#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1br2 s VAL 35 N 0.00 0.00 -0.24 1.96 0.11 0.46 -4.40 120.40 118.29 1br2 s VAL 35 Ca 0.00 -1.34 -0.06 0.00 -2.93 0.00 0.00 61.98 57.65 1br2 s VAL 35 Cb 0.00 -2.82 -0.02 0.00 -1.53 0.00 0.00 36.38 32.01 1br2 s VAL 35 CO 0.00 0.00 0.03 0.26 -3.33 0.00 0.00 175.10 172.06 1br2 s TRP 36 N -2.55 3.04 0.06 1.54 0.23 0.10 -0.33 118.94 121.04 1br2 s TRP 36 Ca 0.24 -0.69 0.09 0.00 -2.03 0.00 0.00 56.10 53.71 1br2 s TRP 36 Cb -0.03 -2.19 -0.03 0.00 0.03 0.00 0.00 33.47 31.25 1br2 s TRP 36 CO 0.18 -0.46 -0.25 0.14 0.96 0.00 0.00 176.95 177.52 1br2 s VAL 37 N 1.55 2.28 0.86 4.03 -7.23 0.13 -0.80 120.40 121.22 1br2 s VAL 37 Ca 0.06 -1.44 -0.13 0.00 -1.81 0.00 0.00 61.98 58.65 1br2 s VAL 37 Cb -0.15 -1.93 0.05 0.00 0.56 0.00 0.00 36.38 34.91 1br2 s VAL 37 CO 0.01 0.30 0.74 -0.81 -0.31 0.00 0.00 175.10 175.03 1br2 n PRO 38 N 1.54 -0.07 -3.56 4.82 -0.04 -1.26 0.64 135.00 137.07 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 0.52 -2.07 -0.05 0.00 -0.04 0.00 0.00 33.50 31.86 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 -2.01 -0.42 -0.15 3.54 0.15 -0.44 -4.50 113.70 109.86 1br2 s SER 39 Ca 0.64 0.06 -0.23 0.00 0.70 0.00 0.00 55.95 57.12 1br2 s SER 39 Cb -0.26 0.51 -0.20 0.00 -1.71 0.00 0.00 66.02 64.35 1br2 s SER 39 CO 0.60 -0.78 0.49 -0.33 1.20 0.00 0.00 173.24 174.42 1br2 h GLU 40 N 2.58 0.00 -0.46 5.44 5.08 -1.97 -3.35 114.58 121.90 1br2 h GLU 40 Ca -0.32 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.05 1br2 h GLU 40 Cb 1.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1br2 h GLU 40 CO 0.42 0.84 0.29 0.87 -1.00 0.00 0.00 179.01 180.43 1br2 h LYS 41 N -1.00 0.57 -5.39 2.33 1.79 -1.98 -3.42 116.57 109.47 1br2 h LYS 41 Ca -0.09 -0.03 -0.50 0.00 -2.18 0.00 0.00 60.65 57.85 1br2 h LYS 41 Cb 0.94 -0.13 -0.29 0.00 -1.58 0.00 0.00 32.23 31.17 1br2 h LYS 41 CO -0.05 0.38 -0.82 -1.01 -1.08 0.00 0.00 179.45 176.87 1br2 s HIS 42 N -6.15 1.34 0.29 -1.35 3.76 -1.26 -4.66 115.29 107.27 1br2 s HIS 42 Ca -0.13 -0.26 0.03 0.00 -0.15 0.00 0.00 55.06 54.55 1br2 s HIS 42 Cb 0.12 -0.86 0.75 0.00 1.11 0.00 0.00 32.58 33.70 1br2 s HIS 42 CO 0.73 -0.02 1.47 0.41 -0.85 0.00 0.00 174.74 176.49 1br2 n GLY 43 N 2.65 -1.24 3.10 -2.22 0.00 -1.26 -3.30 105.19 102.92 1br2 n GLY 43 Ca -0.15 0.91 -0.08 0.00 0.00 0.00 0.00 46.02 46.71 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 -5.89 0.60 0.04 1.61 0.40 -1.26 -1.33 117.98 112.15 1br2 s PHE 44 Ca -0.12 -1.11 0.02 0.00 -0.60 0.00 0.00 56.93 55.12 1br2 s PHE 44 Cb 0.28 -0.41 -0.02 0.00 0.51 0.00 0.00 43.02 43.37 1br2 s PHE 44 CO 0.73 -0.41 -0.07 -2.00 0.70 0.00 0.00 175.22 174.17 1br2 s GLU 45 N -3.95 0.51 0.01 0.44 2.12 0.21 -4.77 118.70 113.26 1br2 s GLU 45 Ca 0.11 -0.76 -0.28 0.00 0.36 0.00 0.00 54.97 54.40 1br2 s GLU 45 Cb 0.08 -0.24 -0.04 0.00 0.26 0.00 0.00 34.13 34.19 1br2 s GLU 45 CO -0.07 0.03 0.90 0.00 -0.54 0.00 0.00 175.26 175.59 1br2 s ALA 46 N -1.46 3.22 -0.12 6.30 0.00 -1.26 0.22 121.76 128.66 1br2 s ALA 46 Ca -0.10 0.44 -0.13 0.00 0.00 0.00 0.00 51.96 52.17 1br2 s ALA 46 Cb -0.10 -3.23 0.04 0.00 0.00 0.00 0.00 23.12 19.83 1br2 s ALA 46 CO 0.00 -0.15 0.37 0.00 0.00 0.00 0.00 175.76 175.98 1br2 s ALA 47 N 0.75 -0.92 0.01 0.00 0.00 0.55 -1.91 121.76 120.24 1br2 s ALA 47 Ca 0.47 0.97 -0.18 0.00 0.00 0.00 0.00 51.96 53.23 1br2 s ALA 47 Cb -0.21 -0.53 -0.06 0.00 0.00 0.00 0.00 23.12 22.33 1br2 s ALA 47 CO 0.26 -0.19 0.51 -1.12 0.00 0.00 0.00 175.76 175.22 1br2 s SER 48 N -0.00 6.92 1.10 0.00 0.01 -1.16 0.17 113.70 120.74 1br2 s SER 48 Ca -0.02 1.09 -0.12 0.00 1.31 0.00 0.00 55.95 58.21 1br2 s SER 48 Cb -0.03 -2.32 0.25 0.00 0.21 0.00 0.00 66.02 64.14 1br2 s SER 48 CO 0.01 0.23 1.05 -0.63 0.41 0.00 0.00 173.24 174.31 1br2 s ILE 49 N -0.72 2.06 0.00 1.44 -1.09 -1.26 -1.71 121.20 119.92 1br2 s ILE 49 Ca 0.27 0.02 0.00 0.00 -2.23 0.00 0.00 60.65 58.71 1br2 s ILE 49 Cb -0.18 -2.12 0.00 0.00 -1.58 0.00 0.00 42.46 38.58 1br2 s ILE 49 CO 0.16 -0.03 0.00 1.21 -1.23 0.00 0.00 174.94 175.05 1br2 n GLU 56 N -4.73 0.00 -4.13 2.79 4.07 -1.26 -4.38 120.64 113.00 1br2 n GLU 56 Ca 0.05 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 57.00 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 0.32 -4.70 120.40 123.75 1br2 s VAL 57 Ca 0.00 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.01 1br2 s VAL 57 Cb 0.00 -0.70 0.07 0.00 0.00 0.00 0.00 36.38 35.75 1br2 s VAL 57 CO 0.00 -0.24 -0.07 -0.89 0.00 0.00 0.00 175.10 173.89 1br2 s THR 58 N -1.13 2.07 0.38 3.92 2.01 -1.26 0.73 115.64 122.35 1br2 s THR 58 Ca -0.06 -1.69 0.03 0.00 0.31 0.00 0.00 61.69 60.29 1br2 s THR 58 Cb -0.09 -2.26 0.03 0.00 0.01 0.00 0.00 72.50 70.19 1br2 s THR 58 CO 0.01 -0.14 0.26 1.33 -0.69 0.00 0.00 174.62 175.38 1br2 n VAL 59 N 4.44 0.00 -3.64 3.82 0.24 0.04 -4.75 118.33 118.48 1br2 n VAL 59 Ca -0.11 -1.52 -0.25 0.00 -2.04 0.00 0.00 64.34 60.42 1br2 n VAL 59 Cb 0.42 -0.13 -0.17 0.00 -1.47 0.00 0.00 33.84 32.49 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 -3.53 0.13 0.30 7.34 -1.05 -0.69 -0.29 118.70 120.90 1br2 s GLU 60 Ca 0.20 -0.03 -0.29 0.00 -0.15 0.00 0.00 54.97 54.69 1br2 s GLU 60 Cb -0.02 -1.60 -0.13 0.00 -0.44 0.00 0.00 34.13 31.95 1br2 s GLU 60 CO 0.12 -0.59 1.36 1.28 0.95 0.00 0.00 175.26 178.38 1br2 n LEU 61 N 5.25 3.41 0.17 1.83 4.77 -1.00 -3.01 117.00 128.42 1br2 n LEU 61 Ca -0.07 1.18 0.05 0.00 -0.03 0.00 0.00 56.01 57.14 1br2 n LEU 61 Cb 0.49 -1.47 0.19 0.00 -2.33 0.00 0.00 43.42 40.30 1br2 n LEU 61 CO 0.10 -0.45 0.61 0.06 -1.33 0.00 0.00 177.39 176.37 1br2 h GLN 62 N 3.40 0.00 0.00 3.23 -0.00 -1.71 0.11 115.11 120.13 1br2 h GLN 62 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.19 1br2 h GLN 62 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.76 1br2 h GLN 62 CO 0.69 0.38 0.00 -0.85 -0.00 0.00 0.00 178.83 179.06 1br2 n GLU 63 N -3.30 0.00 -0.32 0.06 0.28 -1.26 -4.37 120.64 111.73 1br2 n GLU 63 Ca 0.01 0.21 -0.03 0.00 -0.16 0.00 0.00 57.16 57.20 1br2 n GLU 63 Cb 0.61 -0.68 0.09 0.00 1.43 0.00 0.00 31.44 32.90 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 0.96 0.00 -1.84 -1.07 -1.97 -3.45 115.58 108.21 1br2 h ASN 64 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.35 1br2 h ASN 64 Cb 0.00 -0.23 0.00 0.00 -2.07 0.00 0.00 38.32 36.02 1br2 h ASN 64 CO 0.00 0.68 0.00 0.61 0.07 0.00 0.00 177.43 178.79 1br2 n GLY 65 N -1.34 3.02 3.60 9.14 0.00 0.37 -4.98 105.19 115.00 1br2 n GLY 65 Ca 0.10 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.54 1br2 n GLY 65 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1br2 n LYS 66 N -0.66 0.82 -2.36 1.61 2.85 -1.26 -4.02 118.16 115.13 1br2 n LYS 66 Ca 0.00 0.28 -0.42 0.00 -1.05 0.00 0.00 58.31 57.12 1br2 n LYS 66 Cb 0.00 -2.01 -0.03 0.00 -0.65 0.00 0.00 35.03 32.34 1br2 n LYS 66 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 1br2 s LYS 67 N 4.34 4.44 0.26 -1.58 2.20 -1.26 -2.37 119.74 125.76 1br2 s LYS 67 Ca 1.05 1.86 0.07 0.00 -0.36 0.00 0.00 55.97 58.59 1br2 s LYS 67 Cb -1.15 -3.29 -0.05 0.00 -1.51 0.00 0.00 37.83 31.83 1br2 s LYS 67 CO 0.65 -0.21 -0.10 0.54 -0.36 0.00 0.00 175.35 175.87 1br2 s VAL 68 N 0.60 1.73 -0.29 4.02 0.11 0.61 -4.96 120.40 122.22 1br2 s VAL 68 Ca 0.57 -2.17 0.00 0.00 -2.93 0.00 0.00 61.98 57.45 1br2 s VAL 68 Cb -0.32 -2.31 0.09 0.00 -1.53 0.00 0.00 36.38 32.31 1br2 s VAL 68 CO 0.32 -0.40 0.05 -0.89 -3.33 0.00 0.00 175.10 170.85 1br2 s THR 69 N -2.96 1.28 0.26 5.04 2.01 -1.26 -0.78 115.64 119.23 1br2 s THR 69 Ca 0.27 -1.49 0.11 0.00 0.31 0.00 0.00 61.69 60.89 1br2 s THR 69 Cb 0.02 -1.86 -0.05 0.00 0.01 0.00 0.00 72.50 70.62 1br2 s THR 69 CO 0.10 -0.50 -0.18 -1.48 -0.69 0.00 0.00 174.62 171.88 1br2 s LEU 70 N 1.44 2.58 1.07 4.42 0.05 0.22 -4.91 118.68 123.56 1br2 s LEU 70 Ca 0.06 -1.04 -0.17 0.00 0.05 0.00 0.00 54.13 53.03 1br2 s LEU 70 Cb -0.18 -0.97 0.09 0.00 -2.05 0.00 0.00 46.19 43.08 1br2 s LEU 70 CO -0.16 -0.03 0.15 -0.24 -0.55 0.00 0.00 176.35 175.51 1br2 n SER 71 N -0.56 -2.28 -0.04 1.48 2.88 -1.26 0.12 113.62 113.96 1br2 n SER 71 Ca -0.06 0.02 -0.14 0.00 -1.33 0.00 0.00 58.87 57.36 1br2 n SER 71 Cb 0.60 -1.04 -0.11 0.00 -0.75 0.00 0.00 64.21 62.91 1br2 n SER 71 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 1br2 h LYS 72 N -1.92 0.08 0.00 -1.46 -0.00 -1.91 -3.17 116.57 108.18 1br2 h LYS 72 Ca -0.51 -0.08 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 0.37 0.80 0.12 -0.40 -0.00 0.00 0.00 179.45 180.35 1br2 n ASP 73 N -4.64 0.08 0.13 7.07 5.68 -1.26 -0.38 116.55 123.23 1br2 n ASP 73 Ca -0.09 0.44 0.12 0.00 -0.50 0.00 0.00 54.79 54.75 1br2 n ASP 73 Cb 0.41 -0.44 0.04 0.00 -1.14 0.00 0.00 41.12 40.00 1br2 n ASP 73 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1br2 h ASP 74 N 0.00 0.00 -3.55 -1.12 3.32 -1.90 -3.46 116.42 109.71 1br2 h ASP 74 Ca 0.00 -0.01 -0.52 0.00 0.02 0.00 0.00 57.03 56.52 1br2 h ASP 74 Cb 0.24 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 1br2 h ASP 74 CO 0.00 0.00 0.14 -0.63 -1.72 0.00 0.00 179.24 177.03 1br2 s ILE 75 N -3.32 4.49 -0.03 0.35 1.01 0.49 -4.11 121.20 120.07 1br2 s ILE 75 Ca 0.01 1.46 0.02 0.00 0.00 0.00 0.00 60.65 62.14 1br2 s ILE 75 Cb 0.09 -3.97 0.01 0.00 0.01 0.00 0.00 42.46 38.60 1br2 s ILE 75 CO 0.76 0.34 -0.07 -1.10 0.00 0.00 0.00 174.94 174.87 1br2 s GLN 76 N -1.62 0.83 0.31 2.79 -0.21 0.02 -4.99 119.66 116.79 1br2 s GLN 76 Ca 0.40 -0.22 -0.29 0.00 0.02 0.00 0.00 55.36 55.27 1br2 s GLN 76 Cb -0.19 -0.80 -0.10 0.00 1.00 0.00 0.00 33.01 32.92 1br2 s GLN 76 CO 0.23 0.05 1.28 0.15 -2.12 0.00 0.00 175.29 174.88 1br2 s LYS 77 N 0.39 4.39 0.81 2.91 3.01 -1.26 0.02 119.74 130.02 1br2 s LYS 77 Ca -0.06 2.15 -0.11 0.00 -1.01 0.00 0.00 55.97 56.95 1br2 s LYS 77 Cb -0.10 -3.10 0.11 0.00 -1.01 0.00 0.00 37.83 33.74 1br2 s LYS 77 CO 0.00 -0.14 1.15 -1.64 0.51 0.00 0.00 175.35 175.23 1br2 s MET 78 N -1.58 1.66 0.25 1.68 -1.94 -1.26 -4.76 119.30 113.35 1br2 s MET 78 Ca 0.49 -0.23 0.11 0.00 -1.71 0.00 0.00 55.69 54.35 1br2 s MET 78 Cb -0.39 -2.02 -0.05 0.00 2.01 0.00 0.00 34.83 34.39 1br2 s MET 78 CO 0.50 -1.69 -0.17 -0.80 -0.01 0.00 0.00 175.02 172.84 1br2 s ASN 79 N -4.66 3.74 0.75 3.03 0.01 -1.26 -4.85 114.94 111.71 1br2 s ASN 79 Ca 0.65 -0.91 -0.14 0.00 -0.71 0.00 0.00 52.86 51.75 1br2 s ASN 79 Cb -0.09 -0.40 0.05 0.00 0.41 0.00 0.00 41.25 41.23 1br2 s ASN 79 CO 0.48 0.06 1.20 -2.84 -1.51 0.00 0.00 177.10 174.49 1br2 s PRO 80 N -3.30 2.02 0.67 -0.60 0.02 -1.26 -4.85 135.00 127.69 1br2 s PRO 80 Ca 0.28 1.72 0.35 0.00 0.02 0.00 0.00 61.00 63.37 1br2 s PRO 80 Cb -0.06 -1.82 1.90 0.00 0.02 0.00 0.00 34.50 34.54 1br2 s PRO 80 CO 0.15 -1.92 2.08 -1.35 -0.33 0.00 0.00 177.00 175.62 1br2 h PRO 81 N -0.50 0.00 0.00 5.54 0.11 -2.02 -0.80 132.00 134.33 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 0.49 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 -0.77 1.05 2.10 -2.06 -1.47 116.57 115.42 1br2 h LYS 82 Ca 0.00 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.49 1br2 h LYS 82 Cb 0.45 0.00 -0.10 0.00 -0.90 0.00 0.00 32.23 31.68 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 -2.85 2.13 -1.81 0.07 3.72 -0.31 -4.94 117.46 113.46 1br2 n PHE 83 Ca -0.02 -1.01 -0.43 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 -0.79 6.19 -1.17 4.37 0.15 -0.56 -3.14 113.70 118.75 1br2 s SER 84 Ca 0.48 2.13 -0.06 0.00 0.70 0.00 0.00 55.95 59.20 1br2 s SER 84 Cb 0.38 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 62.14 1br2 s SER 84 CO 0.12 -1.34 0.84 0.29 1.20 0.00 0.00 173.24 174.35 1br2 n LYS 85 N 7.86 -3.59 -1.96 5.44 5.02 -1.26 -4.94 118.16 124.73 1br2 n LYS 85 Ca 0.22 0.71 -0.41 0.00 -2.02 0.00 0.00 58.31 56.81 1br2 n LYS 85 Cb 0.43 -5.29 -0.01 0.00 -0.02 0.00 0.00 35.03 30.14 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 -3.49 2.42 0.14 -0.18 -7.23 -1.19 -4.89 120.40 105.99 1br2 s VAL 86 Ca 0.25 0.41 0.15 0.00 -1.81 0.00 0.00 61.98 60.98 1br2 s VAL 86 Cb -0.05 -3.26 0.06 0.00 0.56 0.00 0.00 36.38 33.69 1br2 s VAL 86 CO 0.78 0.09 1.63 -0.33 -0.31 0.00 0.00 175.10 176.96 1br2 h GLU 87 N 3.61 0.00 -4.01 4.82 5.08 -1.92 -3.40 114.58 118.76 1br2 h GLU 87 Ca -0.49 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.29 1br2 h GLU 87 Cb 1.23 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 30.09 1br2 h GLU 87 CO 0.68 0.50 -0.77 0.34 -1.00 0.00 0.00 179.01 178.76 1br2 s ASP 88 N -6.55 3.70 0.00 1.42 -1.08 -1.25 0.00 116.67 112.91 1br2 s ASP 88 Ca 0.00 -1.24 0.10 0.00 -0.52 0.00 0.00 52.55 50.89 1br2 s ASP 88 Cb 0.11 -0.99 0.47 0.00 -1.46 0.00 0.00 42.92 41.04 1br2 s ASP 88 CO 0.72 -0.30 1.23 0.23 0.52 0.00 0.00 175.17 177.58 1br2 n MET 89 N 4.78 0.10 0.22 4.34 2.81 -0.84 -0.74 117.12 127.79 1br2 n MET 89 Ca -0.08 0.24 0.09 0.00 -1.81 0.00 0.00 57.70 56.14 1br2 n MET 89 Cb 0.44 -1.50 0.47 0.00 -0.71 0.00 0.00 33.22 31.92 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 2.42 1.05 -0.39 3.04 0.00 -1.91 -2.74 119.26 120.74 1br2 h ALA 90 Ca 0.00 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 1br2 h ALA 90 Cb 0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1br2 h ALA 90 CO 0.00 0.30 -0.12 0.93 0.00 0.00 0.00 179.25 180.37 1br2 h GLU 91 N 0.00 0.70 -5.98 0.00 3.07 -1.34 -3.46 114.58 107.57 1br2 h GLU 91 Ca -0.00 -0.23 -0.74 0.00 -0.50 0.00 0.00 59.36 57.90 1br2 h GLU 91 Cb 0.72 -0.06 0.08 0.00 -0.84 0.00 0.00 28.75 28.65 1br2 h GLU 91 CO 0.03 0.79 -0.19 1.28 -1.40 0.00 0.00 179.01 179.52 1br2 n LEU 92 N -4.17 -0.54 -0.19 1.33 4.77 -1.04 -4.85 117.00 112.31 1br2 n LEU 92 Ca 0.01 1.14 -0.09 0.00 -0.03 0.00 0.00 56.01 57.04 1br2 n LEU 92 Cb 0.36 -0.93 0.03 0.00 -2.33 0.00 0.00 43.42 40.55 1br2 n LEU 92 CO 0.42 -2.37 0.79 0.74 -1.33 0.00 0.00 177.39 175.64 1br2 h THR 93 N 2.13 1.27 -3.21 -5.08 2.02 -1.90 -3.40 112.91 104.73 1br2 h THR 93 Ca -0.41 -1.20 -0.67 0.00 0.77 0.00 0.00 66.41 64.89 1br2 h THR 93 Cb 1.43 0.88 -0.33 0.00 -1.74 0.00 0.00 68.15 68.39 1br2 h THR 93 CO 0.61 0.43 -0.86 0.00 0.37 0.00 0.00 175.52 176.08 1br2 s LEU 95 N 0.83 4.64 0.08 0.00 2.96 -1.26 -4.86 118.68 121.05 1br2 s LEU 95 Ca -0.06 -1.69 -0.13 0.00 -0.22 0.00 0.00 54.13 52.03 1br2 s LEU 95 Cb -0.15 -1.77 0.02 0.00 0.50 0.00 0.00 46.19 44.78 1br2 s LEU 95 CO -0.02 -0.41 0.29 0.54 -1.32 0.00 0.00 176.35 175.43 1br2 s ASN 96 N 1.52 -0.07 0.25 3.68 2.20 -1.26 -5.02 114.94 116.23 1br2 s ASN 96 Ca 0.03 -0.37 -0.13 0.00 -0.94 0.00 0.00 52.86 51.45 1br2 s ASN 96 Cb -0.21 0.38 0.33 0.00 -2.00 0.00 0.00 41.25 39.74 1br2 s ASN 96 CO -0.03 -0.70 1.56 -0.33 -2.94 0.00 0.00 177.10 174.66 1br2 h GLU 97 N 2.89 -0.01 -0.90 3.55 5.08 -1.99 0.28 114.58 123.47 1br2 h GLU 97 Ca -0.33 0.00 0.13 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 30.38 1br2 h GLU 97 CO 0.49 -0.01 0.52 0.00 -1.00 0.00 0.00 179.01 179.01 1br2 h ALA 98 N 1.64 1.37 0.04 3.43 0.00 -1.96 0.67 119.26 124.45 1br2 h ALA 98 Ca 0.39 0.06 -0.26 0.00 0.00 0.00 0.00 54.91 55.10 1br2 h ALA 98 Cb 0.64 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.35 1br2 h ALA 98 CO -0.96 0.03 -1.08 0.77 0.00 0.00 0.00 179.25 178.02 1br2 h SER 99 N 0.77 0.72 0.20 0.00 0.02 -0.81 -1.87 113.55 112.58 1br2 h SER 99 Ca 0.47 -0.62 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1br2 h SER 99 Cb 0.58 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1br2 h SER 99 CO -0.32 1.42 -0.10 0.58 -1.14 0.00 0.00 176.83 177.28 1br2 h VAL 100 N 0.28 0.89 -0.72 2.27 2.07 -0.84 0.86 116.25 121.05 1br2 h VAL 100 Ca -0.13 -0.70 0.12 0.00 0.82 0.00 0.00 66.70 66.81 1br2 h VAL 100 Cb 1.73 1.29 -0.08 0.00 -1.52 0.00 0.00 31.29 32.71 1br2 h VAL 100 CO 0.20 0.15 0.32 0.25 0.02 0.00 0.00 177.57 178.51 1br2 h LEU 101 N -0.64 0.36 -0.04 2.57 5.85 -0.95 -0.11 115.31 122.35 1br2 h LEU 101 Ca -0.03 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1br2 h LEU 101 Cb 0.46 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.53 1br2 h LEU 101 CO 0.05 0.18 0.02 -0.74 -0.34 0.00 0.00 178.44 177.60 1br2 h HIS 102 N 0.51 0.05 -0.73 1.25 2.76 -1.12 0.46 115.15 118.33 1br2 h HIS 102 Ca 0.38 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.61 1br2 h HIS 102 Cb 0.49 -0.02 -0.05 0.00 1.55 0.00 0.00 27.41 29.39 1br2 h HIS 102 CO -0.14 0.18 0.48 -0.97 -1.30 0.00 0.00 177.93 176.18 1br2 h ASN 103 N -0.08 0.64 0.06 3.26 -1.24 0.01 -0.52 115.58 117.72 1br2 h ASN 103 Ca 0.01 0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.03 1br2 h ASN 103 Cb 0.14 -0.13 0.00 0.00 0.73 0.00 0.00 38.32 39.06 1br2 h ASN 103 CO -0.00 0.41 -0.03 -0.07 -1.29 0.00 0.00 177.43 176.45 1br2 h LEU 104 N 0.73 -0.07 -0.62 0.34 3.38 -0.79 -2.82 115.31 115.45 1br2 h LEU 104 Ca 0.32 -0.54 0.12 0.00 0.09 0.00 0.00 57.88 57.87 1br2 h LEU 104 Cb 0.31 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.99 1br2 h LEU 104 CO -0.11 0.55 0.13 -0.09 0.09 0.00 0.00 178.44 179.01 1br2 h ARG 105 N -0.75 0.25 0.98 1.13 2.43 -0.42 0.13 114.38 118.13 1br2 h ARG 105 Ca -0.01 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 1br2 h ARG 105 Cb 0.61 -0.06 0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1br2 h ARG 105 CO 0.01 0.16 -0.48 0.93 -1.51 0.00 0.00 179.97 179.09 1br2 h GLU 106 N 0.26 -1.28 -1.00 0.20 5.08 -1.18 -1.79 114.58 114.86 1br2 h GLU 106 Ca 0.33 0.09 0.15 0.00 -1.00 0.00 0.00 59.36 58.92 1br2 h GLU 106 Cb 0.50 0.29 -0.09 0.00 0.50 0.00 0.00 28.75 29.95 1br2 h GLU 106 CO -0.42 -0.85 0.62 0.00 -1.00 0.00 0.00 179.01 177.35 1br2 h ARG 107 N -1.33 0.88 0.17 2.33 3.08 -1.23 -1.05 114.38 117.23 1br2 h ARG 107 Ca -0.13 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 59.86 1br2 h ARG 107 Cb 1.02 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1br2 h ARG 107 CO 0.22 0.58 -0.20 -0.92 -1.07 0.00 0.00 179.97 178.58 1br2 h TYR 108 N 0.90 -0.55 0.00 3.04 3.20 -0.46 0.60 116.97 123.70 1br2 h TYR 108 Ca 0.53 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.40 1br2 h TYR 108 Cb 0.64 0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.13 1br2 h TYR 108 CO -0.01 -0.25 0.00 1.19 -1.64 0.00 0.00 178.16 177.45 1br2 n PHE 109 N -3.53 0.00 1.13 -3.82 3.72 -0.70 0.64 117.46 114.90 1br2 n PHE 109 Ca -0.04 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.48 1br2 n PHE 109 Cb 0.17 -0.43 0.32 0.00 -0.94 0.00 0.00 39.48 38.61 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 -1.43 2.27 0.00 4.37 7.64 -0.22 -4.92 113.62 121.33 1br2 n SER 110 Ca 0.01 -1.76 0.00 0.00 1.01 0.00 0.00 58.87 58.13 1br2 n SER 110 Cb 0.04 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 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 1.27 1.08 3.53 0.23 0.00 