#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 0.95 0.03 -1.23 0.00 -1.26 -5.10 107.32 100.70 1x0r s GLY 3 Ca 0.00 -1.14 0.05 0.00 0.00 0.00 0.00 44.72 43.63 1x0r s GLY 3 CO 0.00 -0.70 -0.10 -0.45 0.00 0.00 0.00 173.10 171.85 1x0r s SER 4 N -3.14 4.35 0.01 1.64 0.15 -1.26 -5.10 113.70 110.35 1x0r s SER 4 Ca 0.24 -0.26 0.01 0.00 0.70 0.00 0.00 55.95 56.63 1x0r s SER 4 Cb -0.02 -0.91 -0.01 0.00 -1.71 0.00 0.00 66.02 63.37 1x0r s SER 4 CO 0.15 0.26 -0.03 -0.51 1.20 0.00 0.00 173.24 174.31 1x0r s ILE 5 N -1.01 0.17 1.04 6.45 2.07 -1.26 -3.42 121.20 125.25 1x0r s ILE 5 Ca 0.17 -0.53 -0.11 0.00 -1.41 0.00 0.00 60.65 58.77 1x0r s ILE 5 Cb -0.11 -0.24 0.22 0.00 0.13 0.00 0.00 42.46 42.46 1x0r s ILE 5 CO 0.08 -0.23 1.09 -2.84 -1.91 0.00 0.00 174.94 171.13 1x0r s PRO 6 N -0.79 0.00 0.17 3.50 0.02 -1.26 -5.03 135.00 131.62 1x0r s PRO 6 Ca -0.07 1.22 0.10 0.00 0.02 0.00 0.00 61.00 62.26 1x0r s PRO 6 Cb -0.05 -1.63 -0.04 0.00 0.02 0.00 0.00 34.50 32.79 1x0r s PRO 6 CO -0.00 -3.22 -0.21 -0.51 -0.33 0.00 0.00 177.00 172.73 1x0r s LEU 7 N -6.94 2.43 0.18 -5.54 1.43 -1.26 -5.05 118.68 103.92 1x0r s LEU 7 Ca 0.68 -0.85 -0.33 0.00 -1.03 0.00 0.00 54.13 52.59 1x0r s LEU 7 Cb -0.24 -0.99 -0.14 0.00 0.03 0.00 0.00 46.19 44.84 1x0r s LEU 7 CO 0.61 0.05 1.44 -0.38 0.23 0.00 0.00 176.35 178.30 1x0r n ILE 8 N 0.34 0.41 0.00 -0.59 5.41 -1.26 -0.90 119.36 122.77 1x0r n ILE 8 Ca -0.13 -0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.51 1x0r n ILE 8 Cb 0.56 -1.33 0.00 0.00 -0.71 0.00 0.00 39.64 38.17 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 2.70 2.01 3.91 7.39 0.00 0.67 -5.01 105.19 116.86 1x0r n GLY 9 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.92 3.61 0.38 1.61 2.02 -0.08 -4.79 118.70 120.53 1x0r s GLU 10 Ca 0.00 -0.02 -0.28 0.00 0.02 0.00 0.00 54.97 54.70 1x0r s GLU 10 Cb 0.00 -2.62 -0.11 0.00 0.10 0.00 0.00 34.13 31.50 1x0r s GLU 10 CO 0.00 0.17 1.42 -2.13 0.02 0.00 0.00 175.26 174.73 1x0r n ARG 11 N -1.17 2.45 -1.86 1.61 0.63 -1.26 -1.17 116.66 115.89 1x0r n ARG 11 Ca -0.02 0.86 -0.41 0.00 -0.92 0.00 0.00 57.85 57.36 1x0r n ARG 11 Cb 0.54 -2.56 -0.02 0.00 0.45 0.00 0.00 32.46 30.88 1x0r n ARG 11 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 1x0r s PHE 12 N -1.12 2.85 -0.11 -0.14 5.36 0.34 -4.81 117.98 120.35 1x0r s PHE 12 Ca 0.55 0.85 -0.41 0.00 -0.96 0.00 0.00 56.93 56.96 1x0r s PHE 12 Cb -0.50 -3.99 -0.19 0.00 -0.34 0.00 0.00 43.02 38.00 1x0r s PHE 12 CO 0.63 -3.30 1.30 -2.30 -1.46 0.00 0.00 175.22 170.09 1x0r n PRO 13 N 2.28 0.38 -2.49 10.12 -0.02 -1.26 -4.52 135.00 139.50 1x0r n PRO 13 Ca 0.08 0.14 -0.33 0.00 -2.02 0.00 0.00 63.50 61.36 1x0r n PRO 13 Cb 0.38 -1.69 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 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 1.06 3.84 0.13 -0.52 2.12 -1.26 -4.41 118.70 119.66 1x0r s GLU 14 Ca 0.93 1.19 0.08 0.00 0.36 0.00 0.00 54.97 57.52 1x0r s GLU 14 Cb -1.22 -2.11 -0.04 0.00 0.26 0.00 0.00 34.13 31.01 1x0r s GLU 14 CO 0.60 -0.37 -0.10 -1.21 -0.54 0.00 0.00 175.26 173.64 1x0r s GLU 16 N -3.56 2.07 -0.00 4.30 2.02 -1.26 -4.98 118.70 117.30 1x0r s GLU 16 Ca 0.63 -1.11 -0.10 0.00 0.02 0.00 0.00 54.97 54.42 1x0r s GLU 16 Cb -0.13 -2.24 0.01 0.00 0.10 0.00 0.00 34.13 31.86 1x0r s GLU 16 CO 0.24 0.48 0.19 0.54 0.02 0.00 0.00 175.26 176.73 1x0r s VAL 17 N -1.35 0.08 -0.15 2.63 0.11 0.12 -4.96 120.40 116.86 1x0r s VAL 17 Ca 0.22 -0.62 -0.13 0.00 -2.93 0.00 0.00 61.98 58.52 1x0r s VAL 17 Cb -0.10 -0.49 -0.05 0.00 -1.53 0.00 0.00 36.38 34.21 1x0r s VAL 17 CO 0.14 -0.34 0.26 -0.89 -3.33 0.00 0.00 175.10 170.93 1x0r s THR 18 N -1.36 5.33 0.38 5.04 2.01 -1.26 -1.14 115.64 124.64 1x0r s THR 18 Ca -0.14 0.47 0.05 0.00 0.31 0.00 0.00 61.69 62.38 1x0r s THR 18 Cb -0.07 -3.59 -0.07 0.00 0.01 0.00 0.00 72.50 68.79 1x0r s THR 18 CO 0.02 0.43 0.04 0.42 -0.69 0.00 0.00 174.62 174.84 1x0r s THR 19 N 0.22 1.52 -2.00 -0.82 -4.23 0.10 -0.62 115.64 109.81 1x0r s THR 19 Ca 0.15 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.71 1x0r s THR 19 Cb -0.13 -2.82 0.14 0.00 1.34 0.00 0.00 72.50 71.03 1x0r s THR 19 CO 0.03 0.00 0.93 -0.90 -0.54 0.00 0.00 174.62 174.14 1x0r n ASP 20 N -0.88 0.00 -0.28 3.99 5.68 -0.68 -1.03 116.55 123.34 1x0r n ASP 20 Ca -0.05 -1.26 0.06 0.00 -0.50 0.00 0.00 54.79 53.05 1x0r n ASP 20 Cb 0.67 0.00 -0.00 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 -0.61 0.00 0.00 2.11 8.25 -1.26 -4.96 115.22 118.75 1x0r n HIS 21 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 1x0r n HIS 21 Cb 0.02 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.13 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 1.00 0.98 3.78 -1.41 0.00 -0.20 -5.04 105.19 104.30 1x0r n GLY 22 Ca 0.05 -1.99 -0.39 0.00 0.00 0.00 0.00 46.02 43.69 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 -1.18 4.78 0.23 1.61 1.01 -1.26 0.00 120.40 125.59 1x0r s VAL 23 Ca 0.00 1.32 -0.05 0.00 0.00 0.00 0.00 61.98 63.26 1x0r s VAL 23 Cb 0.00 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 1x0r s VAL 23 CO 0.00 0.47 0.27 0.27 0.00 0.00 0.00 175.10 176.10 1x0r s ILE 24 N -0.57 0.00 -0.11 2.22 -4.36 -0.29 -4.95 121.20 113.13 1x0r s ILE 24 Ca 0.32 -1.78 0.00 0.00 -0.26 0.00 0.00 60.65 58.92 1x0r s ILE 24 Cb -0.19 -2.41 -0.02 0.00 1.25 0.00 0.00 42.46 41.09 1x0r s ILE 24 CO 0.19 0.00 -0.12 -0.75 0.24 0.00 0.00 174.94 174.51 1x0r s LYS 25 N -4.04 3.19 0.01 0.37 2.20 -1.26 0.14 119.74 120.35 1x0r s LYS 25 Ca 0.33 -0.66 0.05 0.00 -0.36 0.00 0.00 55.97 55.33 1x0r s LYS 25 Cb 0.04 -2.61 -0.03 0.00 -1.51 0.00 0.00 37.83 33.72 1x0r s LYS 25 CO 0.12 0.34 -0.12 -0.51 -0.36 0.00 0.00 175.35 174.82 1x0r s LEU 26 N 0.04 2.90 0.00 5.43 1.43 -1.26 0.07 118.68 127.28 1x0r s LEU 26 Ca -0.04 -0.26 0.29 0.00 -1.03 0.00 0.00 54.13 53.09 1x0r s LEU 26 Cb -0.14 -1.67 1.22 0.00 0.03 0.00 0.00 46.19 45.63 1x0r s LEU 26 CO 0.04 0.28 1.86 -0.81 0.23 0.00 0.00 176.35 177.95 1x0r n PRO 27 N 1.67 0.59 -0.32 1.29 -0.04 -1.26 -4.16 135.00 132.77 1x0r n PRO 27 Ca -0.16 -0.19 0.19 0.00 -0.04 0.00 0.00 63.50 63.31 1x0r n PRO 27 Cb 0.52 -1.50 0.39 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 0.45 0.28 -0.97 3.54 5.19 -1.95 -0.61 116.42 122.35 1x0r h ASP 28 Ca 0.00 0.20 0.13 0.00 -0.62 0.00 0.00 57.03 56.74 1x0r h ASP 28 Cb 0.37 0.20 -0.08 0.00 0.18 0.00 0.00 39.33 39.99 1x0r h ASP 28 CO 0.00 -0.15 0.62 -0.74 -3.12 0.00 0.00 179.24 175.85 1x0r h HIS 29 N 0.27 1.05 0.07 4.55 2.76 -0.72 0.32 115.15 123.47 1x0r h HIS 29 Ca 0.66 0.03 -0.29 0.00 -2.20 0.00 0.00 60.37 58.57 1x0r h HIS 29 Cb 1.43 -0.33 -0.02 0.00 1.55 0.00 0.00 27.41 30.04 1x0r h HIS 29 CO -0.13 0.40 -1.53 1.88 -1.30 0.00 0.00 177.93 177.25 1x0r h TYR 30 N 0.90 0.29 -0.77 5.26 -1.99 -1.40 -3.33 116.97 115.93 1x0r h TYR 30 Ca 0.49 -0.21 0.12 0.00 2.00 0.00 0.00 58.73 61.14 1x0r h TYR 30 Cb 0.58 -0.01 -0.09 0.00 2.00 0.00 0.00 36.73 39.21 1x0r h TYR 30 CO -0.00 1.60 0.37 0.28 -0.00 0.00 0.00 178.16 180.41 1x0r h VAL 31 N -0.45 0.76 -0.28 -2.88 2.07 -1.24 0.19 116.25 114.42 1x0r h VAL 31 Ca -0.36 -0.20 0.08 0.00 0.82 0.00 0.00 66.70 67.05 1x0r h VAL 31 Cb 1.67 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1x0r h VAL 31 CO -0.03 0.10 0.23 0.28 0.02 0.00 0.00 177.57 178.17 1x0r h SER 32 N 0.57 0.00 -0.67 0.57 0.02 -1.08 -0.68 113.55 112.28 1x0r h SER 32 Ca 0.41 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.36 1x0r h SER 32 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 1x0r h SER 32 CO -0.34 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.35 1x0r n GLN 33 N -4.22 2.78 -1.27 3.45 6.02 -0.14 -4.92 117.38 119.08 1x0r n GLN 33 Ca 0.04 -2.57 -0.09 0.00 -0.01 0.00 0.00 57.00 54.37 1x0r n GLN 33 Cb 0.39 -1.52 -0.04 0.00 1.02 0.00 0.00 30.24 30.08 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 1.43 1.04 3.88 1.08 0.00 -0.26 -4.99 105.19 107.37 1x0r n GLY 34 Ca 0.22 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.58 3.61 0.66 1.61 1.02 0.48 -4.81 119.74 119.72 