.20 107.32 117.40 3a8k s GLY 86 Ca -0.03 0.52 0.01 0.00 0.00 0.00 0.00 44.72 45.22 3a8k s GLY 86 CO 0.01 0.83 -0.18 -0.29 0.00 0.00 0.00 173.10 173.46 3a8k s MET 87 N -3.26 3.06 0.26 2.90 0.00 0.28 -2.25 119.30 120.29 3a8k s MET 87 Ca 0.65 -0.81 0.12 0.00 0.00 0.00 0.00 55.69 55.65 3a8k s MET 87 Cb -0.14 -2.59 -0.05 0.00 0.00 0.00 0.00 34.83 32.05 3a8k s MET 87 CO 0.18 -0.15 -0.19 -0.51 0.00 0.00 0.00 175.02 174.35 3a8k s LEU 88 N 1.17 2.61 0.68 4.11 1.43 -1.26 -0.01 118.68 127.41 3a8k s LEU 88 Ca 0.02 -0.96 -0.00 0.00 -1.03 0.00 0.00 54.13 52.15 3a8k s LEU 88 Cb -0.14 -1.16 0.11 0.00 0.03 0.00 0.00 46.19 45.02 3a8k s LEU 88 CO -0.09 0.05 0.95 0.54 0.23 0.00 0.00 176.35 178.04 3a8k s ASN 89 N -3.34 4.56 0.00 2.29 2.20 -0.59 -4.70 114.94 115.36 3a8k s ASN 89 Ca 0.28 -0.28 0.17 0.00 -0.94 0.00 0.00 52.86 52.09 3a8k s ASN 89 Cb -0.06 -0.21 0.78 0.00 -2.00 0.00 0.00 41.25 39.77 3a8k s ASN 89 CO 0.14 -1.70 1.55 0.00 -2.94 0.00 0.00 177.10 174.15 3a8k n ALA 90 N -2.73 1.84 0.40 3.54 0.00 -1.26 -0.91 120.51 121.40 3a8k n ALA 90 Ca 0.13 -0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.58 3a8k n ALA 90 Cb 0.60 -1.28 0.32 0.00 0.00 0.00 0.00 19.45 19.09 3a8k n ALA 90 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3a8k n SER 91 N -1.44 0.15 0.00 0.00 3.41 -1.26 -4.41 113.62 110.07 3a8k n SER 91 Ca 0.05 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 3a8k n SER 91 Cb 0.18 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 3a8k n SER 91 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3a8k n GLY 92 N -0.24 2.56 3.74 5.00 0.00 -0.08 -4.79 105.19 111.37 3a8k n GLY 92 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 3a8k n GLY 92 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3a8k s GLY 93 N -1.92 2.35 -0.25 -0.02 0.00 -1.26 -4.08 107.32 102.14 3a8k s GLY 93 Ca 0.00 0.81 -0.18 0.00 0.00 0.00 0.00 44.72 45.35 3a8k s GLY 93 CO 0.00 1.21 0.53 0.14 0.00 0.00 0.00 173.10 174.97 3a8k s VAL 94 N -2.02 5.07 -0.07 1.40 1.01 -0.69 -1.54 120.40 123.56 3a8k s VAL 94 Ca 0.73 0.91 -0.22 0.00 0.00 0.00 0.00 61.98 63.41 3a8k s VAL 94 Cb -0.27 -3.84 -0.30 0.00 0.00 0.00 0.00 36.38 31.97 3a8k s VAL 94 CO 0.43 0.09 0.81 0.40 0.00 0.00 0.00 175.10 176.83 3a8k h ILE 95 N 5.36 1.45 -3.11 2.22 2.04 -0.71 -2.48 117.51 122.27 3a8k h ILE 95 Ca -0.29 -2.49 0.01 0.00 1.00 0.00 0.00 64.86 63.09 3a8k h ILE 95 Cb 1.14 3.12 -0.09 0.00 -0.74 0.00 0.00 36.82 40.25 3a8k h ILE 95 CO 0.72 0.69 0.15 -0.62 0.00 0.00 0.00 178.15 179.10 3a8k s ASP 96 N -6.90 -0.37 -0.24 1.72 -1.08 -1.07 -4.92 116.67 103.81 3a8k s ASP 96 Ca -0.16 -0.35 -0.06 0.00 -0.52 0.00 0.00 52.55 51.46 3a8k s ASP 96 Cb 0.01 0.63 -0.02 0.00 -1.46 0.00 0.00 42.92 42.08 3a8k s ASP 96 CO 0.80 -1.11 0.03 0.54 0.52 0.00 0.00 175.17 175.95 3a8k s ASN 97 N -2.84 4.86 0.33 -0.34 4.22 -1.26 -0.56 114.94 119.34 3a8k s ASN 97 Ca 0.07 -0.29 0.03 0.00 -2.14 0.00 0.00 52.86 50.53 3a8k s ASN 97 Cb -0.02 -1.86 -0.05 0.00 1.28 0.00 0.00 41.25 40.60 3a8k s ASN 97 CO -0.04 -0.04 0.09 -1.48 -2.04 0.00 0.00 177.10 173.60 3a8k s LEU 98 N 1.57 1.99 -0.02 3.54 0.05 0.72 -4.78 118.68 121.74 3a8k s LEU 98 Ca 0.06 -1.47 0.04 0.00 0.05 0.00 0.00 54.13 52.81 3a8k s LEU 98 Cb -0.15 -0.19 -0.03 0.00 -2.05 0.00 0.00 46.19 43.77 3a8k s LEU 98 CO 0.01 -0.74 -0.11 -0.63 -0.55 0.00 0.00 176.35 174.34 3a8k s ILE 99 N -3.39 3.35 -0.04 1.48 -1.09 -1.16 -1.00 121.20 119.36 3a8k s ILE 99 Ca 0.33 -0.77 0.03 0.00 -2.23 0.00 0.00 60.65 58.01 3a8k s ILE 99 Cb 0.07 -2.39 0.00 0.00 -1.58 0.00 0.00 42.46 38.56 3a8k s ILE 99 CO 0.15 0.48 -0.12 0.54 -1.23 0.00 0.00 174.94 174.75 3a8k s VAL 100 N -0.88 1.08 -0.08 2.92 0.11 -0.59 -1.34 120.40 121.61 3a8k s VAL 100 Ca 0.14 -0.50 -0.02 0.00 -2.93 0.00 0.00 61.98 58.68 3a8k s VAL 100 Cb -0.11 -0.95 -0.03 0.00 -1.53 0.00 0.00 36.38 33.75 3a8k s VAL 100 CO 0.04 0.33 0.00 -0.31 -3.33 0.00 0.00 175.10 171.83 3a8k s TYR 101 N 0.29 3.16 -0.20 1.54 1.51 0.07 -0.89 117.35 122.83 3a8k s TYR 101 Ca -0.07 0.19 -0.12 0.00 -1.01 0.00 0.00 57.07 56.06 3a8k s TYR 101 Cb -0.12 -1.78 -0.05 0.00 -0.11 0.00 0.00 41.96 39.91 3a8k s TYR 101 CO 0.02 0.47 0.21 -0.47 -1.11 0.00 0.00 175.55 174.67 3a8k s TYR 102 N -0.91 3.40 -0.11 2.71 5.04 0.01 -1.37 117.35 126.13 3a8k s TYR 102 Ca 0.14 0.41 -0.08 0.00 -2.44 0.00 0.00 57.07 55.10 3a8k s TYR 102 Cb -0.11 -2.27 -0.05 0.00 0.35 0.00 0.00 41.96 39.88 3a8k s TYR 102 CO 0.03 0.20 -0.19 1.19 -1.34 0.00 0.00 175.55 175.45 3a8k n PHE 103 N 3.78 0.00 -4.19 4.97 3.72 -0.54 0.37 117.46 125.57 3a8k n PHE 103 Ca -0.14 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.12 3a8k n PHE 103 Cb 0.52 -0.42 -0.09 0.00 -0.94 0.00 0.00 39.48 38.55 3a8k n PHE 103 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3a8k s THR 104 N -2.35 0.00 0.54 4.37 -4.23 -0.92 -4.55 115.64 108.50 3a8k s THR 104 Ca -0.18 -1.91 0.22 0.00 -1.18 0.00 0.00 61.69 58.64 3a8k s THR 104 Cb 0.06 -2.48 0.32 0.00 1.34 0.00 0.00 72.50 71.73 3a8k s THR 104 CO 0.24 0.00 2.14 -0.33 -0.54 0.00 0.00 174.62 176.13 3a8k h GLU 105 N 2.42 0.00 -0.45 3.99 4.39 -1.98 -1.60 114.58 121.35 3a8k h GLU 105 Ca -0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.39 3a8k h GLU 105 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 3a8k h GLU 105 CO 0.46 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 178.06 3a8k n ASP 106 N -4.28 4.12 -3.61 1.42 8.00 -1.26 -3.90 116.55 117.04 3a8k n ASP 106 Ca -0.00 -2.55 -0.06 0.00 0.71 0.00 0.00 54.79 52.88 3a8k n ASP 106 Cb 0.20 -0.49 -0.08 0.00 -0.02 0.00 0.00 41.12 40.74 3a8k n ASP 106 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3a8k s PHE 107 N -2.01 -0.96 0.15 1.24 5.36 -0.60 -0.90 117.98 120.26 3a8k s PHE 107 Ca 0.42 1.66 0.02 0.00 -0.96 0.00 0.00 56.93 58.07 3a8k s PHE 107 Cb 0.29 0.41 -0.04 0.00 -0.34 0.00 0.00 43.02 43.33 3a8k s PHE 107 CO 0.17 -0.56 -0.02 -0.06 -1.46 0.00 0.00 175.22 173.28 3a8k s PHE 108 N 2.68 1.13 -0.02 10.12 0.40 -0.46 -1.47 117.98 130.36 3a8k s PHE 108 Ca -0.00 -0.98 0.02 0.00 -0.60 0.00 0.00 56.93 55.37 3a8k s PHE 108 Cb -0.12 -0.64 0.00 0.00 0.51 0.00 0.00 43.02 42.77 3a8k s PHE 108 CO -0.15 -0.18 -0.05 0.50 0.70 0.00 0.00 175.22 176.04 3a8k s ARG 109 N -3.88 0.57 0.08 0.44 3.52 -0.47 -0.70 118.95 118.51 3a8k s ARG 109 Ca 0.20 -0.17 0.06 0.00 -0.13 0.00 0.00 55.73 55.69 3a8k s ARG 109 Cb 0.06 -0.58 -0.04 0.00 -1.56 0.00 0.00 34.95 32.83 3a8k s ARG 109 CO 0.01 0.06 -0.08 -0.51 -0.81 0.00 0.00 175.30 173.98 3a8k s LEU 110 N 0.19 3.12 -0.11 -0.88 1.43 0.79 -0.75 118.68 122.46 3a8k s LEU 110 Ca -0.02 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 3a8k s LEU 110 Cb -0.06 -1.88 0.02 0.00 0.03 0.00 0.00 46.19 44.30 3a8k s LEU 110 CO -0.00 0.20 -0.12 -0.69 0.23 0.00 0.00 176.35 175.97 3a8k s VAL 111 N -1.18 1.29 0.19 -1.59 1.01 -0.45 -0.81 120.40 118.85 3a8k s VAL 111 Ca 0.21 -0.49 0.08 0.00 0.00 0.00 0.00 61.98 61.78 3a8k s VAL 111 Cb -0.11 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 3a8k s VAL 111 CO 0.13 0.41 -0.15 0.68 0.00 0.00 0.00 175.10 176.17 3a8k s VAL 112 N 1.32 1.68 0.63 2.92 -7.23 0.79 -2.97 120.40 117.55 3a8k s VAL 112 Ca -0.01 -2.10 -0.17 0.00 -1.81 0.00 0.00 61.98 57.89 3a8k s VAL 112 Cb -0.14 -1.94 -0.02 0.00 0.56 0.00 0.00 36.38 34.85 3a8k s VAL 112 CO -0.05 -0.53 1.16 0.20 -0.31 0.00 0.00 175.10 175.56 3a8k s ASN 113 N -3.10 5.11 0.17 4.85 0.01 -1.26 -0.16 114.94 120.56 3a8k s ASN 113 Ca 0.19 2.21 -0.14 0.00 -0.71 0.00 0.00 52.86 54.41 3a8k s ASN 113 Cb -0.02 -2.58 0.07 0.00 0.41 0.00 0.00 41.25 39.14 3a8k s ASN 113 CO 0.06 -1.64 1.83 -1.28 -1.51 0.00 0.00 177.10 174.56 3a8k h SER 114 N 0.47 0.57 0.55 -1.22 0.87 -1.91 -2.52 113.55 110.37 3a8k h SER 114 Ca -0.49 -0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.02 3a8k h SER 114 Cb 1.27 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 63.09 3a8k h SER 114 CO 0.54 0.41 -0.20 0.00 -0.53 0.00 0.00 176.83 177.05 3a8k h ALA 115 N 1.20 1.20 -0.30 6.23 0.00 -1.90 -2.83 119.26 122.86 3a8k h ALA 115 Ca 0.20 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3a8k h ALA 115 Cb -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3a8k h ALA 115 CO -0.06 0.25 0.00 0.25 0.00 0.00 0.00 179.25 179.69 3a8k n THR 116 N -3.62 0.63 0.18 0.00 -2.24 -1.12 -4.74 114.28 103.36 3a8k n THR 116 Ca -0.01 -0.81 -0.16 0.00 -2.27 0.00 0.00 64.05 60.80 3a8k n THR 116 Cb 0.33 0.80 -0.08 0.00 -2.10 0.00 0.00 70.33 69.28 3a8k n THR 116 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3a8k h ARG 117 N 2.80 -0.75 -0.34 -0.78 2.43 -1.19 0.11 114.38 116.66 3a8k h ARG 117 Ca 0.00 0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 3a8k h ARG 117 Cb 0.74 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 3a8k h ARG 117 CO 0.00 -0.50 -0.01 0.93 -1.51 0.00 0.00 179.97 178.88 3a8k h GLU 118 N -0.78 0.60 -0.80 0.20 4.39 -1.85 0.12 114.58 116.47 3a8k h GLU 118 Ca -0.01 -0.20 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 3a8k h GLU 118 Cb 0.74 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 29.31 3a8k h GLU 118 CO -0.17 0.74 0.38 -0.22 -1.16 0.00 0.00 179.01 178.57 3a8k h LYS 119 N 0.41 1.15 -0.23 2.33 3.64 -1.88 -2.06 116.57 119.93 3a8k h LYS 119 Ca 0.09 -0.17 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 3a8k h LYS 119 Cb 0.47 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 3a8k h LYS 119 CO 0.02 0.89 -0.13 -0.44 -2.27 0.00 0.00 179.45 177.52 3a8k h ASP 120 N 1.13 0.52 -0.81 4.20 3.32 -0.20 -1.74 116.42 122.83 3a8k h ASP 120 Ca 0.27 -0.42 0.04 0.00 0.02 0.00 0.00 57.03 56.94 3a8k