#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x0r s GLY 3 N 0.00 1.88 0.02 -1.23 0.00 -1.26 -5.12 107.32 101.61 1x0r s GLY 3 Ca 0.00 -1.79 0.04 0.00 0.00 0.00 0.00 44.72 42.97 1x0r s GLY 3 CO 0.00 -1.53 -0.09 -0.45 0.00 0.00 0.00 173.10 171.03 1x0r s SER 4 N -3.31 4.48 0.14 1.64 0.15 -1.26 -5.11 113.70 110.43 1x0r s SER 4 Ca 0.37 -0.22 -0.07 0.00 0.70 0.00 0.00 55.95 56.74 1x0r s SER 4 Cb 0.06 -0.98 -0.02 0.00 -1.71 0.00 0.00 66.02 63.37 1x0r s SER 4 CO 0.16 0.26 0.20 0.27 1.20 0.00 0.00 173.24 175.34 1x0r s ILE 5 N -1.02 0.09 0.64 6.45 -4.36 -1.26 -3.62 121.20 118.11 1x0r s ILE 5 Ca 0.18 -1.52 -0.13 0.00 -0.26 0.00 0.00 60.65 58.92 1x0r s ILE 5 Cb -0.11 -1.82 -0.02 0.00 1.25 0.00 0.00 42.46 41.76 1x0r s ILE 5 CO 0.08 -0.41 1.05 -2.84 0.24 0.00 0.00 174.94 173.06 1x0r s PRO 6 N -3.97 3.22 0.29 0.37 0.02 -1.26 -5.03 135.00 128.64 1x0r s PRO 6 Ca 0.17 1.03 0.09 0.00 0.02 0.00 0.00 61.00 62.31 1x0r s PRO 6 Cb 0.05 -2.03 -0.04 0.00 0.02 0.00 0.00 34.50 32.50 1x0r s PRO 6 CO -0.01 -0.88 0.02 -0.51 -0.33 0.00 0.00 177.00 175.29 1x0r s LEU 7 N -5.00 3.14 0.46 -5.54 1.43 -1.26 -5.06 118.68 106.84 1x0r s LEU 7 Ca 0.60 -0.75 -0.24 0.00 -1.03 0.00 0.00 54.13 52.71 1x0r s LEU 7 Cb -0.14 -1.63 -0.07 0.00 0.03 0.00 0.00 46.19 44.38 1x0r s LEU 7 CO 0.46 -0.09 1.31 -0.63 0.23 0.00 0.00 176.35 177.63 1x0r s ILE 8 N -2.39 2.49 0.00 -0.59 1.01 -1.26 -0.99 121.20 119.47 1x0r s ILE 8 Ca 0.33 0.41 0.00 0.00 0.00 0.00 0.00 60.65 61.39 1x0r s ILE 8 Cb -0.05 -3.23 0.00 0.00 0.01 0.00 0.00 42.46 39.20 1x0r s ILE 8 CO 0.20 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.79 1x0r n GLY 9 N 0.63 3.16 3.88 6.18 0.00 0.13 -4.98 105.19 114.19 1x0r n GLY 9 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1x0r n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x0r s GLU 10 N -0.43 3.71 0.26 1.61 2.02 -0.16 -4.79 118.70 120.92 1x0r s GLU 10 Ca 0.00 0.44 -0.29 0.00 0.02 0.00 0.00 54.97 55.13 1x0r s GLU 10 Cb 0.00 -2.36 -0.09 0.00 0.10 0.00 0.00 34.13 31.78 1x0r s GLU 10 CO 0.00 -0.12 1.18 0.50 0.02 0.00 0.00 175.26 176.83 1x0r s ARG 11 N -4.17 4.53 0.36 1.61 3.52 -1.26 -1.00 118.95 122.54 1x0r s ARG 11 Ca 0.51 1.92 -0.27 0.00 -0.13 0.00 0.00 55.73 57.76 1x0r s ARG 11 Cb -0.10 -3.18 -0.12 0.00 -1.56 0.00 0.00 34.95 29.99 1x0r s ARG 11 CO 0.36 0.03 1.25 0.34 -0.81 0.00 0.00 175.30 176.47 1x0r n PHE 12 N 1.52 2.11 -1.70 5.12 7.35 0.14 -4.82 117.46 127.17 1x0r n PHE 12 Ca 0.01 0.55 -0.43 0.00 -0.76 0.00 0.00 57.45 56.82 1x0r n PHE 12 Cb 0.44 -2.38 -0.03 0.00 0.35 0.00 0.00 39.48 37.85 1x0r n PHE 12 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1x0r n PRO 13 N 0.42 2.70 -2.38 -7.13 -0.02 -1.26 -4.44 135.00 122.89 1x0r n PRO 13 Ca 0.06 0.98 -0.36 0.00 -2.02 0.00 0.00 63.50 62.15 1x0r n PRO 13 Cb 0.37 -2.83 -0.02 0.00 -0.02 0.00 0.00 33.50 31.00 1x0r n PRO 13 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1x0r s GLU 14 N 1.61 3.88 -0.07 -0.52 2.12 -1.26 -4.39 118.70 120.07 1x0r s GLU 14 Ca 0.78 1.64 0.05 0.00 0.36 0.00 0.00 54.97 57.79 1x0r s GLU 14 Cb -0.52 -2.40 -0.01 0.00 0.26 0.00 0.00 34.13 31.46 1x0r s GLU 14 CO 0.35 -0.42 -0.23 -1.21 -0.54 0.00 0.00 175.26 173.21 1x0r s GLU 16 N -2.71 2.54 0.08 4.30 2.02 -1.26 -5.00 118.70 118.67 1x0r s GLU 16 Ca 0.62 -0.83 0.03 0.00 0.02 0.00 0.00 54.97 54.81 1x0r s GLU 16 Cb -0.25 -2.08 -0.03 0.00 0.10 0.00 0.00 34.13 31.87 1x0r s GLU 16 CO 0.30 0.29 -0.10 0.14 0.02 0.00 0.00 175.26 175.91 1x0r s VAL 17 N 0.05 0.86 -0.19 2.63 -7.23 -0.55 -4.98 120.40 110.98 1x0r s VAL 17 Ca -0.09 -1.51 -0.11 0.00 -1.81 0.00 0.00 61.98 58.46 1x0r s VAL 17 Cb -0.15 -1.20 -0.05 0.00 0.56 0.00 0.00 36.38 35.54 1x0r s VAL 17 CO 0.05 -0.51 0.18 -0.89 -0.31 0.00 0.00 175.10 173.62 1x0r s THR 18 N -2.19 5.38 0.39 5.32 2.01 -1.26 -1.07 115.64 124.21 1x0r s THR 18 Ca 0.02 0.30 0.03 0.00 0.31 0.00 0.00 61.69 62.36 1x0r s THR 18 Cb -0.04 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.91 1x0r s THR 18 CO -0.00 0.42 0.09 0.42 -0.69 0.00 0.00 174.62 174.86 1x0r s THR 19 N 0.41 0.85 -2.01 -0.82 -4.23 -0.87 -0.44 115.64 108.53 1x0r s THR 19 Ca 0.11 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.68 1x0r s THR 19 Cb -0.12 -2.48 0.17 0.00 1.34 0.00 0.00 72.50 71.41 1x0r s THR 19 CO -0.00 0.00 1.21 -0.90 -0.54 0.00 0.00 174.62 174.39 1x0r n ASP 20 N -1.09 0.22 -0.36 3.99 5.68 -0.72 -1.54 116.55 122.72 1x0r n ASP 20 Ca -0.06 -1.85 0.05 0.00 -0.50 0.00 0.00 54.79 52.43 1x0r n ASP 20 Cb 0.66 -0.02 0.03 0.00 -1.14 0.00 0.00 41.12 40.64 1x0r n ASP 20 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1x0r n HIS 21 N -0.45 0.00 0.00 2.11 8.25 -1.26 -4.95 115.22 118.92 1x0r n HIS 21 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1x0r n HIS 21 Cb 0.05 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.16 1x0r n HIS 21 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x0r n GLY 22 N 0.66 1.84 3.74 -1.41 0.00 -0.59 -5.04 105.19 104.39 1x0r n GLY 22 Ca 0.05 -2.11 -0.41 0.00 0.00 0.00 0.00 46.02 43.55 1x0r n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x0r s VAL 23 N -1.50 4.36 0.05 1.61 1.01 -1.26 -2.05 120.40 122.62 1x0r s VAL 23 Ca 0.00 2.07 -0.01 0.00 0.00 0.00 0.00 61.98 64.04 1x0r s VAL 23 Cb 0.00 -4.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 1x0r s VAL 23 CO 0.00 0.37 -0.03 0.27 0.00 0.00 0.00 175.10 175.71 1x0r s ILE 24 N -0.36 0.21 -0.15 2.22 -4.36 -0.23 -4.97 121.20 113.56 1x0r s ILE 24 Ca 0.45 -1.71 -0.06 0.00 -0.26 0.00 0.00 60.65 59.07 1x0r s ILE 24 Cb -0.24 -1.39 -0.04 0.00 1.25 0.00 0.00 42.46 42.04 1x0r s ILE 24 CO 0.31 -0.95 0.07 -0.75 0.24 0.00 0.00 174.94 173.86 1x0r s LYS 25 N -3.67 3.65 0.00 0.37 2.20 -1.26 -1.48 119.74 119.55 1x0r s LYS 25 Ca 0.05 -0.30 0.01 0.00 -0.36 0.00 0.00 55.97 55.37 1x0r s LYS 25 Cb 0.06 -3.13 -0.04 0.00 -1.51 0.00 0.00 37.83 33.22 1x0r s LYS 25 CO -0.09 0.49 0.02 -0.51 -0.36 0.00 0.00 175.35 174.90 1x0r s LEU 26 N -0.24 3.61 0.00 5.43 1.43 -1.26 -0.24 118.68 127.40 1x0r s LEU 26 Ca 0.08 0.02 0.28 0.00 -1.03 0.00 0.00 54.13 53.49 1x0r s LEU 26 Cb -0.12 -2.09 1.16 0.00 0.03 0.00 0.00 46.19 45.16 1x0r s LEU 26 CO 0.01 0.27 1.82 -0.81 0.23 0.00 0.00 176.35 177.87 1x0r n PRO 27 N 1.30 0.67 -0.32 1.29 -0.04 -1.26 -4.19 135.00 132.44 1x0r n PRO 27 Ca -0.14 -0.25 0.18 0.00 -0.04 0.00 0.00 63.50 63.26 1x0r n PRO 27 Cb 0.53 -1.49 0.38 0.00 -0.04 0.00 0.00 33.50 32.88 1x0r n PRO 27 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1x0r h ASP 28 N 0.61 0.30 -0.79 3.54 5.19 -1.94 0.06 116.42 123.40 1x0r h ASP 28 Ca 0.00 0.19 0.06 0.00 -0.62 0.00 0.00 57.03 56.66 1x0r h ASP 28 Cb 0.38 0.18 -0.06 0.00 0.18 0.00 0.00 39.33 40.02 1x0r h ASP 28 CO 0.00 -0.12 0.47 -0.74 -3.12 0.00 0.00 179.24 175.73 1x0r h HIS 29 N 0.30 0.87 0.18 4.55 2.76 -0.96 -0.49 115.15 122.36 1x0r h HIS 29 Ca 0.65 0.03 -0.30 0.00 -2.20 0.00 0.00 60.37 58.54 1x0r h HIS 29 Cb 1.38 -0.27 0.02 0.00 1.55 0.00 0.00 27.41 30.09 1x0r h HIS 29 CO -0.12 0.42 -1.44 1.88 -1.30 0.00 0.00 177.93 177.37 1x0r h TYR 30 N 0.85 0.70 -0.55 5.26 -1.99 -1.24 -3.31 116.97 116.71 1x0r h TYR 30 Ca 0.35 -0.51 0.10 0.00 2.00 0.00 0.00 58.73 60.67 1x0r h TYR 30 Cb 0.20 -0.03 -0.08 0.00 2.00 0.00 0.00 36.73 38.82 1x0r h TYR 30 CO -0.05 1.56 0.08 0.28 -0.00 0.00 0.00 178.16 180.02 1x0r h VAL 31 N -0.06 0.64 0.00 -2.88 2.07 -1.31 0.36 116.25 115.07 1x0r h VAL 31 Ca -0.28 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 1x0r h VAL 31 Cb 1.96 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 32.15 1x0r h VAL 31 CO 0.17 0.04 -0.02 0.28 0.02 0.00 0.00 177.57 178.06 1x0r h SER 32 N 0.20 0.00 -0.39 0.57 0.02 -1.25 1.45 113.55 114.16 1x0r h SER 32 Ca 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.23 1x0r h SER 32 Cb 0.