1x0r s LYS 35 Ca 0.00 -0.03 -0.10 0.00 0.02 0.00 0.00 55.97 55.86 1x0r s LYS 35 Cb 0.00 -3.09 -0.00 0.00 -0.52 0.00 0.00 37.83 34.22 1x0r s LYS 35 CO 0.00 0.66 1.03 -1.58 -0.92 0.00 0.00 175.35 174.54 1x0r s TRP 36 N -1.27 3.39 0.02 3.18 0.52 -0.77 -3.96 118.94 120.05 1x0r s TRP 36 Ca 0.27 1.02 -0.09 0.00 0.02 0.00 0.00 56.10 57.32 1x0r s TRP 36 Cb -0.13 -2.90 0.00 0.00 -1.15 0.00 0.00 33.47 29.29 1x0r s TRP 36 CO 0.15 -0.96 0.17 -0.59 0.02 0.00 0.00 176.95 175.74 1x0r s PHE 37 N -3.22 0.03 -0.24 -1.98 -0.12 0.02 -0.97 117.98 111.50 1x0r s PHE 37 Ca 0.56 -0.17 -0.05 0.00 -0.05 0.00 0.00 56.93 57.22 1x0r s PHE 37 Cb -0.11 -0.03 -0.01 0.00 -0.63 0.00 0.00 43.02 42.24 1x0r s PHE 37 CO 0.51 -0.35 0.01 0.08 -0.05 0.00 0.00 175.22 175.42 1x0r s VAL 38 N -1.87 3.74 -0.21 -2.49 1.01 0.82 -0.51 120.40 120.88 1x0r s VAL 38 Ca -0.11 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 61.34 1x0r s VAL 38 Cb -0.05 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.52 1x0r s VAL 38 CO -0.00 0.33 0.10 -0.22 0.00 0.00 0.00 175.10 175.31 1x0r s LEU 39 N 1.52 3.90 0.09 3.92 2.96 -0.14 -0.85 118.68 130.08 1x0r s LEU 39 Ca 0.05 0.06 0.04 0.00 -0.22 0.00 0.00 54.13 54.06 1x0r s LEU 39 Cb -0.15 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.49 1x0r s LEU 39 CO -0.00 0.10 -0.11 0.72 -1.32 0.00 0.00 176.35 175.74 1x0r s PHE 40 N 0.80 1.12 0.27 5.38 -0.12 -0.23 -0.14 117.98 125.06 1x0r s PHE 40 Ca 0.05 -0.59 0.11 0.00 -0.05 0.00 0.00 56.93 56.46 1x0r s PHE 40 Cb -0.13 -0.61 -0.05 0.00 -0.63 0.00 0.00 43.02 41.60 1x0r s PHE 40 CO 0.02 0.03 -0.15 -1.54 -0.05 0.00 0.00 175.22 173.53 1x0r s SER 41 N -2.25 3.84 0.01 1.98 1.04 -0.03 -1.25 113.70 117.03 1x0r s SER 41 Ca 0.04 -0.92 -0.10 0.00 0.48 0.00 0.00 55.95 55.45 1x0r s SER 41 Cb -0.05 -0.45 0.01 0.00 0.10 0.00 0.00 66.02 65.63 1x0r s SER 41 CO 0.01 0.03 0.19 -1.38 0.98 0.00 0.00 173.24 173.07 1x0r s HIS 42 N -2.42 0.00 0.21 5.02 -3.43 -0.47 -3.82 115.29 110.38 1x0r s HIS 42 Ca 0.30 -0.10 -0.10 0.00 -0.80 0.00 0.00 55.06 54.36 1x0r s HIS 42 Cb -0.06 -0.01 0.18 0.00 -1.43 0.00 0.00 32.58 31.26 1x0r s HIS 42 CO 0.16 -0.36 1.87 -1.00 -2.00 0.00 0.00 174.74 173.41 1x0r h PRO 43 N 3.91 0.94 -1.63 -0.38 0.13 -1.72 -3.40 132.00 129.86 1x0r h PRO 43 Ca -0.31 -0.06 0.06 0.00 -0.87 0.00 0.00 66.00 64.82 1x0r h PRO 43 Cb 1.19 -0.21 -0.24 0.00 0.13 0.00 0.00 31.00 31.87 1x0r h PRO 43 CO 0.43 0.62 0.47 0.00 -0.23 0.00 0.00 178.00 179.29 1x0r s ALA 44 N -6.13 -1.92 0.67 -0.56 0.00 -1.26 -4.36 121.76 108.20 1x0r s ALA 44 Ca -0.13 1.67 -0.17 0.00 0.00 0.00 0.00 51.96 53.33 1x0r s ALA 44 Cb 0.15 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.38 1x0r s ALA 44 CO 0.78 -0.29 1.28 -0.51 0.00 0.00 0.00 175.76 177.01 1x0r s ASP 45 N -0.63 4.46 -1.30 0.00 1.11 -1.26 -3.31 116.67 115.74 1x0r s ASP 45 Ca -0.01 2.57 -0.02 0.00 0.18 0.00 0.00 52.55 55.27 1x0r s ASP 45 Cb -0.02 -2.61 0.01 0.00 1.07 0.00 0.00 42.92 41.37 1x0r s ASP 45 CO -0.00 -2.10 0.86 0.49 1.18 0.00 0.00 175.17 175.60 1x0r n PHE 46 N -2.12 -2.11 -4.09 4.23 3.01 -1.26 -5.01 117.46 110.11 1x0r n PHE 46 Ca 0.15 0.89 -0.17 0.00 1.01 0.00 0.00 57.45 59.33 1x0r n PHE 46 Cb 0.49 -4.62 -0.15 0.00 -0.01 0.00 0.00 39.48 35.18 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 -3.51 0.36 0.19 4.37 2.01 -1.21 -5.09 115.64 112.75 1x0r s THR 47 Ca 0.11 -0.10 -0.12 0.00 0.31 0.00 0.00 61.69 61.89 1x0r s THR 47 Cb -0.05 -0.37 0.10 0.00 0.01 0.00 0.00 72.50 72.20 1x0r s THR 47 CO 0.78 0.15 1.80 1.55 -0.69 0.00 0.00 174.62 178.21 1x0r h PRO 48 N 6.65 0.91 -0.29 4.92 0.13 -1.95 -1.71 132.00 140.66 1x0r h PRO 48 Ca -0.35 -0.11 -0.18 0.00 -0.87 0.00 0.00 66.00 64.49 1x0r h PRO 48 Cb 1.17 -0.18 -0.00 0.00 0.13 0.00 0.00 31.00 32.12 1x0r h PRO 48 CO 0.49 0.69 -0.52 0.28 -0.23 0.00 0.00 178.00 178.71 1x0r h VAL 49 N 0.89 1.28 -0.51 1.56 2.07 -1.99 -1.37 116.25 118.18 1x0r h VAL 49 Ca 0.23 -1.71 -0.00 0.00 0.82 0.00 0.00 66.70 66.03 1x0r h VAL 49 Cb 0.05 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1x0r h VAL 49 CO -0.04 0.56 0.30 0.00 0.02 0.00 0.00 177.57 178.41 1x0r h THR 51 N 0.68 1.19 -0.70 0.00 2.02 -1.00 0.59 112.91 115.69 1x0r h THR 51 Ca 0.18 -0.52 0.05 0.00 0.77 0.00 0.00 66.41 66.90 1x0r h THR 51 Cb 0.00 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 66.93 1x0r h THR 51 CO -0.03 0.21 0.46 0.71 0.37 0.00 0.00 175.52 177.24 1x0r h THR 52 N 0.71 1.05 -0.17 3.16 1.35 -0.42 -1.90 112.91 116.69 1x0r h THR 52 Ca 0.18 -0.26 -0.22 0.00 -0.55 0.00 0.00 66.41 65.56 1x0r h THR 52 Cb 0.09 0.21 0.01 0.00 -1.73 0.00 0.00 68.15 66.73 1x0r h THR 52 CO -0.03 0.14 -0.75 -0.33 -0.25 0.00 0.00 175.52 174.30 1x0r h GLU 53 N 0.76 0.80 -0.31 4.72 5.08 -0.68 -0.63 114.58 124.33 1x0r h GLU 53 Ca 0.29 -0.64 -0.07 0.00 -1.00 0.00 0.00 59.36 57.95 1x0r h GLU 53 Cb 0.19 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1x0r h GLU 53 CO -0.09 1.25 -0.09 0.74 -1.00 0.00 0.00 179.01 179.81 1x0r h PHE 54 N 0.54 0.54 -0.42 4.33 -1.00 -0.61 0.15 116.94 120.47 1x0r h PHE 54 Ca -0.05 -0.08 -0.14 0.00 2.81 0.00 0.00 57.97 60.52 1x0r h PHE 54 Cb 1.38 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 40.78 1x0r h PHE 54 CO 0.09 0.59 -0.28 0.28 -1.61 0.00 0.00 178.31 177.38 1x0r h VAL 55 N 0.47 1.27 -0.41 -0.55 2.07 -1.14 -0.64 116.25 117.33 1x0r h VAL 55 Ca 0.09 -1.45 -0.08 0.00 0.82 0.00 0.00 66.70 66.08 1x0r h VAL 55 Cb 0.45 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1x0r h VAL 55 CO 0.02 0.49 -0.05 -1.28 0.02 0.00 0.00 177.57 176.78 1x0r h SER 56 N 0.77 0.75 -0.28 0.57 0.87 -0.50 0.10 113.55 115.83 1x0r h SER 56 Ca 0.08 -0.34 -0.01 0.00 -1.23 0.00 0.00 61.79 60.30 1x0r h SER 56 Cb 0.87 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 1x0r h SER 56 CO 0.08 0.91 0.15 -0.26 -0.53 0.00 0.00 176.83 177.18 1x0r h PHE 57 N 0.58 0.38 -0.48 2.24 -1.00 -0.91 -2.00 116.94 115.75 1x0r h PHE 57 Ca 0.11 -0.01 0.05 0.00 2.81 0.00 0.00 57.97 60.93 1x0r h PHE 57 Cb 0.55 -0.12 -0.05 0.00 3.61 0.00 0.00 35.95 39.95 1x0r h PHE 57 CO 0.04 0.33 0.22 0.00 -1.61 0.00 0.00 178.31 177.30 1x0r h ALA 58 N 1.02 0.61 -0.15 2.45 0.00 -0.97 0.86 119.26 123.07 1x0r h ALA 58 Ca 0.10 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.08 1x0r h ALA 58 Cb 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1x0r h ALA 58 CO -0.02 -0.14 0.11 0.00 0.00 0.00 0.00 179.25 179.20 1x0r h ARG 59 N 0.44 0.03 -0.41 0.00 3.08 -0.86 -2.70 114.38 113.95 1x0r h ARG 59 Ca 0.22 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1x0r h ARG 59 Cb 0.15 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1x0r h ARG 59 CO -0.17 0.02 0.00 0.54 -1.07 0.00 0.00 179.97 179.29 1x0r n ARG 60 N -4.50 2.46 -0.14 0.04 1.74 -0.63 -4.57 116.66 111.06 1x0r n ARG 60 Ca 0.00 -2.27 -0.03 0.00 -0.77 0.00 0.00 57.85 54.78 1x0r n ARG 60 Cb 0.22 -1.49 0.05 0.00 -1.02 0.00 0.00 32.46 30.22 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 4.14 0.03 -0.67 -1.55 3.20 -0.52 -0.63 116.97 120.97 1x0r h TYR 61 Ca 0.00 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1x0r h TYR 61 Cb 0.94 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 1x0r h TYR 61 CO 0.27 -0.06 0.39 1.49 -1.64 0.00 0.00 178.16 178.60 1x0r h GLU 62 N 0.15 0.92 -0.86 1.82 4.81 -1.80 0.10 114.58 119.72 1x0r h GLU 62 Ca 0.23 -0.08 0.08 0.00 -0.13 0.00 0.00 59.36 59.46 1x0r h GLU 62 Cb 0.33 -0.19 -0.06 0.00 0.63 0.00 0.00 28.75 29.46 1x0r h GLU 62 CO -0.35 0.65 0.56 -0.44 -0.73 0.00 0.00 179.01 178.70 1x0r h ASP 63 N 0.93 0.79 -0.27 1.04 3.32 -1.44 -1.32 116.42 119.47 1x0r h ASP 63 Ca 0.24 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 1x0r h ASP 63 Cb -0.01 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1x0r h ASP 63 CO -0.04 0.49 -0.04 -0.26 -1.72 0.00 0.00 179.24 177.67 1x0r h PHE 64 N 0.89 0.57 -0.64 4.55 -1.00 -0.47 -3.12 116.94 117.72 1x0r h PHE 64 Ca 0.38 -0.11 -0.00 0.00 2.81 0.00 0.00 57.97 61.05 1x0r h PHE 64 Cb 0.32 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 