h ASP 120 Cb 0.13 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.48 3a8k h ASP 120 CO -0.03 0.82 0.51 -0.07 -1.72 0.00 0.00 179.24 178.76 3a8k h LEU 121 N 0.21 0.84 -0.50 1.55 3.38 -0.69 0.51 115.31 120.60 3a8k h LEU 121 Ca 0.05 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3a8k h LEU 121 Cb 0.64 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 3a8k h LEU 121 CO 0.04 0.57 0.11 0.28 0.09 0.00 0.00 178.44 179.53 3a8k h SER 122 N 0.99 0.77 -0.49 -0.43 0.02 -1.32 0.26 113.55 113.35 3a8k h SER 122 Ca 0.33 -0.24 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 3a8k h SER 122 Cb 0.05 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 3a8k h SER 122 CO -0.13 0.81 0.09 -0.25 -1.14 0.00 0.00 176.83 176.22 3a8k h TRP 123 N 0.69 0.85 -0.21 3.45 2.91 -0.87 -1.74 115.95 121.03 3a8k h TRP 123 Ca 0.16 -0.11 -0.05 0.00 1.13 0.00 0.00 58.89 60.01 3a8k h TRP 123 Cb 0.35 -0.24 -0.01 0.00 -0.51 0.00 0.00 29.16 28.76 3a8k h TRP 123 CO 0.02 0.78 -0.08 0.82 -1.03 0.00 0.00 178.44 178.95 3a8k h ILE 124 N 0.69 1.30 -0.11 2.65 2.04 -0.69 -1.55 117.51 121.83 3a8k h ILE 124 Ca 0.15 -1.12 -0.12 0.00 1.00 0.00 0.00 64.86 64.77 3a8k h ILE 124 Cb 0.37 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 3a8k h ILE 124 CO 0.01 0.34 -0.47 0.71 0.00 0.00 0.00 178.15 178.73 3a8k h THR 125 N 0.14 1.33 -0.06 -0.27 1.35 -0.39 0.10 112.91 115.10 3a8k h THR 125 Ca 0.05 -1.67 -0.01 0.00 -0.55 0.00 0.00 66.41 64.22 3a8k h THR 125 Cb 0.56 1.77 -0.00 0.00 -1.73 0.00 0.00 68.15 68.74 3a8k h THR 125 CO 0.03 0.50 -0.01 -0.61 -0.25 0.00 0.00 175.52 175.18 3a8k h GLN 126 N 0.23 0.12 -0.09 4.72 4.15 -1.30 -2.99 115.11 119.95 3a8k h GLN 126 Ca 0.01 -0.04 -0.10 0.00 0.77 0.00 0.00 58.65 59.29 3a8k h GLN 126 Cb 0.92 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.59 3a8k h GLN 126 CO 0.08 0.43 -0.40 0.45 -1.93 0.00 0.00 178.83 177.46 3a8k h HIS 127 N -0.20 0.23 0.00 3.99 3.86 -1.07 -3.18 115.15 118.77 3a8k h HIS 127 Ca 0.02 -0.06 -0.11 0.00 -1.16 0.00 0.00 60.37 59.05 3a8k h HIS 127 Cb 0.39 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.79 3a8k h HIS 127 CO 0.05 0.58 -0.53 0.00 0.86 0.00 0.00 177.93 178.88 3a8k h ALA 128 N 1.42 0.91 -0.65 2.45 0.00 -1.01 -3.37 119.26 119.00 3a8k h ALA 128 Ca 0.02 -0.49 0.14 0.00 0.00 0.00 0.00 54.91 54.58 3a8k h ALA 128 Cb 0.79 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.38 3a8k h ALA 128 CO 0.06 0.67 -0.04 1.49 0.00 0.00 0.00 179.25 181.42 3a8k h GLU 129 N 0.00 0.08 0.00 0.00 4.81 -1.50 0.12 114.58 118.09 3a8k h GLU 129 Ca -0.01 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3a8k h GLU 129 Cb 1.09 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.45 3a8k h GLU 129 CO 0.07 0.05 0.00 -0.35 -0.73 0.00 0.00 179.01 178.05 3a8k n PRO 130 N -5.34 0.07 0.00 0.92 -0.04 -1.26 -1.70 135.00 127.66 3a8k n PRO 130 Ca 0.09 0.29 0.14 0.00 -0.04 0.00 0.00 63.50 63.99 3a8k n PRO 130 Cb 0.37 -1.63 0.62 0.00 -0.04 0.00 0.00 33.50 32.82 3a8k n PRO 130 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3a8k n PHE 131 N -1.76 0.00 -3.55 0.54 3.72 0.42 -4.97 117.46 111.86 3a8k n PHE 131 Ca 0.03 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.23 3a8k n PHE 131 Cb 0.21 -0.09 0.08 0.00 -0.94 0.00 0.00 39.48 38.74 3a8k n PHE 131 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a8k n GLY 132 N 1.20 -0.41 3.88 1.37 0.00 -0.69 -4.53 105.19 106.01 3a8k n GLY 132 Ca 0.17 0.16 -0.35 0.00 0.00 0.00 0.00 46.02 46.00 3a8k n GLY 132 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a8k s ILE 133 N -3.39 5.25 -0.27 -0.61 1.01 -1.26 -4.88 121.20 117.05 3a8k s ILE 133 Ca 0.21 0.23 -0.22 0.00 0.00 0.00 0.00 60.65 60.88 3a8k s ILE 133 Cb -0.10 -3.59 -0.01 0.00 0.01 0.00 0.00 42.46 38.78 3a8k s ILE 133 CO 0.75 0.34 0.70 -0.70 0.00 0.00 0.00 174.94 176.03 3a8k s GLU 134 N -1.81 4.05 -0.23 2.79 2.12 0.04 -4.93 118.70 120.73 3a8k s GLU 134 Ca 0.29 0.59 -0.04 0.00 0.36 0.00 0.00 54.97 56.17 3a8k s GLU 134 Cb -0.13 -3.68 -0.00 0.00 0.26 0.00 0.00 34.13 30.57 3a8k s GLU 134 CO 0.17 -0.52 -0.03 0.42 -0.54 0.00 0.00 175.26 174.76 3a8k s ILE 135 N 2.69 3.42 -0.19 -3.70 1.01 -1.26 -1.43 121.20 121.74 3a8k s ILE 135 Ca 0.29 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 60.38 3a8k s ILE 135 Cb -0.15 -2.61 0.02 0.00 0.01 0.00 0.00 42.46 39.74 3a8k s ILE 135 CO 0.10 0.35 -0.18 -0.89 0.00 0.00 0.00 174.94 174.32 3a8k s THR 136 N 1.47 2.17 -0.29 2.92 2.01 0.11 -4.98 115.64 119.04 3a8k s THR 136 Ca 0.05 -1.00 -0.20 0.00 0.31 0.00 0.00 61.69 60.85 3a8k s THR 136 Cb -0.15 -1.96 -0.01 0.00 0.01 0.00 0.00 72.50 70.39 3a8k s THR 136 CO -0.02 0.46 0.63 -0.69 -0.69 0.00 0.00 174.62 174.30 3a8k s VAL 137 N 1.28 4.95 -1.22 3.82 1.01 -1.26 -1.08 120.40 127.90 3a8k s VAL 137 Ca 0.03 0.92 -0.05 0.00 0.00 0.00 0.00 61.98 62.89 3a8k s VAL 137 Cb -0.14 -3.98 0.20 0.00 0.00 0.00 0.00 36.38 32.45 3a8k s VAL 137 CO -0.11 -0.10 2.07 0.54 0.00 0.00 0.00 175.10 177.50 3a8k n ARG 138 N 5.84 4.64 0.00 2.72 5.12 -0.03 -4.65 116.66 130.30 3a8k n ARG 138 Ca -0.01 -3.88 0.10 0.00 -1.93 0.00 0.00 57.85 52.13 3a8k n ARG 138 Cb 0.49 -2.63 0.52 0.00 -1.16 0.00 0.00 32.46 29.68 3a8k n ARG 138 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 3a8k n ASP 139 N 1.59 0.00 0.00 0.55 8.00 -1.26 -2.06 116.55 123.37 3a8k n ASP 139 Ca 0.51 0.10 0.08 0.00 0.71 0.00 0.00 54.79 56.19 3a8k n ASP 139 Cb 0.28 -0.33 0.38 0.00 -0.02 0.00 0.00 41.12 41.43 3a8k n ASP 139 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3a8k n ASP 140 N -1.33 0.00 -4.61 -2.24 5.75 -1.26 -4.84 116.55 108.02 3a8k n ASP 140 Ca 0.09 0.36 -0.33 0.00 -0.01 0.00 0.00 54.79 54.91 3a8k n ASP 140 Cb 0.19 -0.44 -0.10 0.00 -1.03 0.00 0.00 41.12 39.74 3a8k n ASP 140 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3a8k s LEU 141 N -2.87 3.23 0.48 -2.12 1.43 -0.87 -1.63 118.68 116.33 3a8k s LEU 141 Ca 0.11 -0.09 0.07 0.00 -1.03 0.00 0.00 54.13 53.19 3a8k s LEU 141 Cb 0.11 -1.82 0.02 0.00 0.03 0.00 0.00 46.19 44.53 3a8k s LEU 141 CO 0.29 0.30 0.45 -0.44 0.23 0.00 0.00 176.35 177.19 3a8k s SER 142 N -1.29 4.92 -0.17 2.29 0.01 0.56 -4.77 113.70 115.26 3a8k s SER 142 Ca 0.16 -0.92 -0.12 0.00 1.31 0.00 0.00 55.95 56.37 3a8k s SER 142 Cb -0.11 -0.11 0.05 0.00 0.21 0.00 0.00 66.02 66.06 3a8k s SER 142 CO 0.06 -0.91 0.42 -0.32 0.41 0.00 0.00 173.24 172.91 3a8k s MET 143 N -4.26 0.45 -0.08 12.44 1.75 -1.26 -1.48 119.30 126.86 3a8k s MET 143 Ca 0.46 0.69 0.03 0.00 -1.25 0.00 0.00 55.69 55.62 3a8k s MET 143 Cb -0.03 0.12 0.01 0.00 2.84 0.00 0.00 34.83 37.76 3a8k s MET 143 CO 0.27 -0.11 -0.19 0.42 -0.65 0.00 0.00 175.02 174.77 3a8k s ILE 144 N 0.79 1.65 -0.25 10.11 1.01 -0.23 -0.81 121.20 133.47 3a8k s ILE 144 Ca -0.05 -0.79 -0.10 0.00 0.00 0.00 0.00 60.65 59.72 3a8k s ILE 144 Cb -0.05 -1.45 -0.05 0.00 0.01 0.00 0.00 42.46 40.92 3a8k s ILE 144 CO -0.06 0.47 0.16 0.00 0.00 0.00 0.00 174.94 175.51 3a8k s ALA 145 N 0.45 3.54 -0.26 9.38 0.00 0.23 -0.63 121.76 134.48 3a8k s ALA 145 Ca -0.16 -0.96 -0.03 0.00 0.00 0.00 0.00 51.96 50.81 3a8k s ALA 145 Cb -0.17 -2.33 0.02 0.00 0.00 0.00 0.00 23.12 20.65 3a8k s ALA 145 CO 0.06 -0.31 -0.03 0.08 0.00 0.00 0.00 175.76 175.56 3a8k s VAL 146 N 1.28 3.07 0.01 0.00 1.01 0.10 -0.81 120.40 125.06 3a8k s VAL 146 Ca 0.07 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.10 3a8k s VAL 146 Cb -0.14 -2.57 -0.01 0.00 0.00 0.00 0.00 36.38 33.65 3a8k s VAL 146 CO 0.06 0.17 -0.10 -1.10 0.00 0.00 0.00 175.10 174.13 3a8k s GLN 147 N 1.35 0.73 0.00 2.72 -1.52 0.62 -0.71 119.66 122.85 3a8k s GLN 147 Ca 0.00 -0.47 0.00 0.00 -1.95 0.00 0.00 55.36 52.94 3a8k s GLN 147 Cb -0.17 -0.69 0.00 0.00 -0.22 0.00 0.00 33.01 31.93 3a8k s GLN 147 CO -0.03 0.18 0.00 0.41 -0.25 0.00 0.00 175.29 175.60 3a8k n GLY 148 N 2.46 3.56 0.27 3.09 0.00 -0.09 -0.16 105.19 114.33 3a8k n GLY 148 Ca -0.16 -1.72 0.15 0.00 0.00 0.00 0.00 46.02 44.29 3a8k n GLY 148 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a8k h PRO 149 N 0.00 0.00 -0.27 1.61 0.13 -1.65 -2.44 132.00 129.37 3a8k h PRO 149 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3a8k h PRO 149 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3a8k h PRO 149 CO 0.00 0.09 0.00 0.09 -0.23 0.00 0.00 178.00 177.95 3a8k n ASN 150 N -3.46 2.83 0.13 1.44 3.02 -0.23 -4.69 115.26 114.30 3a8k n ASN 150 Ca -0.01 -1.84 -0.14 0.00 -0.03 0.00 0.00 54.58 52.56 3a8k n ASN 150 Cb 0.24 -0.18 -0.08 0.00 -0.61 0.00 0.00 39.78 39.16 3a8k n ASN 150 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a8k h ALA 151 N 2.86 -0.28 -0.65 5.41 0.00 -1.44 -1.48 119.26 123.68 3a8k h ALA 151 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3a8k h ALA 151 Cb 0.74 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 3a8k h ALA 151 CO 0.00 -0.61 0.42 1.96 0.00 0.00 0.00 179.25 181.02 3a8k h GLN 152 N -0.38 0.87 -0.37 0.00 4.20 -1.84 -1.25 115.11 116.35 3a8k h GLN 152 Ca -0.03 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 3a8k h GLN 152 Cb 0.29 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 3a8k h GLN 152 CO 0.05 0.60 0.18 0.00 -0.67 0.00 0.00 178.83 178.98 3a8k h ALA 153 N 1.22 0.47 -0.48 3.87 0.00 -1.86 0.06 119.26 122.55 3a8k h ALA 153 Ca 0.24 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3a8k h ALA 153 Cb -0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3a8k h ALA 153 CO -0.05 0.04 0.18 0.87 0.00 0.00 0.00 179.25 180.29 3a8k h LYS 154 N 0.46 0.72 -0.73 0.00 1.57 -1.12 -2.57 116.57 114.90 3a8k h LYS 154 Ca 0.13 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 3a8k h