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.95 1x0r h SER 32 CO -0.39 0.02 0.00 0.00 -1.14 0.00 0.00 176.83 175.31 1x0r n GLN 33 N -3.40 2.53 -2.25 3.45 6.02 0.11 -4.94 117.38 118.90 1x0r n GLN 33 Ca -0.03 -2.31 -0.16 0.00 -0.01 0.00 0.00 57.00 54.50 1x0r n GLN 33 Cb 0.12 -1.52 -0.01 0.00 1.02 0.00 0.00 30.24 29.85 1x0r n GLN 33 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1x0r n GLY 34 N 1.52 -0.16 3.63 1.08 0.00 0.50 -4.99 105.19 106.76 1x0r n GLY 34 Ca 0.19 -0.20 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1x0r n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x0r s LYS 35 N -4.71 3.03 0.73 1.61 1.02 -0.01 -4.86 119.74 116.55 1x0r s LYS 35 Ca 0.00 -0.46 -0.11 0.00 0.02 0.00 0.00 55.97 55.42 1x0r s LYS 35 Cb 0.00 -2.76 0.03 0.00 -0.52 0.00 0.00 37.83 34.58 1x0r s LYS 35 CO 0.00 0.62 1.07 -1.58 -0.92 0.00 0.00 175.35 174.55 1x0r s TRP 36 N -0.67 3.01 0.04 3.18 0.52 -0.75 -3.81 118.94 120.46 1x0r s TRP 36 Ca 0.11 1.34 -0.03 0.00 0.02 0.00 0.00 56.10 57.54 1x0r s TRP 36 Cb -0.12 -2.96 -0.02 0.00 -1.15 0.00 0.00 33.47 29.22 1x0r s TRP 36 CO 0.02 -1.42 0.03 -0.59 0.02 0.00 0.00 176.95 175.02 1x0r s PHE 37 N -3.07 0.33 -0.25 -1.98 -0.12 0.13 -0.13 117.98 112.90 1x0r s PHE 37 Ca 0.59 -0.74 -0.01 0.00 -0.05 0.00 0.00 56.93 56.72 1x0r s PHE 37 Cb -0.14 -0.24 0.03 0.00 -0.63 0.00 0.00 43.02 42.04 1x0r s PHE 37 CO 0.55 -0.36 -0.08 0.08 -0.05 0.00 0.00 175.22 175.36 1x0r s VAL 38 N -3.06 2.72 -0.23 -2.49 1.01 0.14 -0.52 120.40 117.96 1x0r s VAL 38 Ca -0.01 -1.11 -0.13 0.00 0.00 0.00 0.00 61.98 60.73 1x0r s VAL 38 Cb 0.02 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 1x0r s VAL 38 CO -0.07 0.19 0.28 -0.22 0.00 0.00 0.00 175.10 175.27 1x0r s LEU 39 N 1.29 4.12 0.14 3.92 2.96 -0.72 -1.07 118.68 129.32 1x0r s LEU 39 Ca -0.01 0.28 0.06 0.00 -0.22 0.00 0.00 54.13 54.24 1x0r s LEU 39 Cb -0.17 -2.30 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 1x0r s LEU 39 CO -0.05 -0.02 -0.14 0.72 -1.32 0.00 0.00 176.35 175.54 1x0r s PHE 40 N 1.29 1.43 0.34 5.38 -0.12 0.65 -0.46 117.98 126.49 1x0r s PHE 40 Ca 0.13 -0.58 0.09 0.00 -0.05 0.00 0.00 56.93 56.51 1x0r s PHE 40 Cb -0.14 -0.73 -0.06 0.00 -0.63 0.00 0.00 43.02 41.45 1x0r s PHE 40 CO 0.07 0.17 -0.08 -1.54 -0.05 0.00 0.00 175.22 173.78 1x0r s SER 41 N -2.67 3.56 -0.02 1.98 1.04 -0.39 -1.08 113.70 116.11 1x0r s SER 41 Ca 0.12 -1.21 -0.18 0.00 0.48 0.00 0.00 55.95 55.16 1x0r s SER 41 Cb -0.03 -0.32 0.03 0.00 0.10 0.00 0.00 66.02 65.80 1x0r s SER 41 CO 0.03 -0.24 0.38 -1.38 0.98 0.00 0.00 173.24 173.01 1x0r s HIS 42 N -2.69 -0.27 0.13 5.02 -3.43 -0.20 -3.71 115.29 110.14 1x0r s HIS 42 Ca 0.32 0.44 -0.19 0.00 -0.80 0.00 0.00 55.06 54.83 1x0r s HIS 42 Cb 0.03 0.16 -0.03 0.00 -1.43 0.00 0.00 32.58 31.31 1x0r s HIS 42 CO 0.16 -0.43 1.75 -1.00 -2.00 0.00 0.00 174.74 173.21 1x0r h PRO 43 N 3.71 0.17 -1.89 -0.38 0.13 -1.72 -3.39 132.00 128.62 1x0r h PRO 43 Ca -0.29 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.81 1x0r h PRO 43 Cb 1.17 -0.04 -0.22 0.00 0.13 0.00 0.00 31.00 32.04 1x0r h PRO 43 CO 0.40 0.11 0.23 0.00 -0.23 0.00 0.00 178.00 178.51 1x0r s ALA 44 N -6.18 -1.83 0.77 -0.56 0.00 -1.26 -4.38 121.76 108.33 1x0r s ALA 44 Ca -0.13 1.84 -0.13 0.00 0.00 0.00 0.00 51.96 53.53 1x0r s ALA 44 Cb 0.10 -0.97 0.06 0.00 0.00 0.00 0.00 23.12 22.30 1x0r s ALA 44 CO 0.69 -0.32 1.17 -0.51 0.00 0.00 0.00 175.76 176.79 1x0r s ASP 45 N -0.05 4.02 -1.52 0.00 1.11 -1.26 -3.16 116.67 115.82 1x0r s ASP 45 Ca -0.02 2.21 -0.06 0.00 0.18 0.00 0.00 52.55 54.87 1x0r s ASP 45 Cb -0.04 -2.57 0.02 0.00 1.07 0.00 0.00 42.92 41.40 1x0r s ASP 45 CO 0.01 -2.37 0.62 0.49 1.18 0.00 0.00 175.17 175.11 1x0r n PHE 46 N -3.16 -2.00 -4.60 4.23 3.01 -1.26 -5.00 117.46 108.69 1x0r n PHE 46 Ca 0.12 0.54 -0.22 0.00 1.01 0.00 0.00 57.45 58.90 1x0r n PHE 46 Cb 0.51 -4.33 -0.15 0.00 -0.01 0.00 0.00 39.48 35.50 1x0r n PHE 46 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 1x0r s THR 47 N -3.16 1.05 0.07 4.37 2.01 -1.19 -5.09 115.64 113.70 1x0r s THR 47 Ca 0.33 -0.55 -0.21 0.00 0.31 0.00 0.00 61.69 61.57 1x0r s THR 47 Cb -0.15 -0.89 -0.11 0.00 0.01 0.00 0.00 72.50 71.36 1x0r s THR 47 CO 0.41 0.30 1.55 1.55 -0.69 0.00 0.00 174.62 177.74 1x0r h PRO 48 N 5.95 0.25 -0.86 4.92 0.13 -1.94 -0.77 132.00 139.67 1x0r h PRO 48 Ca -0.34 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1x0r h PRO 48 Cb 1.17 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 32.22 1x0r h PRO 48 CO 0.49 0.41 0.55 0.28 -0.23 0.00 0.00 178.00 179.50 1x0r h VAL 49 N 0.04 1.23 -0.77 1.56 2.07 -1.99 0.90 116.25 119.30 1x0r h VAL 49 Ca 0.05 -0.46 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 1x0r h VAL 49 Cb 0.28 -0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.00 1x0r h VAL 49 CO 0.00 0.23 0.46 0.00 0.02 0.00 0.00 177.57 178.29 1x0r h THR 51 N 1.05 1.20 -0.64 0.00 2.02 -0.07 0.47 112.91 116.95 1x0r h THR 51 Ca 0.28 -0.63 0.02 0.00 0.77 0.00 0.00 66.41 66.85 1x0r h THR 51 Cb -0.04 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 1x0r h THR 51 CO -0.05 0.23 0.42 0.71 0.37 0.00 0.00 175.52 177.20 1x0r h THR 52 N 0.57 1.12 -0.34 3.16 1.35 0.11 -1.98 112.91 116.89 1x0r h THR 52 Ca 0.15 -0.28 -0.16 0.00 -0.55 0.00 0.00 66.41 65.57 1x0r h THR 52 Cb 0.19 0.24 -0.00 0.00 -1.73 0.00 0.00 68.15 66.85 1x0r h THR 52 CO -0.01 0.15 -0.40 -0.33 -0.25 0.00 0.00 175.52 174.68 1x0r h GLU 53 N 0.81 0.87 -0.78 4.72 5.08 -0.13 -0.83 114.58 124.32 1x0r h GLU 53 Ca 0.25 -0.48 -0.04 0.00 -1.00 0.00 0.00 59.36 58.09 1x0r h GLU 53 Cb -0.01 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 1x0r h GLU 53 CO -0.06 1.13 0.35 0.74 -1.00 0.00 0.00 179.01 180.16 1x0r h PHE 54 N 0.67 1.15 -0.39 4.33 -1.00 -0.60 0.44 116.94 121.55 1x0r h PHE 54 Ca 0.05 -0.07 -0.12 0.00 2.81 0.00 0.00 57.97 60.64 1x0r h PHE 54 Cb 0.99 -0.35 -0.01 0.00 3.61 0.00 0.00 35.95 40.19 1x0r h PHE 54 CO 0.07 0.86 -0.24 0.28 -1.61 0.00 0.00 178.31 177.67 1x0r h VAL 55 N 1.12 1.27 -0.43 -0.55 2.07 -1.27 0.39 116.25 118.84 1x0r h VAL 55 Ca 0.26 -1.36 -0.06 0.00 0.82 0.00 0.00 66.70 66.36 1x0r h VAL 55 Cb 0.16 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1x0r h VAL 55 CO -0.03 0.45 0.03 -1.28 0.02 0.00 0.00 177.57 176.77 1x0r h SER 56 N 0.68 0.72 -0.52 0.57 0.87 -0.33 0.29 113.55 115.83 1x0r h SER 56 Ca 0.09 -0.29 -0.05 0.00 -1.23 0.00 0.00 61.79 60.32 1x0r h SER 56 Cb 0.76 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.51 1x0r h SER 56 CO 0.06 0.83 0.14 -0.26 -0.53 0.00 0.00 176.83 177.06 1x0r h PHE 57 N 0.58 0.86 -0.98 2.24 -1.00 0.14 -2.21 116.94 116.57 1x0r h PHE 57 Ca 0.13 -0.10 0.02 0.00 2.81 0.00 0.00 57.97 60.83 1x0r h PHE 57 Cb 0.44 -0.24 -0.05 0.00 3.61 0.00 0.00 35.95 39.70 1x0r h PHE 57 CO 0.03 0.75 0.65 0.00 -1.61 0.00 0.00 178.31 178.13 1x0r h ALA 58 N 1.01 1.33 0.00 2.45 0.00 -0.08 -0.57 119.26 123.39 1x0r h ALA 58 Ca 0.16 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1x0r h ALA 58 Cb 0.32 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1x0r h ALA 58 CO -0.00 0.61 0.00 0.00 0.00 0.00 0.00 179.25 179.86 1x0r h ARG 59 N 1.30 0.00 -0.67 0.00 3.08 0.00 -2.57 114.38 115.52 1x0r h ARG 59 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 1x0r h ARG 59 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.96 1x0r h ARG 59 CO -0.10 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.34 1x0r n ARG 60 N -2.60 2.88 -0.31 0.04 1.74 -0.83 -4.64 116.66 112.94 1x0r n ARG 60 Ca 0.04 -2.61 -0.02 0.00 -0.77 0.00 0.00 57.85 54.49 1x0r n ARG 60 Cb 0.40 -1.57 0.15 0.00 -1.02 0.00 0.00 32.46 30.42 1x0r n ARG 60 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 1x0r h TYR 61 N 3.92 1.15 -0.50 -1.55 3.20 -0.69 -0.30 116.97 122.20 1x0r h TYR 61 Ca 0.00 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.82 1x0r h TYR 61 Cb 1.01 -0.38 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 1x0r h TYR 61 CO 0.49 0.74 0.07 1.49 -1.64 0.00 0.00 178.16 179.30 1x0r h GLU 62 N 1.22 0.79 -0.43 1.82 4.81 -1.82 0.27 114.58 121.24 1x0r h GLU 62 Ca 0.32 -0.18 -0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1x0r h GLU 62 Cb -0.10 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.15 1x0r h GLU 62 CO -0.07 0.75 -0.02 -0.44 -0.73 0.00 0.00 179.01 178.50 1x0r h ASP 63 N 0.75 0.68 -0.12 1.04 5.19 -1.41 0.33 116.42 122.88 1x0r h ASP 63 Ca 0.16 -0.16 -0.23 0.00 -0.62 0.00 0.00 57.03 56.18 1x0r h ASP 63 Cb 0.36 -0.18 0.01 0.00 0.18 0.00 0.00 39.33 39.70 1x0r h ASP 63 CO 0.01 0.76 -0.81 -0.26 -3.12 0.00 0.00 179.24 175.82 1x0r h PHE 64 N 0.66 1.05 -0.53 4.55 -1.00 -0.55 -3.09 116.94 118.03 1x0r h PHE 64 Ca 0.13 -0.49 0.03 0.00 2.81 0.00 0.00 57.97 60.45 1x0r h PHE 64 Cb 0.45 -0.15 -0.04 0.00 3.61 0.00 