#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 0.18 0.01 -1.23 0.00 -1.26 -5.11 107.32 99.90 1x0r s GLY 3 Ca 0.00 -0.63 0.01 0.00 0.00 0.00 0.00 44.72 44.11 1x0r s GLY 3 CO 0.00 -0.73 0.03 -0.45 0.00 0.00 0.00 173.10 171.95 1x0r s SER 4 N -2.89 5.32 0.17 1.64 0.15 -1.26 -5.10 113.70 111.73 1x0r s SER 4 Ca 0.09 0.03 -0.06 0.00 0.70 0.00 0.00 55.95 56.71 1x0r s SER 4 Cb 0.04 -1.44 -0.02 0.00 -1.71 0.00 0.00 66.02 62.89 1x0r s SER 4 CO -0.07 0.27 0.23 0.27 1.20 0.00 0.00 173.24 175.14 1x0r s ILE 5 N -1.15 0.06 0.76 6.45 -4.36 -1.26 -3.54 121.20 118.16 1x0r s ILE 5 Ca 0.21 -1.59 -0.11 0.00 -0.26 0.00 0.00 60.65 58.90 1x0r s ILE 5 Cb -0.12 -2.01 0.05 0.00 1.25 0.00 0.00 42.46 41.63 1x0r s ILE 5 CO 0.12 -0.27 1.10 -2.84 0.24 0.00 0.00 174.94 173.30 1x0r s PRO 6 N -4.02 2.40 0.14 0.37 0.02 -1.26 -5.00 135.00 127.65 1x0r s PRO 6 Ca 0.22 0.55 0.10 0.00 0.02 0.00 0.00 61.00 61.89 1x0r s PRO 6 Cb 0.04 -1.96 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 1x0r s PRO 6 CO 0.03 -1.38 -0.23 -0.51 -0.33 0.00 0.00 177.00 174.58 1x0r s LEU 7 N -5.60 2.35 0.49 -5.54 1.43 -1.26 -5.07 118.68 105.48 1x0r s LEU 7 Ca 0.60 -0.76 -0.24 0.00 -1.03 0.00 0.00 54.13 52.70 1x0r s LEU 7 Cb -0.13 -1.03 -0.07 0.00 0.03 0.00 0.00 46.19 44.99 1x0r s LEU 7 CO 0.53 0.09 1.38 -0.38 0.23 0.00 0.00 176.35 178.20 1x0r n ILE 8 N 0.77 3.23 0.00 -0.59 5.41 -1.26 -1.08 119.36 125.84 1x0r n ILE 8 Ca -0.17 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.08 1x0r n ILE 8 Cb 0.54 -1.73 0.00 0.00 -0.71 0.00 0.00 39.64 37.75 1x0r n ILE 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1x0r n GLY 9 N 0.69 3.28 3.89 7.39 0.00 0.95 -5.00 105.19 116.41 1x0r n GLY 9 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.59 3.68 0.37 1.61 2.02 -0.24 -4.79 118.70 120.76 1x0r s GLU 10 Ca 0.00 0.19 -0.27 0.00 0.02 0.00 0.00 54.97 54.92 1x0r s GLU 10 Cb 0.00 -2.52 -0.09 0.00 0.10 0.00 0.00 34.13 31.62 1x0r s GLU 10 CO 0.00 0.07 1.24 0.50 0.02 0.00 0.00 175.26 177.09 1x0r s ARG 11 N -3.81 4.15 0.33 1.61 3.52 -1.26 -1.05 118.95 122.43 1x0r s ARG 11 Ca 0.47 2.04 -0.29 0.00 -0.13 0.00 0.00 55.73 57.82 1x0r s ARG 11 Cb -0.10 -2.84 -0.12 0.00 -1.56 0.00 0.00 34.95 30.33 1x0r s ARG 11 CO 0.32 -0.30 1.52 0.34 -0.81 0.00 0.00 175.30 176.37 1x0r n PHE 12 N 0.36 2.84 -1.68 5.12 7.35 0.20 -4.81 117.46 126.84 1x0r n PHE 12 Ca 0.03 0.36 -0.52 0.00 -0.76 0.00 0.00 57.45 56.56 1x0r n PHE 12 Cb 0.44 -2.55 -0.06 0.00 0.35 0.00 0.00 39.48 37.66 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 1.33 1.73 -1.91 -7.13 -0.02 -1.26 -4.50 135.00 123.25 1x0r n PRO 13 Ca 0.05 0.63 -0.37 0.00 -2.02 0.00 0.00 63.50 61.80 1x0r n PRO 13 Cb 0.37 -2.40 0.04 0.00 -0.02 0.00 0.00 33.50 31.49 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 3.33 2.94 -0.05 -0.52 2.56 -1.26 -4.43 118.70 121.28 1x0r s GLU 14 Ca 0.93 1.98 0.03 0.00 0.00 0.00 0.00 54.97 57.90 1x0r s GLU 14 Cb -0.85 -2.00 0.01 0.00 2.00 0.00 0.00 34.13 33.29 1x0r s GLU 14 CO 0.55 -1.27 -0.12 -1.21 -0.56 0.00 0.00 175.26 172.65 1x0r s GLU 16 N -3.21 1.47 0.05 4.30 2.02 -1.26 -4.97 118.70 117.09 1x0r s GLU 16 Ca 0.77 -0.41 0.04 0.00 0.02 0.00 0.00 54.97 55.39 1x0r s GLU 16 Cb -0.34 -1.27 -0.02 0.00 0.10 0.00 0.00 34.13 32.59 1x0r s GLU 16 CO 0.38 0.09 -0.12 0.14 0.02 0.00 0.00 175.26 175.78 1x0r s VAL 17 N 0.41 0.92 -0.18 2.63 -7.23 -0.10 -4.96 120.40 111.88 1x0r s VAL 17 Ca -0.09 -1.06 -0.17 0.00 -1.81 0.00 0.00 61.98 58.85 1x0r s VAL 17 Cb -0.13 -0.88 -0.04 0.00 0.56 0.00 0.00 36.38 35.89 1x0r s VAL 17 CO 0.02 -0.16 0.46 -0.89 -0.31 0.00 0.00 175.10 174.22 1x0r s THR 18 N -1.07 5.16 0.44 5.32 2.01 -1.26 -0.40 115.64 125.84 1x0r s THR 18 Ca -0.02 0.85 0.04 0.00 0.31 0.00 0.00 61.69 62.86 1x0r s THR 18 Cb -0.09 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.60 1x0r s THR 18 CO 0.01 0.24 0.04 0.42 -0.69 0.00 0.00 174.62 174.64 1x0r s THR 19 N 1.28 1.25 -2.00 -0.82 -4.23 -0.60 -1.08 115.64 109.44 1x0r s THR 19 Ca 0.22 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 58.94 1x0r s THR 19 Cb -0.15 -2.51 0.60 0.00 1.34 0.00 0.00 72.50 71.78 1x0r s THR 19 CO 0.09 0.00 1.67 -0.90 -0.54 0.00 0.00 174.62 174.94 1x0r n ASP 20 N -1.11 0.00 -0.68 3.99 5.75 -0.64 -1.26 116.55 122.59 1x0r n ASP 20 Ca -0.10 -0.83 0.07 0.00 -0.01 0.00 0.00 54.79 53.92 1x0r n ASP 20 Cb 0.67 0.00 0.11 0.00 -1.03 0.00 0.00 41.12 40.87 1x0r n ASP 20 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1x0r n HIS 21 N -0.94 0.23 0.00 2.11 8.25 -1.26 -4.98 115.22 118.63 1x0r n HIS 21 Ca 0.16 -0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1x0r n HIS 21 Cb 0.07 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.18 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 0.83 2.81 3.71 -1.41 0.00 -0.39 -5.04 105.19 105.70 1x0r n GLY 22 Ca 0.11 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.66 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 -2.16 3.90 0.10 1.61 1.01 -1.26 -1.56 120.40 122.04 1x0r s VAL 23 Ca 0.00 1.36 0.01 0.00 0.00 0.00 0.00 61.98 63.34 1x0r s VAL 23 Cb 0.00 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1x0r s VAL 23 CO 0.00 0.09 -0.03 0.27 0.00 0.00 0.00 175.10 175.43 1x0r s ILE 24 N 1.23 0.50 -0.13 2.22 -4.36 0.47 -4.94 121.20 116.18 1x0r s ILE 24 Ca 0.60 -1.90 -0.04 0.00 -0.26 0.00 0.00 60.65 59.05 1x0r s ILE 24 Cb -0.31 -1.73 -0.03 0.00 1.25 0.00 0.00 42.46 41.64 1x0r s ILE 24 CO 0.29 -0.82 -0.01 -0.75 0.24 0.00 0.00 174.94 173.89 1x0r s LYS 25 N -3.89 3.44 -0.05 0.37 2.20 -1.26 -0.92 119.74 119.63 1x0r s LYS 25 Ca 0.13 -0.45 0.04 0.00 -0.36 0.00 0.00 55.97 55.34 1x0r s LYS 25 Cb 0.06 -2.91 -0.02 0.00 -1.51 0.00 0.00 37.83 33.45 1x0r s LYS 25 CO -0.04 0.43 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.70 1x0r s LEU 26 N -0.14 2.56 0.00 5.43 1.43 -1.26 -0.72 118.68 125.97 1x0r s LEU 26 Ca 0.04 -0.27 0.30 0.00 -1.03 0.00 0.00 54.13 53.16 1x0r s LEU 26 Cb -0.13 -1.50 1.40 0.00 0.03 0.00 0.00 46.19 45.99 1x0r s LEU 26 CO 0.02 0.33 1.94 -0.81 0.23 0.00 0.00 176.35 178.06 1x0r n PRO 27 N 2.42 1.28 -0.26 1.29 -0.04 -1.26 -4.14 135.00 134.30 1x0r n PRO 27 Ca -0.17 -0.50 0.05 0.00 -0.04 0.00 0.00 63.50 62.84 1x0r n PRO 27 Cb 0.52 -1.49 0.18 0.00 -0.04 0.00 0.00 33.50 32.67 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 1.21 0.31 -0.65 3.54 5.19 -1.96 -0.50 116.42 123.56 1x0r h ASP 28 Ca 0.00 0.10 0.13 0.00 -0.62 0.00 0.00 57.03 56.64 1x0r h ASP 28 Cb 0.29 0.07 -0.10 0.00 0.18 0.00 0.00 39.33 39.77 1x0r h ASP 28 CO 0.00 0.13 0.13 -0.74 -3.12 0.00 0.00 179.24 175.64 1x0r h HIS 29 N 0.47 0.20 0.18 4.55 2.76 -1.27 0.60 115.15 122.64 1x0r h HIS 29 Ca 0.41 0.04 -0.33 0.00 -2.20 0.00 0.00 60.37 58.29 1x0r h HIS 29 Cb 0.59 0.01 0.01 0.00 1.55 0.00 0.00 27.41 29.58 1x0r h HIS 29 CO -0.16 -0.06 -1.57 1.88 -1.30 0.00 0.00 177.93 176.72 1x0r h TYR 30 N 0.25 0.70 -0.95 5.26 -1.99 -1.49 -3.31 116.97 115.45 1x0r h TYR 30 Ca 0.35 -0.51 0.12 0.00 2.00 0.00 0.00 58.73 60.69 1x0r h TYR 30 Cb 0.55 -0.03 -0.09 0.00 2.00 0.00 0.00 36.73 39.17 1x0r h TYR 30 CO -0.27 1.53 0.57 0.28 -0.00 0.00 0.00 178.16 180.27 1x0r h VAL 31 N 0.11 0.87 0.00 -2.88 2.07 -0.93 0.29 116.25 115.78 1x0r h VAL 31 Ca -0.27 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 1x0r h VAL 31 Cb 2.09 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1x0r h VAL 31 CO 0.21 0.16 -0.13 0.28 0.02 0.00 0.00 177.57 178.11 1x0r h SER 32 N 0.88 0.00 -0.39 0.57 0.02 -1.00 0.15 113.55 113.78 1x0r h SER 32 Ca 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.43 1x0r h SER 32 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 1x0r h SER 32 CO -0.29 0.13 0.00 0.00 -1.14 0.00 0.00 176.83 175.53 1x0r n GLN 33 N -3.92 2.20 -1.56 3.45 6.02 -0.16 -4.90 117.38 118.50 1x0r n GLN 33 Ca -0.02 -1.84 -0.05 0.00 -0.01 0.00 0.00 57.00 55.08 1x0r n GLN 33 Cb 0.22 -1.45 -0.01 0.00 1.02 0.00 0.00 30.24 30.02 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 1.35 0.51 3.69 1.08 0.00 0.51 -5.02 105.19 107.31 1x0r n GLY 34 Ca 0.18 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 