#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ii6 s GLU 2 N 0.00 3.75 0.37 2.12 2.02 -0.74 -4.83 118.70 121.39 3ii6 s GLU 2 Ca 0.00 1.09 0.05 0.00 0.02 0.00 0.00 54.97 56.13 3ii6 s GLU 2 Cb 0.00 -2.10 -0.03 0.00 0.10 0.00 0.00 34.13 32.10 3ii6 s GLU 2 CO 0.00 -0.44 0.19 -0.98 0.02 0.00 0.00 175.26 174.05 3ii6 s ARG 3 N -3.91 1.84 -0.30 1.61 1.70 -1.26 -0.87 118.95 117.76 3ii6 s ARG 3 Ca 0.62 -2.10 -0.10 0.00 -0.47 0.00 0.00 55.73 53.68 3ii6 s ARG 3 Cb -0.12 -0.19 0.18 0.00 -0.57 0.00 0.00 34.95 34.25 3ii6 s ARG 3 CO 0.30 -0.55 0.96 0.21 -1.08 0.00 0.00 175.30 175.15 3ii6 s LYS 4 N -3.62 0.24 -0.12 3.89 2.47 0.18 -4.89 119.74 117.90 3ii6 s LYS 4 Ca 0.31 0.36 -0.10 0.00 -1.56 0.00 0.00 55.97 54.97 3ii6 s LYS 4 Cb 0.02 0.19 -0.05 0.00 -1.46 0.00 0.00 37.83 36.54 3ii6 s LYS 4 CO 0.20 -0.34 0.22 0.42 0.16 0.00 0.00 175.35 176.01 3ii6 s ILE 5 N 2.93 5.36 -0.02 5.43 1.01 -1.26 -0.91 121.20 133.73 3ii6 s ILE 5 Ca 0.11 0.40 -0.00 0.00 0.00 0.00 0.00 60.65 61.15 3ii6 s ILE 5 Cb -0.08 -3.52 0.03 0.00 0.01 0.00 0.00 42.46 38.90 3ii6 s ILE 5 CO -0.17 0.53 0.03 -0.44 0.00 0.00 0.00 174.94 174.90 3ii6 s SER 6 N -0.48 0.27 -0.05 3.58 0.01 -0.74 -4.99 113.70 111.30 3ii6 s SER 6 Ca 0.16 0.04 -0.20 0.00 1.31 0.00 0.00 55.95 57.26 3ii6 s SER 6 Cb -0.13 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 65.96 3ii6 s SER 6 CO 0.05 -0.15 0.56 0.00 0.41 0.00 0.00 173.24 174.11 3ii6 s ARG 7 N 1.26 4.32 0.14 12.44 1.70 -1.26 -1.10 118.95 136.45 3ii6 s ARG 7 Ca -0.07 0.65 0.00 0.00 -0.47 0.00 0.00 55.73 55.84 3ii6 s ARG 7 Cb -0.13 -3.39 0.00 0.00 -0.57 0.00 0.00 34.95 30.87 3ii6 s ARG 7 CO -0.03 0.26 0.00 0.44 -1.08 0.00 0.00 175.30 174.90 3ii6 n ILE 8 N 3.19 0.00 -3.93 4.99 -5.35 -0.21 -4.96 119.36 113.09 3ii6 n ILE 8 Ca -0.06 -0.65 -0.14 0.00 -0.27 0.00 0.00 62.75 61.63 3ii6 n ILE 8 Cb 0.51 0.11 -0.15 0.00 -1.74 0.00 0.00 39.64 38.38 3ii6 n ILE 8 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 3ii6 s HIS 9 N -1.47 0.15 0.26 4.28 3.76 -1.26 -2.67 115.29 118.33 3ii6 s HIS 9 Ca 0.00 -0.00 -0.24 0.00 -0.15 0.00 0.00 55.06 54.68 3ii6 s HIS 9 Cb -0.00 -0.16 -0.09 0.00 1.11 0.00 0.00 32.58 33.44 3ii6 s HIS 9 CO 0.00 -0.03 0.83 -0.51 -0.85 0.00 0.00 174.74 174.18 3ii6 s LEU 10 N 0.27 4.39 0.27 0.89 1.43 -1.26 -4.30 118.68 120.38 3ii6 s LEU 10 Ca -0.02 1.65 -0.01 0.00 -1.03 0.00 0.00 54.13 54.72 3ii6 s LEU 10 Cb -0.04 -3.72 0.57 0.00 0.03 0.00 0.00 46.19 43.03 3ii6 s LEU 10 CO -0.01 0.02 1.73 0.58 0.23 0.00 0.00 176.35 178.90 3ii6 h VAL 11 N 2.79 0.61 -0.04 -1.59 2.07 -1.09 -2.16 116.25 116.85 3ii6 h VAL 11 Ca -0.47 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 66.90 3ii6 h VAL 11 Cb 1.19 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 3ii6 h VAL 11 CO 0.65 0.09 0.17 0.28 0.02 0.00 0.00 177.57 178.78 3ii6 h SER 12 N 0.48 0.00 -1.90 0.57 0.02 -1.88 -3.34 113.55 107.50 3ii6 h SER 12 Ca 0.48 0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.93 3ii6 h SER 12 Cb 0.78 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 62.94 3ii6 h SER 12 CO -0.44 0.00 -1.13 -0.62 -1.14 0.00 0.00 176.83 173.50 3ii6 n GLU 13 N -3.18 0.88 -0.26 3.45 1.02 -0.81 -5.04 120.64 116.70 3ii6 n GLU 13 Ca -0.02 -3.25 0.03 0.00 -0.02 0.00 0.00 57.16 53.91 3ii6 n GLU 13 Cb 0.24 -1.51 0.09 0.00 -0.02 0.00 0.00 31.44 30.24 3ii6 n GLU 13 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 3ii6 n PRO 14 N 0.69 -0.08 -0.06 3.49 -0.01 -1.23 -3.03 135.00 134.78 3ii6 n PRO 14 Ca 0.23 1.11 -0.22 0.00 -0.01 0.00 0.00 63.50 64.61 3ii6 n PRO 14 Cb 0.62 -1.66 -0.13 0.00 -0.01 0.00 0.00 33.50 32.32 3ii6 n PRO 14 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 175.50 175.94 3ii6 n SER 15 N -5.15 2.02 -4.60 2.55 2.88 -1.26 -4.89 113.62 105.17 3ii6 n SER 15 Ca 0.11 0.22 -0.43 0.00 -1.33 0.00 0.00 58.87 57.43 3ii6 n SER 15 Cb 0.35 -0.81 -0.03 0.00 -0.75 0.00 0.00 64.21 62.96 3ii6 n SER 15 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 3ii6 n ILE 16 N -3.76 0.37 -1.97 2.46 2.08 -1.17 -5.03 119.36 112.35 3ii6 n ILE 16 Ca -0.37 -0.44 -0.38 0.00 0.56 0.00 0.00 62.75 62.13 3ii6 n ILE 16 Cb 0.93 -2.53 0.02 0.00 -0.75 0.00 0.00 39.64 37.31 3ii6 n ILE 16 CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 3ii6 s THR 17 N 8.03 2.47 0.08 1.39 2.01 -1.26 -4.51 115.64 123.86 3ii6 s THR 17 Ca 1.00 0.36 -0.10 0.00 0.31 0.00 0.00 61.69 63.26 3ii6 s THR 17 Cb -0.35 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 68.97 3ii6 s THR 17 CO 0.36 0.00 0.21 -1.00 -0.69 0.00 0.00 174.62 173.50 3ii6 s HIS 18 N -1.38 0.09 -0.03 4.92 3.76 -1.09 -4.84 115.29 116.72 3ii6 s HIS 18 Ca 0.68 -0.47 0.03 0.00 -0.15 0.00 0.00 55.06 55.15 3ii6 s HIS 18 Cb -0.36 -0.02 0.00 0.00 1.11 0.00 0.00 32.58 33.31 3ii6 s HIS 18 CO 0.43 -0.54 -0.11 -0.06 -0.85 0.00 0.00 174.74 173.62 3ii6 s PHE 19 N -3.59 1.13 -0.18 1.40 0.08 -0.97 -1.04 117.98 114.82 3ii6 s PHE 19 Ca 0.03 -0.31 -0.04 0.00 0.12 0.00 0.00 56.93 56.73 3ii6 s PHE 19 Cb 0.03 -0.80 -0.02 0.00 -0.57 0.00 0.00 43.02 41.66 3ii6 s PHE 19 CO -0.10 -0.13 -0.03 -1.17 -0.10 0.00 0.00 175.22 173.69 3ii6 s LEU 20 N 0.23 3.16 -0.23 -0.37 2.96 -0.26 -2.65 118.68 121.52 3ii6 s LEU 20 Ca -0.04 -0.20 0.00 0.00 -0.22 0.00 0.00 54.13 53.66 3ii6 s LEU 20 Cb -0.10 -1.78 0.03 0.00 0.50 0.00 0.00 46.19 44.84 3ii6 s LEU 20 CO 0.01 0.11 -0.11 -1.58 -1.32 0.00 0.00 176.35 173.46 3ii6 s GLN 21 N 0.71 2.79 0.48 1.98 0.74 0.06 -1.79 119.66 124.64 3ii6 s GLN 21 Ca -0.02 -0.99 0.07 0.00 0.05 0.00 0.00 55.36 54.48 3ii6 s GLN 21 Cb -0.14 -2.84 0.01 0.00 1.10 0.00 0.00 33.01 31.14 3ii6 s GLN 21 CO 0.02 -0.36 0.44 0.14 -0.55 0.00 0.00 175.29 174.98 3ii6 s VAL 22 N 1.28 2.22 -0.29 1.34 -7.23 -0.09 -1.65 120.40 115.98 3ii6 s VAL 22 Ca 0.00 -1.36 -0.22 0.00 -1.81 0.00 0.00 61.98 58.59 3ii6 s VAL 22 Cb -0.16 -2.57 0.17 0.00 0.56 0.00 0.00 36.38 34.37 3ii6 s VAL 22 CO -0.07 0.00 1.23 -0.44 -0.31 0.00 0.00 175.10 175.51 3ii6 s SER 23 N -4.25 -0.23 0.00 4.85 0.01 -1.20 -0.64 113.70 112.23 3ii6 s SER 23 Ca 0.45 0.42 0.00 0.00 1.31 0.00 0.00 55.95 58.13 3ii6 s SER 23 Cb -0.03 0.65 0.00 0.00 0.21 0.00 0.00 66.02 66.84 3ii6 s SER 23 CO 0.27 -0.07 0.00 -2.67 0.41 0.00 0.00 173.24 171.18 3ii6 n TRP 24 N 2.34 -0.07 -3.65 2.43 2.14 -0.05 -2.26 117.44 118.33 3ii6 n TRP 24 Ca -0.13 0.00 -0.03 0.00 2.07 0.00 0.00 57.50 59.41 3ii6 n TRP 24 Cb 0.57 0.00 -0.05 0.00 -0.81 0.00 0.00 31.31 31.02 3ii6 n TRP 24 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 3ii6 s GLU 25 N -0.53 0.60 -1.13 -2.67 2.02 -1.26 -1.79 118.70 113.94 3ii6 s GLU 25 Ca 0.00 1.40 -0.18 0.00 0.02 0.00 0.00 54.97 56.21 3ii6 s GLU 25 Cb 0.00 0.70 -0.05 0.00 0.10 0.00 0.00 34.13 34.87 3ii6 s GLU 25 CO 0.00 -0.19 2.07 1.63 0.02 0.00 0.00 175.26 178.79 3ii6 n LYS 26 N 5.18 2.21 -4.55 1.61 4.01 -1.26 -4.82 118.16 120.55 3ii6 n LYS 26 Ca -0.14 -2.26 -0.27 0.00 -0.51 0.00 0.00 58.31 55.13 3ii6 n