#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 -3.84 1.96 3.14 0.34 -4.41 118.33 115.52 1br2 n VAL 35 Ca 0.00 -1.33 -0.36 0.00 -2.96 0.00 0.00 64.34 59.69 1br2 n VAL 35 Cb 0.00 1.00 -0.13 0.00 -1.06 0.00 0.00 33.84 33.65 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 -2.77 3.02 0.07 1.45 0.23 0.13 -0.40 118.94 120.68 1br2 s TRP 36 Ca 0.22 -0.66 0.09 0.00 -2.03 0.00 0.00 56.10 53.72 1br2 s TRP 36 Cb -0.03 -2.17 -0.03 0.00 0.03 0.00 0.00 33.47 31.27 1br2 s TRP 36 CO 0.16 -0.44 -0.25 0.14 0.96 0.00 0.00 176.95 177.51 1br2 s VAL 37 N 1.53 2.08 0.86 4.03 -7.23 0.10 -0.88 120.40 120.90 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 -1.81 0.06 0.00 0.56 0.00 0.00 36.38 35.05 1br2 s VAL 37 CO 0.00 0.23 0.80 -0.81 -0.31 0.00 0.00 175.10 175.02 1br2 n PRO 38 N 1.49 -0.09 -3.57 4.82 -0.04 -1.26 0.99 135.00 137.34 1br2 n PRO 38 Ca -0.17 0.04 -0.13 0.00 -0.04 0.00 0.00 63.50 63.20 1br2 n PRO 38 Cb 0.53 -2.12 -0.05 0.00 -0.04 0.00 0.00 33.50 31.82 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 -0.39 -0.15 3.54 0.15 -0.45 -4.49 113.70 109.83 1br2 s SER 39 Ca 0.65 0.00 -0.22 0.00 0.70 0.00 0.00 55.95 57.09 1br2 s SER 39 Cb -0.26 0.50 -0.19 0.00 -1.71 0.00 0.00 66.02 64.36 1br2 s SER 39 CO 0.59 -0.79 0.45 -0.33 1.20 0.00 0.00 173.24 174.37 1br2 h GLU 40 N 2.56 0.00 -0.47 5.44 5.08 -1.97 -3.35 114.58 121.87 1br2 h GLU 40 Ca -0.32 0.00 0.02 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 0.29 0.87 -1.00 0.00 0.00 179.01 180.38 1br2 h LYS 41 N -1.00 0.57 -5.46 2.33 1.79 -1.98 -3.42 116.57 109.40 1br2 h LYS 41 Ca -0.09 -0.03 -0.51 0.00 -2.18 0.00 0.00 60.65 57.84 1br2 h LYS 41 Cb 0.89 -0.13 -0.29 0.00 -1.58 0.00 0.00 32.23 31.13 1br2 h LYS 41 CO -0.05 0.38 -0.82 -1.01 -1.08 0.00 0.00 179.45 176.86 1br2 s HIS 42 N -6.15 1.39 0.30 -1.35 3.76 -1.26 -4.67 115.29 107.31 1br2 s HIS 42 Ca -0.13 -0.27 0.04 0.00 -0.15 0.00 0.00 55.06 54.55 1br2 s HIS 42 Cb 0.12 -0.89 0.79 0.00 1.11 0.00 0.00 32.58 33.71 1br2 s HIS 42 CO 0.73 -0.02 1.48 0.41 -0.85 0.00 0.00 174.74 176.50 1br2 n GLY 43 N 2.62 -1.22 3.10 -2.22 0.00 -1.26 -3.29 105.19 102.93 1br2 n GLY 43 Ca -0.15 0.91 -0.08 0.00 0.00 0.00 0.00 46.02 46.70 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 -5.87 0.60 0.04 1.61 0.40 -1.26 -1.35 117.98 112.15 1br2 s PHE 44 Ca -0.12 -1.09 0.02 0.00 -0.60 0.00 0.00 56.93 55.15 1br2 s PHE 44 Cb 0.28 -0.41 -0.02 0.00 0.51 0.00 0.00 43.02 43.38 1br2 s PHE 44 CO 0.74 -0.39 -0.08 -2.00 0.70 0.00 0.00 175.22 174.19 1br2 s GLU 45 N -3.93 0.52 0.00 0.44 2.12 0.28 -4.76 118.70 113.37 1br2 s GLU 45 Ca 0.10 -0.70 -0.30 0.00 0.36 0.00 0.00 54.97 54.43 1br2 s GLU 45 Cb 0.08 -0.31 -0.03 0.00 0.26 0.00 0.00 34.13 34.13 1br2 s GLU 45 CO -0.08 0.06 0.96 0.00 -0.54 0.00 0.00 175.26 175.66 1br2 s ALA 46 N -1.26 3.18 -0.13 6.30 0.00 -1.26 0.00 121.76 128.60 1br2 s ALA 46 Ca -0.09 0.52 -0.11 0.00 0.00 0.00 0.00 51.96 52.28 1br2 s ALA 46 Cb -0.09 -3.31 0.03 0.00 0.00 0.00 0.00 23.12 19.75 1br2 s ALA 46 CO 0.00 -0.21 0.33 0.00 0.00 0.00 0.00 175.76 175.89 1br2 s ALA 47 N 0.92 -0.82 0.05 0.00 0.00 0.46 -1.93 121.76 120.44 1br2 s ALA 47 Ca 0.51 0.96 -0.19 0.00 0.00 0.00 0.00 51.96 53.24 1br2 s ALA 47 Cb -0.21 -0.56 -0.06 0.00 0.00 0.00 0.00 23.12 22.28 1br2 s ALA 47 CO 0.27 -0.16 0.55 -1.12 0.00 0.00 0.00 175.76 175.30 1br2 s SER 48 N 0.26 7.01 1.09 0.00 0.01 -1.15 0.13 113.70 121.05 1br2 s SER 48 Ca -0.01 1.20 -0.12 0.00 1.31 0.00 0.00 55.95 58.33 1br2 s SER 48 Cb -0.03 -2.34 0.24 0.00 0.21 0.00 0.00 66.02 64.10 1br2 s SER 48 CO -0.00 0.26 1.06 -0.63 0.41 0.00 0.00 173.24 174.34 1br2 s ILE 49 N -1.00 2.09 0.00 1.44 -1.09 -1.26 -1.56 121.20 119.83 1br2 s ILE 49 Ca 0.28 0.03 0.00 0.00 -2.23 0.00 0.00 60.65 58.73 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 0.18 -0.04 0.00 1.21 -1.23 0.00 0.00 174.94 175.06 1br2 n GLU 56 N -4.64 0.00 -4.14 2.79 4.07 -1.26 -4.39 120.64 113.06 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 0.54 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 0.69 -0.27 6.31 1.01 0.25 -4.71 120.40 123.67 1br2 s VAL 57 Ca 0.00 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.05 1br2 s VAL 57 Cb 0.00 -0.69 0.07 0.00 0.00 0.00 0.00 36.38 35.75 1br2 s VAL 57 CO 0.00 -0.22 -0.08 -0.89 0.00 0.00 0.00 175.10 173.90 1br2 s THR 58 N -1.08 2.15 0.34 3.92 2.01 -1.26 0.46 115.64 122.18 1br2 s THR 58 Ca -0.05 -1.72 0.03 0.00 0.31 0.00 0.00 61.69 60.25 1br2 s THR 58 Cb -0.08 -2.32 0.03 0.00 0.01 0.00 0.00 72.50 70.14 1br2 s THR 58 CO 0.01 -0.11 0.22 1.33 -0.69 0.00 0.00 174.62 175.38 1br2 n VAL 59 N 4.42 0.00 -3.66 3.82 0.24 0.23 -4.74 118.33 118.64 1br2 n VAL 59 Ca -0.11 -1.37 -0.25 0.00 -2.04 0.00 0.00 64.34 60.57 1br2 n VAL 59 Cb 0.42 -0.14 -0.17 0.00 -1.47 0.00 0.00 33.84 32.47 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 -3.37 0.17 0.31 7.34 -1.05 -0.60 -0.34 118.70 121.16 1br2 s GLU 60 Ca 0.17 -0.02 -0.29 0.00 -0.15 0.00 0.00 54.97 54.68 1br2 s GLU 60 Cb -0.01 -1.51 -0.12 0.00 -0.44 0.00 0.00 34.13 32.04 1br2 s GLU 60 CO 0.11 -0.56 1.40 1.28 0.95 0.00 0.00 175.26 178.43 1br2 n LEU 61 N 5.24 3.73 0.17 1.83 4.77 -1.00 -2.91 117.00 128.82 1br2 n LEU 61 Ca -0.06 1.18 0.05 0.00 -0.03 0.00 0.00 56.01 57.15 1br2 n LEU 61 Cb 0.49 -1.51 0.18 0.00 -2.33 0.00 0.00 43.42 40.25 1br2 n LEU 61 CO 0.10 -0.30 0.59 0.06 -1.33 0.00 0.00 177.39 176.51 1br2 h GLN 62 N 3.40 0.00 0.00 3.23 -0.00 -1.72 0.92 115.11 120.94 1br2 h GLN 62 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.18 1br2 h GLN 62 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.75 1br2 h GLN 62 CO 0.69 0.40 0.00 -0.85 -0.00 0.00 0.00 178.83 179.07 1br2 n GLU 63 N -3.31 0.00 -0.33 0.06 0.28 -1.26 -4.37 120.64 111.72 1br2 n GLU 63 Ca 0.01 0.19 -0.01 0.00 -0.16 0.00 0.00 57.16 57.19 1br2 n GLU 63 Cb 0.62 -0.67 0.12 0.00 1.43 0.00 0.00 31.44 32.94 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 0.97 0.00 -1.84 -0.00 -1.97 -3.45 115.58 109.29 1br2 h ASN 64 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 56.30 56.29 1br2 h ASN 64 Cb 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 38.32 38.10 1br2 h ASN 64 CO 0.00 0.67 0.00 0.61 -0.00 0.00 0.00 177.43 178.71 1br2 n GLY 65 N -1.34 3.02 3.59 9.14 0.00 0.32 -4.98 105.19 114.94 1br2 n GLY 65 Ca 0.11 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.70 0.75 -2.35 1.61 -0.00 -1.26 -4.02 118.16 112.20 1br2 n LYS 66 Ca 0.00 0.26 -0.42 0.00 -0.00 0.00 0.00 58.31 58.15 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 4.38 4.43 0.24 -1.58 2.20 -1.26 -2.37 119.74 125.78 1br2 s LYS 67 Ca 1.05 1.88 0.07 0.00 -0.36 0.00 0.00 55.97 58.61 1br2 s LYS 67 Cb -1.18 -3.29 -0.05 0.00 -1.51 0.00 0.00 37.83 31.81 1br2 s LYS 67 CO 0.66 -0.24 -0.10 0.54 -0.36 0.00 0.00 175.35 175.85 1br2 s VAL 68 N 0.67 1.68 -0.30 4.02 0.11 0.54 -4.96 120.40 122.16 1br2 s VAL 68 Ca 0.58 -2.17 0.01 0.00 -2.93 0.00 0.00 61.98 57.47 1br2 s VAL 68 Cb -0.32 -2.26 0.09 0.00 -1.53 0.00 0.00 36.38 32.36 1br2 s VAL 68 CO 0.32 -0.43 0.06 -0.89 -3.33 0.00 0.00 175.10 170.83 1br2 s THR 69 N -3.00 1.29 0.27 5.04 2.01 -1.26 -0.60 115.64 119.38 1br2 s THR 69 Ca 0.26 -1.58 0.11 0.00 0.31 0.00 0.00 61.69 60.80 1br2 s THR 69 Cb 0.02 -1.91 -0.05 0.00 0.01 0.00 0.00 72.50 70.57 1br2 s THR 69 CO 0.10 -0.56 -0.19 -1.48 -0.69 0.00 0.00 174.62 171.79 1br2 s LEU 70 N 1.42 2.58 1.08 4.42 0.05 0.17 -4.91 118.68 123.50 1br2 s LEU 70 Ca 0.08 -1.03 -0.17 0.00 0.05 0.00 0.00 54.13 53.06 1br2 s LEU 70 Cb -0.18 -1.03 0.10 0.00 -2.05 0.00 0.00 46.19 43.02 1br2 s LEU 70 CO -0.18 0.01 0.12 -0.24 -0.55 0.00 0.00 176.35 175.51 1br2 n SER 71 N -0.57 -2.29 -0.04 1.48 2.88 -1.26 0.85 113.62 114.67 1br2 n SER 71 Ca -0.06 -0.02 -0.14 0.00 -1.33 0.00 0.00 58.87 57.32 1br2 n SER 71 Cb 0.60 -1.02 -0.11 0.00 -0.75 0.00 0.00 64.21 62.93 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 -1.97 0.07 0.00 -1.46 -0.00 -1.91 -3.19 116.57 108.11 1br2 h LYS 72 Ca -0.52 -0.07 0.00 0.00 -0.00 0.00 0.00 60.65 60.07 1br2 h LYS 72 Cb 1.34 0.02 0.00 0.00 -0.00 0.00 0.00 32.23 33.59 1br2 h LYS 72 CO 0.38 0.81 0.11 -0.40 -0.00 0.00 0.00 179.45 180.34 1br2 n ASP 73 N -4.65 0.09 0.13 7.07 3.85 -1.26 -0.45 116.55 121.34 1br2 n ASP 73 Ca -0.09 0.45 0.11 0.00 -0.71 0.00 0.00 54.79 54.55 1br2 n ASP 73 Cb 0.41 -0.46 0.04 0.00 -1.35 0.00 0.00 41.12 39.77 1br2 n ASP 73 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 1br2 h ASP 74 N 0.00 0.00 -3.61 -1.12 3.32 -1.90 -3.46 116.42 109.65 1br2 h ASP 74 Ca 0.00 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.54 1br2 h ASP 74 Cb 0.22 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 1br2 h ASP 74 CO 0.00 0.02 0.17 -0.63 -1.72 0.00 0.00 179.24 177.08 1br2 s ILE 75 N -3.31 4.44 -0.02 0.35 1.01 0.41 -4.13 121.20 119.94 1br2 s ILE 75 Ca 0.01 1.51 0.02 0.00 0.00 0.00 0.00 60.65 62.19 1br2 s ILE 75 Cb 0.08 -3.97 0.01 0.00 0.01 0.00 0.00 42.46 38.59 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 -1.73 0.70 0.29 2.79 -0.21 -0.05 -4.98 119.66 116.45 1br2 s GLN 76 Ca 0.42 -0.19 -0.29 0.00 0.02 0.00 0.00 55.36 55.31 1br2 s GLN 76 Cb -0.19 -0.69 -0.10 0.00 1.00 0.00 0.00 33.01 33.04 1br2 s GLN 76 CO 0.23 0.05 1.27 0.15 -2.12 0.00 0.00 175.29 174.87 1br2 s LYS 77 N 0.30 4.42 0.81 2.91 3.01 -1.26 0.22 119.74 130.14 1br2 s LYS 77 Ca -0.04 2.10 -0.11 0.00 -1.01 0.00 0.00 55.97 56.91 1br2 s LYS 77 Cb -0.08 -3.13 0.10 0.00 -1.01 0.00 0.00 37.83 33.72 1br2 s LYS 77 CO 0.00 -0.13 1.16 -1.64 0.51 0.00 0.00 175.35 175.25 1br2 s MET 78 N -1.29 1.74 0.25 1.68 -1.94 -1.26 -4.76 119.30 113.72 1br2 s MET 78 Ca 0.50 -0.15 0.11 0.00 -1.71 0.00 0.00 55.69 54.44 1br2 s MET 78 Cb -0.37 -2.01 -0.05 0.00 2.01 0.00 0.00 34.83 34.41 1br2 s MET 78 CO 0.47 -1.66 -0.16 -0.80 -0.01 0.00 0.00 175.02 172.85 1br2 s ASN 79 N -4.63 3.79 0.76 3.03 0.01 -1.26 -4.85 114.94 111.78 1br2 s ASN 79 Ca 0.64 -0.88 -0.14 0.00 -0.71 0.00 0.00 52.86 51.77 1br2 s ASN 79 Cb -0.09 -0.43 0.06 0.00 0.41 0.00 0.00 41.25 41.19 1br2 s ASN 79 CO 0.48 0.06 1.21 -2.84 -1.51 0.00 0.00 177.10 174.50 1br2 s PRO 80 N -3.28 1.96 0.66 -0.60 0.02 -1.26 -4.85 135.00 127.66 1br2 s PRO 80 Ca 0.28 1.75 0.35 0.00 0.02 0.00 0.00 61.00 63.39 1br2 s PRO 80 Cb -0.06 -1.81 1.88 0.00 0.02 0.00 0.00 34.50 34.53 1br2 s PRO 80 CO 0.15 -1.97 2.07 -1.35 -0.33 0.00 0.00 177.00 175.57 1br2 h PRO 81 N -0.53 0.00 0.00 5.54 0.11 -2.02 -0.77 132.00 134.33 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 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1br2 h PRO 81 CO 0.48 0.00 0.00 1.57 -0.21 0.00 0.00 178.00 179.85 1br2 h LYS 82 N 0.00 0.00 -0.78 1.05 2.10 -2.06 -1.50 116.57 115.38 1br2 h LYS 82 Ca 0.01 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.50 1br2 h LYS 82 Cb 0.46 0.00 -0.10 0.00 -0.90 0.00 0.00 32.23 31.69 1br2 h LYS 82 CO -0.00 0.00 0.21 1.19 -2.00 0.00 0.00 179.45 178.85 1br2 n PHE 83 N -2.97 2.08 -1.81 0.07 3.72 -0.30 -4.94 117.46 113.31 1br2 n PHE 83 Ca -0.03 -0.99 -0.42 0.00 -0.05 0.00 0.00 57.45 55.95 1br2 n PHE 83 Cb 0.07 -0.60 -0.03 0.00 -0.94 0.00 0.00 39.48 37.98 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 -0.76 6.23 -1.18 4.37 0.15 -0.57 -3.12 113.70 118.82 1br2 s SER 84 Ca 0.47 2.17 -0.06 0.00 0.70 0.00 0.00 55.95 59.23 1br2 s SER 84 Cb 0.37 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 62.14 1br2 s SER 84 CO 0.12 -1.29 0.82 0.29 1.20 0.00 0.00 173.24 174.38 1br2 n LYS 85 N 7.79 -3.65 -1.96 5.44 5.02 -1.26 -4.93 118.16 124.61 1br2 n LYS 85 Ca 0.21 0.69 -0.41 0.00 -2.02 0.00 0.00 58.31 56.79 1br2 n LYS 85 Cb 0.43 -5.24 -0.01 0.00 -0.02 0.00 0.00 35.03 30.19 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 -3.50 2.38 0.11 -0.18 -7.23 -1.18 -4.90 120.40 105.90 1br2 s VAL 86 Ca 0.23 0.38 0.15 0.00 -1.81 0.00 0.00 61.98 60.93 1br2 s VAL 86 Cb -0.05 -3.24 0.05 0.00 0.56 0.00 0.00 36.38 33.69 1br2 s VAL 86 CO 0.79 0.09 1.59 -0.33 -0.31 0.00 0.00 175.10 176.94 1br2 h GLU 87 N 3.19 0.00 -4.01 4.82 5.08 -1.91 -3.40 114.58 118.35 1br2 h GLU 87 Ca -0.50 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.28 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 0.65 0.52 -0.77 0.34 -1.00 0.00 0.00 179.01 178.75 1br2 s ASP 88 N -6.54 3.64 0.00 1.42 -1.08 -1.25 -0.02 116.67 112.84 1br2 s ASP 88 Ca 0.01 -1.19 0.10 0.00 -0.52 0.00 0.00 52.55 50.95 1br2 s ASP 88 Cb 0.10 -0.98 0.51 0.00 -1.46 0.00 0.00 42.92 41.10 1br2 s ASP 88 CO 0.73 -0.29 1.23 0.23 0.52 0.00 0.00 175.17 177.58 1br2 n MET 89 N 4.79 0.13 0.21 4.34 2.81 -0.81 -0.96 117.12 127.64 1br2 n MET 89 Ca -0.09 0.20 0.08 0.00 -1.81 0.00 0.00 57.70 56.09 1br2 n MET 89 Cb 0.45 -1.50 0.44 0.00 -0.71 0.00 0.00 33.22 31.90 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 2.47 1.05 -0.48 3.04 0.00 -1.91 -2.83 119.26 120.60 1br2 h ALA 90 Ca 0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1br2 h ALA 90 Cb 0.10 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1br2 h ALA 90 CO 0.00 0.34 -0.03 0.93 0.00 0.00 0.00 179.25 180.49 1br2 h GLU 91 N 0.00 0.82 -5.67 0.00 3.07 -1.45 -3.46 114.58 107.89 1br2 h GLU 91 Ca -0.00 -0.24 -0.69 0.00 -0.50 0.00 0.00 59.36 57.93 1br2 h GLU 91 Cb 0.75 -0.09 0.07 0.00 -0.84 0.00 0.00 28.75 28.65 1br2 h GLU 91 CO 0.04 0.84 -0.21 1.28 -1.40 0.00 0.00 179.01 179.56 1br2 n LEU 92 N -4.20 -0.57 -0.16 1.33 4.77 -1.07 -4.85 117.00 112.25 1br2 n LEU 92 Ca 0.02 1.08 -0.11 0.00 -0.03 0.00 0.00 56.01 56.97 1br2 n LEU 92 Cb 0.32 -0.88 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 1br2 n LEU 92 CO 0.42 -2.29 0.67 0.74 -1.33 0.00 0.00 177.39 175.61 1br2 h THR 93 N 1.94 1.27 -3.24 -5.08 2.02 -1.90 -3.40 112.91 104.50 1br2 h THR 93 Ca -0.38 -1.38 -0.67 0.00 0.77 0.00 0.00 66.41 64.75 1br2 h THR 93 Cb 1.36 1.11 -0.32 0.00 -1.74 0.00 0.00 68.15 68.55 1br2 h THR 93 CO 0.58 0.48 -0.84 0.00 0.37 0.00 0.00 175.52 176.11 1br2 s LEU 95 N 0.78 4.70 0.07 0.00 2.96 -1.26 -4.86 118.68 121.07 1br2 s LEU 95 Ca -0.07 -1.82 -0.11 0.00 -0.22 0.00 0.00 54.13 51.91 1br2 s LEU 95 Cb -0.16 -1.74 0.01 0.00 0.50 0.00 0.00 46.19 44.80 1br2 s LEU 95 CO -0.00 -0.42 0.25 0.54 -1.32 0.00 0.00 176.35 175.40 1br2 s ASN 96 N 1.44 -0.01 0.24 3.68 2.20 -1.26 -5.02 114.94 116.20 1br2 s ASN 96 Ca 0.04 -0.42 -0.15 0.00 -0.94 0.00 0.00 52.86 51.39 1br2 s ASN 96 Cb -0.21 0.35 0.30 0.00 -2.00 0.00 0.00 41.25 39.69 1br2 s ASN 96 CO -0.04 -0.68 1.55 -0.33 -2.94 0.00 0.00 177.10 174.66 1br2 h GLU 97 N 2.97 -0.00 -0.93 3.55 5.08 -1.99 0.31 114.58 123.58 1br2 h GLU 97 Ca -0.33 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.17 1br2 h GLU 97 Cb 1.21 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.37 1br2 h GLU 97 CO 0.51 -0.00 0.54 0.00 -1.00 0.00 0.00 179.01 179.06 1br2 h ALA 98 N 1.54 1.41 0.02 3.43 0.00 -1.96 0.18 119.26 123.87 1br2 h ALA 98 Ca 0.38 0.05 -0.25 0.00 0.00 0.00 0.00 54.91 55.10 1br2 h ALA 98 Cb 0.63 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1br2 h ALA 98 CO -1.00 0.06 -1.01 0.77 0.00 0.00 0.00 179.25 178.07 1br2 h SER 99 N 0.81 0.68 0.25 0.00 0.02 -0.74 -1.79 113.55 112.77 1br2 h SER 99 Ca 0.48 -0.56 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 1br2 h SER 99 Cb 0.59 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1br2 h SER 99 CO -0.31 1.36 -0.12 0.58 -1.14 0.00 0.00 176.83 177.20 1br2 h VAL 100 N 0.28 0.78 -0.74 2.27 2.07 -0.78 0.71 116.25 120.85 1br2 h VAL 100 Ca -0.11 -0.75 0.14 0.00 0.82 0.00 0.00 66.70 66.80 1br2 h VAL 100 Cb 1.66 1.18 -0.09 0.00 -1.52 0.00 0.00 31.29 32.52 1br2 h VAL 100 CO 0.18 0.15 0.29 0.25 0.02 0.00 0.00 177.57 178.46 1br2 h LEU 101 N -0.74 0.27 0.00 2.57 5.85 -0.73 0.00 115.31 122.52 1br2 h LEU 101 Ca -0.03 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1br2 h LEU 101 Cb 0.50 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1br2 h LEU 101 CO 0.06 0.10 -0.00 -0.74 -0.34 0.00 0.00 178.44 177.52 1br2 h HIS 102 N 0.44 -0.00 -0.81 1.25 2.76 -1.15 0.10 115.15 117.74 1br2 h HIS 102 Ca 0.40 -0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.67 1br2 h HIS 102 Cb 0.60 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 29.51 1br2 h HIS 102 CO -0.17 0.12 0.53 -0.97 -1.30 0.00 0.00 177.93 176.13 1br2 h ASN 103 N -0.12 0.69 0.04 3.26 -1.24 0.18 -0.39 115.58 118.00 1br2 h ASN 103 Ca -0.00 0.02 -0.00 0.00 0.71 0.00 0.00 56.30 57.02 1br2 h ASN 103 Cb 0.12 -0.13 0.00 0.00 0.73 0.00 0.00 38.32 39.04 1br2 h ASN 103 CO 0.00 0.41 -0.02 -0.07 -1.29 0.00 0.00 177.43 176.47 1br2 h LEU 104 N 0.77 -0.04 -0.60 0.34 3.38 -0.74 -2.82 115.31 115.60 1br2 h LEU 104 Ca 0.37 -0.59 0.12 0.00 0.09 0.00 0.00 57.88 57.87 1br2 h LEU 104 Cb 0.42 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.09 1br2 h LEU 104 CO -0.14 0.59 0.07 -0.09 0.09 0.00 0.00 178.44 178.96 1br2 h ARG 105 N -0.71 0.18 0.94 1.13 2.43 -0.18 0.15 114.38 118.32 1br2 h ARG 105 Ca -0.01 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 1br2 h ARG 105 Cb 0.63 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 30.14 1br2 h ARG 105 CO 0.01 0.12 -0.45 0.93 -1.51 0.00 0.00 179.97 179.07 1br2 h GLU 106 N 0.19 -1.22 -0.98 0.20 5.08 -1.16 -1.82 114.58 114.88 1br2 h GLU 106 Ca 0.32 0.08 0.14 0.00 -1.00 0.00 0.00 59.36 58.90 1br2 h GLU 106 Cb 0.49 0.28 -0.08 0.00 0.50 0.00 0.00 28.75 29.93 1br2 h GLU 106 CO -0.45 -0.81 0.61 0.00 -1.00 0.00 0.00 179.01 177.36 1br2 h ARG 107 N -1.27 0.85 0.20 2.33 3.08 -1.21 -0.89 114.38 117.47 1br2 h ARG 107 Ca -0.13 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 1br2 h ARG 107 Cb 0.97 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 1br2 h ARG 107 CO 0.21 0.56 -0.20 -0.92 -1.07 0.00 0.00 179.97 178.55 1br2 h TYR 108 N 0.87 -0.55 0.00 3.04 3.20 -0.39 0.74 116.97 123.88 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 0.63 0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.11 1br2 h TYR 108 CO -0.00 -0.26 0.00 1.19 -1.64 0.00 0.00 178.16 177.44 1br2 n PHE 109 N -3.53 0.00 1.02 -3.82 3.72 -0.71 0.90 117.46 115.03 1br2 n PHE 109 Ca -0.05 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.48 1br2 n PHE 109 Cb 0.18 -0.34 0.25 0.00 -0.94 0.00 0.00 39.48 38.63 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 -1.34 2.59 0.00 4.37 7.64 -0.36 -4.93 113.62 121.59 1br2 n SER 110 Ca 0.02 -1.85 0.00 0.00 1.01 0.00 0.00 58.87 58.05 1br2 n SER 110 Cb 0.04 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 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 1.32 1.06 3.54 0.23 0.00 0.26 -5.02 105.19 106.58 1br2 n GLY 111 Ca 0.16 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 4.43 0.00 0.99 1.43 0.24 -4.91 118.68 120.86 1br2 s LEU 112 Ca 0.00 -0.17 0.19 0.00 -1.03 0.00 0.00 54.13 53.13 1br2 s LEU 112 Cb 0.00 -2.68 -0.20 0.00 0.03 0.00 0.00 46.19 43.34 1br2 s LEU 112 CO 0.00 -0.64 0.83 2.30 0.23 0.00 0.00 176.35 179.07 1br2 n ILE 113 N 5.65 0.00 -4.12 -0.59 -5.35 -1.26 -2.62 119.36 111.07 1br2 n ILE 113 Ca -0.03 -0.05 -0.34 0.00 -0.27 0.00 0.00 62.75 62.06 1br2 n ILE 113 Cb 0.48 1.01 -0.11 0.00 -1.74 0.00 0.00 39.64 39.29 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 -2.82 3.17 -0.09 4.28 2.02 -1.26 -2.24 117.35 120.42 1br2 s TYR 114 Ca 0.08 -0.07 -0.03 0.00 -0.37 0.00 0.00 57.07 56.67 1br2 s TYR 114 Cb 0.15 -2.05 0.05 0.00 -0.40 0.00 0.00 41.96 39.71 1br2 s TYR 114 CO 0.79 0.07 0.13 0.99 -1.57 0.00 0.00 175.55 175.96 1br2 s THR 115 N 0.43 -0.22 0.27 -0.71 2.01 -0.32 -4.51 115.64 112.59 1br2 s THR 115 Ca 0.01 0.31 -0.29 0.00 0.31 0.00 0.00 61.69 62.02 1br2 s THR 115 Cb -0.13 -0.30 -0.10 0.00 0.01 0.00 0.00 72.50 71.98 1br2 s THR 115 CO 0.01 0.10 1.29 -0.31 -0.69 0.00 0.00 174.62 175.03 1br2 s TYR 116 N 2.26 3.20 -0.43 4.92 2.02 0.97 -1.25 117.35 129.02 1br2 s TYR 116 Ca 0.04 1.34 0.02 0.00 -0.37 0.00 0.00 57.07 58.10 1br2 s TYR 116 Cb -0.13 -3.61 0.14 0.00 -0.40 0.00 0.00 41.96 37.97 1br2 s TYR 116 CO -0.06 -1.76 0.26 -1.54 -1.57 0.00 0.00 175.55 170.89 1br2 s SER 117 N -0.14 3.30 1.00 2.29 1.04 -0.45 -1.93 113.70 118.82 1br2 s SER 117 Ca 0.52 -2.67 0.00 0.00 0.48 0.00 0.00 55.95 54.29 1br2 s SER 117 Cb -0.38 -0.86 0.00 0.00 0.10 0.00 0.00 66.02 64.89 1br2 s SER 117 CO 0.45 -0.25 0.00 0.61 0.98 0.00 0.00 173.24 175.03 1br2 n GLY 118 N 3.46 0.70 0.12 7.32 0.00 -1.26 -3.43 105.19 112.10 1br2 n GLY 118 Ca 0.13 -0.65 -0.09 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.47 115.31 114.10 1br2 h LEU 119 Ca 0.00 -0.32 -0.30 0.00 0.09 0.00 0.00 57.88 57.35 1br2 h LEU 119 Cb 0.00 0.04 0.15 0.00 0.09 0.00 0.00 40.66 40.94 1br2 h LEU 119 CO 0.00 0.44 0.03 2.22 0.09 0.00 0.00 178.44 181.22 1br2 n PHE 120 N -4.87 -3.61 -4.11 1.13 -1.74 -1.22 -4.99 117.46 98.05 1br2 n PHE 120 Ca -0.06 -0.73 -0.13 0.00 -0.56 0.00 0.00 57.45 55.97 1br2 n PHE 120 Cb 0.23 -0.89 -0.11 0.00 1.52 0.00 0.00 39.48 40.23 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 -1.88 2.05 -0.03 0.00 1.01 -0.38 0.21 120.40 121.37 1br2 s VAL 122 Ca -0.03 -1.30 0.00 0.00 0.00 0.00 0.00 61.98 60.65 1br2 s VAL 122 Cb -0.06 -1.74 0.03 0.00 0.00 0.00 0.00 36.38 34.60 1br2 s VAL 122 CO -0.00 0.39 0.00 -0.69 0.00 0.00 0.00 175.10 174.80 1br2 s VAL 123 N -0.75 0.16 -0.18 2.92 1.01 -0.11 -1.18 120.40 122.27 1br2 s VAL 123 Ca 0.11 0.10 -0.04 0.00 0.00 0.00 0.00 61.98 62.14 1br2 s VAL 123 Cb -0.10 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 1br2 s VAL 123 CO 0.01 0.14 -0.02 -0.63 0.00 0.00 0.00 175.10 174.60 1br2 s ILE 124 N 1.04 3.92 -0.20 2.22 1.01 -0.95 0.56 121.20 128.80 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 -2.74 -0.13 0.00 0.01 0.00 0.00 42.46 39.47 1br2 s ILE 124 CO -0.02 0.46 1.90 -3.20 0.00 0.00 0.00 174.94 174.08 1br2 n ASN 125 N 3.85 2.89 0.17 3.58 2.85 -0.62 -4.83 115.26 123.14 1br2 n ASN 125 Ca -0.17 0.90 0.04 0.00 -0.11 0.00 0.00 54.58 55.24 1br2 n ASN 125 Cb 0.52 -1.28 0.18 0.00 1.24 0.00 0.00 39.78 40.44 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 9.19 0.00 -1.52 1.20 0.13 -1.93 -3.42 132.00 135.65 1br2 h PRO 126 Ca -0.44 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.31 1br2 h PRO 126 Cb 1.29 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.30 1br2 h PRO 126 CO 0.97 0.43 -0.36 0.66 -0.23 0.00 0.00 