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 -3.23 2.57 0.68 1.61 1.02 -0.09 -4.84 119.74 117.47 1x0r s LYS 35 Ca 0.00 -0.83 -0.05 0.00 0.02 0.00 0.00 55.97 55.12 1x0r s LYS 35 Cb 0.00 -2.55 0.07 0.00 -0.52 0.00 0.00 37.83 34.82 1x0r s LYS 35 CO 0.00 0.54 0.97 -1.58 -0.92 0.00 0.00 175.35 174.37 1x0r s TRP 36 N -1.32 2.70 0.02 3.18 0.52 -0.82 -3.95 118.94 119.28 1x0r s TRP 36 Ca 0.26 0.26 -0.11 0.00 0.02 0.00 0.00 56.10 56.52 1x0r s TRP 36 Cb -0.12 -3.12 0.01 0.00 -1.15 0.00 0.00 33.47 29.09 1x0r s TRP 36 CO 0.19 -1.38 0.23 -0.59 0.02 0.00 0.00 176.95 175.42 1x0r s PHE 37 N -3.16 -0.04 -0.21 -1.98 -0.12 -0.43 0.22 117.98 112.26 1x0r s PHE 37 Ca 0.61 -0.05 -0.04 0.00 -0.05 0.00 0.00 56.93 57.40 1x0r s PHE 37 Cb -0.10 0.02 -0.01 0.00 -0.63 0.00 0.00 43.02 42.30 1x0r s PHE 37 CO 0.44 -0.40 -0.04 0.08 -0.05 0.00 0.00 175.22 175.25 1x0r s VAL 38 N -1.96 3.50 -0.24 -2.49 1.01 0.72 -0.91 120.40 120.03 1x0r s VAL 38 Ca -0.10 -0.46 -0.09 0.00 0.00 0.00 0.00 61.98 61.34 1x0r s VAL 38 Cb -0.04 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 1x0r s VAL 38 CO -0.00 0.43 0.11 -0.22 0.00 0.00 0.00 175.10 175.41 1x0r s LEU 39 N 1.30 3.75 0.18 3.92 2.96 -0.56 -0.80 118.68 129.43 1x0r s LEU 39 Ca 0.04 -0.05 0.07 0.00 -0.22 0.00 0.00 54.13 53.97 1x0r s LEU 39 Cb -0.14 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 1x0r s LEU 39 CO -0.01 0.03 -0.14 0.72 -1.32 0.00 0.00 176.35 175.62 1x0r s PHE 40 N 1.24 1.64 0.32 5.38 -0.12 -0.02 -0.26 117.98 126.16 1x0r s PHE 40 Ca 0.06 -0.57 0.07 0.00 -0.05 0.00 0.00 56.93 56.44 1x0r s PHE 40 Cb -0.14 -0.79 -0.06 0.00 -0.63 0.00 0.00 43.02 41.40 1x0r s PHE 40 CO 0.05 0.30 -0.06 -1.54 -0.05 0.00 0.00 175.22 173.92 1x0r s SER 41 N -3.09 3.19 0.02 1.98 1.04 0.04 -1.15 113.70 115.73 1x0r s SER 41 Ca 0.19 -1.23 -0.11 0.00 0.48 0.00 0.00 55.95 55.28 1x0r s SER 41 Cb -0.02 -0.25 0.01 0.00 0.10 0.00 0.00 66.02 65.87 1x0r s SER 41 CO 0.06 -0.32 0.24 -1.38 0.98 0.00 0.00 173.24 172.81 1x0r s HIS 42 N -2.86 -0.04 0.25 5.02 -3.43 -0.22 -3.77 115.29 110.24 1x0r s HIS 42 Ca 0.32 -0.07 -0.03 0.00 -0.80 0.00 0.00 55.06 54.48 1x0r s HIS 42 Cb 0.04 0.03 0.30 0.00 -1.43 0.00 0.00 32.58 31.52 1x0r s HIS 42 CO 0.14 -0.42 1.74 -1.00 -2.00 0.00 0.00 174.74 173.20 1x0r h PRO 43 N 3.59 0.81 -1.69 -0.38 0.13 -1.75 -3.41 132.00 129.30 1x0r h PRO 43 Ca -0.31 -0.23 0.05 0.00 -0.87 0.00 0.00 66.00 64.64 1x0r h PRO 43 Cb 1.19 -0.09 -0.25 0.00 0.13 0.00 0.00 31.00 31.98 1x0r h PRO 43 CO 0.45 0.83 0.35 0.00 -0.23 0.00 0.00 178.00 179.39 1x0r s ALA 44 N -4.94 -2.00 0.68 -0.56 0.00 -1.26 -4.37 121.76 109.29 1x0r s ALA 44 Ca -0.10 2.03 -0.16 0.00 0.00 0.00 0.00 51.96 53.74 1x0r s ALA 44 Cb 0.14 -1.46 0.01 0.00 0.00 0.00 0.00 23.12 21.81 1x0r s ALA 44 CO 0.82 -0.29 1.17 -0.51 0.00 0.00 0.00 175.76 176.94 1x0r s ASP 45 N 0.64 4.74 -1.14 0.00 1.11 -1.26 -3.21 116.67 117.55 1x0r s ASP 45 Ca -0.01 2.22 -0.07 0.00 0.18 0.00 0.00 52.55 54.86 1x0r s ASP 45 Cb -0.05 -2.58 0.01 0.00 1.07 0.00 0.00 42.92 41.38 1x0r s ASP 45 CO -0.08 -1.88 1.00 0.49 1.18 0.00 0.00 175.17 175.87 1x0r n PHE 46 N -2.38 -2.42 -4.43 4.23 3.01 -1.26 -5.02 117.46 109.19 1x0r n PHE 46 Ca 0.12 0.86 -0.20 0.00 1.01 0.00 0.00 57.45 59.24 1x0r n PHE 46 Cb 0.51 -4.44 -0.14 0.00 -0.01 0.00 0.00 39.48 35.40 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 -3.27 0.91 0.05 4.37 2.01 -1.20 -5.08 115.64 113.43 1x0r s THR 47 Ca 0.47 -0.62 -0.21 0.00 0.31 0.00 0.00 61.69 61.64 1x0r s THR 47 Cb -0.21 -0.78 -0.13 0.00 0.01 0.00 0.00 72.50 71.39 1x0r s THR 47 CO 0.62 0.16 1.47 1.55 -0.69 0.00 0.00 174.62 177.73 1x0r h PRO 48 N 5.59 0.25 -0.53 4.92 0.13 -1.95 -1.48 132.00 138.93 1x0r h PRO 48 Ca -0.34 -0.09 -0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1x0r h PRO 48 Cb 1.18 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 1x0r h PRO 48 CO 0.48 0.50 0.31 0.28 -0.23 0.00 0.00 178.00 179.34 1x0r h VAL 49 N -0.03 1.16 -0.52 1.56 2.07 -1.99 -0.84 116.25 117.66 1x0r h VAL 49 Ca 0.04 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1x0r h VAL 49 Cb 0.40 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1x0r h VAL 49 CO 0.01 0.17 0.34 0.00 0.02 0.00 0.00 177.57 178.11 1x0r h THR 51 N 0.71 1.25 -0.42 0.00 2.02 -0.84 0.54 112.91 116.16 1x0r h THR 51 Ca 0.19 -0.78 0.02 0.00 0.77 0.00 0.00 66.41 66.61 1x0r h THR 51 Cb -0.08 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 1x0r h THR 51 CO -0.04 0.31 0.28 0.71 0.37 0.00 0.00 175.52 177.15 1x0r h THR 52 N 0.98 1.06 0.07 3.16 1.35 0.49 -2.05 112.91 117.97 1x0r h THR 52 Ca 0.23 -0.17 -0.26 0.00 -0.55 0.00 0.00 66.41 65.66 1x0r h THR 52 Cb 0.22 0.53 0.02 0.00 -1.73 0.00 0.00 68.15 67.19 1x0r h THR 52 CO -0.02 0.09 -1.07 -0.33 -0.25 0.00 0.00 175.52 173.95 1x0r h GLU 53 N 0.49 0.59 -0.73 4.72 5.08 0.19 -1.73 114.58 123.20 1x0r h GLU 53 Ca 0.16 -0.74 -0.04 0.00 -1.00 0.00 0.00 59.36 57.75 1x0r h GLU 53 Cb 0.06 0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1x0r h GLU 53 CO -0.04 1.32 0.29 0.74 -1.00 0.00 0.00 179.01 180.32 1x0r h PHE 54 N 0.20 1.10 -0.60 4.33 -1.00 -0.64 -0.64 116.94 119.69 1x0r h PHE 54 Ca -0.15 -0.08 -0.09 0.00 2.81 0.00 0.00 57.97 60.46 1x0r h PHE 54 Cb 1.75 -0.33 -0.02 0.00 3.61 0.00 0.00 35.95 40.96 1x0r h PHE 54 CO 0.12 0.84 0.02 0.28 -1.61 0.00 0.00 178.31 177.96 1x0r h VAL 55 N 1.06 1.26 -0.23 -0.55 2.07 -1.36 0.43 116.25 118.94 1x0r h VAL 55 Ca 0.24 -1.11 -0.03 0.00 0.82 0.00 0.00 66.70 66.63 1x0r h VAL 55 Cb 0.20 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1x0r h VAL 55 CO -0.02 0.41 0.04 -1.28 0.02 0.00 0.00 177.57 176.73 1x0r h SER 56 N 0.95 0.36 0.13 0.57 0.87 -0.37 0.07 113.55 116.13 1x0r h SER 56 Ca 0.18 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1x0r h SER 56 Cb 0.52 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 1x0r h SER 56 CO 0.03 0.52 -0.13 -0.26 -0.53 0.00 0.00 176.83 176.46 1x0r h PHE 57 N 0.18 -0.33 -0.89 2.24 -1.00 -1.03 -1.26 116.94 114.85 1x0r h PHE 57 Ca 0.07 0.00 0.06 0.00 2.81 0.00 0.00 57.97 60.91 1x0r h PHE 57 Cb 0.31 0.13 -0.06 0.00 3.61 0.00 0.00 35.95 39.94 1x0r h PHE 57 CO 0.02 -0.20 0.56 0.00 -1.61 0.00 0.00 178.31 177.08 1x0r h ALA 58 N 0.56 1.22 0.00 2.45 0.00 -0.79 0.19 119.26 122.88 1x0r h ALA 58 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1x0r h ALA 58 Cb 0.27 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1x0r h ALA 58 CO -0.03 0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.55 1x0r h ARG 59 N 1.03 0.00 -0.51 0.00 3.08 -0.77 -2.78 114.38 114.43 1x0r h ARG 59 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 1x0r h ARG 59 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1x0r h ARG 59 CO -0.16 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.28 1x0r n ARG 60 N -3.06 2.57 -0.15 0.04 1.74 -0.49 -4.67 116.66 112.64 1x0r n ARG 60 Ca 0.01 -2.39 -0.04 0.00 -0.77 0.00 0.00 57.85 54.66 1x0r n ARG 60 Cb 0.34 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.33 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 4.09 0.30 -0.10 -1.55 3.20 -0.69 0.38 116.97 122.60 1x0r h TYR 61 Ca 0.00 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 1x0r h TYR 61 Cb 0.95 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.14 1x0r h TYR 61 CO 0.34 0.11 -0.14 1.49 -1.64 0.00 0.00 178.16 178.31 1x0r h GLU 62 N 0.34 0.16 -0.79 1.82 4.81 -1.83 0.21 114.58 119.30 1x0r h GLU 62 Ca 0.22 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.38 1x0r h GLU 62 Cb 0.21 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.53 1x0r h GLU 62 CO -0.22 0.31 0.36 -0.44 -0.73 0.00 0.00 179.01 178.29 1x0r h ASP 63 N 0.15 1.05 -0.36 1.04 3.32 -0.60 -0.81 116.42 120.21 1x0r h ASP 63 Ca 0.03 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 56.92 1x0r h ASP 63 Cb 0.35 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1x0r h ASP 63 CO 0.02 0.90 0.13 -0.26 -1.72 0.00 0.00 179.24 178.31 1x0r h PHE 64 N 1.14 0.57 -0.82 4.55 -1.00 -0.67 -3.04 116.94 117.68 1x0r h PHE 64 Ca 0.27 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 