LYS 26 Cb 0.51 -3.13 -0.08 0.00 -0.51 0.00 0.00 35.03 31.82 3ii6 n LYS 26 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 3ii6 s THR 27 N 4.22 0.58 -0.05 -0.18 -4.23 -1.26 -5.04 115.64 109.69 3ii6 s THR 27 Ca 0.52 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 59.16 3ii6 s THR 27 Cb 0.14 -2.28 -0.22 0.00 1.34 0.00 0.00 72.50 71.47 3ii6 s THR 27 CO 0.02 0.00 0.68 -0.11 -0.54 0.00 0.00 174.62 174.67 3ii6 n LEU 28 N -0.98 0.88 0.23 4.79 0.00 -1.26 -4.32 117.00 116.34 3ii6 n LEU 28 Ca -0.07 0.42 0.16 0.00 0.00 0.00 0.00 56.01 56.51 3ii6 n LEU 28 Cb 0.65 0.16 0.69 0.00 0.00 0.00 0.00 43.42 44.92 3ii6 n LEU 28 CO 0.35 0.37 0.96 -0.08 0.00 0.00 0.00 177.39 178.99 3ii6 h GLU 29 N 0.00 0.00 -0.00 1.96 4.81 -1.96 -1.88 114.58 117.51 3ii6 h GLU 29 Ca -0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 3ii6 h GLU 29 Cb 1.98 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.36 3ii6 h GLU 29 CO 0.08 0.00 -0.04 -1.13 -0.73 0.00 0.00 179.01 177.18 3ii6 n SER 30 N -2.72 0.09 0.00 1.04 3.41 -1.26 -4.27 113.62 109.90 3ii6 n SER 30 Ca 0.00 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 3ii6 n SER 30 Cb 0.22 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 3ii6 n SER 30 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ii6 n GLY 31 N 1.38 2.51 3.60 5.00 0.00 -0.71 -3.34 105.19 113.63 3ii6 n GLY 31 Ca 0.11 -2.11 -0.06 0.00 0.00 0.00 0.00 46.02 43.96 3ii6 n GLY 31 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ii6 s PHE 32 N -2.12 -0.23 0.35 1.61 -0.12 -0.98 -4.71 117.98 111.78 3ii6 s PHE 32 Ca 0.00 0.05 0.09 0.00 -0.05 0.00 0.00 56.93 57.02 3ii6 s PHE 32 Cb 0.00 0.57 -0.06 0.00 -0.63 0.00 0.00 43.02 42.90 3ii6 s PHE 32 CO 0.00 -0.59 -0.01 0.08 -0.05 0.00 0.00 175.22 174.66 3ii6 s VAL 33 N -3.06 2.48 -0.46 -2.49 1.01 -0.96 -1.35 120.40 115.57 3ii6 s VAL 33 Ca 0.08 -2.02 0.03 0.00 0.00 0.00 0.00 61.98 60.08 3ii6 s VAL 33 Cb -0.01 -2.78 0.20 0.00 0.00 0.00 0.00 36.38 33.79 3ii6 s VAL 33 CO -0.05 -0.18 0.83 -0.51 0.00 0.00 0.00 175.10 175.20 3ii6 s ILE 34 N -2.56 -0.76 0.09 2.22 2.07 -0.88 -3.22 121.20 118.15 3ii6 s ILE 34 Ca 0.35 -0.67 -0.22 0.00 -1.41 0.00 0.00 60.65 58.69 3ii6 s ILE 34 Cb 0.01 0.00 -0.07 0.00 0.13 0.00 0.00 42.46 42.54 3ii6 s ILE 34 CO 0.19 0.00 0.67 -0.89 -1.91 0.00 0.00 174.94 173.00 3ii6 s THR 35 N 1.02 4.64 0.43 4.00 2.01 -0.66 -4.08 115.64 123.01 3ii6 s THR 35 Ca 0.27 1.44 0.08 0.00 0.31 0.00 0.00 61.69 63.78 3ii6 s THR 35 Cb 0.03 -4.01 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 3ii6 s THR 35 CO -0.07 0.49 0.41 -0.22 -0.69 0.00 0.00 174.62 174.55 3ii6 s LEU 36 N -0.82 3.38 -0.07 4.42 2.96 0.36 -0.76 118.68 128.15 3ii6 s LEU 36 Ca 0.33 -0.74 -0.31 0.00 -0.22 0.00 0.00 54.13 53.19 3ii6 s LEU 36 Cb -0.21 -2.06 0.11 0.00 0.50 0.00 0.00 46.19 44.53 3ii6 s LEU 36 CO 0.22 -0.71 0.99 0.28 -1.32 0.00 0.00 176.35 175.81 3ii6 s THR 37 N -2.48 0.00 -0.03 3.68 -1.32 -1.08 -2.11 115.64 112.29 3ii6 s THR 37 Ca 0.49 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 61.01 3ii6 s THR 37 Cb -0.04 -1.00 0.06 0.00 -1.51 0.00 0.00 72.50 70.01 3ii6 s THR 37 CO 0.28 0.00 0.92 -0.90 -2.21 0.00 0.00 174.62 172.71 3ii6 n ASP 38 N -0.16 1.42 0.00 8.08 5.75 -1.22 -2.29 116.55 128.13 3ii6 n ASP 38 Ca -0.06 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.71 3ii6 n ASP 38 Cb 0.61 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 3ii6 n ASP 38 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ii6 n GLY 39 N -0.53 1.58 0.00 6.12 0.00 -1.26 -4.82 105.19 106.27 3ii6 n GLY 39 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3ii6 n GLY 39 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3ii6 n HIS 40 N -0.08 0.00 -3.82 1.61 -0.00 -1.26 -4.98 115.22 106.69 3ii6 n HIS 40 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.63 3ii6 n HIS 40 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 29.98 3ii6 n HIS 40 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 3ii6 n SER 41 N -0.10 -1.18 -3.40 0.26 7.64 -1.26 -5.00 113.62 110.59 3ii6 n SER 41 Ca 0.00 -2.30 0.02 0.00 1.01 0.00 0.00 58.87 57.59 3ii6 n SER 41 Cb 0.00 2.10 -0.04 0.00 -1.01 0.00 0.00 64.21 65.26 3ii6 n SER 41 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ii6 s ALA 42 N -2.25 -2.70 0.05 -0.43 0.00 -1.26 -3.44 121.76 111.73 3ii6 s ALA 42 Ca 0.18 2.03 0.09 0.00 0.00 0.00 0.00 51.96 54.26 3ii6 s ALA 42 Cb -0.02 -2.06 -0.03 0.00 0.00 0.00 0.00 23.12 21.01 3ii6 s ALA 42 CO 0.13 -0.99 -0.24 -1.58 0.00 0.00 0.00 175.76 173.08 3ii6 s TRP 43 N 2.52 2.39 0.00 0.00 0.51 -0.90 -1.11 118.94 122.35 3ii6 s TRP 43 Ca -0.02 -0.36 0.00 0.00 -2.12 0.00 0.00 56.10 53.60 3ii6 s TRP 43 Cb -0.07 -1.40 0.00 0.00 -0.81 0.00 0.00 33.47 31.19 3ii6 s TRP 43 CO -0.17 0.18 0.00 2.41 -0.51 0.00 0.00 176.95 178.86 3ii6 n THR 44 N 1.63 0.00 0.00 2.01 -1.04 -1.00 -0.49 114.28 115.39 3ii6 n THR 44 Ca -0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 3ii6 n THR 44 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 3ii6 n THR 44 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ii6 n GLY 45 N 2.60 3.70 2.96 3.41 0.00 -1.26 -1.84 105.19 114.76 3ii6 n GLY 45 Ca 0.00 -1.44 -0.10 0.00 0.00 0.00 0.00 46.02 44.48 3ii6 n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ii6 s THR 46 N -2.00 0.08 0.22 2.61 2.01 -1.26 -2.08 115.64 115.22 3ii6 s THR 46 Ca 0.00 -0.64 0.09 0.00 0.31 0.00 0.00 61.69 61.45 3ii6 s THR 46 Cb 0.00 -0.20 -0.05 0.00 0.01 0.00 0.00 72.50 72.26 3ii6 s THR 46 CO 0.00 -0.35 -0.15 -0.69 -0.69 0.00 0.00 174.62 172.74 3ii6 s VAL 47 N -1.03 1.88 0.07 3.82 1.01 -0.46 -4.95 120.40 120.74 3ii6 s VAL 47 Ca -0.11 -2.25 0.03 0.00 0.00 0.00 0.00 61.98 59.64 3ii6 s VAL 47 Cb -0.07 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 3ii6 s VAL 47 CO -0.01 -0.55 -0.08 -0.94 0.00 0.00 0.00 175.10 173.52 3ii6 s SER 48 N -3.36 1.12 0.24 3.32 1.04 -1.26 -2.33 113.70 112.47 3ii6 s SER 48 Ca 0.24 -0.74 0.07 0.00 0.48 0.00 0.00 55.95 56.00 3ii6 s SER 48 Cb -0.01 0.04 0.72 0.00 0.10 0.00 0.00 66.02 66.86 3ii6 s SER 48 CO 0.09 -0.28 1.11 1.21 0.98 0.00 0.00 173.24 176.34 3ii6 n GLU 49 N 0.83 -0.05 -0.07 4.02 4.07 -1.21 -2.22 120.64 126.01 3ii6 n GLU 49 Ca -0.18 1.02 -0.20 0.00 -0.06 0.00 0.00 57.16 57.74 3ii6 n GLU 49 Cb 0.57 -1.71 -0.13 0.00 -0.06 0.00 0.00 31.44 30.11 3ii6 n GLU 49 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 3ii6 n SER 50 N -4.80 2.04 -0.31 4.31 3.41 -1.26 -3.18 113.62 113.83 3ii6 n SER 50 Ca 0.21 0.05 0.03 0.00 -0.26 0.00 0.00 58.87 58.89 3ii6 n SER 50 Cb 0.70 -0.64 0.10 0.00 -0.26 0.00 0.00 64.21 64.11 3ii6 n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3ii6 h GLU 51 N -0.02 -0.01 -0.58 4.33 5.08 -1.93 0.49 114.58 121.94 3ii6 h GLU 51 Ca -0.51 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 57.96 3ii6 h GLU 51 Cb 1.94 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 31.11 