#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oz3 s LEU 1 N 0.00 4.43 -0.27 -3.43 2.96 -1.26 -5.00 118.68 116.12 2oz3 s LEU 1 Ca 0.00 2.23 -0.29 0.00 -0.22 0.00 0.00 54.13 55.85 2oz3 s LEU 1 Cb 0.00 -3.60 0.01 0.00 0.50 0.00 0.00 46.19 43.10 2oz3 s LEU 1 CO 0.00 -0.42 1.04 -0.55 -1.32 0.00 0.00 176.35 175.10 2oz3 s SER 2 N 0.34 7.02 -0.21 3.68 0.15 -1.26 -5.02 113.70 118.40 2oz3 s SER 2 Ca 0.55 1.22 -0.15 0.00 0.70 0.00 0.00 55.95 58.27 2oz3 s SER 2 Cb -0.33 -2.53 -0.04 0.00 -1.71 0.00 0.00 66.02 61.41 2oz3 s SER 2 CO 0.35 -0.74 0.36 -0.63 1.20 0.00 0.00 173.24 173.78 2oz3 s ILE 3 N 3.36 5.22 0.77 6.45 1.09 -1.26 -5.07 121.20 131.75 2oz3 s ILE 3 Ca 0.44 0.62 -0.12 0.00 -1.10 0.00 0.00 60.65 60.49 2oz3 s ILE 3 Cb -0.14 -3.70 0.06 0.00 -1.06 0.00 0.00 42.46 37.62 2oz3 s ILE 3 CO 0.10 0.26 1.13 -2.16 -0.10 0.00 0.00 174.94 174.16 2oz3 s PRO 4 N 1.35 2.10 0.36 2.79 0.04 -1.26 -4.87 135.00 135.51 2oz3 s PRO 4 Ca 0.17 1.41 0.07 0.00 0.04 0.00 0.00 61.00 62.70 2oz3 s PRO 4 Cb -0.15 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 2oz3 s PRO 4 CO 0.08 -1.80 0.42 0.95 0.04 0.00 0.00 177.00 176.69 2oz3 s THR 5 N -2.55 3.51 -0.22 1.26 -4.23 -1.26 -2.24 115.64 109.90 2oz3 s THR 5 Ca 0.66 -1.17 -0.24 0.00 -1.18 0.00 0.00 61.69 59.76 2oz3 s THR 5 Cb -0.21 -3.21 -0.01 0.00 1.34 0.00 0.00 72.50 70.41 2oz3 s THR 5 CO 0.51 -0.11 0.80 -0.63 -0.54 0.00 0.00 174.62 174.65 2oz3 s ILE 6 N -2.29 4.87 -0.16 2.99 1.01 0.55 -0.30 121.20 127.87 2oz3 s ILE 6 Ca 0.46 1.53 -0.18 0.00 0.00 0.00 0.00 60.65 62.46 2oz3 s ILE 6 Cb -0.07 -4.10 -0.16 0.00 0.01 0.00 0.00 42.46 38.14 2oz3 s ILE 6 CO 0.30 -0.03 0.28 0.50 0.00 0.00 0.00 174.94 175.98 2oz3 h LYS 7 N 7.60 0.00 -3.40 2.79 3.11 -1.14 0.83 116.57 126.37 2oz3 h LYS 7 Ca -0.25 0.00 -0.13 0.00 -2.81 0.00 0.00 60.65 57.46 2oz3 h LYS 7 Cb 1.11 0.00 -0.20 0.00 -1.00 0.00 0.00 32.23 32.14 2oz3 h LYS 7 CO 0.85 0.68 -0.41 -1.14 -2.81 0.00 0.00 179.45 176.62 2oz3 s GLN 8 N -2.18 0.59 -0.05 1.90 0.74 -0.84 -4.76 119.66 115.06 2oz3 s GLN 8 Ca -0.19 -0.41 0.06 0.00 0.05 0.00 0.00 55.36 54.87 2oz3 s GLN 8 Cb 0.02 0.25 -0.01 0.00 1.10 0.00 0.00 33.01 34.37 2oz3 s GLN 8 CO 0.47 -0.16 -0.23 0.54 -0.55 0.00 0.00 175.29 175.36 2oz3 s VAL 9 N -1.70 1.86 0.02 1.34 0.11 -1.26 -0.24 120.40 120.53 2oz3 s VAL 9 Ca -0.12 -0.97 0.04 0.00 -2.93 0.00 0.00 61.98 58.01 2oz3 s VAL 9 Cb -0.05 -1.57 -0.02 0.00 -1.53 0.00 0.00 36.38 33.21 2oz3 s VAL 9 CO 0.01 0.52 -0.13 -0.13 -3.33 0.00 0.00 175.10 172.04 2oz3 s ARG 10 N -0.19 0.91 -0.09 1.54 0.52 0.38 -4.99 118.95 117.04 2oz3 s ARG 10 Ca -0.01 -0.65 0.04 0.00 -0.52 0.00 0.00 55.73 54.59 2oz3 s ARG 10 Cb -0.12 -0.90 -0.00 0.00 0.52 0.00 0.00 34.95 34.45 2oz3 s ARG 10 CO 0.02 0.23 -0.23 0.00 0.02 0.00 0.00 175.30 175.34 2oz3 s ALA 11 N -0.69 2.11 0.11 2.13 0.00 -1.26 -0.48 121.76 123.67 2oz3 s ALA 11 Ca 0.02 -0.95 0.08 0.00 0.00 0.00 0.00 51.96 51.11 2oz3 s ALA 11 Cb -0.07 -0.76 -0.04 0.00 0.00 0.00 0.00 23.12 22.26 2oz3 s ALA 11 CO 0.01 0.31 -0.21 -0.06 0.00 0.00 0.00 175.76 175.81 2oz3 s PHE 12 N 0.22 1.83 -0.19 0.00 0.08 0.17 -4.57 117.98 115.52 2oz3 s PHE 12 Ca -0.15 -0.42 -0.09 0.00 0.12 0.00 0.00 56.93 56.40 2oz3 s PHE 12 Cb -0.17 -0.99 -0.05 0.00 -0.57 0.00 0.00 43.02 41.24 2oz3 s PHE 12 CO 0.07 0.22 0.11 0.08 -0.10 0.00 0.00 175.22 175.60 2oz3 s VAL 13 N -1.21 5.17 0.16 -0.44 1.01 -0.35 -0.27 120.40 124.48 2oz3 s VAL 13 Ca 0.07 0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.86 2oz3 s VAL 13 Cb -0.10 -3.35 -0.07 0.00 0.00 0.00 0.00 36.38 32.86 2oz3 s VAL 13 CO 0.04 0.44 1.16 -0.76 0.00 0.00 0.00 175.10 175.99 2oz3 s LEU 14 N 0.39 4.45 -0.19 3.92 1.43 -0.89 -1.84 118.68 125.94 2oz3 s LEU 14 Ca 0.06 2.13 -0.03 0.00 -1.03 0.00 0.00 54.13 55.27 2oz3 s LEU 14 Cb -0.12 -3.60 0.06 0.00 0.03 0.00 0.00 46.19 42.56 2oz3 s LEU 14 CO -0.01 -0.33 0.03 0.00 0.23 0.00 0.00 176.35 176.27 2oz3 s ARG 15 N -0.05 0.66 0.66 1.70 3.03 -1.11 -4.52 118.95 119.32 2oz3 s ARG 15 Ca 0.53 -0.43 -0.17 0.00 2.03 0.00 0.00 55.73 57.69 2oz3 s ARG 15 Cb -0.31 -2.12 -0.00 0.00 -1.03 0.00 0.00 34.95 31.49 2oz3 s ARG 15 CO 0.35 -0.64 1.23 0.20 -1.13 0.00 0.00 175.30 175.30 2oz3 s GLY 25 N 1.85 2.62 -0.41 3.88 0.00 -1.26 -4.90 107.32 109.11 2oz3 s GLY 25 Ca -0.01 1.01 0.11 0.00 0.00 0.00 0.00 44.72 45.83 2oz3 s GLY 25 CO -0.08 1.42 0.80 1.34 0.00 0.00 0.00 173.10 176.58 2oz3 n ASP 26 N -2.10 1.71 -2.79 1.64 -0.08 -1.26 -4.56 116.55 109.11 2oz3 n ASP 26 Ca 0.14 -3.14 -0.39 0.00 -1.51 0.00 0.00 54.79 49.89 2oz3 n ASP 26 Cb 0.49 -0.60 0.05 0.00 2.34 0.00 0.00 41.12 43.40 2oz3 n ASP 26 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2oz3 n GLY 27 N 0.13 5.60 3.74 0.27 0.00 -1.26 -5.08 105.19 108.59 2oz3 n GLY 27 Ca 0.25 -2.45 -0.41 0.00 0.00 0.00 0.00 46.02 43.41 2oz3 n GLY 27 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2oz3 s HIS 28 N -4.02 3.88 0.56 1.61 5.04 -1.26 -4.73 115.29 116.36 2oz3 s HIS 28 Ca 0.55 1.85 0.25 0.00 -1.54 0.00 0.00 55.06 56.16 2oz3 s HIS 28 Cb 0.45 -3.03 1.52 0.00 0.04 0.00 0.00 32.58 31.56 2oz3 s HIS 28 CO -0.33 0.29 2.11 0.11 -2.34 0.00 0.00 174.74 174.58 2oz3 h TRP 29 N 4.98 0.00 0.00 3.88 5.08 -1.61 -2.78 115.95 125.50 2oz3 h TRP 29 Ca -0.44 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.53 2oz3 h TRP 29 Cb 1.21 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.37 2oz3 h TRP 29 CO 0.63 0.00 0.00 1.51 -1.28 0.00 0.00 178.44 179.30 2oz3 n ILE 30 N -4.13 0.55 -0.42 0.12 3.06 -1.26 -2.60 119.36 114.67 2oz3 n ILE 30 Ca 0.02 0.08 0.00 0.00 -2.50 0.00 0.00 62.75 60.35 2oz3 n ILE 30 Cb 0.29 -0.78 0.00 0.00 0.54 0.00 0.00 39.64 39.70 2oz3 n ILE 30 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 2oz3 n ASP 31 N -1.69 1.22 -4.43 9.51 2.03 -1.07 -4.88 116.55 117.24 2oz3 n ASP 31 Ca 0.05 -1.64 -0.44 0.00 0.52 0.00 0.00 54.79 53.28 2oz3 n ASP 31 Cb 0.28 -0.01 -0.03 0.00 -0.72 0.00 0.00 41.12 40.63 2oz3 n ASP 31 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2oz3 s ASP 32 N -0.66 6.49 -1.45 1.67 2.15 -1.07 -4.32 116.67 119.47 2oz3 s ASP 32 Ca 0.01 -1.80 -0.11 0.00 0.43 0.00 0.00 52.55 51.07 2oz3 s ASP 32 Cb 0.01 -2.37 0.05 0.00 -0.30 0.00 0.00 42.92 40.30 2oz3 s ASP 32 CO 0.00 -1.11 1.07 1.57 -0.17 0.00 0.00 175.17 176.53 2oz3 n HIS 33 N 6.53 -2.55 -2.50 -5.34 -0.00 0.13 -4.93 115.22 106.56 2oz3 n HIS 33 Ca 0.13 0.95 -0.42 0.00 -0.00 0.00 0.00 57.72 58.38 2oz3 n HIS 33 Cb 0.47 -4.45 -0.03 0.00 -0.00 0.00 0.00 29.99 25.98 2oz3 n HIS 33 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 2oz3 s ILE 34 N -3.32 4.34 0.03 3.57 -1.09 -1.26 -4.38 121.20 119.09 2oz3 s ILE 34 Ca 0.61 1.66 -0.30 0.00 -2.23 0.00 0.00 60.65 60.39 2oz3 s ILE 34 Cb -0.29 -4.06 -0.07 0.00 -1.58 0.00 0.00 42.46 36.45 2oz3 s ILE 34 CO 0.79 0.01 1.58 -0.55 -1.23 0.00 0.00 174.94 175.53 2oz3 s SER 35 N 1.38 6.69 0.26 3.58 0.15 -0.43 -4.83 113.70 120.49 2oz3 s SER 35 Ca 0.55 2.33 0.02 0.00 0.70 0.00 0.00 55.95 59.55 2oz3 s SER 35 Cb -0.24 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.46 2oz3 s SER 35 CO 0.22 -0.84 0.06 0.42 1.20 0.00 0.00 173.24 174.29 2oz3 s THR 36 N 2.80 0.83 0.00 6.45 -4.23 -1.26 -4.48 115.64 115.75 2oz3 s THR 36 Ca 0.71 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 2oz3 s THR 36 Cb -0.36 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 70.91 2oz3 s THR 36 CO 0.30 -0.11 0.00 -2.65 -0.54 0.00 0.00 174.62 171.62 2oz3 n PRO 37 N -0.49 0.00 -0.07 3.99 -0.02 -1.26 -4.52 135.00 132.62 2oz3 n PRO 37 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 2oz3 n PRO 37 Cb 0.66 -0.91 0.00 0.00 -0.02 0.00 0.00 33.50 33.22 2oz3 n PRO 37 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oz3 n GLY 39 N 1.03 0.00 0.25 -1.23 0.00 -1.26 -4.78 105.19 99.20 2oz3 n GLY 39 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 2oz3 n GLY 39 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2oz3 h LYS 40 N 0.00 0.00 -5.05 1.61 2.10 -1.95 -3.39 116.57 109.88 2oz3 h LYS 40 Ca 0.00 0.00 -0.65 0.00 -2.00 0.00 0.00 60.65 58.00 2oz3 h LYS 40 Cb 0.00 0.00 -0.16 0.00 -0.90 0.00 0.00 32.23 31.17 2oz3 h LYS 40 CO 0.00 0.06 -0.22 0.71 -2.00 0.00 0.00 179.45 178.00 2oz3 s TYR 41 N -3.59 3.21 0.64 0.07 2.02 -1.26 -4.98 117.35 113.45 2oz3 s TYR 41 Ca 0.02 0.08 0.41 0.00 -0.37 0.00 0.00 57.07 57.21 2oz3 s TYR 41 Cb 0.09 -2.72 2.27 0.00 -0.40 0.00 0.00 41.96 41.19 2oz3 s TYR 41 CO 0.59 -0.43 2.34 -1.35 -1.57 0.00 0.00 175.55 175.12 2oz3 h PRO 42 N 8.42 0.00 -0.58 -1.71 0.11 -2.01 -1.92 132.00 134.32 2oz3 h PRO 42 Ca -0.30 0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.92 2oz3 h PRO 42 Cb 1.14 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.17 2oz3 h PRO 42 CO 0.71 0.00 0.14 0.93 -0.21 0.00 0.00 178.00 179.57 2oz3 h GLU 43 N 0.00 0.27 -0.32 1.05 5.08 -1.94 -3.24 114.58 115.48 2oz3 h GLU 43 Ca -0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2oz3 h GLU 43 Cb 0.02 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2oz3 h GLU 43 CO 0.00 0.18 0.00 0.66 -1.00 0.00 0.00 179.01 178.85 2oz3 n TYR 44 N -5.10 0.93 0.09 4.33 4.01 -0.73 -4.62 117.16 116.06 2oz3 n TYR 44 Ca 0.08 -0.76 -0.20 0.00 -0.16 0.00 0.00 57.90 56.86 2oz3 n TYR 44 Cb 0.30 -0.25 -0.15 0.00 -0.31 0.00 0.00 39.34 38.93 2oz3 n TYR 44 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 2oz3 h ARG 45 N 2.11 0.35 -0.05 -0.72 2.43 -1.56 -3.38 114.38 113.57 2oz3 h ARG 45 Ca 0.00 -0.60 -0.23 0.00 -0.81 0.00 0.00 59.98 58.34 2oz3 h ARG 45 Cb 1.31 0.22 0.02 0.00 -0.42 0.00 0.00 29.97 31.09 2oz3 h ARG 45 CO 0.19 1.25 -0.88 0.37 -1.51 0.00 0.00 179.97 179.38 2oz3 h GLN 46 N 0.10 0.69 -4.24 0.20 5.75 -1.82 -3.39 115.11 112.39 2oz3 h GLN 46 Ca -0.26 -0.67 -0.49 0.00 -0.15 0.00 0.00 58.65 57.08 2oz3 h GLN 46 Cb 2.07 0.17 -0.35 0.00 1.07 0.00 0.00 27.48 30.44 2oz3 h GLN 46 CO 0.19 1.27 -0.80 0.45 -2.65 0.00 0.00 178.83 177.29 2oz3 s SER 47 N -7.14 1.76 0.37 -0.69 0.15 -1.26 -0.69 113.70 106.20 2oz3 s SER 47 Ca -0.11 -0.25 0.10 0.00 0.70 0.00 0.00 55.95 56.39 2oz3 s SER 47 Cb 0.07 -0.72 0.71 0.00 -1.71 0.00 0.00 66.02 64.37 2oz3 s SER 47 CO 0.90 -0.06 1.86 0.03 1.20 0.00 0.00 173.24 177.16 2oz3 h ARG 48 N 7.61 0.18 -0.90 5.44 3.08 -1.82 -2.72 114.38 125.24 2oz3 h ARG 48 Ca -0.31 -0.05 0.13 0.00 0.07 0.00 0.00 59.98 59.82 2oz3 h ARG 48 Cb 1.15 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 31.12 2oz3 h ARG 48 CO 0.43 0.42 0.58 0.00 -1.07 0.00 0.00 179.97 180.32 2oz3 h ARG 49 N 0.16 0.75 -0.53 0.04 3.08 -1.95 -2.47 114.38 113.47 2oz3 h ARG 49 Ca 0.03 -0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.09 2oz3 h ARG 49 Cb 0.52 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 2oz3 h ARG 49 CO 0.04 0.49 0.35 0.66 -1.07 0.00 0.00 179.97 180.44 2oz3 h SER 50 N 0.77 0.42 0.34 7.04 4.64 -1.85 -0.85 113.55 124.05 2oz3 h SER 50 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 2oz3 h SER 50 Cb 0.61 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2oz3 h SER 50 CO -0.20 0.27 -0.54 2.22 -0.87 0.00 0.00 176.83 177.71 2oz3 n PHE 51 N -4.47 0.00 0.00 4.77 1.16 -1.05 -4.99 117.46 112.88 2oz3 n PHE 51 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.65 2oz3 n PHE 51 Cb 0.24 -0.17 0.00 0.00 -1.61 0.00 0.00 39.48 37.94 2oz3 n PHE 51 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2oz3 n GLY 52 N 1.47 0.77 0.29 4.97 0.00 -0.32 -4.97 105.19 107.40 2oz3 n GLY 52 Ca 0.07 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.28 2oz3 n GLY 52 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2oz3 h ILE 53 N 0.00 0.00 -0.01 -0.61 2.10 -1.70 -3.04 117.51 114.25 2oz3 h ILE 53 Ca 0.00 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 65.85 2oz3 h ILE 53 Cb 0.00 0.99 0.00 0.00 -1.09 0.00 0.00 36.82 36.72 2oz3 h ILE 53 CO 0.00 0.00 -0.32 -0.46 -1.08 0.00 0.00 178.15 176.29 2oz3 n ASN 54 N -2.91 1.32 0.26 2.19 6.94 -1.26 -4.67 115.26 117.13 2oz3 n ASN 54 Ca -0.02 -1.08 0.16 0.00 -0.02 0.00 0.00 54.58 53.62 2oz3 n ASN 54 Cb 0.11 0.23 0.54 0.00 -2.36 0.00 0.00 39.78 38.30 2oz3 n ASN 54 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 2oz3 h VAL 55 N 1.57 0.02 0.10 3.53 3.04 -1.92 -3.25 116.25 119.36 2oz3 h VAL 55 Ca 0.00 -0.66 -0.32 0.00 -1.01 0.00 0.00 66.70 64.70 2oz3 h VAL 55 Cb 0.58 1.65 -0.02 0.00 -2.01 0.00 0.00 31.29 31.49 2oz3 h VAL 55 CO 0.00 0.01 -1.73 -0.07 -1.01 0.00 0.00 177.57 174.77 2oz3 h LEU 56 N 0.00 0.35 0.00 3.16 3.38 -1.86 -3.50 115.31 116.84 2oz3 h LEU 56 Ca -0.00 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.12 2oz3 h LEU 56 Cb 0.65 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2oz3 h LEU 56 CO 0.00 1.74 0.00 0.61 0.09 0.00 0.00 178.44 180.88 2oz3 n GLY 57 N 1.83 -2.35 3.61 0.83 0.00 -1.23 -3.31 105.19 104.57 2oz3 n GLY 57 Ca -0.30 -1.76 -0.35 0.00 0.00 0.00 0.00 46.02 43.61 2oz3 n GLY 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oz3 s THR 58 N -0.32 4.68 0.07 2.61 2.01 -1.26 -2.40 115.64 121.03 2oz3 s THR 58 Ca 0.00 -0.07 -0.25 0.00 0.31 0.00 0.00 61.69 61.68 2oz3 s THR 58 Cb 0.00 -3.11 -0.06 0.00 0.01 0.00 0.00 72.50 69.34 2oz3 s THR 58 CO 0.00 0.45 0.76 -0.22 -0.69 0.00 0.00 174.62 174.92 2oz3 s LEU 59 N 0.47 4.48 -0.16 4.42 2.96 -0.21 -2.10 118.68 128.55 2oz3 s LEU 59 Ca 0.03 1.48 0.00 0.00 -0.22 0.00 0.00 54.13 55.42 2oz3 s LEU 59 Cb -0.13 -3.23 0.00 0.00 0.50 0.00 0.00 46.19 43.33 2oz3 s LEU 59 CO 0.01 0.06 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.25 2oz3 s VAL 60 N -0.31 2.52 -0.19 1.68 1.01 0.63 -1.89 120.40 123.85 2oz3 s VAL 60 Ca 0.38 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.49 2oz3 s VAL 60 Cb -0.21 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 2oz3 s VAL 60 CO 0.23 0.52 0.00 -0.69 0.00 0.00 0.00 175.10 175.16 2oz3 s VAL 61 N 0.92 4.01 -0.10 2.92 1.01 -0.75 0.43 120.40 128.84 2oz3 s VAL 61 Ca -0.04 -0.30 0.01 0.00 0.00 0.00 0.00 61.98 61.66 2oz3 s VAL 61 Cb -0.15 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.40 2oz3 s VAL 61 CO -0.02 0.44 -0.13 -1.61 0.00 0.00 0.00 175.10 173.78 2oz3 s GLU 62 N 0.87 3.02 -0.19 2.72 2.02 0.37 -1.53 118.70 125.98 2oz3 s GLU 62 Ca 0.01 -0.68 0.00 0.00 0.02 0.00 0.00 54.97 54.32 2oz3 s GLU 62 Cb -0.14 -2.54 0.04 0.00 0.10 0.00 0.00 34.13 31.59 2oz3 s GLU 62 CO 0.02 0.40 -0.08 0.42 0.02 0.00 0.00 175.26 176.04 2oz3 s ILE 63 N -0.14 1.42 -0.20 -1.63 1.01 0.15 -0.47 121.20 121.35 2oz3 s ILE 63 Ca -0.01 -0.86 -0.11 0.00 0.00 0.00 0.00 60.65 59.68 2oz3 s ILE 63 Cb -0.14 -1.54 -0.05 0.00 0.01 0.00 0.00 42.46 40.74 2oz3 s ILE 63 CO 0.03 0.15 0.15 -0.70 0.00 0.00 0.00 174.94 174.57 2oz3 s GLU 64 N 1.49 4.20 0.48 2.79 2.12 0.67 -0.58 118.70 129.86 2oz3 s GLU 64 Ca -0.01 -0.18 0.09 0.00 0.36 0.00 0.00 54.97 55.23 2oz3 s GLU 64 Cb -0.16 -3.42 0.04 0.00 0.26 0.00 0.00 34.13 30.84 2oz3 s GLU 64 CO -0.08 0.28 0.64 0.00 -0.54 0.00 0.00 175.26 175.56 2oz3 s ALA 65 N 0.40 4.57 -0.57 6.30 0.00 -0.25 -0.65 121.76 131.57 2oz3 s ALA 65 Ca 0.09 -1.85 0.26 0.00 0.00 0.00 0.00 51.96 50.46 2oz3 s ALA 65 Cb -0.11 -1.51 0.78 0.00 0.00 0.00 0.00 23.12 22.28 2oz3 s ALA 65 CO -0.01 -0.49 1.75 0.66 0.00 0.00 0.00 175.76 177.66 2oz3 h SER 66 N 0.49 0.00 0.20 0.00 4.64 -0.97 -2.48 113.55 115.44 2oz3 h SER 66 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2oz3 h SER 66 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2oz3 h SER 66 CO 0.44 0.00 -0.14 -0.90 -0.87 0.00 0.00 176.83 175.36 2oz3 n ASP 67 N -2.49 0.92 0.00 4.97 5.75 -1.26 -4.95 116.55 119.49 2oz3 n ASP 67 Ca 0.04 -0.94 0.00 0.00 -0.01 0.00 0.00 54.79 53.88 2oz3 n ASP 67 Cb 0.41 0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.53 2oz3 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2oz3 n GLY 68 N 1.27 0.68 3.77 6.12 0.00 -0.93 -5.06 105.19 111.04 2oz3 n GLY 68 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2oz3 n GLY 68 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2oz3 s ASN 69 N -2.96 6.84 -0.17 1.61 0.01 -1.26 -4.87 114.94 114.14 2oz3 s ASN 69 Ca 0.00 2.59 0.01 0.00 -0.71 0.00 0.00 52.86 54.75 2oz3 s ASN 69 Cb 0.00 -2.64 0.03 0.00 0.41 0.00 0.00 41.25 39.04 2oz3 s ASN 69 CO 0.00 -0.48 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.28 2oz3 s VAL 70 N -1.16 1.70 0.35 1.60 1.01 -1.26 -1.09 120.40 121.54 2oz3 s VAL 70 Ca 0.49 -0.80 -0.15 0.00 0.00 0.00 0.00 61.98 61.51 2oz3 s VAL 70 Cb -0.38 -1.62 -0.09 0.00 0.00 0.00 0.00 36.38 34.29 2oz3 s VAL 70 CO 0.50 0.40 0.77 -0.83 0.00 0.00 0.00 175.10 175.94 2oz3 s GLY 71 N 1.42 2.31 0.09 4.51 0.00 0.25 -4.81 107.32 111.09 2oz3 s GLY 71 Ca 0.03 0.08 -0.10 0.00 0.00 0.00 0.00 44.72 44.73 2oz3 s GLY 71 CO -0.10 0.29 0.21 -0.11 0.00 0.00 0.00 173.10 173.39 2oz3 s PHE 72 N -2.06 0.10 0.07 1.90 -0.12 -1.26 0.32 117.98 116.94 2oz3 s PHE 72 Ca 0.55 -0.51 -0.08 0.00 -0.05 0.00 0.00 56.93 56.84 2oz3 s PHE 72 Cb -0.10 -0.02 -0.00 0.00 -0.63 0.00 0.00 43.02 42.27 2oz3 s PHE 72 CO 0.18 -0.56 0.17 0.00 -0.05 0.00 0.00 175.22 174.96 2oz3 s ALA 73 N -3.78 -0.20 -0.05 1.99 0.00 -0.58 -4.36 121.76 114.78 2oz3 s ALA 73 Ca 0.04 -0.56 0.01 0.00 0.00 0.00 0.00 51.96 51.45 2oz3 s ALA 73 Cb 0.04 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.53 2oz3 s ALA 73 CO -0.11 -0.45 -0.05 0.14 0.00 0.00 0.00 175.76 175.30 2oz3 s VAL 74 N -3.43 3.87 0.32 0.00 -7.23 -1.26 -1.82 120.40 110.85 2oz3 s VAL 74 Ca 0.02 -0.50 -0.06 0.00 -1.81 0.00 0.00 61.98 59.62 2oz3 s VAL 74 Cb 0.03 -2.63 0.00 0.00 0.56 0.00 0.00 36.38 34.35 2oz3 s VAL 74 CO -0.09 0.53 0.49 0.28 -0.31 0.00 0.00 175.10 176.01 2oz3 s THR 75 N -0.89 0.00 -0.01 5.32 -1.32 -0.79 -4.99 115.64 112.95 2oz3 s THR 75 Ca 0.14 -1.52 -0.30 0.00 -1.21 0.00 0.00 61.69 58.81 2oz3 s THR 75 Cb -0.11 -2.56 -0.03 0.00 -1.51 0.00 0.00 72.50 68.29 2oz3 s THR 75 CO 0.04 0.00 1.08 -0.89 -2.21 0.00 0.00 174.62 172.64 2oz3 s THR 76 N -3.25 4.54 0.00 5.08 2.01 -1.26 -1.04 115.64 121.72 2oz3 s THR 76 Ca 0.28 1.82 0.00 0.00 0.31 0.00 0.00 61.69 64.10 2oz3 s THR 76 Cb -0.01 -4.17 0.00 0.00 0.01 0.00 0.00 72.50 68.33 2oz3 s THR 76 CO 0.17 0.09 0.00 0.61 -0.69 0.00 0.00 174.62 174.80 2oz3 n GLY 77 N 3.10 0.68 7.00 4.40 0.00 -1.01 -4.73 105.19 114.63 2oz3 n GLY 77 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2oz3 n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oz3 n GLY 78 N 0.00 2.97 0.21 -0.02 0.00 -1.21 -3.72 105.19 103.41 2oz3 n GLY 78 Ca 0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.57 2oz3 n GLY 78 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2oz3 h GLU 79 N 0.00 0.66 -0.80 1.61 4.81 -1.89 -0.22 114.58 118.76 2oz3 h GLU 79 Ca 0.00 -0.25 -0.01 0.00 -0.13 0.00 0.00 59.36 58.96 2oz3 h GLU 79 Cb 0.00 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 2oz3 h GLU 79 CO 0.00 0.83 0.44 -1.35 -0.73 0.00 0.00 179.01 178.19 2oz3 h PRO 80 N 0.45 1.10 -0.58 0.92 0.11 -1.90 -0.01 132.00 132.09 2oz3 h PRO 80 Ca 0.09 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2oz3 h PRO 80 Cb 0.58 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 31.44 2oz3 h PRO 80 CO 0.03 0.81 0.38 0.00 -0.21 0.00 0.00 178.00 179.01 2oz3 h ALA 81 N 1.37 0.74 -0.55 -0.75 0.00 -1.60 -2.53 119.26 115.93 2oz3 h ALA 81 Ca 0.28 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.16 2oz3 h ALA 81 Cb 0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2oz3 h ALA 81 CO -0.05 0.19 0.34 0.00 0.00 0.00 0.00 179.25 179.74 2oz3 h ALA 82 N 1.20 0.71 -0.43 0.00 0.00 -0.62 -1.11 119.26 119.01 2oz3 h ALA 82 Ca 0.21 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.18 2oz3 h ALA 82 Cb -0.07 -0.18 -0.09 0.00 0.00 0.00 0.00 17.79 17.45 2oz3 h ALA 82 CO -0.04 0.08 -0.38 -0.92 0.00 0.00 0.00 179.25 177.98 2oz3 h TYR 83 N 0.68 -1.09 -0.47 0.00 3.20 -0.83 -1.64 116.97 116.82 2oz3 h TYR 83 Ca 0.22 0.07 0.01 0.00 3.14 0.00 0.00 58.73 62.17 2oz3 h TYR 83 Cb -0.01 0.54 -0.03 0.00 1.54 0.00 0.00 36.73 38.78 2oz3 h TYR 83 CO -0.05 -0.41 0.30 0.82 -1.64 0.00 0.00 178.16 177.17 2oz3 h ILE 84 N -0.28 1.08 0.01 1.81 2.04 -1.01 -0.39 117.51 120.77 2oz3 h ILE 84 Ca 0.16 -0.21 0.03 0.00 1.00 0.00 0.00 64.86 65.84 2oz3 h ILE 84 Cb 0.56 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2oz3 h ILE 84 CO -0.58 0.11 -0.19 0.58 0.00 0.00 0.00 178.15 178.08 2oz3 h VAL 85 N 0.60 0.56 -0.04 1.67 2.07 -1.05 0.35 116.25 120.40 2oz3 h VAL 85 Ca 0.18 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.65 2oz3 h VAL 85 Cb -0.02 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2oz3 h VAL 85 CO -0.06 0.00 -0.18 -0.33 0.02 0.00 0.00 177.57 177.02 2oz3 h GLU 86 N -0.31 0.19 0.06 1.57 4.39 -1.15 0.50 114.58 119.83 2oz3 h GLU 86 Ca 0.05 -0.15 -0.12 0.00 0.34 0.00 0.00 59.36 59.48 2oz3 h GLU 86 Cb 0.37 0.03 0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2oz3 h GLU 86 CO -0.17 0.80 -0.50 0.87 -1.16 0.00 0.00 179.01 178.86 2oz3 h LYS 87 N -0.38 0.23 0.00 2.33 1.79 -1.16 -3.40 116.57 115.99 2oz3 h LYS 87 Ca -0.01 -0.33 -0.01 0.00 -2.18 0.00 0.00 60.65 58.12 2oz3 h LYS 87 Cb 0.84 0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 31.60 2oz3 h LYS 87 CO 0.04 1.10 -0.78 1.58 -1.08 0.00 0.00 179.45 180.31 2oz3 n HIS 88 N -4.32 0.45 0.09 -1.35 -0.00 -0.47 -4.78 115.22 104.84 2oz3 n HIS 88 Ca -0.12 0.20 -0.07 0.00 0.46 0.00 0.00 57.72 58.19 2oz3 n HIS 88 Cb 0.66 -0.64 0.03 0.00 -0.12 0.00 0.00 29.99 29.92 2oz3 n HIS 88 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 2oz3 h LEU 89 N -1.00 0.23 -1.50 0.27 3.38 -0.64 -3.26 115.31 112.79 2oz3 h LEU 89 Ca -0.01 -0.17 0.18 0.00 0.09 0.00 0.00 57.88 57.97 2oz3 h LEU 89 Cb 0.78 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 2oz3 h LEU 89 CO -0.00 0.94 0.57 0.00 0.09 0.00 0.00 178.44 180.04 2oz3 h ALA 90 N 1.05 2.14 -0.01 1.53 0.00 -1.12 -2.85 119.26 119.99 2oz3 h ALA 90 Ca -0.03 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2oz3 h ALA 90 Cb 1.41 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 2oz3 h ALA 90 CO 0.12 -0.40 0.02 0.07 0.00 0.00 0.00 179.25 179.06 2oz3 h ARG 91 N 0.44 0.00 0.00 0.00 0.11 -1.86 -2.18 114.38 110.90 2oz3 h ARG 91 Ca 0.44 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.52 2oz3 h ARG 91 Cb 1.04 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.12 2oz3 h ARG 91 CO -0.17 0.00 -0.99 1.19 0.10 0.00 0.00 179.97 180.10 2oz3 n PHE 92 N -3.49 0.59 -0.05 4.08 3.72 -1.08 -4.36 117.46 116.88 2oz3 n PHE 92 Ca -0.03 0.17 -0.21 0.00 -0.05 0.00 0.00 57.45 57.33 2oz3 n PHE 92 Cb 0.09 -0.70 -0.13 0.00 -0.94 0.00 0.00 39.48 37.81 2oz3 n PHE 92 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2oz3 n LEU 93 N -2.29 2.65 -4.65 4.37 4.32 -0.85 -4.68 117.00 115.86 2oz3 n LEU 93 Ca 0.01 0.13 -0.43 0.00 -0.02 0.00 0.00 56.01 55.71 2oz3 n LEU 93 Cb 0.49 -1.04 -0.02 0.00 -1.62 0.00 0.00 43.42 41.23 2oz3 n LEU 93 CO 0.40 0.83 1.17 -1.61 -1.22 0.00 0.00 177.39 176.95 2oz3 s GLU 94 N -2.53 4.14 0.00 3.23 2.02 -1.03 -1.93 118.70 122.61 2oz3 s GLU 94 Ca -0.27 1.72 0.00 0.00 0.02 0.00 0.00 54.97 56.44 2oz3 s GLU 94 Cb 0.08 -3.85 0.00 0.00 0.10 0.00 0.00 34.13 30.46 2oz3 s GLU 94 CO 0.70 -0.84 0.00 0.41 0.02 0.00 0.00 175.26 175.55 2oz3 n GLY 95 N 3.89 3.09 3.76 -1.39 0.00 0.29 -4.98 105.19 109.85 2oz3 n GLY 95 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2oz3 n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oz3 s ALA 96 N -2.82 2.49 0.72 4.61 0.00 -0.81 -4.55 121.76 121.39 2oz3 s ALA 96 Ca 0.00 0.81 -0.14 0.00 0.00 0.00 0.00 51.96 52.63 2oz3 s ALA 96 Cb 0.00 -3.39 0.03 0.00 0.00 0.00 0.00 23.12 19.76 2oz3 s ALA 96 CO 0.00 -1.22 1.15 1.03 0.00 0.00 0.00 175.76 176.72 2oz3 s ARG 97 N -3.63 2.33 0.39 0.00 0.52 -1.26 -0.33 118.95 116.97 2oz3 s ARG 97 Ca 0.73 1.53 0.27 0.00 -0.52 0.00 0.00 55.73 57.74 2oz3 s ARG 97 Cb -0.26 -1.88 0.86 0.00 0.52 0.00 0.00 34.95 34.19 2oz3 s ARG 97 CO 0.36 -1.64 1.77 -0.39 0.02 0.00 0.00 175.30 175.42 2oz3 h VAL 98 N -0.36 0.00 -0.01 3.52 -1.51 -1.78 -2.88 116.25 113.23 2oz3 h VAL 98 Ca -0.46 -0.61 0.00 0.00 -1.23 0.00 0.00 66.70 64.40 2oz3 h VAL 98 Cb 1.27 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 31.98 2oz3 h VAL 98 CO 0.51 0.00 -0.17 0.35 -1.23 0.00 0.00 177.57 177.03 2oz3 n THR 99 N -2.76 0.00 -0.96 7.19 -2.24 -1.26 -4.57 114.28 109.69 2oz3 n THR 99 Ca 0.03 -0.10 -0.11 0.00 -2.27 0.00 0.00 64.05 61.60 2oz3 n THR 99 Cb 0.39 0.15 -0.16 0.00 -2.10 0.00 0.00 70.33 68.61 2oz3 n THR 99 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2oz3 n ASP 100 N -0.77 5.22 -0.02 3.42 9.92 -1.09 -4.63 116.55 128.61 2oz3 n ASP 100 Ca 0.14 -2.47 -0.16 0.00 -0.53 0.00 0.00 54.79 51.76 2oz3 n ASP 100 Cb 0.31 -1.39 -0.09 0.00 -0.64 0.00 0.00 41.12 39.31 2oz3 n ASP 100 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 2oz3 h ILE 101 N 1.93 1.39 -0.29 0.53 2.04 -1.87 -2.17 117.51 119.07 2oz3 h ILE 101 Ca 0.17 -1.90 -0.02 0.00 1.00 0.00 0.00 64.86 64.11 2oz3 h ILE 101 Cb 1.47 2.34 -0.01 0.00 -0.74 0.00 0.00 36.82 39.88 2oz3 h ILE 101 CO 0.21 0.56 0.11 -0.33 0.00 0.00 0.00 178.15 178.71 2oz3 h GLU 102 N 0.03 0.43 0.87 2.37 4.39 -1.99 -2.53 114.58 118.14 2oz3 h GLU 102 Ca -0.05 -0.08 -0.04 0.00 0.34 0.00 0.00 59.36 59.53 2oz3 h GLU 102 Cb 1.19 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 2oz3 h GLU 102 CO 0.11 0.46 -0.46 -0.09 -1.16 0.00 0.00 179.01 177.86 2oz3 h ARG 103 N 0.31 -1.18 -0.71 2.33 2.43 -1.93 -2.05 114.38 113.57 2oz3 h ARG 103 Ca 0.09 0.08 0.15 0.00 -0.81 0.00 0.00 59.98 59.50 2oz3 h ARG 103 Cb 0.20 0.27 -0.11 0.00 -0.42 0.00 0.00 29.97 29.91 2oz3 h ARG 103 CO -0.01 -0.79 0.16 0.82 -1.51 0.00 0.00 179.97 178.65 2oz3 h ILE 104 N -1.23 0.53 -0.09 1.20 2.04 -1.45 -1.10 117.51 117.41 2oz3 h ILE 104 Ca -0.12 -0.09 0.02 0.00 1.00 0.00 0.00 64.86 65.68 2oz3 h ILE 104 Cb 0.96 0.