60.99 1x0r h PHE 64 Cb 0.14 -0.17 -0.04 0.00 3.61 0.00 0.00 35.95 39.50 1x0r h PHE 64 CO 0.02 0.54 0.48 1.96 -1.61 0.00 0.00 178.31 179.69 1x0r h GLN 65 N 0.43 1.12 -0.99 1.51 4.20 -0.35 -1.49 115.11 119.55 1x0r h GLN 65 Ca 0.12 -0.11 0.11 0.00 0.06 0.00 0.00 58.65 58.83 1x0r h GLN 65 Cb 0.23 -0.23 -0.08 0.00 0.30 0.00 0.00 27.48 27.69 1x0r h GLN 65 CO -0.01 0.80 0.62 0.00 -0.67 0.00 0.00 178.83 179.57 1x0r h ARG 66 N 1.12 0.97 0.00 1.46 3.08 -1.13 -0.95 114.38 118.93 1x0r h ARG 66 Ca 0.29 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1x0r h ARG 66 Cb -0.02 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.81 1x0r h ARG 66 CO -0.05 0.64 0.00 1.28 -1.07 0.00 0.00 179.97 180.77 1x0r n LEU 67 N -4.62 0.00 0.00 3.04 4.77 -0.65 -4.92 117.00 114.62 1x0r n LEU 67 Ca 0.18 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1x0r n LEU 67 Cb 0.33 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1x0r n LEU 67 CO 0.28 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1x0r n GLY 68 N 0.69 0.38 3.18 -0.72 0.00 -0.36 -4.95 105.19 103.41 1x0r n GLY 68 Ca 0.13 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.00 1.81 0.35 1.61 1.01 -0.67 -1.94 120.40 120.57 1x0r s VAL 69 Ca 0.00 -0.89 0.07 0.00 0.00 0.00 0.00 61.98 61.16 1x0r s VAL 69 Cb 0.00 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.79 1x0r s VAL 69 CO 0.00 0.51 0.36 -0.62 0.00 0.00 0.00 175.10 175.34 1x0r s ASP 70 N 0.26 5.43 0.05 3.32 -1.08 0.13 -3.79 116.67 120.99 1x0r s ASP 70 Ca -0.13 -0.45 0.08 0.00 -0.52 0.00 0.00 52.55 51.52 1x0r s ASP 70 Cb -0.16 -0.97 -0.03 0.00 -1.46 0.00 0.00 42.92 40.30 1x0r s ASP 70 CO 0.06 -0.43 -0.20 -0.76 0.52 0.00 0.00 175.17 174.36 1x0r s LEU 71 N -4.07 2.51 -0.17 -1.34 1.43 -1.26 -0.20 118.68 115.58 1x0r s LEU 71 Ca 0.43 -0.48 -0.09 0.00 -1.03 0.00 0.00 54.13 52.96 1x0r s LEU 71 Cb -0.07 -1.46 0.06 0.00 0.03 0.00 0.00 46.19 44.76 1x0r s LEU 71 CO 0.28 0.25 0.41 -0.51 0.23 0.00 0.00 176.35 177.00 1x0r s ILE 72 N -0.92 -0.07 0.66 -0.59 2.07 0.02 -4.19 121.20 118.17 1x0r s ILE 72 Ca 0.14 0.10 0.04 0.00 -1.41 0.00 0.00 60.65 59.53 1x0r s ILE 72 Cb -0.10 -0.61 0.11 0.00 0.13 0.00 0.00 42.46 41.99 1x0r s ILE 72 CO 0.05 0.04 0.91 -0.83 -1.91 0.00 0.00 174.94 173.20 1x0r s GLY 73 N 1.49 1.74 -0.26 1.50 0.00 0.69 -0.84 107.32 111.64 1x0r s GLY 73 Ca -0.09 -1.97 -0.15 0.00 0.00 0.00 0.00 44.72 42.51 1x0r s GLY 73 CO -0.13 -1.44 0.64 -2.27 0.00 0.00 0.00 173.10 169.91 1x0r s LEU 74 N -4.93 -0.80 0.35 0.66 2.96 -0.30 0.55 118.68 117.18 1x0r s LEU 74 Ca 0.65 1.41 -0.09 0.00 -0.22 0.00 0.00 54.13 55.88 1x0r s LEU 74 Cb -0.05 2.21 0.02 0.00 0.50 0.00 0.00 46.19 48.87 1x0r s LEU 74 CO 0.42 -0.23 0.61 -0.94 -1.32 0.00 0.00 176.35 174.89 1x0r s SER 75 N 1.57 0.46 0.00 3.68 1.04 -0.67 -1.06 113.70 118.72 1x0r s SER 75 Ca -0.10 -1.29 0.22 0.00 0.48 0.00 0.00 55.95 55.26 1x0r s SER 75 Cb -0.06 0.74 1.32 0.00 0.10 0.00 0.00 66.02 68.13 1x0r s SER 75 CO -0.18 -1.45 1.80 1.33 0.98 0.00 0.00 173.24 175.72 1x0r n VAL 76 N -0.54 0.00 -1.46 5.02 0.24 -1.26 -0.83 118.33 119.50 1x0r n VAL 76 Ca -0.03 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.98 1x0r n VAL 76 Cb 0.61 -0.41 0.13 0.00 -1.47 0.00 0.00 33.84 32.69 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 -1.77 3.73 0.77 -1.34 1.11 -1.26 -2.74 116.67 115.18 1x0r s ASP 77 Ca 0.33 1.16 -0.11 0.00 0.18 0.00 0.00 52.55 54.11 1x0r s ASP 77 Cb 0.15 -1.81 0.06 0.00 1.07 0.00 0.00 42.92 42.39 1x0r s ASP 77 CO 0.26 -2.43 1.14 -0.94 1.18 0.00 0.00 175.17 174.38 1x0r s SER 78 N -3.86 4.80 0.35 0.27 1.04 -1.26 -3.20 113.70 111.84 1x0r s SER 78 Ca 0.63 0.86 0.15 0.00 0.48 0.00 0.00 55.95 58.07 1x0r s SER 78 Cb -0.15 -1.46 0.61 0.00 0.10 0.00 0.00 66.02 65.12 1x0r s SER 78 CO 0.54 -1.72 1.72 -0.37 0.98 0.00 0.00 173.24 174.40 1x0r h VAL 79 N -0.91 1.12 -0.51 5.02 -1.51 -1.94 -1.29 116.25 116.24 1x0r h VAL 79 Ca -0.46 -1.64 -0.11 0.00 -1.23 0.00 0.00 66.70 63.26 1x0r h VAL 79 Cb 1.31 1.94 -0.02 0.00 -2.13 0.00 0.00 31.29 32.39 1x0r h VAL 79 CO 0.65 0.44 -0.10 -0.26 -1.23 0.00 0.00 177.57 177.07 1x0r h PHE 80 N 0.00 1.05 -0.39 5.19 -1.00 -2.00 -1.24 116.94 118.55 1x0r h PHE 80 Ca -0.00 -0.21 -0.09 0.00 2.81 0.00 0.00 57.97 60.48 1x0r h PHE 80 Cb 0.90 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 40.18 1x0r h PHE 80 CO 0.00 0.99 -0.14 0.77 -1.61 0.00 0.00 178.31 178.32 1x0r h SER 81 N 0.85 0.69 -0.44 2.17 0.02 -1.88 -1.35 113.55 113.60 1x0r h SER 81 Ca 0.14 -0.21 0.04 0.00 -0.84 0.00 0.00 61.79 60.92 1x0r h SER 81 Cb 0.64 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.95 1x0r h SER 81 CO 0.04 0.85 0.21 0.45 -1.14 0.00 0.00 176.83 177.24 1x0r h HIS 82 N 0.63 0.38 -0.06 3.45 3.86 -0.86 0.24 115.15 122.79 1x0r h HIS 82 Ca 0.11 0.02 -0.13 0.00 -1.16 0.00 0.00 60.37 59.21 1x0r h HIS 82 Cb 0.60 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 1x0r h HIS 82 CO 0.03 0.18 -0.54 0.82 0.86 0.00 0.00 177.93 179.28 1x0r h ILE 83 N 0.41 1.37 -0.42 2.45 2.04 -0.92 -1.36 117.51 121.09 1x0r h ILE 83 Ca 0.19 -1.85 -0.12 0.00 1.00 0.00 0.00 64.86 64.09 1x0r h ILE 83 Cb 0.12 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 1x0r h ILE 83 CO -0.15 0.54 -0.21 0.11 0.00 0.00 0.00 178.15 178.44 1x0r h LYS 84 N 0.14 0.83 -0.27 2.37 1.79 -0.86 0.24 116.57 120.81 1x0r h LYS 84 Ca 0.00 -0.33 -0.07 0.00 -2.18 0.00 0.00 60.65 58.07 1x0r h LYS 84 Cb 1.00 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.61 1x0r h LYS 84 CO 0.08 0.96 -0.10 2.35 -1.08 0.00 0.00 179.45 181.66 1x0r h TRP 85 N 0.72 0.61 -0.78 -1.35 7.01 -0.20 -0.85 115.95 121.11 1x0r h TRP 85 Ca 0.10 -0.14 0.01 0.00 2.11 0.00 0.00 58.89 60.97 1x0r h TRP 85 Cb 0.73 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 27.61 1x0r h TRP 85 CO 0.04 0.77 0.51 0.87 -2.79 0.00 0.00 178.44 177.84 1x0r h LYS 86 N 0.28 1.03 -0.78 2.65 1.57 -1.05 -0.54 116.57 119.72 1x0r h LYS 86 Ca 0.06 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1x0r h LYS 86 Cb 0.59 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 1x0r h LYS 86 CO 0.03 0.69 0.38 0.93 -0.57 0.00 0.00 179.45 180.91 1x0r h GLU 87 N 1.06 1.13 0.13 3.15 5.08 -0.57 -2.05 114.58 122.52 1x0r h GLU 87 Ca 0.29 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1x0r h GLU 87 Cb -0.12 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 28.92 1x0r h GLU 87 CO -0.06 0.88 -0.12 2.35 -1.00 0.00 0.00 179.01 181.06 1x0r h TRP 88 N 1.11 -0.30 -0.56 4.33 7.01 -0.75 -1.46 115.95 125.33 1x0r h TRP 88 Ca 0.27 0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.36 1x0r h TRP 88 Cb 0.12 0.12 -0.07 0.00 -2.10 0.00 0.00 29.16 27.23 1x0r h TRP 88 CO 0.01 -0.18 0.17 0.82 -2.79 0.00 0.00 178.44 176.47 1x0r h ILE 89 N -0.27 0.75 -0.35 2.65 2.04 -1.05 0.80 117.51 122.08 1x0r h ILE 89 Ca 0.00 -0.11 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 1x0r h ILE 89 Cb 0.25 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1x0r h ILE 89 CO -0.03 0.06 0.10 -0.08 0.00 0.00 0.00 178.15 178.21 1x0r h GLU 90 N 0.33 0.55 -0.28 2.37 4.81 -1.13 0.16 114.58 121.39 1x0r h GLU 90 Ca 0.28 -0.12 -0.19 0.00 -0.13 0.00 0.00 59.36 59.20 1x0r h GLU 90 Cb 0.36 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1x0r h GLU 90 CO -0.31 0.59 -0.56 -0.09 -0.73 0.00 0.00 179.01 177.91 1x0r h ARG 91 N 0.42 0.87 0.00 1.92 2.43 -0.85 -2.37 114.38 116.80 1x0r h ARG 91 Ca 0.11 -0.56 -0.04 0.00 -0.81 0.00 0.00 59.98 58.69 1x0r h ARG 91 Cb 0.27 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1x0r h ARG 91 CO -0.00 1.19 -1.84 0.72 -1.51 0.00 0.00 179.97 178.54 1x0r n HIS 92 N -4.00 0.21 0.02 2.20 8.25 0.27 -4.37 115.22 117.80 1x0r n HIS 92 Ca -0.04 0.06 0.05 0.00 -0.26 0.00 0.00 57.72 57.53 1x0r n HIS 92 Cb 0.63 -0.64 -0.07 0.00 1.12 0.00 0.00 29.99 31.03 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 -2.40 0.00 -0.71 1.59 2.08 0.50 -4.83 119.36 115.59 1x0r n ILE 93 Ca -0.06 -0.22 0.00 0.00 0.56 0.00 0.00 62.75 63.03 1x0r n ILE 93 Cb 0.63 0.32 0.00 0.00 -0.75 0.00 0.00 39.64 39.84 1x0r n ILE 