0.00 35.95 39.82 1x0r h PHE 64 CO 0.02 1.32 0.30 1.96 -1.61 0.00 0.00 178.31 180.30 1x0r h GLN 65 N 0.48 0.58 -0.75 1.51 4.20 0.18 0.06 115.11 121.37 1x0r h GLN 65 Ca -0.07 -0.04 0.19 0.00 0.06 0.00 0.00 58.65 58.80 1x0r h GLN 65 Cb 1.45 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 29.06 1x0r h GLN 65 CO 0.17 0.39 0.53 0.00 -0.67 0.00 0.00 178.83 179.24 1x0r h ARG 66 N 0.60 0.15 -7.14 1.46 3.08 -0.32 -3.37 114.38 108.85 1x0r h ARG 66 Ca 0.22 -0.01 -0.46 0.00 0.07 0.00 0.00 59.98 59.80 1x0r h ARG 66 Cb 0.05 -0.03 0.08 0.00 0.08 0.00 0.00 29.97 30.14 1x0r h ARG 66 CO -0.11 0.10 0.12 -0.51 -1.07 0.00 0.00 179.97 178.50 1x0r s LEU 67 N -8.93 3.00 -1.10 3.04 1.43 -0.69 -4.93 118.68 110.49 1x0r s LEU 67 Ca -0.06 -0.04 -0.07 0.00 -1.03 0.00 0.00 54.13 52.92 1x0r s LEU 67 Cb 0.21 -2.48 0.29 0.00 0.03 0.00 0.00 46.19 44.23 1x0r s LEU 67 CO 0.76 -1.69 1.23 0.61 0.23 0.00 0.00 176.35 177.49 1x0r n GLY 68 N -2.80 4.53 3.17 -3.19 0.00 -1.26 -4.92 105.19 100.73 1x0r n GLY 68 Ca 0.12 -2.62 -0.27 0.00 0.00 0.00 0.00 46.02 43.25 1x0r n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x0r s VAL 69 N -1.79 1.56 0.28 1.61 1.01 -0.08 -1.81 120.40 121.18 1x0r s VAL 69 Ca 0.31 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.57 1x0r s VAL 69 Cb -0.05 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 1x0r s VAL 69 CO -0.02 0.44 0.13 -0.62 0.00 0.00 0.00 175.10 175.03 1x0r s ASP 70 N -0.11 5.01 -0.05 3.32 -1.08 0.82 -3.89 116.67 120.70 1x0r s ASP 70 Ca -0.01 -0.50 0.05 0.00 -0.52 0.00 0.00 52.55 51.56 1x0r s ASP 70 Cb -0.11 -1.05 -0.02 0.00 -1.46 0.00 0.00 42.92 40.28 1x0r s ASP 70 CO 0.02 -0.10 -0.18 -0.76 0.52 0.00 0.00 175.17 174.67 1x0r s LEU 71 N -3.80 2.54 -0.02 -1.34 1.43 -1.26 -0.69 118.68 115.53 1x0r s LEU 71 Ca 0.34 -0.28 -0.01 0.00 -1.03 0.00 0.00 54.13 53.15 1x0r s LEU 71 Cb -0.06 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.68 1x0r s LEU 71 CO 0.23 0.33 0.06 -0.51 0.23 0.00 0.00 176.35 176.69 1x0r s ILE 72 N -0.64 -0.02 0.22 -0.59 2.07 -0.23 -4.09 121.20 117.91 1x0r s ILE 72 Ca 0.10 0.08 0.03 0.00 -1.41 0.00 0.00 60.65 59.45 1x0r s ILE 72 Cb -0.11 -0.10 0.03 0.00 0.13 0.00 0.00 42.46 42.42 1x0r s ILE 72 CO 0.00 0.03 0.28 0.61 -1.91 0.00 0.00 174.94 173.96 1x0r n GLY 73 N 3.49 2.08 3.62 1.50 0.00 0.10 -0.26 105.19 115.72 1x0r n GLY 73 Ca -0.18 -2.17 -0.03 0.00 0.00 0.00 0.00 46.02 43.63 1x0r n GLY 73 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x0r s LEU 74 N 0.00 -0.67 0.29 0.99 1.98 -0.24 -0.37 118.68 120.66 1x0r s LEU 74 Ca 0.22 1.05 -0.09 0.00 -2.89 0.00 0.00 54.13 52.41 1x0r s LEU 74 Cb -0.02 1.94 0.00 0.00 0.66 0.00 0.00 46.19 48.78 1x0r s LEU 74 CO 0.14 -0.16 0.48 -0.94 -1.89 0.00 0.00 176.35 173.98 1x0r s SER 75 N 1.60 0.28 0.00 3.68 1.04 -0.93 -1.04 113.70 118.33 1x0r s SER 75 Ca -0.09 -1.17 0.21 0.00 0.48 0.00 0.00 55.95 55.38 1x0r s SER 75 Cb -0.05 0.62 1.07 0.00 0.10 0.00 0.00 66.02 67.77 1x0r s SER 75 CO -0.17 -1.22 1.65 1.33 0.98 0.00 0.00 173.24 175.81 1x0r n VAL 76 N -0.45 0.32 -0.88 5.02 0.24 -1.26 -1.59 118.33 119.73 1x0r n VAL 76 Ca -0.01 0.08 -0.30 0.00 -2.04 0.00 0.00 64.34 62.07 1x0r n VAL 76 Cb 0.62 -0.74 0.18 0.00 -1.47 0.00 0.00 33.84 32.43 1x0r n VAL 76 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1x0r s ASP 77 N -2.49 2.59 0.78 -1.34 1.11 -1.26 -2.96 116.67 113.10 1x0r s ASP 77 Ca 0.21 1.68 -0.11 0.00 0.18 0.00 0.00 52.55 54.52 1x0r s ASP 77 Cb 0.14 -2.32 0.08 0.00 1.07 0.00 0.00 42.92 41.89 1x0r s ASP 77 CO 0.30 -3.23 1.14 -0.94 1.18 0.00 0.00 175.17 173.62 1x0r s SER 78 N -2.96 4.55 0.45 0.27 1.04 -1.26 -3.37 113.70 112.43 1x0r s SER 78 Ca 0.66 0.67 0.22 0.00 0.48 0.00 0.00 55.95 57.98 1x0r s SER 78 Cb -0.21 -1.20 1.09 0.00 0.10 0.00 0.00 66.02 65.80 1x0r s SER 78 CO 0.59 -1.84 1.93 -0.37 0.98 0.00 0.00 173.24 174.53 1x0r h VAL 79 N -0.94 0.76 -0.11 5.02 -1.51 -1.94 -2.06 116.25 115.46 1x0r h VAL 79 Ca -0.45 -0.93 -0.05 0.00 -1.23 0.00 0.00 66.70 64.03 1x0r h VAL 79 Cb 1.32 1.57 -0.00 0.00 -2.13 0.00 0.00 31.29 32.05 1x0r h VAL 79 CO 0.64 0.22 -0.13 -0.26 -1.23 0.00 0.00 177.57 176.81 1x0r h PHE 80 N 0.00 0.35 -0.96 5.19 -1.00 -2.00 0.13 116.94 118.65 1x0r h PHE 80 Ca -0.00 -0.11 0.00 0.00 2.81 0.00 0.00 57.97 60.67 1x0r h PHE 80 Cb 0.55 -0.07 -0.05 0.00 3.61 0.00 0.00 35.95 39.99 1x0r h PHE 80 CO 0.00 0.72 0.62 0.77 -1.61 0.00 0.00 178.31 178.81 1x0r h SER 81 N -0.12 1.12 -0.18 2.17 0.02 -1.88 -1.32 113.55 113.37 1x0r h SER 81 Ca 0.02 -0.04 0.03 0.00 -0.84 0.00 0.00 61.79 60.95 1x0r h SER 81 Cb 0.67 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 1x0r h SER 81 CO 0.03 0.83 0.02 0.45 -1.14 0.00 0.00 176.83 177.02 1x0r h HIS 82 N 1.31 0.03 -0.23 3.45 3.86 -0.89 0.50 115.15 123.18 1x0r h HIS 82 Ca 0.35 0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.47 1x0r h HIS 82 Cb -0.12 0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.35 1x0r h HIS 82 CO 0.00 -0.00 -0.31 0.82 0.86 0.00 0.00 177.93 179.30 1x0r h ILE 83 N 0.09 1.28 -0.36 2.45 2.04 -0.57 -0.90 117.51 121.54 1x0r h ILE 83 Ca 0.08 -1.36 -0.14 0.00 1.00 0.00 0.00 64.86 64.44 1x0r h ILE 83 Cb 0.09 1.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1x0r h ILE 83 CO -0.13 0.43 -0.33 0.11 0.00 0.00 0.00 178.15 178.24 1x0r h LYS 84 N 0.40 0.81 -0.51 2.37 1.79 -0.73 0.14 116.57 120.84 1x0r h LYS 84 Ca 0.05 -0.39 -0.09 0.00 -2.18 0.00 0.00 60.65 58.04 1x0r h LYS 84 Cb 0.74 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.36 1x0r h LYS 84 CO 0.06 1.02 -0.05 2.35 -1.08 0.00 0.00 179.45 181.74 1x0r h TRP 85 N 0.68 0.98 -0.40 -1.35 7.01 0.49 -0.18 115.95 123.17 1x0r h TRP 85 Ca 0.07 -0.17 -0.09 0.00 2.11 0.00 0.00 58.89 60.82 1x0r h TRP 85 Cb 0.88 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.67 1x0r h TRP 85 CO 0.05 0.91 -0.09 0.87 -2.79 0.00 0.00 178.44 177.38 1x0r h LYS 86 N 0.82 0.77 -0.77 2.65 1.57 -0.89 -0.97 116.57 119.75 1x0r h LYS 86 Ca 0.14 -0.29 0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1x0r h LYS 86 Cb 0.56 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.77 1x0r h LYS 86 CO 0.03 0.90 0.48 0.93 -0.57 0.00 0.00 179.45 181.23 1x0r h GLU 87 N 0.59 0.90 -0.52 3.15 5.08 -0.37 -2.20 114.58 121.20 1x0r h GLU 87 Ca 0.10 -0.05 0.05 0.00 -1.00 0.00 0.00 59.36 58.45 1x0r h GLU 87 Cb 0.61 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.62 1x0r h GLU 87 CO 0.04 0.59 0.27 2.35 -1.00 0.00 0.00 179.01 181.26 1x0r h TRP 88 N 0.92 0.49 -0.09 4.33 7.01 -0.53 0.14 115.95 128.22 1x0r h TRP 88 Ca 0.31 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.33 1x0r h TRP 88 Cb 0.05 -0.14 -0.00 0.00 -2.10 0.00 0.00 29.16 26.96 1x0r h TRP 88 CO -0.04 0.24 0.05 0.82 -2.79 0.00 0.00 178.44 176.72 1x0r h ILE 89 N 0.52 1.08 -0.56 2.65 2.04 -1.03 0.34 117.51 122.54 1x0r h ILE 89 Ca 0.23 -0.22 0.04 0.00 1.00 0.00 0.00 64.86 65.91 1x0r h ILE 89 Cb 0.14 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 1x0r h ILE 89 CO -0.16 0.07 0.31 -0.08 0.00 0.00 0.00 178.15 178.29 1x0r h GLU 90 N 0.06 0.58 -0.16 2.37 4.81 -1.15 0.44 114.58 121.53 1x0r h GLU 90 Ca 0.03 -0.03 -0.21 0.00 -0.13 0.00 0.00 59.36 59.01 1x0r h GLU 90 Cb 0.07 -0.13 0.01 0.00 0.63 0.00 0.00 28.75 29.32 1x0r h GLU 90 CO -0.01 0.38 -0.74 -0.09 -0.73 0.00 0.00 179.01 177.83 1x0r h ARG 91 N 0.60 0.74 0.00 1.92 2.43 -0.65 -1.71 114.38 117.71 1x0r h ARG 91 Ca 0.24 -0.58 -0.04 0.00 -0.81 0.00 0.00 59.98 58.79 1x0r h ARG 91 Cb 0.11 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1x0r h ARG 91 CO -0.14 1.20 -1.92 0.72 -1.51 0.00 0.00 179.97 178.31 1x0r n HIS 92 N -3.93 0.00 -0.00 2.20 8.25 0.12 -4.41 115.22 117.45 1x0r n HIS 92 Ca -0.06 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.45 1x0r n HIS 92 Cb 0.72 -0.49 -0.08 0.00 1.12 0.00 0.00 29.99 31.26 1x0r n HIS 92 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1x0r n ILE 93 N -2.23 0.00 -0.75 1.59 5.41 0.15 -4.60 119.36 118.94 1x0r n ILE 93 Ca -0.06 -0.24 0.00 0.00 1.00 0.00 0.00 62.75 63.45 1x0r n ILE 93 Cb 0.57 0.27 0.00 0.00 -0.71 0.00 0.00 39.64 39.77 1x0r n ILE 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1x0r n GLY 94 N 1.90 0.55 3.28 7.39 0.00 -0.64 -4.84 105.19 112.82 1x0r n GLY 94 Ca -0.02 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.94 