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 2oz3 h ILE 104 CO 0.16 0.05 -0.06 -0.25 0.00 0.00 0.00 178.15 178.05 2oz3 h TRP 105 N 0.27 -0.14 -0.40 1.37 7.01 -1.37 -2.56 115.95 120.12 2oz3 h TRP 105 Ca 0.40 0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.49 2oz3 h TRP 105 Cb 0.66 0.08 -0.08 0.00 -2.10 0.00 0.00 29.16 27.72 2oz3 h TRP 105 CO -0.26 -0.10 -0.15 0.22 -2.79 0.00 0.00 178.44 175.36 2oz3 h ASP 106 N -0.06 -0.53 0.00 2.65 3.58 -0.51 -1.47 116.42 120.08 2oz3 h ASP 106 Ca 0.06 0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.65 2oz3 h ASP 106 Cb 0.15 0.31 0.00 0.00 1.72 0.00 0.00 39.33 41.51 2oz3 h ASP 106 CO -0.13 -0.19 0.00 0.00 -2.88 0.00 0.00 179.24 176.04 2oz3 n GLN 107 N -5.35 0.17 0.00 0.28 6.02 -0.53 -0.75 117.38 117.22 2oz3 n GLN 107 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 2oz3 n GLN 107 Cb 0.26 -1.32 0.00 0.00 1.02 0.00 0.00 30.24 30.20 2oz3 n GLN 107 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 2oz3 n TYR 109 N 0.77 0.00 0.25 1.08 4.19 -0.55 -2.25 117.16 120.66 2oz3 n TYR 109 Ca 0.00 0.00 0.14 0.00 3.31 0.00 0.00 57.90 61.35 2oz3 n TYR 109 Cb 0.07 0.00 0.57 0.00 0.49 0.00 0.00 39.34 40.47 2oz3 n TYR 109 CO 0.00 0.00 0.00 -0.91 0.91 0.00 0.00 176.86 176.86 2oz3 h ASN 110 N 0.00 0.00 0.86 2.98 2.35 -1.19 -2.00 115.58 118.57 2oz3 h ASN 110 Ca 0.00 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 2oz3 h ASN 110 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2oz3 h ASN 110 CO 0.00 0.09 -1.19 -1.20 -1.65 0.00 0.00 177.43 173.48 2oz3 n SER 111 N -3.21 0.84 -0.77 5.81 7.64 -0.95 -3.98 113.62 119.00 2oz3 n SER 111 Ca 0.01 0.34 0.10 0.00 1.01 0.00 0.00 58.87 60.33 2oz3 n SER 111 Cb 0.36 0.35 0.07 0.00 -1.01 0.00 0.00 64.21 63.98 2oz3 n SER 111 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2oz3 n THR 112 N -2.76 0.00 -0.31 0.44 -2.24 -1.14 -4.58 114.28 103.69 2oz3 n THR 112 Ca -0.04 -0.46 0.13 0.00 -2.27 0.00 0.00 64.05 61.41 2oz3 n THR 112 Cb 0.67 1.40 0.28 0.00 -2.10 0.00 0.00 70.33 70.58 2oz3 n THR 112 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2oz3 h LEU 113 N 3.75 -0.27 -2.67 3.22 5.85 -1.49 0.42 115.31 124.12 2oz3 h LEU 113 Ca 0.00 0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.96 2oz3 h LEU 113 Cb 0.83 0.38 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 2oz3 h LEU 113 CO 0.00 -0.27 0.09 0.10 -0.34 0.00 0.00 178.44 178.03 2oz3 h TYR 114 N 0.09 0.00 0.00 1.25 -0.00 -1.87 -2.93 116.97 113.51 2oz3 h TYR 114 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.30 2oz3 h TYR 114 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.89 2oz3 h TYR 114 CO -0.39 0.00 -0.07 2.48 -0.00 0.00 0.00 178.16 180.18 2oz3 n TYR 115 N -3.13 0.00 0.00 0.10 0.18 -0.17 -5.07 117.16 109.06 2oz3 n TYR 115 Ca -0.02 -0.14 0.00 0.00 1.88 0.00 0.00 57.90 59.61 2oz3 n TYR 115 Cb 0.16 -0.02 0.00 0.00 -0.38 0.00 0.00 39.34 39.10 2oz3 n TYR 115 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2oz3 n GLY 116 N -0.16 1.18 5.00 -7.48 0.00 0.13 -4.83 105.19 99.03 2oz3 n GLY 116 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2oz3 n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oz3 n ARG 117 N 0.00 0.00 -4.15 1.61 1.74 -1.26 -4.77 116.66 109.83 2oz3 n ARG 117 Ca 0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 2oz3 n ARG 117 Cb 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.34 2oz3 n ARG 117 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2oz3 s LYS 118 N 0.00 0.86 3.27 5.56 1.02 -1.26 -4.77 119.74 124.42 2oz3 s LYS 118 Ca 0.00 -1.38 0.00 0.00 0.02 0.00 0.00 55.97 54.61 2oz3 s LYS 118 Cb 0.00 0.13 0.00 0.00 -0.52 0.00 0.00 37.83 37.44 2oz3 s LYS 118 CO 0.00 -0.18 0.00 0.41 -0.92 0.00 0.00 175.35 174.66 2oz3 n GLY 119 N -0.05 0.48 0.37 -3.33 0.00 -1.26 -4.39 105.19 97.00 2oz3 n GLY 119 Ca -0.08 -1.07 -0.03 0.00 0.00 0.00 0.00 46.02 44.84 2oz3 n GLY 119 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2oz3 h LEU 120 N 0.00 1.14 -0.91 0.99 5.85 -1.95 -0.55 115.31 119.87 2oz3 h LEU 120 Ca 0.00 -0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.57 2oz3 h LEU 120 Cb 0.00 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 2oz3 h LEU 120 CO 0.00 0.85 -0.27 0.58 -0.34 0.00 0.00 178.44 179.26 2oz3 h VAL 121 N 1.32 1.27 -0.21 1.05 2.07 -1.88 -0.85 116.25 119.01 2oz3 h VAL 121 Ca 0.35 -1.31 -0.18 0.00 0.82 0.00 0.00 66.70 66.39 2oz3 h VAL 121 Cb -0.10 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2oz3 h VAL 121 CO -0.07 0.41 -0.55 0.40 0.02 0.00 0.00 177.57 177.78 2oz3 h ILE 122 N 0.42 1.30 -0.72 4.57 1.08 -1.37 -0.89 117.51 121.88 2oz3 h ILE 122 Ca 0.06 -1.77 0.16 0.00 -0.39 0.00 0.00 64.86 62.92 2oz3 h ILE 122 Cb 0.70 1.84 -0.12 0.00 -3.07 0.00 0.00 36.82 36.16 2oz3 h ILE 122 CO 0.05 0.56 0.01 0.78 -0.69 0.00 0.00 178.15 178.86 2oz3 h ASN 123 N 0.47 -0.32 -0.02 1.72 4.21 -1.04 0.04 115.58 120.64 2oz3 h ASN 123 Ca -0.01 0.18 -0.00 0.00 1.21 0.00 0.00 56.30 57.68 2oz3 h ASN 123 Cb 1.17 0.32 -0.00 0.00 -1.12 0.00 0.00 38.32 38.69 2oz3 h ASN 123 CO 0.12 -0.16 0.01 0.74 -1.29 0.00 0.00 177.43 176.85 2oz3 h THR 124 N 0.11 1.14 -0.82 2.81 2.02 -0.93 -2.28 112.91 114.97 2oz3 h THR 124 Ca 0.39 -0.41 0.08 0.00 0.77 0.00 0.00 66.41 67.25 2oz3 h THR 124 Cb 0.68 1.38 -0.07 0.00 -1.74 0.00 0.00 68.15 68.40 2oz3 h THR 124 CO -0.63 0.11 0.48 0.40 0.37 0.00 0.00 175.52 176.24 2oz3 h ILE 125 N -0.13 0.95 -0.67 3.11 2.04 -0.93 -2.69 117.51 119.18 2oz3 h ILE 125 Ca 0.01 -0.28 -0.05 0.00 1.00 0.00 0.00 64.86 65.54 2oz3 h ILE 125 Cb 0.17 0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.27 2oz3 h ILE 125 CO -0.00 0.15 0.23 0.28 0.00 0.00 0.00 178.15 178.81 2oz3 h SER 126 N 0.82 0.95 -0.13 1.72 0.02 -0.82 -1.11 113.55 115.01 2oz3 h SER 126 Ca 0.38 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2oz3 h SER 126 Cb 0.30 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 2oz3 h SER 126 CO -0.22 0.89 0.08 1.23 -1.14 0.00 0.00 176.83 177.67 2oz3 h GLY 127 N 0.96 0.18 0.85 -3.77 0.00 -1.20 0.50 103.07 100.59 2oz3 h GLY 127 Ca 0.22 -0.07 0.05 0.00 0.00 0.00 0.00 47.33 47.53 2oz3 h GLY 127 CO -0.01 0.07 0.65 -2.08 0.00 0.00 0.00 176.54 175.16 2oz3 h VAL 128 N 0.17 1.14 -0.28 4.60 2.07 -1.33 -1.84 116.25 120.78 2oz3 h VAL 128 Ca 0.05 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 67.09 2oz3 h VAL 128 Cb -0.02 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.56 2oz3 h VAL 128 CO -0.01 0.22 -0.03 -0.78 0.02 0.00 0.00 177.57 176.99 2oz3 h ASP 129 N 1.22 0.51 -0.84 0.57 3.58 -0.82 -1.49 116.42 119.15 2oz3 h ASP 129 Ca 0.41 -0.34 -0.02 0.00 0.42 0.00 0.00 57.03 57.50 2oz3 h ASP 129 Cb 0.06 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 40.93 2oz3 h ASP 129 CO -0.14 0.72 0.46 -0.07 -2.88 0.00 0.00 179.24 177.33 2oz3 h LEU 130 N 0.29 1.06 -1.10 2.28 3.38 -0.74 -1.96 115.31 118.51 2oz3 h LEU 130 Ca 0.08 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2oz3 h LEU 130 Cb 0.48 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2oz3 h LEU 130 CO 0.02 0.85 0.04 0.00 0.09 0.00 0.00 178.44 179.44 2oz3 h ALA 131 N 1.32 1.27 -0.46 1.53 0.00 -1.19 -1.24 119.26 120.48 2oz3 h ALA 131 Ca 0.30 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2oz3 h ALA 131 Cb 0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2oz3 h ALA 131 CO -0.05 0.50 -0.09 -0.07 0.00 0.00 0.00 179.25 179.54 2oz3 h LEU 132 N 0.65 0.88 -0.82 0.00 3.38 -0.87 -0.43 115.31 118.10 2oz3 h LEU 132 Ca 0.14 -0.35 -0.10 0.00 0.09 0.00 0.00 57.88 57.66 2oz3 h LEU 132 Cb 0.34 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2oz3 h LEU 132 CO 0.01 1.03 -0.16 -0.50 0.09 0.00 0.00 178.44 178.91 2oz3 h TRP 133 N 0.72 0.80 -0.30 1.13 4.06 -1.28 -1.04 115.95 120.04 2oz3 h TRP 133 Ca 0.12 -0.16 -0.00 0.00 2.06 0.00 0.00 58.89 60.91 2oz3 h TRP 133 Cb 0.63 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.58 2oz3 h TRP 133 CO 0.05 0.83 0.18 0.22 -3.56 0.00 0.00 178.44 176.15 2oz3 h ASP 134 N 0.65 0.36 -0.44 -3.49 3.58 -1.10 -1.70 116.42 114.28 2oz3 h ASP 134 Ca 0.10 -0.06 0.01 0.00 0.42 0.00 0.00 57.03 57.51 2oz3 h ASP 134 Cb 0.63 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.56 2oz3 h ASP 134 CO 0.04 0.31 0.27 0.25 -2.88 0.00 0.00 179.24 177.23 2oz3 h LEU 135 N 0.38 0.45 -1.07 2.28 5.85 -0.94 -2.39 115.31 119.86 2oz3 h LEU 135 Ca 0.11 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.75 2oz3 h LEU 135 Cb 0.02 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2oz3 h LEU 135 CO -0.02 0.32 -0.18 0.25 -0.34 0.00 0.00 178.44 178.47 2oz3 h LEU 136 N 0.54 0.43 -0.44 2.25 5.85 -1.13 -0.63 115.31 122.19 2oz3 h LEU 136 Ca 0.17 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 2oz3 h LEU 136 Cb -0.01 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 2oz3 h LEU 136 CO -0.07 0.63 0.27 1.23 -0.34 0.00 0.00 178.44 180.17 2oz3 h GLY 137 N 0.95 0.63 1.64 3.75 0.00 -1.08 -2.01 103.07 106.95 2oz3 h GLY 137 Ca 0.07 -0.26 -0.18 0.00 0.00 0.00 0.00 47.33 46.96 2oz3 h GLY 137 CO 0.04 0.25 -0.74 0.50 0.00 0.00 0.00 176.54 176.58 2oz3 h LYS 138 N 0.58 0.35 -0.79 4.80 1.57 -0.96 0.54 116.57 122.67 2oz3 h LYS 138 Ca 0.16 -0.30 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2oz3 h LYS 138 Cb -0.02 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.32 2oz3 h LYS 138 CO -0.03 0.95 0.48 0.28 -0.57 0.00 0.00 179.45 180.56 2oz3 h VAL 139 N 0.24 1.22 -0.00 0.50 2.07 -1.12 -2.93 116.25 116.23 2oz3 h VAL 139 Ca -0.03 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.02 2oz3 h VAL 139 Cb 1.32 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 2oz3 h VAL 139 CO 0.12 0.23 -0.23 0.54 0.02 0.00 0.00 177.57 178.25 2oz3 n ARG 140 N -4.48 0.31 -3.80 1.57 1.74 -0.76 -4.95 116.66 106.29 2oz3 n ARG 140 Ca 0.08 -0.13 -0.23 0.00 -0.77 0.00 0.00 57.85 56.80 2oz3 n ARG 140 Cb 0.05 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.01 2oz3 n ARG 140 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2oz3 n ARG 141 N -1.23 -4.30 -3.91 5.56 1.74 -0.08 -5.01 116.66 109.42 2oz3 n ARG 141 Ca 0.09 0.54 -0.11 0.00 -0.77 0.00 0.00 57.85 57.60 2oz3 n ARG 141 Cb 0.32 -4.94 -0.13 0.00 -1.02 0.00 0.00 32.46 26.70 2oz3 n ARG 141 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2oz3 s GLU 142 N -6.21 0.13 0.54 5.56 2.02 -0.01 -4.81 118.70 115.92 2oz3 s GLU 142 Ca 0.01 -0.23 -0.20 0.00 0.02 0.00 0.00 54.97 54.57 2oz3 s GLU 142 Cb -0.01 0.05 -0.06 0.00 0.10 0.00 0.00 34.13 34.21 2oz3 s GLU 142 CO 0.84 -0.02 1.16 -1.25 0.02 0.00 0.00 175.26 176.01 2oz3 s PRO 143 N -0.58 3.34 0.29 0.39 0.04 -1.24 -1.08 135.00 136.16 2oz3 s PRO 143 Ca -0.06 1.71 0.03 0.00 0.04 0.00 0.00 61.00 62.71 2oz3 s PRO 143 Cb -0.04 -2.07 0.61 0.00 0.04 0.00 0.00 34.50 33.04 2oz3 s PRO 143 CO -0.00 -0.88 1.84 0.28 0.04 0.00 0.00 177.00 178.27 2oz3 h VAL 144 N 1.26 0.89 -0.40 -0.36 2.07 -1.17 -0.92 116.25 117.63 2oz3 h VAL 144 Ca -0.50 -0.32 0.12 0.00 0.82 0.00 0.00 66.70 66.81 2oz3 h VAL 144 Cb 1.27 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 2oz3 h VAL 144 CO 0.57 0.17 0.36 1.12 0.02 0.00 0.00 177.57 179.81 2oz3 h HIS 145 N 0.94 0.00 0.00 1.57 2.07 -1.85 0.81 115.15 118.69 2oz3 h HIS 145 Ca 0.50 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.02 2oz3 h HIS 145 Cb 0.55 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.53 2oz3 h HIS 145 CO -0.00 0.00 -0.16 1.96 -3.07 0.00 0.00 177.93 176.65 2oz3 h GLN 146 N 0.00 0.00 0.00 5.12 4.20 -1.51 -1.76 115.11 121.16 2oz3 h GLN 146 Ca 0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2oz3 h GLN 146 Cb 0.91 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.69 2oz3 h GLN 146 CO -0.00 0.00 -0.17 -0.07 -0.67 0.00 0.00 178.83 177.92 2oz3 h LEU 147 N 0.00 0.00 -3.78 1.46 3.38 -0.87 -3.37 115.31 112.12 2oz3 h LEU 147 Ca 0.00 -0.03 -0.53 0.00 0.09 0.00 0.00 57.88 57.42 2oz3 h LEU 147 Cb 0.90 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.34 2oz3 h LEU 147 CO 0.00 0.01 0.02 0.18 0.09 0.00 0.00 178.44 178.75 2oz3 n LEU 148 N -2.61 5.91 0.00 1.67 4.77 -1.08 -4.87 117.00 120.78 2oz3 n LEU 148 Ca 0.04 -4.34 0.00 0.00 -0.03 0.00 0.00 56.01 51.68 2oz3 n LEU 148 Cb 0.48 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2oz3 n LEU 148 CO 0.33 1.66 0.00 0.61 -1.33 0.00 0.00 177.39 178.67 2oz3 n GLY 149 N -0.89 0.74 0.01 -0.72 0.00 -1.26 -4.88 105.19 98.19 2oz3 n GLY 149 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.52 2oz3 