#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hfs s LYS 3 N 0.00 3.07 -0.05 1.43 3.01 -1.26 -4.47 119.74 121.47 2hfs s LYS 3 Ca 0.00 -0.50 -0.30 0.00 -1.01 0.00 0.00 55.97 54.16 2hfs s LYS 3 Cb 0.00 -2.86 -0.05 0.00 -1.01 0.00 0.00 37.83 33.92 2hfs s LYS 3 CO 0.00 0.64 1.44 -2.14 0.51 0.00 0.00 175.35 175.80 2hfs s PRO 4 N -1.81 4.25 -0.19 -1.68 0.02 -1.26 -4.74 135.00 129.58 2hfs s PRO 4 Ca 0.24 1.96 -0.17 0.00 0.02 0.00 0.00 61.00 63.04 2hfs s PRO 4 Cb -0.12 -3.71 -0.21 0.00 0.02 0.00 0.00 34.50 30.48 2hfs s PRO 4 CO 0.15 -0.67 0.24 0.28 -0.33 0.00 0.00 177.00 176.67 2hfs n VAL 5 N 5.01 1.60 -3.66 3.83 0.31 -0.71 -4.92 118.33 119.79 2hfs n VAL 5 Ca 0.14 -0.21 -0.27 0.00 -0.01 0.00 0.00 64.34 63.99 2hfs n VAL 5 Cb 0.44 -1.95 -0.03 0.00 -0.91 0.00 0.00 33.84 31.38 2hfs n VAL 5 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2hfs s LYS 6 N -2.42 3.52 0.03 5.55 1.02 -0.44 -5.03 119.74 121.98 2hfs s LYS 6 Ca -0.27 -0.33 0.02 0.00 0.02 0.00 0.00 55.97 55.41 2hfs s LYS 6 Cb 0.06 -2.81 -0.25 0.00 -0.52 0.00 0.00 37.83 34.31 2hfs s LYS 6 CO 0.64 0.37 0.95 0.66 -0.92 0.00 0.00 175.35 177.05 2hfs h SER 7 N 1.88 0.22 -3.57 2.83 4.64 -1.91 -3.45 113.55 114.19 2hfs h SER 7 Ca -0.48 -0.30 -0.12 0.00 -0.47 0.00 0.00 61.79 60.42 2hfs h SER 7 Cb 1.19 -0.07 -0.25 0.00 -0.31 0.00 0.00 62.40 62.96 2hfs h SER 7 CO 0.67 1.25 -0.27 -0.75 -0.87 0.00 0.00 176.83 176.86 2hfs s LYS 8 N -2.64 0.43 0.43 4.77 2.20 -1.26 -1.02 119.74 122.66 2hfs s LYS 8 Ca -0.05 0.67 -0.24 0.00 -0.36 0.00 0.00 55.97 55.99 2hfs s LYS 8 Cb 0.08 0.11 -0.08 0.00 -1.51 0.00 0.00 37.83 36.43 2hfs s LYS 8 CO 0.84 -0.11 1.18 0.95 -0.36 0.00 0.00 175.35 177.85 2hfs s THR 9 N 0.78 3.08 0.00 3.43 -4.23 -0.22 -4.93 115.64 113.55 2hfs s THR 9 Ca -0.05 0.86 0.00 0.00 -1.18 0.00 0.00 61.69 61.32 2hfs s THR 9 Cb -0.06 -3.46 0.00 0.00 1.34 0.00 0.00 72.50 70.32 2hfs s THR 9 CO -0.06 0.04 0.01 0.35 -0.54 0.00 0.00 174.62 174.42 2hfs n THR 10 N -0.21 0.00 -0.60 3.99 -2.24 -1.26 -4.83 114.28 109.12 2hfs n THR 10 Ca 0.06 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 2hfs n THR 10 Cb 0.47 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.70 2hfs n THR 10 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hfs n GLY 11 N 0.74 -1.35 2.91 3.38 0.00 -1.26 -5.04 105.19 104.56 2hfs n GLY 11 Ca 0.00 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.12 2hfs n GLY 11 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2hfs s LYS 12 N -2.08 1.88 -0.41 1.61 2.47 -1.26 -5.08 119.74 116.88 2hfs s LYS 12 Ca 0.00 -2.55 -0.16 0.00 -1.56 0.00 0.00 55.97 51.70 2hfs s LYS 12 Cb 0.00 -3.17 0.02 0.00 -1.46 0.00 0.00 37.83 33.22 2hfs s LYS 12 CO 0.00 -1.12 0.37 -0.80 0.16 0.00 0.00 175.35 173.95 2hfs s ASN 13 N -0.23 6.15 0.06 1.43 0.01 -1.26 -5.04 114.94 116.07 2hfs s ASN 13 Ca 0.17 -0.72 0.01 0.00 -0.71 0.00 0.00 52.86 51.61 2hfs s ASN 13 Cb -0.25 -2.19 -0.04 0.00 0.41 0.00 0.00 41.25 39.18 2hfs s ASN 13 CO -0.01 -0.49 -0.05 0.27 -1.51 0.00 0.00 177.10 175.31 2hfs s ILE 14 N 1.93 0.43 -0.04 0.60 -4.36 -1.26 -1.77 121.20 116.73 2hfs s ILE 14 Ca 0.09 -1.65 0.05 0.00 -0.26 0.00 0.00 60.65 58.88 2hfs s ILE 14 Cb -0.18 -1.31 -0.01 0.00 1.25 0.00 0.00 42.46 42.21 2hfs s ILE 14 CO 0.12 -0.81 -0.20 -0.83 0.24 0.00 0.00 174.94 173.46 2hfs s GLY 15 N -2.61 1.03 0.42 6.27 0.00 -0.15 -4.21 107.32 108.07 2hfs s GLY 15 Ca 0.04 -0.83 -0.17 0.00 0.00 0.00 0.00 44.72 43.77 2hfs s GLY 15 CO -0.06 -0.53 0.88 -0.19 0.00 0.00 0.00 173.10 173.20 2hfs s TYR 16 N -0.16 3.39 1.12 1.90 2.02 -0.56 -0.68 117.35 124.38 2hfs s TYR 16 Ca -0.00 1.39 -0.16 0.00 -0.37 0.00 0.00 57.07 57.92 2hfs s TYR 16 Cb -0.11 -2.69 0.25 0.00 -0.40 0.00 0.00 41.96 39.00 2hfs s TYR 16 CO 0.02 -0.13 1.11 0.20 -1.57 0.00 0.00 175.55 175.18 2hfs s GLY 17 N -2.59 1.58 -0.06 0.71 0.00 -0.81 -4.01 107.32 102.13 2hfs s GLY 17 Ca 0.58 -0.74 -0.03 0.00 0.00 0.00 0.00 44.72 44.53 2hfs s GLY 17 CO 0.22 0.04 0.14 1.25 0.00 0.00 0.00 173.10 174.74 2hfs s LYS 18 N -5.25 0.07 -0.04 2.90 2.36 -0.15 -1.09 119.74 118.55 2hfs s LYS 18 Ca 0.69 0.37 0.04 0.00 -2.55 0.00 0.00 55.97 54.51 2hfs s LYS 18 Cb -0.13 -0.20 -0.00 0.00 -1.05 0.00 0.00 37.83 36.45 2hfs s LYS 18 CO 0.56 -0.18 -0.15 0.14 1.55 0.00 0.00 175.35 177.28 2hfs s VAL 19 N 1.24 1.27 -0.39 4.02 -7.23 0.96 -4.16 120.40 116.10 2hfs s VAL 19 Ca -0.08 -0.63 -0.26 0.00 -1.81 0.00 0.00 61.98 59.20 2hfs s VAL 19 Cb -0.12 -1.10 0.02 0.00 0.56 0.00 0.00 36.38 35.74 2hfs s VAL 19 CO -0.06 0.37 0.91 -0.63 -0.31 0.00 0.00 175.10 175.39 2hfs s ILE 20 N 0.07 4.57 -0.09 -0.62 1.01 -1.26 0.62 121.20 125.49 2hfs s ILE 20 Ca -0.03 1.06 -0.25 0.00 0.00 0.00 0.00 60.65 61.43 2hfs s ILE 20 Cb -0.11 -4.35 -0.29 0.00 0.01 0.00 0.00 42.46 37.73 2hfs s ILE 20 CO 0.02 -0.61 0.82 -0.07 0.00 0.00 0.00 174.94 175.10 2hfs h LEU 21 N 10.17 0.26 -7.83 2.97 3.38 -1.38 -3.42 115.31 119.46 2hfs h LEU 21 Ca -0.24 -0.96 -0.35 0.00 0.09 0.00 0.00 57.88 56.42 2hfs h LEU 21 Cb 1.08 -0.09 -0.31 0.00 0.09 0.00 0.00 40.66 41.44 2hfs h LEU 21 CO 0.99 1.23 -0.76 -0.36 0.09 0.00 0.00 178.44 179.63 2hfs s PHE 22 N -2.34 0.53 0.00 1.13 0.08 -0.83 -4.98 117.98 111.57 2hfs s PHE 22 Ca -0.16 -0.11 0.00 0.00 0.12 0.00 0.00 56.93 56.78 2hfs s PHE 22 Cb -0.01 -0.42 0.00 0.00 -0.57 0.00 0.00 43.02 42.03 2hfs s PHE 22 CO 0.77 -0.07 0.00 0.41 -0.10 0.00 0.00 175.22 176.23 2hfs n GLY 23 N 3.37 1.07 3.59 4.36 0.00 -1.26 -1.28 105.19 115.05 2hfs n GLY 23 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 2hfs n GLY 23 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2hfs n GLU 24 N -1.77 1.27 0.00 1.61 0.00 -1.26 -1.54 120.64 118.96 2hfs n GLU 24 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 57.16 57.61 2hfs n GLU 24 Cb 0.00 -1.92 0.00 0.00 0.00 0.00 0.00 31.44 29.52 2hfs n GLU 24 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2hfs n HIS 25 N -0.30 0.00 0.15 -1.84 8.25 -1.26 -4.50 115.22 115.72 2hfs n HIS 25 Ca 0.10 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.63 2hfs n HIS 25 Cb 0.37 0.00 0.57 0.00 1.12 0.00 0.00 29.99 32.05 2hfs n HIS 25 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 2hfs h PHE 26 N 0.00 0.19 -0.49 4.41 -1.00 -1.94 -2.70 116.94 115.42 2hfs h PHE 26 Ca 0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 2hfs h PHE 26 Cb 0.00 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.47 2hfs h PHE 26 CO 0.00 0.11 0.22 -0.24 -1.61 0.00 0.00 178.31 176.79 2hfs h VAL 27 N 0.20 1.17 -0.93 -0.55 3.04 -1.43 -0.98 116.25 116.76 2hfs h VAL 27 Ca 0.07 -0.51 0.20 0.00 -1.01 0.00 0.00 66.70 65.45 2hfs h VAL 27 Cb 0.04 0.57 -0.08 0.00 -2.01 0.00 0.00 31.29 29.81 2hfs h VAL 27 CO -0.01 0.20 0.60 0.58 -1.01 0.00 0.00 177.57 177.94 2hfs h VAL 28 N 0.69 0.70 -0.36 1.51 2.07 -1.76 -2.54 116.25 116.54 2hfs h VAL 28 Ca 0.17 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2hfs h VAL 28 Cb 0.10 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 2hfs h VAL 28 CO -0.02 0.09 0.00 1.41 0.02 0.00 0.00 177.57 179.07 2hfs n HIS 29 N -4.57 0.47 0.00 1.57 8.25 -0.40 -4.90 115.22 115.63 2hfs n HIS 29 Ca 0.20 -0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 2hfs n HIS 29 Cb 0.65 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.76 2hfs n HIS 29 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hfs n GLY 30 N 1.45 0.94 3.87 -1.41 0.00 -0.96 -5.11 105.19 103.98 2hfs n GLY 30 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 2hfs n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hfs s ALA 31 N -2.00 3.17 0.28 4.61 0.00 -1.05 -4.58 121.76 122.18 2hfs s ALA 31 Ca 0.00 -0.10 -0.22 0.00 0.00 0.00 0.00 51.96 51.64 2hfs s ALA 31 Cb 0.00 -2.97 -0.09 0.00 0.00 0.00 0.00 23.12 20.06 2hfs s ALA 31 CO 0.00 -0.46 0.82 -1.21 0.00 0.00 0.00 175.76 174.91 2hfs s GLU 32 N -4.71 4.36 0.11 0.00 2.02 -1.26 -4.12 118.70 115.10 2hfs s GLU 32 Ca 0.54 1.05 0.07 0.00 0.02 0.00 0.00 54.97 56.65 2hfs s GLU 32 Cb -0.11 -2.79 -0.04 0.00 0.10 0.00 0.00 34.13 31.30 2hfs s GLU 32 CO 0.45 0.32 -0.17 0.00 0.02 0.00 0.00 175.26 175.87 2hfs s ALA 33 N -1.61 1.63 -0.26 5.21 0.00 0.17 -4.66 121.76 122.24 2hfs s ALA 33 Ca 0.47 -1.24 -0.02 0.00 0.00 0.00 0.00 51.96 51.17 2hfs s ALA 33 Cb -0.17 -0.16 0.03 0.00 0.00 0.00 0.00 23.12 22.82 2hfs s ALA 33 CO 0.21 0.24 -0.04 0.42 0.00 0.00 0.00 175.76 176.59 2hfs s ILE 34 N -1.55 2.93 -0.07 0.00 1.01 -0.40 -0.29 121.20 122.83 2hfs s ILE 34 Ca 0.07 -1.08 -0.01 0.00 0.00 0.00 0.00 60.65 59.62 2hfs s ILE 34 Cb -0.08 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 39.82 2hfs s ILE 34 CO 0.04 0.14 0.01 -0.69 0.00 0.00 0.00 174.94 174.43 2hfs s VAL 35 N 1.32 4.32 -0.20 2.92 1.01 -0.48 -0.93 120.40 128.37 2hfs s VAL 35 Ca -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 2hfs s VAL 35 Cb -0.17 -2.84 -0.00 0.00 0.00 0.00 0.00 36.38 33.37 2hfs s VAL 35 CO -0.04 0.57 -0.09 0.00 0.00 0.00 0.00 175.10 175.55 2hfs s ALA 36 N -0.92 2.70 -0.33 5.51 0.00 0.20 -0.31 121.76 128.61 2hfs s ALA 36 Ca 0.14 -1.12 -0.24 0.00 0.00 0.00 0.00 51.96 50.74 2hfs s ALA 36 Cb -0.11 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.49 2hfs s ALA 36 CO 0.04 -0.29 0.81 0.20 0.00 0.00 0.00 175.76 176.52 2hfs s GLY 37 N 1.24 1.68 0.57 0.00 0.00 0.12 -0.03 107.32 110.89 2hfs s GLY 37 Ca 0.03 -0.46 -0.08 0.00 0.00 0.00 0.00 44.72 44.21 2hfs s GLY 37 CO -0.03 1.80 0.91 -0.26 0.00 0.00 0.00 173.10 175.51 2hfs s ILE 38 N 3.07 4.44 0.27 0.90 -4.36 -0.25 -1.77 121.20 123.49 2hfs s ILE 38 Ca 0.33 0.37 0.01 0.00 -0.26 0.00 0.00 60.65 61.10 2hfs s ILE 38 Cb -0.14 -3.74 0.07 0.00 1.25 0.00 0.00 42.46 39.91 2hfs s ILE 38 CO 0.14 -0.83 1.72 0.28 0.24 0.00 0.00 174.94 176.49 2hfs h SER 39 N -0.10 0.57 -3.44 4.36 0.02 -1.19 -3.34 113.55 110.43 2hfs h SER 39 Ca -0.46 -0.18 -0.53 0.00 -0.84 0.00 0.00 61.79 59.78 2hfs h SER 39 Cb 1.22 -0.15 0.07 0.00 0.14 0.00 0.00 62.40 63.67 2hfs h SER 39 CO 0.62 0.78 0.79 -1.61 -1.14 0.00 0.00 176.83 176.27 2hfs s GLU 40 N -4.59 4.22 0.11 3.45 8.01 -1.26 -4.86 118.70 123.78 2hfs s GLU 40 Ca -0.08 2.40 -0.01 0.00 0.01 0.00 0.00 54.97 57.29 2hfs s GLU 40 Cb 0.14 -3.07 -0.04 0.00 -4.31 0.00 0.00 34.13 26.85 2hfs s GLU 40 CO 0.80 -0.48 0.02 1.52 0.01 0.00 0.00 175.26 177.14 2hfs s TYR 41 N -0.16 0.81 -0.10 1.61 -0.85 -1.26 -1.93 117.35 115.48 2hfs s TYR 41 Ca 0.59 -1.16 -0.06 0.00 -0.52 0.00 0.00 57.07 55.92 2hfs s TYR 41 Cb -0.44 -0.48 -0.04 0.00 0.38 0.00 0.00 41.96 41.38 2hfs s TYR 41 CO 0.47 -0.44 0.15 0.99 -1.52 0.00 0.00 175.55 175.20 2hfs s THR 42 N -3.96 5.49 -0.02 -3.49 2.01 0.15 -1.30 115.64 114.52 2hfs s THR 42 Ca 0.19 0.13 0.06 0.00 0.31 0.00 0.00 61.69 62.38 2hfs s THR 42 Cb 0.07 -3.43 -0.03 0.00 0.01 0.00 0.00 72.50 69.13 2hfs s THR 42 CO -0.01 0.56 -0.20 -0.70 -0.69 0.00 0.00 174.62 173.57 2hfs s GLU 43 N -1.23 2.24 -0.08 4.92 2.12 -0.74 -0.97 118.70 124.96 2hfs s GLU 43 Ca 0.18 -0.85 0.04 0.00 0.36 0.00 0.00 54.97 54.70 2hfs s GLU 43 Cb -0.12 -2.20 -0.00 