LYS 154 Cb 0.12 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 3a8k h LYS 154 CO -0.02 0.66 0.24 0.00 -0.57 0.00 0.00 179.45 179.76 3a8k h ALA 155 N 1.03 1.03 -0.23 3.86 0.00 -1.06 -2.65 119.26 121.24 3a8k h ALA 155 Ca 0.16 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.92 3a8k h ALA 155 Cb 0.21 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3a8k h ALA 155 CO -0.01 0.66 0.18 0.00 0.00 0.00 0.00 179.25 180.07 3a8k h ALA 156 N 1.16 2.16 0.00 0.00 0.00 -0.58 -0.86 119.26 121.14 3a8k h ALA 156 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3a8k h ALA 156 Cb 0.29 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3a8k h ALA 156 CO -0.01 -0.30 0.00 1.79 0.00 0.00 0.00 179.25 180.73 3a8k h THR 157 N 0.00 0.00 -0.01 0.00 1.35 -1.23 -1.74 112.91 111.28 3a8k h THR 157 Ca 0.11 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.92 3a8k h THR 157 Cb 0.46 0.83 0.00 0.00 -1.73 0.00 0.00 68.15 67.71 3a8k h THR 157 CO -0.00 0.00 -0.57 0.18 -0.25 0.00 0.00 175.52 174.88 3a8k n LEU 158 N -2.71 1.29 -4.75 3.87 4.77 -0.33 -4.95 117.00 114.19 3a8k n LEU 158 Ca -0.02 -0.64 -0.29 0.00 -0.03 0.00 0.00 56.01 55.03 3a8k n LEU 158 Cb 0.08 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.30 3a8k n LEU 158 CO 0.16 0.27 0.69 -0.36 -1.33 0.00 0.00 177.39 176.82 3a8k s PHE 159 N -2.30 2.48 0.69 -1.77 0.08 -0.65 -5.10 117.98 111.40 3a8k s PHE 159 Ca 0.11 1.07 0.02 0.00 0.12 0.00 0.00 56.93 58.25 3a8k s PHE 159 Cb 0.14 -3.23 0.12 0.00 -0.57 0.00 0.00 43.02 39.48 3a8k s PHE 159 CO 0.56 -2.30 0.95 0.54 -0.10 0.00 0.00 175.22 174.87 3a8k s ASN 160 N -3.73 4.50 0.26 1.36 2.20 -1.26 -4.92 114.94 113.34 3a8k s ASN 160 Ca 0.63 -0.51 -0.05 0.00 -0.94 0.00 0.00 52.86 51.99 3a8k s ASN 160 Cb -0.16 0.12 0.31 0.00 -2.00 0.00 0.00 41.25 39.52 3a8k s ASN 160 CO 0.55 -1.76 1.92 0.44 -2.94 0.00 0.00 177.10 175.31 3a8k h ASP 161 N -0.37 1.12 -0.27 3.54 3.32 -1.99 -0.95 116.42 120.82 3a8k h ASP 161 Ca -0.34 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 56.60 3a8k h ASP 161 Cb 1.27 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 3a8k h ASP 161 CO 0.40 0.78 -0.11 0.00 -1.72 0.00 0.00 179.24 178.59 3a8k h ALA 162 N 1.40 1.09 -0.09 3.45 0.00 -1.99 0.75 119.26 123.87 3a8k h ALA 162 Ca 0.39 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3a8k h ALA 162 Cb -0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3a8k h ALA 162 CO -0.11 0.56 0.01 1.96 0.00 0.00 0.00 179.25 181.68 3a8k h GLN 163 N 0.62 0.15 -0.94 0.00 4.20 -1.80 -0.21 115.11 117.12 3a8k h GLN 163 Ca 0.11 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.79 3a8k h GLN 163 Cb 0.55 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.26 3a8k h GLN 163 CO 0.03 0.38 0.62 0.00 -0.67 0.00 0.00 178.83 179.20 3a8k h ARG 164 N -0.10 1.23 -0.84 1.46 3.08 -0.97 -2.19 114.38 116.04 3a8k h ARG 164 Ca 0.03 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 3a8k h ARG 164 Cb 0.31 -0.28 -0.04 0.00 0.08 0.00 0.00 29.97 30.04 3a8k h ARG 164 CO 0.00 0.81 0.48 0.37 -1.07 0.00 0.00 179.97 180.56 3a8k h GLN 165 N 1.26 1.16 -0.09 0.04 4.15 -0.58 -2.01 115.11 119.04 3a8k h GLN 165 Ca 0.35 -0.12 -0.10 0.00 0.77 0.00 0.00 58.65 59.56 3a8k h GLN 165 Cb -0.12 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 27.32 3a8k h GLN 165 CO -0.08 0.83 -0.37 0.00 -1.93 0.00 0.00 178.83 177.28 3a8k h ALA 166 N 1.36 1.20 -0.43 3.38 0.00 -0.43 -2.82 119.26 121.53 3a8k h ALA 166 Ca 0.30 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3a8k h ALA 166 Cb -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3a8k h ALA 166 CO -0.05 0.55 0.00 1.33 0.00 0.00 0.00 179.25 181.07 3a8k n VAL 167 N -4.06 0.62 -1.72 0.00 0.24 -0.97 -4.89 118.33 107.55 3a8k n VAL 167 Ca -0.01 -0.81 -0.42 0.00 -2.04 0.00 0.00 64.34 61.05 3a8k n VAL 167 Cb 0.44 0.86 -0.03 0.00 -1.47 0.00 0.00 33.84 33.64 3a8k n VAL 167 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3a8k s GLU 168 N -1.30 4.15 -1.63 7.34 2.12 -0.78 -1.38 118.70 127.22 3a8k s GLU 168 Ca 0.37 2.56 0.00 0.00 0.36 0.00 0.00 54.97 58.26 3a8k s GLU 168 Cb 0.21 -3.93 0.00 0.00 0.26 0.00 0.00 34.13 30.67 3a8k s GLU 168 CO 0.29 -0.90 0.00 0.41 -0.54 0.00 0.00 175.26 174.52 3a8k n GLY 169 N 4.38 1.43 3.71 -1.50 0.00 -1.26 -4.95 105.19 107.01 3a8k n GLY 169 Ca 0.19 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 3a8k n GLY 169 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3a8k s MET 170 N -3.44 4.27 0.80 1.61 1.75 -0.48 -5.00 119.30 118.82 3a8k s MET 170 Ca 0.00 2.18 -0.11 0.00 -1.25 0.00 0.00 55.69 56.51 3a8k s MET 170 Cb 0.00 -3.27 0.07 0.00 2.84 0.00 0.00 34.83 34.48 3a8k s MET 170 CO 0.00 -0.53 1.09 0.15 -0.65 0.00 0.00 175.02 175.08 3a8k s LYS 171 N 1.33 2.03 0.66 4.11 1.02 -1.26 -5.00 119.74 122.63 3a8k s LYS 171 Ca 0.67 0.90 -0.17 0.00 0.02 0.00 0.00 55.97 57.39 3a8k s LYS 171 Cb -0.39 -1.89 -0.00 0.00 -0.52 0.00 0.00 37.83 35.03 3a8k s LYS 171 CO 0.30 -1.72 1.24 -2.14 -0.92 0.00 0.00 175.35 172.11 3a8k s PRO 172 N -5.00 2.53 -0.88 -1.68 0.02 -1.26 -3.72 135.00 125.01 3a8k s PRO 172 Ca 0.61 1.90 -0.03 0.00 0.02 0.00 0.00 61.00 63.49 3a8k s PRO 172 Cb -0.16 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.50 3a8k s PRO 172 CO 0.56 -1.57 0.75 1.19 -0.33 0.00 0.00 177.00 177.60 3a8k n PHE 173 N -2.10 -1.76 -4.18 6.54 3.01 0.50 -4.95 117.46 114.53 3a8k n PHE 173 Ca 0.14 0.67 -0.17 0.00 1.01 0.00 0.00 57.45 59.10 3a8k n PHE 173 Cb 0.49 -3.91 -0.12 0.00 -0.01 0.00 0.00 39.48 35.94 3a8k n PHE 173 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3a8k s PHE 174 N -3.23 1.18 -0.01 1.38 0.08 -1.24 -1.11 117.98 115.03 3a8k s PHE 174 Ca 0.22 -0.52 0.01 0.00 0.12 0.00 0.00 56.93 56.76 3a8k s PHE 174 Cb -0.10 -0.65 0.01 0.00 -0.57 0.00 0.00 43.02 41.70 3a8k s PHE 174 CO 0.50 0.05 -0.02 0.20 -0.10 0.00 0.00 175.22 175.85 3a8k s GLY 175 N -2.00 0.17 0.00 4.36 0.00 0.13 -0.99 107.32 108.98 3a8k s GLY 175 Ca 0.01 -0.04 0.01 0.00 0.00 0.00 0.00 44.72 44.69 3a8k s GLY 175 CO 0.02 0.09 -0.02 0.54 0.00 0.00 0.00 173.10 173.72 3a8k s VAL 176 N 0.23 0.17 -0.10 1.40 0.11 0.91 -4.38 120.40 118.73 3a8k s VAL 176 Ca -0.02 -0.21 -0.23 0.00 -2.93 0.00 0.00 61.98 58.60 3a8k s VAL 176 Cb -0.05 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.60 3a8k s VAL 176 CO -0.01 -0.03 0.67 -1.58 -3.33 0.00 0.00 175.10 170.83 3a8k s GLN 177 N -0.25 4.39 -0.27 1.54 2.00 -1.26 -0.61 119.66 125.19 3a8k s GLN 177 Ca -0.01 0.80 -0.03 0.00 -2.00 0.00 0.00 55.36 54.12 3a8k s GLN 177 Cb -0.02 -3.47 0.09 0.00 0.80 0.00 0.00 33.01 30.41 3a8k s GLN 177 CO -0.00 0.01 0.11 0.00 -0.50 0.00 0.00 175.29 174.91 3a8k s ALA 178 N 1.00 0.80 0.00 1.58 0.00 0.17 -5.01 121.76 120.30 3a8k s ALA 178 Ca 0.35 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 51.24 3a8k s ALA 178 Cb -0.17 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 21.58 3a8k s ALA 178 CO 0.16 -1.55 0.00 0.41 0.00 0.00 0.00 175.76 174.78 3a8k n GLY 179 N 5.16 2.55 1.79 0.00 0.00 -1.26 -2.35 105.19 111.08 3a8k n GLY 179 Ca -0.06 -0.42 -0.03 0.00 0.00 0.00 0.00 46.02 45.52 3a8k n GLY 179 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3a8k n ASP 180 N 2.70 4.61 -4.69 1.61 5.68 -1.26 -4.79 116.55 120.41 3a8k n ASP 180 Ca 0.00 -3.23 -0.36 0.00 -0.50 0.00 0.00 54.79 50.70 3a8k n ASP 180 Cb 0.00 -0.71 -0.09 0.00 -1.14 0.00 0.00 41.12 39.18 3a8k n ASP 180 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 3a8k s LEU 181 N -2.99 4.15 -0.34 -2.12 1.43 -0.99 -4.23 118.68 113.60 3a8k s LEU 181 Ca 0.53 0.20 -0.12 0.00 -1.03 0.00 0.00 54.13 53.71 3a8k s LEU 181 Cb 0.43 -2.15 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 3a8k s LEU 181 CO 0.12 0.09 0.22 0.12 0.23 0.00 0.00 176.35 177.13 3a8k s PHE 182 N 0.84 3.21 -0.18 0.29 5.36 -0.07 -0.66 117.98 126.78 3a8k s PHE 182 Ca 0.09 -0.37 -0.02 0.00 -0.96 0.00 0.00 56.93 55.68 3a8k s PHE 182 Cb -0.13 -2.44 -0.01 0.00 -0.34 0.00 0.00 43.02 40.10 3a8k s PHE 182 CO 0.03 -0.41 -0.10 0.42 -1.46 0.00 0.00 175.22 173.70 3a8k s ILE 183 N 1.68 3.08 -0.03 3.12 1.01 0.21 -0.88 121.20 129.40 3a8k s ILE 183 Ca 0.05 -0.61 0.04 0.00 0.00 0.00 0.00 60.65 60.13 3a8k s ILE 183 Cb -0.17 -2.35 -0.00 0.00 0.01 0.00 0.00 42.46 39.94 3a8k s ILE 183 CO 0.09 0.48 -0.14 0.00 0.00 0.00 0.00 174.94 175.36 3a8k s ALA 184 N 1.05 1.26 -1.43 9.38 0.00 -0.50 -0.06 121.76 131.45 3a8k s ALA 184 Ca -0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 51.96 51.27 3a8k s ALA 184 Cb -0.15 -0.40 0.06 0.00 0.00 0.00 0.00 23.12 22.63 3a8k s ALA 184 CO -0.02 0.24 2.27 0.25 0.00 0.00 0.00 175.76 178.50 3a8k n THR 185 N 3.08 3.92 -4.22 0.00 -2.24 -0.17 -0.31 114.28 114.35 3a8k n THR 185 Ca -0.17 -3.37 -0.13 0.00 -2.27 0.00 0.00 64.05 58.11 3a8k n THR 185 Cb 0.54 -2.52 -0.10 0.00 -2.10 0.00 0.00 70.33 66.15 3a8k n THR 185 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3a8k s THR 186 N 2.07 0.42 0.00 4.28 -4.23 -1.26 -0.37 115.64 116.55 3a8k s THR 186 Ca 0.49 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 59.04 3a8k s THR 186 Cb 0.14 -2.21 0.00 0.00 1.34 0.00 0.00 72.50 71.77 3a8k s THR 186 CO -0.06 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.27 3a8k n GLY 187 N -0.23 -0.26 1.34 3.99 0.00 -1.26 -3.87 105.19 104.90 3a8k n GLY 187 Ca -0.04 -0.93 0.03 0.00 0.00 0.00 0.00 46.02 45.08 3a8k n GLY 187 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3a8k n TYR 188 N -0.06 0.23 0.00 1.61 9.36 -1.26 -4.79 117.16 122.24 3a8k n TYR 188 Ca 0.00 -1.04 0.00 0.00 3.32 0.00 0.00 57.90 60.18 3a8k n TYR 188 Cb 0.00 -0.20 0.00 0.00 -0.63 0.00 0.00 