93 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1x0r n GLY 94 N 1.91 0.59 3.39 7.39 0.00 -0.83 -4.91 105.19 112.72 1x0r n GLY 94 Ca -0.02 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 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 3.19 -0.11 1.61 1.01 -1.23 -4.93 120.40 117.94 1x0r s VAL 95 Ca 0.00 -0.61 -0.18 0.00 0.00 0.00 0.00 61.98 61.19 1x0r s VAL 95 Cb 0.00 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 1x0r s VAL 95 CO 0.00 0.51 0.48 -0.60 0.00 0.00 0.00 175.10 175.49 1x0r s ARG 96 N 0.42 4.33 -0.21 2.72 3.52 -1.26 -2.66 118.95 125.80 1x0r s ARG 96 Ca -0.09 0.46 -0.22 0.00 -0.13 0.00 0.00 55.73 55.75 1x0r s ARG 96 Cb -0.16 -3.43 -0.02 0.00 -1.56 0.00 0.00 34.95 29.79 1x0r s ARG 96 CO 0.05 0.18 0.68 0.42 -0.81 0.00 0.00 175.30 175.81 1x0r s ILE 97 N 0.56 4.97 -2.43 4.11 -1.09 -1.26 -4.93 121.20 121.13 1x0r s ILE 97 Ca 0.26 1.27 0.24 0.00 -2.23 0.00 0.00 60.65 60.20 1x0r s ILE 97 Cb -0.15 -3.99 0.19 0.00 -1.58 0.00 0.00 42.46 36.93 1x0r s ILE 97 CO 0.11 0.06 1.32 -0.81 -1.23 0.00 0.00 174.94 174.38 1x0r n PRO 98 N 5.37 1.65 -3.94 2.79 -0.04 -1.26 -4.93 135.00 134.63 1x0r n PRO 98 Ca 0.00 -1.27 -0.22 0.00 -0.04 0.00 0.00 63.50 61.97 1x0r n PRO 98 Cb 0.49 -1.47 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.23 2.75 0.59 0.54 -0.12 -1.26 -5.09 117.98 113.15 1x0r s PHE 99 Ca 0.26 -0.40 -0.14 0.00 -0.05 0.00 0.00 56.93 56.59 1x0r s PHE 99 Cb 0.19 -1.81 -0.05 0.00 -0.63 0.00 0.00 43.02 40.73 1x0r s PHE 99 CO 0.43 0.20 1.02 -1.25 -0.05 0.00 0.00 175.22 175.58 1x0r s PRO 100 N -3.94 3.56 -0.07 1.99 0.04 -1.26 -4.89 135.00 130.43 1x0r s PRO 100 Ca 0.41 0.95 0.03 0.00 0.04 0.00 0.00 61.00 62.43 1x0r s PRO 100 Cb -0.03 -2.08 0.01 0.00 0.04 0.00 0.00 34.50 32.44 1x0r s PRO 100 CO 0.24 -0.60 -0.16 0.42 0.04 0.00 0.00 177.00 176.94 1x0r s ILE 101 N -2.80 1.43 0.30 0.56 1.01 -1.26 -0.23 121.20 120.20 1x0r s ILE 101 Ca 0.59 -0.67 -0.28 0.00 0.00 0.00 0.00 60.65 60.29 1x0r s ILE 101 Cb -0.12 -1.26 -0.09 0.00 0.01 0.00 0.00 42.46 41.00 1x0r s ILE 101 CO 0.42 0.42 1.01 -0.63 0.00 0.00 0.00 174.94 176.16 1x0r s ILE 102 N 0.40 3.87 -0.30 2.92 1.01 0.19 -1.63 121.20 127.66 1x0r s ILE 102 Ca -0.12 1.73 -0.09 0.00 0.00 0.00 0.00 60.65 62.17 1x0r s ILE 102 Cb -0.15 -4.04 -0.00 0.00 0.01 0.00 0.00 42.46 38.28 1x0r s ILE 102 CO 0.04 0.29 0.12 0.00 0.00 0.00 0.00 174.94 175.40 1x0r s ALA 103 N -1.36 3.20 -0.45 9.38 0.00 -0.24 -1.67 121.76 130.62 1x0r s ALA 103 Ca 0.47 -1.39 0.07 0.00 0.00 0.00 0.00 51.96 51.11 1x0r s ALA 103 Cb -0.25 -2.29 0.40 0.00 0.00 0.00 0.00 23.12 20.98 1x0r s ALA 103 CO 0.32 -0.88 1.02 -3.47 0.00 0.00 0.00 175.76 172.75 1x0r n ASP 104 N 4.94 3.92 -4.70 0.00 2.03 -0.01 -4.59 116.55 118.14 1x0r n ASP 104 Ca -0.14 -3.52 -0.42 0.00 0.52 0.00 0.00 54.79 51.23 1x0r n ASP 104 Cb 0.49 -0.51 -0.03 0.00 -0.72 0.00 0.00 41.12 40.35 1x0r n ASP 104 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1x0r s PRO 105 N -3.39 4.28 0.00 -0.67 0.04 -1.11 -1.49 135.00 132.66 1x0r s PRO 105 Ca 0.45 2.10 0.00 0.00 0.04 0.00 0.00 61.00 63.58 1x0r s PRO 105 Cb 0.37 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 31.48 1x0r s PRO 105 CO -0.14 -0.56 0.00 1.04 0.04 0.00 0.00 177.00 177.39 1x0r n GLN 106 N 4.82 0.00 -1.02 4.56 1.13 -1.26 -4.72 117.38 120.90 1x0r n GLN 106 Ca 0.13 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.19 1x0r n GLN 106 Cb 0.42 0.00 -0.00 0.00 0.11 0.00 0.00 30.24 30.77 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 -0.35 0.47 0.06 1.08 0.00 -0.56 -4.93 105.19 100.97 1x0r n GLY 107 Ca 0.00 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.50 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 0.99 -0.34 2.61 2.02 -1.84 0.95 112.91 117.30 1x0r h THR 108 Ca -0.01 -0.09 -0.17 0.00 0.77 0.00 0.00 66.41 66.90 1x0r h THR 108 Cb 0.08 1.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1x0r h THR 108 CO 0.02 0.02 -0.45 0.58 0.37 0.00 0.00 175.52 176.06 1x0r h VAL 109 N -0.10 1.27 -0.98 3.16 2.07 -1.91 -2.83 116.25 116.93 1x0r h VAL 109 Ca -0.01 -1.63 0.01 0.00 0.82 0.00 0.00 66.70 65.90 1x0r h VAL 109 Cb 0.09 1.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.31 1x0r h VAL 109 CO 0.01 0.54 0.65 0.00 0.02 0.00 0.00 177.57 178.79 1x0r h ALA 110 N 0.72 1.25 -0.40 1.67 0.00 -1.74 -1.91 119.26 118.84 1x0r h ALA 110 Ca 0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1x0r h ALA 110 Cb 1.05 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1x0r h ALA 110 CO 0.11 0.63 0.09 0.00 0.00 0.00 0.00 179.25 180.07 1x0r h ARG 111 N 1.33 0.65 -0.09 0.00 3.08 0.10 0.13 114.38 119.58 1x0r h ARG 111 Ca 0.36 -0.16 0.02 0.00 0.07 0.00 0.00 59.98 60.27 1x0r h ARG 111 Cb -0.15 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 29.82 1x0r h ARG 111 CO -0.08 0.68 0.06 0.00 -1.07 0.00 0.00 179.97 179.56 1x0r h ARG 112 N 0.51 0.03 -0.30 0.04 2.47 -1.15 0.14 114.38 116.12 1x0r h ARG 112 Ca 0.12 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.84 1x0r h ARG 112 Cb 0.33 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.64 1x0r h ARG 112 CO 0.00 0.02 0.00 1.28 0.56 0.00 0.00 179.97 181.83 1x0r n LEU 113 N -4.52 3.16 -3.14 3.04 4.77 -0.78 -4.30 117.00 115.23 1x0r n LEU 113 Ca -0.01 -1.30 -0.22 0.00 -0.03 0.00 0.00 56.01 54.44 1x0r n LEU 113 Cb 0.15 -0.19 0.05 0.00 -2.33 0.00 0.00 43.42 41.10 1x0r n LEU 113 CO 0.34 0.65 0.08 0.61 -1.33 0.00 0.00 177.39 177.75 1x0r n GLY 114 N 1.44 -0.50 0.46 -0.72 0.00 0.50 -4.58 105.19 101.79 1x0r n GLY 114 Ca 0.18 0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.48 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 -4.27 1.57 -4.45 0.99 4.77 0.33 -4.72 117.00 111.21 1x0r n LEU 115 Ca -0.07 -0.50 -0.43 0.00 -0.03 0.00 0.00 56.01 54.97 1x0r n LEU 115 Cb 0.60 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.56 1x0r n LEU 115 CO 0.52 0.27 0.09 -0.76 -1.33 0.00 0.00 177.39 176.18 1x0r s LEU 116 N -2.22 5.10 0.00 2.23 1.43 -1.26 -0.83 118.68 123.13 1x0r s LEU 116 Ca 0.30 -0.90 0.02 0.00 -1.03 0.00 0.00 54.13 52.52 1x0r s LEU 116 Cb 0.20 -2.30 0.02 0.00 0.03 0.00 0.00 46.19 44.13 1x0r s LEU 116 CO 0.42 -0.61 0.15 1.41 0.23 0.00 0.00 176.35 177.95 1x0r n HIS 117 N 5.51 -2.06 -0.23 0.29 8.25 -1.26 -5.00 115.22 120.72 1x0r n HIS 117 Ca -0.09 -0.56 0.00 0.00 -0.26 0.00 0.00 57.72 56.81 1x0r n HIS 117 Cb 0.46 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.45 1x0r n HIS 117 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x0r n ALA 118 N -2.77 0.00 0.00 -1.41 0.00 -1.26 -3.24 120.51 111.83 1x0r n ALA 118 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1x0r n ALA 118 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.60 1x0r n ALA 118 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1x0r n GLU 119 N -0.54 0.00 -3.73 0.00 1.02 -1.26 -4.78 120.64 111.34 1x0r n GLU 119 Ca 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.02 1x0r n GLU 119 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 31.30 1x0r n GLU 119 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1x0r s SER 120 N 0.00 -0.30 0.00 1.62 0.15 -1.20 -5.00 113.70 108.98 1x0r s SER 120 Ca 0.00 0.57 0.27 0.00 0.70 0.00 0.00 55.95 57.50 1x0r s SER 120 Cb 0.00 0.48 0.96 0.00 -1.71 0.00 0.00 66.02 65.75 1x0r s SER 120 CO 0.00 -0.15 1.69 0.00 1.20 0.00 0.00 173.24 175.97 1x0r n ALA 121 N 3.97 2.80 -0.02 5.45 0.00 -1.26 -4.22 120.51 127.23 1x0r n ALA 121 Ca -0.23 -0.41 -0.02 0.00 0.00 0.00 0.00 53.44 52.78 1x0r n ALA 121 Cb 0.54 -1.17 -0.03 0.00 0.00 0.00 0.00 19.45 18.80 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 -0.27 0.26 -4.56 0.00 5.66 -1.26 -5.05 114.28 109.07 1x0r n THR 122 Ca 0.16 -0.14 -0.29 0.00 -3.05 0.00 0.00 64.05 60.73 1x0r n THR 122 Cb 0.34 -0.81 -0.13 0.00 -1.55 0.00 0.00 70.33 68.17 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 -2.09 2.33 0.62 1.09 4.02 -1.26 -4.90 115.29 115.10 1x0r s HIS 123 Ca -0.04 -0.38 -0.15 0.00 1.02 0.00 0.00 55.06 55.51 1x0r s HIS 123 Cb 0.01 -1.30 -0.02 0.00 -1.02 0.00 0.00 32.58 30.25 1x0r s HIS 123 