39.71 1x0r h PHE 64 CO -0.00 0.70 0.39 1.96 -1.61 0.00 0.00 178.31 179.75 1x0r h GLN 65 N 0.27 0.85 -0.22 1.51 4.20 -0.42 0.92 115.11 122.23 1x0r h GLN 65 Ca 0.07 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 1x0r h GLN 65 Cb 0.50 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 1x0r h GLN 65 CO 0.02 0.59 0.13 -0.09 -0.67 0.00 0.00 178.83 178.81 1x0r h ARG 66 N 0.87 0.29 -0.01 1.46 9.65 -1.26 -0.94 114.38 124.44 1x0r h ARG 66 Ca 0.23 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.09 1x0r h ARG 66 Cb -0.05 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 28.46 1x0r h ARG 66 CO -0.05 0.20 -0.15 1.28 2.80 0.00 0.00 179.97 184.06 1x0r n LEU 67 N -4.49 0.89 -0.28 3.80 4.77 0.23 -4.90 117.00 117.01 1x0r n LEU 67 Ca 0.00 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 1x0r n LEU 67 Cb 0.08 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1x0r n LEU 67 CO 0.35 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1x0r n GLY 68 N 1.27 0.92 2.96 -0.72 0.00 -0.36 -4.93 105.19 104.34 1x0r n GLY 68 Ca 0.15 -0.55 -0.21 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.57 0.71 0.33 1.61 1.01 -0.64 -1.84 120.40 119.00 1x0r s VAL 69 Ca 0.00 -0.27 0.08 0.00 0.00 0.00 0.00 61.98 61.79 1x0r s VAL 69 Cb 0.00 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.68 1x0r s VAL 69 CO 0.00 0.25 0.24 -0.62 0.00 0.00 0.00 175.10 174.96 1x0r s ASP 70 N 0.55 5.11 -0.01 3.32 -1.08 -0.14 -3.34 116.67 121.09 1x0r s ASP 70 Ca -0.08 -0.56 0.07 0.00 -0.52 0.00 0.00 52.55 51.45 1x0r s ASP 70 Cb -0.12 -0.93 -0.03 0.00 -1.46 0.00 0.00 42.92 40.39 1x0r s ASP 70 CO 0.01 -0.31 -0.21 -0.76 0.52 0.00 0.00 175.17 174.42 1x0r s LEU 71 N -3.93 2.38 -0.08 -1.34 1.43 -1.26 -0.13 118.68 115.75 1x0r s LEU 71 Ca 0.39 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 53.06 1x0r s LEU 71 Cb -0.05 -1.43 0.04 0.00 0.03 0.00 0.00 46.19 44.78 1x0r s LEU 71 CO 0.25 0.31 0.17 -0.51 0.23 0.00 0.00 176.35 176.80 1x0r s ILE 72 N -0.74 -0.04 0.68 -0.59 2.07 -0.03 -4.21 121.20 118.34 1x0r s ILE 72 Ca 0.12 0.16 -0.01 0.00 -1.41 0.00 0.00 60.65 59.51 1x0r s ILE 72 Cb -0.10 -0.28 0.14 0.00 0.13 0.00 0.00 42.46 42.34 1x0r s ILE 72 CO 0.01 0.06 0.93 0.61 -1.91 0.00 0.00 174.94 174.64 1x0r n GLY 73 N 4.13 0.55 3.62 1.50 0.00 0.62 -1.07 105.19 114.52 1x0r n GLY 73 Ca -0.25 -2.01 -0.04 0.00 0.00 0.00 0.00 46.02 43.72 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 -0.79 0.28 0.99 1.98 -0.38 0.25 118.68 121.00 1x0r s LEU 74 Ca 0.61 1.22 -0.08 0.00 -2.89 0.00 0.00 54.13 52.98 1x0r s LEU 74 Cb -0.03 2.08 -0.00 0.00 0.66 0.00 0.00 46.19 48.90 1x0r s LEU 74 CO 0.40 -0.19 0.45 -0.94 -1.89 0.00 0.00 176.35 174.19 1x0r s SER 75 N 1.83 0.26 0.00 3.68 1.04 -0.73 -1.37 113.70 118.42 1x0r s SER 75 Ca -0.08 -1.17 0.26 0.00 0.48 0.00 0.00 55.95 55.43 1x0r s SER 75 Cb -0.06 0.60 1.35 0.00 0.10 0.00 0.00 66.02 68.02 1x0r s SER 75 CO -0.18 -1.18 1.87 0.55 0.98 0.00 0.00 173.24 175.28 1x0r n VAL 76 N -0.43 0.14 -1.01 5.02 3.14 -1.26 -0.42 118.33 123.50 1x0r n VAL 76 Ca -0.01 0.04 -0.29 0.00 -2.96 0.00 0.00 64.34 61.12 1x0r n VAL 76 Cb 0.62 -0.62 0.19 0.00 -1.06 0.00 0.00 33.84 32.98 1x0r n VAL 76 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 1x0r s ASP 77 N -2.43 2.25 0.61 6.55 1.11 -1.26 -2.90 116.67 120.60 1x0r s ASP 77 Ca 0.28 1.30 -0.01 0.00 0.18 0.00 0.00 52.55 54.29 1x0r s ASP 77 Cb 0.17 -1.99 0.05 0.00 1.07 0.00 0.00 42.92 42.22 1x0r s ASP 77 CO 0.37 -3.38 0.87 -0.94 1.18 0.00 0.00 175.17 173.26 1x0r s SER 78 N -3.21 5.05 0.51 0.27 1.04 -1.26 -3.42 113.70 112.68 1x0r s SER 78 Ca 0.66 0.10 0.27 0.00 0.48 0.00 0.00 55.95 57.47 1x0r s SER 78 Cb -0.20 -0.87 1.40 0.00 0.10 0.00 0.00 66.02 66.44 1x0r s SER 78 CO 0.59 -1.35 2.05 -0.37 0.98 0.00 0.00 173.24 175.14 1x0r h VAL 79 N -0.19 0.55 -0.38 5.02 -1.51 -1.93 -0.87 116.25 116.94 1x0r h VAL 79 Ca -0.42 -0.59 -0.16 0.00 -1.23 0.00 0.00 66.70 64.29 1x0r h VAL 79 Cb 1.30 1.39 -0.01 0.00 -2.13 0.00 0.00 31.29 31.84 1x0r h VAL 79 CO 0.54 0.13 -0.39 -0.26 -1.23 0.00 0.00 177.57 176.35 1x0r h PHE 80 N 0.00 1.13 -0.30 5.19 -1.00 -1.99 -0.66 116.94 119.31 1x0r h PHE 80 Ca -0.00 -0.34 -0.02 0.00 2.81 0.00 0.00 57.97 60.42 1x0r h PHE 80 Cb 0.38 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.69 1x0r h PHE 80 CO 0.00 1.17 0.10 0.77 -1.61 0.00 0.00 178.31 178.75 1x0r h SER 81 N 0.75 0.42 -0.51 2.17 0.02 -1.85 0.88 113.55 115.43 1x0r h SER 81 Ca 0.06 -0.19 0.10 0.00 -0.84 0.00 0.00 61.79 60.92 1x0r h SER 81 Cb 0.99 -0.11 -0.09 0.00 0.14 0.00 0.00 62.40 63.33 1x0r h SER 81 CO 0.10 0.50 -0.07 0.45 -1.14 0.00 0.00 176.83 176.66 1x0r h HIS 82 N 0.32 -0.17 -0.22 3.45 3.86 -0.82 0.18 115.15 121.75 1x0r h HIS 82 Ca 0.10 0.04 -0.19 0.00 -1.16 0.00 0.00 60.37 59.16 1x0r h HIS 82 Cb 0.22 0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.84 1x0r h HIS 82 CO 0.00 -0.18 -0.61 0.82 0.86 0.00 0.00 177.93 178.82 1x0r h ILE 83 N 0.05 1.29 -0.51 2.45 2.04 -0.88 -0.22 117.51 121.73 1x0r h ILE 83 Ca 0.26 -1.83 -0.01 0.00 1.00 0.00 0.00 64.86 64.28 1x0r h ILE 83 Cb 0.39 1.77 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 1x0r h ILE 83 CO -0.49 0.58 0.27 0.11 0.00 0.00 0.00 178.15 178.63 1x0r h LYS 84 N 0.57 0.71 -0.56 2.37 1.79 -0.04 -1.00 116.57 120.41 1x0r h LYS 84 Ca -0.00 -0.09 -0.02 0.00 -2.18 0.00 0.00 60.65 58.36 1x0r h LYS 84 Cb 1.21 -0.14 -0.03 0.00 -1.58 0.00 0.00 32.23 31.70 1x0r h LYS 84 CO 0.13 0.56 0.26 2.35 -1.08 0.00 0.00 179.45 181.67 1x0r h TRP 85 N 0.68 0.82 -0.49 -1.35 7.01 -0.47 0.75 115.95 122.89 1x0r h TRP 85 Ca 0.18 -0.05 -0.02 0.00 2.11 0.00 0.00 58.89 61.11 1x0r h TRP 85 Cb 0.06 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 26.84 1x0r h TRP 85 CO -0.02 0.64 0.21 0.87 -2.79 0.00 0.00 178.44 177.36 1x0r h LYS 86 N 0.76 0.69 -0.22 2.65 1.57 -0.77 0.11 116.57 121.36 1x0r h LYS 86 Ca 0.19 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1x0r h LYS 86 Cb 0.14 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1x0r h LYS 86 CO -0.02 0.56 -0.15 0.93 -0.57 0.00 0.00 179.45 180.20 1x0r h GLU 87 N 0.69 0.49 -0.94 3.15 5.08 -0.79 -1.40 114.58 120.86 1x0r h GLU 87 Ca 0.17 -0.23 0.13 0.00 -1.00 0.00 0.00 59.36 58.43 1x0r h GLU 87 Cb 0.11 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.27 1x0r h GLU 87 CO -0.02 0.79 0.56 2.35 -1.00 0.00 0.00 179.01 181.69 1x0r h TRP 88 N 0.19 1.00 -0.45 4.33 7.01 -0.21 0.21 115.95 128.03 1x0r h TRP 88 Ca 0.04 0.03 -0.14 0.00 2.11 0.00 0.00 58.89 60.94 1x0r h TRP 88 Cb 0.67 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 27.41 1x0r h TRP 88 CO 0.07 0.35 -0.27 0.82 -2.79 0.00 0.00 178.44 176.63 1x0r h ILE 89 N 0.85 1.27 -0.46 2.65 2.04 -0.40 0.19 117.51 123.65 1x0r h ILE 89 Ca 0.48 -1.43 -0.06 0.00 1.00 0.00 0.00 64.86 64.84 1x0r h ILE 89 Cb 0.55 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 1x0r h ILE 89 CO -0.29 0.49 0.04 -0.08 0.00 0.00 0.00 178.15 178.31 1x0r h GLU 90 N 0.81 0.79 -0.16 2.37 4.81 -0.97 0.36 114.58 122.59 1x0r h GLU 90 Ca 0.09 -0.23 -0.09 0.00 -0.13 0.00 0.00 59.36 59.00 1x0r h GLU 90 Cb 0.85 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.15 1x0r h GLU 90 CO 0.08 0.82 -0.26 -0.09 -0.73 0.00 0.00 179.01 178.83 1x0r h ARG 91 N 0.65 0.45 0.00 1.92 2.43 -0.22 -2.24 114.38 117.37 1x0r h ARG 91 Ca 0.14 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 1x0r h ARG 91 Cb 0.44 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1x0r h ARG 91 CO 0.02 0.87 -1.28 0.72 -1.51 0.00 0.00 179.97 178.79 1x0r n HIS 92 N -4.42 0.24 0.01 2.20 8.25 0.62 -4.42 115.22 117.70 1x0r n HIS 92 Ca -0.06 0.07 0.02 0.00 -0.26 0.00 0.00 57.72 57.49 1x0r n HIS 92 Cb 0.44 -0.45 -0.03 0.00 1.12 0.00 0.00 29.99 31.07 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 -2.06 0.00 -1.22 1.59 5.41 0.12 -4.48 119.36 118.73 1x0r n ILE 93 Ca 0.00 -0.12 0.00 0.00 1.00 0.00 0.00 62.75 63.63 1x0r n ILE 93 Cb 0.47 0.45 0.00 0.00 -0.71 0.00 0.00 39.64 39.85 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 