39.34 38.51 3a8k n TYR 188 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 3a8k n THR 189 N -0.18 0.00 -0.70 2.97 -2.24 -1.26 -3.40 114.28 109.47 3a8k n THR 189 Ca 0.12 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 3a8k n THR 189 Cb 0.96 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.70 3a8k n THR 189 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a8k n GLY 190 N 1.68 0.64 3.73 3.38 0.00 -1.26 -4.59 105.19 108.76 3a8k n GLY 190 Ca 0.00 -0.11 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 3a8k n GLY 190 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3a8k s GLU 191 N -0.46 2.17 0.97 1.61 0.41 -1.26 -1.03 118.70 121.11 3a8k s GLU 191 Ca 0.00 -1.95 -0.12 0.00 -0.41 0.00 0.00 54.97 52.49 3a8k s GLU 191 Cb 0.00 -1.89 0.17 0.00 -1.78 0.00 0.00 34.13 30.64 3a8k s GLU 191 CO 0.00 -0.15 1.08 0.00 -0.49 0.00 0.00 175.26 175.71 3a8k s ALA 192 N -2.65 1.00 0.00 5.21 0.00 -1.26 -4.78 121.76 119.28 3a8k s ALA 192 Ca 0.37 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.26 3a8k s ALA 192 Cb 0.05 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.95 3a8k s ALA 192 CO 0.20 -2.80 0.00 0.41 0.00 0.00 0.00 175.76 173.57 3a8k n GLY 193 N -0.59 -0.47 3.26 0.00 0.00 -1.26 -0.91 105.19 105.22 3a8k n GLY 193 Ca 0.06 -1.38 -0.20 0.00 0.00 0.00 0.00 46.02 44.50 3a8k n GLY 193 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a8k s TYR 194 N -1.90 1.57 -0.17 1.61 2.02 0.11 -4.13 117.35 116.47 3a8k s TYR 194 Ca 0.00 -0.49 -0.01 0.00 -0.37 0.00 0.00 57.07 56.21 3a8k s TYR 194 Cb 0.00 -0.83 -0.00 0.00 -0.40 0.00 0.00 41.96 40.73 3a8k s TYR 194 CO 0.00 0.19 -0.13 -1.21 -1.57 0.00 0.00 175.55 172.84 3a8k s GLU 195 N -2.37 3.27 -0.23 -0.62 2.02 0.58 0.01 118.70 121.36 3a8k s GLU 195 Ca 0.08 -0.71 0.02 0.00 0.02 0.00 0.00 54.97 54.38 3a8k s GLU 195 Cb -0.07 -2.71 0.05 0.00 0.10 0.00 0.00 34.13 31.50 3a8k s GLU 195 CO 0.04 -0.01 -0.11 0.42 0.02 0.00 0.00 175.26 175.62 3a8k s ILE 196 N 0.91 1.90 -0.07 -1.63 1.01 0.20 -1.41 121.20 122.10 3a8k s ILE 196 Ca -0.03 -1.31 -0.10 0.00 0.00 0.00 0.00 60.65 59.21 3a8k s ILE 196 Cb -0.15 -1.99 -0.05 0.00 0.01 0.00 0.00 42.46 40.28 3a8k s ILE 196 CO -0.01 0.08 0.26 0.00 0.00 0.00 0.00 174.94 175.26 3a8k s ALA 197 N 1.26 3.80 0.25 9.38 0.00 -0.06 -1.06 121.76 135.32 3a8k s ALA 197 Ca -0.05 -0.46 -0.20 0.00 0.00 0.00 0.00 51.96 51.26 3a8k s ALA 197 Cb -0.18 -2.15 0.02 0.00 0.00 0.00 0.00 23.12 20.81 3a8k s ALA 197 CO -0.07 0.56 0.64 -0.48 0.00 0.00 0.00 175.76 176.41 3a8k s LEU 198 N -1.04 -0.17 0.33 0.00 2.34 -0.55 -0.89 118.68 118.70 3a8k s LEU 198 Ca 0.19 -0.56 -0.28 0.00 0.06 0.00 0.00 54.13 53.53 3a8k s LEU 198 Cb -0.14 2.50 -0.12 0.00 -0.56 0.00 0.00 46.19 47.87 3a8k s LEU 198 CO 0.08 -1.23 1.31 -2.65 -1.06 0.00 0.00 176.35 172.80 3a8k n PRO 199 N -0.42 2.13 -0.30 1.48 -0.02 -1.26 -0.33 135.00 136.28 3a8k n PRO 199 Ca -0.06 0.75 0.11 0.00 -2.02 0.00 0.00 63.50 62.28 3a8k n PRO 199 Cb 0.61 -2.34 0.25 0.00 -0.02 0.00 0.00 33.50 31.99 3a8k n PRO 199 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3a8k h ASN 200 N 2.79 -0.25 0.36 2.55 2.35 -1.61 0.11 115.58 121.88 3a8k h ASN 200 Ca -0.46 0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 3a8k h ASN 200 Cb 1.28 0.36 0.00 0.00 0.05 0.00 0.00 38.32 40.01 3a8k h ASN 200 CO 0.64 -0.23 0.00 1.05 -1.65 0.00 0.00 177.43 177.25 3a8k h GLU 201 N 0.11 0.00 -0.00 0.81 9.09 -1.89 -2.42 114.58 120.28 3a8k h GLU 201 Ca 0.52 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.93 3a8k h GLU 201 Cb 1.03 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.13 3a8k h GLU 201 CO -0.74 0.00 -0.78 1.63 0.05 0.00 0.00 179.01 179.17 3a8k n LYS 202 N -2.36 1.28 -0.22 1.06 5.02 0.36 -4.63 118.16 118.68 3a8k n LYS 202 Ca -0.00 -0.08 -0.08 0.00 -2.02 0.00 0.00 58.31 56.13 3a8k n LYS 202 Cb 0.13 -1.32 0.03 0.00 -0.02 0.00 0.00 35.03 33.85 3a8k n LYS 202 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3a8k h ALA 203 N 2.52 0.81 -0.68 7.82 0.00 -1.12 -2.07 119.26 126.54 3a8k h ALA 203 Ca 0.00 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 3a8k h ALA 203 Cb 0.43 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3a8k h ALA 203 CO 0.00 0.53 0.19 0.00 0.00 0.00 0.00 179.25 179.96 3a8k h ALA 204 N 1.05 1.05 -0.47 0.00 0.00 -1.82 0.49 119.26 119.56 3a8k h ALA 204 Ca 0.19 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3a8k h ALA 204 Cb 0.36 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3a8k h ALA 204 CO 0.00 0.63 0.09 -0.44 0.00 0.00 0.00 179.25 179.53 3a8k h ASP 205 N 1.01 0.73 -0.68 0.00 3.32 -1.80 0.29 116.42 119.30 3a8k h ASP 205 Ca 0.22 -0.25 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 3a8k h ASP 205 Cb 0.32 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 3a8k h ASP 205 CO -0.00 0.80 0.29 0.15 -1.72 0.00 0.00 179.24 178.76 3a8k h PHE 206 N 0.64 1.02 -0.30 4.55 3.57 -1.08 -1.70 116.94 123.65 3a8k h PHE 206 Ca 0.14 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 3a8k h PHE 206 Cb 0.37 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 3a8k h PHE 206 CO 0.03 0.78 0.10 2.35 -2.23 0.00 0.00 178.31 179.34 3a8k h TRP 207 N 0.96 0.47 -0.67 0.41 2.91 -0.62 -0.86 115.95 118.54 3a8k h TRP 207 Ca 0.23 -0.04 0.13 0.00 1.13 0.00 0.00 58.89 60.34 3a8k h TRP 207 Cb 0.17 -0.14 -0.10 0.00 -0.51 0.00 0.00 29.16 28.59 3a8k h TRP 207 CO 0.01 0.48 0.17 0.00 -1.03 0.00 0.00 178.44 178.06 3a8k h ARG 208 N 0.32 0.28 -0.69 2.65 3.08 -0.65 -1.29 114.38 118.08 3a8k h ARG 208 Ca 0.10 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 3a8k h ARG 208 Cb 0.22 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.18 3a8k h ARG 208 CO -0.00 0.18 0.36 0.00 -1.07 0.00 0.00 179.97 179.44 3a8k h ALA 209 N 1.54 0.88 -0.27 0.04 0.00 -0.85 -2.55 119.26 118.05 3a8k h ALA 209 Ca 0.37 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 3a8k h ALA 209 Cb 0.58 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3a8k h ALA 209 CO -0.45 0.41 -0.48 -0.07 0.00 0.00 0.00 179.25 178.67 3a8k h LEU 210 N 0.94 0.79 -0.14 0.00 3.38 -0.57 -1.21 115.31 118.51 3a8k h LEU 210 Ca 0.24 -0.39 0.02 0.00 0.09 0.00 0.00 57.88 57.84 3a8k h LEU 210 Cb 0.06 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3a8k h LEU 210 CO -0.04 1.14 0.02 0.58 0.09 0.00 0.00 178.44 180.24 3a8k h VAL 211 N 0.58 0.93 -0.60 1.22 2.07 -1.14 -0.46 116.25 118.85 3a8k h VAL 211 Ca 0.03 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 3a8k h VAL 211 Cb 1.04 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 3a8k h VAL 211 CO 0.10 0.02 0.24 -0.08 0.02 0.00 0.00 177.57 177.86 3a8k h GLU 212 N 0.08 0.86 0.00 1.57 4.22 -1.36 -0.82 114.58 119.13 3a8k h GLU 212 Ca 0.06 -0.13 0.00 0.00 0.08 0.00 0.00 59.36 59.37 3a8k h GLU 212 Cb 0.06 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.16 3a8k h GLU 212 CO -0.09 0.71 0.00 0.00 -2.18 0.00 0.00 179.01 177.45 3a8k n ALA 213 N -2.45 2.23 -0.77 2.92 0.00 -0.46 -4.84 120.51 117.14 3a8k n ALA 213 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3a8k n ALA 213 Cb 0.17 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.41 3a8k n ALA 213 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a8k n GLY 214 N 0.25 0.95 3.55 0.00 0.00 -0.31 -4.94 105.19 104.69 3a8k n GLY 214 Ca 0.10 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 3a8k n GLY 214 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a8k s VAL 215 N -2.00 5.29 0.05 1.61 1.01 -0.22 -4.63 120.40 121.51 3a8k s VAL 215 Ca 0.00 -0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 3a8k s VAL 215 Cb 0.00 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 3a8k s VAL 215 CO 0.00 0.09 0.96 -0.75 0.00 0.00 0.00 175.10 175.40 3a8k s LYS 216 N 1.74 4.61 0.14 2.72 2.20 -0.89 -4.07 119.74 126.18 3a8k s LYS 216 Ca 0.06 1.42 -0.31 0.00 -0.36 0.00 0.00 55.97 56.78 3a8k s LYS 216 Cb -0.17 -3.42 -0.10 0.00 -1.51 0.00 0.00 37.83 32.63 3a8k s LYS 216 CO 0.11 0.07 1.61 -2.14 -0.36 0.00 0.00 175.35 174.64 3a8k s PRO 217 N 0.57 4.20 -0.05 4.03 0.02 -1.26 -0.72 135.00 141.79 3a8k s PRO 217 Ca 0.49 2.38 0.06 0.00 0.02 0.00 0.00 61.00 63.95 3a8k s PRO 217 Cb -0.22 -3.31 -0.01 0.00 0.02 0.00 0.00 34.50 30.98 3a8k s PRO 217 CO 0.28 -0.66 -0.22 0.00 -0.33 0.00 0.00 177.00 176.07 3a8k n GLY 219 N 2.94 1.38 0.35 0.00 0.00 -1.26 -4.36 105.19 104.24 3a8k n GLY 219 Ca -0.17 -2.10 0.12 0.00 0.00 0.00 0.00 46.02 43.87 3a8k n GLY 219 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3a8k h LEU 220 N 0.00 0.36 0.55 0.99 3.38 -0.66 -2.03 115.31 117.90 3a8k h LEU 220 Ca -0.15 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 3a8k h LEU 220 Cb 0.64 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.33 3a8k h LEU 220 CO 0.19 0.22 -0.27 1.23 0.09 0.00 0.00 178.44 179.90 3a8k h GLY 221 N 0.40 -0.78 1.46 0.83 0.00 -1.44 0.22 103.07 103.77 3a8k h GLY 221 Ca 0.27 0.29 -0.05 0.00 0.00 0.00 0.00 47.33 47.84 3a8k h GLY 221 CO -0.07 -0.28 0.05 0.00 0.00 0.00 0.00 176.54 176.23 3a8k h ALA 222 N -0.47 1.28 -0.94 3.60 0.00 -1.75 -2.24 119.26 118.74 3a8k h ALA 222 Ca -0.08 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 54.69 3a8k h ALA 222 Cb 0.61 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 3a8k h ALA 222 CO 0.13 0.49 0.60 -0.09 0.00 0.00 0.00 179.25 180.38 3a8k h ARG 223 N 0.64 1.05 -0.25 0.00 2.43 -0.73 0.95 114.38 118.47 3a8k h ARG 223 Ca 0.14 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 3a8k h ARG 223 Cb 0.33 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 3a8k h ARG 223 CO 0.01 0.70 -0.08 0.22 -1.51 