0.21 -5.02 105.19 106.49 1br2 n GLY 111 Ca 0.17 0.00 -0.43 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 4.44 0.00 0.99 1.43 0.19 -4.92 118.68 120.81 1br2 s LEU 112 Ca 0.00 -0.20 0.20 0.00 -1.03 0.00 0.00 54.13 53.09 1br2 s LEU 112 Cb 0.00 -2.72 -0.13 0.00 0.03 0.00 0.00 46.19 43.37 1br2 s LEU 112 CO 0.00 -0.71 0.90 2.30 0.23 0.00 0.00 176.35 179.07 1br2 n ILE 113 N 5.75 0.00 -4.23 -0.59 -5.35 -1.26 -2.70 119.36 110.98 1br2 n ILE 113 Ca -0.02 -0.14 -0.34 0.00 -0.27 0.00 0.00 62.75 61.98 1br2 n ILE 113 Cb 0.48 1.10 -0.11 0.00 -1.74 0.00 0.00 39.64 39.36 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 -2.61 3.11 -0.08 4.28 2.02 -1.26 -2.14 117.35 120.66 1br2 s TYR 114 Ca 0.11 -0.18 -0.03 0.00 -0.37 0.00 0.00 57.07 56.60 1br2 s TYR 114 Cb 0.15 -2.01 0.04 0.00 -0.40 0.00 0.00 41.96 39.74 1br2 s TYR 114 CO 0.68 0.01 0.13 0.99 -1.57 0.00 0.00 175.55 175.80 1br2 s THR 115 N 0.42 -0.22 0.29 -0.71 2.01 -0.44 -4.50 115.64 112.50 1br2 s THR 115 Ca -0.01 0.34 -0.29 0.00 0.31 0.00 0.00 61.69 62.04 1br2 s THR 115 Cb -0.14 -0.28 -0.10 0.00 0.01 0.00 0.00 72.50 72.00 1br2 s THR 115 CO 0.02 0.13 1.27 -0.31 -0.69 0.00 0.00 174.62 175.04 1br2 s TYR 116 N 2.26 3.20 -0.42 4.92 2.02 0.10 -1.17 117.35 128.26 1br2 s TYR 116 Ca 0.04 1.42 0.02 0.00 -0.37 0.00 0.00 57.07 58.17 1br2 s TYR 116 Cb -0.12 -3.59 0.14 0.00 -0.40 0.00 0.00 41.96 37.99 1br2 s TYR 116 CO -0.05 -1.63 0.25 -1.54 -1.57 0.00 0.00 175.55 171.01 1br2 s SER 117 N -0.37 3.22 1.01 2.29 1.04 -0.20 -1.98 113.70 118.73 1br2 s SER 117 Ca 0.50 -2.58 0.00 0.00 0.48 0.00 0.00 55.95 54.35 1br2 s SER 117 Cb -0.38 -0.78 0.00 0.00 0.10 0.00 0.00 66.02 64.97 1br2 s SER 117 CO 0.47 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 175.04 1br2 n GLY 118 N 3.56 0.63 0.12 7.32 0.00 -1.26 -3.36 105.19 112.20 1br2 n GLY 118 Ca 0.13 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.40 1br2 n GLY 118 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1br2 h LEU 119 N 0.00 -0.15 0.00 0.99 3.38 -1.96 -3.47 115.31 114.11 1br2 h LEU 119 Ca 0.00 -0.32 -0.36 0.00 0.09 0.00 0.00 57.88 57.29 1br2 h LEU 119 Cb 0.00 0.04 0.19 0.00 0.09 0.00 0.00 40.66 40.97 1br2 h LEU 119 CO 0.00 0.45 0.04 2.22 0.09 0.00 0.00 178.44 181.25 1br2 n PHE 120 N -4.87 -3.80 -4.13 1.13 -1.74 -1.21 -4.99 117.46 97.85 1br2 n PHE 120 Ca -0.06 -0.88 -0.15 0.00 -0.56 0.00 0.00 57.45 55.80 1br2 n PHE 120 Cb 0.23 -1.08 -0.11 0.00 1.52 0.00 0.00 39.48 40.03 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 -1.78 2.07 -0.02 0.00 1.01 -0.31 0.29 120.40 121.66 1br2 s VAL 122 Ca -0.02 -1.34 0.00 0.00 0.00 0.00 0.00 61.98 60.62 1br2 s VAL 122 Cb -0.07 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.57 1br2 s VAL 122 CO 0.01 0.36 0.00 -0.69 0.00 0.00 0.00 175.10 174.78 1br2 s VAL 123 N -0.79 0.12 -0.19 2.92 1.01 -0.23 -1.32 120.40 121.94 1br2 s VAL 123 Ca 0.11 0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.14 1br2 s VAL 123 Cb -0.10 -0.22 -0.02 0.00 0.00 0.00 0.00 36.38 36.04 1br2 s VAL 123 CO 0.02 0.12 -0.01 -0.63 0.00 0.00 0.00 175.10 174.60 1br2 s ILE 124 N 0.93 3.92 -0.21 2.22 1.01 -0.91 0.73 121.20 128.89 1br2 s ILE 124 Ca -0.09 -0.33 -0.36 0.00 0.00 0.00 0.00 60.65 59.87 1br2 s ILE 124 Cb -0.12 -2.76 -0.13 0.00 0.01 0.00 0.00 42.46 39.46 1br2 s ILE 124 CO -0.02 0.45 1.90 -3.20 0.00 0.00 0.00 174.94 174.07 1br2 n ASN 125 N 4.03 2.86 0.17 3.58 2.85 -0.65 -4.83 115.26 123.27 1br2 n ASN 125 Ca -0.17 0.89 0.05 0.00 -0.11 0.00 0.00 54.58 55.24 1br2 n ASN 125 Cb 0.52 -1.28 0.19 0.00 1.24 0.00 0.00 39.78 40.46 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 9.24 0.00 -1.36 1.20 0.13 -1.93 -3.42 132.00 135.86 1br2 h PRO 126 Ca -0.44 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.32 1br2 h PRO 126 Cb 1.30 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.29 1br2 h PRO 126 CO 0.97 0.41 -0.35 0.66 -0.23 0.00 0.00 178.00 179.46 1br2 n TYR 127 N -3.34 -0.24 -3.63 1.56 4.01 -1.26 -4.14 117.16 110.11 1br2 n TYR 127 Ca 0.01 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.63 1br2 n TYR 127 Cb 0.61 -3.18 -0.05 0.00 -0.31 0.00 0.00 39.34 36.40 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 -3.68 1.00 0.19 -0.72 -2.85 -1.26 -4.41 119.74 108.01 1br2 s LYS 128 Ca 0.00 -0.44 -0.30 0.00 -1.00 0.00 0.00 55.97 54.23 1br2 s LYS 128 Cb 0.00 0.45 -0.08 0.00 -2.06 0.00 0.00 37.83 36.13 1br2 s LYS 128 CO 0.00 -0.36 1.19 -0.65 0.10 0.00 0.00 175.35 175.62 1br2 s GLN 129 N -2.90 4.50 -0.02 1.78 -1.52 -1.26 -5.03 119.66 115.21 1br2 s GLN 129 Ca -0.03 1.86 0.05 0.00 -1.95 0.00 0.00 55.36 55.29 1br2 s GLN 129 Cb 0.00 -3.24 -0.01 0.00 -0.22 0.00 0.00 33.01 29.54 1br2 s GLN 129 CO -0.05 -0.06 -0.16 -0.51 -0.25 0.00 0.00 175.29 174.25 1br2 s LEU 130 N -0.33 1.98 -1.15 2.90 1.43 -1.26 -5.04 118.68 117.20 1br2 s LEU 130 Ca 0.52 -0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 53.19 1br2 s LEU 130 Cb -0.32 -0.88 -0.07 0.00 0.03 0.00 0.00 46.19 44.95 1br2 s LEU 130 CO 0.37 0.18 2.30 -0.81 0.23 0.00 0.00 176.35 178.62 1br2 n PRO 131 N 2.87 2.49 0.00 1.29 -0.04 -1.26 -4.15 135.00 136.20 1br2 n PRO 131 Ca -0.16 -1.92 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 4.58 0.14 -1.43 0.52 -5.35 -1.26 -4.84 119.36 111.72 1br2 n ILE 132 Ca 0.55 -0.18 0.07 0.00 -0.27 0.00 0.00 62.75 62.92 1br2 n ILE 132 Cb 0.26 1.20 0.18 0.00 -1.74 0.00 0.00 39.64 39.53 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 -0.07 0.00 -0.71 4.28 4.01 -1.26 -4.93 117.16 118.48 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 0.36 -0.21 0.26 0.00 -0.31 0.00 0.00 39.34 39.44 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 0.02 0.03 7.72 1.04 -1.26 -4.90 113.70 113.27 1br2 s SER 134 Ca 0.35 0.82 0.07 0.00 0.48 0.00 0.00 55.95 57.68 1br2 s SER 134 Cb 0.33 -1.18 -0.23 0.00 0.10 0.00 0.00 66.02 65.04 1br2 s SER 134 CO -0.04 -4.70 0.93 -0.08 0.98 0.00 0.00 173.24 170.34 1br2 h GLU 135 N -2.97 0.05 -0.57 4.02 4.81 -1.99 -2.98 114.58 114.96 1br2 h GLU 135 Ca -0.46 -0.08 0.05 0.00 -0.13 0.00 0.00 59.36 58.73 1br2 h GLU 135 Cb 1.32 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.68 1br2 h GLU 135 CO 0.33 0.81 0.31 -0.22 -0.73 0.00 0.00 179.01 179.51 1br2 h LYS 136 N 0.01 0.57 -0.14 1.92 3.64 -1.99 -0.19 116.57 120.40 1br2 h LYS 136 Ca -0.17 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.07 1br2 h LYS 136 Cb 1.92 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.60 1br2 h LYS 136 CO 0.11 0.38 -0.37 0.82 -2.27 0.00 0.00 179.45 178.12 1br2 h ILE 137 N 0.59 1.29 -0.46 2.00 2.04 -1.93 -0.84 117.51 120.20 1br2 h ILE 137 Ca 0.25 -1.43 -0.02 0.00 1.00 0.00 0.00 64.86 64.66 1br2 h ILE 137 Cb 0.13 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1br2 h ILE 137 CO -0.16 0.43 0.21 0.40 0.00 0.00 0.00 178.15 179.04 1br2 h ILE 138 N 0.24 1.16 0.18 -0.67 2.04 -0.95 -1.72 117.51 117.80 1br2 h ILE 138 Ca 0.03 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 1br2 h ILE 138 Cb 0.77 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 1br2 h ILE 138 CO 0.06 0.19 -0.09 0.44 0.00 0.00 0.00 178.15 178.75 1br2 h ASP 139 N 0.64 -0.20 -0.51 1.72 3.32 0.08 -2.51 116.42 118.96 1br2 h ASP 139 Ca 0.16 -0.23 0.15 0.00 0.02 0.00 0.00 57.03 57.13 1br2 h ASP 139 Cb 0.08 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1br2 h ASP 139 CO -0.02 0.13 0.56 0.24 -1.72 0.00 0.00 179.24 178.43 1br2 h MET 140 N -0.56 0.00 -0.02 3.56 2.86 -0.63 0.23 114.93 120.37 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 0.42 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 1br2 h MET 140 CO 0.04 0.00 -0.36 0.66 1.06 0.00 0.00 176.91 178.31 1br2 n TYR 141 N -3.63 0.00 -1.69 -0.22 4.01 -0.70 -4.84 117.16 110.09 1br2 n TYR 141 Ca 0.10 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.40 1br2 n TYR 141 Cb 0.76 -0.01 -0.04 0.00 -0.31 0.00 0.00 39.34 39.74 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 0.20 2.58 -1.51 -0.72 4.81 0.82 -2.04 118.16 122.30 1br2 n LYS 142 Ca 0.11 0.94 -0.15 0.00 -0.87 0.00 0.00 58.31 58.33 1br2 n LYS 142 Cb 0.48 -2.79 -0.06 0.00 0.02 0.00 0.00 35.03 32.68 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 4.04 1.25 3.78 3.14 0.00 -1.26 -4.94 105.19 111.21 1br2 n GLY 143 Ca 0.18 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 -3.39 4.54 0.28 1.61 -0.14 -0.86 -5.04 119.74 116.73 1br2 s LYS 144 Ca 0.00 1.21 -0.22 0.00 -1.36 0.00 0.00 55.97 55.60 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 0.83 0.15 -0.76 0.00 0.00 175.35 175.95 1br2 s LYS 145 N -1.80 4.37 0.31 1.68 -0.14 -1.26 -4.71 119.74 118.19 1br2 s LYS 145 Ca 0.45 1.06 0.07 0.00 -1.36 0.00 0.00 55.97 56.19 1br2 s LYS 145 Cb -0.20 -2.78 0.87 0.00 -1.68 0.00 0.00 37.83 34.05 1br2 s LYS 145 CO 0.24 0.31 1.62 -0.09 -0.76 0.00 0.00 175.35 176.67 1br2 h ARG 146 N 3.15 0.15 0.00 1.68 2.43 -1.92 0.57 114.38 120.44 1br2 h ARG 146 Ca -0.47 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1br2 h ARG 146 Cb 1.19 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1br2 h ARG 146 CO 0.65 0.10 0.00 1.12 -1.51 0.00 0.00 179.97 180.33 1br2 h HIS 147 N 0.15 0.00 -0.00 2.20 2.07 -1.98 -3.15 115.15 114.45 1br2 h HIS 147 Ca 0.63 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.15 1br2 h HIS 147 Cb 1.39 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.37 1br2 h HIS 147 CO -0.24 0.00 -0.19 0.39 -3.07 0.00 0.00 177.93 174.83 1br2 n GLU 148 N -2.71 0.27 -3.83 5.12 1.02 0.20 -4.87 120.64 115.83 1br2 n GLU 148 Ca 0.03 -0.09 -0.12 0.00 -0.02 0.00 0.00 57.16 56.96 1br2 n GLU 148 Cb 0.36 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.17 1br2 n GLU 148 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1br2 s MET 149 N -2.80 0.32 0.80 3.49 -1.94 -1.17 -4.93 119.30 113.08 1br2 s MET 149 Ca 0.19 -0.00 -0.15 0.00 -1.71 0.00 0.00 55.69 54.01 1br2 s MET 149 Cb 0.19 0.14 -0.03 0.00 2.01 0.00 0.00 34.83 37.15 1br2 s MET 149 CO 0.56 -0.06 0.39 -0.35 -0.01 0.00 0.00 175.02 175.54 1br2 n PRO 150 N 2.38 0.09 -1.74 2.03 -0.04 -1.26 -4.81 135.00 131.65 1br2 n PRO 150 Ca -0.16 0.07 -0.42 0.00 -0.04 0.00 0.00 63.50 62.95 1br2 n PRO 150 Cb 0.57 -1.76 -0.02 0.00 -0.04 0.00 0.00 33.50 32.25 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 -0.76 2.75 -3.66 0.54 -0.02 -1.26 -4.92 135.00 127.67 1br2 n PRO 151 Ca 0.08 0.98 -0.15 0.00 -2.02 0.00 0.00 63.50 62.39 1br2 n PRO 151 Cb 0.51 -2.79 -0.08 0.00 -0.02 0.00 0.00 33.50 31.12 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 0.38 -0.39 0.50 6.00 2.46 -1.26 -4.56 115.29 118.43 1br2 s HIS 152 Ca 0.67 0.66 0.32 0.00 0.47 0.00 0.00 55.06 57.18 1br2 s HIS 152 Cb -0.49 0.22 1.77 0.00 -0.13 0.00 0.00 32.58 33.95 1br2 s HIS 152 CO 0.43 -0.47 2.19 0.97 -2.47 0.00 0.00 174.74 175.39 1br2 h ILE 153 N 3.55 0.40 -0.29 0.89 6.09 -1.98 -0.61 117.51 125.55 1br2 h ILE 153 Ca -0.28 -0.25 -0.05 0.00 -1.37 0.00 0.00 64.86 62.91 1br2 h ILE 153 Cb 1.16 1.17 -0.01 0.00 0.47 0.00 0.00 36.82 39.62 1br2 h ILE 153 CO 0.39 0.05 0.01 1.88 -3.07 0.00 0.00 178.15 177.40 1br2 h TYR 154 N 0.00 0.56 -0.66 2.19 0.05 -1.95 -1.03 116.97 116.13 1br2 h TYR 154 Ca -0.00 -0.09 0.07 0.00 0.05 0.00 0.00 58.73 58.76 1br2 h TYR 154 Cb 0.17 -0.15 -0.06 0.00 1.01 0.00 0.00 36.73 37.70 1br2 h TYR 154 CO 0.00 0.65 0.33 0.00 -1.05 0.00 0.00 178.16 178.09 1br2 h ALA 155 N 0.84 0.89 -0.22 3.88 0.00 -1.46 0.51 119.26 123.70 1br2 h ALA 155 Ca 0.08 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1br2 h ALA 155 Cb 0.42 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1br2 h ALA 155 CO 0.01 -0.03 0.10 0.82 0.00 0.00 0.00 179.25 180.15 1br2 h ILE 156 N 0.60 0.99 0.30 0.00 5.03 -1.14 0.27 117.51 123.56 1br2 h ILE 156 Ca 0.31 -0.07 -0.00 0.00 -0.12 0.00 0.00 64.86 64.97 1br2 h ILE 156 Cb 0.27 0.75 -0.01 0.00 -3.03 0.00 0.00 36.82 34.80 1br2 h ILE 156 CO -0.23 0.04 -0.24 0.00 -0.68 0.00 0.00 178.15 177.04 1br2 h ALA 157 N 1.11 -0.54 0.32 1.87 0.00 0.03 -1.69 119.26 120.36 1br2 h ALA 157 Ca 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1br2 h ALA 157 Cb 0.03 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1br2 h ALA 157 CO -0.07 -0.83 -0.18 0.22 0.00 0.00 0.00 179.25 178.39 1br2 h ASP 158 N -0.55 -0.45 0.16 0.00 1.82 0.33 -0.54 116.42 117.18 1br2 h ASP 158 Ca -0.02 0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.63 1br2 h ASP 158 Cb 0.49 0.13 -0.00 0.00 0.68 0.00 0.00 39.33 40.63 1br2 h ASP 158 CO -0.02 -0.30 -0.06 0.71 -1.61 0.00 0.00 179.24 177.96 1br2 h THR 159 N -0.48 0.57 -0.03 2.25 1.35 -0.48 0.69 112.91 116.77 1br2 h THR 159 Ca -0.04 -0.25 -0.17 0.00 -0.55 0.00 0.00 66.41 65.41 1br2 h THR 159 Cb 0.39 1.16 0.01 0.00 -1.73 0.00 0.00 68.15 67.98 1br2 h THR 159 CO 0.05 0.06 -0.63 0.00 -0.25 0.00 0.00 175.52 174.74 1br2 h ALA 160 N 1.94 0.12 0.11 6.62 0.00 -0.99 -2.22 119.26 124.84 1br2 h ALA 160 Ca -0.00 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 1br2 h ALA 160 Cb 0.15 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1br2 h ALA 160 CO 0.01 0.41 -0.12 -0.92 0.00 0.00 0.00 179.25 178.62 1br2 h TYR 161 N 0.03 -0.34 -0.45 0.00 3.20 0.58 -1.48 116.97 118.53 1br2 h TYR 161 Ca -0.07 0.00 0.09 0.00 3.14 0.00 0.00 58.73 61.89 1br2 h TYR 161 Cb 1.32 0.13 -0.10 0.00 1.54 0.00 0.00 36.73 39.62 1br2 h TYR 161 CO 0.13 -0.16 -0.25 0.00 -1.64 0.00 0.00 178.16 176.25 1br2 h ARG 162 N -0.23 -0.15 -1.04 1.82 2.47 -1.06 0.21 114.38 116.40 1br2 h ARG 162 Ca -0.01 0.01 0.27 0.00 -1.26 0.00 0.00 59.98 58.99 1br2 h ARG 162 Cb 0.20 0.03 -0.08 0.00 -1.65 0.00 0.00 29.97 28.48 1br2 h ARG 162 CO -0.02 -0.10 0.69 1.03 0.56 0.00 0.00 179.97 182.13 1br2 h SER 163 N -0.16 0.34 0.68 7.04 0.87 -1.29 0.64 113.55 121.68 1br2 h SER 163 Ca 0.21 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.79 1br2 h SER 163 Cb 0.48 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.45 1br2 h SER 163 CO -0.54 0.08 -0.33 -0.03 -0.53 0.00 0.00 176.83 175.48 1br2 h MET 164 N 0.31 -0.88 0.20 2.24 1.85 0.52 0.16 114.93 119.32 1br2 h MET 164 Ca 0.56 0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 59.70 1br2 h MET 164 Cb 1.60 0.20 0.00 0.00 0.43 0.00 0.00 31.60 33.83 1br2 h MET 164 CO -0.22 -0.58 -0.10 -0.07 -0.40 0.00 0.00 176.91 175.55 1br2 h LEU 165 N -0.94 -0.23 -0.63 3.39 3.38 -0.78 0.22 115.31 119.72 1br2 h LEU 165 Ca -0.09 -0.09 0.11 0.00 0.09 0.00 0.00 57.88 57.89 1br2 h LEU 165 Cb 0.71 0.06 -0.12 0.00 0.09 0.00 0.00 40.66 41.40 1br2 h LEU 165 CO 0.15 -0.05 -0.33 1.56 0.09 0.00 0.00 178.44 179.87 1br2 h GLN 166 N -0.40 -0.14 -0.57 1.13 1.08 0.25 -2.32 115.11 114.16 1br2 h GLN 166 Ca -0.03 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1br2 h GLN 166 Cb 0.31 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1br2 h GLN 166 CO 0.04 -0.09 0.00 -0.25 -0.95 0.00 0.00 178.83 177.58 1br2 n ASP 167 N -5.44 3.52 -4.27 1.46 8.00 0.04 -4.96 116.55 114.89 1br2 n ASP 167 Ca 0.05 -2.00 -0.35 0.00 0.71 0.00 0.00 54.79 53.19 1br2 n ASP 167 Cb 0.36 -0.38 -0.05 0.00 -0.02 0.00 0.00 41.12 41.03 1br2 n ASP 167 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1br2 n ARG 168 N 1.15 -2.25 -4.80 -1.24 5.12 0.75 -4.94 116.66 110.46 1br2 n ARG 168 Ca 0.19 0.28 -0.26 0.00 -1.93 0.00 0.00 57.85 56.13 1br2 n ARG 168 Cb 0.54 -4.67 -0.16 0.00 -1.16 0.00 0.00 32.46 27.01 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 1.73 0.32 5.56 -1.05 -1.03 -5.04 118.70 112.18 1br2 s GLU 169 Ca 0.52 -0.58 -0.29 0.00 -0.15 0.00 0.00 54.97 54.46 1br2 s GLU 169 Cb -0.29 -1.50 -0.11 0.00 -0.44 0.00 0.00 34.13 31.78 1br2 s GLU 169 CO 0.96 0.23 1.56 -0.51 0.95 0.00 0.00 175.26 178.45 1br2 s ASP 170 N 0.07 6.35 0.32 0.83 1.01 -1.26 -4.34 116.67 119.64 1br2 s ASP 170 Ca -0.04 3.00 0.08 0.00 0.71 0.00 0.00 52.55 56.30 1br2 s ASP 170 Cb -0.11 -2.65 -0.04 0.00 1.01 0.00 0.00 42.92 41.13 1br2 s ASP 170 CO 0.02 -0.91 0.12 -1.10 0.21 0.00 0.00 175.17 173.51 1br2 s GLN 171 N -1.05 2.41 -0.16 8.23 -1.52 -1.04 -0.26 119.66 126.27 1br2 s GLN 171 Ca 0.60 -1.47 -0.10 0.00 -1.95 0.00 0.00 55.36 52.44 1br2 s GLN 171 Cb -0.48 -2.22 0.05 0.00 -0.22 0.00 0.00 33.01 30.15 1br2 s GLN 171 CO 0.53 0.19 0.40 -1.54 -0.25 0.00 0.00 175.29 174.62 1br2 s SER 172 N -3.81 -0.47 -0.31 5.90 1.04 -0.36 -0.51 113.70 115.18 1br2 s SER 172 Ca 0.36 0.84 -0.06 0.00 0.48 0.00 0.00 55.95 57.58 1br2 s SER 172 Cb -0.04 0.76 0.02 0.00 0.10 0.00 0.00 66.02 66.86 1br2 s SER 172 CO 0.22 -0.18 0.07 -0.63 0.98 0.00 0.00 173.24 173.71 1br2 s ILE 173 N 1.06 3.74 -0.31 -1.02 1.01 0.03 0.06 121.20 125.77 1br2 s ILE 173 Ca -0.07 -0.91 -0.08 0.00 0.00 0.00 0.00 60.65 59.59 1br2 s ILE 173 Cb -0.07 -3.00 0.01 0.00 0.01 0.00 0.00 42.46 39.41 1br2 s ILE 173 CO -0.09 -0.01 0.11 -0.76 0.00 0.00 0.00 174.94 174.20 1br2 s LEU 174 N 1.44 4.07 -0.10 2.97 1.43 0.30 -2.06 118.68 126.73 1br2 s LEU 174 Ca 0.00 -0.78 -0.22 0.00 -1.03 0.00 0.00 54.13 52.10 1br2 s LEU 174 Cb -0.18 -1.92 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 1br2 s LEU 174 CO 0.02 -0.24 0.65 0.00 0.23 0.00 0.00 176.35 177.01 1br2 s THR 176 N 1.00 3.20 0.00 0.00 -4.23 0.17 -4.62 115.64 111.16 1br2 s THR 176 Ca 0.34 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 1br2 s THR 176 Cb -0.17 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.03 1br2 s THR 176 CO 0.15 -0.24 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 1br2 n GLY 177 N -0.37 4.05 3.76 3.99 0.00 -1.26 -0.44 105.19 114.92 1br2 n GLY 177 Ca -0.09 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.26 2.08 -0.16 1.61 -1.05 -1.26 -3.82 118.70 113.83 1br2 s GLU 178 Ca 0.00 1.21 -0.39 0.00 -0.15 0.00 0.00 54.97 55.64 1br2 s GLU 178 Cb 0.00 -1.87 -0.16 0.00 -0.44 0.00 0.00 34.13 31.66 1br2 s GLU 178 CO 0.00 -1.78 1.64 0.45 0.95 0.00 0.00 175.26 176.52 1br2 n SER 179 N -3.62 2.24 0.00 0.83 2.88 -0.24 -0.87 113.62 114.85 1br2 n SER 179 Ca 0.09 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 1br2 n SER 179 Cb 0.53 -1.17 0.00 0.00 -0.75 0.00 0.00 64.21 62.82 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 3.74 3.14 0.24 0.46 0.00 -1.26 -4.84 105.19 106.66 1br2 n GLY 180 Ca 0.24 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.26 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 0.54 0.00 4.61 0.00 -1.31 -3.46 119.26 119.63 1br2 h ALA 181 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1br2 h ALA 181 Cb 0.00 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1br2 h ALA 181 CO 0.00 -0.41 0.00 0.41 0.00 0.00 0.00 179.25 179.25 1br2 n GLY 182 N -1.39 -0.99 0.29 0.00 0.00 -1.26 -3.95 105.19 97.89 1br2 n GLY 182 