2.17 0.48 3.28 7.39 0.00 -0.77 -4.82 105.19 112.91 1x0r n GLY 94 Ca -0.01 -0.92 -0.32 0.00 0.00 0.00 0.00 46.02 44.78 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 2.32 -0.15 1.61 1.01 -1.22 -4.96 120.40 117.01 1x0r s VAL 95 Ca 0.00 -0.94 -0.15 0.00 0.00 0.00 0.00 61.98 60.89 1x0r s VAL 95 Cb 0.00 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 1x0r s VAL 95 CO 0.00 0.56 0.34 -0.60 0.00 0.00 0.00 175.10 175.39 1x0r s ARG 96 N 0.18 4.26 -0.23 2.72 3.52 -1.26 -3.30 118.95 124.84 1x0r s ARG 96 Ca -0.12 0.18 -0.26 0.00 -0.13 0.00 0.00 55.73 55.40 1x0r s ARG 96 Cb -0.16 -3.42 -0.00 0.00 -1.56 0.00 0.00 34.95 29.80 1x0r s ARG 96 CO 0.07 0.23 0.89 0.42 -0.81 0.00 0.00 175.30 176.10 1x0r s ILE 97 N 0.46 4.80 -2.67 4.11 -1.09 -1.26 -4.93 121.20 120.62 1x0r s ILE 97 Ca 0.19 1.70 0.25 0.00 -2.23 0.00 0.00 60.65 60.57 1x0r s ILE 97 Cb -0.14 -4.17 0.30 0.00 -1.58 0.00 0.00 42.46 36.87 1x0r s ILE 97 CO 0.05 -0.09 1.43 -0.81 -1.23 0.00 0.00 174.94 174.29 1x0r n PRO 98 N 6.00 1.92 -4.44 2.79 -0.04 -1.26 -4.93 135.00 135.03 1x0r n PRO 98 Ca 0.07 -1.43 -0.26 0.00 -0.04 0.00 0.00 63.50 61.84 1x0r n PRO 98 Cb 0.47 -1.47 -0.10 0.00 -0.04 0.00 0.00 33.50 32.37 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 -2.07 2.51 0.55 0.54 -0.12 -1.26 -5.10 117.98 113.03 1x0r s PHE 99 Ca 0.30 -0.55 -0.17 0.00 -0.05 0.00 0.00 56.93 56.46 1x0r s PHE 99 Cb 0.20 -1.63 -0.06 0.00 -0.63 0.00 0.00 43.02 40.91 1x0r s PHE 99 CO 0.35 0.45 1.04 -1.25 -0.05 0.00 0.00 175.22 175.76 1x0r s PRO 100 N -3.72 3.54 -0.09 1.99 0.04 -1.26 -4.89 135.00 130.62 1x0r s PRO 100 Ca 0.35 1.21 0.03 0.00 0.04 0.00 0.00 61.00 62.64 1x0r s PRO 100 Cb 0.04 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1x0r s PRO 100 CO 0.19 -0.63 -0.20 0.42 0.04 0.00 0.00 177.00 176.81 1x0r s ILE 101 N -2.35 1.77 0.24 0.56 1.01 -1.26 -0.28 121.20 120.89 1x0r s ILE 101 Ca 0.64 -0.85 -0.30 0.00 0.00 0.00 0.00 60.65 60.14 1x0r s ILE 101 Cb -0.15 -1.55 -0.09 0.00 0.01 0.00 0.00 42.46 40.68 1x0r s ILE 101 CO 0.31 0.50 1.13 -0.63 0.00 0.00 0.00 174.94 176.25 1x0r s ILE 102 N 0.43 3.54 -0.29 2.92 1.01 0.14 -1.69 121.20 127.26 1x0r s ILE 102 Ca -0.17 1.45 -0.11 0.00 0.00 0.00 0.00 60.65 61.82 1x0r s ILE 102 Cb -0.17 -3.92 -0.03 0.00 0.01 0.00 0.00 42.46 38.34 1x0r s ILE 102 CO 0.07 0.30 0.18 0.00 0.00 0.00 0.00 174.94 175.49 1x0r s ALA 103 N -0.74 3.43 -0.46 9.38 0.00 0.21 -1.77 121.76 131.82 1x0r s ALA 103 Ca 0.47 -1.20 0.09 0.00 0.00 0.00 0.00 51.96 51.32 1x0r s ALA 103 Cb -0.32 -2.45 0.35 0.00 0.00 0.00 0.00 23.12 20.70 1x0r s ALA 103 CO 0.39 -0.69 0.85 -3.47 0.00 0.00 0.00 175.76 172.85 1x0r n ASP 104 N 5.04 2.61 -0.25 0.00 2.03 0.44 -4.57 116.55 121.85 1x0r n ASP 104 Ca -0.14 -3.32 0.33 0.00 0.52 0.00 0.00 54.79 52.17 1x0r n ASP 104 Cb 0.51 -0.58 0.72 0.00 -0.72 0.00 0.00 41.12 41.05 1x0r n ASP 104 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1x0r h PRO 105 N 2.98 0.00 -0.58 -0.67 0.11 -1.72 0.11 132.00 132.23 1x0r h PRO 105 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1x0r h PRO 105 Cb 0.77 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1x0r h PRO 105 CO 0.65 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.48 1x0r n GLN 106 N -3.99 2.58 -0.98 1.05 1.13 -1.26 -4.87 117.38 111.04 1x0r n GLN 106 Ca 0.23 -2.42 0.00 0.00 -1.94 0.00 0.00 57.00 52.86 1x0r n GLN 106 Cb 1.19 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 30.01 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 1.58 0.25 0.31 1.08 0.00 0.39 -4.91 105.19 103.89 1x0r n GLY 107 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 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 0.40 -0.60 2.61 2.02 -1.90 0.15 112.91 115.59 1x0r h THR 108 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1x0r h THR 108 Cb 0.48 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.27 1x0r h THR 108 CO 0.00 0.00 0.35 0.58 0.37 0.00 0.00 175.52 176.82 1x0r h VAL 109 N -0.55 1.19 -0.49 3.16 2.07 -1.91 -2.51 116.25 117.21 1x0r h VAL 109 Ca 0.01 -0.44 -0.08 0.00 0.82 0.00 0.00 66.70 67.01 1x0r h VAL 109 Cb 0.53 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1x0r h VAL 109 CO -0.10 0.20 -0.01 0.00 0.02 0.00 0.00 177.57 177.67 1x0r h ALA 110 N 1.17 1.06 -0.21 1.67 0.00 -1.85 -0.66 119.26 120.44 1x0r h ALA 110 Ca 0.21 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1x0r h ALA 110 Cb 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1x0r h ALA 110 CO -0.04 0.59 -0.42 0.00 0.00 0.00 0.00 179.25 179.38 1x0r h ARG 111 N 0.76 0.49 0.00 0.00 3.08 -0.56 0.60 114.38 118.75 1x0r h ARG 111 Ca 0.15 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.90 1x0r h ARG 111 Cb 0.48 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1x0r h ARG 111 CO 0.02 0.82 -0.20 0.00 -1.07 0.00 0.00 179.97 179.55 1x0r h ARG 112 N 0.40 0.00 -0.16 0.04 3.08 -0.79 -2.62 114.38 114.33 1x0r h ARG 112 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1x0r h ARG 112 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.95 1x0r h ARG 112 CO 0.08 0.20 0.00 1.28 -1.07 0.00 0.00 179.97 180.46 1x0r n LEU 113 N -4.07 3.08 -1.95 3.04 4.77 -0.37 -4.31 117.00 117.18 1x0r n LEU 113 Ca -0.02 -1.15 -0.13 0.00 -0.03 0.00 0.00 56.01 54.68 1x0r n LEU 113 Cb 0.27 -0.09 0.03 0.00 -2.33 0.00 0.00 43.42 41.30 1x0r n LEU 113 CO 0.35 0.57 0.04 0.61 -1.33 0.00 0.00 177.39 177.63 1x0r n GLY 114 N 1.40 0.03 0.90 -0.72 0.00 0.43 -4.62 105.19 102.61 1x0r n GLY 114 Ca 0.16 -0.23 0.12 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.60 2.76 -4.42 0.99 4.77 0.18 -4.76 117.00 113.93 1x0r n LEU 115 Ca -0.04 -1.01 -0.39 0.00 -0.03 0.00 0.00 56.01 54.53 1x0r n LEU 115 Cb 0.56 -0.07 -0.11 0.00 -2.33 0.00 0.00 43.42 41.46 1x0r n LEU 115 CO 0.30 0.51 -0.18 -0.76 -1.33 0.00 0.00 177.39 175.92 1x0r s LEU 116 N -1.84 4.36 0.00 2.23 1.43 -1.26 -1.27 118.68 122.34 1x0r s LEU 116 Ca 0.33 -0.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 1x0r s LEU 116 Cb 0.21 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.41 1x0r s LEU 116 CO 0.31 -0.27 0.00 1.41 0.23 0.00 0.00 176.35 178.03 1x0r n HIS 117 N 4.99 -1.64 1.59 0.29 8.25 -1.26 -4.99 115.22 122.46 1x0r n HIS 117 Ca -0.13 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.48 1x0r n HIS 117 Cb 0.48 0.00 0.81 0.00 1.12 0.00 0.00 29.99 32.40 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 -3.00 2.56 0.17 -1.41 0.00 -1.26 -3.31 120.51 114.26 1x0r n ALA 118 Ca 0.00 -0.17 0.03 0.00 0.00 0.00 0.00 53.44 53.30 1x0r n ALA 118 Cb 0.00 -1.49 0.28 0.00 0.00 0.00 0.00 19.45 18.24 1x0r n ALA 118 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1x0r h GLU 119 N 0.04 0.00 -2.69 0.00 4.81 -1.95 -3.44 114.58 111.36 1x0r h GLU 119 Ca 0.00 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.11 1x0r h GLU 119 Cb 0.21 0.00 -0.24 0.00 0.63 0.00 0.00 28.75 29.35 1x0r h GLU 119 CO 0.00 0.46 -0.23 0.45 -0.73 0.00 0.00 179.01 178.96 1x0r s SER 120 N -6.59 -0.46 0.14 1.04 0.15 -1.21 -5.00 113.70 101.76 1x0r s SER 120 Ca -0.00 0.87 0.25 0.00 0.70 0.00 0.00 55.95 57.77 1x0r s SER 120 Cb 0.12 0.86 0.54 0.00 -1.71 0.00 0.00 66.02 65.83 1x0r s SER 120 CO 0.71 -0.16 1.50 0.00 1.20 0.00 0.00 173.24 176.50 1x0r n ALA 121 N 3.12 2.73 -0.04 5.45 0.00 -1.26 -4.18 120.51 126.32 1x0r n ALA 121 Ca -0.15 -0.18 -0.02 0.00 0.00 0.00 0.00 53.44 53.09 1x0r n ALA 121 Cb 0.57 -1.28 -0.10 0.00 0.00 0.00 0.00 19.45 18.64 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 -2.09 0.59 -4.77 0.00 5.66 -1.26 -5.02 114.28 107.39 1x0r n THR 122 Ca 0.04 -0.45 -0.30 0.00 -3.05 0.00 0.00 64.05 60.29 1x0r n THR 122 Cb 0.43 -0.44 -0.14 0.00 -1.55 0.00 0.00 70.33 68.63 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 -2.45 2.43 0.65 1.09 4.02 -1.26 -4.93 115.29 114.84 1x0r s HIS 123 Ca -0.06 -0.34 -0.14 0.00 1.02 0.00 0.00 55.06 55.54 1x0r s HIS 123 Cb 0.05 -1.42 -0.01 0.00 -1.02 0.00 0.00 32.58 30.19 1x0r s HIS 123 CO 0.50 0.20 1.08 0.95 1.02 0.00 0.00 