0.00 0.00 179.97 179.30 3a8k h ASP 224 N 1.08 0.50 -0.10 -3.80 3.58 -0.41 -1.45 116.42 115.82 3a8k h ASP 224 Ca 0.41 -0.38 0.01 0.00 0.42 0.00 0.00 57.03 57.49 3a8k h ASP 224 Cb 0.18 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.09 3a8k h ASP 224 CO -0.18 0.77 0.04 0.74 -2.88 0.00 0.00 179.24 177.73 3a8k h THR 225 N 0.22 0.99 -0.21 2.25 2.02 -0.97 -2.22 112.91 114.98 3a8k h THR 225 Ca 0.06 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.21 3a8k h THR 225 Cb 0.56 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 3a8k h THR 225 CO 0.03 0.02 0.14 -0.07 0.37 0.00 0.00 175.52 176.01 3a8k h LEU 226 N 0.09 0.24 -1.12 2.58 3.38 -0.76 -1.88 115.31 117.84 3a8k h LEU 226 Ca 0.04 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 3a8k h LEU 226 Cb 0.02 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3a8k h LEU 226 CO -0.04 0.18 -0.30 0.08 0.09 0.00 0.00 178.44 178.45 3a8k h ARG 227 N 0.29 0.24 0.08 1.13 -0.00 -1.10 -2.01 114.38 113.01 3a8k h ARG 227 Ca 0.08 -0.09 -0.00 0.00 -0.00 0.00 0.00 59.98 59.97 3a8k h ARG 227 Cb -0.03 -0.02 0.00 0.00 -0.00 0.00 0.00 29.97 29.92 3a8k h ARG 227 CO -0.02 0.52 -0.04 1.25 -0.00 0.00 0.00 179.97 181.68 3a8k h LEU 228 N 0.21 -0.09 -0.99 0.08 5.85 -1.24 0.20 115.31 119.33 3a8k h LEU 228 Ca 0.03 -0.44 0.35 0.00 0.84 0.00 0.00 57.88 58.66 3a8k h LEU 228 Cb 0.64 0.02 -0.16 0.00 0.37 0.00 0.00 40.66 41.53 3a8k h LEU 228 CO 0.05 0.42 0.48 -0.33 -0.34 0.00 0.00 178.44 178.72 3a8k h GLU 229 N -0.64 0.16 0.00 1.25 5.08 -1.35 0.19 114.58 119.27 3a8k h GLU 229 Ca -0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3a8k h GLU 229 Cb 0.53 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.74 3a8k h GLU 229 CO 0.02 0.11 0.00 0.00 -1.00 0.00 0.00 179.01 178.14 3a8k n ALA 230 N -2.39 2.41 -1.97 3.43 0.00 -0.76 -0.14 120.51 121.09 3a8k n ALA 230 Ca 0.32 -0.14 -0.05 0.00 0.00 0.00 0.00 53.44 53.58 3a8k n ALA 230 Cb 1.05 -1.46 -0.00 0.00 0.00 0.00 0.00 19.45 19.04 3a8k n ALA 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a8k n GLY 231 N 1.11 0.24 3.84 0.00 0.00 0.68 -4.70 105.19 106.36 3a8k n GLY 231 Ca 0.14 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 45.08 3a8k n GLY 231 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3a8k s MET 232 N -4.01 3.83 0.32 1.61 -1.94 0.58 -4.84 119.30 114.83 3a8k s MET 232 Ca 0.00 0.26 -0.29 0.00 -1.71 0.00 0.00 55.69 53.95 3a8k s MET 232 Cb 0.00 -3.23 -0.10 0.00 2.01 0.00 0.00 34.83 33.51 3a8k s MET 232 CO 0.00 0.68 1.23 -0.80 -0.01 0.00 0.00 175.02 176.12 3a8k s ASN 233 N -0.94 6.93 -0.25 3.03 0.01 -1.26 -4.52 114.94 117.94 3a8k s ASN 233 Ca 0.21 2.54 -0.07 0.00 -0.71 0.00 0.00 52.86 54.83 3a8k s ASN 233 Cb -0.15 -2.64 -0.02 0.00 0.41 0.00 0.00 41.25 38.84 3a8k s ASN 233 CO 0.10 -0.40 0.06 -0.22 -1.51 0.00 0.00 177.10 175.13 3a8k s LEU 234 N -1.70 3.44 0.24 0.60 2.96 -1.26 -5.01 118.68 117.95 3a8k s LEU 234 Ca 0.48 -0.29 -0.31 0.00 -0.22 0.00 0.00 54.13 53.78 3a8k s LEU 234 Cb -0.37 -1.90 -0.13 0.00 0.50 0.00 0.00 46.19 44.29 3a8k s LEU 234 CO 0.48 -0.05 1.48 0.00 -1.32 0.00 0.00 176.35 176.94 3a8k n TYR 235 N 4.91 2.36 0.00 5.38 9.36 -1.26 -1.33 117.16 136.57 3a8k n TYR 235 Ca -0.16 0.36 0.00 0.00 3.32 0.00 0.00 57.90 61.42 3a8k n TYR 235 Cb 0.51 -2.51 0.00 0.00 -0.63 0.00 0.00 39.34 36.71 3a8k n TYR 235 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3a8k n GLY 236 N 2.36 2.45 0.83 2.98 0.00 0.87 -4.84 105.19 109.84 3a8k n GLY 236 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 3a8k n GLY 236 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3a8k n GLN 237 N -2.00 0.08 0.21 1.61 6.02 -0.45 -4.76 117.38 118.10 3a8k n GLN 237 Ca 0.00 0.03 0.08 0.00 -0.01 0.00 0.00 57.00 57.10 3a8k n GLN 237 Cb 0.00 -0.51 0.44 0.00 1.02 0.00 0.00 30.24 31.19 3a8k n GLN 237 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 3a8k h GLU 238 N -0.14 0.00 -2.71 -1.09 3.07 -1.62 -3.45 114.58 108.64 3a8k h GLU 238 Ca 0.00 0.00 0.07 0.00 -0.50 0.00 0.00 59.36 58.93 3a8k h GLU 238 Cb 0.14 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 27.95 3a8k h GLU 238 CO 0.00 0.29 0.33 0.00 -1.40 0.00 0.00 179.01 178.23 3a8k s MET 239 N -3.79 1.27 0.00 2.33 0.23 -1.26 -4.65 119.30 113.43 3a8k s MET 239 Ca -0.01 -0.58 0.00 0.00 -1.03 0.00 0.00 55.69 54.07 3a8k s MET 239 Cb 0.11 0.51 0.00 0.00 -1.53 0.00 0.00 34.83 33.92 3a8k s MET 239 CO 0.66 -0.57 0.00 -0.40 -2.03 0.00 0.00 175.02 172.68 3a8k n ASP 240 N -0.38 0.00 0.09 -1.18 5.68 -1.26 -0.09 116.55 119.41 3a8k n ASP 240 Ca -0.10 -0.43 0.09 0.00 -0.50 0.00 0.00 54.79 53.85 3a8k n ASP 240 Cb 0.62 0.00 0.40 0.00 -1.14 0.00 0.00 41.12 41.00 3a8k n ASP 240 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3a8k n GLU 241 N 0.00 0.11 0.00 0.11 4.71 -0.93 -1.13 120.64 123.50 3a8k n GLU 241 Ca 0.00 0.43 0.11 0.00 -0.01 0.00 0.00 57.16 57.69 3a8k n GLU 241 Cb 0.00 -1.75 0.13 0.00 -1.01 0.00 0.00 31.44 28.81 3a8k n GLU 241 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3a8k n THR 242 N -1.96 0.00 -5.03 2.62 -2.24 -1.26 -4.25 114.28 102.15 3a8k n THR 242 Ca 0.02 -0.05 -0.32 0.00 -2.27 0.00 0.00 64.05 61.43 3a8k n THR 242 Cb 0.15 0.62 -0.16 0.00 -2.10 0.00 0.00 70.33 68.84 3a8k n THR 242 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3a8k s ILE 243 N -2.87 2.53 0.38 2.28 -1.09 -0.28 -4.96 121.20 117.19 3a8k s ILE 243 Ca 0.13 -0.87 -0.26 0.00 -2.23 0.00 0.00 60.65 57.42 3a8k s ILE 243 Cb 0.17 -2.00 -0.09 0.00 -1.58 0.00 0.00 42.46 38.97 3a8k s ILE 243 CO 0.71 0.55 1.20 -0.55 -1.23 0.00 0.00 174.94 175.62 3a8k s SER 244 N 0.13 6.57 0.59 3.58 0.15 -1.26 -2.65 113.70 120.81 3a8k s SER 244 Ca -0.10 2.42 0.29 0.00 0.70 0.00 0.00 55.95 59.27 3a8k s SER 244 Cb -0.16 -2.62 1.80 0.00 -1.71 0.00 0.00 66.02 63.33 3a8k s SER 244 CO 0.06 -0.65 2.24 1.55 1.20 0.00 0.00 173.24 177.65 3a8k h PRO 245 N 2.82 0.00 0.00 5.44 0.13 -1.94 -1.35 132.00 137.09 3a8k h PRO 245 Ca -0.49 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.60 3a8k h PRO 245 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 3a8k h PRO 245 CO 0.63 0.00 -0.21 -0.07 -0.23 0.00 0.00 178.00 178.12 3a8k h LEU 246 N 0.00 0.00 -2.09 1.56 3.38 -1.91 -1.51 115.31 114.75 3a8k h LEU 246 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3a8k h LEU 246 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3a8k h LEU 246 CO -0.00 0.21 0.00 0.00 0.09 0.00 0.00 178.44 178.74 3a8k n ALA 247 N -2.34 2.54 -2.05 1.53 0.00 -0.51 -4.19 120.51 115.49 3a8k n ALA 247 Ca -0.02 -1.00 0.04 0.00 0.00 0.00 0.00 53.44 52.46 3a8k n ALA 247 Cb 0.32 -0.97 0.06 0.00 0.00 0.00 0.00 19.45 18.85 3a8k n ALA 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a8k n ALA 248 N 1.01 2.44 -3.63 0.00 0.00 -0.72 -3.67 120.51 115.94 3a8k n ALA 248 Ca 0.18 -2.12 -0.24 0.00 0.00 0.00 0.00 53.44 51.27 3a8k n ALA 248 Cb 0.51 -0.57 0.07 0.00 0.00 0.00 0.00 19.45 19.46 3a8k n ALA 248 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3a8k n ASN 249 N -0.11 -4.86 -0.24 0.00 5.15 -1.19 -4.87 115.26 109.13 3a8k n ASN 249 Ca 0.07 -0.62 0.03 0.00 -0.60 0.00 0.00 54.58 53.46 3a8k n ASN 249 Cb 0.89 -4.77 0.04 0.00 -0.53 0.00 0.00 39.78 35.40 3a8k n ASN 249 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 3a8k n MET 250 N -4.73 0.98 -0.26 1.20 2.81 -0.65 -4.66 117.12 111.81 3a8k n MET 250 Ca -0.07 -1.18 0.14 0.00 -1.81 0.00 0.00 57.70 54.79 3a8k n MET 250 Cb 0.58 -1.11 0.42 0.00 -0.71 0.00 0.00 33.22 32.40 3a8k n MET 250 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 3a8k h GLY 251 N 0.99 1.13 2.00 3.03 0.00 -1.84 -0.63 103.07 107.75 3a8k h GLY 251 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.06 3a8k h GLY 251 CO 0.00 0.05 0.00 0.11 0.00 0.00 0.00 176.54 176.70 3a8k h TRP 252 N 0.61 0.00 -0.19 5.60 5.08 -1.93 -1.94 115.95 123.18 3a8k h TRP 252 Ca 0.46 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.43 3a8k h TRP 252 Cb 0.86 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.02 3a8k h TRP 252 CO -0.00 0.00 0.00 0.25 -1.28 0.00 0.00 178.44 177.41 3a8k n THR 253 N -2.64 0.24 -2.93 0.12 -2.24 -0.25 -4.87 114.28 101.71 3a8k n THR 253 Ca -0.01 -0.62 -0.41 0.00 -2.27 0.00 0.00 64.05 60.73 3a8k n THR 253 Cb 0.10 1.23 -0.05 0.00 -2.10 0.00 0.00 70.33 69.52 3a8k n THR 253 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3a8k s ILE 254 N -1.64 4.87 -1.04 2.28 -1.09 -0.73 -2.76 121.20 121.08 3a8k s ILE 254 Ca 0.31 1.49 -0.13 0.00 -2.23 0.00 0.00 60.65 60.09 3a8k s ILE 254 Cb 0.20 -4.08 0.21 0.00 -1.58 0.00 0.00 42.46 37.21 3a8k s ILE 254 CO 0.29 -0.05 1.12 0.00 -1.23 0.00 0.00 174.94 175.07 3a8k s ALA 255 N 2.72 4.18 0.24 9.38 0.00 -0.56 -4.87 121.76 132.86 3a8k s ALA 255 Ca 0.33 -3.43 -0.06 0.00 0.00 0.00 0.00 51.96 48.81 3a8k s ALA 255 Cb -0.15 -3.78 0.29 0.00 0.00 0.00 0.00 23.12 19.48 3a8k s ALA 255 CO 0.08 -2.50 1.88 -1.49 0.00 0.00 0.00 175.76 173.73 3a8k h TRP 256 N 7.40 1.07 -3.10 0.00 4.06 -1.94 -3.42 115.95 120.03 3a8k h TRP 256 Ca 0.20 0.03 -0.63 0.00 2.06 0.00 0.00 58.89 60.54 3a8k h TRP 256 Cb 0.94 -0.35 -0.12 0.00 -1.00 0.00 0.00 29.16 28.62 3a8k h TRP 256 CO 0.98 0.60 -0.52 -1.21 -3.56 0.00 0.00 178.44 174.73 3a8k s GLU 257 N -6.09 3.81 0.41 0.49 0.41 -1.26 -3.16 118.70 113.32 3a8k s GLU 257 Ca -0.13 -0.24 -0.23 0.00 -0.41 0.00 0.00 54.97 53.96 3a8k s GLU 257 Cb 0.18 -3.24 -0.10 0.00 -1.78 0.00 0.00 34.13 29.19 3a8k s GLU 257 CO 0.80 0.47 1.00 -1.25 -0.49 0.00 0.00 175.26 175.79 3a8k s PRO 258 N -0.15 4.21 0.43 0.39 0.04 -1.26 -5.03 135.00 133.63 3a8k s PRO 258 Ca 0.09 1.35 0.10 0.00 0.04 0.00 0.00 