#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1br2 n VAL 35 N 0.00 0.00 -3.81 1.96 3.14 0.42 -4.42 118.33 115.62 1br2 n VAL 35 Ca 0.00 -1.49 -0.36 0.00 -2.96 0.00 0.00 64.34 59.53 1br2 n VAL 35 Cb 0.00 1.08 -0.13 0.00 -1.06 0.00 0.00 33.84 33.73 1br2 n VAL 35 CO 0.00 0.00 0.00 0.26 -6.46 0.00 0.00 176.83 170.63 1br2 s TRP 36 N -2.52 3.05 0.07 1.45 0.52 0.11 -0.15 118.94 121.47 1br2 s TRP 36 Ca 0.24 -0.68 0.10 0.00 0.02 0.00 0.00 56.10 55.78 1br2 s TRP 36 Cb -0.03 -2.19 -0.03 0.00 -1.15 0.00 0.00 33.47 30.07 1br2 s TRP 36 CO 0.18 -0.46 -0.26 0.14 0.02 0.00 0.00 176.95 176.57 1br2 s VAL 37 N 1.55 2.24 0.87 4.03 -7.23 0.11 -0.96 120.40 121.01 1br2 s VAL 37 Ca 0.06 -1.48 -0.13 0.00 -1.81 0.00 0.00 61.98 58.62 1br2 s VAL 37 Cb -0.15 -1.92 0.06 0.00 0.56 0.00 0.00 36.38 34.93 1br2 s VAL 37 CO 0.01 0.28 0.78 -0.81 -0.31 0.00 0.00 175.10 175.05 1br2 n PRO 38 N 1.49 -0.11 -3.56 4.82 -0.04 -1.26 0.88 135.00 137.22 1br2 n PRO 38 Ca -0.17 0.03 -0.13 0.00 -0.04 0.00 0.00 63.50 63.19 1br2 n PRO 38 Cb 0.52 -2.10 -0.05 0.00 -0.04 0.00 0.00 33.50 31.83 1br2 n PRO 38 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1br2 s SER 39 N -2.07 -0.42 -0.15 3.54 0.15 -0.47 -4.49 113.70 109.79 1br2 s SER 39 Ca 0.64 0.04 -0.22 0.00 0.70 0.00 0.00 55.95 57.12 1br2 s SER 39 Cb -0.26 0.51 -0.19 0.00 -1.71 0.00 0.00 66.02 64.37 1br2 s SER 39 CO 0.60 -0.79 0.48 -0.33 1.20 0.00 0.00 173.24 174.39 1br2 h GLU 40 N 2.55 0.00 -0.49 5.44 5.08 -1.97 -3.35 114.58 121.84 1br2 h GLU 40 Ca -0.32 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.05 1br2 h GLU 40 Cb 1.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1br2 h GLU 40 CO 0.42 0.78 0.31 0.87 -1.00 0.00 0.00 179.01 180.39 1br2 h LYS 41 N -1.00 0.61 -5.45 2.33 1.79 -1.98 -3.42 116.57 109.45 1br2 h LYS 41 Ca -0.07 -0.04 -0.50 0.00 -2.18 0.00 0.00 60.65 57.86 1br2 h LYS 41 Cb 0.87 -0.14 -0.28 0.00 -1.58 0.00 0.00 32.23 31.10 1br2 h LYS 41 CO -0.04 0.41 -0.82 -1.01 -1.08 0.00 0.00 179.45 176.91 1br2 s HIS 42 N -6.15 1.38 0.30 -1.35 3.76 -1.26 -4.66 115.29 107.30 1br2 s HIS 42 Ca -0.13 -0.28 0.02 0.00 -0.15 0.00 0.00 55.06 54.52 1br2 s HIS 42 Cb 0.12 -0.87 0.74 0.00 1.11 0.00 0.00 32.58 33.67 1br2 s HIS 42 CO 0.74 -0.01 1.50 0.41 -0.85 0.00 0.00 174.74 176.53 1br2 n GLY 43 N 2.55 -1.30 3.12 -2.22 0.00 -1.26 -3.27 105.19 102.83 1br2 n GLY 43 Ca -0.15 0.94 -0.08 0.00 0.00 0.00 0.00 46.02 46.72 1br2 n GLY 43 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1br2 s PHE 44 N -5.94 0.67 0.04 1.61 0.40 -1.26 -1.37 117.98 112.12 1br2 s PHE 44 Ca -0.12 -1.05 0.02 0.00 -0.60 0.00 0.00 56.93 55.18 1br2 s PHE 44 Cb 0.28 -0.44 -0.02 0.00 0.51 0.00 0.00 43.02 43.35 1br2 s PHE 44 CO 0.75 -0.34 -0.08 -2.00 0.70 0.00 0.00 175.22 174.25 1br2 s GLU 45 N -3.92 0.53 0.02 0.44 2.12 0.25 -4.77 118.70 113.38 1br2 s GLU 45 Ca 0.11 -0.73 -0.29 0.00 0.36 0.00 0.00 54.97 54.42 1br2 s GLU 45 Cb 0.07 -0.32 -0.04 0.00 0.26 0.00 0.00 34.13 34.11 1br2 s GLU 45 CO -0.07 0.06 0.94 0.00 -0.54 0.00 0.00 175.26 175.64 1br2 s ALA 46 N -1.29 3.20 -0.14 6.30 0.00 -1.26 0.07 121.76 128.65 1br2 s ALA 46 Ca -0.09 0.49 -0.13 0.00 0.00 0.00 0.00 51.96 52.23 1br2 s ALA 46 Cb -0.09 -3.27 0.04 0.00 0.00 0.00 0.00 23.12 19.79 1br2 s ALA 46 CO 0.00 -0.16 0.37 0.00 0.00 0.00 0.00 175.76 175.97 1br2 s ALA 47 N 0.75 -0.92 0.04 0.00 0.00 0.79 -1.96 121.76 120.46 1br2 s ALA 47 Ca 0.49 1.03 -0.18 0.00 0.00 0.00 0.00 51.96 53.30 1br2 s ALA 47 Cb -0.21 -0.59 -0.06 0.00 0.00 0.00 0.00 23.12 22.26 1br2 s ALA 47 CO 0.27 -0.18 0.52 -1.12 0.00 0.00 0.00 175.76 175.25 1br2 s SER 48 N 0.14 6.98 1.09 0.00 0.01 -1.17 0.16 113.70 120.91 1br2 s SER 48 Ca -0.00 1.16 -0.12 0.00 1.31 0.00 0.00 55.95 58.29 1br2 s SER 48 Cb -0.03 -2.33 0.24 0.00 0.21 0.00 0.00 66.02 64.12 1br2 s SER 48 CO 0.01 0.27 1.06 -0.63 0.41 0.00 0.00 173.24 174.36 1br2 s ILE 49 N -1.01 2.08 0.00 1.44 -1.09 -1.26 -1.65 121.20 119.71 1br2 s ILE 49 Ca 0.27 0.03 0.00 0.00 -2.23 0.00 0.00 60.65 58.72 1br2 s ILE 49 Cb -0.19 -2.18 0.00 0.00 -1.58 0.00 0.00 42.46 38.51 1br2 s ILE 49 CO 0.17 -0.04 0.00 1.21 -1.23 0.00 0.00 174.94 175.06 1br2 n GLU 56 N -4.66 0.00 -4.14 2.79 4.07 -1.26 -4.38 120.64 113.06 1br2 n GLU 56 Ca 0.05 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 56.99 1br2 n GLU 56 Cb 0.55 0.00 -0.12 0.00 -0.06 0.00 0.00 31.44 31.80 1br2 n GLU 56 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1br2 s VAL 57 N 0.00 0.70 -0.27 6.31 1.01 0.31 -4.71 120.40 123.75 1br2 s VAL 57 Ca 0.00 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.03 1br2 s VAL 57 Cb 0.00 -0.71 0.07 0.00 0.00 0.00 0.00 36.38 35.74 1br2 s VAL 57 CO 0.00 -0.23 -0.08 -0.89 0.00 0.00 0.00 175.10 173.90 1br2 s THR 58 N -1.10 2.14 0.38 3.92 2.01 -1.26 0.64 115.64 122.37 1br2 s THR 58 Ca -0.05 -1.72 0.03 0.00 0.31 0.00 0.00 61.69 60.26 1br2 s THR 58 Cb -0.09 -2.31 0.03 0.00 0.01 0.00 0.00 72.50 70.15 1br2 s THR 58 CO 0.01 -0.13 0.25 1.33 -0.69 0.00 0.00 174.62 175.39 1br2 n VAL 59 N 4.42 0.00 -3.66 3.82 0.24 0.30 -4.74 118.33 118.71 1br2 n VAL 59 Ca -0.11 -1.55 -0.26 0.00 -2.04 0.00 0.00 64.34 60.38 1br2 n VAL 59 Cb 0.42 -0.10 -0.17 0.00 -1.47 0.00 0.00 33.84 32.52 1br2 n VAL 59 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1br2 s GLU 60 N -3.54 0.24 0.31 7.34 -1.05 -0.66 -0.18 118.70 121.15 1br2 s GLU 60 Ca 0.19 -0.11 -0.29 0.00 -0.15 0.00 0.00 54.97 54.61 1br2 s GLU 60 Cb -0.02 -1.71 -0.13 0.00 -0.44 0.00 0.00 34.13 31.84 1br2 s GLU 60 CO 0.12 -0.60 1.33 1.28 0.95 0.00 0.00 175.26 178.34 1br2 n LEU 61 N 5.21 3.40 0.16 1.83 4.77 -1.02 -3.03 117.00 128.32 1br2 n LEU 61 Ca -0.07 1.18 0.04 0.00 -0.03 0.00 0.00 56.01 57.13 1br2 n LEU 61 Cb 0.49 -1.47 0.15 0.00 -2.33 0.00 0.00 43.42 40.27 1br2 n LEU 61 CO 0.10 -0.48 0.56 0.06 -1.33 0.00 0.00 177.39 176.30 1br2 h GLN 62 N 3.17 0.00 0.00 3.23 -0.00 -1.72 0.76 115.11 120.54 1br2 h GLN 62 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.19 1br2 h GLN 62 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.76 1br2 h GLN 62 CO 0.67 0.44 0.00 -0.85 -0.00 0.00 0.00 178.83 179.09 1br2 n GLU 63 N -3.32 0.00 -0.32 0.06 0.28 -1.26 -4.36 120.64 111.72 1br2 n GLU 63 Ca 0.01 0.17 -0.02 0.00 -0.16 0.00 0.00 57.16 57.16 1br2 n GLU 63 Cb 0.64 -0.65 0.11 0.00 1.43 0.00 0.00 31.44 32.98 1br2 n GLU 63 CO 0.00 0.00 0.00 -2.95 -0.16 0.00 0.00 177.13 174.02 1br2 h ASN 64 N 0.00 0.94 0.00 -1.84 -1.07 -1.97 -3.45 115.58 108.19 1br2 h ASN 64 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 56.30 56.36 1br2 h ASN 64 Cb 0.00 -0.21 0.00 0.00 -2.07 0.00 0.00 38.32 36.04 1br2 h ASN 64 CO 0.00 0.65 0.00 0.61 0.07 0.00 0.00 177.43 178.76 1br2 n GLY 65 N -1.34 3.01 3.61 9.14 0.00 0.26 -4.98 105.19 114.89 1br2 n GLY 65 Ca 0.11 0.00 -0.59 0.00 0.00 0.00 0.00 46.02 45.54 1br2 n GLY 65 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1br2 n LYS 66 N -0.62 0.77 -2.37 1.61 -0.00 -1.26 -4.03 118.16 112.27 1br2 n LYS 66 Ca 0.00 0.26 -0.42 0.00 -0.00 0.00 0.00 58.31 58.16 1br2 n LYS 66 Cb 0.00 -1.97 -0.03 0.00 -0.00 0.00 0.00 35.03 33.03 1br2 n LYS 66 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1br2 s LYS 67 N 4.28 4.44 0.24 -1.58 2.20 -1.26 -2.43 119.74 125.62 1br2 s LYS 67 Ca 1.05 1.85 0.07 0.00 -0.36 0.00 0.00 55.97 58.58 1br2 s LYS 67 Cb -1.17 -3.29 -0.05 0.00 -1.51 0.00 0.00 37.83 31.80 1br2 s LYS 67 CO 0.66 -0.23 -0.11 0.54 -0.36 0.00 0.00 175.35 175.86 1br2 s VAL 68 N 0.68 1.68 -0.29 4.02 0.11 0.74 -4.96 120.40 122.38 1br2 s VAL 68 Ca 0.58 -2.17 0.01 0.00 -2.93 0.00 0.00 61.98 57.46 1br2 s VAL 68 Cb -0.32 -2.22 0.09 0.00 -1.53 0.00 0.00 36.38 32.40 1br2 s VAL 68 CO 0.32 -0.47 0.05 -0.89 -3.33 0.00 0.00 175.10 170.78 1br2 s THR 69 N -3.00 1.34 0.26 5.04 2.01 -1.26 -0.54 115.64 119.48 1br2 s THR 69 Ca 0.26 -1.54 0.11 0.00 0.31 0.00 0.00 61.69 60.82 1br2 s THR 69 Cb 0.01 -1.90 -0.05 0.00 0.01 0.00 0.00 72.50 70.57 1br2 s THR 69 CO 0.09 -0.51 -0.18 -1.48 -0.69 0.00 0.00 174.62 171.85 1br2 s LEU 70 N 1.41 2.58 1.06 4.42 0.05 0.21 -4.91 118.68 123.50 1br2 s LEU 70 Ca 0.06 -1.03 -0.17 0.00 0.05 0.00 0.00 54.13 53.05 1br2 s LEU 70 Cb -0.18 -0.97 0.08 0.00 -2.05 0.00 0.00 46.19 43.07 1br2 s LEU 70 CO -0.16 -0.02 0.12 -0.24 -0.55 0.00 0.00 176.35 175.50 1br2 n SER 71 N -0.55 -2.31 -0.04 1.48 2.88 -1.26 0.12 113.62 113.94 1br2 n SER 71 Ca -0.06 0.03 -0.14 0.00 -1.33 0.00 0.00 58.87 57.37 1br2 n SER 71 Cb 0.60 -1.04 -0.11 0.00 -0.75 0.00 0.00 64.21 62.91 1br2 n SER 71 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 1br2 h LYS 72 N -1.89 0.07 0.00 -1.46 -0.00 -1.91 -3.17 116.57 108.21 1br2 h LYS 72 Ca -0.50 -0.07 0.00 0.00 -0.00 0.00 0.00 60.65 60.08 1br2 h LYS 72 Cb 1.33 0.02 0.00 0.00 -0.00 0.00 0.00 32.23 33.58 1br2 h LYS 72 CO 0.37 0.79 0.10 -0.40 -0.00 0.00 0.00 179.45 180.31 1br2 n ASP 73 N -4.66 0.06 0.13 7.07 5.75 -1.26 -0.45 116.55 123.19 1br2 n ASP 73 Ca -0.09 0.44 0.12 0.00 -0.01 0.00 0.00 54.79 55.24 1br2 n ASP 73 Cb 0.40 -0.44 0.04 0.00 -1.03 0.00 0.00 41.12 40.10 1br2 n ASP 73 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 1br2 h ASP 74 N 0.00 0.00 -3.59 -1.12 3.32 -1.90 -3.46 116.42 109.67 1br2 h ASP 74 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1br2 h ASP 74 Cb 0.21 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 1br2 h ASP 74 CO 0.00 0.00 0.15 -0.63 -1.72 0.00 0.00 179.24 177.05 1br2 s ILE 75 N -3.32 4.47 -0.02 0.35 1.01 0.41 -4.12 121.20 119.98 1br2 s ILE 75 Ca 0.01 1.46 0.02 0.00 0.00 0.00 0.00 60.65 62.14 1br2 s ILE 75 Cb 0.08 -3.95 0.01 0.00 0.01 0.00 0.00 42.46 38.61 1br2 s ILE 75 CO 0.76 0.29 -0.06 -1.10 0.00 0.00 0.00 174.94 174.83 1br2 s GLN 76 N -1.75 0.67 0.28 2.79 -0.21 -0.14 -4.99 119.66 116.31 1br2 s GLN 76 Ca 0.42 -0.19 -0.29 0.00 0.02 0.00 0.00 55.36 55.32 1br2 s GLN 76 Cb -0.19 -0.66 -0.10 0.00 1.00 0.00 0.00 33.01 33.07 1br2 s GLN 76 CO 0.23 0.05 1.26 0.15 -2.12 0.00 0.00 175.29 174.85 1br2 s LYS 77 N 0.29 4.44 0.85 2.91 3.01 -1.26 0.10 119.74 130.07 1br2 s LYS 77 Ca -0.04 2.06 -0.12 0.00 -1.01 0.00 0.00 55.97 56.86 1br2 s LYS 77 Cb -0.08 -3.14 0.12 0.00 -1.01 0.00 0.00 37.83 33.73 1br2 s LYS 77 CO -0.00 -0.11 1.20 -1.64 0.51 0.00 0.00 175.35 175.32 1br2 s MET 78 N -1.18 1.48 0.25 1.68 -1.94 -1.26 -4.77 119.30 113.57 1br2 s MET 78 Ca 0.50 -0.19 0.11 0.00 -1.71 0.00 0.00 55.69 54.41 1br2 s MET 78 Cb -0.37 -1.96 -0.05 0.00 2.01 0.00 0.00 34.83 34.47 1br2 s MET 78 CO 0.45 -1.85 -0.19 -0.80 -0.01 0.00 0.00 175.02 172.62 1br2 s ASN 79 N -4.70 3.67 0.76 3.03 0.01 -1.26 -4.85 114.94 111.60 1br2 s ASN 79 Ca 0.66 -0.92 -0.14 0.00 -0.71 0.00 0.00 52.86 51.75 1br2 s ASN 79 Cb -0.08 -0.36 0.05 0.00 0.41 0.00 0.00 41.25 41.27 1br2 s ASN 79 CO 0.50 0.06 1.21 -2.84 -1.51 0.00 0.00 177.10 174.52 1br2 s PRO 80 N -3.25 1.97 0.67 -0.60 0.02 -1.26 -4.85 135.00 127.70 1br2 s PRO 80 Ca 0.27 1.76 0.35 0.00 0.02 0.00 0.00 61.00 63.40 1br2 s PRO 80 Cb -0.06 -1.81 1.93 0.00 0.02 0.00 0.00 34.50 34.57 1br2 s PRO 80 CO 0.14 -1.97 2.09 -1.35 -0.33 0.00 0.00 177.00 175.58 1br2 h PRO 81 N -0.51 0.00 0.00 5.54 0.11 -2.02 -0.93 132.00 134.18 1br2 h PRO 81 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1br2 h PRO 81 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1br2 h PRO 81 CO 0.48 0.00 0.00 1.57 -0.21 0.00 0.00 178.00 179.84 1br2 h LYS 82 N 0.00 0.00 -0.76 1.05 2.10 -2.06 -1.66 116.57 115.24 1br2 h LYS 82 Ca 0.00 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.50 1br2 h LYS 82 Cb 0.43 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 31.67 1br2 h LYS 82 CO -0.00 0.00 0.19 1.19 -2.00 0.00 0.00 179.45 178.83 1br2 n PHE 83 N -2.87 2.10 -1.82 0.07 3.72 -0.35 -4.95 117.46 113.36 1br2 n PHE 83 Ca -0.02 -0.98 -0.43 0.00 -0.05 0.00 0.00 57.45 55.97 1br2 n PHE 83 Cb 0.07 -0.59 -0.03 0.00 -0.94 0.00 0.00 39.48 37.99 1br2 n PHE 83 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1br2 s SER 84 N -0.78 6.15 -1.17 4.37 0.15 -0.63 -3.11 113.70 118.68 1br2 s SER 84 Ca 0.48 2.06 -0.05 0.00 0.70 0.00 0.00 55.95 59.15 1br2 s SER 84 Cb 0.38 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 62.14 1br2 s SER 84 CO 0.12 -1.38 0.87 0.29 1.20 0.00 0.00 173.24 174.35 1br2 n LYS 85 N 7.91 -4.07 -1.98 5.44 5.02 -1.26 -4.94 118.16 124.27 1br2 n LYS 85 Ca 0.22 0.74 -0.41 0.00 -2.02 0.00 0.00 58.31 56.85 1br2 n LYS 85 Cb 0.44 -5.45 -0.02 0.00 -0.02 0.00 0.00 35.03 29.98 1br2 n LYS 85 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1br2 s VAL 86 N -3.46 2.47 0.16 -0.18 -7.23 -1.18 -4.89 120.40 106.08 1br2 s VAL 86 Ca 0.21 0.45 0.15 0.00 -1.81 0.00 0.00 61.98 60.99 1br2 s VAL 86 Cb -0.04 -3.29 0.06 0.00 0.56 0.00 0.00 36.38 33.67 1br2 s VAL 86 CO 0.77 0.10 1.64 -0.33 -0.31 0.00 0.00 175.10 176.97 1br2 h GLU 87 N 3.65 0.00 -4.02 4.82 5.08 -1.92 -3.40 114.58 118.79 1br2 h GLU 87 Ca -0.49 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.29 1br2 h GLU 87 Cb 1.23 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 30.09 1br2 h GLU 87 CO 0.68 0.50 -0.77 0.34 -1.00 0.00 0.00 179.01 178.76 1br2 s ASP 88 N -6.57 3.70 0.00 1.42 -1.08 -1.25 0.12 116.67 113.01 1br2 s ASP 88 Ca 0.00 -1.23 0.11 0.00 -0.52 0.00 0.00 52.55 50.91 1br2 s ASP 88 Cb 0.11 -1.00 0.55 0.00 -1.46 0.00 0.00 42.92 41.13 1br2 s ASP 88 CO 0.72 -0.30 1.27 0.23 0.52 0.00 0.00 175.17 177.62 1br2 n MET 89 N 4.77 0.14 0.21 4.34 2.81 -0.88 -0.89 117.12 127.62 1br2 n MET 89 Ca -0.08 0.20 0.07 0.00 -1.81 0.00 0.00 57.70 56.07 1br2 n MET 89 Cb 0.44 -1.50 0.42 0.00 -0.71 0.00 0.00 33.22 31.88 1br2 n MET 89 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1br2 h ALA 90 N 2.51 1.09 -0.51 3.04 0.00 -1.91 -2.82 119.26 120.66 1br2 h ALA 90 Ca 0.00 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 1br2 h ALA 90 Cb 0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1br2 h ALA 90 CO 0.00 0.38 0.06 0.93 0.00 0.00 0.00 179.25 180.62 1br2 h GLU 91 N 0.00 0.82 -5.92 0.00 3.07 -1.42 -3.46 114.58 107.67 1br2 h GLU 91 Ca -0.00 -0.20 -0.73 0.00 -0.50 0.00 0.00 59.36 57.93 1br2 h GLU 91 Cb 0.75 -0.11 0.07 0.00 -0.84 0.00 0.00 28.75 28.63 1br2 h GLU 91 CO 0.04 0.78 -0.16 1.28 -1.40 0.00 0.00 179.01 179.55 1br2 n LEU 92 N -4.24 -0.48 -0.20 1.33 4.77 -1.07 -4.85 117.00 112.26 1br2 n LEU 92 Ca 0.03 1.13 -0.10 0.00 -0.03 0.00 0.00 56.01 57.05 1br2 n LEU 92 Cb 0.27 -0.92 0.02 0.00 -2.33 0.00 0.00 43.42 40.46 1br2 n LEU 92 CO 0.41 -2.29 0.79 0.74 -1.33 0.00 0.00 177.39 175.71 1br2 h THR 93 N 2.20 1.27 -3.23 -5.08 2.02 -1.90 -3.40 112.91 104.78 1br2 h THR 93 Ca -0.42 -1.20 -0.67 0.00 0.77 0.00 0.00 66.41 64.89 1br2 h THR 93 Cb 1.41 0.87 -0.33 0.00 -1.74 0.00 0.00 68.15 68.37 1br2 h THR 93 CO 0.61 0.43 -0.85 0.00 0.37 0.00 0.00 175.52 176.09 1br2 s LEU 95 N 0.81 4.40 0.07 0.00 2.96 -1.26 -4.86 118.68 120.81 1br2 s LEU 95 Ca -0.06 -1.64 -0.14 0.00 -0.22 0.00 0.00 54.13 52.06 1br2 s LEU 95 Cb -0.15 -1.72 0.02 0.00 0.50 0.00 0.00 46.19 44.83 1br2 s LEU 95 CO -0.01 -0.36 0.33 0.54 -1.32 0.00 0.00 176.35 175.53 1br2 s ASN 96 N 1.37 -0.14 0.24 3.68 2.20 -1.26 -5.02 114.94 116.01 1br2 s ASN 96 Ca 0.01 -0.28 -0.14 0.00 -0.94 0.00 0.00 52.86 51.51 1br2 s ASN 96 Cb -0.21 0.40 0.32 0.00 -2.00 0.00 0.00 41.25 39.76 1br2 s ASN 96 CO -0.03 -0.71 1.53 -0.62 -2.94 0.00 0.00 177.10 174.33 1br2 n GLU 97 N 0.23 -0.18 -0.34 3.55 1.02 -1.26 0.25 120.64 123.91 1br2 n GLU 97 Ca -0.17 1.53 0.09 0.00 -0.02 0.00 0.00 57.16 58.58 1br2 n GLU 97 Cb 0.61 -2.27 0.28 0.00 -0.02 0.00 0.00 31.44 30.04 1br2 n GLU 97 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1br2 h ALA 98 N 1.58 1.60 0.11 0.62 0.00 -1.96 0.91 119.26 122.12 1br2 h ALA 98 Ca 0.39 0.03 -0.27 0.00 0.00 0.00 0.00 54.91 55.06 1br2 h ALA 98 Cb 0.64 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.26 1br2 h ALA 98 CO -0.99 0.14 -1.19 0.77 0.00 0.00 0.00 179.25 177.98 1br2 h SER 99 N 0.91 0.53 0.23 0.00 0.02 -0.50 -2.23 113.55 112.51 1br2 h SER 99 Ca 0.50 -0.52 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1br2 h SER 99 Cb 0.58 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.95 1br2 h SER 99 CO -0.26 1.38 -0.11 0.58 -1.14 0.00 0.00 176.83 177.27 1br2 h VAL 100 N 0.14 0.82 -0.72 2.27 2.07 -0.77 0.61 116.25 120.67 1br2 h VAL 100 Ca -0.14 -0.73 0.13 0.00 0.82 0.00 0.00 66.70 66.78 1br2 h VAL 100 Cb 1.88 1.21 -0.09 0.00 -1.52 0.00 0.00 31.29 32.78 1br2 h VAL 100 CO 0.20 0.15 0.29 0.25 0.02 0.00 0.00 177.57 178.48 1br2 h LEU 101 N -0.71 0.28 -0.01 2.57 5.85 -0.93 0.51 115.31 122.88 1br2 h LEU 101 Ca -0.03 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1br2 h LEU 101 Cb 0.49 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 1br2 h LEU 101 CO 0.05 0.13 0.00 -0.74 -0.34 0.00 0.00 178.44 177.54 1br2 h HIS 102 N 0.45 0.01 -0.77 1.25 2.76 -1.26 0.86 115.15 118.45 1br2 h HIS 102 Ca 0.39 -0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.64 1br2 h HIS 102 Cb 0.55 -0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.46 1br2 h HIS 102 CO -0.16 0.14 0.51 -0.97 -1.30 0.00 0.00 177.93 176.14 1br2 h ASN 103 N -0.12 0.67 0.08 3.26 -1.24 0.16 -0.53 115.58 117.86 1br2 h ASN 103 Ca 0.00 0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.02 1br2 h ASN 103 Cb 0.13 -0.13 0.00 0.00 0.73 0.00 0.00 38.32 39.05 1br2 h ASN 103 CO -0.00 0.41 -0.04 -0.07 -1.29 0.00 0.00 177.43 176.44 1br2 h LEU 104 N 0.75 -0.09 -0.64 0.34 3.38 -0.67 -2.79 115.31 115.59 1br2 h LEU 104 Ca 0.35 -0.51 0.13 0.00 0.09 0.00 0.00 57.88 57.94 1br2 h LEU 104 Cb 0.37 0.02 -0.10 0.00 0.09 0.00 0.00 40.66 41.04 1br2 h LEU 104 CO -0.13 0.52 0.07 -0.09 0.09 0.00 0.00 178.44 178.91 1br2 h ARG 105 N -0.76 0.18 0.88 1.13 2.43 -0.31 0.98 114.38 118.90 1br2 h ARG 105 Ca -0.01 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1br2 h ARG 105 Cb 0.59 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1br2 h ARG 105 CO 0.02 0.12 -0.42 0.93 -1.51 0.00 0.00 179.97 179.11 1br2 h GLU 106 N 0.19 -1.13 -0.97 0.20 5.08 -1.18 -1.80 114.58 114.96 1br2 h GLU 106 Ca 0.34 0.08 0.14 0.00 -1.00 0.00 0.00 59.36 58.92 1br2 h GLU 106 Cb 0.55 0.26 -0.08 0.00 0.50 0.00 0.00 28.75 29.97 1br2 h GLU 106 CO -0.49 -0.75 0.61 0.00 -1.00 0.00 0.00 179.01 177.38 1br2 h ARG 107 N -1.22 0.84 0.13 2.33 3.08 -1.19 -1.08 114.38 117.27 1br2 h ARG 107 Ca -0.12 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 1br2 h ARG 107 Cb 0.91 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.76 1br2 h ARG 107 CO 0.20 0.55 -0.15 -0.92 -1.07 0.00 0.00 179.97 178.58 1br2 h TYR 108 N 0.86 -0.43 0.00 3.04 3.20 -0.52 0.79 116.97 123.91 1br2 h TYR 108 Ca 0.50 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.37 1br2 h TYR 108 Cb 0.64 0.17 0.00 0.00 1.54 0.00 0.00 36.73 39.08 1br2 h TYR 108 CO -0.00 -0.20 0.00 1.19 -1.64 0.00 0.00 178.16 177.51 1br2 n PHE 109 N -3.26 0.00 1.02 -3.82 3.72 -0.70 0.92 117.46 115.33 1br2 n PHE 109 Ca -0.03 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.49 1br2 n PHE 109 Cb 0.14 -0.40 0.27 0.00 -0.94 0.00 0.00 39.48 38.55 1br2 n PHE 109 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1br2 n SER 110 N -1.40 2.53 0.00 4.37 7.64 -0.37 -4.93 113.62 121.47 1br2 n SER 110 Ca 0.01 -1.83 0.00 0.00 1.01 0.00 0.00 58.87 58.06 1br2 n SER 110 Cb 0.03 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1br2 n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1br2 n GLY 111 N 1.31 1.03 3.53 0.23 0.00 0.26 -5.02 105.19 106.54 1br2 n GLY 111 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1br2 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1br2 s LEU 112 N 0.00 4.45 -0.00 0.99 1.43 0.26 -4.91 118.68 120.89 1br2 s LEU 112 Ca 0.00 -0.20 0.19 0.00 -1.03 0.00 0.00 54.13 53.09 1br2 s LEU 112 Cb 0.00 -2.68 -0.22 0.00 0.03 0.00 0.00 46.19 43.33 1br2 s LEU 112 CO 0.00 -0.65 0.80 2.30 0.23 0.00 0.00 176.35 179.03 1br2 n ILE 113 N 5.66 0.00 -4.10 -0.59 -5.35 -1.26 -2.53 119.36 111.19 1br2 n ILE 113 Ca -0.03 -0.07 -0.34 0.00 -0.27 0.00 0.00 62.75 62.04 1br2 n ILE 113 Cb 0.48 0.94 -0.11 0.00 -1.74 0.00 0.00 39.64 39.22 1br2 n ILE 113 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1br2 s TYR 114 N -2.86 3.17 -0.10 4.28 2.02 -1.26 -2.28 117.35 120.32 1br2 s TYR 114 Ca 0.06 -0.07 -0.03 0.00 -0.37 0.00 0.00 57.07 56.66 1br2 s TYR 114 Cb 0.15 -2.06 0.05 0.00 -0.40 0.00 0.00 41.96 39.70 1br2 s TYR 114 CO 0.80 0.06 0.14 0.99 -1.57 0.00 0.00 175.55 175.97 1br2 s THR 115 N 0.46 -0.21 0.30 -0.71 2.01 -0.42 -4.49 115.64 112.58 1br2 s THR 115 Ca 0.01 0.24 -0.29 0.00 0.31 0.00 0.00 61.69 61.96 1br2 s THR 115 Cb -0.13 -0.35 -0.10 0.00 0.01 0.00 0.00 72.50 71.93 1br2 s THR 115 CO 0.01 0.05 1.28 -0.31 -0.69 0.00 0.00 174.62 174.97 1br2 s TYR 116 N 2.25 3.16 -0.43 4.92 2.02 0.12 -1.45 117.35 127.94 1br2 s TYR 116 Ca 0.04 1.41 0.02 0.00 -0.37 0.00 0.00 57.07 58.17 1br2 s TYR 116 Cb -0.13 -3.61 0.14 0.00 -0.40 0.00 0.00 41.96 37.96 1br2 s TYR 116 CO -0.06 -1.69 0.27 -1.54 -1.57 0.00 0.00 175.55 170.95 1br2 s SER 117 N -0.38 3.21 0.94 2.29 1.04 -0.27 -2.07 113.70 118.46 1br2 s SER 117 Ca 0.50 -2.67 0.00 0.00 0.48 0.00 0.00 55.95 54.26 1br2 s SER 117 Cb -0.38 -0.81 0.00 0.00 0.10 0.00 0.00 66.02 64.93 1br2 s SER 117 CO 0.48 -0.25 0.00 0.61 0.98 0.00 0.00 173.24 175.06 1br2 n GLY 118 N 3.45 0.64 0.12 7.32 0.00 -1.26 -3.45 105.19 112.01 1br2 n GLY 118 Ca 0.14 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.39 1br2 n GLY 118 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1br2 h LEU 119 N 0.00 -0.15 0.00 0.99 3.38 -1.96 -3.47 115.31 114.11 1br2 h LEU 119 Ca 0.00 -0.36 -0.35 0.00 0.09 0.00 0.00 57.88 57.26 1br2 h LEU 119 Cb 0.00 0.04 0.18 0.00 0.09 0.00 0.00 40.66 40.97 1br2 h LEU 119 CO 0.00 0.45 0.05 2.22 0.09 0.00 0.00 178.44 181.25 1br2 n PHE 120 N -4.87 -3.77 -4.13 1.13 -1.74 -1.22 -4.99 117.46 97.86 1br2 n PHE 120 Ca -0.07 -0.86 -0.15 0.00 -0.56 0.00 0.00 57.45 55.82 1br2 n PHE 120 Cb 0.25 -1.04 -0.11 0.00 1.52 0.00 0.00 39.48 40.10 1br2 n PHE 120 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1br2 s VAL 122 N -1.81 2.01 -0.03 0.00 1.01 -0.53 -0.05 120.40 121.00 1br2 s VAL 122 Ca -0.02 -1.29 0.00 0.00 0.00 0.00 0.00 61.98 60.68 1br2 s VAL 122 Cb -0.07 -1.71 0.03 0.00 0.00 0.00 0.00 36.38 34.63 1br2 s VAL 122 CO 0.01 0.37 0.00 -0.69 0.00 0.00 0.00 175.10 174.79 1br2 s VAL 123 N -0.76 0.17 -0.18 2.92 1.01 0.02 -1.30 120.40 122.28 1br2 s VAL 123 Ca 0.10 0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.12 1br2 s VAL 123 Cb -0.10 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.99 1br2 s VAL 123 CO 0.01 0.14 -0.02 -0.63 0.00 0.00 0.00 175.10 174.61 1br2 s ILE 124 N 0.99 3.89 -0.20 2.22 1.01 -0.97 0.60 121.20 128.74 1br2 s ILE 124 Ca -0.10 -0.34 -0.36 0.00 0.00 0.00 0.00 60.65 59.85 1br2 s ILE 124 Cb -0.13 -2.73 -0.13 0.00 0.01 0.00 0.00 42.46 39.48 1br2 s ILE 124 CO -0.02 0.46 1.91 -3.20 0.00 0.00 0.00 174.94 174.09 1br2 n ASN 125 N 3.97 2.90 0.16 3.58 2.85 -0.61 -4.83 115.26 123.28 1br2 n ASN 125 Ca -0.17 0.87 0.04 0.00 -0.11 0.00 0.00 54.58 55.20 1br2 n ASN 125 Cb 0.52 -1.29 0.20 0.00 1.24 0.00 0.00 39.78 40.45 1br2 n ASN 125 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1br2 h PRO 126 N 9.45 0.00 -1.35 1.20 0.13 -1.93 -3.42 132.00 136.09 1br2 h PRO 126 Ca -0.44 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.30 1br2 h PRO 126 Cb 1.29 