174.74 178.48 1x0r s THR 124 N -0.87 3.60 0.00 1.30 -4.23 -1.26 -4.61 115.64 109.56 1x0r s THR 124 Ca 0.13 0.68 0.00 0.00 -1.18 0.00 0.00 61.69 61.32 1x0r s THR 124 Cb -0.10 -3.23 0.00 0.00 1.34 0.00 0.00 72.50 70.50 1x0r s THR 124 CO 0.04 -0.52 0.00 1.33 -0.54 0.00 0.00 174.62 174.93 1x0r n VAL 125 N -2.51 0.00 -3.45 2.29 0.24 -0.39 -3.12 118.33 111.38 1x0r n VAL 125 Ca 0.09 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.98 1x0r n VAL 125 Cb 0.53 -1.41 -0.02 0.00 -1.47 0.00 0.00 33.84 31.46 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 -2.00 3.87 0.33 7.34 0.52 -0.07 -3.87 118.95 125.07 1x0r s ARG 126 Ca 0.00 -3.26 -0.05 0.00 -0.52 0.00 0.00 55.73 51.89 1x0r s ARG 126 Cb 0.00 -4.33 -0.05 0.00 0.52 0.00 0.00 34.95 31.09 1x0r s ARG 126 CO 0.00 -1.25 0.61 0.20 0.02 0.00 0.00 175.30 174.88 1x0r s GLY 127 N 0.74 1.79 -0.12 -3.53 0.00 -1.25 -1.02 107.32 103.93 1x0r s GLY 127 Ca 0.30 -0.52 -0.04 0.00 0.00 0.00 0.00 44.72 44.46 1x0r s GLY 127 CO -0.10 -0.40 0.19 0.14 0.00 0.00 0.00 173.10 172.93 1x0r s VAL 128 N -2.22 -0.30 -0.15 1.40 1.01 0.07 -0.85 120.40 119.36 1x0r s VAL 128 Ca 0.45 0.22 -0.05 0.00 0.00 0.00 0.00 61.98 62.60 1x0r s VAL 128 Cb -0.10 -0.42 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 1x0r s VAL 128 CO 0.32 0.05 0.02 -0.36 0.00 0.00 0.00 175.10 175.13 1x0r s PHE 129 N 2.32 3.17 -0.25 5.22 0.40 0.80 -1.80 117.98 127.84 1x0r s PHE 129 Ca 0.04 -0.01 -0.06 0.00 -0.60 0.00 0.00 56.93 56.30 1x0r s PHE 129 Cb -0.13 -1.98 -0.01 0.00 0.51 0.00 0.00 43.02 41.42 1x0r s PHE 129 CO -0.08 0.18 0.02 0.42 0.70 0.00 0.00 175.22 176.46 1x0r s ILE 130 N 0.06 3.77 -0.06 0.64 -1.09 -0.73 -0.96 121.20 122.83 1x0r s ILE 130 Ca 0.03 -0.51 0.06 0.00 -2.23 0.00 0.00 60.65 58.00 1x0r s ILE 130 Cb -0.13 -2.82 -0.01 0.00 -1.58 0.00 0.00 42.46 37.93 1x0r s ILE 130 CO 0.02 0.28 -0.24 -0.69 -1.23 0.00 0.00 174.94 173.07 1x0r s VAL 131 N 1.51 2.00 0.46 2.92 1.01 0.33 0.06 120.40 128.69 1x0r s VAL 131 Ca 0.05 -1.03 -0.02 0.00 0.00 0.00 0.00 61.98 60.98 1x0r s VAL 131 Cb -0.16 -1.70 0.09 0.00 0.00 0.00 0.00 36.38 34.62 1x0r s VAL 131 CO 0.00 0.55 0.63 -0.90 0.00 0.00 0.00 175.10 175.38 1x0r n ASP 132 N 3.05 0.68 0.00 3.32 5.68 0.14 -0.80 116.55 128.62 1x0r n ASP 132 Ca -0.18 -1.61 0.08 0.00 -0.50 0.00 0.00 54.79 52.58 1x0r n ASP 132 Cb 0.52 -0.42 0.40 0.00 -1.14 0.00 0.00 41.12 40.48 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 -3.04 1.88 0.99 2.12 0.00 -1.25 -0.64 120.51 120.56 1x0r n ALA 133 Ca -0.10 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.37 1x0r n ALA 133 Cb 0.35 -1.26 0.32 0.00 0.00 0.00 0.00 19.45 18.86 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 -1.31 1.97 -1.21 0.00 1.74 -1.26 -4.67 116.66 111.93 1x0r n ARG 134 Ca 0.07 -1.46 -0.06 0.00 -0.77 0.00 0.00 57.85 55.64 1x0r n ARG 134 Cb 0.13 -1.44 -0.02 0.00 -1.02 0.00 0.00 32.46 30.11 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 1.25 0.79 3.69 -0.13 0.00 0.18 -4.95 105.19 106.02 1x0r n GLY 135 Ca 0.17 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.21 4.88 0.05 1.61 1.01 -1.25 0.13 120.40 124.61 1x0r s VAL 136 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 61.98 61.67 1x0r s VAL 136 Cb 0.00 -3.17 -0.07 0.00 0.00 0.00 0.00 36.38 33.14 1x0r s VAL 136 CO 0.00 0.51 1.56 -0.63 0.00 0.00 0.00 175.10 176.54 1x0r s ILE 137 N -0.05 3.25 -0.07 2.22 1.01 -0.32 -0.68 121.20 126.56 1x0r s ILE 137 Ca 0.07 0.70 0.11 0.00 0.00 0.00 0.00 60.65 61.52 1x0r s ILE 137 Cb -0.12 -3.45 -0.16 0.00 0.01 0.00 0.00 42.46 38.74 1x0r s ILE 137 CO 0.01 0.00 0.14 0.54 0.00 0.00 0.00 174.94 175.63 1x0r n ARG 138 N 5.43 1.39 -0.91 2.79 5.12 0.11 -0.23 116.66 130.35 1x0r n ARG 138 Ca 0.15 -0.05 0.00 0.00 -1.93 0.00 0.00 57.85 56.02 1x0r n ARG 138 Cb 0.41 -1.28 0.00 0.00 -1.16 0.00 0.00 32.46 30.43 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 -2.19 0.00 -3.63 0.55 -1.04 -1.20 -4.88 114.28 101.89 1x0r n THR 139 Ca -0.11 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.81 1x0r n THR 139 Cb 0.62 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 69.06 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 -0.39 -0.31 -4.42 1.43 -0.74 -1.77 118.68 112.47 1x0r s LEU 141 Ca 0.00 0.71 0.03 0.00 -1.03 0.00 0.00 54.13 53.84 1x0r s LEU 141 Cb 0.00 1.79 0.09 0.00 0.03 0.00 0.00 46.19 48.10 1x0r s LEU 141 CO 0.00 -0.16 0.03 -0.31 0.23 0.00 0.00 176.35 176.14 1x0r s TYR 142 N 0.02 3.26 0.25 0.29 1.51 -1.26 -0.75 117.35 120.67 1x0r s TYR 142 Ca 0.03 -2.61 -0.08 0.00 -1.01 0.00 0.00 57.07 53.40 1x0r s TYR 142 Cb -0.04 -2.48 -0.07 0.00 -0.11 0.00 0.00 41.96 39.26 1x0r s TYR 142 CO -0.06 -0.91 0.56 0.71 -1.11 0.00 0.00 175.55 174.73 1x0r s TYR 143 N 1.08 3.44 0.00 2.71 1.51 -0.19 -4.93 117.35 120.97 1x0r s TYR 143 Ca 0.07 0.82 0.00 0.00 -1.01 0.00 0.00 57.07 56.94 1x0r s TYR 143 Cb -0.19 -2.23 0.00 0.00 -0.11 0.00 0.00 41.96 39.44 1x0r s TYR 143 CO -0.10 0.22 0.00 -0.35 -1.11 0.00 0.00 175.55 174.21 1x0r n PRO 144 N -0.41 0.00 0.00 -1.71 -0.04 -1.26 -0.89 135.00 130.69 1x0r n PRO 144 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1x0r n PRO 144 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 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 -3.88 0.54 0.00 -1.26 -4.54 120.64 111.50 1x0r n GLU 146 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 57.16 56.91 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 0.94 0.52 -1.84 0.20 -1.26 -5.10 118.68 112.13 1x0r s LEU 147 Ca 0.00 -0.19 -0.18 0.00 0.69 0.00 0.00 54.13 54.44 1x0r s LEU 147 Cb 0.00 -0.64 -0.07 0.00 -0.43 0.00 0.00 46.19 45.05 1x0r s LEU 147 CO 0.00 -0.14 1.02 -0.83 -0.29 0.00 0.00 176.35 176.11 1x0r s GLY 148 N 1.75 2.29 1.01 7.98 0.00 -1.26 -4.95 107.32 114.15 1x0r s GLY 148 Ca 0.04 0.44 -0.13 0.00 0.00 0.00 0.00 44.72 45.06 1x0r s GLY 148 CO -0.06 0.74 1.11 0.50 0.00 0.00 0.00 173.10 175.39 1x0r s ARG 149 N -3.65 0.30 -0.47 2.90 0.52 -1.26 -5.01 118.95 112.27 1x0r s ARG 149 Ca 0.64 0.38 -0.08 0.00 -0.52 0.00 0.00 55.73 56.15 1x0r s ARG 149 Cb -0.14 -1.73 0.12 0.00 0.52 0.00 0.00 34.95 33.72 1x0r s ARG 149 CO 0.27 -2.79 0.33 -1.17 0.02 0.00 0.00 175.30 171.96 1x0r s LEU 150 N -6.46 5.62 0.52 2.53 2.96 -1.26 -4.94 118.68 117.65 1x0r s LEU 150 Ca 0.66 -2.00 0.26 0.00 -0.22 0.00 0.00 54.13 52.83 1x0r s LEU 150 Cb -0.17 -1.97 1.44 0.00 0.50 0.00 0.00 46.19 45.99 1x0r s LEU 150 CO 0.57 -0.65 2.09 0.58 -1.32 0.00 0.00 176.35 177.62 1x0r h VAL 151 N 6.11 0.65 0.00 1.68 2.07 -1.95 -0.51 116.25 124.31 1x0r h VAL 151 Ca -0.18 -0.45 -0.02 0.00 0.82 0.00 0.00 66.70 66.88 1x0r h VAL 151 Cb 1.06 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1x0r h VAL 151 CO 0.82 0.11 -0.07 0.44 0.02 0.00 0.00 177.57 178.88 1x0r h ASP 152 N 0.00 0.00 1.17 0.57 3.32 -1.92 -1.49 116.42 118.08 1x0r h ASP 152 Ca -0.00 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1x0r h ASP 152 Cb 0.27 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1x0r h ASP 152 CO 0.01 0.07 -0.42 -0.08 -1.72 0.00 0.00 179.24 177.11 1x0r h GLU 153 N 0.00 0.00 -0.02 3.56 4.57 -1.44 -0.66 114.58 120.59 1x0r h GLU 153 Ca -0.00 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 57.96 1x0r h GLU 153 Cb 0.55 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1x0r h GLU 153 CO 0.01 0.42 -0.89 0.82 -1.18 0.00 0.00 179.01 178.18 1x0r h ILE 154 N 0.00 1.40 -0.48 2.32 2.04 -1.27 0.15 117.51 121.67 1x0r h ILE 154 Ca -0.00 -2.39 -0.04 0.00 1.00 0.00 0.00 64.86 63.42 1x0r h ILE 154 Cb 1.11 2.35 -0.02 0.00 -0.74 0.00 0.00 36.82 39.53 1x0r h ILE 154 CO 0.05 0.71 0.15 -0.07 0.00 0.00 0.00 178.15 178.99 1x0r h LEU 155 N 0.24 0.71 -0.78 1.44 3.38 -1.21 -0.89 115.31 118.19 1x0r h LEU 155 Ca -0.07 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 1x0r h LEU 155 Cb 1.52 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 42.05 1x0r h LEU 155 CO 0.15 0.73 0.30 -0.09 0.09 0.00 0.00 178.44 179.62 1x0r h ARG 156 N 0.65 1.18 -0.43 1.13 2.43 -0.77 -1.07 114.38 117.49 