CO 0.14 0.27 1.08 0.95 1.02 0.00 0.00 174.74 178.19 1x0r s THR 124 N -0.98 3.62 0.44 1.30 -4.23 -1.26 -4.70 115.64 109.83 1x0r s THR 124 Ca 0.13 0.74 -0.07 0.00 -1.18 0.00 0.00 61.69 61.31 1x0r s THR 124 Cb -0.10 -3.28 0.11 0.00 1.34 0.00 0.00 72.50 70.57 1x0r s THR 124 CO 0.05 -0.48 0.45 0.55 -0.54 0.00 0.00 174.62 174.65 1x0r n VAL 125 N -2.25 0.00 -3.31 2.29 3.14 -0.01 -3.10 118.33 115.09 1x0r n VAL 125 Ca 0.09 -0.24 -0.46 0.00 -2.96 0.00 0.00 64.34 60.77 1x0r n VAL 125 Cb 0.53 -1.31 -0.01 0.00 -1.06 0.00 0.00 33.84 31.99 1x0r n VAL 125 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1x0r s ARG 126 N -4.00 3.91 0.35 1.45 0.52 -0.07 -4.03 118.95 117.08 1x0r s ARG 126 Ca 0.28 -2.82 -0.03 0.00 -0.52 0.00 0.00 55.73 52.64 1x0r s ARG 126 Cb -0.02 -4.52 -0.04 0.00 0.52 0.00 0.00 34.95 30.88 1x0r s ARG 126 CO 0.21 -1.29 0.60 0.20 0.02 0.00 0.00 175.30 175.03 1x0r s GLY 127 N 1.81 1.59 -0.04 -3.53 0.00 -1.25 -1.17 107.32 104.73 1x0r s GLY 127 Ca 0.25 -0.68 -0.02 0.00 0.00 0.00 0.00 44.72 44.28 1x0r s GLY 127 CO -0.08 -0.58 0.07 0.14 0.00 0.00 0.00 173.10 172.65 1x0r s VAL 128 N -2.29 -0.11 -0.14 1.40 1.01 -0.05 -0.78 120.40 119.42 1x0r s VAL 128 Ca 0.43 0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.76 1x0r s VAL 128 Cb -0.10 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.12 1x0r s VAL 128 CO 0.35 0.14 -0.15 -0.36 0.00 0.00 0.00 175.10 175.08 1x0r s PHE 129 N 1.80 2.78 -0.17 5.22 0.40 0.64 -1.52 117.98 127.12 1x0r s PHE 129 Ca -0.00 -0.89 -0.07 0.00 -0.60 0.00 0.00 56.93 55.37 1x0r s PHE 129 Cb -0.12 -1.87 -0.04 0.00 0.51 0.00 0.00 43.02 41.50 1x0r s PHE 129 CO -0.04 -0.38 0.06 0.42 0.70 0.00 0.00 175.22 175.98 1x0r s ILE 130 N 0.64 4.75 -0.03 0.64 1.01 -0.39 -1.49 121.20 126.32 1x0r s ILE 130 Ca -0.08 -0.05 0.02 0.00 0.00 0.00 0.00 60.65 60.54 1x0r s ILE 130 Cb -0.16 -3.13 0.01 0.00 0.01 0.00 0.00 42.46 39.19 1x0r s ILE 130 CO 0.03 0.47 -0.08 -0.69 0.00 0.00 0.00 174.94 174.67 1x0r s VAL 131 N 0.26 0.74 0.35 2.92 1.01 -0.09 0.01 120.40 125.60 1x0r s VAL 131 Ca 0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.68 1x0r s VAL 131 Cb -0.12 -0.67 0.07 0.00 0.00 0.00 0.00 36.38 35.66 1x0r s VAL 131 CO 0.00 0.24 0.48 -0.90 0.00 0.00 0.00 175.10 174.92 1x0r n ASP 132 N 3.43 0.54 0.00 3.32 5.68 0.04 -1.32 116.55 128.23 1x0r n ASP 132 Ca -0.19 -1.48 0.13 0.00 -0.50 0.00 0.00 54.79 52.75 1x0r n ASP 132 Cb 0.54 -0.32 0.73 0.00 -1.14 0.00 0.00 41.12 40.93 1x0r n ASP 132 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1x0r n ALA 133 N -3.02 2.41 0.03 2.12 0.00 -1.25 -0.39 120.51 120.41 1x0r n ALA 133 Ca -0.08 -0.15 0.11 0.00 0.00 0.00 0.00 53.44 53.33 1x0r n ALA 133 Cb 0.27 -1.44 0.28 0.00 0.00 0.00 0.00 19.45 18.56 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 -1.17 2.51 -1.06 0.00 1.74 -1.26 -4.60 116.66 112.82 1x0r n ARG 134 Ca 0.16 -2.33 -0.02 0.00 -0.77 0.00 0.00 57.85 54.89 1x0r n ARG 134 Cb 0.17 -1.52 -0.01 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 1.54 0.55 3.80 -0.13 0.00 0.48 -4.95 105.19 106.48 1x0r n GLY 135 Ca 0.21 -0.83 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.06 5.34 0.04 1.61 1.01 -1.25 0.62 120.40 125.71 1x0r s VAL 136 Ca 0.00 0.42 -0.31 0.00 0.00 0.00 0.00 61.98 62.10 1x0r s VAL 136 Cb 0.00 -3.54 -0.06 0.00 0.00 0.00 0.00 36.38 32.78 1x0r s VAL 136 CO 0.00 0.51 1.35 -0.63 0.00 0.00 0.00 175.10 176.33 1x0r s ILE 137 N -0.33 3.69 -0.15 2.22 1.01 -0.21 -0.78 121.20 126.64 1x0r s ILE 137 Ca 0.16 1.15 0.07 0.00 0.00 0.00 0.00 60.65 62.02 1x0r s ILE 137 Cb -0.13 -3.74 -0.09 0.00 0.01 0.00 0.00 42.46 38.51 1x0r s ILE 137 CO 0.05 0.04 0.21 0.54 0.00 0.00 0.00 174.94 175.78 1x0r n ARG 138 N 4.66 2.25 -3.91 2.79 5.12 0.10 -0.03 116.66 127.64 1x0r n ARG 138 Ca 0.12 -0.04 -0.01 0.00 -1.93 0.00 0.00 57.85 55.99 1x0r n ARG 138 Cb 0.44 -1.01 0.02 0.00 -1.16 0.00 0.00 32.46 30.74 1x0r n ARG 138 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1x0r s THR 139 N -2.11 0.00 -0.30 0.55 2.01 -1.23 -4.89 115.64 109.67 1x0r s THR 139 Ca -0.00 -0.44 -0.20 0.00 0.31 0.00 0.00 61.69 61.35 1x0r s THR 139 Cb 0.05 -2.87 0.20 0.00 0.01 0.00 0.00 72.50 69.89 1x0r s THR 139 CO 0.29 0.00 1.36 -0.76 -0.69 0.00 0.00 174.62 174.82 1x0r s LEU 141 N -3.51 -0.05 -0.31 4.42 1.43 -0.58 -1.27 118.68 118.81 1x0r s LEU 141 Ca 0.24 0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.45 1x0r s LEU 141 Cb -0.02 1.08 0.09 0.00 0.03 0.00 0.00 46.19 47.37 1x0r s LEU 141 CO 0.03 -0.01 0.00 -0.31 0.23 0.00 0.00 176.35 176.29 1x0r s TYR 142 N 0.53 3.46 0.20 0.29 1.51 -1.26 -0.87 117.35 121.21 1x0r s TYR 142 Ca -0.00 -2.69 0.02 0.00 -1.01 0.00 0.00 57.07 53.39 1x0r s TYR 142 Cb -0.04 -2.52 -0.04 0.00 -0.11 0.00 0.00 41.96 39.26 1x0r s TYR 142 CO -0.13 -0.92 0.34 0.71 -1.11 0.00 0.00 175.55 174.45 1x0r s TYR 143 N 1.02 3.48 0.00 2.71 1.51 -0.32 -4.94 117.35 120.80 1x0r s TYR 143 Ca 0.04 0.14 0.00 0.00 -1.01 0.00 0.00 57.07 56.24 1x0r s TYR 143 Cb -0.19 -1.69 0.00 0.00 -0.11 0.00 0.00 41.96 39.96 1x0r s TYR 143 CO -0.08 0.44 0.00 -0.35 -1.11 0.00 0.00 175.55 174.45 1x0r n PRO 144 N -0.88 0.00 0.00 -1.71 -0.04 -1.26 -0.90 135.00 130.21 1x0r n PRO 144 Ca -0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 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 -4.20 0.54 0.00 -1.26 -4.54 120.64 111.18 1x0r n GLU 146 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 57.16 56.90 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 1.41 0.48 -1.84 0.20 -1.26 -5.11 118.68 112.55 1x0r s LEU 147 Ca 0.00 -0.31 -0.20 0.00 0.69 0.00 0.00 54.13 54.31 1x0r s LEU 147 Cb 0.00 -0.85 -0.09 0.00 -0.43 0.00 0.00 46.19 44.82 1x0r s LEU 147 CO 0.00 -0.05 1.00 -0.83 -0.29 0.00 0.00 176.35 176.18 1x0r s GLY 148 N 1.25 2.39 0.84 7.98 0.00 -1.26 -4.94 107.32 113.59 1x0r s GLY 148 Ca -0.03 0.48 -0.12 0.00 0.00 0.00 0.00 44.72 45.05 1x0r s GLY 148 CO -0.03 0.78 1.10 0.50 0.00 0.00 0.00 173.10 175.45 1x0r s ARG 149 N -3.35 1.71 -0.47 2.90 0.52 -1.26 -5.02 118.95 113.98 1x0r s ARG 149 Ca 0.64 0.59 -0.10 0.00 -0.52 0.00 0.00 55.73 56.34 1x0r s ARG 149 Cb -0.13 -1.88 0.11 0.00 0.52 0.00 0.00 34.95 33.57 1x0r s ARG 149 CO 0.20 -1.87 0.35 -1.17 0.02 0.00 0.00 175.30 172.82 1x0r s LEU 150 N -5.92 5.63 0.32 2.53 2.96 -1.26 -4.95 118.68 117.99 1x0r s LEU 150 Ca 0.62 -1.76 0.15 0.00 -0.22 0.00 0.00 54.13 52.92 1x0r s LEU 150 Cb -0.15 -2.04 0.51 0.00 0.50 0.00 0.00 46.19 45.01 1x0r s LEU 150 CO 0.55 -0.67 1.67 0.58 -1.32 0.00 0.00 176.35 177.15 1x0r h VAL 151 N 6.06 1.15 -0.04 1.68 2.07 -1.96 -2.17 116.25 123.05 1x0r h VAL 151 Ca -0.23 -1.83 -0.01 0.00 0.82 0.00 0.00 66.70 65.45 1x0r h VAL 151 Cb 1.08 2.04 -0.00 0.00 -1.52 0.00 0.00 31.29 32.89 1x0r h VAL 151 CO 0.86 0.48 -0.05 0.44 0.02 0.00 0.00 177.57 179.33 1x0r h ASP 152 N 0.00 0.05 0.32 0.57 3.32 -1.92 -0.79 116.42 117.97 1x0r h ASP 152 Ca -0.00 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.97 1x0r h ASP 152 Cb 1.00 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 1x0r h ASP 152 CO 0.06 0.10 -0.33 -0.08 -1.72 0.00 0.00 179.24 177.28 1x0r h GLU 153 N 0.05 0.02 -0.27 3.56 4.57 -1.73 -0.41 114.58 120.37 1x0r h GLU 153 Ca 0.01 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.10 1x0r h GLU 153 Cb 0.12 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 1x0r h GLU 153 CO 0.01 0.35 -0.18 0.82 -1.18 0.00 0.00 179.01 178.83 1x0r h ILE 154 N 0.02 1.30 -0.52 2.32 2.04 -1.23 0.15 117.51 121.59 1x0r h ILE 154 Ca -0.00 -1.30 0.02 0.00 1.00 0.00 0.00 64.86 64.58 1x0r h ILE 154 Cb 0.60 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 1x0r h ILE 154 CO 0.04 0.41 0.32 -0.07 0.00 0.00 0.00 178.15 178.85 1x0r h LEU 155 N 0.34 0.52 -0.72 1.44 3.38 -0.95 -1.09 115.31 118.23 1x0r h LEU 155 Ca 0.06 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.07 1x0r h LEU 155 Cb 0.71 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 1x0r h LEU 155 CO 0.05 0.37 0.43 -0.09 0.09 0.00 0.00 178.44 179.29 1x0r h ARG 156 N 0.64 0.79 -0.09 1.13 2.43 -0.85 0.14 114.38 118.56 1x0r h ARG 156 