1x0r n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x0r s VAL 95 N -2.00 2.45 -0.08 1.61 1.01 -1.22 -4.95 120.40 117.23 1x0r s VAL 95 Ca 0.00 -0.87 -0.15 0.00 0.00 0.00 0.00 61.98 60.96 1x0r s VAL 95 Cb 0.00 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.35 1x0r s VAL 95 CO 0.00 0.54 0.38 -0.60 0.00 0.00 0.00 175.10 175.42 1x0r s ARG 96 N 0.38 4.07 -0.28 2.72 6.06 -1.26 -2.62 118.95 128.01 1x0r s ARG 96 Ca -0.15 0.30 -0.19 0.00 -2.50 0.00 0.00 55.73 53.19 1x0r s ARG 96 Cb -0.17 -3.32 -0.02 0.00 0.06 0.00 0.00 34.95 31.50 1x0r s ARG 96 CO 0.07 0.46 0.58 0.42 -2.50 0.00 0.00 175.30 174.33 1x0r s ILE 97 N -0.30 5.00 -2.92 4.11 -1.09 -1.26 -4.90 121.20 119.84 1x0r s ILE 97 Ca 0.22 0.89 0.24 0.00 -2.23 0.00 0.00 60.65 59.77 1x0r s ILE 97 Cb -0.15 -3.92 0.24 0.00 -1.58 0.00 0.00 42.46 37.05 1x0r s ILE 97 CO 0.10 -0.02 1.31 -0.81 -1.23 0.00 0.00 174.94 174.28 1x0r n PRO 98 N 5.71 2.28 -4.11 2.79 -0.04 -1.26 -4.95 135.00 135.42 1x0r n PRO 98 Ca -0.02 -1.87 -0.23 0.00 -0.04 0.00 0.00 63.50 61.34 1x0r n PRO 98 Cb 0.49 -1.46 -0.06 0.00 -0.04 0.00 0.00 33.50 32.42 1x0r n PRO 98 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1x0r s PHE 99 N -1.97 2.69 0.80 0.54 -0.12 -1.26 -5.09 117.98 113.57 1x0r s PHE 99 Ca 0.30 -0.40 -0.11 0.00 -0.05 0.00 0.00 56.93 56.66 1x0r s PHE 99 Cb 0.20 -1.66 0.07 0.00 -0.63 0.00 0.00 43.02 41.00 1x0r s PHE 99 CO 0.30 0.33 1.10 -1.25 -0.05 0.00 0.00 175.22 175.65 1x0r s PRO 100 N -3.85 2.08 -0.07 1.99 0.04 -1.26 -4.88 135.00 129.05 1x0r s PRO 100 Ca 0.38 0.66 0.00 0.00 0.04 0.00 0.00 61.00 62.08 1x0r s PRO 100 Cb -0.02 -1.92 0.02 0.00 0.04 0.00 0.00 34.50 32.63 1x0r s PRO 100 CO 0.23 -1.63 -0.06 0.42 0.04 0.00 0.00 177.00 176.00 1x0r s ILE 101 N -3.14 0.75 0.39 0.56 1.01 -1.26 -0.72 121.20 118.79 1x0r s ILE 101 Ca 0.61 -0.19 -0.26 0.00 0.00 0.00 0.00 60.65 60.81 1x0r s ILE 101 Cb -0.15 -0.78 -0.09 0.00 0.01 0.00 0.00 42.46 41.46 1x0r s ILE 101 CO 0.54 0.30 1.15 -0.63 0.00 0.00 0.00 174.94 176.29 1x0r s ILE 102 N 1.27 3.27 -0.20 2.92 1.01 0.50 -1.76 121.20 128.21 1x0r s ILE 102 Ca -0.05 1.07 -0.06 0.00 0.00 0.00 0.00 60.65 61.62 1x0r s ILE 102 Cb -0.14 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.70 1x0r s ILE 102 CO -0.02 0.11 0.02 0.00 0.00 0.00 0.00 174.94 175.05 1x0r s ALA 103 N -1.42 3.13 -0.41 9.38 0.00 0.41 -2.19 121.76 130.65 1x0r s ALA 103 Ca 0.56 -0.96 0.11 0.00 0.00 0.00 0.00 51.96 51.67 1x0r s ALA 103 Cb -0.30 -1.85 0.35 0.00 0.00 0.00 0.00 23.12 21.33 1x0r s ALA 103 CO 0.37 -0.13 0.78 -3.47 0.00 0.00 0.00 175.76 173.32 1x0r n ASP 104 N 4.20 1.61 -0.43 0.00 4.64 -0.62 -4.53 116.55 121.42 1x0r n ASP 104 Ca -0.17 -3.14 0.00 0.00 -1.38 0.00 0.00 54.79 50.10 1x0r n ASP 104 Cb 0.52 -0.60 0.00 0.00 -1.04 0.00 0.00 41.12 39.99 1x0r n ASP 104 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 1x0r n PRO 105 N 0.16 0.03 0.00 -0.67 -0.01 -1.16 -1.44 135.00 131.91 1x0r n PRO 105 Ca 0.26 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.75 1x0r n PRO 105 Cb 0.61 -1.01 0.00 0.00 -0.01 0.00 0.00 33.50 33.09 1x0r n PRO 105 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 175.50 176.53 1x0r n GLN 106 N 0.34 0.00 -0.98 -0.52 1.13 -1.26 -4.94 117.38 111.15 1x0r n GLN 106 Ca 0.00 -0.25 0.00 0.00 -1.94 0.00 0.00 57.00 54.81 1x0r n GLN 106 Cb 0.01 -0.38 0.00 0.00 0.11 0.00 0.00 30.24 29.98 1x0r n GLN 106 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1x0r n GLY 107 N 0.00 0.49 0.21 1.08 0.00 -0.52 -4.91 105.19 101.54 1x0r n GLY 107 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1x0r n GLY 107 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1x0r h THR 108 N 0.00 0.57 -0.30 2.61 2.02 -1.92 0.77 112.91 116.66 1x0r h THR 108 Ca 0.00 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.10 1x0r h THR 108 Cb 0.15 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1x0r h THR 108 CO 0.00 0.00 -0.14 0.58 0.37 0.00 0.00 175.52 176.33 1x0r h VAL 109 N -0.24 1.29 -0.47 3.16 2.07 -1.91 -2.50 116.25 117.66 1x0r h VAL 109 Ca 0.08 -1.24 0.04 0.00 0.82 0.00 0.00 66.70 66.40 1x0r h VAL 109 Cb 0.35 1.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.54 1x0r h VAL 109 CO -0.21 0.40 0.24 0.00 0.02 0.00 0.00 177.57 178.01 1x0r h ALA 110 N 0.76 0.59 -0.81 1.67 0.00 -1.73 -1.44 119.26 118.29 1x0r h ALA 110 Ca 0.07 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1x0r h ALA 110 Cb 0.66 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1x0r h ALA 110 CO 0.04 -0.11 0.51 0.00 0.00 0.00 0.00 179.25 179.69 1x0r h ARG 111 N 0.47 0.96 -0.20 0.00 3.08 0.66 0.30 114.38 119.66 1x0r h ARG 111 Ca 0.20 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 1x0r h ARG 111 Cb 0.11 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 1x0r h ARG 111 CO -0.14 0.64 0.08 0.00 -1.07 0.00 0.00 179.97 179.47 1x0r h ARG 112 N 0.99 0.27 -0.02 0.04 3.08 -0.93 -2.37 114.38 115.44 1x0r h ARG 112 Ca 0.33 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1x0r h ARG 112 Cb 0.04 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1x0r h ARG 112 CO -0.12 0.23 -0.26 1.28 -1.07 0.00 0.00 179.97 180.02 1x0r n LEU 113 N -4.45 2.24 -2.16 3.04 4.77 -0.61 -4.28 117.00 115.55 1x0r n LEU 113 Ca -0.00 -0.85 -0.12 0.00 -0.03 0.00 0.00 56.01 55.01 1x0r n LEU 113 Cb 0.12 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.25 1x0r n LEU 113 CO 0.35 0.40 0.12 0.61 -1.33 0.00 0.00 177.39 177.54 1x0r n GLY 114 N 1.28 0.14 0.63 -0.72 0.00 0.80 -4.65 105.19 102.68 1x0r n GLY 114 Ca 0.10 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 46.05 1x0r n GLY 114 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x0r n LEU 115 N -2.84 2.31 -4.42 0.99 4.77 0.31 -4.73 117.00 113.39 1x0r n LEU 115 Ca -0.02 -0.84 -0.44 0.00 -0.03 0.00 0.00 56.01 54.68 1x0r n LEU 115 Cb 0.54 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 1x0r n LEU 115 CO 0.34 0.41 0.29 -0.76 -1.33 0.00 0.00 177.39 176.34 1x0r s LEU 116 N -2.30 5.21 0.00 2.23 1.43 -1.26 -1.33 118.68 122.67 1x0r s LEU 116 Ca 0.21 -1.12 0.00 0.00 -1.03 0.00 0.00 54.13 52.19 1x0r s LEU 116 Cb 0.18 -2.36 0.00 0.00 0.03 0.00 0.00 46.19 44.04 1x0r s LEU 116 CO 0.48 -0.89 0.00 1.41 0.23 0.00 0.00 176.35 177.58 1x0r n HIS 117 N 6.00 -1.14 0.45 0.29 8.25 -1.26 -4.97 115.22 122.83 1x0r n HIS 117 Ca -0.08 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.50 1x0r n HIS 117 Cb 0.44 0.00 0.18 0.00 1.12 0.00 0.00 29.99 31.73 1x0r n HIS 117 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x0r h ALA 118 N 0.02 0.68 0.00 -1.41 0.00 -1.98 -3.22 119.26 113.35 1x0r h ALA 118 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1x0r h ALA 118 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1x0r h ALA 118 CO 0.00 0.00 -0.00 0.93 0.00 0.00 0.00 179.25 180.18 1x0r h GLU 119 N 0.00 0.00 -2.03 0.00 5.08 -1.95 -3.42 114.58 112.26 1x0r h GLU 119 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1x0r h GLU 119 Cb 0.83 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.86 1x0r h GLU 119 CO 0.00 0.00 0.01 0.45 -1.00 0.00 0.00 179.01 178.47 1x0r s SER 120 N -5.34 -0.92 0.00 1.42 0.15 -1.22 -4.97 113.70 102.82 1x0r s SER 120 Ca -0.04 1.49 0.29 0.00 0.70 0.00 0.00 55.95 58.39 1x0r s SER 120 Cb 0.12 1.36 1.23 0.00 -1.71 0.00 0.00 66.02 67.03 1x0r s SER 120 CO 0.45 -0.24 1.87 0.00 1.20 0.00 0.00 173.24 176.52 1x0r n ALA 121 N 4.27 2.70 -0.05 5.45 0.00 -1.26 -4.24 120.51 127.38 1x0r n ALA 121 Ca -0.20 -0.22 -0.05 0.00 0.00 0.00 0.00 53.44 52.97 1x0r n ALA 121 Cb 0.59 -1.37 -0.07 0.00 0.00 0.00 0.00 19.45 18.59 1x0r n ALA 121 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1x0r n THR 122 N -1.17 0.66 -4.43 0.00 5.66 -1.26 -5.03 114.28 108.70 1x0r n THR 122 Ca 0.12 -0.37 -0.29 0.00 -3.05 0.00 0.00 64.05 60.46 1x0r n THR 122 Cb 0.28 -0.79 -0.13 0.00 -1.55 0.00 0.00 70.33 68.15 1x0r n THR 122 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 1x0r s HIS 123 N -2.23 2.41 0.79 1.09 4.02 -1.26 -4.91 115.29 115.20 1x0r s HIS 123 Ca -0.07 -0.33 -0.11 0.00 1.02 0.00 0.00 55.06 55.57 1x0r s HIS 123 Cb 0.03 -1.32 0.06 0.00 -1.02 0.00 0.00 32.58 30.34 1x0r s HIS 123 CO 0.36 0.33 1.09 0.95 1.02 0.00 0.00 174.74 178.49 1x0r s THR 124 N -1.05 3.26 0.00 1.30 -4.23 -1.26 -4.67 115.64 108.99 1x0r s THR 124 Ca 0.15 0.41 0.00 0.00 -1.18 0.00 0.00 61.69 61.07 1x0r s THR 124 Cb -0.10 -3.09 0.00 0.00 1.34 0.00 0.00 72.50 70.65 1x0r s THR 124 CO 0.07 -0.54 0.00 1.33 -0.54 0.00 0.00 174.62 174.94 1x0r n VAL 125 N -3.44 0.00 -3.46 2.29 0.24 -0.44 -3.20 118.33 110.31 1x0r n VAL 125 Ca 0.07 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.96 1x0r n VAL 125 Cb 0.55 -1.99 -0.03 0.00 -1.47 0.00 0.00 33.84 30.91 1x0r n VAL 125 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1x0r s ARG 126 N -2.01 3.79 0.47 7.34 0.52 -0.39 -3.79 118.95 124.87 1x0r s ARG 126 Ca 0.00 -3.21 -0.03 0.00 -0.52 0.00 0.00 55.73 51.97 1x0r s ARG 126 Cb 0.00 -4.30 -0.02 0.00 0.52 0.00 0.00 34.95 31.15 1x0r s ARG 126 CO 0.00 -1.25 0.73 0.20 0.02 0.00 0.00 175.30 175.00 1x0r s GLY 127 N 0.76 1.50 -0.04 -3.53 0.00 -1.24 -1.67 107.32 103.09 1x0r s GLY 127 Ca 0.29 -0.75 -0.02 0.00 0.00 0.00 0.00 44.72 44.24 1x0r s GLY 127 CO -0.10 -0.58 0.09 0.14 0.00 0.00 0.00 173.10 172.65 1x0r s VAL 128 N -2.66 -0.06 -0.14 1.40 1.01 0.65 -1.26 120.40 119.33 1x0r s VAL 128 Ca 0.47 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.66 1x0r s VAL 128 Cb -0.10 -0.17 -0.01 0.00 0.00 0.00 0.00 36.38 36.10 1x0r s VAL 128 CO 0.42 0.09 -0.15 -0.36 0.00 0.00 0.00 175.10 175.09 1x0r s PHE 129 N 1.19 2.78 -0.21 5.22 0.40 0.39 -0.87 117.98 126.88 1x0r s PHE 129 Ca -0.08 -0.85 -0.08 0.00 -0.60 0.00 0.00 56.93 55.32 1x0r s PHE 129 Cb -0.12 -1.86 -0.04 0.00 0.51 0.00 0.00 43.02 41.51 1x0r s PHE 129 CO -0.05 -0.34 0.10 0.42 0.70 0.00 0.00 175.22 176.05 1x0r s ILE 130 N 0.57 4.89 -0.06 0.64 1.01 -0.18 -1.76 121.20 126.30 1x0r s ILE 130 Ca -0.09 0.01 0.04 0.00 0.00 0.00 0.00 60.65 60.61 1x0r s ILE 130 Cb -0.16 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.07 1x0r s ILE 130 CO 0.04 0.40 -0.19 -0.69 0.00 0.00 0.00 174.94 174.50 1x0r s VAL 131 N 0.84 1.59 0.82 2.92 1.01 0.32 0.42 120.40 128.32 1x0r s VAL 131 Ca 0.05 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.17 1x0r s VAL 131 Cb -0.13 -1.38 0.14 0.00 0.00 0.00 0.00 36.38 35.01 1x0r s VAL 131 CO 0.02 0.45 1.13 1.51 0.00 0.00 0.00 175.10 178.22 1x0r s ASP 132 N 0.23 3.93 0.00 3.32 1.47 0.02 -0.69 116.67 124.94 1x0r s ASP 132 Ca -0.10 0.05 0.12 0.00 1.18 0.00 0.00 52.55 53.80 1x0r s ASP 132 Cb -0.14 -0.34 0.67 0.00 -0.34 0.00 0.00 42.92 42.77 1x0r s ASP 132 CO 0.04 -2.17 1.20 0.00 0.68 0.00 0.00 175.17 174.93 1x0r n ALA 133 N -3.23 1.85 0.20 2.11 0.00 -1.25 0.96 120.51 121.16 1x0r n ALA 133 Ca 0.14 -0.07 0.10 0.00 0.00 0.00 0.00 53.44 53.61 1x0r n ALA 133 Cb 0.60 -1.19 0.18 0.00 0.00 0.00 0.00 19.45 19.04 1x0r n ALA 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1x0r n ARG 134 N -1.11 2.27 -0.60 0.00 1.74 -1.26 -4.49 116.66 113.21 1x0r n ARG 134 Ca 0.08 -2.08 0.00 0.00 -0.77 0.00 0.00 57.85 55.07 1x0r n ARG 134 Cb 0.06 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 1x0r n ARG 134 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x0r n GLY 135 N 1.17 0.72 3.85 -0.13 0.00 0.27 -4.95 105.19 106.12 1x0r n GLY 135 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1x0r n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x0r s VAL 136 N -2.22 5.25 -0.08 1.61 1.01 -1.25 0.27 120.40 124.99 1x0r s VAL 136 Ca 0.00 0.56 -0.30 0.00 0.00 0.00 0.00 61.98 62.24 1x0r s VAL 136 Cb 0.00 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 1x0r s VAL 136 CO 0.00 0.58 1.54 -0.63 0.00 0.00 0.00 175.10 176.60 1x0r s ILE 137 N -0.96 3.75 -0.08 2.22 1.01 -0.17 -0.80 121.20 126.17 1x0r s ILE 137 Ca 0.20 0.93 0.14 0.00 0.00 0.00 0.00 60.65 61.92 1x0r s ILE 137 Cb -0.14 -3.60 -0.21 0.00 0.01 0.00 0.00 42.46 38.51 1x0r s ILE 137 CO 0.09 -0.08 0.21 0.54 0.00 0.00 0.00 174.94 175.70 1x0r n ARG 138 N 6.89 1.01 -1.19 2.79 5.12 0.17 0.20 116.66 131.65 1x0r n ARG 138 Ca 0.16 -0.08 -0.00 0.00 -1.93 0.00 0.00 57.85 56.00 1x0r n ARG 138 Cb 0.43 -1.36 0.00 0.00 -1.16 0.00 0.00 32.46 30.37 1x0r n ARG 138 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1x0r n THR 139 N -2.26 0.00 -3.65 0.55 -1.04 -1.22 -4.89 114.28 101.78 1x0r n THR 139 Ca -0.12 -0.01 -0.03 0.00 -2.04 0.00 0.00 64.05 61.85 1x0r n THR 139 Cb 0.66 0.01 -0.07 0.00 -1.82 0.00 0.00 70.33 69.11 1x0r n THR 139 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1x0r s LEU 141 N 0.00 -0.13 -0.39 -4.42 1.43 -0.05 -1.01 118.68 114.11 1x0r s LEU 141 Ca 0.00 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.38 1x0r s LEU 141 Cb -0.00 1.24 0.11 0.00 0.03 0.00 0.00 46.19 47.57 1x0r s LEU 141 CO 0.00 -0.04 0.12 -0.31 0.23 0.00 0.00 176.35 176.35 1x0r s TYR 142 N 0.35 3.32 0.46 0.29 1.51 -1.26 -0.26 117.35 121.77 1x0r s TYR 142 Ca 0.02 -2.90 -0.06 0.00 -1.01 0.00 0.00 57.07 53.13 1x0r s TYR 142 Cb -0.04 -2.73 -0.04 0.00 -0.11 0.00 0.00 41.96 39.04 1x0r s TYR 142 CO -0.13 -0.88 0.76 0.71 -1.11 0.00 0.00 175.55 174.90 1x0r s TYR 143 N 0.64 3.54 0.00 2.71 1.51 -0.67 -4.93 117.35 120.16 1x0r s TYR 143 Ca 0.13 0.82 0.00 0.00 -1.01 0.00 0.00 57.07 57.01 1x0r s TYR 143 Cb -0.21 -2.30 0.00 0.00 -0.11 0.00 0.00 41.96 39.34 1x0r s TYR 143 CO -0.07 -0.22 0.00 -0.35 -1.11 0.00 0.00 175.55 173.80 1x0r n PRO 144 N -2.04 0.00 0.00 -1.71 -0.04 -1.26 -1.26 135.00 128.69 1x0r n PRO 144 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1x0r n PRO 144 Cb 0.55 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.01 1x0r n PRO 144 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1x0r n GLU 146 N 0.00 0.00 -3.87 0.54 0.00 -1.26 -4.54 120.64 111.51 1x0r n GLU 146 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 57.16 56.96 1x0r n GLU 146 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 31.44 31.27 1x0r n GLU 146 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 1x0r s LEU 147 N 0.00 0.81 0.55 -1.84 0.20 -1.26 -5.10 118.68 112.04 1x0r s LEU 147 Ca 0.00 -0.06 -0.17 0.00 0.69 0.00 0.00 54.13 54.60 1x0r s LEU 147 Cb 0.00 -0.34 -0.06 0.00 -0.43 0.00 0.00 46.19 45.36 1x0r s LEU 147 CO 0.00 -0.15 1.03 -0.83 -0.29 0.00 0.00 176.35 176.11 1x0r s GLY 148 N 1.56 2.19 0.79 7.98 0.00 -1.26 -4.93 107.32 113.65 1x0r s GLY 148 Ca -0.02 0.38 -0.12 0.00 0.00 0.00 0.00 44.72 44.97 1x0r s GLY 148 CO -0.03 0.69 1.10 0.50 0.00 0.00 0.00 173.10 175.36 1x0r s ARG 149 N -3.90 2.12 -0.67 2.90 0.52 -1.26 -5.04 118.95 113.62 1x0r s ARG 149 Ca 0.63 0.58 -0.13 0.00 -0.52 0.00 0.00 55.73 56.29 1x0r s ARG 149 Cb -0.14 -1.93 0.17 0.00 0.52 0.00 0.00 34.95 33.57 1x0r s ARG 149 CO 0.32 -1.59 0.60 -1.17 0.02 0.00 0.00 175.30 173.48 1x0r s LEU 150 N -5.74 6.31 0.41 2.53 2.96 -1.26 -4.95 118.68 118.95 1x0r s LEU 150 Ca 0.61 -2.30 0.11 0.00 -0.22 0.00 0.00 54.13 52.33 1x0r s LEU 150 Cb -0.14 -2.16 0.86 0.00 0.50 0.00 0.00 46.19 45.25 1x0r s LEU 150 CO 0.54 -0.67 1.96 0.58 -1.32 0.00 0.00 176.35 177.43 1x0r h VAL 151 N 5.37 1.15 0.00 1.68 2.07 -1.96 -1.62 116.25 122.94 1x0r h VAL 151 Ca -0.08 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 1x0r h VAL 151 Cb 1.06 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.98 1x0r h VAL 151 CO 0.86 0.20 -0.05 0.44 0.02 0.00 0.00 177.57 179.05 1x0r h ASP 152 N 0.20 0.00 0.71 0.57 3.32 -1.92 -0.84 116.42 118.45 1x0r h ASP 152 Ca 0.04 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.99 1x0r h ASP 152 Cb 0.