1x0r h ARG 156 Ca 0.15 -0.22 -0.04 0.00 -0.81 0.00 0.00 59.98 59.06 1x0r h ARG 156 Cb 0.28 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 1x0r h ARG 156 CO -0.00 0.96 0.12 0.82 -1.51 0.00 0.00 179.97 180.36 1x0r h ILE 157 N 1.14 1.23 -0.37 1.20 2.04 -0.52 0.25 117.51 122.47 1x0r h ILE 157 Ca 0.26 -0.77 -0.14 0.00 1.00 0.00 0.00 64.86 65.21 1x0r h ILE 157 Cb 0.24 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1x0r h ILE 157 CO -0.02 0.27 -0.30 -0.37 0.00 0.00 0.00 178.15 177.73 1x0r h VAL 158 N 0.55 1.28 -0.52 1.67 -1.51 -0.62 0.56 116.25 117.66 1x0r h VAL 158 Ca 0.14 -1.47 0.04 0.00 -1.23 0.00 0.00 66.70 64.17 1x0r h VAL 158 Cb 0.30 1.39 -0.04 0.00 -2.13 0.00 0.00 31.29 30.80 1x0r h VAL 158 CO -0.00 0.49 0.28 0.50 -1.23 0.00 0.00 177.57 177.61 1x0r h LYS 159 N 0.67 0.54 -0.50 5.19 1.63 -1.15 -0.80 116.57 122.15 1x0r h LYS 159 Ca 0.07 -0.03 -0.12 0.00 -0.85 0.00 0.00 60.65 59.71 1x0r h LYS 159 Cb 0.89 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 32.38 1x0r h LYS 159 CO 0.08 0.36 -0.17 0.00 -3.45 0.00 0.00 179.45 176.27 1x0r h ALA 160 N 1.26 0.75 -0.44 5.00 0.00 -0.07 0.29 119.26 126.04 1x0r h ALA 160 Ca 0.22 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1x0r h ALA 160 Cb 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1x0r h ALA 160 CO -0.13 0.67 0.20 -0.07 0.00 0.00 0.00 179.25 179.92 1x0r h LEU 161 N 0.86 0.60 -0.37 0.00 4.07 -0.84 0.29 115.31 119.92 1x0r h LEU 161 Ca 0.12 -0.15 -0.05 0.00 0.08 0.00 0.00 57.88 57.89 1x0r h LEU 161 Cb 0.74 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 1x0r h LEU 161 CO 0.06 0.58 0.04 0.11 -1.08 0.00 0.00 178.44 178.15 1x0r h LYS 162 N 0.57 0.62 -0.29 1.13 1.57 -0.86 0.81 116.57 120.13 1x0r h LYS 162 Ca 0.15 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1x0r h LYS 162 Cb 0.15 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1x0r h LYS 162 CO -0.02 0.70 0.15 -0.07 -0.57 0.00 0.00 179.45 179.65 1x0r h LEU 163 N 0.46 0.37 -1.27 2.94 3.38 -0.81 -0.04 115.31 120.34 1x0r h LEU 163 Ca 0.11 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1x0r h LEU 163 Cb 0.40 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1x0r h LEU 163 CO 0.01 0.37 -0.12 1.23 0.09 0.00 0.00 178.44 180.02 1x0r h GLY 164 N 0.34 0.38 0.79 0.83 0.00 -0.30 0.27 103.07 105.38 1x0r h GLY 164 Ca 0.10 -0.25 -0.06 0.00 0.00 0.00 0.00 47.33 47.12 1x0r h GLY 164 CO -0.01 0.23 -0.14 -0.55 0.00 0.00 0.00 176.54 176.07 1x0r h ASP 165 N 0.33 0.44 0.65 0.19 3.32 -0.17 -0.53 116.42 120.66 1x0r h ASP 165 Ca 0.07 -0.45 -0.07 0.00 0.02 0.00 0.00 57.03 56.60 1x0r h ASP 165 Cb 0.42 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1x0r h ASP 165 CO 0.02 0.80 -0.34 0.77 -1.72 0.00 0.00 179.24 178.77 1x0r h SER 166 N 0.09 0.00 -0.25 6.45 4.64 -0.68 -3.13 113.55 120.67 1x0r h SER 166 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1x0r h SER 166 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1x0r h SER 166 CO 0.04 0.34 0.00 0.18 -0.87 0.00 0.00 176.83 176.52 1x0r n LEU 167 N -3.68 3.23 -3.95 5.97 4.32 0.92 -4.96 117.00 118.84 1x0r n LEU 167 Ca -0.01 -1.32 -0.27 0.00 -0.02 0.00 0.00 56.01 54.40 1x0r n LEU 167 Cb 0.45 -0.15 -0.02 0.00 -1.62 0.00 0.00 43.42 42.08 1x0r n LEU 167 CO 0.36 0.64 -0.23 0.29 -1.22 0.00 0.00 177.39 177.23 1x0r n LYS 168 N 1.39 -2.92 -4.18 3.23 5.02 -0.35 -5.00 118.16 115.33 1x0r n LYS 168 Ca 0.17 0.38 -0.19 0.00 -2.02 0.00 0.00 58.31 56.65 1x0r n LYS 168 Cb 0.59 -4.39 -0.12 0.00 -0.02 0.00 0.00 35.03 31.08 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 -6.57 0.85 0.43 1.97 1.81 -0.35 -4.54 118.95 112.54 1x0r s ARG 169 Ca 0.05 -0.98 -0.02 0.00 -1.72 0.00 0.00 55.73 53.06 1x0r s ARG 169 Cb -0.02 -0.89 -0.03 0.00 -0.45 0.00 0.00 34.95 33.56 1x0r s ARG 169 CO 0.89 0.20 0.69 0.00 -0.68 0.00 0.00 175.30 176.40 1x0r s ALA 170 N -1.26 3.54 -0.15 2.13 0.00 0.57 -4.35 121.76 122.24 1x0r s ALA 170 Ca -0.01 -0.72 -0.01 0.00 0.00 0.00 0.00 51.96 51.22 1x0r s ALA 170 Cb -0.10 -2.36 -0.02 0.00 0.00 0.00 0.00 23.12 20.64 1x0r s ALA 170 CO 0.02 -0.24 -0.10 0.08 0.00 0.00 0.00 175.76 175.52 1x0r s VAL 171 N -2.57 3.21 0.79 0.00 1.01 -1.26 -0.75 120.40 120.84 1x0r s VAL 171 Ca 0.45 -0.59 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 1x0r s VAL 171 Cb -0.10 -2.38 0.07 0.00 0.00 0.00 0.00 36.38 33.97 1x0r s VAL 171 CO 0.41 0.51 1.09 -2.16 0.00 0.00 0.00 175.10 174.94 1x0r s PRO 172 N 0.53 2.13 0.22 2.72 0.04 -1.26 -4.94 135.00 134.44 1x0r s PRO 172 Ca -0.07 0.99 -0.31 0.00 0.04 0.00 0.00 61.00 61.64 1x0r s PRO 172 Cb -0.15 -1.90 -0.14 0.00 0.04 0.00 0.00 34.50 32.35 1x0r s PRO 172 CO 0.04 -1.68 1.23 0.00 0.04 0.00 0.00 177.00 176.63 1x0r n ALA 173 N -3.53 0.04 -1.18 8.56 0.00 -1.26 -2.29 120.51 120.86 1x0r n ALA 173 Ca 0.08 0.43 -0.06 0.00 0.00 0.00 0.00 53.44 53.89 1x0r n ALA 173 Cb 0.54 -2.12 -0.03 0.00 0.00 0.00 0.00 19.45 17.84 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 1.91 -4.45 -4.70 0.00 8.00 -1.26 -4.09 116.55 111.96 1x0r n ASP 174 Ca 0.13 0.15 -0.40 0.00 0.71 0.00 0.00 54.79 55.38 1x0r n ASP 174 Cb 0.28 -2.49 0.02 0.00 -0.02 0.00 0.00 41.12 38.92 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 -2.59 2.03 0.77 1.24 -0.00 -0.97 -0.03 117.44 117.90 1x0r n TRP 175 Ca -0.06 0.47 0.02 0.00 -0.00 0.00 0.00 57.50 57.93 1x0r n TRP 175 Cb 0.32 -2.35 0.10 0.00 -0.00 0.00 0.00 31.31 29.38 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 -0.36 1.86 -2.35 5.87 -0.04 -1.26 -4.90 135.00 133.82 1x0r n PRO 176 Ca 0.08 -0.80 -0.28 0.00 -0.04 0.00 0.00 63.50 62.46 1x0r n PRO 176 Cb 0.42 -1.53 0.01 0.00 -0.04 0.00 0.00 33.50 32.36 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 0.14 5.13 -4.77 3.54 3.02 0.96 -2.89 115.26 120.38 1x0r n ASN 177 Ca 0.07 -3.74 -0.38 0.00 -0.03 0.00 0.00 54.58 50.51 1x0r n ASN 177 Cb 0.40 -0.53 -0.01 0.00 -0.61 0.00 0.00 39.78 39.02 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 -3.21 6.32 0.50 6.41 3.84 -0.05 -4.84 114.94 123.91 1x0r s ASN 178 Ca 0.49 2.33 0.29 0.00 0.21 0.00 0.00 52.86 56.18 1x0r s ASN 178 Cb 0.41 -2.61 0.94 0.00 -0.55 0.00 0.00 41.25 39.44 1x0r s ASN 178 CO -0.20 -0.81 1.83 -0.33 -2.79 0.00 0.00 177.10 174.80 1x0r h GLU 179 N 2.32 0.00 0.00 0.43 5.08 -1.87 0.36 114.58 120.90 1x0r h GLU 179 Ca -0.49 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.54 1x0r h GLU 179 Cb 1.24 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.44 1x0r h GLU 179 CO 0.61 0.02 -1.79 -0.89 -1.00 0.00 0.00 179.01 175.95 1x0r n ILE 180 N -3.11 1.54 -0.51 3.13 5.41 -1.26 -4.67 119.36 119.89 1x0r n ILE 180 Ca 0.02 -0.19 0.04 0.00 1.00 0.00 0.00 62.75 63.61 1x0r n ILE 180 Cb 0.40 -1.96 0.05 0.00 -0.71 0.00 0.00 39.64 37.42 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 -4.31 1.25 0.00 1.39 -5.35 -1.24 -5.08 119.36 106.02 1x0r n ILE 181 Ca -0.41 -1.39 0.00 0.00 -0.27 0.00 0.00 62.75 60.68 1x0r n ILE 181 Cb 0.78 0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.92 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 -0.81 2.42 1.33 3.28 0.00 0.13 -1.53 105.19 110.01 1x0r n GLY 182 Ca 0.06 0.33 0.12 0.00 0.00 0.00 0.00 46.02 46.53 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 5.20 2.68 -1.64 1.61 0.28 -1.14 -0.88 120.64 126.76 1x0r n GLU 183 Ca 0.00 -2.60 -0.36 0.00 -0.16 0.00 0.00 57.16 54.04 1x0r n GLU 183 Cb 0.00 -1.57 0.08 0.00 1.43 0.00 0.00 31.44 31.38 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 -1.12 2.64 0.17 -1.84 0.00 -0.58 -4.84 107.32 101.76 1x0r s GLY 184 Ca 0.47 1.06 0.11 0.00 0.00 0.00 0.00 44.72 46.36 1x0r s GLY 184 CO 0.34 1.48 -0.24 1.08 0.00 0.00 0.00 173.10 175.76 1x0r s LEU 185 N -4.66 2.40 -0.07 0.66 1.43 0.14 -4.57 118.68 114.01 1x0r s LEU 185 Ca 0.79 -0.83 -0.13 0.00 -1.03 0.00 0.00 54.13 52.93 1x0r s LEU 185 Cb -0.33 -1.11 -0.05 0.00 0.03 0.00 0.00 46.19 44.72 1x0r s LEU 185 CO 0.41 0.11 0.31 -0.63 0.23 0.00 0.00 176.35 176.78 1x0r s ILE 186 N -1.56 5.23 -0.15 -0.59 1.01 0.07 -1.50 121.20 123.72 