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.14 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 0.01 -0.02 1.61 1.57 -1.88 -2.03 116.57 115.83 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 -0.03 1.15 -0.57 0.00 0.00 179.45 180.01 1br2 h THR 184 N 0.02 1.39 -0.95 -0.16 2.02 -1.95 0.13 112.91 113.40 1br2 h THR 184 Ca 0.40 -1.20 0.20 0.00 0.77 0.00 0.00 66.41 66.58 1br2 h THR 184 Cb 0.63 2.15 -0.08 0.00 -1.74 0.00 0.00 68.15 69.11 1br2 h THR 184 CO -0.80 0.32 0.61 -0.33 0.37 0.00 0.00 175.52 175.69 1br2 h GLU 185 N -0.42 0.52 0.17 6.66 4.39 -1.89 0.33 114.58 124.33 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 0.53 -0.12 0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1br2 h GLU 185 CO 0.01 0.34 -1.38 -0.91 -1.16 0.00 0.00 179.01 175.90 1br2 h ASN 186 N 0.53 0.56 -0.49 1.42 2.35 -1.28 -2.45 115.58 116.21 1br2 h ASN 186 Ca 0.52 -0.63 -0.04 0.00 -0.55 0.00 0.00 56.30 55.60 1br2 h ASN 186 Cb 1.11 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 39.27 1br2 h ASN 186 CO -0.25 1.50 0.16 0.74 -1.65 0.00 0.00 177.43 177.93 1br2 h THR 187 N 0.10 1.22 -0.28 2.81 2.02 0.49 -2.00 112.91 117.28 1br2 h THR 187 Ca -0.20 -0.74 0.04 0.00 0.77 0.00 0.00 66.41 66.28 1br2 h THR 187 Cb 2.05 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 69.23 1br2 h THR 187 CO 0.22 0.27 0.19 0.11 0.37 0.00 0.00 175.52 176.68 1br2 h LYS 188 N 0.66 0.20 -0.01 6.66 1.57 -0.42 -1.81 116.57 123.43 1br2 h LYS 188 Ca 0.16 -0.01 -0.20 0.00 -1.87 0.00 0.00 60.65 58.72 1br2 h LYS 188 Cb 0.25 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1br2 h LYS 188 CO -0.01 0.13 -0.87 0.87 -0.57 0.00 0.00 179.45 179.00 1br2 h LYS 189 N 0.21 0.28 -0.26 3.15 1.79 -0.91 -1.63 116.57 119.19 1br2 h LYS 189 Ca 0.12 -0.29 -0.04 0.00 -2.18 0.00 0.00 60.65 58.26 1br2 h LYS 189 Cb 0.22 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.94 1br2 h LYS 189 CO -0.02 0.99 0.02 0.28 -1.08 0.00 0.00 179.45 179.64 1br2 h VAL 190 N 0.16 1.25 -0.62 0.50 2.07 -0.65 -1.07 116.25 117.90 1br2 h VAL 190 Ca -0.05 -0.87 -0.09 0.00 0.82 0.00 0.00 66.70 66.51 1br2 h VAL 190 Cb 1.49 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 1br2 h VAL 190 CO 0.14 0.28 0.03 0.40 0.02 0.00 0.00 177.57 178.44 1br2 h ILE 191 N 0.25 1.26 -0.76 4.57 2.04 -1.42 -1.11 117.51 122.34 1br2 h ILE 191 Ca 0.08 -1.11 0.04 0.00 1.00 0.00 0.00 64.86 64.87 1br2 h ILE 191 Cb 0.39 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 1br2 h ILE 191 CO 0.01 0.41 0.47 -0.61 0.00 0.00 0.00 178.15 178.43 1br2 h GLN 192 N 0.97 0.87 0.62 2.37 4.15 -1.04 -0.35 115.11 122.70 1br2 h GLN 192 Ca 0.18 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.52 1br2 h GLN 192 Cb 0.51 -0.20 0.01 0.00 0.21 0.00 0.00 27.48 28.01 1br2 h GLN 192 CO 0.02 0.57 -0.30 -0.92 -1.93 0.00 0.00 178.83 176.28 1br2 h TYR 193 N 0.89 -0.77 -0.88 3.99 3.20 -0.94 -2.92 116.97 119.54 1br2 h TYR 193 Ca 0.32 -0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.34 1br2 h TYR 193 Cb 0.08 0.25 -0.10 0.00 1.54 0.00 0.00 36.73 38.50 1br2 h TYR 193 CO -0.04 -0.44 0.45 -0.07 -1.64 0.00 0.00 178.16 176.41 1br2 h LEU 194 N -1.15 0.51 -1.68 2.82 3.38 -1.03 0.45 115.31 118.61 1br2 h LEU 194 Ca -0.08 0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1br2 h LEU 194 Cb 0.67 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1br2 h LEU 194 CO 0.14 0.17 -0.18 0.00 0.09 0.00 0.00 178.44 178.66 1br2 h ALA 195 N 1.60 1.61 -0.03 1.53 0.00 -1.08 -2.61 119.26 120.28 1br2 h ALA 195 Ca 0.50 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1br2 h ALA 195 Cb 0.78 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1br2 h ALA 195 CO -0.40 0.22 0.00 0.28 0.00 0.00 0.00 179.25 179.35 1br2 n VAL 196 N -4.19 0.02 0.00 0.00 0.31 0.12 -3.81 118.33 110.79 1br2 n VAL 196 Ca -0.02 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 1br2 n VAL 196 Cb 0.25 0.32 0.00 0.00 -0.91 0.00 0.00 33.84 33.50 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 -0.01 0.00 0.49 2.52 0.24 -1.02 -4.85 118.33 115.72 1br2 n VAL 197 Ca 0.19 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.55 1br2 n VAL 197 Cb 0.31 -0.79 -0.01 0.00 -1.47 0.00 0.00 33.84 31.88 1br2 n VAL 197 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1br2 n ALA 198 N -1.85 2.96 -1.00 2.33 0.00 -1.03 -5.04 120.51 116.88 1br2 n ALA 198 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1br2 n ALA 198 Cb 0.42 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.48 1br2 n ALA 198 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1br2 n SER 199 N -0.36 0.00 -0.54 0.00 2.88 -1.25 -1.75 113.62 112.60 1br2 n SER 199 Ca 0.04 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.58 1br2 n SER 199 Cb 0.22 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.68 1br2 n SER 199 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1br2 n GLY 218 N 4.11 0.73 0.30 0.46 0.00 -1.26 -4.99 105.19 104.54 1br2 n GLY 218 Ca 0.00 -0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.48 -0.42 1.61 -0.00 -2.03 -2.56 114.58 110.73 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 0.11 -0.05 0.00 -0.00 0.00 0.00 28.75 30.05 1br2 h GLU 219 CO -0.00 -0.32 -0.25 -0.11 -0.00 0.00 0.00 179.01 178.33 1br2 n LEU 220 N -4.29 -0.45 -0.15 3.06 7.94 -1.26 0.16 117.00 122.01 1br2 n LEU 220 Ca -0.06 0.97 -0.03 0.00 -1.11 0.00 0.00 56.01 55.78 1br2 n LEU 220 Cb 0.26 -0.20 0.03 0.00 0.53 0.00 0.00 43.42 44.04 1br2 n LEU 220 CO 0.11 -0.72 0.77 -0.33 -1.11 0.00 0.00 177.39 176.10 1br2 h GLU 221 N 0.00 -0.00 -1.00 1.96 3.07 -1.89 0.97 114.58 117.69 1br2 h GLU 221 Ca 0.07 0.00 0.11 0.00 -0.50 0.00 0.00 59.36 59.04 1br2 h GLU 221 Cb 0.17 0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 28.00 1br2 h GLU 221 CO -0.40 -0.00 0.63 1.57 -1.40 0.00 0.00 179.01 179.41 1br2 h LYS 222 N -0.00 0.99 0.10 2.33 2.10 0.20 -1.23 116.57 121.06 1br2 h LYS 222 Ca 0.23 -0.06 -0.26 0.00 -2.00 0.00 0.00 60.65 58.56 1br2 h LYS 222 Cb 0.36 -0.22 -0.00 0.00 -0.90 0.00 0.00 32.23 31.46 1br2 h LYS 222 CO -0.50 0.65 -1.17 1.96 -2.00 0.00 0.00 179.45 178.39 1br2 h GLN 223 N 1.02 0.24 -0.82 0.07 4.20 0.12 -3.22 115.11 116.72 1br2 h GLN 223 Ca 0.49 -0.39 0.11 0.00 0.06 0.00 0.00 58.65 58.92 1br2 h GLN 223 Cb 0.44 0.14 -0.06 0.00 0.30 0.00 0.00 27.48 28.30 1br2 h GLN 223 CO -0.25 1.17 0.53 1.25 -0.67 0.00 0.00 178.83 180.86 1br2 h LEU 224 N 0.08 0.63 -0.02 1.46 5.85 0.20 0.40 115.31 123.91 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 1.90 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.82 1br2 h LEU 224 CO 0.19 0.36 0.00 0.18 -0.34 0.00 0.00 178.44 178.82 1br2 n LEU 225 N -4.52 0.03 -0.01 2.25 4.77 -0.66 -2.89 117.00 115.98 1br2 n LEU 225 Ca 0.15 -0.01 0.06 0.00 -0.03 0.00 0.00 56.01 56.18 1br2 n LEU 225 Cb 0.39 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.38 1br2 n LEU 225 CO 0.31 0.01 -0.57 0.00 -1.33 0.00 0.00 177.39 175.81 1br2 n GLN 226 N -0.83 0.74 -0.08 3.23 1.13 0.14 -4.57 117.38 117.14 1br2 n GLN 226 Ca 0.17 -0.10 -0.07 0.00 -1.94 0.00 0.00 57.00 55.06 1br2 n GLN 226 Cb 0.08 -1.28 -0.05 0.00 0.11 0.00 0.00 30.24 29.10 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 1.28 -0.53 0.22 -1.58 0.00 -1.29 -1.38 119.26 115.97 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 0.55 0.94 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1br2 h ALA 227 CO 0.00 -0.67 -0.10 -0.91 0.00 0.00 0.00 179.25 177.56 1br2 h ASN 228 N -0.19 -0.25 -1.25 0.00 2.35 -1.83 0.13 115.58 114.53 1br2 h ASN 228 Ca 0.04 -0.01 0.36 0.00 -0.55 0.00 0.00 56.30 56.14 1br2 h ASN 228 Cb 0.30 0.06 -0.08 0.00 0.05 0.00 0.00 38.32 38.65 1br2 h ASN 228 CO -0.31 -0.15 0.86 -0.65 -1.65 0.00 0.00 177.43 175.52 1br2 h PRO 229 N -0.32 0.13 0.02 0.81 0.11 -1.76 1.06 132.00 132.06 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 0.24 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.32 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 0.91 -0.33 4.15 2.04 -0.48 -3.21 117.51 120.72 1br2 h ILE 230 Ca 0.66 -1.64 0.04 0.00 1.00 0.00 0.00 64.86 64.93 1br2 h ILE 230 Cb 2.26 1.70 -0.04 0.00 -0.74 0.00 0.00 36.82 40.01 1br2 h ILE 230 CO -0.18 0.30 0.09 -0.07 0.00 0.00 0.00 178.15 178.30 1br2 h LEU 231 N -0.99 0.06 -0.90 1.44 3.38 0.10 -2.03 115.31 116.38 1br2 h LEU 231 Ca -0.00 0.05 0.15 0.00 0.09 0.00 0.00 57.88 58.16 1br2 h LEU 231 Cb 0.51 0.05 -0.09 0.00 0.09 0.00 0.00 40.66 41.22 1br2 h LEU 231 CO 0.00 0.07 0.50 -0.08 0.09 0.00 0.00 178.44 179.03 1br2 h GLU 232 N 0.21 0.69 -0.33 1.13 4.81 0.93 0.11 114.58 122.14 1br2 h GLU 232 Ca 0.15 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.38 1br2 h GLU 232 Cb 0.15 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1br2 h GLU 232 CO -0.18 0.46 0.23 0.00 -0.73 0.00 0.00 179.01 178.78 1br2 h ALA 233 N 1.57 1.97 0.00 2.92 0.00 -1.37 0.24 119.26 124.59 1br2 h ALA 233 Ca 0.49 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.28 1br2 h ALA 233 Cb 0.66 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1br2 h ALA 233 CO -0.35 -0.03 -1.95 1.19 0.00 0.00 0.00 179.25 178.12 1br2 n PHE 234 N -4.48 0.00 0.39 0.00 3.01 -0.70 0.09 117.46 115.76 1br2 n PHE 234 Ca 0.03 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.54 1br2 n PHE 234 Cb 0.21 -0.56 0.01 0.00 -0.01 0.00 0.00 39.48 39.13 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 1.64 -0.29 3.87 1.37 0.00 0.30 -4.85 105.19 107.22 1br2 n GLY 235 Ca -0.12 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.42 1br2 n GLY 235 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1br2 s ASN 236 N -1.09 5.79 0.10 1.61 -0.87 0.84 -1.13 114.94 120.19 1br2 s ASN 236 Ca 0.08 -0.11 -0.25 0.00 -1.57 0.00 0.00 52.86 51.01 1br2 s ASN 236 Cb 0.07 -1.57 0.08 0.00 -0.02 0.00 0.00 41.25 39.82 1br2 s ASN 236 CO 0.19 -0.02 0.72 0.00 -2.57 0.00 0.00 177.10 175.42 1br2 s ALA 237 N -2.00 -1.68 -0.29 0.60 0.00 0.39 -2.05 121.76 116.74 1br2 s ALA 237 Ca 0.33 0.66 -0.27 0.00 0.00 0.00 0.00 51.96 52.69 1br2 s ALA 237 Cb -0.09 0.70 0.01 0.00 0.00 0.00 0.00 23.12 23.74 1br2 s ALA 237 CO 0.26 -0.75 0.95 0.21 0.00 0.00 0.00 175.76 176.43 1br2 s LYS 238 N -3.50 4.08 0.38 0.00 2.20 -1.10 -0.95 119.74 120.85 1br2 s LYS 238 Ca 0.03 0.95 0.08 0.00 -0.36 0.00 0.00 55.97 56.67 1br2 s LYS 238 Cb -0.01 -3.71 -0.04 0.00 -1.51 0.00 0.00 37.83 32.56 1br2 s LYS 238 CO -0.11 -0.74 0.20 0.95 -0.36 0.00 0.00 175.35 175.30 1br2 s THR 239 N 3.25 2.66 0.49 3.43 -4.23 0.41 -2.18 115.64 119.47 1br2 s THR 239 Ca 0.40 -1.63 0.25 0.00 -1.18 0.00 0.00 61.69 59.52 1br2 s THR 239 Cb -0.14 -2.99 0.29 0.00 1.34 0.00 0.00 72.50 71.00 1br2 s THR 239 CO 0.12 -0.08 2.12 -0.37 -0.54 0.00 0.00 174.62 175.88 1br2 h VAL 240 N 1.40 0.70 0.13 2.29 -1.51 -1.89 -2.40 116.25 114.98 1br2 h VAL 240 Ca -0.43 -0.33 -0.30 0.00 -1.23 0.00 0.00 66.70 64.41 1br2 h VAL 240 Cb 1.25 1.20 -0.00 0.00 -2.13 0.00 0.00 31.29 31.62 1br2 h VAL 240 CO 0.65 0.08 -1.46 0.11 -1.23 0.00 0.00 177.57 175.72 1br2 h LYS 241 N 0.00 0.28 -3.09 5.19 1.79 -1.94 -3.47 116.57 115.32 1br2 h LYS 241 Ca -0.00 -0.48 -0.16 0.00 -2.18 0.00 0.00 60.65 57.83 1br2 h LYS 241 Cb 0.19 0.18 -0.25 0.00 -1.58 0.00 0.00 32.23 30.77 1br2 h LYS 241 CO 0.01 1.17 -0.40 1.21 -1.08 0.00 0.00 179.45 180.36 1br2 s ASN 242 N -7.07 -0.27 0.12 0.86 3.84 -0.90 -4.62 114.94 106.90 1br2 s ASN 242 Ca -0.08 0.50 0.01 0.00 0.21 0.00 0.00 52.86 53.50 1br2 s ASN 242 Cb 0.07 0.53 -0.17 0.00 -0.55 0.00 0.00 41.25 41.12 1br2 s ASN 242 CO 0.87 -0.12 1.26 0.44 -2.79 0.00 0.00 177.10 176.76 1br2 h ASP 243 N 5.59 0.24 -2.07 -4.21 3.32 -1.83 1.19 116.42 118.64 1br2 h ASP 243 Ca -0.26 -0.24 -0.62 0.00 0.02 0.00 0.00 57.03 55.94 1br2 h ASP 243 Cb 1.19 -0.08 -0.40 0.00 0.22 0.00 0.00 39.33 40.26 1br2 h ASP 243 CO 0.34 1.13 -0.46 -3.20 -1.72 0.00 0.00 179.24 175.34 1br2 n ASN 244 N -3.52 4.91 -4.70 6.45 5.15 -1.26 -2.72 115.26 119.58 1br2 n ASN 244 Ca -0.04 -3.70 -0.42 0.00 -0.60 0.00 0.00 54.58 49.82 1br2 n ASN 244 Cb 0.93 -0.60 -0.03 0.00 -0.53 0.00 0.00 39.78 39.54 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 -3.22 7.22 -0.12 1.20 0.15 -0.12 -4.78 113.70 114.02 1br2 s SER 245 Ca 0.48 1.48 -0.29 0.00 0.70 0.00 0.00 55.95 58.32 1br2 s SER 245 Cb 0.31 -2.53 -0.04 0.00 -1.71 0.00 0.00 66.02 62.06 1br2 s SER 245 CO -0.16 -0.32 1.51 -0.44 1.20 0.00 0.00 173.24 175.03 1br2 s SER 246 N 1.02 6.72 -0.53 5.45 0.01 -1.26 -0.46 113.70 124.65 1br2 s SER 246 Ca 0.47 1.95 0.02 0.00 1.31 0.00 0.00 55.95 59.70 1br2 s SER 246 Cb -0.19 -2.53 0.54 0.00 0.21 0.00 0.00 66.02 64.04 1br2 s SER 246 CO 0.21 -0.92 1.89 0.54 0.41 0.00 0.00 173.24 175.37 1br2 n ARG 247 N 7.04 2.51 -3.63 12.44 5.12 -0.28 -4.80 116.66 135.06 1br2 n ARG 247 Ca 0.16 -3.24 -0.09 0.00 -1.93 0.00 0.00 57.85 52.76 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 -3.57 -0.44 0.73 -1.55 -0.71 -1.26 -1.62 117.98 109.57 1br2 s PHE 248 Ca 0.59 1.02 -0.11 0.00 -1.04 0.00 0.00 56.93 57.39 1br2 s PHE 248 Cb 0.48 0.38 0.03 0.00 -1.21 0.00 0.00 43.02 42.71 1br2 s PHE 248 CO 0.04 -0.24 1.09 0.20 -1.34 0.00 0.00 175.22 174.97 1br2 s GLY 249 N -0.03 1.63 -0.26 1.99 0.00 0.28 -4.43 107.32 106.50 1br2 s GLY 249 Ca 0.02 -0.26 -0.15 0.00 0.00 0.00 0.00 44.72 44.33 1br2 s GLY 249 CO -0.05 0.12 0.65 1.25 0.00 0.00 0.00 173.10 175.07 1br2 s LYS 250 N -5.26 0.67 -0.35 2.90 2.20 -0.57 -0.38 119.74 118.94 1br2 s LYS 250 Ca 0.59 1.16 -0.03 0.00 -0.36 0.00 0.00 55.97 57.33 1br2 s LYS 250 Cb -0.12 0.13 0.07 0.00 -1.51 0.00 0.00 37.83 36.39 1br2 s LYS 250 CO 0.53 -0.15 0.10 0.12 -0.36 0.00 0.00 175.35 175.58 1br2 s PHE 251 N 1.56 3.37 -0.24 4.03 5.36 0.12 -0.79 117.98 131.39 1br2 s PHE 251 Ca -0.10 -1.95 -0.17 0.00 -0.96 0.00 0.00 56.93 53.75 1br2 s PHE 251 Cb -0.05 -2.53 -0.03 0.00 -0.34 0.00 0.00 43.02 40.06 1br2 s PHE 251 CO -0.18 -0.84 0.49 0.42 -1.46 0.00 0.00 175.22 173.64 1br2 s ILE 252 N 1.25 5.10 -0.30 3.12 1.09 0.67 -1.83 121.20 130.31 1br2 s ILE 252 Ca 0.00 0.84 -0.03 0.00 -1.10 0.00 0.00 60.65 60.36 1br2 s ILE 252 Cb -0.21 -3.80 0.04 0.00 -1.06 0.00 0.00 42.46 37.43 1br2 s ILE 252 CO -0.01 0.13 0.02 -0.60 -0.10 0.00 0.00 174.94 174.38 1br2 s ARG 253 N 2.04 2.61 -0.20 2.79 3.52 -0.79 -0.06 118.95 128.85 1br2 s ARG 253 Ca 0.21 -1.15 -0.16 0.00 -0.13 0.00 0.00 55.73 54.50 1br2 s ARG 253 Cb -0.15 -3.23 -0.04 0.00 -1.56 0.00 0.00 34.95 29.96 1br2 s ARG 253 CO 0.09 -0.57 0.38 0.42 -0.81 0.00 0.00 175.30 174.81 1br2 s ILE 254 N 1.33 5.21 -0.15 4.11 1.01 -1.06 -1.29 121.20 130.35 1br2 s ILE 254 Ca -0.03 0.68 -0.13 0.00 0.00 0.00 0.00 60.65 61.17 1br2 s ILE 254 Cb -0.19 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 1br2 s ILE 254 CO -0.00 0.26 0.27 0.20 0.00 0.00 0.00 174.94 175.66 1br2 s ASN 255 N 1.03 6.44 0.24 3.58 0.01 -1.11 -0.62 114.94 124.51 1br2 s ASN 255 Ca 0.18 0.51 0.10 0.00 -0.71 0.00 0.00 52.86 52.94 1br2 s ASN 255 Cb -0.15 -2.16 -0.05 0.00 0.41 0.00 0.00 41.25 39.30 1br2 s ASN 255 CO 0.08 0.16 -0.16 -0.36 -1.51 0.00 0.00 177.10 175.31 1br2 s PHE 256 N 0.15 1.98 0.75 2.20 0.40 0.15 0.16 117.98 123.77 1br2 s PHE 256 Ca 0.16 -0.47 -0.04 0.00 -0.60 0.00 0.00 56.93 55.98 1br2 s PHE 256 Cb -0.13 -0.90 0.12 0.00 0.51 0.00 0.00 43.02 42.62 1br2 s PHE 256 CO 0.04 0.52 1.03 0.16 0.70 0.00 0.00 175.22 177.67 1br2 s ASP 257 N -3.41 4.27 0.54 1.36 1.47 -0.21 -1.91 116.67 118.77 1br2 s ASP 257 Ca 0.26 -0.14 0.36 0.00 1.18 0.00 0.00 52.55 54.21 1br2 s ASP 257 Cb -0.02 -0.25 1.88 0.00 -0.34 0.00 0.00 42.92 44.19 1br2 s ASP 257 CO 0.11 -1.92 2.10 -0.37 0.68 0.00 0.00 175.17 175.76 1br2 h VAL 258 N -0.67 0.00 0.00 2.11 -1.51 -1.93 -0.11 116.25 114.14 1br2 h VAL 258 Ca -0.39 -0.08 -0.16 0.00 -1.23 0.00 0.00 66.70 64.84 1br2 h VAL 258 Cb 1.27 0.92 -0.02 0.00 -2.13 0.00 0.00 31.29 31.33 1br2 h VAL 258 CO 0.43 0.00 -0.76 0.74 -1.23 0.00 0.00 177.57 176.75 1br2 h THR 259 N 0.00 1.41 0.00 7.19 2.02 -2.03 -3.47 112.91 118.02 1br2 h THR 259 Ca 0.00 -2.74 0.00 0.00 0.77 0.00 0.00 66.41 64.44 1br2 h THR 259 Cb 0.09 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 69.03 1br2 h THR 259 CO 0.00 0.75 0.00 0.61 0.37 0.00 0.00 175.52 177.25 1br2 n GLY 260 N 0.99 0.99 3.76 2.16 0.00 -0.05 -5.10 105.19 107.94 1br2 n GLY 260 Ca 0.00 0.00 -0.40 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 3.94 0.37 1.61 -0.85 -1.26 -4.72 117.35 114.45 1br2 s TYR 261 Ca 0.00 1.87 -0.28 0.00 -0.52 0.00 0.00 57.07 58.14 1br2 s TYR 261 Cb 0.00 -2.95 -0.11 0.00 0.38 0.00 0.00 41.96 39.28 1br2 s TYR 261 CO 0.00 0.43 1.48 0.42 -1.52 0.00 0.00 175.55 176.37 1br2 s ILE 262 N -1.24 2.06 0.00 -3.49 1.01 -0.72 -1.05 121.20 117.78 1br2 s ILE 262 Ca 0.42 0.07 0.00 0.00 0.00 0.00 0.00 60.65 61.13 1br2 s ILE 262 Cb -0.25 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.18 1br2 s ILE 262 CO 0.30 0.02 0.00 0.52 0.00 0.00 0.00 174.94 175.78 1br2 n VAL 263 N 0.50 0.00 -3.22 2.92 0.31 0.42 -4.81 118.33 114.45 1br2 n VAL 263 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1br2 n VAL 263 Cb 0.39 -0.94 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 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 2.92 5.24 0.00 2.92 0.00 -0.82 -4.94 105.19 110.51 1br2 n GLY 264 Ca 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1br2 n GLY 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1br2 n ALA 265 N -3.00 0.00 -3.74 4.61 0.00 -1.09 -2.75 120.51 114.54 1br2 n ALA 265 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 1br2 n ALA 265 Cb 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 19.45 19.27 1br2 n ALA 265 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1br2 s ASN 266 N 0.00 1.50 -0.23 0.00 2.47 -0.41 -4.02 114.94 114.25 1br2 s ASN 266 Ca 0.00 -0.06 -0.12 0.00 0.42 0.00 0.00 52.86 53.10 1br2 s ASN 266 Cb 0.00 -0.37 -0.05 0.00 -1.45 0.00 0.00 41.25 39.39 1br2 s ASN 266 CO 0.00 -0.21 0.24 -0.63 -3.72 0.00 0.00 177.10 172.78 1br2 s ILE 267 N 2.02 5.30 -0.15 -5.21 1.01 -1.26 -1.89 121.20 121.02 1br2 s ILE 267 Ca 0.05 0.35 -0.01 0.00 0.00 0.00 0.00 60.65 61.03 1br2 s ILE 267 Cb -0.12 -3.57 -0.01 0.00 0.01 0.00 0.00 42.46 38.76 1br2 s ILE 267 CO -0.05 0.31 -0.11 -0.70 0.00 0.00 0.00 174.94 174.39 1br2 s GLU 268 N 1.21 3.39 0.14 2.79 2.56 -0.76 -4.96 118.70 123.07 1br2 s GLU 268 Ca 0.11 -0.67 0.07 0.00 0.00 0.00 0.00 54.97 54.48 1br2 s GLU 268 Cb -0.14 -2.72 -0.04 0.00 2.00 0.00 0.00 34.13 33.23 1br2 s GLU 268 CO 0.06 0.13 -0.04 0.95 -0.56 0.00 0.00 175.26 175.80 1br2 s THR 269 N 0.58 3.63 0.06 -1.70 -4.23 -1.26 0.10 115.64 112.83 1br2 s THR 269 Ca -0.07 -1.31 0.05 0.00 -1.18 0.00 0.00 61.69 59.18 1br2 s THR 269 Cb -0.15 -2.77 -0.03 0.00 1.34 0.00 0.00 72.50 70.89 1br2 s THR 269 CO 0.03 0.00 -0.13 -0.31 -0.54 0.00 0.00 174.62 173.67 1br2 s TYR 270 N -1.49 1.15 -0.51 3.99 1.51 0.48 -4.93 117.35 117.55 1br2 s TYR 270 Ca 0.25 -0.44 -0.21 0.00 -1.01 0.00 0.00 57.07 55.65 1br2 s TYR 270 Cb -0.10 -0.65 0.03 0.00 -0.11 0.00 0.00 41.96 41.12 1br2 s TYR 270 CO 0.17 0.04 0.56 -0.11 -1.11 0.00 0.00 175.55 175.09 1br2 n LEU 271 N 1.42 -1.91 -4.70 -1.29 7.94 -1.26 0.10 117.00 117.31 1br2 n LEU 271 Ca -0.21 -0.42 -0.42 0.00 -1.11 0.00 0.00 56.01 53.85 1br2 n LEU 271 Cb 0.54 -1.38 -0.03 0.00 0.53 0.00 0.00 43.42 43.09 1br2 n LEU 271 CO 0.22 0.14 0.73 -0.22 -1.11 0.00 0.00 177.39 177.15 1br2 s LEU 272 N -3.05 4.32 -1.16 -1.96 2.96 -1.26 -4.03 118.68 114.49 1br2 s LEU 272 Ca 0.21 1.61 -0.19 0.00 -0.22 0.00 0.00 54.13 55.54 1br2 s LEU 272 Cb -0.02 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.06 1br2 s LEU 272 CO 0.77 -0.34 1.96 1.21 -1.32 0.00 0.00 176.35 178.62 1br2 n GLU 273 N 4.37 2.26 -0.33 1.98 2.13 -0.64 -4.76 120.64 125.65 1br2 n GLU 273 Ca 0.07 -2.52 0.07 0.00 0.66 0.00 0.00 57.16 55.45 1br2 n GLU 273 Cb 0.50 -3.34 0.24 0.00 0.27 0.00 0.00 31.44 29.11 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 7.78 0.79 -0.95 5.31 1.57 -1.91 -2.17 116.57 126.98 1br2 h LYS 274 Ca 0.42 -0.05 0.30 0.00 -1.87 0.00 0.00 60.65 59.45 1br2 h LYS 274 Cb 0.77 -0.18 -0.16 0.00 0.08 0.00 0.00 32.23 32.74 1br2 h LYS 274 CO 1.65 0.52 0.32 0.77 -0.57 0.00 0.00 179.45 182.14 1br2 h SER 275 N 0.81 0.06 -0.21 0.86 0.02 -1.93 0.39 113.55 113.55 1br2 h SER 275 Ca 0.49 0.23 0.06 0.00 -0.84 0.00 0.00 61.79 61.72 1br2 h SER 275 Cb 0.59 0.29 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 1br2 h SER 275 CO -0.31 -0.26 0.28 -0.09 -1.14 0.00 0.00 176.83 175.31 1br2 h ARG 276 N 0.14 0.00 0.00 3.45 2.43 -1.58 -0.69 114.38 118.13 1br2 h ARG 276 Ca 0.66 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.83 1br2 h ARG 276 Cb 1.49 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.04 1br2 h ARG 276 CO -0.73 0.00 -0.01 0.00 -1.51 0.00 0.00 179.97 177.72 1br2 h ALA 277 N 1.63 1.94 -0.03 2.80 0.00 -0.38 -3.21 119.26 122.01 1br2 h ALA 277 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1br2 h ALA 277 Cb 0.67 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1br2 h ALA 277 CO -0.00 0.01 0.00 0.44 0.00 0.00 0.00 179.25 179.70 1br2 n ILE 278 N -4.46 0.13 -3.62 0.00 -5.35 -0.27 -4.85 119.36 100.93 1br2 n ILE 278 Ca -0.03 -0.56 -0.08 0.00 -0.27 0.00 0.00 62.75 61.81 1br2 n ILE 278 Cb 0.10 1.04 -0.06 0.00 -1.74 0.00 0.00 39.64 38.98 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 -0.55 0.39 -0.03 6.28 3.52 -1.19 -4.70 118.95 122.67 1br2 s ARG 279 Ca 0.07 0.31 -0.05 0.00 -0.13 0.00 0.00 55.73 55.93 1br2 s ARG 279 Cb 0.05 0.19 0.01 0.00 -1.56 0.00 0.00 34.95 33.64 1br2 s ARG 279 CO 0.07 -0.08 0.13 -0.65 -0.81 0.00 0.00 175.30 173.97 1br2 s GLN 280 N -0.29 0.26 1.09 5.12 1.11 -1.26 -4.33 119.66 121.37 1br2 s GLN 280 Ca 0.03 -0.01 -0.18 0.00 0.01 0.00 0.00 55.36 55.22 1br2 s GLN 280 Cb -0.03 0.12 0.24 0.00 -1.01 0.00 0.00 33.01 32.33 1br2 s GLN 280 CO -0.06 -0.05 1.20 0.00 0.01 0.00 0.00 175.29 176.39 1br2 s ALA 281 N -0.42 1.36 0.42 6.09 0.00 -1.26 -4.61 121.76 123.35 1br2 s ALA 281 Ca -0.05 -1.04 -0.23 0.00 0.00 0.00 0.00 51.96 50.64 1br2 s ALA 281 Cb -0.03 -2.84 -0.12 0.00 0.00 0.00 0.00 23.12 20.12 1br2 s ALA 281 CO 0.01 -3.04 0.59 1.17 0.00 0.00 0.00 175.76 174.49 1br2 n LYS 282 N -4.29 0.64 -1.61 0.00 3.00 -1.26 -1.51 118.16 113.12 1br2 n LYS 282 Ca 0.14 0.23 -0.09 0.00 -0.00 0.00 0.00 58.31 58.58 1br2 n LYS 282 Cb 0.59 -1.55 -0.03 0.00 0.00 0.00 0.00 35.03 34.04 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 1.20 -2.71 -4.47 3.14 8.00 -1.26 -4.85 116.55 115.60 1br2 n ASP 283 Ca 0.11 0.24 -0.29 0.00 0.71 0.00 0.00 54.79 55.56 1br2 n ASP 283 Cb 0.39 -2.56 -0.12 0.00 -0.02 0.00 0.00 41.12 38.81 1br2 n ASP 283 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1br2 s GLU 284 N -3.44 1.72 0.18 -1.24 2.02 -0.57 -4.65 118.70 112.72 1br2 s GLU 284 Ca 0.00 -1.20 0.04 0.00 0.02 0.00 0.00 54.97 53.83 1br2 s GLU 284 Cb 0.00 -2.07 -0.05 0.00 0.10 0.00 0.00 34.13 32.11 1br2 s GLU 284 CO 0.00 0.48 -0.06 -0.98 0.02 0.00 0.00 175.26 174.72 1br2 s ARG 285 N -2.08 1.18 0.00 1.61 1.70 -0.93 -4.50 118.95 115.93 1br2 s ARG 285 Ca 0.17 -1.55 0.00 0.00 -0.47 0.00 0.00 55.73 53.88 1br2 s ARG 285 Cb -0.10 -0.61 0.00 0.00 -0.57 0.00 0.00 34.95 33.66 1br2 s ARG 285 CO 0.09 -0.00 0.00 -2.37 -1.08 0.00 0.00 175.30 171.94 1br2 n THR 286 N -0.30 0.00 -1.68 4.99 5.66 -1.26 -3.76 114.28 117.93 1br2 n THR 286 Ca -0.08 0.00 -0.46 0.00 -3.05 0.00 0.00 64.05 60.46 1br2 n THR 286 Cb 0.62 -1.95 -0.04 0.00 -1.55 0.00 0.00 70.33 67.41 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 -1.25 2.37 -0.30 1.09 3.72 -1.26 -4.24 117.46 117.60 1br2 n PHE 287 Ca 0.00 0.09 0.12 0.00 -0.05 0.00 0.00 57.45 57.61 1br2 n PHE 287 Cb 0.00 -2.62 0.24 0.00 -0.94 0.00 0.00 39.48 36.16 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 4.87 0.52 -0.35 1.38 8.25 -0.87 -0.85 115.22 128.17 1br2 n HIS 288 Ca 0.19 1.03 0.28 0.00 -0.26 0.00 0.00 57.72 58.96 1br2 n HIS 288 Cb 0.31 -1.13 0.58 0.00 1.12 0.00 0.00 29.99 30.87 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 0.41 0.15 1.59 6.09 -0.65 0.15 117.51 125.24 1br2 h ILE 289 Ca 0.51 -0.09 -0.01 0.00 -1.37 0.00 0.00 64.86 63.90 1br2 h ILE 289 Cb 1.03 0.13 0.00 0.00 0.47 0.00 0.00 36.82 38.45 1br2 h ILE 289 CO -0.81 0.05 -0.07 -0.26 -3.07 0.00 0.00 178.15 173.99 1br2 h PHE 290 N 0.26 -0.18 -0.09 2.19 0.04 -1.27 -0.69 116.94 117.19 1br2 h PHE 290 Ca 0.64 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 61.36 1br2 h PHE 290 Cb 1.89 0.06 -0.01 0.00 2.20 0.00 0.00 35.95 40.09 1br2 h PHE 290 CO -0.00 0.06 -0.16 1.88 -0.60 0.00 0.00 178.31 179.49 1br2 h TYR 291 N -0.41 0.14 0.64 -0.55 0.05 -1.12 -1.61 116.97 114.11 1br2 h TYR 291 Ca -0.02 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.71 1br2 h TYR 291 Cb 0.32 -0.04 0.01 0.00 1.01 0.00 0.00 36.73 38.03 1br2 h TYR 291 CO -0.00 0.30 -0.31 1.88 -1.05 0.00 0.00 178.16 178.98 1br2 h TYR 292 N 0.13 -0.79 0.03 4.88 -1.99 -0.58 -1.66 116.97 116.98 1br2 h TYR 292 Ca 0.03 -0.02 0.03 0.00 2.00 0.00 0.00 58.73 60.77 1br2 h TYR 292 Cb 0.36 0.26 -0.04 0.00 2.00 0.00 0.00 36.73 39.31 1br2 h TYR 292 CO 0.00 -0.49 -0.26 1.25 -0.00 0.00 0.00 178.16 178.66 1br2 h LEU 293 N -1.09 -0.77 -1.83 3.88 5.85 -1.06 0.38 115.31 120.67 1br2 h LEU 293 Ca -0.09 0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.79 1br2 h LEU 293 Cb 0.66 0.31 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 1br2 h LEU 293 CO 0.14 -0.34 0.23 0.40 -0.34 0.00 0.00 178.44 178.53 1br2 h ILE 294 N -0.42 0.94 0.00 4.05 2.04 -1.39 -1.65 117.51 121.08 1br2 h ILE 294 Ca 0.05 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1br2 h ILE 294 Cb 0.49 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1br2 h ILE 294 CO -0.21 0.04 -1.35 0.00 0.00 0.00 0.00 178.15 176.63 1br2 n ALA 295 N -2.54 2.72 -0.31 1.87 0.00 -0.63 -4.58 120.51 117.04 1br2 n ALA 295 Ca 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1br2 n ALA 295 Cb 0.26 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.74 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 1.23 1.00 3.76 0.00 0.00 0.13 -4.44 105.19 106.87 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 -0.64 3.47 0.64 4.61 0.00 -0.65 -4.92 121.76 124.27 1br2 s ALA 297 Ca 0.00 1.08 -0.18 0.00 0.00 0.00 0.00 51.96 52.86 1br2 s ALA 297 Cb 0.00 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.69 1br2 s ALA 297 CO 0.00 -0.43 1.24 -1.54 0.00 0.00 0.00 175.76 175.03 1br2 s SER 298 N -0.41 4.76 0.45 0.00 1.04 -1.26 -4.59 113.70 113.70 1br2 s SER 298 Ca 0.49 2.47 0.22 0.00 0.48 0.00 0.00 55.95 59.60 1br2 s SER 298 Cb -0.36 -2.60 1.20 0.00 0.10 0.00 0.00 66.02 64.36 1br2 s SER 298 CO 0.45 -1.89 1.86 -0.08 0.98 0.00 0.00 173.24 174.56 1br2 h GLU 299 N 0.50 0.28 0.00 4.02 4.81 -1.98 0.72 114.58 122.93 1br2 h GLU 299 Ca -0.50 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 58.60 1br2 h GLU 299 Cb 1.31 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 1br2 h GLU 299 CO 0.53 0.18 -0.53 1.96 -0.73 0.00 0.00 179.01 180.42 1br2 h GLN 300 N 0.28 0.00 0.13 1.92 4.20 -1.99 -2.81 115.11 116.84 1br2 h GLN 300 Ca 0.46 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.85 1br2 h GLN 300 Cb 1.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.11 1br2 h GLN 300 CO -0.13 0.53 -1.63 1.98 -0.67 0.00 0.00 178.83 178.90 1br2 h MET 301 N 0.00 0.27 -0.62 1.46 1.85 -0.90 -2.16 114.93 114.82 1br2 h MET 301 Ca -0.01 -0.46 0.13 0.00 -0.61 0.00 0.00 59.70 58.76 1br2 h MET 301 Cb 1.10 0.17 -0.11 0.00 0.43 0.00 0.00 31.60 33.19 1br2 h MET 301 CO 0.07 1.13 -0.06 -0.09 -0.40 0.00 0.00 176.91 177.56 1br2 h ARG 302 N 0.07 0.07 -0.02 0.39 9.65 0.36 0.30 114.38 125.21 1br2 h ARG 302 Ca -0.28 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.59 1br2 h ARG 302 Cb 2.04 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 30.60 1br2 h ARG 302 CO 0.15 0.04 -0.27 0.27 2.80 0.00 0.00 179.97 182.97 1br2 n ASN 303 N -5.34 1.92 0.05 -3.80 2.04 -1.07 -0.02 115.26 109.04 1br2 n ASN 303 Ca 0.09 -1.46 -0.11 0.00 -0.44 0.00 0.00 54.58 52.65 1br2 n ASN 303 Cb 0.35 0.24 -0.13 0.00 -2.53 0.00 0.00 39.78 37.71 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 2.59 0.16 0.15 0.53 3.58 -0.33 -3.25 116.42 119.84 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 0.72 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.71 1br2 h ASP 304 CO 0.00 1.17 -0.72 0.18 -2.88 0.00 0.00 179.24 176.99 1br2 n LEU 305 N -3.34 1.04 -3.47 2.28 4.77 0.86 -4.96 117.00 114.17 1br2 n LEU 305 Ca -0.09 -0.39 -0.23 0.00 -0.03 0.00 0.00 56.01 55.27 1br2 n LEU 305 Cb 1.00 -0.08 0.08 0.00 -2.33 0.00 0.00 43.42 42.09 1br2 n LEU 305 CO 0.48 0.23 0.23 0.18 -1.33 0.00 0.00 177.39 177.19 1br2 n LEU 306 N -1.19 -3.34 -4.77 2.23 4.77 -1.03 -4.89 117.00 108.78 1br2 n LEU 306 Ca 0.06 -0.51 -0.34 0.00 -0.03 0.00 0.00 56.01 55.19 1br2 n LEU 306 Cb 0.36 -2.95 0.02 0.00 -2.33 0.00 0.00 43.42 38.52 1br2 n LEU 306 CO 0.37 0.63 0.76 -0.76 -1.33 0.00 0.00 177.39 177.06 1br2 s LEU 307 N -7.08 3.56 0.00 2.23 1.43 0.97 -5.00 118.68 114.79 1br2 s LEU 307 Ca 0.56 2.07 0.00 0.00 -1.03 0.00 0.00 54.13 55.73 1br2 s LEU 307 Cb -0.25 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.41 1br2 s LEU 307 CO 0.70 -1.42 0.00 -0.62 0.23 0.00 0.00 176.35 175.23 1br2 n GLU 308 N -1.89 3.91 -3.34 1.70 1.02 -1.26 -4.81 120.64 115.96 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 -0.09 1.96 0.61 0.62 0.00 -1.26 -4.95 107.32 104.20 1br2 s GLY 309 Ca 0.00 -1.72 0.33 0.00 0.00 0.00 0.00 44.72 43.33 1br2 s GLY 309 CO 0.00 -1.56 2.23 0.74 0.00 0.00 0.00 173.10 174.51 1br2 h PHE 310 N 0.87 0.00 -0.34 1.90 0.04 -1.95 -0.94 116.94 116.52 1br2 h PHE 310 Ca -0.42 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.35 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 -3.62 3.94 -0.21 2.17 6.94 -1.26 -4.14 115.26 119.08 1br2 n ASN 311 Ca -0.02 -2.74 0.08 0.00 -0.02 0.00 0.00 54.58 51.88 1br2 n ASN 311 Cb 0.16 -0.49 -0.04 0.00 -2.36 0.00 0.00 39.78 37.04 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 -0.04 1.27 -4.32 0.53 5.03 -0.36 -4.91 115.26 112.47 1br2 n ASN 312 Ca 0.20 -1.14 -0.34 0.00 0.87 0.00 0.00 54.58 54.17 1br2 n ASN 312 Cb 0.82 0.71 -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 -2.23 2.93 -0.57 3.10 2.02 -1.22 -4.91 117.35 116.47 1br2 s TYR 313 Ca 0.11 -0.88 0.24 0.00 -0.37 0.00 0.00 57.07 56.17 1br2 s TYR 313 Cb 0.13 -2.04 0.53 0.00 -0.40 0.00 0.00 41.96 40.19 1br2 s TYR 313 CO 0.53 -0.46 1.65 0.00 -1.57 0.00 0.00 175.55 175.70 1br2 h THR 314 N 5.63 0.00 0.00 -0.71 1.03 -1.85 -2.99 112.91 114.02 1br2 h THR 314 Ca -0.38 -0.75 0.00 0.00 -0.01 0.00 0.00 66.41 65.27 1br2 h THR 314 Cb 1.17 1.71 0.00 0.00 -1.07 0.00 0.00 68.15 69.96 1br2 h THR 314 CO 0.60 0.00 0.00 0.49 -0.01 0.00 0.00 175.52 176.60 1br2 n PHE 315 N -2.67 0.33 -2.18 0.00 3.01 -1.26 -3.55 117.46 111.15 1br2 n PHE 315 Ca 0.04 0.11 -0.39 0.00 1.01 0.00 0.00 57.45 58.22 1br2 n PHE 315 Cb 0.48 -0.68 0.00 0.00 -0.01 0.00 0.00 39.48 39.28 1br2 n PHE 315 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1br2 n LEU 316 N -1.78 7.61 0.00 4.37 4.77 -1.13 -4.11 117.00 126.72 1br2 n LEU 316 Ca 0.05 -4.99 0.00 0.00 -0.03 0.00 0.00 56.01 51.04 1br2 n LEU 316 Cb 0.30 -1.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 1br2 n LEU 316 CO 0.24 2.00 0.00 -1.20 -1.33 0.00 0.00 177.39 177.10 1br2 n SER 317 N 0.81 0.00 -3.37 -1.43 7.64 -1.23 -0.50 113.62 115.54 1br2 n SER 317 Ca 0.55 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 60.05 1br2 n SER 317 Cb 0.28 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.46 1br2 n SER 317 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1br2 n ASN 318 N -0.06 7.66 0.00 6.43 3.02 -1.26 -4.94 115.26 126.10 1br2 n ASN 318 Ca 0.00 -2.60 0.00 0.00 -0.03 0.00 0.00 54.58 51.95 1br2 n ASN 318 Cb 0.00 -1.54 0.00 0.00 -0.61 0.00 0.00 39.78 37.63 1br2 n ASN 318 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1br2 n GLY 319 N 3.69 0.23 3.48 7.41 0.00 0.34 -3.56 105.19 116.78 1br2 n GLY 319 Ca 0.72 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 46.30 1br2 n GLY 319 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1br2 s HIS 320 N 0.00 3.05 -0.53 1.61 5.65 -1.26 -4.95 115.29 118.86 1br2 s HIS 320 Ca 0.00 -0.29 -0.14 0.00 0.25 0.00 0.00 55.06 54.88 1br2 s HIS 320 Cb 0.00 -3.41 0.13 0.00 -1.18 0.00 0.00 32.58 28.12 1br2 s HIS 320 CO 0.00 -0.95 0.46 0.08 -0.65 0.00 0.00 174.74 173.69 1br2 s VAL 321 N 2.73 4.91 0.47 0.89 1.01 -1.23 -5.07 120.40 124.11 1br2 s VAL 321 Ca 0.19 -1.63 -0.25 0.00 0.00 0.00 0.00 61.98 60.29 1br2 s VAL 321 Cb -0.16 -4.17 -0.08 0.00 0.00 0.00 0.00 36.38 31.97 1br2 s VAL 321 CO 0.15 -0.85 1.43 -2.65 0.00 0.00 0.00 175.10 173.18 1br2 n PRO 322 N 5.09 2.16 -2.73 2.72 -0.02 -1.26 -4.98 135.00 135.98 1br2 n PRO 322 Ca -0.11 0.77 -0.24 0.00 -2.02 0.00 0.00 63.50 61.90 1br2 n PRO 322 Cb 0.40 -2.63 0.02 0.00 -0.02 0.00 0.00 33.50 31.27 1br2 n PRO 322 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1br2 s ILE 323 N -1.21 3.86 0.00 4.25 1.01 -1.26 -5.08 121.20 122.77 1br2 s ILE 323 Ca 0.63 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 61.00 1br2 s ILE 323 Cb -0.44 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 38.56 1br2 s ILE 323 CO 0.56 -0.39 0.08 -2.65 0.00 0.00 0.00 174.94 172.53 1br2 n PRO 324 N -2.29 0.00 -2.19 2.79 -0.02 -1.26 -4.23 135.00 127.80 1br2 n PRO 324 Ca 0.03 0.01 -0.38 0.00 -2.02 0.00 0.00 63.50 61.13 1br2 n PRO 324 Cb 0.58 -0.58 0.03 0.00 -0.02 0.00 0.00 33.50 33.50 1br2 n PRO 324 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1br2 n ALA 325 N -2.61 6.18 -2.93 3.55 0.00 -1.26 -4.95 120.51 118.48 1br2 n ALA 325 Ca 0.00 -4.28 -0.10 0.00 0.00 0.00 0.00 53.44 49.06 1br2 n ALA 325 Cb 0.00 -1.82 -0.12 0.00 0.00 0.00 0.00 19.45 17.51 1br2 n ALA 325 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1br2 s GLN 326 N -4.05 0.23 -0.34 0.00 2.00 -1.26 -5.12 119.66 111.12 1br2 s GLN 326 Ca 0.48 -0.42 0.02 0.00 -2.00 0.00 0.00 55.36 53.44 1br2 s GLN 326 Cb 0.37 0.04 0.10 0.00 0.80 0.00 0.00 33.01 34.33 1br2 s GLN 326 CO -0.32 -0.03 0.09 -0.65 -0.50 0.00 0.00 175.29 173.89 1br2 s GLN 327 N -0.98 1.11 0.15 1.67 -0.21 -1.26 -4.59 119.66 115.55 1br2 s GLN 327 Ca -0.10 -1.52 -0.16 0.00 0.02 0.00 0.00 55.36 53.60 1br2 s GLN 327 Cb -0.07 -2.56 0.10 0.00 1.00 0.00 0.00 33.01 31.48 1br2 s GLN 327 CO -0.01 -0.98 1.15 -0.25 -2.12 0.00 0.00 175.29 173.08 1br2 n ASP 328 N 4.46 -0.58 -0.30 5.90 8.00 -1.26 0.25 116.55 133.02 1br2 n ASP 328 Ca 0.01 1.30 0.11 0.00 0.71 0.00 0.00 54.79 56.93 1br2 n ASP 328 Cb 0.41 -0.26 0.34 0.00 -0.02 0.00 0.00 41.12 41.60 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 0.72 0.19 -2.24 2.03 -1.82 0.14 116.42 115.45 1br2 h ASP 329 Ca 0.21 0.05 -0.01 0.00 -0.73 0.00 0.00 57.03 56.55 1br2 h ASP 329 Cb 0.40 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 38.80 1br2 h ASP 329 CO -0.72 0.36 -0.09 -0.33 -1.03 0.00 0.00 179.24 177.43 1br2 h GLU 330 N 0.76 -0.24 -0.38 4.15 5.08 0.29 -3.06 114.58 121.18 1br2 h GLU 330 Ca 0.47 0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.96 1br2 h GLU 330 Cb 0.69 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1br2 h GLU 330 CO -0.23 0.14 0.29 0.52 -1.00 0.00 0.00 179.01 178.73 1br2 h MET 331 N -0.71 0.00 -0.42 2.33 2.86 -0.14 -0.36 114.93 118.49 1br2 h MET 331 Ca -0.03 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 1br2 h MET 331 Cb 0.49 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 1br2 h MET 331 CO 0.04 0.00 -0.01 0.35 1.06 0.00 0.00 176.91 178.35 1br2 h PHE 332 N 0.00 0.82 -0.03 -0.22 3.57 -0.65 0.35 116.94 120.78 1br2 h PHE 332 Ca 0.18 -0.15 -0.13 0.00 3.53 0.00 0.00 57.97 61.40 1br2 h PHE 332 Cb 0.77 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.28 1br2 h PHE 332 CO 0.00 0.82 -0.60 1.96 -2.23 0.00 0.00 178.31 178.26 1br2 h GLN 333 N 0.59 0.10 -0.55 1.11 1.08 -1.19 -0.65 115.11 115.60 1br2 h GLN 333 Ca 0.12 -0.07 -0.08 0.00 -1.45 0.00 0.00 58.65 57.17 1br2 h GLN 333 Cb 0.50 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 1br2 h GLN 333 CO 0.02 0.67 0.02 0.93 -0.95 0.00 0.00 178.83 179.52 1br2 h GLU 334 N 0.08 0.95 -0.01 1.46 5.08 -0.72 0.77 114.58 122.18 1br2 h GLU 334 Ca -0.01 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1br2 h GLU 334 Cb 1.08 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 1br2 h GLU 334 CO 0.08 0.95 -0.01 1.15 -1.00 0.00 0.00 179.01 180.19 1br2 h THR 335 N 0.83 1.37 -0.47 1.13 2.02 -0.09 -2.07 112.91 115.65 1br2 h THR 335 Ca 0.16 -1.12 0.01 0.00 0.77 0.00 0.00 66.41 66.23 1br2 h THR 335 Cb 0.51 2.11 -0.02 0.00 -1.74 0.00 0.00 68.15 69.01 1br2 h THR 335 CO 0.02 0.29 0.31 -0.07 0.37 0.00 0.00 175.52 176.45 1br2 h LEU 336 N -0.44 0.51 -0.38 2.58 3.38 -1.05 0.10 115.31 120.02 1br2 h LEU 336 Ca 0.00 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1br2 h LEU 336 Cb 0.49 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1br2 h LEU 336 CO 0.00 0.36 0.14 -0.08 0.09 0.00 0.00 178.44 178.95 1br2 h GLU 337 N 0.60 0.57 -0.29 1.13 4.81 -0.69 0.54 114.58 121.25 1br2 h GLU 337 Ca 0.18 -0.11 -0.17 0.00 -0.13 0.00 0.00 59.36 59.13 1br2 h GLU 337 Cb -0.02 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 1br2 h GLU 337 CO -0.04 0.56 -0.49 0.00 -0.73 