3ii6 h GLU 51 CO -0.02 -0.01 0.14 0.82 -1.00 0.00 0.00 179.01 178.94 3ii6 h ILE 52 N -0.01 0.68 0.00 3.13 2.04 -1.52 -1.99 117.51 119.83 3ii6 h ILE 52 Ca 0.40 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 66.14 3ii6 h ILE 52 Cb 0.63 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 3ii6 h ILE 52 CO -0.90 0.05 -0.12 0.28 0.00 0.00 0.00 178.15 177.46 3ii6 h SER 53 N 0.28 0.00 0.00 1.72 0.02 -0.91 -1.33 113.55 113.32 3ii6 h SER 53 Ca 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 3ii6 h SER 53 Cb 0.42 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.96 3ii6 h SER 53 CO -0.37 0.12 -0.17 -0.61 -1.14 0.00 0.00 176.83 174.66 3ii6 h GLN 54 N 0.00 0.00 -0.36 3.45 5.75 -0.99 -2.78 115.11 120.18 3ii6 h GLN 54 Ca -0.00 0.00 0.05 0.00 -0.15 0.00 0.00 58.65 58.55 3ii6 h GLN 54 Cb 0.47 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.97 3ii6 h GLN 54 CO 0.02 0.00 -0.14 -1.91 -2.65 0.00 0.00 178.83 174.14 3ii6 n GLU 55 N -3.62 -0.09 -0.20 1.69 4.07 -0.77 0.44 120.64 122.17 3ii6 n GLU 55 Ca -0.02 0.56 -0.04 0.00 -0.06 0.00 0.00 57.16 57.60 3ii6 n GLU 55 Cb 0.09 -0.82 0.15 0.00 -0.06 0.00 0.00 31.44 30.80 3ii6 n GLU 55 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3ii6 h ALA 56 N 0.48 1.17 -0.54 4.31 0.00 -1.33 -2.72 119.26 120.63 3ii6 h ALA 56 Ca 0.12 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3ii6 h ALA 56 Cb 0.21 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3ii6 h ALA 56 CO -0.36 0.59 0.10 0.22 0.00 0.00 0.00 179.25 179.79 3ii6 h ASP 57 N 0.95 0.85 -0.50 0.00 1.82 -0.45 -1.38 116.42 117.71 3ii6 h ASP 57 Ca 0.22 -0.25 0.12 0.00 -0.39 0.00 0.00 57.03 56.73 3ii6 h ASP 57 Cb 0.23 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 39.99 3ii6 h ASP 57 CO -0.01 0.89 0.35 0.44 -1.61 0.00 0.00 179.24 179.29 3ii6 h ASP 58 N 0.78 0.10 -0.32 2.28 3.32 0.19 -1.92 116.42 120.85 3ii6 h ASP 58 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3ii6 h ASP 58 Cb 0.39 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3ii6 h ASP 58 CO 0.01 0.06 0.00 0.23 -1.72 0.00 0.00 179.24 177.82 3ii6 n MET 59 N -4.42 2.24 -4.20 3.56 2.81 -0.86 -4.94 117.12 111.31 3ii6 n MET 59 Ca 0.09 -1.87 -0.31 0.00 -1.81 0.00 0.00 57.70 53.80 3ii6 n MET 59 Cb 0.49 -1.47 -0.06 0.00 -0.71 0.00 0.00 33.22 31.48 3ii6 n MET 59 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3ii6 n GLU 60 N 1.09 -2.05 -4.88 0.03 1.02 -0.72 -4.96 120.64 110.16 3ii6 n GLU 60 Ca 0.18 0.24 -0.28 0.00 -0.02 0.00 0.00 57.16 57.29 3ii6 n GLU 60 Cb 0.51 -4.22 -0.17 0.00 -0.02 0.00 0.00 31.44 27.54 3ii6 n GLU 60 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 3ii6 s MET 61 N -7.02 2.27 -0.01 3.49 1.75 -0.58 -5.05 119.30 114.17 3ii6 s MET 61 Ca 0.17 -0.63 -0.35 0.00 -1.25 0.00 0.00 55.69 53.63 3ii6 s MET 61 Cb -0.10 -1.80 -0.17 0.00 2.84 0.00 0.00 34.83 35.60 3ii6 s MET 61 CO 0.95 0.12 0.93 -1.91 -0.65 0.00 0.00 175.02 174.47 3ii6 n GLU 62 N 3.61 0.00 -0.26 4.11 0.00 -1.26 -4.56 120.64 122.27 3ii6 n GLU 62 Ca -0.21 0.00 0.02 0.00 0.00 0.00 0.00 57.16 56.97 3ii6 n GLU 62 Cb 0.52 -1.30 0.15 0.00 0.00 0.00 0.00 31.44 30.82 3ii6 n GLU 62 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 3ii6 h LYS 63 N 2.63 0.63 0.64 5.31 3.64 -1.97 -1.37 116.57 126.08 3ii6 h LYS 63 Ca -0.44 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 58.88 3ii6 h LYS 63 Cb 1.23 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 3ii6 h LYS 63 CO 0.57 0.42 -0.43 0.78 -2.27 0.00 0.00 179.45 178.51 3ii6 h GLY 64 N 0.65 -1.15 -0.40 5.01 0.00 -2.00 -2.68 103.07 102.51 3ii6 h GLY 64 Ca 0.37 0.49 0.07 0.00 0.00 0.00 0.00 47.33 48.25 3ii6 h GLY 64 CO -0.27 -0.39 -0.14 1.17 0.00 0.00 0.00 176.54 176.91 3ii6 n LYS 65 N -5.56 -0.08 -0.03 4.80 4.81 -1.21 0.10 118.16 121.00 3ii6 n LYS 65 Ca -0.13 0.61 -0.12 0.00 -0.87 0.00 0.00 58.31 57.80 3ii6 n LYS 65 Cb 0.44 -0.91 -0.07 0.00 0.02 0.00 0.00 35.03 34.51 3ii6 n LYS 65 CO 0.00 0.00 0.00 -0.92 1.17 0.00 0.00 177.40 177.65 3ii6 h TYR 66 N 0.00 0.17 -0.80 5.64 3.20 -0.92 -0.91 116.97 123.35 3ii6 h TYR 66 Ca 0.15 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.99 3ii6 h TYR 66 Cb 0.25 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.44 3ii6 h TYR 66 CO -0.34 0.40 0.47 0.28 -1.64 0.00 0.00 178.16 177.33 3ii6 h VAL 67 N -0.10 1.23 -0.36 1.81 2.07 -0.68 0.32 116.25 120.53 3ii6 h VAL 67 Ca 0.03 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.07 3ii6 h VAL 67 Cb 0.32 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.17 3ii6 h VAL 67 CO 0.00 0.24 -0.21 0.61 0.02 0.00 0.00 177.57 178.23 3ii6 n GLY 68 N -1.18 -2.54 0.24 2.17 0.00 0.29 -0.86 105.19 103.31 3ii6 n GLY 68 Ca 0.08 0.73 -0.01 0.00 0.00 0.00 0.00 46.02 46.82 3ii6 n GLY 68 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ii6 h GLU 69 N 0.00 0.50 -0.50 1.61 4.39 0.16 -1.57 114.58 119.17 3ii6 h GLU 69 Ca 0.06 -0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.82 3ii6 h GLU 69 Cb 0.15 -0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 28.61 3ii6 h GLU 69 CO -0.34 0.33 0.06 -0.07 -1.16 0.00 0.00 179.01 177.83 3ii6 h LEU 70 N 0.52 -0.10 -0.18 1.33 3.38 0.41 0.29 115.31 120.96 3ii6 h LEU 70 Ca 0.30 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.37 3ii6 h LEU 70 Cb 0.29 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3ii6 h LEU 70 CO -0.24 -0.02 0.12 0.08 0.09 0.00 0.00 178.44 178.47 3ii6 h ARG 71 N 0.18 0.24 -0.82 1.13 0.11 -0.05 0.56 114.38 115.73 3ii6 h ARG 71 Ca 0.26 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 60.29 3ii6 h ARG 71 Cb 0.37 -0.05 -0.04 0.00 1.11 0.00 0.00 29.97 31.36 3ii6 h ARG 71 CO -0.37 0.16 0.39 0.87 0.10 0.00 0.00 179.97 181.12 3ii6 h LYS 72 N 0.25 1.19 0.09 0.08 1.57 -1.21 0.82 116.57 119.36 3ii6 h LYS 72 Ca 0.07 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3ii6 h LYS 72 Cb -0.03 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.07 3ii6 h LYS 72 CO -0.01 0.92 -0.05 0.00 -0.57 0.00 0.00 179.45 179.74 3ii6 h ALA 73 N 1.21 -0.13 0.00 3.86 0.00 -0.75 -2.57 119.26 120.88 3ii6 h ALA 73 Ca 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3ii6 h ALA 73 Cb 0.13 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3ii6 h ALA 73 CO -0.03 -0.37 -0.62 1.28 0.00 0.00 0.00 179.25 179.51 3ii6 n LEU 74 N -4.96 0.62 -0.08 0.00 4.77 0.19 -4.22 117.00 113.33 3ii6 n LEU 74 Ca -0.09 0.15 0.07 0.00 -0.03 0.00 0.00 56.01 56.12 3ii6 n LEU 74 Cb 0.23 -0.20 0.10 0.00 -2.33 0.00 0.00 43.42 41.22 3ii6 n LEU 74 CO 0.32 0.00 0.53 0.18 -1.33 0.00 0.00 177.39 177.09 3ii6 n LEU 75 N -1.93 2.09 -3.97 2.23 4.77 0.27 -4.74 117.00 115.71 3ii6 n LEU 75 Ca 0.04 -2.67 -0.29 0.00 -0.03 0.00 0.00 56.01 53.06 3ii6 n LEU 75 Cb 0.41 -0.30 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 3ii6 n LEU 75 CO 0.36 0.62 -0.24 -1.54 -1.33 0.00 0.00 177.39 175.27 3ii6 n SER 76 N -1.12 -1.30 -1.34 -1.43 3.41 -1.26 -4.92 113.62 105.67 3ii6 n SER 76 Ca 0.11 -1.08 0.10 0.00 -0.26 0.00 0.00 58.87 57.74 3ii6 n SER 76 Cb 0.55 -2.76 0.31 0.00 -0.26 0.00 0.00 64.21 62.05 3ii6 n SER 76 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ii6 n GLY 77 N -2.04 2.26 3.70 5.00 0.00 -0.97 -5.02 105.19 108.12 3ii6 n GLY 77 Ca -0.26 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.60 3ii6 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ii6 s ALA 78 N -1.44 3.60 1.34 4.61 0.00 -1.22 -4.73 121.76 123.92 3ii6 s ALA 78 Ca 0.45 1.01 -0.20 0.00 0.00 0.00 0.00 51.96 53.22 3ii6 s ALA 78 Cb 0.26 -3.60 0.33 0.00 0.00 0.00 0.00 23.12 20.11 3ii6 s ALA 78 CO 0.26 -0.87 0.79 0.41 0.00 0.00 0.00 175.76 176.36 3ii6 n GLY 79 N 3.67 -3.29 0.17 0.00 0.00 -1.26 -4.93 105.19 99.54 3ii6 n GLY 79 Ca 0.13 -1.44 -0.09 0.00 0.00 0.00 0.00 46.02 44.62 3ii6 n GLY 79 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ii6 h PRO 80 N -3.27 0.50 0.00 1.61 0.13 -2.06 -3.24 132.00 125.67 3ii6 h PRO 80 Ca -0.44 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3ii6 h PRO 80 Cb 1.26 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3ii6 h PRO 80 CO 0.29 0.40 0.00 0.00 -0.23 0.00 0.00 178.00 178.46 3ii6 n ALA 81 N -2.24 -0.09 -1.24 -0.56 0.00 -1.26 -4.80 120.51 110.32 3ii6 n ALA 81 Ca -0.01 0.00 -0.53 0.00 0.00 0.00 0.00 53.44 52.90 3ii6 n ALA 81 Cb 0.07 0.22 -0.09 0.00 0.00 0.00 0.00 19.45 19.65 3ii6 n ALA 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3ii6 n ASP 82 N -1.65 0.81 -4.34 0.00 8.00 -1.22 -5.01 116.55 113.14 3ii6 n ASP 82 Ca 0.00 0.77 -0.34 0.00 0.71 0.00 0.00 54.79 55.93 3ii6 n ASP 82 Cb 0.00 -0.74 -0.14 0.00 -0.02 0.00 0.00 41.12 40.22 3ii6 n ASP 82 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3ii6 s VAL 83 N 3.83 3.32 0.16 2.53 1.01 -1.26 -4.78 120.40 125.21 3ii6 s VAL 83 Ca 0.94 -0.53 0.11 0.00 0.00 0.00 0.00 61.98 62.50 3ii6 s VAL 83 Cb -1.25 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 3ii6 s VAL 83 CO 0.62 0.46 -0.24 -0.31 0.00 0.00 0.00 175.10 175.62 3ii6 s TYR 84 N 1.10 2.19 -0.01 5.22 1.51 -1.26 -0.97 117.35 125.12 3ii6 s TYR 84 Ca 0.01 -0.38 0.03 0.00 -1.01 0.00 0.00 57.07 55.71 3ii6 s TYR 84 Cb -0.15 -1.13 -0.01 0.00 -0.11 0.00 0.00 41.96 40.57 3ii6 s TYR 84 CO -0.01 0.40 -0.10 0.99 -1.11 0.00 0.00 175.55 175.73 3ii6 s THR 85 N -1.49 0.76 -0.09 -0.71 2.01 0.82 -4.96 115.64 111.98 3ii6 s THR 85 Ca 0.17 -0.40 0.01 0.00 0.31 0.00 0.00 61.69 61.78 3ii6 s THR 85 Cb -0.08 -0.65 0.02 0.00 0.01 0.00 0.00 72.50 71.80 3ii6 s THR 85 CO 0.08 0.22 -0.11 -0.36 -0.69 0.00 0.00 174.62 173.76 3ii6 s PHE 86 N -0.15 1.57 -0.05 4.92 0.40 -1.26 -0.83 117.98 122.57 3ii6 s PHE 86 Ca 0.03 -0.69 0.03 0.00 -0.60 0.00 0.00 56.93 55.69 3ii6 s PHE 86 Cb -0.05 -1.20 0.01 0.00 0.51 0.00 0.00 43.02 42.30 3ii6 s PHE 86 CO -0.00 -0.41 -0.12 -0.80 0.70 0.00 0.00 175.22 174.60 3ii6 s ASN 87 N 1.11 1.64 -0.07 1.36 0.01 0.20 -0.34 114.94 118.85 3ii6 s ASN 87 Ca -0.06 -0.27 -0.04 0.00 -0.71 0.00 0.00 52.86 51.78 3ii6 s ASN 87 Cb -0.14 -0.65 0.03 0.00 0.41 0.00 0.00 41.25 40.90 3ii6 s ASN 87 CO -0.02 0.05 0.17 0.12 -1.51 0.00 0.00 177.10 175.91 3ii6 s PHE 88 N 0.48 -0.20 -0.39 2.20 5.36 -1.26 -0.95 117.98 123.22 3ii6 s PHE 88 Ca -0.10 0.52 -0.14 0.00 -0.96 0.00 0.00 56.93 56.25 3ii6 s PHE 88 Cb -0.13 -0.00 0.01 0.00 -0.34 0.00 0.00 43.02 42.56 3ii6 s PHE 88 CO 0.02 -0.15 0.28 0.45 -1.46 0.00 0.00 175.22 174.36 3ii6 s SER 89 N 0.77 6.05 0.21 6.13 0.15 -1.11 -4.83 113.70 121.07 3ii6 s SER 89 Ca -0.06 -0.82 -0.05 0.00 0.70 0.00 0.00 55.95 55.73 3ii6 s SER 89 Cb -0.07 -2.14 0.37 0.00 -1.71 0.00 0.00 66.02 62.47 3ii6 s SER 89 CO -0.04 -0.40 1.16 0.29 1.20 0.00 0.00 173.24 175.45 3ii6 n LYS 90 N 5.13 -0.07 -0.02 5.44 5.02 -1.26 -0.20 118.16 132.20 3ii6 n LYS 90 Ca -0.11 1.15 -0.12 0.00 -2.02 0.00 0.00 58.31 57.21 3ii6 n LYS 90 Cb 0.47 -1.74 -0.10 0.00 -0.02 0.00 0.00 35.03 33.65 3ii6 n LYS 90 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3ii6 h GLU 91 N 0.00 -0.05 -0.00 1.97 5.08 -1.98 -3.04 114.58 116.55 3ii6 h GLU 91 Ca 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 3ii6 h GLU 91 Cb 0.60 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3ii6 h GLU 91 CO -0.76 0.60 -0.04 -1.13 -1.00 0.00 0.00 179.01 176.68 3ii6 n SER 92 N -4.76 0.27 -3.78 1.42 3.41 -1.19 -4.95 113.62 104.05 3ii6 n SER 92 Ca -0.08 -0.58 -0.24 0.00 -0.26 0.00 0.00 58.87 57.71 3ii6 n SER 92 Cb 0.33 -0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 64.13 3ii6 n SER 92 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ii6 s TYR 94 N -3.96 2.90 -0.15 0.00 5.04 -1.22 -2.61 117.35 117.35 3ii6 s TYR 94 Ca 0.14 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.39 3ii6 s TYR 94 Cb -0.08 -1.85 -0.00 0.00 0.35 0.00 0.00 41.96 40.38 3ii6 s TYR 94 CO 0.62 -0.04 -0.16 0.12 -1.34 0.00 0.00 175.55 174.75 3ii6 s PHE 95 N 0.10 2.77 0.07 4.97 2.19 0.30 -2.76 117.98 125.62 3ii6 s PHE 95 Ca -0.03 -1.03 0.01 0.00 0.33 0.00 0.00 56.93 56.20 3ii6 s PHE 95 Cb -0.14 -1.88 -0.04 0.00 -1.31 0.00 0.00 43.02 39.65 3ii6 s PHE 95 CO 0.04 -0.46 -0.05 -0.59 1.83 0.00 0.00 175.22 175.98 3ii6 s PHE 96 N 0.78 0.68 -0.00 10.12 -0.12 -0.12 0.20 117.98 129.52 3ii6 s PHE 96 Ca -0.06 -0.88 -0.03 0.00 -0.05 0.00 0.00 56.93 55.91 3ii6 s PHE 96 Cb -0.15 -0.43 -0.00 0.00 -0.63 0.00 0.00 43.02 41.80 3ii6 s PHE 96 CO 0.00 -0.22 0.06 -0.59 -0.05 0.00 0.00 175.22 174.42 3ii6 s PHE 97 N -3.24 0.07 0.19 3.49 -0.71 -0.88 0.58 117.98 117.49 3ii6 s PHE 97 Ca 0.05 -0.15 -0.01 0.00 -1.04 0.00 0.00 56.93 55.77 3ii6 s PHE 97 Cb 0.03 -0.07 -0.04 0.00 -1.21 0.00 0.00 43.02 41.73 3ii6 s PHE 97 CO -0.06 -0.17 0.13 -1.83 -1.34 0.00 0.00 175.22 171.96 3ii6 s GLU 98 N -0.91 1.17 0.06 1.99 -1.05 -0.01 0.12 118.70 120.07 3ii6 s GLU 98 Ca -0.10 -1.59 0.04 0.00 -0.15 0.00 0.00 54.97 53.17 3ii6 s GLU 98 Cb -0.06 0.27 -0.04 0.00 -0.44 0.00 0.00 34.13 33.86 3ii6 s GLU 98 CO 0.00 -0.38 0.00 0.21 0.95 0.00 0.00 175.26 176.05 3ii6 s LYS 99 N -4.14 2.64 -0.27 -4.83 2.20 0.37 -0.13 119.74 115.58 3ii6 s LYS 99 Ca 0.36 -0.76 0.02 0.00 -0.36 0.00 0.00 55.97 55.23 3ii6 s LYS 99 Cb 0.07 -2.59 0.07 0.00 -1.51 0.00 0.00 37.83 33.87 3ii6 s LYS 99 CO 0.10 0.57 -0.06 -0.80 -0.36 0.00 0.00 175.35 174.80 3ii6 s ASN 100 N -2.09 4.35 0.00 1.43 0.01 -0.15 0.86 114.94 119.35 3ii6 s ASN 100 Ca 0.24 -1.50 0.00 0.00 -0.71 0.00 0.00 52.86 50.89 3ii6 s ASN 100 Cb -0.12 -1.45 0.00 0.00 0.41 0.00 0.00 41.25 40.10 3ii6 s ASN 100 CO 0.16 -0.25 0.00 0.18 -1.51 0.00 0.00 177.10 175.68 3ii6 n LEU 101 N 4.47 0.00 -3.67 0.60 4.77 -0.64 -4.35 117.00 118.18 3ii6 n LEU 101 Ca -0.10 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.47 3ii6 n LEU 101 Cb 0.43 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.51 3ii6 n LEU 101 CO 0.20 0.00 2.46 0.29 -1.33 0.00 0.00 177.39 179.01 3ii6 n LYS 102 N 0.00 3.63 -1.12 3.23 5.02 -1.26 -4.13 118.16 123.53 