Ca 0.21 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1x0r h ARG 156 Cb 0.01 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.38 1x0r h ARG 156 CO -0.09 0.53 0.05 0.82 -1.51 0.00 0.00 179.97 179.77 1x0r h ILE 157 N 0.82 1.08 -0.45 1.20 2.04 -0.35 -0.27 117.51 121.58 1x0r h ILE 157 Ca 0.30 -0.21 -0.13 0.00 1.00 0.00 0.00 64.86 65.82 1x0r h ILE 157 Cb 0.10 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1x0r h ILE 157 CO -0.15 0.07 -0.22 1.62 0.00 0.00 0.00 178.15 179.47 1x0r h VAL 158 N 0.07 1.27 -0.20 1.67 3.04 -0.93 -0.89 116.25 120.28 1x0r h VAL 158 Ca 0.03 -1.37 0.01 0.00 -1.01 0.00 0.00 66.70 64.36 1x0r h VAL 158 Cb 0.06 1.15 -0.01 0.00 -2.01 0.00 0.00 31.29 30.48 1x0r h VAL 158 CO -0.01 0.47 0.11 0.50 -1.01 0.00 0.00 177.57 177.63 1x0r h LYS 159 N 0.80 0.22 -0.67 4.17 3.64 -0.63 -0.39 116.57 123.72 1x0r h LYS 159 Ca 0.10 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1x0r h LYS 159 Cb 0.78 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.52 1x0r h LYS 159 CO 0.06 0.15 0.39 0.00 -2.27 0.00 0.00 179.45 177.79 1x0r h ALA 160 N 1.09 0.85 -0.25 5.00 0.00 -0.88 0.16 119.26 125.25 1x0r h ALA 160 Ca 0.08 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1x0r h ALA 160 Cb 0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1x0r h ALA 160 CO -0.05 0.34 0.03 -0.07 0.00 0.00 0.00 179.25 179.50 1x0r h LEU 161 N 0.91 0.40 -0.59 0.00 4.07 -1.11 0.15 115.31 119.14 1x0r h LEU 161 Ca 0.24 -0.28 -0.09 0.00 0.08 0.00 0.00 57.88 57.83 1x0r h LEU 161 Cb -0.01 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 41.60 1x0r h LEU 161 CO -0.04 0.58 0.00 0.11 -1.08 0.00 0.00 178.44 178.01 1x0r h LYS 162 N 0.21 1.04 -0.34 1.13 1.57 -0.84 -1.32 116.57 118.02 1x0r h LYS 162 Ca 0.07 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 58.49 1x0r h LYS 162 Cb 0.36 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1x0r h LYS 162 CO 0.01 1.02 0.08 -0.07 -0.57 0.00 0.00 179.45 179.92 1x0r h LEU 163 N 0.93 0.51 -0.59 2.94 3.38 -0.51 -0.63 115.31 121.34 1x0r h LEU 163 Ca 0.17 -0.23 0.10 0.00 0.09 0.00 0.00 57.88 58.00 1x0r h LEU 163 Cb 0.55 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 41.09 1x0r h LEU 163 CO 0.03 0.61 0.18 1.23 0.09 0.00 0.00 178.44 180.58 1x0r h GLY 164 N 0.39 0.79 1.01 0.83 0.00 -0.68 -0.72 103.07 104.70 1x0r h GLY 164 Ca 0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 1x0r h GLY 164 CO 0.00 -0.06 0.36 -0.55 0.00 0.00 0.00 176.54 176.30 1x0r h ASP 165 N 0.33 0.95 1.59 0.19 3.32 -1.00 0.30 116.42 122.11 1x0r h ASP 165 Ca 0.30 -0.12 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 1x0r h ASP 165 Cb 0.41 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1x0r h ASP 165 CO -0.34 0.81 -0.39 0.77 -1.72 0.00 0.00 179.24 178.36 1x0r h SER 166 N 1.02 0.00 0.03 6.45 4.64 -0.53 -3.19 113.55 121.97 1x0r h SER 166 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1x0r h SER 166 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1x0r h SER 166 CO -0.03 0.39 -0.49 0.18 -0.87 0.00 0.00 176.83 176.01 1x0r n LEU 167 N -3.20 1.79 -3.44 5.97 4.32 -0.33 -4.97 117.00 117.15 1x0r n LEU 167 Ca 0.02 -0.66 -0.18 0.00 -0.02 0.00 0.00 56.01 55.18 1x0r n LEU 167 Cb 0.69 -0.02 0.07 0.00 -1.62 0.00 0.00 43.42 42.54 1x0r n LEU 167 CO 0.39 0.34 0.06 0.29 -1.22 0.00 0.00 177.39 177.24 1x0r n LYS 168 N -0.24 -5.05 -4.11 3.23 5.02 0.85 -5.02 118.16 112.84 1x0r n LYS 168 Ca 0.09 0.80 -0.12 0.00 -2.02 0.00 0.00 58.31 57.07 1x0r n LYS 168 Cb 0.44 -5.69 -0.11 0.00 -0.02 0.00 0.00 35.03 29.65 1x0r n LYS 168 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1x0r s ARG 169 N -5.23 0.67 0.28 1.97 1.81 -0.10 -4.51 118.95 113.82 1x0r s ARG 169 Ca 0.13 -1.02 -0.01 0.00 -1.72 0.00 0.00 55.73 53.11 1x0r s ARG 169 Cb -0.02 -0.25 -0.04 0.00 -0.45 0.00 0.00 34.95 34.19 1x0r s ARG 169 CO 0.75 0.02 0.49 0.00 -0.68 0.00 0.00 175.30 175.87 1x0r s ALA 170 N -2.42 3.74 -0.18 2.13 0.00 0.82 -4.34 121.76 121.50 1x0r s ALA 170 Ca -0.00 -0.80 -0.03 0.00 0.00 0.00 0.00 51.96 51.12 1x0r s ALA 170 Cb -0.03 -2.10 -0.02 0.00 0.00 0.00 0.00 23.12 20.97 1x0r s ALA 170 CO -0.02 0.22 -0.06 0.08 0.00 0.00 0.00 175.76 175.98 1x0r s VAL 171 N -2.08 3.47 0.82 0.00 1.01 -1.26 0.64 120.40 123.00 1x0r s VAL 171 Ca 0.40 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.79 1x0r s VAL 171 Cb -0.10 -2.54 0.09 0.00 0.00 0.00 0.00 36.38 33.82 1x0r s VAL 171 CO 0.32 0.46 1.10 -2.16 0.00 0.00 0.00 175.10 174.81 1x0r s PRO 172 N 0.95 1.82 0.38 2.72 0.04 -1.26 -4.94 135.00 134.71 1x0r s PRO 172 Ca -0.00 1.13 -0.24 0.00 0.04 0.00 0.00 61.00 61.92 1x0r s PRO 172 Cb -0.15 -1.85 -0.13 0.00 0.04 0.00 0.00 34.50 32.42 1x0r s PRO 172 CO 0.01 -1.94 0.72 0.00 0.04 0.00 0.00 177.00 175.82 1x0r n ALA 173 N -3.72 -1.08 -1.82 8.56 0.00 -1.26 -1.80 120.51 119.40 1x0r n ALA 173 Ca 0.09 0.24 -0.14 0.00 0.00 0.00 0.00 53.44 53.63 1x0r n ALA 173 Cb 0.53 -1.86 -0.04 0.00 0.00 0.00 0.00 19.45 18.08 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 1.18 -3.94 -4.76 0.00 8.00 -1.26 -3.94 116.55 111.83 1x0r n ASP 174 Ca 0.11 0.27 -0.37 0.00 0.71 0.00 0.00 54.79 55.52 1x0r n ASP 174 Cb 0.37 -3.51 0.02 0.00 -0.02 0.00 0.00 41.12 37.97 1x0r n ASP 174 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1x0r s TRP 175 N -2.39 2.52 -0.31 1.24 -0.00 -0.75 -0.86 118.94 118.39 1x0r s TRP 175 Ca 0.00 1.50 0.02 0.00 -0.00 0.00 0.00 56.10 57.62 1x0r s TRP 175 Cb 0.00 -3.49 0.23 0.00 -0.00 0.00 0.00 33.47 30.21 1x0r s TRP 175 CO 0.00 -2.10 1.20 -0.35 -0.00 0.00 0.00 176.95 175.70 1x0r n PRO 176 N -1.19 1.64 -1.43 5.86 -0.04 -1.26 -4.91 135.00 133.66 1x0r n PRO 176 Ca 0.11 -0.99 -0.07 0.00 -0.04 0.00 0.00 63.50 62.51 1x0r n PRO 176 Cb 0.49 -1.48 0.10 0.00 -0.04 0.00 0.00 33.50 32.57 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 0.03 2.98 -4.71 3.54 3.02 -0.04 -3.19 115.26 116.89 1x0r n ASN 177 Ca 0.17 -3.55 -0.43 0.00 -0.03 0.00 0.00 54.58 50.74 1x0r n ASN 177 Cb 0.80 -0.43 -0.02 0.00 -0.61 0.00 0.00 39.78 39.52 1x0r n ASN 177 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1x0r n ASN 178 N -0.78 3.35 0.16 6.41 2.85 -0.74 -4.85 115.26 121.66 1x0r n ASN 178 Ca 0.27 1.14 0.13 0.00 -0.11 0.00 0.00 54.58 56.02 1x0r n ASN 178 Cb 0.85 -1.52 0.52 0.00 1.24 0.00 0.00 39.78 40.88 1x0r n ASN 178 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1x0r h GLU 179 N 4.53 0.00 0.01 1.20 5.08 -1.88 0.24 114.58 123.76 1x0r h GLU 179 Ca -0.46 0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 57.49 1x0r h GLU 179 Cb 1.25 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.44 1x0r h GLU 179 CO 0.78 0.00 -2.36 -0.89 -1.00 0.00 0.00 179.01 175.54 1x0r n ILE 180 N -2.40 1.54 -0.35 3.13 5.41 -1.26 -4.73 119.36 120.70 1x0r n ILE 180 Ca 0.02 -0.44 0.01 0.00 1.00 0.00 0.00 62.75 63.34 1x0r n ILE 180 Cb 0.25 -1.72 0.01 0.00 -0.71 0.00 0.00 39.64 37.48 1x0r n ILE 180 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 1x0r n ILE 181 N -3.85 0.86 0.00 1.39 -5.35 -1.24 -5.10 119.36 106.07 1x0r n ILE 181 Ca -0.48 -0.89 0.00 0.00 -0.27 0.00 0.00 62.75 61.11 1x0r n ILE 181 Cb 0.92 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 39.35 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 -0.48 3.23 1.79 3.28 0.00 0.07 -0.88 105.19 112.21 1x0r n GLY 182 Ca 0.01 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 45.96 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 13.16 4.45 -1.48 1.61 0.28 -1.19 -1.79 120.64 135.68 1x0r n GLU 183 Ca 0.00 -3.07 -0.34 0.00 -0.16 0.00 0.00 57.16 53.59 1x0r n GLU 183 Cb 0.00 -2.12 0.09 0.00 1.43 0.00 0.00 31.44 30.83 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 -0.83 2.26 0.26 -1.84 0.00 -0.06 -4.82 107.32 102.28 1x0r s GLY 184 Ca 0.54 0.77 0.11 0.00 0.00 0.00 0.00 44.72 46.14 1x0r s GLY 184 CO 0.20 1.17 -0.15 1.08 0.00 0.00 0.00 173.10 175.39 1x0r s LEU 185 N -5.16 2.73 -0.12 0.66 1.43 -0.21 -4.62 118.68 113.39 1x0r s LEU 185 Ca 0.72 -0.89 -0.03 0.00 -1.03 0.00 0.00 54.13 52.89 1x0r s LEU 185 Cb -0.26 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.64 