0.00 0.26 0.00 0.00 34.13 32.07 2hfs s GLU 43 CO 0.07 0.58 -0.23 0.00 -0.54 0.00 0.00 175.26 175.14 2hfs s ARG 45 N 0.21 2.16 0.10 0.00 0.52 -0.17 -4.39 118.95 117.37 2hfs s ARG 45 Ca -0.13 -0.78 0.09 0.00 -0.52 0.00 0.00 55.73 54.38 2hfs s ARG 45 Cb -0.16 -1.88 -0.03 0.00 0.52 0.00 0.00 34.95 33.40 2hfs s ARG 45 CO 0.07 0.35 -0.22 -0.51 0.02 0.00 0.00 175.30 175.00 2hfs s LEU 46 N -0.15 2.27 -0.02 2.53 1.43 -1.26 -0.71 118.68 122.78 2hfs s LEU 46 Ca -0.02 -0.67 -0.09 0.00 -1.03 0.00 0.00 54.13 52.33 2hfs s LEU 46 Cb -0.12 -0.99 0.01 0.00 0.03 0.00 0.00 46.19 45.11 2hfs s LEU 46 CO 0.02 0.11 0.19 -1.83 0.23 0.00 0.00 176.35 175.07 2hfs s GLU 47 N -1.78 0.47 0.58 1.70 -1.05 -0.50 -1.06 118.70 117.06 2hfs s GLU 47 Ca 0.09 -0.21 -0.20 0.00 -0.15 0.00 0.00 54.97 54.49 2hfs s GLU 47 Cb -0.10 0.20 -0.04 0.00 -0.44 0.00 0.00 34.13 33.76 2hfs s GLU 47 CO 0.04 -0.11 1.27 0.96 0.95 0.00 0.00 175.26 178.37 2hfs s ILE 48 N -1.06 2.34 -0.55 1.83 -4.36 -0.19 -0.23 121.20 118.98 2hfs s ILE 48 Ca -0.11 0.23 0.05 0.00 -0.26 0.00 0.00 60.65 60.56 2hfs s ILE 48 Cb -0.06 -3.10 0.19 0.00 1.25 0.00 0.00 42.46 40.73 2hfs s ILE 48 CO 0.02 -0.03 0.47 -3.20 0.24 0.00 0.00 174.94 172.44 2hfs n ASN 49 N -1.37 1.47 -4.75 4.36 4.05 0.15 -4.66 115.26 114.50 2hfs n ASN 49 Ca 0.12 -2.87 -0.41 0.00 0.45 0.00 0.00 54.58 51.88 2hfs n ASN 49 Cb 0.48 -0.66 -0.02 0.00 1.23 0.00 0.00 39.78 40.81 2hfs n ASN 49 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 177.26 171.37 2hfs s PRO 50 N -0.98 4.21 0.00 1.20 0.02 -1.26 -1.54 135.00 136.65 2hfs s PRO 50 Ca 0.31 2.41 0.00 0.00 0.02 0.00 0.00 61.00 63.74 2hfs s PRO 50 Cb 0.03 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.49 2hfs s PRO 50 CO -0.16 -0.48 0.00 0.41 -0.33 0.00 0.00 177.00 176.45 2hfs n GLY 51 N 1.88 1.09 2.88 0.52 0.00 -1.26 -4.91 105.19 105.39 2hfs n GLY 51 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 2hfs n GLY 51 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hfs s VAL 52 N -3.56 1.56 0.70 1.61 1.01 -0.98 -4.96 120.40 115.77 2hfs s VAL 52 Ca 0.00 -1.77 -0.13 0.00 0.00 0.00 0.00 61.98 60.07 2hfs s VAL 52 Cb 0.00 -2.12 0.02 0.00 0.00 0.00 0.00 36.38 34.28 2hfs s VAL 52 CO 0.00 -0.56 1.10 -2.84 0.00 0.00 0.00 175.10 172.80 2hfs s PRO 53 N 1.28 2.63 1.46 2.72 0.02 -0.86 -0.28 135.00 141.97 2hfs s PRO 53 Ca 0.08 1.30 0.00 0.00 0.02 0.00 0.00 61.00 62.40 2hfs s PRO 53 Cb -0.18 -1.94 0.00 0.00 0.02 0.00 0.00 34.50 32.40 2hfs s PRO 53 CO -0.15 -1.37 0.00 0.41 -0.33 0.00 0.00 177.00 175.56 2hfs n GLY 54 N -0.80 -1.70 3.19 0.52 0.00 0.12 -4.75 105.19 101.77 2hfs n GLY 54 Ca 0.10 -1.33 -0.35 0.00 0.00 0.00 0.00 46.02 44.44 2hfs n GLY 54 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2hfs s LEU 55 N 0.00 3.57 -0.28 0.99 0.20 -1.26 -1.97 118.68 119.93 2hfs s LEU 55 Ca 0.00 -1.07 -0.19 0.00 0.69 0.00 0.00 54.13 53.56 2hfs s LEU 55 Cb 0.00 -1.70 -0.02 0.00 -0.43 0.00 0.00 46.19 44.05 2hfs s LEU 55 CO 0.00 -0.20 0.58 -1.10 -0.29 0.00 0.00 176.35 175.34 2hfs s GLN 56 N 1.29 3.99 -0.21 1.98 -1.52 -0.07 -5.00 119.66 120.13 2hfs s GLN 56 Ca -0.03 0.33 -0.08 0.00 -1.95 0.00 0.00 55.36 53.64 2hfs s GLN 56 Cb -0.18 -3.69 -0.04 0.00 -0.22 0.00 0.00 33.01 28.88 2hfs s GLN 56 CO -0.02 -0.46 0.08 0.08 -0.25 0.00 0.00 175.29 174.72 2hfs s VAL 57 N 2.46 4.78 -0.60 1.09 1.01 -1.26 -4.40 120.40 123.48 2hfs s VAL 57 Ca 0.23 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.23 2hfs s VAL 57 Cb -0.15 -3.19 0.15 0.00 0.00 0.00 0.00 36.38 33.19 2hfs s VAL 57 CO 0.10 0.41 0.37 -0.62 0.00 0.00 0.00 175.10 175.36 2hfs s ASP 58 N 0.78 4.46 -0.56 3.32 2.15 -1.26 -5.05 116.67 120.51 2hfs s ASP 58 Ca 0.04 -3.39 -0.23 0.00 0.43 0.00 0.00 52.55 49.40 2hfs s ASP 58 Cb -0.13 -1.58 0.05 0.00 -0.30 0.00 0.00 42.92 40.95 2hfs s ASP 58 CO 0.02 -0.16 0.87 -0.62 -0.17 0.00 0.00 175.17 175.11 2hfs s ASP 59 N -0.80 6.29 -0.08 -0.34 -1.08 -1.26 -1.88 116.67 117.51 2hfs s ASP 59 Ca 0.21 -0.59 0.12 0.00 -0.52 0.00 0.00 52.55 51.77 2hfs s ASP 59 Cb -0.15 -2.40 0.28 0.00 -1.46 0.00 0.00 42.92 39.19 2hfs s ASP 59 CO -0.08 -1.18 1.21 0.00 0.52 0.00 0.00 175.17 175.64 2hfs n GLN 60 N 7.19 2.52 -1.68 4.34 6.02 0.13 -4.96 117.38 130.94 2hfs n GLN 60 Ca -0.01 -2.26 -0.41 0.00 -0.01 0.00 0.00 57.00 54.31 2hfs n GLN 60 Cb 0.47 -1.41 0.01 0.00 1.02 0.00 0.00 30.24 30.33 2hfs n GLN 60 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2hfs n ARG 61 N -0.50 1.78 -0.83 -1.09 1.74 -0.99 -4.77 116.66 112.00 2hfs n ARG 61 Ca 0.12 0.63 -0.17 0.00 -0.77 0.00 0.00 57.85 57.66 2hfs n ARG 61 Cb 0.56 -2.30 -0.08 0.00 -1.02 0.00 0.00 32.46 29.61 2hfs n ARG 61 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2hfs n PRO 62 N 0.03 2.00 -1.74 5.56 -0.04 -1.26 -4.95 135.00 134.60 2hfs n PRO 62 Ca 0.07 -1.17 -0.34 0.00 -0.04 0.00 0.00 63.50 62.03 2hfs n PRO 62 Cb 0.40 -2.18 0.05 0.00 -0.04 0.00 0.00 33.50 31.73 2hfs n PRO 62 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hfs s ALA 63 N 2.14 2.42 0.74 0.55 0.00 -1.26 -4.37 121.76 121.97 2hfs s ALA 63 Ca 0.50 0.66 -0.15 0.00 0.00 0.00 0.00 51.96 52.96 2hfs s ALA 63 Cb 0.19 -3.36 0.04 0.00 0.00 0.00 0.00 23.12 19.99 2hfs s ALA 63 CO -0.02 -1.35 1.23 0.44 0.00 0.00 0.00 175.76 176.06 2hfs n ILE 64 N -2.35 3.28 -1.66 0.00 -5.35 -0.96 -4.85 119.36 107.47 2hfs n ILE 64 Ca 0.11 -0.33 -0.47 0.00 -0.27 0.00 0.00 62.75 61.79 2hfs n ILE 64 Cb 0.51 -1.31 -0.04 0.00 -1.74 0.00 0.00 39.64 37.06 2hfs n ILE 64 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 2hfs n PRO 65 N -2.64 2.02 0.00 6.28 -0.02 -1.26 -2.09 135.00 137.29 2hfs n PRO 65 Ca 0.15 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 2hfs n PRO 65 Cb 0.49 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 2hfs n PRO 65 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hfs n GLY 66 N 3.46 3.22 0.28 -1.23 0.00 -1.26 -4.92 105.19 104.73 2hfs n GLY 66 Ca 0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 2hfs n GLY 66 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2hfs h TYR 67 N 0.00 -0.64 -0.19 1.61 3.20 -1.77 -1.19 116.97 117.99 2hfs h TYR 67 Ca 0.00 0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.91 2hfs h TYR 67 Cb 0.00 0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 2hfs h TYR 67 CO 0.00 -0.36 -0.04 0.82 -1.64 0.00 0.00 178.16 176.94 2hfs h ILE 68 N -0.54 0.82 -0.67 1.81 2.04 -1.92 -0.29 117.51 118.76 2hfs h ILE 68 Ca -0.01 -0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.90 2hfs h ILE 68 Cb 0.49 0.81 -0.06 0.00 -0.74 0.00 0.00 36.82 37.32 2hfs h ILE 68 CO -0.03 0.00 0.37 0.00 0.00 0.00 0.00 178.15 178.50 2hfs h ALA 69 N 1.19 0.90 -0.42 1.87 0.00 -1.92 -1.64 119.26 119.24 2hfs h ALA 69 Ca 0.09 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 2hfs h ALA 69 Cb 0.13 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2hfs h ALA 69 CO -0.19 0.04 -0.18 0.37 0.00 0.00 0.00 179.25 179.29 2hfs h GLN 70 N 0.68 0.80 -0.01 0.00 4.15 -0.54 -3.16 115.11 117.03 2hfs h GLN 70 Ca 0.30 -0.30 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2hfs h GLN 70 Cb 0.20 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.85 2hfs h GLN 70 CO -0.19 0.92 -0.27 1.63 -1.93 0.00 0.00 178.83 178.99 2hfs n LYS 71 N -4.13 0.89 -0.07 1.69 4.76 -0.18 -4.53 118.16 116.60 2hfs n LYS 71 Ca 0.01 -0.56 -0.09 0.00 -2.87 0.00 0.00 58.31 54.80 2hfs n LYS 71 Cb 0.41 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 32.10 2hfs n LYS 71 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 2hfs h ARG 72 N 1.35 0.30 -0.65 1.97 9.65 -1.27 0.03 114.38 125.76 2hfs h ARG 72 Ca 0.00 -0.02 0.10 0.00 -1.10 0.00 0.00 59.98 58.97 2hfs h ARG 72 Cb 0.53 -0.07 -0.08 0.00 -1.39 0.00 0.00 29.97 28.97 2hfs h ARG 72 CO 0.00 0.20 0.25 -0.44 2.80 0.00 0.00 179.97 182.78 2hfs h ASP 73 N 0.31 0.26 -0.59 -3.80 3.32 -1.82 -0.32 116.42 113.77 2hfs h ASP 73 Ca 0.10 0.08 -0.07 0.00 0.02 0.00 0.00 57.03 57.17 2hfs h ASP 73 Cb 0.01 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2hfs h ASP 73 CO -0.05 0.14 0.11 -0.33 -1.72 0.00 0.00 179.24 177.39 2hfs h GLU 74 N 0.43 0.98 -0.93 3.56 5.08 -1.71 -2.99 114.58 118.99 2hfs h GLU 74 Ca 0.33 -0.25 0.05 0.00 -1.00 0.00 0.00 59.36 58.49 2hfs h GLU 74 Cb 0.42 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.50 2hfs h GLU 74 CO -0.32 0.92 0.60 0.37 -1.00 0.00 0.00 179.01 179.57 2hfs h GLN 75 N 0.88 1.08 -0.47 2.33 4.15 0.60 0.12 115.11 123.80 2hfs h GLN 75 Ca 0.18 -0.06 0.02 0.00 0.77 0.00 0.00 58.65 59.55 2hfs h GLN 75 Cb 0.40 -0.24 -0.03 0.00 0.21 0.00 0.00 27.48 27.82 2hfs h GLN 75 CO 0.01 0.71 0.29 0.82 -1.93 0.00 0.00 178.83 178.73 2hfs h ILE 76 N 1.11 1.07 -0.21 2.39 2.04 -1.05 0.04 117.51 122.89 2hfs h ILE 76 Ca 0.39 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 66.05 2hfs h ILE 76 Cb 0.11 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 2hfs h ILE 76 CO -0.15 0.11 0.12 0.11 0.00 0.00 0.00 178.15 178.33 2hfs h LYS 77 N 0.58 0.30 -0.03 2.37 1.57 -1.21 -1.71 116.57 118.44 2hfs h LYS 77 Ca 0.19 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.95 2hfs h LYS 77 Cb -0.01 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 2hfs h LYS 77 CO -0.07 0.28 -0.12 0.00 -0.57 0.00 0.00 179.45 178.97 2hfs h ALA 78 N 1.00 -0.12 -0.66 3.86 0.00 -0.64 0.02 119.26 122.72 2hfs h ALA 78 Ca 0.08 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2hfs h ALA 78 Cb 0.07 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2hfs h ALA 78 CO -0.01 -0.61 0.22 0.45 0.00 0.00 0.00 179.25 179.30 2hfs h HIS 79 N -0.20 1.02 -0.71 0.00 3.86 -0.91 -1.10 115.15 117.12 2hfs h HIS 79 Ca 0.05 -0.09 -0.06 0.00 -1.16 0.00 0.00 60.37 59.12 2hfs h HIS 79 Cb 0.27 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.41 2hfs h HIS 79 CO -0.20 0.81 0.20 1.96 0.86 0.00 0.00 177.93 181.56 2hfs h GLN 80 N 0.97 1.12 -0.76 2.45 4.20 -1.03 -1.30 115.11 120.76 2hfs h GLN 80 Ca 0.22 -0.25 0.01 0.00 0.06 0.00 0.00 58.65 58.69 2hfs h GLN 80 Cb 0.26 -0.16 -0.04 0.00 0.30 0.00 0.00 27.48 27.84 2hfs h GLN 80 CO -0.01 0.97 0.50 -0.07 -0.67 0.00 0.00 178.83 179.55 2hfs h LEU 81 N 1.06 0.85 -0.12 1.46 3.38 -0.21 0.62 115.31 122.35 2hfs h LEU 81 Ca 0.23 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 2hfs h LEU 81 Cb 0.33 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2hfs h LEU 81 CO -0.00 0.61 -0.00 0.58 0.09 0.00 0.00 178.44 179.71 2hfs h VAL 82 N 1.00 1.26 -0.11 1.22 2.07 -1.04 -1.50 116.25 119.15 2hfs h VAL 82 Ca 0.28 -0.84 0.03 0.00 0.82 0.00 0.00 66.70 67.00 2hfs h VAL 82 Cb -0.08 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2hfs h VAL 82 CO -0.07 0.24 -0.10 -0.07 0.02 0.00 0.00 177.57 177.59 2hfs h LEU 83 N -0.07 -0.30 -0.51 2.57 3.38 -1.01 -0.99 115.31 118.37 2hfs h LEU 83 Ca 0.03 0.06 0.10 0.00 0.09 0.00 0.00 57.88 58.16 2hfs h LEU 83 Cb 0.37 0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.19 2hfs h LEU 83 CO 0.01 -0.13 0.03 -0.78 0.09 0.00 0.00 178.44 177.65 2hfs h ASP 84 N -0.11 -0.16 -0.57 -0.43 1.82 -0.85 -0.76 116.42 115.35 2hfs h ASP 84 Ca 0.08 0.12 -0.04 0.00 -0.39 0.00 0.00 57.03 56.79 2hfs h ASP 84 Cb 0.22 0.20 -0.03 0.00 0.68 0.00 0.00 39.33 40.40 2hfs h ASP 84 CO -0.18 -0.05 0.22 -0.74 -1.61 0.00 0.00 179.24 176.88 2hfs h HIS 85 N 0.14 0.91 -0.34 0.28 2.76 -0.72 -2.38 115.15 115.81 2hfs h HIS 85 Ca 0.26 -0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 2hfs h HIS 85 Cb 0.39 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 29.07 2hfs h HIS 85 CO -0.30 0.72 0.00 1.28 -1.30 0.00 0.00 177.93 178.33 2hfs n LEU 86 N -4.30 2.55 -3.48 0.26 4.77 -0.43 -4.94 117.00 111.43 2hfs n LEU 86 Ca 0.05 -1.14 -0.18 0.00 -0.03 0.00 0.00 56.01 54.71 2hfs n LEU 86 Cb 0.18 -0.22 0.08 0.00 -2.33 0.00 0.00 43.42 41.14 2hfs n LEU 86 CO 0.39 0.57 0.10 0.29 -1.33 0.00 0.00 177.39 177.41 2hfs n LYS 87 N 0.90 -6.51 -3.86 3.23 5.02 -0.39 -4.54 118.16 112.01 2hfs n LYS 87 Ca 0.17 0.82 -0.36 0.00 -2.02 0.00 0.00 58.31 56.92 2hfs n LYS 87 Cb 0.45 -5.79 -0.13 0.00 -0.02 0.00 0.00 35.03 29.54 2hfs n LYS 87 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2hfs s VAL 88 N -3.39 4.06 -0.27 -0.18 1.01 -0.60 -0.14 120.40 120.89 2hfs s VAL 88 Ca 0.05 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 61.70 2hfs s VAL 88 Cb -0.02 -2.87 -0.00 0.00 0.00 0.00 0.00 36.38 33.48 2hfs s VAL 88 CO 0.74 0.38 0.05 -0.62 0.00 0.00 0.00 175.10 175.65 2hfs s ASP 89 N 1.43 4.95 -0.14 3.32 2.15 -1.26 -4.55 116.67 122.57 2hfs s ASP 89 Ca 0.05 -0.53 0.15 0.00 0.43 0.00 0.00 52.55 52.66 2hfs s ASP 89 Cb -0.15 -1.86 0.53 0.00 -0.30 0.00 0.00 42.92 41.15 2hfs s ASP 89 CO 0.02 -0.12 1.44 0.18 -0.17 0.00 0.00 175.17 176.52 2hfs n LEU 90 N 4.86 3.98 0.28 -1.34 4.77 -1.26 -4.65 117.00 123.63 2hfs n LEU 90 Ca -0.16 -2.76 0.18 0.00 -0.03 0.00 0.00 56.01 53.25 2hfs n LEU 90 Cb 0.49 -0.50 0.89 0.00 -2.33 0.00 0.00 43.42 41.97 2hfs n LEU 90 CO 0.31 0.69 1.05 0.77 -1.33 0.00 0.00 177.39 178.87 2hfs h SER 91 N 2.28 0.00 0.00 -1.43 4.64 -1.95 0.33 113.55 117.43 2hfs h SER 91 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2hfs h SER 91 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2hfs h SER 91 CO 0.21 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.78 2hfs n GLY 92 N -0.60 0.36 3.66 -0.77 0.00 -1.26 -4.74 105.19 101.84 2hfs n GLY 92 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2hfs n GLY 92 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2hfs s ASP 93 N 0.51 7.01 0.00 1.61 1.11 -1.26 -2.03 116.67 123.62 2hfs s ASP 93 Ca 0.00 1.26 0.00 0.00 0.18 0.00 0.00 52.55 53.99 2hfs s ASP 93 Cb 0.00 -2.50 0.00 0.00 1.07 0.00 0.00 42.92 41.49 2hfs s ASP 93 CO 0.00 -0.60 0.00 0.61 1.18 0.00 0.00 175.17 176.36 2hfs n GLY 94 N 3.46 1.37 3.09 0.21 0.00 0.62 -4.64 105.19 109.30 2hfs n GLY 94 Ca 0.09 -1.89 -0.15 0.00 0.00 0.00 0.00 46.02 44.08 2hfs n GLY 94 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hfs s LEU 95 N 0.00 2.25 0.56 0.99 1.43 -0.83 -0.68 118.68 122.41 2hfs s LEU 95 Ca 0.00 -0.55 0.06 0.00 -1.03 0.00 0.00 54.13 52.60 2hfs s LEU 95 Cb 0.00 -0.27 0.05 0.00 0.03 0.00 0.00 46.19 46.00 2hfs s LEU 95 CO 0.00 -0.16 0.45 -0.54 0.23 0.00 0.00 176.35 176.33 2hfs s LYS 96 N -1.57 2.23 -0.29 1.70 1.02 0.68 -0.89 119.74 122.61 2hfs s LYS 96 Ca -0.07 -2.04 -0.14 0.00 0.02 0.00 0.00 55.97 53.73 2hfs s LYS 96 Cb -0.10 -2.12 0.12 0.00 -0.52 0.00 0.00 37.83 35.21 2hfs s LYS 96 CO 0.01 -0.70 0.80 0.12 -0.92 0.00 0.00 175.35 174.66 2hfs s PHE 98 N -2.80 -0.95 -0.17 3.18 5.36 0.11 -1.41 117.98 121.30 2hfs s PHE 98 Ca 0.35 1.79 -0.04 0.00 -0.96 0.00 0.00 56.93 58.06 2hfs s PHE 98 Cb -0.03 0.57 -0.03 0.00 -0.34 0.00 0.00 43.02 43.19 2hfs s PHE 98 CO 0.22 -0.47 -0.02 0.42 -1.46 0.00 0.00 175.22 173.91 2hfs s ILE 99 N 1.99 3.99 0.00 3.12 1.01 -0.79 -1.00 121.20 129.51 2hfs s ILE 99 Ca -0.08 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.26 2hfs s ILE 99 Cb -0.06 -2.77 0.00 0.00 0.01 0.00 0.00 42.46 39.63 2hfs s ILE 99 CO -0.18 0.47 0.00 0.61 0.00 0.00 0.00 174.94 175.84 2hfs n GLY 100 N 3.79 5.03 0.00 6.18 0.00 -0.07 0.20 105.19 120.31 2hfs n GLY 100 Ca -0.17 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.21 2hfs n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hfs n GLY 101 N 0.00 -2.08 0.11 -0.02 0.00 -1.26 -1.78 105.19 100.16 2hfs n GLY 101 Ca 0.00 -1.47 0.12 0.00 0.00 0.00 0.00 46.02 44.67 2hfs n GLY 101 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2hfs n PRO 102 N -1.44 0.22 -1.70 1.61 -0.04 -1.07 -4.43 135.00 128.14 2hfs n PRO 102 Ca 0.00 0.29 -0.43 0.00 -0.04 0.00 0.00 63.50 63.32 2hfs n PRO 102 Cb 0.00 -1.81 -0.03 0.00 -0.04 0.00 0.00 33.50 31.62 2hfs n PRO 102 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2hfs n LEU 103 N -2.21 3.71 -4.43 1.53 7.94 -0.42 -4.84 117.00 118.29 2hfs n LEU 103 Ca 0.04 1.09 -0.44 0.00 -1.11 0.00 0.00 56.01 55.60 2hfs n LEU 103 Cb 0.34 -1.52 -0.06 0.00 0.53 0.00 0.00 43.42 42.71 2hfs n LEU 103 CO 0.26 -0.04 0.28 -0.69 -1.11 0.00 0.00 177.39 176.09 2hfs s VAL 104 N 0.71 4.94 0.23 1.96 1.01 -1.26 -4.30 120.40 123.68 2hfs s VAL 104 Ca 0.73 -0.66 -0.31 0.00 0.00 0.00 0.00 61.98 61.74 2hfs s VAL 104 Cb -0.57 -4.28 -0.12 0.00 0.00 0.00 0.00 36.38 31.41 2hfs s VAL 104 CO 0.39 -0.79 1.67 -2.84 0.00 0.00 0.00 175.10 173.53 2hfs s PRO 105 N 2.43 4.13 -0.12 2.72 0.02 -1.26 -4.86 135.00 138.06 2hfs s PRO 105 Ca 0.12 2.57 -0.30 0.00 0.02 0.00 0.00 61.00 63.41 2hfs s PRO 105 Cb -0.21 -3.07 0.12 0.00 0.02 0.00 0.00 34.50 31.36 2hfs s PRO 105 CO 0.10 -0.70 0.97 0.45 -0.33 0.00 0.00 177.00 177.49 2hfs s SER 106 N 0.97 -0.37 0.29 2.53 0.15 -1.26 -2.27 113.70 113.74 2hfs s SER 106 Ca 0.71 0.28 -0.29 0.00 0.70 0.00 0.00 55.95 57.35 2hfs s SER 106 Cb -0.48 0.32 -0.13 0.00 -1.71 0.00 0.00 66.02 64.02 2hfs s SER 106 CO 0.37 -0.42 1.27 -0.24 1.20 0.00 0.00 173.24 175.41 2hfs n SER 107 N 0.43 2.38 0.00 5.45 2.88 -1.26 -2.52 113.62 120.98 2hfs n SER 107 Ca -0.10 1.18 0.00 0.00 -1.33 0.00 0.00 58.87 58.62 2hfs n SER 107 Cb 0.59 -1.41 0.00 0.00 -0.75 0.00 0.00 64.21 62.64 2hfs n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2hfs n GLY 108 N 1.42 1.52 0.70 0.46 0.00 -1.26 -4.31 105.19 103.71 2hfs n GLY 108 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 2hfs n GLY 108 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2hfs n ILE 109 N -2.00 0.07 -1.68 -0.61 0.13 -1.05 -4.71 119.36 109.51 2hfs n ILE 109 Ca 0.00 -0.38 -0.08 0.00 -1.10 0.00 0.00 62.75 61.19 2hfs n ILE 109 Cb 0.00 0.83 -0.02 0.00 -0.84 0.00 0.00 39.64 39.61 2hfs n ILE 109 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2hfs n GLY 110 N 1.25 0.53 0.21 4.50 0.00 -1.26 -0.98 105.19 109.44 2hfs n GLY 110 Ca 0.17 -0.61 0.02 0.00 0.00 0.00 0.00 46.02 45.60 2hfs n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hfs h ALA 111 N 0.19 1.41 -0.60 4.61 0.00 -1.92 -1.42 119.26 121.53 2hfs h ALA 111 Ca -0.18 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 2hfs h ALA 111 Cb 0.83 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2hfs h ALA 111 CO 0.24 0.42 0.21 0.66 0.00 0.00 0.00 179.25 180.78 2hfs h SER 112 N 0.11 0.85 -0.49 0.00 4.64 -1.95 -0.67 113.55 116.05 2hfs h SER 112 Ca 0.02 -0.19 -0.04 0.00 -0.47 0.00 0.00 61.79 61.10 2hfs h SER 112 Cb 0.55 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 2hfs h SER 112 CO 0.04 0.82 0.14 0.00 -0.87 0.00 0.00 176.83 176.96 2hfs h ALA 113 N 1.07 0.65 -0.72 5.18 0.00 -1.63 -2.18 119.26 121.62 2hfs h ALA 113 Ca 0.20 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.97 2hfs h ALA 113 Cb 0.25 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 2hfs h ALA 113 CO -0.01 0.32 0.43 0.77 0.00 0.00 0.00 179.25 180.75 2hfs h SER 114 N 0.67 0.66 0.36 0.00 0.02 -1.10 -0.16 113.55 114.01 2hfs h SER 114 Ca 0.16 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 2hfs h SER 114 Cb 0.29 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.69 2hfs h SER 114 CO -0.00 0.43 -0.50 -0.78 -1.14 0.00 0.00 176.83 174.84 2hfs h ASP 115 N 0.79 -1.41 0.22 3.07 3.58 -0.77 -0.71 116.42 121.20 2hfs h ASP 115 Ca 0.31 0.13 -0.10 0.00 0.42 0.00 0.00 57.03 57.79 2hfs h ASP 115 Cb 0.15 0.49 -0.01 0.00 1.72 0.00 0.00 39.33 41.67 2hfs h ASP 115 CO -0.16 -0.62 -0.38 -0.37 -2.88 0.00 0.00 179.24 174.83 2hfs h VAL 116 N -0.90 1.30 -0.38 2.25 -1.51 -1.19 -1.00 116.25 114.82 2hfs h VAL 116 Ca -0.04 -1.44 -0.03 0.00 -1.23 0.00 0.00 66.70 63.96 2hfs h VAL 116 Cb 0.82 1.64 -0.02 0.00 -2.13 0.00 0.00 31.29 31.60 2hfs h VAL 116 CO -0.14 0.43 0.10 0.58 -1.23 0.00 0.00 177.57 177.31 2hfs h VAL 117 N 0.19 1.22 -0.50 7.19 2.07 -0.96 0.14 116.25 125.60 2hfs h VAL 117 Ca 0.02 -0.75 0.02 0.00 0.82 0.00 0.00 66.70 66.81 2hfs h VAL 117 Cb 0.76 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 2hfs h VAL 117 CO 0.06 0.26 0.31 0.00 0.02 0.00 0.00 177.57 178.21 2hfs h ALA 118 N 0.95 0.65 -0.21 1.67 0.00 -0.72 -1.01 119.26 120.59 2hfs h ALA 118 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2hfs h ALA 118 Cb 0.29 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2hfs h ALA 118 CO -0.00 0.02 0.12 0.35 0.00 0.00 0.00 179.25 179.73 2hfs h PHE 119 N 0.61 0.29 -0.58 0.00 3.57 -1.06 0.16 116.94 119.93 2hfs h PHE 119 Ca 0.20 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.72 2hfs h PHE 119 Cb 0.00 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 2hfs h PHE 119 CO -0.06 0.26 0.35 0.77 -2.23 0.00 0.00 178.31 177.40 2hfs h SER 120 N 0.23 0.57 -0.55 0.41 0.02 -0.42 0.29 113.55 114.11 2hfs h SER 120 Ca 0.07 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 2hfs h SER 120 Cb 0.07 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 2hfs h SER 120 CO -0.01 0.40 0.06 0.03 -1.14 0.00 0.00 176.83 176.17 2hfs h ARG 121 N 0.69 0.92 -0.60 3.45 3.08 -0.87 -0.87 114.38 120.19 2hfs h ARG 121 Ca 0.23 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 2hfs h ARG 121 Cb 0.03 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 2hfs h ARG 121 CO -0.10 0.90 0.19 0.00 -1.07 0.00 0.00 179.97 179.89 2hfs h ALA 122 N 0.98 1.21 -0.49 0.04 0.00 -0.23 -1.40 119.26 119.37 2hfs h ALA 122 Ca 0.16 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2hfs h ALA 122 Cb 0.44 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2hfs h ALA 122 CO 0.02 0.56 0.03 -0.07 0.00 0.00 0.00 179.25 179.79 2hfs h LEU 123 N 0.87 0.82 -1.07 0.00 3.38 -0.79 -0.55 115.31 117.96 2hfs h LEU 123 Ca 0.20 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2hfs h LEU 123 Cb 0.25 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2hfs h LEU 123 CO -0.01 0.90 0.48 -1.28 0.09 0.00 0.00 178.44 178.62 2hfs h SER 124 N 0.70 0.99 0.44 -0.43 0.87 -0.80 -0.58 113.55 114.74 2hfs h SER 124 Ca 0.14 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 2hfs h SER 124 Cb 0.46 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 2hfs h SER 124 CO 0.02 0.77 -0.21 -0.08 -0.53 0.00 0.00 176.83 176.80 2hfs h GLU 125 N 1.13 -0.57 -0.84 