3ii6 n LYS 102 Ca 0.00 -3.07 -0.09 0.00 -2.02 0.00 0.00 58.31 53.13 3ii6 n LYS 102 Cb 0.00 -2.94 -0.04 0.00 -0.02 0.00 0.00 35.03 32.03 3ii6 n LYS 102 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3ii6 n ASP 103 N 3.97 -3.49 -4.94 4.39 9.92 -1.26 -4.98 116.55 120.16 3ii6 n ASP 103 Ca 0.53 0.21 -0.26 0.00 -0.53 0.00 0.00 54.79 54.75 3ii6 n ASP 103 Cb 0.33 -2.91 -0.03 0.00 -0.64 0.00 0.00 41.12 37.87 3ii6 n ASP 103 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 3ii6 s VAL 104 N -1.60 5.31 -0.20 2.53 -7.23 -1.26 -5.11 120.40 112.83 3ii6 s VAL 104 Ca 0.00 -0.66 -0.06 0.00 -1.81 0.00 0.00 61.98 59.45 3ii6 s VAL 104 Cb 0.00 -3.75 -0.03 0.00 0.56 0.00 0.00 36.38 33.16 3ii6 s VAL 104 CO 0.00 -0.12 0.03 -0.55 -0.31 0.00 0.00 175.10 174.16 3ii6 s SER 105 N -3.27 5.14 -0.21 4.85 0.15 -1.26 -1.62 113.70 117.48 3ii6 s SER 105 Ca 0.35 -0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.90 3ii6 s SER 105 Cb -0.11 -1.89 0.04 0.00 -1.71 0.00 0.00 66.02 62.35 3ii6 s SER 105 CO 0.29 0.08 -0.15 -0.36 1.20 0.00 0.00 173.24 174.29 3ii6 s PHE 106 N 0.94 2.83 0.24 3.44 0.40 0.25 -4.96 117.98 121.12 3ii6 s PHE 106 Ca 0.03 -1.82 -0.31 0.00 -0.60 0.00 0.00 56.93 54.23 3ii6 s PHE 106 Cb -0.14 -1.85 -0.11 0.00 0.51 0.00 0.00 43.02 41.43 3ii6 s PHE 106 CO 0.02 -0.81 1.61 0.50 0.70 0.00 0.00 175.22 177.24 3ii6 s ARG 107 N 1.26 4.16 -0.09 0.44 6.06 -1.26 0.14 118.95 129.66 3ii6 s ARG 107 Ca -0.00 2.51 0.12 0.00 -2.50 0.00 0.00 55.73 55.86 3ii6 s ARG 107 Cb -0.16 -3.07 -0.18 0.00 0.06 0.00 0.00 34.95 31.60 3ii6 s ARG 107 CO -0.10 -0.63 0.13 1.28 -2.50 0.00 0.00 175.30 173.48 3ii6 n LEU 108 N 3.00 0.00 0.00 -0.88 4.32 0.33 -4.83 117.00 118.94 3ii6 n LEU 108 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.10 3ii6 n LEU 108 Cb 0.37 0.22 0.00 0.00 -1.62 0.00 0.00 43.42 42.39 3ii6 n LEU 108 CO 0.63 0.22 0.00 0.61 -1.22 0.00 0.00 177.39 177.63 3ii6 n GLY 109 N 2.03 -0.15 3.20 -0.72 0.00 -1.12 -4.98 105.19 103.47 3ii6 n GLY 109 Ca -0.15 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.77 3ii6 n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ii6 s SER 110 N 0.00 1.22 -0.02 1.61 0.01 -1.26 -2.07 113.70 113.19 3ii6 s SER 110 Ca 0.00 -1.07 -0.03 0.00 1.31 0.00 0.00 55.95 56.15 3ii6 s SER 110 Cb 0.00 0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.33 3ii6 s SER 110 CO 0.00 -0.50 0.07 -0.36 0.41 0.00 0.00 173.24 172.87 3ii6 s PHE 111 N -3.62 -0.00 -0.57 2.43 2.99 0.53 -4.96 117.98 114.77 3ii6 s PHE 111 Ca 0.17 0.02 -0.21 0.00 0.00 0.00 0.00 56.93 56.91 3ii6 s PHE 111 Cb 0.05 -0.02 0.06 0.00 0.00 0.00 0.00 43.02 43.11 3ii6 s PHE 111 CO -0.01 -0.12 0.81 0.54 -0.00 0.00 0.00 175.22 176.45 3ii6 s ASN 112 N -0.50 6.23 0.31 1.36 4.22 -1.26 0.11 114.94 125.41 3ii6 s ASN 112 Ca -0.06 -0.88 -0.14 0.00 -2.14 0.00 0.00 52.86 49.64 3ii6 s ASN 112 Cb -0.04 -2.37 -0.09 0.00 1.28 0.00 0.00 41.25 40.04 3ii6 s ASN 112 CO 0.00 -1.17 0.72 -0.76 -2.04 0.00 0.00 177.10 173.85 3ii6 s LEU 113 N 3.38 4.07 -0.23 3.54 1.43 -1.07 -4.48 118.68 125.32 3ii6 s LEU 113 Ca 0.20 1.24 0.01 0.00 -1.03 0.00 0.00 54.13 54.55 3ii6 s LEU 113 Cb -0.18 -4.04 0.06 0.00 0.03 0.00 0.00 46.19 42.06 3ii6 s LEU 113 CO 0.12 -0.20 -0.05 -1.61 0.23 0.00 0.00 176.35 174.85 3ii6 s GLU 114 N -2.98 1.57 0.46 1.70 2.02 -0.77 -4.80 118.70 115.91 3ii6 s GLU 114 Ca 0.53 -0.95 -0.22 0.00 0.02 0.00 0.00 54.97 54.35 3ii6 s GLU 114 Cb -0.10 -2.55 -0.10 0.00 0.10 0.00 0.00 34.13 31.48 3ii6 s GLU 114 CO 0.18 -0.59 0.89 1.17 0.02 0.00 0.00 175.26 176.92 3ii6 n LYS 115 N 4.70 1.08 -4.05 1.61 4.81 -1.26 -2.37 118.16 122.68 3ii6 n LYS 115 Ca -0.12 0.39 -0.33 0.00 -0.87 0.00 0.00 58.31 57.39 3ii6 n LYS 115 Cb 0.44 -1.95 -0.06 0.00 0.02 0.00 0.00 35.03 33.48 3ii6 n LYS 115 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3ii6 s VAL 116 N -1.39 4.90 -0.07 3.15 1.01 -0.27 -4.86 120.40 122.88 3ii6 s VAL 116 Ca 0.66 -0.36 -0.25 0.00 0.00 0.00 0.00 61.98 62.03 3ii6 s VAL 116 Cb -0.53 -3.26 -0.25 0.00 0.00 0.00 0.00 36.38 32.34 3ii6 s VAL 116 CO 0.55 0.34 0.96 1.05 0.00 0.00 0.00 175.10 177.99 3ii6 h GLU 117 N 4.00 0.13 -4.35 2.72 4.11 -1.90 -3.40 114.58 115.88 3ii6 h GLU 117 Ca -0.49 -0.16 -0.74 0.00 0.07 0.00 0.00 59.36 58.03 3ii6 h GLU 117 Cb 1.18 0.05 -0.22 0.00 0.50 0.00 0.00 28.75 30.26 3ii6 h GLU 117 CO 0.64 0.96 0.35 0.54 0.07 0.00 0.00 179.01 181.56 3ii6 s ASN 118 N -6.33 6.64 -0.14 3.06 4.22 -1.26 -4.97 114.94 116.16 3ii6 s ASN 118 Ca -0.16 -2.30 -0.18 0.00 -2.14 0.00 0.00 52.86 48.07 3ii6 s ASN 118 Cb -0.00 -2.29 -0.16 0.00 1.28 0.00 0.00 41.25 40.08 3ii6 s ASN 118 CO 0.73 -0.81 0.40 1.55 -2.04 0.00 0.00 177.10 176.94 3ii6 h PRO 119 N 8.33 0.00 0.00 3.55 0.13 -1.93 -3.33 132.00 138.75 3ii6 h PRO 119 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3ii6 h PRO 119 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3ii6 h PRO 119 CO 0.92 0.63 0.00 0.00 -0.23 0.00 0.00 178.00 179.32 3ii6 n ALA 120 N -2.84 1.44 -0.13 -0.56 0.00 -1.26 -2.96 120.51 114.20 3ii6 n ALA 120 Ca -0.10 -0.03 -0.28 0.00 0.00 0.00 0.00 53.44 53.04 3ii6 n ALA 120 Cb 0.35 -1.10 -0.10 0.00 0.00 0.00 0.00 19.45 18.60 3ii6 n ALA 120 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3ii6 n GLU 121 N -1.33 0.58 -0.30 0.00 1.02 -1.26 -2.81 120.64 116.54 3ii6 n GLU 121 Ca 0.03 0.29 -0.04 0.00 -0.02 0.00 0.00 57.16 57.41 3ii6 n GLU 121 Cb 0.06 -1.51 0.08 0.00 -0.02 0.00 0.00 31.44 30.04 3ii6 n GLU 121 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 3ii6 h VAL 122 N -1.00 1.22 -0.89 2.62 -1.51 -1.67 -1.99 116.25 113.03 3ii6 h VAL 122 Ca -0.62 -0.45 0.17 0.00 -1.23 0.00 0.00 66.70 64.56 3ii6 h VAL 122 Cb 1.54 0.04 -0.16 0.00 -2.13 0.00 0.00 31.29 30.57 3ii6 h VAL 122 CO -0.38 0.23 -0.26 0.40 -1.23 0.00 0.00 177.57 176.32 3ii6 h ILE 123 N 1.13 0.09 -0.34 7.19 2.04 -1.72 0.31 117.51 126.20 3ii6 h ILE 123 Ca 0.30 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.20 3ii6 h ILE 123 Cb -0.08 0.09 -0.04 0.00 -0.74 0.00 0.00 36.82 36.05 3ii6 h ILE 123 CO -0.06 0.00 0.10 0.03 0.00 0.00 0.00 178.15 178.22 3ii6 h ARG 124 N -0.01 0.23 0.10 2.37 3.08 -1.30 0.12 114.38 118.97 3ii6 h ARG 124 Ca 0.40 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.43 3ii6 h ARG 124 Cb 0.64 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.64 3ii6 h ARG 124 CO -0.92 0.15 -0.05 1.49 -1.07 0.00 0.00 179.97 179.58 3ii6 h GLU 125 N 0.24 -0.13 -0.67 0.04 4.22 -1.05 -0.61 114.58 116.62 3ii6 h GLU 125 Ca 0.16 0.01 0.07 0.00 0.08 0.00 0.00 59.36 59.67 3ii6 h GLU 125 Cb 0.14 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.32 3ii6 h GLU 125 CO -0.17 0.21 -0.57 1.25 -2.18 0.00 0.00 179.01 177.55 3ii6 h LEU 126 N -0.49 -1.98 -0.31 1.64 6.46 -0.28 -1.85 115.31 118.50 3ii6 h LEU 126 Ca -0.01 0.28 0.00 0.00 -0.12 0.00 0.00 57.88 58.03 3ii6 h LEU 126 Cb 0.40 0.85 0.00 0.00 -0.73 0.00 0.00 40.66 41.18 3ii6 h LEU 126 CO 0.02 -0.33 0.00 -0.38 -0.62 0.00 0.00 178.44 177.13 3ii6 n ILE 127 N -5.32 0.03 0.09 4.05 5.41 0.41 -1.27 119.36 122.75 3ii6 n ILE 127 Ca -0.01 -0.09 -0.18 0.00 1.00 0.00 0.00 62.75 63.47 3ii6 n ILE 127 Cb 0.31 -0.15 -0.14 0.00 -0.71 0.00 0.00 39.64 38.95 3ii6 n ILE 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ii6 h TYR 129 N 0.08 0.00 0.11 0.00 3.20 -0.53 -2.15 116.97 117.69 3ii6 h TYR 129 Ca -0.22 0.00 -0.22 0.00 3.14 0.00 0.00 58.73 61.43 3ii6 h TYR 129 Cb 2.03 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.31 3ii6 h TYR 129 CO 0.08 0.09 -1.08 0.00 -1.64 0.00 0.00 178.16 175.61 3ii6 h LEU 131 N -0.44 0.60 0.05 0.00 3.38 -1.61 0.64 115.31 117.93 3ii6 h LEU 131 Ca -0.23 0.12 -0.28 0.00 0.09 0.00 0.00 57.88 57.59 3ii6 h LEU 131 Cb 1.62 0.03 0.02 0.00 0.09 0.00 0.00 40.66 42.43 3ii6 h LEU 131 CO 0.07 0.08 -1.12 0.44 0.09 0.00 0.00 178.44 178.01 3ii6 h ASP 132 N 0.51 0.90 0.51 -0.43 5.19 -1.34 -1.89 116.42 119.86 3ii6 h ASP 132 Ca 0.64 -0.77 -0.02 0.00 -0.62 0.00 0.00 57.03 56.25 3ii6 h ASP 132 Cb 1.35 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 40.58 3ii6 h ASP 132 CO -0.43 1.56 -0.24 0.74 -3.12 0.00 0.00 179.24 177.75 3ii6 h THR 133 N 0.34 0.47 -0.51 0.35 2.02 -0.18 -1.79 112.91 113.60 3ii6 h THR 133 Ca -0.15 -0.22 0.04 0.00 0.77 0.00 0.00 66.41 66.84 3ii6 h THR 133 Cb 1.78 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 68.72 3ii6 h THR 133 CO 0.22 0.04 0.34 0.00 0.37 0.00 0.00 175.52 176.48 3ii6 h THR 134 N -0.82 1.04 -0.13 3.16 1.03 0.20 -2.25 112.91 115.14 3ii6 h THR 134 Ca -0.07 -0.19 -0.11 0.00 -0.01 0.00 0.00 66.41 66.02 3ii6 h THR 134 Cb 0.58 0.44 0.00 0.00 -1.07 0.00 0.00 68.15 68.10 3ii6 h THR 134 CO 0.11 0.10 -0.36 0.00 -0.01 0.00 0.00 175.52 175.36 3ii6 h ALA 135 N 1.71 0.22 -0.65 0.00 0.00 -1.35 0.58 119.26 119.77 3ii6 h ALA 135 Ca 0.21 -0.44 0.06 0.00 0.00 0.00 0.00 54.91 54.73 3ii6 h ALA 135 Cb 0.13 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 3ii6 h ALA 135 CO -0.05 0.30 0.36 0.93 0.00 0.00 0.00 179.25 180.78 3ii6 h GLU 136 N 0.08 0.65 0.00 0.00 5.08 -0.88 -1.30 114.58 118.21 3ii6 h GLU 136 Ca -0.01 -0.04 -0.13 0.00 -1.00 0.00 0.00 59.36 58.18 3ii6 h GLU 136 Cb 0.98 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 3ii6 h GLU 136 CO 0.08 0.43 -0.64 -0.91 -1.00 0.00 0.00 179.01 176.97 3ii6 h ASN 137 N 0.67 0.00 -0.01 1.42 2.35 -1.43 -1.53 115.58 117.05 3ii6 h ASN 137 Ca 0.29 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.04 3ii6 h ASN 137 Cb 0.18 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 3ii6 h ASN 137 CO -0.18 0.64 0.00 1.56 -1.65 0.00 0.00 177.43 177.80 3ii6 h GLN 138 N 0.00 0.02 -0.36 0.81 1.08 -0.70 -2.56 115.11 113.40 3ii6 h GLN 138 Ca -0.01 -0.01 -0.11 0.00 -1.45 0.00 0.00 58.65 57.08 3ii6 h GLN 138 Cb 1.46 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.88 3ii6 h GLN 138 CO 0.08 0.32 -0.23 0.00 -0.95 0.00 0.00 178.83 178.05 3ii6 h ALA 139 N 0.70 0.92 0.00 3.87 0.00 -1.22 -1.25 119.26 122.26 3ii6 h ALA 139 Ca 0.00 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 3ii6 h ALA 139 Cb 0.31 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3ii6 h ALA 139 CO 0.00 0.62 -0.33 -0.22 0.00 0.00 0.00 179.25 179.32 3ii6 h LYS 140 N 0.62 0.00 -0.21 0.00 3.64 -1.30 -2.35 116.57 116.97 3ii6 h LYS 140 Ca 0.09 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.35 3ii6 h LYS 140 Cb 0.73 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.55 3ii6 h LYS 140 CO 0.06 0.33 -0.33 -0.97 -2.27 0.00 0.00 179.45 176.27 3ii6 h ASN 141 N 0.00 0.65 -0.65 4.20 -1.24 -1.02 -1.67 115.58 115.86 3ii6 h ASN 141 Ca -0.00 -0.52 0.04 0.00 0.71 0.00 0.00 56.30 56.52 3ii6 h ASN 141 Cb 0.60 -0.19 -0.05 0.00 0.73 0.00 0.00 38.32 39.42 3ii6 h ASN 141 CO 0.04 1.05 0.39 -0.33 -1.29 0.00 0.00 177.43 177.29 3ii6 h GLU 142 N 0.28 0.72 -0.56 6.67 5.08 -0.93 -1.70 114.58 124.14 3ii6 h GLU 142 Ca 0.02 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 3ii6 h GLU 142 Cb 0.91 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 3ii6 h GLU 142 CO 0.08 0.48 0.20 1.25 -1.00 0.00 0.00 179.01 180.02 3ii6 h HIS 143 N 0.75 0.88 -0.26 4.33 2.76 -1.38 -2.52 115.15 119.70 3ii6 h HIS 143 Ca 0.27 -0.08 -0.12 0.00 -2.20 0.00 0.00 60.37 58.24 3ii6 h HIS 143 Cb 0.07 -0.26 -0.01 0.00 1.55 0.00 0.00 27.41 28.76 3ii6 h HIS 143 CO -0.06 0.72 -0.35 -0.07 -1.30 0.00 0.00 177.93 176.87 3ii6 h LEU 144 N 0.78 0.60 -0.29 0.26 3.38 -1.08 -1.89 115.31 117.07 3ii6 h LEU 144 Ca 0.18 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 3ii6 h LEU 144 Cb 0.24 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3ii6 h LEU 144 CO -0.01 0.90 -0.26 -0.61 0.09 0.00 0.00 178.44 178.55 3ii6 h GLN 145 N 0.48 0.69 -0.59 1.13 5.75 -1.29 0.23 115.11 121.51 3ii6 h GLN 145 Ca 0.05 -0.35 -0.02 0.00 -0.15 0.00 0.00 58.65 58.18 3ii6 h GLN 145 Cb 0.84 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.37 3ii6 h GLN 145 CO 0.07 0.96 0.29 0.87 -2.65 0.00 0.00 178.83 178.37 3ii6 h LYS 146 N 0.43 0.85 -0.53 1.69 6.56 -1.34 -1.94 116.57 122.29 3ii6 h LYS 146 Ca 0.05 -0.12 -0.06 0.00 -1.06 0.00 0.00 60.65 59.45 3ii6 h LYS 146 Cb 0.82 -0.15 -0.02 0.00 -0.57 0.00 0.00 32.23 32.31 3ii6 h LYS 146 CO 0.07 0.68 0.08 0.93 -2.06 0.00 0.00 179.45 179.15 3ii6 h GLU 147 N 0.81 0.88 -0.39 3.15 4.39 -1.17 -1.92 114.58 120.33 3ii6 h GLU 147 Ca 0.20 -0.24 0.07 0.00 0.34 0.00 0.00 59.36 59.73 3ii6 h GLU 147 Cb 0.11 -0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 28.60 3ii6 h GLU 147 CO -0.03 0.86 0.03 -0.97 -1.16 0.00 0.00 179.01 177.74 3ii6 h ASN 148 N 0.77 -0.10 -0.49 1.42 -0.73 -0.29 -0.48 115.58 115.67 3ii6 h ASN 148 Ca 0.16 0.08 0.09 0.00 1.87 0.00 0.00 56.30 58.50 3ii6 h ASN 148 Cb 0.41 0.14 -0.07 0.00 0.27 0.00 0.00 38.32 39.06 3ii6 h ASN 148 CO 0.01 -0.02 0.08 -0.33 -0.37 0.00 0.00 177.43 176.81 3ii6 h GLU 149 N 0.14 0.21 -0.15 6.67 5.08 -1.22 -0.43 114.58 124.86 3ii6 h GLU 149 Ca 0.19 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.57 3ii6 h GLU 149 Cb 0.26 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 3ii6 h GLU 149 CO -0.30 0.14 -0.04 -0.09 -1.00 0.00 0.00 179.01 177.72 3ii6 h ARG 150 N 0.21 -0.00 -0.15 2.33 2.43 -1.23 -0.58 114.38 117.39 3ii6 h ARG 150 Ca 0.25 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.31 3ii6 h ARG 150 Cb 0.34 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 3ii6 h ARG 150 CO -0.34 -0.00 -0.33 -0.07 -1.51 0.00 0.00 179.97 177.72 3ii6 h LEU 151 N -0.00 0.56 -0.93 3.80 3.38 -0.77 -1.60 115.31 119.74 3ii6 h LEU 151 Ca 0.07 -0.56 -0.06 0.00 0.09 0.00 0.00 57.88 57.42 3ii6 h LEU 151 Cb 0.12 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3ii6 h LEU 151 CO -0.16 1.02 0.09 0.25 0.09 0.00 0.00 178.44 179.73 3ii6 h LEU 152 N 0.12 0.82 -0.61 1.67 5.85 -1.05 0.25 115.31 122.37 3ii6 h LEU 152 Ca 0.00 -0.17 -0.15 0.00 0.84 0.00 0.00 57.88 58.40 3ii6 h LEU 