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.28 1br2 h PRO 126 CO 0.97 0.47 -0.37 0.66 -0.23 0.00 0.00 178.00 179.49 1br2 n TYR 127 N -3.41 -0.21 -3.62 1.56 4.01 -1.26 -4.12 117.16 110.10 1br2 n TYR 127 Ca 0.01 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.62 1br2 n TYR 127 Cb 0.62 -3.35 -0.05 0.00 -0.31 0.00 0.00 39.34 36.25 1br2 n TYR 127 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 1br2 s LYS 128 N -3.81 1.00 0.21 -0.72 -2.85 -1.26 -4.41 119.74 107.90 1br2 s LYS 128 Ca 0.00 -0.43 -0.30 0.00 -1.00 0.00 0.00 55.97 54.24 1br2 s LYS 128 Cb 0.00 0.45 -0.08 0.00 -2.06 0.00 0.00 37.83 36.13 1br2 s LYS 128 CO 0.00 -0.37 1.19 -0.65 0.10 0.00 0.00 175.35 175.62 1br2 s GLN 129 N -2.87 4.51 -0.02 1.78 -1.52 -1.26 -5.03 119.66 115.24 1br2 s GLN 129 Ca -0.03 1.88 0.05 0.00 -1.95 0.00 0.00 55.36 55.32 1br2 s GLN 129 Cb -0.00 -3.22 -0.01 0.00 -0.22 0.00 0.00 33.01 29.56 1br2 s GLN 129 CO -0.05 -0.04 -0.17 -0.51 -0.25 0.00 0.00 175.29 174.26 1br2 s LEU 130 N -0.54 2.01 -1.27 2.90 1.43 -1.26 -5.04 118.68 116.91 1br2 s LEU 130 Ca 0.51 -0.32 -0.11 0.00 -1.03 0.00 0.00 54.13 53.18 1br2 s LEU 130 Cb -0.33 -0.91 -0.06 0.00 0.03 0.00 0.00 46.19 44.92 1br2 s LEU 130 CO 0.38 0.20 2.43 -0.81 0.23 0.00 0.00 176.35 178.78 1br2 n PRO 131 N 2.76 2.76 0.00 1.29 -0.04 -1.26 -4.16 135.00 136.34 1br2 n PRO 131 Ca -0.15 -2.00 0.00 0.00 -0.04 0.00 0.00 63.50 61.31 1br2 n PRO 131 Cb 0.54 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 1br2 n PRO 131 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1br2 n ILE 132 N 4.37 0.16 -1.43 0.52 -5.35 -1.26 -4.84 119.36 111.55 1br2 n ILE 132 Ca 0.59 -0.20 0.07 0.00 -0.27 0.00 0.00 62.75 62.95 1br2 n ILE 132 Cb 0.25 1.14 0.18 0.00 -1.74 0.00 0.00 39.64 39.47 1br2 n ILE 132 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1br2 n TYR 133 N -0.08 0.00 -0.65 4.28 4.01 -1.26 -4.94 117.16 118.52 1br2 n TYR 133 Ca 0.00 -1.28 -0.30 0.00 -0.16 0.00 0.00 57.90 56.16 1br2 n TYR 133 Cb 0.37 -0.21 0.27 0.00 -0.31 0.00 0.00 39.34 39.46 1br2 n TYR 133 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1br2 s SER 134 N -3.06 -0.22 0.03 7.72 1.04 -1.26 -4.89 113.70 113.06 1br2 s SER 134 Ca 0.35 0.81 0.08 0.00 0.48 0.00 0.00 55.95 57.67 1br2 s SER 134 Cb 0.33 -1.14 -0.23 0.00 0.10 0.00 0.00 66.02 65.08 1br2 s SER 134 CO -0.03 -4.84 0.93 -0.08 0.98 0.00 0.00 173.24 170.20 1br2 h GLU 135 N -3.07 0.03 -0.57 4.02 4.81 -1.99 -2.98 114.58 114.83 1br2 h GLU 135 Ca -0.45 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 58.77 1br2 h GLU 135 Cb 1.32 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.68 1br2 h GLU 135 CO 0.32 0.77 0.32 -0.22 -0.73 0.00 0.00 179.01 179.47 1br2 h LYS 136 N 0.01 0.60 -0.18 1.92 3.64 -1.99 -0.31 116.57 120.26 1br2 h LYS 136 Ca -0.17 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.08 1br2 h LYS 136 Cb 1.91 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 33.59 1br2 h LYS 136 CO 0.11 0.40 -0.33 0.82 -2.27 0.00 0.00 179.45 178.18 1br2 h ILE 137 N 0.62 1.28 -0.43 2.00 2.04 -1.93 -0.84 117.51 120.25 1br2 h ILE 137 Ca 0.24 -1.37 -0.02 0.00 1.00 0.00 0.00 64.86 64.72 1br2 h ILE 137 Cb 0.10 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 1br2 h ILE 137 CO -0.14 0.42 0.20 0.40 0.00 0.00 0.00 178.15 179.03 1br2 h ILE 138 N 0.31 1.15 0.20 -0.67 2.04 -0.96 -1.86 117.51 117.72 1br2 h ILE 138 Ca 0.04 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 1br2 h ILE 138 Cb 0.73 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1br2 h ILE 138 CO 0.06 0.18 -0.09 0.44 0.00 0.00 0.00 178.15 178.73 1br2 h ASP 139 N 0.60 -0.22 -0.51 1.72 3.32 -0.01 -2.49 116.42 118.83 1br2 h ASP 139 Ca 0.15 -0.23 0.15 0.00 0.02 0.00 0.00 57.03 57.12 1br2 h ASP 139 Cb 0.08 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1br2 h ASP 139 CO -0.02 0.12 0.57 0.24 -1.72 0.00 0.00 179.24 178.43 1br2 h MET 140 N -0.59 0.00 -0.02 3.56 2.86 -0.64 0.20 114.93 120.30 1br2 h MET 140 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1br2 h MET 140 Cb 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1br2 h MET 140 CO 0.04 0.00 -0.33 0.66 1.06 0.00 0.00 176.91 178.34 1br2 n TYR 141 N -3.63 0.00 -1.69 -0.22 4.01 -0.75 -4.84 117.16 110.05 1br2 n TYR 141 Ca 0.10 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.40 1br2 n TYR 141 Cb 0.76 -0.01 -0.04 0.00 -0.31 0.00 0.00 39.34 39.75 1br2 n TYR 141 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1br2 n LYS 142 N 0.33 2.58 -1.44 -0.72 4.81 0.69 -2.22 118.16 122.19 1br2 n LYS 142 Ca 0.11 0.94 -0.14 0.00 -0.87 0.00 0.00 58.31 58.34 1br2 n LYS 142 Cb 0.50 -2.79 -0.06 0.00 0.02 0.00 0.00 35.03 32.69 1br2 n LYS 142 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1br2 n GLY 143 N 4.05 1.34 3.78 3.14 0.00 -1.26 -4.94 105.19 111.31 1br2 n GLY 143 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1br2 n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1br2 s LYS 144 N -3.25 4.56 0.30 1.61 -0.14 -0.94 -5.05 119.74 116.82 1br2 s LYS 144 Ca 0.00 1.23 -0.22 0.00 -1.36 0.00 0.00 55.97 55.62 1br2 s LYS 144 Cb 0.00 -2.97 -0.09 0.00 -1.68 0.00 0.00 37.83 33.09 1br2 s LYS 144 CO 0.00 0.39 0.84 0.15 -0.76 0.00 0.00 175.35 175.97 1br2 s LYS 145 N -1.76 4.36 0.31 1.68 -0.14 -1.26 -4.71 119.74 118.22 1br2 s LYS 145 Ca 0.45 1.07 0.07 0.00 -1.36 0.00 0.00 55.97 56.20 1br2 s LYS 145 Cb -0.20 -2.72 0.88 0.00 -1.68 0.00 0.00 37.83 34.10 1br2 s LYS 145 CO 0.25 0.28 1.63 -0.09 -0.76 0.00 0.00 175.35 176.66 1br2 h ARG 146 N 3.03 0.18 0.00 1.68 2.43 -1.92 0.51 114.38 120.29 1br2 h ARG 146 Ca -0.48 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1br2 h ARG 146 Cb 1.19 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1br2 h ARG 146 CO 0.65 0.12 0.00 1.12 -1.51 0.00 0.00 179.97 180.34 1br2 h HIS 147 N 0.18 0.00 -0.00 2.20 2.07 -1.98 -3.14 115.15 114.49 1br2 h HIS 147 Ca 0.64 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.16 1br2 h HIS 147 Cb 1.39 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.37 1br2 h HIS 147 CO -0.21 0.00 -0.21 0.39 -3.07 0.00 0.00 177.93 174.83 1br2 n GLU 148 N -2.57 0.26 -3.83 5.12 1.02 0.18 -4.87 120.64 115.94 1br2 n GLU 148 Ca 0.03 -0.10 -0.12 0.00 -0.02 0.00 0.00 57.16 56.96 1br2 n GLU 148 Cb 0.36 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.17 1br2 n GLU 148 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1br2 s MET 149 N -2.81 0.31 0.85 3.49 -1.94 -1.17 -4.94 119.30 113.10 1br2 s MET 149 Ca 0.18 0.00 -0.14 0.00 -1.71 0.00 0.00 55.69 54.02 1br2 s MET 149 Cb 0.19 0.14 -0.01 0.00 2.01 0.00 0.00 34.83 37.16 1br2 s MET 149 CO 0.57 -0.06 0.40 -0.35 -0.01 0.00 0.00 175.02 175.57 1br2 n PRO 150 N 2.40 -0.01 -1.78 2.03 -0.04 -1.26 -4.81 135.00 131.53 1br2 n PRO 150 Ca -0.16 0.04 -0.42 0.00 -0.04 0.00 0.00 63.50 62.92 1br2 n PRO 150 Cb 0.58 -1.80 -0.03 0.00 -0.04 0.00 0.00 33.50 32.21 1br2 n PRO 150 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1br2 s PRO 151 N -3.16 4.14 -0.03 0.54 0.02 -1.26 -4.92 135.00 130.33 1br2 s PRO 151 Ca 0.60 2.56 -0.20 0.00 0.02 0.00 0.00 61.00 63.98 1br2 s PRO 151 Cb -0.27 -3.07 0.04 0.00 0.02 0.00 0.00 34.50 31.22 1br2 s PRO 151 CO 0.64 -0.69 0.43 -1.58 -0.33 0.00 0.00 177.00 175.47 1br2 s HIS 152 N 0.80 -0.35 0.51 6.54 2.46 -1.26 -4.52 115.29 119.47 1br2 s HIS 152 Ca 0.70 0.59 0.34 0.00 0.47 0.00 0.00 55.06 57.16 1br2 s HIS 152 Cb -0.48 0.20 1.83 0.00 -0.13 0.00 0.00 32.58 34.00 1br2 s HIS 152 CO 0.37 -0.45 2.20 0.97 -2.47 0.00 0.00 174.74 175.36 1br2 h ILE 153 N 3.63 0.34 -0.23 0.89 6.09 -1.98 -0.60 117.51 125.65 1br2 h ILE 153 Ca -0.29 -0.23 -0.04 0.00 -1.37 0.00 0.00 64.86 62.93 1br2 h ILE 153 Cb 1.17 1.17 -0.01 0.00 0.47 0.00 0.00 36.82 39.61 1br2 h ILE 153 CO 0.39 0.04 -0.01 1.88 -3.07 0.00 0.00 178.15 177.38 1br2 h TYR 154 N 0.00 0.45 -0.62 2.19 0.05 -1.95 -0.89 116.97 116.20 1br2 h TYR 154 Ca -0.00 -0.08 0.08 0.00 0.05 0.00 0.00 58.73 58.78 1br2 h TYR 154 Cb 0.16 -0.12 -0.06 0.00 1.01 0.00 0.00 36.73 37.72 1br2 h TYR 154 CO 0.00 0.60 0.28 0.00 -1.05 0.00 0.00 178.16 177.98 1br2 h ALA 155 N 0.80 0.82 -0.33 3.88 0.00 -1.45 0.58 119.26 123.56 1br2 h ALA 155 Ca 0.07 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1br2 h ALA 155 Cb 0.42 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1br2 h ALA 155 CO 0.01 -0.11 0.17 0.82 0.00 0.00 0.00 179.25 180.14 1br2 h ILE 156 N 0.50 1.00 0.48 0.00 5.03 -1.16 0.21 117.51 123.56 1br2 h ILE 156 Ca 0.30 -0.12 -0.02 0.00 -0.12 0.00 0.00 64.86 64.91 1br2 h ILE 156 Cb 0.31 0.62 -0.01 0.00 -3.03 0.00 0.00 36.82 34.71 1br2 h ILE 156 CO -0.26 0.06 -0.32 0.00 -0.68 0.00 0.00 178.15 176.96 1br2 h ALA 157 N 1.16 -0.78 0.24 1.87 0.00 0.31 -1.85 119.26 120.22 1br2 h ALA 157 Ca 0.13 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1br2 h ALA 157 Cb 0.04 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1br2 h ALA 157 CO -0.09 -0.96 -0.20 0.22 0.00 0.00 0.00 179.25 178.23 1br2 h ASP 158 N -0.77 -0.52 0.13 0.00 1.82 0.43 -0.49 116.42 117.01 1br2 h ASP 158 Ca -0.05 0.04 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 1br2 h ASP 158 Cb 0.64 0.17 -0.00 0.00 0.68 0.00 0.00 39.33 40.82 1br2 h ASP 158 CO 0.04 -0.31 -0.05 0.71 -1.61 0.00 0.00 179.24 178.02 1br2 h THR 159 N -0.46 0.61 -0.05 2.25 1.35 -0.62 0.13 112.91 116.12 1br2 h THR 159 Ca -0.01 -0.22 -0.17 0.00 -0.55 0.00 0.00 66.41 65.46 1br2 h THR 159 Cb 0.41 1.14 0.01 0.00 -1.73 0.00 0.00 68.15 67.98 1br2 h THR 159 CO -0.02 0.05 -0.62 0.00 -0.25 0.00 0.00 175.52 174.68 1br2 h ALA 160 N 1.95 0.14 0.13 6.62 0.00 -0.95 -2.14 119.26 125.01 1br2 h ALA 160 Ca -0.00 -0.56 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 1br2 h ALA 160 Cb 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1br2 h ALA 160 CO 0.01 0.42 -0.14 -0.92 0.00 0.00 0.00 179.25 178.62 1br2 h TYR 161 N 0.08 -0.38 -0.46 0.00 3.20 0.68 -1.45 116.97 118.64 1br2 h TYR 161 Ca -0.06 0.00 0.09 0.00 3.14 0.00 0.00 58.73 61.90 1br2 h TYR 161 Cb 1.29 0.15 -0.10 0.00 1.54 0.00 0.00 36.73 39.62 1br2 h TYR 161 CO 0.13 -0.18 -0.19 0.00 -1.64 0.00 0.00 178.16 176.27 1br2 h ARG 162 N -0.27 -0.09 -1.01 1.82 2.47 -0.95 0.12 114.38 116.47 1br2 h ARG 162 Ca -0.02 0.01 0.26 0.00 -1.26 0.00 0.00 59.98 58.97 1br2 h ARG 162 Cb 0.23 0.02 -0.08 0.00 -1.65 0.00 0.00 29.97 28.49 1br2 h ARG 162 CO -0.02 -0.06 0.67 1.03 0.56 0.00 0.00 179.97 182.14 1br2 h SER 163 N -0.09 0.38 0.63 7.04 0.87 -1.26 0.71 113.55 121.83 1br2 h SER 163 Ca 0.22 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.81 1br2 h SER 163 Cb 0.43 -0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.40 1br2 h SER 163 CO -0.53 0.10 -0.30 -0.03 -0.53 0.00 0.00 176.83 175.54 1br2 h MET 164 N 0.35 -0.82 0.14 2.24 1.85 0.36 -0.30 114.93 118.75 1br2 h MET 164 Ca 0.55 0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 59.69 1br2 h MET 164 Cb 1.49 0.19 0.00 0.00 0.43 0.00 0.00 31.60 33.70 1br2 h MET 164 CO -0.23 -0.53 -0.07 -0.07 -0.40 0.00 0.00 176.91 175.62 1br2 h LEU 165 N -0.90 -0.16 -0.60 3.39 3.38 -0.92 0.18 115.31 119.67 1br2 h LEU 165 Ca -0.09 -0.13 0.11 0.00 0.09 0.00 0.00 57.88 57.85 1br2 h LEU 165 Cb 0.67 0.04 -0.12 0.00 0.09 0.00 0.00 40.66 41.34 1br2 h LEU 165 CO 0.14 0.04 -0.34 1.56 0.09 0.00 0.00 178.44 179.94 1br2 h GLN 166 N -0.36 -0.15 -0.57 1.13 1.08 0.40 -2.41 115.11 114.23 1br2 h GLN 166 Ca -0.02 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1br2 h GLN 166 Cb 0.29 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1br2 h GLN 166 CO 0.03 -0.10 0.00 -0.25 -0.95 0.00 0.00 178.83 177.56 1br2 n ASP 167 N -5.43 3.52 -4.26 1.46 8.00 -0.13 -4.97 116.55 114.74 1br2 n ASP 167 Ca 0.04 -1.99 -0.35 0.00 0.71 0.00 0.00 54.79 53.20 1br2 n ASP 167 Cb 0.36 -0.38 -0.05 0.00 -0.02 0.00 0.00 41.12 41.03 1br2 n ASP 167 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1br2 n ARG 168 N 1.19 -2.38 -4.81 -1.24 5.12 0.59 -4.94 116.66 110.20 1br2 n ARG 168 Ca 0.19 0.29 -0.26 0.00 -1.93 0.00 0.00 57.85 56.15 1br2 n ARG 168 Cb 0.54 -4.71 -0.16 0.00 -1.16 0.00 0.00 32.46 26.97 1br2 n ARG 168 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 1br2 s GLU 169 N -6.99 1.67 0.31 5.56 -1.05 -1.02 -5.04 118.70 112.14 1br2 s GLU 169 Ca 0.53 -0.59 -0.30 0.00 -0.15 0.00 0.00 54.97 54.46 1br2 s GLU 169 Cb -0.30 -1.48 -0.11 0.00 -0.44 0.00 0.00 34.13 31.80 1br2 s GLU 169 CO 0.95 0.26 1.57 -0.51 0.95 0.00 0.00 175.26 178.48 1br2 s ASP 170 N -0.03 6.38 0.31 0.83 1.01 -1.26 -4.34 116.67 119.57 1br2 s ASP 170 Ca -0.02 2.96 0.08 0.00 0.71 0.00 0.00 52.55 56.28 1br2 s ASP 170 Cb -0.11 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.14 1br2 s ASP 170 CO 0.02 -0.90 0.13 -1.10 0.21 0.00 0.00 175.17 173.53 1br2 s GLN 171 N -0.81 2.46 -0.17 8.23 -1.52 -1.02 -0.20 119.66 126.62 1br2 s GLN 171 Ca 0.61 -1.44 -0.11 0.00 -1.95 0.00 0.00 55.36 52.48 1br2 s GLN 171 Cb -0.47 -2.25 0.06 0.00 -0.22 0.00 0.00 33.01 30.12 1br2 s GLN 171 CO 0.51 0.20 0.43 -1.54 -0.25 0.00 0.00 175.29 174.63 1br2 s SER 172 N -3.83 -0.53 -0.33 5.90 1.04 -0.29 -0.45 113.70 115.22 1br2 s SER 172 Ca 0.36 0.92 -0.07 0.00 0.48 0.00 0.00 55.95 57.64 1br2 s SER 172 Cb -0.04 0.83 0.03 0.00 0.10 0.00 0.00 66.02 66.94 1br2 s SER 172 CO 0.23 -0.19 0.11 -0.63 0.98 0.00 0.00 173.24 173.74 1br2 s ILE 173 N 1.18 3.89 -0.33 -1.02 1.01 -0.01 0.47 121.20 126.40 1br2 s ILE 173 Ca -0.08 -1.02 -0.09 0.00 0.00 0.00 0.00 60.65 59.47 1br2 s ILE 173 Cb -0.07 -3.16 0.01 0.00 0.01 0.00 0.00 42.46 39.25 1br2 s ILE 173 CO -0.11 -0.13 0.14 -0.76 0.00 0.00 0.00 174.94 174.08 1br2 s LEU 174 N 1.44 4.21 -0.11 2.97 1.43 0.34 -2.19 118.68 126.77 1br2 s LEU 174 Ca -0.00 -0.77 -0.24 0.00 -1.03 0.00 0.00 54.13 52.09 1br2 s LEU 174 Cb -0.19 -1.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.04 1br2 s LEU 174 CO 0.03 -0.26 0.72 0.00 0.23 0.00 0.00 176.35 177.08 1br2 s THR 176 N 1.27 3.14 0.00 0.00 -4.23 0.20 -4.61 115.64 111.41 1br2 s THR 176 Ca 0.37 -1.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.09 1br2 s THR 176 Cb -0.17 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.08 1br2 s THR 176 CO 0.16 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 1br2 n GLY 177 N -0.19 4.04 3.73 3.99 0.00 -1.26 -0.14 105.19 115.36 1br2 n GLY 177 Ca -0.09 -0.58 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 1br2 n GLY 177 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1br2 s GLU 178 N -2.29 1.70 -0.15 1.61 -1.05 -1.26 -3.84 118.70 113.41 1br2 s GLU 178 Ca 0.00 1.16 -0.39 0.00 -0.15 0.00 0.00 54.97 55.60 1br2 s GLU 178 Cb 0.00 -1.83 -0.16 0.00 -0.44 0.00 0.00 34.13 31.70 1br2 s GLU 178 CO 0.00 -2.03 1.64 0.45 0.95 0.00 0.00 175.26 176.26 1br2 n SER 179 N -3.79 2.28 0.00 0.83 2.88 0.03 -1.04 113.62 114.81 1br2 n SER 179 Ca 0.09 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 1br2 n SER 179 Cb 0.53 -1.18 0.00 0.00 -0.75 0.00 0.00 64.21 62.81 1br2 n SER 179 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1br2 n GLY 180 N 3.72 3.03 0.23 0.46 0.00 -1.26 -4.85 105.19 106.53 1br2 n GLY 180 Ca 0.24 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.24 1br2 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1br2 h ALA 181 N 0.00 0.37 0.00 4.61 0.00 -1.39 -3.46 119.26 119.39 1br2 h ALA 181 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1br2 h ALA 181 Cb 0.00 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1br2 h ALA 181 CO 0.00 -0.44 0.00 0.41 0.00 0.00 0.00 179.25 179.22 1br2 n GLY 182 N -1.41 -0.87 0.31 0.00 0.00 -1.26 -3.95 105.19 98.01 1br2 n GLY 182 Ca 0.06 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.18 1br2 n GLY 182 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1br2 h LYS 183 N 0.00 0.07 -0.04 1.61 1.57 -1.88 -1.88 116.57 116.02 1br2 h LYS 183 Ca 0.00 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1br2 h LYS 183 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1br2 h LYS 183 CO 0.00 0.05 -0.16 1.15 -0.57 0.00 0.00 179.45 179.92 1br2 h THR 184 N 0.08 1.46 -0.96 -0.16 2.02 -1.95 0.47 112.91 113.87 1br2 h THR 184 Ca 0.49 -1.59 0.18 0.00 0.77 0.00 0.00 66.41 66.27 1br2 h THR 184 Cb 0.94 2.39 -0.09 0.00 -1.74 0.00 0.00 68.15 69.65 1br2 h THR 184 CO -0.77 0.44 0.61 -0.33 0.37 0.00 0.00 175.52 175.83 1br2 h GLU 185 N -0.37 0.66 0.13 6.66 4.39 -1.87 0.26 114.58 124.45 1br2 h GLU 185 Ca -0.01 -0.04 -0.29 0.00 0.34 0.00 0.00 59.36 59.37 1br2 h GLU 185 Cb 0.79 -0.15 0.02 0.00 -0.10 0.00 0.00 28.75 29.31 1br2 h GLU 185 CO 0.03 0.43 -1.25 -0.91 -1.16 0.00 0.00 179.01 176.16 1br2 h ASN 186 N 0.68 0.67 -0.56 1.42 2.35 -1.33 -2.28 115.58 116.53 1br2 h ASN 186 Ca 0.52 -0.66 -0.03 0.00 -0.55 0.00 0.00 56.30 55.58 1br2 h ASN 186 Cb 0.91 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.04 1br2 h ASN 186 CO -0.28 1.49 0.23 0.74 -1.65 0.00 0.00 177.43 177.96 1br2 h THR 187 N 0.18 1.22 -0.28 2.81 2.02 0.06 -1.90 112.91 117.01 1br2 h THR 187 Ca -0.17 -0.68 0.03 0.00 0.77 0.00 0.00 66.41 66.37 1br2 h THR 187 Cb 1.94 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.95 1br2 h THR 187 CO 0.22 0.26 0.19 0.11 0.37 0.00 0.00 175.52 176.68 1br2 h LYS 188 N 0.77 0.24 -0.03 6.66 1.57 -0.49 -1.88 116.57 123.41 1br2 h LYS 188 Ca 0.19 -0.01 -0.20 0.00 -1.87 0.00 0.00 60.65 58.75 1br2 h LYS 188 Cb 0.19 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1br2 h LYS 188 CO -0.02 0.16 -0.83 0.87 -0.57 0.00 0.00 179.45 179.06 1br2 h LYS 189 N 0.25 0.33 -0.28 3.15 1.79 -0.76 -1.65 116.57 119.40 1br2 h LYS 189 Ca 0.12 -0.32 -0.04 0.00 -2.18 0.00 0.00 60.65 58.23 1br2 h LYS 189 Cb 0.16 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.88 1br2 h LYS 189 CO -0.02 0.99 0.03 0.28 -1.08 0.00 0.00 179.45 179.65 1br2 h VAL 190 N 0.20 1.24 -0.59 0.50 2.07 -0.63 -0.97 116.25 118.08 1br2 h VAL 190 Ca -0.05 -0.84 -0.09 0.00 0.82 0.00 0.00 66.70 66.54 1br2 h VAL 190 Cb 1.44 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 1br2 h VAL 190 CO 0.14 0.27 0.03 0.40 0.02 0.00 0.00 177.57 178.43 1br2 h ILE 191 N 0.27 1.26 -0.71 4.57 2.04 -1.41 -1.09 117.51 122.45 1br2 h ILE 191 Ca 0.08 -1.08 0.02 0.00 1.00 0.00 0.00 64.86 64.88 1br2 h ILE 191 Cb 0.37 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 1br2 h ILE 191 CO 0.01 0.39 0.46 -0.61 0.00 0.00 0.00 178.15 178.40 1br2 h GLN 192 N 0.92 0.88 0.61 2.37 4.15 -1.04 -0.61 115.11 122.40 1br2 h GLN 192 Ca 0.17 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.51 1br2 h GLN 192 Cb 0.50 -0.20 0.01 0.00 0.21 0.00 0.00 27.48 27.99 1br2 h GLN 192 CO 0.02 0.58 -0.30 -0.92 -1.93 0.00 0.00 178.83 176.29 1br2 h TYR 193 N 0.91 -0.77 -0.84 3.99 3.20 -0.92 -2.87 116.97 119.68 1br2 h TYR 193 Ca 0.27 -0.02 0.16 0.00 3.14 0.00 0.00 58.73 62.29 1br2 h TYR 193 Cb -0.03 0.25 -0.10 0.00 1.54 0.00 0.00 36.73 38.39 1br2 h TYR 193 CO -0.03 -0.43 0.39 -0.07 -1.64 0.00 0.00 178.16 176.37 1br2 h LEU 194 N -1.12 0.41 -1.71 2.82 3.38 -1.07 1.00 115.31 119.02 1br2 h LEU 194 Ca -0.08 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1br2 h LEU 194 Cb 0.68 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 1br2 h LEU 194 CO 0.14 0.13 -0.17 0.00 0.09 0.00 0.00 178.44 178.64 1br2 h ALA 195 N 1.60 1.64 -0.02 1.53 0.00 -1.12 -2.52 119.26 120.36 1br2 h ALA 195 Ca 0.48 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1br2 h ALA 195 Cb 0.75 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1br2 h ALA 195 CO -0.42 0.21 0.00 0.28 0.00 0.00 0.00 179.25 179.32 1br2 n VAL 196 N -4.22 0.02 0.00 0.00 0.31 0.32 -3.82 118.33 110.95 1br2 n VAL 196 Ca -0.02 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 1br2 n VAL 196 Cb 0.24 0.26 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 1br2 n VAL 196 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1br2 n VAL 197 N -0.08 0.00 0.49 2.52 0.24 -0.98 -4.85 118.33 115.67 1br2 n VAL 197 Ca 0.20 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.55 1br2 n VAL 197 Cb 0.30 -0.77 -0.01 0.00 -1.47 0.00 0.00 33.84 31.88 1br2 n VAL 197 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1br2 n ALA 198 N -1.83 2.96 -1.00 2.33 0.00 -1.02 -5.04 120.51 116.92 1br2 n ALA 198 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1br2 n ALA 198 Cb 0.41 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.48 1br2 n ALA 198 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1br2 n SER 199 N -0.38 0.00 -0.57 0.00 2.88 -1.25 -1.64 113.62 112.66 1br2 n SER 199 Ca 0.04 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.58 1br2 n SER 199 Cb 0.22 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.68 1br2 n SER 199 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1br2 n GLY 218 N 4.05 0.73 0.30 0.46 0.00 -1.26 -4.98 105.19 104.49 1br2 n GLY 218 Ca 0.00 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 1br2 n GLY 218 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1br2 h GLU 219 N 0.05 -0.48 -0.45 1.61 -0.00 -2.03 -2.57 114.58 110.71 1br2 h GLU 219 Ca -0.03 0.03 0.04 0.00 -0.00 0.00 0.00 59.36 59.40 1br2 h GLU 219 Cb 1.26 0.11 -0.05 0.00 -0.00 0.00 0.00 28.75 30.06 1br2 h GLU 219 CO -0.01 -0.32 -0.27 -0.11 -0.00 0.00 0.00 179.01 178.31 1br2 n LEU 220 N -4.29 -0.48 -0.15 3.06 7.94 -1.26 0.18 117.00 122.00 1br2 n LEU 220 Ca -0.06 0.99 -0.03 0.00 -1.11 0.00 0.00 56.01 55.81 1br2 n LEU 220 Cb 0.26 -0.20 0.04 0.00 0.53 0.00 0.00 43.42 44.06 1br2 n LEU 220 CO 0.11 -0.75 0.80 -0.33 -1.11 0.00 0.00 177.39 176.11 1br2 h GLU 221 N 0.00 0.04 -0.99 1.96 3.07 -1.90 0.93 114.58 117.69 1br2 h GLU 221 Ca 0.07 -0.00 0.10 0.00 -0.50 0.00 0.00 59.36 59.03 1br2 h GLU 221 Cb 0.19 -0.01 -0.08 0.00 -0.84 0.00 0.00 28.75 28.01 1br2 h GLU 221 CO -0.42 0.03 0.63 1.57 -1.40 0.00 0.00 179.01 179.41 1br2 h LYS 222 N 0.04 1.01 0.10 2.33 2.10 0.23 -1.46 116.57 120.92 1br2 h LYS 222 Ca 0.24 -0.06 -0.26 0.00 -2.00 0.00 0.00 60.65 58.57 1br2 h LYS 222 Cb 0.37 -0.23 0.01 0.00 -0.90 0.00 0.00 32.23 31.48 1br2 h LYS 222 CO -0.47 0.67 -1.17 1.96 -2.00 0.00 0.00 179.45 178.44 1br2 h GLN 223 N 1.04 0.31 -0.83 0.07 4.20 0.11 -3.24 115.11 116.77 1br2 h GLN 223 Ca 0.47 -0.47 0.13 0.00 0.06 0.00 0.00 58.65 58.83 1br2 h GLN 223 Cb 0.38 0.17 -0.06 0.00 0.30 0.00 0.00 27.48 28.26 1br2 h GLN 223 CO -0.22 1.20 0.54 1.25 -0.67 0.00 0.00 178.83 180.92 1br2 h LEU 224 N 0.12 0.60 -0.13 1.46 5.85 0.18 0.46 115.31 123.85 1br2 h LEU 224 Ca -0.12 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1br2 h LEU 224 Cb 1.87 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.81 1br2 h LEU 224 CO 0.20 0.33 0.00 0.18 -0.34 0.00 0.00 178.44 178.80 1br2 n LEU 225 N -4.52 0.19 -0.01 2.25 4.77 -0.69 -2.92 117.00 116.07 1br2 n LEU 225 Ca 0.15 -0.08 0.07 0.00 -0.03 0.00 0.00 56.01 56.12 1br2 n LEU 225 Cb 0.43 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.40 1br2 n LEU 225 CO 0.31 0.04 -0.61 0.00 -1.33 0.00 0.00 177.39 175.80 1br2 n GLN 226 N -0.69 0.57 -0.11 3.23 1.13 0.16 -4.58 117.38 117.10 1br2 n GLN 226 Ca 0.16 -0.11 -0.08 0.00 -1.94 0.00 0.00 57.00 55.02 1br2 n GLN 226 Cb 0.10 -1.30 -0.06 0.00 0.11 0.00 0.00 30.24 29.09 1br2 n GLN 226 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1br2 h ALA 227 N 1.27 -0.53 0.14 -1.58 0.00 -1.31 -1.45 119.26 115.80 1br2 h ALA 227 Ca 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1br2 h ALA 227 Cb 0.59 0.99 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1br2 