2.24 4.81 -0.93 -0.33 114.58 120.09 2hfs h GLU 125 Ca 0.29 0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.53 2hfs h GLU 125 Cb -0.02 0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 2hfs h GLU 125 CO -0.05 -0.27 0.41 1.25 -0.73 0.00 0.00 179.01 179.62 2hfs h LEU 126 N -0.85 1.09 -1.58 1.64 5.85 -0.77 -2.15 115.31 118.54 2hfs h LEU 126 Ca -0.06 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.53 2hfs h LEU 126 Cb 0.56 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.31 2hfs h LEU 126 CO 0.10 0.92 0.00 -1.22 -0.34 0.00 0.00 178.44 177.89 2hfs n TYR 127 N -4.33 0.22 -3.77 1.25 4.01 -0.26 -1.32 117.16 112.96 2hfs n TYR 127 Ca 0.08 -0.11 -0.32 0.00 -0.16 0.00 0.00 57.90 57.40 2hfs n TYR 127 Cb 0.14 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.19 2hfs n TYR 127 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2hfs n GLN 128 N 0.83 -1.60 0.09 -0.72 1.13 -0.29 -4.60 117.38 112.21 2hfs n GLN 128 Ca 0.17 0.41 0.12 0.00 -1.94 0.00 0.00 57.00 55.76 2hfs n GLN 128 Cb 0.46 -4.06 0.19 0.00 0.11 0.00 0.00 30.24 26.94 2hfs n GLN 128 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 2hfs h LEU 129 N -1.96 0.00 -0.23 1.08 3.38 -1.39 -3.48 115.31 112.71 2hfs h LEU 129 Ca -0.66 -0.13 -0.44 0.00 0.09 0.00 0.00 57.88 56.74 2hfs h LEU 129 Cb 1.37 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.08 2hfs h LEU 129 CO 0.51 0.07 -0.68 0.59 0.09 0.00 0.00 178.44 179.03 2hfs n ASN 130 N -2.28 -4.70 -4.75 -0.43 5.03 -1.26 -4.89 115.26 101.98 2hfs n ASN 130 Ca 0.03 -0.59 -0.41 0.00 0.87 0.00 0.00 54.58 54.48 2hfs n ASN 130 Cb 0.46 -3.79 -0.01 0.00 -1.02 0.00 0.00 39.78 35.41 2hfs n ASN 130 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2hfs s LEU 131 N -6.96 4.34 0.80 3.41 1.43 -1.26 -5.00 118.68 115.44 2hfs s LEU 131 Ca 0.54 2.97 -0.12 0.00 -1.03 0.00 0.00 54.13 56.49 2hfs s LEU 131 Cb -0.27 -3.64 0.07 0.00 0.03 0.00 0.00 46.19 42.38 2hfs s LEU 131 CO 0.66 -0.92 1.10 0.42 0.23 0.00 0.00 176.35 177.84 2hfs s THR 132 N -0.06 2.95 0.33 5.49 -4.23 -1.26 -4.79 115.64 114.07 2hfs s THR 132 Ca 0.63 0.31 0.07 0.00 -1.18 0.00 0.00 61.69 61.52 2hfs s THR 132 Cb -0.48 -3.10 0.31 0.00 1.34 0.00 0.00 72.50 70.58 2hfs s THR 132 CO 0.49 -0.41 1.82 0.44 -0.54 0.00 0.00 174.62 176.42 2hfs h ASP 133 N -1.08 0.74 -0.47 3.99 3.32 -1.98 0.15 116.42 121.08 2hfs h ASP 133 Ca -0.47 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 56.58 2hfs h ASP 133 Cb 1.28 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 2hfs h ASP 133 CO 0.60 0.32 0.02 -0.08 -1.72 0.00 0.00 179.24 178.38 2hfs h GLU 134 N 0.75 0.81 -0.55 3.56 4.81 -1.99 0.22 114.58 122.20 2hfs h GLU 134 Ca 0.52 -0.25 -0.08 0.00 -0.13 0.00 0.00 59.36 59.42 2hfs h GLU 134 Cb 0.83 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.10 2hfs h GLU 134 CO -0.29 0.85 0.01 0.93 -0.73 0.00 0.00 179.01 179.78 2hfs h GLU 135 N 0.67 0.94 -0.19 1.92 5.08 -1.68 -1.60 114.58 119.72 2hfs h GLU 135 Ca 0.14 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.21 2hfs h GLU 135 Cb 0.47 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2hfs h GLU 135 CO 0.02 0.93 0.06 0.28 -1.00 0.00 0.00 179.01 179.29 2hfs h VAL 136 N 0.87 1.19 -0.70 3.13 2.07 -0.33 -2.04 116.25 120.44 2hfs h VAL 136 Ca 0.16 -0.60 0.07 0.00 0.82 0.00 0.00 66.70 67.15 2hfs h VAL 136 Cb 0.50 1.22 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 2hfs h VAL 136 CO 0.02 0.19 0.39 -1.13 0.02 0.00 0.00 177.57 177.06 2hfs h ASN 137 N 0.13 0.57 -0.53 0.57 -0.00 -0.43 -0.50 115.58 115.39 2hfs h ASN 137 Ca 0.06 0.04 -0.08 0.00 -0.00 0.00 0.00 56.30 56.32 2hfs h ASN 137 Cb 0.23 -0.07 -0.02 0.00 -0.00 0.00 0.00 38.32 38.46 2hfs h ASN 137 CO -0.00 0.36 0.04 0.25 -0.00 0.00 0.00 177.43 178.07 2hfs h LEU 138 N 0.70 0.89 -0.67 0.34 5.85 -1.25 -0.13 115.31 121.04 2hfs h LEU 138 Ca 0.32 -0.29 0.04 0.00 0.84 0.00 0.00 57.88 58.80 2hfs h LEU 138 Cb 0.23 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 2hfs h LEU 138 CO -0.20 0.96 0.39 -1.28 -0.34 0.00 0.00 178.44 177.97 2hfs h SER 139 N 0.79 0.62 -0.47 1.25 0.87 -0.60 -0.43 113.55 115.58 2hfs h SER 139 Ca 0.15 0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.66 2hfs h SER 139 Cb 0.48 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 2hfs h SER 139 CO 0.02 0.41 0.02 0.00 -0.53 0.00 0.00 176.83 176.75 2hfs h ALA 140 N 1.32 0.63 -0.48 6.23 0.00 -0.81 -1.54 119.26 124.60 2hfs h ALA 140 Ca 0.28 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 55.01 2hfs h ALA 140 Cb 0.10 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 2hfs h ALA 140 CO -0.14 0.41 0.11 0.35 0.00 0.00 0.00 179.25 179.97 2hfs h PHE 141 N 0.66 0.18 0.01 0.00 3.57 -0.36 0.10 116.94 121.11 2hfs h PHE 141 Ca 0.13 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.67 2hfs h PHE 141 Cb 0.48 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 2hfs h PHE 141 CO 0.04 0.01 -0.05 0.28 -2.23 0.00 0.00 178.31 176.36 2hfs h VAL 142 N 0.25 0.87 -0.68 1.41 2.07 -0.88 -2.81 116.25 116.48 2hfs h VAL 142 Ca 0.24 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.79 2hfs h VAL 142 Cb 0.30 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 2hfs h VAL 142 CO -0.30 0.00 0.45 1.23 0.02 0.00 0.00 177.57 178.97 2hfs h GLY 143 N -0.10 0.92 2.00 2.17 0.00 -0.55 -1.12 103.07 106.39 2hfs h GLY 143 Ca 0.02 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.03 2hfs h GLY 143 CO -0.05 0.28 0.00 0.83 0.00 0.00 0.00 176.54 177.60 2hfs h GLU 144 N 0.81 0.00 0.00 4.80 4.39 -0.55 -0.82 114.58 123.21 2hfs h GLU 144 Ca 0.27 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.97 2hfs h GLU 144 Cb 0.07 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2hfs h GLU 144 CO -0.08 0.00 -0.01 0.78 -1.16 0.00 0.00 179.01 178.55 2hfs h GLY 145 N 0.45 0.00 2.00 -3.84 0.00 -1.19 -0.02 103.07 100.47 2hfs h GLY 145 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 2hfs h GLY 145 CO 0.00 0.00 -0.44 -1.33 0.00 0.00 0.00 176.54 174.77 2hfs h GLY 146 N 0.16 0.00 0.15 4.60 0.00 -1.31 -3.31 103.07 103.36 2hfs h GLY 146 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.96 2hfs h GLY 146 CO 0.00 0.00 -2.14 -1.72 0.00 0.00 0.00 176.54 172.68 2hfs n TYR 147 N -3.56 0.51 -4.22 5.60 4.02 -0.85 -4.56 117.16 114.10 2hfs n TYR 147 Ca -0.00 0.15 -0.27 0.00 -0.01 0.00 0.00 57.90 57.77 2hfs n TYR 147 Cb 0.55 -1.06 -0.08 0.00 -0.02 0.00 0.00 39.34 38.73 2hfs n TYR 147 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 2hfs s HIS 148 N -2.50 2.80 0.01 -0.72 3.76 -0.08 -5.03 115.29 113.53 2hfs s HIS 148 Ca -0.32 -0.15 -0.20 0.00 -0.15 0.00 0.00 55.06 54.24 2hfs s HIS 148 Cb 0.09 -1.37 -0.20 0.00 1.11 0.00 0.00 32.58 32.21 2hfs s HIS 148 CO 0.61 0.51 1.16 0.78 -0.85 0.00 0.00 174.74 176.95 2hfs h GLY 149 N 2.84 0.42 -6.59 -2.22 0.00 -1.86 -3.40 103.07 92.26 2hfs h GLY 149 Ca -0.47 -0.63 -0.59 0.00 0.00 0.00 0.00 47.33 45.64 2hfs h GLY 149 CO 0.57 0.56 -0.86 -1.59 0.00 0.00 0.00 176.54 175.21 2hfs s THR 150 N -3.50 0.51 0.17 4.70 2.01 -1.26 -5.01 115.64 113.26 2hfs s THR 150 Ca -0.14 -2.25 -0.34 0.00 0.31 0.00 0.00 61.69 59.27 2hfs s THR 150 Cb 0.04 -1.37 -0.14 0.00 0.01 0.00 0.00 72.50 71.04 2hfs s THR 150 CO 0.79 -1.06 1.59 -2.65 -0.69 0.00 0.00 174.62 172.61 2hfs n PRO 151 N 3.49 2.22 0.09 4.92 -0.02 -1.26 -4.90 135.00 139.53 2hfs n PRO 151 Ca 0.18 0.80 -0.08 0.00 -2.02 0.00 0.00 63.50 62.38 2hfs n PRO 151 Cb 0.40 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 2hfs n PRO 151 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2hfs h SER 152 N 5.98 0.24 0.00 2.55 4.64 -1.99 -3.48 113.55 121.50 2hfs h SER 152 Ca -0.45 -0.19 0.00 0.00 -0.47 0.00 0.00 61.79 60.68 2hfs h SER 152 Cb 1.25 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2hfs h SER 152 CO 0.89 0.99 0.00 0.61 -0.87 0.00 0.00 176.83 178.45 2hfs n GLY 153 N 0.83 2.63 0.11 -0.77 0.00 -1.26 -4.98 105.19 101.76 2hfs n GLY 153 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 2hfs n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hfs h ALA 154 N 0.00 0.26 0.21 4.61 0.00 -1.99 -1.53 119.26 120.82 2hfs h ALA 154 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2hfs h ALA 154 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2hfs h ALA 154 CO 0.00 -0.26 -0.10 -0.44 0.00 0.00 0.00 179.25 178.45 2hfs h ASP 155 N 0.28 -0.24 -0.95 0.00 5.19 -1.96 -1.01 116.42 117.73 2hfs h ASP 155 Ca 0.08 -0.19 0.02 0.00 -0.62 0.00 0.00 57.03 56.33 2hfs h ASP 155 Cb -0.03 0.06 -0.05 0.00 0.18 0.00 0.00 39.33 39.49 2hfs h ASP 155 CO -0.02 0.06 0.63 -0.55 -3.12 0.00 0.00 179.24 176.24 2hfs h ASN 156 N -0.55 1.06 -0.47 6.45 7.08 -1.89 -0.40 115.58 126.86 2hfs h ASN 156 Ca -0.03 -0.02 -0.00 0.00 -3.08 0.00 0.00 56.30 53.17 2hfs h ASN 156 Cb 0.41 -0.25 -0.02 0.00 -2.08 0.00 0.00 38.32 36.38 2hfs h ASN 156 CO 0.05 0.74 0.27 0.74 -2.08 0.00 0.00 177.43 177.15 2hfs h THR 157 N 1.24 1.15 -0.60 6.14 2.02 -1.13 0.22 112.91 121.95 2hfs h THR 157 Ca 0.37 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 67.09 2hfs h THR 157 Cb -0.06 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 2hfs h THR 157 CO -0.10 0.16 -0.00 0.00 0.37 0.00 0.00 175.52 175.94 2hfs h ALA 158 N 1.12 0.80 -0.11 6.16 0.00 -0.93 -1.64 119.26 124.67 2hfs h ALA 158 Ca 0.17 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 2hfs h ALA 158 Cb 0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2hfs h ALA 158 CO -0.03 0.65 -0.31 0.00 0.00 0.00 0.00 179.25 179.56 2hfs h ALA 159 N 0.98 1.28 0.00 0.00 0.00 -0.67 0.13 119.26 120.98 2hfs h ALA 159 Ca 0.17 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2hfs h ALA 159 Cb 0.56 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2hfs h ALA 159 CO 0.03 0.49 -0.00 1.79 0.00 0.00 0.00 179.25 181.57 2hfs h THR 160 N 0.19 1.52 0.00 0.00 1.35 -0.83 -1.48 112.91 113.65 2hfs h THR 160 Ca 0.03 -2.12 -0.31 0.00 -0.55 0.00 0.00 66.41 63.45 2hfs h THR 160 Cb 0.64 2.86 -0.06 0.00 -1.73 0.00 0.00 68.15 69.87 2hfs h THR 160 CO 0.05 0.51 -2.01 -1.22 -0.25 0.00 0.00 175.52 172.60 2hfs n TYR 161 N -4.64 0.52 -0.96 4.73 4.01 -0.63 -4.91 117.16 115.28 2hfs n TYR 161 Ca -0.08 0.19 0.13 0.00 -0.16 0.00 0.00 57.90 57.97 2hfs n TYR 161 Cb 0.40 -1.08 -0.03 0.00 -0.31 0.00 0.00 39.34 38.32 2hfs n TYR 161 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2hfs n GLY 162 N 1.63 -1.72 7.00 2.72 0.00 0.46 -5.03 105.19 110.24 2hfs n GLY 162 Ca -0.23 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2hfs n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hfs n GLY 163 N -3.18 -1.32 3.75 -0.02 0.00 -0.73 -4.64 105.19 99.04 2hfs n GLY 163 Ca 0.00 -1.25 -0.38 0.00 0.00 0.00 0.00 46.02 44.39 2hfs n GLY 163 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hfs s LEU 164 N 0.00 4.34 -0.09 0.99 1.43 -1.26 0.14 118.68 124.23 2hfs s LEU 164 Ca 0.00 0.92 0.01 0.00 -1.03 0.00 0.00 54.13 54.03 2hfs s LEU 164 Cb 0.00 -2.73 0.02 0.00 0.03 0.00 0.00 46.19 43.51 2hfs s LEU 