178.00 179.46 1br2 n TYR 127 N -3.34 -0.32 -3.59 1.56 4.01 -1.26 -4.12 117.16 110.10 1br2 n TYR 127 Ca 0.01 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.62 1br2 n TYR 127 Cb 0.63 -3.25 -0.05 0.00 -0.31 0.00 0.00 39.34 36.35 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 -3.82 1.03 0.21 -0.72 -2.85 -1.26 -4.41 119.74 107.91 1br2 s LYS 128 Ca 0.00 -0.37 -0.30 0.00 -1.00 0.00 0.00 55.97 54.30 1br2 s LYS 128 Cb 0.00 0.47 -0.08 0.00 -2.06 0.00 0.00 37.83 36.15 1br2 s LYS 128 CO 0.00 -0.38 1.20 -0.65 0.10 0.00 0.00 175.35 175.61 1br2 s GLN 129 N -2.82 4.50 -0.02 1.78 -1.52 -1.26 -5.03 119.66 115.29 1br2 s GLN 129 Ca -0.03 1.89 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 -0.06 -0.16 -0.51 -0.25 0.00 0.00 175.29 174.26 1br2 s LEU 130 N -0.47 1.98 -1.18 2.90 1.43 -1.26 -5.04 118.68 117.04 1br2 s LEU 130 Ca 0.52 -0.30 -0.11 0.00 -1.03 0.00 0.00 54.13 53.20 1br2 s LEU 130 Cb -0.33 -0.85 -0.07 0.00 0.03 0.00 0.00 46.19 44.97 1br2 s LEU 130 CO 0.38 0.18 2.33 -0.81 0.23 0.00 0.00 176.35 178.66 1br2 n PRO 131 N 2.85 2.55 0.00 1.29 -0.04 -1.26 -4.14 135.00 136.25 1br2 n PRO 131 Ca -0.16 -1.93 0.00 0.00 -0.04 0.00 0.00 63.50 61.38 1br2 n PRO 131 Cb 0.54 -2.78 0.00 0.00 -0.04 0.00 0.00 33.50 31.22 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 4.52 0.15 -1.41 0.52 -5.35 -1.26 -4.84 119.36 111.68 1br2 n ILE 132 Ca 0.56 -0.18 0.07 0.00 -0.27 0.00 0.00 62.75 62.93 1br2 n ILE 132 Cb 0.25 1.16 0.18 0.00 -1.74 0.00 0.00 39.64 39.49 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 -0.68 4.28 4.01 -1.26 -4.94 117.16 118.50 1br2 n TYR 133 Ca 0.00 -1.29 -0.30 0.00 -0.16 0.00 0.00 57.90 56.15 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 -3.07 -0.12 0.03 7.72 1.04 -1.26 -4.90 113.70 113.14 1br2 s SER 134 Ca 0.35 0.81 0.08 0.00 0.48 0.00 0.00 55.95 57.68 1br2 s SER 134 Cb 0.33 -1.15 -0.23 0.00 0.10 0.00 0.00 66.02 65.07 1br2 s SER 134 CO -0.03 -4.78 0.93 -0.08 0.98 0.00 0.00 173.24 170.25 1br2 h GLU 135 N -3.03 0.04 -0.57 4.02 4.81 -1.99 -3.05 114.58 114.82 1br2 h GLU 135 Ca -0.45 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 58.75 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 0.78 0.32 -0.22 -0.73 0.00 0.00 179.01 179.49 1br2 h LYS 136 N 0.01 0.61 -0.22 1.92 3.64 -1.99 -0.46 116.57 120.08 1br2 h LYS 136 Ca -0.17 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.07 1br2 h LYS 136 Cb 1.92 -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 -0.29 0.82 -2.27 0.00 0.00 179.45 178.23 1br2 h ILE 137 N 0.63 1.27 -0.43 2.00 2.04 -1.93 -0.85 117.51 120.24 1br2 h ILE 137 Ca 0.24 -1.31 -0.02 0.00 1.00 0.00 0.00 64.86 64.77 1br2 h ILE 137 Cb 0.09 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 1br2 h ILE 137 CO -0.13 0.41 0.18 0.40 0.00 0.00 0.00 178.15 179.01 1br2 h ILE 138 N 0.37 1.16 0.15 -0.67 2.04 -1.09 -1.50 117.51 117.97 1br2 h ILE 138 Ca 0.05 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 1br2 h ILE 138 Cb 0.70 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1br2 h ILE 138 CO 0.05 0.19 -0.07 0.44 0.00 0.00 0.00 178.15 178.76 1br2 h ASP 139 N 0.61 -0.17 -0.42 1.72 3.32 0.03 -2.43 116.42 119.07 1br2 h ASP 139 Ca 0.15 -0.24 0.12 0.00 0.02 0.00 0.00 57.03 57.08 1br2 h ASP 139 Cb 0.10 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1br2 h ASP 139 CO -0.02 0.16 0.52 0.24 -1.72 0.00 0.00 179.24 178.43 1br2 h MET 140 N -0.52 0.00 -0.02 3.56 2.86 -0.47 0.23 114.93 120.58 1br2 h MET 140 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1br2 h MET 140 Cb 0.40 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.06 1br2 h MET 140 CO 0.03 0.00 -0.38 0.66 1.06 0.00 0.00 176.91 178.28 1br2 n TYR 141 N -3.53 0.00 -1.68 -0.22 4.01 -0.63 -4.85 117.16 110.26 1br2 n TYR 141 Ca 0.08 0.00 -0.45 0.00 -0.16 0.00 0.00 57.90 57.37 1br2 n TYR 141 Cb 0.69 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.69 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 0.26 2.50 -1.51 -0.72 4.81 0.80 -1.99 118.16 122.30 1br2 n LYS 142 Ca 0.10 0.91 -0.15 0.00 -0.87 0.00 0.00 58.31 58.30 1br2 n LYS 142 Cb 0.49 -2.76 -0.06 0.00 0.02 0.00 0.00 35.03 32.72 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 4.08 1.33 3.79 3.14 0.00 -1.26 -4.94 105.19 111.32 1br2 n GLY 143 Ca 0.19 0.00 -0.37 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 -3.42 4.52 0.28 1.61 -0.14 -0.84 -5.05 119.74 116.70 1br2 s LYS 144 Ca 0.00 1.20 -0.22 0.00 -1.36 0.00 0.00 55.97 55.59 1br2 s LYS 144 Cb 0.00 -2.94 -0.09 0.00 -1.68 0.00 0.00 37.83 33.12 1br2 s LYS 144 CO 0.00 0.38 0.82 0.15 -0.76 0.00 0.00 175.35 175.94 1br2 s LYS 145 N -1.81 4.36 0.31 1.68 -0.14 -1.26 -4.71 119.74 118.16 1br2 s LYS 145 Ca 0.45 1.04 0.08 0.00 -1.36 0.00 0.00 55.97 56.18 1br2 s LYS 145 Cb -0.19 -2.77 0.89 0.00 -1.68 0.00 0.00 37.83 34.08 1br2 s LYS 145 CO 0.24 0.31 1.63 -0.09 -0.76 0.00 0.00 175.35 176.68 1br2 h ARG 146 N 3.14 0.18 0.00 1.68 2.43 -1.92 0.54 114.38 120.43 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 0.00 179.97 180.35 1br2 h HIS 147 N 0.19 0.00 -0.00 2.20 2.07 -1.98 -3.13 115.15 114.50 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 1.41 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.39 1br2 h HIS 147 CO -0.20 0.00 -0.22 0.39 -3.07 0.00 0.00 177.93 174.84 1br2 n GLU 148 N -2.73 0.32 -3.85 5.12 1.02 0.19 -4.87 120.64 115.85 1br2 n GLU 148 Ca 0.03 -0.13 -0.12 0.00 -0.02 0.00 0.00 57.16 56.92 1br2 n GLU 148 Cb 0.37 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.18 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 -2.76 0.29 0.81 3.49 -1.94 -1.16 -4.93 119.30 113.10 1br2 s MET 149 Ca 0.19 -0.05 -0.15 0.00 -1.71 0.00 0.00 55.69 53.98 1br2 s MET 149 Cb 0.19 0.13 -0.01 0.00 2.01 0.00 0.00 34.83 37.14 1br2 s MET 149 CO 0.56 -0.06 0.46 -0.35 -0.01 0.00 0.00 175.02 175.62 1br2 n PRO 150 N 2.38 0.08 -1.73 2.03 -0.04 -1.26 -4.81 135.00 131.64 1br2 n PRO 150 Ca -0.17 0.07 -0.42 0.00 -0.04 0.00 0.00 63.50 62.94 1br2 n PRO 150 Cb 0.58 -1.82 -0.02 0.00 -0.04 0.00 0.00 33.50 32.19 1br2 n PRO 150 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1br2 n PRO 151 N -1.03 2.70 -3.64 0.54 -0.02 -1.26 -4.92 135.00 127.37 1br2 n PRO 151 Ca 0.09 0.97 -0.16 0.00 -2.02 0.00 0.00 63.50 62.38 1br2 n PRO 151 Cb 0.51 -2.77 -0.07 0.00 -0.02 0.00 0.00 33.50 31.15 1br2 n PRO 151 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1br2 s HIS 152 N 0.54 -0.42 0.46 6.00 2.46 -1.26 -4.55 115.29 118.52 1br2 s HIS 152 Ca 0.69 0.69 0.38 0.00 0.47 0.00 0.00 55.06 57.30 1br2 s HIS 152 Cb -0.51 0.25 1.95 0.00 -0.13 0.00 0.00 32.58 34.14 1br2 s HIS 152 CO 0.41 -0.50 2.21 0.97 -2.47 0.00 0.00 174.74 175.36 1br2 h ILE 153 N 3.44 0.11 -0.21 0.89 6.09 -1.98 -0.90 117.51 124.95 1br2 h ILE 153 Ca -0.28 -0.23 -0.06 0.00 -1.37 0.00 0.00 64.86 62.91 1br2 h ILE 153 Cb 1.16 1.20 -0.01 0.00 0.47 0.00 0.00 36.82 39.65 1br2 h ILE 153 CO 0.39 0.02 -0.10 1.88 -3.07 0.00 0.00 178.15 177.27 1br2 h TYR 154 N 0.00 0.50 -0.61 2.19 0.05 -1.95 -1.49 116.97 115.67 1br2 h TYR 154 Ca -0.00 -0.12 0.07 0.00 0.05 0.00 0.00 58.73 58.73 1br2 h TYR 154 Cb 0.20 -0.12 -0.06 0.00 1.01 0.00 0.00 36.73 37.77 1br2 h TYR 154 CO 0.00 0.72 0.29 0.00 -1.05 0.00 0.00 178.16 178.12 1br2 h ALA 155 N 0.71 0.80 -0.22 3.88 0.00 -1.51 0.51 119.26 123.42 1br2 h ALA 155 Ca 0.05 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1br2 h ALA 155 Cb 0.59 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1br2 h ALA 155 CO 0.03 -0.08 0.10 0.82 0.00 0.00 0.00 179.25 180.12 1br2 h ILE 156 N 0.53 0.99 0.40 0.00 5.03 -1.32 0.23 117.51 123.36 1br2 h ILE 156 Ca 0.29 -0.08 -0.01 0.00 -0.12 0.00 0.00 64.86 64.94 1br2 h ILE 156 Cb 0.26 0.74 -0.01 0.00 -3.03 0.00 0.00 36.82 34.79 1br2 h ILE 156 CO -0.23 0.04 -0.25 0.00 -0.68 0.00 0.00 178.15 177.03 1br2 h ALA 157 N 1.12 -0.62 0.23 1.87 0.00 -0.18 -1.87 119.26 119.80 1br2 h ALA 157 Ca 0.09 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1br2 h ALA 157 Cb 0.03 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1br2 h ALA 157 CO -0.07 -0.87 -0.18 0.22 0.00 0.00 0.00 179.25 178.36 1br2 h ASP 158 N -0.63 -0.46 0.15 0.00 1.82 0.30 -0.55 116.42 117.06 1br2 h ASP 158 Ca -0.04 0.04 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 1br2 h ASP 158 Cb 0.52 0.15 -0.00 0.00 0.68 0.00 0.00 39.33 40.68 1br2 h ASP 158 CO 0.04 -0.27 -0.06 0.71 -1.61 0.00 0.00 179.24 178.04 1br2 h THR 159 N -0.41 0.64 -0.05 2.25 1.35 -0.58 0.92 112.91 117.02 1br2 h THR 159 Ca -0.01 -0.25 -0.16 0.00 -0.55 0.00 0.00 66.41 65.43 1br2 h THR 159 Cb 0.37 1.16 0.01 0.00 -1.73 0.00 0.00 68.15 67.95 1br2 h THR 159 CO -0.01 0.06 -0.61 0.00 -0.25 0.00 0.00 175.52 174.71 1br2 h ALA 160 N 1.94 0.15 0.15 6.62 0.00 -1.00 -2.13 119.26 124.98 1br2 h ALA 160 Ca -0.00 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 1br2 h ALA 160 Cb 0.15 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1br2 h ALA 160 CO 0.01 0.41 -0.16 -0.92 0.00 0.00 0.00 179.25 178.59 1br2 h TYR 161 N 0.08 -0.44 -0.39 0.00 3.20 0.62 -1.35 116.97 118.69 1br2 h TYR 161 Ca -0.06 0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.89 1br2 h TYR 161 Cb 1.28 0.17 -0.09 0.00 1.54 0.00 0.00 36.73 39.64 1br2 h TYR 161 CO 0.12 -0.21 -0.23 0.00 -1.64 0.00 0.00 178.16 176.21 1br2 h ARG 162 N -0.31 -0.16 -1.05 1.82 2.47 -1.02 0.86 114.38 116.98 1br2 h ARG 162 Ca -0.02 0.01 0.28 0.00 -1.26 0.00 0.00 59.98 58.99 1br2 h ARG 162 Cb 0.27 0.04 -0.09 0.00 -1.65 0.00 0.00 29.97 28.54 1br2 h ARG 162 CO -0.02 -0.11 0.69 1.03 0.56 0.00 0.00 179.97 182.12 1br2 h SER 163 N -0.17 0.36 0.67 7.04 0.87 -1.28 0.67 113.55 121.73 1br2 h SER 163 Ca 0.19 0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.78 1br2 h SER 163 Cb 0.46 0.01 0.01 0.00 -0.44 0.00 0.00 62.40 62.44 1br2 h SER 163 CO -0.49 0.07 -0.32 -0.03 -0.53 0.00 0.00 176.83 175.53 1br2 h MET 164 N 0.32 -0.87 0.10 2.24 1.85 0.36 -0.33 114.93 118.60 1br2 h MET 164 Ca 0.58 0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 59.73 1br2 h MET 164 Cb 1.62 0.20 0.00 0.00 0.43 0.00 0.00 31.60 33.85 1br2 h MET 164 CO -0.25 -0.57 -0.05 -0.07 -0.40 0.00 0.00 176.91 175.58 1br2 h LEU 165 N -0.95 -0.12 -0.61 3.39 3.38 -0.75 0.16 115.31 119.82 1br2 h LEU 165 Ca -0.09 -0.14 0.10 0.00 0.09 0.00 0.00 57.88 57.84 1br2 h LEU 165 Cb 0.71 0.03 -0.11 0.00 0.09 0.00 0.00 40.66 41.37 1br2 h LEU 165 CO 0.15 0.07 -0.35 1.56 0.09 0.00 0.00 178.44 179.97 1br2 h GLN 166 N -0.31 -0.16 -0.60 1.13 1.08 0.31 -2.36 115.11 114.20 1br2 h GLN 166 Ca -0.01 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1br2 h GLN 166 Cb 0.25 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 1br2 h GLN 166 CO 0.02 -0.10 0.00 -0.25 -0.95 0.00 0.00 178.83 177.55 1br2 n ASP 167 N -5.43 3.59 -4.28 1.46 8.00 -0.14 -4.96 116.55 114.78 1br2 n ASP 167 Ca 0.04 -2.00 -0.36 0.00 0.71 0.00 0.00 54.79 53.18 1br2 n ASP 167 Cb 0.36 -0.40 -0.05 0.00 -0.02 0.00 0.00 41.12 41.01 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 1.25 -2.30 -4.84 -1.24 5.12 0.54 -4.94 116.66 110.25 1br2 n ARG 168 Ca 0.20 0.28 -0.26 0.00 -1.93 0.00 0.00 57.85 56.14 1br2 n ARG 168 Cb 0.55 -4.75 -0.16 0.00 -1.16 0.00 0.00 32.46 26.94 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 -7.02 1.82 0.33 5.56 -1.05 -1.05 -5.04 118.70 112.26 1br2 s GLU 169 Ca 0.59 -0.61 -0.29 0.00 -0.15 0.00 0.00 54.97 54.50 1br2 s GLU 169 Cb -0.33 -1.57 -0.11 0.00 -0.44 0.00 0.00 34.13 31.68 1br2 s GLU 169 CO 0.96 0.24 1.55 -0.51 0.95 0.00 0.00 175.26 178.44 1br2 s ASP 170 N 0.07 6.35 0.31 0.83 1.01 -1.26 -4.35 116.67 119.62 1br2 s ASP 170 Ca -0.05 3.00 0.08 0.00 0.71 0.00 0.00 52.55 56.30 1br2 s ASP 170 Cb -0.12 -2.65 -0.04 0.00 1.01 0.00 0.00 42.92 41.12 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 -1.24 2.47 -0.17 8.23 -1.52 -1.02 -0.36 119.66 126.06 1br2 s GLN 171 Ca 0.58 -1.42 -0.11 0.00 -1.95 0.00 0.00 55.36 52.47 1br2 s GLN 171 Cb -0.47 -2.26 0.05 0.00 -0.22 0.00 0.00 33.01 30.11 1br2 s GLN 171 CO 0.55 0.21 0.41 -1.54 -0.25 0.00 0.00 175.29 174.68 1br2 s SER 172 N -3.82 -0.50 -0.30 5.90 1.04 -0.34 -0.40 113.70 115.29 1br2 s SER 172 Ca 0.36 0.88 -0.06 0.00 0.48 0.00 0.00 55.95 57.61 1br2 s SER 172 Cb -0.05 0.79 0.02 0.00 0.10 0.00 0.00 66.02 66.89 1br2 s SER 172 CO 0.23 -0.18 0.07 -0.63 0.98 0.00 0.00 173.24 173.70 1br2 s ILE 173 N 1.08 3.78 -0.30 -1.02 1.01 0.19 0.27 121.20 126.21 1br2 s ILE 173 Ca -0.07 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 59.67 1br2 s ILE 173 Cb -0.07 -2.99 0.01 0.00 0.01 0.00 0.00 42.46 39.42 1br2 s ILE 173 CO -0.09 0.03 0.09 -0.76 0.00 0.00 0.00 174.94 174.22 1br2 s LEU 174 N 1.45 3.92 -0.13 2.97 1.43 0.30 -1.90 118.68 126.71 1br2 s LEU 174 Ca 0.01 -0.71 -0.22 0.00 -1.03 0.00 0.00 54.13 52.19 1br2 s LEU 174 Cb -0.18 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 1br2 s LEU 174 CO 0.02 -0.20 0.64 0.00 0.23 0.00 0.00 176.35 177.04 1br2 s THR 176 N 1.29 3.17 0.00 0.00 -4.23 0.19 -4.61 115.64 111.44 1br2 s THR 176 Ca 0.32 -1.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 1br2 s THR 176 Cb -0.16 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.09 1br2 s THR 176 CO 0.13 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1br2 n GLY 177 N -0.04 4.01 3.74 3.99 0.00 -1.26 -0.20 105.19 115.43 1br2 n GLY 177 Ca -0.10 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.13 2.01 -0.22 1.61 -1.05 -1.26 -3.86 118.70 113.80 1br2 s GLU 178 Ca 0.00 1.30 -0.40 0.00 -0.15 0.00 0.00 54.97 55.72 1br2 s GLU 178 Cb 0.00 -1.86 -0.16 0.00 -0.44 0.00 0.00 34.13 31.67 1br2 s GLU 178 CO 0.00 -1.85 1.64 0.45 0.95 0.00 0.00 175.26 176.45 1br2 n SER 179 N -3.56 2.11 0.00 0.83 2.88 -0.01 -0.67 113.62 115.20 1br2 n SER 179 Ca 0.10 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 1br2 n SER 179 Cb 0.53 -1.13 0.00 0.00 -0.75 0.00 0.00 64.21 62.86 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 3.80 2.94 0.26 0.46 0.00 -1.26 -4.84 105.19 106.54 1br2 n GLY 180 Ca 0.25 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.31 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 0.80 0.00 4.61 0.00 -1.20 -3.46 119.26 120.01 1br2 h ALA 181 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1br2 h ALA 181 Cb 0.00 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1br2 h ALA 181 CO 0.00 -0.38 0.00 0.41 0.00 0.00 0.00 179.25 179.28 1br2 n GLY 182 N -1.37 -0.84 0.29 0.00 0.00 -1.26 -3.97 105.19 98.03 1br2 n GLY 182 Ca 0.12 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.17 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 0.02 -0.02 1.61 1.57 -1.88 -1.85 116.57 116.02 1br2 h LYS 183 Ca 0.00 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1br2 h LYS 183 Cb 0.00 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1br2 h LYS 183 CO 0.00 0.01 -0.02 1.15 -0.57 0.00 0.00 179.45 180.02 1br2 h THR 184 N 0.02 1.40 -0.95 -0.16 2.02 -1.95 0.13 112.91 113.42 1br2 h THR 184 Ca 0.38 -1.22 0.20 0.00 0.77 0.00 0.00 66.41 66.54 1br2 h THR 184 Cb 0.62 2.19 -0.08 0.00 -1.74 0.00 0.00 68.15 69.13 1br2 h THR 184 CO -0.77 0.32 0.61 -0.33 0.37 0.00 0.00 175.52 175.73 1br2 h GLU 185 N -0.45 0.51 0.18 6.66 4.39 -1.90 0.31 114.58 124.28 1br2 h GLU 185 Ca 0.00 -0.03 -0.30 0.00 0.34 0.00 0.00 59.36 59.37 1br2 h GLU 185 Cb 0.54 -0.11 0.02 0.00 -0.10 0.00 0.00 28.75 29.09 1br2 h GLU 185 CO 0.01 0.34 -1.36 -0.91 -1.16 0.00 0.00 179.01 175.92 1br2 h ASN 186 N 0.52 0.60 -0.44 1.42 2.35 -1.25 -2.45 115.58 116.33 1br2 h ASN 186 Ca 0.51 -0.65 -0.02 0.00 -0.55 0.00 0.00 56.30 55.59 1br2 h ASN 186 Cb 1.10 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.26 1br2 h ASN 186 CO -0.24 1.51 0.19 0.74 -1.65 0.00 0.00 177.43 177.98 1br2 h THR 187 N 0.10 1.19 -0.07 2.81 2.02 0.53 -1.99 112.91 117.51 1br2 h THR 187 Ca -0.19 -0.57 0.02 0.00 0.77 0.00 0.00 66.41 66.44 1br2 h THR 187 Cb 2.06 0.76 -0.00 0.00 -1.74 0.00 0.00 68.15 69.22 1br2 h THR 187 CO 0.23 0.21 0.05 0.11 0.37 0.00 0.00 175.52 176.50 1br2 h LYS 188 N 0.56 0.03 -0.01 6.66 1.57 -0.45 -1.53 116.57 123.41 1br2 h LYS 188 Ca 0.15 -0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.72 1br2 h LYS 188 Cb 0.16 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1br2 h LYS 188 CO -0.02 0.02 -0.87 0.87 -0.57 0.00 0.00 179.45 178.88 1br2 h LYS 189 N 0.03 0.29 -0.25 3.15 1.79 -0.88 -1.57 116.57 119.13 1br2 h LYS 189 Ca 0.03 -0.30 -0.03 0.00 -2.18 0.00 0.00 60.65 58.17 1br2 h LYS 189 Cb 0.09 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.82 1br2 h LYS 189 CO -0.00 1.00 0.03 0.28 -1.08 0.00 0.00 179.45 179.68 1br2 h VAL 190 N 0.17 1.23 -0.58 0.50 2.07 -0.63 -0.73 116.25 118.29 1br2 h VAL 190 Ca -0.05 -0.80 -0.09 0.00 0.82 0.00 0.00 66.70 66.58 1br2 h VAL 190 Cb 1.49 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 1br2 h VAL 190 CO 0.14 0.25 0.02 0.40 0.02 0.00 0.00 177.57 178.41 1br2 h ILE 191 N 0.23 1.26 -0.73 4.57 2.04 -1.41 -1.21 117.51 122.26 1br2 h ILE 191 Ca 0.08 -1.09 0.03 0.00 1.00 0.00 0.00 64.86 64.87 1br2 h ILE 191 Cb 0.34 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 1br2 h ILE 191 CO 0.01 0.40 0.46 -0.61 0.00 0.00 0.00 178.15 178.40 1br2 h GLN 192 N 0.92 0.87 0.59 2.37 4.15 -0.97 -0.84 115.11 122.20 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 0.51 -0.20 0.01 0.00 0.21 0.00 0.00 27.48 28.00 1br2 h GLN 192 CO 0.02 0.58 -0.28 -0.92 -1.93 0.00 0.00 178.83 176.30 1br2 h TYR 193 N 0.90 -0.73 -0.84 3.99 5.03 -0.85 -2.87 116.97 121.60 1br2 h TYR 193 Ca 0.29 -0.02 0.17 0.00 2.58 0.00 0.00 58.73 61.75 1br2 h TYR 193 Cb 0.01 0.24 -0.10 0.00 1.55 0.00 0.00 36.73 38.42 1br2 h TYR 193 CO -0.04 -0.40 0.40 -0.07 -1.32 0.00 0.00 178.16 176.73 1br2 h LEU 194 N -1.10 0.42 -1.69 2.82 3.38 -1.09 0.80 115.31 118.85 1br2 h LEU 194 Ca -0.08 0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1br2 h LEU 194 Cb 0.66 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1br2 h LEU 194 CO 0.13 0.13 -0.18 0.00 0.09 0.00 0.00 178.44 178.62 1br2 h ALA 195 N 1.60 1.59 -0.01 1.53 0.00 -1.16 -2.36 119.26 120.45 1br2 h ALA 195 Ca 0.48 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1br2 h ALA 195 Cb 0.76 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1br2 h ALA 195 CO -0.42 0.22 -0.01 0.28 0.00 0.00 0.00 179.25 179.33 1br2 n VAL 196 N -4.17 0.00 0.00 0.00 0.31 0.25 -3.76 118.33 110.96 1br2 n VAL 196 Ca -0.02 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1br2 n VAL 196 Cb 0.25 0.27 0.00 0.00 -0.91 0.00 0.00 33.84 33.45 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 -0.12 0.00 0.61 2.52 0.24 -0.95 -4.84 118.33 115.79 1br2 n VAL 197 Ca 0.20 0.00 0.07 0.00 -2.04 0.00 0.00 64.34 62.57 1br2 n VAL 197 Cb 0.30 -0.77 -0.01 0.00 -1.47 0.00 0.00 33.84 31.90 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 -1.88 3.09 -1.00 2.33 0.00 -0.93 -5.04 120.51 117.08 1br2 n ALA 198 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1br2 n ALA 198 Cb 0.42 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.39 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 -0.24 0.00 -0.54 0.00 2.88 -1.25 -1.80 113.62 112.68 1br2 n SER 199 Ca 0.06 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1br2 n SER 199 Cb 0.29 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.74 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 4.34 0.73 0.27 0.46 0.00 -1.26 -4.98 105.19 104.75 1br2 n GLY 218 Ca 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 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 0.03 -0.43 -0.45 1.61 -0.00 -2.02 -2.60 114.58 110.71 1br2 h GLU 219 Ca -0.02 0.03 0.04 0.00 -0.00 0.00 0.00 59.36 59.41 1br2 h GLU 219 Cb 1.24 0.10 -0.05 0.00 -0.00 0.00 0.00 28.75 30.03 1br2 h GLU 219 CO -0.00 -0.28 -0.27 -0.11 -0.00 0.00 0.00 179.01 178.35 1br2 n LEU 220 N -4.14 -0.48 -0.15 3.06 7.94 -1.26 0.19 117.00 122.16 1br2 n LEU 220 Ca -0.05 0.97 -0.03 0.00 -1.11 0.00 0.00 56.01 55.79 1br2 n LEU 220 Cb 0.24 -0.19 0.03 0.00 0.53 0.00 0.00 43.42 44.03 1br2 n LEU 220 CO 0.10 -0.74 0.78 -0.33 -1.11 0.00 0.00 177.39 176.08 1br2 h GLU 221 N 0.00 0.01 -0.98 1.96 3.07 -1.90 1.03 114.58 117.77 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 0.18 -0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 28.01 1br2 h GLU 221 CO -0.42 0.01 0.62 1.57 -1.40 0.00 0.00 179.01 179.38 1br2 h LYS 222 N 0.01 0.99 0.09 2.33 2.10 0.25 -1.27 116.57 121.06 1br2 h LYS 222 Ca 0.23 -0.06 -0.25 0.00 -2.00 0.00 0.00 60.65 58.57 1br2 h LYS 222 Cb 0.35 -0.22 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 1br2 h LYS 222 CO -0.48 0.65 -1.14 1.96 -2.00 0.00 0.00 179.45 178.45 1br2 h GLN 223 N 1.02 0.28 -0.77 0.07 4.20 0.12 -3.20 115.11 116.83 1br2 h GLN 223 Ca 0.47 -0.42 0.11 0.00 0.06 0.00 0.00 58.65 58.87 1br2 h GLN 223 Cb 0.39 0.15 -0.05 0.00 0.30 0.00 0.00 27.48 28.26 1br2 h GLN 223 CO -0.24 1.16 0.50 1.25 -0.67 0.00 0.00 178.83 180.84 1br2 h LEU 224 N 0.11 0.56 -0.02 1.46 5.85 0.21 0.29 115.31 123.77 1br2 h LEU 224 Ca -0.11 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1br2 h LEU 224 Cb 1.84 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.77 1br2 h LEU 224 CO 0.19 0.32 0.00 0.18 -0.34 0.00 0.00 178.44 178.79 1br2 n LEU 225 N -4.50 0.04 -0.00 2.25 4.77 -0.64 -3.00 117.00 115.90 1br2 n LEU 225 Ca 0.13 -0.01 0.06 0.00 -0.03 0.00 0.00 56.01 56.16 1br2 n LEU 225 Cb 0.38 -0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.38 1br2 n LEU 225 CO 0.32 0.01 -0.48 0.00 -1.33 0.00 0.00 177.39 175.90 1br2 n GLN 226 N -0.87 1.05 -0.07 3.23 1.13 0.99 -4.56 117.38 118.27 1br2 n GLN 226 Ca 0.19 -0.09 -0.08 0.00 -1.94 0.00 0.00 57.00 55.09 1br2 n GLN 226 Cb 0.09 -1.25 -0.05 0.00 0.11 0.00 0.00 30.24 29.13 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 1.37 -0.56 0.22 -1.58 0.00 -1.36 -1.53 119.26 115.82 1br2 h ALA 227 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1br2 h ALA 227 Cb 0.52 0.94 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1br2 h ALA 227 CO 0.00 -0.71 -0.10 -0.91 0.00 0.00 0.00 179.25 177.53 1br2 h ASN 228 N -0.22 -0.24 -1.31 0.00 2.35 -1.83 0.15 115.58 114.48 1br2 h ASN 228 Ca 0.04 -0.05 0.39 0.00 -0.55 0.00 0.00 56.30 56.13 1br2 