152 Cb 0.93 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 3ii6 h LEU 152 CO 0.07 0.83 -0.67 -0.09 -0.34 0.00 0.00 178.44 178.25 3ii6 h ARG 153 N 0.82 0.14 0.11 1.25 2.43 -0.73 -2.40 114.38 116.01 3ii6 h ARG 153 Ca 0.17 -0.11 -0.31 0.00 -0.81 0.00 0.00 59.98 58.92 3ii6 h ARG 153 Cb 0.37 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 3ii6 h ARG 153 CO 0.01 0.76 -1.53 -0.44 -1.51 0.00 0.00 179.97 177.25 3ii6 h ASP 154 N 0.10 0.38 -0.23 -3.80 3.32 -0.91 -2.94 116.42 112.34 3ii6 h ASP 154 Ca -0.01 -0.53 -0.01 0.00 0.02 0.00 0.00 57.03 56.50 3ii6 h ASP 154 Cb 1.19 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.61 3ii6 h ASP 154 CO 0.10 1.44 0.11 -0.25 -1.72 0.00 0.00 179.24 178.92 3ii6 h TRP 155 N 0.07 0.33 -0.59 4.55 7.01 -0.49 -2.06 115.95 124.76 3ii6 h TRP 155 Ca -0.24 -0.02 0.16 0.00 2.11 0.00 0.00 58.89 60.90 3ii6 h TRP 155 Cb 2.01 -0.10 -0.03 0.00 -2.10 0.00 0.00 29.16 28.94 3ii6 h TRP 155 CO 0.06 0.32 0.42 -0.91 -2.79 0.00 0.00 178.44 175.54 3ii6 h ASN 156 N 0.24 0.05 0.00 2.65 2.35 -1.42 -1.98 115.58 117.47 3ii6 h ASN 156 Ca 0.08 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 3ii6 h ASN 156 Cb 0.12 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 3ii6 h ASN 156 CO -0.01 0.03 -0.11 -0.78 -1.65 0.00 0.00 177.43 174.91 3ii6 h ASP 157 N 0.06 0.00 -0.91 5.81 1.82 -1.33 -3.02 116.42 118.84 3ii6 h ASP 157 Ca 0.28 -0.34 0.12 0.00 -0.39 0.00 0.00 57.03 56.70 3ii6 h ASP 157 Cb 1.05 0.00 -0.07 0.00 0.68 0.00 0.00 39.33 40.99 3ii6 h ASP 157 CO -0.02 0.73 0.59 0.58 -1.61 0.00 0.00 179.24 179.51 3ii6 h VAL 158 N -1.00 0.91 0.15 2.25 2.07 -1.40 -1.76 116.25 117.46 3ii6 h VAL 158 Ca -0.02 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.22 3ii6 h VAL 158 Cb 0.43 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 3ii6 h VAL 158 CO -0.01 0.15 -0.14 -0.61 0.02 0.00 0.00 177.57 176.98 3ii6 h GLN 159 N 0.83 -0.30 0.24 1.57 5.75 -1.40 -0.54 115.11 121.26 3ii6 h GLN 159 Ca 0.44 0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.95 3ii6 h GLN 159 Cb 0.54 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.16 3ii6 h GLN 159 CO -0.21 -0.20 -0.12 0.78 -2.65 0.00 0.00 178.83 176.43 3ii6 h GLY 160 N -0.31 -0.35 0.65 2.39 0.00 -1.54 -2.34 103.07 101.57 3ii6 h GLY 160 Ca 0.00 0.13 0.07 0.00 0.00 0.00 0.00 47.33 47.53 3ii6 h GLY 160 CO -0.03 -0.13 0.43 -0.09 0.00 0.00 0.00 176.54 176.72 3ii6 h ARG 161 N -0.34 0.75 0.86 4.80 9.65 -1.20 -1.88 114.38 127.04 3ii6 h ARG 161 Ca -0.03 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 58.76 3ii6 h ARG 161 Cb 0.26 -0.17 0.01 0.00 -1.39 0.00 0.00 29.97 28.68 3ii6 h ARG 161 CO 0.05 0.50 -0.41 0.35 2.80 0.00 0.00 179.97 183.25 3ii6 h PHE 162 N 0.78 -1.07 -0.98 2.20 3.57 -1.02 -0.51 116.94 119.90 3ii6 h PHE 162 Ca 0.34 -0.03 0.20 0.00 3.53 0.00 0.00 57.97 62.02 3ii6 h PHE 162 Cb 0.22 0.36 -0.09 0.00 2.79 0.00 0.00 35.95 39.23 3ii6 h PHE 162 CO -0.06 -0.66 0.62 0.93 -2.23 0.00 0.00 178.31 176.90 3ii6 h GLU 163 N -1.27 0.60 -0.42 1.11 5.08 -1.37 -0.11 114.58 118.20 3ii6 h GLU 163 Ca -0.12 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.14 3ii6 h GLU 163 Cb 0.89 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 3ii6 h GLU 163 CO 0.19 0.40 -0.02 0.87 -1.00 0.00 0.00 179.01 179.45 3ii6 h LYS 164 N 0.62 0.69 -0.41 2.33 1.57 -0.78 -2.68 116.57 117.91 3ii6 h LYS 164 Ca 0.55 -0.18 -0.15 0.00 -1.87 0.00 0.00 60.65 59.00 3ii6 h LYS 164 Cb 1.06 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 3ii6 h LYS 164 CO -0.31 0.72 -0.32 0.00 -0.57 0.00 0.00 179.45 178.96 3ii6 h VAL 166 N 0.76 1.17 -0.60 0.00 2.07 -1.04 -1.07 116.25 117.55 3ii6 h VAL 166 Ca 0.07 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.18 3ii6 h VAL 166 Cb 0.91 -0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 3ii6 h VAL 166 CO 0.08 0.22 0.39 0.28 0.02 0.00 0.00 177.57 178.56 3ii6 h SER 167 N 1.22 0.70 -0.07 0.57 0.02 -1.41 -1.47 113.55 113.11 3ii6 h SER 167 Ca 0.38 -0.03 -0.16 0.00 -0.84 0.00 0.00 61.79 61.13 3ii6 h SER 167 Cb -0.01 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 3ii6 h SER 167 CO -0.12 0.53 -0.52 0.00 -1.14 0.00 0.00 176.83 175.57 3ii6 h ALA 168 N 1.21 0.66 -0.03 3.77 0.00 -1.34 -2.49 119.26 121.03 3ii6 h ALA 168 Ca 0.22 -0.50 -0.14 0.00 0.00 0.00 0.00 54.91 54.49 3ii6 h ALA 168 Cb -0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3ii6 h ALA 168 CO -0.05 0.68 -0.62 -0.22 0.00 0.00 0.00 179.25 179.05 3ii6 h LYS 169 N 0.50 0.11 0.00 0.00 1.63 -1.02 -2.07 116.57 115.72 3ii6 h LYS 169 Ca 0.02 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 3ii6 h LYS 169 Cb 1.08 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.72 3ii6 h LYS 169 CO 0.10 0.70 0.00 0.39 -3.45 0.00 0.00 179.45 177.19 3ii6 n GLU 170 N -3.83 0.04 0.00 1.90 1.02 -0.57 -2.08 120.64 117.12 3ii6 n GLU 170 Ca -0.02 0.16 0.07 0.00 -0.02 0.00 0.00 57.16 57.35 3ii6 n GLU 170 Cb 0.62 -1.56 0.02 0.00 -0.02 0.00 0.00 31.44 30.50 3ii6 n GLU 170 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ii6 n ALA 171 N -1.55 2.81 0.10 0.62 0.00 -0.82 -4.72 120.51 116.95 3ii6 n ALA 171 Ca 0.05 -0.53 -0.13 0.00 0.00 0.00 0.00 53.44 52.83 3ii6 n ALA 171 Cb 0.26 -0.46 -0.08 0.00 0.00 0.00 0.00 19.45 19.17 3ii6 n ALA 171 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3ii6 h LEU 172 N 1.92 -0.21 -0.48 0.00 5.85 -0.96 -2.89 115.31 118.53 3ii6 h LEU 172 Ca 0.00 -0.21 0.10 0.00 0.84 0.00 0.00 57.88 58.61 3ii6 h LEU 172 Cb 0.49 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.48 3ii6 h LEU 172 CO 0.00 0.10 -0.19 -0.08 -0.34 0.00 0.00 178.44 177.93 3ii6 h GLU 173 N -0.54 -0.08 -0.54 1.25 4.81 -1.85 -0.12 114.58 117.51 3ii6 h GLU 173 Ca -0.03 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 3ii6 h GLU 173 Cb 0.41 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 3ii6 h GLU 173 CO 0.04 -0.05 0.07 1.15 -0.73 0.00 0.00 179.01 179.50 3ii6 h THR 174 N -0.08 1.26 -0.33 0.32 2.02 -1.91 -1.31 112.91 112.88 3ii6 h THR 174 Ca 0.23 -0.98 0.07 0.00 0.77 0.00 0.00 66.41 66.50 3ii6 h THR 174 Cb 0.43 0.83 -0.08 0.00 -1.74 0.00 0.00 68.15 67.60 3ii6 h THR 174 CO -0.54 0.36 -0.19 -0.78 0.37 0.00 0.00 175.52 174.74 3ii6 h ASP 175 N 0.80 -0.64 0.12 4.18 -0.00 -1.20 -0.36 116.42 119.31 3ii6 h ASP 175 Ca 0.16 0.14 0.02 0.00 -0.00 0.00 0.00 57.03 57.35 3ii6 h ASP 175 Cb 0.43 0.33 -0.04 0.00 -0.00 0.00 0.00 39.33 40.05 3ii6 h ASP 175 CO 0.01 -0.23 -0.39 -0.07 -0.00 0.00 0.00 179.24 178.56 3ii6 h LEU 176 N -0.15 -1.15 -0.84 2.28 3.38 -0.82 -2.72 115.31 115.28 3ii6 h LEU 176 Ca 0.17 0.13 0.16 0.00 0.09 0.00 0.00 57.88 58.43 3ii6 h LEU 176 Cb 0.41 0.43 -0.15 0.00 0.09 0.00 0.00 40.66 41.44 3ii6 h LEU 176 CO -0.42 -0.47 -0.24 -1.22 0.09 0.00 0.00 178.44 176.18 3ii6 n TYR 177 N -5.45 0.24 0.16 1.13 4.02 -0.51 -0.14 117.16 116.61 3ii6 n TYR 177 Ca -0.07 1.02 0.01 0.00 -0.01 0.00 0.00 57.90 58.86 3ii6 n