61.00 62.58 3a8k s PRO 258 Cb -0.12 -2.43 0.95 0.00 0.04 0.00 0.00 34.50 32.95 3a8k s PRO 258 CO 0.01 -0.07 2.04 0.00 0.04 0.00 0.00 177.00 179.02 3a8k h ALA 259 N 2.33 1.73 0.00 8.56 0.00 -1.91 -2.59 119.26 127.38 3a8k h ALA 259 Ca -0.48 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3a8k h ALA 259 Cb 1.20 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3a8k h ALA 259 CO 0.62 0.22 0.00 -0.40 0.00 0.00 0.00 179.25 179.69 3a8k n ASP 260 N -4.44 0.00 -4.46 0.00 5.75 -1.26 -4.67 116.55 107.47 3a8k n ASP 260 Ca 0.00 -1.34 -0.43 0.00 -0.01 0.00 0.00 54.79 53.02 3a8k n ASP 260 Cb 0.13 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.18 3a8k n ASP 260 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 3a8k s ARG 261 N -2.00 3.15 0.44 0.11 3.52 -0.98 -5.02 118.95 118.17 3a8k s ARG 261 Ca 0.31 -0.84 -0.23 0.00 -0.13 0.00 0.00 55.73 54.84 3a8k s ARG 261 Cb 0.14 -4.28 -0.08 0.00 -1.56 0.00 0.00 34.95 29.17 3a8k s ARG 261 CO 0.24 -1.85 1.14 0.34 -0.81 0.00 0.00 175.30 174.35 3a8k s ASP 262 N 3.71 6.36 0.05 -2.12 2.15 -1.26 -5.03 116.67 120.53 3a8k s ASP 262 Ca 0.24 2.24 -0.15 0.00 0.43 0.00 0.00 52.55 55.31 3a8k s ASP 262 Cb -0.15 -2.60 0.03 0.00 -0.30 0.00 0.00 42.92 39.89 3a8k s ASP 262 CO 0.09 -0.78 0.34 0.72 -0.17 0.00 0.00 175.17 175.37 3a8k s PHE 263 N -1.56 -0.16 -0.00 -5.34 -0.12 -1.26 -4.17 117.98 105.37 3a8k s PHE 263 Ca 0.61 0.03 -0.30 0.00 -0.05 0.00 0.00 56.93 57.22 3a8k s PHE 263 Cb -0.27 0.14 -0.07 0.00 -0.63 0.00 0.00 43.02 42.19 3a8k s PHE 263 CO 0.33 -0.54 1.78 0.42 -0.05 0.00 0.00 175.22 177.17 3a8k s ILE 264 N -2.67 3.29 0.00 -4.49 1.01 -0.05 -1.95 121.20 116.34 3a8k s ILE 264 Ca -0.04 0.40 0.00 0.00 0.00 0.00 0.00 60.65 61.01 3a8k s ILE 264 Cb -0.00 -3.26 0.00 0.00 0.01 0.00 0.00 42.46 39.21 3a8k s ILE 264 CO -0.04 -0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.48 3a8k n GLY 265 N 4.29 0.70 0.44 6.18 0.00 -1.24 -4.47 105.19 111.08 3a8k n GLY 265 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 3a8k n GLY 265 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3a8k h ARG 266 N 3.54 -0.46 -0.54 1.61 2.43 -1.71 0.24 114.38 119.48 3a8k h ARG 266 Ca 0.00 0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.29 3a8k h ARG 266 Cb 0.00 0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 29.59 3a8k h ARG 266 CO 0.00 -0.31 0.17 0.93 -1.51 0.00 0.00 179.97 179.25 3a8k h GLU 267 N -0.48 0.32 -0.44 0.20 5.08 -1.90 0.19 114.58 117.55 3a8k h GLU 267 Ca 0.07 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.44 3a8k h GLU 267 Cb 0.64 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 3a8k h GLU 267 CO -0.49 0.21 0.24 0.00 -1.00 0.00 0.00 179.01 177.97 3a8k h ALA 268 N 1.39 0.55 -0.73 3.43 0.00 -1.69 -2.42 119.26 119.79 3a8k h ALA 268 Ca 0.27 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 3a8k h ALA 268 Cb 0.34 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3a8k h ALA 268 CO -0.30 -0.10 0.22 -0.07 0.00 0.00 0.00 179.25 179.00 3a8k h LEU 269 N 0.48 1.05 -0.91 0.00 4.07 -0.09 -2.23 115.31 117.69 3a8k h LEU 269 Ca 0.18 -0.20 0.01 0.00 0.08 0.00 0.00 57.88 57.95 3a8k h LEU 269 Cb 0.05 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 41.47 3a8k h LEU 269 CO -0.10 0.98 0.59 -0.33 -1.08 0.00 0.00 178.44 178.50 3a8k h GLU 270 N 1.08 1.20 -0.05 1.13 5.08 -0.27 0.18 114.58 122.93 3a8k h GLU 270 Ca 0.23 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3a8k h GLU 270 Cb 0.31 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 3a8k h GLU 270 CO -0.01 0.81 0.02 0.28 -1.00 0.00 0.00 179.01 179.11 3a8k h VAL 271 N 1.23 1.15 -0.81 3.13 2.07 -1.24 -2.02 116.25 119.77 3a8k h VAL 271 Ca 0.33 -0.46 0.11 0.00 0.82 0.00 0.00 66.70 67.50 3a8k h VAL 271 Cb -0.12 1.36 -0.08 0.00 -1.52 0.00 0.00 31.29 30.93 3a8k h VAL 271 CO -0.07 0.13 0.45 1.56 0.02 0.00 0.00 177.57 179.65 3a8k h GLN 272 N -0.09 0.70 -0.04 1.57 4.20 -1.13 -1.15 115.11 119.17 3a8k h GLN 272 Ca 0.02 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3a8k h GLN 272 Cb 0.19 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 3a8k h GLN 272 CO -0.00 0.46 0.01 -0.09 -0.67 0.00 0.00 178.83 178.54 3a8k h ARG 273 N 0.72 0.03 -0.52 1.46 2.43 -0.47 0.42 114.38 118.45 3a8k h ARG 273 Ca 0.41 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.57 3a8k h ARG 273 Cb 0.44 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.96 3a8k h ARG 273 CO -0.28 0.02 0.29 0.93 -1.51 0.00 0.00 179.97 179.41 3a8k h GLU 274 N 0.03 0.72 0.04 0.20 5.08 -0.98 -3.22 114.58 116.45 3a8k h GLU 274 Ca 0.02 -0.08 -0.23 0.00 -1.00 0.00 0.00 59.36 58.07 3a8k h GLU 274 Cb 0.01 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 3a8k h GLU 274 CO -0.02 0.55 -1.02 0.45 -1.00 0.00 0.00 179.01 177.97 3a8k h HIS 275 N 0.69 0.39 0.00 4.33 3.86 -1.16 -3.51 115.15 119.75 3a8k h HIS 275 Ca 0.18 -0.24 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 3a8k h HIS 275 Cb 0.04 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.48 3a8k h HIS 275 CO -0.02 1.11 0.00 0.41 0.86 0.00 0.00 177.93 180.29 3a8k n GLY 276 N 1.15 1.72 3.35 2.45 0.00 0.15 -5.08 105.19 108.93 3a8k n GLY 276 Ca -0.05 -1.77 -0.20 0.00 0.00 0.00 0.00 46.02 44.00 3a8k n GLY 276 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3a8k s THR 277 N -2.55 0.25 1.05 2.61 -4.23 -1.26 -4.85 115.64 106.66 3a8k s THR 277 Ca 0.00 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.39 3a8k s THR 277 Cb 0.00 -2.47 0.22 0.00 1.34 0.00 0.00 72.50 71.59 3a8k s THR 277 CO 0.00 0.00 1.07 -1.61 -0.54 0.00 0.00 174.62 173.54 3a8k s GLU 278 N -3.69 -0.03 0.02 3.99 2.02 -1.26 -4.37 118.70 115.38 3a8k s GLU 278 Ca 0.35 1.01 0.02 0.00 0.02 0.00 0.00 54.97 56.37 3a8k s GLU 278 Cb 0.04 -1.64 -0.02 0.00 0.10 0.00 0.00 34.13 32.61 3a8k s GLU 278 CO 0.20 -3.17 -0.07 -1.59 0.02 0.00 0.00 175.26 170.64 3a8k s LYS 279 N -4.61 0.51 -0.16 1.61 -2.85 -0.09 -3.96 119.74 110.20 3a8k s LYS 279 Ca 0.67 -0.53 -0.27 0.00 -1.00 0.00 0.00 55.97 54.84 3a8k s LYS 279 Cb -0.23 -0.39 -0.01 0.00 -2.06 0.00 0.00 37.83 35.14 3a8k s LYS 279 CO 0.61 0.09 0.91 -1.17 0.10 0.00 0.00 175.35 175.90 3a8k s LEU 280 N -0.96 4.19 0.29 2.77 2.96 -1.24 -1.77 118.68 124.92 3a8k s LEU 280 Ca -0.04 1.31 0.06 0.00 -0.22 0.00 0.00 54.13 55.24 3a8k s LEU 280 Cb -0.07 -3.38 -0.06 0.00 0.50 0.00 0.00 46.19 43.19 3a8k s LEU 280 CO 0.00 -0.45 -0.02 0.68 -1.32 0.00 0.00 176.35 175.25 3a8k s VAL 281 N 2.24 1.48 0.22 1.68 -7.23 0.87 -4.50 120.40 115.15 3a8k s VAL 281 Ca 0.42 -2.07 -0.06 0.00 -1.81 0.00 0.00 61.98 58.45 3a8k s VAL 281 Cb -0.17 -2.56 -0.06 0.00 0.56 0.00 0.00 36.38 34.15 3a8k s VAL 281 CO 0.13 -0.21 0.49 -0.83 -0.31 0.00 0.00 175.10 174.38 3a8k s GLY 282 N -3.45 2.11 0.02 2.32 0.00 0.43 -0.95 107.32 107.80 3a8k s GLY 282 Ca 0.31 -0.47 0.05 0.00 0.00 0.00 0.00 44.72 44.62 3a8k s GLY 282 CO 0.13 -0.36 -0.16 1.08 0.00 0.00 0.00 173.10 173.79 3a8k s LEU 283 N -3.02 2.12 -0.10 0.66 1.43 -0.17 -0.39 118.68 119.21 3a8k s LEU 283 Ca 0.44 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 53.17 3a8k s LEU 283 Cb -0.11 -0.74 0.01 0.00 0.03 0.00 0.00 46.19 45.38 3a8k s LEU 283 CO 0.25 0.11 -0.21 -0.69 0.23 0.00 0.00 176.35 176.05 3a8k s VAL 284 N -0.66 1.85 -0.25 -1.59 1.01 0.11 -1.17 120.40 119.70 3a8k s VAL 284 Ca 0.04 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.14 3a8k s VAL 284 Cb -0.07 -1.62 0.03 0.00 0.00 0.00 0.00 36.38 34.72 3a8k s VAL 284 CO 0.01 0.51 -0.09 -0.32 0.00 0.00 0.00 175.10 175.21 3a8k s MET 285 N 0.53 2.69 0.10 2.72 1.75 -0.20 -1.68 119.30 125.22 3a8k s MET 285 Ca -0.15 -1.06 0.09 0.00 -1.25 0.00 0.00 55.69 53.32 3a8k s MET 285 Cb -0.17 -2.93 -0.19 0.00 2.84 0.00 0.00 34.83 34.39 3a8k s MET 285 CO 0.05 -0.43 1.14 1.79 -0.65 0.00 0.00 175.02 176.93 3a8k h THR 286 N 6.27 1.40 -4.26 10.11 1.35 -1.85 -2.57 112.91 123.36 3a8k h THR 286 Ca -0.31 -3.10 -0.50 0.00 -0.55 0.00 0.00 66.41 61.95 3a8k h THR 286 Cb 1.09 2.68 0.08 0.00 -1.73 0.00 0.00 68.15 70.28 3a8k h THR 286 CO 0.56 0.80 0.37 -1.83 -0.25 0.00 0.00 175.52 175.17 3a8k s GLU 287 N -2.72 3.13 0.84 4.72 1.03 -1.26 -4.91 118.70 119.53 3a8k s GLU 287 Ca -0.00 1.09 -0.12 0.00 0.03 0.00 0.00 54.97 55.96 3a8k s GLU 287 Cb 0.09 -2.01 0.10 0.00 -0.80 0.00 0.00 34.13 31.51 3a8k s GLU 287 CO 0.81 -0.96 1.19 0.15 -1.33 0.00 0.00 175.26 175.13 3a8k s LYS 288 N -4.53 1.42 0.00 -4.83 -0.14 -1.26 -4.85 119.74 105.54 3a8k s LYS 288 Ca 0.61 1.72 0.00 0.00 -1.36 0.00 0.00 55.97 56.94 3a8k s LYS 288 Cb -0.15 -1.76 0.00 0.00 -1.68 0.00 0.00 37.83 34.24 3a8k s LYS 288 CO 0.45 -2.37 0.00 0.41 -0.76 0.00 0.00 175.35 173.08 3a8k n GLY 289 N 0.46 4.03 3.53 -3.33 0.00 -1.26 -5.07 105.19 103.54 3a8k n GLY 289 Ca 0.13 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 3a8k n GLY 289 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a8k s VAL 290 N -2.06 5.06 -0.44 1.61 1.01 -1.26 -4.90 120.40 119.42 3a8k s VAL 290 Ca 0.00 0.03 -0.29 0.00 0.00 0.00 0.00 61.98 61.72 3a8k s VAL 290 Cb 0.00 -3.97 0.01 0.00 0.00 0.00 0.00 36.38 32.42 3a8k s VAL 290 CO 0.00 -0.28 1.38 -0.76 0.00 0.00 0.00 175.10 175.44 3a8k s LEU 291 N 2.25 3.57 0.21 3.92 1.43 -1.26 -5.01 118.68 123.79 3a8k s LEU 291 Ca 0.15 0.71 0.11 0.00 -1.03 0.00 0.00 54.13 54.07 3a8k s LEU 291 Cb -0.16 -3.49 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 3a8k s LEU 291 CO 0.13 -1.45 -0.20 -0.60 0.23 0.00 0.00 176.35 174.47 3a8k s ARG 292 N 4.95 1.67 0.69 1.70 3.52 -1.26 -3.52 118.95 126.70 3a8k s ARG 292 Ca 0.59 -1.52 -0.16 0.00 -0.13 0.00 0.00 55.73 54.51 3a8k s ARG 292 Cb -0.12 -1.90 0.02 0.00 -1.56 0.00 0.00 34.95 31.39 3a8k s ARG 292 CO 0.32 0.39 1.23 0.54 -0.81 0.00 0.00 175.30 176.97 3a8k s ASN 293 N -2.88 4.41 0.00 -2.12 2.20 -1.26 -3.37 114.94 111.92 3a8k s ASN 293 Ca 0.23 2.42 0.00 0.00 -0.94 0.00 0.00 52.86 54.58 3a8k s ASN 293 Cb -0.07 -2.60 0.00 0.00 -2.00 0.00 0.00 41.25 36.58 3a8k s ASN 293 CO 0.12 -2.12 0.00 -0.62 -2.94 0.00 0.00 177.10 171.54 3a8k n GLU 294 N -2.40 0.00 -1.76 3.55 1.02 0.65 -4.97 120.64 116.73 3a8k n GLU 294 Ca 0.14 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.87 3a8k n GLU 294 Cb 0.50 -1.79 -0.01 0.00 -0.02 0.00 0.00 31.44 30.11 3a8k n GLU 294 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3a8k n LEU 295 N 0.00 4.62 -4.77 -4.62 4.32 -1.22 -4.69 117.00 110.65 3a8k n LEU 295 Ca 0.00 1.18 -0.37 0.00 -0.02 0.00 0.00 56.01 56.80 3a8k n LEU 295 Cb 0.00 -1.62 -0.00 0.00 -1.62 0.00 0.00 43.42 40.18 3a8k n LEU 295 CO 0.00 0.19 0.86 -2.84 -1.22 0.00 0.00 177.39 174.38 3a8k s PRO 296 N -1.22 3.72 -0.10 3.23 0.02 -1.26 -0.88 135.00 138.51 3a8k s PRO 296 Ca 0.59 1.86 0.04 0.00 0.02 0.00 0.00 61.00 63.51 3a8k s PRO 296 Cb -0.48 -2.44 0.00 0.00 0.02 0.00 0.00 34.50 31.61 3a8k s PRO 296 CO 0.55 -0.61 -0.23 0.08 -0.33 0.00 0.00 177.00 176.47 3a8k s VAL 297 N -1.48 1.99 0.04 3.83 1.01 -0.61 -2.00 120.40 123.17 3a8k s VAL 297 Ca 0.63 -0.97 0.07 0.00 0.00 0.00 0.00 61.98 61.72 3a8k s VAL 297 Cb -0.31 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 3a8k s VAL 297 CO 0.38 0.54 -0.22 -0.13 0.00 0.00 0.00 175.10 175.67 3a8k s ARG 298 N 0.44 1.49 0.06 2.72 0.52 -0.01 0.50 118.95 124.67 3a8k s ARG 298 Ca -0.17 -0.94 -0.13 0.00 -0.52 0.00 0.00 55.73 53.97 3a8k s ARG 298 Cb -0.17 -1.59 0.02 0.00 0.52 0.00 0.00 34.95 33.73 3a8k s ARG 298 CO 0.07 0.41 0.30 -0.59 0.02 0.00 0.00 175.30 175.51 3a8k s PHE 299 N -0.76 -0.09 -0.12 -0.53 -0.71 -0.96 -0.65 117.98 114.15 3a8k s PHE 299 Ca 0.08 -0.11 -0.00 0.00 -1.04 0.00 0.00 56.93 55.86 3a8k s PHE 299 Cb -0.09 0.10 -0.02 0.00 -1.21 0.00 0.00 43.02 41.80 3a8k s PHE 299 CO 0.01 -0.54 -0.12 0.99 -1.34 0.00 0.00 175.22 174.23 3a8k s THR 300 N -2.88 3.20 0.51 -4.49 2.01 -1.26 0.04 115.64 112.78 3a8k s THR 300 Ca -0.03 -0.62 -0.05 0.00 0.31 0.00 0.00 61.69 61.30 3a8k s THR 300 Cb 0.00 -2.34 0.11 0.00 0.01 0.00 0.00 72.50 70.28 3a8k s THR 300 CO -0.05 0.53 0.70 -0.90 -0.69 0.00 0.00 174.62 174.21 3a8k n ASP 301 N 3.32 0.46 0.01 3.53 5.68 0.57 -4.84 116.55 125.28 3a8k n ASP 301 Ca -0.18 -1.50 0.13 0.00 -0.50 0.00 0.00 54.79 52.74 3a8k n ASP 301 Cb 0.53 -0.50 0.57 0.00 -1.14 0.00 0.00 41.12 40.57 3a8k n ASP 301 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3a8k h ALA 302 N -1.18 2.11 -0.32 2.12 0.00 -1.89 -1.99 119.26 118.11 3a8k h ALA 302 Ca -0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3a8k h ALA 302 Cb 0.73 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3a8k h ALA 302 CO 0.20 -0.21 0.00 1.04 0.00 0.00 0.00 179.25 180.28 3a8k n GLN 303 N -4.46 2.08 -0.12 0.00 3.00 -1.26 -4.91 117.38 111.71 3a8k n GLN 303 Ca 0.07 -1.64 0.00 0.00 -0.01 0.00 0.00 57.00 55.42 3a8k n GLN 303 Cb 0.35 -1.43 0.00 0.00 0.00 0.00 0.00 30.24 29.17 3a8k n GLN 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3a8k n GLY 304 N 1.28 0.56 3.68 1.08 0.00 -0.75 -5.05 105.19 106.00 3a8k n GLY 304 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 3a8k n GLY 304 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a8k s ASN 305 N -2.80 7.04 0.38 1.61 0.01 -1.26 -4.74 114.94 115.18 3a8k s ASN 305 Ca 0.00 1.74 -0.24 0.00 -0.71 0.00 0.00 52.86 53.64 3a8k s ASN 305 Cb 0.00 -2.55 -0.09 0.00 0.41 0.00 0.00 41.25 39.01 3a8k s ASN 305 CO 0.00 -0.62 1.01 -1.58 -1.51 0.00 0.00 177.10 174.40 3a8k s GLN 306 N 2.59 4.29 0.06 -0.60 0.74 -1.26 -0.32 119.66 125.16 3a8k s GLN 306 Ca 0.54 1.43 0.01 0.00 0.05 0.00 0.00 55.36 57.39 3a8k s GLN 306 Cb -0.23 -2.58 -0.04 0.00 1.10 0.00 0.00 33.01 31.26 3a8k s GLN 306 CO 0.19 -0.01 -0.05 -1.01 -0.55 0.00 0.00 175.29 173.86 3a8k s HIS 307 N -1.69 0.66 -0.03 1.67 3.76 0.11 -4.94 115.29 114.82 3a8k s HIS 307 Ca 0.56 -0.87 0.01 0.00 -0.15 0.00 0.00 55.06 54.61 3a8k s HIS 307 Cb -0.20 -0.42 0.02 0.00 1.11 0.00 0.00 32.58 33.09 3a8k s HIS 307 CO 0.25 -0.23 -0.05 -2.00 -0.85 0.00 0.00 174.74 171.86 3a8k s GLU 308 N -3.29 0.79 0.00 1.40 2.12 -1.26 -2.27 118.70 116.19 3a8k s GLU 308 Ca 0.04 -0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.22 3a8k s GLU 308 Cb 0.02 -0.78 0.00 0.00 0.26 0.00 0.00 34.13 33.63 3a8k s GLU 308 CO -0.05 -0.02 0.00 0.41 -0.54 0.00 0.00 175.26 175.05 3a8k n GLY 309 N 3.77 5.73 3.39 -1.50 0.00 0.18 -4.53 105.19 112.22 3a8k n GLY 309 Ca -0.23 -1.71 -0.14 0.00 0.00 0.00 0.00 46.02 43.94 3a8k n GLY 309 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3a8k s ILE 310 N -0.55 0.01 0.09 -0.61 2.07 -0.02 -1.57 121.20 120.62 3a8k s ILE 310 Ca 0.00 -0.08 -0.31 0.00 -1.41 0.00 0.00 60.65 58.85 3a8k s ILE 310 Cb 0.00 -0.72 -0.07 0.00 0.13 0.00 0.00 42.46 41.80 3a8k s ILE 310 CO 0.00 -0.05 1.34 -0.63 -1.91 0.00 0.00 174.94 173.69 3a8k s ILE 311 N -0.20 3.54 -0.16 2.00 1.01 -0.05 -1.30 121.20 126.05 3a8k s ILE 311 Ca -0.04 1.10 -0.09 0.00 0.00 0.00 0.00 60.65 61.62 3a8k s ILE 311 Cb -0.03 -3.70 -0.23 0.00 0.01 0.00 0.00 42.46 38.50 3a8k s ILE 311 CO 0.02 0.08 0.25 0.35 0.00 0.00 0.00 174.94 175.64 3a8k n THR 312 N 4.01 1.69 -3.88 2.92 -2.24 0.41 -0.25 114.28 116.95 3a8k n THR 312 Ca 0.11 -0.51 -0.11 0.00 -2.27 0.00 0.00 64.05 61.27 3a8k n THR 312 Cb 0.44 -1.77 -0.11 0.00 -2.10 0.00 0.00 70.33 66.78 3a8k n THR 312 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3a8k s SER 313 N -6.97 0.02 0.04 3.42 0.01 -1.09 -4.63 113.70 104.50 3a8k s SER 313 Ca -0.26 -0.14 -0.00 0.00 1.31 0.00 0.00 55.95 56.86 3a8k s SER 313 Cb 0.07 0.20 -0.03 0.00 0.21 0.00 0.00 66.02 66.47 3a8k s SER 313 CO 0.71 -0.27 -0.03 -0.83 0.41 0.00 0.00 173.24 173.22 3a8k s GLY 314 N -1.02 0.39 0.04 3.44 0.00 -1.26 -0.30 107.32 108.61 3a8k s GLY 314 Ca -0.11 -0.95 -0.27 0.00 0.00 0.00 0.00 44.72 43.39 3a8k s GLY 314 CO 0.01 -1.04 0.79 -1.08 0.00 0.00 0.00 173.10 171.79 3a8k s THR 315 N -2.79 0.00 -0.13 0.90 -1.32 -0.56 -4.81 115.64 106.93 3a8k s THR 315 Ca -0.03 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.17 3a8k s THR 315 Cb -0.00 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.98 3a8k s THR 315 CO -0.06 0.00 0.95 0.12 -2.21 0.00 0.00 174.62 173.43 3a8k s PHE 316 N -3.21 3.47 -0.49 9.09 5.36 -1.26 -1.21 117.98 129.73 3a8k s PHE 316 Ca 0.03 1.48 -0.22 0.00 -0.96 0.00 0.00 56.93 57.26 3a8k s PHE 316 Cb -0.01 -3.14 0.04 0.00 -0.34 0.00 0.00 43.02 39.57 3a8k s PHE 316 CO -0.09 -0.24 0.77 0.45 -1.46 0.00 0.00 175.22 174.64 3a8k s SER 317 N 1.11 6.33 0.39 6.13 0.15 -0.02 -4.94 113.70 122.85 3a8k s SER 317 Ca 0.45 -0.42 0.08 0.00 0.70 0.00 0.00 55.95 56.76 3a8k s SER 317 Cb -0.17 -2.37 0.80 0.00 -1.71 0.00 0.00 66.02 62.57 3a8k s SER 317 CO 0.15 -0.98 1.96 -0.65 1.20 0.00 0.00 173.24 174.92 3a8k h PRO 318 N 9.07 0.38 -0.49 5.44 0.11 -1.95 0.83 132.00 145.39 3a8k h PRO 318 Ca -0.26 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 65.73 3a8k h PRO 318 Cb 1.09 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 3a8k h PRO 318 CO 0.99 0.39 0.08 1.15 -0.21 0.00 0.00 178.00 180.39 3a8k h THR 319 N 0.37 1.25 0.00 -1.15 2.02 -1.95 -3.22 112.91 110.23 3a8k h THR 319 Ca 0.09 -0.92 -0.19 0.00 0.77 0.00 0.00 66.41 66.16 3a8k h THR 319 Cb 0.21 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 3a8k h THR 319 CO 0.00 0.33 -1.23 -0.07 0.37 0.00 0.00 175.52 174.92 3a8k h LEU 320 N 0.68 0.00 0.00 2.58 3.38 -1.94 -3.47 115.31 116.54 3a8k h LEU 320 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3a8k h LEU 320 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3a8k h LEU 320 CO 0.01 0.70 0.00 0.61 0.09 0.00 0.00 178.44 179.85 3a8k n GLY 321 N 1.39 0.70 3.39 0.83 0.00 0.28 -5.05 105.19 106.72 3a8k n GLY 321 Ca -0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 3a8k n GLY 321 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a8k s TYR 322 N -2.50 1.81 0.40 1.61 2.02 -1.18 -4.96 117.35 114.55 3a8k s TYR 322 Ca 0.00 -0.79 -0.24 0.00 -0.37 0.00 0.00 57.07 55.67 3a8k s TYR 322 Cb 0.00 -1.05 -0.09 0.00 -0.40 0.00 0.00 41.96 40.42 3a8k s TYR 322 CO 0.00 0.16 1.08 -1.12 -1.57 0.00 0.00 175.55 174.10 3a8k s SER 323 N -3.40 6.69 0.06 2.29 0.01 -0.97 -0.84 113.70 117.55 3a8k s SER 323 Ca 0.29 2.11 -0.00 0.00 1.31 0.00 0.00 55.95 59.66 3a8k s SER 323 Cb 0.05 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 3a8k s SER 323 CO 0.11 -0.54 -0.04 0.27 0.41 0.00 0.00 173.24 173.45 3a8k s ILE 324 N -1.59 0.34 0.02 1.44 -4.36 -0.35 -1.03 121.20 115.67 3a8k s ILE 324 Ca 0.58 -1.84 -0.24 0.00 -0.26 0.00 0.00 60.65 58.89 3a8k s ILE 324 Cb -0.24 -1.57 0.05 0.00 1.25 0.00 0.00 42.46 41.95 3a8k s ILE 324 CO 0.30 -0.96 0.54 0.00 0.24 0.00 0.00 174.94 175.05 3a8k s ALA 325 N -3.84 -1.38 0.02 2.27 0.00 -0.32 -1.49 121.76 117.02 3a8k s ALA 325 Ca 0.08 0.74 -0.01 0.00 0.00 0.00 0.00 51.96 52.78 3a8k s ALA 325 Cb 0.07 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 3a8k s ALA 325 CO -0.09 -0.44 0.18 -0.51 0.00 0.00 0.00 175.76 174.90 3a8k s LEU 326 N -1.71 4.31 -0.09 0.00 1.43 0.59 -0.99 118.68 122.21 3a8k s LEU 326 Ca -0.08 0.29 -0.08 0.00 -1.03 0.00 0.00 54.13 53.23 3a8k s LEU 326 Cb -0.01 -2.71 0.03 0.00 0.03 0.00 0.00 46.19 43.53 3a8k s LEU 326 CO 0.02 0.23 0.24 0.00 0.23 0.00 0.00 176.35 177.06 3a8k s ALA 327 N -1.39 -0.58 -0.19 4.21 0.00 -0.13 -0.44 121.76 123.25 3a8k s ALA 327 Ca 