h ASN 228 Cb 0.32 0.06 -0.10 0.00 0.05 0.00 0.00 38.32 38.66 1br2 h ASN 228 CO -0.32 -0.11 0.88 -0.65 -1.65 0.00 0.00 177.43 175.58 1br2 h PRO 229 N -0.36 0.13 0.02 0.81 0.11 -1.76 1.10 132.00 132.05 1br2 h PRO 229 Ca -0.03 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 1br2 h PRO 229 Cb 0.28 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.36 1br2 h PRO 229 CO 0.05 0.09 -0.01 0.82 -0.21 0.00 0.00 178.00 178.74 1br2 h ILE 230 N 0.13 1.05 -0.26 4.15 2.04 -0.63 -3.21 117.51 120.79 1br2 h ILE 230 Ca 0.73 -1.73 0.03 0.00 1.00 0.00 0.00 64.86 64.89 1br2 h ILE 230 Cb 2.40 1.96 -0.03 0.00 -0.74 0.00 0.00 36.82 40.41 1br2 h ILE 230 CO -0.25 0.35 0.06 -0.07 0.00 0.00 0.00 178.15 178.24 1br2 h LEU 231 N -0.98 0.03 -0.96 1.44 3.38 0.16 -2.11 115.31 116.27 1br2 h LEU 231 Ca -0.00 0.04 0.16 0.00 0.09 0.00 0.00 57.88 58.16 1br2 h LEU 231 Cb 0.59 0.05 -0.10 0.00 0.09 0.00 0.00 40.66 41.29 1br2 h LEU 231 CO 0.00 0.05 0.57 -0.08 0.09 0.00 0.00 178.44 179.07 1br2 h GLU 232 N 0.16 0.76 -0.25 1.13 4.81 0.98 0.12 114.58 122.30 1br2 h GLU 232 Ca 0.12 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1br2 h GLU 232 Cb 0.11 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1br2 h GLU 232 CO -0.15 0.51 0.17 0.00 -0.73 0.00 0.00 179.01 178.80 1br2 h ALA 233 N 1.59 1.94 0.00 2.92 0.00 -1.37 0.27 119.26 124.61 1br2 h ALA 233 Ca 0.52 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.36 1br2 h ALA 233 Cb 0.72 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1br2 h ALA 233 CO -0.34 0.02 -1.85 1.19 0.00 0.00 0.00 179.25 178.26 1br2 n PHE 234 N -4.50 0.00 0.30 0.00 3.01 -0.64 0.01 117.46 115.65 1br2 n PHE 234 Ca 0.01 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.51 1br2 n PHE 234 Cb 0.15 -0.47 0.01 0.00 -0.01 0.00 0.00 39.48 39.15 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 1.62 -0.35 3.89 1.37 0.00 0.33 -4.86 105.19 107.19 1br2 n GLY 235 Ca -0.08 -0.20 -0.21 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.95 5.86 0.05 1.61 -0.87 0.94 -0.97 114.94 120.61 1br2 s ASN 236 Ca 0.06 -0.13 -0.27 0.00 -1.57 0.00 0.00 52.86 50.95 1br2 s ASN 236 Cb 0.06 -1.55 0.09 0.00 -0.02 0.00 0.00 41.25 39.83 1br2 s ASN 236 CO 0.15 -0.09 0.79 0.00 -2.57 0.00 0.00 177.10 175.38 1br2 s ALA 237 N -2.08 -1.75 -0.32 0.60 0.00 0.40 -2.18 121.76 116.42 1br2 s ALA 237 Ca 0.34 0.84 -0.27 0.00 0.00 0.00 0.00 51.96 52.88 1br2 s ALA 237 Cb -0.08 0.57 0.01 0.00 0.00 0.00 0.00 23.12 23.62 1br2 s ALA 237 CO 0.27 -0.71 0.98 0.21 0.00 0.00 0.00 175.76 176.51 1br2 s LYS 238 N -3.32 4.01 0.37 0.00 2.20 -1.11 -1.08 119.74 120.81 1br2 s LYS 238 Ca 0.04 0.88 0.08 0.00 -0.36 0.00 0.00 55.97 56.60 1br2 s LYS 238 Cb -0.01 -3.75 -0.04 0.00 -1.51 0.00 0.00 37.83 32.52 1br2 s LYS 238 CO -0.10 -0.86 0.20 0.95 -0.36 0.00 0.00 175.35 175.18 1br2 s THR 239 N 3.46 2.83 0.50 3.43 -4.23 0.41 -2.16 115.64 119.89 1br2 s THR 239 Ca 0.41 -1.61 0.23 0.00 -1.18 0.00 0.00 61.69 59.54 1br2 s THR 239 Cb -0.13 -3.00 0.28 0.00 1.34 0.00 0.00 72.50 70.99 1br2 s THR 239 CO 0.15 -0.11 2.13 -0.37 -0.54 0.00 0.00 174.62 175.88 1br2 h VAL 240 N 1.41 0.78 0.15 2.29 -1.51 -1.89 -2.24 116.25 115.24 1br2 h VAL 240 Ca -0.43 -0.28 -0.30 0.00 -1.23 0.00 0.00 66.70 64.46 1br2 h VAL 240 Cb 1.25 1.16 0.01 0.00 -2.13 0.00 0.00 31.29 31.59 1br2 h VAL 240 CO 0.63 0.07 -1.39 0.11 -1.23 0.00 0.00 177.57 175.77 1br2 h LYS 241 N 0.00 0.32 -2.99 5.19 1.79 -1.94 -3.47 116.57 115.46 1br2 h LYS 241 Ca -0.00 -0.55 -0.15 0.00 -2.18 0.00 0.00 60.65 57.78 1br2 h LYS 241 Cb 0.16 0.20 -0.25 0.00 -1.58 0.00 0.00 32.23 30.77 1br2 h LYS 241 CO 0.01 1.24 -0.35 1.21 -1.08 0.00 0.00 179.45 180.48 1br2 s ASN 242 N -7.19 -0.31 0.12 0.86 3.84 -0.84 -4.63 114.94 106.79 1br2 s ASN 242 Ca -0.07 0.58 0.04 0.00 0.21 0.00 0.00 52.86 53.61 1br2 s ASN 242 Cb 0.06 0.61 -0.17 0.00 -0.55 0.00 0.00 41.25 41.20 1br2 s ASN 242 CO 0.89 -0.14 1.27 0.44 -2.79 0.00 0.00 177.10 176.77 1br2 h ASP 243 N 5.50 0.15 -2.07 -4.21 3.32 -1.83 1.19 116.42 118.47 1br2 h ASP 243 Ca -0.26 -0.15 -0.61 0.00 0.02 0.00 0.00 57.03 56.03 1br2 h ASP 243 Cb 1.19 -0.05 -0.41 0.00 0.22 0.00 0.00 39.33 40.28 1br2 h ASP 243 CO 0.32 1.08 -0.52 -3.20 -1.72 0.00 0.00 179.24 175.19 1br2 n ASN 244 N -3.46 4.80 -4.70 6.45 5.15 -1.26 -2.75 115.26 119.49 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 0.93 -0.58 -0.03 0.00 -0.53 0.00 0.00 39.78 39.56 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 -3.31 7.21 -0.12 1.20 0.15 -0.24 -4.77 113.70 113.82 1br2 s SER 245 Ca 0.48 1.47 -0.29 0.00 0.70 0.00 0.00 55.95 58.31 1br2 s SER 245 Cb 0.31 -2.52 -0.04 0.00 -1.71 0.00 0.00 66.02 62.06 1br2 s SER 245 CO -0.16 -0.31 1.52 -0.44 1.20 0.00 0.00 173.24 175.05 1br2 s SER 246 N 1.02 6.72 -0.52 5.45 0.01 -1.26 -0.45 113.70 124.66 1br2 s SER 246 Ca 0.46 1.97 0.02 0.00 1.31 0.00 0.00 55.95 59.71 1br2 s SER 246 Cb -0.19 -2.53 0.56 0.00 0.21 0.00 0.00 66.02 64.07 1br2 s SER 246 CO 0.21 -0.92 1.92 0.54 0.41 0.00 0.00 173.24 175.40 1br2 n ARG 247 N 7.03 2.44 -3.63 12.44 5.12 -0.14 -4.80 116.66 135.13 1br2 n ARG 247 Ca 0.16 -3.17 -0.10 0.00 -1.93 0.00 0.00 57.85 52.81 1br2 n ARG 247 Cb 0.44 -2.21 -0.07 0.00 -1.16 0.00 0.00 32.46 29.46 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 -3.52 -0.48 0.75 -1.55 -0.71 -1.26 -1.55 117.98 109.65 1br2 s PHE 248 Ca 0.59 1.15 -0.12 0.00 -1.04 0.00 0.00 56.93 57.52 1br2 s PHE 248 Cb 0.49 0.37 0.04 0.00 -1.21 0.00 0.00 43.02 42.70 1br2 s PHE 248 CO 0.05 -0.25 1.10 0.20 -1.34 0.00 0.00 175.22 174.99 1br2 s GLY 249 N 0.10 1.62 -0.28 1.99 0.00 0.24 -4.42 107.32 106.57 1br2 s GLY 249 Ca 0.02 -0.32 -0.17 0.00 0.00 0.00 0.00 44.72 44.25 1br2 s GLY 249 CO -0.05 0.08 0.71 1.25 0.00 0.00 0.00 173.10 175.09 1br2 s LYS 250 N -5.31 0.71 -0.34 2.90 2.20 -0.56 -0.63 119.74 118.71 1br2 s LYS 250 Ca 0.59 1.17 -0.03 0.00 -0.36 0.00 0.00 55.97 57.34 1br2 s LYS 250 Cb -0.12 0.17 0.06 0.00 -1.51 0.00 0.00 37.83 36.43 1br2 s LYS 250 CO 0.52 -0.14 0.08 0.12 -0.36 0.00 0.00 175.35 175.58 1br2 s PHE 251 N 1.47 3.35 -0.22 4.03 5.36 0.98 -0.72 117.98 132.23 1br2 s PHE 251 Ca -0.09 -1.91 -0.17 0.00 -0.96 0.00 0.00 56.93 53.80 1br2 s PHE 251 Cb -0.05 -2.46 -0.03 0.00 -0.34 0.00 0.00 43.02 40.13 1br2 s PHE 251 CO -0.17 -0.83 0.45 0.42 -1.46 0.00 0.00 175.22 173.62 1br2 s ILE 252 N 1.26 5.14 -0.28 3.12 1.09 0.72 -1.89 121.20 130.36 1br2 s ILE 252 Ca -0.01 0.79 -0.02 0.00 -1.10 0.00 0.00 60.65 60.31 1br2 s ILE 252 Cb -0.21 -3.77 0.04 0.00 -1.06 0.00 0.00 42.46 37.46 1br2 s ILE 252 CO -0.01 0.19 -0.01 -0.60 -0.10 0.00 0.00 174.94 174.40 1br2 s ARG 253 N 1.70 2.62 -0.20 2.79 3.52 -0.69 -0.06 118.95 128.64 1br2 s ARG 253 Ca 0.20 -1.13 -0.16 0.00 -0.13 0.00 0.00 55.73 54.51 1br2 s ARG 253 Cb -0.15 -3.14 -0.04 0.00 -1.56 0.00 0.00 34.95 30.06 1br2 s ARG 253 CO 0.09 -0.53 0.39 0.42 -0.81 0.00 0.00 175.30 174.86 1br2 s ILE 254 N 1.30 5.21 -0.15 4.11 1.01 -1.04 -1.19 121.20 130.44 1br2 s ILE 254 Ca -0.03 0.70 -0.13 0.00 0.00 0.00 0.00 60.65 61.20 1br2 s ILE 254 Cb -0.18 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.51 1br2 s ILE 254 CO -0.02 0.26 0.27 0.20 0.00 0.00 0.00 174.94 175.66 1br2 s ASN 255 N 0.99 6.44 0.27 3.58 0.01 -1.11 -0.53 114.94 124.59 1br2 s ASN 255 Ca 0.19 0.51 0.09 0.00 -0.71 0.00 0.00 52.86 52.95 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 0.15 -0.14 -0.36 -1.51 0.00 0.00 177.10 175.32 1br2 s PHE 256 N 0.23 2.10 0.72 2.20 0.40 0.19 0.17 117.98 123.99 1br2 s PHE 256 Ca 0.16 -0.50 -0.02 0.00 -0.60 0.00 0.00 56.93 55.97 1br2 s PHE 256 Cb -0.13 -1.04 0.12 0.00 0.51 0.00 0.00 43.02 42.47 1br2 s PHE 256 CO 0.04 0.51 1.00 0.16 0.70 0.00 0.00 175.22 177.63 1br2 s ASP 257 N -3.47 4.38 0.50 1.36 1.47 -0.30 -2.05 116.67 118.57 1br2 s ASP 257 Ca 0.28 -0.20 0.33 0.00 1.18 0.00 0.00 52.55 54.15 1br2 s ASP 257 Cb -0.01 -0.23 1.73 0.00 -0.34 0.00 0.00 42.92 44.07 1br2 s ASP 257 CO 0.13 -1.83 2.02 -0.37 0.68 0.00 0.00 175.17 175.79 1br2 h VAL 258 N -0.56 0.00 0.00 2.11 -1.51 -1.93 -0.28 116.25 114.07 1br2 h VAL 258 Ca -0.38 -0.09 -0.15 0.00 -1.23 0.00 0.00 66.70 64.85 1br2 h VAL 258 Cb 1.27 0.88 -0.02 0.00 -2.13 0.00 0.00 31.29 31.29 1br2 h VAL 258 CO 0.43 0.00 -0.72 0.74 -1.23 0.00 0.00 177.57 176.79 1br2 h THR 259 N 0.00 1.33 0.00 7.19 2.02 -2.03 -3.48 112.91 117.94 1br2 h THR 259 Ca 0.00 -2.64 0.00 0.00 0.77 0.00 0.00 66.41 64.54 1br2 h THR 259 Cb 0.10 2.50 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 1br2 h THR 259 CO 0.00 0.70 0.00 0.61 0.37 0.00 0.00 175.52 177.20 1br2 n GLY 260 N 1.00 0.94 3.76 2.16 0.00 -0.12 -5.10 105.19 107.83 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 3.85 0.36 1.61 -0.85 -1.26 -4.72 117.35 114.35 1br2 s TYR 261 Ca 0.00 1.85 -0.28 0.00 -0.52 0.00 0.00 57.07 58.12 1br2 s TYR 261 Cb 0.00 -3.00 -0.11 0.00 0.38 0.00 0.00 41.96 39.23 1br2 s TYR 261 CO 0.00 0.25 1.49 0.42 -1.52 0.00 0.00 175.55 176.19 1br2 s ILE 262 N -1.31 2.10 0.00 -3.49 1.01 -0.74 -1.15 121.20 117.62 1br2 s ILE 262 Ca 0.44 0.10 0.00 0.00 0.00 0.00 0.00 60.65 61.19 1br2 s ILE 262 Cb -0.25 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.16 1br2 s ILE 262 CO 0.31 0.02 0.00 0.52 0.00 0.00 0.00 174.94 175.79 1br2 n VAL 263 N 0.67 0.00 -3.28 2.92 0.31 0.44 -4.82 118.33 114.57 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 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 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 2.91 5.20 0.00 2.92 0.00 -0.80 -4.94 105.19 110.48 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 -3.71 4.61 0.00 -1.10 -2.74 120.51 114.57 1br2 n ALA 265 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 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 1.27 -0.24 0.00 2.47 -0.34 -3.99 114.94 114.11 1br2 s ASN 266 Ca 0.00 0.01 -0.11 0.00 0.42 0.00 0.00 52.86 53.18 1br2 s ASN 266 Cb 0.00 -0.27 -0.05 0.00 -1.45 0.00 0.00 41.25 39.48 1br2 s ASN 266 CO 0.00 -0.22 0.18 -0.63 -3.72 0.00 0.00 177.10 172.71 1br2 s ILE 267 N 2.01 5.35 -0.16 -5.21 1.01 -1.26 -1.71 121.20 121.23 1br2 s ILE 267 Ca 0.04 0.21 -0.01 0.00 0.00 0.00 0.00 60.65 60.88 1br2 s ILE 267 Cb -0.12 -3.52 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 1br2 s ILE 267 CO -0.04 0.33 -0.10 -0.70 0.00 0.00 0.00 174.94 174.43 1br2 s GLU 268 N 1.16 3.41 0.13 2.79 2.56 -0.79 -4.96 118.70 123.00 1br2 s GLU 268 Ca 0.08 -0.65 0.07 0.00 0.00 0.00 0.00 54.97 54.47 1br2 s GLU 268 Cb -0.14 -2.76 -0.04 0.00 2.00 0.00 0.00 34.13 33.19 1br2 s GLU 268 CO 0.05 0.10 -0.06 0.95 -0.56 0.00 0.00 175.26 175.75 1br2 s THR 269 N 0.67 3.54 0.07 -1.70 -4.23 -1.26 -0.02 115.64 112.71 1br2 s THR 269 Ca -0.05 -1.32 0.06 0.00 -1.18 0.00 0.00 61.69 59.19 1br2 s THR 269 Cb -0.15 -2.71 -0.03 0.00 1.34 0.00 0.00 72.50 70.95 1br2 s THR 269 CO 0.02 0.02 -0.15 -0.31 -0.54 0.00 0.00 174.62 173.66 1br2 s TYR 270 N -1.43 1.33 -0.44 3.99 1.51 0.20 -4.94 117.35 117.56 1br2 s TYR 270 Ca 0.24 -0.43 -0.25 0.00 -1.01 0.00 0.00 57.07 55.62 1br2 s TYR 270 Cb -0.10 -0.75 0.04 0.00 -0.11 0.00 0.00 41.96 41.03 1br2 s TYR 270 CO 0.16 0.08 0.53 -0.11 -1.11 0.00 0.00 175.55 175.10 1br2 n LEU 271 N 1.35 -1.87 -4.69 -1.29 7.94 -1.26 0.81 117.00 117.99 1br2 n LEU 271 Ca -0.20 -0.29 -0.42 0.00 -1.11 0.00 0.00 56.01 53.99 1br2 n LEU 271 Cb 0.54 -1.29 -0.03 0.00 0.53 0.00 0.00 43.42 43.17 1br2 n LEU 271 CO 0.22 0.09 0.69 -0.22 -1.11 0.00 0.00 177.39 177.06 1br2 s LEU 272 N -2.55 4.26 -0.93 -1.96 2.96 -1.26 -4.03 118.68 115.17 1br2 s LEU 272 Ca 0.24 1.45 -0.21 0.00 -0.22 0.00 0.00 54.13 55.40 1br2 s LEU 272 Cb -0.02 -3.44 -0.11 0.00 0.50 0.00 0.00 46.19 43.11 1br2 s LEU 272 CO 0.72 -0.37 1.97 1.21 -1.32 0.00 0.00 176.35 178.56 1br2 n GLU 273 N 4.71 1.78 -0.35 1.98 2.13 -0.60 -4.75 120.64 125.54 1br2 n GLU 273 Ca 0.06 -2.06 0.13 0.00 0.66 0.00 0.00 57.16 55.95 1br2 n GLU 273 Cb 0.49 -3.06 0.32 0.00 0.27 0.00 0.00 31.44 29.46 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 7.73 0.69 -0.91 5.31 1.57 -1.91 -2.07 116.57 126.99 1br2 h LYS 274 Ca 0.43 -0.04 0.26 0.00 -1.87 0.00 0.00 60.65 59.43 1br2 h LYS 274 Cb 0.69 -0.16 -0.15 0.00 0.08 0.00 0.00 32.23 32.70 1br2 h LYS 274 CO 1.87 0.46 0.26 0.77 -0.57 0.00 0.00 179.45 182.25 1br2 h SER 275 N 0.72 0.01 -0.27 0.86 0.02 -1.94 0.19 113.55 113.14 1br2 h SER 275 Ca 0.58 0.21 0.08 0.00 -0.84 0.00 0.00 61.79 61.82 1br2 h SER 275 Cb 0.93 0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 1br2 h SER 275 CO -0.40 -0.20 0.33 -0.09 -1.14 0.00 0.00 176.83 175.33 1br2 h ARG 276 N 0.18 0.00 -0.14 3.45 2.43 -1.56 -0.14 114.38 118.60 1br2 h ARG 276 Ca 0.60 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.79 1br2 h ARG 276 Cb 1.26 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 1br2 h ARG 276 CO -0.69 0.00 0.10 0.00 -1.51 0.00 0.00 179.97 177.86 1br2 h ALA 277 N 1.59 2.02 -0.06 2.80 0.00 -0.79 -3.17 119.26 121.66 1br2 h ALA 277 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1br2 h ALA 277 Cb 0.79 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 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 -4.51 0.23 -3.63 0.00 -5.35 -0.07 -4.85 119.36 101.18 1br2 n ILE 278 Ca -0.00 -0.61 -0.07 0.00 -0.27 0.00 0.00 62.75 61.80 1br2 n ILE 278 Cb 0.16 1.00 -0.06 0.00 -1.74 0.00 0.00 39.64 39.00 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 -0.70 0.34 -0.04 6.28 3.52 -1.20 -4.71 118.95 122.45 1br2 s ARG 279 Ca 0.10 0.27 -0.05 0.00 -0.13 0.00 0.00 55.73 55.92 1br2 s ARG 279 Cb 0.07 0.16 0.01 0.00 -1.56 0.00 0.00 34.95 33.63 1br2 s ARG 279 CO 0.09 -0.07 0.13 -0.65 -0.81 0.00 0.00 175.30 173.99 1br2 s GLN 280 N -0.30 0.23 1.09 5.12 1.11 -1.26 -4.30 119.66 121.34 1br2 s GLN 280 Ca 0.04 0.03 -0.17 0.00 0.01 0.00 0.00 55.36 55.27 1br2 s GLN 280 Cb -0.03 0.10 0.24 0.00 -1.01 0.00 0.00 33.01 32.31 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 -0.29 1.26 0.42 6.09 0.00 -1.26 -4.61 121.76 123.37 1br2 s ALA 281 Ca -0.04 -0.97 -0.23 0.00 0.00 0.00 0.00 51.96 50.73 1br2 s ALA 281 Cb -0.03 -2.87 -0.12 0.00 0.00 0.00 0.00 23.12 20.10 1br2 s ALA 281 CO 0.00 -3.06 0.62 1.17 0.00 0.00 0.00 175.76 174.49 1br2 n LYS 282 N -4.32 0.67 -1.61 0.00 3.00 -1.26 -1.63 118.16 113.00 1br2 n LYS 282 Ca 0.13 0.24 -0.10 0.00 -0.00 0.00 0.00 58.31 58.58 1br2 n LYS 282 Cb 0.59 -1.58 -0.03 0.00 0.00 0.00 0.00 35.03 34.01 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 1.15 -2.85 -4.48 3.14 8.00 -1.26 -4.85 116.55 115.41 1br2 n ASP 283 Ca 0.11 0.25 -0.29 0.00 0.71 0.00 0.00 54.79 55.58 1br2 n ASP 283 Cb 0.39 -2.68 -0.11 0.00 -0.02 0.00 0.00 41.12 38.70 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 -3.45 1.73 0.19 -1.24 2.02 -0.65 -4.66 118.70 112.64 1br2 s GLU 284 Ca 0.00 -1.27 0.03 0.00 0.02 0.00 0.00 54.97 53.75 1br2 s GLU 284 Cb 0.00 -2.05 -0.05 0.00 0.10 0.00 0.00 34.13 32.13 1br2 s GLU 284 CO 0.00 0.46 -0.02 -0.98 0.02 0.00 0.00 175.26 174.74 1br2 s ARG 285 N -2.30 1.19 0.00 1.61 1.70 -0.92 -4.49 118.95 115.74 1br2 s ARG 285 Ca 0.19 -1.58 0.00 0.00 -0.47 0.00 0.00 55.73 53.87 1br2 s ARG 285 Cb -0.10 -0.47 0.00 0.00 -0.57 0.00 0.00 34.95 33.81 1br2 s ARG 285 CO 0.10 -0.08 0.00 -2.37 -1.08 0.00 0.00 175.30 171.87 1br2 n THR 286 N -0.30 0.00 -1.68 4.99 5.66 -1.26 -3.79 114.28 117.89 1br2 n THR 286 Ca -0.07 0.00 -0.46 0.00 -3.05 0.00 0.00 64.05 60.48 1br2 n THR 286 Cb 0.63 -1.97 -0.04 0.00 -1.55 0.00 0.00 70.33 67.40 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 -1.28 2.39 -0.31 1.09 3.72 -1.26 -4.25 117.46 117.56 1br2 n PHE 287 Ca 0.00 0.11 0.09 0.00 -0.05 0.00 0.00 57.45 57.60 1br2 n PHE 287 Cb 0.00 -2.61 0.18 0.00 -0.94 0.00 0.00 39.48 36.11 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 4.56 0.42 -0.38 1.38 8.25 -0.93 -1.09 115.22 127.43 1br2 n HIS 288 Ca 0.18 1.05 0.30 0.00 -0.26 0.00 0.00 57.72 58.99 1br2 n HIS 288 Cb 0.31 -1.07 0.60 0.00 1.12 0.00 0.00 29.99 30.95 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 0.34 0.18 1.59 6.09 -0.72 0.12 117.51 125.10 1br2 h ILE 289 Ca 0.46 -0.07 -0.01 0.00 -1.37 0.00 0.00 64.86 63.87 1br2 h ILE 289 Cb 0.83 0.10 0.00 0.00 0.47 0.00 0.00 36.82 38.23 1br2 h ILE 289 CO -0.85 0.04 -0.08 -0.26 -3.07 0.00 0.00 178.15 173.92 1br2 h PHE 290 N 0.22 -0.22 -0.16 2.19 0.04 -1.39 -0.69 116.94 116.94 1br2 h PHE 290 Ca 0.69 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 61.42 1br2 h PHE 290 Cb 2.06 0.07 -0.01 0.00 2.20 0.00 0.00 35.95 40.27 1br2 h PHE 290 CO -0.00 0.04 -0.06 1.88 -0.60 0.00 0.00 178.31 179.56 1br2 h TYR 291 N -0.45 0.24 0.69 -0.55 0.05 -1.02 -1.67 116.97 114.25 1br2 h TYR 291 Ca -0.02 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.70 1br2 h TYR 291 Cb 0.35 -0.07 0.01 0.00 1.01 0.00 0.00 36.73 38.03 1br2 h TYR 291 CO -0.00 0.30 -0.33 1.88 -1.05 0.00 0.00 178.16 178.96 1br2 h TYR 292 N 0.23 -0.86 0.12 4.88 -1.99 -0.64 -1.68 116.97 117.03 1br2 h TYR 292 Ca 0.05 -0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.78 1br2 h TYR 292 Cb 0.27 0.28 -0.03 0.00 2.00 0.00 0.00 36.73 39.24 1br2 h TYR 292 CO 0.00 -0.53 -0.27 1.25 -0.00 0.00 0.00 178.16 178.60 1br2 h LEU 293 N -1.20 -0.78 -1.73 3.88 5.85 -1.05 0.43 115.31 120.69 1br2 h LEU 293 Ca -0.09 0.09 0.10 0.00 0.84 0.00 0.00 57.88 58.81 1br2 h LEU 293 Cb 0.71 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 42.01 1br2 h LEU 293 CO 0.16 -0.36 0.36 0.40 -0.34 0.00 0.00 178.44 178.65 1br2 h ILE 294 N -0.49 0.88 0.00 4.05 2.04 -1.39 -1.13 117.51 121.47 1br2 h ILE 294 Ca 0.03 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1br2 h ILE 294 Cb 0.52 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1br2 h ILE 294 CO -0.16 0.06 -1.32 0.00 0.00 0.00 0.00 178.15 176.72 1br2 n ALA 295 N -2.54 2.88 -0.26 1.87 0.00 -0.63 -4.57 120.51 117.26 1br2 n ALA 295 Ca 0.08 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1br2 n ALA 295 Cb 0.38 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.87 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 1.26 0.94 3.75 0.00 0.00 0.14 -4.40 105.19 106.88 1br2 n GLY 296 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.58 3.47 0.63 4.61 0.00 -0.47 -4.92 121.76 124.50 1br2 s ALA 297 Ca 0.00 1.05 -0.18 0.00 0.00 0.00 0.00 51.96 52.83 1br2 s ALA 297 Cb 0.00 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 1br2 s ALA 297 CO 0.00 -0.42 1.26 -1.54 0.00 0.00 0.00 175.76 175.05 1br2 s SER 298 N -0.21 4.82 0.47 0.00 1.04 -1.26 -4.58 113.70 113.98 1br2 s SER 298 Ca 0.51 2.52 0.24 0.00 0.48 0.00 0.00 55.95 59.70 1br2 s SER 298 Cb -0.35 -2.61 1.28 0.00 0.10 0.00 0.00 66.02 64.44 1br2 s SER 298 CO 0.42 -1.85 1.86 -0.08 0.98 0.00 0.00 173.24 174.56 1br2 h GLU 299 N 0.64 0.21 0.00 4.02 4.81 -1.98 0.60 114.58 122.87 1br2 h GLU 299 Ca -0.51 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 58.62 1br2 h GLU 299 Cb 1.32 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.64 1br2 h GLU 299 CO 0.54 0.14 -0.45 1.96 -0.73 0.00 0.00 179.01 180.46 1br2 h GLN 300 N 0.21 0.00 0.10 1.92 4.20 -1.99 -2.89 115.11 116.67 1br2 h GLN 300 Ca 0.47 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.86 1br2 h GLN 300 Cb 1.48 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.25 1br2 h GLN 300 CO -0.11 0.45 -1.67 1.98 -0.67 0.00 0.00 178.83 178.81 1br2 h MET 301 N 0.00 0.21 -0.66 1.46 1.85 -0.72 -2.45 114.93 114.62 1br2 h MET 301 Ca -0.00 -0.36 0.14 0.00 -0.61 0.00 0.00 59.70 58.87 1br2 h MET 301 Cb 1.10 0.13 -0.11 0.00 0.43 0.00 0.00 31.60 33.15 1br2 h MET 301 CO 0.06 1.03 -0.01 -0.09 -0.40 0.00 0.00 176.91 177.49 1br2 h ARG 302 N 0.06 0.10 -0.01 0.39 9.65 0.09 0.22 114.38 124.87 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 2.02 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 30.58 1br2 h ARG 302 CO 0.13 0.06 -0.37 0.27 2.80 0.00 0.00 179.97 182.87 1br2 n ASN 303 N -5.31 1.79 0.05 -3.80 2.04 -1.10 0.13 115.26 109.05 1br2 n ASN 303 Ca 0.10 -1.37 -0.11 0.00 -0.44 0.00 0.00 54.58 52.76 1br2 n ASN 303 Cb 0.38 0.33 -0.13 0.00 -2.53 0.00 0.00 39.78 37.83 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 2.24 0.15 0.06 0.53 3.58 -0.46 -3.24 116.42 119.28 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 0.69 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.69 1br2 h ASP 304 CO 0.00 1.17 -0.59 0.18 -2.88 0.00 0.00 179.24 177.12 1br2 n LEU 305 N -3.33 1.49 -3.47 2.28 4.77 0.57 -4.96 117.00 114.35 1br2 n LEU 305 Ca -0.09 -0.56 -0.23 0.00 -0.03 0.00 0.00 56.01 55.10 1br2 n LEU 305 Cb 1.00 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 42.13 1br2 n LEU 305 CO 0.48 0.30 0.23 0.18 -1.33 0.00 0.00 177.39 177.25 1br2 n LEU 306 N -0.62 -3.38 -4.78 2.23 4.77 -1.06 -4.89 117.00 109.26 1br2 n LEU 306 Ca 0.08 -0.52 -0.34 0.00 -0.03 0.00 0.00 56.01 55.20 1br2 n LEU 306 Cb 0.40 -2.94 0.00 0.00 -2.33 0.00 0.00 43.42 38.55 1br2 n LEU 306 CO 0.32 0.62 0.75 -0.76 -1.33 0.00 0.00 177.39 177.00 1br2 s LEU 307 N -7.02 3.70 0.00 2.23 1.43 0.12 -5.00 118.68 114.13 1br2 s LEU 307 Ca 0.54 2.06 0.00 0.00 -1.03 0.00 0.00 54.13 55.70 1br2 s LEU 307 Cb -0.24 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.42 1br2 s LEU 307 CO 0.70 -1.17 0.00 -0.62 0.23 0.00 0.00 176.35 175.49 1br2 n GLU 308 N -1.45 3.92 -3.34 1.70 1.02 -1.26 -4.81 120.64 116.41 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 1.98 0.61 0.62 0.00 -1.26 -4.95 107.32 104.24 1br2 s GLY 309 Ca 0.00 -1.74 0.33 0.00 0.00 0.00 0.00 44.72 43.31 1br2 s GLY 309 CO 0.00 -1.57 2.23 0.74 0.00 0.00 0.00 173.10 174.50 1br2 h PHE 310 N 0.87 0.00 -0.33 1.90 0.04 -1.95 -0.88 116.94 116.59 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 -3.59 3.90 -0.21 2.17 6.94 -1.26 -4.16 115.26 119.04 1br2 n ASN 311 Ca -0.02 -2.76 0.08 0.00 -0.02 0.00 0.00 54.58 51.86 1br2 n ASN 311 Cb 0.16 -0.49 -0.04 0.00 -2.36 0.00 0.00 39.78 37.05 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 1.27 -4.34 0.53 5.03 -0.34 -4.91 115.26 112.40 1br2 n ASN 312 Ca 0.20 -1.13 -0.35 0.00 0.87 0.00 0.00 54.58 54.17 1br2 n ASN 312 Cb 0.82 0.70 -0.14 0.00 -1.02 0.00 0.00 39.78 40.15 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 -2.21 2.95 -0.49 3.10 2.02 -1.22 -4.90 117.35 116.60 1br2 s TYR 313 Ca 0.10 -0.81 0.24 0.00 -0.37 0.00 0.00 57.07 56.23 1br2 s TYR 313 Cb 0.13 -2.06 0.41 0.00 -0.40 0.00 0.00 41.96 40.05 1br2 s TYR 313 CO 0.53 -0.44 1.61 1.79 -1.57 0.00 0.00 175.55 177.47 1br2 h THR 314 N 5.60 0.00 0.00 -0.71 1.35 -1.85 -2.93 112.91 114.36 1br2 h THR 314 Ca -0.38 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 64.59 1br2 h THR 314 Cb 1.17 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 69.44 1br2 h THR 314 CO 0.60 0.00 0.00 0.49 -0.25 0.00 0.00 175.52 176.36 1br2 n PHE 315 N -2.89 0.04 -2.36 4.73 3.72 -1.26 -3.51 117.46 115.92 1br2 n PHE 315 Ca 0.04 0.01 -0.41 0.00 -0.05 0.00 0.00 57.45 57.05 1br2 n PHE 315 Cb 0.51 -0.52 0.01 0.00 -0.94 0.00 0.00 39.48 38.54 1br2 n PHE 315 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1br2 n LEU 316 N -1.53 7.63 0.00 4.37 4.77 -1.11 -4.14 117.00 126.99 1br2 n LEU 316 Ca 0.06 -5.16 0.00 0.00 -0.03 0.00 0.00 56.01 50.88 1br2 n LEU 316 Cb 0.28 -1.