h ALA 227 CO 0.00 -0.70 -0.07 -0.91 0.00 0.00 0.00 179.25 177.57 1br2 h ASN 228 N -0.19 -0.16 -1.25 0.00 2.35 -1.84 0.15 115.58 114.64 1br2 h ASN 228 Ca 0.05 -0.05 0.36 0.00 -0.55 0.00 0.00 56.30 56.11 1br2 h ASN 228 Cb 0.32 0.04 -0.08 0.00 0.05 0.00 0.00 38.32 38.65 1br2 h ASN 228 CO -0.37 -0.05 0.85 -0.65 -1.65 0.00 0.00 177.43 175.55 1br2 h PRO 229 N -0.25 0.14 0.01 0.81 0.11 -1.74 1.03 132.00 132.11 1br2 h PRO 229 Ca -0.02 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 1br2 h PRO 229 Cb 0.20 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.28 1br2 h PRO 229 CO 0.03 0.09 -0.00 0.82 -0.21 0.00 0.00 178.00 178.73 1br2 h ILE 230 N 0.15 0.83 -0.29 4.15 2.04 -0.63 -3.22 117.51 120.54 1br2 h ILE 230 Ca 0.67 -1.61 0.05 0.00 1.00 0.00 0.00 64.86 64.97 1br2 h ILE 230 Cb 2.24 1.57 -0.05 0.00 -0.74 0.00 0.00 36.82 39.85 1br2 h ILE 230 CO -0.19 0.28 0.00 -0.07 0.00 0.00 0.00 178.15 178.17 1br2 h LEU 231 N -1.00 -0.11 -0.95 1.44 3.38 0.12 -1.92 115.31 116.28 1br2 h LEU 231 Ca -0.00 0.06 0.16 0.00 0.09 0.00 0.00 57.88 58.20 1br2 h LEU 231 Cb 0.47 0.11 -0.10 0.00 0.09 0.00 0.00 40.66 41.23 1br2 h LEU 231 CO 0.00 -0.02 0.55 -0.08 0.09 0.00 0.00 178.44 178.98 1br2 h GLU 232 N 0.09 0.73 -0.25 1.13 4.81 0.85 0.14 114.58 122.08 1br2 h GLU 232 Ca 0.14 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.34 1br2 h GLU 232 Cb 0.18 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1br2 h GLU 232 CO -0.23 0.48 0.17 0.00 -0.73 0.00 0.00 179.01 178.70 1br2 h ALA 233 N 1.60 1.91 0.00 2.92 0.00 -1.35 0.28 119.26 124.61 1br2 h ALA 233 Ca 0.53 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.33 1br2 h ALA 233 Cb 0.75 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1br2 h ALA 233 CO -0.36 0.06 -1.95 1.19 0.00 0.00 0.00 179.25 178.19 1br2 n PHE 234 N -4.50 0.00 0.36 0.00 3.01 -0.53 -0.00 117.46 115.79 1br2 n PHE 234 Ca 0.01 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.51 1br2 n PHE 234 Cb 0.13 -0.55 0.01 0.00 -0.01 0.00 0.00 39.48 39.05 1br2 n PHE 234 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1br2 n GLY 235 N 1.59 -0.26 3.91 1.37 0.00 0.37 -4.86 105.19 107.31 1br2 n GLY 235 Ca -0.11 -0.24 -0.23 0.00 0.00 0.00 0.00 46.02 45.44 1br2 n GLY 235 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1br2 s ASN 236 N -1.11 6.05 0.05 1.61 -0.87 0.97 -1.10 114.94 120.54 1br2 s ASN 236 Ca 0.07 0.00 -0.27 0.00 -1.57 0.00 0.00 52.86 51.10 1br2 s ASN 236 Cb 0.07 -1.72 0.09 0.00 -0.02 0.00 0.00 41.25 39.66 1br2 s ASN 236 CO 0.19 -0.01 0.76 0.00 -2.57 0.00 0.00 177.10 175.47 1br2 s ALA 237 N -1.91 -1.74 -0.32 0.60 0.00 0.18 -2.08 121.76 116.50 1br2 s ALA 237 Ca 0.33 0.88 -0.28 0.00 0.00 0.00 0.00 51.96 52.89 1br2 s ALA 237 Cb -0.09 0.48 0.02 0.00 0.00 0.00 0.00 23.12 23.52 1br2 s ALA 237 CO 0.27 -0.66 1.04 0.21 0.00 0.00 0.00 175.76 176.62 1br2 s LYS 238 N -3.03 4.04 0.37 0.00 2.20 -1.14 -1.40 119.74 120.78 1br2 s LYS 238 Ca 0.01 0.99 0.08 0.00 -0.36 0.00 0.00 55.97 56.69 1br2 s LYS 238 Cb -0.01 -3.74 -0.04 0.00 -1.51 0.00 0.00 37.83 32.53 1br2 s LYS 238 CO -0.08 -0.88 0.19 0.95 -0.36 0.00 0.00 175.35 175.17 1br2 s THR 239 N 3.57 2.75 0.50 3.43 -4.23 0.32 -2.05 115.64 119.93 1br2 s THR 239 Ca 0.44 -1.64 0.21 0.00 -1.18 0.00 0.00 61.69 59.51 1br2 s THR 239 Cb -0.12 -2.99 0.27 0.00 1.34 0.00 0.00 72.50 71.00 1br2 s THR 239 CO 0.15 -0.10 2.12 -0.37 -0.54 0.00 0.00 174.62 175.88 1br2 h VAL 240 N 1.43 0.83 0.09 2.29 -1.51 -1.89 -2.35 116.25 115.14 1br2 h VAL 240 Ca -0.43 -0.27 -0.28 0.00 -1.23 0.00 0.00 66.70 64.48 1br2 h VAL 240 Cb 1.25 1.16 -0.01 0.00 -2.13 0.00 0.00 31.29 31.56 1br2 h VAL 240 CO 0.64 0.07 -1.40 0.11 -1.23 0.00 0.00 177.57 175.76 1br2 h LYS 241 N 0.00 0.19 -2.93 5.19 1.79 -1.95 -3.47 116.57 115.39 1br2 h LYS 241 Ca -0.00 -0.32 -0.14 0.00 -2.18 0.00 0.00 60.65 58.01 1br2 h LYS 241 Cb 0.15 0.12 -0.25 0.00 -1.58 0.00 0.00 32.23 30.67 1br2 h LYS 241 CO 0.01 1.05 -0.33 1.21 -1.08 0.00 0.00 179.45 180.31 1br2 s ASN 242 N -6.88 -0.35 0.14 0.86 3.84 -0.89 -4.61 114.94 107.07 1br2 s ASN 242 Ca -0.06 0.67 0.03 0.00 0.21 0.00 0.00 52.86 53.72 1br2 s ASN 242 Cb 0.08 0.67 -0.09 0.00 -0.55 0.00 0.00 41.25 41.35 1br2 s ASN 242 CO 0.85 -0.12 1.33 0.44 -2.79 0.00 0.00 177.10 176.80 1br2 h ASP 243 N 5.75 0.18 -2.05 -4.21 3.32 -1.84 0.94 116.42 118.51 1br2 h ASP 243 Ca -0.27 -0.17 -0.61 0.00 0.02 0.00 0.00 57.03 56.00 1br2 h ASP 243 Cb 1.19 -0.06 -0.41 0.00 0.22 0.00 0.00 39.33 40.27 1br2 h ASP 243 CO 0.30 1.03 -0.52 -3.20 -1.72 0.00 0.00 179.24 175.14 1br2 n ASN 244 N -3.55 4.82 -4.70 6.45 5.15 -1.26 -2.87 115.26 119.30 1br2 n ASN 244 Ca -0.03 -3.70 -0.42 0.00 -0.60 0.00 0.00 54.58 49.83 1br2 n ASN 244 Cb 0.87 -0.58 -0.03 0.00 -0.53 0.00 0.00 39.78 39.51 1br2 n ASN 244 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1br2 s SER 245 N -3.30 7.23 -0.07 1.20 0.15 -0.50 -4.78 113.70 113.64 1br2 s SER 245 Ca 0.48 1.50 -0.30 0.00 0.70 0.00 0.00 55.95 58.34 1br2 s SER 245 Cb 0.32 -2.53 -0.04 0.00 -1.71 0.00 0.00 66.02 62.05 1br2 s SER 245 CO -0.16 -0.33 1.46 -0.44 1.20 0.00 0.00 173.24 174.96 1br2 s SER 246 N 1.04 6.81 -0.52 5.45 0.01 -1.26 -0.65 113.70 124.58 1br2 s SER 246 Ca 0.47 2.04 0.02 0.00 1.31 0.00 0.00 55.95 59.79 1br2 s SER 246 Cb -0.19 -2.54 0.53 0.00 0.21 0.00 0.00 66.02 64.03 1br2 s SER 246 CO 0.21 -0.81 1.86 0.54 0.41 0.00 0.00 173.24 175.46 1br2 n ARG 247 N 6.38 2.52 -3.63 12.44 5.12 -0.26 -4.81 116.66 134.42 1br2 n ARG 247 Ca 0.15 -3.26 -0.09 0.00 -1.93 0.00 0.00 57.85 52.72 1br2 n ARG 247 Cb 0.44 -2.20 -0.07 0.00 -1.16 0.00 0.00 32.46 29.47 1br2 n ARG 247 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 1br2 s PHE 248 N -3.57 -0.45 0.73 -1.55 -0.71 -1.26 -1.52 117.98 109.66 1br2 s PHE 248 Ca 0.59 1.06 -0.11 0.00 -1.04 0.00 0.00 56.93 57.42 1br2 s PHE 248 Cb 0.48 0.38 0.03 0.00 -1.21 0.00 0.00 43.02 42.70 1br2 s PHE 248 CO 0.04 -0.23 1.09 0.20 -1.34 0.00 0.00 175.22 174.97 1br2 s GLY 249 N 0.07 1.63 -0.26 1.99 0.00 0.30 -4.44 107.32 106.61 1br2 s GLY 249 Ca 0.03 -0.24 -0.15 0.00 0.00 0.00 0.00 44.72 44.36 1br2 s GLY 249 CO -0.06 0.14 0.64 1.25 0.00 0.00 0.00 173.10 175.07 1br2 s LYS 250 N -5.24 0.66 -0.35 2.90 2.20 -0.49 -0.39 119.74 119.03 1br2 s LYS 250 Ca 0.59 1.14 -0.03 0.00 -0.36 0.00 0.00 55.97 57.31 1br2 s LYS 250 Cb -0.13 0.12 0.07 0.00 -1.51 0.00 0.00 37.83 36.39 1br2 s LYS 250 CO 0.53 -0.15 0.09 0.12 -0.36 0.00 0.00 175.35 175.59 1br2 s PHE 251 N 1.54 3.38 -0.21 4.03 5.36 0.92 -0.72 117.98 132.28 1br2 s PHE 251 Ca -0.09 -1.99 -0.18 0.00 -0.96 0.00 0.00 56.93 53.70 1br2 s PHE 251 Cb -0.06 -2.55 -0.03 0.00 -0.34 0.00 0.00 43.02 40.05 1br2 s PHE 251 CO -0.18 -0.85 0.51 0.42 -1.46 0.00 0.00 175.22 173.66 1br2 s ILE 252 N 1.24 5.11 -0.29 3.12 1.09 0.55 -1.89 121.20 130.13 1br2 s ILE 252 Ca 0.00 0.92 -0.02 0.00 -1.10 0.00 0.00 60.65 60.45 1br2 s ILE 252 Cb -0.21 -3.83 0.04 0.00 -1.06 0.00 0.00 42.46 37.41 1br2 s ILE 252 CO -0.02 0.17 -0.01 -0.60 -0.10 0.00 0.00 174.94 174.38 1br2 s ARG 253 N 1.74 2.53 -0.21 2.79 3.52 -0.70 -0.07 118.95 128.56 1br2 s ARG 253 Ca 0.23 -1.19 -0.16 0.00 -0.13 0.00 0.00 55.73 54.48 1br2 s ARG 253 Cb -0.15 -3.14 -0.04 0.00 -1.56 0.00 0.00 34.95 30.05 1br2 s ARG 253 CO 0.09 -0.57 0.41 0.42 -0.81 0.00 0.00 175.30 174.84 1br2 s ILE 254 N 1.28 5.19 -0.13 4.11 1.01 -1.11 -1.16 121.20 130.38 1br2 s ILE 254 Ca -0.04 0.71 -0.13 0.00 0.00 0.00 0.00 60.65 61.19 1br2 s ILE 254 Cb -0.19 -3.73 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 1br2 s ILE 254 CO -0.02 0.23 0.28 0.20 0.00 0.00 0.00 174.94 175.64 1br2 s ASN 255 N 1.12 6.48 0.26 3.58 0.01 -1.12 -0.77 114.94 124.50 1br2 s ASN 255 Ca 0.19 0.57 0.09 0.00 -0.71 0.00 0.00 52.86 53.00 1br2 s ASN 255 Cb -0.15 -2.17 -0.05 0.00 0.41 0.00 0.00 41.25 39.29 1br2 s ASN 255 CO 0.08 0.18 -0.15 -0.36 -1.51 0.00 0.00 177.10 175.35 1br2 s PHE 256 N 0.01 2.03 0.73 2.20 0.40 0.13 0.16 117.98 123.63 1br2 s PHE 256 Ca 0.17 -0.50 -0.03 0.00 -0.60 0.00 0.00 56.93 55.98 1br2 s PHE 256 Cb -0.13 -0.97 0.12 0.00 0.51 0.00 0.00 43.02 42.55 1br2 s PHE 256 CO 0.05 0.50 1.01 0.16 0.70 0.00 0.00 175.22 177.64 1br2 s ASP 257 N -3.44 4.34 0.53 1.36 1.47 -0.16 -2.10 116.67 118.67 1br2 s ASP 257 Ca 0.27 -0.20 0.36 0.00 1.18 0.00 0.00 52.55 54.16 1br2 s ASP 257 Cb -0.01 -0.21 1.86 0.00 -0.34 0.00 0.00 42.92 44.22 1br2 s ASP 257 CO 0.12 -1.87 2.09 -0.37 0.68 0.00 0.00 175.17 175.81 1br2 h VAL 258 N -0.59 0.00 0.00 2.11 -1.51 -1.93 -0.03 116.25 114.29 1br2 h VAL 258 Ca -0.38 -0.08 -0.15 0.00 -1.23 0.00 0.00 66.70 64.86 1br2 h VAL 258 Cb 1.27 0.91 -0.02 0.00 -2.13 0.00 0.00 31.29 31.32 1br2 h VAL 258 CO 0.43 0.00 -0.70 0.74 -1.23 0.00 0.00 177.57 176.80 1br2 h THR 259 N 0.00 1.31 0.00 7.19 2.02 -2.03 -3.48 112.91 117.92 1br2 h THR 259 Ca 0.00 -2.59 0.00 0.00 0.77 0.00 0.00 66.41 64.59 1br2 h THR 259 Cb 0.09 2.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.97 1br2 h THR 259 CO 0.00 0.69 0.00 0.61 0.37 0.00 0.00 175.52 177.19 1br2 n GLY 260 N 0.96 0.96 3.76 2.16 0.00 -0.03 -5.10 105.19 107.90 1br2 n GLY 260 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1br2 n GLY 260 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1br2 s TYR 261 N -2.00 3.90 0.36 1.61 -0.85 -1.26 -4.71 117.35 114.41 1br2 s TYR 261 Ca 0.00 1.88 -0.28 0.00 -0.52 0.00 0.00 57.07 58.14 1br2 s TYR 261 Cb 0.00 -2.99 -0.11 0.00 0.38 0.00 0.00 41.96 39.24 1br2 s TYR 261 CO 0.00 0.34 1.51 0.42 -1.52 0.00 0.00 175.55 176.29 1br2 s ILE 262 N -1.26 2.04 0.00 -3.49 1.01 -0.65 -0.99 121.20 117.86 1br2 s ILE 262 Ca 0.43 0.04 0.00 0.00 0.00 0.00 0.00 60.65 61.12 1br2 s ILE 262 Cb -0.25 -3.03 0.00 0.00 0.01 0.00 0.00 42.46 39.19 1br2 s ILE 262 CO 0.31 0.01 0.00 0.52 0.00 0.00 0.00 174.94 175.78 1br2 n VAL 263 N 0.73 0.00 -3.18 2.92 0.31 0.43 -4.82 118.33 114.73 1br2 n VAL 263 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1br2 n VAL 263 Cb 0.39 -1.04 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 1br2 n VAL 263 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1br2 n GLY 264 N 2.89 5.45 0.00 2.92 0.00 -0.83 -4.94 105.19 110.68 1br2 n GLY 264 Ca 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1br2 n GLY 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1br2 n ALA 265 N -3.00 0.00 -3.74 4.61 0.00 -1.11 -2.79 120.51 114.48 1br2 n ALA 265 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 1br2 n ALA 265 Cb 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 19.45 19.27 1br2 n ALA 265 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1br2 s ASN 266 N 0.00 1.45 -0.24 0.00 2.47 -0.31 -4.01 114.94 114.31 1br2 s ASN 266 Ca 0.00 -0.04 -0.12 0.00 0.42 0.00 0.00 52.86 53.12 1br2 s ASN 266 Cb 0.00 -0.35 -0.05 0.00 -1.45 0.00 0.00 41.25 39.40 1br2 s ASN 266 CO 0.00 -0.21 0.24 -0.63 -3.72 0.00 0.00 177.10 172.78 1br2 s ILE 267 N 2.02 5.30 -0.15 -5.21 1.01 -1.26 -1.72 121.20 121.20 1br2 s ILE 267 Ca 0.05 0.33 -0.01 0.00 0.00 0.00 0.00 60.65 61.03 1br2 s ILE 267 Cb -0.12 -3.57 -0.01 0.00 0.01 0.00 0.00 42.46 38.76 1br2 s ILE 267 CO -0.05 0.30 -0.12 -0.70 0.00 0.00 0.00 174.94 174.37 1br2 s GLU 268 N 1.25 3.37 0.16 2.79 2.56 -0.79 -4.97 118.70 123.07 1br2 s GLU 268 Ca 0.11 -0.68 0.08 0.00 0.00 0.00 0.00 54.97 54.47 1br2 s GLU 268 Cb -0.14 -2.68 -0.04 0.00 2.00 0.00 0.00 34.13 33.26 1br2 s GLU 268 CO 0.06 0.14 -0.05 0.95 -0.56 0.00 0.00 175.26 175.80 1br2 s THR 269 N 0.55 3.50 0.06 -1.70 -4.23 -1.26 -0.06 115.64 112.50 1br2 s THR 269 Ca -0.08 -1.46 0.04 0.00 -1.18 0.00 0.00 61.69 59.02 1br2 s THR 269 Cb -0.16 -2.73 -0.03 0.00 1.34 0.00 0.00 72.50 70.93 1br2 s THR 269 CO 0.04 -0.06 -0.12 -0.31 -0.54 0.00 0.00 174.62 173.62 1br2 s TYR 270 N -1.62 1.07 -0.49 3.99 1.51 0.48 -4.93 117.35 117.36 1br2 s TYR 270 Ca 0.25 -0.45 -0.25 0.00 -1.01 0.00 0.00 57.07 55.61 1br2 s TYR 270 Cb -0.10 -0.61 0.04 0.00 -0.11 0.00 0.00 41.96 41.18 1br2 s TYR 270 CO 0.17 0.02 0.57 -0.11 -1.11 0.00 0.00 175.55 175.09 1br2 n LEU 271 N 1.45 -2.01 -4.70 -1.29 7.94 -1.26 0.11 117.00 117.24 1br2 n LEU 271 Ca -0.21 -0.35 -0.42 0.00 -1.11 0.00 0.00 56.01 53.92 1br2 n LEU 271 Cb 0.54 -1.40 -0.03 0.00 0.53 0.00 0.00 43.42 43.06 1br2 n LEU 271 CO 0.21 0.11 0.66 -0.22 -1.11 0.00 0.00 177.39 177.04 1br2 s LEU 272 N -2.86 4.28 -1.16 -1.96 2.96 -1.26 -4.02 118.68 114.66 1br2 s LEU 272 Ca 0.25 1.45 -0.19 0.00 -0.22 0.00 0.00 54.13 55.41 1br2 s LEU 272 Cb -0.03 -3.42 -0.04 0.00 0.50 0.00 0.00 46.19 43.20 1br2 s LEU 272 CO 0.78 -0.33 1.96 1.21 -1.32 0.00 0.00 176.35 178.65 1br2 n GLU 273 N 4.51 2.25 -0.33 1.98 2.13 -0.58 -4.75 120.64 125.85 1br2 n GLU 273 Ca 0.05 -2.52 0.07 0.00 0.66 0.00 0.00 57.16 55.42 1br2 n GLU 273 Cb 0.50 -3.34 0.22 0.00 0.27 0.00 0.00 31.44 29.09 1br2 n GLU 273 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1br2 h LYS 274 N 7.81 0.82 -0.94 5.31 1.57 -1.91 -2.26 116.57 126.97 1br2 h LYS 274 Ca 0.41 -0.05 0.29 0.00 -1.87 0.00 0.00 60.65 59.43 1br2 h LYS 274 Cb 0.78 -0.19 -0.16 0.00 0.08 0.00 0.00 32.23 32.74 1br2 h LYS 274 CO 1.65 0.54 0.27 0.77 -0.57 0.00 0.00 179.45 182.11 1br2 h SER 275 N 0.85 -0.01 -0.34 0.86 0.02 -1.93 0.40 113.55 113.39 1br2 h SER 275 Ca 0.47 0.23 0.10 0.00 -0.84 0.00 0.00 61.79 61.75 1br2 h SER 275 Cb 0.53 0.31 -0.01 0.00 0.14 0.00 0.00 62.40 63.36 1br2 h SER 275 CO -0.29 -0.26 0.39 -0.09 -1.14 0.00 0.00 176.83 175.44 1br2 h ARG 276 N 0.13 0.00 -0.10 3.45 2.43 -1.59 -0.83 114.38 117.88 1br2 h ARG 276 Ca 0.64 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.83 1br2 h ARG 276 Cb 1.41 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.95 1br2 h ARG 276 CO -0.74 0.00 0.07 0.00 -1.51 0.00 0.00 179.97 177.79 1br2 h ALA 277 N 1.54 2.03 -0.06 2.80 0.00 -0.36 -3.16 119.26 122.05 1br2 h ALA 277 Ca 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1br2 h ALA 277 Cb 0.94 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1br2 h ALA 277 CO -0.00 -0.05 0.00 0.44 0.00 0.00 0.00 179.25 179.64 1br2 n ILE 278 N -4.52 0.27 -3.62 0.00 -5.35 -0.32 -4.84 119.36 100.97 1br2 n ILE 278 Ca -0.01 -0.63 -0.07 0.00 -0.27 0.00 0.00 62.75 61.76 1br2 n ILE 278 Cb 0.15 0.96 -0.06 0.00 -1.74 0.00 0.00 39.64 38.94 1br2 n ILE 278 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1br2 s ARG 279 N -0.65 0.37 -0.05 6.28 3.52 -1.19 -4.71 118.95 122.51 1br2 s ARG 279 Ca 0.09 0.28 -0.06 0.00 -0.13 0.00 0.00 55.73 55.91 1br2 s ARG 279 Cb 0.06 0.18 0.01 0.00 -1.56 0.00 0.00 34.95 33.63 1br2 s ARG 279 CO 0.08 -0.08 0.16 -0.65 -0.81 0.00 0.00 175.30 174.00 1br2 s GLN 280 N -0.33 0.26 1.09 5.12 1.11 -1.26 -4.32 119.66 121.32 1br2 s GLN 280 Ca 0.04 0.08 -0.17 0.00 0.01 0.00 0.00 55.36 55.31 1br2 s GLN 280 Cb -0.03 0.12 0.24 0.00 -1.01 0.00 0.00 33.01 32.32 1br2 s GLN 280 CO -0.07 -0.04 1.18 0.00 0.01 0.00 0.00 175.29 176.37 1br2 s ALA 281 N -0.26 1.25 0.41 6.09 0.00 -1.26 -4.60 121.76 123.39 1br2 s ALA 281 Ca -0.03 -0.95 -0.23 0.00 0.00 0.00 0.00 51.96 50.75 1br2 s ALA 281 Cb -0.03 -2.88 -0.13 0.00 0.00 0.00 0.00 23.12 20.09 1br2 s ALA 281 CO 0.01 -3.05 0.59 1.17 0.00 0.00 0.00 175.76 174.48 1br2 n LYS 282 N -4.32 0.63 -1.72 0.00 3.00 -1.26 -1.52 118.16 112.98 1br2 n LYS 282 Ca 0.13 0.23 -0.09 0.00 -0.00 0.00 0.00 58.31 58.57 1br2 n LYS 282 Cb 0.59 -1.54 -0.03 0.00 0.00 0.00 0.00 35.03 34.05 1br2 n LYS 282 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1br2 n ASP 283 N 1.23 -2.73 -4.46 3.14 8.00 -1.26 -4.85 116.55 115.62 1br2 n ASP 283 Ca 0.11 0.25 -0.29 0.00 0.71 0.00 0.00 54.79 55.57 1br2 n ASP 283 Cb 0.39 -2.56 -0.12 0.00 -0.02 0.00 0.00 41.12 38.81 1br2 n ASP 283 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1br2 s GLU 284 N -3.64 1.65 0.21 -1.24 2.02 -0.57 -4.66 118.70 112.48 1br2 s GLU 284 Ca 0.00 -1.24 0.04 0.00 0.02 0.00 0.00 54.97 53.79 1br2 s GLU 284 Cb 0.00 -2.04 -0.05 0.00 0.10 0.00 0.00 34.13 32.14 1br2 s GLU 284 CO 0.00 0.47 -0.03 -0.98 0.02 0.00 0.00 175.26 174.74 1br2 s ARG 285 N -2.13 1.28 0.00 1.61 1.70 -0.87 -4.50 118.95 116.03 1br2 s ARG 285 Ca 0.17 -1.62 0.00 0.00 -0.47 0.00 0.00 55.73 53.80 1br2 s ARG 285 Cb -0.10 -0.63 0.00 0.00 -0.57 0.00 0.00 34.95 33.65 1br2 s ARG 285 CO 0.09 -0.05 0.00 -2.37 -1.08 0.00 0.00 175.30 171.88 1br2 n THR 286 N -0.37 0.00 -1.68 4.99 5.66 -1.26 -3.81 114.28 117.81 1br2 n THR 286 Ca -0.06 0.00 -0.45 0.00 -3.05 0.00 0.00 64.05 60.48 1br2 n THR 286 Cb 0.63 -1.94 -0.04 0.00 -1.55 0.00 0.00 70.33 67.43 1br2 n THR 286 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 1br2 n PHE 287 N -1.12 2.40 -0.31 1.09 3.72 -1.26 -4.24 117.46 117.75 1br2 n PHE 287 Ca 0.00 0.13 0.10 0.00 -0.05 0.00 0.00 57.45 57.63 1br2 n PHE 287 Cb 0.00 -2.61 0.21 0.00 -0.94 0.00 0.00 39.48 36.14 1br2 n PHE 287 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1br2 n HIS 288 N 4.38 0.47 -0.36 1.38 8.25 -0.88 -0.83 115.22 127.63 1br2 n HIS 288 Ca 0.18 1.06 0.29 0.00 -0.26 0.00 0.00 57.72 58.99 1br2 n HIS 288 Cb 0.31 -1.10 0.58 0.00 1.12 0.00 0.00 29.99 30.90 1br2 n HIS 288 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 1br2 h ILE 289 N 0.00 0.38 0.19 1.59 6.09 -0.73 0.18 117.51 125.21 1br2 h ILE 289 Ca 0.49 -0.09 -0.01 0.00 -1.37 0.00 0.00 64.86 63.89 1br2 h ILE 289 Cb 0.94 0.11 0.00 0.00 0.47 0.00 0.00 36.82 38.34 1br2 h ILE 289 CO -0.85 0.05 -0.09 -0.26 -3.07 0.00 0.00 178.15 173.93 1br2 h PHE 290 N 0.25 -0.24 -0.07 2.19 0.04 -1.26 -0.66 116.94 117.19 1br2 h PHE 290 Ca 0.66 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 61.38 1br2 h PHE 290 Cb 1.94 0.08 -0.01 0.00 2.20 0.00 0.00 35.95 40.16 1br2 h PHE 290 CO -0.00 -0.01 -0.17 1.88 -0.60 0.00 0.00 178.31 179.41 1br2 h TYR 291 N -0.43 0.11 0.67 -0.55 0.05 -1.03 -1.59 116.97 114.20 1br2 h TYR 291 Ca -0.03 -0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.71 1br2 h TYR 291 Cb 0.33 -0.03 0.01 0.00 1.01 0.00 0.00 36.73 38.05 1br2 h TYR 291 CO -0.01 0.28 -0.32 1.88 -1.05 0.00 0.00 178.16 178.94 1br2 h TYR 292 N 0.10 -0.83 0.16 4.88 -1.99 -0.46 -1.60 116.97 117.22 1br2 h TYR 292 Ca 0.02 -0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.74 1br2 h TYR 292 Cb 0.37 0.28 -0.03 0.00 2.00 0.00 0.00 36.73 39.34 1br2 h TYR 292 CO 0.00 -0.50 -0.27 1.25 -0.00 0.00 0.00 178.16 178.64 1br2 h LEU 293 N -1.20 -0.75 -1.61 3.88 5.85 -1.05 0.31 115.31 120.72 1br2 h LEU 293 Ca -0.09 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.80 1br2 h LEU 293 Cb 0.71 0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.98 1br2 h LEU 293 CO 0.15 -0.37 0.40 0.40 -0.34 0.00 0.00 178.44 178.69 1br2 h ILE 294 N -0.50 0.91 0.00 4.05 2.04 -1.38 -1.26 117.51 121.37 1br2 h ILE 294 Ca 0.02 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1br2 h ILE 294 Cb 0.51 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1br2 h ILE 294 CO -0.13 0.08 -1.11 0.00 0.00 0.00 0.00 178.15 176.99 1br2 n ALA 295 N -2.51 2.89 -0.40 1.87 0.00 -0.60 -4.54 120.51 117.23 1br2 n ALA 295 Ca 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1br2 n ALA 295 Cb 0.35 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1br2 n ALA 295 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1br2 n GLY 296 N 1.27 0.56 3.75 0.00 0.00 0.10 -4.39 105.19 106.48 1br2 n GLY 296 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1br2 n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1br2 s ALA 297 N -0.57 3.50 0.66 4.61 0.00 -0.51 -4.93 121.76 124.52 1br2 s ALA 297 Ca 0.00 1.15 -0.17 0.00 0.00 0.00 0.00 51.96 52.94 1br2 s ALA 297 Cb 0.00 -3.46 -0.00 0.00 0.00 0.00 0.00 23.12 19.66 1br2 s ALA 297 CO 0.00 -0.53 1.24 -1.54 0.00 0.00 0.00 175.76 174.93 1br2 s SER 298 N -0.16 4.64 0.45 0.00 1.04 -1.26 -4.59 113.70 113.83 1br2 s SER 298 Ca 0.52 2.47 0.21 0.00 0.48 0.00 0.00 55.95 59.63 1br2 s SER 298 Cb -0.37 -2.60 1.19 0.00 0.10 0.00 0.00 66.02 64.34 1br2 s SER 298 CO 0.45 -1.97 1.86 -0.08 0.98 0.00 0.00 173.24 174.48 1br2 h GLU 299 N 0.37 0.29 0.00 4.02 4.81 -1.98 0.61 114.58 122.69 1br2 h GLU 299 Ca -0.50 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 58.62 1br2 h GLU 299 Cb 1.31 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 1br2 h GLU 299 CO 0.53 0.19 -0.47 1.96 -0.73 0.00 0.00 179.01 180.49 1br2 h GLN 300 N 0.29 0.00 0.11 1.92 4.20 -1.99 -2.79 115.11 116.86 1br2 h GLN 300 Ca 0.46 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.86 1br2 h GLN 300 Cb 1.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.10 1br2 h GLN 300 CO -0.14 0.47 -1.65 1.98 -0.67 0.00 0.00 178.83 178.82 1br2 h MET 301 N 0.00 0.24 -0.67 1.46 1.85 -0.94 -2.23 114.93 114.64 1br2 h MET 301 Ca -0.00 -0.41 0.14 0.00 -0.61 0.00 0.00 59.70 58.82 1br2 h MET 301 Cb 1.04 0.15 -0.11 0.00 0.43 0.00 0.00 31.60 33.11 1br2 h MET 301 CO 0.06 1.08 0.02 -0.09 -0.40 0.00 0.00 176.91 177.58 1br2 h ARG 302 N 0.06 0.13 -0.02 0.39 9.65 0.20 0.31 114.38 125.10 1br2 h ARG 302 Ca -0.29 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.58 1br2 h ARG 302 Cb 2.03 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 30.58 1br2 h ARG 302 CO 0.14 0.08 -0.30 0.27 2.80 0.00 0.00 179.97 182.97 1br2 n ASN 303 N -5.28 2.08 0.05 -3.80 2.04 -1.06 -0.06 115.26 109.21 1br2 n ASN 303 Ca 0.11 -1.54 -0.11 0.00 -0.44 0.00 0.00 54.58 52.60 1br2 n ASN 303 Cb 0.40 0.28 -0.13 0.00 -2.53 0.00 0.00 39.78 37.79 1br2 n ASN 303 CO 0.00 0.00 0.00 -0.78 -0.44 0.00 0.00 177.26 176.04 1br2 h ASP 304 N 2.79 0.15 0.15 0.53 3.58 -0.30 -3.25 116.42 120.08 1br2 h ASP 304 Ca 0.00 -0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.25 1br2 h ASP 304 Cb 0.76 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.76 1br2 h ASP 304 CO 0.00 1.16 -0.72 0.18 -2.88 0.00 0.00 179.24 176.98 1br2 n LEU 305 N -3.34 1.04 -3.46 2.28 4.77 0.87 -4.96 117.00 114.20 1br2 n LEU 305 Ca -0.09 -0.39 -0.23 0.00 -0.03 0.00 0.00 56.01 55.27 1br2 n LEU 305 Cb 1.00 -0.07 0.08 0.00 -2.33 0.00 0.00 43.42 42.09 1br2 n LEU 305 CO 0.48 0.23 0.23 0.18 -1.33 0.00 0.00 177.39 177.19 1br2 n LEU 306 N -1.18 -3.33 -4.77 2.23 4.77 -1.05 -4.88 117.00 108.78 1br2 n LEU 306 Ca 0.06 -0.51 -0.34 0.00 -0.03 0.00 0.00 56.01 55.19 1br2 n LEU 306 Cb 0.36 -2.94 0.02 0.00 -2.33 0.00 0.00 43.42 38.53 1br2 n LEU 306 CO 0.37 0.62 0.76 -0.76 -1.33 0.00 0.00 177.39 177.05 1br2 s LEU 307 N -7.06 3.56 0.00 2.23 1.43 0.91 -5.00 118.68 114.75 1br2 s LEU 307 Ca 0.56 2.07 0.00 0.00 -1.03 0.00 0.00 54.13 55.73 1br2 s LEU 307 Cb -0.25 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.41 1br2 s LEU 307 CO 0.69 -1.41 0.00 -0.62 0.23 0.00 0.00 176.35 175.24 1br2 n GLU 308 N -1.88 3.92 -3.33 1.70 1.02 -1.26 -4.81 120.64 116.00 1br2 n GLU 308 Ca 0.11 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 57.06 1br2 n GLU 308 Cb 0.52 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.92 1br2 n GLU 308 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1br2 s GLY 309 N -0.08 2.01 0.60 0.62 0.00 -1.26 -4.95 107.32 104.26 1br2 s GLY 309 Ca 0.00 -1.76 0.32 0.00 0.00 0.00 0.00 44.72 43.28 1br2 s GLY 309 CO 0.00 -1.59 2.23 0.74 0.00 0.00 0.00 173.10 174.49 1br2 h PHE 310 N 0.86 0.00 -0.37 1.90 0.04 -1.95 -1.24 116.94 116.18 1br2 h PHE 310 Ca -0.41 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.36 1br2 h PHE 310 Cb 1.