n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oz3 n GLY 150 N -2.40 -2.70 3.74 -0.02 0.00 -0.67 -4.93 105.19 98.21 2oz3 n GLY 150 Ca 0.00 -1.39 -0.36 0.00 0.00 0.00 0.00 46.02 44.27 2oz3 n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oz3 s ALA 151 N -3.40 2.39 -0.45 4.61 0.00 -1.26 -4.35 121.76 119.30 2oz3 s ALA 151 Ca 0.00 1.10 0.06 0.00 0.00 0.00 0.00 51.96 53.12 2oz3 s ALA 151 Cb 0.00 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.59 2oz3 s ALA 151 CO 0.00 -1.51 0.40 1.33 0.00 0.00 0.00 175.76 175.98 2oz3 n VAL 152 N -1.94 0.00 -4.16 0.00 0.24 0.05 -4.92 118.33 107.61 2oz3 n VAL 152 Ca 0.15 -0.42 -0.16 0.00 -2.04 0.00 0.00 64.34 61.87 2oz3 n VAL 152 Cb 0.49 1.05 -0.11 0.00 -1.47 0.00 0.00 33.84 33.79 2oz3 n VAL 152 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2oz3 s ARG 153 N -1.16 0.79 0.31 7.34 1.70 -1.25 -5.06 118.95 121.62 2oz3 s ARG 153 Ca 0.04 -1.00 0.16 0.00 -0.47 0.00 0.00 55.73 54.46 2oz3 s ARG 153 Cb 0.05 -0.66 0.29 0.00 -0.57 0.00 0.00 34.95 34.05 2oz3 s ARG 153 CO 0.17 0.13 1.55 -0.44 -1.08 0.00 0.00 175.30 175.63 2oz3 h ASP 154 N 4.07 0.00 -5.01 -2.89 3.32 -1.95 -3.46 116.42 110.50 2oz3 h ASP 154 Ca -0.39 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.51 2oz3 h ASP 154 Cb 1.19 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.54 2oz3 h ASP 154 CO 0.44 0.48 -0.56 -1.83 -1.72 0.00 0.00 179.24 176.05 2oz3 s GLU 155 N -3.19 0.46 0.12 3.56 -1.05 -1.26 -1.66 118.70 115.67 2oz3 s GLU 155 Ca 0.02 -0.54 -0.24 0.00 -0.15 0.00 0.00 54.97 54.06 2oz3 s GLU 155 Cb 0.09 0.18 -0.07 0.00 -0.44 0.00 0.00 34.13 33.89 2oz3 s GLU 155 CO 0.72 -0.10 0.74 -0.51 0.95 0.00 0.00 175.26 177.06 2oz3 s LEU 156 N -1.58 4.55 0.06 1.83 1.43 -1.26 -4.97 118.68 118.74 2oz3 s LEU 156 Ca -0.13 1.53 0.07 0.00 -1.03 0.00 0.00 54.13 54.58 2oz3 s LEU 156 Cb -0.07 -3.22 -0.03 0.00 0.03 0.00 0.00 46.19 42.90 2oz3 s LEU 156 CO -0.01 0.17 -0.16 0.00 0.23 0.00 0.00 176.35 176.58 2oz3 s GLN 157 N -0.84 2.05 -0.03 1.70 -2.07 -1.26 -4.37 119.66 114.84 2oz3 s GLN 157 Ca 0.35 -1.01 0.04 0.00 -1.82 0.00 0.00 55.36 52.92 2oz3 s GLN 157 Cb -0.22 -2.21 -0.00 0.00 -1.09 0.00 0.00 33.01 29.49 2oz3 s GLN 157 CO 0.24 0.53 -0.13 -0.06 -1.32 0.00 0.00 175.29 174.55 2oz3 s PHE 158 N -1.00 1.36 0.17 9.60 0.08 -0.78 -0.87 117.98 126.53 2oz3 s PHE 158 Ca 0.16 -0.36 -0.02 0.00 0.12 0.00 0.00 56.93 56.83 2oz3 s PHE 158 Cb -0.11 -0.93 -0.05 0.00 -0.57 0.00 0.00 43.02 41.37 2oz3 s PHE 158 CO 0.07 -0.13 0.37 1.52 -0.10 0.00 0.00 175.22 176.96 2oz3 s TYR 159 N 0.08 3.48 -0.12 0.36 -0.85 -0.33 -1.18 117.35 118.79 2oz3 s TYR 159 Ca -0.03 0.42 -0.04 0.00 -0.52 0.00 0.00 57.07 56.90 2oz3 s TYR 159 Cb -0.10 -1.91 -0.03 0.00 0.38 0.00 0.00 41.96 40.30 2oz3 s TYR 159 CO 0.01 0.42 0.03 0.00 -1.52 0.00 0.00 175.55 174.48 2oz3 s ALA 160 N -1.76 3.34 -0.26 9.51 0.00 -0.13 -1.08 121.76 131.39 2oz3 s ALA 160 Ca 0.39 -0.77 -0.08 0.00 0.00 0.00 0.00 51.96 51.50 2oz3 s ALA 160 Cb -0.12 -1.65 -0.03 0.00 0.00 0.00 0.00 23.12 21.32 2oz3 s ALA 160 CO 0.27 0.44 0.08 0.99 0.00 0.00 0.00 175.76 177.54 2oz3 s THR 161 N -0.41 4.39 0.00 0.00 2.01 -0.02 -1.19 115.64 120.43 2oz3 s THR 161 Ca 0.08 -0.17 0.00 0.00 0.31 0.00 0.00 61.69 61.91 2oz3 s THR 161 Cb -0.12 -3.07 0.00 0.00 0.01 0.00 0.00 72.50 69.32 2oz3 s THR 161 CO 0.02 0.31 0.00 0.61 -0.69 0.00 0.00 174.62 174.87 2oz3 n GLY 162 N 4.94 0.41 0.04 4.40 0.00 -0.47 -4.66 105.19 109.85 2oz3 n GLY 162 Ca -0.16 -1.16 0.16 0.00 0.00 0.00 0.00 46.02 44.86 2oz3 n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oz3 n ALA 163 N -0.82 2.65 -3.40 4.61 0.00 -1.26 -4.24 120.51 118.05 2oz3 n ALA 163 Ca 0.00 -0.21 -0.26 0.00 0.00 0.00 0.00 53.44 52.97 2oz3 n ALA 163 Cb 0.00 -1.48 -0.08 0.00 0.00 0.00 0.00 19.45 17.89 2oz3 n ALA 163 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2oz3 n ARG 164 N -0.95 1.51 0.29 0.00 5.12 -1.26 -4.92 116.66 116.45 2oz3 n ARG 164 Ca 0.22 -3.95 0.16 0.00 -1.93 0.00 0.00 57.85 52.35 2oz3 n ARG 164 Cb 0.16 -1.82 0.95 0.00 -1.16 0.00 0.00 32.46 30.59 2oz3 n ARG 164 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2oz3 h PRO 165 N 4.45 0.00 -0.84 5.56 0.13 -1.90 -2.29 132.00 137.10 2oz3 h PRO 165 Ca 0.16 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.29 2oz3 h PRO 165 Cb 0.78 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.87 2oz3 h PRO 165 CO 0.63 0.00 0.55 0.38 -0.23 0.00 0.00 178.00 179.33 2oz3 h ASP 166 N 0.00 0.97 0.26 1.44 -0.00 -1.96 -1.75 116.42 115.39 2oz3 h ASP 166 Ca 0.01 -0.03 -0.31 0.00 -0.00 0.00 0.00 57.03 56.70 2oz3 h ASP 166 Cb 0.07 -0.24 0.03 0.00 -0.00 0.00 0.00 39.33 39.19 2oz3 h ASP 166 CO -0.00 0.71 -1.31 -0.07 -0.00 0.00 0.00 179.24 178.57 2oz3 h LEU 167 N 1.14 0.78 -1.52 0.15 3.38 -1.82 -3.15 115.31 114.28 2oz3 h LEU 167 Ca 0.31 -0.77 0.08 0.00 0.09 0.00 0.00 57.88 57.58 2oz3 h LEU 167 Cb -0.12 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.34 2oz3 h LEU 167 CO -0.06 1.59 0.42 0.00 0.09 0.00 0.00 178.44 180.48 2oz3 h ALA 168 N 0.32 1.86 -0.53 1.53 0.00 -1.43 -1.72 119.26 119.28 2oz3 h ALA 168 Ca -0.20 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.71 2oz3 h ALA 168 Cb 2.00 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.62 2oz3 h ALA 168 CO 0.24 0.02 0.34 0.37 0.00 0.00 0.00 179.25 180.23 2oz3 h GLN 169 N 0.57 0.68 -2.04 0.00 4.15 -1.29 -2.21 115.11 114.97 2oz3 h GLN 169 Ca 0.29 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.65 2oz3 h GLN 169 Cb 0.38 -0.15 -0.00 0.00 0.21 0.00 0.00 27.48 27.91 2oz3 h GLN 169 CO -0.09 0.45 -0.00 1.63 -1.93 0.00 0.00 178.83 178.89 2oz3 n LYS 170 N -4.73 0.66 0.00 1.69 5.02 -0.65 -4.39 118.16 115.75 2oz3 n LYS 170 Ca 0.03 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 2oz3 n LYS 170 Cb 0.03 -1.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 2oz3 n LYS 170 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2oz3 n GLY 172 N 1.80 -0.21 3.74 0.72 0.00 -0.98 -5.10 105.19 105.15 2oz3 n GLY 172 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 2oz3 n GLY 172 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oz3 s PHE 173 N 0.00 2.16 -1.34 1.61 0.08 -0.87 -3.71 117.98 115.92 2oz3 s PHE 173 Ca 0.00 1.52 0.30 0.00 0.12 0.00 0.00 56.93 58.87 2oz3 s PHE 173 Cb 0.00 -3.58 1.45 0.00 -0.57 0.00 0.00 43.02 40.32 2oz3 s PHE 173 CO 0.00 -2.65 2.02 0.44 -0.10 0.00 0.00 175.22 174.93 2oz3 n ILE 174 N -2.00 0.02 -3.64 0.64 -5.35 -0.32 -4.61 119.36 104.09 2oz3 n ILE 174 Ca 0.15 0.00 -0.02 0.00 -0.27 0.00 0.00 62.75 62.61 2oz3 n ILE 174 Cb 0.49 -0.51 -0.04 0.00 -1.74 0.00 0.00 39.64 37.84 2oz3 n ILE 174 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2oz3 s GLY 175 N -2.66 0.09 -0.13 3.28 0.00 -1.26 -3.43 107.32 103.21 2oz3 s GLY 175 Ca 0.25 2.82 -0.01 0.00 0.00 0.00 0.00 44.72 47.78 2oz3 s GLY 175 CO 0.47 1.10 -0.02 -0.32 0.00 0.00 0.00 173.10 174.32 2oz3 s GLY 176 N -1.04 0.74 0.41 0.20 0.00 -0.07 -0.95 107.32 106.60 2oz3 s GLY 176 Ca 0.09 -0.53 0.07 0.00 0.00 0.00 0.00 44.72 44.35 2oz3 s GLY 176 CO -0.08 1.06 0.56 1.25 0.00 0.00 0.00 173.10 175.89 2oz3 s LYS 177 N 1.79 2.90 0.02 2.90 2.20 -0.33 -4.21 119.74 125.01 2oz3 s LYS 177 Ca 0.03 -1.12 0.08 0.00 -0.36 0.00 0.00 55.97 54.60 2oz3 s LYS 177 Cb -0.14 -2.75 -0.03 0.00 -1.51 0.00 0.00 37.83 33.40 2oz3 s LYS 177 CO -0.07 -0.21 -0.24 -1.25 -0.36 0.00 0.00 175.35 173.21 2oz3 s PRO 179 N -4.34 1.98 0.21 4.03 0.04 -1.26 -1.36 135.00 134.30 2oz3 s PRO 179 Ca 0.52 -1.01 -0.30 0.00 0.04 0.00 0.00 61.00 60.25 2oz3 s PRO 179 Cb -0.10 -2.05 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 2oz3 s PRO 179 CO 0.33 0.54 1.26 -1.17 0.04 0.00 0.00 177.00 178.00 2oz3 s LEU 180 N -1.03 4.44 -0.07 -3.56 2.96 0.45 -4.90 118.68 116.96 2oz3 s LEU 180 Ca 0.12 2.37 0.19 0.00 -0.22 0.00 0.00 54.13 56.59 2oz3 s LEU 180 Cb -0.10 -3.61 -0.29 0.00 0.50 0.00 0.00 46.19 42.68 2oz3 s LEU 180 CO 0.01 -0.46 0.33 1.41 -1.32 0.00 0.00 176.35 176.33 2oz3 n HIS 181 N 2.33 0.00 -4.46 5.38 8.25 -1.26 -1.32 115.22 124.14 2oz3 n HIS 181 Ca 0.05 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.28 2oz3 n HIS 181 Cb 0.43 -0.60 -0.16 0.00 1.12 0.00 0.00 29.99 30.78 2oz3 n HIS 181 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2oz3 s HIS 182 N -3.13 1.20 0.30 4.41 3.76 -1.26 -4.08 115.29 116.48 2oz3 s HIS 182 Ca -0.08 -0.39 0.04 0.00 -0.15 0.00 0.00 55.06 54.48 2oz3 s HIS 182 Cb 0.11 -0.89 0.04 0.00 1.11 0.00 0.00 32.58 32.95 2oz3 s HIS 182 CO 0.83 -0.21 0.35 0.41 -0.85 0.00 0.00 174.74 175.27 2oz3 n GLY 183 N 3.70 2.26 0.41 -2.22 0.00 -1.26 -4.87 105.19 103.21 2oz3 n GLY 183 Ca -0.22 -2.20 0.20 0.00 0.00 0.00 0.00 46.02 43.80 2oz3 n GLY 183 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2oz3 h PRO 184 N 0.00 0.33 0.00 1.61 0.11 -1.92 -2.54 132.00 129.59 2oz3 h PRO 184 Ca -0.15 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.93 2oz3 h PRO 184 Cb 0.65 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.69 2oz3 h PRO 184 CO 0.23 0.22 -0.03 0.66 -0.21 0.00 0.00 178.00 178.87 2oz3 h SER 185 N 0.34 0.00 -0.09 -2.05 4.64 -1.94 -2.08 113.55 112.37 2oz3 h SER 185 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 2oz3 h SER 185 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2oz3 h SER 185 CO -0.15 0.03 0.00 -0.62 -0.87 0.00 0.00 176.83 175.22 2oz3 n GLU 186 N -3.13 1.62 0.00 4.77 1.02 -0.95 -5.01 120.64 118.95 2oz3 n GLU 186 Ca 0.01 -0.92 0.00 0.00 -0.02 0.00 0.00 57.16 56.24 2oz3 n GLU 186 Cb 0.37 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 2oz3 n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2oz3 n GLY 187 N 1.11 1.33 0.14 0.62 0.00 -0.78 -2.34 105.19 105.27 2oz3 n GLY 187 Ca 0.17 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2oz3 n GLY 187 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2oz3 h GLU 188 N 0.00 0.00 -0.18 1.61 4.39 -1.95 -2.94 114.58 115.51 2oz3 h GLU 188 Ca 0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 2oz3 h GLU 188 Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2oz3 h GLU 188 CO 0.00 0.58 -0.16 0.93 -1.16 0.00 0.00 179.01 179.20 2oz3 h GLU 189 N 0.00 0.42 -0.85 2.33 4.39 -2.00 -1.41 114.58 117.47 2oz3 h GLU 189 Ca -0.01 -0.22 0.10 0.00 0.34 0.00 0.00 59.36 59.58 2oz3 h GLU 189 Cb 1.15 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.74 2oz3 h GLU 189 CO 0.08 0.78 0.55 0.78 -1.16 0.00 0.00 179.01 180.04 2oz3 h GLY 190 N 0.08 1.17 1.47 -3.84 0.00 -1.49 -0.96 103.07 99.49 2oz3 h GLY 190 Ca 0.03 -0.33 -0.19 0.00 0.00 0.00 0.00 47.33 46.84 2oz3 h GLY 190 CO 0.04 0.17 -0.73 -2.00 0.00 0.00 0.00 176.54 174.03 2oz3 h LEU 191 N 0.79 0.62 -0.56 3.11 5.85 -1.33 -0.36 115.31 123.43 2oz3 h LEU 191 Ca 0.40 -0.40 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 2oz3 h LEU 191 Cb 0.48 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2oz3 h LEU 191 CO -0.17 1.16 0.34 0.11 -0.34 0.00 0.00 178.44 179.54 2oz3 h LYS 192 N 0.36 0.76 -0.24 1.25 1.57 -0.99 -2.54 116.57 116.76 2oz3 h LYS 192 Ca -0.03 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 2oz3 h LYS 192 Cb 1.31 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2oz3 h LYS 192 CO 0.13 0.55 0.05 0.87 -0.57 0.00 0.00 179.45 180.48 2oz3 h LYS 193 N 0.76 0.38 -0.45 3.15 1.57 -0.78 0.13 116.57 121.34 2oz3 h LYS 193 Ca 0.20 -0.09 0.09 0.00 -1.87 0.00 0.00 60.65 58.98 2oz3 h LYS 193 Cb -0.02 -0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.16 2oz3 h LYS 193 CO -0.04 0.49 -0.05 -0.91 -0.57 0.00 0.00 179.45 178.38 2oz3 h ASN 194 N 0.20 -0.28 0.55 0.86 2.35 -1.12 -0.85 115.58 117.28 2oz3 h ASN 194 Ca 0.07 0.12 -0.14 0.00 -0.55 0.00 0.00 56.30 55.80 2oz3 h ASN 194 Cb 0.29 0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.87 2oz3 h ASN 194 CO 0.00 -0.10 -0.64 -0.07 -1.65 0.00 0.00 177.43 174.97 2oz3 h LEU 195 N 0.06 0.10 -0.71 1.61 3.38 -1.25 -2.21 115.31 116.28 2oz3 h LEU 195 Ca 0.22 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 58.00 2oz3 h LEU 195 Cb 0.33 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2oz3 h LEU 195 CO -0.41 0.71 -0.64 -0.33 0.09 0.00 0.00 178.44 177.86 2oz3 h GLU 196 N 0.06 0.01 -0.26 1.13 5.08 -0.52 -0.13 114.58 119.94 2oz3 h GLU 196 Ca -0.01 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 2oz3 h GLU 196 Cb 1.14 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 2oz3 h GLU 196 CO 0.09 0.65 -0.11 1.49 -1.00 0.00 0.00 179.01 180.12 2oz3 h GLU 197 N 0.01 0.53 -0.60 2.33 4.81 -1.04 -1.54 114.58 119.08 2oz3 h GLU 197 Ca -0.01 -0.23 -0.04 0.00 -0.13 0.00 0.00 59.36 58.95 2oz3 h GLU 197 Cb 1.13 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.47 2oz3 h GLU 197 CO 0.08 0.78 0.19 1.25 -0.73 0.00 0.00 179.01 180.59 2oz3 h LEU 198 N 