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 1br2 n LEU 316 CO 0.22 2.04 0.00 -1.20 -1.33 0.00 0.00 177.39 177.12 1br2 n SER 317 N 0.81 0.00 -3.31 -1.43 7.64 -1.23 -0.86 113.62 115.24 1br2 n SER 317 Ca 0.53 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 60.02 1br2 n SER 317 Cb 0.26 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.43 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 -0.08 8.70 0.00 6.43 3.02 -1.26 -4.96 115.26 127.11 1br2 n ASN 318 Ca 0.00 -2.57 0.00 0.00 -0.03 0.00 0.00 54.58 51.98 1br2 n ASN 318 Cb 0.00 -1.55 0.00 0.00 -0.61 0.00 0.00 39.78 37.62 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 3.59 0.47 3.48 7.41 0.00 -0.04 -3.63 105.19 116.46 1br2 n GLY 319 Ca 0.78 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 46.36 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 3.07 -0.48 1.61 5.65 -1.26 -4.95 115.29 118.93 1br2 s HIS 320 Ca 0.00 -0.33 -0.14 0.00 0.25 0.00 0.00 55.06 54.84 1br2 s HIS 320 Cb 0.00 -3.36 0.10 0.00 -1.18 0.00 0.00 32.58 28.14 1br2 s HIS 320 CO 0.00 -0.92 0.39 0.08 -0.65 0.00 0.00 174.74 173.64 1br2 s VAL 321 N 2.63 4.90 0.46 0.89 1.01 -1.24 -5.06 120.40 123.99 1br2 s VAL 321 Ca 0.17 -1.34 -0.25 0.00 0.00 0.00 0.00 61.98 60.56 1br2 s VAL 321 Cb -0.17 -4.04 -0.08 0.00 0.00 0.00 0.00 36.38 32.09 1br2 s VAL 321 CO 0.15 -0.67 1.43 -2.16 0.00 0.00 0.00 175.10 173.85 1br2 s PRO 322 N 1.55 3.64 0.44 2.72 0.04 -1.26 -4.98 135.00 137.15 1br2 s PRO 322 Ca 0.04 2.42 -0.02 0.00 0.04 0.00 0.00 61.00 63.48 1br2 s PRO 322 Cb -0.26 -2.63 -0.02 0.00 0.04 0.00 0.00 34.50 31.63 1br2 s PRO 322 CO 0.04 -0.85 0.69 0.42 0.04 0.00 0.00 177.00 177.34 1br2 s ILE 323 N -1.20 4.61 0.00 0.56 1.01 -1.26 -5.07 121.20 119.84 1br2 s ILE 323 Ca 0.62 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 61.05 1br2 s ILE 323 Cb -0.44 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.31 1br2 s ILE 323 CO 0.56 -0.58 0.04 -0.81 0.00 0.00 0.00 174.94 174.14 1br2 n PRO 324 N -2.09 0.00 -2.13 2.79 -0.04 -1.26 -4.16 135.00 128.10 1br2 n PRO 324 Ca -0.01 0.01 -0.39 0.00 -0.04 0.00 0.00 63.50 63.08 1br2 n PRO 324 Cb 0.56 -0.54 0.03 0.00 -0.04 0.00 0.00 33.50 33.52 1br2 n PRO 324 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1br2 n ALA 325 N -2.83 6.28 -2.93 0.55 0.00 -1.26 -4.95 120.51 115.38 1br2 n ALA 325 Ca 0.00 -4.25 -0.11 0.00 0.00 0.00 0.00 53.44 49.08 1br2 n ALA 325 Cb 0.00 -1.90 -0.12 0.00 0.00 0.00 0.00 19.45 17.44 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 -4.08 0.29 -0.32 0.00 2.00 -1.26 -5.12 119.66 111.17 1br2 s GLN 326 Ca 0.49 -0.49 0.02 0.00 -2.00 0.00 0.00 55.36 53.38 1br2 s GLN 326 Cb 0.38 -0.01 0.10 0.00 0.80 0.00 0.00 33.01 34.28 1br2 s GLN 326 CO -0.34 -0.01 0.07 -0.65 -0.50 0.00 0.00 175.29 173.86 1br2 s GLN 327 N -1.10 1.11 0.16 1.67 -0.21 -1.26 -4.61 119.66 115.42 1br2 s GLN 327 Ca -0.11 -1.48 -0.15 0.00 0.02 0.00 0.00 55.36 53.64 1br2 s GLN 327 Cb -0.08 -2.62 0.14 0.00 1.00 0.00 0.00 33.01 31.46 1br2 s GLN 327 CO -0.01 -0.96 1.14 -0.25 -2.12 0.00 0.00 175.29 173.10 1br2 n ASP 328 N 4.54 -0.53 -0.30 5.90 8.00 -1.26 0.20 116.55 133.11 1br2 n ASP 328 Ca 0.01 1.29 0.10 0.00 0.71 0.00 0.00 54.79 56.90 1br2 n ASP 328 Cb 0.42 -0.27 0.33 0.00 -0.02 0.00 0.00 41.12 41.57 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 0.75 0.23 -2.24 2.03 -1.81 0.68 116.42 116.06 1br2 h ASP 329 Ca 0.23 0.04 -0.01 0.00 -0.73 0.00 0.00 57.03 56.56 1br2 h ASP 329 Cb 0.42 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 38.81 1br2 h ASP 329 CO -0.73 0.40 -0.11 -0.33 -1.03 0.00 0.00 179.24 177.44 1br2 h GLU 330 N 0.81 -0.29 -0.46 4.15 5.08 0.19 -3.06 114.58 121.01 1br2 h GLU 330 Ca 0.45 0.02 0.13 0.00 -1.00 0.00 0.00 59.36 58.96 1br2 h GLU 330 Cb 0.60 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1br2 h GLU 330 CO -0.22 0.07 0.33 0.52 -1.00 0.00 0.00 179.01 178.72 1br2 h MET 331 N -0.75 0.01 -0.40 2.33 2.86 -0.39 -0.13 114.93 118.47 1br2 h MET 331 Ca -0.03 -0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 1br2 h MET 331 Cb 0.50 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 1br2 h MET 331 CO 0.05 0.01 0.05 0.35 1.06 0.00 0.00 176.91 178.43 1br2 h PHE 332 N 0.01 0.72 -0.02 -0.22 3.57 -0.78 0.41 116.94 120.64 1br2 h PHE 332 Ca 0.22 -0.11 -0.13 0.00 3.53 0.00 0.00 57.97 61.48 1br2 h PHE 332 Cb 0.86 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 1br2 h PHE 332 CO -0.00 0.71 -0.60 1.96 -2.23 0.00 0.00 178.31 178.16 1br2 h GLN 333 N 0.51 0.05 -0.54 1.11 1.08 -1.19 -0.42 115.11 115.72 1br2 h GLN 333 Ca 0.12 -0.04 -0.09 0.00 -1.45 0.00 0.00 58.65 57.19 1br2 h GLN 333 Cb 0.39 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.81 1br2 h GLN 333 CO 0.01 0.63 -0.01 0.93 -0.95 0.00 0.00 178.83 179.45 1br2 h GLU 334 N 0.04 0.97 0.00 1.46 5.08 -0.59 0.35 114.58 121.88 1br2 h GLU 334 Ca -0.01 -0.31 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1br2 h GLU 334 Cb 1.06 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1br2 h GLU 334 CO 0.08 0.98 -0.00 1.15 -1.00 0.00 0.00 179.01 180.22 1br2 h THR 335 N 0.84 1.38 -0.32 1.13 2.02 0.13 -2.03 112.91 116.06 1br2 h THR 335 Ca 0.15 -1.14 0.01 0.00 0.77 0.00 0.00 66.41 66.20 1br2 h THR 335 Cb 0.55 2.16 -0.02 0.00 -1.74 0.00 0.00 68.15 69.10 1br2 h THR 335 CO 0.03 0.29 0.22 -0.07 0.37 0.00 0.00 175.52 176.36 1br2 h LEU 336 N -0.49 0.36 -0.34 2.58 3.38 -1.03 0.13 115.31 119.92 1br2 h LEU 336 Ca -0.00 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1br2 h LEU 336 Cb 0.49 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1br2 h LEU 336 CO 0.00 0.26 0.09 -0.08 0.09 0.00 0.00 178.44 178.80 1br2 h GLU 337 N 0.43 0.54 -0.25 1.13 4.81 -0.77 0.06 114.58 120.54 1br2 h GLU 337 Ca 0.12 -0.13 -0.17 0.00 -0.13 0.00 0.00 59.36 59.05 1br2 h GLU 337 Cb -0.03 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 1br2 h GLU 337 CO -0.03 0.59 -0.54 0.00 -0.73 0.00 0.00 179.01 178.30 1br2 h ALA 338 N 0.93 0.59 -0.53 2.92 0.00 -0.61 -0.13 119.26 122.43 1br2 h ALA 338 Ca 0.11 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1br2 h ALA 338 Cb 0.29 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1br2 h ALA 338 CO 0.00 0.68 0.20 0.52 0.00 0.00 0.00 179.25 180.65 1br2 h MET 339 N 0.56 0.80 0.31 0.00 2.86 -0.68 0.53 114.93 119.32 1br2 h MET 339 Ca 0.01 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1br2 h MET 339 Cb 1.11 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.62 1br2 h MET 339 CO 0.11 0.71 -0.42 1.15 1.06 0.00 0.00 176.91 179.53 1br2 h THR 340 N 0.72 0.16 -0.92 2.22 2.02 -0.69 -0.16 112.91 116.26 1br2 h THR 340 Ca 0.17 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.43 1br2 h THR 340 Cb 0.22 0.16 -0.06 0.00 -1.74 0.00 0.00 68.15 66.73 1br2 h THR 340 CO -0.01 0.00 0.59 0.40 0.37 0.00 0.00 175.52 176.87 1br2 h ILE 341 N -0.78 1.03 0.00 3.11 2.04 -0.73 0.21 117.51 122.39 1br2 h ILE 341 Ca -0.02 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 1br2 h ILE 341 Cb 0.73 -0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1br2 h ILE 341 CO -0.13 0.18 -0.01 -0.03 0.00 0.00 0.00 178.15 178.17 1br2 h MET 342 N 1.00 0.00 0.00 2.37 4.05 0.87 -3.44 114.93 119.78 1br2 h MET 342 Ca 0.41 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.83 1br2 h MET 342 Cb 0.27 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.07 1br2 h MET 342 CO -0.16 0.01 0.00 0.41 0.23 0.00 0.00 176.91 177.40 1br2 n GLY 343 N -0.80 1.23 3.73 1.39 0.00 0.73 -4.86 105.19 106.61 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 3.54 0.55 1.61 0.40 -0.18 -5.00 117.98 116.89 1br2 s PHE 344 Ca 0.00 1.52 -0.17 0.00 -0.60 0.00 0.00 56.93 57.69 1br2 s PHE 344 Cb 0.00 -3.32 -0.06 0.00 0.51 0.00 0.00 43.02 40.15 1br2 s PHE 344 CO 0.00 -0.81 1.02 0.95 0.70 0.00 0.00 175.22 177.08 1br2 s THR 345 N 0.05 4.16 0.38 0.64 -4.23 -1.26 -4.50 115.64 110.86 1br2 s THR 345 Ca 0.52 1.06 0.14 0.00 -1.18 0.00 0.00 61.69 62.22 1br2 s THR 345 Cb -0.30 -3.55 0.36 0.00 1.34 0.00 0.00 72.50 70.35 1br2 s THR 345 CO 0.34 -0.57 1.81 -0.33 -0.54 0.00 0.00 174.62 175.33 1br2 h GLU 346 N 0.76 0.51 0.00 3.99 4.39 -1.99 0.35 114.58 122.60 1br2 h GLU 346 Ca -0.47 -0.03 -0.14 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 29.72 1br2 h GLU 346 CO 0.59 0.34 -0.69 1.05 -1.16 0.00 0.00 179.01 179.14 1br2 h GLU 347 N 0.53 0.00 -0.35 2.33 9.09 -1.98 -0.63 114.58 123.57 1br2 h GLU 347 Ca 0.53 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.85 1br2 h GLU 347 Cb 1.15 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.24 1br2 h GLU 347 CO -0.27 0.69 -0.13 0.93 0.05 0.00 0.00 179.01 180.28 1br2 h GLU 348 N 0.00 0.71 -0.45 1.06 5.08 -0.76 -0.38 114.58 119.83 1br2 h GLU 348 Ca -0.01 -0.29 -0.10 0.00 -1.00 0.00 0.00 59.36 57.96 1br2 h GLU 348 Cb 1.28 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1br2 h GLU 348 CO 0.09 0.89 -0.11 1.96 -1.00 0.00 0.00 179.01 180.84 1br2 h GLN 349 N 0.49 0.87 0.00 2.33 4.20 -0.81 -1.00 115.11 121.20 1br2 h GLN 349 Ca 0.08 -0.34 -0.10 0.00 0.06 0.00 0.00 58.65 58.35 1br2 h GLN 349 Cb 0.65 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 1br2 h GLN 349 CO 0.04 0.98 -0.50 1.79 -0.67 0.00 0.00 178.83 180.47 1br2 h THR 350 N 0.71 1.15 -0.21 -0.54 1.35 -1.06 -0.79 112.91 113.53 1br2 h THR 350 Ca 0.11 -1.84 -0.17 0.00 -0.55 0.00 0.00 66.41 63.97 1br2 h THR 350 Cb 0.66 2.05 -0.00 0.00 -1.73 0.00 0.00 68.15 69.12 1br2 h THR 350 CO 0.05 0.49 -0.57 0.28 -0.25 0.00 0.00 175.52 175.51 1br2 h SER 351 N 0.00 0.72 -0.00 5.36 0.02 -0.84 0.58 113.55 119.40 1br2 h SER 351 Ca -0.00 -0.40 -0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1br2 h SER 351 Cb 1.01 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 63.34 1br2 h SER 351 CO 0.06 1.14 -0.00 0.40 -1.14 0.00 0.00 176.83 177.29 1br2 h ILE 352 N 0.49 1.29 -0.13 3.27 2.04 -0.95 -1.96 117.51 121.56 1br2 h ILE 352 Ca 0.00 -0.87 -0.02 0.00 1.00 0.00 0.00 64.86 64.98 1br2 h ILE 352 Cb 1.14 1.87 -0.01 0.00 -0.74 0.00 0.00 36.82 39.09 1br2 h ILE 352 CO 0.11 0.23 0.01 -0.07 0.00 0.00 0.00 178.15 178.43 1br2 h LEU 353 N -0.36 0.16 -0.53 1.44 3.38 -1.10 -0.88 115.31 117.42 1br2 h LEU 353 Ca 0.00 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 1br2 h LEU 353 Cb 0.37 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1br2 h LEU 353 CO 0.00 0.19 -0.11 -0.09 0.09 0.00 0.00 178.44 178.52 1br2 h ARG 354 N 0.18 1.02 -0.43 1.13 2.43 -0.65 -1.52 114.38 116.54 1br2 h ARG 354 Ca 0.05 -0.38 -0.10 0.00 -0.81 0.00 0.00 59.98 58.73 1br2 h ARG 354 Cb 0.11 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1br2 h ARG 354 CO 0.00 1.07 -0.13 0.28 -1.51 0.00 0.00 179.97 179.69 1br2 h VAL 355 N 0.90 1.26 -0.61 0.20 2.07 -0.50 -1.01 116.25 118.55 1br2 h VAL 355 Ca 0.14 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 1br2 h VAL 355 Cb 0.69 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1br2 h VAL 355 CO 0.05 0.41 0.36 0.58 0.02 0.00 0.00 177.57 178.99 1br2 h VAL 356 N 0.71 1.18 -0.58 2.57 2.07 -0.89 -1.67 116.25 119.64 1br2 h VAL 356 Ca 0.12 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 1br2 h VAL 356 Cb 0.61 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1br2 h VAL 356 CO 0.04 0.19 0.34 -1.28 0.02 0.00 0.00 177.57 176.88 1br2 h SER 357 N 0.83 0.71 -0.71 0.57 0.87 -0.73 -2.42 113.55 112.66 1br2 h SER 357 Ca 0.22 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.69 1br2 h SER 357 Cb -0.01 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.73 1br2 h SER 357 CO -0.04 0.57 0.38 0.77 -0.53 0.00 0.00 176.83 177.99 1br2 h SER 358 N 0.78 0.90 -0.19 6.23 4.64 -0.81 -0.07 113.55 125.03 1br2 h SER 358 Ca 0.21 -0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.42 1br2 h SER 358 Cb 0.00 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 61.85 1br2 h SER 358 CO -0.04 0.73 0.04 0.58 -0.87 0.00 0.00 176.83 177.28 1br2 h VAL 359 N 1.01 1.15 0.03 0.95 2.07 -0.85 0.18 116.25 120.79 1br2 h VAL 359 Ca 0.25 -0.55 -0.24 0.00 0.82 0.00 0.00 66.70 66.99 1br2 h VAL 359 Cb 0.04 0.89 0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1br2 h VAL 359 CO -0.04 0.19 -0.94 -0.07 0.02 0.00 0.00 177.57 176.74 1br2 h LEU 360 N 0.40 0.78 -1.44 2.57 3.38 -0.77 -3.24 115.31 116.99 1br2 h LEU 360 Ca 0.09 -0.77 -0.05 0.00 0.09 0.00 0.00 57.88 57.24 1br2 h LEU 360 Cb 0.20 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1br2 h LEU 360 CO 0.00 1.45 -0.20 -0.61 0.09 0.00 0.00 178.44 179.17 1br2 h GLN 361 N 0.19 0.11 -0.78 1.13 5.75 -0.65 -1.64 115.11 119.22 1br2 h GLN 361 Ca -0.12 -0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.41 1br2 h GLN 361 Cb 1.62 -0.01 -0.06 0.00 1.07 0.00 0.00 27.48 30.10 1br2 h GLN 361 CO 0.18 0.32 0.47 -0.07 -2.65 0.00 0.00 178.83 177.07 1br2 h LEU 362 N 0.10 0.72 -2.03 -2.39 3.38 -0.99 0.27 115.31 114.36 1br2 h LEU 362 Ca 0.02 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.07 1br2 h LEU 362 Cb 0.42 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1br2 h LEU 362 CO 0.03 0.46 0.15 1.23 0.09 0.00 0.00 178.44 180.40 1br2 h GLY 363 N 0.85 0.00 2.00 0.83 0.00 -1.35 -2.04 103.07 103.36 1br2 h GLY 363 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 1br2 h GLY 363 CO -0.18 0.00 0.00 3.43 0.00 0.00 0.00 176.54 179.79 1br2 h ASN 364 N 0.00 0.00 -3.98 0.19 4.21 -0.93 -3.44 115.58 111.64 1br2 h ASN 364 Ca 0.10 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 57.06 1br2 h ASN 364 Cb 0.40 0.00 0.12 0.00 -1.12 0.00 0.00 38.32 37.72 1br2 h ASN 364 CO -0.00 0.00 0.72 -0.38 -1.29 0.00 0.00 177.43 176.48 1br2 n ILE 365 N -2.50 2.73 -4.31 2.81 5.41 -0.77 -4.85 119.36 117.88 1br2 n ILE 365 Ca 0.04 -0.50 -0.20 0.00 1.00 0.00 0.00 62.75 63.09 1br2 n ILE 365 Cb 0.39 -1.87 -0.16 0.00 -0.71 0.00 0.00 39.64 37.29 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 -1.18 0.69 0.13 1.39 1.01 -1.26 -5.08 120.40 116.09 1br2 s VAL 366 Ca 0.60 -0.27 0.07 0.00 0.00 0.00 0.00 61.98 62.38 1br2 s VAL 366 Cb -0.45 -0.65 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 1br2 s VAL 366 CO 0.58 0.24 -0.04 -0.36 0.00 0.00 0.00 175.10 175.52 1br2 s PHE 367 N 0.51 2.83 0.16 5.22 0.08 -1.26 -4.22 117.98 121.30 1br2 s PHE 367 Ca -0.08 -0.12 0.09 0.00 0.12 0.00 0.00 56.93 56.95 1br2 s PHE 367 Cb -0.11 -1.43 -0.04 0.00 -0.57 0.00 0.00 43.02 40.86 1br2 s PHE 367 CO 0.01 0.47 -0.20 0.15 -0.10 0.00 0.00 175.22 175.55 1br2 s LYS 368 N -2.49 1.32 0.00 0.44 1.02 -0.10 -4.89 119.74 115.03 1br2 s LYS 368 Ca 0.25 -1.39 0.00 0.00 0.02 0.00 0.00 55.97 54.84 1br2 s LYS 368 Cb -0.11 -1.49 0.00 0.00 -0.52 0.00 0.00 37.83 35.71 1br2 s LYS 368 CO 0.16 0.32 0.00 1.63 -0.92 0.00 0.00 175.35 176.54 1br2 n LYS 369 N 0.44 0.40 0.00 1.68 4.76 -1.26 -0.50 118.16 123.69 1br2 n LYS 369 Ca -0.14 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.30 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 -0.87 0.00 0.00 1.97 1.02 -1.26 -4.69 120.64 116.82 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 -4.41 3.49 7.27 -1.26 -5.15 117.38 117.32 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 1.31 -0.04 1.69 0.00 -0.80 -4.53 121.76 119.39 1br2 s ALA 376 Ca 0.00 -0.89 -0.02 0.00 0.00 0.00 0.00 51.96 51.06 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 0.09 -1.54 0.00 0.00 0.00 175.76 174.56 1br2 s SER 377 N -1.17 -0.03 -0.57 0.00 1.04 0.35 -4.86 113.70 108.46 1br2 s SER 377 Ca 0.03 0.17 -0.21 0.00 0.48 0.00 0.00 55.95 56.41 1br2 s SER 377 Cb -0.08 0.07 0.07 0.00 0.10 0.00 0.00 66.02 66.18 1br2 s SER 377 CO 0.01 -0.12 0.81 0.00 0.98 0.00 0.00 173.24 174.93 1br2 s MET 378 N 0.95 3.16 0.18 4.02 0.23 -1.26 -0.93 119.30 125.65 1br2 s MET 378 Ca -0.08 -0.79 -0.10 0.00 -1.03 0.00 0.00 55.69 53.69 1br2 s MET 378 Cb -0.10 -4.15 0.09 0.00 -1.53 0.00 0.00 34.83 29.13 1br2 s MET 378 CO -0.04 -1.51 1.71 -1.35 -2.03 0.00 0.00 175.02 171.81 1br2 h PRO 379 N 9.27 1.00 -4.69 3.16 0.11 -1.96 -3.39 132.00 135.49 1br2 h PRO 379 Ca -0.28 -0.22 -0.68 0.00 0.11 0.00 0.00 66.00 64.93 1br2 h PRO 379 Cb 1.08 -0.14 -0.20 0.00 0.11 0.00 0.00 31.00 31.85 1br2 h PRO 379 CO 1.08 0.88 -0.49 0.34 -0.21 0.00 0.00 178.00 179.60 1br2 s ASP 380 N -6.27 5.95 0.00 -2.05 -1.08 -1.26 -4.93 116.67 107.03 1br2 s ASP 380 Ca -0.12 -0.53 0.23 0.00 -0.52 0.00 0.00 52.55 51.60 1br2 s ASP 380 Cb 0.14 -2.11 0.12 0.00 -1.46 0.00 0.00 42.92 39.61 1br2 s ASP 380 CO 0.82 -0.26 1.18 -0.46 0.52 0.00 0.00 175.17 176.96 1br2 n ASN 381 N 5.08 2.05 -0.27 -0.34 6.94 -1.26 -4.54 115.26 122.92 1br2 n ASN 381 Ca -0.13 -1.52 -0.07 0.00 -0.02 0.00 0.00 54.58 52.85 1br2 n ASN 381 Cb 0.49 0.37 -0.06 0.00 -2.36 0.00 0.00 39.78 38.22 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 0.10 -0.43 -0.14 5.53 -1.04 -1.26 0.13 114.28 117.17 1br2 n THR 382 Ca 0.10 1.89 -0.03 0.00 -2.04 0.00 0.00 64.05 63.97 1br2 n THR 382 Cb 0.47 -2.37 0.04 0.00 -1.82 0.00 0.00 70.33 66.65 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 0.08 0.40 -0.69 2.41 0.00 -1.89 0.47 119.26 120.04 1br2 h ALA 383 Ca 0.10 0.14 0.13 0.00 0.00 0.00 0.00 54.91 55.28 1br2 h ALA 383 Cb 0.26 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1br2 h ALA 383 CO -0.60 -0.40 0.46 0.00 0.00 0.00 0.00 179.25 178.72 1br2 h ALA 384 N 1.40 2.08 0.22 0.00 0.00 -0.06 0.12 119.26 123.02 1br2 h ALA 384 Ca 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1br2 h ALA 384 Cb 0.32 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1br2 h ALA 384 CO -0.38 -0.25 -0.11 1.96 0.00 0.00 0.00 179.25 180.47 1br2 h GLN 385 N 0.41 -0.29 -0.44 0.00 4.20 0.56 -2.48 115.11 117.08 1br2 h GLN 385 Ca 0.33 0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.10 1br2 h GLN 385 Cb 0.73 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.53 1br2 h GLN 385 CO -0.10 0.08 0.20 0.87 -0.67 0.00 0.00 178.83 179.21 1br2 h LYS 386 N -0.75 0.39 -0.31 1.46 1.57 -0.12 0.95 116.57 119.76 1br2 h LYS 386 Ca -0.03 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.79 1br2 h LYS 386 Cb 0.50 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.66 1br2 h LYS 386 CO 0.05 0.26 -0.09 0.28 -0.57 0.00 0.00 179.45 179.38 1br2 h VAL 387 N 0.40 0.66 -0.45 0.50 2.07 -0.83 0.10 116.25 118.70 1br2 h VAL 387 Ca 0.20 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.65 1br2 h VAL 387 Cb 0.13 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1br2 h VAL 387 CO -0.16 0.00 -0.00 0.00 0.02 0.00 0.00 177.57 177.43 1br2 h HIS 389 N 0.68 1.07 0.00 0.00 6.17 0.42 0.76 115.15 124.26 1br2 h HIS 389 Ca 0.14 -0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.22 1br2 h HIS 389 Cb 0.43 -0.35 0.00 0.00 2.52 0.00 0.00 27.41 30.00 1br2 h HIS 389 CO 0.02 0.71 -0.00 1.28 0.71 0.00 0.00 177.93 180.65 1br2 n LEU 390 N -4.46 0.58 -0.17 0.26 4.77 0.24 -3.69 117.00 114.54 1br2 n LEU 390 Ca 0.08 0.55 0.06 0.00 -0.03 0.00 0.00 56.01 56.68 1br2 n LEU 390 Cb 0.05 -0.37 -0.04 0.00 -2.33 0.00 0.00 43.42 40.74 1br2 n LEU 390 CO 0.37 -0.13 0.11 0.23 -1.33 0.00 0.00 177.39 176.65 1br2 n MET 391 N -2.04 2.25 -3.05 3.23 2.81 -0.13 -4.83 117.12 115.35 1br2 n MET 391 Ca 0.06 -0.39 -0.12 0.00 -1.81 0.00 0.00 57.70 55.44 1br2 n MET 391 Cb 0.40 -1.16 0.04 0.00 -0.71 0.00 0.00 33.22 31.80 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 1.17 0.12 3.45 3.03 0.00 0.18 -4.46 105.19 108.68 1br2 n GLY 392 Ca 0.04 -0.17 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.18 1.90 -0.30 -0.61 1.09 -0.86 -1.08 121.20 118.17 1br2 s ILE 393 Ca 0.27 -2.19 -0.16 0.00 -1.10 0.00 0.00 60.65 57.47 1br2 s ILE 393 Cb -0.12 -2.43 -0.02 0.00 -1.06 0.00 0.00 42.46 38.83 1br2 s ILE 393 CO 0.40 -0.33 0.43 0.21 -0.10 0.00 0.00 174.94 175.55 1br2 s ASN 394 N -3.47 6.29 0.32 3.58 2.47 -1.26 -4.54 114.94 118.33 1br2 s ASN 394 Ca 0.29 0.17 0.10 0.00 0.42 0.00 0.00 52.86 53.85 1br2 s ASN 394 Cb 0.02 -2.24 0.95 0.00 -1.45 0.00 0.00 41.25 38.54 1br2 s ASN 394 CO 0.13 -0.30 1.65 0.58 -3.72 0.00 0.00 177.10 175.43 1br2 h VAL 395 N 5.47 0.28 0.04 -5.21 2.07 -1.92 0.45 116.25 117.43 1br2 h VAL 395 Ca -0.30 -0.09 -0.23 0.00 0.82 0.00 0.00 66.70 66.91 1br2 h VAL 395 Cb 1.15 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1br2 h VAL 395 CO 0.70 0.05 -1.04 0.71 0.02 0.00 0.00 177.57 178.00 1br2 h THR 396 N 0.25 1.59 -0.11 2.57 1.35 -1.97 0.45 112.91 117.04 1br2 h THR 396 Ca 0.67 -3.08 -0.18 0.00 -0.55 0.00 0.00 66.41 63.27 1br2 h THR 396 Cb 1.49 2.77 -0.00 0.00 -1.73 0.00 0.00 68.15 70.68 1br2 h THR 396 CO -0.65 0.89 -0.69 0.44 -0.25 0.00 0.00 175.52 175.26 1br2 h ASP 397 N 0.05 0.58 0.54 5.36 5.19 -1.41 -1.82 116.42 124.91 1br2 h ASP 397 Ca -0.06 -0.36 -0.03 0.00 -0.62 0.00 0.00 57.03 55.96 1br2 h ASP 397 Cb 1.76 -0.17 0.01 0.00 0.18 0.00 0.00 39.33 41.10 1br2 h ASP 397 CO 0.15 1.10 -0.26 0.15 -3.12 0.00 0.00 179.24 177.27 1br2 h PHE 398 N 0.35 -0.67 -1.02 4.55 3.57 -0.18 -1.51 116.94 122.01 1br2 h PHE 398 Ca -0.02 -0.02 0.26 0.00 3.53 0.00 0.00 57.97 61.72 1br2 h PHE 398 Cb 1.27 0.22 -0.12 0.00 2.79 0.00 0.00 35.95 40.11 1br2 h PHE 398 CO 0.05 -0.39 0.62 1.15 -2.23 0.00 0.00 178.31 177.51 1br2 h THR 399 N -1.16 0.49 0.04 4.41 2.02 -0.95 0.02 112.91 117.79 1br2 h THR 399 Ca -0.07 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 1br2 h THR 399 Cb 0.59 