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1x0r h ASP 152 CO 0.02 0.05 -0.49 -0.08 -1.72 0.00 0.00 179.24 177.02 1x0r h GLU 153 N 0.00 0.00 -0.32 3.56 4.57 -1.63 -1.71 114.58 119.05 1x0r h GLU 153 Ca -0.00 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.05 1x0r h GLU 153 Cb 0.12 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 1x0r h GLU 153 CO 0.01 0.49 -0.29 0.82 -1.18 0.00 0.00 179.01 178.86 1x0r h ILE 154 N 0.00 1.29 -0.68 2.32 2.04 -1.16 0.11 117.51 121.43 1x0r h ILE 154 Ca -0.00 -1.45 0.01 0.00 1.00 0.00 0.00 64.86 64.41 1x0r h ILE 154 Cb 0.97 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 38.53 1x0r h ILE 154 CO 0.06 0.47 0.45 -0.07 0.00 0.00 0.00 178.15 179.06 1x0r h LEU 155 N 0.52 0.77 -1.01 1.44 3.38 -1.18 -0.94 115.31 118.29 1x0r h LEU 155 Ca 0.05 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1x0r h LEU 155 Cb 0.86 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1x0r h LEU 155 CO 0.07 0.55 0.14 -0.09 0.09 0.00 0.00 178.44 179.20 1x0r h ARG 156 N 0.91 0.86 0.09 1.13 2.43 -1.04 -0.20 114.38 118.55 1x0r h ARG 156 Ca 0.26 -0.17 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1x0r h ARG 156 Cb -0.08 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.34 1x0r h ARG 156 CO -0.07 0.76 -0.04 0.82 -1.51 0.00 0.00 179.97 179.94 1x0r h ILE 157 N 0.83 1.07 -0.29 1.20 2.04 -0.15 0.10 117.51 122.31 1x0r h ILE 157 Ca 0.18 -0.57 0.01 0.00 1.00 0.00 0.00 64.86 65.49 1x0r h ILE 157 Cb 0.29 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1x0r h ILE 157 CO -0.00 0.14 0.17 0.58 0.00 0.00 0.00 178.15 179.04 1x0r h VAL 158 N -0.37 1.04 -0.41 1.67 2.07 -0.93 -0.62 116.25 118.70 1x0r h VAL 158 Ca -0.01 -0.12 0.05 0.00 0.82 0.00 0.00 66.70 67.43 1x0r h VAL 158 Cb 0.32 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 1x0r h VAL 158 CO 0.02 0.07 0.15 0.50 0.02 0.00 0.00 177.57 178.33 1x0r h LYS 159 N 0.36 0.31 -0.28 1.57 1.63 -0.95 -0.19 116.57 119.03 1x0r h LYS 159 Ca 0.11 -0.02 -0.14 0.00 -0.85 0.00 0.00 60.65 59.76 1x0r h LYS 159 Cb -0.01 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.54 1x0r h LYS 159 CO -0.05 0.21 -0.38 0.00 -3.45 0.00 0.00 179.45 175.78 1x0r h ALA 160 N 1.26 0.81 -0.23 5.00 0.00 -0.75 0.17 119.26 125.52 1x0r h ALA 160 Ca 0.19 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 1x0r h ALA 160 Cb 0.16 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1x0r h ALA 160 CO -0.18 0.65 -0.02 -0.07 0.00 0.00 0.00 179.25 179.62 1x0r h LEU 161 N 0.53 0.42 -0.49 0.00 -0.00 -0.89 -0.48 115.31 114.41 1x0r h LEU 161 Ca 0.05 -0.33 -0.01 0.00 -0.00 0.00 0.00 57.88 57.58 1x0r h LEU 161 Cb 0.90 -0.11 -0.02 0.00 -0.00 0.00 0.00 40.66 41.42 1x0r h LEU 161 CO 0.08 0.66 0.27 0.11 -0.00 0.00 0.00 178.44 179.55 1x0r h LYS 162 N 0.18 0.68 -0.37 1.13 1.57 -0.80 0.38 116.57 119.34 1x0r h LYS 162 Ca 0.06 -0.08 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1x0r h LYS 162 Cb 0.45 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1x0r h LYS 162 CO 0.02 0.54 0.22 -0.07 -0.57 0.00 0.00 179.45 179.58 1x0r h LEU 163 N 0.65 0.35 -0.69 2.94 3.38 -0.89 -0.02 115.31 121.03 1x0r h LEU 163 Ca 0.17 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1x0r h LEU 163 Cb 0.05 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1x0r h LEU 163 CO -0.03 0.25 0.45 1.23 0.09 0.00 0.00 178.44 180.43 1x0r h GLY 164 N 0.44 0.97 1.06 0.83 0.00 -0.93 -0.15 103.07 105.30 1x0r h GLY 164 Ca 0.15 -0.35 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 1x0r h GLY 164 CO -0.07 0.33 0.05 -0.55 0.00 0.00 0.00 176.54 176.31 1x0r h ASP 165 N 0.91 1.00 1.07 0.19 3.32 -0.70 -1.12 116.42 121.09 1x0r h ASP 165 Ca 0.26 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1x0r h ASP 165 Cb -0.08 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.21 1x0r h ASP 165 CO -0.07 1.03 -0.10 -1.54 -1.72 0.00 0.00 179.24 176.85 1x0r n SER 166 N -4.24 0.34 -0.24 6.45 3.41 -0.04 -3.55 113.62 115.74 1x0r n SER 166 Ca 0.03 0.41 0.03 0.00 -0.26 0.00 0.00 58.87 59.08 1x0r n SER 166 Cb 0.31 -0.46 0.04 0.00 -0.26 0.00 0.00 64.21 63.84 1x0r n SER 166 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1x0r n LEU 167 N -1.77 1.82 -3.65 1.04 4.32 -0.15 -4.99 117.00 113.63 1x0r n LEU 167 Ca 0.06 -1.39 -0.25 0.00 -0.02 0.00 0.00 56.01 54.41 1x0r n LEU 167 Cb 0.37 -0.04 0.04 0.00 -1.62 0.00 0.00 43.42 42.17 1x0r n LEU 167 CO 0.30 0.42 -0.07 1.17 -1.22 0.00 0.00 177.39 177.99 1x0r n LYS 168 N 0.17 -2.63 -4.10 3.23 4.81 -0.50 -5.01 118.16 114.13 1x0r n LYS 168 Ca 0.04 0.56 -0.13 0.00 -0.87 0.00 0.00 58.31 57.91 1x0r n LYS 168 Cb 0.21 -4.73 -0.11 0.00 0.02 0.00 0.00 35.03 30.42 1x0r n LYS 168 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1x0r s ARG 169 N -5.79 0.63 0.25 1.64 1.81 -0.74 -4.52 118.95 112.24 1x0r s ARG 169 Ca 0.29 -0.94 -0.03 0.00 -1.72 0.00 0.00 55.73 53.33 1x0r s ARG 169 Cb -0.09 -0.30 -0.05 0.00 -0.45 0.00 0.00 34.95 34.07 1x0r s ARG 169 CO 0.83 0.04 0.48 0.00 -0.68 0.00 0.00 175.30 175.97 1x0r s ALA 170 N -2.03 3.71 -0.20 2.13 0.00 -0.05 -4.37 121.76 120.96 1x0r s ALA 170 Ca -0.03 -0.68 -0.05 0.00 0.00 0.00 0.00 51.96 51.20 1x0r s ALA 170 Cb -0.06 -2.17 -0.02 0.00 0.00 0.00 0.00 23.12 20.88 1x0r s ALA 170 CO -0.01 0.32 -0.00 0.08 0.00 0.00 0.00 175.76 176.15 1x0r s VAL 171 N -1.99 3.89 0.88 0.00 1.01 -1.26 -1.24 120.40 121.69 1x0r s VAL 171 Ca 0.41 -0.33 -0.11 0.00 0.00 0.00 0.00 61.98 61.95 1x0r s VAL 171 Cb -0.11 -2.76 0.12 0.00 0.00 0.00 0.00 36.38 33.63 1x0r s VAL 171 CO 0.30 0.42 1.09 -2.16 0.00 0.00 0.00 175.10 174.75 1x0r s PRO 172 N 1.08 1.37 0.23 2.72 0.04 -1.26 -4.92 135.00 134.27 1x0r s PRO 172 Ca 0.02 0.88 -0.31 0.00 0.04 0.00 0.00 61.00 61.64 1x0r s PRO 172 Cb -0.14 -1.82 -0.15 0.00 0.04 0.00 0.00 34.50 32.43 1x0r s PRO 172 CO 0.01 -2.18 1.14 0.00 0.04 0.00 0.00 177.00 176.02 1x0r n ALA 173 N -3.85 -0.21 -1.52 8.56 0.00 -1.26 -1.94 120.51 120.30 1x0r n ALA 173 Ca 0.07 0.42 -0.17 0.00 0.00 0.00 0.00 53.44 53.77 1x0r n ALA 173 Cb 0.55 -2.07 -0.07 0.00 0.00 0.00 0.00 19.45 17.86 1x0r n ALA 173 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1x0r n ASP 174 N 1.70 -5.02 -4.74 0.00 8.00 -1.26 -4.13 116.55 111.10 1x0r n ASP 174 Ca 0.12 0.40 -0.38 0.00 0.71 0.00 0.00 54.79 55.64 1x0r n ASP 174 Cb 0.29 -4.01 0.06 0.00 -0.02 0.00 0.00 41.12 37.44 1x0r n ASP 174 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 1x0r n TRP 175 N -2.57 2.09 0.18 1.24 -0.00 -0.82 -1.26 117.44 116.31 1x0r n TRP 175 Ca -0.17 0.42 0.04 0.00 -0.00 0.00 0.00 57.50 57.79 1x0r n TRP 175 Cb 0.56 -2.31 0.19 0.00 -0.00 0.00 0.00 31.31 29.75 1x0r n TRP 175 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 1x0r n PRO 176 N -1.54 2.77 -2.01 5.87 -0.04 -1.26 -4.89 135.00 133.90 1x0r n PRO 176 Ca 0.14 -1.51 -0.31 0.00 -0.04 0.00 0.00 63.50 61.78 1x0r n PRO 176 Cb 0.47 -1.80 0.03 0.00 -0.04 0.00 0.00 33.50 32.16 1x0r n PRO 176 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1x0r n ASN 177 N 0.34 6.04 -4.77 3.54 3.02 -0.39 -2.88 115.26 120.17 1x0r n ASN 177 Ca 0.13 -3.77 -0.40 0.00 -0.03 0.00 0.00 54.58 50.52 1x0r n ASN 177 Cb 0.66 -0.68 -0.02 0.00 -0.61 0.00 0.00 39.78 39.13 1x0r n ASN 177 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1x0r s ASN 178 N -2.62 6.59 0.48 6.41 3.84 -0.09 -4.83 114.94 124.72 1x0r s ASN 178 Ca 0.53 2.56 0.27 0.00 0.21 0.00 0.00 52.86 56.43 1x0r s ASN 178 Cb 0.43 -2.64 0.76 0.00 -0.55 0.00 0.00 41.25 39.26 1x0r s ASN 178 CO -0.16 -0.65 1.76 -0.33 -2.79 0.00 0.00 177.10 174.94 1x0r h GLU 179 N 2.99 0.00 0.10 0.43 5.08 -1.88 0.13 114.58 121.43 1x0r h GLU 179 Ca -0.49 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 57.59 1x0r h GLU 179 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1x0r h GLU 179 CO 0.64 0.01 -1.45 0.82 -1.00 0.00 0.00 179.01 178.03 1x0r h ILE 180 N 0.00 0.97 0.00 3.13 2.04 -1.94 -3.43 117.51 118.28 1x0r h ILE 180 Ca -0.00 -2.36 0.00 0.00 1.00 0.00 0.00 64.86 63.50 1x0r h ILE 180 Cb 0.80 2.63 0.00 0.00 -0.74 0.00 0.00 36.82 39.52 1x0r h ILE 180 CO 0.00 0.68 0.00 2.30 0.00 0.00 0.00 178.15 181.13 1x0r n ILE 181 N -3.94 0.54 0.00 -0.67 -5.35 -1.24 -5.09 119.36 103.61 1x0r n ILE 181 Ca -0.27 -0.62 0.00 0.00 -0.27 0.00 0.00 62.75 61.59 1x0r n ILE 181 Cb 0.89 0.80 0.00 0.00 -1.74 0.00 0.00 39.64 39.58 1x0r n ILE 181 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1x0r n GLY 182 N -0.27 3.50 1.06 3.28 0.00 0.44 -0.94 105.19 112.26 1x0r n GLY 182 Ca 0.00 0.10 0.07 0.00 0.00 0.00 0.00 46.02 46.19 1x0r n GLY 182 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1x0r n GLU 183 N 10.89 2.53 -1.41 1.61 0.28 -1.14 -0.91 120.64 132.49 1x0r n GLU 183 Ca 0.00 -1.90 -0.33 0.00 -0.16 0.00 0.00 57.16 54.77 1x0r n GLU 183 Cb 0.00 -1.54 0.09 0.00 1.43 0.00 0.00 31.44 31.41 1x0r n GLU 183 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1x0r s GLY 184 N -0.89 2.09 0.14 -1.84 0.00 -0.12 -4.83 107.32 101.88 1x0r s GLY 184 Ca 0.35 0.64 0.09 0.00 0.00 0.00 0.00 44.72 45.80 1x0r s GLY 184 CO 0.20 1.02 -0.22 1.08 0.00 0.00 0.00 173.10 175.18 1x0r s LEU 185 N -5.38 2.37 -0.07 0.66 1.43 0.95 -4.60 118.68 114.04 1x0r s LEU 185 Ca 0.69 -0.79 -0.16 0.00 -1.03 0.00 0.00 54.13 52.85 1x0r s LEU 185 Cb -0.24 -0.