0.27 0.82 -0.41 1.64 5.85 -1.39 -3.13 115.31 118.96 2oz3 h LEU 198 Ca 0.06 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 2oz3 h LEU 198 Cb 0.61 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2oz3 h LEU 198 CO 0.04 0.77 0.09 0.00 -0.34 0.00 0.00 178.44 179.00 2oz3 h ALA 199 N 1.34 0.55 0.00 1.25 0.00 -0.90 -1.25 119.26 120.25 2oz3 h ALA 199 Ca 0.20 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2oz3 h ALA 199 Cb 0.24 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2oz3 h ALA 199 CO -0.01 0.24 0.00 2.41 0.00 0.00 0.00 179.25 181.89 2oz3 n THR 200 N -4.53 0.00 0.00 0.00 -1.04 -0.59 -1.23 114.28 106.89 2oz3 n THR 200 Ca -0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2oz3 n THR 200 Cb 0.22 -0.18 0.00 0.00 -1.82 0.00 0.00 70.33 68.55 2oz3 n THR 200 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2oz3 n ARG 202 N 0.14 0.00 -0.25 -2.82 3.00 -0.47 -1.94 116.66 114.32 2oz3 n ARG 202 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.85 57.78 2oz3 n ARG 202 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 32.46 32.50 2oz3 n ARG 202 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 2oz3 h GLU 203 N 0.00 1.11 -0.42 -0.14 4.81 -1.42 -2.82 114.58 115.69 2oz3 h GLU 203 Ca 0.00 -0.27 -0.08 0.00 -0.13 0.00 0.00 59.36 58.88 2oz3 h GLU 203 Cb 0.00 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 2oz3 h GLU 203 CO 0.00 0.98 -0.05 0.00 -0.73 0.00 0.00 179.01 179.21 2oz3 h ARG 204 N 1.04 0.78 0.00 1.92 -0.00 -1.66 -3.33 114.38 113.13 2oz3 h ARG 204 Ca 0.22 -0.27 0.00 0.00 -0.50 0.00 0.00 59.98 59.42 2oz3 h ARG 204 Cb 0.37 -0.06 0.00 0.00 0.00 0.00 0.00 29.97 30.28 2oz3 h ARG 204 CO 0.00 0.88 -0.82 1.33 0.00 0.00 0.00 179.97 181.36 2oz3 n VAL 205 N -4.36 0.01 -2.10 2.04 0.24 -1.23 -5.04 118.33 107.89 2oz3 n VAL 205 Ca -0.01 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 2oz3 n VAL 205 Cb 0.33 0.65 0.00 0.00 -1.47 0.00 0.00 33.84 33.35 2oz3 n VAL 205 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oz3 n GLY 206 N 1.49 -2.19 0.22 7.63 0.00 -1.06 -4.49 105.19 106.78 2oz3 n GLY 206 Ca 0.04 -1.48 0.11 0.00 0.00 0.00 0.00 46.02 44.69 2oz3 n GLY 206 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2oz3 h PRO 207 N 0.00 0.00 0.00 1.61 0.11 -1.95 -3.38 132.00 128.39 2oz3 h PRO 207 Ca 0.00 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.80 2oz3 h PRO 207 Cb 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.05 2oz3 h PRO 207 CO 0.00 0.10 -2.16 -0.25 -0.21 0.00 0.00 178.00 175.48 2oz3 n ASP 208 N -3.14 1.35 -4.76 -2.05 8.00 -1.26 -4.98 116.55 109.70 2oz3 n ASP 208 Ca 0.03 -0.04 -0.41 0.00 0.71 0.00 0.00 54.79 55.08 2oz3 n ASP 208 Cb 0.52 0.53 0.00 0.00 -0.02 0.00 0.00 41.12 42.15 2oz3 n ASP 208 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2oz3 n PHE 209 N -2.77 2.84 -2.57 1.24 7.35 -1.26 -4.94 117.46 117.35 2oz3 n PHE 209 Ca -0.30 0.45 -0.42 0.00 -0.76 0.00 0.00 57.45 56.42 2oz3 n PHE 209 Cb 1.00 -2.50 -0.03 0.00 0.35 0.00 0.00 39.48 38.30 2oz3 n PHE 209 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 2oz3 s TRP 210 N -1.14 3.57 0.29 -5.13 0.51 -1.22 -4.98 118.94 110.84 2oz3 s TRP 210 Ca 0.56 1.53 0.07 0.00 -2.12 0.00 0.00 56.10 56.14 2oz3 s TRP 210 Cb -0.48 -3.26 -0.06 0.00 -0.81 0.00 0.00 33.47 28.87 2oz3 s TRP 210 CO 0.62 -0.59 -0.07 -0.51 -0.51 0.00 0.00 176.95 175.89 2oz3 s LEU 211 N 0.84 2.54 -0.07 2.99 1.43 -1.26 -0.89 118.68 124.25 2oz3 s LEU 211 Ca 0.54 -1.18 -0.03 0.00 -1.03 0.00 0.00 54.13 52.43 2oz3 s LEU 211 Cb -0.25 -0.73 0.04 0.00 0.03 0.00 0.00 46.19 45.28 2oz3 s LEU 211 CO 0.29 -0.30 0.15 -0.36 0.23 0.00 0.00 176.35 176.37 2oz3 s PHE 213 N -2.91 -0.16 -0.12 0.29 2.99 -1.04 -0.68 117.98 116.34 2oz3 s PHE 213 Ca 0.30 0.54 -0.21 0.00 0.00 0.00 0.00 56.93 57.56 2oz3 s PHE 213 Cb 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 43.02 42.83 2oz3 s PHE 213 CO 0.13 -0.22 0.60 0.34 -0.00 0.00 0.00 175.22 176.06 2oz3 s ASP 214 N 1.79 6.79 0.00 1.36 -1.08 -1.26 -0.68 116.67 123.59 2oz3 s ASP 214 Ca -0.02 0.95 0.10 0.00 -0.52 0.00 0.00 52.55 53.06 2oz3 s ASP 214 Cb -0.12 -2.35 0.01 0.00 -1.46 0.00 0.00 42.92 39.00 2oz3 s ASP 214 CO -0.06 -0.11 0.67 0.00 0.52 0.00 0.00 175.17 176.20 2oz3 n TRP 216 N -0.12 0.00 0.00 0.00 -0.00 -1.16 -4.61 117.44 111.55 2oz3 n TRP 216 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.55 2oz3 n TRP 216 Cb 0.23 -0.04 0.00 0.00 -0.00 0.00 0.00 31.31 31.49 2oz3 n TRP 216 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 177.69 176.56 2oz3 n SER 218 N 0.00 0.00 -4.87 5.87 3.41 -1.14 -4.31 113.62 112.58 2oz3 n SER 218 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 2oz3 n SER 218 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2oz3 n SER 218 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2oz3 s LEU 219 N 0.00 3.28 0.48 1.04 1.43 0.37 -4.49 118.68 120.79 2oz3 s LEU 219 Ca 0.00 -0.84 0.07 0.00 -1.03 0.00 0.00 54.13 52.33 2oz3 s LEU 219 Cb 0.00 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.34 2oz3 s LEU 219 CO 0.00 -0.70 0.40 1.51 0.23 0.00 0.00 176.35 177.78 2oz3 s ASP 220 N -4.13 4.81 0.09 2.29 1.47 -1.26 -4.59 116.67 115.34 2oz3 s ASP 220 Ca 0.46 -1.00 -0.26 0.00 1.18 0.00 0.00 52.55 52.94 2oz3 s ASP 220 Cb -0.02 -0.09 -0.15 0.00 -0.34 0.00 0.00 42.92 42.32 2oz3 s ASP 220 CO 0.27 -0.87 1.70 0.25 0.68 0.00 0.00 175.17 177.19 2oz3 h LEU 221 N 0.90 -0.29 -0.46 2.11 6.46 -1.95 -1.31 115.31 120.77 2oz3 h LEU 221 Ca -0.39 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 2oz3 h LEU 221 Cb 1.28 0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 41.28 2oz3 h LEU 221 CO 0.58 -0.19 0.30 -1.13 -0.62 0.00 0.00 178.44 177.38 2oz3 h ASN 222 N -0.30 0.54 -0.10 1.25 -0.73 -1.99 -0.53 115.58 113.73 2oz3 h ASN 222 Ca -0.02 -0.02 -0.01 0.00 1.87 0.00 0.00 56.30 58.12 2oz3 h ASN 222 Cb 0.25 -0.13 -0.00 0.00 0.27 0.00 0.00 38.32 38.70 2oz3 h ASN 222 CO 0.02 0.40 0.03 0.22 -0.37 0.00 0.00 177.43 177.73 2oz3 h TYR 223 N 0.63 0.15 -0.93 0.67 3.20 -1.96 -0.31 116.97 118.43 2oz3 h TYR 223 Ca 0.17 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.14 2oz3 h TYR 223 Cb -0.06 -0.05 -0.08 0.00 1.54 0.00 0.00 36.73 38.08 2oz3 h TYR 223 CO -0.04 0.28 0.56 0.00 -1.64 0.00 0.00 178.16 177.32 2oz3 h ALA 224 N 0.86 1.37 -0.18 1.82 0.00 -1.19 0.24 119.26 122.19 2oz3 h ALA 224 Ca 0.03 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2oz3 h ALA 224 Cb 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2oz3 h ALA 224 CO -0.00 0.15 0.07 1.15 0.00 0.00 0.00 179.25 180.62 2oz3 h THR 225 N 0.89 1.17 -0.39 0.00 2.02 -0.63 -1.95 112.91 114.02 2oz3 h THR 225 Ca 0.46 -0.51 -0.16 0.00 0.77 0.00 0.00 66.41 66.98 2oz3 h THR 225 Cb 0.46 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 2oz3 h THR 225 CO -0.27 0.16 -0.36 0.03 0.37 0.00 0.00 175.52 175.45 2oz3 h ARG 226 N 0.13 0.93 -0.01 6.66 3.08 -0.66 -1.75 114.38 122.76 2oz3 h ARG 226 Ca 0.06 -0.48 0.02 0.00 0.07 0.00 0.00 59.98 59.65 2oz3 h ARG 226 Cb 0.19 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 2oz3 h ARG 226 CO -0.00 1.14 -0.13 1.25 -1.07 0.00 0.00 179.97 181.16 2oz3 h LEU 227 N 0.75 -0.37 -0.52 3.04 5.85 -0.55 0.10 115.31 123.62 2oz3 h LEU 227 Ca 0.06 0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.90 2oz3 h LEU 227 Cb 0.96 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 42.09 2oz3 h LEU 227 CO 0.09 -0.18 0.22 0.00 -0.34 0.00 0.00 178.44 178.24 2oz3 h ALA 228 N 0.76 0.65 -0.57 1.25 0.00 -1.35 0.55 119.26 120.54 2oz3 h ALA 228 Ca 0.05 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.03 2oz3 h ALA 228 Cb 0.27 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2oz3 h ALA 228 CO -0.13 -0.15 0.34 -0.09 0.00 0.00 0.00 179.25 179.22 2oz3 h ARG 229 N 0.43 0.66 -0.42 0.00 2.43 -1.16 -2.30 114.38 114.01 2oz3 h ARG 229 Ca 0.24 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.32 2oz3 h ARG 229 Cb 0.22 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 2oz3 h ARG 229 CO -0.21 0.43 0.06 0.78 -1.51 0.00 0.00 179.97 179.52 2oz3 h GLY 230 N 0.68 0.70 2.00 2.80 0.00 -0.36 -3.03 103.07 105.86 2oz3 h GLY 230 Ca 0.23 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.16 2oz3 h GLY 230 CO -0.11 0.38 0.00 0.00 0.00 0.00 0.00 176.54 176.81 2oz3 h ALA 231 N 1.44 1.00 -0.85 3.60 0.00 -0.58 -3.32 119.26 120.55 2oz3 h ALA 231 Ca 0.14 0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.18 2oz3 h ALA 231 Cb 0.31 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.01 2oz3 h ALA 231 CO 0.00 0.00 0.45 -0.09 0.00 0.00 0.00 179.25 179.62 2oz3 h ARG 232 N 0.00 0.65 0.00 0.00 2.43 -1.29 -0.77 114.38 115.40 2oz3 h ARG 232 Ca 0.00 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 2oz3 h ARG 232 Cb 0.70 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2oz3 h ARG 232 CO 0.00 0.43 -0.04 1.05 -1.51 0.00 0.00 179.97 179.90 2oz3 h GLU 233 N 0.67 0.00 -0.69 0.20 4.11 -1.78 -2.58 114.58 114.51 2oz3 h GLU 233 Ca 0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.89 2oz3 h GLU 233 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2oz3 h GLU 233 CO -0.34 0.04 0.00 0.66 0.07 0.00 0.00 179.01 179.44 2oz3 n TYR 234 N -4.11 0.92 -1.77 2.06 4.01 -0.33 -4.98 117.16 112.95 2oz3 n TYR 234 Ca -0.03 -0.48 -0.09 0.00 -0.16 0.00 0.00 57.90 57.15 2oz3 n TYR 234 Cb 0.12 -0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.13 2oz3 n TYR 234 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2oz3 n GLY 235 N 1.58 0.45 3.70 2.72 0.00 -0.97 -4.94 105.19 107.73 2oz3 n GLY 235 Ca 0.23 -0.58 -0.44 0.00 0.00 0.00 0.00 46.02 45.24 2oz3 n GLY 235 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2oz3 n LEU 236 N -1.11 3.65 0.01 0.99 7.94 -1.21 -4.73 117.00 122.54 2oz3 n LEU 236 Ca -0.09 1.08 -0.18 0.00 -1.11 0.00 0.00 56.01 55.71 2oz3 n LEU 236 Cb 0.45 -1.51 -0.13 0.00 0.53 0.00 0.00 43.42 42.75 2oz3 n LEU 236 CO 0.12 -0.03 0.19 0.50 -1.11 0.00 0.00 177.39 177.06 2oz3 h LYS 237 N 6.16 0.25 -2.88 1.96 3.64 -1.27 -3.48 116.57 120.96 2oz3 h LYS 237 Ca -0.44 -0.37 -0.10 0.00 -1.27 0.00 0.00 60.65 58.47 2oz3 h LYS 237 Cb 1.23 0.13 -0.19 0.00 -0.41 0.00 0.00 32.23 32.98 2oz3 h LYS 237 CO 0.91 1.13 -0.17 1.67 -2.27 0.00 0.00 179.45 180.72 2oz3 s TRP 238 N -2.62 -0.27 -0.19 1.91 -2.14 -1.26 -4.86 118.94 109.51 2oz3 s TRP 238 Ca -0.15 0.38 -0.06 0.00 2.66 0.00 0.00 56.10 58.93 2oz3 s TRP 238 Cb 0.01 0.17 -0.03 0.00 -3.10 0.00 0.00 33.47 30.51 2oz3 s TRP 238 CO 0.79 -0.46 0.03 -1.50 -2.66 0.00 0.00 176.95 173.15 2oz3 s ILE 239 N -1.57 4.40 -0.08 0.66 2.07 -1.26 -2.49 121.20 122.93 2oz3 s ILE 239 Ca -0.11 -0.17 0.03 0.00 -1.41 0.00 0.00 60.65 58.99 2oz3 s ILE 239 Cb -0.03 -2.98 -0.02 0.00 0.13 0.00 0.00 42.46 39.56 2oz3 s ILE 239 CO 0.04 0.45 -0.16 -0.70 -1.91 0.00 0.00 174.94 172.65 2oz3 s GLU 240 N 0.60 2.87 -1.31 3.50 2.12 0.14 -1.82 118.70 124.81 2oz3 s GLU 240 Ca 0.01 -0.74 -0.21 0.00 0.36 0.00 0.00 54.97 54.40 2oz3 s GLU 240 Cb -0.13 -2.43 0.02 0.00 0.26 0.00 0.00 34.13 31.85 2oz3 s GLU 240 CO 0.02 0.40 0.50 0.39 -0.54 0.00 0.00 175.26 176.03 2oz3 n GLU 241 N 2.95 -0.87 -0.15 4.30 1.02 0.07 -0.85 120.64 127.10 2oz3 n GLU 241 Ca -0.18 0.16 -0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2oz3 n GLU 241 Cb 0.52 -3.22 0.25 0.00 -0.02 0.00 0.00 31.44 28.97 2oz3 n GLU 241 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2oz3 h ALA 242 N 1.24 1.39 -2.36 0.62 0.00 -1.84 -3.08 119.26 115.22 2oz3 h ALA 242 Ca -0.69 -0.11 -0.50 0.00 0.00 0.00 0.00 54.91 53.61 2oz3 h ALA 242 Cb 1.40 -0.25 -0.15 0.00 0.00 0.00 0.00 17.79 18.78 2oz3 h ALA 242 CO 0.57 0.49 -0.75 -0.51 0.00 0.00 0.00 179.25 179.05 2oz3 s LEU 243 N -9.59 2.54 0.38 0.00 1.43 -1.26 -0.48 118.68 111.70 2oz3 s LEU 243 Ca -0.10 -0.99 -0.25 0.00 -1.03 0.00 0.00 54.13 51.76 2oz3 s LEU 243 Cb 0.17 -0.80 -0.12 0.00 0.03 0.00 0.00 46.19 45.47 2oz3 s LEU 243 CO 0.78 -0.10 0.96 -2.65 0.23 0.00 0.00 176.35 175.57 2oz3 n PRO 244 N -0.29 1.26 0.03 1.29 -0.02 -1.26 -4.77 135.00 131.24 2oz3 n PRO 244 Ca -0.08 0.45 0.07 0.00 -2.02 0.00 0.00 63.50 61.92 2oz3 n PRO 244 Cb 0.60 -1.93 0.31 0.00 -0.02 0.00 0.00 33.50 32.46 2oz3 n PRO 244 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2oz3 n PRO 245 N 0.35 0.04 0.22 0.52 -0.04 -1.26 -1.83 135.00 133.00 2oz3 n PRO 245 Ca 0.10 0.32 0.12 0.00 -0.04 0.00 0.00 63.50 64.00 2oz3 n PRO 245 Cb 0.37 -1.58 0.30 0.00 -0.04 0.00 0.00 33.50 32.55 2oz3 n PRO 245 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2oz3 h ASP 246 N 0.00 0.00 -1.60 3.54 3.32 -1.94 -3.40 116.42 116.34 2oz3 h ASP 246 Ca 0.00 0.00 -0.76 0.00 0.02 0.00 0.00 57.03 56.29 2oz3 h ASP 246 Cb 0.23 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.61 