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 1br2 h THR 399 CO 0.12 0.09 -0.02 0.03 0.37 0.00 0.00 175.52 176.11 1br2 h ARG 400 N 0.49 -0.06 0.00 6.66 3.08 -1.30 0.21 114.38 123.47 1br2 h ARG 400 Ca 0.65 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.70 1br2 h ARG 400 Cb 1.38 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.45 1br2 h ARG 400 CO -0.45 0.36 -0.04 0.77 -1.07 0.00 0.00 179.97 179.55 1br2 h SER 401 N -0.49 0.00 0.01 7.04 0.02 -0.20 0.66 113.55 120.58 1br2 h SER 401 Ca -0.01 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 1br2 h SER 401 Cb 0.45 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1br2 h SER 401 CO 0.01 0.04 -0.45 0.40 -1.14 0.00 0.00 176.83 175.69 1br2 h ILE 402 N 0.00 1.51 0.00 3.27 1.08 -0.98 -3.28 117.51 119.11 1br2 h ILE 402 Ca -0.00 -2.31 0.00 0.00 -0.39 0.00 0.00 64.86 62.16 1br2 h ILE 402 Cb 0.07 3.03 0.00 0.00 -3.07 0.00 0.00 36.82 36.85 1br2 h ILE 402 CO 0.00 0.54 0.00 -0.07 -0.69 0.00 0.00 178.15 177.93 1br2 h LEU 403 N -0.94 0.00 -5.43 1.44 3.38 -0.77 -3.43 115.31 109.56 1br2 h LEU 403 Ca -0.12 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1br2 h LEU 403 Cb 1.15 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.73 1br2 h LEU 403 CO -0.05 0.00 -0.35 0.42 0.09 0.00 0.00 178.44 178.55 1br2 s THR 404 N -3.24 -0.74 -0.84 0.22 -4.23 0.23 -3.01 115.64 104.02 1br2 s THR 404 Ca 0.07 -0.31 0.27 0.00 -1.18 0.00 0.00 61.69 60.54 1br2 s THR 404 Cb 0.07 0.00 0.27 0.00 1.34 0.00 0.00 72.50 74.17 1br2 s THR 404 CO 0.64 0.00 1.84 -0.81 -0.54 0.00 0.00 174.62 175.75 1br2 n PRO 405 N 3.62 0.16 -0.89 3.99 -0.05 -1.24 -4.41 135.00 136.18 1br2 n PRO 405 Ca 0.12 0.13 0.00 0.00 -0.05 0.00 0.00 63.50 63.70 1br2 n PRO 405 Cb 0.59 -1.68 0.00 0.00 -0.05 0.00 0.00 33.50 32.36 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 -1.95 0.00 -2.73 0.54 -0.00 -1.26 -5.01 118.16 107.75 1br2 n LYS 416 Ca 0.06 0.47 -0.38 0.00 -0.00 0.00 0.00 58.31 58.45 1br2 n LYS 416 Cb 0.39 -0.42 -0.06 0.00 -0.00 0.00 0.00 35.03 34.94 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 3.27 -0.05 0.58 0.00 -1.26 -5.03 121.76 119.26 1br2 s ALA 417 Ca 0.00 0.60 0.04 0.00 0.00 0.00 0.00 51.96 52.61 1br2 s ALA 417 Cb 0.00 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 1br2 s ALA 417 CO 0.00 0.13 -0.17 -0.65 0.00 0.00 0.00 175.76 175.07 1br2 s GLN 418 N -1.70 2.54 0.41 0.00 -1.52 -1.17 -5.01 119.66 113.21 1br2 s GLN 418 Ca 0.47 -0.76 0.06 0.00 -1.95 0.00 0.00 55.36 53.18 1br2 s GLN 418 Cb -0.23 -2.33 0.00 0.00 -0.22 0.00 0.00 33.01 30.24 1br2 s GLN 418 CO 0.29 0.54 0.57 0.95 -0.25 0.00 0.00 175.29 177.39 1br2 s THR 419 N -0.53 3.49 0.12 -0.19 -4.23 -1.26 -1.90 115.64 111.14 1br2 s THR 419 Ca 0.07 -0.89 -0.34 0.00 -1.18 0.00 0.00 61.69 59.36 1br2 s THR 419 Cb -0.11 -3.22 -0.12 0.00 1.34 0.00 0.00 72.50 70.39 1br2 s THR 419 CO 0.01 -0.10 1.55 0.50 -0.54 0.00 0.00 174.62 176.04 1br2 h LYS 420 N 0.63 -0.52 -0.96 3.99 3.64 -1.83 0.82 116.57 122.34 1br2 h LYS 420 Ca -0.43 0.04 0.26 0.00 -1.27 0.00 0.00 60.65 59.24 1br2 h LYS 420 Cb 1.27 0.12 -0.18 0.00 -0.41 0.00 0.00 32.23 33.03 1br2 h LYS 420 CO 0.50 -0.35 0.04 0.93 -2.27 0.00 0.00 179.45 178.31 1br2 h GLU 421 N -0.54 0.03 0.00 1.90 4.39 -1.97 0.51 114.58 118.91 1br2 h GLU 421 Ca 0.04 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 1br2 h GLU 421 Cb 0.66 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.30 1br2 h GLU 421 CO -0.48 0.02 -0.58 -0.56 -1.16 0.00 0.00 179.01 176.26 1br2 h GLN 422 N 0.03 0.00 -0.02 2.33 3.07 -1.38 -2.79 115.11 116.35 1br2 h GLN 422 Ca 0.58 0.00 -0.20 0.00 0.09 0.00 0.00 58.65 59.12 1br2 h GLN 422 Cb 1.18 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.76 1br2 h GLN 422 CO -0.88 0.05 -0.75 0.00 0.09 0.00 0.00 178.83 177.34 1br2 h ALA 423 N 1.93 0.12 -0.08 0.06 0.00 0.42 -2.67 119.26 119.03 1br2 h ALA 423 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1br2 h ALA 423 Cb 1.06 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1br2 h ALA 423 CO 0.01 0.49 0.04 -0.44 0.00 0.00 0.00 179.25 179.35 1br2 h ASP 424 N 0.13 0.07 0.05 0.00 3.32 -0.24 -2.51 116.42 117.23 1br2 h ASP 424 Ca -0.09 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.98 1br2 h ASP 424 Cb 1.43 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.92 1br2 h ASP 424 CO 0.15 0.05 -0.52 0.15 -1.72 0.00 0.00 179.24 177.35 1br2 h PHE 425 N 0.09 -1.52 -0.73 4.55 3.04 -1.49 -1.40 116.94 119.48 1br2 h PHE 425 Ca 0.03 0.04 0.16 0.00 3.98 0.00 0.00 57.97 62.19 1br2 h PHE 425 Cb 0.00 0.65 -0.13 0.00 2.56 0.00 0.00 35.95 39.04 1br2 h PHE 425 CO -0.08 -0.57 -0.07 0.00 -2.02 0.00 0.00 178.31 175.57 1br2 h ALA 426 N -0.51 0.65 -0.25 2.41 0.00 -1.35 0.28 119.26 120.49 1br2 h ALA 426 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1br2 h ALA 426 Cb 0.72 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1br2 h ALA 426 CO -0.32 -0.42 0.17 0.82 0.00 0.00 0.00 179.25 179.50 1br2 h ILE 427 N 0.06 1.07 0.26 0.00 1.08 -0.99 0.05 117.51 119.03 1br2 h ILE 427 Ca 0.38 -0.13 -0.01 0.00 -0.39 0.00 0.00 64.86 64.71 1br2 h ILE 427 Cb 0.64 0.70 -0.00 0.00 -3.07 0.00 0.00 36.82 35.09 1br2 h ILE 427 CO -0.69 0.07 -0.16 -0.33 -0.69 0.00 0.00 178.15 176.35 1br2 h GLU 428 N 0.34 -0.39 -0.94 2.37 5.08 -0.01 -0.44 114.58 120.60 1br2 h GLU 428 Ca 0.09 0.03 0.23 0.00 -1.00 0.00 0.00 59.36 58.71 1br2 h GLU 428 Cb -0.03 0.09 -0.12 0.00 0.50 0.00 0.00 28.75 29.18 1br2 h GLU 428 CO -0.02 -0.26 0.47 0.00 -1.00 0.00 0.00 179.01 178.20 1br2 h ALA 429 N 0.32 1.58 -0.15 3.43 0.00 -0.24 0.22 119.26 124.42 1br2 h ALA 429 Ca -0.02 0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1br2 h ALA 429 Cb 0.34 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1br2 h ALA 429 CO 0.02 -0.32 -0.05 1.25 0.00 0.00 0.00 179.25 180.15 1br2 h LEU 430 N 0.47 0.31 -0.00 0.00 5.85 -0.51 -0.58 115.31 120.85 1br2 h LEU 430 Ca 0.60 -0.39 0.02 0.00 0.84 0.00 0.00 57.88 58.95 1br2 h LEU 430 Cb 1.13 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 1br2 h LEU 430 CO -0.51 0.62 -0.41 0.00 -0.34 0.00 0.00 178.44 177.80 1br2 h ALA 431 N 0.69 -0.84 -0.58 1.25 0.00 0.10 0.63 119.26 120.51 1br2 h ALA 431 Ca 0.04 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.96 1br2 h ALA 431 Cb 0.50 0.85 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 1br2 h ALA 431 CO 0.02 -0.97 0.24 0.87 0.00 0.00 0.00 179.25 179.41 1br2 h LYS 432 N -0.51 0.43 -0.86 0.00 1.57 -1.00 -0.09 116.57 116.11 1br2 h LYS 432 Ca 0.01 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1br2 h LYS 432 Cb 0.55 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.72 1br2 h LYS 432 CO -0.28 0.28 0.45 0.00 -0.57 0.00 0.00 179.45 179.34 1br2 h ALA 433 N 1.37 1.11 -0.71 3.86 0.00 -0.38 0.18 119.26 124.69 1br2 h ALA 433 Ca 0.28 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1br2 h ALA 433 Cb 0.30 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1br2 h ALA 433 CO -0.26 0.63 0.23 0.87 0.00 0.00 0.00 179.25 180.72 1br2 h LYS 434 N 1.21 1.09 -0.04 0.00 1.79 0.12 -2.20 116.57 118.54 1br2 h LYS 434 Ca 0.30 -0.22 -0.03 0.00 -2.18 0.00 0.00 60.65 58.52 1br2 h LYS 434 Cb 0.06 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.54 1br2 h LYS 434 CO -0.05 0.92 -0.10 0.35 -1.08 0.00 0.00 179.45 179.49 1br2 h PHE 435 N 1.05 0.18 -0.99 -1.35 3.57 -0.46 -2.10 116.94 116.83 1br2 h PHE 435 Ca 0.23 -0.07 0.22 0.00 3.53 0.00 0.00 57.97 61.89 1br2 h PHE 435 Cb 0.28 -0.03 -0.10 0.00 2.79 0.00 0.00 35.95 38.90 1br2 h PHE 435 CO 0.02 0.71 0.63 1.49 -2.23 0.00 0.00 178.31 178.93 1br2 h GLU 436 N -0.41 0.54 0.01 1.11 4.81 -0.52 0.36 114.58 120.48 1br2 h GLU 436 Ca -0.00 -0.03 -0.27 0.00 -0.13 0.00 0.00 59.36 58.93 1br2 h GLU 436 Cb 0.71 -0.12 0.02 0.00 0.63 0.00 0.00 28.75 29.99 1br2 h GLU 436 CO 0.02 0.36 -1.05 0.00 -0.73 0.00 0.00 179.01 177.60 1br2 h ARG 437 N 0.55 0.68 -0.38 1.92 3.08 -1.37 -0.95 114.38 117.92 1br2 h ARG 437 Ca 0.57 -0.74 -0.03 0.00 0.07 0.00 0.00 59.98 59.85 1br2 h ARG 437 Cb 1.18 0.21 -0.02 0.00 0.08 0.00 0.00 29.97 31.43 1br2 h ARG 437 CO -0.32 1.32 0.12 1.25 -1.07 0.00 0.00 179.97 181.27 1br2 h LEU 438 N 0.38 0.50 0.40 3.04 5.85 -0.47 0.14 115.31 125.14 1br2 h LEU 438 Ca -0.13 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.51 1br2 h LEU 438 Cb 1.71 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.61 1br2 h LEU 438 CO 0.20 0.48 -0.19 0.15 -0.34 0.00 0.00 178.44 178.74 1br2 h PHE 439 N 0.54 -0.49 -1.08 1.25 3.57 -0.88 -1.00 116.94 118.84 1br2 h PHE 439 Ca 0.13 -0.01 0.29 0.00 3.53 0.00 0.00 57.97 61.91 1br2 h PHE 439 Cb 0.16 0.16 -0.09 0.00 2.79 0.00 0.00 35.95 38.98 1br2 h PHE 439 CO 0.01 -0.18 0.71 -0.09 -2.23 0.00 0.00 178.31 176.52 1br2 h ARG 440 N -1.01 0.30 0.34 1.11 2.43 -0.85 0.27 114.38 116.96 1br2 h ARG 440 Ca -0.05 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 1br2 h ARG 440 Cb 0.53 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1br2 h ARG 440 CO 0.09 0.20 -0.16 2.35 -1.51 0.00 0.00 179.97 180.93 1br2 h TRP 441 N 0.31 -0.42 -0.67 2.20 7.01 -0.67 -0.32 115.95 123.39 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 1.71 0.14 -0.09 0.00 -2.10 0.00 0.00 29.16 28.82 1br2 h TRP 441 CO -0.00 -0.10 0.20 0.82 -2.79 0.00 0.00 178.44 176.56 1br2 h ILE 442 N -0.98 0.64 0.17 2.65 2.04 0.12 0.35 117.51 122.50 1br2 h ILE 442 Ca -0.05 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.70 1br2 h ILE 442 Cb 0.51 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 1br2 h ILE 442 CO 0.08 0.06 -0.18 0.25 0.00 0.00 0.00 178.15 178.35 1br2 h LEU 443 N 0.34 -0.49 -0.48 1.44 5.85 -0.52 1.00 115.31 122.44 1br2 h LEU 443 Ca 0.36 0.05 0.09 0.00 0.84 0.00 0.00 57.88 59.22 1br2 h LEU 443 Cb 0.54 0.17 -0.09 0.00 0.37 0.00 0.00 40.66 41.66 1br2 h LEU 443 CO -0.41 -0.27 -0.06 0.74 -0.34 0.00 0.00 178.44 178.10 1br2 h THR 444 N -0.39 0.57 -0.80 1.05 2.02 0.64 0.98 112.91 116.98 1br2 h THR 444 Ca 0.01 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 1br2 h THR 444 Cb 0.38 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 1br2 h THR 444 CO -0.06 0.01 0.49 -0.09 0.37 0.00 0.00 175.52 176.24 1br2 h ARG 445 N 0.05 1.08 -0.84 6.66 9.65 0.00 -1.22 114.38 129.76 1br2 h ARG 445 Ca 0.24 -0.09 -0.01 0.00 -1.10 0.00 0.00 59.98 59.01 1br2 h ARG 445 Cb 0.36 -0.23 -0.04 0.00 -1.39 0.00 0.00 29.97 28.67 1br2 h ARG 445 CO -0.45 0.76 0.48 0.28 2.80 0.00 0.00 179.97 183.84 1br2 h VAL 446 N 1.09 1.24 -0.02 0.20 2.07 0.64 -2.17 116.25 119.30 1br2 h VAL 446 Ca 0.29 -0.57 -0.09 0.00 0.82 0.00 0.00 66.70 67.15 1br2 h VAL 446 Cb -0.05 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.79 1br2 h VAL 446 CO -0.05 0.26 -0.41 0.78 0.02 0.00 0.00 177.57 178.17 1br2 h ASN 447 N 1.17 0.04 -0.23 0.57 2.35 0.16 -0.90 115.58 118.74 1br2 h ASN 447 Ca 0.30 -0.02 -0.06 0.00 -0.55 0.00 0.00 56.30 55.98 1br2 h ASN 447 Cb -0.00 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1br2 h ASN 447 CO -0.05 0.45 -0.08 0.11 -1.65 0.00 0.00 177.43 176.21 1br2 h LYS 448 N 0.04 0.46 0.00 0.81 1.57 -0.66 -1.00 116.57 117.79 1br2 h LYS 448 Ca 0.00 -0.18 -0.08 0.00 -1.87 0.00 0.00 60.65 58.51 1br2 h LYS 448 Cb 0.74 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 1br2 h LYS 448 CO 0.06 0.71 -0.40 0.00 -0.57 0.00 0.00 179.45 179.24 1br2 h ALA 449 N 0.74 1.23 0.00 3.86 0.00 -1.22 -2.85 119.26 121.01 1br2 h ALA 449 Ca 0.06 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1br2 h ALA 449 Cb 0.55 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1br2 h ALA 449 CO 0.03 0.50 -0.49 -0.07 0.00 0.00 0.00 179.25 179.21 1br2 h LEU 450 N 0.00 0.00 -9.15 0.00 3.38 -0.99 -3.49 115.31 105.06 1br2 h LEU 450 Ca -0.00 -0.14 -0.67 0.00 0.09 0.00 0.00 57.88 57.15 1br2 h LEU 450 Cb 0.75 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.33 1br2 h LEU 450 CO 0.05 0.07 -0.78 -1.81 0.09 0.00 0.00 178.44 176.06 1br2 s ASP 451 N -4.47 4.03 0.00 -0.43 1.01 -0.39 -2.72 116.67 113.70 1br2 s ASP 451 Ca 0.07 -0.53 0.00 0.00 0.71 0.00 0.00 52.55 52.80 1br2 s ASP 451 Cb 0.12 -0.62 0.00 0.00 1.01 0.00 0.00 42.92 43.43 1br2 s ASP 451 CO 0.70 0.17 0.00 0.00 0.21 0.00 0.00 175.17 176.25 1br2 n ALA 458 N 0.69 0.00 -2.97 5.23 0.00 -1.09 -4.98 120.51 117.39 1br2 n ALA 458 Ca -0.15 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.19 1br2 n ALA 458 Cb 0.53 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.86 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 0.08 0.10 0.00 1.04 -0.87 -4.97 113.70 109.08 1br2 s SER 459 Ca 0.00 -0.20 0.08 0.00 0.48 0.00 0.00 55.95 56.31 1br2 s SER 459 Cb 0.00 0.11 -0.03 0.00 0.10 0.00 0.00 66.02 66.20 1br2 s SER 459 CO 0.00 -0.19 -0.19 0.72 0.98 0.00 0.00 173.24 174.56 1br2 s PHE 460 N -0.80 1.67 -0.38 5.02 -0.12 -1.26 0.54 117.98 122.64 1br2 s PHE 460 Ca -0.09 -0.43 0.04 0.00 -0.05 0.00 0.00 56.93 56.40 1br2 s PHE 460 Cb -0.05 -0.92 0.11 0.00 -0.63 0.00 0.00 43.02 41.53 1br2 s PHE 460 CO -0.00 0.17 0.10 -1.17 -0.05 0.00 0.00 175.22 174.27 1br2 s LEU 461 N -1.88 4.69 0.46 -1.99 0.20 0.31 -2.42 118.68 118.05 1br2 s LEU 461 Ca 0.05 -2.34 -0.22 0.00 0.69 0.00 0.00 54.13 52.31 1br2 s LEU 461 Cb -0.10 -1.64 -0.08 0.00 -0.43 0.00 0.00 46.19 43.94 1br2 s LEU 461 CO 0.04 -0.35 1.08 -0.83 -0.29 0.00 0.00 176.35 175.99 1br2 s GLY 462 N 0.68 2.64 -0.05 7.98 0.00 0.46 -2.51 107.32 116.52 1br2 s GLY 462 Ca 0.12 0.72 -0.00 0.00 0.00 0.00 0.00 44.72 45.56 1br2 s GLY 462 CO -0.06 1.10 -0.01 -0.42 0.00 0.00 0.00 173.10 173.72 1br2 s ILE 463 N -1.77 0.33 -0.32 0.90 1.01 0.91 -0.63 121.20 121.63 1br2 s ILE 463 Ca 0.64 0.08 -0.02 0.00 0.00 0.00 0.00 60.65 61.35 1br2 s ILE 463 Cb -0.21 -0.45 0.06 0.00 0.01 0.00 0.00 42.46 41.86 1br2 s ILE 463 CO 0.26 0.22 0.03 -0.22 0.00 0.00 0.00 174.94 175.23 1br2 s LEU 464 N 1.53 4.10 -0.84 2.97 2.96 -0.80 -0.20 118.68 128.41 1br2 s LEU 464 Ca -0.02 -1.37 -0.02 0.00 -0.22 0.00 0.00 54.13 52.50 1br2 s LEU 464 Cb -0.13 -1.73 0.21 0.00 0.50 0.00 0.00 46.19 45.03 1br2 s LEU 464 CO -0.03 -0.30 0.70 -0.62 -1.32 0.00 0.00 176.35 174.78 1br2 s ASP 465 N 1.32 5.81 0.88 3.68 2.15 0.10 -2.76 116.67 127.85 1br2 s ASP 465 Ca -0.03 -3.56 -0.13 0.00 0.43 0.00 0.00 52.55 49.26 1br2 s ASP 465 Cb -0.20 -1.89 0.12 0.00 -0.30 0.00 0.00 42.92 40.65 1br2 s ASP 465 CO -0.01 -0.22 1.16 0.27 -0.17 0.00 0.00 175.17 176.20 1br2 s ILE 466 N -1.10 1.99 0.01 4.11 -4.36 -1.26 -1.50 121.20 119.08 1br2 s ILE 466 Ca 0.25 0.00 -0.30 0.00 -0.26 0.00 0.00 60.65 60.34 1br2 s ILE 466 Cb -0.09 -2.85 -0.03 0.00 1.25 0.00 0.00 42.46 40.73 1br2 s ILE 466 CO -0.11 0.00 1.02 0.00 0.24 0.00 0.00 174.94 176.09 1br2 s ALA 467 N -3.42 3.22 0.45 2.27 0.00 -1.26 -4.84 121.76 118.17 1br2 s ALA 467 Ca 0.64 0.59 -0.21 0.00 0.00 0.00 0.00 51.96 52.98 1br2 s ALA 467 Cb -0.13 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.54 1br2 s ALA 467 CO 0.52 -0.29 1.02 0.20 0.00 0.00 0.00 175.76 177.21 1br2 s GLY 468 N 1.03 2.55 0.08 0.00 0.00 -1.26 -4.73 107.32 104.99 1br2 s GLY 468 Ca 0.53 0.59 -0.37 0.00 0.00 0.00 0.00 44.72 45.48 1br2 s GLY 468 CO 0.28 0.93 1.26 0.33 0.00 0.00 0.00 173.10 175.90 1br2 n PHE 469 N -0.68 1.31 -3.88 1.90 7.35 -1.25 -4.00 117.46 118.21 1br2 n PHE 469 Ca 0.08 0.72 -0.11 0.00 -0.76 0.00 0.00 57.45 57.38 1br2 n PHE 469 Cb 0.52 -2.28 -0.11 0.00 0.35 0.00 0.00 39.48 37.96 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 0.28 0.30 -0.41 -4.13 -1.05 -1.26 -0.83 118.70 111.60 1br2 s GLU 470 Ca 0.84 -0.23 0.02 0.00 -0.15 0.00 0.00 54.97 55.45 1br2 s GLU 470 Cb -1.00 0.13 0.13 0.00 -0.44 0.00 0.00 34.13 32.94 1br2 s GLU 470 CO 0.49 -0.06 0.20 0.42 0.95 0.00 0.00 175.26 177.26 1br2 s ILE 471 N -0.83 1.41 0.70 1.83 1.01 -1.26 -4.89 121.20 119.17 1br2 s ILE 471 Ca -0.09 -2.35 -0.07 0.00 0.00 0.00 0.00 60.65 58.14 1br2 s ILE 471 Cb -0.05 -2.01 0.06 0.00 0.01 0.00 0.00 42.46 40.47 1br2 s ILE 471 CO 0.00 -0.83 1.01 -0.36 0.00 0.00 0.00 174.94 174.77 1br2 s PHE 472 N 0.61 2.94 0.27 3.97 0.08 -1.26 -4.96 117.98 119.62 1br2 s PHE 472 Ca 0.16 0.46 -0.01 0.00 0.12 0.00 0.00 56.93 57.66 1br2 s PHE 472 Cb -0.23 -3.17 0.52 0.00 -0.57 0.00 0.00 43.02 39.57 1br2 s PHE 472 CO -0.05 -1.38 1.79 0.93 -0.10 0.00 0.00 175.22 176.41 1br2 h GLU 473 N -0.58 0.72 -4.52 0.44 5.08 -1.99 -3.35 114.58 110.37 1br2 h GLU 473 Ca -0.44 -0.04 -0.62 0.00 -1.00 0.00 0.00 59.36 57.25 1br2 h GLU 473 Cb 1.31 -0.16 -0.37 0.00 0.50 0.00 0.00 28.75 30.03 1br2 h GLU 473 CO 0.60 0.47 -0.80 0.42 -1.00 0.00 0.00 179.01 178.71 1br2 s ILE 474 N -5.97 1.67 -0.35 3.13 -1.09 -1.26 -5.08 121.20 112.25 1br2 s ILE 474 Ca -0.12 -1.19 -0.12 0.00 -2.23 0.00 0.00 60.65 56.99 1br2 s ILE 474 Cb 0.22 -1.83 -0.00 0.00 -1.58 0.00 0.00 42.46 39.26 1br2 s ILE 474 CO 0.79 0.02 0.22 0.20 -1.23 0.00 0.00 174.94 174.94 1br2 s ASN 475 N 1.35 5.88 0.19 3.58 0.01 -1.26 -5.03 114.94 119.66 1br2 s ASN 475 Ca -0.04 -0.59 0.00 0.00 -0.71 0.00 0.00 52.86 51.52 1br2 s ASN 475 Cb -0.18 -2.09 0.00 0.00 0.41 0.00 0.00 41.25 39.39 1br2 s ASN 475 CO -0.07 -0.27 0.00 -0.24 -1.51 0.00 0.00 177.10 175.01 1br2 n SER 476 N 5.06 0.00 -0.01 -1.22 2.88 -1.26 -1.39 113.62 117.68 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 0.64 0.00 -0.75 0.00 0.00 64.21 64.59 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 -0.19 0.11 -0.01 0.66 3.57 -1.90 -1.10 116.94 118.07 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 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.71 1br2 h PHE 477 CO 0.00 0.05 0.00 0.93 -2.23 0.00 0.00 178.31 177.06 1br2 h GLU 478 N 0.10 0.01 -0.86 1.11 3.07 -1.99 -2.43 114.58 113.59 1br2 h GLU 478 Ca 0.25 -0.00 0.01 0.00 -0.50 0.00 0.00 59.36 59.12 1br2 h GLU 478 Cb 0.87 -0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.73 1br2 h GLU 478 CO -0.02 0.14 0.57 1.96 -1.40 0.00 0.00 179.01 180.25 1br2 h GLN 479 N -0.11 1.12 -0.04 2.33 7.50 -1.57 -1.09 115.11 123.25 1br2 h GLN 479 Ca 0.00 -0.07 0.01 0.00 0.50 0.00 0.00 58.65 59.10 1br2 h GLN 479 Cb 0.13 -0.25 -0.01 0.00 0.05 0.00 0.00 27.48 27.39 1br2 h GLN 479 CO -0.00 0.74 -0.04 1.25 -1.50 0.00 0.00 178.83 179.28 1br2 h LEU 480 N 1.15 -0.13 -0.34 1.46 5.85 -1.13 0.97 115.31 123.14 1br2 h LEU 480 Ca 0.32 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 59.06 1br2 h LEU 480 Cb -0.11 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1br2 h LEU 480 CO -0.07 -0.06 0.20 0.00 -0.34 0.00 0.00 178.44 178.17 1br2 h ILE 482 N 0.44 0.40 -0.21 0.00 2.04 -0.89 -0.62 117.51 118.68 1br2 h ILE 482 Ca 0.12 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.94 1br2 h ILE 482 Cb 0.02 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 1br2 h ILE 482 CO -0.02 0.00 -0.05 0.78 0.00 0.00 0.00 178.15 178.86 1br2 h ASN 483 N -0.61 0.29 -0.60 1.72 2.35 -0.72 -1.59 115.58 116.42 1br2 h ASN 483 Ca -0.02 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.64 1br2 h ASN 483 Cb 0.56 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.82 1br2 h ASN 483 CO -0.05 0.39 0.18 0.22 -1.65 0.00 0.00 177.43 176.53 1br2 h TYR 484 N 0.30 0.98 -0.35 1.19 3.20 -0.27 -0.24 116.97 121.78 1br2 h TYR 484 Ca 0.07 -0.10 -0.08 0.00 3.14 0.00 0.00 58.73 61.76 1br2 h TYR 484 Cb 0.29 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 1br2 h TYR 484 CO 0.01 0.81 -0.11 1.15 -1.64 0.00 0.00 178.16 178.37 1br2 h THR 485 N 0.86 1.24 -0.47 1.81 2.02 -0.51 0.92 112.91 118.79 1br2 h THR 485 Ca 0.19 -1.07 -0.12 0.00 0.77 0.00 0.00 66.41 66.19 1br2 h THR 485 Cb 0.30 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 1br2 h THR 485 CO -0.01 0.36 -0.18 0.78 0.37 0.00 0.00 175.52 176.85 1br2 h ASN 486 N 0.56 0.92 -0.57 4.18 2.35 -0.72 -0.12 115.58 122.18 1br2 h ASN 486 Ca 0.10 -0.32 -0.05 0.00 -0.55 0.00 0.00 56.30 55.48 1br2 h ASN 486 Cb 0.52 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 1br2 h ASN 486 CO 0.03 1.08 0.17 -0.08 -1.65 0.00 0.00 177.43 176.98 1br2 h GLU 487 N 0.80 0.89 -0.91 0.81 4.57 -0.54 -0.65 114.58 119.54 1br2 h GLU 487 Ca 0.12 -0.19 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 1br2 h GLU 487 Cb 0.72 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.14 1br2 h GLU 487 CO 0.06 0.81 0.54 0.87 -1.18 0.00 0.00 179.01 180.10 1br2 h LYS 488 N 0.80 1.24 -0.24 1.92 1.57 -0.41 -1.52 116.57 119.93 1br2 h LYS 488 Ca 0.18 -0.11 -0.14 0.00 -1.87 0.00 0.00 60.65 58.71 1br2 h LYS 488 Cb 0.29 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 1br2 h LYS 488 CO -0.00 0.87 -0.38 1.25 -0.57 0.00 0.00 179.45 180.61 1br2 h LEU 489 N 1.25 0.75 -0.88 2.94 5.85 -0.61 -1.69 115.31 122.93 1br2 h LEU 489 Ca 0.33 -0.52 0.01 0.00 0.84 0.00 0.00 57.88 58.54 1br2 h LEU 489 Cb -0.04 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.73 1br2 h LEU 489 CO -0.06 1.13 0.58 -0.61 -0.34 0.00 0.00 178.44 179.13 1br2 h GLN 490 N 0.39 1.14 -0.23 1.25 5.75 -0.88 -1.59 115.11 120.94 1br2 h GLN 490 Ca 0.02 -0.07 0.01 0.00 -0.15 0.00 0.00 58.65 58.46 1br2 h GLN 490 Cb 0.97 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 29.25 1br2 h GLN 490 CO 0.09 0.75 0.14 0.37 -2.65 0.00 0.00 178.83 177.53 1br2 h GLN 491 N 1.17 0.29 -0.86 1.69 5.75 -1.15 0.22 115.11 122.21 1br2 h GLN 491 Ca 0.33 -0.02 0.16 0.00 -0.15 0.00 0.00 58.65 58.97 1br2 h GLN 491 Cb -0.11 -0.07 -0.07 0.00 1.07 0.00 0.00 27.48 28.31 1br2 h GLN 491 CO -0.08 0.19 0.56 1.25 -2.65 0.00 0.00 178.83 178.11 1br2 h LEU 492 N 0.30 0.52 0.56 -2.39 5.85 -0.43 0.30 115.31 120.02 1br2 h LEU 492 Ca 0.09 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1br2 h LEU 492 Cb -0.02 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 40.95 1br2 h LEU 492 CO -0.03 0.25 -0.27 0.15 -0.34 0.00 0.00 178.44 178.20 1br2 h PHE 493 N 0.54 -0.70 -0.85 1.25 3.57 -0.25 -2.02 116.94 118.49 1br2 h PHE 493 Ca 0.44 -0.02 0.16 0.00 3.53 0.00 0.00 57.97 62.08 1br2 h PHE 493 Cb 0.89 0.23 -0.15 0.00 2.79 0.00 0.00 35.95 39.71 1br2 h PHE 493 CO -0.00 -0.43 -0.29 -0.91 -2.23 0.00 0.00 178.31 174.45 1br2 h ASN 494 N -0.92 -1.04 0.34 0.41 2.35 0.47 0.15 115.58 117.34 1br2 h ASN 494 Ca -0.08 0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1br2 h ASN 494 Cb 0.57 0.60 -0.03 0.00 0.05 0.00 0.00 38.32 39.52 1br2 h ASN 494 CO 0.13 -0.29 -0.40 -0.74 -1.65 0.00 