1x0r s LEU 185 CO 0.45 0.05 0.02 -0.63 0.23 0.00 0.00 176.35 176.46 1x0r s ILE 186 N -2.30 4.41 -0.05 -0.59 1.01 0.21 -2.04 121.20 121.84 1x0r s ILE 186 Ca 0.29 -0.20 -0.30 0.00 0.00 0.00 0.00 60.65 60.44 1x0r s ILE 186 Cb -0.06 -2.89 -0.03 0.00 0.01 0.00 0.00 42.46 39.49 1x0r s ILE 186 CO 0.15 0.56 1.13 -0.69 0.00 0.00 0.00 174.94 176.10 1x0r s VAL 187 N -0.48 4.41 0.17 2.92 1.01 -0.53 -0.13 120.40 127.78 1x0r s VAL 187 Ca 0.09 1.72 -0.33 0.00 0.00 0.00 0.00 61.98 63.46 1x0r s VAL 187 Cb -0.12 -4.11 -0.15 0.00 0.00 0.00 0.00 36.38 32.01 1x0r s VAL 187 CO 0.02 0.03 1.39 -2.65 0.00 0.00 0.00 175.10 173.88 1x0r n PRO 188 N 4.90 1.71 -1.72 2.72 -0.02 -1.26 -4.66 135.00 136.66 1x0r n PRO 188 Ca 0.10 0.61 -0.36 0.00 -2.02 0.00 0.00 63.50 61.83 1x0r n PRO 188 Cb 0.47 -2.26 0.07 0.00 -0.02 0.00 0.00 33.50 31.76 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 0.12 2.53 0.49 0.52 0.04 -1.26 -4.96 135.00 132.47 1x0r s PRO 189 Ca 0.75 1.98 -0.23 0.00 0.04 0.00 0.00 61.00 63.54 1x0r s PRO 189 Cb -0.76 -1.85 -0.07 0.00 0.04 0.00 0.00 34.50 31.86 1x0r s PRO 189 CO 0.47 -1.59 1.32 -2.14 0.04 0.00 0.00 177.00 175.09 1x0r s PRO 190 N -3.47 3.51 0.00 0.56 0.02 -1.26 -4.94 135.00 129.43 1x0r s PRO 190 Ca 0.80 2.15 0.07 0.00 0.02 0.00 0.00 61.00 64.04 1x0r s PRO 190 Cb -0.35 -2.44 0.12 0.00 0.02 0.00 0.00 34.50 31.85 1x0r s PRO 190 CO 0.40 -0.86 0.93 0.25 -0.33 0.00 0.00 177.00 177.39 1x0r n THR 191 N -0.57 0.50 -4.12 0.99 -2.24 -1.26 -4.92 114.28 102.67 1x0r n THR 191 Ca 0.08 -0.75 -0.12 0.00 -2.27 0.00 0.00 64.05 60.99 1x0r n THR 191 Cb 0.45 0.82 -0.11 0.00 -2.10 0.00 0.00 70.33 69.39 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 -0.78 0.64 0.10 4.28 -4.23 -1.26 -5.06 115.64 109.33 1x0r s THR 192 Ca 0.11 -1.49 -0.23 0.00 -1.18 0.00 0.00 61.69 58.90 1x0r s THR 192 Cb 0.06 -1.13 -0.13 0.00 1.34 0.00 0.00 72.50 72.65 1x0r s THR 192 CO 0.09 -0.60 1.72 -0.08 -0.54 0.00 0.00 174.62 175.21 1x0r h GLU 193 N 3.77 -0.07 -0.89 3.99 4.81 -1.99 0.20 114.58 124.41 1x0r h GLU 193 Ca -0.36 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 58.92 1x0r h GLU 193 Cb 1.18 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.53 1x0r h GLU 193 CO 0.52 -0.05 0.58 -0.44 -0.73 0.00 0.00 179.01 178.89 1x0r h ASP 194 N -0.07 0.93 -0.39 1.04 5.19 -1.99 0.24 116.42 121.37 1x0r h ASP 194 Ca 0.01 -0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.32 1x0r h ASP 194 Cb 0.08 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.37 1x0r h ASP 194 CO -0.03 0.62 -0.10 -0.61 -3.12 0.00 0.00 179.24 176.01 1x0r h GLN 195 N 1.07 0.84 -0.42 3.56 4.15 -1.89 -1.24 115.11 121.17 1x0r h GLN 195 Ca 0.36 -0.28 -0.05 0.00 0.77 0.00 0.00 58.65 59.46 1x0r h GLN 195 Cb 0.09 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 1x0r h GLN 195 CO -0.12 0.90 0.08 0.00 -1.93 0.00 0.00 178.83 177.76 1x0r h ALA 196 N 1.13 0.56 -0.29 3.38 0.00 0.09 0.10 119.26 124.23 1x0r h ALA 196 Ca 0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1x0r h ALA 196 Cb 0.60 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1x0r h ALA 196 CO 0.04 0.27 0.14 -0.09 0.00 0.00 0.00 179.25 179.61 1x0r h ARG 197 N 0.56 0.42 -0.83 0.00 9.65 -0.76 -3.03 114.38 120.38 1x0r h ARG 197 Ca 0.13 -0.06 0.06 0.00 -1.10 0.00 0.00 59.98 59.01 1x0r h ARG 197 Cb 0.37 -0.08 -0.06 0.00 -1.39 0.00 0.00 29.97 28.81 1x0r h ARG 197 CO 0.01 0.40 0.51 0.00 2.80 0.00 0.00 179.97 183.69 1x0r h ALA 198 N 1.00 1.14 0.00 2.80 0.00 -0.92 0.15 119.26 123.43 1x0r h ALA 198 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1x0r h ALA 198 Cb 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1x0r h ALA 198 CO -0.01 0.25 0.00 -2.13 0.00 0.00 0.00 179.25 177.36 1x0r n ARG 199 N -4.64 0.12 -1.11 0.00 0.63 0.32 -3.32 116.66 108.67 1x0r n ARG 199 Ca 0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.05 1x0r n ARG 199 Cb 0.17 -1.04 0.00 0.00 0.45 0.00 0.00 32.46 32.04 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 0.15 -0.91 0.00 -0.14 1.02 0.52 -4.06 120.64 117.22 1x0r n GLU 201 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1x0r n GLU 201 Cb 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.44 1x0r n GLU 201 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1x0r n SER 202 N 0.52 0.00 -1.23 1.62 3.41 -1.21 -4.97 113.62 111.75 1x0r n SER 202 Ca 0.00 -1.00 -0.02 0.00 -0.26 0.00 0.00 58.87 57.59 1x0r n SER 202 Cb 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 1x0r n SER 202 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x0r n GLY 203 N 0.00 0.11 0.24 5.00 0.00 -1.26 -4.79 105.19 104.50 1x0r n GLY 203 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1x0r n GLY 203 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1x0r h GLN 204 N 0.00 0.00 -4.81 1.61 4.15 -1.94 -3.46 115.11 110.66 1x0r h GLN 204 Ca -0.04 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.06 1x0r h GLN 204 Cb 0.25 0.00 -0.15 0.00 0.21 0.00 0.00 27.48 27.79 1x0r h GLN 204 CO 0.06 0.17 -0.63 0.71 -1.93 0.00 0.00 178.83 177.22 1x0r s TYR 205 N -3.92 1.40 0.32 3.99 1.51 -1.26 -5.06 117.35 114.33 1x0r s TYR 205 Ca -0.01 -1.18 -0.27 0.00 -1.01 0.00 0.00 57.07 54.60 1x0r s TYR 205 Cb 0.12 -0.80 -0.09 0.00 -0.11 0.00 0.00 41.96 41.08 1x0r s TYR 205 CO 0.61 -0.36 1.00 1.03 -1.11 0.00 0.00 175.55 176.72 1x0r s ARG 206 N -4.03 4.53 -0.11 -0.62 0.52 -0.78 -4.88 118.95 113.58 1x0r s ARG 206 Ca 0.35 1.49 -0.12 0.00 -0.52 0.00 0.00 55.73 56.93 1x0r s ARG 206 Cb 0.07 -2.88 0.03 0.00 0.52 0.00 0.00 34.95 32.70 1x0r s ARG 206 CO 0.11 0.19 0.34 0.45 0.02 0.00 0.00 175.30 176.41 1x0r s SER 207 N -1.40 -0.34 -0.05 0.23 0.15 -1.26 -1.00 113.70 110.03 1x0r s SER 207 Ca 0.50 0.61 0.13 0.00 0.70 0.00 0.00 55.95 57.89 1x0r s SER 207 Cb -0.23 0.65 -0.19 0.00 -1.71 0.00 0.00 66.02 64.54 1x0r s SER 207 CO 0.29 -0.16 0.23 0.18 1.20 0.00 0.00 173.24 174.98 1x0r n LEU 208 N 2.68 0.00 -3.81 3.45 4.32 0.68 -5.00 117.00 119.31 1x0r n LEU 208 Ca -0.14 0.00 -0.03 0.00 -0.02 0.00 0.00 56.01 55.82 1x0r n LEU 208 Cb 0.57 0.08 0.00 0.00 -1.62 0.00 0.00 43.42 42.46 1x0r n LEU 208 CO 0.16 0.08 0.78 -0.62 -1.22 0.00 0.00 177.39 176.57 1x0r s ASP 209 N -3.80 -0.08 0.58 -1.43 -1.08 -1.21 -4.93 116.67 104.71 1x0r s ASP 209 Ca -0.05 -0.54 0.38 0.00 -0.52 0.00 0.00 52.55 51.81 1x0r s ASP 209 Cb 0.07 0.48 1.83 0.00 -1.46 0.00 0.00 42.92 43.84 1x0r s ASP 209 CO 0.54 -0.93 2.13 4.11 0.52 0.00 0.00 175.17 181.54 1x0r h TRP 210 N 2.00 0.00 -0.03 -5.34 5.08 -1.96 -1.02 115.95 114.68 1x0r h TRP 210 Ca -0.26 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.71 1x0r h TRP 210 Cb 1.22 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.38 1x0r h TRP 210 CO 0.87 0.00 -0.02 -2.67 -1.28 0.00 0.00 178.44 175.34 1x0r n TRP 211 N -2.99 0.00 -3.59 0.12 4.27 -1.26 -4.50 117.44 109.49 1x0r n TRP 211 Ca -0.01 0.00 -0.27 0.00 -3.89 0.00 0.00 57.50 53.33 1x0r n TRP 211 Cb 0.18 0.00 -0.10 0.00 -1.36 0.00 0.00 31.31 30.03 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 1.26 1.91 -4.25 -2.67 -0.00 -0.38 -4.59 117.46 108.73 1x0r n PHE 212 Ca 0.14 -3.95 -0.27 0.00 -0.00 0.00 0.00 57.45 53.37 1x0r n PHE 212 Cb 0.58 -0.36 -0.09 0.00 -0.00 0.00 0.00 39.48 39.61 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 -1.69 -0.40 0.03 0.00 -2.14 -0.17 -1.46 118.94 113.11 1x0r s TRP 214 Ca 0.26 0.10 -0.00 0.00 2.66 0.00 0.00 56.10 59.11 1x0r s TRP 214 Cb -0.09 0.60 0.00 0.00 -3.10 0.00 0.00 33.47 30.88 1x0r s TRP 214 CO 0.16 -0.98 0.04 -0.40 -2.66 0.00 0.00 176.95 173.11 1x0r n ASP 215 N -0.40 -0.10 -3.40 -2.66 5.68 -0.87 -1.86 116.55 112.94 1x0r n ASP 215 Ca -0.12 -1.15 -0.26 0.00 -0.50 0.00 0.00 54.79 52.76 1x0r n ASP 215 Cb 0.63 0.19 -0.09 0.00 -1.14 0.00 0.00 41.12 40.72 1x0r n ASP 215 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1x0r n THR 216 N -0.04 0.60 0.82 2.12 -2.24 -1.26 -1.05 114.28 113.23 1x0r n THR 216 Ca 0.00 -4.46 0.12 0.00 -2.27 0.00 0.00 64.05 57.45 1x0r n THR 216 Cb 0.04 -1.99 0.24 0.00 -2.10 0.00 0.00 70.33 66.52 