164 CO 0.00 0.08 -0.12 -0.63 0.23 0.00 0.00 176.35 175.91 2hfs s ILE 165 N 0.16 1.22 -0.21 -0.59 1.01 0.57 -0.64 121.20 122.73 2hfs s ILE 165 Ca 0.27 -0.48 -0.24 0.00 0.00 0.00 0.00 60.65 60.20 2hfs s ILE 165 Cb -0.16 -1.15 -0.01 0.00 0.01 0.00 0.00 42.46 41.15 2hfs s ILE 165 CO 0.12 0.39 0.78 -0.22 0.00 0.00 0.00 174.94 176.01 2hfs s LEU 166 N 1.08 4.12 -0.16 2.97 1.98 0.20 -1.38 118.68 127.49 2hfs s LEU 166 Ca -0.06 1.03 0.00 0.00 -2.89 0.00 0.00 54.13 52.21 2hfs s LEU 166 Cb -0.15 -3.13 0.00 0.00 0.66 0.00 0.00 46.19 43.58 2hfs s LEU 166 CO -0.02 -0.42 -0.16 -0.47 -1.89 0.00 0.00 176.35 173.39 2hfs s TYR 167 N 2.40 2.78 0.00 5.38 6.04 0.60 -1.62 117.35 132.93 2hfs s TYR 167 Ca 0.34 -1.20 -0.03 0.00 0.04 0.00 0.00 57.07 56.23 2hfs s TYR 167 Cb -0.16 -1.90 -0.01 0.00 -1.04 0.00 0.00 41.96 38.85 2hfs s TYR 167 CO 0.10 -0.57 0.05 -0.98 -1.54 0.00 0.00 175.55 172.61 2hfs s ARG 168 N 0.97 0.30 -0.61 4.97 1.70 -0.65 0.44 118.95 126.07 2hfs s ARG 168 Ca -0.03 -0.34 -0.15 0.00 -0.47 0.00 0.00 55.73 54.75 2hfs s ARG 168 Cb -0.15 0.12 0.15 0.00 -0.57 0.00 0.00 34.95 34.50 2hfs s ARG 168 CO -0.03 -0.06 0.55 1.03 -1.08 0.00 0.00 175.30 175.72 2hfs s ARG 169 N -1.00 3.10 -0.35 3.89 0.52 -1.26 -0.40 118.95 123.44 2hfs s ARG 169 Ca -0.11 -1.93 -0.07 0.00 -0.52 0.00 0.00 55.73 53.11 2hfs s ARG 169 Cb -0.07 -4.29 0.05 0.00 0.52 0.00 0.00 34.95 31.16 2hfs s ARG 169 CO 0.00 -1.30 0.13 -0.65 0.02 0.00 0.00 175.30 173.49 2hfs s GLN 170 N 1.17 2.60 -0.77 3.54 -0.21 0.17 -4.57 119.66 121.59 2hfs s GLN 170 Ca 0.07 -1.23 -0.04 0.00 0.02 0.00 0.00 55.36 54.18 2hfs s GLN 170 Cb -0.24 -3.50 0.00 0.00 1.00 0.00 0.00 33.01 30.27 2hfs s GLN 170 CO -0.01 -0.71 0.67 0.09 -2.12 0.00 0.00 175.29 173.21 2hfs n ASN 171 N 4.81 -4.20 0.00 5.90 3.02 -1.26 -3.24 115.26 120.29 2hfs n ASN 171 Ca -0.12 -0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.12 2hfs n ASN 171 Cb 0.44 -3.11 0.00 0.00 -0.61 0.00 0.00 39.78 36.51 2hfs n ASN 171 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2hfs n GLY 172 N -1.33 1.28 3.35 7.41 0.00 -1.26 -5.02 105.19 109.61 2hfs n GLY 172 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2hfs n GLY 172 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hfs s LYS 173 N -0.15 1.66 -0.02 1.61 -2.85 -1.20 -5.12 119.74 113.68 2hfs s LYS 173 Ca 0.00 -1.15 -0.20 0.00 -1.00 0.00 0.00 55.97 53.61 2hfs s LYS 173 Cb 0.00 -1.91 -0.05 0.00 -2.06 0.00 0.00 37.83 33.81 2hfs s LYS 173 CO 0.00 0.48 0.59 -1.12 0.10 0.00 0.00 175.35 175.40 2hfs s SER 174 N -1.44 6.94 -0.05 0.03 0.01 -1.26 0.44 113.70 118.38 2hfs s SER 174 Ca 0.12 1.13 0.03 0.00 1.31 0.00 0.00 55.95 58.53 2hfs s SER 174 Cb -0.10 -2.36 0.01 0.00 0.21 0.00 0.00 66.02 63.78 2hfs s SER 174 CO 0.03 0.08 -0.12 -0.69 0.41 0.00 0.00 173.24 172.95 2hfs s VAL 175 N -0.06 1.06 -0.02 3.43 1.01 0.47 -4.93 120.40 121.35 2hfs s VAL 175 Ca 0.31 -0.47 0.07 0.00 0.00 0.00 0.00 61.98 61.89 2hfs s VAL 175 Cb -0.18 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 2hfs s VAL 175 CO 0.17 0.33 -0.22 -0.36 0.00 0.00 0.00 175.10 175.01 2hfs s PHE 176 N 0.44 2.00 -0.19 5.22 0.40 -1.26 -1.63 117.98 122.95 2hfs s PHE 176 Ca -0.09 -0.40 -0.17 0.00 -0.60 0.00 0.00 56.93 55.67 2hfs s PHE 176 Cb -0.13 -1.29 0.05 0.00 0.51 0.00 0.00 43.02 42.16 2hfs s PHE 176 CO 0.02 -0.05 0.51 0.21 0.70 0.00 0.00 175.22 176.61 2hfs s LYS 177 N -0.47 0.58 0.36 0.44 2.36 -0.64 -4.98 119.74 117.38 2hfs s LYS 177 Ca 0.07 0.73 -0.26 0.00 -2.55 0.00 0.00 55.97 53.96 2hfs s LYS 177 Cb -0.09 0.26 -0.09 0.00 -1.05 0.00 0.00 37.83 36.86 2hfs s LYS 177 CO -0.00 -0.08 1.08 -1.25 1.55 0.00 0.00 175.35 176.64 2hfs s PRO 178 N 0.42 4.32 -0.28 4.03 0.04 -1.26 0.61 135.00 142.88 2hfs s PRO 178 Ca -0.01 1.65 -0.09 0.00 0.04 0.00 0.00 61.00 62.58 2hfs s PRO 178 Cb -0.04 -2.79 -0.03 0.00 0.04 0.00 0.00 34.50 31.68 2hfs s PRO 178 CO -0.01 -0.03 0.14 0.42 0.04 0.00 0.00 177.00 177.55 2hfs s ILE 179 N -1.46 4.75 0.20 0.56 1.01 0.19 -4.79 121.20 121.66 2hfs s ILE 179 Ca 0.53 -0.13 -0.30 0.00 0.00 0.00 0.00 60.65 60.75 2hfs s ILE 179 Cb -0.26 -3.29 -0.09 0.00 0.01 0.00 0.00 42.46 38.83 2hfs s ILE 179 CO 0.33 0.23 1.29 0.00 0.00 0.00 0.00 174.94 176.79 2hfs s ALA 180 N 1.67 3.51 -0.14 9.38 0.00 -1.26 -4.36 121.76 130.55 2hfs s ALA 180 Ca 0.06 1.08 -0.17 0.00 0.00 0.00 0.00 51.96 52.93 2hfs s ALA 180 Cb -0.16 -3.47 0.04 0.00 0.00 0.00 0.00 23.12 19.53 2hfs s ALA 180 CO 0.07 -0.51 0.47 0.12 0.00 0.00 0.00 175.76 175.90 2hfs s PHE 181 N 0.08 -0.48 -0.90 0.00 5.99 -0.27 -4.90 117.98 117.50 2hfs s PHE 181 Ca 0.56 1.10 0.08 0.00 0.00 0.00 0.00 56.93 58.67 2hfs s PHE 181 Cb -0.36 0.18 0.11 0.00 0.00 0.00 0.00 43.02 42.95 2hfs s PHE 181 CO 0.38 -0.30 0.88 1.04 -0.00 0.00 0.00 175.22 177.21 2hfs n GLN 182 N 2.43 0.91 -5.19 10.12 6.02 -1.26 -0.56 117.38 129.85 2hfs n GLN 182 Ca -0.15 -1.24 -0.31 0.00 -0.01 0.00 0.00 57.00 55.29 2hfs n GLN 182 Cb 0.57 -1.16 -0.17 0.00 1.02 0.00 0.00 30.24 30.50 2hfs n GLN 182 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2hfs s GLN 183 N -0.76 2.70 0.27 -1.09 -0.21 -1.26 -4.90 119.66 114.41 2hfs s GLN 183 Ca 0.11 -0.85 -0.30 0.00 0.02 0.00 0.00 55.36 54.34 2hfs s GLN 183 Cb 0.07 -2.16 -0.10 0.00 1.00 0.00 0.00 33.01 31.83 2hfs s GLN 183 CO 0.10 0.26 1.40 0.50 -2.12 0.00 0.00 175.29 175.43 2hfs s ARG 184 N 0.12 4.30 -0.23 2.91 3.52 -1.26 -4.53 118.95 123.78 2hfs s ARG 184 Ca -0.11 2.26 -0.16 0.00 -0.13 0.00 0.00 55.73 57.59 2hfs s ARG 184 Cb -0.16 -3.11 -0.04 0.00 -1.56 0.00 0.00 34.95 30.09 2hfs s ARG 184 CO 0.06 -0.35 0.43 -0.51 -0.81 0.00 0.00 175.30 174.12 2hfs s LEU 185 N -0.71 4.11 -0.37 -0.88 1.43 -0.68 -4.96 118.68 116.61 2hfs s LEU 185 Ca 0.56 0.49 -0.16 0.00 -1.03 0.00 0.00 54.13 54.00 2hfs s LEU 185 Cb -0.41 -2.55 -0.00 0.00 0.03 0.00 0.00 46.19 43.26 2hfs s LEU 185 CO 0.45 -0.16 0.38 -0.31 0.23 0.00 0.00 176.35 176.95 2hfs s TYR 186 N 1.71 3.20 0.06 0.29 1.51 -1.26 -1.27 117.35 121.59 2hfs s TYR 186 Ca 0.19 -0.15 0.05 0.00 -1.01 0.00 0.00 57.07 56.15 2hfs s TYR 186 Cb -0.15 -2.74 -0.04 0.00 -0.11 0.00 0.00 41.96 38.92 2hfs s TYR 186 CO 0.09 -0.52 -0.04 -0.51 -1.11 0.00 0.00 175.55 173.45 2hfs s LEU 187 N 2.05 3.28 -0.19 -1.29 1.43 0.83 -1.01 118.68 123.78 2hfs s LEU 187 Ca 0.12 -0.20 -0.04 0.00 -1.03 0.00 0.00 54.13 52.98 2hfs s LEU 187 Cb -0.17 -1.98 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 2hfs s LEU 187 CO 0.12 0.22 -0.04 -0.69 0.23 0.00 0.00 176.35 176.19 2hfs s VAL 188 N -1.17 3.59 -0.12 -1.59 1.01 -0.34 -1.77 120.40 120.00 2hfs s VAL 188 Ca 0.22 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.78 2hfs s VAL 188 Cb -0.11 -2.61 -0.00 0.00 0.00 0.00 0.00 36.38 33.65 2hfs s VAL 188 CO 0.13 0.45 -0.19 -0.69 0.00 0.00 0.00 175.10 174.80 2hfs s VAL 189 N 1.04 2.46 -0.12 2.92 1.01 -0.67 -0.23 120.40 126.82 2hfs s VAL 189 Ca 0.01 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.15 2hfs s VAL 189 Cb -0.15 -1.99 0.00 0.00 0.00 0.00 0.00 36.38 34.25 2hfs s VAL 189 CO 0.00 0.54 -0.23 -0.69 0.00 0.00 0.00 175.10 174.73 2hfs s VAL 190 N 0.40 2.03 -0.12 2.92 1.01 0.22 -1.38 120.40 125.48 2hfs s VAL 190 Ca -0.14 -0.99 -0.14 0.00 0.00 0.00 0.00 61.98 60.71 2hfs s VAL 190 Cb -0.17 -1.77 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 2hfs s VAL 190 CO 0.07 0.55 0.33 -0.83 0.00 0.00 0.00 175.10 175.22 2hfs s GLY 191 N 0.56 2.29 0.33 4.51 0.00 0.08 -0.93 107.32 114.16 2hfs s GLY 191 Ca -0.14 -0.38 0.26 0.00 0.00 0.00 0.00 44.72 44.46 2hfs s GLY 191 CO 0.04 0.36 1.74 -0.91 0.00 0.00 0.00 173.10 174.33 2hfs h THR 192 N 4.44 0.00 0.00 0.90 1.35 -1.29 -2.47 112.91 115.83 2hfs h THR 192 Ca -0.44 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 2hfs h THR 192 Cb 1.18 1.56 0.00 0.00 -1.73 0.00 0.00 68.15 69.16 2hfs h THR 192 CO 0.71 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.59 2hfs n GLY 193 N 0.87 0.51 3.56 5.82 0.00 -1.26 -4.63 105.19 110.05 2hfs n GLY 193 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 2hfs n GLY 193 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hfs s ILE 194 N -2.37 5.17 -0.44 -0.61 1.01 -1.26 -5.01 121.20 117.68 2hfs s ILE 194 Ca 0.00 0.05 -0.25 0.00 0.00 0.00 0.00 60.65 60.45 2hfs s ILE 194 Cb 0.00 -3.49 0.02 0.00 0.01 0.00 0.00 42.46 39.00 2hfs s ILE 194 CO 0.00 0.21 0.91 0.20 0.00 0.00 0.00 174.94 176.26 2hfs s ASN 195 N 1.73 6.52 0.12 3.58 0.01 -1.26 -0.80 114.94 124.83 2hfs s ASN 195 Ca 0.07 0.17 -0.21 0.00 -0.71 0.00 0.00 52.86 52.18 2hfs s ASN 195 Cb -0.16 -2.44 -0.07 0.00 0.41 0.00 0.00 41.25 38.98 2hfs s ASN 195 CO 0.10 -1.00 0.64 0.00 -1.51 0.00 0.00 177.10 175.33 2hfs s ALA 196 N 3.65 3.53 -0.79 0.60 0.00 -1.26 -4.99 121.76 122.50 2hfs s ALA 196 Ca 0.36 0.13 -0.25 0.00 0.00 0.00 0.00 51.96 52.20 2hfs s ALA 196 Cb -0.11 -2.74 -0.01 0.00 0.00 0.00 0.00 23.12 20.27 2hfs s ALA 196 CO 0.25 0.37 1.73 -1.12 0.00 0.00 0.00 175.76 176.98 2hfs s SER 197 N -1.21 5.57 0.16 0.00 0.01 -1.26 -4.86 113.70 112.10 2hfs s SER 197 Ca 0.33 -0.40 -0.25 0.00 1.31 0.00 0.00 55.95 56.93 2hfs s SER 197 Cb -0.20 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.50 2hfs s SER 197 CO 0.21 -2.27 1.59 0.74 0.41 0.00 0.00 173.24 173.92 2hfs h THR 198 N 6.85 0.17 -0.93 1.44 2.02 -1.96 -1.17 112.91 119.32 2hfs h THR 198 Ca -0.08 0.00 0.24 0.00 0.77 0.00 0.00 66.41 67.34 2hfs h THR 198 Cb 1.07 0.17 -0.13 0.00 -1.74 0.00 0.00 68.15 67.52 2hfs h THR 198 CO 1.26 0.00 0.43 0.00 0.37 0.00 0.00 175.52 177.58 2hfs h ALA 199 N 0.55 1.55 -0.08 6.16 0.00 -1.99 -0.77 119.26 124.67 2hfs h ALA 199 Ca 0.15 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 2hfs h ALA 199 Cb 0.57 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2hfs h ALA 199 CO -0.54 -0.38 0.03 -0.22 0.00 0.00 0.00 179.25 178.15 2hfs h LYS 200 N 0.40 0.12 -0.38 0.00 1.63 -1.64 -2.21 116.57 114.50 2hfs h LYS 200 Ca 0.60 -0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 60.30 2hfs h LYS 200 Cb 1.18 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.78 2hfs h LYS 200 CO -0.55 0.25 -0.05 0.28 -3.45 0.00 0.00 179.45 175.94 2hfs h VAL 201 N -0.03 1.27 -0.87 2.00 2.07 -0.77 0.22 116.25 120.13 2hfs h VAL 201 Ca 0.03 -1.08 0.10 0.00 0.82 0.00 0.00 66.70 66.57 2hfs h VAL 201 Cb 0.17 1.21 -0.08 0.00 -1.52 0.00 0.00 31.29 31.08 2hfs h VAL 201 CO -0.00 0.36 0.51 0.58 0.02 0.00 0.00 177.57 179.04 2hfs h VAL 202 N 0.50 0.90 -0.08 2.57 2.07 -1.25 -1.30 116.25 119.67 2hfs h VAL 202 Ca 0.10 -0.29 -0.25 0.00 0.82 0.00 0.00 66.70 67.09 2hfs h VAL 202 Cb 0.54 -0.01 0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2hfs h VAL 202 CO 0.03 0.15 -0.91 -1.13 0.02 0.00 0.00 177.57 175.73 2hfs h ASN 203 N 0.84 0.93 -0.55 0.57 -1.24 -0.74 -1.59 115.58 113.80 2hfs h ASN 203 Ca 0.43 -0.68 -0.03 0.00 0.71 0.00 0.00 56.30 56.73 2hfs h ASN 203 Cb 0.41 -0.28 -0.03 0.00 0.73 0.00 0.00 38.32 39.15 2hfs h ASN 203 CO -0.26 1.48 0.25 0.44 -1.29 0.00 0.00 177.43 178.05 2hfs h ASP 204 N 0.47 0.77 -0.34 1.15 