2oz3 h ASP 246 CO 0.00 0.11 1.87 -0.67 -1.72 0.00 0.00 179.24 178.83 2oz3 n ASP 247 N -3.15 5.79 -0.13 6.45 2.03 -0.76 -4.74 116.55 122.04 2oz3 n ASP 247 Ca 0.02 -3.18 -0.05 0.00 0.52 0.00 0.00 54.79 52.10 2oz3 n ASP 247 Cb 0.50 -1.42 0.03 0.00 -0.72 0.00 0.00 41.12 39.51 2oz3 n ASP 247 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 2oz3 h TYR 248 N 5.48 0.26 -0.95 -0.67 0.05 -1.85 -2.11 116.97 117.19 2oz3 h TYR 248 Ca 0.41 0.02 0.06 0.00 0.05 0.00 0.00 58.73 59.27 2oz3 h TYR 248 Cb 0.57 -0.06 -0.06 0.00 1.01 0.00 0.00 36.73 38.19 2oz3 h TYR 248 CO 1.27 0.10 0.61 -1.49 -1.05 0.00 0.00 178.16 177.60 2oz3 h TRP 249 N 0.31 1.13 -0.02 4.88 6.55 -1.99 -2.34 115.95 124.48 2oz3 h TRP 249 Ca 0.19 0.03 -0.18 0.00 0.95 0.00 0.00 58.89 59.88 2oz3 h TRP 249 Cb 0.17 -0.37 -0.01 0.00 -0.86 0.00 0.00 29.16 28.09 2oz3 h TRP 249 CO -0.15 0.60 -0.78 0.78 -1.05 0.00 0.00 178.44 177.84 2oz3 h GLY 250 N 1.12 0.21 1.07 1.49 0.00 -1.89 -2.64 103.07 102.44 2oz3 h GLY 250 Ca 0.40 -0.33 -0.12 0.00 0.00 0.00 0.00 47.33 47.28 2oz3 h GLY 250 CO -0.16 0.29 -0.18 -0.97 0.00 0.00 0.00 176.54 175.52 2oz3 h TYR 251 N 0.12 1.07 -0.95 5.60 -1.99 -1.13 -0.81 116.97 118.87 2oz3 h TYR 251 Ca -0.03 -0.25 -0.00 0.00 2.00 0.00 0.00 58.73 60.44 2oz3 h TYR 251 Cb 1.36 -0.25 -0.05 0.00 2.00 0.00 0.00 36.73 39.79 2oz3 h TYR 251 CO 0.02 1.05 0.58 0.00 -0.00 0.00 0.00 178.16 179.82 2oz3 h ALA 252 N 0.86 1.21 -0.30 3.88 0.00 -1.44 -1.42 119.26 122.06 2oz3 h ALA 252 Ca 0.11 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.75 2oz3 h ALA 252 Cb 0.75 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2oz3 h ALA 252 CO 0.06 0.66 -0.47 1.49 0.00 0.00 0.00 179.25 180.99 2oz3 h GLU 253 N 1.31 0.84 -0.75 0.00 4.81 -1.36 -2.81 114.58 116.62 2oz3 h GLU 253 Ca 0.34 -0.51 -0.05 0.00 -0.13 0.00 0.00 59.36 59.01 2oz3 h GLU 253 Cb -0.07 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 2oz3 h GLU 253 CO -0.07 1.15 0.25 1.25 -0.73 0.00 0.00 179.01 180.86 2oz3 h LEU 254 N 0.62 1.06 -0.76 1.64 5.85 -1.00 0.43 115.31 123.15 2oz3 h LEU 254 Ca 0.02 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.61 2oz3 h LEU 254 Cb 1.08 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.77 2oz3 h LEU 254 CO 0.11 0.97 0.46 -0.09 -0.34 0.00 0.00 178.44 179.55 2oz3 h ARG 255 N 1.10 0.83 -0.60 1.25 2.43 -1.28 0.23 114.38 118.35 2oz3 h ARG 255 Ca 0.24 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 2oz3 h ARG 255 Cb 0.27 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 2oz3 h ARG 255 CO -0.01 0.55 0.23 0.00 -1.51 0.00 0.00 179.97 179.23 2oz3 h ARG 256 N 0.85 0.87 -0.00 0.20 3.08 -1.19 -3.19 114.38 115.00 2oz3 h ARG 256 Ca 0.33 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.24 2oz3 h ARG 256 Cb 0.14 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2oz3 h ARG 256 CO -0.16 0.72 -0.10 0.09 -1.07 0.00 0.00 179.97 179.45 2oz3 n ASN 257 N -4.32 0.26 -4.80 7.04 5.03 0.11 -4.92 115.26 113.66 2oz3 n ASN 257 Ca 0.05 -0.23 -0.35 0.00 0.87 0.00 0.00 54.58 54.92 2oz3 n ASN 257 Cb 0.17 -0.18 -0.06 0.00 -1.02 0.00 0.00 39.78 38.69 2oz3 n ASN 257 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2oz3 s ALA 258 N -2.65 3.12 0.29 5.41 0.00 -0.02 -4.93 121.76 122.98 2oz3 s ALA 258 Ca 0.24 0.49 -0.30 0.00 0.00 0.00 0.00 51.96 52.40 2oz3 s ALA 258 Cb 0.20 -3.18 -0.13 0.00 0.00 0.00 0.00 23.12 20.01 2oz3 s ALA 258 CO 0.50 0.11 1.38 -2.30 0.00 0.00 0.00 175.76 175.45 2oz3 n PRO 259 N -0.04 2.18 -2.18 0.00 -0.02 -1.26 -4.83 135.00 128.85 2oz3 n PRO 259 Ca 0.05 0.77 -0.42 0.00 -2.02 0.00 0.00 63.50 61.87 2oz3 n PRO 259 Cb 0.52 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.56 2oz3 n PRO 259 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2oz3 s THR 260 N -0.53 3.85 0.00 3.45 -1.32 -1.26 -5.11 115.64 114.73 2oz3 s THR 260 Ca 0.62 1.05 0.00 0.00 -1.21 0.00 0.00 61.69 62.15 2oz3 s THR 260 Cb -0.59 -3.68 0.00 0.00 -1.51 0.00 0.00 72.50 66.72 2oz3 s THR 260 CO 0.55 -0.08 0.00 0.61 -2.21 0.00 0.00 174.62 173.49 2oz3 n GLY 261 N 3.90 0.69 3.51 6.08 0.00 -1.26 -5.22 105.19 112.87 2oz3 n GLY 261 Ca 0.16 -0.22 0.01 0.00 0.00 0.00 0.00 46.02 45.97 2oz3 n GLY 261 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oz3 s VAL 264 N -0.83 -0.11 0.08 1.61 1.01 -1.26 -4.99 120.40 115.91 2oz3 s VAL 264 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 61.98 62.03 2oz3 s VAL 264 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 2oz3 s VAL 264 CO 0.00 0.00 -0.13 0.42 0.00 0.00 0.00 175.10 175.39 2oz3 s THR 265 N 1.59 1.11 0.35 3.92 -4.23 -0.76 0.34 115.64 117.97 2oz3 s THR 265 Ca -0.06 -1.43 -0.17 0.00 -1.18 0.00 0.00 61.69 58.85 2oz3 s THR 265 Cb -0.03 -1.19 0.05 0.00 1.34 0.00 0.00 72.50 72.67 2oz3 s THR 265 CO -0.14 -0.32 0.78 0.28 -0.54 0.00 0.00 174.62 174.68 2oz3 s THR 266 N -1.62 0.00 0.00 3.99 -1.32 -1.16 -0.75 115.64 114.78 2oz3 s THR 266 Ca 0.01 -0.99 0.00 0.00 -1.21 0.00 0.00 61.69 59.50 2oz3 s THR 266 Cb -0.08 -2.63 0.00 0.00 -1.51 0.00 0.00 72.50 68.28 2oz3 s THR 266 CO 0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 2oz3 n GLY 267 N -0.51 0.70 0.35 6.08 0.00 -1.26 -1.37 105.19 109.17 2oz3 n GLY 267 Ca -0.07 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.03 2oz3 n GLY 267 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2oz3 h GLU 268 N 0.00 0.84 -0.71 1.61 4.81 -1.76 -1.85 114.58 117.52 2oz3 h GLU 268 Ca 0.00 -0.05 -0.48 0.00 -0.13 0.00 0.00 59.36 58.70 2oz3 h GLU 268 Cb 0.00 -0.19 -0.29 0.00 0.63 0.00 0.00 28.75 28.90 2oz3 h GLU 268 CO 0.00 0.55 -0.08 0.72 -0.73 0.00 0.00 179.01 179.47 2oz3 n HIS 269 N -4.71 2.40 -4.28 0.92 8.25 -1.26 -4.06 115.22 112.48 2oz3 n HIS 269 Ca 0.20 -2.26 -0.28 0.00 -0.26 0.00 0.00 57.72 55.12 2oz3 n HIS 269 Cb 0.42 -0.72 -0.10 0.00 1.12 0.00 0.00 29.99 30.71 2oz3 n HIS 269 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2oz3 s GLU 270 N -3.55 1.98 0.02 -0.41 2.56 -0.69 -4.91 118.70 113.70 2oz3 s GLU 270 Ca 0.53 -1.20 -0.03 0.00 0.00 0.00 0.00 54.97 54.28 2oz3 s GLU 270 Cb 0.44 -2.17 -0.01 0.00 2.00 0.00 0.00 34.13 34.39 2oz3 s GLU 270 CO 0.01 0.46 0.03 0.00 -0.56 0.00 0.00 175.26 175.20 2oz3 s ALA 271 N -1.44 0.01 0.47 6.30 0.00 -1.26 -4.43 121.76 121.41 2oz3 s ALA 271 Ca 0.22 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.67 2oz3 s ALA 271 Cb -0.10 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.18 2oz3 s ALA 271 CO 0.13 -0.21 0.00 0.25 0.00 0.00 0.00 175.76 175.94 2oz3 n THR 272 N 1.36 -0.63 -0.21 0.00 -2.24 -0.65 -3.37 114.28 108.53 2oz3 n THR 272 Ca -0.22 0.69 0.19 0.00 -2.27 0.00 0.00 64.05 62.44 2oz3 n THR 272 Cb 0.56 -1.07 0.53 0.00 -2.10 0.00 0.00 70.33 68.24 2oz3 n THR 272 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 2oz3 h ARG 273 N -1.11 0.37 0.13 -0.78 0.11 -1.86 -2.24 114.38 109.00 2oz3 h ARG 273 Ca -0.14 -0.02 -0.29 0.00 0.10 0.00 0.00 59.98 59.63 2oz3 h ARG 273 Cb 1.08 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 32.08 2oz3 h ARG 273 CO 0.06 0.24 -1.34 -1.49 0.10 0.00 0.00 179.97 177.53 2oz3 h TRP 274 N 0.38 0.50 -0.64 4.08 6.55 -1.99 0.20 115.95 125.03 2oz3 h TRP 274 Ca 0.43 -0.37 -0.07 0.00 0.95 0.00 0.00 58.89 59.84 2oz3 h TRP 274 Cb 1.11 -0.02 -0.03 0.00 -0.86 0.00 0.00 29.16 29.36 2oz3 h TRP 274 CO -0.00 1.32 0.12 0.78 -1.05 0.00 0.00 178.44 179.61 2oz3 h GLY 275 N 1.57 1.13 1.80 1.49 0.00 -1.53 -3.15 103.07 104.37 2oz3 h GLY 275 Ca -0.17 -0.74 -0.17 0.00 0.00 0.00 0.00 47.33 46.25 2oz3 h GLY 275 CO 0.19 0.69 -0.72 0.74 0.00 0.00 0.00 176.54 177.44 2oz3 h PHE 276 N 0.96 0.27 0.00 5.60 0.04 -1.30 -2.87 116.94 119.63 2oz3 h PHE 276 Ca 0.19 -0.12 0.00 0.00 2.80 0.00 0.00 57.97 60.84 2oz3 h PHE 276 Cb 0.42 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.53 2oz3 h PHE 276 CO 0.03 0.84 0.00 -2.13 -0.60 0.00 0.00 178.31 176.46 2oz3 n ARG 277 N -3.77 0.00 0.00 1.51 0.63 0.68 -1.84 116.66 113.87 2oz3 n ARG 277 Ca -0.03 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.90 2oz3 n ARG 277 Cb 0.70 -1.04 0.00 0.00 0.45 0.00 0.00 32.46 32.57 2oz3 n ARG 277 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2oz3 n LEU 279 N 0.60 0.00 -0.03 6.15 4.77 -1.09 -0.51 117.00 126.89 2oz3 n LEU 279 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.83 2oz3 n LEU 279 Cb 0.00 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 2oz3 n LEU 279 CO 0.00 0.00 0.38 -0.07 -1.33 0.00 0.00 177.39 176.37 2oz3 h LEU 280 N 0.00 0.17 -1.71 2.23 3.38 -1.67 0.55 115.31 118.26 2oz3 h LEU 280 Ca 0.00 -0.83 0.00 0.00 0.09 0.00 0.00 57.88 57.14 2oz3 h LEU 280 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2oz3 h LEU 280 CO 0.00 0.98 0.00 -0.62 0.09 0.00 0.00 178.44 178.89 2oz3 n GLU 281 N -4.52 0.00 -2.64 1.13 1.02 0.33 -4.56 120.64 111.40 2oz3 n GLU 281 Ca -0.10 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 56.99 2oz3 n GLU 281 Cb 0.51 -1.35 0.06 0.00 -0.02 0.00 0.00 31.44 30.64 2oz3 n GLU 281 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2oz3 n GLY 283 N 0.85 0.41 0.11 0.62 0.00 -1.08 -5.19 105.19 100.91 2oz3 n GLY 283 Ca 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 46.02 45.92 2oz3 n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oz3 n ASP 286 N -0.37 0.48 -4.04 0.00 8.00 0.15 -4.85 116.55 115.93 2oz3 n ASP 286 Ca -0.16 0.23 -0.22 0.00 0.71 0.00 0.00 54.79 55.34 2oz3 n ASP 286 Cb 0.65 0.45 -0.16 0.00 -0.02 0.00 0.00 41.12 42.04 2oz3 n ASP 286 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2oz3 s ILE 287 N -2.59 0.98 -0.07 0.53 1.01 -1.24 -3.85 121.20 115.97 2oz3 s ILE 287 Ca -0.07 -0.46 -0.08 0.00 0.00 0.00 0.00 60.65 60.04 2oz3 s ILE 287 Cb 0.07 -0.86 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 2oz3 s ILE 287 CO 0.83 0.30 0.22 0.27 0.00 0.00 0.00 174.94 176.56 2oz3 s ILE 288 N 0.20 5.36 -0.41 2.92 -4.36 -0.72 -2.96 121.20 121.24 2oz3 s ILE 288 Ca -0.04 0.33 0.11 0.00 -0.26 0.00 0.00 60.65 60.79 2oz3 s ILE 288 Cb -0.10 -3.50 0.38 0.00 1.25 0.00 0.00 42.46 40.49 2oz3 s ILE 288 CO 0.01 0.56 0.87 0.00 0.24 0.00 0.00 174.94 176.62 2oz3 n GLN 289 N 1.76 1.72 -1.77 0.37 6.02 -0.47 -1.71 117.38 123.30 2oz3 n GLN 289 Ca -0.17 -3.76 -0.37 0.00 -0.01 0.00 0.00 57.00 52.69 2oz3 n GLN 289 Cb 0.54 -1.75 0.06 0.00 1.02 0.00 0.00 30.24 30.11 2oz3 n GLN 289 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2oz3 s PRO 290 N -2.93 2.75 -0.31 -1.09 0.04 -1.25 -2.13 135.00 130.08 2oz3 s PRO 290 Ca 0.39 2.11 -0.13 0.00 0.04 0.00 0.00 61.00 63.41 2oz3 s PRO 290 Cb 0.37 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.91 2oz3 s PRO 290 CO -0.07 -1.46 0.28 0.34 0.04 0.00 0.00 177.00 176.13 2oz3 s ASP 291 N -1.26 6.11 0.58 6.66 -1.08 -1.26 -1.62 116.67 124.81 2oz3 s ASP 291 Ca 0.79 -0.14 0.30 0.00 -0.52 0.00 0.00 52.55 52.99 2oz3 s ASP 291 Cb -0.38 -2.16 1.78 0.00 -1.46 0.00 0.00 42.92 40.69 2oz3 s ASP 291 CO 0.42 -0.20 2.22 1.62 0.52 0.00 0.00 175.17 179.74 2oz3 h VAL 292 N 5.45 0.48 0.00 1.11 3.04 -1.91 0.61 116.25 125.04 2oz3 h VAL 292 Ca -0.32 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 2oz3 h VAL 292 Cb 1.16 1.10 0.00 0.00 -2.01 0.00 0.00 31.29 31.54 2oz3 h VAL 292 CO 0.63 0.03 0.00 0.61 -1.01 0.00 0.00 177.57 177.83 2oz3 n GLY 293 N -1.11 -1.66 0.00 3.17 0.00 -1.26 -2.82 105.19 101.51 2oz3 n GLY 293 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2oz3 n GLY 293 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2oz3 n TRP 294 N -2.24 0.00 1.03 1.61 8.01 0.17 -4.33 117.44 121.69 2oz3 n TRP 294 Ca 0.05 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.35 2oz3 n TRP 294 Cb 0.41 0.00 0.03 0.00 -2.01 0.00 0.00 31.31 29.74 2oz3 n TRP 294 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2oz3 n GLY 296 N 1.45 1.08 0.99 0.00 0.00 -1.26 -1.64 105.19 105.81 2oz3 n GLY 296 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2oz3 n GLY 296 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oz3 n GLY 297 N 0.00 -2.33 0.26 -0.02 0.00 -1.13 -4.14 105.19 97.83 2oz3 n GLY 297 Ca 0.00 -1.96 -0.08 0.00 0.00 0.00 0.00 46.02 43.99 2oz3 n GLY 297 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2oz3 h VAL 298 N 0.00 1.23 -0.61 1.61 2.07 -1.85 0.11 116.25 118.81 2oz3 h VAL 298 Ca 0.00 -0.73 0.06 0.00 0.82 0.00 0.00 66.70 66.85 2oz3 h VAL 298 Cb 0.00 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 30.33 2oz3 h VAL 298 CO 0.00 0.28 0.32 0.74 0.02 0.00 0.00 177.57 178.93 2oz3 h THR 299 N 0.81 0.95 0.12 2.57 2.02 -1.92 0.84 112.91 118.30 2oz3 h THR 299 Ca 0.19 -0.21 -0.28 0.00 0.77 0.00 0.00 66.41 66.88 2oz3 h THR 299 Cb 0.22 0.30 0.02 0.00 -1.74 0.00 0.00 68.15 66.94 2oz3 h THR 299 CO -0.01 0.11 -1.22 -0.08 0.37 0.00 0.00 175.52 174.69 2oz3 h GLU 300 N 0.60 0.47 -0.47 