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 1.51 0.12 -2.23 -0.78 -0.04 -1.26 -4.90 135.00 127.42 1x0r n PRO 217 Ca 0.25 0.03 -0.38 0.00 -0.04 0.00 0.00 63.50 63.37 1x0r n PRO 217 Cb 0.46 -1.58 -0.01 0.00 -0.04 0.00 0.00 33.50 32.33 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 -3.07 3.12 0.69 0.55 0.00 -1.26 -5.02 121.76 116.77 1x0r s ALA 218 Ca 0.09 1.01 -0.14 0.00 0.00 0.00 0.00 51.96 52.93 1x0r s ALA 218 Cb 0.16 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.89 1x0r s ALA 218 CO 0.70 -0.63 1.10 -1.54 0.00 0.00 0.00 175.76 175.39 1x0r s SER 219 N -1.12 4.96 0.39 0.00 1.04 -1.26 -4.82 113.70 112.89 1x0r s SER 219 Ca 0.59 1.93 0.12 0.00 0.48 0.00 0.00 55.95 59.07 1x0r s SER 219 Cb -0.32 -2.54 0.92 0.00 0.10 0.00 0.00 66.02 64.19 1x0r s SER 219 CO 0.40 -1.73 1.92 -0.09 0.98 0.00 0.00 173.24 174.71 1x0r h ARG 220 N -0.31 0.54 -0.65 4.02 2.43 -1.99 -0.88 114.38 117.55 1x0r h ARG 220 Ca -0.46 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 58.61 1x0r h ARG 220 Cb 1.24 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.64 1x0r h ARG 220 CO 0.53 0.36 0.14 -0.44 -1.51 0.00 0.00 179.97 179.05 1x0r h ASP 221 N 0.56 1.00 -0.34 -3.80 3.32 -1.98 0.37 116.42 115.54 1x0r h ASP 221 Ca 0.38 -0.24 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 1x0r h ASP 221 Cb 0.68 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1x0r h ASP 221 CO -0.14 0.99 0.04 0.44 -1.72 0.00 0.00 179.24 178.85 1x0r h ASP 222 N 0.97 0.55 -0.41 6.45 3.32 -1.60 0.08 116.42 125.78 1x0r h ASP 222 Ca 0.20 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 56.93 1x0r h ASP 222 Cb 0.39 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1x0r h ASP 222 CO 0.01 0.69 0.07 0.58 -1.72 0.00 0.00 179.24 178.86 1x0r h VAL 223 N 0.40 1.24 0.00 -1.35 2.07 -0.85 -2.89 116.25 114.86 1x0r h VAL 223 Ca 0.10 -0.86 -0.11 0.00 0.82 0.00 0.00 66.70 66.65 1x0r h VAL 223 Cb 0.38 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1x0r h VAL 223 CO 0.01 0.30 -0.52 -0.33 0.02 0.00 0.00 177.57 177.04 1x0r h GLU 224 N 0.52 0.00 -0.69 1.57 5.08 -0.05 -0.32 114.58 120.70 1x0r h GLU 224 Ca 0.12 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 1x0r h GLU 224 Cb 0.37 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1x0r h GLU 224 CO 0.01 0.52 0.19 1.49 -1.00 0.00 0.00 179.01 180.22 1x0r h GLU 225 N 0.00 1.09 -0.09 2.33 4.81 -1.00 0.12 114.58 121.85 1x0r h GLU 225 Ca -0.01 -0.25 -0.18 0.00 -0.13 0.00 0.00 59.36 58.80 1x0r h GLU 225 Cb 1.26 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1x0r h GLU 225 CO 0.07 0.95 -0.70 0.00 -0.73 0.00 0.00 179.01 178.60 1x0r h ALA 226 N 1.09 0.64 0.00 2.92 0.00 -1.28 -2.27 119.26 120.36 1x0r h ALA 226 Ca 0.22 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 1x0r h ALA 226 Cb 0.33 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1x0r h ALA 226 CO -0.00 0.75 -0.35 -0.09 0.00 0.00 0.00 179.25 179.55 1x0r h ARG 227 N 0.28 0.00 -0.33 0.00 2.43 -0.82 -2.89 114.38 113.04 1x0r h ARG 227 Ca -0.02 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1x0r h ARG 227 Cb 1.26 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.79 1x0r h ARG 227 CO 0.12 0.35 -0.16 -0.09 -1.51 0.00 0.00 179.97 178.69 1x0r h ARG 228 N 0.00 0.59 -0.34 0.20 2.43 -0.19 -1.47 114.38 115.60 1x0r h ARG 228 Ca -0.00 -0.19 0.02 0.00 -0.81 0.00 0.00 59.98 58.99 1x0r h ARG 228 Cb 1.04 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.51 1x0r h ARG 228 CO 0.05 0.72 0.18 1.88 -1.51 0.00 0.00 179.97 181.29 1x0r h TYR 229 N 0.53 0.33 -0.53 2.20 0.99 -1.26 0.20 116.97 119.43 1x0r h TYR 229 Ca 0.09 0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.77 1x0r h TYR 229 Cb 0.58 -0.10 -0.02 0.00 1.00 0.00 0.00 36.73 38.19 1x0r h TYR 229 CO 0.02 0.18 0.10 -0.07 -0.00 0.00 0.00 178.16 178.39 1x0r h LEU 230 N 0.36 0.84 -0.91 3.88 3.38 -1.30 -0.84 115.31 120.74 1x0r h LEU 230 Ca 0.14 -0.25 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1x0r h LEU 230 Cb 0.04 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.51 1x0r h LEU 230 CO -0.09 0.88 0.59 -0.09 0.09 0.00 0.00 178.44 179.82 1x0r h ARG 231 N 0.77 1.11 -0.33 1.13 2.43 -0.85 0.10 114.38 118.74 1x0r h ARG 231 Ca 0.16 -0.07 -0.07 0.00 -0.81 0.00 0.00 59.98 59.20 1x0r h ARG 231 Cb 0.39 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1x0r h ARG 231 CO 0.01 0.73 -0.06 -0.09 -1.51 0.00 0.00 179.97 179.05 1x0r h ARG 232 N 1.14 0.63 -0.65 0.20 2.43 -0.52 -0.51 114.38 117.10 1x0r h ARG 232 Ca 0.36 -0.23 0.05 0.00 -0.81 0.00 0.00 59.98 59.35 1x0r h ARG 232 Cb -0.00 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.47 1x0r h ARG 232 CO -0.12 0.79 0.43 0.00 -1.51 0.00 0.00 179.97 179.56 1x0r h ALA 233 N 0.82 1.69 0.00 2.80 0.00 -0.69 -2.42 119.26 121.46 1x0r h ALA 233 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1x0r h ALA 233 Cb 0.54 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1x0r h ALA 233 CO 0.03 0.22 -0.38 0.00 0.00 0.00 0.00 179.25 179.12 1x0r n ALA 234 N -2.46 3.00 -2.23 0.00 0.00 0.32 -4.86 120.51 114.28 1x0r n ALA 234 Ca 0.09 -0.24 -0.41 0.00 0.00 0.00 0.00 53.44 52.88 1x0r n ALA 234 Cb 0.17 -1.24 -0.05 0.00 0.00 0.00 0.00 19.45 18.33 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 -3.06 4.67 -0.07 0.00 2.12 -0.27 -5.03 118.70 117.07 1x0r s GLU 235 Ca 0.10 1.36 -0.30 0.00 0.36 0.00 0.00 54.97 56.49 1x0r s GLU 235 Cb 0.16 -3.36 -0.03 0.00 0.26 0.00 0.00 34.13 31.17 1x0r s GLU 235 CO 0.66 0.28 1.15 0.21 -0.54 0.00 0.00 175.26 177.01 1x0r s LYS 236 N -0.19 4.37 0.31 4.30 2.20 -1.26 -4.97 119.74 124.50 1x0r s LYS 236 Ca 0.44 1.60 -0.29 0.00 -0.36 0.00 0.00 55.97 57.36 1x0r s LYS 236 Cb -0.23 -3.55 -0.13 0.00 -1.51 0.00 0.00 37.83 32.41 1x0r s LYS 236 CO 0.28 -0.41 1.22 -2.30 -0.36 0.00 0.00 175.35 173.79 1x0r n PRO 237 N 5.11 1.86 -0.07 4.03 -0.02 -1.26 -4.90 135.00 139.76 1x0r n PRO 237 Ca 0.10 0.65 -0.09 0.00 -2.02 0.00 0.00 63.50 62.15 1x0r n PRO 237 Cb 0.47 -2.18 0.07 0.00 -0.02 0.00 0.00 33.50 31.84 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 2.61 0.81 -3.73 3.55 0.00 -2.04 -3.44 119.26 117.02 1x0r h ALA 238 Ca -0.44 -0.41 -0.26 0.00 0.00 0.00 0.00 54.91 53.80 1x0r h ALA 238 Cb 1.30 -0.13 -0.29 0.00 0.00 0.00 0.00 17.79 18.67 1x0r h ALA 238 CO 0.64 0.64 -0.73 0.21 0.00 0.00 0.00 179.25 180.01 1x0r s LYS 239 N -4.46 0.11 0.02 0.00 2.20 -1.26 -5.14 119.74 111.22 1x0r s LYS 239 Ca -0.09 -0.02 -0.22 0.00 -0.36 0.00 0.00 55.97 55.28 1x0r s LYS 239 Cb 0.12 -0.15 -0.06 0.00 -1.51 0.00 0.00 37.83 36.24 1x0r s LYS 239 CO 0.84 -0.00 0.65 -0.51 -0.36 0.00 0.00 175.35 175.97 1x0r s LEU 240 N 0.15 4.44 0.55 5.43 1.43 -1.26 -4.96 118.68 124.46 1x0r s LEU 240 Ca -0.01 1.27 0.25 0.00 -1.03 0.00 0.00 54.13 54.62 1x0r s LEU 240 Cb -0.03 -3.03 1.47 0.00 0.03 0.00 0.00 46.19 44.63 1x0r s LEU 240 CO -0.00 0.09 2.04 -0.07 0.23 0.00 0.00 176.35 178.63 1x0r h LEU 241 N 5.54 0.00 -0.84 1.79 3.38 -1.98 -1.95 115.31 121.25 1x0r h LEU 241 Ca -0.45 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.59 1x0r h LEU 241 Cb 1.20 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.89 1x0r h LEU 241 CO 0.70 0.00 0.51 0.22 0.09 0.00 0.00 178.44 179.95 1x0r h TYR 242 N 0.00 0.93 0.37 1.13 3.20 -1.94 -2.52 116.97 118.14 1x0r h TYR 242 Ca 0.16 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.04 1x0r h TYR 242 Cb 0.73 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.71 1x0r h TYR 242 CO 0.00 0.44 -0.18 0.93 -1.64 0.00 0.00 178.16 177.72 1x0r h GLU 243 N 0.90 -0.48 -0.95 1.82 5.08 -1.76 -3.10 114.58 116.10 1x0r h GLU 243 Ca 0.38 0.03 0.31 0.00 -1.00 0.00 0.00 59.36 59.08 1x0r h GLU 243 Cb 0.23 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.51 1x0r h GLU 243 CO -0.20 -0.32 0.63 0.39 -1.00 0.00 0.00 179.01 178.51 1x0r n GLU 244 N -4.06 -0.02 0.00 2.33 -0.58 -1.15 -5.12 120.64 112.05 1x0r n GLU 244 Ca -0.06 0.76 0.15 0.00 -0.42 0.00 0.00 57.16 57.59 1x0r n GLU 244 Cb 0.19 -1.56 0.64 0.00 -0.57 0.00 0.00 31.44 30.14 1x0r n GLU 244 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65