3.32 -0.25 0.15 116.42 121.69 2hfs h ASP 204 Ca -0.09 -0.09 -0.17 0.00 0.02 0.00 0.00 57.03 56.70 2hfs h ASP 204 Cb 1.55 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.90 2hfs h ASP 204 CO 0.18 0.68 -0.43 0.58 -1.72 0.00 0.00 179.24 178.53 2hfs h VAL 205 N 0.84 1.27 -0.10 -1.35 2.07 -1.25 -3.22 116.25 114.51 2hfs h VAL 205 Ca 0.20 -1.61 0.04 0.00 0.82 0.00 0.00 66.70 66.15 2hfs h VAL 205 Cb 0.14 1.45 -0.05 0.00 -1.52 0.00 0.00 31.29 31.31 2hfs h VAL 205 CO -0.02 0.53 -0.21 -0.74 0.02 0.00 0.00 177.57 177.16 2hfs h HIS 206 N 0.73 -0.54 0.00 1.57 -0.00 -0.37 -2.60 115.15 113.94 2hfs h HIS 206 Ca 0.05 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.44 2hfs h HIS 206 Cb 1.03 0.26 0.00 0.00 -0.00 0.00 0.00 27.41 28.70 2hfs h HIS 206 CO 0.06 -0.29 0.00 1.63 -0.00 0.00 0.00 177.93 179.34 2hfs n LYS 207 N -5.34 0.00 0.00 5.26 5.02 0.43 -2.74 118.16 120.80 2hfs n LYS 207 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 2hfs n LYS 207 Cb 0.26 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 2hfs n LYS 207 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2hfs n LYS 209 N 1.03 0.00 0.31 1.97 4.81 -0.98 -0.26 118.16 125.04 2hfs n LYS 209 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.29 2hfs n LYS 209 Cb 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 34.98 2hfs n LYS 209 CO 0.00 0.00 0.00 0.37 1.17 0.00 0.00 177.40 178.94 2hfs h GLN 210 N 0.00 -0.78 0.00 1.64 4.15 -1.81 -2.80 115.11 115.51 2hfs h GLN 210 Ca 0.00 0.05 -0.10 0.00 0.77 0.00 0.00 58.65 59.37 2hfs h GLN 210 Cb 0.00 0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 2hfs h GLN 210 CO 0.00 -0.47 -0.48 1.96 -1.93 0.00 0.00 178.83 177.91 2hfs h GLN 211 N -1.10 0.00 -2.13 1.69 4.20 -0.92 -3.31 115.11 113.54 2hfs h GLN 211 Ca -0.08 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.05 2hfs h GLN 211 Cb 0.67 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 28.04 2hfs h GLN 211 CO 0.14 0.48 -0.81 1.04 -0.67 0.00 0.00 178.83 179.00 2hfs n GLN 212 N -3.73 1.97 -0.24 1.46 6.02 -1.25 -4.97 117.38 116.65 2hfs n GLN 212 Ca -0.01 -4.16 -0.03 0.00 -0.01 0.00 0.00 57.00 52.80 2hfs n GLN 212 Cb 0.54 -1.90 0.16 0.00 1.02 0.00 0.00 30.24 30.06 2hfs n GLN 212 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2hfs h PRO 213 N 3.79 1.05 -0.06 -1.09 0.13 -1.59 -2.69 132.00 131.54 2hfs h PRO 213 Ca 0.14 -0.14 -0.07 0.00 -0.87 0.00 0.00 66.00 65.06 2hfs h PRO 213 Cb 0.73 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.66 2hfs h PRO 213 CO 0.69 0.80 -0.23 0.28 -0.23 0.00 0.00 178.00 179.32 2hfs h VAL 214 N 1.05 1.44 -0.36 1.56 2.07 -1.93 -2.48 116.25 117.59 2hfs h VAL 214 Ca 0.26 -1.64 -0.15 0.00 0.82 0.00 0.00 66.70 65.98 2hfs h VAL 214 Cb 0.09 2.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 2hfs h VAL 214 CO -0.04 0.46 -0.37 -0.61 0.02 0.00 0.00 177.57 177.03 2hfs h GLN 215 N -0.26 0.89 -0.66 1.57 4.15 -1.97 -2.89 115.11 115.93 2hfs h GLN 215 Ca -0.01 -0.48 0.03 0.00 0.77 0.00 0.00 58.65 58.97 2hfs h GLN 215 Cb 0.87 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.53 2hfs h GLN 215 CO 0.05 1.12 0.40 0.35 -1.93 0.00 0.00 178.83 178.82 2hfs h PHE 216 N 0.70 0.75 -0.49 3.99 3.04 -1.53 -0.67 116.94 122.73 2hfs h PHE 216 Ca 0.06 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.03 2hfs h PHE 216 Cb 0.97 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 39.21 2hfs h PHE 216 CO 0.07 0.42 0.31 -0.22 -2.02 0.00 0.00 178.31 176.86 2hfs h LYS 217 N 0.78 0.65 -0.43 1.11 3.64 -1.42 0.12 116.57 121.02 2hfs h LYS 217 Ca 0.27 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 2hfs h LYS 217 Cb 0.05 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 2hfs h LYS 217 CO -0.12 0.44 0.22 0.00 -2.27 0.00 0.00 179.45 177.72 2hfs h ARG 218 N 0.67 0.62 -0.23 1.90 3.08 -0.94 -0.11 114.38 119.36 2hfs h ARG 218 Ca 0.18 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 60.03 2hfs h ARG 218 Cb -0.05 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 29.88 2hfs h ARG 218 CO -0.04 0.52 -0.32 -0.07 -1.07 0.00 0.00 179.97 178.99 2hfs h LEU 219 N 0.56 0.69 -0.14 3.04 3.38 -0.40 0.20 115.31 122.64 2hfs h LEU 219 Ca 0.15 -0.51 0.04 0.00 0.09 0.00 0.00 57.88 57.65 2hfs h LEU 219 Cb 0.09 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 2hfs h LEU 219 CO -0.02 1.06 -0.12 0.22 0.09 0.00 0.00 178.44 179.67 2hfs h TYR 220 N 0.33 -0.31 -0.69 1.13 5.03 -0.78 0.17 116.97 121.85 2hfs h TYR 220 Ca 0.03 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.31 2hfs h TYR 220 Cb 0.90 0.16 -0.03 0.00 1.55 0.00 0.00 36.73 39.31 2hfs h TYR 220 CO 0.08 -0.19 0.24 -0.44 -1.32 0.00 0.00 178.16 176.54 2hfs h ASP 221 N -0.14 0.97 -0.42 -2.11 3.32 -0.86 -1.24 116.42 115.94 2hfs h ASP 221 Ca 0.09 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.93 2hfs h ASP 221 Cb 0.28 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 2hfs h ASP 221 CO -0.22 0.89 0.08 0.78 -1.72 0.00 0.00 179.24 179.05 2hfs h ASN 222 N 1.02 0.71 -0.19 6.45 2.35 -0.18 -2.85 115.58 122.89 2hfs h ASN 222 Ca 0.23 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 2hfs h ASN 222 Cb 0.25 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 2hfs h ASN 222 CO -0.01 0.73 0.08 0.22 -1.65 0.00 0.00 177.43 176.80 2hfs h TYR 223 N 0.73 0.28 -0.96 1.19 5.03 0.13 -2.54 116.97 120.83 2hfs h TYR 223 Ca 0.16 -0.02 0.20 0.00 2.58 0.00 0.00 58.73 61.65 2hfs h TYR 223 Cb 0.33 -0.08 -0.08 0.00 1.55 0.00 0.00 36.73 38.44 2hfs h TYR 223 CO 0.02 0.32 0.61 1.79 -1.32 0.00 0.00 178.16 179.58 2hfs h THR 224 N 0.16 0.69 -0.39 1.81 1.35 -1.03 0.25 112.91 115.75 2hfs h THR 224 Ca 0.06 -0.20 -0.15 0.00 -0.55 0.00 0.00 66.41 65.58 2hfs h THR 224 Cb 0.15 0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 66.63 2hfs h THR 224 CO -0.01 0.11 -0.34 -0.74 -0.25 0.00 0.00 175.52 174.29 2hfs h HIS 225 N 0.58 1.06 0.24 4.73 -0.00 -1.35 -1.50 115.15 118.90 2hfs h HIS 225 Ca 0.52 -0.30 -0.01 0.00 -0.00 0.00 0.00 60.37 60.58 2hfs h HIS 225 Cb 1.06 -0.23 0.00 0.00 -0.00 0.00 0.00 27.41 28.24 2hfs h HIS 225 CO -0.00 1.10 -0.11 0.82 -0.00 0.00 0.00 177.93 179.74 2hfs h ILE 226 N 0.75 0.78 -0.15 6.26 2.04 -0.13 -1.59 117.51 125.46 2hfs h ILE 226 Ca 0.07 -0.09 -0.10 0.00 1.00 0.00 0.00 64.86 65.74 2hfs h ILE 226 Cb 0.91 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 2hfs h ILE 226 CO 0.08 0.02 -0.35 1.62 0.00 0.00 0.00 178.15 179.52 2hfs h VAL 227 N -0.37 1.29 -0.54 1.67 3.04 -1.25 0.71 116.25 120.81 2hfs h VAL 227 Ca -0.03 -1.41 0.03 0.00 -1.01 0.00 0.00 66.70 64.28 2hfs h VAL 227 Cb 0.28 1.56 -0.04 0.00 -2.01 0.00 0.00 31.29 31.08 2hfs h VAL 227 CO 0.05 0.43 0.31 -1.28 -1.01 0.00 0.00 177.57 176.07 2hfs h SER 228 N 0.27 0.49 0.15 3.17 0.87 -1.14 -0.46 113.55 116.89 2hfs h SER 228 Ca 0.03 0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.48 2hfs h SER 228 Cb 0.75 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 2hfs h SER 228 CO 0.06 0.34 -0.44 1.56 -0.53 0.00 0.00 176.83 177.81 2hfs h GLN 229 N 0.61 0.36 -0.32 2.24 4.20 -0.76 -2.69 115.11 118.76 2hfs h GLN 229 Ca 0.22 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.72 2hfs h GLN 229 Cb 0.06 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2hfs h GLN 229 CO -0.11 0.74 0.13 0.00 -0.67 0.00 0.00 178.83 178.92 2hfs h ALA 230 N 1.23 0.42 -0.67 3.87 0.00 -0.25 0.16 119.26 124.02 2hfs h ALA 230 Ca 0.02 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2hfs h ALA 230 Cb 0.90 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2hfs h ALA 230 CO 0.08 0.01 0.45 0.00 0.00 0.00 0.00 179.25 179.78 2hfs h ARG 231 N 0.38 0.86 -0.36 0.00 3.08 -1.05 0.28 114.38 117.57 2hfs h ARG 231 Ca 0.11 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 59.96 2hfs h ARG 231 Cb 0.18 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2hfs h ARG 231 CO -0.01 0.57 -0.35 1.49 -1.07 0.00 0.00 179.97 180.60 2hfs h GLU 232 N 0.88 0.87 -0.28 0.04 4.81 -1.11 -1.61 114.58 118.18 2hfs h GLU 232 Ca 0.25 -0.45 -0.07 0.00 -0.13 0.00 0.00 59.36 58.95 2hfs h GLU 232 Cb -0.06 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 2hfs h GLU 232 CO -0.06 1.10 -0.15 0.00 -0.73 0.00 0.00 179.01 179.17 2hfs h ALA 233 N 0.75 1.23 -0.62 2.92 0.00 -0.06 -0.62 119.26 122.86 2hfs h ALA 233 Ca 0.06 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 2hfs h ALA 233 Cb 0.93 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2hfs h ALA 233 CO 0.09 0.50 0.04 -0.07 0.00 0.00 0.00 179.25 179.81 2hfs h LEU 234 N 0.45 1.04 -1.01 0.00 3.38 -0.82 -0.10 115.31 118.24 2hfs h LEU 234 Ca 0.08 -0.29 -0.10 0.00 0.09 0.00 0.00 57.88 57.66 2hfs h LEU 234 Cb 0.52 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2hfs h LEU 234 CO 0.03 1.07 -0.47 1.56 0.09 0.00 0.00 178.44 180.72 2hfs h GLN 235 N 0.97 0.00 0.00 1.13 1.08 -0.83 -3.02 115.11 114.45 2hfs h GLN 235 Ca 0.18 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 2hfs h GLN 235 Cb 0.51 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 2hfs h GLN 235 CO 0.02 0.47 -0.50 1.63 -0.95 0.00 0.00 178.83 179.50 2hfs n LYS 236 N -3.85 0.14 -2.30 1.46 5.02 -0.28 -4.97 118.16 113.38 2hfs n LYS 236 Ca -0.01 0.04 -0.06 0.00 -2.02 0.00 0.00 58.31 56.26 2hfs n LYS 236 Cb 0.51 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.93 2hfs n LYS 236 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2hfs n GLY 237 N 1.42 0.22 3.20 0.72 0.00 -0.64 -5.02 105.19 105.09 2hfs n GLY 237 Ca 0.05 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 2hfs n GLY 237 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2hfs s ASP 238 N -2.82 6.12 0.34 1.61 -1.08 -0.14 -4.90 116.67 115.79 2hfs s ASP 238 Ca 0.04 -3.09 0.13 0.00 -0.52 0.00 0.00 52.55 49.12 2hfs s ASP 238 Cb -0.02 -2.02 0.59 0.00 -1.46 0.00 0.00 42.92 40.01 2hfs s ASP 238 CO 0.05 -0.38 1.73 -0.07 0.52 0.00 0.00 175.17 177.03 2hfs h LEU 239 N 6.98 0.00 -0.23 -1.34 3.38 -1.95 -0.88 115.31 121.27 2hfs h LEU 239 Ca 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2hfs h LEU 239 Cb 0.94 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 2hfs h LEU 239 CO 0.79 0.47 0.10 -0.61 0.09 0.00 0.00 178.44 179.28 2hfs h GLN 240 N 0.00 0.33 -0.56 1.13 4.15 -1.94 0.17 115.11 118.38 2hfs h GLN 240 Ca -0.00 -0.05 -0.08 0.00 0.77 0.00 0.00 58.65 59.29 2hfs h GLN 240 Cb 0.87 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.48 2hfs h GLN 240 CO 0.06 0.35 0.04 -0.09 -1.93 0.00 0.00 178.83 177.25 2hfs h ARG 241 N 0.23 0.94 -0.32 1.69 9.65 -1.90 -1.73 114.38 122.94 2hfs h ARG 241 Ca 0.08 -0.26 0.05 0.00 -1.10 0.00 0.00 59.98 58.75 2hfs h ARG 241 Cb 0.13 -0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.55 2hfs h ARG 241 CO -0.01 0.91 0.01 1.25 2.80 0.00 0.00 179.97 184.92 2hfs h LEU 242 N 0.87 -0.11 -0.31 3.80 5.85 -0.93 -1.40 115.31 123.08 2hfs h LEU 242 Ca 0.17 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.98 2hfs h LEU 242 Cb 0.46 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 