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.42 1br2 h PHE 310 CO 0.46 0.00 0.00 0.27 -0.60 0.00 0.00 178.31 178.44 1br2 n ASN 311 N -3.71 4.00 -0.18 2.17 6.94 -1.26 -4.16 115.26 119.07 1br2 n ASN 311 Ca -0.02 -2.69 0.08 0.00 -0.02 0.00 0.00 54.58 51.93 1br2 n ASN 311 Cb 0.14 -0.49 -0.05 0.00 -2.36 0.00 0.00 39.78 37.01 1br2 n ASN 311 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1br2 n ASN 312 N 0.09 1.18 -4.35 0.53 5.03 -0.47 -4.91 115.26 112.37 1br2 n ASN 312 Ca 0.20 -1.09 -0.34 0.00 0.87 0.00 0.00 54.58 54.22 1br2 n ASN 312 Cb 0.82 0.76 -0.14 0.00 -1.02 0.00 0.00 39.78 40.20 1br2 n ASN 312 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1br2 s TYR 313 N -2.28 2.93 -0.55 3.10 2.02 -1.22 -4.90 117.35 116.44 1br2 s TYR 313 Ca 0.10 -0.77 0.24 0.00 -0.37 0.00 0.00 57.07 56.27 1br2 s TYR 313 Cb 0.13 -2.01 0.48 0.00 -0.40 0.00 0.00 41.96 40.16 1br2 s TYR 313 CO 0.56 -0.38 1.59 0.00 -1.57 0.00 0.00 175.55 175.74 1br2 h THR 314 N 5.54 0.00 0.00 -0.71 1.03 -1.85 -3.03 112.91 113.89 1br2 h THR 314 Ca -0.36 -0.76 0.00 0.00 -0.01 0.00 0.00 66.41 65.29 1br2 h THR 314 Cb 1.18 1.67 0.00 0.00 -1.07 0.00 0.00 68.15 69.92 1br2 h THR 314 CO 0.60 0.00 0.00 0.49 -0.01 0.00 0.00 175.52 176.60 1br2 n PHE 315 N -2.65 0.34 -2.16 0.00 3.01 -1.26 -3.55 117.46 111.18 1br2 n PHE 315 Ca 0.04 0.11 -0.39 0.00 1.01 0.00 0.00 57.45 58.22 1br2 n PHE 315 Cb 0.49 -0.68 0.00 0.00 -0.01 0.00 0.00 39.48 39.28 1br2 n PHE 315 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1br2 n LEU 316 N -1.79 7.61 0.00 4.37 4.77 -1.15 -4.12 117.00 126.70 1br2 n LEU 316 Ca 0.05 -4.98 0.00 0.00 -0.03 0.00 0.00 56.01 51.05 1br2 n LEU 316 Cb 0.30 -1.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 1br2 n LEU 316 CO 0.24 2.00 0.00 -1.20 -1.33 0.00 0.00 177.39 177.10 1br2 n SER 317 N 0.84 0.00 -3.37 -1.43 7.64 -1.23 -0.51 113.62 115.56 1br2 n SER 317 Ca 0.55 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 60.05 1br2 n SER 317 Cb 0.28 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.46 1br2 n SER 317 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1br2 n ASN 318 N -0.06 7.67 0.00 6.43 3.02 -1.26 -4.94 115.26 126.11 1br2 n ASN 318 Ca 0.00 -2.60 0.00 0.00 -0.03 0.00 0.00 54.58 51.95 1br2 n ASN 318 Cb 0.00 -1.54 0.00 0.00 -0.61 0.00 0.00 39.78 37.63 1br2 n ASN 318 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1br2 n GLY 319 N 3.69 0.23 3.48 7.41 0.00 0.33 -3.56 105.19 116.77 1br2 n GLY 319 Ca 0.72 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 46.30 1br2 n GLY 319 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1br2 s HIS 320 N 0.00 3.05 -0.53 1.61 5.65 -1.26 -4.95 115.29 118.86 1br2 s HIS 320 Ca 0.00 -0.30 -0.14 0.00 0.25 0.00 0.00 55.06 54.87 1br2 s HIS 320 Cb 0.00 -3.42 0.13 0.00 -1.18 0.00 0.00 32.58 28.11 1br2 s HIS 320 CO 0.00 -0.95 0.46 0.08 -0.65 0.00 0.00 174.74 173.68 1br2 s VAL 321 N 2.72 4.92 0.47 0.89 1.01 -1.23 -5.07 120.40 124.12 1br2 s VAL 321 Ca 0.18 -1.63 -0.25 0.00 0.00 0.00 0.00 61.98 60.29 1br2 s VAL 321 Cb -0.17 -4.17 -0.08 0.00 0.00 0.00 0.00 36.38 31.97 1br2 s VAL 321 CO 0.15 -0.85 1.42 -0.81 0.00 0.00 0.00 175.10 175.01 1br2 n PRO 322 N 5.09 2.14 -2.74 2.72 -0.04 -1.26 -4.98 135.00 135.93 1br2 n PRO 322 Ca -0.11 0.77 -0.24 0.00 -0.04 0.00 0.00 63.50 63.87 1br2 n PRO 322 Cb 0.40 -2.62 0.02 0.00 -0.04 0.00 0.00 33.50 31.26 1br2 n PRO 322 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1br2 s ILE 323 N -1.21 3.87 0.00 0.52 1.01 -1.26 -5.08 121.20 119.05 1br2 s ILE 323 Ca 0.63 -0.29 0.00 0.00 0.00 0.00 0.00 60.65 61.00 1br2 s ILE 323 Cb -0.44 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 38.56 1br2 s ILE 323 CO 0.56 -0.39 0.08 -2.65 0.00 0.00 0.00 174.94 172.53 1br2 n PRO 324 N -2.28 0.00 -2.19 2.79 -0.02 -1.26 -4.23 135.00 127.80 1br2 n PRO 324 Ca 0.03 0.01 -0.38 0.00 -2.02 0.00 0.00 63.50 61.13 1br2 n PRO 324 Cb 0.58 -0.58 0.03 0.00 -0.02 0.00 0.00 33.50 33.50 1br2 n PRO 324 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1br2 n ALA 325 N -2.60 6.18 -2.93 3.55 0.00 -1.26 -4.95 120.51 118.49 1br2 n ALA 325 Ca 0.00 -4.28 -0.10 0.00 0.00 0.00 0.00 53.44 49.05 1br2 n ALA 325 Cb 0.00 -1.82 -0.12 0.00 0.00 0.00 0.00 19.45 17.51 1br2 n ALA 325 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1br2 s GLN 326 N -4.05 0.23 -0.34 0.00 2.00 -1.26 -5.12 119.66 111.12 1br2 s GLN 326 Ca 0.48 -0.42 0.02 0.00 -2.00 0.00 0.00 55.36 53.44 1br2 s GLN 326 Cb 0.37 0.03 0.10 0.00 0.80 0.00 0.00 33.01 34.32 1br2 s GLN 326 CO -0.31 -0.02 0.09 -0.65 -0.50 0.00 0.00 175.29 173.89 1br2 s GLN 327 N -0.99 1.10 0.15 1.67 -0.21 -1.26 -4.59 119.66 115.53 1br2 s GLN 327 Ca -0.10 -1.51 -0.18 0.00 0.02 0.00 0.00 55.36 53.59 1br2 s GLN 327 Cb -0.07 -2.55 0.07 0.00 1.00 0.00 0.00 33.01 31.46 1br2 s GLN 327 CO -0.01 -0.98 1.14 -0.25 -2.12 0.00 0.00 175.29 173.07 1br2 n ASP 328 N 4.47 -0.62 -0.30 5.90 8.00 -1.26 0.25 116.55 132.98 1br2 n ASP 328 Ca 0.01 1.30 0.13 0.00 0.71 0.00 0.00 54.79 56.94 1br2 n ASP 328 Cb 0.41 -0.24 0.36 0.00 -0.02 0.00 0.00 41.12 41.64 1br2 n ASP 328 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 1br2 h ASP 329 N 0.00 0.69 0.26 -2.24 2.03 -1.81 0.18 116.42 115.53 1br2 h ASP 329 Ca 0.19 0.05 -0.01 0.00 -0.73 0.00 0.00 57.03 56.53 1br2 h ASP 329 Cb 0.38 -0.08 0.00 0.00 -0.83 0.00 0.00 39.33 38.80 1br2 h ASP 329 CO -0.72 0.32 -0.12 -0.33 -1.03 0.00 0.00 179.24 177.36 1br2 h GLU 330 N 0.71 -0.33 -0.51 4.15 5.08 0.28 -3.06 114.58 120.90 1br2 h GLU 330 Ca 0.49 0.02 0.15 0.00 -1.00 0.00 0.00 59.36 59.02 1br2 h GLU 330 Cb 0.80 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1br2 h GLU 330 CO -0.25 0.02 0.37 0.52 -1.00 0.00 0.00 179.01 178.67 1br2 h MET 331 N -0.78 0.01 -0.40 2.33 2.86 -0.06 0.11 114.93 119.00 1br2 h MET 331 Ca -0.04 -0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.55 1br2 h MET 331 Cb 0.51 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 1br2 h MET 331 CO 0.06 0.01 0.02 0.35 1.06 0.00 0.00 176.91 178.41 1br2 h PHE 332 N 0.01 0.75 -0.03 -0.22 3.57 -0.56 0.38 116.94 120.84 1br2 h PHE 332 Ca 0.24 -0.12 -0.13 0.00 3.53 0.00 0.00 57.97 61.49 1br2 h PHE 332 Cb 0.96 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 1br2 h PHE 332 CO -0.00 0.75 -0.59 1.96 -2.23 0.00 0.00 178.31 178.21 1br2 h GLN 333 N 0.53 0.10 -0.56 1.11 1.08 -1.14 -0.65 115.11 115.57 1br2 h GLN 333 Ca 0.12 -0.07 -0.08 0.00 -1.45 0.00 0.00 58.65 57.17 1br2 h GLN 333 Cb 0.44 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.86 1br2 h GLN 333 CO 0.02 0.66 0.04 0.93 -0.95 0.00 0.00 178.83 179.52 1br2 h GLU 334 N 0.07 0.97 -0.02 1.46 5.08 -0.57 0.10 114.58 121.68 1br2 h GLU 334 Ca -0.01 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 1br2 h GLU 334 Cb 1.06 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.21 1br2 h GLU 334 CO 0.08 0.95 -0.01 1.15 -1.00 0.00 0.00 179.01 180.18 1br2 h THR 335 N 0.86 1.35 -0.45 1.13 2.02 0.05 -2.02 112.91 115.84 1br2 h THR 335 Ca 0.16 -1.06 0.00 0.00 0.77 0.00 0.00 66.41 66.29 1br2 h THR 335 Cb 0.49 2.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.90 1br2 h THR 335 CO 0.02 0.28 0.28 -0.07 0.37 0.00 0.00 175.52 176.41 1br2 h LEU 336 N -0.38 0.52 -0.38 2.58 3.38 -1.05 0.18 115.31 120.16 1br2 h LEU 336 Ca 0.00 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1br2 h LEU 336 Cb 0.46 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1br2 h LEU 336 CO 0.00 0.39 0.14 -0.08 0.09 0.00 0.00 178.44 178.99 1br2 h GLU 337 N 0.61 0.58 -0.29 1.13 4.81 -0.62 0.36 114.58 121.16 1br2 h GLU 337 Ca 0.16 -0.11 -0.17 0.00 -0.13 0.00 0.00 59.36 59.11 1br2 h GLU 337 Cb -0.05 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.24 1br2 h GLU 337 CO -0.03 0.57 -0.51 0.00 -0.73 0.00 0.00 179.01 178.31 1br2 h ALA 338 N 0.99 0.55 -0.57 2.92 0.00 -0.67 0.05 119.26 122.52 1br2 h ALA 338 Ca 0.13 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1br2 h ALA 338 Cb 0.21 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1br2 h ALA 338 CO -0.01 0.68 0.25 0.52 0.00 0.00 0.00 179.25 180.69 1br2 h MET 339 N 0.64 0.83 0.33 0.00 2.86 -0.56 0.60 114.93 119.63 1br2 h MET 339 Ca 0.02 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1br2 h MET 339 Cb 1.10 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.59 1br2 h MET 339 CO 0.11 0.70 -0.41 1.15 1.06 0.00 0.00 176.91 179.52 1br2 h THR 340 N 0.77 0.18 -0.95 2.22 2.02 -0.64 0.30 112.91 116.80 1br2 h THR 340 Ca 0.19 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.44 1br2 h THR 340 Cb 0.16 0.18 -0.06 0.00 -1.74 0.00 0.00 68.15 66.68 1br2 h THR 340 CO -0.02 0.00 0.61 0.40 0.37 0.00 0.00 175.52 176.88 1br2 h ILE 341 N -0.79 1.06 0.00 3.11 2.04 -0.65 0.19 117.51 122.47 1br2 h ILE 341 Ca -0.02 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1br2 h ILE 341 Cb 0.72 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1br2 h ILE 341 CO -0.11 0.20 0.00 -0.03 0.00 0.00 0.00 178.15 178.21 1br2 h MET 342 N 1.07 0.00 0.00 2.37 4.05 0.10 -3.44 114.93 119.08 1br2 h MET 342 Ca 0.42 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.84 1br2 h MET 342 Cb 0.22 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.02 1br2 h MET 342 CO -0.17 0.00 0.00 0.41 0.23 0.00 0.00 176.91 177.38 1br2 n GLY 343 N -0.81 1.17 3.73 1.39 0.00 0.66 -4.85 105.19 106.49 1br2 n GLY 343 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1br2 n GLY 343 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1br2 s PHE 344 N -2.00 3.47 0.56 1.61 0.40 -0.02 -5.00 117.98 117.00 1br2 s PHE 344 Ca 0.00 1.43 -0.16 0.00 -0.60 0.00 0.00 56.93 57.61 1br2 s PHE 344 Cb 0.00 -3.39 -0.06 0.00 0.51 0.00 0.00 43.02 40.08 1br2 s PHE 344 CO 0.00 -1.09 1.02 0.95 0.70 0.00 0.00 175.22 176.80 1br2 s THR 345 N 0.17 4.22 0.37 0.64 -4.23 -1.26 -4.49 115.64 111.06 1br2 s THR 345 Ca 0.53 1.03 0.13 0.00 -1.18 0.00 0.00 61.69 62.20 1br2 s THR 345 Cb -0.31 -3.57 0.35 0.00 1.34 0.00 0.00 72.50 70.30 1br2 s THR 345 CO 0.34 -0.64 1.81 -0.33 -0.54 0.00 0.00 174.62 175.26 1br2 h GLU 346 N 0.58 0.55 0.00 3.99 4.39 -1.99 0.32 114.58 122.42 1br2 h GLU 346 Ca -0.47 -0.03 -0.15 0.00 0.34 0.00 0.00 59.36 59.05 1br2 h GLU 346 Cb 1.20 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.71 1br2 h GLU 346 CO 0.60 0.36 -0.71 1.05 -1.16 0.00 0.00 179.01 179.15 1br2 h GLU 347 N 0.56 0.00 -0.43 2.33 9.09 -1.98 -0.79 114.58 123.36 1br2 h GLU 347 Ca 0.53 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.84 1br2 h GLU 347 Cb 1.09 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.18 1br2 h GLU 347 CO -0.27 0.71 -0.10 0.93 0.05 0.00 0.00 179.01 180.32 1br2 h GLU 348 N 0.00 0.84 -0.44 1.06 5.08 -0.81 -0.14 114.58 120.17 1br2 h GLU 348 Ca -0.01 -0.32 -0.09 0.00 -1.00 0.00 0.00 59.36 57.94 1br2 h GLU 348 Cb 1.30 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1br2 h GLU 348 CO 0.09 0.95 -0.09 1.96 -1.00 0.00 0.00 179.01 180.92 1br2 h GLN 349 N 0.66 0.83 0.00 2.33 4.20 -0.84 -1.09 115.11 121.20 1br2 h GLN 349 Ca 0.11 -0.31 -0.11 0.00 0.06 0.00 0.00 58.65 58.39 1br2 h GLN 349 Cb 0.64 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.35 1br2 h GLN 349 CO 0.04 0.94 -0.55 1.79 -0.67 0.00 0.00 178.83 180.38 1br2 h THR 350 N 0.66 1.23 -0.24 -0.54 1.35 -1.08 -0.63 112.91 113.66 1br2 h THR 350 Ca 0.11 -1.98 -0.17 0.00 -0.55 0.00 0.00 66.41 63.82 1br2 h THR 350 Cb 0.62 2.12 -0.00 0.00 -1.73 0.00 0.00 68.15 69.15 1br2 h THR 350 CO 0.04 0.54 -0.53 0.28 -0.25 0.00 0.00 175.52 175.60 1br2 h SER 351 N 0.00 0.77 0.01 5.36 0.02 -0.83 0.68 113.55 119.57 1br2 h SER 351 Ca -0.01 -0.41 -0.00 0.00 -0.84 0.00 0.00 61.79 60.54 1br2 h SER 351 Cb 1.07 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.39 1br2 h SER 351 CO 0.07 1.15 -0.01 0.40 -1.14 0.00 0.00 176.83 177.31 1br2 h ILE 352 N 0.54 1.25 -0.10 3.27 2.04 -0.97 -1.94 117.51 121.61 1br2 h ILE 352 Ca 0.02 -0.81 -0.02 0.00 1.00 0.00 0.00 64.86 65.05 1br2 h ILE 352 Cb 1.10 1.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.97 1br2 h ILE 352 CO 0.11 0.21 -0.02 -0.07 0.00 0.00 0.00 178.15 178.37 1br2 h LEU 353 N -0.36 0.12 -0.51 1.44 3.38 -1.08 -1.14 115.31 117.16 1br2 h LEU 353 Ca -0.00 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1br2 h LEU 353 Cb 0.35 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1br2 h LEU 353 CO 0.00 0.17 -0.13 -0.09 0.09 0.00 0.00 178.44 178.48 1br2 h ARG 354 N 0.14 0.99 -0.41 1.13 2.43 -0.62 -1.62 114.38 116.42 1br2 h ARG 354 Ca 0.03 -0.38 -0.09 0.00 -0.81 0.00 0.00 59.98 58.73 1br2 h ARG 354 Cb 0.13 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1br2 h ARG 354 CO 0.00 1.06 -0.11 0.28 -1.51 0.00 0.00 179.97 179.70 1br2 h VAL 355 N 0.85 1.25 -0.56 0.20 2.07 -0.51 -1.18 116.25 118.38 1br2 h VAL 355 Ca 0.13 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.50 1br2 h VAL 355 Cb 0.70 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 1br2 h VAL 355 CO 0.05 0.39 0.31 0.58 0.02 0.00 0.00 177.57 178.92 1br2 h VAL 356 N 0.66 1.18 -0.56 2.57 2.07 -0.93 -1.75 116.25 119.49 1br2 h VAL 356 Ca 0.11 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 1br2 h VAL 356 Cb 0.57 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1br2 h VAL 356 CO 0.04 0.19 0.31 -1.28 0.02 0.00 0.00 177.57 176.85 1br2 h SER 357 N 0.75 0.70 -0.77 0.57 0.87 -0.77 -2.42 113.55 112.48 1br2 h SER 357 Ca 0.20 -0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1br2 h SER 357 Cb 0.03 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 61.78 1br2 h SER 357 CO -0.03 0.59 0.47 0.77 -0.53 0.00 0.00 176.83 178.10 1br2 h SER 358 N 0.76 0.92 -0.08 6.23 4.64 -0.91 0.15 113.55 125.25 1br2 h SER 358 Ca 0.20 -0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 61.44 1br2 h SER 358 Cb 0.04 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 1br2 h SER 358 CO -0.03 0.70 -0.03 0.58 -0.87 0.00 0.00 176.83 177.18 1br2 h VAL 359 N 1.06 1.14 0.11 0.95 2.07 -0.85 0.44 116.25 121.17 1br2 h VAL 359 Ca 0.28 -0.57 -0.27 0.00 0.82 0.00 0.00 66.70 66.96 1br2 h VAL 359 Cb -0.05 1.03 0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1br2 h VAL 359 CO -0.05 0.19 -1.13 -0.07 0.02 0.00 0.00 177.57 176.52 1br2 h LEU 360 N 0.28 0.81 -1.46 2.57 3.38 -0.82 -3.26 115.31 116.81 1br2 h LEU 360 Ca 0.06 -0.83 -0.05 0.00 0.09 0.00 0.00 57.88 57.16 1br2 h LEU 360 Cb 0.24 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1br2 h LEU 360 CO 0.01 1.55 -0.20 -0.61 0.09 0.00 0.00 178.44 179.29 1br2 h GLN 361 N 0.18 0.11 -0.98 1.13 5.75 -0.56 -1.61 115.11 119.13 1br2 h GLN 361 Ca -0.17 -0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.36 1br2 h GLN 361 Cb 1.82 -0.01 -0.06 0.00 1.07 0.00 0.00 27.48 30.30 1br2 h GLN 361 CO 0.22 0.31 0.63 -0.07 -2.65 0.00 0.00 178.83 177.26 1br2 h LEU 362 N 0.10 1.02 -2.04 -2.39 3.38 -0.97 0.24 115.31 114.65 1br2 h LEU 362 Ca 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1br2 h LEU 362 Cb 0.41 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1br2 h LEU 362 CO 0.03 0.67 -0.02 1.23 0.09 0.00 0.00 178.44 180.43 1br2 h GLY 363 N 1.17 0.00 2.00 0.83 0.00 -1.36 -2.50 103.07 103.22 1br2 h GLY 363 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.74 1br2 h GLY 363 CO -0.16 0.00 0.00 3.43 0.00 0.00 0.00 176.54 179.81 1br2 h ASN 364 N 0.00 0.00 -3.81 0.19 4.21 -0.93 -3.43 115.58 111.80 1br2 h ASN 364 Ca -0.00 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.96 1br2 h ASN 364 Cb 0.04 0.00 0.12 0.00 -1.12 0.00 0.00 38.32 37.36 1br2 h ASN 364 CO 0.00 0.00 0.69 -0.38 -1.29 0.00 0.00 177.43 176.45 1br2 n ILE 365 N -2.60 2.31 -4.34 2.81 5.41 -0.94 -4.86 119.36 117.15 1br2 n ILE 365 Ca 0.04 -0.50 -0.20 0.00 1.00 0.00 0.00 62.75 63.08 1br2 n ILE 365 Cb 0.40 -1.84 -0.16 0.00 -0.71 0.00 0.00 39.64 37.33 1br2 n ILE 365 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1br2 s VAL 366 N -1.15 0.73 0.12 1.39 1.01 -1.26 -5.08 120.40 116.15 1br2 s VAL 366 Ca 0.57 -0.30 0.07 0.00 0.00 0.00 0.00 61.98 62.31 1br2 s VAL 366 Cb -0.48 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1br2 s VAL 366 CO 0.61 0.24 -0.08 -0.36 0.00 0.00 0.00 175.10 175.51 1br2 s PHE 367 N 0.39 2.76 0.18 5.22 0.08 -1.26 -4.21 117.98 121.14 1br2 s PHE 367 Ca -0.06 -0.15 0.10 0.00 0.12 0.00 0.00 56.93 56.94 1br2 s PHE 367 Cb -0.10 -1.43 -0.04 0.00 -0.57 0.00 0.00 43.02 40.88 1br2 s PHE 367 CO 0.01 0.45 -0.21 0.15 -0.10 0.00 0.00 175.22 175.51 1br2 s LYS 368 N -2.33 1.40 0.00 0.44 1.02 -0.17 -4.89 119.74 115.20 1br2 s LYS 368 Ca 0.23 -1.46 0.00 0.00 0.02 0.00 0.00 55.97 54.76 1br2 s LYS 368 Cb -0.11 -1.61 0.00 0.00 -0.52 0.00 0.00 37.83 35.60 1br2 s LYS 368 CO 0.15 0.34 0.00 1.63 -0.92 0.00 0.00 175.35 176.55 1br2 n LYS 369 N 0.32 0.50 0.00 1.68 4.76 -1.26 -0.73 118.16 123.44 1br2 n LYS 369 Ca -0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.31 1br2 n LYS 369 Cb 0.56 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.75 1br2 n LYS 369 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1br2 n GLU 370 N -0.82 0.00 0.00 1.97 1.02 -1.26 -4.70 120.64 116.85 1br2 n GLU 370 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1br2 n GLU 370 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1br2 n GLU 370 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1br2 n GLN 375 N 0.00 0.00 -4.42 3.49 7.27 -1.26 -5.15 117.38 117.31 1br2 n GLN 375 Ca 0.00 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.86 1br2 n GLN 375 Cb 0.00 0.00 -0.13 0.00 2.41 0.00 0.00 30.24 32.52 1br2 n GLN 375 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1br2 s ALA 376 N 0.00 1.32 -0.05 1.69 0.00 -0.80 -4.56 121.76 119.36 1br2 s ALA 376 Ca 0.00 -0.89 -0.02 0.00 0.00 0.00 0.00 51.96 51.05 1br2 s ALA 376 Cb 0.00 -0.22 0.03 0.00 0.00 0.00 0.00 23.12 22.93 1br2 s ALA 376 CO 0.00 0.26 0.11 -1.54 0.00 0.00 0.00 175.76 174.59 1br2 s SER 377 N -1.16 -0.07 -0.57 0.00 1.04 0.09 -4.86 113.70 108.17 1br2 s SER 377 Ca 0.03 0.22 -0.21 0.00 0.48 0.00 0.00 55.95 56.47 1br2 s SER 377 Cb -0.08 0.14 0.06 0.00 0.10 0.00 0.00 66.02 66.24 1br2 s SER 377 CO 0.01 -0.12 0.81 0.00 0.98 0.00 0.00 173.24 174.92 1br2 s MET 378 N 0.89 3.16 0.19 4.02 0.23 -1.26 -1.00 119.30 125.53 1br2 s MET 378 Ca -0.07 -0.77 -0.10 0.00 -1.03 0.00 0.00 55.69 53.71 1br2 s MET 378 Cb -0.09 -4.14 0.11 0.00 -1.53 0.00 0.00 34.83 29.17 1br2 s MET 378 CO -0.04 -1.49 1.76 -1.35 -2.03 0.00 0.00 175.02 171.86 1br2 h PRO 379 N 9.25 1.00 -4.66 3.16 0.11 -1.96 -3.38 132.00 135.52 1br2 h PRO 379 Ca -0.28 -0.17 -0.69 0.00 0.11 0.00 0.00 66.00 64.97 1br2 h PRO 379 Cb 1.08 -0.17 -0.20 0.00 0.11 0.00 0.00 31.00 31.82 1br2 h PRO 379 CO 1.07 0.82 -0.48 0.34 -0.21 0.00 0.00 178.00 179.55 1br2 s ASP 380 N -6.17 6.00 0.00 -2.05 -1.08 -1.26 -4.93 116.67 107.18 1br2 s ASP 380 Ca -0.13 -0.59 0.23 0.00 -0.52 0.00 0.00 52.55 51.55 1br2 s ASP 380 Cb 0.14 -2.12 0.14 0.00 -1.46 0.00 0.00 42.92 39.62 1br2 s ASP 380 CO 0.81 -0.29 1.18 -0.46 0.52 0.00 0.00 175.17 176.92 1br2 n ASN 381 N 5.10 1.75 -0.21 -0.34 6.94 -1.26 -4.54 115.26 122.70 1br2 n ASN 381 Ca -0.12 -1.34 -0.05 0.00 -0.02 0.00 0.00 54.58 53.04 1br2 n ASN 381 Cb 0.49 0.44 -0.05 0.00 -2.36 0.00 0.00 39.78 38.30 1br2 n ASN 381 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 1br2 n THR 382 N -0.26 -0.34 -0.14 5.53 -1.04 -1.26 0.14 114.28 116.92 1br2 n THR 382 Ca 0.09 1.70 -0.04 0.00 -2.04 0.00 0.00 64.05 63.76 1br2 n THR 382 Cb 0.43 -2.14 0.03 0.00 -1.82 0.00 0.00 70.33 66.83 1br2 n THR 382 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1br2 h ALA 383 N -0.09 0.34 -0.71 2.41 0.00 -1.89 0.54 119.26 119.87 1br2 h ALA 383 Ca 0.08 0.15 0.15 0.00 0.00 0.00 0.00 54.91 55.29 1br2 h ALA 383 Cb 0.20 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1br2 h ALA 383 CO -0.46 -0.43 0.48 0.00 0.00 0.00 0.00 179.25 178.84 1br2 h ALA 384 N 1.42 2.18 0.18 0.00 0.00 -0.01 0.18 119.26 123.21 1br2 h ALA 384 Ca 0.22 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1br2 h ALA 384 Cb 0.33 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1br2 h ALA 384 CO -0.42 -0.37 -0.09 1.96 0.00 0.00 0.00 179.25 180.33 1br2 h GLN 385 N 0.34 -0.23 -0.33 0.00 4.20 0.61 -2.60 115.11 117.10 1br2 h GLN 385 Ca 0.34 0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.11 1br2 h GLN 385 Cb 0.86 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.66 1br2 h GLN 385 CO -0.09 0.16 0.08 0.87 -0.67 0.00 0.00 178.83 179.18 1br2 h LYS 386 N -0.72 0.20 -0.32 1.46 1.57 0.24 0.77 116.57 119.77 1br2 h LYS 386 Ca -0.02 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1br2 h LYS 386 Cb 0.50 -0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.70 1br2 h LYS 386 CO 0.04 0.13 -0.13 0.28 -0.57 0.00 0.00 179.45 179.20 1br2 h VAL 387 N 0.20 0.57 -0.54 0.50 2.07 -0.76 0.13 116.25 118.42 1br2 h VAL 387 Ca 0.15 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.62 1br2 h VAL 387 Cb 0.16 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1br2 h VAL 387 CO -0.19 0.00 0.12 0.00 0.02 0.00 0.00 177.57 177.52 1br2 h HIS 389 N 0.81 1.07 0.00 0.00 6.17 0.54 0.16 115.15 123.90 1br2 h HIS 389 Ca 0.18 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.27 1br2 h HIS 389 Cb 0.31 -0.36 0.00 0.00 2.52 0.00 0.00 27.41 29.88 1br2 h HIS 389 CO 0.02 0.69 -0.00 1.28 0.71 0.00 0.00 177.93 180.63 1br2 n LEU 390 N -4.48 0.52 -0.07 0.26 4.77 0.31 -3.68 117.00 114.64 1br2 n LEU 390 Ca 0.09 0.55 0.07 0.00 -0.03 0.00 0.00 56.01 56.68 1br2 n LEU 390 Cb 0.03 -0.38 -0.06 0.00 -2.33 0.00 0.00 43.42 40.68 1br2 n LEU 390 CO 0.37 -0.11 0.03 0.23 -1.33 0.00 0.00 177.39 176.57 1br2 n MET 391 N -1.98 2.31 -2.98 3.23 2.81 0.11 -4.84 117.12 115.78 1br2 n MET 391 Ca 0.06 -0.17 -0.11 0.00 -1.81 0.00 0.00 57.70 55.68 1br2 n MET 391 Cb 0.40 -1.17 0.04 0.00 -0.71 0.00 0.00 33.22 31.78 1br2 n MET 391 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1br2 n GLY 392 N 1.27 0.28 3.48 3.03 0.00 0.47 -4.42 105.19 109.29 1br2 n GLY 392 Ca 0.03 -0.26 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 1br2 n GLY 392 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1br2 s ILE 393 N -3.14 1.95 -0.30 -0.61 1.09 -0.81 -1.07 121.20 118.30 1br2 s ILE 393 Ca 0.25 -2.17 -0.16 0.00 -1.10 0.00 0.00 60.65 57.47 1br2 s ILE 393 Cb -0.11 -2.53 -0.02 0.00 -1.06 0.00 0.00 42.46 38.73 1br2 s ILE 393 CO 0.33 -0.26 0.43 0.21 -0.10 0.00 0.00 174.94 175.54 1br2 s ASN 394 N -3.52 6.28 0.32 3.58 2.47 -1.26 -4.56 114.94 118.25 1br2 s ASN 394 Ca 0.31 0.15 0.10 0.00 0.42 0.00 0.00 52.86 53.83 1br2 s ASN 394 Cb 0.03 -2.23 0.96 0.00 -1.45 0.00 0.00 41.25 38.55 1br2 s ASN 394 CO 0.14 -0.30 1.63 0.58 -3.72 0.00 0.00 177.10 175.44 1br2 h VAL 395 N 5.47 0.23 0.05 -5.21 2.07 -1.92 0.44 116.25 117.38 1br2 h VAL 395 Ca -0.30 -0.07 -0.23 0.00 0.82 0.00 0.00 66.70 66.92 1br2 h VAL 395 Cb 1.15 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1br2 h VAL 395 CO 0.69 0.04 -1.04 0.71 0.02 0.00 0.00 177.57 177.99 1br2 h THR 396 N 0.20 1.55 -0.14 2.57 1.35 -1.96 0.39 112.91 116.86 1br2 h THR 396 Ca 0.67 -2.98 -0.17 0.00 -0.55 0.00 0.00 66.41 63.38 1br2 h THR 396 Cb 1.51 2.73 -0.00 0.00 -1.73 0.00 0.00 68.15 70.66 1br2 h THR 396 CO -0.68 0.86 -0.63 0.44 -0.25 0.00 0.00 175.52 175.26 1br2 h ASP 397 N 0.07 0.59 0.57 5.36 5.19 -1.35 -1.78 116.42 125.07 1br2 h ASP 397 Ca -0.07 -0.34 -0.03 0.00 -0.62 0.00 0.00 57.03 55.97 1br2 h ASP 397 Cb 1.74 -0.17 0.01 0.00 0.18 0.00 0.00 