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.94 1x0r s LEU 185 CO 0.47 0.07 0.41 -0.63 0.23 0.00 0.00 176.35 176.90 1x0r s ILE 186 N -1.50 5.14 -0.11 -0.59 1.01 -0.37 -1.62 121.20 123.16 1x0r s ILE 186 Ca 0.13 0.82 -0.27 0.00 0.00 0.00 0.00 60.65 61.34 1x0r s ILE 186 Cb -0.08 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.64 1x0r s ILE 186 CO 0.06 0.46 0.88 -0.69 0.00 0.00 0.00 174.94 175.66 1x0r s VAL 187 N -0.21 4.88 -0.01 2.92 1.01 0.13 -0.87 120.40 128.25 1x0r s VAL 187 Ca 0.23 1.78 -0.38 0.00 0.00 0.00 0.00 61.98 63.61 1x0r s VAL 187 Cb -0.15 -4.20 -0.18 0.00 0.00 0.00 0.00 36.38 31.85 1x0r s VAL 187 CO 0.10 0.07 1.33 -2.65 0.00 0.00 0.00 175.10 173.96 1x0r n PRO 188 N 4.78 0.80 -1.87 2.72 -0.02 -1.26 -4.62 135.00 135.52 1x0r n PRO 188 Ca 0.05 0.29 -0.37 0.00 -2.02 0.00 0.00 63.50 61.45 1x0r n PRO 188 Cb 0.49 -1.89 0.04 0.00 -0.02 0.00 0.00 33.50 32.13 1x0r n PRO 188 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1x0r s PRO 189 N 0.85 2.93 0.45 0.52 0.04 -1.26 -4.96 135.00 133.57 1x0r s PRO 189 Ca 0.89 2.02 -0.25 0.00 0.04 0.00 0.00 61.00 63.70 1x0r s PRO 189 Cb -1.08 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 31.35 1x0r s PRO 189 CO 0.53 -1.29 1.32 -2.30 0.04 0.00 0.00 177.00 175.30 1x0r n PRO 190 N -1.46 1.96 -0.00 0.56 -0.02 -1.26 -4.95 135.00 129.83 1x0r n PRO 190 Ca 0.13 0.70 0.04 0.00 -2.02 0.00 0.00 63.50 62.35 1x0r n PRO 190 Cb 0.48 -2.47 0.03 0.00 -0.02 0.00 0.00 33.50 31.51 1x0r n PRO 190 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1x0r n THR 191 N -0.36 0.02 -4.27 3.45 -2.24 -1.26 -4.87 114.28 104.74 1x0r n THR 191 Ca 0.07 -0.51 -0.16 0.00 -2.27 0.00 0.00 64.05 61.18 1x0r n THR 191 Cb 0.41 1.14 -0.10 0.00 -2.10 0.00 0.00 70.33 69.68 1x0r n THR 191 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1x0r s THR 192 N -0.61 1.31 0.20 4.28 -4.23 -1.26 -5.04 115.64 110.30 1x0r s THR 192 Ca 0.08 -2.02 -0.10 0.00 -1.18 0.00 0.00 61.69 58.47 1x0r s THR 192 Cb 0.06 -1.82 0.13 0.00 1.34 0.00 0.00 72.50 72.21 1x0r s THR 192 CO 0.09 -0.65 1.79 -0.08 -0.54 0.00 0.00 174.62 175.23 1x0r h GLU 193 N 2.88 1.04 -0.40 3.99 4.81 -1.99 0.33 114.58 125.24 1x0r h GLU 193 Ca -0.37 -0.15 -0.08 0.00 -0.13 0.00 0.00 59.36 58.62 1x0r h GLU 193 Cb 1.20 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 1x0r h GLU 193 CO 0.61 0.81 -0.08 -0.44 -0.73 0.00 0.00 179.01 179.18 1x0r h ASP 194 N 1.01 0.67 -0.54 1.04 3.45 -1.99 -0.98 116.42 119.09 1x0r h ASP 194 Ca 0.25 -0.18 -0.09 0.00 0.43 0.00 0.00 57.03 57.44 1x0r h ASP 194 Cb 0.11 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 38.68 1x0r h ASP 194 CO -0.03 0.80 -0.02 -0.61 -1.57 0.00 0.00 179.24 177.81 1x0r h GLN 195 N 0.64 0.96 -0.63 3.56 4.15 -1.89 -1.51 115.11 120.38 1x0r h GLN 195 Ca 0.12 -0.31 -0.04 0.00 0.77 0.00 0.00 58.65 59.19 1x0r h GLN 195 Cb 0.52 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 28.10 1x0r h GLN 195 CO 0.03 0.98 0.25 0.00 -1.93 0.00 0.00 178.83 178.16 1x0r h ALA 196 N 0.95 0.82 -0.13 3.38 0.00 -0.49 0.06 119.26 123.84 1x0r h ALA 196 Ca 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1x0r h ALA 196 Cb 0.56 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1x0r h ALA 196 CO 0.03 0.43 0.05 -0.09 0.00 0.00 0.00 179.25 179.68 1x0r h ARG 197 N 0.88 0.20 -0.64 0.00 2.43 -0.99 -2.79 114.38 113.46 1x0r h ARG 197 Ca 0.21 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.35 1x0r h ARG 197 Cb 0.20 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 1x0r h ARG 197 CO -0.02 0.29 0.42 0.00 -1.51 0.00 0.00 179.97 179.16 1x0r h ALA 198 N 0.90 1.54 0.00 2.80 0.00 -1.01 -1.15 119.26 122.35 1x0r h ALA 198 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1x0r h ALA 198 Cb 0.17 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1x0r h ALA 198 CO -0.00 0.43 0.00 -2.13 0.00 0.00 0.00 179.25 177.54 1x0r n ARG 199 N -4.44 0.34 0.00 0.00 0.63 -0.02 -1.13 116.66 112.05 1x0r n ARG 199 Ca 0.07 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.00 1x0r n ARG 199 Cb 0.04 -1.25 0.00 0.00 0.45 0.00 0.00 32.46 31.70 1x0r n ARG 199 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1x0r n GLU 201 N 0.59 0.00 -0.06 -0.14 1.02 -0.43 -3.78 120.64 117.83 1x0r n GLU 201 Ca 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.18 1x0r n GLU 201 Cb 0.13 0.00 0.38 0.00 -0.02 0.00 0.00 31.44 31.93 1x0r n GLU 201 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1x0r h SER 202 N 0.00 0.56 -0.83 1.62 4.64 -1.38 -3.47 113.55 114.70 1x0r h SER 202 Ca 0.00 -0.01 -0.25 0.00 -0.47 0.00 0.00 61.79 61.06 1x0r h SER 202 Cb 0.00 -0.14 -0.10 0.00 -0.31 0.00 0.00 62.40 61.85 1x0r h SER 202 CO 0.00 0.40 -0.23 0.61 -0.87 0.00 0.00 176.83 176.74 1x0r n GLY 203 N -1.46 1.17 0.16 -0.77 0.00 -1.25 -4.87 105.19 98.18 1x0r n GLY 203 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.19 1x0r n GLY 203 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1x0r h GLN 204 N 0.00 0.00 -6.07 1.61 3.07 -1.91 -3.47 115.11 108.34 1x0r h GLN 204 Ca -0.25 0.00 -0.58 0.00 0.09 0.00 0.00 58.65 57.91 1x0r h GLN 204 Cb 1.05 0.00 -0.11 0.00 0.08 0.00 0.00 27.48 28.50 1x0r h GLN 204 CO 0.37 0.00 -0.63 0.71 0.09 0.00 0.00 178.83 179.37 1x0r s TYR 205 N -3.29 2.56 0.50 0.06 1.51 -1.26 -5.06 117.35 112.36 1x0r s TYR 205 Ca 0.03 -0.39 -0.22 0.00 -1.01 0.00 0.00 57.07 55.48 1x0r s TYR 205 Cb 0.08 -1.41 -0.06 0.00 -0.11 0.00 0.00 41.96 40.46 1x0r s TYR 205 CO 0.74 0.51 1.19 1.03 -1.11 0.00 0.00 175.55 177.91 1x0r s ARG 206 N -3.70 3.55 -0.12 -0.62 0.52 -1.01 -4.88 118.95 112.69 1x0r s ARG 206 Ca 0.34 1.81 -0.23 0.00 -0.52 0.00 0.00 55.73 57.13 1x0r s ARG 206 Cb -0.02 -2.28 0.05 0.00 0.52 0.00 0.00 34.95 33.22 1x0r s ARG 206 CO 0.19 -0.74 0.56 0.45 0.02 0.00 0.00 175.30 175.79 1x0r s SER 207 N -1.39 -0.54 -0.11 0.23 0.15 -1.26 -1.47 113.70 109.30 1x0r s SER 207 Ca 0.67 0.79 0.14 0.00 0.70 0.00 0.00 55.95 58.25 1x0r s SER 207 Cb -0.30 0.78 -0.20 0.00 -1.71 0.00 0.00 66.02 64.59 1x0r s SER 207 CO 0.35 -0.40 0.14 0.18 1.20 0.00 0.00 173.24 174.71 1x0r n LEU 208 N 1.78 0.00 0.00 3.45 4.32 0.87 -5.00 117.00 122.42 1x0r n LEU 208 Ca -0.17 0.00 -0.05 0.00 -0.02 0.00 0.00 56.01 55.77 1x0r n LEU 208 Cb 0.56 0.25 0.02 0.00 -1.62 0.00 0.00 43.42 42.63 1x0r n LEU 208 CO 0.16 0.25 0.53 -0.67 -1.22 0.00 0.00 177.39 176.44 1x0r n ASP 209 N -2.39 -1.61 0.24 -1.43 -0.08 -1.21 -4.96 116.55 105.11 1x0r n ASP 209 Ca -0.17 -2.00 0.11 0.00 -1.51 0.00 0.00 54.79 51.22 1x0r n ASP 209 Cb 0.80 2.65 0.52 0.00 2.34 0.00 0.00 41.12 47.43 1x0r n ASP 209 CO 0.00 0.00 0.00 4.11 0.12 0.00 0.00 177.20 181.43 1x0r h TRP 210 N 1.78 0.00 -0.02 -0.67 5.08 -1.97 -2.05 115.95 118.10 1x0r h TRP 210 Ca -0.24 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.73 1x0r h TRP 210 Cb 0.96 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.12 1x0r h TRP 210 CO 0.00 0.18 -0.24 -2.67 -1.28 0.00 0.00 178.44 174.43 1x0r n TRP 211 N -3.35 0.00 -3.75 0.12 4.27 -1.26 -4.48 117.44 108.98 1x0r n TRP 211 Ca 0.00 0.00 -0.28 0.00 -3.89 0.00 0.00 57.50 53.33 1x0r n TRP 211 Cb 0.39 -0.02 -0.11 0.00 -1.36 0.00 0.00 31.31 30.22 1x0r n TRP 211 CO 0.00 0.00 0.00 0.34 -2.29 0.00 0.00 177.69 175.74 1x0r n PHE 212 N 0.37 2.83 -4.40 -2.67 -0.00 -0.77 -4.52 117.46 108.31 1x0r n PHE 212 Ca 0.12 -4.17 -0.27 0.00 -0.00 0.00 0.00 57.45 53.13 1x0r n PHE 212 Cb 0.48 -0.52 -0.11 0.00 -0.00 0.00 0.00 39.48 39.33 1x0r n PHE 212 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1x0r s TRP 214 N -1.62 0.07 0.00 0.00 1.48 -0.54 -0.69 118.94 117.63 1x0r s TRP 214 Ca 0.21 -0.43 0.00 0.00 -1.06 0.00 0.00 56.10 54.82 1x0r s TRP 214 Cb -0.08 0.31 0.00 0.00 -1.16 0.00 0.00 33.47 32.54 1x0r s TRP 214 CO 0.10 -0.95 0.00 -0.40 -4.06 0.00 0.00 176.95 171.65 1x0r n ASP 215 N -0.35 0.00 -3.20 -2.66 3.85 -0.64 -2.41 116.55 111.14 1x0r n ASP 215 Ca -0.07 -0.00 -0.23 0.00 -0.71 0.00 0.00 54.79 53.78 1x0r n ASP 215 Cb 0.62 0.00 -0.06 0.00 -1.35 0.00 0.00 41.12 40.33 1x0r n ASP 215 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1x0r n THR 216 N 0.00 -0.11 1.25 2.12 -2.24 -1.26 -0.03 114.28 114.00 1x0r n THR 216 Ca 0.00 -4.35 0.14 0.00 -2.27 0.00 0.00 64.05 57.57 1x0r n THR 216 Cb 0.00 -1.48 