2hfs h LEU 242 CO 0.02 -0.02 0.15 1.23 -0.34 0.00 0.00 178.44 179.47 2hfs h GLY 243 N 0.10 0.41 1.03 3.75 0.00 -0.66 -2.44 103.07 105.26 2hfs h GLY 243 Ca 0.15 -0.10 0.05 0.00 0.00 0.00 0.00 47.33 47.43 2hfs h GLY 243 CO -0.25 0.08 0.52 -1.61 0.00 0.00 0.00 176.54 175.27 2hfs h GLN 244 N 0.31 0.87 -1.53 4.80 5.75 -1.00 -1.55 115.11 122.77 2hfs h GLN 244 Ca 0.13 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.58 2hfs h GLN 244 Cb 0.05 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 28.41 2hfs h GLN 244 CO -0.10 0.58 0.00 1.28 -2.65 0.00 0.00 178.83 177.94 2hfs n LEU 245 N -4.47 2.46 0.00 -2.39 4.77 -0.56 -1.48 117.00 115.34 2hfs n LEU 245 Ca 0.11 -1.18 0.00 0.00 -0.03 0.00 0.00 56.01 54.91 2hfs n LEU 245 Cb 0.17 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 2hfs n LEU 245 CO 0.34 0.43 0.00 0.59 -1.33 0.00 0.00 177.39 177.42 2hfs n ASN 247 N 0.96 0.00 -0.21 -1.43 3.02 -0.58 0.18 115.26 117.21 2hfs n ASN 247 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 54.58 54.48 2hfs n ASN 247 Cb 0.33 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.53 2hfs n ASN 247 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2hfs h ALA 248 N 0.00 0.76 -0.85 5.41 0.00 -1.53 -2.02 119.26 121.03 2hfs h ALA 248 Ca 0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2hfs h ALA 248 Cb 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 2hfs h ALA 248 CO 0.00 0.37 0.42 -0.97 0.00 0.00 0.00 179.25 179.07 2hfs h ASN 249 N 0.81 1.11 -0.94 0.00 -0.00 -0.54 -2.26 115.58 113.75 2hfs h ASN 249 Ca 0.20 -0.13 0.05 0.00 -0.00 0.00 0.00 56.30 56.42 2hfs h ASN 249 Cb 0.19 -0.28 -0.06 0.00 -0.00 0.00 0.00 38.32 38.17 2hfs h ASN 249 CO -0.02 0.92 0.61 -0.74 -0.00 0.00 0.00 177.43 178.20 2hfs h HIS 250 N 1.21 1.13 -0.66 0.67 2.76 -1.66 -1.65 115.15 116.96 2hfs h HIS 250 Ca 0.30 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.44 2hfs h HIS 250 Cb 0.10 -0.37 -0.03 0.00 1.55 0.00 0.00 27.41 28.66 2hfs h HIS 250 CO 0.01 0.61 0.19 0.22 -1.30 0.00 0.00 177.93 177.66 2hfs h ASP 251 N 1.13 0.95 -0.28 3.26 3.58 -0.82 -0.55 116.42 123.69 2hfs h ASP 251 Ca 0.39 -0.18 -0.11 0.00 0.42 0.00 0.00 57.03 57.56 2hfs h ASP 251 Cb 0.10 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 2hfs h ASP 251 CO -0.15 0.90 -0.20 -0.07 -2.88 0.00 0.00 179.24 176.84 2hfs h LEU 252 N 0.98 0.75 -0.94 2.28 3.38 -1.03 -2.54 115.31 118.18 2hfs h LEU 252 Ca 0.21 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2hfs h LEU 252 Cb 0.30 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 2hfs h LEU 252 CO -0.00 0.94 0.39 0.00 0.09 0.00 0.00 178.44 179.86 2hfs h ARG 254 N 1.14 1.16 0.00 0.00 3.08 -0.96 -2.36 114.38 116.43 2hfs h ARG 254 Ca 0.28 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2hfs h ARG 254 Cb 0.10 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.89 2hfs h ARG 254 CO -0.04 0.77 0.00 1.96 -1.07 0.00 0.00 179.97 181.59 2hfs h GLN 255 N 1.19 0.00 -0.66 0.04 4.20 -0.93 0.01 115.11 118.96 2hfs h GLN 255 Ca 0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.07 2hfs h GLN 255 Cb -0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 2hfs h GLN 255 CO -0.10 0.00 0.00 0.44 -0.67 0.00 0.00 178.83 178.50 2hfs n ILE 256 N -2.66 1.06 -3.27 2.54 -5.35 -0.79 -4.98 119.36 105.90 2hfs n ILE 256 Ca 0.03 -0.92 -0.17 0.00 -0.27 0.00 0.00 62.75 61.42 2hfs n ILE 256 Cb 0.39 0.36 0.06 0.00 -1.74 0.00 0.00 39.64 38.70 2hfs n ILE 256 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2hfs n ASP 257 N 1.34 -4.99 -0.51 7.28 2.03 -0.01 -4.79 116.55 116.89 2hfs n ASP 257 Ca 0.22 -0.39 0.06 0.00 0.52 0.00 0.00 54.79 55.20 2hfs n ASP 257 Cb 0.62 -3.73 0.08 0.00 -0.72 0.00 0.00 41.12 37.38 2hfs n ASP 257 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2hfs n VAL 258 N -4.24 0.36 -2.21 5.18 0.24 -0.92 -4.95 118.33 111.78 2hfs n VAL 258 Ca -0.00 -0.68 -0.08 0.00 -2.04 0.00 0.00 64.34 61.53 2hfs n VAL 258 Cb 0.55 0.97 0.05 0.00 -1.47 0.00 0.00 33.84 33.93 2hfs n VAL 258 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2hfs n SER 259 N 0.58 0.41 -3.79 -1.34 2.88 -1.26 0.38 113.62 111.48 2hfs n SER 259 Ca 0.08 -1.36 -0.06 0.00 -1.33 0.00 0.00 58.87 56.20 2hfs n SER 259 Cb 0.33 -0.25 -0.02 0.00 -0.75 0.00 0.00 64.21 63.53 2hfs n SER 259 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hfs h ARG 261 N 2.00 1.06 -0.17 0.00 2.43 -2.00 -1.13 114.38 116.58 2hfs h ARG 261 Ca -0.21 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 58.87 2hfs h ARG 261 Cb 1.24 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.55 2hfs h ARG 261 CO 0.24 0.70 -0.02 0.93 -1.51 0.00 0.00 179.97 180.32 2hfs h GLU 262 N 1.09 0.31 -0.35 0.20 3.07 -1.96 -1.40 114.58 115.54 2hfs h GLU 262 Ca 0.40 -0.11 -0.00 0.00 -0.50 0.00 0.00 59.36 59.16 2hfs h GLU 262 Cb 0.17 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 2hfs h GLU 262 CO -0.15 0.55 0.21 -0.07 -1.40 0.00 0.00 179.01 178.15 2hfs h LEU 263 N 0.04 0.43 -0.59 1.33 3.38 -1.86 -1.92 115.31 116.12 2hfs h LEU 263 Ca 0.05 -0.05 0.12 0.00 0.09 0.00 0.00 57.88 58.08 2hfs h LEU 263 Cb 0.42 -0.11 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 2hfs h LEU 263 CO 0.01 0.35 0.08 -0.33 0.09 0.00 0.00 178.44 178.65 2hfs h GLU 264 N 0.46 0.19 -0.73 1.13 4.39 -1.15 0.23 114.58 119.10 2hfs h GLU 264 Ca 0.13 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2hfs h GLU 264 Cb 0.01 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 2hfs h GLU 264 CO -0.02 0.13 0.32 1.03 -1.16 0.00 0.00 179.01 179.31 2hfs h SER 265 N 0.20 0.99 0.55 1.42 0.87 -0.95 -1.10 113.55 115.53 2hfs h SER 265 Ca 0.31 -0.15 -0.03 0.00 -1.23 0.00 0.00 61.79 60.69 2hfs h SER 265 Cb 0.47 -0.25 0.01 0.00 -0.44 0.00 0.00 62.40 62.19 2hfs h SER 265 CO -0.44 0.87 -0.26 0.40 -0.53 0.00 0.00 176.83 176.87 2hfs h ILE 266 N 1.04 0.39 -0.99 2.23 2.04 -0.83 -2.22 117.51 119.17 2hfs h ILE 266 Ca 0.25 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.86 2hfs h ILE 266 Cb 0.17 0.49 -0.05 0.00 -0.74 0.00 0.00 36.82 36.69 2hfs h ILE 266 CO -0.03 0.04 0.65 -0.37 0.00 0.00 0.00 178.15 178.45 2hfs h VAL 267 N -0.92 1.24 0.07 1.67 -1.51 -0.92 0.27 116.25 116.15 2hfs h VAL 267 Ca -0.08 -0.45 0.02 0.00 -1.23 0.00 0.00 66.70 64.96 2hfs h VAL 267 Cb 0.63 -0.20 -0.04 0.00 -2.13 0.00 0.00 31.29 29.55 2hfs h VAL 267 CO 0.12 0.24 -0.28 -0.61 -1.23 0.00 0.00 177.57 175.81 2hfs h GLN 268 N 1.32 -0.45 -0.54 5.19 4.15 -1.20 -2.03 115.11 121.55 2hfs h GLN 268 Ca 0.37 0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.79 2hfs h GLN 268 Cb -0.13 0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.64 2hfs h GLN 268 CO -0.09 -0.30 0.21 1.15 -1.93 0.00 0.00 178.83 177.88 2hfs h THR 269 N -0.47 1.20 -0.20 2.39 2.02 -0.73 0.17 112.91 117.29 2hfs h THR 269 Ca 0.04 -0.62 0.01 0.00 0.77 0.00 0.00 66.41 66.61 2hfs h THR 269 Cb 0.52 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 2hfs h THR 269 CO -0.20 0.25 0.12 0.00 0.37 0.00 0.00 175.52 176.05 2hfs h ARG 271 N 0.24 0.94 -0.93 0.00 3.08 -0.83 -1.93 114.38 114.95 2hfs h ARG 271 Ca 0.07 -0.33 0.14 0.00 0.07 0.00 0.00 59.98 59.93 2hfs h ARG 271 Cb -0.01 -0.07 -0.08 0.00 0.08 0.00 0.00 29.97 29.89 2hfs h ARG 271 CO -0.03 0.99 0.59 1.15 -1.07 0.00 0.00 179.97 181.60 2hfs h THR 272 N 0.80 0.85 -0.39 2.04 2.02 -0.66 -1.83 112.91 115.74 2hfs h THR 272 Ca 0.14 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 2hfs h THR 272 Cb 0.61 -0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 2hfs h THR 272 CO 0.04 0.14 0.02 -1.22 0.37 0.00 0.00 175.52 174.88 2hfs n TYR 273 N -4.59 1.38 -0.52 3.16 4.01 -0.45 -4.90 117.16 115.24 2hfs n TYR 273 Ca 0.18 -0.52 0.00 0.00 -0.16 0.00 0.00 57.90 57.40 2hfs n TYR 273 Cb 0.44 -0.39 0.00 0.00 -0.31 0.00 0.00 39.34 39.08 2hfs n TYR 273 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2hfs n GLY 274 N 0.35 0.72 3.66 2.72 0.00 -0.69 -4.28 105.19 107.67 2hfs n GLY 274 Ca 0.19 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 2hfs n GLY 274 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hfs n ALA 275 N -0.43 0.74 0.19 4.61 0.00 -0.76 -4.77 120.51 120.09 2hfs n ALA 275 Ca 0.00 0.36 0.03 0.00 0.00 0.00 0.00 53.44 53.83 2hfs n ALA 275 Cb 0.00 -2.17 0.42 0.00 0.00 0.00 0.00 19.45 17.70 2hfs n ALA 275 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2hfs h LEU 276 N 2.29 0.05 -7.00 0.00 3.38 0.07 -3.44 115.31 110.65 2hfs h LEU 276 Ca -0.44 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 57.60 2hfs h LEU 276 Cb 1.31 -0.01 -0.19 0.00 0.09 0.00 0.00 40.66 41.86 2hfs h LEU 276 CO 0.61 0.30 0.48 -0.83 0.09 0.00 0.00 178.44 179.09 2hfs s GLY 277 N -4.21 -0.40 -0.03 0.83 0.00 -1.22 -3.29 107.32 98.99 2hfs s GLY 277 Ca -0.04 1.44 -0.13 0.00 0.00 0.00 0.00 44.72 46.00 2hfs s GLY 277 CO 0.72 0.68 0.28 0.00 0.00 0.00 0.00 173.10 174.78 2hfs s ALA 278 N -2.12 -0.71 0.12 3.20 0.00 -1.26 -0.63 121.76 120.37 2hfs s ALA 278 Ca 0.00 0.38 -0.24 0.00 0.00 0.00 0.00 51.96 52.10 2hfs s ALA 278 Cb -0.01 -0.05 0.08 0.00 0.00 0.00 0.00 23.12 23.14 2hfs s ALA 278 CO -0.03 -0.23 0.69 -1.59 0.00 0.00 0.00 175.76 174.61 2hfs s LYS 279 N -1.00 1.18 0.72 0.00 -2.85 -0.47 -4.11 119.74 113.20 2hfs s LYS 279 Ca -0.11 -0.46 -0.15 0.00 -1.00 0.00 0.00 55.97 54.25 2hfs s LYS 279 Cb -0.05 0.53 0.03 0.00 -2.06 0.00 0.00 37.83 36.28 2hfs s LYS 279 CO 0.03 -0.52 1.20 -0.48 0.10 0.00 0.00 175.35 175.68 2hfs s LEU 280 N -2.69 3.34 -0.18 2.77 0.05 -1.26 -0.75 118.68 119.95 2hfs s LEU 280 Ca 0.03 2.33 -0.01 0.00 0.05 0.00 0.00 54.13 56.53 2hfs s LEU 280 Cb -0.01 -4.59 0.05 0.00 -2.05 0.00 0.00 46.19 39.59 2hfs s LEU 280 CO -0.11 -2.17 -0.04 -0.55 -0.55 0.00 0.00 176.35 172.93 2hfs s SER 281 N -2.04 3.06 0.00 1.48 0.15 0.13 -4.71 113.70 111.77 2hfs s SER 281 Ca 0.74 -0.80 0.00 0.00 0.70 0.00 0.00 55.95 56.59 2hfs s SER 281 Cb -0.29 -0.92 0.00 0.00 -1.71 0.00 0.00 66.02 63.11 2hfs s SER 281 CO 0.44 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.28 2hfs n GLY 282 N 4.86 0.99 0.35 9.45 0.00 -1.26 -4.24 105.19 115.34 2hfs n GLY 282 Ca -0.11 -1.58 -0.01 0.00 0.00 0.00 0.00 46.02 44.31 2hfs n GLY 282 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2hfs h THR 283 N 0.00 1.18 0.00 2.61 2.02 -1.94 -3.45 112.91 113.34 2hfs h THR 283 Ca 0.00 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.76 2hfs h THR 283 Cb 0.00 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.28 2hfs h THR 283 CO 0.00 0.22 0.00 0.61 0.37 0.00 0.00 175.52 176.72 2hfs n GLY 284 N -1.36 -1.77 4.41 2.16 0.00 -1.26 -4.93 105.19 102.44 2hfs n GLY 284 Ca 0.12 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 44.09 2hfs n GLY 284 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hfs n ARG 285 N 0.00 -1.18 0.00 1.61 1.74 0.16 -4.43 116.66 114.57 2hfs n ARG 285 Ca 0.00 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 2hfs n ARG 285 Cb 0.00 -4.38 0.00 0.00 -1.02 0.00 0.00 32.46 27.06 2hfs n ARG 285 