39.33 41.08 1br2 h ASP 397 CO 0.16 1.07 -0.28 0.15 -3.12 0.00 0.00 179.24 177.22 1br2 h PHE 398 N 0.38 -0.71 -1.03 4.55 3.57 -0.22 -1.58 116.94 121.89 1br2 h PHE 398 Ca -0.01 -0.02 0.26 0.00 3.53 0.00 0.00 57.97 61.74 1br2 h PHE 398 Cb 1.19 0.24 -0.11 0.00 2.79 0.00 0.00 35.95 40.05 1br2 h PHE 398 CO 0.05 -0.44 0.63 1.15 -2.23 0.00 0.00 178.31 177.47 1br2 h THR 399 N -1.20 0.50 0.03 4.41 2.02 -0.96 0.21 112.91 117.93 1br2 h THR 399 Ca -0.08 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 1br2 h THR 399 Cb 0.60 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1br2 h THR 399 CO 0.13 0.09 -0.01 0.03 0.37 0.00 0.00 175.52 176.12 1br2 h ARG 400 N 0.48 -0.04 0.00 6.66 3.08 -1.28 0.47 114.38 123.75 1br2 h ARG 400 Ca 0.64 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.68 1br2 h ARG 400 Cb 1.41 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.46 1br2 h ARG 400 CO -0.41 0.39 -0.07 0.77 -1.07 0.00 0.00 179.97 179.57 1br2 h SER 401 N -0.47 0.00 0.01 7.04 0.02 -0.23 0.78 113.55 120.69 1br2 h SER 401 Ca -0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 1br2 h SER 401 Cb 0.44 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1br2 h SER 401 CO 0.01 0.07 -0.29 0.40 -1.14 0.00 0.00 176.83 175.88 1br2 h ILE 402 N 0.00 1.61 0.00 3.27 1.08 -0.94 -3.26 117.51 119.26 1br2 h ILE 402 Ca -0.00 -2.32 -0.00 0.00 -0.39 0.00 0.00 64.86 62.15 1br2 h ILE 402 Cb 0.13 3.15 -0.00 0.00 -3.07 0.00 0.00 36.82 37.03 1br2 h ILE 402 CO 0.01 0.55 -0.01 -0.07 -0.69 0.00 0.00 178.15 177.94 1br2 h LEU 403 N -0.97 0.00 -5.53 1.44 3.38 -0.72 -3.43 115.31 109.48 1br2 h LEU 403 Ca -0.08 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1br2 h LEU 403 Cb 1.09 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.66 1br2 h LEU 403 CO -0.04 0.01 -0.34 0.42 0.09 0.00 0.00 178.44 178.59 1br2 s THR 404 N -3.30 -0.71 -0.86 0.22 -4.23 0.27 -3.11 115.64 103.93 1br2 s THR 404 Ca 0.06 -0.19 0.27 0.00 -1.18 0.00 0.00 61.69 60.65 1br2 s THR 404 Cb 0.06 0.00 0.23 0.00 1.34 0.00 0.00 72.50 74.12 1br2 s THR 404 CO 0.65 0.00 1.78 -0.81 -0.54 0.00 0.00 174.62 175.69 1br2 n PRO 405 N 3.81 0.14 -0.86 3.99 -0.05 -1.23 -4.35 135.00 136.44 1br2 n PRO 405 Ca 0.11 0.10 0.00 0.00 -0.05 0.00 0.00 63.50 63.66 1br2 n PRO 405 Cb 0.59 -1.65 0.00 0.00 -0.05 0.00 0.00 33.50 32.40 1br2 n PRO 405 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 175.50 175.81 1br2 n LYS 416 N -1.88 0.00 -2.72 0.54 -0.00 -1.26 -5.01 118.16 107.84 1br2 n LYS 416 Ca 0.06 0.46 -0.39 0.00 -0.00 0.00 0.00 58.31 58.44 1br2 n LYS 416 Cb 0.39 -0.40 -0.06 0.00 -0.00 0.00 0.00 35.03 34.96 1br2 n LYS 416 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1br2 s ALA 417 N 0.00 3.29 -0.05 0.58 0.00 -1.26 -5.03 121.76 119.29 1br2 s ALA 417 Ca 0.00 0.62 0.04 0.00 0.00 0.00 0.00 51.96 52.63 1br2 s ALA 417 Cb 0.00 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 1br2 s ALA 417 CO 0.00 0.13 -0.18 -0.65 0.00 0.00 0.00 175.76 175.07 1br2 s GLN 418 N -1.59 2.50 0.40 0.00 -1.52 -1.18 -5.02 119.66 113.25 1br2 s GLN 418 Ca 0.46 -0.76 0.06 0.00 -1.95 0.00 0.00 55.36 53.16 1br2 s GLN 418 Cb -0.24 -2.31 0.00 0.00 -0.22 0.00 0.00 33.01 30.24 1br2 s GLN 418 CO 0.30 0.55 0.56 0.95 -0.25 0.00 0.00 175.29 177.40 1br2 s THR 419 N -0.56 3.62 0.11 -0.19 -4.23 -1.26 -1.90 115.64 111.23 1br2 s THR 419 Ca 0.08 -0.90 -0.31 0.00 -1.18 0.00 0.00 61.69 59.38 1br2 s THR 419 Cb -0.11 -3.26 -0.11 0.00 1.34 0.00 0.00 72.50 70.35 1br2 s THR 419 CO 0.01 -0.12 1.51 0.50 -0.54 0.00 0.00 174.62 175.98 1br2 h LYS 420 N 0.67 -0.46 -0.99 3.99 3.64 -1.82 0.90 116.57 122.49 1br2 h LYS 420 Ca -0.44 0.03 0.27 0.00 -1.27 0.00 0.00 60.65 59.25 1br2 h LYS 420 Cb 1.27 0.11 -0.18 0.00 -0.41 0.00 0.00 32.23 33.01 1br2 h LYS 420 CO 0.51 -0.31 0.05 0.93 -2.27 0.00 0.00 179.45 178.36 1br2 h GLU 421 N -0.48 0.01 0.00 1.90 4.39 -1.96 0.55 114.58 118.98 1br2 h GLU 421 Ca 0.04 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 1br2 h GLU 421 Cb 0.61 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1br2 h GLU 421 CO -0.46 0.01 -0.61 -0.56 -1.16 0.00 0.00 179.01 176.22 1br2 h GLN 422 N 0.01 0.00 -0.01 2.33 3.07 -1.33 -2.82 115.11 116.36 1br2 h GLN 422 Ca 0.61 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 59.15 1br2 h GLN 422 Cb 1.26 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.84 1br2 h GLN 422 CO -0.91 0.01 -0.74 0.00 0.09 0.00 0.00 178.83 177.27 1br2 h ALA 423 N 1.99 0.10 -0.13 0.06 0.00 0.47 -2.70 119.26 119.06 1br2 h ALA 423 Ca -0.00 -0.61 0.01 0.00 0.00 0.00 0.00 54.91 54.31 1br2 h ALA 423 Cb 1.01 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1br2 h ALA 423 CO 0.00 0.46 0.04 -0.44 0.00 0.00 0.00 179.25 179.32 1br2 h ASP 424 N 0.08 0.05 0.08 0.00 3.32 -0.20 -2.55 116.42 117.19 1br2 h ASP 424 Ca -0.09 0.01 0.01 0.00 0.02 0.00 0.00 57.03 56.99 1br2 h ASP 424 Cb 1.43 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.94 1br2 h ASP 424 CO 0.15 0.05 -0.51 0.15 -1.72 0.00 0.00 179.24 177.35 1br2 h PHE 425 N 0.10 -1.48 -0.73 4.55 3.04 -1.51 -1.44 116.94 119.47 1br2 h PHE 425 Ca 0.05 0.04 0.16 0.00 3.98 0.00 0.00 57.97 62.21 1br2 h PHE 425 Cb 0.03 0.64 -0.13 0.00 2.56 0.00 0.00 35.95 39.05 1br2 h PHE 425 CO -0.11 -0.57 -0.00 0.00 -2.02 0.00 0.00 178.31 175.62 1br2 h ALA 426 N -0.56 0.74 -0.21 2.41 0.00 -1.35 0.37 119.26 120.65 1br2 h ALA 426 Ca -0.00 0.23 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1br2 h ALA 426 Cb 0.72 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1br2 h ALA 426 CO -0.30 -0.42 0.13 0.82 0.00 0.00 0.00 179.25 179.49 1br2 h ILE 427 N 0.10 1.03 0.34 0.00 1.08 -1.04 -0.09 117.51 118.94 1br2 h ILE 427 Ca 0.39 -0.09 -0.01 0.00 -0.39 0.00 0.00 64.86 64.76 1br2 h ILE 427 Cb 0.68 0.74 -0.01 0.00 -3.07 0.00 0.00 36.82 35.16 1br2 h ILE 427 CO -0.64 0.05 -0.24 -0.33 -0.69 0.00 0.00 178.15 176.30 1br2 h GLU 428 N 0.27 -0.55 -0.93 2.37 5.08 0.10 0.02 114.58 120.94 1br2 h GLU 428 Ca 0.08 0.04 0.25 0.00 -1.00 0.00 0.00 59.36 58.73 1br2 h GLU 428 Cb -0.01 0.13 -0.14 0.00 0.50 0.00 0.00 28.75 29.23 1br2 h GLU 428 CO -0.03 -0.37 0.41 0.00 -1.00 0.00 0.00 179.01 178.02 1br2 h ALA 429 N 0.04 1.55 -0.16 3.43 0.00 -0.13 0.28 119.26 124.26 1br2 h ALA 429 Ca -0.03 0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1br2 h ALA 429 Cb 0.49 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1br2 h ALA 429 CO 0.01 -0.42 -0.05 1.25 0.00 0.00 0.00 179.25 180.04 1br2 h LEU 430 N 0.35 0.32 -0.02 0.00 5.85 -0.36 -0.57 115.31 120.87 1br2 h LEU 430 Ca 0.61 -0.38 0.02 0.00 0.84 0.00 0.00 57.88 58.96 1br2 h LEU 430 Cb 1.23 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 1br2 h LEU 430 CO -0.58 0.63 -0.41 0.00 -0.34 0.00 0.00 178.44 177.74 1br2 h ALA 431 N 0.70 -0.83 -0.59 1.25 0.00 0.14 0.61 119.26 120.54 1br2 h ALA 431 Ca 0.04 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.97 1br2 h ALA 431 Cb 0.49 0.86 -0.07 0.00 0.00 0.00 0.00 17.79 19.08 1br2 h ALA 431 CO 0.02 -0.96 0.25 0.87 0.00 0.00 0.00 179.25 179.42 1br2 h LYS 432 N -0.50 0.44 -0.83 0.00 1.57 -0.98 -0.39 116.57 115.89 1br2 h LYS 432 Ca 0.01 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1br2 h LYS 432 Cb 0.54 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 1br2 h LYS 432 CO -0.29 0.29 0.47 0.00 -0.57 0.00 0.00 179.45 179.35 1br2 h ALA 433 N 1.38 1.06 -0.74 3.86 0.00 -0.38 0.15 119.26 124.60 1br2 h ALA 433 Ca 0.29 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1br2 h ALA 433 Cb 0.32 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1br2 h ALA 433 CO -0.27 0.55 0.23 0.87 0.00 0.00 0.00 179.25 180.64 1br2 h LYS 434 N 1.15 1.14 0.00 0.00 1.79 0.11 -2.17 116.57 118.59 1br2 h LYS 434 Ca 0.29 -0.24 -0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1br2 h LYS 434 Cb 0.01 -0.17 0.00 0.00 -1.58 0.00 0.00 32.23 30.49 1br2 h LYS 434 CO -0.05 0.97 -0.00 0.35 -1.08 0.00 0.00 179.45 179.64 1br2 h PHE 435 N 1.10 -0.00 -1.02 -1.35 3.57 -0.59 -1.97 116.94 116.67 1br2 h PHE 435 Ca 0.24 -0.00 0.25 0.00 3.53 0.00 0.00 57.97 61.99 1br2 h PHE 435 Cb 0.31 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 38.94 1br2 h PHE 435 CO 0.03 0.56 0.63 1.49 -2.23 0.00 0.00 178.31 178.79 1br2 h GLU 436 N -0.57 0.49 0.05 1.11 4.81 -0.58 0.93 114.58 120.81 1br2 h GLU 436 Ca -0.00 -0.03 -0.25 0.00 -0.13 0.00 0.00 59.36 58.95 1br2 h GLU 436 Cb 0.56 -0.11 0.01 0.00 0.63 0.00 0.00 28.75 29.84 1br2 h GLU 436 CO 0.00 0.32 -1.06 0.00 -0.73 0.00 0.00 179.01 177.54 1br2 h ARG 437 N 0.50 0.46 -0.35 1.92 3.08 -1.35 -1.24 114.38 117.40 1br2 h ARG 437 Ca 0.62 -0.55 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 1br2 h ARG 437 Cb 1.34 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 31.55 1br2 h ARG 437 CO -0.39 1.20 0.04 1.25 -1.07 0.00 0.00 179.97 181.00 1br2 h LEU 438 N 0.23 0.49 0.43 3.04 5.85 -0.13 0.11 115.31 125.33 1br2 h LEU 438 Ca -0.12 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1br2 h LEU 438 Cb 1.72 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.63 1br2 h LEU 438 CO 0.19 0.53 -0.21 0.15 -0.34 0.00 0.00 178.44 178.76 1br2 h PHE 439 N 0.51 -0.54 -1.08 1.25 3.57 -0.83 -0.84 116.94 118.99 1br2 h PHE 439 Ca 0.12 -0.01 0.29 0.00 3.53 0.00 0.00 57.97 61.89 1br2 h PHE 439 Cb 0.27 0.18 -0.09 0.00 2.79 0.00 0.00 35.95 39.09 1br2 h PHE 439 CO 0.01 -0.24 0.70 -0.09 -2.23 0.00 0.00 178.31 176.46 1br2 h ARG 440 N -1.05 0.32 0.39 1.11 2.43 -1.02 0.35 114.38 116.90 1br2 h ARG 440 Ca -0.06 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 1br2 h ARG 440 Cb 0.54 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1br2 h ARG 440 CO 0.10 0.21 -0.19 2.35 -1.51 0.00 0.00 179.97 180.93 1br2 h TRP 441 N 0.33 -0.48 -0.71 2.20 7.01 -0.71 -0.02 115.95 123.57 1br2 h TRP 441 Ca 0.61 -0.01 0.13 0.00 2.11 0.00 0.00 58.89 61.73 1br2 h TRP 441 Cb 1.67 0.16 -0.09 0.00 -2.10 0.00 0.00 29.16 28.80 1br2 h TRP 441 CO -0.00 -0.18 0.26 0.82 -2.79 0.00 0.00 178.44 176.55 1br2 h ILE 442 N -1.02 0.68 0.28 2.65 2.04 0.25 0.34 117.51 122.72 1br2 h ILE 442 Ca -0.05 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1br2 h ILE 442 Cb 0.52 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1br2 h ILE 442 CO 0.09 0.08 -0.26 0.25 0.00 0.00 0.00 178.15 178.30 1br2 h LEU 443 N 0.41 -0.70 -0.58 1.44 5.85 -0.36 0.77 115.31 122.15 1br2 h LEU 443 Ca 0.38 0.06 0.12 0.00 0.84 0.00 0.00 57.88 59.28 1br2 h LEU 443 Cb 0.55 0.24 -0.10 0.00 0.37 0.00 0.00 40.66 41.72 1br2 h LEU 443 CO -0.38 -0.39 -0.04 0.74 -0.34 0.00 0.00 178.44 178.03 1br2 h THR 444 N -0.57 0.50 -0.83 1.05 2.02 0.82 0.16 112.91 116.07 1br2 h THR 444 Ca -0.01 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1br2 h THR 444 Cb 0.52 0.41 -0.04 0.00 -1.74 0.00 0.00 68.15 67.30 1br2 h THR 444 CO -0.05 0.02 0.48 -0.09 0.37 0.00 0.00 175.52 176.25 1br2 h ARG 445 N 0.08 1.14 -0.78 6.66 9.65 -0.05 -1.07 114.38 130.00 1br2 h ARG 445 Ca 0.29 -0.12 -0.03 0.00 -1.10 0.00 0.00 59.98 59.03 1br2 h ARG 445 Cb 0.47 -0.23 -0.04 0.00 -1.39 0.00 0.00 29.97 28.78 1br2 h ARG 445 CO -0.52 0.82 0.37 0.28 2.80 0.00 0.00 179.97 183.72 1br2 h VAL 446 N 1.14 1.25 0.00 0.20 2.07 0.14 -2.19 116.25 118.86 1br2 h VAL 446 Ca 0.29 -0.70 -0.08 0.00 0.82 0.00 0.00 66.70 67.04 1br2 h VAL 446 Cb -0.01 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 1br2 h VAL 446 CO -0.05 0.30 -0.39 0.78 0.02 0.00 0.00 177.57 178.23 1br2 h ASN 447 N 1.11 0.00 -0.21 0.57 2.35 0.21 -0.95 115.58 118.66 1br2 h ASN 447 Ca 0.27 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.95 1br2 h ASN 447 Cb 0.12 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 1br2 h ASN 447 CO -0.03 0.39 -0.13 0.11 -1.65 0.00 0.00 177.43 176.12 1br2 h LYS 448 N 0.00 0.47 0.00 0.81 1.57 -0.70 -1.65 116.57 117.07 1br2 h LYS 448 Ca -0.00 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.48 1br2 h LYS 448 Cb 0.72 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 1br2 h LYS 448 CO 0.05 0.76 -0.38 0.00 -0.57 0.00 0.00 179.45 179.32 1br2 h ALA 449 N 0.69 1.19 0.00 3.86 0.00 -1.17 -2.93 119.26 120.90 1br2 h ALA 449 Ca 0.04 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1br2 h ALA 449 Cb 0.64 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1br2 h ALA 449 CO 0.04 0.47 -0.53 -0.07 0.00 0.00 0.00 179.25 179.16 1br2 h LEU 450 N 0.00 0.00 -9.20 0.00 3.38 -1.08 -3.49 115.31 104.93 1br2 h LEU 450 Ca -0.00 -0.10 -0.67 0.00 0.09 0.00 0.00 57.88 57.20 1br2 h LEU 450 Cb 0.75 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.33 1br2 h LEU 450 CO 0.05 0.05 -0.76 -1.81 0.09 0.00 0.00 178.44 176.06 1br2 s ASP 451 N -4.82 4.20 0.00 -0.43 1.01 -0.63 -2.75 116.67 113.24 1br2 s ASP 451 Ca 0.05 -0.45 0.00 0.00 0.71 0.00 0.00 52.55 52.86 1br2 s ASP 451 Cb 0.11 -0.73 0.00 0.00 1.01 0.00 0.00 42.92 43.32 1br2 s ASP 451 CO 0.71 0.18 0.00 0.00 0.21 0.00 0.00 175.17 176.27 1br2 n ALA 458 N 0.75 0.00 -2.95 5.23 0.00 -1.09 -4.98 120.51 117.48 1br2 n ALA 458 Ca -0.14 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.19 1br2 n ALA 458 Cb 0.52 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.85 1br2 n ALA 458 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1br2 s SER 459 N 0.00 0.09 0.12 0.00 1.04 -0.89 -4.97 113.70 109.08 1br2 s SER 459 Ca 0.00 -0.19 0.08 0.00 0.48 0.00 0.00 55.95 56.31 1br2 s SER 459 Cb 0.00 0.09 -0.04 0.00 0.10 0.00 0.00 66.02 66.17 1br2 s SER 459 CO 0.00 -0.16 -0.19 0.72 0.98 0.00 0.00 173.24 174.59 1br2 s PHE 460 N -0.72 1.72 -0.42 5.02 -0.12 -1.26 0.18 117.98 122.38 1br2 s PHE 460 Ca -0.08 -0.45 0.04 0.00 -0.05 0.00 0.00 56.93 56.39 1br2 s PHE 460 Cb -0.05 -0.92 0.11 0.00 -0.63 0.00 0.00 43.02 41.54 1br2 s PHE 460 CO -0.00 0.22 0.15 -1.17 -0.05 0.00 0.00 175.22 174.37 1br2 s LEU 461 N -2.14 4.42 0.47 -1.99 0.20 0.05 -2.45 118.68 117.23 1br2 s LEU 461 Ca 0.08 -2.52 -0.22 0.00 0.69 0.00 0.00 54.13 52.17 1br2 s LEU 461 Cb -0.08 -1.59 -0.08 0.00 -0.43 0.00 0.00 46.19 44.01 1br2 s LEU 461 CO 0.05 -0.31 1.10 -0.83 -0.29 0.00 0.00 176.35 176.06 1br2 s GLY 462 N 0.40 2.68 -0.06 7.98 0.00 0.40 -2.76 107.32 115.97 1br2 s GLY 462 Ca 0.14 0.79 -0.00 0.00 0.00 0.00 0.00 44.72 45.64 1br2 s GLY 462 CO -0.05 1.19 -0.01 -0.42 0.00 0.00 0.00 173.10 173.80 1br2 s ILE 463 N -1.71 0.40 -0.30 0.90 1.01 0.90 -0.83 121.20 121.58 1br2 s ILE 463 Ca 0.65 0.04 -0.01 0.00 0.00 0.00 0.00 60.65 61.33 1br2 s ILE 463 Cb -0.23 -0.51 0.06 0.00 0.01 0.00 0.00 42.46 41.78 1br2 s ILE 463 CO 0.28 0.23 -0.01 -0.22 0.00 0.00 0.00 174.94 175.22 1br2 s LEU 464 N 1.51 3.87 -0.85 2.97 2.96 -0.93 -0.33 118.68 127.89 1br2 s LEU 464 Ca -0.02 -1.34 -0.02 0.00 -0.22 0.00 0.00 54.13 52.53 1br2 s LEU 464 Cb -0.13 -1.68 0.21 0.00 0.50 0.00 0.00 46.19 45.09 1br2 s LEU 464 CO -0.03 -0.26 0.72 -0.62 -1.32 0.00 0.00 176.35 174.84 1br2 s ASP 465 N 1.23 5.86 0.87 3.68 2.15 0.10 -2.77 116.67 127.80 1br2 s ASP 465 Ca -0.05 -3.60 -0.12 0.00 0.43 0.00 0.00 52.55 49.21 1br2 s ASP 465 Cb -0.20 -1.90 0.11 0.00 -0.30 0.00 0.00 42.92 40.64 1br2 s ASP 465 CO -0.02 -0.21 1.15 0.27 -0.17 0.00 0.00 175.17 176.19 1br2 s ILE 466 N -1.16 2.03 0.01 4.11 -4.36 -1.26 -1.40 121.20 119.17 1br2 s ILE 466 Ca 0.26 0.01 -0.30 0.00 -0.26 0.00 0.00 60.65 60.36 1br2 s ILE 466 Cb -0.09 -2.86 -0.04 0.00 1.25 0.00 0.00 42.46 40.73 1br2 s ILE 466 CO -0.11 -0.01 1.06 0.00 0.24 0.00 0.00 174.94 176.11 1br2 s ALA 467 N -3.39 3.26 0.50 2.27 0.00 -1.26 -4.85 121.76 118.30 1br2 s ALA 467 Ca 0.63 0.63 -0.19 0.00 0.00 0.00 0.00 51.96 53.03 1br2 s ALA 467 Cb -0.13 -3.39 -0.08 0.00 0.00 0.00 0.00 23.12 19.52 1br2 s ALA 467 CO 0.52 -0.34 1.02 0.20 0.00 0.00 0.00 175.76 177.16 1br2 s GLY 468 N 1.05 2.35 0.10 0.00 0.00 -1.26 -4.72 107.32 104.85 1br2 s GLY 468 Ca 0.54 0.48 -0.36 0.00 0.00 0.00 0.00 44.72 45.38 1br2 s GLY 468 CO 0.27 0.78 1.31 0.33 0.00 0.00 0.00 173.10 175.79 1br2 n PHE 469 N -1.21 1.48 -3.90 1.90 7.35 -1.25 -4.06 117.46 117.77 1br2 n PHE 469 Ca 0.08 0.64 -0.11 0.00 -0.76 0.00 0.00 57.45 57.31 1br2 n PHE 469 Cb 0.53 -2.32 -0.11 0.00 0.35 0.00 0.00 39.48 37.93 1br2 n PHE 469 CO 0.00 0.00 0.00 -1.83 -0.76 0.00 0.00 176.76 174.17 1br2 s GLU 470 N 0.31 0.33 -0.41 -4.13 -1.05 -1.26 -0.79 118.70 111.70 1br2 s GLU 470 Ca 0.82 -0.32 0.02 0.00 -0.15 0.00 0.00 54.97 55.33 1br2 s GLU 470 Cb -0.93 0.13 0.13 0.00 -0.44 0.00 0.00 34.13 33.02 1br2 s GLU 470 CO 0.48 -0.07 0.21 0.42 0.95 0.00 0.00 175.26 177.25 1br2 s ILE 471 N -1.03 1.26 0.72 1.83 1.01 -1.26 -4.89 121.20 118.84 1br2 s ILE 471 Ca -0.11 -2.32 -0.08 0.00 0.00 0.00 0.00 60.65 58.14 1br2 s ILE 471 Cb -0.07 -1.89 0.06 0.00 0.01 0.00 0.00 42.46 40.57 1br2 s ILE 471 CO 0.00 -0.86 1.04 -0.36 0.00 0.00 0.00 174.94 174.76 1br2 s PHE 472 N 0.60 2.95 0.26 3.97 0.08 -1.26 -4.96 117.98 119.62 1br2 s PHE 472 Ca 0.16 0.52 -0.02 0.00 0.12 0.00 0.00 56.93 57.72 1br2 s PHE 472 Cb -0.23 -3.23 0.49 0.00 -0.57 0.00 0.00 43.02 39.48 1br2 s PHE 472 CO -0.03 -1.44 1.80 0.93 -0.10 0.00 0.00 175.22 176.37 1br2 h GLU 473 N -0.66 0.76 -4.52 0.44 5.08 -1.99 -3.35 114.58 110.33 1br2 h GLU 473 Ca -0.45 -0.05 -0.62 0.00 -1.00 0.00 0.00 59.36 57.25 1br2 h GLU 473 Cb 1.31 -0.17 -0.37 0.00 0.50 0.00 0.00 28.75 30.02 1br2 h GLU 473 CO 0.61 0.50 -0.80 0.42 -1.00 0.00 0.00 179.01 178.74 1br2 s ILE 474 N -5.99 1.63 -0.35 3.13 -1.09 -1.26 -5.08 121.20 112.19 1br2 s ILE 474 Ca -0.12 -1.11 -0.12 0.00 -2.23 0.00 0.00 60.65 57.06 1br2 s ILE 474 Cb 0.21 -1.77 -0.00 0.00 -1.58 0.00 0.00 42.46 39.31 1br2 s ILE 474 CO 0.79 0.07 0.22 0.20 -1.23 0.00 0.00 174.94 174.99 1br2 s ASN 475 N 1.38 5.89 0.18 3.58 0.01 -1.26 -5.03 114.94 119.69 1br2 s ASN 475 Ca -0.03 -0.60 0.00 0.00 -0.71 0.00 0.00 52.86 51.51 1br2 s ASN 475 Cb -0.17 -2.09 0.00 0.00 0.41 0.00 0.00 41.25 39.40 1br2 s ASN 475 CO -0.07 -0.28 0.00 -0.24 -1.51 0.00 0.00 177.10 175.00 1br2 n SER 476 N 5.07 0.00 0.01 -1.22 2.88 -1.26 -1.25 113.62 117.85 1br2 n SER 476 Ca -0.13 -1.00 0.18 0.00 -1.33 0.00 0.00 58.87 56.59 1br2 n SER 476 Cb 0.49 -0.00 0.66 0.00 -0.75 0.00 0.00 64.21 64.61 1br2 n SER 476 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1br2 h PHE 477 N -0.18 0.06 0.00 0.66 3.57 -1.90 -1.44 116.94 117.71 1br2 h PHE 477 Ca -0.00 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1br2 h PHE 477 Cb 0.00 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.72 1br2 h PHE 477 CO 0.00 0.02 -0.00 0.93 -2.23 0.00 0.00 178.31 177.03 1br2 h GLU 478 N 0.05 -0.00 -0.75 1.11 3.07 -1.99 -2.57 114.58 113.49 1br2 h GLU 478 Ca 0.23 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.09 1br2 h GLU 478 Cb 0.86 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.73 1br2 h GLU 478 CO -0.01 0.13 0.45 1.96 -1.40 0.00 0.00 179.01 180.13 1br2 h GLN 479 N -0.13 1.02 -0.06 2.33 7.50 -1.64 -1.20 115.11 122.94 1br2 h GLN 479 Ca -0.00 -0.09 0.02 0.00 0.50 0.00 0.00 58.65 59.08 1br2 h GLN 479 Cb 0.13 -0.21 -0.02 0.00 0.05 0.00 0.00 27.48 27.43 1br2 h GLN 479 CO 0.00 0.72 -0.04 1.25 -1.50 0.00 0.00 178.83 179.26 1br2 h LEU 480 N 1.04 -0.14 -0.28 1.46 5.85 -1.18 0.49 115.31 122.55 1br2 h LEU 480 Ca 0.27 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 1br2 h LEU 480 Cb -0.03 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1br2 h LEU 480 CO -0.05 -0.06 0.17 0.00 -0.34 0.00 0.00 178.44 178.16 1br2 h ILE 482 N 0.36 0.43 -0.29 0.00 2.04 -0.98 -0.30 117.51 118.77 1br2 h ILE 482 Ca 0.10 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.92 1br2 h ILE 482 Cb 0.01 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1br2 h ILE 482 CO -0.02 0.00 -0.00 0.78 0.00 0.00 0.00 178.15 178.91 1br2 h ASN 483 N -0.58 0.41 -0.62 1.72 2.35 -0.81 -1.55 115.58 116.51 1br2 h ASN 483 Ca -0.01 -0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.62 1br2 h ASN 483 Cb 0.53 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.77 1br2 h ASN 483 CO -0.05 0.48 0.18 0.22 -1.65 0.00 0.00 177.43 176.60 1br2 h TYR 484 N 0.43 1.01 -0.37 1.19 3.20 -0.11 -0.54 116.97 121.78 1br2 h TYR 484 Ca 0.10 -0.11 -0.07 0.00 3.14 0.00 0.00 58.73 61.78 1br2 h TYR 484 Cb 0.28 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 1br2 h TYR 484 CO 0.01 0.84 -0.08 1.15 -1.64 0.00 0.00 178.16 178.44 1br2 h THR 485 N 0.89 1.23 -0.56 1.81 2.02 -0.41 0.52 112.91 118.41 1br2 h THR 485 Ca 0.20 -1.01 -0.10 0.00 0.77 0.00 0.00 66.41 66.26 1br2 h THR 485 Cb 0.32 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 1br2 h THR 485 CO -0.00 0.34 -0.04 0.78 0.37 0.00 0.00 175.52 176.97 1br2 h ASN 486 N 0.58 0.99 -0.58 4.18 2.35 -0.73 0.37 115.58 122.74 1br2 h ASN 486 Ca 0.11 -0.29 -0.05 0.00 -0.55 0.00 0.00 56.30 55.52 1br2 h ASN 486 Cb 0.48 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1br2 h ASN 486 CO 0.03 1.06 0.17 -0.08 -1.65 0.00 0.00 177.43 176.96 1br2 h GLU 487 N 0.91 0.91 -0.77 0.81 4.57 -0.56 -0.69 114.58 119.75 1br2 h GLU 487 Ca 0.16 -0.20 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1br2 h GLU 487 Cb 0.58 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.01 1br2 h GLU 487 CO 0.04 0.82 0.39 0.87 -1.18 0.00 0.00 179.01 179.95 1br2 h LYS 488 N 0.82 1.08 -0.23 1.92 1.57 -0.36 -1.26 116.57 120.11 1br2 h LYS 488 Ca 0.19 -0.14 -0.16 0.00 -1.87 0.00 0.00 60.65 58.67 1br2 h LYS 488 Cb 0.30 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1br2 h LYS 488 CO -0.00 0.82 -0.48 1.25 -0.57 0.00 0.00 179.45 180.46 1br2 h LEU 489 N 1.08 0.83 -0.83 2.94 5.85 -0.48 -1.96 115.31 122.74 1br2 h LEU 489 Ca 0.27 -0.55 -0.00 0.00 0.84 0.00 0.00 57.88 58.44 1br2 h LEU 489 Cb 0.07 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 1br2 h LEU 489 CO -0.04 1.22 0.50 -0.61 -0.34 0.00 0.00 178.44 179.17 1br2 h GLN 490 N 0.47 1.12 -0.19 1.25 5.75 -0.88 -1.58 115.11 121.05 1br2 h GLN 490 Ca 0.01 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 58.41 1br2 h GLN 490 Cb 1.08 -0.24 -0.01 0.00 1.07 0.00 0.00 27.48 29.39 1br2 h GLN 490 CO 0.11 0.78 0.12 0.37 -2.65 0.00 0.00 178.83 177.56 1br2 h GLN 491 N 1.14 0.24 -0.95 1.69 5.75 -1.16 -0.16 115.11 121.65 1br2 h GLN 491 Ca 0.30 -0.01 0.18 0.00 -0.15 0.00 0.00 58.65 58.97 1br2 h GLN 491 Cb -0.05 -0.05 -0.08 0.00 1.07 0.00 0.00 27.48 28.36 1br2 h GLN 491 CO -0.06 0.16 0.61 1.25 -2.65 0.00 0.00 178.83 178.14 1br2 h LEU 492 N 0.25 0.64 0.70 -2.39 5.85 -0.58 0.31 115.31 120.09 1br2 h LEU 492 Ca 0.07 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1br2 h LEU 492 Cb -0.02 -0.05 0.01 0.00 0.37 0.00 0.00 40.66 40.97 1br2 h LEU 492 CO -0.03 0.26 -0.34 0.15 -0.34 0.00 0.00 178.44 178.15 1br2 h PHE 493 N 0.64 -0.88 -0.78 1.25 3.57 -0.32 -1.85 116.94 118.58 1br2 h PHE 493 Ca 0.51 -0.02 0.14 0.00 3.53 0.00 0.00 57.97 62.13 1br2 h PHE 493 Cb 0.94 0.29 -0.14 0.00 2.79 0.00 0.00 35.95 39.83 1br2 h PHE 493 CO -0.00 -0.55 -0.31 -0.91 -2.23 0.00 0.00 178.31 174.31 1br2 h ASN 494 N -1.15 -1.11 0.31 0.41 2.35 0.49 0.19 115.58 117.07 1br2 h ASN 494 Ca -0.10 0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1br2 h ASN 494 Cb 0.73 0.61 -0.03 0.00 0.05 0.00 0.00 38.32 39.67 1br2 h ASN 494 CO 0.16 -0.29 -0.39 -0.74 -1.65 0.00 0.00 177.43 174.52 1br2 h HIS 495 N -0.06 -1.08 0.36 1.19 2.76 -0.43 0.13 115.15 118.02 1br2 h HIS 495 Ca 0.32 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.49 1br2 h HIS 495 Cb 0.58 0.43 -0.01 0.00 1.55 0.00 0.00 27.41 29.97 1br2 h HIS 495 CO -0.71 -0.53 -0.27 1.15 -1.30 0.00 0.00 177.93 176.28 1br2 h THR 496 N -0.75 0.00 -0.69 6.26 2.02 -0.65 0.37 112.91 119.47 1br2 h THR 496 Ca -0.01 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.32 1br2 h THR 496 Cb 0.70 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.99 1br2 h THR 496 CO -0.12 0.00 0.05 0.24 0.37 0.00 0.00 175.52 176.06 1br2 h MET 497 N -0.60 0.15 0.00 6.66 2.07 -0.60 -2.53 114.93 120.09 1br2 h MET 497 Ca -0.05 -0.01 -0.34 0.00 -2.07 0.00 0.00 59.70 57.24 1br2 h MET 497 Cb 0.49 -0.03 -0.06 0.00 -1.87 0.00 0.00 31.60 30.14 1br2 h MET 497 CO 0.02 0.10 -2.20 1.19 1.07 0.00 0.00 176.91 177.09 1br2 n PHE 498 N -5.27 0.00 0.01 -0.22 3.72 0.45 -4.35 117.46 111.80 1br2 n PHE 498 Ca 0.12 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.51 1br2 n PHE 498 Cb 0.42 -0.79 -0.00 0.00 -0.94 0.00 0.00 39.48 38.17 1br2 n PHE 498 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1br2 h ILE 499 N -0.37 0.00 -1.01 4.37 5.03 -0.42 -3.23 117.51 121.88 1br2 h ILE 499 Ca -0.51 -0.20 0.27 0.00 -0.12 0.00 0.00 64.86 64.30 1br2 h ILE 499 Cb 1.61 0.00 -0.13 0.00 -3.03 0.00 0.00 36.82 35.27 1br2 h ILE 499 CO -0.20 0.00 0.59 -0.07 -0.68 0.00 0.00 178.15 177.79 1br2 h LEU 500 N -0.25 0.63 0.04 1.44 3.38 -0.81 0.21 115.31 119.94 1br2 h LEU 500 Ca -0.00 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1br2 h LEU 500 Cb 0.04 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1br2 h LEU 500 CO 0.01 0.04 -0.11 -0.33 0.09 0.00 0.00 178.44 178.13 1br2 h GLU 501 N 0.51 -0.16 -0.90 1.13 4.39 -1.58 -1.98 114.58 115.98 1br2 h GLU 501 Ca 0.67 0.01 0.08 0.00 0.34 0.00 0.00 59.36 60.47 1br2 h GLU 501 Cb 1.36 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.98 1br2 h GLU 501 CO -0.51 -0.11 0.58 1.96 -1.16 0.00 0.00 179.01 179.78 1br2 h GLN 502 N -0.17 0.92 -0.65 2.33 4.20 -1.40 -2.17 115.11 118.17 1br2 h GLN 502 Ca -0.00 -0.06 0.09 0.00 0.06 0.00 0.00 58.65 58.74 1br2 h GLN 502 Cb 0.17 -0.21 -0.07 0.00 0.30 0.00 0.00 27.48 27.67 1br2 h GLN 502 CO -0.06 0.61 0.28 0.93 -0.67 0.00 0.00 178.83 179.93 1br2 h GLU 503 N 0.95 0.48 -0.15 1.46 5.08 -0.64 -0.38 114.58 121.38 1br2 h GLU 503 Ca 0.41 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.67 1br2 h GLU 503 Cb 0.33 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1br2 h GLU 503 CO -0.17 0.32 -0.21 1.49 -1.00 0.00 0.00 179.01 179.44 1br2 h GLU 504 N 0.49 0.25 0.19 2.33 4.57 -0.72 -0.24 114.58 121.46 1br2 h GLU 504 Ca 0.32 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.42 1br2 h GLU 504 Cb 0.37 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.93 1br2 h GLU 504 CO -0.29 0.45 -0.11 1.88 -1.18 0.00 0.00 179.01 179.77 1br2 h TYR 505 N 0.23 -0.28 -0.87 0.92 0.05 -0.81 -0.21 116.97 115.99 1br2 h TYR 505 Ca 0.04 -0.00 0.15 0.00 0.05 0.00 0.00 58.73 58.96 1br2 h TYR 505 Cb 0.50 0.10 -0.09 0.00 1.01 0.00 0.00 36.73 38.25 1br2 h TYR 505 CO 0.01 -0.16 0.47 0.37 -1.05 0.00 0.00 178.16 177.79 1br2 h GLN 506 N -0.28 0.65 -0.13 4.88 -0.00 -1.42 -0.41 115.11 118.42 1br2 h GLN 506 Ca -0.03 -0.04 0.01 0.00 -0.00 0.00 0.00 58.65 58.59 1br2 h GLN 506 Cb 0.22 -0.15 -0.01 0.00 0.00 0.00 0.00 27.48 27.54 1br2 h GLN 506 CO 0.03 0.43 0.08 -0.09 0.00 0.00 0.00 178.83 179.29 1br2 h ARG 507 N 0.67 0.14 -0.34 1.69 2.43 -0.88 -0.34 114.38 117.75 1br2 h ARG 507 Ca 0.47 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.63 1br2 h ARG 507 Cb 0.65 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1br2 h ARG 507 CO -0.35 0.09 0.00 -1.91 -1.51 0.00 0.00 179.97 176.29 1br2 n GLU 508 N -4.52 2.30 -1.55 0.20 4.07 -0.10 -4.93 120.64 116.11 1br2 n GLU 508 Ca -0.01 -1.97 -0.04 0.00 -0.06 0.00 0.00 57.16 55.09 1br2 n GLU 508 Cb 0.10 -1.48 -0.01 0.00 -0.06 0.00 0.00 31.44 30.00 1br2 n GLU 508 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1br2 n GLY 509 N 1.41 0.45 3.78 8.31 0.00 -0.14 0.02 105.19 119.02 1br2 n GLY 509 Ca 0.18 -0.83 -0.37 0.00 0.00 0.00 0.00 46.02 45.00 1br2 n GLY 509 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1br2 s ILE 510 N -2.15 3.94 -0.80 -0.61 -1.09 -0.86 -4.88 121.20 114.75 1br2 s ILE 510 Ca 0.00 1.55 -0.25 0.00 -2.23 0.00 0.00 60.65 59.72 1br2 s ILE 510 Cb 0.00 -3.84 -0.04 0.00 -1.58 0.00 0.00 42.46 37.00 1br2 s ILE 510 CO 0.00 0.07 1.94 -0.70 -1.23 0.00 0.00 174.94 175.03 1br2 s GLU 511 N -2.27 2.53 -0.02 2.79 2.12 -1.26 -4.55 118.70 118.04 1br2 s GLU 511 Ca 0.54 0.06 -0.01 0.00 0.36 0.00 0.00 54.97 55.92 1br2 s GLU 511 Cb -0.21 -4.83 0.02 0.00 0.26 0.00 0.00 34.13 29.38 1br2 s GLU 511 CO 0.26 -3.21 0.04 -0.46 -0.54 0.00 0.00 175.26 171.36 1br2 s TRP 512 N 9.97 -0.01 -0.24 5.30 -0.11 -1.26 -5.11 118.94 127.48 1br2 s TRP 512 Ca 0.70 0.15 -0.06 0.00 1.22 0.00 0.00 56.10 58.12 1br2 s TRP 512 Cb -0.09 -0.14 -0.02 0.00 -1.50 0.00 0.00 33.47 31.72 1br2 s TRP 512 CO 0.07 -0.07 0.03 -0.80 -4.62 0.00 0.00 176.95 171.55 1br2 s ASN 513 N 0.74 4.83 0.34 5.86 -0.87 -1.26 -4.90 114.94 119.67 1br2 s ASN 513 Ca -0.06 -0.27 -0.26 0.00 -1.57 0.00 0.00 52.86 50.70 1br2 s ASN 513 Cb -0.09 -1.85 -0.13 0.00 -0.02 0.00 0.00 41.25 39.16 1br2 s ASN 513 CO -0.02 -0.02 0.78 0.33 -2.57 0.00 0.00 177.10 175.59 1br2 n PHE 514 N 4.83 0.39 -4.03 2.20 7.35 -1.26 -4.99 117.46 121.95 1br2 n PHE 514 Ca -0.17 0.69 -0.31 0.00 -0.76 0.00 0.00 57.45 56.90 1br2 n PHE 514 Cb 0.51 -2.12 -0.16 0.00 0.35 0.00 0.00 39.48 38.07 1br2 n PHE 514 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1br2 s ILE 515 N -1.22 1.87 -0.53 -2.13 1.01 -1.26 -5.07 121.20 113.88 1br2 s ILE 515 Ca 0.62 -1.25 -0.28 0.00 0.00 0.00 0.00 60.65 59.73 1br2 s ILE 515 Cb -0.68 -1.95 0.02 0.00 0.01 0.00 0.00 42.46 39.87 1br2 s ILE 515 CO 0.58 0.12 1.25 -0.62 0.00 0.00 0.00 174.94 176.27 1br2 s ASP 516 N 1.28 6.43 0.00 3.58 2.15 -1.26 -4.84 116.67 124.00 1br2 s ASP 516 Ca -0.04 0.32 0.11 0.00 0.43 0.00 0.00 52.55 53.38 1br2 s ASP 516 Cb -0.17 -2.55 0.57 0.00 -0.30 0.00 0.00 42.92 40.46 1br2 s ASP 516 CO -0.08 -1.46 1.38 0.49 -0.17 0.00 0.00 175.17 175.34 1br2 n PHE 517 N 8.54 0.09 -3.61 -5.34 3.72 -1.26 -4.93 117.46 114.67 1br2 n PHE 517 Ca 0.11 -0.05 -0.26 0.00 -0.05 0.00 0.00 57.45 57.20 1br2 n PHE 517 Cb 0.49 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.07 1br2 n PHE 517 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1br2 n GLY 518 N 0.78 -0.88 2.73 1.37 0.00 -1.26 -4.99 105.19 102.94 1br2 n GLY 518 Ca 0.09 0.41 -0.18 0.00 0.00 0.00 0.00 46.02 46.34 1br2 n GLY 518 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1br2 s LEU 519 N -6.32 -0.02 -0.06 0.99 1.43 -1.26 -5.12 118.68 108.32 1br2 s LEU 519 Ca 0.37 -1.38 -0.02 0.00 -1.03 0.00 0.00 54.13 52.07 1br2 s LEU 519 Cb -0.11 0.46 0.04 0.00 0.03 0.00 0.00 46.19 46.60 1br2 s LEU 519 CO 0.83 -0.30 0.12 -0.62 0.23 0.00 0.00 176.35 176.61 1br2 s ASP 520 N 1.68 0.14 0.00 2.29 2.15 -1.26 -4.84 116.67 116.83 1br2 s ASP 520 Ca 0.15 0.24 0.15 0.00 0.43 0.00 0.00 52.55 53.52 1br2 s ASP 520 Cb -0.16 0.13 0.16 0.00 -0.30 0.00 0.00 42.92 42.75 1br2 s ASP 520 CO -0.12 -0.17 1.03 0.18 -0.17 0.00 0.00 175.17 175.92 1br2 n LEU 521 N 4.45 2.41 -0.37 -1.34 4.77 -1.26 -4.68 117.00 120.98 1br2 n LEU 521 Ca -0.22 -1.12 0.03 0.00 -0.03 0.00 0.00 56.01 54.68 1br2 n LEU 521 Cb 0.51 -0.04 0.10 0.00 -2.33 0.00 0.00 43.42 41.66 1br2 n LEU 521 CO 0.16 0.46 0.62 1.67 -1.33 0.00 0.00 177.39 178.97 1br2 n GLN 522 N 0.87 -0.14 0.00 3.23 -0.06 -1.26 -1.95 117.38 118.07 1br2 n GLN 522 Ca 0.10 1.53 0.00 0.00 -2.00 0.00 0.00 57.00 56.63 1br2 n GLN 522 Cb 0.40 -2.29 0.00 0.00 -4.06 0.00 0.00 30.24 24.29 1br2 n GLN 522 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 1br2 n PRO 523 N -5.55 0.00 -0.23 3.69 -0.04 -1.26 0.32 135.00 131.93 1br2 n PRO 523 Ca 0.14 0.73 0.01 0.00 -0.04 0.00 0.00 63.50 64.34 1br2 n PRO 523 Cb 0.46 -1.31 0.09 0.00 -0.04 0.00 0.00 33.50 32.70 1br2 n PRO 523 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1br2 h ILE 525 N 0.04 0.75 -0.25 0.00 2.04 -0.76 0.04 117.51 119.37 1br2 h ILE 525 Ca 0.34 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.98 1br2 h ILE 525 Cb 0.55 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1br2 h ILE 525 CO -0.65 0.07 -0.24 -0.33 0.00 0.00 0.00 178.15 177.00 1br2 h GLU 526 N 0.38 0.48 0.00 2.37 4.39 0.27 -0.75 114.58 121.72 1br2 h GLU 526 Ca 0.31 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.83 1br2 h GLU 526 Cb 0.40 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1br2 h GLU 526 CO -0.32 0.69 0.00 -0.11 -1.16 0.00 0.00 179.01 178.11 1br2 n LEU 527 N -4.13 0.00 -0.01 1.33 7.94 0.48 -1.33 117.00 121.27 1br2 n LEU 527 Ca -0.00 0.47 -0.02 0.00 -1.11 0.00 0.00 56.01 55.34 1br2 n LEU 527 Cb 0.40 -0.47 -0.01 0.00 0.53 0.00 0.00 43.42 43.86 1br2 n LEU 527 CO 0.42 -0.41 -0.60 -0.38 -1.11 0.00 0.00 177.39 175.31 1br2 n ILE 528 N -1.47 0.16 -0.26 1.96 5.41 -0.82 -1.40 119.36 122.95 1br2 n ILE 528 Ca 0.01 -0.05 0.09 0.00 1.00 0.00 0.00 62.75 63.80 1br2 n ILE 528 Cb 0.04 -0.96 0.24 0.00 -0.71 0.00 0.00 39.64 38.25 1br2 n ILE 528 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 1br2 n GLU 529 N -2.80 2.76 -1.88 0.38 0.28 -0.35 -1.90 120.64 117.13 1br2 n GLU 529 Ca -0.05 -2.37 -0.22 0.00 -0.16 0.00 0.00 57.16 54.35 1br2 n GLU 529 Cb 0.55 -1.43 -0.06 0.00 1.43 0.00 0.00 31.44 31.93 1br2 n GLU 529 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1br2 s ARG 530 N -1.02 2.22 0.00 3.44 6.06 -0.44 -4.82 118.95 124.39 1br2 s ARG 530 Ca 0.37 -0.04 0.00 0.00 -2.50 0.00 0.00 55.73 53.56 1br2 s ARG 530 Cb 0.19 -4.97 0.00 0.00 0.06 0.00 0.00 34.95 30.23 1br2 s ARG 530 CO 0.26 -3.77 0.82 -2.30 -2.50 0.00 0.00 175.30 167.81 1br2 n PRO 531 N 8.83 0.00 -1.19 5.12 -0.02 -1.26 -2.88 135.00 143.60 1br2 n PRO 531 Ca 0.43 0.35 -0.16 0.00 -2.02 0.00 0.00 63.50 62.10 1br2 n PRO 531 Cb 0.46 -1.32 0.10 0.00 -0.02 0.00 0.00 33.50 32.72 1br2 n PRO 531 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1br2 n THR 532 N -1.52 0.00 -0.99 3.45 -2.24 -1.26 -4.67 114.28 107.05 1br2 n THR 532 Ca 0.00 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1br2 n THR 532 Cb 0.00 -1.60 0.00 0.00 -2.10 0.00 0.00 70.33 66.63 1br2 n THR 532 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1br2 n ASN 533 N -3.37 0.00 -4.60 3.42 3.02 -1.26 -4.41 115.26 108.05 1br2 n ASN 533 Ca 0.09 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.21 1br2 n ASN 533 Cb 0.32 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.46 1br2 n ASN 533 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1br2 n PRO 534 N 14.00 2.08 -1.75 3.52 -0.02 -1.26 -4.89 135.00 146.68 1br2 n PRO 534 Ca 0.00 0.62 -0.41 0.00 -2.02 0.00 0.00 63.50 61.69 1br2 n PRO 534 Cb 0.00 -3.13 0.01 0.00 -0.02 0.00 0.00 33.50 30.35 1br2 n PRO 534 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1br2 n PRO 535 N 8.44 2.34 -4.05 0.52 -0.01 -1.26 -4.75 135.00 136.23 1br2 n PRO 535 Ca 0.29 0.83 -0.24 0.00 -0.01 0.00 0.00 63.50 64.37 1br2 n PRO 535 Cb 0.42 -2.57 -0.06 0.00 -0.01 0.00 0.00 33.50 31.27 1br2 n PRO 535 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 175.50 175.69 1br2 s GLY 536 N -0.34 2.15 0.14 -1.23 0.00 -1.14 -4.75 107.32 102.15 1br2 s GLY 536 Ca 0.58 -1.97 -0.32 0.00 0.00 0.00 0.00 44.72 43.01 1br2 s GLY 536 CO 0.60 -1.82 1.55 -2.08 0.00 0.00 0.00 173.10 171.35 1br2 h VAL 537 N 1.44 0.01 -0.18 1.40 2.07 -1.32 0.62 116.25 120.29 1br2 h VAL 537 Ca -0.43 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.14 1br2 h VAL 537 Cb 1.25 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 1br2 h VAL 537 CO 0.65 0.00 -0.11 -0.07 0.02 0.00 0.00 177.57 178.07 1br2 h LEU 538 N -0.33 -0.35 -0.90 2.57 3.38 -1.65 -1.83 115.31 116.19 1br2 h LEU 538 Ca 0.10 0.08 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 1br2 h LEU 538 Cb 0.57 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1br2 h LEU 538 CO -0.65 -0.14 -0.36 0.00 0.09 0.00 0.00 178.44 177.38 1br2 h ALA 539 N 1.04 1.06 -0.90 1.53 0.00 -1.55 -1.47 119.26 118.98 1br2 h ALA 539 Ca 0.10 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.64 1br2 h ALA 539 Cb 0.25 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 1br2 h ALA 539 CO -0.24 0.59 0.59 -0.07 0.00 0.00 0.00 179.25 180.12 1br2 h LEU 540 N 0.31 1.01 0.77 0.00 3.38 0.57 -0.97 115.31 120.39 1br2 h LEU 540 Ca 0.03 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1br2 h LEU 540 Cb 0.78 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.30 1br2 h LEU 540 CO 0.06 0.72 -0.37 0.25 0.09 0.00 0.00 178.44 179.19 1br2 h LEU 541 N 1.19 -0.87 -1.65 1.67 5.85 -0.88 0.29 115.31 120.90 1br2 h LEU 541 Ca 0.34 0.03 0.44 0.00 0.84 0.00 0.00 57.88 59.53 1br2 h LEU 541 Cb -0.09 0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.07 1br2 h LEU 541 CO -0.09 -0.54 0.98 0.44 -0.34 0.00 0.00 178.44 178.89 1br2 h ASP 542 N -1.21 0.16 0.17 1.25 3.32 -1.10 0.92 116.42 119.94 1br2 h ASP 542 Ca -0.11 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1br2 h ASP 542 Cb 0.79 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1br2 h ASP 542 CO 0.17 -0.08 -0.08 -0.33 -1.72 0.00 0.00 179.24 177.20 1br2 h GLU 543 N 0.08 -0.22 -0.91 3.56 3.07 -0.71 -3.31 114.58 116.14 1br2 h GLU 543 Ca 0.79 0.01 0.15 0.00 -0.50 0.00 0.00 59.36 59.82 1br2 h GLU 543 Cb 2.73 0.05 -0.16 0.00 -0.84 0.00 0.00 28.75 30.54 1br2 h GLU 543 CO -0.23 0.18 -0.31 0.39 -1.40 0.00 0.00 179.01 177.64 1br2 n GLU 544 N -4.92 -0.17 -2.53 2.33 -0.58 0.31 -5.10 120.64 109.98 1br2 n GLU 544 Ca -0.07 1.41 -0.41 0.00 -0.42 0.00 0.00 57.16 57.67 1br2 n GLU 544 Cb 0.25 -2.09 -0.03 0.00 -0.57 0.00 0.00 31.44 29.00 1br2 n GLU 544 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1br2 n ALA 550 N 9.43 0.00 -1.87 0.00 0.00 -1.26 -4.93 120.51 121.88 1br2 n ALA 550 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.23 1br2 n ALA 550 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1br2 n ALA 550 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1br2 s THR 551 N 0.00 4.69 0.30 0.00 -4.23 -1.26 -4.91 115.64 110.22 1br2 s THR 551 Ca 0.00 0.92 0.01 0.00 -1.18 0.00 0.00 61.69 61.43 1br2 s THR 551 Cb 0.00 -3.85 0.17 0.00 1.34 0.00 0.00 72.50 70.16 1br2 s THR 551 CO 0.00 -1.08 1.86 0.44 -0.54 0.00 0.00 174.62 175.30 1br2 h ASP 552 N -0.13 0.70 -0.30 3.99 3.32 -2.00 -0.41 116.42 121.59 1br2 h ASP 552 Ca -0.44 -0.11 -0.06 0.00 0.02 0.00 0.00 57.03 56.43 1br2 h ASP 552 Cb 1.19 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 1br2 h ASP 552 CO 0.62 0.68 -0.02 0.00 -1.72 0.00 0.00 179.24 178.80 1br2 h THR 553 N 0.74 1.23 -0.90 0.35 1.03 -1.92 -0.99 112.91 112.45 1br2 h THR 553 Ca 0.17 -0.94 0.00 0.00 -0.01 0.00 0.00 66.41 65.63 1br2 h THR 553 Cb 0.25 0.94 -0.04 0.00 -1.07 0.00 0.00 68.15 68.23 1br2 h THR 553 CO -0.00 0.32 0.57 -1.28 -0.01 0.00 0.00 175.52 175.12 1br2 h SER 554 N 0.62 1.06 0.23 0.00 0.87 -1.47 -1.22 113.55 113.63 1br2 h SER 554 Ca 0.12 -0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.65 1br2 h SER 554 Cb 0.42 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 62.09 1br2 h SER 554 CO 0.02 0.79 -0.28 0.15 -0.53 0.00 0.00 176.83 176.98 1br2 h PHE 555 N 1.23 -0.75 -0.64 2.24 3.57 -0.24 -2.10 116.94 120.25 1br2 h PHE 555 Ca 0.33 0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.95 1br2 h PHE 555 Cb -0.10 0.30 -0.08 0.00 2.79 0.00 0.00 35.95 38.86 1br2 h PHE 555 CO 0.00 -0.40 0.21 0.28 -2.23 0.00 0.00 178.31 176.17 1br2 h VAL 556 N -0.56 0.69 -0.53 1.41 2.07 -0.94 0.49 116.25 118.88 1br2 h VAL 556 Ca 0.00 -0.12 0.07 0.00 0.82 0.00 0.00 66.70 67.47 1br2 h VAL 556 Cb 0.54 0.30 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 1br2 h VAL 556 CO -0.09 0.07 0.20 -0.33 0.02 0.00 0.00 177.57 177.43 1br2 h GLU 557 N 0.36 0.37 -0.33 1.57 3.07 -0.77 -1.01 114.58 117.85 1br2 h GLU 557 Ca 0.34 -0.02 -0.17 0.00 -0.50 0.00 0.00 59.36 59.00 1br2 h GLU 557 Cb 0.47 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.29 1br2 h GLU 557 CO -0.37 0.25 -0.47 1.57 -1.40 0.00 0.00 179.01 178.59 1br2 h LYS 558 N 0.38 0.87 -1.01 2.33 2.10 -0.70 -2.58 116.57 117.97 1br2 h LYS 558 Ca 0.26 -0.50 0.10 0.00 -2.00 0.00 0.00 60.65 58.50 1br2 h LYS 558 Cb 0.28 0.04 -0.08 0.00 -0.90 0.00 0.00 32.23 31.57 1br2 h LYS 558 CO -0.26 1.15 0.64 1.25 -2.00 0.00 0.00 179.45 180.23 1br2 h LEU 559 N 0.69 0.98 0.10 7.07 5.85 -0.33 -0.25 115.31 129.41 1br2 h LEU 559 Ca 0.04 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1br2 h LEU 559 Cb 1.06 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.92 1br2 h LEU 559 CO 0.11 0.56 -0.05 0.40 -0.34 0.00 0.00 178.44 179.12 1br2 h ILE 560 N 1.07 1.07 -0.09 4.05 2.04 -1.05 0.18 117.51 124.78 1br2 h ILE 560 Ca 0.47 -0.64 0.03 0.00 1.00 0.00 0.00 64.86 65.72 1br2 h ILE 560 Cb 0.36 1.48 -0.00 0.00 -0.74 0.00 0.00 36.82 37.92 1br2 h ILE 560 CO -0.23 0.16 0.08 -0.61 0.00 0.00 0.00 178.15 177.54 1br2 h GLN 561 N -0.43 0.00 0.02 2.37 4.15 -0.99 0.51 115.11 120.75 1br2 h GLN 561 Ca -0.01 0.00 -0.18 0.00 0.77 0.00 0.00 58.65 59.22 1br2 h GLN 561 Cb 0.36 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.03 1br2 h GLN 561 CO 0.02 0.00 -0.99 0.93 -1.93 0.00 0.00 178.83 176.87 1br2 h GLU 562 N 0.00 0.05 0.00 1.69 4.39 -0.93 -3.45 114.58 116.34 1br2 h GLU 562 Ca 0.04 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1br2 h GLU 562 Cb 0.19 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1br2 h GLU 562 CO -0.00 1.04 0.00 1.04 -1.16 0.00 0.00 179.01 179.93 1br2 n GLN 563 N -4.36 0.00 0.00 2.33 1.13 0.62 -4.90 117.38 112.20 1br2 n GLN 563 Ca -0.25 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 54.86 1br2 n GLN 563 Cb 0.68 -0.38 0.00 0.00 0.11 0.00 0.00 30.24 30.65 1br2 n GLN 563 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1br2 n GLY 564 N 2.00 0.04 0.24 1.08 0.00 0.18 -1.50 105.19 107.24 1br2 n GLY 564 Ca 0.00 0.22 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 1br2 n GLY 564 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1br2 h ASN 565 N 0.00 0.89 -0.20 1.61 4.21 -1.90 -3.37 115.58 116.82 1br2 h ASN 565 Ca 0.00 -0.45 -0.22 0.00 1.21 0.00 0.00 56.30 56.83 1br2 h ASN 565 Cb 0.00 -0.25 -0.00 0.00 -1.12 0.00 0.00 38.32 36.95 1br2 h ASN 565 CO 0.00 1.16 0.22 1.57 -1.29 0.00 0.00 177.43 179.08 1br2 n HIS 566 N -4.17 0.42 -0.11 1.19 -0.00 -0.56 -4.63 115.22 107.36 1br2 n HIS 566 Ca -0.03 0.28 -0.02 0.00 0.46 0.00 0.00 57.72 58.41 1br2 n HIS 566 Cb 0.49 -0.59 -0.02 0.00 -0.12 0.00 0.00 29.99 29.76 1br2 n HIS 566 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1br2 n ALA 567 N 1.25 -0.14 -0.56 1.57 0.00 -1.26 0.15 120.51 121.52 1br2 n ALA 567 Ca 0.10 0.24 -0.13 0.00 0.00 0.00 0.00 53.44 53.65 1br2 n ALA 567 Cb -0.01 -0.06 0.05 0.00 0.00 0.00 0.00 19.45 19.43 1br2 n ALA 567 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1br2 n LYS 568 N -4.36 1.65 -4.17 0.00 4.76 -1.26 -4.84 118.16 109.94 1br2 n LYS 568 Ca 0.01 -1.35 -0.13 0.00 -2.87 0.00 0.00 58.31 53.98 1br2 n LYS 568 Cb 0.08 -1.53 -0.10 0.00 -1.84 0.00 0.00 35.03 31.64 1br2 n LYS 568 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1br2 s PHE 569 N -1.54 0.99 -0.30 2.13 2.19 0.40 -2.51 117.98 119.35 1br2 s PHE 569 Ca 0.26 -0.74 -0.11 0.00 0.33 0.00 0.00 56.93 56.67 1br2 s PHE 569 Cb 0.21 -0.55 0.12 0.00 -1.31 0.00 0.00 43.02 41.49 1br2 s PHE 569 CO 0.01 -0.05 0.67 -0.65 1.83 0.00 0.00 175.22 177.03 1br2 s GLN 570 N -3.16 0.60 0.71 10.12 -0.21 -0.51 -4.81 119.66 122.40 1br2 s GLN 570 Ca 0.08 1.39 -0.15 0.00 0.02 0.00 0.00 55.36 56.70 1br2 s GLN 570 Cb -0.00 0.72 0.03 0.00 1.00 0.00 0.00 33.01 34.75 1br2 s GLN 570 CO -0.02 -0.19 1.18 -1.59 -2.12 0.00 0.00 175.29 172.55 1br2 s LYS 571 N 2.62 2.35 0.00 2.91 0.00 -1.26 -0.69 119.74 125.68 1br2 s LYS 571 Ca -0.07 1.65 0.00 0.00 0.00 0.00 0.00 55.97 57.55 1br2 s LYS 571 Cb -0.10 -1.87 0.00 0.00 0.00 0.00 0.00 37.83 35.85 1br2 s LYS 571 CO -0.19 -1.64 0.00 0.45 0.00 0.00 0.00 175.35 173.96 1br2 n SER 572 N -2.60 0.00 -3.85 0.03 2.88 -1.25 -4.70 113.62 104.12 1br2 n SER 572 Ca 0.12 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.38 1br2 n SER 572 Cb 0.51 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.00 1br2 n SER 572 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1br2 n LYS 578 N 0.00 -5.69 -1.63 -1.46 0.00 -1.26 -5.06 118.16 103.05 1br2 n LYS 578 Ca 0.00 0.62 -0.09 0.00 -0.00 0.00 0.00 58.31 58.84 1br2 n LYS 578 Cb 0.00 -5.48 -0.03 0.00 -0.00 0.00 0.00 35.03 29.52 1br2 n LYS 578 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1br2 n THR 579 N -4.66 -0.18 -3.89 0.58 -2.24 -1.26 -4.61 114.28 98.03 1br2 n THR 579 Ca -0.01 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.47 1br2 n THR 579 Cb 0.55 -1.35 -0.04 0.00 -2.10 0.00 0.00 70.33 67.39 1br2 n THR 579 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1br2 s GLU 580 N -3.46 3.46 0.24 -0.78 2.02 -1.26 -0.06 118.70 118.86 1br2 s GLU 580 Ca 0.00 -0.45 -0.13 0.00 0.02 0.00 0.00 54.97 54.42 1br2 s GLU 580 Cb 0.00 -2.99 -0.00 0.00 0.10 0.00 0.00 34.13 31.24 1br2 s GLU 580 CO 0.00 0.56 0.47 -0.59 0.02 0.00 0.00 175.26 175.71 1br2 s PHE 581 N -1.62 0.32 -0.03 1.61 -0.71 -0.72 -3.92 117.98 112.92 1br2 s PHE 581 Ca 0.36 -0.68 0.06 0.00 -1.04 0.00 0.00 56.93 55.62 1br2 s PHE 581 Cb -0.12 0.19 -0.01 0.00 -1.21 0.00 0.00 43.02 41.86 1br2 s PHE 581 CO 0.28 -0.96 -0.20 0.00 -1.34 0.00 0.00 175.22 173.00 1br2 s ILE 583 N -0.31 2.31 -1.03 0.00 -1.09 -0.11 -1.42 121.20 119.54 1br2 s ILE 583 Ca 0.04 -0.95 -0.16 0.00 -2.23 0.00 0.00 60.65 57.35 1br2 s ILE 583 Cb -0.09 -1.89 0.16 0.00 -1.58 0.00 0.00 42.46 39.06 1br2 s ILE 583 CO 0.00 0.56 1.21 -0.76 -1.23 0.00 0.00 174.94 174.72 1br2 s LEU 584 N 0.12 5.30 0.54 2.97 1.43 -1.04 -1.54 118.68 126.46 1br2 s LEU 584 Ca -0.11 -2.56 -0.18 0.00 -1.03 0.00 0.00 54.13 50.26 1br2 s LEU 584 Cb -0.16 -2.37 -0.06 0.00 0.03 0.00 0.00 46.19 43.63 1br2 s LEU 584 CO 0.06 -0.85 1.04 -1.00 0.23 0.00 0.00 176.35 175.84 1br2 s HIS 585 N 1.78 3.03 0.30 0.29 3.76 0.12 -4.88 115.29 119.69 1br2 s HIS 585 Ca 0.35 1.54 0.06 0.00 -0.15 0.00 0.00 55.06 56.85 1br2 s HIS 585 Cb -0.05 -3.02 0.76 0.00 1.11 0.00 0.00 32.58 31.39 1br2 s HIS 585 CO -0.06 -0.92 1.73 0.10 -0.85 0.00 0.00 174.74 174.74 1br2 h TYR 586 N 0.99 0.87 0.00 1.40 -0.00 -1.95 0.76 116.97 119.03 1br2 h TYR 586 Ca -0.48 0.04 0.00 0.00 -0.00 0.00 0.00 58.73 58.29 1br2 h TYR 586 Cb 1.22 -0.24 0.00 0.00 -0.00 0.00 0.00 36.73 37.71 1br2 h TYR 586 CO 0.58 0.07 0.00 0.00 -0.00 0.00 0.00 178.16 178.81 1br2 n ALA 587 N -2.39 2.07 0.00 0.10 0.00 -1.26 -4.79 120.51 114.23 1br2 n ALA 587 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1br2 n ALA 587 Cb 0.65 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1br2 n ALA 587 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1br2 n GLY 588 N 0.86 0.55 3.56 0.00 0.00 0.26 -5.08 105.19 105.34 1br2 n GLY 588 Ca 0.05 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.18 1br2 n GLY 588 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1br2 s LYS 589 N -1.76 3.64 -0.19 1.61 2.20 -1.26 0.13 119.74 124.11 1br2 s LYS 589 Ca 0.00 -0.02 -0.06 0.00 -0.36 0.00 0.00 55.97 55.54 1br2 s LYS 589 Cb 0.00 -3.82 -0.03 0.00 -1.51 0.00 0.00 37.83 32.47 1br2 s LYS 589 CO 0.00 -0.74 0.02 0.08 -0.36 0.00 0.00 175.35 174.35 1br2 s VAL 590 N 2.65 4.17 -0.45 4.02 1.01 -0.59 -4.97 120.40 