0.00 0.00 179.01 178.31 1br2 h ALA 338 N 0.98 0.59 -0.51 2.92 0.00 -0.65 -0.05 119.26 122.54 1br2 h ALA 338 Ca 0.12 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1br2 h ALA 338 Cb 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1br2 h ALA 338 CO -0.01 0.68 0.20 0.52 0.00 0.00 0.00 179.25 180.64 1br2 h MET 339 N 0.62 0.76 0.28 0.00 2.86 -0.68 0.65 114.93 119.42 1br2 h MET 339 Ca 0.03 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1br2 h MET 339 Cb 1.07 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.58 1br2 h MET 339 CO 0.11 0.67 -0.39 1.15 1.06 0.00 0.00 176.91 179.51 1br2 h THR 340 N 0.68 0.21 -0.97 2.22 2.02 -0.60 0.05 112.91 116.51 1br2 h THR 340 Ca 0.17 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.41 1br2 h THR 340 Cb 0.20 0.21 -0.06 0.00 -1.74 0.00 0.00 68.15 66.75 1br2 h THR 340 CO -0.01 0.00 0.63 0.40 0.37 0.00 0.00 175.52 176.91 1br2 h ILE 341 N -0.73 1.08 0.00 3.11 2.04 -0.65 0.24 117.51 122.60 1br2 h ILE 341 Ca -0.01 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1br2 h ILE 341 Cb 0.69 -0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1br2 h ILE 341 CO -0.13 0.21 0.00 -0.03 0.00 0.00 0.00 178.15 178.20 1br2 h MET 342 N 1.13 0.00 0.00 2.37 4.05 0.11 -3.45 114.93 119.15 1br2 h MET 342 Ca 0.42 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.84 1br2 h MET 342 Cb 0.17 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.97 1br2 h MET 342 CO -0.16 0.00 0.00 0.41 0.23 0.00 0.00 176.91 177.39 1br2 n GLY 343 N -0.87 1.16 3.73 1.39 0.00 0.84 -4.85 105.19 106.59 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 3.50 0.58 1.61 0.40 -0.10 -5.00 117.98 116.97 1br2 s PHE 344 Ca 0.00 1.48 -0.15 0.00 -0.60 0.00 0.00 56.93 57.66 1br2 s PHE 344 Cb 0.00 -3.36 -0.05 0.00 0.51 0.00 0.00 43.02 40.12 1br2 s PHE 344 CO 0.00 -0.94 1.03 0.95 0.70 0.00 0.00 175.22 176.96 1br2 s THR 345 N 0.05 4.14 0.37 0.64 -4.23 -1.26 -4.50 115.64 110.84 1br2 s THR 345 Ca 0.52 0.97 0.12 0.00 -1.18 0.00 0.00 61.69 62.12 1br2 s THR 345 Cb -0.31 -3.53 0.35 0.00 1.34 0.00 0.00 72.50 70.35 1br2 s THR 345 CO 0.35 -0.64 1.82 -0.33 -0.54 0.00 0.00 174.62 175.27 1br2 h GLU 346 N 0.45 0.56 0.00 3.99 4.39 -1.99 0.26 114.58 122.24 1br2 h GLU 346 Ca -0.46 -0.03 -0.14 0.00 0.34 0.00 0.00 59.36 59.06 1br2 h GLU 346 Cb 1.20 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.71 1br2 h GLU 346 CO 0.59 0.37 -0.69 1.05 -1.16 0.00 0.00 179.01 179.17 1br2 h GLU 347 N 0.57 0.00 -0.37 2.33 9.09 -1.98 -1.07 114.58 123.14 1br2 h GLU 347 Ca 0.52 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.84 1br2 h GLU 347 Cb 1.06 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.15 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 0.75 -0.48 1.06 5.08 -0.94 -0.42 114.58 119.63 1br2 h GLU 348 Ca -0.01 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 57.95 1br2 h GLU 348 Cb 1.28 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.48 1br2 h GLU 348 CO 0.09 0.92 -0.08 1.96 -1.00 0.00 0.00 179.01 180.90 1br2 h GLN 349 N 0.55 0.90 0.00 2.33 4.20 -0.82 -1.06 115.11 121.22 1br2 h GLN 349 Ca 0.09 -0.33 -0.12 0.00 0.06 0.00 0.00 58.65 58.35 1br2 h GLN 349 Cb 0.67 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1br2 h GLN 349 CO 0.05 0.98 -0.56 1.79 -0.67 0.00 0.00 178.83 180.42 1br2 h THR 350 N 0.76 1.22 -0.20 -0.54 1.35 -1.15 -0.73 112.91 113.61 1br2 h THR 350 Ca 0.13 -2.03 -0.18 0.00 -0.55 0.00 0.00 66.41 63.78 1br2 h THR 350 Cb 0.62 2.15 -0.00 0.00 -1.73 0.00 0.00 68.15 69.19 1br2 h THR 350 CO 0.04 0.55 -0.58 0.28 -0.25 0.00 0.00 175.52 175.55 1br2 h SER 351 N 0.00 0.74 0.02 5.36 0.02 -0.87 0.10 113.55 118.92 1br2 h SER 351 Ca -0.01 -0.41 -0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1br2 h SER 351 Cb 1.11 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1br2 h SER 351 CO 0.07 1.16 -0.01 0.40 -1.14 0.00 0.00 176.83 177.32 1br2 h ILE 352 N 0.50 1.23 -0.12 3.27 2.04 -0.99 -1.87 117.51 121.58 1br2 h ILE 352 Ca 0.00 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 1br2 h ILE 352 Cb 1.16 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.98 1br2 h ILE 352 CO 0.12 0.20 0.01 -0.07 0.00 0.00 0.00 178.15 178.40 1br2 h LEU 353 N -0.35 0.15 -0.54 1.44 3.38 -1.09 -1.34 115.31 116.95 1br2 h LEU 353 Ca -0.00 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1br2 h LEU 353 Cb 0.34 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1br2 h LEU 353 CO 0.00 0.18 -0.13 -0.09 0.09 0.00 0.00 178.44 178.49 1br2 h ARG 354 N 0.17 1.04 -0.31 1.13 2.43 -0.50 -1.49 114.38 116.84 1br2 h ARG 354 Ca 0.04 -0.40 -0.09 0.00 -0.81 0.00 0.00 59.98 58.72 1br2 h ARG 354 Cb 0.11 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1br2 h ARG 354 CO 0.00 1.09 -0.21 0.28 -1.51 0.00 0.00 179.97 179.62 1br2 h VAL 355 N 0.92 1.26 -0.56 0.20 2.07 -0.48 -1.21 116.25 118.45 1br2 h VAL 355 Ca 0.14 -1.23 -0.03 0.00 0.82 0.00 0.00 66.70 66.40 1br2 h VAL 355 Cb 0.70 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1br2 h VAL 355 CO 0.05 0.40 0.23 0.58 0.02 0.00 0.00 177.57 178.86 1br2 h VAL 356 N 0.51 1.22 -0.65 2.57 2.07 -0.93 -1.87 116.25 119.17 1br2 h VAL 356 Ca 0.08 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 1br2 h VAL 356 Cb 0.64 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1br2 h VAL 356 CO 0.05 0.26 0.33 -1.28 0.02 0.00 0.00 177.57 176.94 1br2 h SER 357 N 0.76 0.83 -0.67 0.57 0.87 -0.78 -2.49 113.55 112.65 1br2 h SER 357 Ca 0.19 -0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 1br2 h SER 357 Cb 0.18 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 61.89 1br2 h SER 357 CO -0.02 0.71 0.35 0.77 -0.53 0.00 0.00 176.83 178.12 1br2 h SER 358 N 0.89 0.86 -0.15 6.23 4.64 -0.96 -0.19 113.55 124.87 1br2 h SER 358 Ca 0.22 -0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.43 1br2 h SER 358 Cb 0.09 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 1br2 h SER 358 CO -0.03 0.72 0.01 0.58 -0.87 0.00 0.00 176.83 177.23 1br2 h VAL 359 N 0.96 1.15 0.09 0.95 2.07 -0.92 0.42 116.25 120.98 1br2 h VAL 359 Ca 0.24 -0.59 -0.29 0.00 0.82 0.00 0.00 66.70 66.88 1br2 h VAL 359 Cb 0.06 0.96 0.03 0.00 -1.52 0.00 0.00 31.29 30.82 1br2 h VAL 359 CO -0.04 0.20 -1.18 -0.07 0.02 0.00 0.00 177.57 176.51 1br2 h LEU 360 N 0.37 0.89 -1.43 2.57 3.38 -0.85 -3.24 115.31 116.99 1br2 h LEU 360 Ca 0.08 -0.80 -0.06 0.00 0.09 0.00 0.00 57.88 57.20 1br2 h LEU 360 Cb 0.24 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1br2 h LEU 360 CO 0.00 1.59 -0.26 -0.61 0.09 0.00 0.00 178.44 179.25 1br2 h GLN 361 N 0.30 0.03 -0.79 1.13 5.75 -0.61 -1.93 115.11 118.99 1br2 h GLN 361 Ca -0.17 -0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.37 1br2 h GLN 361 Cb 1.85 -0.00 -0.06 0.00 1.07 0.00 0.00 27.48 30.34 1br2 h GLN 361 CO 0.23 0.30 0.48 -0.07 -2.65 0.00 0.00 178.83 177.12 1br2 h LEU 362 N 0.03 0.76 -1.95 -2.39 3.38 -0.95 -0.55 115.31 113.64 1br2 h LEU 362 Ca 0.00 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.04 1br2 h LEU 362 Cb 0.48 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1br2 h LEU 362 CO 0.04 0.50 0.14 1.23 0.09 0.00 0.00 178.44 180.44 1br2 h GLY 363 N 0.90 0.07 2.00 0.83 0.00 -1.41 -2.20 103.07 103.26 1br2 h GLY 363 Ca 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1br2 h GLY 363 CO -0.16 0.02 0.00 3.43 0.00 0.00 0.00 176.54 179.83 1br2 h ASN 364 N 0.06 0.00 -3.65 0.19 2.35 -1.10 -3.44 115.58 109.99 1br2 h ASN 364 Ca 0.09 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.29 1br2 h ASN 364 Cb 0.30 0.00 0.11 0.00 0.05 0.00 0.00 38.32 38.78 1br2 h ASN 364 CO -0.01 0.00 0.67 -0.38 -1.65 0.00 0.00 177.43 176.07 1br2 n ILE 365 N -2.46 1.96 -4.36 2.81 5.41 -0.83 -4.86 119.36 117.02 1br2 n ILE 365 Ca 0.04 -0.49 -0.21 0.00 1.00 0.00 0.00 62.75 63.09 1br2 n ILE 365 Cb 0.38 -1.82 -0.16 0.00 -0.71 0.00 0.00 39.64 37.34 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 -1.06 0.78 0.10 1.39 1.01 -1.26 -5.08 120.40 116.27 1br2 s VAL 366 Ca 0.55 -0.31 0.07 0.00 0.00 0.00 0.00 61.98 62.28 1br2 s VAL 366 Cb -0.51 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 1br2 s VAL 366 CO 0.63 0.26 -0.08 -0.36 0.00 0.00 0.00 175.10 175.54 1br2 s PHE 367 N 0.53 2.78 0.19 5.22 0.08 -1.26 -4.23 117.98 121.28 1br2 s PHE 367 Ca -0.09 -0.13 0.10 0.00 0.12 0.00 0.00 56.93 56.93 1br2 s PHE 367 Cb -0.12 -1.46 -0.04 0.00 -0.57 0.00 0.00 43.02 40.83 1br2 s PHE 367 CO 0.01 0.43 -0.21 0.15 -0.10 0.00 0.00 175.22 175.50 1br2 s LYS 368 N -2.18 1.41 0.00 0.44 1.02 -0.18 -4.89 119.74 115.37 1br2 s LYS 368 Ca 0.22 -1.49 0.00 0.00 0.02 0.00 0.00 55.97 54.71 1br2 s LYS 368 Cb -0.11 -1.58 0.00 0.00 -0.52 0.00 0.00 37.83 35.62 1br2 s LYS 368 CO 0.14 0.33 0.00 1.63 -0.92 0.00 0.00 175.35 176.53 1br2 n LYS 369 N 0.18 0.51 0.00 1.68 4.76 -1.26 -0.75 118.16 123.28 1br2 n LYS 369 Ca -0.12 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.32 1br2 n LYS 369 Cb 0.57 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.76 1br2 n LYS 369 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1br2 n GLU 370 N -0.82 0.00 0.00 1.97 1.02 -1.26 -4.71 120.64 116.85 1br2 n GLU 370 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1br2 n GLU 370 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1br2 n GLU 370 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1br2 n GLN 375 N 0.00 0.00 -4.43 3.49 7.27 -1.26 -5.15 117.38 117.30 1br2 n GLN 375 Ca 0.00 0.00 -0.22 0.00 0.07 0.00 0.00 57.00 56.85 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 1.35 -0.05 1.69 0.00 -0.74 -4.56 121.76 119.46 1br2 s ALA 376 Ca 0.00 -0.90 -0.02 0.00 0.00 0.00 0.00 51.96 51.03 1br2 s ALA 376 Cb 0.00 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 22.92 1br2 s ALA 376 CO 0.00 0.27 0.10 -1.54 0.00 0.00 0.00 175.76 174.60 1br2 s SER 377 N -1.18 -0.06 -0.57 0.00 1.04 0.07 -4.86 113.70 108.14 1br2 s SER 377 Ca 0.03 0.21 -0.21 0.00 0.48 0.00 0.00 55.95 56.46 1br2 s SER 377 Cb -0.08 0.12 0.06 0.00 0.10 0.00 0.00 66.02 66.22 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 0.87 3.17 0.18 4.02 0.23 -1.26 -1.01 119.30 125.50 1br2 s MET 378 Ca -0.07 -0.76 -0.11 0.00 -1.03 0.00 0.00 55.69 53.73 1br2 s MET 378 Cb -0.09 -4.14 0.09 0.00 -1.53 0.00 0.00 34.83 29.16 1br2 s MET 378 CO -0.04 -1.50 1.72 -1.35 -2.03 0.00 0.00 175.02 171.83 1br2 h PRO 379 N 9.26 0.99 -4.67 3.16 0.11 -1.96 -3.38 132.00 135.50 1br2 h PRO 379 Ca -0.28 -0.20 -0.69 0.00 0.11 0.00 0.00 66.00 64.94 1br2 h PRO 379 Cb 1.08 -0.15 -0.20 0.00 0.11 0.00 0.00 31.00 31.84 1br2 h PRO 379 CO 1.08 0.85 -0.47 0.34 -0.21 0.00 0.00 178.00 179.59 1br2 s ASP 380 N -6.23 6.02 0.00 -2.05 -1.08 -1.26 -4.93 116.67 107.15 1br2 s ASP 380 Ca -0.13 -0.56 0.24 0.00 -0.52 0.00 0.00 52.55 51.58 1br2 s ASP 380 Cb 0.14 -2.13 0.20 0.00 -1.46 0.00 0.00 42.92 39.66 1br2 s ASP 380 CO 0.81 -0.29 1.22 -0.46 0.52 0.00 0.00 175.17 176.98 1br2 n ASN 381 N 5.11 1.82 -0.21 -0.34 6.94 -1.26 -4.55 115.26 122.77 1br2 n ASN 381 Ca -0.12 -1.39 -0.05 0.00 -0.02 0.00 0.00 54.58 52.99 1br2 n ASN 381 Cb 0.49 0.37 -0.05 0.00 -2.36 0.00 0.00 39.78 38.23 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 -0.11 -0.34 -0.12 5.53 -1.04 -1.26 0.16 114.28 117.10 1br2 n THR 382 Ca 0.10 1.69 -0.05 0.00 -2.04 0.00 0.00 64.05 63.75 1br2 n THR 382 Cb 0.44 -2.13 0.01 0.00 -1.82 0.00 0.00 70.33 66.83 1br2 n THR 382 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1br2 h ALA 383 N -0.08 0.23 -0.68 2.41 0.00 -1.89 0.69 119.26 119.94 1br2 h ALA 383 Ca 0.08 0.15 0.15 0.00 0.00 0.00 0.00 54.91 55.29 1br2 h ALA 383 Cb 0.20 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1br2 h ALA 383 CO -0.46 -0.47 0.46 0.00 0.00 0.00 0.00 179.25 178.77 1br2 h ALA 384 N 1.35 2.23 0.16 0.00 0.00 0.08 0.20 119.26 123.29 1br2 h ALA 384 Ca 0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1br2 h ALA 384 Cb 0.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1br2 h ALA 384 CO -0.43 -0.42 -0.08 1.96 0.00 0.00 0.00 179.25 180.29 1br2 h GLN 385 N 0.29 -0.21 -0.35 0.00 4.20 0.73 -2.70 115.11 117.07 1br2 h GLN 385 Ca 0.33 0.01 0.04 0.00 0.06 0.00 0.00 58.65 59.09 1br2 h GLN 385 Cb 0.89 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.68 1br2 h GLN 385 CO -0.08 0.19 0.12 0.87 -0.67 0.00 0.00 178.83 179.26 1br2 h LYS 386 N -0.71 0.26 -0.32 1.46 1.57 0.43 0.54 116.57 119.80 1br2 h LYS 386 Ca -0.02 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1br2 h LYS 386 Cb 0.50 -0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.69 1br2 h LYS 386 CO 0.04 0.17 -0.14 0.28 -0.57 0.00 0.00 179.45 179.23 1br2 h VAL 387 N 0.26 0.56 -0.48 0.50 2.07 -0.71 0.15 116.25 118.60 1br2 h VAL 387 Ca 0.16 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.62 1br2 h VAL 387 Cb 0.13 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1br2 h VAL 387 CO -0.16 0.00 0.06 0.00 0.02 0.00 0.00 177.57 177.49 1br2 h HIS 389 N 0.72 1.19 0.00 0.00 6.17 0.60 0.14 115.15 123.96 1br2 h HIS 389 Ca 0.15 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.22 1br2 h HIS 389 Cb 0.35 -0.39 0.00 0.00 2.52 0.00 0.00 27.41 29.89 1br2 h HIS 389 CO 0.02 0.80 -0.09 1.28 0.71 0.00 0.00 177.93 180.65 1br2 n LEU 390 N -4.39 0.68 -0.19 0.26 4.77 0.38 -3.78 117.00 114.74 1br2 n LEU 390 Ca 0.10 0.51 0.07 0.00 -0.03 0.00 0.00 56.01 56.66 1br2 n LEU 390 Cb 0.06 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 40.79 1br2 n LEU 390 CO 0.38 -0.13 0.13 0.23 -1.33 0.00 0.00 177.39 176.66 1br2 n MET 391 N -2.12 2.04 -3.03 3.23 2.81 0.19 -4.84 117.12 115.39 1br2 n MET 391 Ca 0.05 -0.44 -0.12 0.00 -1.81 0.00 0.00 57.70 55.39 1br2 n MET 391 Cb 0.42 -1.20 0.04 0.00 -0.71 0.00 0.00 33.22 31.77 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 1.19 0.11 3.47 3.03 0.00 0.38 -4.46 105.19 108.91 1br2 n GLY 392 Ca 0.05 -0.17 -0.23 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 1.84 -0.31 -0.61 1.09 -0.85 -1.15 121.20 118.03 1br2 s ILE 393 Ca 0.26 -2.15 -0.17 0.00 -1.10 0.00 0.00 60.65 57.49 1br2 s ILE 393 Cb -0.11 -2.51 -0.02 0.00 -1.06 0.00 0.00 42.46 38.76 1br2 s ILE 393 CO 0.40 -0.27 0.44 0.21 -0.10 0.00 0.00 174.94 175.62 1br2 s ASN 394 N -3.50 6.29 0.33 3.58 2.47 -1.26 -4.56 114.94 118.29 1br2 s ASN 394 Ca 0.30 0.11 0.11 0.00 0.42 0.00 0.00 52.86 53.81 1br2 s ASN 394 Cb 0.03 -2.24 1.01 0.00 -1.45 0.00 0.00 41.25 38.60 1br2 s ASN 394 CO 0.13 -0.33 1.64 0.58 -3.72 0.00 0.00 177.10 175.40 1br2 h VAL 395 N 5.50 0.23 0.07 -5.21 2.07 -1.92 0.50 116.25 117.49 1br2 h VAL 395 Ca -0.29 -0.07 -0.24 0.00 0.82 0.00 0.00 66.70 66.91 1br2 h VAL 395 Cb 1.14 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1br2 h VAL 395 CO 0.71 0.04 -1.10 0.71 0.02 0.00 0.00 177.57 177.95 1br2 h THR 396 N 0.22 1.54 -0.14 2.57 1.35 -1.96 0.70 112.91 117.18 1br2 h THR 396 Ca 0.70 -3.02 -0.17 0.00 -0.55 0.00 0.00 66.41 63.37 1br2 h THR 396 Cb 1.59 2.80 -0.01 0.00 -1.73 0.00 0.00 68.15 70.81 1br2 h THR 396 CO -0.67 0.88 -0.61 0.44 -0.25 0.00 0.00 175.52 175.31 1br2 h ASP 397 N 0.07 0.53 0.55 5.36 5.19 -1.30 -1.64 116.42 125.18 1br2 h ASP 397 Ca -0.09 -0.30 -0.03 0.00 -0.62 0.00 0.00 57.03 55.99 1br2 h ASP 397 Cb 1.82 -0.15 0.01 0.00 0.18 0.00 0.00 39.33 41.18 1br2 h ASP 397 CO 0.17 1.01 -0.26 0.15 -3.12 0.00 0.00 179.24 177.19 1br2 h PHE 398 N 0.35 -0.68 -1.02 4.55 3.57 -0.11 -1.52 116.94 122.08 1br2 h PHE 398 Ca -0.01 -0.02 0.27 0.00 3.53 0.00 0.00 57.97 61.75 1br2 h PHE 398 Cb 1.15 0.23 -0.13 0.00 2.79 0.00 0.00 35.95 39.99 1br2 h PHE 398 CO 0.04 -0.41 0.61 1.15 -2.23 0.00 0.00 178.31 177.47 1br2 h THR 399 N -1.18 0.46 -0.03 4.41 2.02 -0.88 0.00 112.91 117.71 1br2 h THR 399 Ca -0.08 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 1br2 h THR 399 Cb 0.58 -0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 66.93 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 0.48 0.07 0.00 6.66 3.08 -1.26 0.45 114.38 123.86 1br2 h ARG 400 Ca 0.67 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.67 1br2 h ARG 400 Cb 1.42 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.46 1br2 h ARG 400 CO -0.48 0.49 -0.09 0.77 -1.07 0.00 0.00 179.97 179.58 1br2 h SER 401 N -0.35 0.00 0.00 7.04 0.02 -0.23 0.57 113.55 120.60 1br2 h SER 401 Ca 0.01 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.91 1br2 h SER 401 Cb 0.47 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 1br2 h SER 401 CO 0.01 0.09 -0.27 0.40 -1.14 0.00 0.00 176.83 175.92 1br2 h ILE 402 N 0.00 1.43 0.00 3.27 1.08 -0.99 -3.26 117.51 119.04 1br2 h ILE 402 Ca -0.00 -2.17 -0.00 0.00 -0.39 0.00 0.00 64.86 62.29 1br2 h ILE 402 Cb 0.17 2.80 -0.00 0.00 -3.07 0.00 0.00 36.82 36.72 1br2 h ILE 402 CO 0.01 0.48 -0.01 -0.07 -0.69 0.00 0.00 178.15 177.88 1br2 h LEU 403 N -1.00 0.00 -5.51 1.44 3.38 -0.80 -3.42 115.31 109.40 1br2 h LEU 403 Ca -0.07 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1br2 h LEU 403 Cb 0.97 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.54 1br2 h LEU 403 CO -0.04 0.01 -0.35 0.42 0.09 0.00 0.00 178.44 178.57 1br2 s THR 404 N -3.35 -0.73 -0.80 0.22 -4.23 0.20 -3.09 115.64 103.85 1br2 s THR 404 Ca 0.05 -0.23 0.27 0.00 -1.18 0.00 0.00 61.69 60.60 1br2 s THR 404 Cb 0.06 0.00 0.26 0.00 1.34 0.00 0.00 72.50 74.17 1br2 s THR 404 CO 0.63 0.00 1.79 -0.81 -0.54 0.00 0.00 174.62 175.70 1br2 n PRO 405 N 3.76 0.20 -0.91 3.99 -0.05 -1.23 -4.34 135.00 136.42 1br2 n PRO 405 Ca 0.11 0.16 0.00 0.00 -0.05 0.00 0.00 63.50 63.72 1br2 n PRO 405 Cb 0.59 -1.72 0.00 0.00 -0.05 0.00 0.00 33.50 32.32 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 -2.07 0.00 -2.72 0.54 -0.00 -1.26 -5.01 118.16 107.65 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 0.41 -0.44 -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 -5.03 121.76 119.27 1br2 s ALA 417 Ca 0.00 0.61 0.05 0.00 0.00 0.00 0.00 51.96 52.62 1br2 s ALA 417 Cb 0.00 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 1br2 s ALA 417 CO 0.00 0.13 -0.18 -0.65 0.00 0.00 0.00 175.76 175.05 1br2 s GLN 418 N -1.67 2.48 0.37 0.00 -1.52 -1.18 -5.02 119.66 113.14 1br2 s GLN 418 Ca 0.46 -0.78 0.06 0.00 -1.95 0.00 0.00 55.36 53.16 1br2 s GLN 418 Cb -0.23 -2.29 -0.00 0.00 -0.22 0.00 0.00 33.01 30.26 1br2 s GLN 418 CO 0.29 0.55 0.53 0.95 -0.25 0.00 0.00 175.29 177.35 1br2 s THR 419 N -0.55 3.77 0.11 -0.19 -4.23 -1.26 -1.79 115.64 111.50 1br2 s THR 419 Ca 0.08 -0.93 -0.28 0.00 -1.18 0.00 0.00 61.69 59.38 1br2 s THR 419 Cb -0.11 -3.31 -0.10 0.00 1.34 0.00 0.00 72.50 70.32 1br2 s THR 419 CO 0.01 -0.13 1.46 0.50 -0.54 0.00 0.00 174.62 175.91 1br2 h LYS 420 N 0.75 -0.36 -0.98 3.99 3.64 -1.82 