1x0r s ILE 186 Ca 0.18 0.60 -0.25 0.00 0.00 0.00 0.00 60.65 61.18 1x0r s ILE 186 Cb -0.08 -3.61 -0.02 0.00 0.01 0.00 0.00 42.46 38.76 1x0r s ILE 186 CO 0.08 0.54 0.82 -0.69 0.00 0.00 0.00 174.94 175.69 1x0r s VAL 187 N -0.64 4.91 0.24 2.92 1.01 -0.35 -0.32 120.40 128.17 1x0r s VAL 187 Ca 0.20 1.62 -0.31 0.00 0.00 0.00 0.00 61.98 63.49 1x0r s VAL 187 Cb -0.14 -4.13 -0.14 0.00 0.00 0.00 0.00 36.38 31.97 1x0r s VAL 187 CO 0.08 0.07 1.28 -0.81 0.00 0.00 0.00 175.10 175.72 1x0r n PRO 188 N 4.95 1.75 -1.70 2.72 -0.04 -1.26 -4.59 135.00 136.83 1x0r n PRO 188 Ca 0.04 0.62 -0.41 0.00 -0.04 0.00 0.00 63.50 63.71 1x0r n PRO 188 Cb 0.49 -2.19 0.01 0.00 -0.04 0.00 0.00 33.50 31.78 1x0r n PRO 188 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1x0r n PRO 189 N 1.58 1.90 -1.26 0.54 -0.04 -1.26 -4.97 135.00 131.50 1x0r n PRO 189 Ca 0.11 0.68 -0.34 0.00 -0.04 0.00 0.00 63.50 63.91 1x0r n PRO 189 Cb 0.31 -2.37 0.11 0.00 -0.04 0.00 0.00 33.50 31.51 1x0r n PRO 189 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1x0r n PRO 190 N 0.05 0.41 -0.02 0.54 -0.02 -1.26 -4.94 135.00 129.75 1x0r n PRO 190 Ca 0.07 0.21 0.01 0.00 -2.02 0.00 0.00 63.50 61.77 1x0r n PRO 190 Cb 0.39 -2.46 0.01 0.00 -0.02 0.00 0.00 33.50 31.42 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 -2.97 0.77 -3.99 3.45 -2.24 -1.26 -4.90 114.28 103.15 1x0r n THR 191 Ca 0.14 -0.80 -0.09 0.00 -2.27 0.00 0.00 64.05 61.03 1x0r n THR 191 Cb 0.50 0.57 -0.10 0.00 -2.10 0.00 0.00 70.33 69.20 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 -0.86 0.15 0.27 4.28 -4.23 -1.26 -5.04 115.64 108.95 1x0r s THR 192 Ca 0.03 -1.22 -0.02 0.00 -1.18 0.00 0.00 61.69 59.29 1x0r s THR 192 Cb 0.02 -0.85 0.26 0.00 1.34 0.00 0.00 72.50 73.27 1x0r s THR 192 CO 0.00 -0.67 1.86 -0.33 -0.54 0.00 0.00 174.62 174.93 1x0r h GLU 193 N 3.85 1.02 -0.45 3.99 5.08 -1.99 0.33 114.58 126.41 1x0r h GLU 193 Ca -0.33 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 57.83 1x0r h GLU 193 Cb 1.18 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1x0r h GLU 193 CO 0.51 0.68 -0.26 -0.44 -1.00 0.00 0.00 179.01 178.50 1x0r h ASP 194 N 1.05 0.99 -0.70 1.42 3.32 -1.99 -0.98 116.42 119.54 1x0r h ASP 194 Ca 0.44 -0.40 -0.05 0.00 0.02 0.00 0.00 57.03 57.05 1x0r h ASP 194 Cb 0.29 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 1x0r h ASP 194 CO -0.21 1.19 0.26 1.56 -1.72 0.00 0.00 179.24 180.32 1x0r h GLN 195 N 0.82 1.08 -0.01 3.56 4.20 -1.74 -0.20 115.11 122.81 1x0r h GLN 195 Ca 0.10 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 1x0r h GLN 195 Cb 0.84 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.45 1x0r h GLN 195 CO 0.07 0.90 0.01 0.00 -0.67 0.00 0.00 178.83 179.14 1x0r h ALA 196 N 1.22 0.02 -0.28 3.87 0.00 -0.60 0.02 119.26 123.51 1x0r h ALA 196 Ca 0.24 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1x0r h ALA 196 Cb 0.24 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 1x0r h ALA 196 CO -0.01 -0.40 -0.08 -0.09 0.00 0.00 0.00 179.25 178.66 1x0r h ARG 197 N -0.13 -0.02 -0.90 0.00 9.65 -1.08 -2.94 114.38 118.96 1x0r h ARG 197 Ca 0.00 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1x0r h ARG 197 Cb 0.16 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.70 1x0r h ARG 197 CO -0.00 -0.01 0.55 0.00 2.80 0.00 0.00 179.97 183.30 1x0r h ALA 198 N 1.25 1.27 0.00 2.80 0.00 -0.71 0.92 119.26 124.79 1x0r h ALA 198 Ca 0.14 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1x0r h ALA 198 Cb 0.23 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1x0r h ALA 198 CO -0.30 0.63 0.00 -2.13 0.00 0.00 0.00 179.25 177.45 1x0r n ARG 199 N -4.36 0.00 0.00 0.00 0.00 -0.04 -0.50 116.66 111.75 1x0r n ARG 199 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.95 1x0r n ARG 199 Cb 0.06 -0.99 0.00 0.00 0.00 0.00 0.00 32.46 31.53 1x0r n ARG 199 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1x0r n GLU 201 N 0.00 0.00 0.24 -0.14 1.02 0.32 -3.10 120.64 118.99 1x0r n GLU 201 Ca 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.26 1x0r n GLU 201 Cb 0.00 0.00 0.74 0.00 -0.02 0.00 0.00 31.44 32.16 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 0.00 -3.05 1.62 4.64 -1.05 -3.45 113.55 112.25 1x0r h SER 202 Ca 0.00 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.07 1x0r h SER 202 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 1x0r h SER 202 CO 0.00 0.00 -0.29 0.61 -0.87 0.00 0.00 176.83 176.28 1x0r n GLY 203 N -1.47 0.04 0.03 -0.77 0.00 -1.18 -4.83 105.19 97.01 1x0r n GLY 203 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.14 1x0r n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x0r n GLN 204 N -2.48 0.21 -4.35 1.61 10.64 -1.26 -4.89 117.38 116.85 1x0r n GLN 204 Ca -0.14 -0.05 -0.20 0.00 -1.83 0.00 0.00 57.00 54.78 1x0r n GLN 204 Cb 0.54 -1.50 -0.10 0.00 -0.86 0.00 0.00 30.24 28.32 1x0r n GLN 204 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1x0r s TYR 205 N -2.83 1.80 0.66 2.61 1.51 -1.26 -5.07 117.35 114.77 1x0r s TYR 205 Ca 0.18 -0.51 -0.16 0.00 -1.01 0.00 0.00 57.07 55.57 1x0r s TYR 205 Cb 0.19 -0.85 0.00 0.00 -0.11 0.00 0.00 41.96 41.19 1x0r s TYR 205 CO 0.55 0.38 1.15 1.03 -1.11 0.00 0.00 175.55 177.55 1x0r s ARG 206 N -3.32 2.67 -0.15 -0.62 0.52 -1.09 -4.85 118.95 112.10 1x0r s ARG 206 Ca 0.21 1.58 -0.28 0.00 -0.52 0.00 0.00 55.73 56.71 1x0r s ARG 206 Cb -0.03 -1.92 0.08 0.00 0.52 0.00 0.00 34.95 33.61 1x0r s ARG 206 CO 0.07 -1.39 0.78 0.45 0.02 0.00 0.00 175.30 175.23 1x0r s SER 207 N -2.21 -0.62 -0.04 0.23 0.15 -1.26 -1.62 113.70 108.32 1x0r s SER 207 Ca 0.71 0.90 0.08 0.00 0.70 0.00 0.00 55.95 58.34 1x0r s SER 207 Cb -0.25 0.81 -0.12 0.00 -1.71 0.00 0.00 66.02 64.75 1x0r s SER 207 CO 0.40 -0.42 0.12 0.18 1.20 0.00 0.00 173.24 174.73 1x0r n LEU 208 N 1.54 0.00 -3.80 3.45 7.99 0.39 -5.01 117.00 121.56 1x0r n LEU 208 Ca -0.16 0.00 -0.05 0.00 -0.01 0.00 0.00 56.01 55.80 1x0r n LEU 208 Cb 0.56 0.08 -0.01 0.00 -0.11 0.00 0.00 43.42 43.95 1x0r n LEU 208 CO 0.14 0.08 0.67 -0.62 -1.51 0.00 0.00 177.39 176.15 1x0r s ASP 209 N -3.40 -0.14 0.60 -1.43 -1.08 -1.21 -4.93 116.67 105.08 1x0r s ASP 209 Ca -0.03 -0.57 0.35 0.00 -0.52 0.00 0.00 52.55 51.77 1x0r s ASP 209 Cb 0.04 0.58 1.90 0.00 -1.46 0.00 0.00 42.92 43.98 1x0r s ASP 209 CO 0.35 -1.09 2.22 4.11 0.52 0.00 0.00 175.17 181.28 1x0r h TRP 210 N 2.00 0.00 -0.49 -5.34 5.08 -1.97 -0.39 115.95 114.85 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 1.23 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.39 1x0r h TRP 210 CO 0.66 0.03 0.00 -2.67 -1.28 0.00 0.00 178.44 175.18 1x0r n TRP 211 N -3.44 0.64 -3.68 0.12 4.27 -1.26 -4.48 117.44 109.61 1x0r n TRP 211 Ca -0.02 -0.32 -0.28 0.00 -3.89 0.00 0.00 57.50 52.99 1x0r n TRP 211 Cb 0.14 -0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 29.98 1x0r n TRP 211 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 1x0r s PHE 212 N -1.34 2.45 0.18 -2.67 5.99 -0.15 -4.50 117.98 117.93 1x0r s PHE 212 Ca 0.41 -2.87 0.11 0.00 0.00 0.00 0.00 56.93 54.58 1x0r s PHE 212 Cb 0.23 -1.91 -0.04 0.00 0.00 0.00 0.00 43.02 41.30 1x0r s PHE 212 CO 0.32 -0.68 -0.21 0.00 -0.00 0.00 0.00 175.22 174.66 1x0r s TRP 214 N -1.55 -0.22 0.00 0.00 -2.14 -0.64 -1.21 118.94 113.18 1x0r s TRP 214 Ca 0.20 -0.20 0.00 0.00 2.66 0.00 0.00 56.10 58.77 1x0r s TRP 214 Cb -0.09 0.66 0.00 0.00 -3.10 0.00 0.00 33.47 30.94 1x0r s TRP 214 CO 0.10 -1.16 0.00 -0.40 -2.66 0.00 0.00 176.95 172.83 1x0r n ASP 215 N -0.44 0.00 -3.20 -2.66 3.85 -0.56 -2.68 116.55 110.85 1x0r n ASP 215 Ca -0.06 -0.39 -0.23 0.00 -0.71 0.00 0.00 54.79 53.40 1x0r n ASP 215 Cb 0.60 0.00 -0.06 0.00 -1.35 0.00 0.00 41.12 40.31 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 0.10 1.02 2.12 -2.24 -1.26 -0.69 114.28 113.34 1x0r n THR 216 Ca 0.00 -4.44 0.14 0.00 -2.27 0.00 0.00 64.05 57.48 1x0r n THR 216 Cb 0.00 -1.44 0.63 0.00 -2.10 0.00 0.00 70.33 67.42 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 0.89 0.03 -2.36 -0.78 -0.04 -1.26 -4.85 135.00 