0.51 0.00 -2.10 0.00 0.00 70.33 67.26 1x0r n THR 216 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1x0r n PRO 217 N 0.98 0.49 -2.38 -0.78 -0.04 -1.26 -4.87 135.00 127.14 1x0r n PRO 217 Ca 0.23 -0.20 -0.33 0.00 -0.04 0.00 0.00 63.50 63.16 1x0r n PRO 217 Cb 0.55 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.49 1x0r n PRO 217 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x0r s ALA 218 N -2.65 2.86 0.65 0.55 0.00 -1.26 -5.03 121.76 116.88 1x0r s ALA 218 Ca 0.23 0.49 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 1x0r s ALA 218 Cb 0.19 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 1x0r s ALA 218 CO 0.53 -0.44 1.04 -1.54 0.00 0.00 0.00 175.76 175.35 1x0r s SER 219 N -2.36 5.86 0.34 0.00 1.04 -1.26 -4.86 113.70 112.46 1x0r s SER 219 Ca 0.65 1.53 0.02 0.00 0.48 0.00 0.00 55.95 58.62 1x0r s SER 219 Cb -0.15 -2.48 0.60 0.00 0.10 0.00 0.00 66.02 64.08 1x0r s SER 219 CO 0.26 -1.12 1.99 -0.09 0.98 0.00 0.00 173.24 175.26 1x0r h ARG 220 N -0.41 0.89 -0.76 4.02 2.43 -1.98 -1.51 114.38 117.07 1x0r h ARG 220 Ca -0.44 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 58.71 1x0r h ARG 220 Cb 1.20 -0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 30.50 1x0r h ARG 220 CO 0.60 0.59 0.48 -0.44 -1.51 0.00 0.00 179.97 179.69 1x0r h ASP 221 N 0.92 0.80 -0.19 -3.80 3.32 -1.98 0.64 116.42 116.12 1x0r h ASP 221 Ca 0.27 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.23 1x0r h ASP 221 Cb -0.04 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 1x0r h ASP 221 CO -0.07 0.55 -0.15 0.44 -1.72 0.00 0.00 179.24 178.29 1x0r h ASP 222 N 0.94 0.59 -0.27 6.45 3.32 -1.66 -0.41 116.42 125.39 1x0r h ASP 222 Ca 0.30 -0.17 -0.16 0.00 0.02 0.00 0.00 57.03 57.02 1x0r h ASP 222 Cb 0.01 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.40 1x0r h ASP 222 CO -0.11 0.76 -0.46 0.58 -1.72 0.00 0.00 179.24 178.30 1x0r h VAL 223 N 0.54 1.29 0.00 -1.35 2.07 -0.79 -2.28 116.25 115.73 1x0r h VAL 223 Ca 0.09 -1.65 -0.14 0.00 0.82 0.00 0.00 66.70 65.82 1x0r h VAL 223 Cb 0.58 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 1x0r h VAL 223 CO 0.04 0.53 -0.68 -0.33 0.02 0.00 0.00 177.57 177.15 1x0r h GLU 224 N 0.54 0.00 -0.11 1.57 5.08 -0.66 -0.68 114.58 120.32 1x0r h GLU 224 Ca 0.02 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1x0r h GLU 224 Cb 1.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 1x0r h GLU 224 CO 0.10 0.68 0.04 1.49 -1.00 0.00 0.00 179.01 180.32 1x0r h GLU 225 N 0.00 0.16 -0.74 2.33 4.81 -1.08 -1.32 114.58 118.74 1x0r h GLU 225 Ca -0.01 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 1x0r h GLU 225 Cb 1.52 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.84 1x0r h GLU 225 CO 0.09 0.27 0.32 0.00 -0.73 0.00 0.00 179.01 178.96 1x0r h ALA 226 N 0.88 1.16 0.00 2.92 0.00 -1.12 -2.28 119.26 120.83 1x0r h ALA 226 Ca 0.04 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1x0r h ALA 226 Cb 0.17 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1x0r h ALA 226 CO -0.00 0.62 -0.51 -0.09 0.00 0.00 0.00 179.25 179.26 1x0r h ARG 227 N 1.07 0.00 -0.58 0.00 2.43 -1.01 -2.82 114.38 113.46 1x0r h ARG 227 Ca 0.25 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.41 1x0r h ARG 227 Cb 0.17 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 1x0r h ARG 227 CO -0.03 0.51 0.31 -0.09 -1.51 0.00 0.00 179.97 179.16 1x0r h ARG 228 N 0.00 0.80 -0.83 0.20 2.43 -0.67 0.38 114.38 116.70 1x0r h ARG 228 Ca -0.01 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1x0r h ARG 228 Cb 0.92 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 30.27 1x0r h ARG 228 CO 0.07 0.60 0.42 1.88 -1.51 0.00 0.00 179.97 181.43 1x0r h TYR 229 N 0.81 1.16 -0.18 2.20 0.99 -1.22 0.15 116.97 120.88 1x0r h TYR 229 Ca 0.21 -0.04 -0.14 0.00 2.00 0.00 0.00 58.73 60.75 1x0r h TYR 229 Cb 0.04 -0.37 0.00 0.00 1.00 0.00 0.00 36.73 37.40 1x0r h TYR 229 CO 0.01 0.83 -0.44 -0.07 -0.00 0.00 0.00 178.16 178.49 1x0r h LEU 230 N 1.16 0.69 -0.92 3.88 3.38 -1.22 -0.73 115.31 121.55 1x0r h LEU 230 Ca 0.29 -0.57 0.05 0.00 0.09 0.00 0.00 57.88 57.74 1x0r h LEU 230 Cb 0.08 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.57 1x0r h LEU 230 CO -0.04 1.14 0.59 0.03 0.09 0.00 0.00 178.44 180.25 1x0r h ARG 231 N 0.28 1.07 -0.37 1.13 3.08 0.02 0.07 114.38 119.66 1x0r h ARG 231 Ca -0.00 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 1x0r h ARG 231 Cb 1.05 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.84 1x0r h ARG 231 CO 0.10 0.71 -0.06 -0.09 -1.07 0.00 0.00 179.97 179.56 1x0r h ARG 232 N 1.10 0.70 -0.78 0.04 2.43 -0.53 -1.36 114.38 115.97 1x0r h ARG 232 Ca 0.39 -0.25 0.07 0.00 -0.81 0.00 0.00 59.98 59.38 1x0r h ARG 232 Cb 0.10 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.55 1x0r h ARG 232 CO -0.15 0.83 0.51 0.00 -1.51 0.00 0.00 179.97 179.65 1x0r h ALA 233 N 0.84 1.67 0.00 2.80 0.00 -0.42 -2.27 119.26 121.89 1x0r h ALA 233 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1x0r h ALA 233 Cb 0.55 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1x0r h ALA 233 CO 0.03 0.20 -0.07 0.00 0.00 0.00 0.00 179.25 179.41 1x0r n ALA 234 N -2.43 2.44 -2.46 0.00 0.00 -0.06 -4.86 120.51 113.15 1x0r n ALA 234 Ca 0.12 -0.10 -0.39 0.00 0.00 0.00 0.00 53.44 53.06 1x0r n ALA 234 Cb 0.24 -1.43 -0.05 0.00 0.00 0.00 0.00 19.45 18.21 1x0r n ALA 234 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1x0r s GLU 235 N -3.04 4.37 -0.14 0.00 2.12 -0.58 -5.02 118.70 116.42 1x0r s GLU 235 Ca 0.12 0.84 -0.29 0.00 0.36 0.00 0.00 54.97 56.00 1x0r s GLU 235 Cb 0.17 -3.35 -0.03 0.00 0.26 0.00 0.00 34.13 31.18 1x0r s GLU 235 CO 0.57 0.34 1.45 0.21 -0.54 0.00 0.00 175.26 177.29 1x0r s LYS 236 N -0.15 4.13 0.17 4.30 2.20 -1.26 -4.93 119.74 124.21 1x0r s LYS 236 Ca 0.33 1.82 -0.33 0.00 -0.36 0.00 0.00 55.97 57.43 1x0r s LYS 236 Cb -0.19 -3.89 -0.15 0.00 -1.51 0.00 0.00 37.83 32.09 1x0r s LYS 236 CO 0.19 -0.86 1.22 -2.30 -0.36 0.00 0.00 175.35 173.24 1x0r n PRO 237 N 6.98 1.30 0.09 4.03 -0.02 -1.26 -4.92 135.00 141.19 1x0r n PRO 237 Ca 0.16 0.46 -0.12 0.00 -2.02 0.00 0.00 63.50 61.98 1x0r n PRO 237 Cb 0.44 -2.00 -0.05 0.00 -0.02 0.00 0.00 33.50 31.87 1x0r n PRO 237 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1x0r h ALA 238 N 3.63 -0.48 -3.85 3.55 0.00 -2.04 -3.43 119.26 116.63 1x0r h ALA 238 Ca -0.44 -0.03 -0.40 0.00 0.00 0.00 0.00 54.91 54.04 1x0r h ALA 238 Cb 1.33 0.52 -0.27 0.00 0.00 0.00 0.00 17.79 19.38 1x0r h ALA 238 CO 0.72 -0.83 -0.78 0.21 0.00 0.00 0.00 179.25 178.56 1x0r s LYS 239 N -6.02 0.80 0.19 0.00 2.20 -1.26 -5.14 119.74 110.51 1x0r s LYS 239 Ca -0.16 -0.52 -0.17 0.00 -0.36 0.00 0.00 55.97 54.76 1x0r s LYS 239 Cb 0.08 -0.76 -0.08 0.00 -1.51 0.00 0.00 37.83 35.57 1x0r s LYS 239 CO 0.65 0.20 0.64 -0.51 -0.36 0.00 0.00 175.35 175.97 1x0r s LEU 240 N -0.67 4.32 0.55 5.43 1.43 -1.26 -4.98 118.68 123.50 1x0r s LEU 240 Ca 0.01 1.25 0.33 0.00 -1.03 0.00 0.00 54.13 54.69 1x0r s LEU 240 Cb -0.06 -3.48 1.47 0.00 0.03 0.00 0.00 46.19 44.15 1x0r s LEU 240 CO 0.00 0.05 2.03 -0.07 0.23 0.00 0.00 176.35 178.59 1x0r h LEU 241 N 3.39 0.00 -1.05 1.79 3.38 -2.01 -2.97 115.31 117.85 1x0r h LEU 241 Ca -0.48 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.41 1x0r h LEU 241 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1x0r h LEU 241 CO 0.66 0.05 -0.20 0.10 0.09 0.00 0.00 178.44 179.13 1x0r h TYR 242 N 0.00 0.48 -0.31 1.13 -0.00 -1.93 -1.45 116.97 114.89 1x0r h TYR 242 Ca -0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 58.73 58.60 1x0r h TYR 242 Cb 0.45 -0.12 -0.01 0.00 0.00 0.00 0.00 36.73 37.05 1x0r h TYR 242 CO 0.00 0.62 0.02 0.93 -0.00 0.00 0.00 178.16 179.73 1x0r h GLU 243 N 0.40 0.53 0.00 0.10 5.08 -1.93 -2.51 114.58 116.25 1x0r h GLU 243 Ca 0.07 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1x0r h GLU 243 Cb 0.58 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1x0r h GLU 243 CO 0.04 0.66 -0.04 0.39 -1.00 0.00 0.00 179.01 179.06 1x0r n GLU 244 N -4.58 0.26 0.00 2.33 1.02 -1.20 -5.13 120.64 113.33 1x0r n GLU 244 Ca -0.02 0.20 0.01 0.00 -0.02 0.00 0.00 57.16 57.33 1x0r n GLU 244 Cb 0.24 -1.79 0.08 0.00 -0.02 0.00 0.00 31.44 29.96 1x0r n GLU 244 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31