126.25 1br2 s VAL 590 Ca 0.23 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 61.85 1br2 s VAL 590 Cb -0.15 -2.88 0.08 0.00 0.00 0.00 0.00 36.38 33.43 1br2 s VAL 590 CO 0.15 0.43 0.33 0.28 0.00 0.00 0.00 175.10 176.29 1br2 s THR 591 N 0.83 4.68 0.72 3.92 -1.32 -1.26 -0.94 115.64 122.26 1br2 s THR 591 Ca 0.01 -1.27 -0.11 0.00 -1.21 0.00 0.00 61.69 59.10 1br2 s THR 591 Cb -0.14 -3.84 0.02 0.00 -1.51 0.00 0.00 72.50 67.03 1br2 s THR 591 CO 0.02 -0.56 1.09 -0.31 -2.21 0.00 0.00 174.62 172.65 1br2 s TYR 592 N 1.52 3.23 -0.27 9.09 2.02 0.20 -4.40 117.35 128.74 1br2 s TYR 592 Ca 0.04 1.12 -0.01 0.00 -0.37 0.00 0.00 57.07 57.85 1br2 s TYR 592 Cb -0.24 -3.03 0.08 0.00 -0.40 0.00 0.00 41.96 38.37 1br2 s TYR 592 CO 0.04 -1.27 0.04 1.21 -1.57 0.00 0.00 175.55 174.00 1br2 s ASN 593 N -4.20 3.78 0.00 2.29 3.04 -0.38 -1.75 114.94 117.72 1br2 s ASN 593 Ca 0.58 -1.37 0.03 0.00 0.04 0.00 0.00 52.86 52.15 1br2 s ASN 593 Cb -0.12 -0.94 0.20 0.00 -1.54 0.00 0.00 41.25 38.85 1br2 s ASN 593 CO 0.53 -0.34 0.58 0.00 -3.04 0.00 0.00 177.10 174.83 1br2 n ALA 594 N 4.80 1.87 -1.68 1.71 0.00 0.91 -4.58 120.51 123.55 1br2 n ALA 594 Ca -0.06 -0.02 -0.46 0.00 0.00 0.00 0.00 53.44 52.90 1br2 n ALA 594 Cb 0.44 -1.06 -0.04 0.00 0.00 0.00 0.00 19.45 18.79 1br2 n ALA 594 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1br2 n SER 595 N -0.65 3.43 0.00 0.00 7.64 -1.26 -1.23 113.62 121.55 1br2 n SER 595 Ca 0.03 1.03 0.00 0.00 1.01 0.00 0.00 58.87 60.93 1br2 n SER 595 Cb 0.01 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 61.77 1br2 n SER 595 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1br2 n ALA 596 N 4.95 0.00 -0.26 -0.43 0.00 -1.26 -4.88 120.51 118.63 1br2 n ALA 596 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.65 1br2 n ALA 596 Cb 0.31 -0.64 0.15 0.00 0.00 0.00 0.00 19.45 19.27 1br2 n ALA 596 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1br2 h TRP 597 N 0.00 0.69 -0.76 0.00 4.06 -1.50 0.11 115.95 118.56 1br2 h TRP 597 Ca 0.00 0.03 0.06 0.00 2.06 0.00 0.00 58.89 61.04 1br2 h TRP 597 Cb 0.20 -0.20 -0.06 0.00 -1.00 0.00 0.00 29.16 28.11 1br2 h TRP 597 CO 0.13 0.26 0.45 -0.07 -3.56 0.00 0.00 178.44 175.65 1br2 h LEU 598 N 0.65 0.70 -0.26 -4.49 3.38 -1.90 0.15 115.31 113.54 1br2 h LEU 598 Ca 0.36 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.24 1br2 h LEU 598 Cb 0.37 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1br2 h LEU 598 CO -0.26 0.45 -0.29 0.71 0.09 0.00 0.00 178.44 179.13 1br2 h THR 599 N 0.83 1.31 -0.63 0.22 1.35 -1.76 -2.57 112.91 111.66 1br2 h THR 599 Ca 0.33 -1.47 -0.02 0.00 -0.55 0.00 0.00 66.41 64.70 1br2 h THR 599 Cb 0.16 1.65 -0.03 0.00 -1.73 0.00 0.00 68.15 68.21 1br2 h THR 599 CO -0.17 0.46 0.32 0.11 -0.25 0.00 0.00 175.52 175.99 1br2 h LYS 600 N 0.38 0.88 0.00 4.72 1.57 -0.22 0.25 116.57 124.14 1br2 h LYS 600 Ca 0.04 -0.10 -0.09 0.00 -1.87 0.00 0.00 60.65 58.63 1br2 h LYS 600 Cb 0.86 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 1br2 h LYS 600 CO 0.07 0.67 -0.41 -0.97 -0.57 0.00 0.00 179.45 178.24 1br2 h ASN 601 N 0.88 0.00 0.21 0.86 -1.24 -0.67 -3.28 115.58 112.34 1br2 h ASN 601 Ca 0.22 0.00 -0.35 0.00 0.71 0.00 0.00 56.30 56.88 1br2 h ASN 601 Cb 0.07 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.12 1br2 h ASN 601 CO -0.03 0.41 -1.81 0.24 -1.29 0.00 0.00 177.43 174.95 1br2 h MET 602 N 0.00 0.33 -5.68 6.67 2.86 -0.99 -0.24 114.93 117.88 1br2 h MET 602 Ca -0.00 -0.56 -0.26 0.00 -2.06 0.00 0.00 59.70 56.82 1br2 h MET 602 Cb 1.13 0.21 0.13 0.00 0.06 0.00 0.00 31.60 33.12 1br2 h MET 602 CO 0.05 1.24 -0.73 -3.47 1.06 0.00 0.00 176.91 175.07 1br2 n ASP 603 N -3.53 -6.47 -4.67 1.22 2.03 0.81 -4.81 116.55 101.13 1br2 n ASP 603 Ca -0.26 -0.68 -0.43 0.00 0.52 0.00 0.00 54.79 53.95 1br2 n ASP 603 Cb 1.06 -4.63 -0.02 0.00 -0.72 0.00 0.00 41.12 36.81 1br2 n ASP 603 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1br2 s PRO 604 N -4.55 4.32 0.37 -0.67 0.04 -1.26 -5.05 135.00 128.20 1br2 s PRO 604 Ca 0.36 1.41 0.08 0.00 0.04 0.00 0.00 61.00 62.89 1br2 s PRO 604 Cb -0.07 -3.61 -0.03 0.00 0.04 0.00 0.00 34.50 30.83 1br2 s PRO 604 CO 0.78 -0.51 0.32 -1.17 0.04 0.00 0.00 177.00 176.46 1br2 s LEU 605 N 2.73 3.48 -1.13 -3.56 2.96 -1.26 -4.90 118.68 116.99 1br2 s LEU 605 Ca 0.47 -0.63 -0.11 0.00 -0.22 0.00 0.00 54.13 53.64 1br2 s LEU 605 Cb -0.17 -2.11 0.25 0.00 0.50 0.00 0.00 46.19 44.66 1br2 s LEU 605 CO 0.12 -0.49 1.19 0.21 -1.32 0.00 0.00 176.35 176.06 1br2 s ASN 606 N -4.05 7.23 0.38 3.68 3.04 -1.26 -4.88 114.94 119.08 1br2 s ASN 606 Ca 0.44 -3.39 0.33 0.00 0.04 0.00 0.00 52.86 50.28 1br2 s ASN 606 Cb -0.04 -2.26 1.22 0.00 -1.54 0.00 0.00 41.25 38.62 1br2 s ASN 606 CO 0.27 -0.43 1.14 -0.90 -3.04 0.00 0.00 177.10 174.14 1br2 n ASP 607 N 3.59 0.04 0.00 -4.21 5.68 -1.26 -0.54 116.55 119.84 1br2 n ASP 607 Ca 0.27 0.80 0.00 0.00 -0.50 0.00 0.00 54.79 55.36 1br2 n ASP 607 Cb 0.40 -0.40 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 1br2 n ASP 607 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1br2 n ASN 608 N -3.60 0.00 -0.31 -1.12 5.03 -1.26 -0.04 115.26 113.96 1br2 n ASN 608 Ca 0.32 0.85 0.09 0.00 0.87 0.00 0.00 54.58 56.70 1br2 n ASN 608 Cb 1.39 -0.35 0.30 0.00 -1.02 0.00 0.00 39.78 40.10 1br2 n ASN 608 CO 0.00 0.00 0.00 1.62 -1.83 0.00 0.00 177.26 177.05 1br2 h VAL 609 N 0.00 0.91 -0.72 2.41 3.04 -1.35 0.33 116.25 120.87 1br2 h VAL 609 Ca 0.00 -0.30 0.15 0.00 -1.01 0.00 0.00 66.70 65.54 1br2 h VAL 609 Cb 0.00 -0.03 -0.10 0.00 -2.01 0.00 0.00 31.29 29.14 1br2 h VAL 609 CO 0.00 0.16 0.20 0.74 -1.01 0.00 0.00 177.57 177.66 1br2 h THR 610 N 0.87 0.57 -0.31 3.17 2.02 -0.68 -0.81 112.91 117.74 1br2 h THR 610 Ca 0.45 -0.11 -0.07 0.00 0.77 0.00 0.00 66.41 67.46 1br2 h THR 610 Cb 0.53 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1br2 h THR 610 CO -0.22 0.06 -0.08 -1.28 0.37 0.00 0.00 175.52 174.37 1br2 h SER 611 N 0.31 0.60 -0.73 4.18 0.87 0.17 -1.45 113.55 117.50 1br2 h SER 611 Ca 0.40 -0.37 0.15 0.00 -1.23 0.00 0.00 61.79 60.75 1br2 h SER 611 Cb 0.65 -0.16 -0.14 0.00 -0.44 0.00 0.00 62.40 62.31 1br2 h SER 611 CO -0.47 0.83 -0.12 -0.07 -0.53 0.00 0.00 176.83 176.48 1br2 h LEU 612 N 0.36 -0.56 -0.59 2.23 3.38 -0.57 0.47 115.31 120.04 1br2 h LEU 612 Ca 0.08 0.21 -0.11 0.00 0.09 0.00 0.00 57.88 58.15 1br2 h LEU 612 Cb 0.57 0.41 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 1br2 h LEU 612 CO 0.03 -0.22 -0.06 -0.07 0.09 0.00 0.00 178.44 178.21 1br2 h LEU 613 N 0.03 1.05 -1.86 1.67 3.38 -1.16 -2.38 115.31 116.04 1br2 h LEU 613 Ca 0.37 -0.33 0.31 0.00 0.09 0.00 0.00 57.88 58.32 1br2 h LEU 613 Cb 0.60 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.01 1br2 h LEU 613 CO -0.72 1.13 0.77 -1.13 0.09 0.00 0.00 178.44 178.58 1br2 h ASN 614 N 0.95 0.10 -1.92 -0.43 -1.24 0.10 0.23 115.58 113.37 1br2 h ASN 614 Ca 0.16 0.02 -0.57 0.00 0.71 0.00 0.00 56.30 56.61 1br2 h ASN 614 Cb 0.63 0.00 -0.42 0.00 0.73 0.00 0.00 38.32 39.27 1br2 h ASN 614 CO 0.04 0.02 -0.74 0.00 -1.29 0.00 0.00 177.43 175.46 1br2 n GLN 615 N -4.30 3.04 -2.78 6.67 6.02 -0.76 -4.72 117.38 120.57 1br2 n GLN 615 Ca 0.24 -4.55 -0.36 0.00 -0.01 0.00 0.00 57.00 52.32 1br2 n GLN 615 Cb 1.11 -2.15 -0.06 0.00 1.02 0.00 0.00 30.24 30.15 1br2 n GLN 615 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1br2 s SER 616 N -3.41 7.25 0.65 1.08 0.15 0.07 -4.89 113.70 114.60 1br2 s SER 616 Ca 0.47 1.82 0.38 0.00 0.70 0.00 0.00 55.95 59.32 1br2 s SER 616 Cb 0.34 -2.57 2.08 0.00 -1.71 0.00 0.00 66.02 64.16 1br2 s SER 616 CO -0.14 -0.13 2.22 0.77 1.20 0.00 0.00 173.24 177.15 1br2 h SER 617 N 2.94 0.00 -3.47 5.45 4.64 -1.34 -3.39 113.55 118.39 1br2 h SER 617 Ca -0.47 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.25 1br2 h SER 617 Cb 1.19 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.17 1br2 h SER 617 CO 0.64 0.00 -0.11 -0.62 -0.87 0.00 0.00 176.83 175.88 1br2 s ASP 618 N -5.15 6.52 0.07 4.97 -1.08 -1.26 -4.99 116.67 115.74 1br2 s ASP 618 Ca -0.05 0.62 -0.25 0.00 -0.52 0.00 0.00 52.55 52.35 1br2 s ASP 618 Cb 0.12 -2.27 -0.17 0.00 -1.46 0.00 0.00 42.92 39.15 1br2 s ASP 618 CO 0.41 -0.13 1.62 0.07 0.52 0.00 0.00 175.17 177.65 1br2 h LYS 619 N 7.41 -0.20 -0.52 4.34 5.09 -1.96 -0.72 116.57 130.00 1br2 h LYS 619 Ca -0.35 0.01 0.09 0.00 0.09 0.00 0.00 60.65 60.50 1br2 h LYS 619 Cb 1.16 0.05 -0.08 0.00 0.10 0.00 0.00 32.23 33.46 1br2 h LYS 619 CO 0.73 -0.06 0.08 0.35 -2.09 0.00 0.00 179.45 178.45 1br2 h PHE 620 N -0.30 0.11 0.27 0.07 3.57 -1.94 0.93 116.94 119.65 1br2 h PHE 620 Ca -0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1br2 h PHE 620 Cb 0.23 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 1br2 h PHE 620 CO -0.04 -0.04 -0.28 0.28 -2.23 0.00 0.00 178.31 176.00 1br2 h VAL 621 N 0.20 0.42 -0.79 1.41 2.07 -1.87 0.20 116.25 117.89 1br2 h VAL 621 Ca 0.26 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.93 1br2 h VAL 621 Cb 0.37 0.42 -0.10 0.00 -1.52 0.00 0.00 31.29 30.46 1br2 h VAL 621 CO -0.37 0.00 0.34 0.00 0.02 0.00 0.00 177.57 177.56 1br2 h ALA 622 N 0.03 1.14 0.67 1.67 0.00 0.37 -0.25 119.26 122.89 1br2 h ALA 622 Ca -0.01 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1br2 h ALA 622 Cb 0.54 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1br2 h ALA 622 CO -0.06 -0.20 -0.45 -0.44 0.00 0.00 0.00 179.25 178.10 1br2 h ASP 623 N 0.48 -1.16 -1.17 0.00 5.19 0.16 -0.40 116.42 119.52 1br2 h ASP 623 Ca 0.44 0.07 0.38 0.00 -0.62 0.00 0.00 57.03 57.30 1br2 h ASP 623 Cb 0.67 0.35 -0.13 0.00 0.18 0.00 0.00 39.33 40.40 1br2 h ASP 623 CO -0.41 -0.68 0.73 -0.07 -3.12 0.00 0.00 179.24 175.69 1br2 h LEU 624 N -1.07 0.35 -3.81 1.55 3.38 0.75 0.10 115.31 116.56 1br2 h LEU 624 Ca -0.09 0.15 -0.56 0.00 0.09 0.00 0.00 57.88 57.47 1br2 h LEU 624 Cb 0.88 0.12 -0.34 0.00 0.09 0.00 0.00 40.66 41.40 1br2 h LEU 624 CO 0.06 -0.15 -0.09 0.79 0.09 0.00 0.00 178.44 179.15 1br2 n TRP 625 N -4.81 2.77 0.12 1.13 7.02 -0.24 -4.97 117.44 118.46 1br2 n TRP 625 Ca 0.34 -2.46 -0.02 0.00 -1.02 0.00 0.00 57.50 54.34 1br2 n TRP 625 Cb 1.22 -0.78 0.12 0.00 -2.42 0.00 0.00 31.31 29.44 1br2 n TRP 625 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 1br2 h LYS 626 N 1.98 0.00 0.00 -0.99 1.57 0.82 -3.39 116.57 116.55 1br2 h LYS 626 Ca 0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.23 1br2 h LYS 626 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1br2 h LYS 626 CO 1.04 0.68 -0.31 -2.13 -0.57 0.00 0.00 179.45 178.16 1br2 n ARG 657 N -3.67 0.16 -1.59 3.15 0.00 -1.26 -5.11 116.66 108.34 1br2 n ARG 657 Ca -0.01 0.06 -0.32 0.00 -0.00 0.00 0.00 57.85 57.59 1br2 n ARG 657 Cb 0.68 -0.77 0.06 0.00 0.00 0.00 0.00 32.46 32.43 1br2 n ARG 657 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1br2 s THR 658 N -1.61 3.49 0.15 5.15 -4.23 -1.26 -4.77 115.64 112.55 1br2 s THR 658 Ca -0.09 0.58 -0.25 0.00 -1.18 0.00 0.00 61.69 60.75 1br2 s THR 658 Cb 0.01 -3.12 0.01 0.00 1.34 0.00 0.00 72.50 70.74 1br2 s THR 658 CO 0.13 -0.53 1.60 0.58 -0.54 0.00 0.00 174.62 175.86 1br2 h VAL 659 N -0.45 0.26 -0.52 2.29 2.07 -1.34 0.16 116.25 118.73 1br2 h VAL 659 Ca -0.45 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.17 1br2 h VAL 659 Cb 1.23 0.26 -0.11 0.00 -1.52 0.00 0.00 31.29 31.15 1br2 h VAL 659 CO 0.54 0.00 -0.29 1.23 0.02 0.00 0.00 177.57 179.07 1br2 h GLY 660 N -0.34 -0.03 0.42 2.17 0.00 -1.92 -0.19 103.07 103.18 1br2 h GLY 660 Ca 0.12 0.37 0.05 0.00 0.00 0.00 0.00 47.33 47.88 1br2 h GLY 660 CO -0.43 -0.21 -0.10 1.46 0.00 0.00 0.00 176.54 177.26 1br2 h GLN 661 N -0.16 -0.05 -0.94 4.80 4.20 -1.60 -1.78 115.11 119.58 1br2 h GLN 661 Ca 0.22 0.00 0.10 0.00 0.06 0.00 0.00 58.65 59.03 1br2 h GLN 661 Cb 0.52 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.24 1br2 h GLN 661 CO -0.61 -0.03 0.58 -0.07 -0.67 0.00 0.00 178.83 178.02 1br2 h LEU 662 N -0.05 0.86 0.31 1.46 3.38 0.23 -2.31 115.31 119.19 1br2 h LEU 662 Ca 0.13 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1br2 h LEU 662 Cb 0.25 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1br2 h LEU 662 CO -0.29 0.50 -0.15 0.22 0.09 0.00 0.00 178.44 178.81 1br2 h TYR 663 N 0.97 -0.38 -0.93 1.13 3.20 -0.44 -2.35 116.97 118.16 1br2 h TYR 663 Ca 0.44 -0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.48 1br2 h TYR 663 Cb 0.36 0.13 -0.17 0.00 1.54 0.00 0.00 36.73 38.58 1br2 h TYR 663 CO -0.02 -0.10 -0.27 0.87 -1.64 0.00 0.00 178.16 177.00 1br2 h LYS 664 N -0.64 -0.01 0.48 1.82 1.57 -0.90 0.39 116.57 119.27 1br2 h LYS 664 Ca -0.04 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1br2 h LYS 664 Cb 0.46 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1br2 h LYS 664 CO 0.07 -0.00 -0.51 0.93 -0.57 0.00 0.00 179.45 179.37 1br2 h GLU 665 N -0.01 -0.95 -0.70 3.15 5.08 -1.26 0.37 114.58 120.25 1br2 h GLU 665 Ca 0.42 0.07 0.12 0.00 -1.00 0.00 0.00 59.36 58.97 1br2 h GLU 665 Cb 0.66 0.22 -0.09 0.00 0.50 0.00 0.00 28.75 30.04 1br2 h GLU 665 CO -0.96 -0.64 0.27 0.37 -1.00 0.00 0.00 179.01 177.06 1br2 h GLN 666 N -0.99 0.42 0.06 2.33 4.15 -0.40 0.04 115.11 120.72 1br2 h GLN 666 Ca -0.06 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.33 1br2 h GLN 666 Cb 0.87 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.46 1br2 h GLN 666 CO -0.08 0.28 -0.03 1.25 -1.93 0.00 0.00 178.83 178.32 1br2 h LEU 667 N 0.43 -0.07 -0.84 -2.39 5.85 -0.03 -1.67 115.31 116.60 1br2 h LEU 667 Ca 0.37 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.09 1br2 h LEU 667 Cb 0.53 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1br2 h LEU 667 CO -0.37 -0.04 0.51 0.71 -0.34 0.00 0.00 178.44 178.91 1br2 h THR 668 N -0.09 1.23 -0.67 1.05 1.35 -0.18 0.23 112.91 115.84 1br2 h THR 668 Ca -0.01 -0.49 0.02 0.00 -0.55 0.00 0.00 66.41 65.38 1br2 h THR 668 Cb 0.07 0.05 -0.04 0.00 -1.73 0.00 0.00 68.15 66.50 1br2 h THR 668 CO 0.01 0.24 0.44 0.11 -0.25 0.00 0.00 175.52 176.07 1br2 h LYS 669 N 1.15 0.83 0.44 4.72 1.57 -0.77 -0.88 116.57 123.62 1br2 h LYS 669 Ca 0.30 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 1br2 h LYS 669 Cb -0.06 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.07 1br2 h LYS 669 CO -0.06 0.55 -0.21 1.25 -0.57 0.00 0.00 179.45 180.41 1br2 h LEU 670 N 0.85 -0.50 -0.95 2.94 5.85 -0.22 -2.07 115.31 121.21 1br2 h LEU 670 Ca 0.25 0.02 0.29 0.00 0.84 0.00 0.00 57.88 59.28 1br2 h LEU 670 Cb -0.02 0.13 -0.17 0.00 0.37 0.00 0.00 40.66 40.97 1br2 h LEU 670 CO -0.06 -0.14 0.23 0.24 -0.34 0.00 0.00 178.44 178.37 1br2 h MET 671 N -1.03 0.09 0.38 1.25 2.86 -0.46 0.25 114.93 118.28 1br2 h MET 671 Ca -0.06 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1br2 h MET 671 Cb 0.45 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1br2 h MET 671 CO 0.10 0.06 -0.18 1.15 1.06 0.00 0.00 176.91 179.10 1br2 h THR 672 N 0.10 0.64 -0.63 2.22 2.02 -1.16 0.50 112.91 116.59 1br2 h THR 672 Ca 0.64 -0.14 0.13 0.00 0.77 0.00 0.00 66.41 67.81 1br2 h THR 672 Cb 1.41 0.71 -0.09 0.00 -1.74 0.00 0.00 68.15 68.44 1br2 h THR 672 CO -0.78 0.03 0.11 0.74 0.37 0.00 0.00 175.52 175.99 1br2 h THR 673 N -0.58 0.58 -0.87 3.16 2.02 0.09 0.29 112.91 117.60 1br2 h THR 673 Ca -0.05 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 1br2 h THR 673 Cb 0.43 0.33 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 1br2 h THR 673 CO 0.08 0.04 0.51 -0.07 0.37 0.00 0.00 175.52 176.45 1br2 h LEU 674 N 0.23 1.07 -2.10 2.58 3.38 -0.34 -1.77 115.31 118.36 1br2 h LEU 674 Ca 0.34 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.25 1br2 h LEU 674 Cb 0.53 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1br2 h LEU 674 CO -0.45 0.83 0.06 0.03 0.09 0.00 0.00 178.44 179.00 1br2 h ARG 675 N 1.21 0.00 -0.96 1.13 -0.00 0.37 -1.84 114.38 114.29 1br2 h ARG 675 Ca 0.31 0.00 -0.43 0.00 -0.50 0.00 0.00 59.98 59.36 1br2 h ARG 675 Cb -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 29.97 29.69 1br2 h ARG 675 CO -0.05 0.00 0.55 0.09 0.00 0.00 0.00 179.97 180.55 1br2 n ASN 676 N -4.35 3.86 -3.90 7.04 3.02 -0.63 -4.91 115.26 115.39 1br2 n ASN 676 Ca -0.01 -3.42 -0.10 0.00 -0.03 0.00 0.00 54.58 51.01 1br2 n ASN 676 Cb 0.16 -0.80 -0.09 0.00 -0.61 0.00 0.00 39.78 38.44 1br2 n ASN 676 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1br2 s THR 677 N -3.00 0.11 -0.44 3.41 -4.23 -0.69 -4.62 115.64 106.18 1br2 s THR 677 Ca 0.52 -0.92 -0.29 0.00 -1.18 0.00 0.00 61.69 59.82 1br2 s THR 677 Cb 0.44 -0.72 0.02 0.00 1.34 0.00 0.00 72.50 73.58 1br2 s THR 677 CO 0.11 -0.51 1.21 0.21 -0.54 0.00 0.00 174.62 175.10 1br2 s ASN 678 N -1.84 6.57 0.43 3.99 2.47 0.72 -4.83 114.94 122.45 1br2 s ASN 678 Ca -0.09 0.63 -0.22 0.00 0.42 0.00 0.00 52.86 53.60 1br2 s ASN 678 Cb -0.04 -2.55 -0.10 0.00 -1.45 0.00 0.00 41.25 37.12 1br2 s ASN 678 CO -0.02 -1.27 0.99 -2.16 -3.72 0.00 0.00 177.10 170.92 1br2 s PRO 679 N 4.53 4.12 -0.26 0.43 0.04 -1.26 -1.13 135.00 141.46 1br2 s PRO 679 Ca 0.52 1.28 -0.04 0.00 0.04 0.00 0.00 61.00 62.80 1br2 s PRO 679 Cb -0.09 -2.27 0.09 0.00 0.04 0.00 0.00 34.50 32.26 1br2 s PRO 679 CO 0.31 -0.14 0.11 -0.80 0.04 0.00 0.00 177.00 176.51 1br2 s ASN 680 N -1.96 3.32 0.09 6.66 0.01 0.18 -4.90 114.94 118.34 1br2 s ASN 680 Ca 0.62 -1.17 -0.24 0.00 -0.71 0.00 0.00 52.86 51.36 1br2 s ASN 680 Cb -0.14 -0.43 -0.07 0.00 0.41 0.00 0.00 41.25 41.02 1br2 s ASN 680 CO 0.19 -0.41 0.75 -0.36 -1.51 0.00 0.00 177.10 175.76 1br2 s PHE 681 N 2.01 3.81 -0.21 2.20 0.40 -1.26 0.13 117.98 125.06 1br2 s PHE 681 Ca 0.07 1.51 0.01 0.00 -0.60 0.00 0.00 56.93 57.92 1br2 s PHE 681 Cb -0.16 -2.76 0.04 0.00 0.51 0.00 0.00 43.02 40.65 1br2 s PHE 681 CO -0.27 0.40 -0.12 0.08 0.70 0.00 0.00 175.22 176.01 1br2 s VAL 682 N -0.58 1.83 -0.45 -0.44 1.01 0.20 -2.79 120.40 119.17 1br2 s VAL 682 Ca 0.36 -1.14 -0.18 0.00 0.00 0.00 0.00 61.98 61.02 1br2 s VAL 682 Cb -0.21 -1.87 0.04 0.00 0.00 0.00 0.00 36.38 34.33 1br2 s VAL 682 CO 0.24 0.19 0.53 -0.13 0.00 0.00 0.00 175.10 175.92 1br2 s ARG 683 N 1.31 3.13 -0.27 2.72 1.81 0.92 -0.63 118.95 127.95 1br2 s ARG 683 Ca -0.02 -0.76 -0.21 0.00 -1.72 0.00 0.00 55.73 53.03 1br2 s ARG 683 Cb -0.17 -4.01 -0.01 0.00 -0.45 0.00 0.00 34.95 30.31 1br2 s ARG 683 CO -0.08 -1.00 0.66 0.00 -0.68 0.00 0.00 175.30 174.19 1br2 s ILE 685 N 2.59 5.40 -0.19 0.00 -1.09 0.20 -4.29 121.20 123.81 1br2 s ILE 685 Ca 0.27 0.17 -0.13 0.00 -2.23 0.00 0.00 60.65 58.73 1br2 s ILE 685 Cb -0.15 -3.37 -0.05 0.00 -1.58 0.00 0.00 42.46 37.31 1br2 s ILE 685 CO 0.09 0.58 0.28 -0.51 -1.23 0.00 0.00 174.94 174.15 1br2 s ILE 686 N -0.74 5.30 0.03 2.92 2.07 -1.26 -1.58 121.20 127.95 1br2 s ILE 686 Ca 0.13 0.48 -0.20 0.00 -1.41 0.00 0.00 60.65 59.66 1br2 s ILE 686 Cb -0.12 -3.61 -0.17 0.00 0.13 0.00 0.00 42.46 38.69 1br2 s ILE 686 CO 0.03 0.35 1.25 1.55 -1.91 0.00 0.00 174.94 176.21 1br2 h PRO 687 N 7.02 0.41 -4.43 3.50 0.13 -1.86 -3.42 132.00 133.35 1br2 h PRO 687 Ca -0.39 -0.29 -0.35 0.00 -0.87 0.00 0.00 66.00 64.10 1br2 h PRO 687 Cb 1.16 0.05 -0.10 0.00 0.13 0.00 0.00 31.00 32.24 1br2 h PRO 687 CO 0.73 0.90 -0.31 0.54 -0.23 0.00 0.00 178.00 179.63 1br2 s ASN 688 N -6.39 1.19 -0.04 1.44 2.20 -1.24 -0.36 114.94 111.74 1br2 s ASN 688 Ca -0.14 -1.59 0.14 0.00 -0.94 0.00 0.00 52.86 50.33 1br2 s ASN 688 Cb 0.05 0.62 0.42 0.00 -2.00 0.00 0.00 41.25 40.34 1br2 s ASN 688 CO 0.78 -1.20 1.35 1.41 -2.94 0.00 0.00 177.10 176.50 1br2 n HIS 689 N -0.58 0.70 -1.12 1.54 8.25 -1.26 -4.45 115.22 118.29 1br2 n HIS 689 Ca 0.03 -0.57 -0.01 0.00 -0.26 0.00 0.00 57.72 56.91 1br2 n HIS 689 Cb 0.62 -0.09 0.27 0.00 1.12 0.00 0.00 29.99 31.91 1br2 n HIS 689 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1br2 n GLU 690 N 0.55 3.04 -2.90 -0.41 4.71 -1.26 -4.91 120.64 119.46 1br2 n GLU 690 Ca 0.16 -3.04 -0.10 0.00 -0.01 0.00 0.00 57.16 54.18 1br2 n GLU 690 Cb 0.57 -2.01 -0.01 0.00 -1.01 0.00 0.00 31.44 28.97 1br2 n GLU 690 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1br2 n LYS 691 N -0.50 -2.56 -3.78 3.49 5.02 -1.26 -4.85 118.16 113.72 1br2 n LYS 691 Ca 0.33 0.11 -0.37 0.00 -2.02 0.00 0.00 58.31 56.36 1br2 n LYS 691 Cb 1.16 -4.64 -0.06 0.00 -0.02 0.00 0.00 35.03 31.47 1br2 n LYS 691 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1br2 s ARG 692 N -5.45 3.64 0.02 1.97 3.52 -1.26 -5.02 118.95 116.37 1br2 s ARG 692 Ca 0.17 -0.02 -0.17 0.00 -0.13 0.00 0.00 55.73 55.58 1br2 s ARG 692 Cb -0.10 -3.23 -0.06 0.00 -1.56 0.00 0.00 34.95 30.00 1br2 s ARG 692 CO 0.21 0.69 0.47 0.00 -0.81 0.00 0.00 175.30 175.86 1br2 s ALA 693 N -0.83 3.64 0.00 6.12 0.00 -1.26 -4.05 121.76 125.38 1br2 s ALA 693 Ca 0.16 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.00 1br2 s ALA 693 Cb -0.13 -2.50 0.00 0.00 0.00 0.00 0.00 23.12 20.50 1br2 s ALA 693 CO 0.05 0.42 0.00 0.41 0.00 0.00 0.00 175.76 176.64 1br2 n GLY 694 N 1.89 0.54 3.02 0.00 0.00 -1.26 -5.00 105.19 104.38 1br2 n GLY 694 Ca -0.12 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 1br2 n GLY 694 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1br2 s LYS 695 N -0.15 1.64 -0.43 1.61 2.20 -1.26 -5.06 119.74 118.29 1br2 s LYS 695 Ca 0.00 -2.03 -0.19 0.00 -0.36 0.00 0.00 55.97 53.40 1br2 s LYS 695 Cb 0.00 -3.27 0.03 0.00 -1.51 0.00 0.00 37.83 33.07 1br2 s LYS 695 CO 0.00 -0.99 0.53 -1.17 -0.36 0.00 0.00 175.35 173.37 1br2 s LEU 696 N 0.68 4.73 -1.05 5.43 0.20 -1.26 -3.71 118.68 123.70 1br2 s LEU 696 Ca 0.12 -0.56 -0.22 0.00 0.69 0.00 0.00 54.13 54.15 1br2 s LEU 696 Cb -0.21 -2.53 0.05 0.00 -0.43 0.00 0.00 46.19 43.07 1br2 s LEU 696 CO -0.06 -0.69 1.50 -0.62 -0.29 0.00 0.00 176.35 176.19 1br2 s ASP 697 N 1.96 6.49 0.26 3.68 -1.08 0.52 -4.88 116.67 123.62 1br2 s ASP 697 Ca 0.16 -1.55 0.09 0.00 -0.52 0.00 0.00 52.55 50.74 1br2 s ASP 697 Cb -0.16 -2.57 0.81 0.00 -1.46 0.00 0.00 42.92 39.54 1br2 s ASP 697 CO 0.16 -1.51 1.18 0.00 0.52 0.00 0.00 175.17 175.51 1br2 n ALA 698 N 9.01 0.59 0.08 3.66 0.00 -1.26 -0.10 120.51 132.49 1br2 n ALA 698 Ca 0.35 0.78 -0.16 0.00 0.00 0.00 0.00 53.44 54.42 1br2 n ALA 698 Cb 0.50 -0.68 -0.14 0.00 0.00 0.00 0.00 19.45 19.13 1br2 n ALA 698 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1br2 h HIS 699 N 0.00 0.43 -0.37 0.00 3.86 -1.89 -1.17 115.15 116.00 1br2 h HIS 699 Ca 0.55 -0.31 -0.06 0.00 -1.16 0.00 0.00 60.37 59.38 1br2 h HIS 699 Cb 1.34 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.77 1br2 h HIS 699 CO -0.18 1.30 -0.04 1.25 0.86 0.00 0.00 177.93 181.13 1br2 h LEU 700 N 0.06 0.57 -0.05 2.43 5.85 -0.83 0.55 115.31 123.90 1br2 h LEU 700 Ca -0.19 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.37 1br2 h LEU 700 Cb 1.98 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.86 1br2 h LEU 700 CO 0.17 0.67 -0.09 0.58 -0.34 0.00 0.00 178.44 179.43 1br2 h VAL 701 N 0.57 1.41 -0.51 1.05 2.07 -0.99 -2.33 116.25 117.51 1br2 h VAL 701 Ca 0.11 -1.37 0.05 0.00 0.82 0.00 0.00 66.70 66.32 1br2 h VAL 701 Cb 0.42 2.20 -0.05 0.00 -1.52 0.00 0.00 31.29 32.34 1br2 h VAL 701 CO 0.02 0.38 0.23 -0.07 0.02 0.00 0.00 177.57 178.15 1br2 h LEU 702 N -0.33 0.30 -0.70 2.57 3.38 -0.85 0.15 115.31 119.83 1br2 h LEU 702 Ca 0.00 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.04 1br2 h LEU 702 Cb 0.66 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 1br2 h LEU 702 CO 0.02 0.21 0.44 -0.33 0.09 0.00 0.00 178.44 178.87 1br2 h GLU 703 N 0.45 0.85 -0.20 1.13 5.08 -0.90 -0.04 