TYR 177 Cb 0.37 -0.95 0.32 0.00 -0.02 0.00 0.00 39.34 39.06 3ii6 n TYR 177 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 3ii6 h LYS 178 N 0.00 0.05 -0.00 -0.72 1.57 -0.87 -0.90 116.57 115.70 3ii6 h LYS 178 Ca 0.38 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 59.06 3ii6 h LYS 178 Cb 0.59 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.90 3ii6 h LYS 178 CO -0.86 0.43 -0.31 0.00 -0.57 0.00 0.00 179.45 178.15 3ii6 h ARG 179 N 0.05 0.21 -0.83 3.15 3.08 -0.23 -2.95 114.38 116.86 3ii6 h ARG 179 Ca 0.00 -0.23 0.18 0.00 0.07 0.00 0.00 59.98 60.00 3ii6 h ARG 179 Cb 0.70 0.06 -0.11 0.00 0.08 0.00 0.00 29.97 30.71 3ii6 h ARG 179 CO 0.05 0.95 0.36 0.74 -1.07 0.00 0.00 179.97 181.00 3ii6 h PHE 180 N -0.44 0.60 -0.35 3.04 0.05 -0.86 -2.50 116.94 116.49 3ii6 h PHE 180 Ca -0.04 0.04 -0.05 0.00 3.82 0.00 0.00 57.97 61.73 3ii6 h PHE 180 Cb 1.06 -0.14 -0.01 0.00 2.00 0.00 0.00 35.95 38.86 3ii6 h PHE 180 CO 0.17 0.03 0.00 0.82 -0.18 0.00 0.00 178.31 179.15 3ii6 h ILE 181 N 0.45 1.26 -0.51 -0.55 2.04 -1.15 -2.44 117.51 116.60 3ii6 h ILE 181 Ca 0.49 -0.97 -0.08 0.00 1.00 0.00 0.00 64.86 65.30 3ii6 h ILE 181 Cb 0.82 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 3ii6 h ILE 181 CO -0.46 0.32 0.01 -0.07 0.00 0.00 0.00 178.15 177.95 3ii6 h LEU 182 N 0.42 0.82 -0.31 1.44 3.38 -1.39 0.16 115.31 119.82 3ii6 h LEU 182 Ca 0.10 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 3ii6 h LEU 182 Cb 0.45 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3ii6 h LEU 182 CO 0.02 0.88 -0.09 0.58 0.09 0.00 0.00 178.44 179.92 3ii6 h VAL 183 N 0.80 1.28 -0.11 1.22 2.07 -1.35 -1.89 116.25 118.26 3ii6 h VAL 183 Ca 0.15 -1.15 -0.05 0.00 0.82 0.00 0.00 66.70 66.47 3ii6 h VAL 183 Cb 0.46 1.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3ii6 h VAL 183 CO 0.02 0.37 -0.14 -0.07 0.02 0.00 0.00 177.57 177.77 3ii6 h LEU 184 N 0.38 0.32 -1.56 2.57 3.38 -1.28 -1.17 115.31 117.96 3ii6 h LEU 184 Ca 0.08 -0.51 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 3ii6 h LEU 184 Cb 0.59 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3ii6 h LEU 184 CO 0.03 0.76 -0.23 0.78 0.09 0.00 0.00 178.44 179.87 3ii6 h ASN 185 N -0.12 0.00 -0.69 -0.43 2.35 -0.72 -0.00 115.58 115.97 3ii6 h ASN 185 Ca 0.01 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 3ii6 h ASN 185 Cb 0.68 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.02 3ii6 h ASN 185 CO 0.03 0.23 0.27 -0.33 -1.65 0.00 0.00 177.43 175.99 3ii6 h GLU 186 N 0.00 1.06 -0.59 0.81 5.08 -0.87 -1.57 114.58 118.50 3ii6 h GLU 186 Ca -0.00 -0.19 0.09 0.00 -1.00 0.00 0.00 59.36 58.26 3ii6 h GLU 186 Cb 0.44 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 3ii6 h GLU 186 CO 0.03 0.87 0.40 0.87 -1.00 0.00 0.00 179.01 180.18 3ii6 h LYS 187 N 1.03 0.41 0.11 2.33 1.79 0.19 -2.69 116.57 119.75 3ii6 h LYS 187 Ca 0.24 -0.02 -0.28 0.00 -2.18 0.00 0.00 60.65 58.41 3ii6 h LYS 187 Cb 0.22 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 30.77 3ii6 h LYS 187 CO -0.02 0.27 -1.31 0.87 -1.08 0.00 0.00 179.45 178.18 3ii6 h LYS 188 N 0.42 0.24 -0.97 3.15 1.57 -0.67 -1.84 116.57 118.47 3ii6 h LYS 188 Ca 0.27 -0.40 0.23 0.00 -1.87 0.00 0.00 60.65 58.87 3ii6 h LYS 188 Cb 0.51 0.15 -0.08 0.00 0.08 0.00 0.00 32.23 32.89 3ii6 h LYS 188 CO -0.08 1.16 0.63 1.15 -0.57 0.00 0.00 179.45 181.74 3ii6 h THR 189 N 0.06 0.63 0.01 -0.16 2.02 -0.96 -0.50 112.91 114.02 3ii6 h THR 189 Ca -0.16 -0.15 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 3ii6 h THR 189 Cb 1.97 0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 68.52 3ii6 h THR 189 CO 0.18 0.08 -0.23 0.50 0.37 0.00 0.00 175.52 176.43 3ii6 h LYS 190 N 0.44 0.03 -0.89 6.66 3.11 -1.42 -2.59 116.57 121.90 3ii6 h LYS 190 Ca 0.53 -0.05 0.24 0.00 -2.81 0.00 0.00 60.65 58.56 3ii6 h LYS 190 Cb 1.27 0.02 -0.15 0.00 -1.00 0.00 0.00 32.23 32.37 3ii6 h LYS 190 CO -0.24 1.02 0.15 0.82 -2.81 0.00 0.00 179.45 178.39 3ii6 h ILE 191 N -0.94 0.23 -0.41 2.00 2.04 -1.08 -1.24 117.51 118.11 3ii6 h ILE 191 Ca -0.05 -0.04 -0.09 0.00 1.00 0.00 0.00 64.86 65.68 3ii6 h ILE 191 Cb 1.10 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 3ii6 h ILE 191 CO -0.01 0.02 -0.11 0.03 0.00 0.00 0.00 178.15 178.08 3ii6 h ARG 192 N 0.12 0.72 0.01 2.37 3.08 -1.08 -0.51 114.38 119.09 3ii6 h ARG 192 Ca 0.55 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 60.34 3ii6 h ARG 192 Cb 1.12 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.10 3ii6 h ARG 192 CO -0.74 0.81 -0.11 1.03 -1.07 0.00 0.00 179.97 179.89 3ii6 h SER 193 N 0.65 0.09 -0.68 7.04 0.87 -0.96 -1.11 113.55 119.44 3ii6 h SER 193 Ca 0.11 -0.86 0.06 0.00 -1.23 0.00 0.00 61.79 59.87 3ii6 h SER 193 Cb 0.57 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.46 3ii6 h SER 193 CO 0.04 0.94 0.45 -0.07 -0.53 0.00 0.00 176.83 177.66 3ii6 h LEU 194 N -0.76 0.62 -0.04 2.23 3.38 -1.14 -1.63 115.31 117.97 3ii6 h LEU 194 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3ii6 h LEU 194 Cb 0.96 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 3ii6 h LEU 194 CO 0.02 0.40 -0.02 -0.74 0.09 0.00 0.00 178.44 178.19 3ii6 h HIS 195 N 0.70 0.10 -0.82 1.13 2.76 -1.03 -1.82 115.15 116.18 3ii6 h HIS 195 Ca 0.29 -0.02 0.13 0.00 -2.20 0.00 0.00 60.37 58.56 3ii6 h HIS 195 Cb 0.26 -0.02 -0.06 0.00 1.55 0.00 0.00 27.41 29.14 3ii6 h HIS 195 CO -0.00 0.47 0.53 -0.97 -1.30 0.00 0.00 177.93 176.66 3ii6 h ASN 196 N -0.29 0.59 0.47 3.26 -1.24 -1.04 -1.04 115.58 116.29 3ii6 h ASN 196 Ca 0.01 0.03 -0.18 0.00 0.71 0.00 0.00 56.30 56.87 3ii6 h ASN 196 Cb 0.44 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.39 3ii6 h ASN 196 CO 0.01 0.32 -0.76 0.11 -1.29 0.00 0.00 177.43 175.82 3ii6 h LYS 197 N 0.64 0.23 -0.04 6.67 1.57 -1.22 -1.60 116.57 122.81 3ii6 h LYS 197 Ca 0.40 -0.21 -0.07 0.00 -1.87 0.00 0.00 60.65 58.89 3ii6 h LYS 197 Cb 0.64 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 3ii6 h LYS 197 CO -0.16 0.89 -0.32 1.25 -0.57 0.00 0.00 179.45 180.54 3ii6 h LEU 198 N 0.15 0.08 0.35 2.94 5.85 -0.69 0.58 115.31 124.57 3ii6 h LEU 198 Ca -0.03 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 3ii6 h LEU 198 Cb 1.34 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.35 3ii6 h LEU 198 CO 0.12 0.40 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.38 3ii6 h LEU 199 N 0.07 -0.39 -2.66 2.25 3.38 -0.93 -1.28 115.31 115.75 3ii6 h LEU 199 Ca 0.01 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 3ii6 h LEU 199 Cb 0.61 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 3ii6 h LEU 199 CO 0.04 -0.02 -0.01 0.78 0.09 0.00 0.00 178.44 179.33 3ii6 h ASN 200 N -0.82 0.00 0.00 -0.43 2.35 -1.04 -3.51 115.58 112.13 3ii6 h ASN 200 Ca -0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3ii6 h ASN 200 Cb 0.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.89 3ii6 h ASN 200 CO 0.08 0.01 0.00 0.00 -1.65 0.00 0.00 177.43 175.86