0.00 177.43 174.47 1br2 h HIS 495 N -0.03 -1.11 0.32 1.19 2.76 -0.45 0.68 115.15 118.50 1br2 h HIS 495 Ca 0.36 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.53 1br2 h HIS 495 Cb 0.61 0.44 -0.01 0.00 1.55 0.00 0.00 27.41 30.00 1br2 h HIS 495 CO -0.72 -0.55 -0.24 1.15 -1.30 0.00 0.00 177.93 176.27 1br2 h THR 496 N -0.78 0.00 -0.71 6.26 2.02 -0.58 0.32 112.91 119.45 1br2 h THR 496 Ca -0.02 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.31 1br2 h THR 496 Cb 0.72 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 67.01 1br2 h THR 496 CO -0.10 0.00 0.02 0.24 0.37 0.00 0.00 175.52 176.04 1br2 h MET 497 N -0.54 0.12 0.00 6.66 2.07 -0.71 -2.56 114.93 119.96 1br2 h MET 497 Ca -0.04 -0.01 -0.33 0.00 -2.07 0.00 0.00 59.70 57.25 1br2 h MET 497 Cb 0.45 -0.03 -0.05 0.00 -1.87 0.00 0.00 31.60 30.10 1br2 h MET 497 CO 0.01 0.08 -2.16 1.19 1.07 0.00 0.00 176.91 177.10 1br2 n PHE 498 N -5.31 0.00 0.01 -0.22 3.72 0.23 -4.33 117.46 111.56 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 0.43 -0.76 -0.00 0.00 -0.94 0.00 0.00 39.48 38.20 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 -0.40 0.00 -1.01 4.37 5.03 -0.53 -3.21 117.51 121.76 1br2 h ILE 499 Ca -0.49 -0.15 0.28 0.00 -0.12 0.00 0.00 64.86 64.38 1br2 h ILE 499 Cb 1.58 0.00 -0.13 0.00 -3.03 0.00 0.00 36.82 35.23 1br2 h ILE 499 CO -0.20 0.00 0.59 -0.07 -0.68 0.00 0.00 178.15 177.78 1br2 h LEU 500 N -0.19 0.60 0.04 1.44 3.38 -0.76 0.14 115.31 119.96 1br2 h LEU 500 Ca -0.00 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1br2 h LEU 500 Cb 0.03 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1br2 h LEU 500 CO 0.01 0.00 -0.10 -0.33 0.09 0.00 0.00 178.44 178.10 1br2 h GLU 501 N 0.47 -0.16 -0.91 1.13 4.39 -1.59 -1.83 114.58 116.08 1br2 h GLU 501 Ca 0.68 0.01 0.09 0.00 0.34 0.00 0.00 59.36 60.49 1br2 h GLU 501 Cb 1.43 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 30.05 1br2 h GLU 501 CO -0.53 -0.10 0.59 1.96 -1.16 0.00 0.00 179.01 179.77 1br2 h GLN 502 N -0.16 0.91 -0.65 2.33 4.20 -1.34 -2.08 115.11 118.33 1br2 h GLN 502 Ca -0.00 -0.05 0.10 0.00 0.06 0.00 0.00 58.65 58.75 1br2 h GLN 502 Cb 0.16 -0.21 -0.07 0.00 0.30 0.00 0.00 27.48 27.66 1br2 h GLN 502 CO -0.05 0.60 0.27 0.93 -0.67 0.00 0.00 178.83 179.92 1br2 h GLU 503 N 0.94 0.46 -0.14 1.46 5.08 -0.65 0.07 114.58 121.79 1br2 h GLU 503 Ca 0.42 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.69 1br2 h GLU 503 Cb 0.37 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1br2 h GLU 503 CO -0.18 0.30 -0.19 1.49 -1.00 0.00 0.00 179.01 179.43 1br2 h GLU 504 N 0.47 0.23 0.05 2.33 4.57 -0.63 -0.42 114.58 121.18 1br2 h GLU 504 Ca 0.32 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.44 1br2 h GLU 504 Cb 0.39 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.95 1br2 h GLU 504 CO -0.30 0.43 -0.03 1.88 -1.18 0.00 0.00 179.01 179.81 1br2 h TYR 505 N 0.22 -0.08 -0.90 0.92 0.05 -0.73 -0.22 116.97 116.23 1br2 h TYR 505 Ca 0.04 -0.00 0.17 0.00 0.05 0.00 0.00 58.73 58.99 1br2 h TYR 505 Cb 0.47 0.03 -0.10 0.00 1.01 0.00 0.00 36.73 38.14 1br2 h TYR 505 CO 0.01 -0.05 0.48 0.37 -1.05 0.00 0.00 178.16 177.92 1br2 h GLN 506 N -0.08 0.60 -0.03 4.88 -0.00 -1.40 0.29 115.11 119.37 1br2 h GLN 506 Ca -0.01 -0.04 -0.00 0.00 -0.00 0.00 0.00 58.65 58.61 1br2 h GLN 506 Cb 0.06 -0.14 -0.00 0.00 0.00 0.00 0.00 27.48 27.40 1br2 h GLN 506 CO 0.01 0.40 0.01 -0.09 0.00 0.00 0.00 178.83 179.16 1br2 h ARG 507 N 0.62 0.04 -0.33 1.69 2.43 -0.91 -0.30 114.38 117.63 1br2 h ARG 507 Ca 0.51 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.68 1br2 h ARG 507 Cb 0.80 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 1br2 h ARG 507 CO -0.40 0.04 0.00 -1.91 -1.51 0.00 0.00 179.97 176.19 1br2 n GLU 508 N -4.53 2.33 -1.63 0.20 4.07 0.03 -4.93 120.64 116.18 1br2 n GLU 508 Ca -0.02 -2.00 -0.03 0.00 -0.06 0.00 0.00 57.16 55.04 1br2 n GLU 508 Cb 0.09 -1.48 -0.01 0.00 -0.06 0.00 0.00 31.44 29.98 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 1.42 0.41 3.78 8.31 0.00 -0.12 -0.14 105.19 118.85 1br2 n GLY 509 Ca 0.18 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.14 4.04 -0.79 -0.61 -1.09 -0.93 -4.88 121.20 114.79 1br2 s ILE 510 Ca 0.00 1.60 -0.25 0.00 -2.23 0.00 0.00 60.65 59.77 1br2 s ILE 510 Cb 0.00 -3.85 -0.04 0.00 -1.58 0.00 0.00 42.46 36.99 1br2 s ILE 510 CO 0.00 0.05 1.93 -0.70 -1.23 0.00 0.00 174.94 175.00 1br2 s GLU 511 N -2.31 2.55 -0.03 2.79 2.12 -1.26 -4.57 118.70 118.00 1br2 s GLU 511 Ca 0.54 0.07 -0.01 0.00 0.36 0.00 0.00 54.97 55.93 1br2 s GLU 511 Cb -0.19 -4.81 0.02 0.00 0.26 0.00 0.00 34.13 29.41 1br2 s GLU 511 CO 0.24 -3.17 0.05 -0.46 -0.54 0.00 0.00 175.26 171.38 1br2 s TRP 512 N 9.86 -0.02 -0.24 5.30 -0.11 -1.26 -5.11 118.94 127.36 1br2 s TRP 512 Ca 0.70 0.17 -0.07 0.00 1.22 0.00 0.00 56.10 58.13 1br2 s TRP 512 Cb -0.09 -0.15 -0.03 0.00 -1.50 0.00 0.00 33.47 31.70 1br2 s TRP 512 CO 0.07 -0.08 0.05 -0.80 -4.62 0.00 0.00 176.95 171.57 1br2 s ASN 513 N 0.82 5.00 0.31 5.86 -0.87 -1.26 -4.90 114.94 119.91 1br2 s ASN 513 Ca -0.07 -0.22 -0.26 0.00 -1.57 0.00 0.00 52.86 50.74 1br2 s ASN 513 Cb -0.09 -1.89 -0.14 0.00 -0.02 0.00 0.00 41.25 39.11 1br2 s ASN 513 CO -0.03 -0.01 0.83 0.33 -2.57 0.00 0.00 177.10 175.65 1br2 n PHE 514 N 4.77 0.60 -4.06 2.20 7.35 -1.26 -4.99 117.46 122.08 1br2 n PHE 514 Ca -0.17 0.71 -0.32 0.00 -0.76 0.00 0.00 57.45 56.92 1br2 n PHE 514 Cb 0.51 -2.15 -0.15 0.00 0.35 0.00 0.00 39.48 38.04 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 -1.15 2.02 -0.50 -2.13 1.01 -1.26 -5.06 121.20 114.12 1br2 s ILE 515 Ca 0.61 -1.35 -0.29 0.00 0.00 0.00 0.00 60.65 59.62 1br2 s ILE 515 Cb -0.71 -2.06 0.02 0.00 0.01 0.00 0.00 42.46 39.73 1br2 s ILE 515 CO 0.59 0.13 1.23 -0.62 0.00 0.00 0.00 174.94 176.26 1br2 s ASP 516 N 1.21 6.48 0.00 3.58 2.15 -1.26 -4.84 116.67 124.00 1br2 s ASP 516 Ca -0.04 0.43 0.12 0.00 0.43 0.00 0.00 52.55 53.49 1br2 s ASP 516 Cb -0.18 -2.55 0.56 0.00 -0.30 0.00 0.00 42.92 40.46 1br2 s ASP 516 CO -0.07 -1.39 1.39 0.49 -0.17 0.00 0.00 175.17 175.42 1br2 n PHE 517 N 8.34 0.14 -3.62 -5.34 3.01 -1.26 -4.94 117.46 113.80 1br2 n PHE 517 Ca 0.12 -0.07 -0.27 0.00 1.01 0.00 0.00 57.45 58.24 1br2 n PHE 517 Cb 0.49 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 40.00 1br2 n PHE 517 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1br2 n GLY 518 N 0.84 -0.91 2.72 1.37 0.00 -1.26 -4.99 105.19 102.96 1br2 n GLY 518 Ca 0.10 0.43 -0.19 0.00 0.00 0.00 0.00 46.02 46.36 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 -6.33 0.01 -0.06 0.99 1.43 -1.26 -5.12 118.68 108.34 1br2 s LEU 519 Ca 0.40 -1.36 -0.02 0.00 -1.03 0.00 0.00 54.13 52.12 1br2 s LEU 519 Cb -0.12 0.41 0.04 0.00 0.03 0.00 0.00 46.19 46.55 1br2 s LEU 519 CO 0.84 -0.31 0.12 -0.62 0.23 0.00 0.00 176.35 176.60 1br2 s ASP 520 N 1.73 0.14 0.00 2.29 2.15 -1.26 -4.85 116.67 116.87 1br2 s ASP 520 Ca 0.14 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 42.76 1br2 s ASP 520 CO -0.14 -0.17 1.03 0.18 -0.17 0.00 0.00 175.17 175.90 1br2 n LEU 521 N 4.46 2.40 -0.36 -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 54.67 1br2 n LEU 521 Cb 0.51 -0.04 0.09 0.00 -2.33 0.00 0.00 43.42 41.65 1br2 n LEU 521 CO 0.16 0.46 0.60 1.67 -1.33 0.00 0.00 177.39 178.95 1br2 n GLN 522 N 0.86 -0.15 0.00 3.23 -0.06 -1.26 -1.87 117.38 118.13 1br2 n GLN 522 Ca 0.10 1.50 0.00 0.00 -2.00 0.00 0.00 57.00 56.60 1br2 n GLN 522 Cb 0.40 -2.23 0.00 0.00 -4.06 0.00 0.00 30.24 24.34 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 -5.51 0.00 -0.23 3.69 -0.04 -1.26 0.38 135.00 132.03 1br2 n PRO 523 Ca 0.13 0.75 0.01 0.00 -0.04 0.00 0.00 63.50 64.35 1br2 n PRO 523 Cb 0.44 -1.32 0.09 0.00 -0.04 0.00 0.00 33.50 32.67 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 0.70 -0.24 0.00 2.04 -0.61 0.45 117.51 119.89 1br2 h ILE 525 Ca 0.34 -0.10 -0.09 0.00 1.00 0.00 0.00 64.86 66.01 1br2 h ILE 525 Cb 0.54 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1br2 h ILE 525 CO -0.65 0.05 -0.23 -0.33 0.00 0.00 0.00 178.15 176.99 1br2 h GLU 526 N 0.28 0.44 0.00 2.37 4.39 0.29 -0.62 114.58 121.74 1br2 h GLU 526 Ca 0.29 -0.16 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 -0.35 0.65 0.00 -0.11 -1.16 0.00 0.00 179.01 178.03 1br2 n LEU 527 N -4.14 0.00 -0.02 1.33 7.94 0.56 -1.43 117.00 121.25 1br2 n LEU 527 Ca -0.00 0.50 -0.03 0.00 -1.11 0.00 0.00 56.01 55.37 1br2 n LEU 527 Cb 0.38 -0.50 -0.01 0.00 0.53 0.00 0.00 43.42 43.82 1br2 n LEU 527 CO 0.41 -0.44 -0.61 -0.38 -1.11 0.00 0.00 177.39 175.26 1br2 n ILE 528 N -1.50 0.18 -0.10 1.96 5.41 -0.75 -1.41 119.36 123.16 1br2 n ILE 528 Ca 0.01 -0.06 0.11 0.00 1.00 0.00 0.00 62.75 63.80 1br2 n ILE 528 Cb 0.04 -0.99 0.25 0.00 -0.71 0.00 0.00 39.64 38.23 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 -2.82 2.60 -1.92 0.38 0.28 -0.32 -1.88 120.64 116.96 1br2 n GLU 529 Ca -0.06 -2.39 -0.27 0.00 -0.16 0.00 0.00 57.16 54.28 1br2 n GLU 529 Cb 0.55 -1.49 -0.05 0.00 1.43 0.00 0.00 31.44 31.89 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 -1.15 2.35 0.00 3.44 6.06 -0.51 -4.83 118.95 124.31 1br2 s ARG 530 Ca 0.40 0.11 0.00 0.00 -2.50 0.00 0.00 55.73 53.75 1br2 s ARG 530 Cb 0.22 -4.87 0.00 0.00 0.06 0.00 0.00 34.95 30.36 1br2 s ARG 530 CO 0.29 -3.48 0.81 -2.30 -2.50 0.00 0.00 175.30 168.12 1br2 n PRO 531 N 8.91 0.00 -0.89 5.12 -0.02 -1.26 -2.77 135.00 144.10 1br2 n PRO 531 Ca 0.38 0.32 -0.11 0.00 -2.02 0.00 0.00 63.50 62.07 1br2 n PRO 531 Cb 0.47 -1.31 0.08 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 -1.46 0.00 -1.98 3.45 -2.24 -1.26 -4.68 114.28 106.12 1br2 n THR 532 Ca 0.00 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 1br2 n THR 532 Cb 0.00 -1.68 0.00 0.00 -2.10 0.00 0.00 70.33 66.55 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 -3.27 0.00 -4.61 3.42 3.02 -1.26 -4.37 115.26 108.19 1br2 n ASN 533 Ca 0.07 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.18 1br2 n ASN 533 Cb 0.23 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.37 1br2 n ASN 533 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1br2 n PRO 534 N 14.00 2.11 -1.74 3.52 -0.04 -1.26 -4.89 135.00 146.69 1br2 n PRO 534 Ca 0.00 0.64 -0.41 0.00 -0.04 0.00 0.00 63.50 63.69 1br2 n PRO 534 Cb 0.00 -3.11 0.00 0.00 -0.04 0.00 0.00 33.50 30.36 1br2 n PRO 534 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1br2 n PRO 535 N 8.36 2.38 -4.06 0.54 -0.04 -1.26 -4.75 135.00 136.16 1br2 n PRO 535 Ca 0.28 0.84 -0.24 0.00 -0.04 0.00 0.00 63.50 64.34 1br2 n PRO 535 Cb 0.42 -2.54 -0.07 0.00 -0.04 0.00 0.00 33.50 31.27 1br2 n PRO 535 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1br2 s GLY 536 N -0.28 2.22 0.14 0.55 0.00 -1.11 -4.77 107.32 104.06 1br2 s GLY 536 Ca 0.56 -2.02 -0.32 0.00 0.00 0.00 0.00 44.72 42.94 1br2 s GLY 536 CO 0.62 -1.85 1.55 -2.08 0.00 0.00 0.00 173.10 171.33 1br2 h VAL 537 N 1.42 0.01 -0.22 1.40 2.07 -1.32 0.61 116.25 120.21 1br2 h VAL 537 Ca -0.43 0.00 0.05 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 0.67 0.00 -0.08 -0.07 0.02 0.00 0.00 177.57 178.11 1br2 h LEU 538 N -0.32 -0.29 -0.85 2.57 3.38 -1.65 -1.74 115.31 116.41 1br2 h LEU 538 Ca 0.10 0.08 -0.11 0.00 0.09 0.00 0.00 57.88 58.03 1br2 h LEU 538 Cb 0.57 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1br2 h LEU 538 CO -0.66 -0.11 -0.36 0.00 0.09 0.00 0.00 178.44 177.41 1br2 h ALA 539 N 1.16 1.02 -1.01 1.53 0.00 -1.52 -1.65 119.26 118.80 1br2 h ALA 539 Ca 0.11 -0.40 0.02 0.00 0.00 0.00 0.00 54.91 54.64 1br2 h ALA 539 Cb 0.22 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 1br2 h ALA 539 CO -0.25 0.60 0.67 -0.07 0.00 0.00 0.00 179.25 180.19 1br2 h LEU 540 N 0.36 1.14 0.80 0.00 3.38 0.65 -0.48 115.31 121.16 1br2 h LEU 540 Ca 0.04 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1br2 h LEU 540 Cb 0.80 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.27 1br2 h LEU 540 CO 0.06 0.81 -0.38 0.25 0.09 0.00 0.00 178.44 179.27 1br2 h LEU 541 N 1.34 -0.91 -1.62 1.67 5.85 -0.90 0.31 115.31 121.06 1br2 h LEU 541 Ca 0.38 0.03 0.42 0.00 0.84 0.00 0.00 57.88 59.55 1br2 h LEU 541 Cb -0.11 0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.05 1br2 h LEU 541 CO -0.09 -0.54 0.93 0.44 -0.34 0.00 0.00 178.44 178.84 1br2 h ASP 542 N -1.28 0.19 0.18 1.25 3.32 -1.04 0.90 116.42 119.92 1br2 h ASP 542 Ca -0.11 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1br2 h ASP 542 Cb 0.82 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1br2 h ASP 542 CO 0.18 -0.08 -0.08 -0.33 -1.72 0.00 0.00 179.24 177.21 1br2 h GLU 543 N 0.10 -0.23 -0.90 3.56 3.07 -0.63 -3.31 114.58 116.24 1br2 h GLU 543 Ca 0.76 0.02 0.16 0.00 -0.50 0.00 0.00 59.36 59.80 1br2 h GLU 543 Cb 2.59 0.05 -0.16 0.00 -0.84 0.00 0.00 28.75 30.39 1br2 h GLU 543 CO -0.25 0.17 -0.30 0.39 -1.40 0.00 0.00 179.01 177.61 1br2 n GLU 544 N -4.93 -0.16 -2.56 2.33 -0.58 0.30 -5.10 120.64 109.95 1br2 n GLU 544 Ca -0.07 1.40 -0.41 0.00 -0.42 0.00 0.00 57.16 57.66 1br2 n GLU 544 Cb 0.25 -2.08 -0.03 0.00 -0.57 0.00 0.00 31.44 29.01 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 9.26 0.00 -1.91 0.00 0.00 -1.26 -4.93 120.51 121.67 1br2 n ALA 550 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.22 1br2 n ALA 550 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.93 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 4.66 0.33 0.00 -4.23 -1.26 -4.91 115.64 110.22 1br2 s THR 551 Ca 0.00 0.96 0.02 0.00 -1.18 0.00 0.00 61.69 61.49 1br2 s THR 551 Cb 0.00 -3.80 0.21 0.00 1.34 0.00 0.00 72.50 70.25 1br2 s THR 551 CO 0.00 -0.90 1.93 0.44 -0.54 0.00 0.00 174.62 175.55 1br2 h ASP 552 N 0.33 0.66 -0.30 3.99 3.32 -2.00 0.10 116.42 122.52 1br2 h ASP 552 Ca -0.46 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 56.45 1br2 h ASP 552 Cb 1.19 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 1br2 h ASP 552 CO 0.62 0.59 -0.05 0.00 -1.72 0.00 0.00 179.24 178.68 1br2 h THR 553 N 0.73 1.24 -0.89 0.35 1.03 -1.92 -1.06 112.91 112.39 1br2 h THR 553 Ca 0.18 -1.01 0.01 0.00 -0.01 0.00 0.00 66.41 65.58 1br2 h THR 553 Cb 0.12 0.98 -0.04 0.00 -1.07 0.00 0.00 68.15 68.13 1br2 h THR 553 CO -0.02 0.35 0.58 -1.28 -0.01 0.00 0.00 175.52 175.14 1br2 h SER 554 N 0.63 1.02 0.22 0.00 0.87 -1.19 -1.11 113.55 113.99 1br2 h SER 554 Ca 0.12 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1br2 h SER 554 Cb 0.47 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.16 1br2 h SER 554 CO 0.02 0.75 -0.22 0.15 -0.53 0.00 0.00 176.83 177.00 1br2 h PHE 555 N 1.21 -0.59 -0.68 2.24 3.57 -0.29 -2.26 116.94 120.14 1br2 h PHE 555 Ca 0.32 0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.94 1br2 h PHE 555 Cb -0.13 0.23 -0.08 0.00 2.79 0.00 0.00 35.95 38.76 1br2 h PHE 555 CO 0.00 -0.33 0.26 0.28 -2.23 0.00 0.00 178.31 176.29 1br2 h VAL 556 N -0.48 0.72 -0.53 1.41 2.07 -0.84 0.00 116.25 118.61 1br2 h VAL 556 Ca -0.00 -0.15 0.07 0.00 0.82 0.00 0.00 66.70 67.44 1br2 h VAL 556 Cb 0.45 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.42 1br2 h VAL 556 CO -0.06 0.08 0.22 -0.33 0.02 0.00 0.00 177.57 177.51 1br2 h GLU 557 N 0.43 0.42 -0.34 1.57 3.07 -0.81 -0.84 114.58 118.07 1br2 h GLU 557 Ca 0.35 -0.02 -0.17 0.00 -0.50 0.00 0.00 59.36 59.02 1br2 h GLU 557 Cb 0.48 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 28.29 1br2 h GLU 557 CO -0.35 0.27 -0.46 1.57 -1.40 0.00 0.00 179.01 178.65 1br2 h LYS 558 N 0.43 0.90 -0.97 2.33 2.10 -0.83 -2.46 116.57 118.07 1br2 h LYS 558 Ca 0.25 -0.52 0.10 0.00 -2.00 0.00 0.00 60.65 58.48 1br2 h LYS 558 Cb 0.24 0.04 -0.07 0.00 -0.90 0.00 0.00 32.23 31.54 1br2 h LYS 558 CO -0.23 1.16 0.62 1.25 -2.00 0.00 0.00 179.45 180.25 1br2 h LEU 559 N 0.72 0.92 0.11 7.07 5.85 -0.44 -0.18 115.31 129.36 1br2 h LEU 559 Ca 0.04 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1br2 h LEU 559 Cb 1.06 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1br2 h LEU 559 CO 0.11 0.54 -0.05 0.40 -0.34 0.00 0.00 178.44 179.09 1br2 h ILE 560 N 1.01 1.06 -0.15 4.05 2.04 -1.00 0.15 117.51 124.67 1br2 h ILE 560 Ca 0.45 -0.72 0.04 0.00 1.00 0.00 0.00 64.86 65.64 1br2 h ILE 560 Cb 0.37 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 1br2 h ILE 560 CO -0.21 0.17 0.12 -0.61 0.00 0.00 0.00 178.15 177.63 1br2 h GLN 561 N -0.48 0.00 0.06 2.37 4.15 -0.90 0.41 115.11 120.71 1br2 h GLN 561 Ca -0.02 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 59.18 1br2 h GLN 561 Cb 0.39 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1br2 h GLN 561 CO 0.02 0.00 -1.17 0.93 -1.93 0.00 0.00 178.83 176.69 1br2 h GLU 562 N 0.00 0.12 0.00 1.69 4.39 -0.94 -3.45 114.58 116.39 1br2 h GLU 562 Ca 0.07 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.57 1br2 h GLU 562 Cb 0.31 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1br2 h GLU 562 CO -0.00 1.10 0.00 1.04 -1.16 0.00 0.00 179.01 179.99 1br2 n GLN 563 N -4.19 0.00 0.00 2.33 1.13 0.50 -4.90 117.38 112.25 1br2 n GLN 563 Ca -0.26 0.03 0.00 0.00 -1.94 0.00 0.00 57.00 54.83 1br2 n GLN 563 Cb 0.76 -0.32 0.00 0.00 0.11 0.00 0.00 30.24 30.79 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 1.98 0.03 0.25 1.08 0.00 0.14 -1.59 105.19 107.08 1br2 n GLY 564 Ca 0.00 0.19 -0.13 0.00 0.00 0.00 0.00 46.02 46.09 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 0.90 -0.17 1.61 4.21 -1.90 -3.37 115.58 116.85 1br2 h ASN 565 Ca 0.00 -0.45 -0.18 0.00 1.21 0.00 0.00 56.30 56.88 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 0.18 1.57 -1.29 0.00 0.00 177.43 179.04 1br2 n HIS 566 N -4.17 0.35 -0.11 1.19 -0.00 -0.62 -4.64 115.22 107.22 1br2 n HIS 566 Ca -0.02 0.23 -0.03 0.00 0.46 0.00 0.00 57.72 58.36 1br2 n HIS 566 Cb 0.49 -0.48 -0.02 0.00 -0.12 0.00 0.00 29.99 29.86 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 1.01 -0.15 -0.47 1.57 0.00 -1.26 0.14 120.51 121.34 1br2 n ALA 567 Ca 0.08 0.23 -0.11 0.00 0.00 0.00 0.00 53.44 53.63 1br2 n ALA 567 Cb -0.01 -0.05 0.04 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 -4.33 1.55 -4.17 0.00 4.76 -1.26 -4.85 118.16 109.86 1br2 n LYS 568 Ca 0.01 -1.14 -0.13 0.00 -2.87 0.00 0.00 58.31 54.18 1br2 n LYS 568 Cb 0.07 -1.45 -0.11 0.00 -1.84 0.00 0.00 35.03 31.71 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 -1.30 0.98 -0.30 2.13 2.19 0.36 -2.59 117.98 119.45 1br2 s PHE 569 Ca 0.22 -0.74 -0.12 0.00 0.33 0.00 0.00 56.93 56.63 1br2 s PHE 569 Cb 0.18 -0.54 0.12 0.00 -1.31 0.00 0.00 43.02 41.46 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 -3.11 0.60 0.70 10.12 -0.21 -0.51 -4.82 119.66 122.43 1br2 s GLN 570 Ca 0.07 1.38 -0.15 0.00 0.02 0.00 0.00 55.36 56.68 1br2 s GLN 570 Cb -0.00 0.69 0.02 0.00 1.00 0.00 0.00 33.01 34.72 1br2 s GLN 570 CO -0.01 -0.18 1.17 -1.59 -2.12 0.00 0.00 175.29 172.55 1br2 s LYS 571 N 2.59 2.39 0.00 2.91 0.00 -1.26 -0.76 119.74 125.61 1br2 s LYS 571 Ca -0.07 1.61 0.00 0.00 0.00 0.00 0.00 55.97 57.52 1br2 s LYS 571 Cb -0.10 -1.88 0.00 0.00 0.00 0.00 0.00 37.83 35.85 1br2 s LYS 571 CO -0.19 -1.61 0.00 0.45 0.00 0.00 0.00 175.35 174.00 1br2 n SER 572 N -2.60 0.00 -3.85 0.03 2.88 -1.25 -4.71 113.62 104.12 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 -5.51 -1.64 -1.46 0.00 -1.26 -5.06 118.16 103.23 1br2 n LYS 578 Ca 0.00 0.61 -0.10 0.00 -0.00 0.00 0.00 58.31 58.82 1br2 n LYS 578 Cb 0.00 -5.43 -0.03 0.00 -0.00 0.00 0.00 35.03 29.57 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 -4.61 -0.18 -3.86 0.58 -2.24 -1.26 -4.61 114.28 98.11 1br2 n THR 579 Ca -0.04 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.45 1br2 n THR 579 Cb 0.56 -1.41 -0.04 0.00 -2.10 0.00 0.00 70.33 67.35 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 -3.49 3.48 0.25 -0.78 2.02 -1.26 -0.24 118.70 118.68 1br2 s GLU 580 Ca 0.00 -0.41 -0.12 0.00 0.02 0.00 0.00 54.97 54.46 1br2 s GLU 580 Cb 0.00 -2.96 -0.01 0.00 0.10 0.00 0.00 34.13 31.26 1br2 s GLU 580 CO 0.00 0.54 0.46 -0.59 0.02 0.00 0.00 175.26 175.69 1br2 s PHE 581 N -1.64 0.42 -0.02 1.61 -0.71 -0.75 -3.93 117.98 112.96 1br2 s PHE 581 Ca 0.36 -0.78 0.05 0.00 -1.04 0.00 0.00 56.93 55.53 1br2 s PHE 581 Cb -0.12 0.15 -0.01 0.00 -1.21 0.00 0.00 43.02 41.83 1br2 s PHE 581 CO 0.28 -0.99 -0.18 0.00 -1.34 0.00 0.00 175.22 172.99 1br2 s ILE 583 N -0.26 2.24 -1.01 0.00 -1.09 -0.11 -1.42 121.20 119.56 1br2 s ILE 583 Ca 0.03 -0.97 -0.16 0.00 -2.23 0.00 0.00 60.65 57.32 1br2 s ILE 583 Cb -0.09 -1.85 0.17 0.00 -1.58 0.00 0.00 42.46 39.11 1br2 s ILE 583 CO 0.00 0.56 1.15 -0.76 -1.23 0.00 0.00 174.94 174.67 1br2 s LEU 584 N 0.13 5.45 0.56 2.97 1.43 -1.07 -1.49 118.68 126.66 1br2 s LEU 584 Ca -0.12 -2.56 -0.17 0.00 -1.03 0.00 0.00 54.13 50.26 1br2 s LEU 584 Cb -0.16 -2.35 -0.05 0.00 0.03 0.00 0.00 46.19 43.66 1br2 s LEU 584 CO 0.06 -0.82 1.05 -1.00 0.23 0.00 0.00 176.35 175.87 1br2 s HIS 585 N 1.60 3.01 0.30 0.29 3.76 0.11 -4.89 115.29 119.47 1br2 s HIS 585 Ca 0.33 1.53 0.05 0.00 -0.15 0.00 0.00 55.06 56.82 1br2 s HIS 585 Cb -0.06 -3.02 0.74 0.00 1.11 0.00 0.00 32.58 31.35 1br2 s HIS 585 CO -0.07 -1.01 1.74 0.10 -0.85 0.00 0.00 174.74 174.66 1br2 h TYR 586 N 0.78 0.90 0.00 1.40 -0.00 -1.95 0.59 116.97 118.69 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 -0.25 0.00 0.00 -0.00 0.00 0.00 36.73 37.70 1br2 h TYR 586 CO 0.58 0.11 0.00 0.00 -0.00 0.00 0.00 178.16 178.85 1br2 n ALA 587 N -2.38 2.06 0.00 0.10 0.00 -1.26 -4.80 120.51 114.23 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 0.61 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.63 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 0.85 0.67 3.56 0.00 0.00 0.21 -5.08 105.19 105.39 1br2 n GLY 588 Ca 0.05 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 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 -1.78 3.63 -0.19 1.61 2.20 -1.26 0.06 119.74 124.00 1br2 s LYS 589 Ca 0.00 -0.03 -0.06 0.00 -0.36 0.00 0.00 55.97 55.52 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 0.00 175.35 174.34 1br2 s VAL 590 N 2.65 4.20 -0.43 4.02 1.01 -0.55 -4.97 120.40 126.33 1br2 s VAL 590 Ca 0.23 -0.23 -0.11 0.00 0.00 0.00 0.00 61.98 61.86 1br2 s VAL 590 Cb -0.15 -2.89 0.07 0.00 0.00 0.00 0.00 36.38 33.42 1br2 s VAL 590 CO 0.15 0.44 0.30 0.28 0.00 0.00 0.00 175.10 