0.85 116.57 122.64 1br2 h LYS 420 Ca -0.44 0.02 0.27 0.00 -1.27 0.00 0.00 60.65 59.23 1br2 h LYS 420 Cb 1.26 0.08 -0.18 0.00 -0.41 0.00 0.00 32.23 32.98 1br2 h LYS 420 CO 0.51 -0.24 0.03 0.93 -2.27 0.00 0.00 179.45 178.42 1br2 h GLU 421 N -0.37 0.02 0.00 1.90 4.39 -1.96 0.46 114.58 119.01 1br2 h GLU 421 Ca 0.05 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1br2 h GLU 421 Cb 0.51 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 1br2 h GLU 421 CO -0.46 0.01 -0.54 -0.56 -1.16 0.00 0.00 179.01 176.30 1br2 h GLN 422 N 0.02 0.00 -0.02 2.33 3.07 -1.24 -2.83 115.11 116.44 1br2 h GLN 422 Ca 0.59 0.00 -0.18 0.00 0.09 0.00 0.00 58.65 59.15 1br2 h GLN 422 Cb 1.21 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.79 1br2 h GLN 422 CO -0.91 0.00 -0.69 0.00 0.09 0.00 0.00 178.83 177.33 1br2 h ALA 423 N 2.02 0.10 -0.10 0.06 0.00 0.44 -2.67 119.26 119.11 1br2 h ALA 423 Ca 0.00 -0.59 0.02 0.00 0.00 0.00 0.00 54.91 54.34 1br2 h ALA 423 Cb 0.99 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1br2 h ALA 423 CO 0.00 0.43 -0.02 -0.44 0.00 0.00 0.00 179.25 179.22 1br2 h ASP 424 N 0.04 -0.08 0.09 0.00 3.32 -0.37 -2.41 116.42 117.02 1br2 h ASP 424 Ca -0.08 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.01 1br2 h ASP 424 Cb 1.38 0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.93 1br2 h ASP 424 CO 0.14 -0.02 -0.53 0.15 -1.72 0.00 0.00 179.24 177.25 1br2 h PHE 425 N 0.01 -1.55 -0.70 4.55 3.04 -1.50 -1.51 116.94 119.27 1br2 h PHE 425 Ca 0.05 0.04 0.15 0.00 3.98 0.00 0.00 57.97 62.19 1br2 h PHE 425 Cb 0.07 0.67 -0.13 0.00 2.56 0.00 0.00 35.95 39.12 1br2 h PHE 425 CO -0.14 -0.60 -0.06 0.00 -2.02 0.00 0.00 178.31 175.50 1br2 h ALA 426 N -0.52 0.63 -0.23 2.41 0.00 -1.30 0.35 119.26 120.61 1br2 h ALA 426 Ca -0.00 0.24 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1br2 h ALA 426 Cb 0.75 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1br2 h ALA 426 CO -0.31 -0.42 0.12 0.82 0.00 0.00 0.00 179.25 179.47 1br2 h ILE 427 N 0.07 1.01 0.31 0.00 1.08 -0.99 -0.01 117.51 118.98 1br2 h ILE 427 Ca 0.37 -0.09 -0.01 0.00 -0.39 0.00 0.00 64.86 64.74 1br2 h ILE 427 Cb 0.61 0.73 -0.01 0.00 -3.07 0.00 0.00 36.82 35.08 1br2 h ILE 427 CO -0.65 0.05 -0.22 -0.33 -0.69 0.00 0.00 178.15 176.30 1br2 h GLU 428 N 0.26 -0.51 -0.92 2.37 5.08 -0.00 -0.12 114.58 120.73 1br2 h GLU 428 Ca 0.09 0.04 0.25 0.00 -1.00 0.00 0.00 59.36 58.74 1br2 h GLU 428 Cb 0.01 0.12 -0.14 0.00 0.50 0.00 0.00 28.75 29.24 1br2 h GLU 428 CO -0.05 -0.34 0.40 0.00 -1.00 0.00 0.00 179.01 178.01 1br2 h ALA 429 N 0.11 1.53 -0.18 3.43 0.00 -0.12 0.22 119.26 124.25 1br2 h ALA 429 Ca -0.03 0.19 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1br2 h ALA 429 Cb 0.46 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1br2 h ALA 429 CO 0.01 -0.43 -0.09 1.25 0.00 0.00 0.00 179.25 179.99 1br2 h LEU 430 N 0.33 0.39 0.02 0.00 5.85 -0.40 -1.11 115.31 120.38 1br2 h LEU 430 Ca 0.60 -0.41 0.01 0.00 0.84 0.00 0.00 57.88 58.93 1br2 h LEU 430 Cb 1.23 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 1br2 h LEU 430 CO -0.59 0.72 -0.39 0.00 -0.34 0.00 0.00 178.44 177.84 1br2 h ALA 431 N 0.69 -0.84 -0.56 1.25 0.00 0.12 0.70 119.26 120.62 1br2 h ALA 431 Ca 0.04 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.97 1br2 h ALA 431 Cb 0.57 0.82 -0.07 0.00 0.00 0.00 0.00 17.79 19.11 1br2 h ALA 431 CO 0.03 -0.95 0.18 0.87 0.00 0.00 0.00 179.25 179.37 1br2 h LYS 432 N -0.50 0.33 -0.85 0.00 1.57 -1.00 -0.04 116.57 116.07 1br2 h LYS 432 Ca 0.01 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1br2 h LYS 432 Cb 0.53 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 1br2 h LYS 432 CO -0.25 0.22 0.48 0.00 -0.57 0.00 0.00 179.45 179.33 1br2 h ALA 433 N 1.40 1.09 -0.64 3.86 0.00 -0.50 0.13 119.26 124.59 1br2 h ALA 433 Ca 0.28 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1br2 h ALA 433 Cb 0.35 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1br2 h ALA 433 CO -0.31 0.58 0.15 0.87 0.00 0.00 0.00 179.25 180.54 1br2 h LYS 434 N 1.18 1.02 -0.02 0.00 1.79 0.14 -2.19 116.57 118.48 1br2 h LYS 434 Ca 0.30 -0.24 -0.02 0.00 -2.18 0.00 0.00 60.65 58.51 1br2 h LYS 434 Cb 0.00 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 30.52 1br2 h LYS 434 CO -0.05 0.91 -0.07 0.35 -1.08 0.00 0.00 179.45 179.51 1br2 h PHE 435 N 0.97 0.11 -1.00 -1.35 3.57 -0.43 -2.12 116.94 116.69 1br2 h PHE 435 Ca 0.20 -0.04 0.23 0.00 3.53 0.00 0.00 57.97 61.89 1br2 h PHE 435 Cb 0.36 -0.02 -0.10 0.00 2.79 0.00 0.00 35.95 38.98 1br2 h PHE 435 CO 0.03 0.68 0.63 1.49 -2.23 0.00 0.00 178.31 178.91 1br2 h GLU 436 N -0.49 0.51 0.05 1.11 4.81 -0.67 0.16 114.58 120.07 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 0.68 -0.12 0.02 0.00 0.63 0.00 0.00 28.75 29.96 1br2 h GLU 436 CO 0.01 0.34 -1.10 0.00 -0.73 0.00 0.00 179.01 177.53 1br2 h ARG 437 N 0.53 0.57 -0.38 1.92 3.08 -1.38 -1.12 114.38 117.59 1br2 h ARG 437 Ca 0.57 -0.68 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 1br2 h ARG 437 Cb 1.23 0.21 -0.02 0.00 0.08 0.00 0.00 29.97 31.47 1br2 h ARG 437 CO -0.32 1.28 0.12 1.25 -1.07 0.00 0.00 179.97 181.23 1br2 h LEU 438 N 0.29 0.50 0.40 3.04 5.85 -0.46 0.19 115.31 125.13 1br2 h LEU 438 Ca -0.14 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1br2 h LEU 438 Cb 1.76 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.67 1br2 h LEU 438 CO 0.21 0.49 -0.19 0.15 -0.34 0.00 0.00 178.44 178.75 1br2 h PHE 439 N 0.54 -0.50 -1.06 1.25 3.57 -0.96 -0.95 116.94 118.83 1br2 h PHE 439 Ca 0.13 -0.01 0.28 0.00 3.53 0.00 0.00 57.97 61.90 1br2 h PHE 439 Cb 0.17 0.17 -0.09 0.00 2.79 0.00 0.00 35.95 38.99 1br2 h PHE 439 CO 0.01 -0.20 0.69 -0.09 -2.23 0.00 0.00 178.31 176.49 1br2 h ARG 440 N -1.02 0.31 0.41 1.11 2.43 -0.92 0.28 114.38 116.98 1br2 h ARG 440 Ca -0.06 -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 30.01 1br2 h ARG 440 CO 0.09 0.21 -0.20 2.35 -1.51 0.00 0.00 179.97 180.91 1br2 h TRP 441 N 0.32 -0.51 -0.67 2.20 7.01 -0.56 -0.45 115.95 123.28 1br2 h TRP 441 Ca 0.59 -0.01 0.12 0.00 2.11 0.00 0.00 58.89 61.70 1br2 h TRP 441 Cb 1.63 0.17 -0.09 0.00 -2.10 0.00 0.00 29.16 28.77 1br2 h TRP 441 CO -0.00 -0.22 0.22 0.82 -2.79 0.00 0.00 178.44 176.46 1br2 h ILE 442 N -1.05 0.66 0.16 2.65 2.04 -0.04 0.27 117.51 122.20 1br2 h ILE 442 Ca -0.06 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.69 1br2 h ILE 442 Cb 0.52 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1br2 h ILE 442 CO 0.09 0.07 -0.22 0.25 0.00 0.00 0.00 178.15 178.34 1br2 h LEU 443 N 0.36 -0.60 -0.56 1.44 5.85 -0.49 0.91 115.31 122.23 1br2 h LEU 443 Ca 0.36 0.06 0.11 0.00 0.84 0.00 0.00 57.88 59.26 1br2 h LEU 443 Cb 0.53 0.22 -0.09 0.00 0.37 0.00 0.00 40.66 41.69 1br2 h LEU 443 CO -0.40 -0.31 0.01 0.74 -0.34 0.00 0.00 178.44 178.14 1br2 h THR 444 N -0.43 0.56 -0.76 1.05 2.02 0.63 0.16 112.91 116.14 1br2 h THR 444 Ca 0.01 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 1br2 h THR 444 Cb 0.43 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.23 1br2 h THR 444 CO -0.09 0.02 0.42 -0.09 0.37 0.00 0.00 175.52 176.15 1br2 h ARG 445 N 0.13 1.06 -0.78 6.66 9.65 -0.15 -1.15 114.38 129.80 1br2 h ARG 445 Ca 0.29 -0.12 -0.02 0.00 -1.10 0.00 0.00 59.98 59.02 1br2 h ARG 445 Cb 0.44 -0.21 -0.04 0.00 -1.39 0.00 0.00 29.97 28.78 1br2 h ARG 445 CO -0.46 0.79 0.39 0.28 2.80 0.00 0.00 179.97 183.76 1br2 h VAL 446 N 1.05 1.24 0.00 0.20 2.07 0.11 -2.20 116.25 118.71 1br2 h VAL 446 Ca 0.27 -0.65 -0.08 0.00 0.82 0.00 0.00 66.70 67.05 1br2 h VAL 446 Cb 0.03 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 1br2 h VAL 446 CO -0.04 0.28 -0.40 0.78 0.02 0.00 0.00 177.57 178.21 1br2 h ASN 447 N 1.10 0.00 -0.19 0.57 2.35 0.07 -1.24 115.58 118.24 1br2 h ASN 447 Ca 0.27 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.96 1br2 h ASN 447 Cb 0.09 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 1br2 h ASN 447 CO -0.04 0.40 -0.13 0.11 -1.65 0.00 0.00 177.43 176.12 1br2 h LYS 448 N 0.00 0.42 0.00 0.81 1.57 -0.66 -1.72 116.57 116.99 1br2 h LYS 448 Ca -0.00 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.50 1br2 h LYS 448 Cb 0.76 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 1br2 h LYS 448 CO 0.05 0.75 -0.36 0.00 -0.57 0.00 0.00 179.45 179.32 1br2 h ALA 449 N 0.66 1.19 0.00 3.86 0.00 -1.26 -2.91 119.26 120.81 1br2 h ALA 449 Ca 0.04 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1br2 h ALA 449 Cb 0.64 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1br2 h ALA 449 CO 0.04 0.45 -0.52 -0.07 0.00 0.00 0.00 179.25 179.14 1br2 h LEU 450 N 0.00 0.00 -9.14 0.00 3.38 -1.15 -3.49 115.31 104.91 1br2 h LEU 450 Ca -0.00 -0.14 -0.67 0.00 0.09 0.00 0.00 57.88 57.16 1br2 h LEU 450 Cb 0.73 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.31 1br2 h LEU 450 CO 0.05 0.07 -0.78 -1.81 0.09 0.00 0.00 178.44 176.05 1br2 s ASP 451 N -4.54 4.02 0.00 -0.43 1.01 -0.66 -2.68 116.67 113.40 1br2 s ASP 451 Ca 0.06 -0.52 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 0.18 0.00 0.00 0.21 0.00 0.00 175.17 176.26 1br2 n ALA 458 N 0.75 0.00 -2.98 5.23 0.00 -1.10 -4.98 120.51 117.43 1br2 n ALA 458 Ca -0.15 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.18 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 0.12 0.00 1.04 -0.80 -4.97 113.70 109.17 1br2 s SER 459 Ca 0.00 -0.20 0.08 0.00 0.48 0.00 0.00 55.95 56.30 1br2 s SER 459 Cb 0.00 0.12 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 1br2 s SER 459 CO 0.00 -0.20 -0.19 0.72 0.98 0.00 0.00 173.24 174.56 1br2 s PHE 460 N -0.84 1.68 -0.38 5.02 -0.12 -1.26 0.35 117.98 122.42 1br2 s PHE 460 Ca -0.09 -0.45 0.03 0.00 -0.05 0.00 0.00 56.93 56.37 1br2 s PHE 460 Cb -0.06 -0.90 0.11 0.00 -0.63 0.00 0.00 43.02 41.55 1br2 s PHE 460 CO -0.00 0.21 0.12 -1.17 -0.05 0.00 0.00 175.22 174.33 1br2 s LEU 461 N -2.15 4.12 0.46 -1.99 0.20 0.21 -2.51 118.68 117.02 1br2 s LEU 461 Ca 0.08 -2.31 -0.22 0.00 0.69 0.00 0.00 54.13 52.37 1br2 s LEU 461 Cb -0.08 -1.47 -0.08 0.00 -0.43 0.00 0.00 46.19 44.13 1br2 s LEU 461 CO 0.04 -0.34 1.08 -0.83 -0.29 0.00 0.00 176.35 176.01 1br2 s GLY 462 N 0.70 2.65 -0.05 7.98 0.00 0.34 -2.58 107.32 116.36 1br2 s GLY 462 Ca 0.13 0.74 -0.00 0.00 0.00 0.00 0.00 44.72 45.58 1br2 s GLY 462 CO -0.08 1.12 -0.01 -0.42 0.00 0.00 0.00 173.10 173.71 1br2 s ILE 463 N -1.76 0.37 -0.30 0.90 1.01 0.91 -0.79 121.20 121.54 1br2 s ILE 463 Ca 0.65 0.04 -0.01 0.00 0.00 0.00 0.00 60.65 61.33 1br2 s ILE 463 Cb -0.22 -0.47 0.06 0.00 0.01 0.00 0.00 42.46 41.84 1br2 s ILE 463 CO 0.26 0.22 -0.00 -0.22 0.00 0.00 0.00 174.94 175.20 1br2 s LEU 464 N 1.42 3.95 -0.82 2.97 2.96 -0.87 -0.24 118.68 128.05 1br2 s LEU 464 Ca -0.04 -1.38 -0.02 0.00 -0.22 0.00 0.00 54.13 52.48 1br2 s LEU 464 Cb -0.13 -1.69 0.20 0.00 0.50 0.00 0.00 46.19 45.07 1br2 s LEU 464 CO -0.03 -0.27 0.68 -0.62 -1.32 0.00 0.00 176.35 174.80 1br2 s ASP 465 N 1.25 5.77 0.85 3.68 2.15 0.03 -2.90 116.67 127.51 1br2 s ASP 465 Ca -0.04 -3.50 -0.12 0.00 0.43 0.00 0.00 52.55 49.32 1br2 s ASP 465 Cb -0.20 -1.89 0.10 0.00 -0.30 0.00 0.00 42.92 40.63 1br2 s ASP 465 CO -0.02 -0.23 1.16 0.27 -0.17 0.00 0.00 175.17 176.17 1br2 s ILE 466 N -1.01 2.07 0.02 4.11 -4.36 -1.26 -1.51 121.20 119.24 1br2 s ILE 466 Ca 0.25 0.02 -0.30 0.00 -0.26 0.00 0.00 60.65 60.36 1br2 s ILE 466 Cb -0.10 -2.90 -0.04 0.00 1.25 0.00 0.00 42.46 40.66 1br2 s ILE 466 CO -0.10 -0.03 1.08 0.00 0.24 0.00 0.00 174.94 176.13 1br2 s ALA 467 N -3.43 3.28 0.46 2.27 0.00 -1.26 -4.86 121.76 118.23 1br2 s ALA 467 Ca 0.63 0.66 -0.21 0.00 0.00 0.00 0.00 51.96 53.04 1br2 s ALA 467 Cb -0.13 -3.40 -0.09 0.00 0.00 0.00 0.00 23.12 19.50 1br2 s ALA 467 CO 0.51 -0.36 1.00 0.20 0.00 0.00 0.00 175.76 177.11 1br2 s GLY 468 N 1.06 2.47 0.08 0.00 0.00 -1.26 -4.73 107.32 104.94 1br2 s GLY 468 Ca 0.55 0.53 -0.37 0.00 0.00 0.00 0.00 44.72 45.43 1br2 s GLY 468 CO 0.28 0.84 1.28 0.33 0.00 0.00 0.00 173.10 175.82 1br2 n PHE 469 N -0.80 1.34 -3.89 1.90 7.35 -1.25 -4.02 117.46 118.08 1br2 n PHE 469 Ca 0.08 0.71 -0.11 0.00 -0.76 0.00 0.00 57.45 57.38 1br2 n PHE 469 Cb 0.53 -2.29 -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 0.34 0.31 -0.41 -4.13 -1.05 -1.26 -1.07 118.70 111.42 1br2 s GLU 470 Ca 0.85 -0.29 0.02 0.00 -0.15 0.00 0.00 54.97 55.39 1br2 s GLU 470 Cb -1.00 0.12 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 0.00 175.26 177.25 1br2 s ILE 471 N -0.95 1.34 0.71 1.83 1.01 -1.26 -4.90 121.20 118.98 1br2 s ILE 471 Ca -0.10 -2.30 -0.07 0.00 0.00 0.00 0.00 60.65 58.18 1br2 s ILE 471 Cb -0.06 -1.96 0.06 0.00 0.01 0.00 0.00 42.46 40.51 1br2 s ILE 471 CO 0.00 -0.83 1.03 -0.36 0.00 0.00 0.00 174.94 174.78 1br2 s PHE 472 N 0.65 2.95 0.26 3.97 0.08 -1.26 -4.96 117.98 119.67 1br2 s PHE 472 Ca 0.16 0.50 -0.01 0.00 0.12 0.00 0.00 56.93 57.69 1br2 s PHE 472 Cb -0.23 -3.19 0.50 0.00 -0.57 0.00 0.00 43.02 39.53 1br2 s PHE 472 CO -0.05 -1.40 1.79 0.93 -0.10 0.00 0.00 175.22 176.39 1br2 h GLU 473 N -0.62 0.74 -4.58 0.44 5.08 -1.99 -3.35 114.58 110.30 1br2 h GLU 473 Ca -0.45 -0.04 -0.62 0.00 -1.00 0.00 0.00 59.36 57.24 1br2 h GLU 473 Cb 1.31 -0.17 -0.37 0.00 0.50 0.00 0.00 28.75 30.02 1br2 h GLU 473 CO 0.61 0.49 -0.80 0.42 -1.00 0.00 0.00 179.01 178.73 1br2 s ILE 474 N -5.98 1.71 -0.33 3.13 -1.09 -1.26 -5.08 121.20 112.30 1br2 s ILE 474 Ca -0.12 -1.17 -0.11 0.00 -2.23 0.00 0.00 60.65 57.02 1br2 s ILE 474 Cb 0.21 -1.83 -0.01 0.00 -1.58 0.00 0.00 42.46 39.25 1br2 s ILE 474 CO 0.79 0.08 0.20 0.20 -1.23 0.00 0.00 174.94 174.97 1br2 s ASN 475 N 1.34 5.80 0.21 3.58 0.01 -1.26 -5.03 114.94 119.59 1br2 s ASN 475 Ca -0.04 -0.51 0.01 0.00 -0.71 0.00 0.00 52.86 51.61 1br2 s ASN 475 Cb -0.17 -2.07 0.01 0.00 0.41 0.00 0.00 41.25 39.43 1br2 s ASN 475 CO -0.07 -0.23 0.10 -0.24 -1.51 0.00 0.00 177.10 175.15 1br2 n SER 476 N 5.04 0.21 -0.09 -1.22 2.88 -1.26 -1.29 113.62 117.88 1br2 n SER 476 Ca -0.13 -1.16 0.18 0.00 -1.33 0.00 0.00 58.87 56.43 1br2 n SER 476 Cb 0.49 -0.06 0.60 0.00 -0.75 0.00 0.00 64.21 64.49 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 -0.16 0.24 0.09 0.66 3.57 -1.90 -1.40 116.94 118.05 1br2 h PHE 477 Ca -0.03 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 1br2 h PHE 477 Cb 0.14 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.81 1br2 h PHE 477 CO 0.00 0.09 -0.04 0.93 -2.23 0.00 0.00 178.31 177.06 1br2 h GLU 478 N 0.21 -0.12 -0.79 1.11 3.07 -1.99 -2.39 114.58 113.68 1br2 h GLU 478 Ca 0.32 0.01 0.01 0.00 -0.50 0.00 0.00 59.36 59.19 1br2 h GLU 478 Cb 0.95 0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.85 1br2 h GLU 478 CO -0.06 -0.03 0.52 1.96 -1.40 0.00 0.00 179.01 180.00 1br2 h GLN 479 N -0.18 1.04 -0.12 2.33 7.50 -1.63 -0.96 115.11 123.10 1br2 h GLN 479 Ca -0.01 -0.07 0.02 0.00 0.50 0.00 0.00 58.65 59.09 1br2 h GLN 479 Cb 0.14 -0.23 -0.02 0.00 0.05 0.00 0.00 27.48 27.42 1br2 h GLN 479 CO 0.02 0.70 -0.00 1.25 -1.50 0.00 0.00 178.83 179.30 1br2 h LEU 480 N 1.07 -0.05 -0.24 1.46 5.85 -1.03 0.66 115.31 123.03 1br2 h LEU 480 Ca 0.29 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 59.03 1br2 h LEU 480 Cb -0.11 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1br2 h LEU 480 CO -0.06 -0.01 0.13 0.00 -0.34 0.00 0.00 178.44 178.17 1br2 h ILE 482 N 0.28 0.43 -0.27 0.00 2.04 -0.87 -0.17 117.51 118.95 1br2 h ILE 482 Ca 0.09 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.90 1br2 h ILE 482 Cb 0.06 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 1br2 h ILE 482 CO -0.01 0.00 -0.02 0.78 0.00 0.00 0.00 178.15 178.90 1br2 h ASN 483 N -0.53 0.38 -0.57 1.72 2.35 -0.83 -1.76 115.58 116.34 1br2 h ASN 483 Ca 0.01 -0.06 -0.05 0.00 -0.55 0.00 0.00 56.30 55.64 1br2 h ASN 483 Cb 0.51 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 1br2 h ASN 483 CO -0.09 0.46 0.17 0.22 -1.65 0.00 0.00 177.43 176.54 1br2 h TYR 484 N 0.40 0.93 -0.40 1.19 3.20 -0.40 -0.17 116.97 121.71 1br2 h TYR 484 Ca 0.09 -0.10 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 1br2 h TYR 484 Cb 0.29 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1br2 h TYR 484 CO 0.01 0.78 -0.04 1.15 -1.64 0.00 0.00 178.16 178.43 1br2 h THR 485 N 0.81 1.23 -0.61 1.81 2.02 -0.49 0.63 112.91 118.31 1br2 h THR 485 Ca 0.18 -0.97 -0.10 0.00 0.77 0.00 0.00 66.41 66.29 1br2 h THR 485 Cb 0.30 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 1br2 h THR 485 CO -0.00 0.33 -0.00 0.78 0.37 0.00 0.00 175.52 177.00 1br2 h ASN 486 N 0.62 1.06 -0.63 4.18 2.35 -0.72 0.28 115.58 122.72 1br2 h ASN 486 Ca 0.12 -0.31 -0.04 0.00 -0.55 0.00 0.00 56.30 55.52 1br2 h ASN 486 Cb 0.44 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.50 1br2 h ASN 486 CO 0.02 1.11 0.22 -0.08 -1.65 0.00 0.00 177.43 177.05 1br2 h GLU 487 N 0.98 0.96 -0.63 0.81 4.57 -0.52 -0.21 114.58 120.53 1br2 h GLU 487 Ca 0.17 -0.19 -0.03 0.00 -1.18 0.00 0.00 59.36 58.13 1br2 h GLU 487 Cb 0.56 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 1br2 h GLU 487 CO 0.03 0.83 0.27 0.87 -1.18 0.00 0.00 179.01 179.84 1br2 h LYS 488 N 0.89 0.91 -0.16 1.92 1.57 -0.35 -1.50 116.57 119.85 1br2 h LYS 488 Ca 0.21 -0.14 -0.17 0.00 -1.87 0.00 0.00 60.65 58.68 1br2 h LYS 488 Cb 0.26 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 32.41 1br2 h LYS 488 CO -0.01 0.73 -0.57 1.25 -0.57 0.00 0.00 179.45 180.29 1br2 h LEU 489 N 0.90 0.78 -0.89 2.94 5.85 -0.41 -2.11 115.31 122.37 1br2 h LEU 489 Ca 0.22 -0.60 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1br2 h LEU 489 Cb 0.15 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 1br2 h LEU 489 CO -0.02 1.25 0.56 -0.61 -0.34 0.00 0.00 178.44 179.27 1br2 h GLN 490 N 0.35 1.19 -0.21 1.25 5.75 -0.83 -1.64 115.11 120.98 1br2 h GLN 490 Ca -0.02 -0.09 0.01 0.00 -0.15 0.00 0.00 58.65 58.39 1br2 h GLN 490 Cb 1.19 -0.26 -0.02 0.00 1.07 0.00 0.00 27.48 29.47 1br2 h GLN 490 CO 0.12 0.82 0.11 0.37 -2.65 0.00 0.00 178.83 177.60 1br2 h GLN 491 N 1.21 0.23 -0.91 1.69 5.75 -1.23 0.00 115.11 121.85 1br2 h GLN 491 Ca 0.32 -0.01 0.17 0.00 -0.15 0.00 0.00 58.65 58.98 1br2 h GLN 491 Cb -0.08 -0.05 -0.07 0.00 1.07 0.00 0.00 27.48 28.34 1br2 h GLN 491 CO -0.06 0.15 0.59 1.25 -2.65 0.00 0.00 178.83 178.11 1br2 h LEU 492 N 0.24 0.56 0.60 -2.39 5.85 -0.62 0.33 115.31 119.88 1br2 h LEU 492 Ca 0.08 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1br2 h LEU 492 Cb 0.01 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 40.98 1br2 h LEU 492 CO -0.05 0.25 -0.29 0.15 -0.34 0.00 0.00 178.44 178.16 1br2 h PHE 493 N 0.58 -0.75 -0.85 1.25 3.57 -0.37 -1.88 116.94 118.48 1br2 h PHE 493 Ca 0.47 -0.02 0.16 0.00 3.53 0.00 