0.30 0.71 -0.12 0.00 0.00 0.00 0.00 51.96 52.85 3a8k s ALA 327 Cb -0.13 -0.42 -0.05 0.00 0.00 0.00 0.00 23.12 22.52 3a8k s ALA 327 CO 0.22 -0.12 0.21 0.50 0.00 0.00 0.00 175.76 176.56 3a8k s ARG 328 N 0.29 4.20 0.02 0.00 3.52 -0.42 -0.09 118.95 126.47 3a8k s ARG 328 Ca -0.01 -0.09 -0.07 0.00 -0.13 0.00 0.00 55.73 55.42 3a8k s ARG 328 Cb -0.03 -3.45 -0.00 0.00 -1.56 0.00 0.00 34.95 29.91 3a8k s ARG 328 CO -0.01 0.23 0.14 0.14 -0.81 0.00 0.00 175.30 174.98 3a8k s VAL 329 N 0.55 0.10 0.65 7.11 -7.23 -0.73 -0.84 120.40 120.02 3a8k s VAL 329 Ca 0.12 -0.84 -0.17 0.00 -1.81 0.00 0.00 61.98 59.27 3a8k s VAL 329 Cb -0.12 -0.65 -0.03 0.00 0.56 0.00 0.00 36.38 36.14 3a8k s VAL 329 CO 0.01 -0.46 0.93 -2.65 -0.31 0.00 0.00 175.10 172.62 3a8k n PRO 330 N 1.12 0.71 -0.80 4.82 -0.02 -1.26 -0.91 135.00 138.66 3a8k n PRO 330 Ca -0.21 0.29 -0.31 0.00 -2.02 0.00 0.00 63.50 61.25 3a8k n PRO 330 Cb 0.57 -2.16 0.15 0.00 -0.02 0.00 0.00 33.50 32.04 3a8k n PRO 330 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3a8k s GLU 331 N -2.96 1.23 0.00 -0.52 2.02 -1.26 -4.00 118.70 113.21 3a8k s GLU 331 Ca 0.75 1.50 0.00 0.00 0.02 0.00 0.00 54.97 57.24 3a8k s GLU 331 Cb -0.39 -1.76 0.00 0.00 0.10 0.00 0.00 34.13 32.09 3a8k s GLU 331 CO 0.48 -2.47 0.00 0.41 0.02 0.00 0.00 175.26 173.71 3a8k n GLY 332 N -0.00 0.73 3.77 -1.39 0.00 -1.26 -5.06 105.19 101.98 3a8k n GLY 332 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 3a8k n GLY 332 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3a8k s ILE 333 N -2.04 2.57 0.00 -0.61 2.07 -1.26 -4.66 121.20 117.27 3a8k s ILE 333 Ca 0.00 0.51 0.00 0.00 -1.41 0.00 0.00 60.65 59.75 3a8k s ILE 333 Cb 0.00 -3.30 0.00 0.00 0.13 0.00 0.00 42.46 39.29 3a8k s ILE 333 CO 0.00 0.07 0.00 0.61 -1.91 0.00 0.00 174.94 173.71 3a8k n GLY 334 N 0.65 1.87 0.01 1.50 0.00 -1.26 -5.03 105.19 102.93 3a8k n GLY 334 Ca 0.04 -1.81 0.12 0.00 0.00 0.00 0.00 46.02 44.37 3a8k n GLY 334 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3a8k n GLU 335 N 0.00 0.04 -4.20 1.61 -0.58 -1.26 -4.70 120.64 111.55 3a8k n GLU 335 Ca 0.00 -0.03 -0.12 0.00 -0.42 0.00 0.00 57.16 56.60 3a8k n GLU 335 Cb 0.00 -1.50 -0.10 0.00 -0.57 0.00 0.00 31.44 29.27 3a8k n GLU 335 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3a8k s THR 336 N -2.98 0.72 0.25 2.62 -4.23 -1.26 -0.96 115.64 109.81 3a8k s THR 336 Ca 0.11 -1.96 -0.14 0.00 -1.18 0.00 0.00 61.69 58.52 3a8k s THR 336 Cb 0.17 -1.84 0.05 0.00 1.34 0.00 0.00 72.50 72.22 3a8k s THR 336 CO 0.71 -0.73 0.72 0.00 -0.54 0.00 0.00 174.62 174.79 3a8k n ALA 337 N -0.12 -1.74 -2.70 3.99 0.00 -0.68 -4.82 120.51 114.44 3a8k n ALA 337 Ca -0.10 -0.95 -0.17 0.00 0.00 0.00 0.00 53.44 52.21 3a8k n ALA 337 Cb 0.62 0.68 -0.12 0.00 0.00 0.00 0.00 19.45 20.63 3a8k n ALA 337 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3a8k s ILE 338 N -2.22 1.03 -0.08 0.00 -5.25 0.17 -1.81 121.20 113.05 3a8k s ILE 338 Ca 0.15 -1.33 0.03 0.00 -0.99 0.00 0.00 60.65 58.52 3a8k s ILE 338 Cb -0.03 -1.06 -0.02 0.00 2.95 0.00 0.00 42.46 44.30 3a8k s ILE 338 CO 0.08 -0.29 -0.17 0.68 -1.79 0.00 0.00 174.94 173.45 3a8k s VAL 339 N -1.44 2.79 -0.35 8.37 -7.23 0.49 -0.83 120.40 122.21 3a8k s VAL 339 Ca -0.02 -0.80 -0.24 0.00 -1.81 0.00 0.00 61.98 59.11 3a8k s VAL 339 Cb -0.09 -2.10 0.01 0.00 0.56 0.00 0.00 36.38 34.76 3a8k s VAL 339 CO 0.02 0.57 0.82 -1.58 -0.31 0.00 0.00 175.10 174.62 3a8k s GLN 340 N -0.26 3.83 -0.27 4.82 0.74 -0.85 -0.24 119.66 127.44 3a8k s GLN 340 Ca 0.01 0.46 0.00 0.00 0.05 0.00 0.00 55.36 55.88 3a8k s GLN 340 Cb -0.13 -3.78 0.05 0.00 1.10 0.00 0.00 33.01 30.24 3a8k s GLN 340 CO 0.03 -0.83 -0.07 0.42 -0.55 0.00 0.00 175.29 174.29 3a8k s ILE 341 N 3.15 2.57 0.00 -2.34 1.01 -0.39 -4.35 121.20 120.86 3a8k s ILE 341 Ca 0.33 -1.40 0.00 0.00 0.00 0.00 0.00 60.65 59.58 3a8k s ILE 341 Cb -0.13 -2.44 0.00 0.00 0.01 0.00 0.00 42.46 39.90 3a8k s ILE 341 CO 0.16 0.02 0.00 0.54 0.00 0.00 0.00 174.94 175.66 3a8k n ARG 342 N 4.55 0.00 0.13 2.79 1.74 -1.26 -0.44 116.66 124.17 3a8k n ARG 342 Ca -0.15 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 56.95 3a8k n ARG 342 Cb 0.44 0.00 0.37 0.00 -1.02 0.00 0.00 32.46 32.25 3a8k n ARG 342 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 3a8k h ASN 343 N 0.00 0.20 -2.86 0.55 4.21 -2.01 -3.46 115.58 112.20 3a8k h ASN 343 Ca 0.00 -0.05 -0.63 0.00 1.21 0.00 0.00 56.30 56.83 3a8k h ASN 343 Cb 0.00 -0.05 -0.06 0.00 -1.12 0.00 0.00 38.32 37.09 3a8k h ASN 343 CO 0.00 0.40 -0.32 -0.13 -1.29 0.00 0.00 177.43 176.09 3a8k s ARG 344 N -4.60 3.72 -0.47 0.81 0.52 0.42 -5.05 118.95 114.29 3a8k s ARG 344 Ca -0.05 0.17 -0.22 0.00 -0.52 0.00 0.00 55.73 55.11 3a8k s ARG 344 Cb 0.15 -3.21 0.03 0.00 0.52 0.00 0.00 34.95 32.44 3a8k s ARG 344 CO 0.73 0.72 0.75 -1.21 0.02 0.00 0.00 175.30 176.31 3a8k s GLU 345 N -1.01 3.31 -0.30 3.54 2.02 -1.26 -1.26 118.70 123.74 3a8k s GLU 345 Ca 0.20 -0.33 -0.17 0.00 0.02 0.00 0.00 54.97 54.68 3a8k s GLU 345 Cb -0.15 -3.99 -0.02 0.00 0.10 0.00 0.00 34.13 30.08 3a8k s GLU 345 CO 0.09 -1.17 0.48 -1.64 0.02 0.00 0.00 175.26 173.04 3a8k s MET 346 N 3.17 3.89 0.45 1.61 -1.94 0.67 -4.88 119.30 122.28 3a8k s MET 346 Ca 0.26 0.08 -0.23 0.00 -1.71 0.00 0.00 55.69 54.09 3a8k s MET 346 Cb -0.14 -3.71 -0.08 0.00 2.01 0.00 0.00 34.83 32.91 3a8k s MET 346 CO 0.19 -0.44 1.10 -2.14 -0.01 0.00 0.00 175.02 173.72 3a8k s PRO 347 N 2.29 3.87 0.03 2.03 0.02 -1.26 -0.38 135.00 141.59 3a8k s PRO 347 Ca 0.19 1.60 -0.15 0.00 0.02 0.00 0.00 61.00 62.66 3a8k s PRO 347 Cb -0.16 -2.36 0.03 0.00 0.02 0.00 0.00 34.50 32.03 3a8k s PRO 347 CO 0.11 -0.42 0.34 0.14 -0.33 0.00 0.00 177.00 176.84 3a8k s VAL 348 N -1.68 0.07 0.11 3.83 -7.23 -0.75 -4.75 120.40 110.00 3a8k s VAL 348 Ca 0.63 -0.57 -0.15 0.00 -1.81 0.00 0.00 61.98 60.09 3a8k s VAL 348 Cb -0.24 -0.87 -0.07 0.00 0.56 0.00 0.00 36.38 35.77 3a8k s VAL 348 CO 0.29 -0.31 0.53 -0.75 -0.31 0.00 0.00 175.10 174.55 3a8k s LYS 349 N -2.21 4.00 -0.15 4.82 2.20 -0.68 -1.69 119.74 126.03 3a8k s LYS 349 Ca -0.07 0.51 -0.07 0.00 -0.36 0.00 0.00 55.97 55.98 3a8k s LYS 349 Cb -0.02 -3.03 -0.04 0.00 -1.51 0.00 0.00 37.83 33.23 3a8k s LYS 349 CO -0.01 0.54 0.08 0.08 -0.36 0.00 0.00 175.35 175.69 3a8k s VAL 350 N -1.35 5.01 0.24 4.02 1.01 -0.14 0.05 120.40 129.26 3a8k s VAL 350 Ca 0.34 0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.34 3a8k s VAL 350 Cb -0.16 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 3a8k s VAL 350 CO 0.18 0.53 0.25 0.42 0.00 0.00 0.00 175.10 176.47 3a8k s THR 351 N -0.23 0.00 0.69 3.92 -4.23 0.47 -4.77 115.64 111.50 3a8k s THR 351 Ca 0.09 -1.87 -0.17 0.00 -1.18 0.00 0.00 61.69 58.56 3a8k s THR 351 Cb -0.12 -2.47 0.01 0.00 1.34 0.00 0.00 72.50 71.27 3a8k s THR 351 CO 0.01 0.00 1.22 0.29 -0.54 0.00 0.00 174.62 175.60 3a8k n LYS 352 N -0.38 0.84 -0.44 3.99 5.02 -1.26 -0.43 118.16 125.49 3a8k n LYS 352 Ca 0.02 0.35 -0.06 0.00 -2.02 0.00 0.00 58.31 56.60 3a8k n LYS 352 Cb 0.64 -2.46 -0.07 0.00 -0.02 0.00 0.00 35.03 33.12 3a8k n LYS 352 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3a8k n PRO 353 N -2.15 0.91 -3.64 1.97 -0.04 -1.26 -3.60 135.00 127.19 3a8k n PRO 353 Ca 0.15 -0.47 -0.08 0.00 -0.04 0.00 0.00 63.50 63.06 3a8k n PRO 353 Cb 0.49 -1.75 -0.07 0.00 -0.04 0.00 0.00 33.50 32.13 3a8k n PRO 353 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3a8k s VAL 354 N 2.19 0.00 -0.03 0.52 0.11 -1.26 -4.31 120.40 117.62 3a8k s VAL 354 Ca 0.29 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.36 3a8k s VAL 354 Cb 0.14 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.96 3a8k s VAL 354 CO -0.00 0.00 0.00 0.49 -3.33 0.00 0.00 175.10 172.26 3a8k n PHE 355 N 3.67 0.00 -4.18 1.54 3.01 -0.12 -4.85 117.46 116.53 3a8k n PHE 355 Ca -0.18 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.17 3a8k n PHE 355 Cb 0.58 -0.13 -0.10 0.00 -0.01 0.00 0.00 39.48 39.82 3a8k n PHE 355 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3a8k s VAL 356 N -2.06 0.73 -0.30 -4.37 1.01 0.80 -0.94 120.40 115.26 3a8k s VAL 356 Ca -0.02 -1.95 -0.10 0.00 0.00 0.00 0.00 61.98 59.91 3a8k s VAL 356 Cb 0.01 -1.73 0.17 0.00 0.00 0.00 0.00 36.38 34.83 3a8k s VAL 356 CO 0.10 -0.83 0.87 -0.60 0.00 0.00 0.00 175.10 174.63 3a8k s ARG 357 N -3.83 0.36 -0.66 2.72 3.52 -0.78 -4.45 118.95 115.83 3a8k s ARG 357 Ca 0.13 0.72 -0.09 0.00 -0.13 0.00 0.00 55.73 56.36 3a8k s ARG 357 Cb 0.05 0.41 0.01 0.00 -1.56 0.00 0.00 34.95 33.87 3a8k s ARG 357 CO -0.04 -0.30 0.65 0.09 -0.81 0.00 0.00 175.30 174.89 3a8k n ASN 358 N 5.34 -6.65 0.00 -2.12 4.13 -0.20 -2.75 115.26 113.02 3a8k n ASN 358 Ca -0.06 -0.22 0.00 0.00 1.68 0.00 0.00 54.58 55.98 3a8k n ASN 358 Cb 0.52 -3.75 0.00 0.00 -1.54 0.00 0.00 39.78 35.01 3a8k n ASN 358 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3a8k n GLY 359 N -1.21 1.30 3.12 7.41 0.00 -1.26 -4.91 105.19 109.64 3a8k n GLY 359 Ca -0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.67 3a8k n GLY 359 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a8k s LYS 360 N 0.00 2.05 0.38 1.61 1.02 -1.11 -5.02 119.74 118.66 3a8k s LYS 360 Ca 0.00 -0.61 -0.24 0.00 0.02 0.00 0.00 55.97 55.13 3a8k s LYS 360 Cb 0.00 -1.68 -0.13 0.00 -0.52 0.00 0.00 37.83 35.50 3a8k s LYS 360 CO 0.00 0.16 0.76 0.00 -0.92 0.00 0.00 175.35 175.36 3a8k n ALA 361 N 3.44 -0.91 1.25 5.17 0.00 -1.26 -1.86 120.51 126.34 3a8k n ALA 361 Ca -0.20 0.25 0.13 0.00 0.00 0.00 0.00 53.44 53.62 3a8k n ALA 361 Cb 0.52 -1.89 0.31 0.00 0.00 0.00 0.00 19.45 18.40 3a8k n ALA 361 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78