114.58 120.95 1br2 h GLU 703 Ca 0.23 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1br2 h GLU 703 Cb 0.19 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1br2 h GLU 703 CO -0.19 0.56 0.07 1.96 -1.00 0.00 0.00 179.01 180.41 1br2 h GLN 704 N 0.87 0.30 -0.43 2.33 4.20 -0.77 -1.03 115.11 120.58 1br2 h GLN 704 Ca 0.27 -0.06 0.13 0.00 0.06 0.00 0.00 58.65 59.05 1br2 h GLN 704 Cb -0.01 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 1br2 h GLN 704 CO -0.10 0.39 0.33 -0.07 -0.67 0.00 0.00 178.83 178.71 1br2 h LEU 705 N 0.16 0.00 0.46 1.46 3.38 -0.11 -2.37 115.31 118.29 1br2 h LEU 705 Ca 0.06 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1br2 h LEU 705 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1br2 h LEU 705 CO -0.00 0.00 -0.22 0.03 0.09 0.00 0.00 178.44 178.34 1br2 h ARG 706 N 0.00 -0.59 0.00 1.13 3.08 0.30 -2.87 114.38 115.43 1br2 h ARG 706 Ca 0.21 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.30 1br2 h ARG 706 Cb 0.86 0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1br2 h ARG 706 CO -0.00 -0.39 0.00 0.00 -1.07 0.00 0.00 179.97 178.50 1br2 n ASN 708 N -1.42 0.81 -0.81 0.00 5.03 -0.90 -4.92 115.26 113.04 1br2 n ASN 708 Ca 0.06 -0.61 -0.11 0.00 0.87 0.00 0.00 54.58 54.79 1br2 n ASN 708 Cb 0.17 0.31 -0.05 0.00 -1.02 0.00 0.00 39.78 39.20 1br2 n ASN 708 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1br2 n GLY 709 N 1.45 1.16 0.29 7.41 0.00 -0.79 -4.91 105.19 109.79 1br2 n GLY 709 Ca 0.08 -0.35 0.09 0.00 0.00 0.00 0.00 46.02 45.83 1br2 n GLY 709 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1br2 h VAL 710 N 0.00 0.52 -0.30 1.61 2.07 -1.75 0.94 116.25 119.34 1br2 h VAL 710 Ca -0.22 -0.13 -0.14 0.00 0.82 0.00 0.00 66.70 67.04 1br2 h VAL 710 Cb 0.80 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1br2 h VAL 710 CO 0.32 0.07 -0.36 -0.07 0.02 0.00 0.00 177.57 177.54 1br2 h LEU 711 N 0.37 0.84 -1.08 2.57 3.38 -1.91 -1.52 115.31 117.96 1br2 h LEU 711 Ca 0.48 -0.49 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1br2 h LEU 711 Cb 0.84 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1br2 h LEU 711 CO -0.50 1.16 -0.38 -0.33 0.09 0.00 0.00 178.44 178.48 1br2 h GLU 712 N 0.54 0.15 0.00 1.13 3.07 -1.64 0.76 114.58 118.59 1br2 h GLU 712 Ca 0.04 -0.07 -0.03 0.00 -0.50 0.00 0.00 59.36 58.80 1br2 h GLU 712 Cb 0.95 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.85 1br2 h GLU 712 CO 0.09 0.52 -0.15 0.78 -1.40 0.00 0.00 179.01 178.85 1br2 h GLY 713 N 1.17 0.00 0.82 -3.84 0.00 0.12 -2.30 103.07 99.04 1br2 h GLY 713 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.03 1br2 h GLY 713 CO 0.06 0.00 -1.83 1.39 0.00 0.00 0.00 176.54 176.16 1br2 n ILE 714 N -3.34 1.61 0.25 2.60 5.41 -0.57 -3.58 119.36 121.75 1br2 n ILE 714 Ca -0.00 -0.78 -0.15 0.00 1.00 0.00 0.00 62.75 62.82 1br2 n ILE 714 Cb 0.37 -1.08 -0.08 0.00 -0.71 0.00 0.00 39.64 38.13 1br2 n ILE 714 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1br2 h ARG 715 N 0.01 -0.60 -0.46 0.38 2.47 -0.66 -2.27 114.38 113.25 1br2 h ARG 715 Ca -0.33 0.04 0.08 0.00 -1.26 0.00 0.00 59.98 58.51 1br2 h ARG 715 Cb 2.04 0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 30.47 1br2 h ARG 715 CO 0.07 -0.34 0.31 0.97 0.56 0.00 0.00 179.97 181.55 1br2 h ILE 716 N -0.75 0.90 0.00 2.04 6.09 -1.60 0.93 117.51 125.11 1br2 h ILE 716 Ca -0.06 -0.09 0.00 0.00 -1.37 0.00 0.00 64.86 63.34 1br2 h ILE 716 Cb 0.54 0.62 0.00 0.00 0.47 0.00 0.00 36.82 38.45 1br2 h ILE 716 CO 0.10 0.05 0.00 0.00 -3.07 0.00 0.00 178.15 175.23 1br2 n ARG 718 N -2.56 0.52 0.29 0.00 1.74 0.17 -4.21 116.66 112.61 1br2 n ARG 718 Ca 0.02 0.27 0.18 0.00 -0.77 0.00 0.00 57.85 57.55 1br2 n ARG 718 Cb 0.29 -1.48 0.97 0.00 -1.02 0.00 0.00 32.46 31.23 1br2 n ARG 718 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1br2 h GLN 719 N -1.00 0.00 0.00 5.56 4.20 0.51 -3.44 115.11 120.94 1br2 h GLN 719 Ca -0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1br2 h GLN 719 Cb 0.94 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.72 1br2 h GLN 719 CO -0.01 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.56 1br2 n GLY 720 N -1.16 4.76 2.67 3.46 0.00 -0.42 -5.04 105.19 109.46 1br2 n GLY 720 Ca -0.02 -1.91 -0.29 0.00 0.00 0.00 0.00 46.02 43.79 1br2 n GLY 720 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1br2 s PHE 721 N 1.95 1.73 0.07 1.61 0.40 -1.26 -4.63 117.98 117.85 1br2 s PHE 721 Ca 0.00 -2.20 -0.28 0.00 -0.60 0.00 0.00 56.93 53.85 1br2 s PHE 721 Cb 0.00 -1.70 -0.17 0.00 0.51 0.00 0.00 43.02 41.66 1br2 s PHE 721 CO 0.00 -0.80 1.64 -1.00 0.70 0.00 0.00 175.22 175.75 1br2 h PRO 722 N 6.96 -0.47 -7.23 0.24 0.13 -1.75 -3.42 132.00 126.47 1br2 h PRO 722 Ca -0.01 0.03 -0.48 0.00 -0.87 0.00 0.00 66.00 64.67 1br2 h PRO 722 Cb 0.95 0.11 0.03 0.00 0.13 0.00 0.00 31.00 32.21 1br2 h PRO 722 CO 0.44 -0.29 0.38 -0.80 -0.23 0.00 0.00 178.00 177.51 1br2 s ASN 723 N -4.79 6.44 -0.30 1.44 0.01 -1.18 -4.94 114.94 111.61 1br2 s ASN 723 Ca -0.15 1.57 -0.13 0.00 -0.71 0.00 0.00 52.86 53.44 1br2 s ASN 723 Cb 0.04 -2.50 0.17 0.00 0.41 0.00 0.00 41.25 39.37 1br2 s ASN 723 CO 0.63 -0.72 0.96 0.00 -1.51 0.00 0.00 177.10 176.47 1br2 s ARG 724 N -4.28 0.29 0.18 -0.60 1.70 -1.26 -0.95 118.95 114.03 1br2 s ARG 724 Ca 0.59 0.63 0.11 0.00 -0.47 0.00 0.00 55.73 56.59 1br2 s ARG 724 Cb -0.11 0.37 -0.04 0.00 -0.57 0.00 0.00 34.95 34.60 1br2 s ARG 724 CO 0.36 -0.20 -0.23 0.96 -1.08 0.00 0.00 175.30 175.11 1br2 s ILE 725 N 2.67 2.25 0.39 4.99 -4.36 -0.88 -4.92 121.20 121.34 1br2 s ILE 725 Ca 0.01 -1.97 -0.25 0.00 -0.26 0.00 0.00 60.65 58.17 1br2 s ILE 725 Cb -0.08 -2.05 -0.09 0.00 1.25 0.00 0.00 42.46 41.48 1br2 s ILE 725 CO -0.16 -0.12 1.12 0.68 0.24 0.00 0.00 174.94 176.70 1br2 s VAL 726 N -1.64 3.38 0.04 8.37 -7.23 -1.26 -0.98 120.40 121.08 1br2 s VAL 726 Ca 0.19 1.14 -0.08 0.00 -1.81 0.00 0.00 61.98 61.42 1br2 s VAL 726 Cb -0.08 -3.64 -0.02 0.00 0.56 0.00 0.00 36.38 33.21 1br2 s VAL 726 CO 0.09 0.09 0.97 0.49 -0.31 0.00 0.00 175.10 176.43 1br2 n PHE 727 N 0.14 -0.12 -0.26 2.82 3.72 -1.18 -1.14 117.46 121.45 1br2 n PHE 727 Ca 0.04 0.33 -0.02 0.00 -0.05 0.00 0.00 57.45 57.74 1br2 n PHE 727 Cb 0.47 -0.46 0.04 0.00 -0.94 0.00 0.00 39.48 38.59 1br2 n PHE 727 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1br2 h GLN 728 N 0.00 -0.08 -0.70 -1.08 4.15 -1.90 0.23 115.11 115.73 1br2 h GLN 728 Ca 0.04 0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.53 1br2 h GLN 728 Cb 0.11 0.02 -0.06 0.00 0.21 0.00 0.00 27.48 27.76 1br2 h GLN 728 CO -0.25 -0.06 0.40 1.49 -1.93 0.00 0.00 178.83 178.48 1br2 h GLU 729 N -0.09 0.70 -0.48 1.69 4.81 -1.51 0.28 114.58 119.99 1br2 h GLU 729 Ca 0.29 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 1br2 h GLU 729 Cb 0.57 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1br2 h GLU 729 CO -0.78 0.46 0.24 0.35 -0.73 0.00 0.00 179.01 178.55 1br2 h PHE 730 N 0.72 0.68 -0.04 0.92 3.57 0.58 -0.13 116.94 123.23 1br2 h PHE 730 Ca 0.31 -0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.80 1br2 h PHE 730 Cb 0.20 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 1br2 h PHE 730 CO -0.07 0.53 -0.06 -0.09 -2.23 0.00 0.00 178.31 176.39 1br2 h ARG 731 N 0.63 -0.08 -0.16 1.11 1.12 0.94 -1.54 114.38 116.41 1br2 h ARG 731 Ca 0.17 0.01 -0.08 0.00 -1.11 0.00 0.00 59.98 58.96 1br2 h ARG 731 Cb 0.09 0.02 -0.00 0.00 -0.01 0.00 0.00 29.97 30.07 1br2 h ARG 731 CO -0.02 -0.05 -0.22 -0.56 -3.11 0.00 0.00 179.97 176.00 1br2 h GLN 732 N -0.08 0.42 -0.48 0.20 3.07 -0.35 0.52 115.11 118.42 1br2 h GLN 732 Ca 0.04 -0.25 -0.00 0.00 0.09 0.00 0.00 58.65 58.52 1br2 h GLN 732 Cb 0.13 0.02 -0.02 0.00 0.08 0.00 0.00 27.48 27.69 1br2 h GLN 732 CO -0.09 0.83 0.28 -0.09 0.09 0.00 0.00 178.83 179.86 1br2 h ARG 733 N 0.05 0.66 -0.16 0.06 2.43 -1.00 -3.32 114.38 113.10 1br2 h ARG 733 Ca 0.02 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1br2 h ARG 733 Cb 0.79 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1br2 h ARG 733 CO 0.05 0.49 0.00 0.66 -1.51 0.00 0.00 179.97 179.67 1br2 n TYR 734 N -4.69 0.37 0.22 2.20 4.01 -0.58 -4.58 117.16 114.10 1br2 n TYR 734 Ca 0.02 -0.71 0.06 0.00 -0.16 0.00 0.00 57.90 57.11 1br2 n TYR 734 Cb 0.06 -0.13 0.53 0.00 -0.31 0.00 0.00 39.34 39.49 1br2 n TYR 734 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 1br2 h GLU 735 N 1.02 0.05 0.00 -0.72 4.57 -0.99 -0.85 114.58 117.67 1br2 h GLU 735 Ca 0.00 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1br2 h GLU 735 Cb 0.92 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.50 1br2 h GLU 735 CO 0.06 0.15 -0.02 0.82 -1.18 0.00 0.00 179.01 178.84 1br2 h ILE 736 N 0.05 0.94 0.00 2.32 5.03 -1.82 0.14 117.51 124.17 1br2 h ILE 736 Ca 0.01 -0.08 0.00 0.00 -0.12 0.00 0.00 64.86 64.67 1br2 h ILE 736 Cb 0.21 1.04 0.00 0.00 -3.03 0.00 0.00 36.82 35.04 1br2 h ILE 736 CO 0.01 0.02 0.00 0.18 -0.68 0.00 0.00 178.15 177.68 1br2 n LEU 737 N -4.41 0.61 -2.96 1.44 4.77 -0.32 -3.85 117.00 112.27 1br2 n LEU 737 Ca -0.03 0.59 -0.15 0.00 -0.03 0.00 0.00 56.01 56.40 1br2 n LEU 737 Cb 0.11 -0.44 0.01 0.00 -2.33 0.00 0.00 43.42 40.76 1br2 n LEU 737 CO 0.33 -0.30 0.01 0.00 -1.33 0.00 0.00 177.39 176.10 1br2 n ALA 738 N -1.73 0.54 -0.28 -1.18 0.00 -0.06 -4.93 120.51 112.88 1br2 n ALA 738 Ca 0.04 -2.41 0.04 0.00 0.00 0.00 0.00 53.44 51.12 1br2 n ALA 738 Cb 0.33 -1.06 0.18 0.00 0.00 0.00 0.00 19.45 18.90 1br2 n ALA 738 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1br2 h ALA 739 N 3.50 1.16 -0.50 0.00 0.00 -0.93 0.48 119.26 122.96 1br2 h ALA 739 Ca -0.02 0.06 -0.24 0.00 0.00 0.00 0.00 54.91 54.71 1br2 h ALA 739 Cb 1.00 -0.05 -0.14 0.00 0.00 0.00 0.00 17.79 18.60 1br2 h ALA 739 CO 0.35 -0.03 0.30 0.09 0.00 0.00 0.00 179.25 179.96 1br2 n ASN 740 N -4.84 3.43 -0.09 0.00 3.02 -1.26 -4.27 115.26 111.24 1br2 n ASN 740 Ca 0.14 -2.81 -0.18 0.00 -0.03 0.00 0.00 54.58 51.70 1br2 n ASN 740 Cb 0.35 -0.67 -0.11 0.00 -0.61 0.00 0.00 39.78 38.74 1br2 n ASN 740 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1br2 h ALA 741 N 1.70 0.17 -2.77 5.41 0.00 -1.22 -3.48 119.26 119.08 1br2 h ALA 741 Ca 0.29 -0.95 -0.59 0.00 0.00 0.00 0.00 54.91 53.66 1br2 h ALA 741 Cb 1.91 0.53 -0.04 0.00 0.00 0.00 0.00 17.79 20.20 1br2 h ALA 741 CO 0.55 0.51 -0.36 0.42 0.00 0.00 0.00 179.25 180.37 1br2 s ILE 742 N -2.29 5.22 0.60 0.00 1.09 -1.26 -4.57 121.20 119.98 1br2 s ILE 742 Ca -0.24 -0.07 -0.19 0.00 -1.10 0.00 0.00 60.65 59.04 1br2 s ILE 742 Cb 0.03 -3.63 -0.03 0.00 -1.06 0.00 0.00 42.46 37.78 1br2 s ILE 742 CO 0.56 0.06 1.29 -2.16 -0.10 0.00 0.00 174.94 174.59 1br2 s PRO 743 N -2.63 2.87 -0.71 2.79 0.04 -1.26 -4.89 135.00 131.22 1br2 s PRO 743 Ca 0.40 2.05 -0.27 0.00 0.04 0.00 0.00 61.00 63.22 1br2 s PRO 743 Cb -0.12 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.42 1br2 s PRO 743 CO 0.25 -1.35 1.53 -1.59 0.04 0.00 0.00 177.00 175.89 1br2 s LYS 744 N -3.20 2.97 0.00 4.56 0.00 -1.26 -4.63 119.74 118.17 1br2 s LYS 744 Ca 0.78 0.05 0.00 0.00 0.00 0.00 0.00 55.97 56.80 1br2 s LYS 744 Cb -0.36 -4.33 0.00 0.00 0.00 0.00 0.00 37.83 33.13 1br2 s LYS 744 CO 0.40 -2.41 0.00 0.41 0.00 0.00 0.00 175.35 173.75 1br2 n GLY 745 N 5.60 0.46 3.65 0.59 0.00 -1.26 -5.06 105.19 109.17 1br2 n GLY 745 Ca 0.12 -1.32 -0.42 0.00 0.00 0.00 0.00 46.02 44.40 1br2 n GLY 745 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1br2 s PHE 746 N -3.63 3.33 -0.19 1.61 5.36 -1.26 -5.01 117.98 118.19 1br2 s PHE 746 Ca 0.00 1.27 -0.04 0.00 -0.96 0.00 0.00 56.93 57.20 1br2 s PHE 746 Cb 0.00 -3.13 0.06 0.00 -0.34 0.00 0.00 43.02 39.62 1br2 s PHE 746 CO 0.00 -0.41 0.08 1.41 -1.46 0.00 0.00 175.22 174.84 1br2 s MET 747 N 2.89 0.23 0.34 10.12 -2.45 -1.26 -4.94 119.30 124.21 1br2 s MET 747 Ca 0.39 -0.21 -0.26 0.00 -1.25 0.00 0.00 55.69 54.35 1br2 s MET 747 Cb -0.15 -1.86 -0.13 0.00 1.25 0.00 0.00 34.83 33.93 1br2 s MET 747 CO 0.08 -0.69 0.93 -0.40 1.05 0.00 0.00 175.02 175.99 1br2 n ASP 748 N 5.21 0.93 -0.31 1.11 5.75 -1.26 -4.60 116.55 123.38 1br2 n ASP 748 Ca -0.07 1.11 -0.04 0.00 -0.01 0.00 0.00 54.79 55.78 1br2 n ASP 748 Cb 0.48 -1.27 0.01 0.00 -1.03 0.00 0.00 41.12 39.31 1br2 n ASP 748 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1br2 h GLY 749 N 1.69 -0.10 0.81 6.12 0.00 -1.98 0.43 103.07 110.05 1br2 h GLY 749 Ca -0.40 0.52 -0.04 0.00 0.00 0.00 0.00 47.33 47.40 1br2 h GLY 749 CO 0.58 -0.18 -0.39 1.70 0.00 0.00 0.00 176.54 178.25 1br2 h LYS 750 N -0.08 -1.05 -0.17 4.80 3.64 -1.92 0.02 116.57 121.81 1br2 h LYS 750 Ca 0.28 0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.76 1br2 h LYS 750 Cb 0.57 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 1br2 h LYS 750 CO -0.86 -0.70 0.11 1.96 -2.27 0.00 0.00 179.45 177.69 1br2 h GLN 751 N -1.14 0.12 -0.26 1.90 1.08 -1.83 -0.38 115.11 114.60 1br2 h GLN 751 Ca -0.11 -0.01 -0.07 0.00 -1.45 0.00 0.00 58.65 57.01 1br2 h GLN 751 Cb 0.84 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.23 1br2 h GLN 751 CO 0.18 0.08 -0.11 0.00 -0.95 0.00 0.00 178.83 178.04 1br2 h ALA 752 N 1.91 0.36 0.39 3.87 0.00 0.02 -1.18 119.26 124.63 1br2 h ALA 752 Ca 0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1br2 h ALA 752 Cb 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1br2 h ALA 752 CO -0.01 0.21 -0.19 0.00 0.00 0.00 0.00 179.25 179.26 1br2 h ILE 754 N -0.69 0.43 0.65 0.00 2.04 -1.05 0.17 117.51 119.07 1br2 h ILE 754 Ca -0.05 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 1br2 h ILE 754 Cb 0.49 -0.07 0.01 0.00 -0.74 0.00 0.00 36.82 36.50 1br2 h ILE 754 CO 0.09 0.08 -0.31 -0.07 0.00 0.00 0.00 178.15 177.94 1br2 h LEU 755 N 0.46 -0.74 -0.53 1.44 3.38 -0.78 -2.50 115.31 116.05 1br2 h LEU 755 Ca 0.68 -0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.76 1br2 h LEU 755 Cb 1.44 0.19 -0.09 0.00 0.09 0.00 0.00 40.66 42.28 1br2 h LEU 755 CO -0.52 -0.36 -0.07 0.24 0.09 0.00 0.00 178.44 177.81 1br2 h MET 756 N -1.17 0.05 -0.24 1.13 2.86 0.13 0.27 114.93 117.95 1br2 h MET 756 Ca -0.09 -0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1br2 h MET 756 Cb 0.69 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.28 1br2 h MET 756 CO 0.15 0.03 -0.15 0.82 1.06 0.00 0.00 176.91 178.82 1br2 h ILE 757 N 0.05 0.57 -0.49 -1.22 2.04 -0.78 0.86 117.51 118.54 1br2 h ILE 757 Ca 0.26 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.18 1br2 h ILE 757 Cb 0.40 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 1br2 h ILE 757 CO -0.50 0.00 0.18 0.11 0.00 0.00 0.00 178.15 177.94 1br2 h LYS 758 N -0.13 0.35 -0.43 2.37 1.57 -0.68 0.23 116.57 119.84 1br2 h LYS 758 Ca 0.13 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.95 1br2 h LYS 758 Cb 0.33 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1br2 h LYS 758 CO -0.32 0.23 0.29 0.00 -0.57 0.00 0.00 179.45 179.09 1br2 h ALA 759 N 1.32 1.94 0.00 3.86 0.00 0.19 0.80 119.26 127.37 1br2 h ALA 759 Ca 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1br2 h ALA 759 Cb 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1br2 h ALA 759 CO -0.23 -0.02 -0.20 1.28 0.00 0.00 0.00 179.25 180.09 1br2 n LEU 760 N -4.48 0.24 -3.44 0.00 4.77 0.27 -4.93 117.00 109.44 1br2 n LEU 760 Ca 0.05 0.32 -0.21 0.00 -0.03 0.00 0.00 56.01 56.14 1br2 n LEU 760 Cb 0.24 -0.39 0.08 0.00 -2.33 0.00 0.00 43.42 41.02 1br2 n LEU 760 CO 0.35 0.03 0.20 -0.62 -1.33 0.00 0.00 177.39 176.01 1br2 n GLU 761 N -1.56 -7.29 -2.41 3.23 1.02 0.28 -4.93 120.64 108.97 1br2 n GLU 761 Ca 0.06 0.81 -0.42 0.00 -0.02 0.00 0.00 57.16 57.59 1br2 n GLU 761 Cb 0.35 -5.77 -0.03 0.00 -0.02 0.00 0.00 31.44 25.97 1br2 n GLU 761 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1br2 s LEU 762 N -6.80 4.35 0.10 -4.62 1.43 -1.10 -4.96 118.68 107.09 1br2 s LEU 762 Ca 0.38 1.99 -0.31 0.00 -1.03 0.00 0.00 54.13 55.16 1br2 s LEU 762 Cb -0.17 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.39 1br2 s LEU 762 CO 0.70 -0.50 1.65 -0.62 0.23 0.00 0.00 176.35 177.81 1br2 s ASP 763 N 1.18 6.57 0.63 2.29 2.15 -1.26 -4.82 116.67 123.41 1br2 s ASP 763 Ca 0.59 2.56 0.25 0.00 0.43 0.00 0.00 52.55 56.38 1br2 s ASP 763 Cb -0.29 -2.57 1.30 0.00 -0.30 0.00 0.00 42.92 41.06 1br2 s ASP 763 CO 0.28 -0.89 1.73 1.55 -0.17 0.00 0.00 175.17 177.67 1br2 h PRO 764 N 7.92 0.00 0.00 4.34 0.13 -1.92 0.40 132.00 142.86 1br2 h PRO 764 Ca -0.43 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.60 1br2 h PRO 764 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1br2 h PRO 764 CO 0.93 0.00 -0.46 -0.97 -0.23 0.00 0.00 178.00 177.27 1br2 h ASN 765 N 0.00 0.00 0.52 1.44 -1.24 -2.03 -3.10 115.58 111.17 1br2 h ASN 765 Ca 0.13 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.14 1br2 h ASN 765 Cb 1.25 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.30 1br2 h ASN 765 CO -0.00 0.46 0.00 0.18 -1.29 0.00 0.00 177.43 176.77 1br2 n LEU 766 N -3.56 0.00 0.00 0.34 4.77 0.14 -4.83 117.00 113.86 1br2 n LEU 766 Ca -0.00 0.48 -0.09 0.00 -0.03 0.00 0.00 56.01 56.37 1br2 n LEU 766 Cb 0.56 -0.48 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 1br2 n LEU 766 CO 0.38 -0.22 0.36 0.00 -1.33 0.00 0.00 177.39 176.58 1br2 n TYR 767 N -1.48 -1.89 -3.70 -1.77 0.18 -1.17 -1.45 117.16 105.87 1br2 n TYR 767 Ca 0.04 -1.67 -0.14 0.00 1.88 0.00 0.00 57.90 58.01 1br2 n TYR 767 Cb 0.18 0.68 -0.09 0.00 -0.38 0.00 0.00 39.34 39.73 1br2 n TYR 767 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1br2 s ARG 768 N -2.25 0.62 -0.39 -3.48 1.81 0.01 -4.95 118.95 110.32 1br2 s ARG 768 Ca 0.16 0.61 -0.13 0.00 -1.72 0.00 0.00 55.73 54.65 1br2 s ARG 768 Cb -0.03 0.30 0.02 0.00 -0.45 0.00 0.00 34.95 34.79 1br2 s ARG 768 CO 0.12 -0.09 0.26 0.42 -0.68 0.00 0.00 175.30 175.32 1br2 s ILE 769 N 0.07 4.98 0.12 1.52 -1.09 -1.26 0.49 121.20 126.03 1br2 s ILE 769 Ca -0.02 -0.70 0.00 0.00 -2.23 0.00 0.00 60.65 57.71 1br2 s ILE 769 Cb -0.03 -3.76 0.02 0.00 -1.58 0.00 0.00 42.46 37.11 1br2 s ILE 769 CO 0.01 -0.25 0.16 0.61 -1.23 0.00 0.00 174.94 174.24 1br2 n GLY 770 N 5.09 0.79 0.39 6.18 0.00 0.10 -4.82 105.19 112.93 1br2 n GLY 770 Ca -0.11 -1.97 -0.14 0.00 0.00 0.00 0.00 46.02 43.79 1br2 n GLY 770 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1br2 h GLN 771 N 0.00 -0.61 -0.00 1.61 5.75 -0.75 -3.34 115.11 117.77 1br2 h GLN 771 Ca -0.05 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 1br2 h GLN 771 Cb 0.20 0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.88 1br2 h GLN 771 CO 0.06 -0.40 -0.21 -1.13 -2.65 0.00 0.00 178.83 174.50 1br2 n SER 772 N -5.45 0.87 -3.70 -0.69 3.41 -1.26 -5.04 113.62 101.76 1br2 n SER 772 Ca -0.07 -0.94 -0.10 0.00 -0.26 0.00 0.00 58.87 57.50 1br2 n SER 772 Cb 0.37 0.60 -0.04 0.00 -0.26 0.00 0.00 64.21 64.88 1br2 n SER 772 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1br2 s LYS 773 N -1.29 1.18 -0.16 4.33 -2.85 -1.25 -3.09 119.74 116.61 1br2 s LYS 773 Ca 0.05 -0.80 -0.11 0.00 -1.00 0.00 0.00 55.97 54.11 1br2 s LYS 773 Cb 0.06 0.48 -0.05 0.00 -2.06 0.00 0.00 37.83 36.26 1br2 s LYS 773 CO 0.22 -0.47 0.21 0.42 0.10 0.00 0.00 175.35 175.82 1br2 s ILE 774 N -3.84 5.37 -0.17 3.79 1.01 -0.15 0.02 121.20 127.22 1br2 s ILE 774 Ca 0.06 0.36 -0.14 0.00 0.00 0.00 0.00 60.65 60.94 1br2 s ILE 774 Cb 0.01 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.91 1br2 s ILE 774 CO -0.08 0.47 0.28 -0.36 0.00 0.00 0.00 174.94 175.25 1br2 s PHE 775 N 0.02 3.45 0.14 3.97 0.40 0.18 -2.07 117.98 124.07 1br2 s PHE 775 Ca 0.13 0.56 0.08 0.00 -0.60 0.00 0.00 56.93 57.11 1br2 s PHE 775 Cb -0.12 -2.33 -0.04 0.00 0.51 0.00 0.00 43.02 41.03 1br2 s PHE 775 CO 0.02 0.23 -0.08 -0.06 0.70 0.00 0.00 175.22 176.03 1br2 s PHE 776 N 0.51 2.72 0.81 0.36 0.08 -0.12 -0.81 117.98 121.52 1br2 s PHE 776 Ca 0.16 -0.18 -0.11 0.00 0.12 0.00 0.00 56.93 56.92 1br2 s PHE 776 Cb -0.13 -1.37 0.07 0.00 -0.57 0.00 0.00 43.02 41.03 1br2 s PHE 776 CO 0.03 0.47 1.09 1.03 -0.10 0.00 0.00 175.22 177.74 1br2 s ARG 777 N -2.56 2.01 0.27 0.44 1.81 -0.53 -2.91 118.95 117.48 1br2 s ARG 777 Ca 0.24 0.84 -0.30 0.00 -1.72 0.00 0.00 55.73 54.79 1br2 s ARG 777 Cb -0.10 -1.89 -0.13 0.00 -0.45 0.00 0.00 34.95 32.37 1br2 s ARG 777 CO 0.15 -1.73 1.31 -2.37 -0.68 0.00 0.00 175.30 171.98 1br2 n THR 778 N -3.54 1.36 -1.22 0.02 5.66 -1.26 -2.04 114.28 113.26 1br2 n THR 778 Ca 0.07 -0.34 -0.08 0.00 -3.05 0.00 0.00 64.05 60.66 1br2 n THR 778 Cb 0.55 -1.39 -0.03 0.00 -1.55 0.00 0.00 70.33 67.90 1br2 n THR 778 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1br2 n GLY 779 N 1.66 0.82 0.06 1.09 0.00 -1.26 -4.88 105.19 102.68 1br2 n GLY 779 Ca 0.10 -0.12 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1br2 n GLY 779 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1br2 h VAL 780 N 0.00 1.18 -0.37 1.61 2.07 -1.77 -3.04 116.25 115.94 1br2 h VAL 780 Ca -0.16 -1.90 0.01 0.00 0.82 0.00 0.00 66.70 65.47 1br2 h VAL 780 Cb 0.91 2.24 -0.02 0.00 -1.52 0.00 0.00 31.29 32.91 1br2 h VAL 780 CO 0.23 0.40 0.25 -0.07 0.02 0.00 0.00 177.57 178.40 1br2 h LEU 781 N -1.00 0.42 0.01 2.57 3.38 -1.90 -1.42 115.31 117.37 1br2 h LEU 781 Ca -0.01 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1br2 h LEU 781 Cb 0.68 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 1br2 h LEU 781 CO -0.00 0.30 -0.35 0.00 0.09 0.00 0.00 178.44 178.47 1br2 h ALA 782 N 1.77 -0.80 -0.95 1.53 0.00 -1.93 0.57 119.26 119.44 1br2 h ALA 782 Ca 0.14 -0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.13 1br2 h ALA 782 Cb -0.04 0.80 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 1br2 h ALA 782 CO -0.03 -0.90 0.60 1.25 0.00 0.00 0.00 179.25 180.17 1br2 h HIS 783 N -0.45 0.98 -0.77 0.00 -0.00 -1.29 0.26 115.15 113.88 1br2 h HIS 783 Ca 0.01 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.41 1br2 h HIS 783 Cb 0.48 -0.31 -0.04 0.00 -0.00 0.00 0.00 27.41 27.54 1br2 h HIS 783 CO -0.46 0.34 0.51 -0.07 -0.00 0.00 0.00 177.93 178.25 1br2 h LEU 784 N 0.81 0.89 0.21 0.26 3.38 -0.13 0.85 115.31 121.58 1br2 h LEU 784 Ca 0.49 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.42 1br2 h LEU 784 Cb 0.68 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1br2 h LEU 784 CO -0.26 0.65 -0.10 -0.08 0.09 0.00 0.00 178.44 178.74 1br2 h GLU 785 N 1.04 -0.28 -0.79 1.13 4.57 0.34 0.01 114.58 120.61 1br2 h GLU 785 Ca 0.28 0.02 0.12 0.00 -1.18 0.00 0.00 59.36 58.60 1br2 h GLU 785 Cb -0.11 0.06 -0.08 0.00 -0.16 0.00 0.00 28.75 28.46 1br2 h GLU 785 CO -0.06 -0.04 0.40 0.93 -1.18 0.00 0.00 179.01 179.06 1br2 h GLU 786 N -0.48 0.62 -0.45 1.92 5.08 -0.75 0.15 114.58 120.68 1br2 h GLU 786 Ca -0.03 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 1br2 h GLU 786 Cb 0.36 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1br2 h GLU 786 CO 0.05 0.41 -0.06 0.93 -1.00 0.00 0.00 179.01 179.34 1br2 h GLU 787 N 0.64 0.77 -0.14 2.33 5.08 -0.68 -2.63 114.58 119.94 1br2 h GLU 787 Ca 0.41 -0.23 0.04 0.00 -1.00 0.00 0.00 59.36 58.58 1br2 h GLU 787 Cb 0.49 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1br2 h GLU 787 CO -0.31 0.81 0.15 -0.09 -1.00 0.00 0.00 179.01 178.57 1br2 h ARG 788 N 0.71 0.00 -0.03 2.33 2.43 0.13 -3.51 114.38 116.44 1br2 h ARG 788 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1br2 h ARG 788 Cb 0.52 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1br2 h ARG 788 CO 0.03 0.00 0.00 -0.25 -1.51 0.00 0.00 179.97 178.24