0.00 57.97 62.12 1br2 h PHE 493 Cb 0.94 0.25 -0.16 0.00 2.79 0.00 0.00 35.95 39.77 1br2 h PHE 493 CO -0.00 -0.47 -0.26 -0.91 -2.23 0.00 0.00 178.31 174.44 1br2 h ASN 494 N -1.00 -0.94 0.34 0.41 2.35 0.56 0.16 115.58 117.45 1br2 h ASN 494 Ca -0.08 0.26 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1br2 h ASN 494 Cb 0.62 0.57 -0.02 0.00 0.05 0.00 0.00 38.32 39.54 1br2 h ASN 494 CO 0.14 -0.29 -0.33 -0.74 -1.65 0.00 0.00 177.43 174.56 1br2 h HIS 495 N -0.02 -0.89 0.36 1.19 2.76 -0.40 0.48 115.15 118.63 1br2 h HIS 495 Ca 0.38 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.54 1br2 h HIS 495 Cb 0.62 0.34 -0.00 0.00 1.55 0.00 0.00 27.41 29.92 1br2 h HIS 495 CO -0.70 -0.47 -0.25 1.15 -1.30 0.00 0.00 177.93 176.36 1br2 h THR 496 N -0.70 0.00 -0.69 6.26 2.02 -0.55 0.36 112.91 119.62 1br2 h THR 496 Ca -0.02 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.31 1br2 h THR 496 Cb 0.63 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.92 1br2 h THR 496 CO -0.06 0.00 0.03 0.24 0.37 0.00 0.00 175.52 176.11 1br2 h MET 497 N -0.58 0.13 0.00 6.66 2.07 -0.72 -2.49 114.93 120.01 1br2 h MET 497 Ca -0.05 -0.01 -0.30 0.00 -2.07 0.00 0.00 59.70 57.28 1br2 h MET 497 Cb 0.48 -0.03 -0.05 0.00 -1.87 0.00 0.00 31.60 30.13 1br2 h MET 497 CO 0.03 0.09 -2.08 1.19 1.07 0.00 0.00 176.91 177.20 1br2 n PHE 498 N -5.28 0.00 0.00 -0.22 3.72 0.16 -4.33 117.46 111.50 1br2 n PHE 498 Ca 0.12 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.51 1br2 n PHE 498 Cb 0.42 -0.72 -0.00 0.00 -0.94 0.00 0.00 39.48 38.24 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 -0.22 0.00 -0.96 4.37 5.03 -0.46 -3.25 117.51 122.02 1br2 h ILE 499 Ca -0.45 -0.22 0.27 0.00 -0.12 0.00 0.00 64.86 64.34 1br2 h ILE 499 Cb 1.59 0.00 -0.14 0.00 -3.03 0.00 0.00 36.82 35.24 1br2 h ILE 499 CO -0.14 0.00 0.48 -0.07 -0.68 0.00 0.00 178.15 177.75 1br2 h LEU 500 N -0.25 0.44 0.02 1.44 3.38 -0.68 -0.10 115.31 119.55 1br2 h LEU 500 Ca -0.00 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1br2 h LEU 500 Cb 0.02 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1br2 h LEU 500 CO 0.01 -0.05 -0.11 -0.33 0.09 0.00 0.00 178.44 178.05 1br2 h GLU 501 N 0.39 -0.15 -0.93 1.13 4.39 -1.58 -1.78 114.58 116.05 1br2 h GLU 501 Ca 0.64 0.01 0.09 0.00 0.34 0.00 0.00 59.36 60.45 1br2 h GLU 501 Cb 1.33 0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 29.95 1br2 h GLU 501 CO -0.56 -0.10 0.60 1.96 -1.16 0.00 0.00 179.01 179.75 1br2 h GLN 502 N -0.15 0.92 -0.62 2.33 4.20 -1.41 -2.12 115.11 118.26 1br2 h GLN 502 Ca -0.00 -0.06 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 27.65 1br2 h GLN 502 CO -0.06 0.61 0.24 0.93 -0.67 0.00 0.00 178.83 179.87 1br2 h GLU 503 N 0.95 0.40 -0.15 1.46 5.08 -0.65 0.34 114.58 122.01 1br2 h GLU 503 Ca 0.43 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.71 1br2 h GLU 503 Cb 0.38 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1br2 h GLU 503 CO -0.19 0.27 -0.14 1.49 -1.00 0.00 0.00 179.01 179.44 1br2 h GLU 504 N 0.42 0.25 0.08 2.33 4.57 -0.65 -0.60 114.58 120.97 1br2 h GLU 504 Ca 0.32 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.43 1br2 h GLU 504 Cb 0.40 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1br2 h GLU 504 CO -0.31 0.39 -0.04 1.88 -1.18 0.00 0.00 179.01 179.74 1br2 h TYR 505 N 0.23 -0.12 -0.91 0.92 0.05 -0.70 -0.03 116.97 116.41 1br2 h TYR 505 Ca 0.05 -0.00 0.17 0.00 0.05 0.00 0.00 58.73 58.99 1br2 h TYR 505 Cb 0.39 0.04 -0.10 0.00 1.01 0.00 0.00 36.73 38.07 1br2 h TYR 505 CO 0.01 -0.07 0.50 0.37 -1.05 0.00 0.00 178.16 177.92 1br2 h GLN 506 N -0.12 0.64 -0.03 4.88 -0.00 -1.39 0.19 115.11 119.28 1br2 h GLN 506 Ca -0.01 -0.04 -0.01 0.00 -0.00 0.00 0.00 58.65 58.59 1br2 h GLN 506 Cb 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 27.48 27.43 1br2 h GLN 506 CO 0.02 0.42 -0.03 -0.09 0.00 0.00 0.00 178.83 179.15 1br2 h ARG 507 N 0.66 0.04 -0.30 1.69 2.43 -0.96 -0.13 114.38 117.81 1br2 h ARG 507 Ca 0.52 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.68 1br2 h ARG 507 Cb 0.78 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1br2 h ARG 507 CO -0.38 0.08 0.00 -1.91 -1.51 0.00 0.00 179.97 176.24 1br2 n GLU 508 N -4.48 2.30 -1.65 0.20 4.07 -0.02 -4.92 120.64 116.13 1br2 n GLU 508 Ca -0.02 -1.96 -0.04 0.00 -0.06 0.00 0.00 57.16 55.07 1br2 n GLU 508 Cb 0.13 -1.48 -0.01 0.00 -0.06 0.00 0.00 31.44 30.02 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 1.40 0.42 3.78 8.31 0.00 -0.06 -0.08 105.19 118.97 1br2 n GLY 509 Ca 0.18 -0.79 -0.37 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.18 3.95 -0.79 -0.61 -1.09 -0.91 -4.89 121.20 114.68 1br2 s ILE 510 Ca 0.00 1.56 -0.25 0.00 -2.23 0.00 0.00 60.65 59.72 1br2 s ILE 510 Cb 0.00 -3.83 -0.04 0.00 -1.58 0.00 0.00 42.46 37.00 1br2 s ILE 510 CO 0.00 0.07 1.95 -0.70 -1.23 0.00 0.00 174.94 175.02 1br2 s GLU 511 N -2.28 2.53 -0.03 2.79 2.12 -1.26 -4.55 118.70 118.02 1br2 s GLU 511 Ca 0.54 0.10 -0.01 0.00 0.36 0.00 0.00 54.97 55.95 1br2 s GLU 511 Cb -0.20 -4.80 0.02 0.00 0.26 0.00 0.00 34.13 29.41 1br2 s GLU 511 CO 0.26 -3.19 0.07 -0.46 -0.54 0.00 0.00 175.26 171.39 1br2 s TRP 512 N 9.97 -0.05 -0.24 5.30 -0.11 -1.26 -5.11 118.94 127.45 1br2 s TRP 512 Ca 0.71 0.22 -0.06 0.00 1.22 0.00 0.00 56.10 58.19 1br2 s TRP 512 Cb -0.09 -0.12 -0.02 0.00 -1.50 0.00 0.00 33.47 31.73 1br2 s TRP 512 CO 0.08 -0.09 0.03 -0.80 -4.62 0.00 0.00 176.95 171.55 1br2 s ASN 513 N 0.78 4.89 0.29 5.86 -0.87 -1.26 -4.90 114.94 119.74 1br2 s ASN 513 Ca -0.06 -0.25 -0.27 0.00 -1.57 0.00 0.00 52.86 50.70 1br2 s ASN 513 Cb -0.09 -1.87 -0.14 0.00 -0.02 0.00 0.00 41.25 39.13 1br2 s ASN 513 CO -0.03 -0.02 0.86 0.33 -2.57 0.00 0.00 177.10 175.67 1br2 n PHE 514 N 4.82 0.70 -4.06 2.20 7.35 -1.26 -4.99 117.46 122.23 1br2 n PHE 514 Ca -0.17 0.74 -0.32 0.00 -0.76 0.00 0.00 57.45 56.94 1br2 n PHE 514 Cb 0.51 -2.16 -0.15 0.00 0.35 0.00 0.00 39.48 38.03 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 -1.11 2.02 -0.52 -2.13 1.01 -1.26 -5.06 121.20 114.15 1br2 s ILE 515 Ca 0.60 -1.35 -0.28 0.00 0.00 0.00 0.00 60.65 59.62 1br2 s ILE 515 Cb -0.73 -2.06 0.02 0.00 0.01 0.00 0.00 42.46 39.71 1br2 s ILE 515 CO 0.59 0.13 1.24 -0.62 0.00 0.00 0.00 174.94 176.29 1br2 s ASP 516 N 1.21 6.43 0.00 3.58 2.15 -1.26 -4.83 116.67 123.95 1br2 s ASP 516 Ca -0.04 0.35 0.12 0.00 0.43 0.00 0.00 52.55 53.40 1br2 s ASP 516 Cb -0.18 -2.55 0.55 0.00 -0.30 0.00 0.00 42.92 40.45 1br2 s ASP 516 CO -0.07 -1.45 1.38 0.49 -0.17 0.00 0.00 175.17 175.34 1br2 n PHE 517 N 8.51 0.11 -3.60 -5.34 3.72 -1.26 -4.93 117.46 114.66 1br2 n PHE 517 Ca 0.11 -0.05 -0.27 0.00 -0.05 0.00 0.00 57.45 57.19 1br2 n PHE 517 Cb 0.49 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 39.07 1br2 n PHE 517 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1br2 n GLY 518 N 0.79 -0.93 2.78 1.37 0.00 -1.26 -4.99 105.19 102.94 1br2 n GLY 518 Ca 0.09 0.44 -0.16 0.00 0.00 0.00 0.00 46.02 46.39 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 -6.29 -0.18 -0.05 0.99 1.43 -1.26 -5.12 118.68 108.19 1br2 s LEU 519 Ca 0.41 -1.21 -0.02 0.00 -1.03 0.00 0.00 54.13 52.28 1br2 s LEU 519 Cb -0.12 0.60 0.04 0.00 0.03 0.00 0.00 46.19 46.73 1br2 s LEU 519 CO 0.83 -0.31 0.11 -0.62 0.23 0.00 0.00 176.35 176.60 1br2 s ASP 520 N 1.83 0.16 0.00 2.29 2.15 -1.26 -4.85 116.67 116.98 1br2 s ASP 520 Ca 0.14 0.22 0.15 0.00 0.43 0.00 0.00 52.55 53.49 1br2 s ASP 520 Cb -0.15 0.11 0.19 0.00 -0.30 0.00 0.00 42.92 42.78 1br2 s ASP 520 CO -0.15 -0.17 1.08 0.18 -0.17 0.00 0.00 175.17 175.94 1br2 n LEU 521 N 4.45 2.53 -0.37 -1.34 4.77 -1.26 -4.68 117.00 121.10 1br2 n LEU 521 Ca -0.22 -1.23 0.01 0.00 -0.03 0.00 0.00 56.01 54.54 1br2 n LEU 521 Cb 0.51 -0.08 0.08 0.00 -2.33 0.00 0.00 43.42 41.60 1br2 n LEU 521 CO 0.16 0.51 0.62 -0.61 -1.33 0.00 0.00 177.39 176.74 1br2 h GLN 522 N 3.00 -0.01 0.00 3.23 5.75 -1.97 -1.95 115.11 123.16 1br2 h GLN 522 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1br2 h GLN 522 Cb 0.69 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.24 1br2 h GLN 522 CO 0.00 -0.00 0.00 -0.35 -2.65 0.00 0.00 178.83 175.83 1br2 n PRO 523 N -5.53 0.00 -0.22 -2.39 -0.04 -1.26 0.45 135.00 126.01 1br2 n PRO 523 Ca 0.12 0.78 0.01 0.00 -0.04 0.00 0.00 63.50 64.37 1br2 n PRO 523 Cb 0.43 -1.34 0.10 0.00 -0.04 0.00 0.00 33.50 32.65 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 0.08 0.74 -0.19 0.00 2.04 -0.66 -0.07 117.51 119.45 1br2 h ILE 525 Ca 0.34 -0.12 -0.09 0.00 1.00 0.00 0.00 64.86 65.98 1br2 h ILE 525 Cb 0.55 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1br2 h ILE 525 CO -0.59 0.06 -0.28 -0.33 0.00 0.00 0.00 178.15 177.02 1br2 h GLU 526 N 0.35 0.37 0.00 2.37 4.39 0.26 -1.21 114.58 121.12 1br2 h GLU 526 Ca 0.29 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.86 1br2 h GLU 526 Cb 0.38 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1br2 h GLU 526 CO -0.32 0.62 0.00 -0.11 -1.16 0.00 0.00 179.01 178.04 1br2 n LEU 527 N -4.12 0.12 -0.02 1.33 7.94 0.51 -1.51 117.00 121.25 1br2 n LEU 527 Ca -0.01 0.55 -0.04 0.00 -1.11 0.00 0.00 56.01 55.40 1br2 n LEU 527 Cb 0.40 -0.56 -0.02 0.00 0.53 0.00 0.00 43.42 43.77 1br2 n LEU 527 CO 0.41 -0.53 -0.67 -0.38 -1.11 0.00 0.00 177.39 175.11 1br2 n ILE 528 N -1.66 0.28 -0.25 1.96 5.41 -0.85 -1.15 119.36 123.10 1br2 n ILE 528 Ca 0.00 -0.09 0.09 0.00 1.00 0.00 0.00 62.75 63.75 1br2 n ILE 528 Cb 0.05 -1.02 0.24 0.00 -0.71 0.00 0.00 39.64 38.20 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 -2.87 2.78 -1.89 0.38 0.28 -0.51 -1.89 120.64 116.91 1br2 n GLU 529 Ca -0.09 -2.34 -0.22 0.00 -0.16 0.00 0.00 57.16 54.34 1br2 n GLU 529 Cb 0.58 -1.42 -0.06 0.00 1.43 0.00 0.00 31.44 31.98 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 -1.01 2.23 0.00 3.44 6.06 -0.57 -4.82 118.95 124.28 1br2 s ARG 530 Ca 0.36 -0.06 0.00 0.00 -2.50 0.00 0.00 55.73 53.53 1br2 s ARG 530 Cb 0.19 -4.98 0.00 0.00 0.06 0.00 0.00 34.95 30.22 1br2 s ARG 530 CO 0.25 -3.76 0.83 -2.30 -2.50 0.00 0.00 175.30 167.81 1br2 n PRO 531 N 8.83 0.00 -1.18 5.12 -0.02 -1.26 -2.88 135.00 143.60 1br2 n PRO 531 Ca 0.42 0.36 -0.15 0.00 -2.02 0.00 0.00 63.50 62.11 1br2 n PRO 531 Cb 0.46 -1.33 0.10 0.00 -0.02 0.00 0.00 33.50 32.71 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 -1.53 0.00 -1.00 3.45 -2.24 -1.26 -4.67 114.28 107.03 1br2 n THR 532 Ca 0.00 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1br2 n THR 532 Cb 0.00 -1.60 0.00 0.00 -2.10 0.00 0.00 70.33 66.63 1br2 n THR 532 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1br2 n ASN 533 N -3.36 0.00 -4.60 3.42 3.02 -1.26 -4.41 115.26 108.07 1br2 n ASN 533 Ca 0.09 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.21 1br2 n ASN 533 Cb 0.32 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.45 1br2 n ASN 533 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1br2 n PRO 534 N 14.00 2.07 -1.75 3.52 -0.02 -1.26 -4.89 135.00 146.67 1br2 n PRO 534 Ca 0.00 0.62 -0.41 0.00 -2.02 0.00 0.00 63.50 61.69 1br2 n PRO 534 Cb 0.00 -3.13 0.01 0.00 -0.02 0.00 0.00 33.50 30.36 1br2 n PRO 534 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1br2 n PRO 535 N 8.44 2.35 -4.04 0.52 -0.02 -1.26 -4.75 135.00 136.24 1br2 n PRO 535 Ca 0.29 0.83 -0.24 0.00 -2.02 0.00 0.00 63.50 62.36 1br2 n PRO 535 Cb 0.42 -2.57 -0.06 0.00 -0.02 0.00 0.00 33.50 31.27 1br2 n PRO 535 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1br2 s GLY 536 N -0.33 2.18 0.14 -1.23 0.00 -1.14 -4.75 107.32 102.19 1br2 s GLY 536 Ca 0.57 -1.98 -0.31 0.00 0.00 0.00 0.00 44.72 43.00 1br2 s GLY 536 CO 0.61 -1.83 1.55 -2.08 0.00 0.00 0.00 173.10 171.35 1br2 h VAL 537 N 1.42 0.02 -0.14 1.40 2.07 -1.21 0.65 116.25 120.45 1br2 h VAL 537 Ca -0.43 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.13 1br2 h VAL 537 Cb 1.25 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1br2 h VAL 537 CO 0.66 0.00 -0.12 -0.07 0.02 0.00 0.00 177.57 178.06 1br2 h LEU 538 N -0.35 -0.38 -0.94 2.57 3.38 -1.65 -1.79 115.31 116.15 1br2 h LEU 538 Ca 0.10 0.08 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 1br2 h LEU 538 Cb 0.58 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1br2 h LEU 538 CO -0.63 -0.16 -0.34 0.00 0.09 0.00 0.00 178.44 177.40 1br2 h ALA 539 N 0.96 1.10 -0.91 1.53 0.00 -1.52 -1.19 119.26 119.24 1br2 h ALA 539 Ca 0.09 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1br2 h ALA 539 Cb 0.27 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1br2 h ALA 539 CO -0.22 0.57 0.56 -0.07 0.00 0.00 0.00 179.25 180.09 1br2 h LEU 540 N 0.30 1.07 0.79 0.00 3.38 0.64 -0.63 115.31 120.87 1br2 h LEU 540 Ca 0.04 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1br2 h LEU 540 Cb 0.75 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.24 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 1.24 -0.89 -1.63 1.67 5.85 -0.63 0.22 115.31 121.13 1br2 h LEU 541 Ca 0.33 0.03 0.42 0.00 0.84 0.00 0.00 57.88 59.50 1br2 h LEU 541 Cb -0.08 0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.09 1br2 h LEU 541 CO -0.06 -0.54 0.94 0.44 -0.34 0.00 0.00 178.44 178.88 1br2 h ASP 542 N -1.27 0.18 0.14 1.25 3.32 -1.01 0.78 116.42 119.81 1br2 h ASP 542 Ca -0.11 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1br2 h ASP 542 Cb 0.81 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.42 1br2 h ASP 542 CO 0.18 -0.07 -0.07 -0.33 -1.72 0.00 0.00 179.24 177.23 1br2 h GLU 543 N 0.10 -0.18 -0.92 3.56 3.07 -0.69 -3.31 114.58 116.22 1br2 h GLU 543 Ca 0.76 0.01 0.15 0.00 -0.50 0.00 0.00 59.36 59.78 1br2 h GLU 543 Cb 2.59 0.04 -0.16 0.00 -0.84 0.00 0.00 28.75 30.38 1br2 h GLU 543 CO -0.24 0.26 -0.32 0.39 -1.40 0.00 0.00 179.01 177.70 1br2 n GLU 544 N -4.89 -0.18 -2.50 2.33 -0.58 0.26 -5.10 120.64 109.98 1br2 n GLU 544 Ca -0.07 1.42 -0.40 0.00 -0.42 0.00 0.00 57.16 57.68 1br2 n GLU 544 Cb 0.26 -2.11 -0.03 0.00 -0.57 0.00 0.00 31.44 29.00 1br2 n GLU 544 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1br2 n ALA 550 N 9.64 0.00 -1.85 0.00 0.00 -1.26 -4.93 120.51 122.11 1br2 n ALA 550 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.25 1br2 n ALA 550 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1br2 n ALA 550 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1br2 s THR 551 N 0.00 4.65 0.31 0.00 -1.32 -1.26 -4.91 115.64 113.11 1br2 s THR 551 Ca 0.00 0.94 0.01 0.00 -1.21 0.00 0.00 61.69 61.44 1br2 s THR 551 Cb 0.00 -3.82 0.18 0.00 -1.51 0.00 0.00 72.50 67.34 1br2 s THR 551 CO 0.00 -1.04 1.88 0.44 -2.21 0.00 0.00 174.62 173.68 1br2 h ASP 552 N -0.08 0.66 -0.29 8.08 3.32 -2.00 -0.08 116.42 126.04 1br2 h ASP 552 Ca -0.45 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 56.44 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 0.65 -0.04 0.00 -1.72 0.00 0.00 179.24 178.75 1br2 h THR 553 N 0.70 1.23 -0.96 0.35 1.03 -1.91 -1.28 112.91 112.07 1br2 h THR 553 Ca 0.16 -0.96 0.01 0.00 -0.01 0.00 0.00 66.41 65.60 1br2 h THR 553 Cb 0.23 0.97 -0.05 0.00 -1.07 0.00 0.00 68.15 68.23 1br2 h THR 553 CO -0.01 0.33 0.62 -1.28 -0.01 0.00 0.00 175.52 175.17 1br2 h SER 554 N 0.61 1.12 0.18 0.00 0.87 -1.40 -1.12 113.55 113.81 1br2 h SER 554 Ca 0.12 -0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.65 1br2 h SER 554 Cb 0.44 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 62.09 1br2 h SER 554 CO 0.02 0.82 -0.25 0.15 -0.53 0.00 0.00 176.83 177.05 1br2 h PHE 555 N 1.31 -0.66 -0.63 2.24 3.57 -0.28 -2.06 116.94 120.42 1br2 h PHE 555 Ca 0.35 0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.96 1br2 h PHE 555 Cb -0.12 0.27 -0.08 0.00 2.79 0.00 0.00 35.95 38.80 1br2 h PHE 555 CO 0.00 -0.36 0.22 0.28 -2.23 0.00 0.00 178.31 176.23 1br2 h VAL 556 N -0.49 0.72 -0.57 1.41 2.07 -0.96 0.57 116.25 119.01 1br2 h VAL 556 Ca 0.01 -0.13 0.08 0.00 0.82 0.00 0.00 66.70 67.48 1br2 h VAL 556 Cb 0.48 0.30 -0.06 0.00 -1.52 0.00 0.00 31.29 30.50 1br2 h VAL 556 CO -0.10 0.07 0.24 -0.33 0.02 0.00 0.00 177.57 177.47 1br2 h GLU 557 N 0.39 0.43 -0.26 1.57 3.07 -0.76 -0.89 114.58 118.12 1br2 h GLU 557 Ca 0.33 -0.03 -0.17 0.00 -0.50 0.00 0.00 59.36 58.99 1br2 h GLU 557 Cb 0.44 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1br2 h GLU 557 CO -0.34 0.28 -0.53 1.57 -1.40 0.00 0.00 179.01 178.59 1br2 h LYS 558 N 0.44 0.75 -1.00 2.33 2.10 -0.67 -2.62 116.57 117.91 1br2 h LYS 558 Ca 0.28 -0.47 0.08 0.00 -2.00 0.00 0.00 60.65 58.55 1br2 h LYS 558 Cb 0.29 0.05 -0.07 0.00 -0.90 0.00 0.00 32.23 31.60 1br2 h LYS 558 CO -0.25 1.09 0.64 1.25 -2.00 0.00 0.00 179.45 180.18 1br2 h LEU 559 N 0.58 0.99 0.12 7.07 5.85 -0.25 -0.33 115.31 129.34 1br2 h LEU 559 Ca 0.02 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 1br2 h LEU 559 Cb 1.11 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.95 1br2 h LEU 559 CO 0.11 0.60 -0.06 0.40 -0.34 0.00 0.00 178.44 179.15 1br2 h ILE 560 N 1.10 1.04 -0.07 4.05 2.04 -1.05 0.15 117.51 124.77 1br2 h ILE 560 Ca 0.45 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.69 1br2 h ILE 560 Cb 0.28 1.