176.27 1br2 s THR 591 N 0.75 4.57 0.74 3.92 -1.32 -1.26 -0.93 115.64 122.11 1br2 s THR 591 Ca 0.01 -1.27 -0.11 0.00 -1.21 0.00 0.00 61.69 59.11 1br2 s THR 591 Cb -0.14 -3.77 0.03 0.00 -1.51 0.00 0.00 72.50 67.12 1br2 s THR 591 CO 0.02 -0.52 1.10 -0.31 -2.21 0.00 0.00 174.62 172.70 1br2 s TYR 592 N 1.50 3.15 -0.27 9.09 2.02 0.17 -4.39 117.35 128.63 1br2 s TYR 592 Ca 0.03 1.07 -0.01 0.00 -0.37 0.00 0.00 57.07 57.79 1br2 s TYR 592 Cb -0.23 -3.10 0.08 0.00 -0.40 0.00 0.00 41.96 38.30 1br2 s TYR 592 CO 0.04 -1.40 0.05 1.21 -1.57 0.00 0.00 175.55 173.88 1br2 s ASN 593 N -4.22 3.74 0.00 2.29 3.04 -0.49 -1.81 114.94 117.49 1br2 s ASN 593 Ca 0.59 -1.36 0.04 0.00 0.04 0.00 0.00 52.86 52.16 1br2 s ASN 593 Cb -0.12 -0.88 0.22 0.00 -1.54 0.00 0.00 41.25 38.92 1br2 s ASN 593 CO 0.52 -0.35 0.58 0.00 -3.04 0.00 0.00 177.10 174.82 1br2 n ALA 594 N 4.84 1.85 -1.68 1.71 0.00 0.66 -4.59 120.51 123.32 1br2 n ALA 594 Ca -0.05 -0.02 -0.46 0.00 0.00 0.00 0.00 53.44 52.91 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 -0.67 3.41 0.00 0.00 7.64 -1.26 -1.20 113.62 121.54 1br2 n SER 595 Ca 0.03 1.04 0.00 0.00 1.01 0.00 0.00 58.87 60.94 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 4.70 0.00 -0.26 -0.43 0.00 -1.26 -4.87 120.51 118.39 1br2 n ALA 596 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.64 1br2 n ALA 596 Cb 0.31 -0.66 0.14 0.00 0.00 0.00 0.00 19.45 19.24 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 0.71 -0.78 0.00 4.06 -1.48 0.14 115.95 118.59 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 -0.21 -0.06 0.00 -1.00 0.00 0.00 29.16 28.10 1br2 h TRP 597 CO 0.13 0.27 0.47 -0.07 -3.56 0.00 0.00 178.44 175.68 1br2 h LEU 598 N 0.67 0.72 -0.26 -4.49 3.38 -1.90 0.18 115.31 113.62 1br2 h LEU 598 Ca 0.36 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.23 1br2 h LEU 598 Cb 0.35 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1br2 h LEU 598 CO -0.26 0.47 -0.31 0.71 0.09 0.00 0.00 178.44 179.14 1br2 h THR 599 N 0.86 1.31 -0.66 0.22 1.35 -1.75 -2.66 112.91 111.58 1br2 h THR 599 Ca 0.34 -1.49 -0.01 0.00 -0.55 0.00 0.00 66.41 64.69 1br2 h THR 599 Cb 0.17 1.67 -0.03 0.00 -1.73 0.00 0.00 68.15 68.22 1br2 h THR 599 CO -0.17 0.47 0.36 0.11 -0.25 0.00 0.00 175.52 176.05 1br2 h LYS 600 N 0.39 0.91 0.00 4.72 1.57 -0.09 0.25 116.57 124.32 1br2 h LYS 600 Ca 0.03 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 58.64 1br2 h LYS 600 Cb 0.89 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 1br2 h LYS 600 CO 0.07 0.67 -0.40 -0.97 -0.57 0.00 0.00 179.45 178.25 1br2 h ASN 601 N 0.92 0.00 0.17 0.86 -1.24 -0.62 -3.30 115.58 112.37 1br2 h ASN 601 Ca 0.23 0.00 -0.35 0.00 0.71 0.00 0.00 56.30 56.89 1br2 h ASN 601 Cb 0.02 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.07 1br2 h ASN 601 CO -0.04 0.40 -1.80 0.24 -1.29 0.00 0.00 177.43 174.94 1br2 h MET 602 N 0.00 0.35 -5.63 6.67 2.86 -1.05 0.45 114.93 118.59 1br2 h MET 602 Ca -0.00 -0.61 -0.23 0.00 -2.06 0.00 0.00 59.70 56.80 1br2 h MET 602 Cb 1.15 0.23 0.12 0.00 0.06 0.00 0.00 31.60 33.16 1br2 h MET 602 CO 0.05 1.29 -0.67 -3.47 1.06 0.00 0.00 176.91 175.17 1br2 n ASP 603 N -3.59 -6.63 -4.67 1.22 2.03 0.83 -4.80 116.55 100.94 1br2 n ASP 603 Ca -0.27 -0.62 -0.43 0.00 0.52 0.00 0.00 54.79 54.00 1br2 n ASP 603 Cb 1.06 -4.76 -0.02 0.00 -0.72 0.00 0.00 41.12 36.68 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 -4.36 4.31 0.37 -0.67 0.04 -1.26 -5.05 135.00 128.39 1br2 s PRO 604 Ca 0.33 1.37 0.08 0.00 0.04 0.00 0.00 61.00 62.81 1br2 s PRO 604 Cb -0.06 -3.61 -0.03 0.00 0.04 0.00 0.00 34.50 30.84 1br2 s PRO 604 CO 0.77 -0.52 0.30 -1.17 0.04 0.00 0.00 177.00 176.42 1br2 s LEU 605 N 2.80 3.46 -1.15 -3.56 2.96 -1.26 -4.91 118.68 117.02 1br2 s LEU 605 Ca 0.45 -0.65 -0.10 0.00 -0.22 0.00 0.00 54.13 53.61 1br2 s LEU 605 Cb -0.16 -2.06 0.25 0.00 0.50 0.00 0.00 46.19 44.71 1br2 s LEU 605 CO 0.10 -0.47 1.25 -3.20 -1.32 0.00 0.00 176.35 172.70 1br2 n ASN 606 N -1.41 5.46 -0.44 3.68 4.05 -1.26 -4.88 115.26 120.46 1br2 n ASN 606 Ca 0.00 -3.04 0.34 0.00 0.45 0.00 0.00 54.58 52.34 1br2 n ASN 606 Cb 0.61 -1.44 0.54 0.00 1.23 0.00 0.00 39.78 40.72 1br2 n ASN 606 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 177.26 173.31 1br2 n ASP 607 N 3.55 0.05 0.00 1.20 5.68 -1.26 -0.68 116.55 125.08 1br2 n ASP 607 Ca 0.28 0.78 0.00 0.00 -0.50 0.00 0.00 54.79 55.36 1br2 n ASP 607 Cb 0.40 -0.39 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 -3.58 0.00 -0.32 -1.12 5.03 -1.26 0.13 115.26 114.15 1br2 n ASN 608 Ca 0.30 0.83 0.09 0.00 0.87 0.00 0.00 54.58 56.67 1br2 n ASN 608 Cb 1.31 -0.33 0.30 0.00 -1.02 0.00 0.00 39.78 40.04 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 0.89 -0.74 2.41 3.04 -1.28 0.89 116.25 121.46 1br2 h VAL 609 Ca 0.00 -0.30 0.15 0.00 -1.01 0.00 0.00 66.70 65.55 1br2 h VAL 609 Cb 0.00 -0.05 -0.10 0.00 -2.01 0.00 0.00 31.29 29.13 1br2 h VAL 609 CO 0.00 0.16 0.23 0.74 -1.01 0.00 0.00 177.57 177.69 1br2 h THR 610 N 0.86 0.58 -0.28 3.17 2.02 -0.75 -0.63 112.91 117.88 1br2 h THR 610 Ca 0.47 -0.12 -0.07 0.00 0.77 0.00 0.00 66.41 67.46 1br2 h THR 610 Cb 0.58 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 1br2 h THR 610 CO -0.23 0.06 -0.09 -1.28 0.37 0.00 0.00 175.52 174.34 1br2 h SER 611 N 0.34 0.57 -0.75 4.18 0.87 0.22 -1.37 113.55 117.62 1br2 h SER 611 Ca 0.41 -0.38 0.15 0.00 -1.23 0.00 0.00 61.79 60.75 1br2 h SER 611 Cb 0.68 -0.16 -0.14 0.00 -0.44 0.00 0.00 62.40 62.34 1br2 h SER 611 CO -0.46 0.83 -0.16 -0.07 -0.53 0.00 0.00 176.83 176.44 1br2 h LEU 612 N 0.32 -0.64 -0.64 2.23 3.38 -0.48 0.50 115.31 119.98 1br2 h LEU 612 Ca 0.07 0.22 -0.11 0.00 0.09 0.00 0.00 57.88 58.15 1br2 h LEU 612 Cb 0.59 0.44 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 1br2 h LEU 612 CO 0.03 -0.24 -0.14 -0.07 0.09 0.00 0.00 178.44 178.11 1br2 h LEU 613 N 0.01 0.92 -1.92 1.67 3.38 -1.15 -2.42 115.31 115.80 1br2 h LEU 613 Ca 0.37 -0.31 0.28 0.00 0.09 0.00 0.00 57.88 58.31 1br2 h LEU 613 Cb 0.58 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 1br2 h LEU 613 CO -0.75 1.06 0.71 -1.13 0.09 0.00 0.00 178.44 178.41 1br2 h ASN 614 N 0.81 0.06 -2.04 -0.43 -1.24 0.11 -0.77 115.58 112.08 1br2 h ASN 614 Ca 0.12 0.01 -0.57 0.00 0.71 0.00 0.00 56.30 56.57 1br2 h ASN 614 Cb 0.68 -0.00 -0.42 0.00 0.73 0.00 0.00 38.32 39.31 1br2 h ASN 614 CO 0.05 0.02 -0.75 0.00 -1.29 0.00 0.00 177.43 175.46 1br2 n GLN 615 N -4.28 2.94 -2.86 6.67 6.02 -0.73 -4.73 117.38 120.40 1br2 n GLN 615 Ca 0.21 -4.55 -0.37 0.00 -0.01 0.00 0.00 57.00 52.28 1br2 n GLN 615 Cb 1.02 -2.14 -0.06 0.00 1.02 0.00 0.00 30.24 30.08 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 -3.35 7.27 0.65 1.08 0.15 -0.30 -4.89 113.70 114.30 1br2 s SER 616 Ca 0.47 1.73 0.37 0.00 0.70 0.00 0.00 55.95 59.21 1br2 s SER 616 Cb 0.32 -2.54 2.02 0.00 -1.71 0.00 0.00 66.02 64.11 1br2 s SER 616 CO -0.14 -0.04 2.18 0.77 1.20 0.00 0.00 173.24 177.21 1br2 h SER 617 N 3.24 0.00 -3.49 5.45 4.64 -1.34 -3.38 113.55 118.67 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 0.65 0.00 -0.11 -0.62 -0.87 0.00 0.00 176.83 175.88 1br2 s ASP 618 N -5.09 6.49 0.06 4.97 -1.08 -1.26 -4.99 116.67 115.77 1br2 s ASP 618 Ca -0.04 0.58 -0.25 0.00 -0.52 0.00 0.00 52.55 52.32 1br2 s ASP 618 Cb 0.12 -2.26 -0.17 0.00 -1.46 0.00 0.00 42.92 39.15 1br2 s ASP 618 CO 0.40 -0.15 1.60 0.07 0.52 0.00 0.00 175.17 177.61 1br2 h LYS 619 N 7.50 -0.17 -0.51 4.34 5.09 -1.96 -0.78 116.57 130.08 1br2 h LYS 619 Ca -0.34 0.01 0.09 0.00 0.09 0.00 0.00 60.65 60.50 1br2 h LYS 619 Cb 1.16 0.04 -0.08 0.00 0.10 0.00 0.00 32.23 33.45 1br2 h LYS 619 CO 0.72 -0.02 0.07 0.35 -2.09 0.00 0.00 179.45 178.49 1br2 h PHE 620 N -0.29 0.10 0.30 0.07 3.57 -1.94 0.96 116.94 119.72 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 -0.03 -0.04 -0.29 0.28 -2.23 0.00 0.00 178.31 175.99 1br2 h VAL 621 N 0.20 0.39 -0.78 1.41 2.07 -1.88 0.15 116.25 117.82 1br2 h VAL 621 Ca 0.26 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.92 1br2 h VAL 621 Cb 0.37 0.39 -0.10 0.00 -1.52 0.00 0.00 31.29 30.43 1br2 h VAL 621 CO -0.36 0.00 0.33 0.00 0.02 0.00 0.00 177.57 177.56 1br2 h ALA 622 N -0.03 1.12 0.64 1.67 0.00 0.37 -0.37 119.26 122.65 1br2 h ALA 622 Ca -0.01 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1br2 h ALA 622 Cb 0.56 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1br2 h ALA 622 CO -0.05 -0.19 -0.44 -0.44 0.00 0.00 0.00 179.25 178.14 1br2 h ASP 623 N 0.48 -1.12 -1.11 0.00 5.19 0.16 -0.64 116.42 119.37 1br2 h ASP 623 Ca 0.43 0.07 0.37 0.00 -0.62 0.00 0.00 57.03 57.28 1br2 h ASP 623 Cb 0.65 0.34 -0.14 0.00 0.18 0.00 0.00 39.33 40.36 1br2 h ASP 623 CO -0.40 -0.65 0.67 -0.07 -3.12 0.00 0.00 179.24 175.67 1br2 h LEU 624 N -1.03 0.39 -3.82 1.55 3.38 0.64 0.80 115.31 117.23 1br2 h LEU 624 Ca -0.08 0.17 -0.57 0.00 0.09 0.00 0.00 57.88 57.49 1br2 h LEU 624 Cb 0.84 0.13 -0.34 0.00 0.09 0.00 0.00 40.66 41.39 1br2 h LEU 624 CO 0.05 -0.16 -0.05 0.79 0.09 0.00 0.00 178.44 179.16 1br2 n TRP 625 N -4.90 2.79 0.14 1.13 7.02 -0.28 -4.97 117.44 118.37 1br2 n TRP 625 Ca 0.34 -2.48 0.00 0.00 -1.02 0.00 0.00 57.50 54.33 1br2 n TRP 625 Cb 1.16 -0.81 0.16 0.00 -2.42 0.00 0.00 31.31 29.40 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 0.63 -3.39 116.57 116.36 1br2 h LYS 626 Ca 0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.24 1br2 h LYS 626 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 1br2 h LYS 626 CO 1.06 0.60 -0.45 -2.13 -0.57 0.00 0.00 179.45 177.96 1br2 n ARG 657 N -3.60 0.24 -1.69 3.15 0.00 -1.26 -5.11 116.66 108.38 1br2 n ARG 657 Ca -0.00 0.10 -0.32 0.00 -0.00 0.00 0.00 57.85 57.62 1br2 n ARG 657 Cb 0.65 -0.90 0.04 0.00 0.00 0.00 0.00 32.46 32.25 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 -1.90 3.76 0.15 5.15 -4.23 -1.26 -4.79 115.64 112.52 1br2 s THR 658 Ca -0.13 0.68 -0.25 0.00 -1.18 0.00 0.00 61.69 60.81 1br2 s THR 658 Cb 0.02 -3.28 0.01 0.00 1.34 0.00 0.00 72.50 70.58 1br2 s THR 658 CO 0.19 -0.64 1.60 0.58 -0.54 0.00 0.00 174.62 175.81 1br2 h VAL 659 N -0.33 0.25 -0.50 2.29 2.07 -1.20 0.30 116.25 119.13 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 1.22 0.25 -0.10 0.00 -1.52 0.00 0.00 31.29 31.14 1br2 h VAL 659 CO 0.56 0.00 -0.25 1.23 0.02 0.00 0.00 177.57 179.12 1br2 h GLY 660 N -0.34 0.05 0.44 2.17 0.00 -1.92 -0.18 103.07 103.29 1br2 h GLY 660 Ca 0.13 0.33 0.05 0.00 0.00 0.00 0.00 47.33 47.84 1br2 h GLY 660 CO -0.44 -0.22 -0.10 1.46 0.00 0.00 0.00 176.54 177.25 1br2 h GLN 661 N -0.14 -0.05 -0.92 4.80 4.20 -1.57 -1.51 115.11 119.91 1br2 h GLN 661 Ca 0.23 0.00 0.10 0.00 0.06 0.00 0.00 58.65 59.04 1br2 h GLN 661 Cb 0.50 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.21 1br2 h GLN 661 CO -0.58 -0.04 0.56 -0.07 -0.67 0.00 0.00 178.83 178.03 1br2 h LEU 662 N -0.06 0.82 0.29 1.46 3.38 0.22 -2.18 115.31 119.24 1br2 h LEU 662 Ca 0.12 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1br2 h LEU 662 Cb 0.24 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1br2 h LEU 662 CO -0.28 0.46 -0.14 0.22 0.09 0.00 0.00 178.44 178.80 1br2 h TYR 663 N 0.92 -0.36 -0.87 1.13 3.20 -0.36 -2.34 116.97 118.30 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 0.39 0.12 -0.16 0.00 1.54 0.00 0.00 36.73 38.62 1br2 h TYR 663 CO -0.03 -0.09 -0.20 0.87 -1.64 0.00 0.00 178.16 177.07 1br2 h LYS 664 N -0.59 0.00 0.44 1.82 1.57 -0.79 0.39 116.57 119.41 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 0.43 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1br2 h LYS 664 CO 0.06 0.00 -0.49 0.93 -0.57 0.00 0.00 179.45 179.39 1br2 h GLU 665 N 0.01 -0.90 -0.72 3.15 5.08 -1.21 0.21 114.58 120.19 1br2 h GLU 665 Ca 0.43 0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.98 1br2 h GLU 665 Cb 0.67 0.20 -0.09 0.00 0.50 0.00 0.00 28.75 30.03 1br2 h GLU 665 CO -0.89 -0.60 0.28 0.37 -1.00 0.00 0.00 179.01 177.17 1br2 h GLN 666 N -0.93 0.42 0.04 2.33 4.15 -0.48 0.62 115.11 121.25 1br2 h GLN 666 Ca -0.05 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.34 1br2 h GLN 666 Cb 0.82 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.42 1br2 h GLN 666 CO -0.08 0.28 -0.02 1.25 -1.93 0.00 0.00 178.83 178.32 1br2 h LEU 667 N 0.43 -0.05 -0.79 -2.39 5.85 -0.03 -1.69 115.31 116.64 1br2 h LEU 667 Ca 0.39 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.08 1br2 h LEU 667 Cb 0.57 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 1br2 h LEU 667 CO -0.39 -0.01 0.46 0.71 -0.34 0.00 0.00 178.44 178.88 1br2 h THR 668 N -0.08 1.23 -0.69 1.05 1.35 -0.12 0.24 112.91 115.89 1br2 h THR 668 Ca -0.01 -0.53 0.03 0.00 -0.55 0.00 0.00 66.41 65.36 1br2 h THR 668 Cb 0.07 0.14 -0.04 0.00 -1.73 0.00 0.00 68.15 66.59 1br2 h THR 668 CO 0.01 0.25 0.45 0.11 -0.25 0.00 0.00 175.52 176.09 1br2 h LYS 669 N 1.09 0.80 0.49 4.72 1.57 -0.68 -0.90 116.57 123.68 1br2 h LYS 669 Ca 0.28 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.99 1br2 h LYS 669 Cb -0.01 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.12 1br2 h LYS 669 CO -0.05 0.53 -0.24 1.25 -0.57 0.00 0.00 179.45 180.38 1br2 h LEU 670 N 0.83 -0.56 -0.94 2.94 5.85 -0.21 -2.11 115.31 121.11 1br2 h LEU 670 Ca 0.27 0.02 0.28 0.00 0.84 0.00 0.00 57.88 59.29 1br2 h LEU 670 Cb 0.06 0.15 -0.16 0.00 0.37 0.00 0.00 40.66 41.08 1br2 h LEU 670 CO -0.08 -0.17 0.27 0.24 -0.34 0.00 0.00 178.44 178.36 1br2 h MET 671 N -1.12 0.14 0.45 1.25 2.86 -0.44 0.27 114.93 118.35 1br2 h MET 671 Ca -0.07 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 1br2 h MET 671 Cb 0.51 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1br2 h MET 671 CO 0.11 0.09 -0.22 1.15 1.06 0.00 0.00 176.91 179.11 1br2 h THR 672 N 0.15 0.56 -0.58 2.22 2.02 -1.16 0.51 112.91 116.62 1br2 h THR 672 Ca 0.63 -0.12 0.12 0.00 0.77 0.00 0.00 66.41 67.81 1br2 h THR 672 Cb 1.37 0.62 -0.09 0.00 -1.74 0.00 0.00 68.15 68.30 1br2 h THR 672 CO -0.73 0.02 0.04 0.74 0.37 0.00 0.00 175.52 175.97 1br2 h THR 673 N -0.67 0.56 -0.91 3.16 2.02 -0.13 0.40 112.91 117.35 1br2 h THR 673 Ca -0.06 -0.06 0.01 0.00 0.77 0.00 0.00 66.41 67.07 1br2 h THR 673 Cb 0.50 0.39 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 1br2 h THR 673 CO 0.10 0.03 0.61 -0.07 0.37 0.00 0.00 175.52 176.56 1br2 h LEU 674 N 0.16 1.05 -2.15 2.58 3.38 -0.22 -1.05 115.31 119.06 1br2 h LEU 674 Ca 0.30 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1br2 h LEU 674 Cb 0.48 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1br2 h LEU 674 CO -0.46 0.75 0.00 0.03 0.09 0.00 0.00 178.44 178.86 1br2 h ARG 675 N 1.23 0.00 -0.98 1.13 -0.00 0.44 -1.84 114.38 114.36 1br2 h ARG 675 Ca 0.34 0.00 -0.46 0.00 -0.50 0.00 0.00 59.98 59.36 1br2 h ARG 675 Cb -0.13 0.00 -0.27 0.00 0.00 0.00 0.00 29.97 29.56 1br2 h ARG 675 CO -0.08 0.00 0.58 0.09 0.00 0.00 0.00 179.97 180.56 1br2 n ASN 676 N -4.31 3.77 -3.89 7.04 3.02 -0.40 -4.91 115.26 115.59 1br2 n ASN 676 Ca -0.03 -3.45 -0.10 0.00 -0.03 0.00 0.00 54.58 50.97 1br2 n ASN 676 Cb 0.09 -0.81 -0.09 0.00 -0.61 0.00 0.00 39.78 38.36 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 -3.02 0.11 -0.45 3.41 -4.23 -0.69 -4.62 115.64 106.15 1br2 s THR 677 Ca 0.52 -0.89 -0.29 0.00 -1.18 0.00 0.00 61.69 59.85 1br2 s THR 677 Cb 0.44 -0.71 0.02 0.00 1.34 0.00 0.00 72.50 73.59 1br2 s THR 677 CO 0.10 -0.49 1.22 0.21 -0.54 0.00 0.00 174.62 175.12 1br2 s ASN 678 N -1.82 6.56 0.42 3.99 2.47 0.51 -4.83 114.94 122.25 1br2 s ASN 678 Ca -0.09 0.62 -0.22 0.00 0.42 0.00 0.00 52.86 53.59 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 -1.29 0.98 -2.16 -3.72 0.00 0.00 177.10 170.90 1br2 s PRO 679 N 4.55 4.18 -0.27 0.43 0.04 -1.26 -1.20 135.00 141.48 1br2 s PRO 679 Ca 0.52 1.25 -0.03 0.00 0.04 0.00 0.00 61.00 62.77 1br2 s PRO 679 Cb -0.10 -2.29 0.09 0.00 0.04 0.00 0.00 34.50 32.25 1br2 s PRO 679 CO 0.31 -0.09 0.11 -0.80 0.04 0.00 0.00 177.00 176.58 1br2 s ASN 680 N -1.98 3.44 0.09 6.66 0.01 0.14 -4.91 114.94 118.39 1br2 s ASN 680 Ca 0.61 -1.24 -0.26 0.00 -0.71 0.00 0.00 52.86 51.27 1br2 s ASN 680 Cb -0.13 -0.45 -0.06 0.00 0.41 0.00 0.00 41.25 41.01 1br2 s ASN 680 CO 0.18 -0.41 0.79 -0.36 -1.51 0.00 0.00 177.10 175.78 1br2 s PHE 681 N 2.00 3.80 -0.21 2.20 0.40 -1.26 0.11 117.98 125.02 1br2 s PHE 681 Ca 0.08 1.56 0.01 0.00 -0.60 0.00 0.00 56.93 57.98 1br2 s PHE 681 Cb -0.16 -2.83 0.04 0.00 0.51 0.00 0.00 43.02 40.58 1br2 s PHE 681 CO -0.29 0.35 -0.13 0.08 0.70 0.00 0.00 175.22 175.92 1br2 s VAL 682 N -0.42 1.91 -0.46 -0.44 1.01 0.53 -2.78 120.40 119.75 1br2 s VAL 682 Ca 0.38 -1.16 -0.18 0.00 0.00 0.00 0.00 61.98 61.02 1br2 s VAL 682 Cb -0.22 -1.91 0.04 0.00 0.00 0.00 0.00 36.38 34.29 1br2 s VAL 682 CO 0.25 0.22 0.54 -0.13 0.00 0.00 0.00 175.10 175.98 1br2 s ARG 683 N 1.28 3.13 -0.26 2.72 1.81 0.13 -0.64 118.95 127.13 1br2 s ARG 683 Ca -0.02 -0.76 -0.21 0.00 -1.72 0.00 0.00 55.73 53.02 1br2 s ARG 683 Cb -0.16 -4.02 -0.02 0.00 -0.45 0.00 0.00 34.95 30.30 1br2 s ARG 683 CO -0.09 -1.02 0.65 0.00 -0.68 0.00 0.00 175.30 174.17 1br2 s ILE 685 N 2.56 5.35 -0.17 0.00 -1.09 0.19 -4.28 121.20 123.76 1br2 s ILE 685 Ca 0.27 0.15 -0.14 0.00 -2.23 0.00 0.00 60.65 58.71 1br2 s ILE 685 Cb -0.15 -3.34 -0.05 0.00 -1.58 0.00 0.00 42.46 37.34 1br2 s ILE 685 CO 0.09 0.59 0.29 -0.51 -1.23 0.00 0.00 174.94 174.17 1br2 s ILE 686 N -0.75 5.30 0.02 2.92 2.07 -1.26 -1.59 121.20 127.91 1br2 s ILE 686 Ca 0.13 0.54 -0.20 0.00 -1.41 0.00 0.00 60.65 59.71 1br2 s ILE 686 Cb -0.12 -3.63 -0.18 0.00 0.13 0.00 0.00 42.46 38.66 1br2 s ILE 686 CO 0.03 0.37 1.22 1.55 -1.91 0.00 0.00 174.94 176.20 1br2 h PRO 687 N 6.82 0.40 -4.48 3.50 0.13 -1.86 -3.41 132.00 133.10 1br2 h PRO 687 Ca -0.40 -0.30 -0.38 0.00 -0.87 0.00 0.00 66.00 64.05 1br2 h PRO 687 Cb 1.16 0.06 -0.10 0.00 0.13 0.00 0.00 31.00 32.25 1br2 h PRO 687 CO 0.75 0.93 -0.31 0.54 -0.23 0.00 0.00 178.00 179.68 1br2 s ASN 688 N -6.43 1.36 -0.03 1.44 2.20 -1.24 -0.36 114.94 111.87 1br2 s ASN 688 Ca -0.14 -1.65 0.13 0.00 -0.94 0.00 0.00 52.86 50.27 1br2 s ASN 688 Cb 0.04 0.63 0.39 0.00 -2.00 0.00 0.00 41.25 40.32 1br2 s ASN 688 CO 0.79 -1.22 1.33 1.41 -2.94 0.00 0.00 177.10 176.46 1br2 n HIS 689 N -0.62 0.63 -1.12 1.54 8.25 -1.26 -4.47 115.22 118.18 1br2 n HIS 689 Ca 0.04 -0.55 -0.02 0.00 -0.26 0.00 0.00 57.72 56.93 1br2 n HIS 689 Cb 0.62 -0.07 0.27 0.00 1.12 0.00 0.00 29.99 31.92 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 0.53 3.08 -2.99 -0.41 4.71 -1.26 -4.90 120.64 119.40 1br2 n GLU 690 Ca 0.15 -3.04 -0.12 0.00 -0.01 0.00 0.00 57.16 54.14 1br2 n GLU 690 Cb 0.53 -2.03 -0.02 0.00 -1.01 0.00 0.00 31.44 28.91 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 -0.48 -2.51 -3.77 3.49 5.02 -1.26 -4.85 118.16 113.80 1br2 n LYS 691 Ca 0.34 0.14 -0.37 0.00 -2.02 0.00 0.00 58.31 56.40 1br2 n LYS 691 Cb 1.19 -4.68 -0.06 0.00 -0.02 0.00 0.00 35.03 31.45 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 -5.55 3.71 0.05 1.97 3.52 -1.26 -5.02 118.95 116.36 1br2 s ARG 692 Ca 0.21 -0.04 -0.17 0.00 -0.13 0.00 0.00 55.73 55.60 1br2 s ARG 692 Cb -0.12 -3.25 -0.06 0.00 -1.56 0.00 0.00 34.95 29.96 1br2 s ARG 692 CO 0.25 0.64 0.50 0.00 -0.81 0.00 0.00 175.30 175.89 1br2 s ALA 693 N -0.68 3.63 -0.00 6.12 0.00 -1.26 -4.03 121.76 125.53 1br2 s ALA 693 Ca 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1br2 s ALA 693 Cb -0.13 -2.53 0.00 0.00 0.00 0.00 0.00 23.12 20.47 1br2 s ALA 693 CO 0.05 0.44 0.00 0.41 0.00 0.00 0.00 175.76 176.65 1br2 n GLY 694 N 1.68 0.49 3.02 0.00 0.00 -1.26 -4.99 105.19 104.13 1br2 n GLY 694 Ca -0.11 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.16 1.61 -0.44 1.61 2.20 -1.26 -5.06 119.74 118.24 1br2 s LYS 695 Ca 0.00 -1.96 -0.19 0.00 -0.36 0.00 0.00 55.97 53.46 1br2 s LYS 695 Cb 0.00 -3.27 0.03 0.00 -1.51 0.00 0.00 37.83 33.08 1br2 s LYS 695 CO 0.00 -0.98 0.54 -1.17 -0.36 0.00 0.00 175.35 173.39 1br2 s LEU 696 N 0.78 4.74 -1.06 5.43 0.20 -1.26 -3.72 118.68 123.79 1br2 s LEU 696 Ca 0.11 -0.58 -0.22 0.00 0.69 0.00 0.00 54.13 54.13 1br2 s LEU 696 Cb -0.20 -2.53 0.05 0.00 -0.43 0.00 0.00 46.19 43.08 1br2 s LEU 696 CO -0.07 -0.70 1.53 -0.62 -0.29 0.00 0.00 176.35 176.20 1br2 s ASP 697 N 2.01 6.47 0.25 3.68 -1.08 0.51 -4.88 116.67 123.63 1br2 s ASP 697 Ca 0.17 -1.58 0.09 0.00 -0.52 0.00 0.00 52.55 50.70 1br2 s ASP 697 Cb -0.16 -2.57 0.79 0.00 -1.46 0.00 0.00 42.92 39.52 1br2 s ASP 697 CO 0.15 -1.53 1.17 0.00 0.52 0.00 0.00 175.17 175.48 1br2 n ALA 698 N 9.12 0.58 0.08 3.66 0.00 -1.26 -0.15 120.51 132.54 1br2 n ALA 698 Ca 0.36 0.77 -0.15 0.00 0.00 0.00 0.00 53.44 54.42 1br2 n ALA 698 Cb 0.50 -0.67 -0.14 0.00 0.00 0.00 0.00 19.45 19.14 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 0.42 -0.54 0.00 3.86 -1.90 -1.13 115.15 115.86 1br2 h HIS 699 Ca 0.54 -0.31 -0.07 0.00 -1.16 0.00 0.00 60.37 59.38 1br2 h HIS 699 Cb 1.31 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.74 1br2 h HIS 699 CO -0.18 1.29 0.06 1.25 0.86 0.00 0.00 177.93 181.21 1br2 h LEU 700 N 0.06 0.83 -0.06 2.43 5.85 -0.87 0.88 115.31 124.44 1br2 h LEU 700 Ca -0.18 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.34 1br2 h LEU 700 Cb 1.98 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.79 1br2 h LEU 700 CO 0.17 0.86 -0.04 0.58 -0.34 0.00 0.00 178.44 179.67 1br2 h VAL 701 N 0.83 1.35 -0.55 1.05 2.07 -0.89 -2.22 116.25 117.88 1br2 h VAL 701 Ca 0.17 -1.12 0.06 0.00 0.82 0.00 0.00 66.70 66.63 1br2 h VAL 701 Cb 0.41 1.97 -0.05 0.00 -1.52 0.00 0.00 31.29 32.10 1br2 h VAL 701 CO 0.01 0.31 0.26 -0.07 0.02 0.00 0.00 177.57 178.09 1br2 h LEU 702 N -0.28 0.34 -0.72 2.57 3.38 -0.88 0.19 115.31 119.91 1br2 h LEU 702 Ca 0.01 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.04 1br2 h LEU 702 Cb 0.51 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1br2 h LEU 702 CO 0.01 0.23 0.47 -0.33 0.09 0.00 0.00 178.44 178.91 1br2 h GLU 703 N 0.49 0.92 -0.28 1.13 5.08 -0.79 -0.67 114.58 120.46 1br2 h GLU 703 Ca 0.25 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 1br2 h GLU 703 Cb 0.21 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1br2 h GLU 703 CO -0.20 0.61 0.08 1.96 -1.00 0.00 0.00 179.01 180.45 1br2 h GLN 704 N 0.95 0.44 -0.37 2.33 4.20 -0.68 -1.41 115.11 120.57 1br2 h GLN 704 