6.66 4.57 -1.69 -3.22 114.58 121.50 2oz3 h GLU 300 Ca 0.27 -0.66 0.10 0.00 -1.18 0.00 0.00 59.36 57.89 2oz3 h GLU 300 Cb 0.17 0.23 -0.10 0.00 -0.16 0.00 0.00 28.75 28.90 2oz3 h GLU 300 CO -0.18 1.29 -0.17 1.25 -1.18 0.00 0.00 179.01 180.01 2oz3 h LEU 301 N 0.19 -0.62 -0.69 1.64 5.85 -0.54 0.61 115.31 121.76 2oz3 h LEU 301 Ca -0.16 0.16 0.12 0.00 0.84 0.00 0.00 57.88 58.84 2oz3 h LEU 301 Cb 1.90 0.36 -0.13 0.00 0.37 0.00 0.00 40.66 43.17 2oz3 h LEU 301 CO 0.22 -0.21 -0.34 -0.07 -0.34 0.00 0.00 178.44 177.70 2oz3 h LEU 302 N -0.07 -1.19 -0.51 2.25 3.38 -0.88 0.50 115.31 118.79 2oz3 h LEU 302 Ca 0.23 0.24 -0.03 0.00 0.09 0.00 0.00 57.88 58.41 2oz3 h LEU 302 Cb 0.42 0.61 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 2oz3 h LEU 302 CO -0.52 -0.30 0.21 0.11 0.09 0.00 0.00 178.44 178.03 2oz3 h LYS 303 N -0.12 0.77 -0.60 1.13 1.57 -1.34 -1.68 116.57 116.30 2oz3 h LYS 303 Ca 0.26 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 2oz3 h LYS 303 Cb 0.56 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 2oz3 h LYS 303 CO -0.75 0.67 0.35 0.82 -0.57 0.00 0.00 179.45 179.97 2oz3 h ILE 304 N 0.69 1.19 -0.87 1.86 2.04 0.17 -1.60 117.51 120.99 2oz3 h ILE 304 Ca 0.17 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 2oz3 h ILE 304 Cb 0.19 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 2oz3 h ILE 304 CO -0.02 0.20 0.51 -1.28 0.00 0.00 0.00 178.15 177.56 2oz3 h SER 305 N 0.82 1.05 0.36 1.72 0.87 0.18 -1.78 113.55 116.78 2oz3 h SER 305 Ca 0.21 -0.07 -0.07 0.00 -1.23 0.00 0.00 61.79 60.63 2oz3 h SER 305 Cb 0.01 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 2oz3 h SER 305 CO -0.04 0.82 -0.34 0.00 -0.53 0.00 0.00 176.83 176.74 2oz3 h ALA 306 N 1.28 1.41 -0.20 6.23 0.00 -0.93 0.14 119.26 127.19 2oz3 h ALA 306 Ca 0.31 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2oz3 h ALA 306 Cb -0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2oz3 h ALA 306 CO -0.06 0.43 -0.03 -0.07 0.00 0.00 0.00 179.25 179.52 2oz3 h LEU 307 N 0.00 0.37 -0.75 0.00 3.38 -0.82 -2.72 115.31 114.76 2oz3 h LEU 307 Ca -0.00 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 2oz3 h LEU 307 Cb 0.61 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 2oz3 h LEU 307 CO 0.04 0.64 0.33 0.00 0.09 0.00 0.00 178.44 179.54 2oz3 h ALA 308 N 0.75 0.98 -0.57 1.53 0.00 -1.02 -2.11 119.26 118.81 2oz3 h ALA 308 Ca 0.05 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 54.90 2oz3 h ALA 308 Cb 0.47 -0.30 -0.11 0.00 0.00 0.00 0.00 17.79 17.85 2oz3 h ALA 308 CO 0.02 0.57 -0.23 -0.44 0.00 0.00 0.00 179.25 179.17 2oz3 h ASP 309 N 1.07 -0.80 0.37 0.00 3.45 -0.75 0.13 116.42 119.88 2oz3 h ASP 309 Ca 0.26 0.20 -0.07 0.00 0.43 0.00 0.00 57.03 57.84 2oz3 h ASP 309 Cb 0.16 0.45 -0.01 0.00 -0.56 0.00 0.00 39.33 39.37 2oz3 h ASP 309 CO -0.03 -0.25 -0.33 0.00 -1.57 0.00 0.00 179.24 177.06 2oz3 h ALA 310 N 1.32 1.40 -0.05 3.45 0.00 -1.22 -2.40 119.26 121.75 2oz3 h ALA 310 Ca 0.26 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2oz3 h ALA 310 Cb 0.50 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2oz3 h ALA 310 CO -0.63 0.41 0.00 0.72 0.00 0.00 0.00 179.25 179.75 2oz3 n HIS 311 N -4.06 0.05 -3.69 0.00 8.25 -0.68 -4.94 115.22 110.15 2oz3 n HIS 311 Ca -0.02 -0.03 -0.28 0.00 -0.26 0.00 0.00 57.72 57.14 2oz3 n HIS 311 Cb 0.38 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.50 2oz3 n HIS 311 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2oz3 n ASN 312 N 0.30 -4.54 -4.91 0.41 3.02 0.29 -4.99 115.26 104.85 2oz3 n ASN 312 Ca 0.18 -0.64 -0.30 0.00 -0.03 0.00 0.00 54.58 53.80 2oz3 n ASN 312 Cb 0.37 -3.66 -0.04 0.00 -0.61 0.00 0.00 39.78 35.84 2oz3 n ASN 312 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oz3 s ALA 313 N -3.18 3.75 0.34 5.41 0.00 -0.33 -5.03 121.76 122.73 2oz3 s ALA 313 Ca 0.56 -0.62 -0.26 0.00 0.00 0.00 0.00 51.96 51.64 2oz3 s ALA 313 Cb -0.29 -2.14 -0.09 0.00 0.00 0.00 0.00 23.12 20.60 2oz3 s ALA 313 CO 0.69 0.50 1.04 -0.51 0.00 0.00 0.00 175.76 177.48 2oz3 s LEU 314 N -3.06 4.33 -0.29 0.00 1.43 -1.25 -4.50 118.68 115.33 2oz3 s LEU 314 Ca 0.41 2.08 -0.05 0.00 -1.03 0.00 0.00 54.13 55.54 2oz3 s LEU 314 Cb -0.11 -3.95 0.02 0.00 0.03 0.00 0.00 46.19 42.19 2oz3 s LEU 314 CO 0.27 -0.28 0.05 -0.69 0.23 0.00 0.00 176.35 175.92 2oz3 s VAL 315 N -1.46 3.58 -0.59 -1.59 1.01 -0.52 -1.75 120.40 119.08 2oz3 s VAL 315 Ca 0.51 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.56 2oz3 s VAL 315 Cb -0.25 -2.90 0.15 0.00 0.00 0.00 0.00 36.38 33.38 2oz3 s VAL 315 CO 0.32 0.03 0.37 -0.69 0.00 0.00 0.00 175.10 175.13 2oz3 s VAL 316 N 1.41 3.22 0.66 2.92 1.01 -0.69 -3.92 120.40 125.01 2oz3 s VAL 316 Ca 0.00 -3.20 -0.17 0.00 0.00 0.00 0.00 61.98 58.61 2oz3 s VAL 316 Cb -0.18 -3.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 2oz3 s VAL 316 CO 0.01 -0.85 1.19 -2.65 0.00 0.00 0.00 175.10 172.79 2oz3 n PRO 317 N 3.23 0.93 -1.50 2.72 -0.02 -1.26 -4.39 135.00 134.70 2oz3 n PRO 317 Ca 0.07 0.37 -0.49 0.00 -2.02 0.00 0.00 63.50 61.44 2oz3 n PRO 317 Cb 0.35 -2.42 -0.04 0.00 -0.02 0.00 0.00 33.50 31.37 2oz3 n PRO 317 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 2oz3 n HIS 318 N -2.06 0.55 -1.63 6.00 -0.00 -0.64 -4.37 115.22 113.07 2oz3 n HIS 318 Ca 0.15 0.84 -0.43 0.00 0.46 0.00 0.00 57.72 58.74 2oz3 n HIS 318 Cb 0.48 -2.13 -0.03 0.00 -0.12 0.00 0.00 29.99 28.19 2oz3 n HIS 318 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2oz3 n GLY 319 N 1.77 1.47 2.28 1.57 0.00 -1.26 -4.78 105.19 106.25 2oz3 n GLY 319 Ca 0.16 0.81 -0.05 0.00 0.00 0.00 0.00 46.02 46.94 2oz3 n GLY 319 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2oz3 n SER 320 N 9.20 2.34 0.00 1.61 7.64 -1.26 -4.87 113.62 128.28 2oz3 n SER 320 Ca 0.25 -2.58 0.00 0.00 1.01 0.00 0.00 58.87 57.54 2oz3 n SER 320 Cb 0.41 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 2oz3 n SER 320 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2oz3 n SER 321 N -0.50 0.00 0.17 6.43 2.88 -1.26 -2.44 113.62 118.90 2oz3 n SER 321 Ca 0.17 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.85 2oz3 n SER 321 Cb 0.89 0.00 0.70 0.00 -0.75 0.00 0.00 64.21 65.05 2oz3 n SER 321 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2oz3 h VAL 322 N 0.00 0.81 -0.20 2.46 -1.51 -1.92 -1.85 116.25 114.05 2oz3 h VAL 322 Ca 0.00 0.00 -0.10 0.00 -1.23 0.00 0.00 66.70 65.37 2oz3 h VAL 322 Cb 0.00 0.89 -0.01 0.00 -2.13 0.00 0.00 31.29 30.04 2oz3 h VAL 322 CO 0.00 0.00 -0.30 1.88 -1.23 0.00 0.00 177.57 177.92 2oz3 h TYR 323 N 0.00 0.44 -0.02 5.19 0.05 -1.83 -2.11 116.97 118.68 2oz3 h TYR 323 Ca 0.09 -0.10 -0.04 0.00 0.05 0.00 0.00 58.73 58.74 2oz3 h TYR 323 Cb 0.39 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 38.03 2oz3 h TYR 323 CO 0.00 0.65 -0.13 1.03 -1.05 0.00 0.00 178.16 178.66 2oz3 h SER 324 N 0.34 0.15 -0.67 3.88 0.87 -1.42 -3.37 113.55 113.33 2oz3 h SER 324 Ca 0.05 -0.68 -0.04 0.00 -1.23 0.00 0.00 61.79 59.89 2oz3 h SER 324 Cb 0.70 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.59 2oz3 h SER 324 CO 0.05 0.80 0.25 1.88 -0.53 0.00 0.00 176.83 179.29 2oz3 h TYR 325 N -0.49 1.03 -0.38 2.24 0.05 -0.94 -1.13 116.97 117.34 2oz3 h TYR 325 Ca -0.01 -0.08 -0.09 0.00 0.05 0.00 0.00 58.73 58.60 2oz3 h TYR 325 Cb 0.80 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 38.22 2oz3 h TYR 325 CO 0.15 0.81 -0.12 0.45 -1.05 0.00 0.00 178.16 178.40 2oz3 h HIS 326 N 0.95 0.74 0.54 4.88 3.86 -1.62 -2.59 115.15 121.91 2oz3 h HIS 326 Ca 0.22 -0.13 -0.03 0.00 -1.16 0.00 0.00 60.37 59.28 2oz3 h HIS 326 Cb 0.23 -0.19 0.01 0.00 1.06 0.00 0.00 27.41 28.51 2oz3 h HIS 326 CO 0.02 0.77 -0.26 0.35 0.86 0.00 0.00 177.93 179.66 2oz3 h PHE 327 N 0.62 -0.67 0.00 2.45 3.04 -1.60 -3.34 116.94 117.43 2oz3 h PHE 327 Ca 0.11 -0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.01 2oz3 h PHE 327 Cb 0.56 0.22 -0.00 0.00 2.56 0.00 0.00 35.95 39.29 2oz3 h PHE 327 CO 0.03 -0.34 -0.14 -0.39 -2.02 0.00 0.00 178.31 175.44 2oz3 h VAL 328 N -1.02 0.42 -0.64 1.41 -1.51 -1.21 -0.82 116.25 112.88 2oz3 h VAL 328 Ca -0.07 -0.80 0.11 0.00 -1.23 0.00 0.00 66.70 64.70 2oz3 h VAL 328 Cb 0.63 1.57 -0.04 0.00 -2.13 0.00 0.00 31.29 31.32 2oz3 h VAL 328 CO 0.12 0.14 0.43 0.00 -1.23 0.00 0.00 177.57 177.03 2oz3 h ALA 329 N 1.86 2.01 -0.01 5.19 0.00 -1.58 -3.01 119.26 123.72 2oz3 h ALA 329 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2oz3 h ALA 329 Cb 0.56 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2oz3 h ALA 329 CO 0.02 -0.16 -0.35 0.25 0.00 0.00 0.00 179.25 179.01 2oz3 n THR 330 N -4.47 0.00 -3.86 0.00 -2.24 -0.31 -0.77 114.28 102.63 2oz3 n THR 330 Ca 0.11 -0.09 -0.36 0.00 -2.27 0.00 0.00 64.05 61.44 2oz3 n THR 330 Cb 0.39 0.37 -0.13 0.00 -2.10 0.00 0.00 70.33 68.86 2oz3 n THR 330 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2oz3 s ARG 331 N -2.67 3.56 0.41 -0.78 1.81 -1.14 -4.60 118.95 115.54 2oz3 s ARG 331 Ca 0.20 -0.53 0.12 0.00 -1.72 0.00 0.00 55.73 53.80 2oz3 s ARG 331 Cb 0.19 -3.18 0.96 0.00 -0.45 0.00 0.00 34.95 32.47 2oz3 s ARG 331 CO 0.58 -0.15 1.96 1.96 -0.68 0.00 0.00 175.30 178.97 2oz3 h GLN 332 N 8.05 0.49 -0.46 3.54 1.08 -1.90 -2.58 115.11 123.33 2oz3 h GLN 332 Ca -0.39 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 56.78 2oz3 h GLN 332 Cb 1.17 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.49 2oz3 h GLN 332 CO 0.59 0.32 0.00 0.27 -0.95 0.00 0.00 178.83 179.06 2oz3 n ASN 333 N -4.48 2.45 -3.60 1.46 6.94 -1.26 -4.23 115.26 112.55 2oz3 n ASN 333 Ca 0.11 -2.04 -0.30 0.00 -0.02 0.00 0.00 54.58 52.33 2oz3 n ASN 333 Cb 0.37 -0.32 -0.07 0.00 -2.36 0.00 0.00 39.78 37.40 2oz3 n ASN 333 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2oz3 n SER 334 N 0.74 4.03 0.18 0.53 7.64 -0.97 -1.44 113.62 124.33 2oz3 n SER 334 Ca 0.15 -3.40 0.13 0.00 1.01 0.00 0.00 58.87 56.76 2oz3 n SER 334 Cb 0.40 -0.78 0.36 0.00 -1.01 0.00 0.00 64.21 63.19 2oz3 n SER 334 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2oz3 h PRO 335 N 4.59 0.00 -4.69 1.43 0.13 -1.79 -3.45 132.00 128.22 2oz3 h PRO 335 Ca 0.19 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 65.06 2oz3 h PRO 335 Cb 0.67 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 31.66 2oz3 h PRO 335 CO 0.89 0.00 -0.65 -0.59 -0.23 0.00 0.00 178.00 177.42 2oz3 s PHE 336 N -3.25 1.16 0.05 1.56 -0.12 -1.26 -4.59 117.98 111.53 2oz3 s PHE 336 Ca 0.07 -1.14 0.02 0.00 -0.05 0.00 0.00 56.93 55.83 2oz3 s PHE 336 Cb 0.09 -0.66 -0.03 0.00 -0.63 0.00 0.00 43.02 41.79 2oz3 s PHE 336 CO 0.60 -0.36 -0.08 0.00 -0.05 0.00 0.00 175.22 175.33 2oz3 s ALA 337 N -3.83 0.62 0.09 1.99 0.00 -0.05 -4.84 121.76 115.74 2oz3 s ALA 337 Ca 0.28 -0.85 -0.26 0.00 0.00 0.00 0.00 51.96 51.13 2oz3 s ALA 337 Cb 0.07 0.06 -0.06 0.00 0.00 0.00 0.00 23.12 23.19 2oz3 s ALA 337 CO 0.06 -0.05 0.80 -2.00 0.00 0.00 0.00 175.76 174.56 2oz3 s GLU 338 N -1.91 4.55 -0.15 0.00 2.12 -1.26 -1.19 118.70 120.86 2oz3 s GLU 338 Ca -0.07 1.15 0.01 0.00 0.36 0.00 0.00 54.97 56.42 2oz3 s GLU 338 Cb -0.08 -3.34 0.02 0.00 0.26 0.00 0.00 34.13 30.99 2oz3 s GLU 338 CO -0.00 0.35 -0.16 0.12 -0.54 0.00 0.00 175.26 175.03 2oz3 s PHE 339 N -0.33 2.31 0.00 5.30 5.36 -0.24 -4.30 117.98 126.08 2oz3 s PHE 339 Ca 0.39 -1.31 0.00 0.00 -0.96 0.00 0.00 56.93 55.05 2oz3 s PHE 339 Cb -0.22 -1.67 0.00 0.00 -0.34 0.00 0.00 43.02 40.80 2oz3 s PHE 339 CO 0.25 -0.69 0.00 -0.11 -1.46 0.00 0.00 175.22 173.21 2oz3 n LEU 340 N 4.68 0.00 -1.23 6.12 7.94 -1.26 -0.84 117.00 132.41 2oz3 n LEU 340 Ca -0.18 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.72 2oz3 n LEU 340 Cb 0.50 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.45 2oz3 n LEU 340 CO 0.23 -0.01 -0.32 0.00 -1.11 0.00 0.00 177.39 176.18 2oz3 n ALA 343 N -3.00 -2.28 0.25 1.96 0.00 -1.26 -4.87 120.51 111.31 2oz3 n ALA 343 Ca 0.00 0.32 0.07 0.00 0.00 0.00 0.00 53.44 53.84 2oz3 n ALA 343 Cb 0.00 -1.14 0.61 0.00 0.00 0.00 0.00 19.45 18.91 2oz3 n ALA 343 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2oz3 h PRO 344 N 1.91 0.00 -0.02 0.00 0.11 -1.92 0.19 132.00 132.27 2oz3 h PRO 344 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2oz3 h PRO 344 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2oz3 h PRO 344 CO 0.00 0.07 -0.04 1.63 -0.21 0.00 0.00 178.00 179.44 2oz3 n LYS 345 N -4.41 1.93 -3.78 1.05 5.02 -1.26 -1.61 118.16 115.11 2oz3 n LYS 345 Ca -0.03 -1.43 -0.26 0.00 -2.02 0.00 0.00 58.31 54.56 2oz3 n LYS 345 Cb 0.15 -1.47 0.04 0.00 -0.02 0.00 0.00 35.03 33.73 2oz3 n LYS 345 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2oz3 n ALA 346 N 0.72 -1.47 -0.02 7.82 0.00 0.67 -4.84 120.51 123.39 2oz3 n ALA 346 Ca 0.15 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2oz3 