126.63 1x0r n PRO 217 Ca 0.24 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.30 1x0r n PRO 217 Cb 0.54 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 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 -2.97 3.44 0.51 0.55 0.00 -1.26 -4.99 121.76 117.04 1x0r s ALA 218 Ca 0.15 0.99 -0.20 0.00 0.00 0.00 0.00 51.96 52.90 1x0r s ALA 218 Cb 0.19 -3.40 -0.09 0.00 0.00 0.00 0.00 23.12 19.82 1x0r s ALA 218 CO 0.52 -0.35 0.75 0.45 0.00 0.00 0.00 175.76 177.14 1x0r n SER 219 N 1.77 -0.02 0.04 0.00 2.88 -1.26 -4.80 113.62 112.24 1x0r n SER 219 Ca 0.02 0.86 0.02 0.00 -1.33 0.00 0.00 58.87 58.43 1x0r n SER 219 Cb 0.44 -1.26 0.36 0.00 -0.75 0.00 0.00 64.21 63.00 1x0r n SER 219 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1x0r h ARG 220 N 0.71 0.43 -0.20 -1.46 2.43 -1.98 0.56 114.38 114.87 1x0r h ARG 220 Ca -0.45 -0.08 -0.20 0.00 -0.81 0.00 0.00 59.98 58.44 1x0r h ARG 220 Cb 1.38 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 1x0r h ARG 220 CO 0.51 0.44 -0.67 -0.44 -1.51 0.00 0.00 179.97 178.30 1x0r h ASP 221 N 0.42 0.89 -0.60 -3.80 3.32 -1.99 0.35 116.42 115.01 1x0r h ASP 221 Ca 0.10 -0.54 -0.07 0.00 0.02 0.00 0.00 57.03 56.54 1x0r h ASP 221 Cb 0.25 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1x0r h ASP 221 CO 0.00 1.33 0.10 0.44 -1.72 0.00 0.00 179.24 179.39 1x0r h ASP 222 N 0.56 0.95 -0.28 6.45 3.32 -1.74 -1.31 116.42 124.37 1x0r h ASP 222 Ca -0.02 -0.26 -0.17 0.00 0.02 0.00 0.00 57.03 56.61 1x0r h ASP 222 Cb 1.28 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.57 1x0r h ASP 222 CO 0.14 0.97 -0.45 0.58 -1.72 0.00 0.00 179.24 178.76 1x0r h VAL 223 N 0.90 1.28 -0.14 -1.35 2.07 -0.77 -1.87 116.25 116.36 1x0r h VAL 223 Ca 0.18 -1.63 -0.09 0.00 0.82 0.00 0.00 66.70 65.98 1x0r h VAL 223 Cb 0.42 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1x0r h VAL 223 CO 0.01 0.54 -0.30 -0.08 0.02 0.00 0.00 177.57 177.76 1x0r h GLU 224 N 0.68 0.27 -0.33 1.57 4.22 -0.72 -0.34 114.58 119.93 1x0r h GLU 224 Ca 0.04 -0.10 -0.04 0.00 0.08 0.00 0.00 59.36 59.34 1x0r h GLU 224 Cb 1.04 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1x0r h GLU 224 CO 0.10 0.55 0.03 1.49 -2.18 0.00 0.00 179.01 179.00 1x0r h GLU 225 N 0.24 0.56 -0.74 1.92 4.81 -0.91 0.24 114.58 120.70 1x0r h GLU 225 Ca 0.03 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 1x0r h GLU 225 Cb 0.65 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.94 1x0r h GLU 225 CO 0.05 0.66 0.38 0.00 -0.73 0.00 0.00 179.01 179.37 1x0r h ALA 226 N 0.87 1.28 0.00 2.92 0.00 -0.88 -0.58 119.26 122.88 1x0r h ALA 226 Ca 0.10 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1x0r h ALA 226 Cb 0.39 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1x0r h ALA 226 CO 0.01 0.57 -0.25 -0.09 0.00 0.00 0.00 179.25 179.49 1x0r h ARG 227 N 1.04 0.00 -0.25 0.00 2.43 -0.76 -2.68 114.38 114.16 1x0r h ARG 227 Ca 0.26 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.31 1x0r h ARG 227 Cb 0.07 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1x0r h ARG 227 CO -0.04 0.25 -0.34 0.00 -1.51 0.00 0.00 179.97 178.33 1x0r h ARG 228 N 0.00 0.54 -0.47 0.20 3.08 0.66 -0.73 114.38 117.66 1x0r h ARG 228 Ca -0.00 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.79 1x0r h ARG 228 Cb 0.73 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.75 1x0r h ARG 228 CO 0.03 0.81 0.27 1.88 -1.07 0.00 0.00 179.97 181.90 1x0r h TYR 229 N 0.46 0.64 -0.38 3.04 0.99 -1.10 0.30 116.97 120.92 1x0r h TYR 229 Ca 0.05 -0.01 -0.08 0.00 2.00 0.00 0.00 58.73 60.69 1x0r h TYR 229 Cb 0.82 -0.21 -0.01 0.00 1.00 0.00 0.00 36.73 38.33 1x0r h TYR 229 CO 0.03 0.46 -0.08 -0.07 -0.00 0.00 0.00 178.16 178.51 1x0r h LEU 230 N 0.62 0.72 -0.84 3.88 3.38 -1.37 -1.72 115.31 119.98 1x0r h LEU 230 Ca 0.17 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 1x0r h LEU 230 Cb 0.03 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 1x0r h LEU 230 CO -0.03 0.91 0.39 0.03 0.09 0.00 0.00 178.44 179.82 1x0r h ARG 231 N 0.52 1.23 -0.48 1.13 3.08 -0.85 -0.55 114.38 118.46 1x0r h ARG 231 Ca 0.10 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 59.90 1x0r h ARG 231 Cb 0.58 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 1x0r h ARG 231 CO 0.03 0.95 0.09 -0.09 -1.07 0.00 0.00 179.97 179.89 1x0r h ARG 232 N 1.21 0.78 -0.83 0.04 2.43 -0.24 -1.09 114.38 116.68 1x0r h ARG 232 Ca 0.29 -0.20 0.07 0.00 -0.81 0.00 0.00 59.98 59.33 1x0r h ARG 232 Cb 0.15 -0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 29.54 1x0r h ARG 232 CO -0.03 0.78 0.50 0.00 -1.51 0.00 0.00 179.97 179.71 1x0r h ALA 233 N 0.97 1.16 0.00 2.80 0.00 -0.79 -2.60 119.26 120.79 1x0r h ALA 233 Ca 0.15 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1x0r h ALA 233 Cb 0.37 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1x0r h ALA 233 CO 0.01 0.19 -0.45 0.00 0.00 0.00 0.00 179.25 179.00 1x0r h ALA 234 N 1.42 0.88 -2.33 0.00 0.00 -0.88 -3.45 119.26 114.90 1x0r h ALA 234 Ca 0.38 -0.41 -0.55 0.00 0.00 0.00 0.00 54.91 54.33 1x0r h ALA 234 Cb 0.25 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1x0r h ALA 234 CO -0.20 0.56 0.55 -2.00 0.00 0.00 0.00 179.25 178.16 1x0r s GLU 235 N -3.40 4.44 0.18 0.00 2.12 -0.43 -5.03 118.70 116.58 1x0r s GLU 235 Ca 0.01 1.49 -0.30 0.00 0.36 0.00 0.00 54.97 56.53 1x0r s GLU 235 Cb 0.10 -3.51 -0.09 0.00 0.26 0.00 0.00 34.13 30.90 1x0r s GLU 235 CO 0.71 -0.28 1.31 0.21 -0.54 0.00 0.00 175.26 176.68 1x0r s LYS 236 N 1.73 4.38 0.30 4.30 2.20 -1.26 -4.96 119.74 126.43 1x0r s LYS 236 Ca 0.52 2.04 -0.30 0.00 -0.36 0.00 0.00 55.97 57.87 1x0r s LYS 236 Cb -0.21 -3.21 -0.11 0.00 -1.51 0.00 0.00 37.83 32.79 1x0r s LYS 236 CO 0.22 -0.27 1.58 -2.14 -0.36 0.00 0.00 175.35 174.38 1x0r s PRO 237 N 0.08 4.12 0.15 4.03 0.02 -1.26 -4.91 135.00 137.23 1x0r s PRO 237 Ca 0.58 2.58 -0.17 0.00 0.02 0.00 0.00 61.00 64.01 1x0r s PRO 237 Cb -0.36 -3.02 0.05 0.00 0.02 0.00 0.00 34.50 31.19 1x0r s PRO 237 CO 0.37 -0.62 1.72 0.00 -0.33 0.00 0.00 177.00 178.14 1x0r h ALA 238 N 4.63 0.32 -3.51 -1.55 0.00 -2.04 -3.42 119.26 113.69 1x0r h ALA 238 Ca -0.47 0.07 -0.30 0.00 0.00 0.00 0.00 54.91 54.20 1x0r h ALA 238 Cb 1.22 0.10 -0.24 0.00 0.00 0.00 0.00 17.79 18.87 1x0r h ALA 238 CO 0.78 -0.36 -0.75 -1.59 0.00 0.00 0.00 179.25 177.33 1x0r s LYS 239 N -6.18 0.51 0.32 0.00 -2.85 -1.26 -5.13 119.74 105.14 1x0r s LYS 239 Ca -0.13 -0.51 -0.20 0.00 -1.00 0.00 0.00 55.97 54.12 1x0r s LYS 239 Cb 0.12 -0.38 -0.09 0.00 -2.06 0.00 0.00 37.83 35.42 1x0r s LYS 239 CO 0.70 0.09 0.83 -0.51 0.10 0.00 0.00 175.35 176.56 1x0r s LEU 240 N -0.93 4.19 0.48 2.77 1.43 -1.26 -4.98 118.68 120.37 1x0r s LEU 240 Ca -0.04 1.55 0.27 0.00 -1.03 0.00 0.00 54.13 54.88 1x0r s LEU 240 Cb -0.06 -4.01 0.94 0.00 0.03 0.00 0.00 46.19 43.09 1x0r s LEU 240 CO 0.00 -0.13 1.83 -0.07 0.23 0.00 0.00 176.35 178.21 1x0r h LEU 241 N 2.76 0.00 -1.65 1.79 3.38 -2.00 -2.58 115.31 117.00 1x0r h LEU 241 Ca -0.48 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 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 0.64 0.11 -0.13 0.22 0.09 0.00 0.00 178.44 179.37 1x0r h TYR 242 N 0.00 0.05 -0.43 1.13 3.20 -1.94 -2.94 116.97 116.05 1x0r h TYR 242 Ca -0.00 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1x0r h TYR 242 Cb 0.74 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.97 1x0r h TYR 242 CO 0.00 0.19 0.26 0.93 -1.64 0.00 0.00 178.16 177.89 1x0r h GLU 243 N 0.05 0.58 0.11 1.82 5.08 -1.86 -3.27 114.58 117.10 1x0r h GLU 243 Ca 0.01 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1x0r h GLU 243 Cb 0.27 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1x0r h GLU 243 CO 0.02 0.43 -0.05 0.93 -1.00 0.00 0.00 179.01 179.33 1x0r h GLU 244 N 0.56 -0.15 0.00 2.33 5.08 -1.70 -3.52 114.58 117.18 1x0r h GLU 244 Ca 0.15 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1x0r h GLU 244 Cb 0.00 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1x0r h GLU 244 CO -0.03 -0.10 0.00 0.00 -1.00 0.00 0.00 179.01 177.88