Ca 0.27 -0.10 0.11 0.00 0.06 0.00 0.00 58.65 58.99 1br2 h GLN 704 Cb -0.07 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 1br2 h GLN 704 CO -0.08 0.52 0.28 -0.07 -0.67 0.00 0.00 178.83 178.81 1br2 h LEU 705 N 0.29 0.00 0.45 1.46 3.38 -0.17 -2.32 115.31 118.40 1br2 h LEU 705 Ca 0.09 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1br2 h LEU 705 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1br2 h LEU 705 CO -0.00 0.00 -0.21 0.03 0.09 0.00 0.00 178.44 178.34 1br2 h ARG 706 N 0.00 -0.58 0.00 1.13 3.08 -0.04 -2.79 114.38 115.18 1br2 h ARG 706 Ca 0.18 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1br2 h ARG 706 Cb 0.74 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.92 1br2 h ARG 706 CO -0.00 -0.37 0.00 0.00 -1.07 0.00 0.00 179.97 178.53 1br2 n ASN 708 N -1.52 0.82 -0.83 0.00 5.03 -0.88 -4.92 115.26 112.94 1br2 n ASN 708 Ca 0.04 -0.62 -0.11 0.00 0.87 0.00 0.00 54.58 54.76 1br2 n ASN 708 Cb 0.19 0.27 -0.05 0.00 -1.02 0.00 0.00 39.78 39.17 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 1.43 1.19 0.30 7.41 0.00 -0.86 -4.90 105.19 109.76 1br2 n GLY 709 Ca 0.08 -0.36 0.08 0.00 0.00 0.00 0.00 46.02 45.82 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 0.64 -0.32 1.61 2.07 -1.74 0.75 116.25 119.25 1br2 h VAL 710 Ca -0.22 -0.17 -0.15 0.00 0.82 0.00 0.00 66.70 66.97 1br2 h VAL 710 Cb 0.81 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1br2 h VAL 710 CO 0.33 0.09 -0.39 -0.07 0.02 0.00 0.00 177.57 177.55 1br2 h LEU 711 N 0.51 0.91 -0.97 2.57 3.38 -1.91 -1.96 115.31 117.83 1br2 h LEU 711 Ca 0.47 -0.49 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1br2 h LEU 711 Cb 0.74 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1br2 h LEU 711 CO -0.42 1.21 -0.38 -0.33 0.09 0.00 0.00 178.44 178.61 1br2 h GLU 712 N 0.62 0.26 0.00 1.13 3.07 -1.72 0.97 114.58 118.91 1br2 h GLU 712 Ca 0.04 -0.11 -0.01 0.00 -0.50 0.00 0.00 59.36 58.78 1br2 h GLU 712 Cb 0.99 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.89 1br2 h GLU 712 CO 0.09 0.61 -0.03 0.78 -1.40 0.00 0.00 179.01 179.06 1br2 h GLY 713 N 1.17 0.00 0.67 -3.84 0.00 0.69 -2.18 103.07 99.59 1br2 h GLY 713 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.03 1br2 h GLY 713 CO 0.06 0.00 -1.93 1.39 0.00 0.00 0.00 176.54 176.06 1br2 n ILE 714 N -3.14 1.56 0.20 2.60 5.41 -0.69 -3.68 119.36 121.63 1br2 n ILE 714 Ca 0.01 -0.80 -0.15 0.00 1.00 0.00 0.00 62.75 62.81 1br2 n ILE 714 Cb 0.33 -0.93 -0.08 0.00 -0.71 0.00 0.00 39.64 38.25 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 0.00 -0.46 -0.54 0.38 2.47 -0.49 -2.24 114.38 113.50 1br2 h ARG 715 Ca -0.37 0.03 0.07 0.00 -1.26 0.00 0.00 59.98 58.45 1br2 h ARG 715 Cb 2.08 0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 30.47 1br2 h ARG 715 CO 0.06 -0.23 0.36 0.97 0.56 0.00 0.00 179.97 181.69 1br2 h ILE 716 N -0.61 0.95 0.00 2.04 6.09 -1.59 1.07 117.51 125.45 1br2 h ILE 716 Ca -0.05 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 63.29 1br2 h ILE 716 Cb 0.45 0.48 0.00 0.00 0.47 0.00 0.00 36.82 38.21 1br2 h ILE 716 CO 0.08 0.08 0.00 0.00 -3.07 0.00 0.00 178.15 175.24 1br2 n ARG 718 N -2.68 0.52 0.25 0.00 1.74 0.15 -4.21 116.66 112.44 1br2 n ARG 718 Ca 0.02 0.29 0.17 0.00 -0.77 0.00 0.00 57.85 57.56 1br2 n ARG 718 Cb 0.28 -1.50 0.89 0.00 -1.02 0.00 0.00 32.46 31.12 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 0.86 -3.44 115.11 121.29 1br2 h GLN 719 Ca -0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1br2 h GLN 719 Cb 0.93 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.71 1br2 h GLN 719 CO -0.03 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.54 1br2 n GLY 720 N -1.19 4.62 2.67 3.46 0.00 -0.20 -5.03 105.19 109.51 1br2 n GLY 720 Ca -0.02 -1.86 -0.29 0.00 0.00 0.00 0.00 46.02 43.84 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 2.09 1.69 0.08 1.61 0.40 -1.26 -4.63 117.98 117.96 1br2 s PHE 721 Ca 0.00 -2.15 -0.28 0.00 -0.60 0.00 0.00 56.93 53.90 1br2 s PHE 721 Cb 0.00 -1.68 -0.17 0.00 0.51 0.00 0.00 43.02 41.68 1br2 s PHE 721 CO 0.00 -0.81 1.66 -1.00 0.70 0.00 0.00 175.22 175.77 1br2 h PRO 722 N 7.03 -0.43 -7.21 0.24 0.13 -1.75 -3.42 132.00 126.60 1br2 h PRO 722 Ca -0.02 0.03 -0.48 0.00 -0.87 0.00 0.00 66.00 64.66 1br2 h PRO 722 Cb 0.95 0.10 0.02 0.00 0.13 0.00 0.00 31.00 32.20 1br2 h PRO 722 CO 0.44 -0.27 0.37 -0.80 -0.23 0.00 0.00 178.00 177.51 1br2 s ASN 723 N -4.82 6.53 -0.30 1.44 0.01 -1.20 -4.95 114.94 111.66 1br2 s ASN 723 Ca -0.15 1.51 -0.13 0.00 -0.71 0.00 0.00 52.86 53.38 1br2 s ASN 723 Cb 0.05 -2.49 0.17 0.00 0.41 0.00 0.00 41.25 39.39 1br2 s ASN 723 CO 0.64 -0.64 0.98 0.00 -1.51 0.00 0.00 177.10 176.57 1br2 s ARG 724 N -4.30 0.27 0.18 -0.60 1.70 -1.26 -0.89 118.95 114.05 1br2 s ARG 724 Ca 0.57 0.57 0.11 0.00 -0.47 0.00 0.00 55.73 56.51 1br2 s ARG 724 Cb -0.10 0.33 -0.04 0.00 -0.57 0.00 0.00 34.95 34.56 1br2 s ARG 724 CO 0.36 -0.21 -0.24 0.96 -1.08 0.00 0.00 175.30 175.10 1br2 s ILE 725 N 2.72 2.40 0.41 4.99 -4.36 -0.86 -4.91 121.20 121.58 1br2 s ILE 725 Ca 0.01 -1.95 -0.24 0.00 -0.26 0.00 0.00 60.65 58.20 1br2 s ILE 725 Cb -0.09 -2.14 -0.08 0.00 1.25 0.00 0.00 42.46 41.40 1br2 s ILE 725 CO -0.15 -0.08 1.11 0.68 0.24 0.00 0.00 174.94 176.75 1br2 s VAL 726 N -1.56 3.41 0.06 8.37 -7.23 -1.26 -0.91 120.40 121.27 1br2 s VAL 726 Ca 0.20 1.11 -0.11 0.00 -1.81 0.00 0.00 61.98 61.37 1br2 s VAL 726 Cb -0.08 -3.59 -0.03 0.00 0.56 0.00 0.00 36.38 33.24 1br2 s VAL 726 CO 0.10 0.04 1.05 0.49 -0.31 0.00 0.00 175.10 176.46 1br2 n PHE 727 N -0.08 -0.16 -0.22 2.82 3.72 -1.16 -1.33 117.46 121.05 1br2 n PHE 727 Ca 0.05 0.45 -0.04 0.00 -0.05 0.00 0.00 57.45 57.87 1br2 n PHE 727 Cb 0.48 -0.49 0.02 0.00 -0.94 0.00 0.00 39.48 38.56 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 -0.12 -0.65 -1.08 4.15 -1.90 0.21 115.11 115.72 1br2 h GLN 728 Ca 0.06 0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.55 1br2 h GLN 728 Cb 0.15 0.03 -0.05 0.00 0.21 0.00 0.00 27.48 27.81 1br2 h GLN 728 CO -0.34 -0.08 0.35 1.49 -1.93 0.00 0.00 178.83 178.32 1br2 h GLU 729 N -0.12 0.63 -0.54 1.69 4.81 -1.59 0.24 114.58 119.70 1br2 h GLU 729 Ca 0.26 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 1br2 h GLU 729 Cb 0.55 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1br2 h GLU 729 CO -0.70 0.42 0.28 0.35 -0.73 0.00 0.00 179.01 178.63 1br2 h PHE 730 N 0.65 0.75 -0.10 0.92 3.57 0.29 -0.37 116.94 122.66 1br2 h PHE 730 Ca 0.29 -0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.79 1br2 h PHE 730 Cb 0.20 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 1br2 h PHE 730 CO -0.09 0.57 -0.02 -0.09 -2.23 0.00 0.00 178.31 176.45 1br2 h ARG 731 N 0.72 0.00 -0.13 1.11 1.12 0.82 -1.77 114.38 116.25 1br2 h ARG 731 Ca 0.19 -0.00 -0.07 0.00 -1.11 0.00 0.00 59.98 58.99 1br2 h ARG 731 Cb 0.08 -0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.04 1br2 h ARG 731 CO -0.03 0.00 -0.19 -0.56 -3.11 0.00 0.00 179.97 176.09 1br2 h GLN 732 N 0.00 0.36 -0.50 0.20 3.07 -0.44 0.36 115.11 118.17 1br2 h GLN 732 Ca 0.05 -0.21 -0.00 0.00 0.09 0.00 0.00 58.65 58.57 1br2 h GLN 732 Cb 0.07 0.02 -0.02 0.00 0.08 0.00 0.00 27.48 27.62 1br2 h GLN 732 CO -0.10 0.79 0.30 -0.09 0.09 0.00 0.00 178.83 179.82 1br2 h ARG 733 N -0.04 0.67 -0.14 0.06 2.43 -1.06 -3.32 114.38 112.98 1br2 h ARG 733 Ca 0.01 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1br2 h ARG 733 Cb 0.75 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1br2 h ARG 733 CO 0.04 0.49 0.00 0.66 -1.51 0.00 0.00 179.97 179.66 1br2 n TYR 734 N -4.69 0.32 0.21 2.20 4.01 -0.67 -4.59 117.16 113.94 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 0.88 0.07 0.00 -0.72 4.57 -1.02 -0.95 114.58 117.41 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 0.89 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.47 1br2 h GLU 735 CO 0.05 0.16 -0.01 0.82 -1.18 0.00 0.00 179.01 178.85 1br2 h ILE 736 N 0.07 0.92 0.00 2.32 5.03 -1.82 0.10 117.51 124.14 1br2 h ILE 736 Ca 0.02 -0.04 0.00 0.00 -0.12 0.00 0.00 64.86 64.71 1br2 h ILE 736 Cb 0.19 1.02 0.00 0.00 -3.03 0.00 0.00 36.82 35.00 1br2 h ILE 736 CO 0.01 0.01 0.00 0.18 -0.68 0.00 0.00 178.15 177.67 1br2 n LEU 737 N -4.39 0.46 -2.97 1.44 4.77 -0.36 -3.82 117.00 112.13 1br2 n LEU 737 Ca -0.03 0.57 -0.15 0.00 -0.03 0.00 0.00 56.01 56.37 1br2 n LEU 737 Cb 0.10 -0.45 0.01 0.00 -2.33 0.00 0.00 43.42 40.75 1br2 n LEU 737 CO 0.33 -0.24 -0.00 0.00 -1.33 0.00 0.00 177.39 176.15 1br2 n ALA 738 N -1.67 0.59 -0.28 -1.18 0.00 0.13 -4.92 120.51 113.17 1br2 n ALA 738 Ca 0.05 -2.44 0.05 0.00 0.00 0.00 0.00 53.44 51.10 1br2 n ALA 738 Cb 0.32 -1.06 0.19 0.00 0.00 0.00 0.00 19.45 18.91 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 3.49 1.19 -0.47 0.00 0.00 -1.02 -0.15 119.26 122.30 1br2 h ALA 739 Ca -0.02 0.07 -0.22 0.00 0.00 0.00 0.00 54.91 54.74 1br2 h ALA 739 Cb 0.99 -0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.61 1br2 h ALA 739 CO 0.36 -0.05 0.28 0.09 0.00 0.00 0.00 179.25 179.93 1br2 n ASN 740 N -4.85 3.37 -0.09 0.00 3.02 -1.26 -4.27 115.26 111.18 1br2 n ASN 740 Ca 0.15 -2.75 -0.16 0.00 -0.03 0.00 0.00 54.58 51.78 1br2 n ASN 740 Cb 0.37 -0.66 -0.09 0.00 -0.61 0.00 0.00 39.78 38.79 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 1.72 0.16 -2.62 5.41 0.00 -1.34 -3.48 119.26 119.11 1br2 h ALA 741 Ca 0.27 -0.91 -0.56 0.00 0.00 0.00 0.00 54.91 53.72 1br2 h ALA 741 Cb 1.84 0.55 -0.03 0.00 0.00 0.00 0.00 17.79 20.14 1br2 h ALA 741 CO 0.51 0.52 -0.21 0.42 0.00 0.00 0.00 179.25 180.49 1br2 s ILE 742 N -2.27 5.05 0.57 0.00 1.09 -1.26 -4.61 121.20 119.77 1br2 s ILE 742 Ca -0.23 0.24 -0.20 0.00 -1.10 0.00 0.00 60.65 59.36 1br2 s ILE 742 Cb 0.03 -3.62 -0.04 0.00 -1.06 0.00 0.00 42.46 37.77 1br2 s ILE 742 CO 0.50 -0.02 1.27 -2.16 -0.10 0.00 0.00 174.94 174.43 1br2 s PRO 743 N -2.75 3.05 -0.69 2.79 0.04 -1.26 -4.89 135.00 131.29 1br2 s PRO 743 Ca 0.44 2.00 -0.27 0.00 0.04 0.00 0.00 61.00 63.21 1br2 s PRO 743 Cb -0.12 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.35 1br2 s PRO 743 CO 0.23 -1.19 1.59 -1.59 0.04 0.00 0.00 177.00 176.08 1br2 s LYS 744 N -3.12 2.91 0.00 4.56 0.00 -1.26 -4.63 119.74 118.20 1br2 s LYS 744 Ca 0.75 0.16 0.00 0.00 0.00 0.00 0.00 55.97 56.87 1br2 s LYS 744 Cb -0.35 -4.33 0.00 0.00 0.00 0.00 0.00 37.83 33.15 1br2 s LYS 744 CO 0.39 -2.47 0.00 0.41 0.00 0.00 0.00 175.35 173.68 1br2 n GLY 745 N 5.61 0.50 3.67 0.59 0.00 -1.26 -5.06 105.19 109.24 1br2 n GLY 745 Ca 0.13 -1.39 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 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 -3.76 3.41 -0.18 1.61 5.36 -1.26 -5.01 117.98 118.15 1br2 s PHE 746 Ca 0.00 1.43 -0.04 0.00 -0.96 0.00 0.00 56.93 57.36 1br2 s PHE 746 Cb 0.00 -3.17 0.06 0.00 -0.34 0.00 0.00 43.02 39.57 1br2 s PHE 746 CO 0.00 -0.34 0.07 1.41 -1.46 0.00 0.00 175.22 174.90 1br2 s MET 747 N 2.56 0.25 0.38 10.12 -2.45 -1.26 -4.93 119.30 123.96 1br2 s MET 747 Ca 0.43 -0.18 -0.25 0.00 -1.25 0.00 0.00 55.69 54.44 1br2 s MET 747 Cb -0.16 -1.91 -0.12 0.00 1.25 0.00 0.00 34.83 33.88 1br2 s MET 747 CO 0.11 -0.66 0.82 -0.40 1.05 0.00 0.00 175.02 175.94 1br2 n ASP 748 N 5.21 0.36 -0.24 1.11 5.75 -1.26 -4.61 116.55 122.88 1br2 n ASP 748 Ca -0.08 1.03 -0.04 0.00 -0.01 0.00 0.00 54.79 55.69 1br2 n ASP 748 Cb 0.48 -1.23 0.02 0.00 -1.03 0.00 0.00 41.12 39.37 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 1.33 0.01 1.00 6.12 0.00 -1.98 0.30 103.07 109.86 1br2 h GLY 749 Ca -0.41 0.42 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 1br2 h GLY 749 CO 0.56 -0.22 -0.44 1.70 0.00 0.00 0.00 176.54 178.14 1br2 h LYS 750 N -0.12 -1.16 -0.15 4.80 3.64 -1.92 -0.11 116.57 121.55 1br2 h LYS 750 Ca 0.27 0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.72 1br2 h LYS 750 Cb 0.56 0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 1br2 h LYS 750 CO -0.74 -0.78 0.07 1.96 -2.27 0.00 0.00 179.45 177.70 1br2 h GLN 751 N -1.21 0.20 -0.22 1.90 1.08 -1.87 0.37 115.11 115.37 1br2 h GLN 751 Ca -0.12 -0.02 -0.07 0.00 -1.45 0.00 0.00 58.65 56.99 1br2 h GLN 751 Cb 0.93 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.31 1br2 h GLN 751 CO 0.20 0.16 -0.13 0.00 -0.95 0.00 0.00 178.83 178.10 1br2 h ALA 752 N 1.88 0.31 0.39 3.87 0.00 -0.22 -1.09 119.26 124.39 1br2 h ALA 752 Ca 0.05 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1br2 h ALA 752 Cb 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1br2 h ALA 752 CO -0.01 0.18 -0.19 0.00 0.00 0.00 0.00 179.25 179.24 1br2 h ILE 754 N -0.67 0.42 0.54 0.00 2.04 -0.92 0.25 117.51 119.18 1br2 h ILE 754 Ca -0.05 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1br2 h ILE 754 Cb 0.48 -0.05 0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1br2 h ILE 754 CO 0.09 0.08 -0.26 -0.07 0.00 0.00 0.00 178.15 177.98 1br2 h LEU 755 N 0.43 -0.62 -0.49 1.44 3.38 -0.75 -2.65 115.31 116.05 1br2 h LEU 755 Ca 0.68 -0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.71 1br2 h LEU 755 Cb 1.52 0.16 -0.08 0.00 0.09 0.00 0.00 40.66 42.35 1br2 h LEU 755 CO -0.49 -0.24 -0.01 0.24 0.09 0.00 0.00 178.44 178.03 1br2 h MET 756 N -1.08 0.10 -0.31 1.13 2.86 0.22 0.25 114.93 118.10 1br2 h MET 756 Ca -0.07 -0.01 0.06 0.00 -2.06 0.00 0.00 59.70 57.62 1br2 h MET 756 Cb 0.62 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.20 1br2 h MET 756 CO 0.12 0.06 -0.08 0.82 1.06 0.00 0.00 176.91 178.90 1br2 h ILE 757 N 0.10 0.69 -0.52 -1.22 2.04 -0.64 0.67 117.51 118.64 1br2 h ILE 757 Ca 0.24 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.15 1br2 h ILE 757 Cb 0.37 0.69 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 1br2 h ILE 757 CO -0.42 0.00 0.25 0.11 0.00 0.00 0.00 178.15 178.09 1br2 h LYS 758 N -0.00 0.47 -0.45 2.37 1.57 -0.85 0.39 116.57 120.07 1br2 h LYS 758 Ca 0.15 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.94 1br2 h LYS 758 Cb 0.23 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1br2 h LYS 758 CO -0.32 0.31 0.30 0.00 -0.57 0.00 0.00 179.45 179.17 1br2 h ALA 759 N 1.29 1.85 0.00 3.86 0.00 0.17 -0.11 119.26 126.33 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 0.16 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1br2 h ALA 759 CO -0.18 0.08 -0.16 1.28 0.00 0.00 0.00 179.25 180.28 1br2 n LEU 760 N -4.48 0.23 -3.38 0.00 4.77 0.21 -4.93 117.00 109.42 1br2 n LEU 760 Ca 0.05 0.36 -0.20 0.00 -0.03 0.00 0.00 56.01 56.20 1br2 n LEU 760 Cb 0.19 -0.41 0.08 0.00 -2.33 0.00 0.00 43.42 40.95 1br2 n LEU 760 CO 0.35 0.02 0.18 -0.62 -1.33 0.00 0.00 177.39 175.99 1br2 n GLU 761 N -1.59 -7.07 -2.43 3.23 1.02 -0.05 -4.93 120.64 108.82 1br2 n GLU 761 Ca 0.06 0.79 -0.42 0.00 -0.02 0.00 0.00 57.16 57.58 1br2 n GLU 761 Cb 0.35 -5.70 -0.03 0.00 -0.02 0.00 0.00 31.44 26.04 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 -6.65 4.35 0.09 -4.62 1.43 -1.07 -4.96 118.68 107.26 1br2 s LEU 762 Ca 0.34 1.98 -0.31 0.00 -1.03 0.00 0.00 54.13 55.11 1br2 s LEU 762 Cb -0.15 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.41 1br2 s LEU 762 CO 0.69 -0.49 1.68 -0.62 0.23 0.00 0.00 176.35 177.84 1br2 s ASP 763 N 1.16 6.56 0.62 2.29 2.15 -1.26 -4.82 116.67 123.37 1br2 s ASP 763 Ca 0.58 2.56 0.26 0.00 0.43 0.00 0.00 52.55 56.38 1br2 s ASP 763 Cb -0.29 -2.57 1.26 0.00 -0.30 0.00 0.00 42.92 41.03 1br2 s ASP 763 CO 0.28 -0.91 1.70 1.55 -0.17 0.00 0.00 175.17 177.62 1br2 h PRO 764 N 8.19 0.00 0.00 4.34 0.13 -1.93 0.53 132.00 143.26 1br2 h PRO 764 Ca -0.43 0.00 -0.09 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 -0.45 -0.97 -0.23 0.00 0.00 178.00 177.28 1br2 h ASN 765 N 0.00 0.00 0.54 1.44 -1.24 -2.03 -3.09 115.58 111.20 1br2 h ASN 765 Ca 0.19 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.20 1br2 h ASN 765 Cb 1.46 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.51 1br2 h ASN 765 CO -0.00 0.45 0.00 0.18 -1.29 0.00 0.00 177.43 176.77 1br2 n LEU 766 N -3.57 0.14 0.00 0.34 4.77 0.19 -4.83 117.00 114.04 1br2 n LEU 766 Ca -0.00 0.53 -0.09 0.00 -0.03 0.00 0.00 56.01 56.42 1br2 n LEU 766 Cb 0.55 -0.52 0.01 0.00 -2.33 0.00 0.00 43.42 41.14 1br2 n LEU 766 CO 0.38 -0.32 0.39 0.00 -1.33 0.00 0.00 177.39 176.51 1br2 n TYR 767 N -1.65 -1.99 -3.69 -1.77 0.18 -1.17 -1.13 117.16 105.93 1br2 n TYR 767 Ca 0.03 -1.79 -0.14 0.00 1.88 0.00 0.00 57.90 57.88 1br2 n TYR 767 Cb 0.18 0.74 -0.09 0.00 -0.38 0.00 0.00 39.34 39.79 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 -2.26 0.63 -0.38 -3.48 1.81 -0.08 -4.94 118.95 110.27 1br2 s ARG 768 Ca 0.17 0.61 -0.13 0.00 -1.72 0.00 0.00 55.73 54.67 1br2 s ARG 768 Cb -0.03 0.30 0.01 0.00 -0.45 0.00 0.00 34.95 34.78 1br2 s ARG 768 CO 0.13 -0.10 0.24 0.42 -0.68 0.00 0.00 175.30 175.32 1br2 s ILE 769 N 0.05 4.96 0.20 1.52 -1.09 -1.26 0.67 121.20 126.25 1br2 s ILE 769 Ca -0.02 -0.63 -0.00 0.00 -2.23 0.00 0.00 60.65 57.77 1br2 s ILE 769 Cb -0.03 -3.71 0.04 0.00 -1.58 0.00 0.00 42.46 37.18 1br2 s ILE 769 CO 0.02 -0.20 0.27 0.61 -1.23 0.00 0.00 174.94 174.40 1br2 n GLY 770 N 5.08 0.68 0.38 6.18 0.00 0.12 -4.82 105.19 112.81 1br2 n GLY 770 Ca -0.12 -1.97 -0.13 0.00 0.00 0.00 0.00 46.02 43.80 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 -0.56 -0.00 1.61 5.75 -0.87 -3.33 115.11 117.70 1br2 h GLN 771 Ca -0.09 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 1br2 h GLN 771 Cb 0.32 0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.00 1br2 h GLN 771 CO 0.09 -0.37 -0.20 -1.13 -2.65 0.00 0.00 178.83 174.58 1br2 n SER 772 N -5.44 0.88 -3.70 -0.69 3.41 -1.26 -5.03 113.62 101.78 1br2 n SER 772 Ca -0.06 -0.94 -0.10 0.00 -0.26 0.00 0.00 58.87 57.51 1br2 n SER 772 Cb 0.36 0.59 -0.04 0.00 -0.26 0.00 0.00 64.21 64.86 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 -1.26 1.22 -0.15 4.33 -2.85 -1.25 -3.01 119.74 116.78 1br2 s LYS 773 Ca 0.05 -0.81 -0.12 0.00 -1.00 0.00 0.00 55.97 54.10 1br2 s LYS 773 Cb 0.06 0.49 -0.05 0.00 -2.06 0.00 0.00 37.83 36.27 1br2 s LYS 773 CO 0.21 -0.50 0.24 0.42 0.10 0.00 0.00 175.35 175.82 1br2 s ILE 774 N -3.85 5.34 -0.14 3.79 1.01 -0.09 0.15 121.20 127.42 1br2 s ILE 774 Ca 0.07 0.42 -0.13 0.00 0.00 0.00 0.00 60.65 61.01 1br2 s ILE 774 Cb 0.01 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.87 1br2 s ILE 774 CO -0.07 0.45 0.29 -0.36 0.00 0.00 0.00 174.94 175.25 1br2 s PHE 775 N 0.09 3.50 0.15 3.97 0.40 0.21 -2.03 117.98 124.27 1br2 s PHE 775 Ca 0.15 0.63 0.08 0.00 -0.60 0.00 0.00 56.93 57.18 1br2 s PHE 775 Cb -0.13 -2.30 -0.04 0.00 0.51 0.00 0.00 43.02 41.07 1br2 s PHE 775 CO 0.03 0.33 -0.09 -0.06 0.70 0.00 0.00 175.22 176.13 1br2 s PHE 776 N 0.16 2.70 0.83 0.36 0.08 -0.07 -0.90 117.98 121.14 1br2 s PHE 776 Ca 0.17 -0.19 -0.11 0.00 0.12 0.00 0.00 56.93 56.92 1br2 s PHE 776 Cb -0.13 -1.36 0.09 0.00 -0.57 0.00 0.00 43.02 41.05 1br2 s PHE 776 CO 0.05 0.47 1.09 1.03 -0.10 0.00 0.00 175.22 177.76 1br2 s ARG 777 N -2.57 1.83 0.29 0.44 1.81 -0.29 -2.95 118.95 117.52 1br2 s ARG 777 Ca 0.23 0.78 -0.30 0.00 -1.72 0.00 0.00 55.73 54.73 1br2 s ARG 777 Cb -0.10 -1.88 -0.13 0.00 -0.45 0.00 0.00 34.95 32.39 1br2 s ARG 777 CO 0.15 -1.83 1.33 -2.37 -0.68 0.00 0.00 175.30 171.90 1br2 n THR 778 N -3.60 1.49 -1.31 0.02 5.66 -1.26 -2.17 114.28 113.11 1br2 n THR 778 Ca 0.07 -0.37 -0.11 0.00 -3.05 0.00 0.00 64.05 60.60 1br2 n THR 778 Cb 0.55 -1.49 -0.05 0.00 -1.55 0.00 0.00 70.33 67.80 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 1.48 1.07 0.06 1.09 0.00 -1.26 -4.88 105.19 102.75 1br2 n GLY 779 Ca 0.08 -0.12 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 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 0.91 -0.51 1.61 2.07 -1.79 -3.07 116.25 115.46 1br2 h VAL 780 Ca -0.22 -1.72 0.05 0.00 0.82 0.00 0.00 66.70 65.64 1br2 h VAL 780 Cb 1.01 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.51 1br2 h VAL 780 CO 0.32 0.31 0.34 -0.07 0.02 0.00 0.00 177.57 178.49 1br2 h LEU 781 N -1.00 0.44 0.04 2.57 3.38 -1.90 -1.13 115.31 117.71 1br2 h LEU 781 Ca -0.02 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1br2 h LEU 781 Cb 0.59 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 1br2 h LEU 781 CO -0.01 0.29 -0.37 0.00 0.09 0.00 0.00 178.44 178.44 1br2 h ALA 782 N 1.71 -0.83 -0.95 1.53 0.00 -1.94 0.53 119.26 119.32 1br2 h ALA 782 Ca 0.22 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.20 1br2 h ALA 782 Cb 0.23 0.79 -0.08 0.00 0.00 0.00 0.00 17.79 18.72 1br2 h ALA 782 CO -0.06 -0.93 0.60 1.25 0.00 0.00 0.00 179.25 180.11 1br2 h HIS 783 N -0.49 0.96 -0.80 0.00 -0.00 -1.24 0.30 115.15 113.89 1br2 h HIS 783 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 1br2 h HIS 783 Cb 0.51 -0.30 -0.04 0.00 -0.00 0.00 0.00 27.41 27.57 1br2 h HIS 783 CO -0.44 0.34 0.51 -0.07 -0.00 0.00 0.00 177.93 178.28 1br2 h LEU 784 N 0.80 0.93 0.29 0.26 3.38 -0.01 0.34 115.31 121.30 1br2 h LEU 784 Ca 0.48 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.40 1br2 h LEU 784 Cb 0.67 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1br2 h LEU 784 CO -0.25 0.69 -0.14 -0.08 0.09 0.00 0.00 178.44 178.75 1br2 h GLU 785 N 1.08 -0.38 -0.82 1.13 4.57 0.36 0.25 114.58 120.76 1br2 h GLU 785 Ca 0.29 0.03 0.13 0.00 -1.18 0.00 0.00 59.36 58.63 1br2 h GLU 785 Cb -0.10 0.09 -0.09 0.00 -0.16 0.00 0.00 28.75 28.49 1br2 h GLU 785 CO -0.06 -0.13 0.42 0.93 -1.18 0.00 0.00 179.01 178.99 1br2 h GLU 786 N -0.57 0.61 -0.35 1.92 5.08 -0.66 0.20 114.58 120.80 1br2 h GLU 786 Ca -0.04 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.19 1br2 h GLU 786 Cb 0.42 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1br2 h GLU 786 CO 0.07 0.40 -0.15 0.93 -1.00 0.00 0.00 179.01 179.26 1br2 h GLU 787 N 0.63 0.63 -0.09 2.33 5.08 -0.74 -2.58 114.58 119.83 1br2 h GLU 787 Ca 0.44 -0.21 0.03 0.00 -1.00 0.00 0.00 59.36 58.61 1br2 h GLU 787 Cb 0.58 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1br2 h GLU 787 CO -0.34 0.76 0.10 -0.09 -1.00 0.00 0.00 179.01 178.44 1br2 h ARG 788 N 0.57 0.00 -0.03 2.33 2.43 0.15 -3.51 114.38 116.33 1br2 h ARG 788 Ca 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1br2 h ARG 788 Cb 0.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1br2 h ARG 788 CO 0.04 0.00 0.00 -0.25 -1.51 0.00 0.00 179.97 178.25