n ALA 346 Cb 0.49 -4.12 0.00 0.00 0.00 0.00 0.00 19.45 15.82 2oz3 n ALA 346 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2oz3 n ASP 347 N -2.93 0.23 -3.95 0.00 3.85 -1.26 -4.72 116.55 107.77 2oz3 n ASP 347 Ca -0.05 -0.60 -0.09 0.00 -0.71 0.00 0.00 54.79 53.35 2oz3 n ASP 347 Cb 0.57 0.69 -0.09 0.00 -1.35 0.00 0.00 41.12 40.94 2oz3 n ASP 347 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2oz3 s GLN 348 N -0.69 0.65 -0.18 0.11 -2.07 -1.26 -5.06 119.66 111.15 2oz3 s GLN 348 Ca 0.00 -0.92 -0.24 0.00 -1.82 0.00 0.00 55.36 52.38 2oz3 s GLN 348 Cb 0.00 0.25 -0.02 0.00 -1.09 0.00 0.00 33.01 32.15 2oz3 s GLN 348 CO 0.00 -0.16 0.77 0.08 -1.32 0.00 0.00 175.29 174.65 2oz3 s VAL 349 N -3.23 4.92 0.01 3.63 1.01 -1.26 -4.50 120.40 120.98 2oz3 s VAL 349 Ca 0.00 1.49 0.03 0.00 0.00 0.00 0.00 61.98 63.50 2oz3 s VAL 349 Cb 0.03 -4.08 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 2oz3 s VAL 349 CO -0.07 0.05 -0.08 -0.69 0.00 0.00 0.00 175.10 174.31 2oz3 s VAL 350 N 2.07 0.62 0.00 2.92 1.01 -1.26 -5.09 120.40 120.68 2oz3 s VAL 350 Ca 0.35 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.81 2oz3 s VAL 350 Cb -0.16 -0.56 0.00 0.00 0.00 0.00 0.00 36.38 35.66 2oz3 s VAL 350 CO 0.12 0.04 0.00 -2.65 0.00 0.00 0.00 175.10 172.61 2oz3 n PRO 351 N 2.52 1.38 0.00 2.72 -0.02 -1.26 -4.94 135.00 135.41 2oz3 n PRO 351 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 2oz3 n PRO 351 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.05 2oz3 n PRO 351 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2oz3 n PHE 353 N -0.81 0.00 -2.51 6.00 3.72 -1.26 -4.95 117.46 117.65 2oz3 n PHE 353 Ca 0.00 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.99 2oz3 n PHE 353 Cb 0.00 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.50 2oz3 n PHE 353 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 2oz3 s HIS 354 N 0.00 3.59 -2.41 1.38 2.46 -1.26 -1.17 115.29 117.88 2oz3 s HIS 354 Ca 0.00 1.60 0.22 0.00 0.47 0.00 0.00 55.06 57.36 2oz3 s HIS 354 Cb 0.00 -3.28 0.66 0.00 -0.13 0.00 0.00 32.58 29.84 2oz3 s HIS 354 CO 0.00 -0.61 1.51 -0.35 -2.47 0.00 0.00 174.74 172.82 2oz3 n PRO 355 N 2.29 1.95 0.23 2.88 -0.04 -1.26 -4.97 135.00 136.08 2oz3 n PRO 355 Ca 0.02 -1.42 0.15 0.00 -0.04 0.00 0.00 63.50 62.21 2oz3 n PRO 355 Cb 0.46 -1.44 0.52 0.00 -0.04 0.00 0.00 33.50 33.00 2oz3 n PRO 355 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 2oz3 h GLN 356 N 2.95 0.00 -5.03 0.54 3.07 -1.55 -3.41 115.11 111.67 2oz3 h GLN 356 Ca 0.00 0.00 -0.67 0.00 0.09 0.00 0.00 58.65 58.07 2oz3 h GLN 356 Cb 0.64 0.00 -0.33 0.00 0.08 0.00 0.00 27.48 27.88 2oz3 h GLN 356 CO 0.00 0.00 -0.81 -0.51 0.09 0.00 0.00 178.83 177.60 2oz3 s LEU 357 N -5.77 2.43 0.15 0.06 1.02 -0.91 -2.16 118.68 113.50 2oz3 s LEU 357 Ca 0.04 -0.60 -0.19 0.00 0.02 0.00 0.00 54.13 53.40 2oz3 s LEU 357 Cb 0.08 -1.57 -0.07 0.00 0.02 0.00 0.00 46.19 44.65 2oz3 s LEU 357 CO 0.55 -0.02 0.64 -0.76 0.02 0.00 0.00 176.35 176.79 2oz3 s LEU 358 N 1.34 4.43 0.00 1.79 1.43 0.54 -4.23 118.68 123.99 2oz3 s LEU 358 Ca 0.05 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.47 2oz3 s LEU 358 Cb -0.14 -3.26 0.00 0.00 0.03 0.00 0.00 46.19 42.83 2oz3 s LEU 358 CO -0.10 0.15 0.00 0.61 0.23 0.00 0.00 176.35 177.24 2oz3 n GLY 359 N 1.16 0.74 3.65 -3.19 0.00 -1.26 -0.82 105.19 105.47 2oz3 n GLY 359 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 2oz3 n GLY 359 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2oz3 s GLU 360 N -0.56 4.06 0.58 1.61 2.12 -1.26 -4.73 118.70 120.51 2oz3 s GLU 360 Ca 0.00 1.71 -0.13 0.00 0.36 0.00 0.00 54.97 56.90 2oz3 s GLU 360 Cb 0.00 -3.90 -0.05 0.00 0.26 0.00 0.00 34.13 30.44 2oz3 s GLU 360 CO 0.00 -0.96 1.02 -1.25 -0.54 0.00 0.00 175.26 173.53 2oz3 s PRO 361 N 4.03 3.66 0.16 4.30 0.04 -1.26 -4.90 135.00 141.03 2oz3 s PRO 361 Ca 0.63 0.88 0.06 0.00 0.04 0.00 0.00 61.00 62.61 2oz3 s PRO 361 Cb -0.24 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 2oz3 s PRO 361 CO 0.23 -0.51 -0.13 0.14 0.04 0.00 0.00 177.00 176.76 2oz3 s VAL 362 N -2.90 1.46 0.16 -0.36 -7.23 -1.26 -4.94 120.40 105.33 2oz3 s VAL 362 Ca 0.57 -2.00 -0.34 0.00 -1.81 0.00 0.00 61.98 58.41 2oz3 s VAL 362 Cb -0.11 -1.82 -0.14 0.00 0.56 0.00 0.00 36.38 34.87 2oz3 s VAL 362 CO 0.44 -0.57 1.48 -2.65 -0.31 0.00 0.00 175.10 173.50 2oz3 n PRO 363 N -0.01 1.89 -3.90 4.82 -0.02 -1.26 -4.98 135.00 131.54 2oz3 n PRO 363 Ca -0.11 0.68 -0.35 0.00 -2.02 0.00 0.00 63.50 61.70 2oz3 n PRO 363 Cb 0.59 -2.39 -0.14 0.00 -0.02 0.00 0.00 33.50 31.54 2oz3 n PRO 363 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 2oz3 s GLU 364 N 0.53 3.25 -1.27 -0.52 -1.05 0.48 -4.64 118.70 115.49 2oz3 s GLU 364 Ca 0.78 -0.71 -0.03 0.00 -0.15 0.00 0.00 54.97 54.86 2oz3 s GLU 364 Cb -0.74 -3.04 0.01 0.00 -0.44 0.00 0.00 34.13 29.92 2oz3 s GLU 364 CO 0.42 -0.26 0.98 -1.71 0.95 0.00 0.00 175.26 175.65 2oz3 n ASN 365 N 4.78 -2.92 -0.77 0.83 5.15 -1.26 -2.70 115.26 118.37 2oz3 n ASN 365 Ca -0.18 -0.65 -0.10 0.00 -0.60 0.00 0.00 54.58 53.06 2oz3 n ASN 365 Cb 0.50 -4.84 -0.04 0.00 -0.53 0.00 0.00 39.78 34.86 2oz3 n ASN 365 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2oz3 n GLY 366 N -1.42 1.06 0.00 8.20 0.00 -1.24 -4.57 105.19 107.21 2oz3 n GLY 366 Ca -0.21 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2oz3 n GLY 366 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oz3 n ARG 367 N -1.63 0.00 -4.49 1.61 1.74 -1.10 -1.87 116.66 110.93 2oz3 n ARG 367 Ca -0.10 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.77 2oz3 n ARG 367 Cb 0.46 0.00 -0.14 0.00 -1.02 0.00 0.00 32.46 31.76 2oz3 n ARG 367 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2oz3 s ARG 369 N 0.28 1.06 0.53 5.56 1.81 -1.26 -0.38 118.95 126.55 2oz3 s ARG 369 Ca 0.00 -0.70 0.31 0.00 -1.72 0.00 0.00 55.73 53.62 2oz3 s ARG 369 Cb 0.00 -1.07 1.41 0.00 -0.45 0.00 0.00 34.95 34.84 2oz3 s ARG 369 CO 0.00 0.28 2.01 -0.07 -0.68 0.00 0.00 175.30 176.84 2oz3 h LEU 370 N 5.20 0.00 -2.23 2.53 -0.00 -1.64 -2.68 115.31 116.48 2oz3 h LEU 370 Ca -0.37 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.50 2oz3 h LEU 370 Cb 1.17 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.83 2oz3 h LEU 370 CO 0.45 0.08 -0.02 0.77 -0.00 0.00 0.00 178.44 179.73 2oz3 h SER 371 N 0.00 0.00 1.24 -0.43 4.64 -1.98 -1.93 113.55 115.09 2oz3 h SER 371 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2oz3 h SER 371 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2oz3 h SER 371 CO 0.01 0.02 0.00 0.54 -0.87 0.00 0.00 176.83 176.53 2oz3 n ARG 372 N -3.19 0.16 -2.89 4.77 1.74 -1.01 -4.03 116.66 112.22 2oz3 n ARG 372 Ca -0.01 0.15 -0.39 0.00 -0.77 0.00 0.00 57.85 56.83 2oz3 n ARG 372 Cb 0.19 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 29.93 2oz3 n ARG 372 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2oz3 n LEU 373 N -1.97 6.38 -0.00 0.55 4.77 -0.72 -4.68 117.00 121.32 2oz3 n LEU 373 Ca 0.06 -5.36 0.03 0.00 -0.03 0.00 0.00 56.01 50.71 2oz3 n LEU 373 Cb 0.38 -1.10 -0.04 0.00 -2.33 0.00 0.00 43.42 40.33 2oz3 n LEU 373 CO 0.28 1.94 -0.05 -0.90 -1.33 0.00 0.00 177.39 177.34 2oz3 n ASP 374 N 0.54 0.50 -4.80 -1.43 5.75 -1.26 -4.78 116.55 111.07 2oz3 n ASP 374 Ca 0.36 -0.62 -0.35 0.00 -0.01 0.00 0.00 54.79 54.16 2oz3 n ASP 374 Cb 0.31 1.02 -0.07 0.00 -1.03 0.00 0.00 41.12 41.36 2oz3 n ASP 374 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2oz3 s GLN 375 N -1.69 4.38 0.62 0.11 -1.52 -1.26 -4.54 119.66 115.76 2oz3 s GLN 375 Ca 0.02 1.18 -0.18 0.00 -1.95 0.00 0.00 55.36 54.43 2oz3 s GLN 375 Cb 0.05 -2.50 -0.03 0.00 -0.22 0.00 0.00 33.01 30.31 2oz3 s GLN 375 CO 0.28 0.14 1.10 -2.30 -0.25 0.00 0.00 175.29 174.26 2oz3 n PRO 376 N -0.03 0.99 0.00 2.91 -0.02 -1.26 -3.68 135.00 133.91 2oz3 n PRO 376 Ca 0.04 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2oz3 n PRO 376 Cb 0.52 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 2oz3 n PRO 376 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oz3 n GLY 377 N 1.14 3.25 0.31 -1.23 0.00 -0.24 -2.25 105.19 106.17 2oz3 n GLY 377 Ca 0.15 -0.17 0.13 0.00 0.00 0.00 0.00 46.02 46.12 2oz3 n GLY 377 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2oz3 n PHE 378 N 13.79 0.00 -0.84 1.61 3.72 -1.26 -0.68 117.46 133.79 2oz3 n PHE 378 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2oz3 n PHE 378 Cb 0.00 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.45 2oz3 n PHE 378 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2oz3 n GLY 379 N 1.35 0.56 3.65 1.37 0.00 -0.95 -4.89 105.19 106.28 2oz3 n GLY 379 Ca 0.12 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 2oz3 n GLY 379 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2oz3 s VAL 380 N -2.00 3.31 0.14 1.61 -7.23 -1.26 -4.75 120.40 110.22 2oz3 s VAL 380 Ca 0.00 -1.90 0.10 0.00 -1.81 0.00 0.00 61.98 58.37 2oz3 s VAL 380 Cb 0.00 -2.85 -0.04 0.00 0.56 0.00 0.00 36.38 34.05 2oz3 s VAL 380 CO 0.00 -0.34 -0.23 0.42 -0.31 0.00 0.00 175.10 174.64 2oz3 s THR 381 N -2.36 2.04 -0.20 5.32 -4.23 0.00 -4.98 115.64 111.24 2oz3 s THR 381 Ca 0.32 -1.79 -0.29 0.00 -1.18 0.00 0.00 61.69 58.76 2oz3 s THR 381 Cb -0.05 -1.87 -0.01 0.00 1.34 0.00 0.00 72.50 71.90 2oz3 s THR 381 CO 0.20 -0.08 1.33 -0.22 -0.54 0.00 0.00 174.62 175.32 2oz3 s LEU 382 N -2.27 4.09 -0.34 4.79 2.96 -1.26 -0.34 118.68 126.31 2oz3 s LEU 382 Ca 0.14 1.60 -0.43 0.00 -0.22 0.00 0.00 54.13 55.21 2oz3 s LEU 382 Cb -0.09 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 42.89 2oz3 s LEU 382 CO 0.06 -0.90 1.62 -3.20 -1.32 0.00 0.00 176.35 172.61 2oz3 n ASN 383 N 7.08 1.68 0.24 3.68 2.85 -0.92 -4.88 115.26 124.99 2oz3 n ASN 383 Ca 0.15 1.13 0.10 0.00 -0.11 0.00 0.00 54.58 55.86 2oz3 n ASN 383 Cb 0.45 -1.01 0.60 0.00 1.24 0.00 0.00 39.78 41.06 2oz3 n ASN 383 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2oz3 h PRO 384 N 5.83 0.00 0.00 1.20 0.13 -1.93 -2.85 132.00 134.38 2oz3 h PRO 384 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2oz3 h PRO 384 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2oz3 h PRO 384 CO 0.94 0.19 0.00 -1.91 -0.23 0.00 0.00 178.00 176.99 2oz3 n GLU 385 N -3.63 0.21 -2.02 0.86 4.07 -1.26 -4.79 120.64 114.07 2oz3 n GLU 385 Ca -0.01 0.34 -0.41 0.00 -0.06 0.00 0.00 57.16 57.02 2oz3 n GLU 385 Cb 0.31 -1.84 -0.02 0.00 -0.06 0.00 0.00 31.44 29.84 2oz3 n GLU 385 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2oz3 s GLN 387 N -1.35 3.60 -0.37 0.00 -0.21 -1.26 -5.04 119.66 115.03 2oz3 s GLN 387 Ca 0.53 -0.46 -0.07 0.00 0.02 0.00 0.00 55.36 55.37 2oz3 s GLN 387 Cb -0.42 -3.78 0.05 0.00 1.00 0.00 0.00 33.01 29.86 2oz3 s GLN 387 CO 0.51 -0.45 0.16 -0.51 -2.12 0.00 0.00 175.29 172.88 2oz3 s LEU 388 N 1.89 4.64 0.06 2.90 1.02 -1.26 -2.75 118.68 125.18 2oz3 s LEU 388 Ca 0.09 -1.28 -0.28 0.00 0.02 0.00 0.00 54.13 52.69 2oz3 s LEU 388 Cb -0.17 -1.91 -0.05 0.00 0.02 0.00 0.00 46.19 44.08 2oz3 s LEU 388 CO 0.11 -0.40 0.88 -2.28 0.02 0.00 0.00 176.35 174.68 2oz3 s HIS 389 N 1.41 3.75 -0.70 0.29 5.65 -0.76 -4.91 115.29 120.01 2oz3 s HIS 389 Ca 0.01 1.64 -0.02 0.00 0.25 0.00 0.00 55.06 56.94 2oz3 s HIS 389 Cb -0.21 -2.96 0.18 0.00 -1.18 0.00 0.00 32.58 28.41 2oz3 s HIS 389 CO 0.03 0.19 0.53 0.50 -0.65 0.00 0.00 174.74 175.34 2oz3 s ARG 390 N 0.16 2.72 0.50 2.88 3.52 -1.26 -1.21 118.95 126.26 2oz3 s ARG 390 Ca 0.44 -2.80 0.28 0.00 -0.13 0.00 0.00 55.73 53.52 2oz3 s ARG 390 Cb -0.22 -3.75 1.23 0.00 -1.56 0.00 0.00 34.95 30.66 2oz3 s ARG 390 CO 0.26 -1.20 1.95 -1.00 -0.81 0.00 0.00 175.30 174.50 2oz3 h PRO 391 N 6.60 0.00 -4.75 5.12 0.13 -1.96 -3.44 132.00 133.69 2oz3 h PRO 391 Ca 0.04 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.82 2oz3 h PRO 391 Cb 0.90 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 31.78 2oz3 h PRO 391 CO 0.75 0.13 -0.76 0.71 -0.23 0.00 0.00 178.00 178.60 2oz3 s TYR 392 N -3.81 0.81 0.31 1.56 2.02 -1.26 -5.11 117.35 111.87 2oz3 s TYR 392 Ca -0.00 -0.30 0.03 0.00 -0.37 0.00 0.00 57.07 56.42 2oz3 s TYR 392 Cb 0.11 -0.49 -0.06 0.00 -0.40 0.00 0.00 41.96 41.12 2oz3 s TYR 392 CO 0.59 -0.02 0.08 0.95 -1.57 0.00 0.00 175.55 175.58 2oz3 s THR 393 N -0.73 0.93 0.07 -0.71 -4.23 -1.26 -4.83 115.64 104.88 2oz3 s THR 393 Ca -0.02 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.35 2oz3 s THR 393 Cb -0.06 -2.72 0.02 0.00 1.34 0.00 0.00 72.50 71.08 2oz3 s THR 393 CO 0.00 0.00 0.33 -1.38 -0.54 0.00 0.00 174.62 173.03 2oz3 s HIS 394 N -3.45 -0.12 0.00 3.99 -3.43 -1.26 -4.85 115.29 106.17 2oz3 s HIS 394 Ca 0.36 -0.09 0.00 0.00 -0.80 0.00 0.00 55.06 54.53 2oz3 s HIS 394 Cb 0.08 0.13 0.00 0.00 -1.43 0.00 0.00 32.58 31.36 2oz3 s HIS 394 CO 0.15 -0.57 0.00 0.39 -2.00 0.00 0.00 174.74 172.71