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2hfs n GLY 286 N -1.64 0.62 7.00 -0.13 0.00 -1.26 -4.36 105.19 105.42 2hfs n GLY 286 Ca -0.05 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.93 2hfs n GLY 286 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hfs n GLY 287 N 0.00 1.91 3.43 -0.02 0.00 0.02 -4.84 105.19 105.68 2hfs n GLY 287 Ca 0.00 -0.49 -0.27 0.00 0.00 0.00 0.00 46.02 45.26 2hfs n GLY 287 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2hfs s ILE 288 N 0.00 2.38 0.17 -0.61 -4.36 -1.26 -0.97 121.20 116.55 2hfs s ILE 288 Ca 0.00 -2.02 0.09 0.00 -0.26 0.00 0.00 60.65 58.47 2hfs s ILE 288 Cb 0.00 -2.14 -0.04 0.00 1.25 0.00 0.00 42.46 41.53 2hfs s ILE 288 CO 0.00 -0.11 -0.14 0.00 0.24 0.00 0.00 174.94 174.92 2hfs s ALA 289 N -1.66 2.80 -0.04 2.27 0.00 -0.10 -0.69 121.76 124.33 2hfs s ALA 289 Ca 0.21 -1.47 0.04 0.00 0.00 0.00 0.00 51.96 50.74 2hfs s ALA 289 Cb -0.08 -0.64 -0.00 0.00 0.00 0.00 0.00 23.12 22.40 2hfs s ALA 289 CO 0.10 0.49 -0.17 0.54 0.00 0.00 0.00 175.76 176.72 2hfs s VAL 290 N -1.55 1.44 -0.08 0.00 0.11 0.07 -0.61 120.40 119.77 2hfs s VAL 290 Ca 0.22 -0.72 0.05 0.00 -2.93 0.00 0.00 61.98 58.60 2hfs s VAL 290 Cb -0.09 -1.24 -0.01 0.00 -1.53 0.00 0.00 36.38 33.52 2hfs s VAL 290 CO 0.13 0.41 -0.24 0.00 -3.33 0.00 0.00 175.10 172.07 2hfs s ALA 291 N 0.04 2.19 -0.21 1.54 0.00 0.69 -1.37 121.76 124.64 2hfs s ALA 291 Ca -0.04 -1.00 -0.22 0.00 0.00 0.00 0.00 51.96 50.71 2hfs s ALA 291 Cb -0.12 -0.77 -0.02 0.00 0.00 0.00 0.00 23.12 22.21 2hfs s ALA 291 CO 0.02 0.34 0.68 -1.17 0.00 0.00 0.00 175.76 175.63 2hfs s LEU 292 N 0.12 4.13 0.14 0.00 2.96 0.20 -1.20 118.68 125.04 2hfs s LEU 292 Ca -0.12 0.88 0.04 0.00 -0.22 0.00 0.00 54.13 54.71 2hfs s LEU 292 Cb -0.16 -2.96 -0.04 0.00 0.50 0.00 0.00 46.19 43.53 2hfs s LEU 292 CO 0.07 -0.33 0.16 0.00 -1.32 0.00 0.00 176.35 174.93 2hfs s ALA 293 N 2.14 3.67 -0.50 5.97 0.00 -0.18 0.81 121.76 133.69 2hfs s ALA 293 Ca 0.30 -1.13 0.26 0.00 0.00 0.00 0.00 51.96 51.39 2hfs s ALA 293 Cb -0.16 -1.49 0.88 0.00 0.00 0.00 0.00 23.12 22.36 2hfs s ALA 293 CO 0.10 0.56 1.76 0.00 0.00 0.00 0.00 175.76 178.18 2hfs h ALA 294 N 2.51 1.00 -2.57 0.00 0.00 -1.86 -3.38 119.26 114.97 2hfs h ALA 294 Ca -0.48 0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.54 2hfs h ALA 294 Cb 1.19 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.88 2hfs h ALA 294 CO 0.65 0.00 0.39 -1.54 0.00 0.00 0.00 179.25 178.75 2hfs s SER 295 N -4.81 -0.31 0.23 0.00 1.04 -1.26 -4.97 113.70 103.63 2hfs s SER 295 Ca 0.07 -0.28 -0.06 0.00 0.48 0.00 0.00 55.95 56.16 2hfs s SER 295 Cb 0.10 0.53 0.40 0.00 0.10 0.00 0.00 66.02 67.15 2hfs s SER 295 CO 0.53 -0.93 1.72 -1.28 0.98 0.00 0.00 173.24 174.25 2hfs h SER 296 N 2.00 0.16 -0.31 7.02 0.87 -1.95 -1.87 113.55 119.47 2hfs h SER 296 Ca -0.24 0.11 -0.16 0.00 -1.23 0.00 0.00 61.79 60.27 2hfs h SER 296 Cb 1.25 0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 63.32 2hfs h SER 296 CO 0.28 0.06 -0.41 0.44 -0.53 0.00 0.00 176.83 176.67 2hfs h ASP 297 N 0.36 0.94 0.77 6.23 3.32 -2.01 -2.52 116.42 123.52 2hfs h ASP 297 Ca 0.38 -0.44 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2hfs h ASP 297 Cb 0.58 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2hfs h ASP 297 CO -0.41 1.22 0.00 1.56 -1.72 0.00 0.00 179.24 179.88 2hfs h GLN 298 N 0.71 0.00 -0.20 3.56 4.20 -1.84 -1.79 115.11 119.75 2hfs h GLN 298 Ca 0.05 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.56 2hfs h GLN 298 Cb 0.99 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.78 2hfs h GLN 298 CO 0.10 0.00 -0.66 -0.09 -0.67 0.00 0.00 178.83 177.50 2hfs h ARG 299 N 0.00 0.81 -0.98 1.46 2.43 -0.92 -3.10 114.38 114.08 2hfs h ARG 299 Ca 0.00 -0.60 0.14 0.00 -0.81 0.00 0.00 59.98 58.72 2hfs h ARG 299 Cb 0.38 0.10 -0.09 0.00 -0.42 0.00 0.00 29.97 29.95 2hfs h ARG 299 CO 0.00 1.21 0.60 -0.44 -1.51 0.00 0.00 179.97 179.84 2hfs h ASP 300 N 0.55 0.84 0.57 -3.80 3.32 -1.09 -0.41 116.42 116.41 2hfs h ASP 300 Ca -0.03 0.07 -0.19 0.00 0.02 0.00 0.00 57.03 56.90 2hfs h ASP 300 Cb 1.28 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 2hfs h ASP 300 CO 0.14 0.40 -0.84 0.00 -1.72 0.00 0.00 179.24 177.23 2hfs h ALA 301 N 1.57 0.57 -0.13 3.45 0.00 -1.60 -1.53 119.26 121.60 2hfs h ALA 301 Ca 0.52 -0.70 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2hfs h ALA 301 Cb 0.62 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2hfs h ALA 301 CO -0.31 0.90 0.02 0.82 0.00 0.00 0.00 179.25 180.68 2hfs h ILE 302 N 0.11 1.22 -0.08 0.00 2.04 -1.13 0.85 117.51 120.51 2hfs h ILE 302 Ca -0.04 -0.69 0.01 0.00 1.00 0.00 0.00 64.86 65.15 2hfs h ILE 302 Cb 1.45 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.95 2hfs h ILE 302 CO 0.13 0.20 0.02 0.58 0.00 0.00 0.00 178.15 179.08 2hfs h VAL 303 N -0.01 0.98 -0.44 1.67 2.07 -1.11 -0.15 116.25 119.26 2hfs h VAL 303 Ca 0.04 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.63 2hfs h VAL 303 Cb 0.29 0.91 -0.09 0.00 -1.52 0.00 0.00 31.29 30.88 2hfs h VAL 303 CO 0.00 0.01 -0.14 0.50 0.02 0.00 0.00 177.57 177.96 2hfs h LYS 304 N 0.06 -0.04 -0.32 1.57 3.64 -1.23 -1.67 116.57 118.58 2hfs h LYS 304 Ca 0.04 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2hfs h LYS 304 Cb 0.02 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 2hfs h LYS 304 CO -0.04 -0.03 0.20 0.78 -2.27 0.00 0.00 179.45 178.08 2hfs h GLY 305 N -0.05 0.47 0.80 5.01 0.00 -0.40 -1.70 103.07 107.20 2hfs h GLY 305 Ca 0.21 -0.19 0.03 0.00 0.00 0.00 0.00 47.33 47.38 2hfs h GLY 305 CO -0.48 0.19 0.27 1.41 0.00 0.00 0.00 176.54 177.93 2hfs h LEU 306 N 0.42 0.41 -0.86 3.11 3.38 -0.77 0.24 115.31 121.24 2hfs h LEU 306 Ca 0.12 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2hfs h LEU 306 Cb 0.01 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2hfs h LEU 306 CO -0.02 0.29 0.42 0.11 0.09 0.00 0.00 178.44 179.32 2hfs h LYS 307 N 0.53 1.23 0.01 1.13 1.57 -1.23 0.32 116.57 120.13 2hfs h LYS 307 Ca 0.21 -0.18 -0.23 0.00 -1.87 0.00 0.00 60.65 58.58 2hfs h LYS 307 Cb 0.08 -0.22 0.02 0.00 0.08 0.00 0.00 32.23 32.18 2hfs h LYS 307 CO -0.12 0.94 -0.92 0.00 -0.57 0.00 0.00 179.45 178.78 2hfs h ALA 308 N 1.23 0.10 0.00 3.86 0.00 -0.95 -3.41 119.26 120.09 2hfs h ALA 308 Ca 0.30 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2hfs h ALA 308 Cb 0.11 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2hfs h ALA 308 CO -0.04 0.58 -0.51 1.63 0.00 0.00 0.00 179.25 180.91 2hfs n LYS 309 N -3.97 3.90 -3.77 0.00 4.76 0.81 -4.88 118.16 115.00 2hfs n LYS 309 Ca -0.11 -0.01 -0.29 0.00 -2.87 0.00 0.00 58.31 55.02 2hfs n LYS 309 Cb 0.82 -0.84 -0.13 0.00 -1.84 0.00 0.00 35.03 33.04 2hfs n LYS 309 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2hfs h PRO 311 N 6.47 0.00 0.00 0.00 0.13 -1.89 -1.61 132.00 135.10 2hfs h PRO 311 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2hfs h PRO 311 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2hfs h PRO 311 CO 0.55 0.06 0.00 0.39 -0.23 0.00 0.00 178.00 178.77 2hfs n GLU 312 N -3.60 0.15 -2.86 0.86 4.71 -1.26 -4.29 120.64 114.35 2hfs n GLU 312 Ca -0.02 0.44 -0.44 0.00 -0.01 0.00 0.00 57.16 57.13 2hfs n GLU 312 Cb 0.17 -1.82 -0.00 0.00 -1.01 0.00 0.00 31.44 28.78 2hfs n GLU 312 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2hfs s ALA 313 N -3.30 3.83 0.23 0.62 0.00 -0.61 -4.56 121.76 117.97 2hfs s ALA 313 Ca 0.03 -3.25 -0.01 0.00 0.00 0.00 0.00 51.96 48.73 2hfs s ALA 313 Cb 0.08 -4.26 0.25 0.00 0.00 0.00 0.00 23.12 19.20 2hfs s ALA 313 CO 0.32 -2.91 1.63 0.87 0.00 0.00 0.00 175.76 175.68 2hfs h LYS 314 N 7.27 0.59 -4.25 0.00 1.79 -1.65 -3.43 116.57 116.90 2hfs h LYS 314 Ca 0.35 -0.27 -0.37 0.00 -2.18 0.00 0.00 60.65 58.18 2hfs h LYS 314 Cb 0.87 -0.01 -0.31 0.00 -1.58 0.00 0.00 32.23 31.20 2hfs h LYS 314 CO 1.30 0.84 -0.77 -0.06 -1.08 0.00 0.00 179.45 179.68 2hfs s PHE 315 N -4.38 0.63 -0.08 -1.35 0.40 -0.97 -4.99 117.98 107.25 2hfs s PHE 315 Ca -0.08 -0.14 -0.01 0.00 -0.60 0.00 0.00 56.93 56.11 2hfs s PHE 315 Cb 0.13 -0.49 0.03 0.00 0.51 0.00 0.00 43.02 43.19 2hfs s PHE 315 CO 0.82 -0.09 -0.03 0.42 0.70 0.00 0.00 175.22 177.04 2hfs s ILE 316 N 0.32 0.62 0.06 0.64 1.01 -1.26 -0.74 121.20 121.85 2hfs s ILE 316 Ca -0.04 -0.05 0.08 0.00 0.00 0.00 0.00 60.65 60.64 2hfs s ILE 316 Cb -0.08 -0.71 -0.03 0.00 0.01 0.00 0.00 42.46 41.66 2hfs s ILE 316 CO -0.00 0.29 -0.21 0.26 0.00 0.00 0.00 174.94 175.28 2hfs s TRP 317 N 1.72 1.86 -0.39 3.97 0.51 -0.48 -5.00 118.94 121.12 2hfs s TRP 317 Ca 0.02 -0.39 -0.12 0.00 -2.12 0.00 0.00 56.10 53.50 2hfs s TRP 317 Cb -0.13 -1.09 0.03 0.00 -0.81 0.00 0.00 33.47 31.48 2hfs s TRP 317 CO -0.05 0.12 0.24 1.03 -0.51 0.00 0.00 176.95 177.78 2hfs s ARG 318 N -1.34 2.84 0.19 4.98 0.52 -1.26 -1.67 118.95 123.21 2hfs s ARG 318 Ca 0.08 -1.11 0.10 0.00 -0.52 0.00 0.00 55.73 54.27 2hfs s ARG 318 Cb -0.09 -3.82 -0.04 0.00 0.52 0.00 0.00 34.95 31.52 2hfs s ARG 318 CO 0.02 -0.75 -0.20 0.71 0.02 0.00 0.00 175.30 175.10 2hfs s TYR 319 N 1.58 2.02 0.05 -0.53 4.12 -0.73 -5.01 117.35 118.85 2hfs s TYR 319 Ca 0.03 -0.42 0.02 0.00 0.02 0.00 0.00 57.07 56.72 2hfs s TYR 319 Cb -0.20 -0.99 -0.03 0.00 -1.52 0.00 0.00 41.96 39.23 2hfs s TYR 319 CO 0.07 0.43 -0.08 0.95 0.02 0.00 0.00 175.55 176.94 2hfs s THR 320 N -2.02 0.60 -0.25 -0.71 -4.23 -1.26 -0.12 115.64 107.65 2hfs s THR 320 Ca 0.19 -1.23 -0.04 0.00 -1.18 0.00 0.00 61.69 59.44 2hfs s THR 320 Cb -0.06 -0.80 0.01 0.00 1.34 0.00 0.00 72.50 72.98 2hfs s THR 320 CO 0.09 -0.45 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.00 2hfs s VAL 321 N -1.73 3.32 0.30 2.29 1.01 -0.40 -0.61 120.40 124.59 2hfs s VAL 321 Ca -0.06 -0.74 -0.29 0.00 0.00 0.00 0.00 61.98 60.89 2hfs s VAL 321 Cb -0.08 -2.62 -0.10 0.00 0.00 0.00 0.00 36.38 33.58 2hfs s VAL 321 CO -0.00 0.26 1.21 -1.58 0.00 0.00 0.00 175.10 174.99 2hfs s GLN 322 N 1.43 4.48 0.35 2.72 0.74 -1.26 -1.69 119.66 126.42 2hfs s GLN 322 Ca 0.03 2.03 -0.29 0.00 0.05 0.00 0.00 55.36 57.18 2hfs s GLN 322 Cb -0.16 -3.13 -0.11 0.00 1.10 0.00 0.00 33.01 30.71 2hfs s GLN 322 CO -0.02 -0.01 1.49 -2.30 -0.55 0.00 0.00 175.29 173.89 2hfs n PRO 323 N 1.06 2.59 -3.70 1.67 -0.02 -1.26 -4.75 135.00 130.58 2hfs n PRO 323 Ca -0.00 0.91 -0.11 0.00 -2.02 0.00 0.00 63.50 62.28 2hfs n PRO 323 Cb 0.43 -2.63 -0.12 0.00 -0.02 0.00 0.00 33.50 31.16 2hfs n PRO 323 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2hfs s SER 324 N 0.02 -0.33 -0.52 2.55 0.15 0.28 -4.99 113.70 110.86 2hfs s SER 324 Ca 0.57 0.73 -0.07 0.00 0.70 0.00 0.00 55.95 57.88 2hfs s SER 324 Cb -0.50 0.66 -0.20 0.00 -1.71 0.00 0.00 66.02 64.27 2hfs s SER 324 CO 0.59 -0.19 3.29 0.00 1.20 0.00 0.00 173.24 178.13 2hfs n ALA 325 N 4.42 6.52 -0.88 5.45 0.00 -1.26 -1.12 120.51 133.65 2hfs n ALA 325 Ca -0.22 -2.29 0.00 0.00 0.00 0.00 0.00 53.44 50.94 2hfs n ALA 325 Cb 0.53 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.33 2hfs n ALA 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50