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 1br2 h ILE 560 CO -0.20 0.15 0.06 -0.61 0.00 0.00 0.00 178.15 177.55 1br2 h GLN 561 N -0.46 0.00 0.02 2.37 4.15 -1.03 0.53 115.11 120.69 1br2 h GLN 561 Ca -0.02 0.00 -0.18 0.00 0.77 0.00 0.00 58.65 59.22 1br2 h GLN 561 Cb 0.37 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 1br2 h GLN 561 CO 0.03 0.00 -0.98 0.93 -1.93 0.00 0.00 178.83 176.88 1br2 h GLU 562 N 0.00 0.05 0.00 1.69 4.39 -0.97 -3.45 114.58 116.29 1br2 h GLU 562 Ca 0.03 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1br2 h GLU 562 Cb 0.15 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1br2 h GLU 562 CO -0.00 1.04 0.00 1.04 -1.16 0.00 0.00 179.01 179.93 1br2 n GLN 563 N -4.37 0.00 0.00 2.33 1.13 0.50 -4.90 117.38 112.07 1br2 n GLN 563 Ca -0.25 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 54.86 1br2 n GLN 563 Cb 0.68 -0.38 0.00 0.00 0.11 0.00 0.00 30.24 30.65 1br2 n GLN 563 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1br2 n GLY 564 N 1.99 0.05 0.25 1.08 0.00 0.18 -1.49 105.19 107.25 1br2 n GLY 564 Ca 0.00 0.22 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 1br2 n GLY 564 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1br2 h ASN 565 N 0.00 0.90 -0.20 1.61 4.21 -1.90 -3.37 115.58 116.83 1br2 h ASN 565 Ca 0.00 -0.45 -0.22 0.00 1.21 0.00 0.00 56.30 56.83 1br2 h ASN 565 Cb 0.00 -0.25 -0.00 0.00 -1.12 0.00 0.00 38.32 36.95 1br2 h ASN 565 CO 0.00 1.16 0.22 1.57 -1.29 0.00 0.00 177.43 179.09 1br2 n HIS 566 N -4.16 0.43 -0.11 1.19 -0.00 -0.55 -4.63 115.22 107.37 1br2 n HIS 566 Ca -0.02 0.28 -0.02 0.00 0.46 0.00 0.00 57.72 58.41 1br2 n HIS 566 Cb 0.49 -0.59 -0.02 0.00 -0.12 0.00 0.00 29.99 29.76 1br2 n HIS 566 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1br2 n ALA 567 N 1.25 -0.15 -0.62 1.57 0.00 -1.26 0.14 120.51 121.45 1br2 n ALA 567 Ca 0.10 0.25 -0.14 0.00 0.00 0.00 0.00 53.44 53.65 1br2 n ALA 567 Cb -0.01 -0.06 0.04 0.00 0.00 0.00 0.00 19.45 19.42 1br2 n ALA 567 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1br2 n LYS 568 N -4.36 1.66 -4.15 0.00 4.76 -1.26 -4.85 118.16 109.97 1br2 n LYS 568 Ca 0.01 -1.36 -0.12 0.00 -2.87 0.00 0.00 58.31 53.97 1br2 n LYS 568 Cb 0.08 -1.53 -0.11 0.00 -1.84 0.00 0.00 35.03 31.63 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 -1.56 0.89 -0.29 2.13 2.19 0.37 -2.57 117.98 119.14 1br2 s PHE 569 Ca 0.27 -0.74 -0.12 0.00 0.33 0.00 0.00 56.93 56.67 1br2 s PHE 569 Cb 0.21 -0.51 0.11 0.00 -1.31 0.00 0.00 43.02 41.53 1br2 s PHE 569 CO 0.01 -0.09 0.65 -0.65 1.83 0.00 0.00 175.22 176.98 1br2 s GLN 570 N -2.98 0.61 0.71 10.12 -0.21 -0.43 -4.81 119.66 122.67 1br2 s GLN 570 Ca 0.05 1.38 -0.15 0.00 0.02 0.00 0.00 55.36 56.66 1br2 s GLN 570 Cb -0.01 0.66 0.03 0.00 1.00 0.00 0.00 33.01 34.69 1br2 s GLN 570 CO -0.02 -0.19 1.17 -1.59 -2.12 0.00 0.00 175.29 172.54 1br2 s LYS 571 N 2.53 2.33 0.00 2.91 0.00 -1.26 -0.83 119.74 125.43 1br2 s LYS 571 Ca -0.07 1.60 0.00 0.00 0.00 0.00 0.00 55.97 57.50 1br2 s LYS 571 Cb -0.10 -1.87 0.00 0.00 0.00 0.00 0.00 37.83 35.86 1br2 s LYS 571 CO -0.19 -1.66 0.00 0.45 0.00 0.00 0.00 175.35 173.95 1br2 n SER 572 N -2.69 0.00 -3.88 0.03 2.88 -1.25 -4.70 113.62 104.00 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 -5.40 -1.73 -1.46 0.00 -1.26 -5.06 118.16 103.25 1br2 n LYS 578 Ca 0.00 0.60 -0.11 0.00 -0.00 0.00 0.00 58.31 58.80 1br2 n LYS 578 Cb 0.00 -5.42 -0.03 0.00 -0.00 0.00 0.00 35.03 29.59 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 -0.24 -3.88 0.58 -2.24 -1.26 -4.60 114.28 98.03 1br2 n THR 579 Ca -0.03 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.45 1br2 n THR 579 Cb 0.56 -1.49 -0.04 0.00 -2.10 0.00 0.00 70.33 67.26 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 -3.66 3.47 0.24 -0.78 2.02 -1.26 -0.02 118.70 118.71 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 -2.99 -0.01 0.00 0.10 0.00 0.00 34.13 31.23 1br2 s GLU 580 CO 0.00 0.56 0.44 -0.59 0.02 0.00 0.00 175.26 175.69 1br2 s PHE 581 N -1.59 0.43 -0.02 1.61 -0.71 -0.66 -3.90 117.98 113.14 1br2 s PHE 581 Ca 0.36 -0.78 0.05 0.00 -1.04 0.00 0.00 56.93 55.52 1br2 s PHE 581 Cb -0.12 0.11 -0.01 0.00 -1.21 0.00 0.00 43.02 41.79 1br2 s PHE 581 CO 0.28 -0.95 -0.17 0.00 -1.34 0.00 0.00 175.22 173.04 1br2 s ILE 583 N -0.34 2.20 -1.01 0.00 -1.09 -0.14 -1.32 121.20 119.50 1br2 s ILE 583 Ca 0.05 -0.99 -0.16 0.00 -2.23 0.00 0.00 60.65 57.32 1br2 s ILE 583 Cb -0.07 -1.83 0.16 0.00 -1.58 0.00 0.00 42.46 39.13 1br2 s ILE 583 CO -0.00 0.56 1.18 -0.76 -1.23 0.00 0.00 174.94 174.69 1br2 s LEU 584 N 0.14 5.27 0.52 2.97 1.43 -1.06 -1.56 118.68 126.39 1br2 s LEU 584 Ca -0.12 -2.46 -0.19 0.00 -1.03 0.00 0.00 54.13 50.33 1br2 s LEU 584 Cb -0.16 -2.37 -0.07 0.00 0.03 0.00 0.00 46.19 43.62 1br2 s LEU 584 CO 0.07 -0.89 1.04 -1.00 0.23 0.00 0.00 176.35 175.80 1br2 s HIS 585 N 1.93 3.02 0.29 0.29 3.76 0.13 -4.89 115.29 119.83 1br2 s HIS 585 Ca 0.34 1.55 0.04 0.00 -0.15 0.00 0.00 55.06 56.84 1br2 s HIS 585 Cb -0.05 -3.03 0.72 0.00 1.11 0.00 0.00 32.58 31.32 1br2 s HIS 585 CO -0.07 -0.88 1.71 0.10 -0.85 0.00 0.00 174.74 174.76 1br2 h TYR 586 N 1.20 0.73 0.00 1.40 -0.00 -1.95 0.89 116.97 119.23 1br2 h TYR 586 Ca -0.49 0.04 0.00 0.00 -0.00 0.00 0.00 58.73 58.28 1br2 h TYR 586 Cb 1.22 -0.18 0.00 0.00 -0.00 0.00 0.00 36.73 37.77 1br2 h TYR 586 CO 0.58 0.01 0.00 0.00 -0.00 0.00 0.00 178.16 178.75 1br2 n ALA 587 N -2.46 2.05 0.00 0.10 0.00 -1.26 -4.81 120.51 114.13 1br2 n ALA 587 Ca 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1br2 n ALA 587 Cb 0.63 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 0.84 0.63 3.56 0.00 0.00 0.31 -5.08 105.19 105.45 1br2 n GLY 588 Ca 0.05 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 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 -1.72 3.59 -0.19 1.61 2.20 -1.26 0.22 119.74 124.19 1br2 s LYS 589 Ca 0.00 -0.09 -0.06 0.00 -0.36 0.00 0.00 55.97 55.46 1br2 s LYS 589 Cb 0.00 -3.83 -0.03 0.00 -1.51 0.00 0.00 37.83 32.46 1br2 s LYS 589 CO 0.00 -0.75 0.03 0.08 -0.36 0.00 0.00 175.35 174.35 1br2 s VAL 590 N 2.62 4.36 -0.43 4.02 1.01 -0.60 -4.97 120.40 126.41 1br2 s VAL 590 Ca 0.22 -0.18 -0.11 0.00 0.00 0.00 0.00 61.98 61.91 1br2 s VAL 590 Cb -0.15 -2.97 0.07 0.00 0.00 0.00 0.00 36.38 33.33 1br2 s VAL 590 CO 0.15 0.44 0.29 0.28 0.00 0.00 0.00 175.10 176.26 1br2 s THR 591 N 0.72 4.60 0.69 3.92 -1.32 -1.26 -0.97 115.64 122.02 1br2 s THR 591 Ca 0.02 -1.21 -0.11 0.00 -1.21 0.00 0.00 61.69 59.18 1br2 s THR 591 Cb -0.14 -3.75 0.00 0.00 -1.51 0.00 0.00 72.50 67.11 1br2 s THR 591 CO 0.02 -0.48 1.07 -0.31 -2.21 0.00 0.00 174.62 172.71 1br2 s TYR 592 N 1.51 3.32 -0.28 9.09 2.02 0.21 -4.38 117.35 128.85 1br2 s TYR 592 Ca 0.03 1.18 -0.00 0.00 -0.37 0.00 0.00 57.07 57.91 1br2 s TYR 592 Cb -0.23 -2.94 0.09 0.00 -0.40 0.00 0.00 41.96 38.47 1br2 s TYR 592 CO 0.04 -1.12 0.05 1.21 -1.57 0.00 0.00 175.55 174.17 1br2 s ASN 593 N -4.17 3.96 0.00 2.29 3.04 -0.42 -1.66 114.94 117.98 1br2 s ASN 593 Ca 0.58 -1.52 0.03 0.00 0.04 0.00 0.00 52.86 51.99 1br2 s ASN 593 Cb -0.12 -1.00 0.17 0.00 -1.54 0.00 0.00 41.25 38.76 1br2 s ASN 593 CO 0.53 -0.36 0.49 0.00 -3.04 0.00 0.00 177.10 174.72 1br2 n ALA 594 N 4.75 1.77 -1.68 1.71 0.00 0.97 -4.61 120.51 123.42 1br2 n ALA 594 Ca -0.04 -0.02 -0.45 0.00 0.00 0.00 0.00 53.44 52.93 1br2 n ALA 594 Cb 0.43 -1.05 -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 -0.68 3.47 0.00 0.00 7.64 -1.26 -1.27 113.62 121.53 1br2 n SER 595 Ca 0.02 1.03 0.00 0.00 1.01 0.00 0.00 58.87 60.93 1br2 n SER 595 Cb 0.01 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 61.76 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 4.83 0.00 -0.26 -0.43 0.00 -1.26 -4.88 120.51 118.51 1br2 n ALA 596 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.66 1br2 n ALA 596 Cb 0.31 -0.64 0.16 0.00 0.00 0.00 0.00 19.45 19.28 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 0.70 -0.71 0.00 4.06 -1.51 0.15 115.95 118.63 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 0.17 -0.20 -0.06 0.00 -1.00 0.00 0.00 29.16 28.08 1br2 h TRP 597 CO 0.11 0.24 0.41 -0.07 -3.56 0.00 0.00 178.44 175.57 1br2 h LEU 598 N 0.64 0.62 -0.27 -4.49 3.38 -1.90 0.15 115.31 113.45 1br2 h LEU 598 Ca 0.38 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 58.26 1br2 h LEU 598 Cb 0.43 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1br2 h LEU 598 CO -0.29 0.40 -0.29 0.71 0.09 0.00 0.00 178.44 179.06 1br2 h THR 599 N 0.76 1.31 -0.67 0.22 1.35 -1.73 -2.67 112.91 111.48 1br2 h THR 599 Ca 0.32 -1.46 -0.01 0.00 -0.55 0.00 0.00 66.41 64.70 1br2 h THR 599 Cb 0.18 1.63 -0.03 0.00 -1.73 0.00 0.00 68.15 68.20 1br2 h THR 599 CO -0.18 0.47 0.37 0.11 -0.25 0.00 0.00 175.52 176.03 1br2 h LYS 600 N 0.40 0.92 0.00 4.72 1.57 -0.12 0.25 116.57 124.31 1br2 h LYS 600 Ca 0.04 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.63 1br2 h LYS 600 Cb 0.86 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 1br2 h LYS 600 CO 0.07 0.67 -0.46 -0.97 -0.57 0.00 0.00 179.45 178.19 1br2 h ASN 601 N 0.93 0.00 0.23 0.86 -1.24 -0.66 -3.28 115.58 112.42 1br2 h ASN 601 Ca 0.24 0.00 -0.35 0.00 0.71 0.00 0.00 56.30 56.90 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 0.46 -1.77 0.24 -1.29 0.00 0.00 177.43 175.03 1br2 h MET 602 N 0.00 0.33 -5.71 6.67 2.86 -1.05 -0.27 114.93 117.75 1br2 h MET 602 Ca -0.00 -0.56 -0.28 0.00 -2.06 0.00 0.00 59.70 56.79 1br2 h MET 602 Cb 1.15 0.21 0.13 0.00 0.06 0.00 0.00 31.60 33.16 1br2 h MET 602 CO 0.06 1.23 -0.78 -3.47 1.06 0.00 0.00 176.91 175.01 1br2 n ASP 603 N -3.52 -6.36 -4.67 1.22 2.03 0.81 -4.82 116.55 101.24 1br2 n ASP 603 Ca -0.25 -0.73 -0.43 0.00 0.52 0.00 0.00 54.79 53.91 1br2 n ASP 603 Cb 1.06 -4.57 -0.02 0.00 -0.72 0.00 0.00 41.12 36.87 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 -4.71 4.33 0.36 -0.67 0.04 -1.26 -5.05 135.00 128.03 1br2 s PRO 604 Ca 0.39 1.47 0.08 0.00 0.04 0.00 0.00 61.00 62.98 1br2 s PRO 604 Cb -0.08 -3.61 -0.03 0.00 0.04 0.00 0.00 34.50 30.82 1br2 s PRO 604 CO 0.78 -0.50 0.28 -1.17 0.04 0.00 0.00 177.00 176.44 1br2 s LEU 605 N 2.66 3.46 -1.15 -3.56 2.96 -1.26 -4.91 118.68 116.89 1br2 s LEU 605 Ca 0.49 -0.64 -0.11 0.00 -0.22 0.00 0.00 54.13 53.66 1br2 s LEU 605 Cb -0.19 -2.05 0.24 0.00 0.50 0.00 0.00 46.19 44.69 1br2 s LEU 605 CO 0.14 -0.43 1.23 0.21 -1.32 0.00 0.00 176.35 176.18 1br2 s ASN 606 N -4.00 7.24 0.37 3.68 3.04 -1.26 -4.88 114.94 119.13 1br2 s ASN 606 Ca 0.42 -3.39 0.32 0.00 0.04 0.00 0.00 52.86 50.25 1br2 s ASN 606 Cb -0.04 -2.28 1.19 0.00 -1.54 0.00 0.00 41.25 38.58 1br2 s ASN 606 CO 0.26 -0.45 1.13 -0.90 -3.04 0.00 0.00 177.10 174.10 1br2 n ASP 607 N 3.76 0.06 0.00 -4.21 5.68 -1.26 -0.63 116.55 119.95 1br2 n ASP 607 Ca 0.28 0.82 0.00 0.00 -0.50 0.00 0.00 54.79 55.40 1br2 n ASP 607 Cb 0.40 -0.41 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 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 -3.67 0.00 -0.28 -1.12 5.03 -1.26 -0.12 115.26 113.85 1br2 n ASN 608 Ca 0.31 0.91 0.07 0.00 0.87 0.00 0.00 54.58 56.74 1br2 n ASN 608 Cb 1.34 -0.41 0.30 0.00 -1.02 0.00 0.00 39.78 40.00 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 0.96 -0.68 2.41 3.04 -1.32 -0.28 116.25 120.37 1br2 h VAL 609 Ca 0.00 -0.30 0.14 0.00 -1.01 0.00 0.00 66.70 65.54 1br2 h VAL 609 Cb 0.00 0.02 -0.10 0.00 -2.01 0.00 0.00 31.29 29.20 1br2 h VAL 609 CO 0.00 0.16 0.12 0.74 -1.01 0.00 0.00 177.57 177.58 1br2 h THR 610 N 0.87 0.53 -0.32 3.17 2.02 -0.71 -1.09 112.91 117.38 1br2 h THR 610 Ca 0.41 -0.08 -0.07 0.00 0.77 0.00 0.00 66.41 67.44 1br2 h THR 610 Cb 0.42 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 1br2 h THR 610 CO -0.17 0.04 -0.06 -1.28 0.37 0.00 0.00 175.52 174.41 1br2 h SER 611 N 0.23 0.61 -0.71 4.18 0.87 0.13 -1.32 113.55 117.52 1br2 h SER 611 Ca 0.37 -0.36 0.16 0.00 -1.23 0.00 0.00 61.79 60.73 1br2 h SER 611 Cb 0.62 -0.17 -0.13 0.00 -0.44 0.00 0.00 62.40 62.29 1br2 h SER 611 CO -0.50 0.82 -0.04 -0.07 -0.53 0.00 0.00 176.83 176.52 1br2 h LEU 612 N 0.38 -0.40 -0.59 2.23 3.38 -0.69 0.40 115.31 120.03 1br2 h LEU 612 Ca 0.08 0.19 -0.12 0.00 0.09 0.00 0.00 57.88 58.12 1br2 h LEU 612 Cb 0.55 0.35 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 1br2 h LEU 612 CO 0.03 -0.18 -0.19 -0.07 0.09 0.00 0.00 178.44 178.12 1br2 h LEU 613 N 0.08 0.93 -1.91 1.67 3.38 -1.11 -2.47 115.31 115.89 1br2 h LEU 613 Ca 0.38 -0.34 0.30 0.00 0.09 0.00 0.00 57.88 58.31 1br2 h LEU 613 Cb 0.64 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.08 1br2 h LEU 613 CO -0.65 1.10 0.75 -1.13 0.09 0.00 0.00 178.44 178.60 1br2 h ASN 614 N 0.80 0.07 -1.94 -0.43 -1.24 0.96 -0.18 115.58 113.62 1br2 h ASN 614 Ca 0.11 0.01 -0.57 0.00 0.71 0.00 0.00 56.30 56.57 1br2 h ASN 614 Cb 0.74 0.00 -0.42 0.00 0.73 0.00 0.00 38.32 39.38 1br2 h ASN 614 CO 0.06 0.01 -0.75 0.00 -1.29 0.00 0.00 177.43 175.46 1br2 n GLN 615 N -4.27 2.98 -2.82 6.67 6.02 -0.75 -4.73 117.38 120.49 1br2 n GLN 615 Ca 0.23 -4.53 -0.36 0.00 -0.01 0.00 0.00 57.00 52.33 1br2 n GLN 615 Cb 1.09 -2.14 -0.07 0.00 1.02 0.00 0.00 30.24 30.14 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 -3.38 7.22 0.64 1.08 0.15 -0.08 -4.89 113.70 114.45 1br2 s SER 616 Ca 0.47 1.76 0.36 0.00 0.70 0.00 0.00 55.95 59.24 1br2 s SER 616 Cb 0.34 -2.55 2.02 0.00 -1.71 0.00 0.00 66.02 64.11 1br2 s SER 616 CO -0.14 -0.12 2.19 0.77 1.20 0.00 0.00 173.24 177.14 1br2 h SER 617 N 2.91 0.00 -3.48 5.45 4.64 -1.37 -3.39 113.55 118.31 1br2 h SER 617 Ca -0.47 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.25 1br2 h SER 617 Cb 1.19 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.17 1br2 h SER 617 CO 0.64 0.00 -0.08 -0.62 -0.87 0.00 0.00 176.83 175.90 1br2 s ASP 618 N -5.20 6.52 0.07 4.97 -1.08 -1.26 -4.99 116.67 115.70 1br2 s ASP 618 Ca -0.05 0.62 -0.26 0.00 -0.52 0.00 0.00 52.55 52.34 1br2 s ASP 618 Cb 0.13 -2.28 -0.17 0.00 -1.46 0.00 0.00 42.92 39.15 1br2 s ASP 618 CO 0.42 -0.16 1.63 0.07 0.52 0.00 0.00 175.17 177.65 1br2 h LYS 619 N 7.48 -0.27 -0.53 4.34 5.09 -1.96 -0.53 116.57 130.18 1br2 h LYS 619 Ca -0.34 0.02 0.09 0.00 0.09 0.00 0.00 60.65 60.51 1br2 h LYS 619 Cb 1.16 0.06 -0.08 0.00 0.10 0.00 0.00 32.23 33.47 1br2 h LYS 619 CO 0.73 -0.13 0.10 0.35 -2.09 0.00 0.00 179.45 178.41 1br2 h PHE 620 N -0.34 0.16 0.27 0.07 3.57 -1.94 0.98 116.94 119.71 1br2 h PHE 620 Ca -0.03 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1br2 h PHE 620 Cb 0.26 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 1br2 h PHE 620 CO -0.05 -0.02 -0.26 0.28 -2.23 0.00 0.00 178.31 176.03 1br2 h VAL 621 N 0.24 0.44 -0.77 1.41 2.07 -1.87 0.24 116.25 118.01 1br2 h VAL 621 Ca 0.27 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.94 1br2 h VAL 621 Cb 0.38 0.44 -0.10 0.00 -1.52 0.00 0.00 31.29 30.49 1br2 h VAL 621 CO -0.36 0.00 0.32 0.00 0.02 0.00 0.00 177.57 177.55 1br2 h ALA 622 N 0.07 1.10 0.71 1.67 0.00 0.47 -0.23 119.26 123.05 1br2 h ALA 622 Ca -0.01 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1br2 h ALA 622 Cb 0.52 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1br2 h ALA 622 CO -0.06 -0.20 -0.47 -0.44 0.00 0.00 0.00 179.25 178.08 1br2 h ASP 623 N 0.46 -1.21 -1.07 0.00 5.19 0.18 -0.40 116.42 119.56 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 0.36 -0.15 0.00 0.18 0.00 0.00 39.33 40.38 1br2 h ASP 623 CO -0.41 -0.71 0.63 -0.07 -3.12 0.00 0.00 179.24 175.56 1br2 h LEU 624 N -1.12 0.41 -3.83 1.55 3.38 0.65 0.14 115.31 116.49 1br2 h LEU 624 Ca -0.09 0.19 -0.56 0.00 0.09 0.00 0.00 57.88 57.50 1br2 h LEU 624 Cb 0.92 0.16 -0.32 0.00 0.09 0.00 0.00 40.66 41.50 1br2 h LEU 624 CO 0.07 -0.21 0.11 0.79 0.09 0.00 0.00 178.44 179.30 1br2 n TRP 625 N -5.00 2.79 0.14 1.13 7.02 -0.21 -4.98 117.44 118.33 1br2 n TRP 625 Ca 0.34 -2.50 -0.00 0.00 -1.02 0.00 0.00 57.50 54.32 1br2 n TRP 625 Cb 1.15 -0.90 0.15 0.00 -2.42 0.00 0.00 31.31 29.29 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 1.90 0.00 0.00 -0.99 1.57 0.85 -3.39 116.57 116.51 1br2 h LYS 626 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1br2 h LYS 626 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1br2 h LYS 626 CO 1.11 0.62 -0.35 -2.13 -0.57 0.00 0.00 179.45 178.13 1br2 n ARG 657 N -3.59 0.19 -1.69 3.15 0.00 -1.26 -5.11 116.66 108.35 1br2 n ARG 657 Ca -0.00 0.07 -0.32 0.00 -0.00 0.00 0.00 57.85 57.60 1br2 n ARG 657 Cb 0.66 -0.80 0.05 0.00 0.00 0.00 0.00 32.46 32.36 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 -1.70 3.60 0.15 5.15 -4.23 -1.26 -4.78 115.64 112.57 1br2 s THR 658 Ca -0.10 0.64 -0.23 0.00 -1.18 0.00 0.00 61.69 60.83 1br2 s THR 658 Cb 0.01 -3.21 0.04 0.00 1.34 0.00 0.00 72.50 70.69 1br2 s THR 658 CO 0.15 -0.56 1.62 0.58 -0.54 0.00 0.00 174.62 175.87 1br2 h VAL 659 N -0.28 0.34 -0.46 2.29 2.07 -1.34 -0.01 116.25 118.86 1br2 h VAL 659 Ca -0.45 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.16 1br2 h VAL 659 Cb 1.23 0.34 -0.10 0.00 -1.52 0.00 0.00 31.29 31.24 1br2 h VAL 659 CO 0.55 0.00 -0.31 1.23 0.02 0.00 0.00 177.57 179.06 1br2 h GLY 660 N -0.25 -0.15 0.35 2.17 0.00 -1.92 -0.29 103.07 102.96 1br2 h GLY 660 Ca 0.15 0.40 0.06 0.00 0.00 0.00 0.00 47.33 47.94 1br2 h GLY 660 CO -0.43 -0.21 -0.09 1.46 0.00 0.00 0.00 176.54 177.27 1br2 h GLN 661 N -0.21 -0.01 -0.90 4.80 4.20 -1.56 -1.64 115.11 119.79 1br2 h GLN 661 Ca 0.20 0.00 0.09 0.00 0.06 0.00 0.00 58.65 59.00 1br2 h GLN 661 Cb 0.53 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.24 1br2 h GLN 661 CO -0.58 -0.01 0.55 -0.07 -0.67 0.00 0.00 178.83 178.05 1br2 h LEU 662 N -0.01 0.83 0.30 1.46 3.38 -0.04 -2.31 115.31 118.91 1br2 h LEU 662 Ca 0.15 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1br2 h LEU 662 Cb 0.25 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1br2 h LEU 662 CO -0.33 0.48 -0.14 0.22 0.09 0.00 0.00 178.44 178.76 1br2 h TYR 663 N 0.94 -0.37 -0.88 1.13 3.20 -0.28 -2.39 116.97 118.32 1br2 h TYR 663 Ca 0.42 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.46 1br2 h TYR 663 Cb 0.32 0.12 -0.17 0.00 1.54 0.00 0.00 36.73 38.55 1br2 h TYR 663 CO -0.03 -0.10 -0.24 0.87 -1.64 0.00 0.00 178.16 177.02 1br2 h LYS 664 N -0.60 -0.01 0.36 1.82 1.57 -0.87 0.36 116.57 119.21 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 0.44 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 1br2 h LYS 664 CO 0.07 -0.00 -0.47 0.93 -0.57 0.00 0.00 179.45 179.41 1br2 h GLU 665 N -0.01 -0.82 -0.70 3.15 5.08 -1.24 0.80 114.58 120.84 1br2 h GLU 665 Ca 0.41 0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.96 1br2 h GLU 665 Cb 0.64 0.19 -0.09 0.00 0.50 0.00 0.00 28.75 29.98 1br2 h GLU 665 CO -0.91 -0.55 0.22 0.37 -1.00 0.00 0.00 179.01 177.14 1br2 h GLN 666 N -0.85 0.35 -0.06 2.33 4.15 -0.47 0.42 115.11 120.98 1br2 h GLN 666 Ca -0.04 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 1br2 h GLN 666 Cb 0.77 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.38 1br2 h GLN 666 CO -0.12 0.23 0.03 1.25 -1.93 0.00 0.00 178.83 178.30 1br2 h LEU 667 N 0.36 0.07 -0.79 -2.39 5.85 -0.01 -1.68 115.31 116.71 1br2 h LEU 667 Ca 0.38 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.05 1br2 h LEU 667 Cb 0.58 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 1br2 h LEU 667 CO -0.42 0.09 0.46 0.71 -0.34 0.00 0.00 178.44 178.94 1br2 h THR 668 N 0.04 1.23 -0.65 1.05 1.35 0.09 0.18 112.91 116.19 1br2 h THR 668 Ca 0.02 -0.52 0.03 0.00 -0.55 0.00 0.00 66.41 65.39 1br2 h THR 668 Cb 0.03 0.14 -0.04 0.00 -1.73 0.00 0.00 68.15 66.56 1br2 h THR 668 CO -0.00 0.24 0.43 0.11 -0.25 0.00 0.00 175.52 176.05 1br2 h LYS 669 N 1.08 0.78 0.42 4.72 1.57 -0.67 -0.80 116.57 123.67 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 0.52 -0.20 1.25 -0.57 0.00 0.00 179.45 180.40 1br2 h LEU 670 N 0.80 -0.47 -0.95 2.94 5.85 -0.25 -1.91 115.31 121.32 1br2 h LEU 670 Ca 0.26 0.02 0.29 0.00 0.84 0.00 0.00 57.88 59.28 1br2 h LEU 670 Cb 0.03 0.12 -0.17 0.00 0.37 0.00 0.00 40.66 41.02 1br2 h LEU 670 CO -0.07 -0.15 0.23 0.24 -0.34 0.00 0.00 178.44 178.35 1br2 h MET 671 N -0.93 0.09 0.36 1.25 2.86 -0.53 0.26 114.93 118.29 1br2 h MET 671 Ca -0.06 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1br2 h MET 671 Cb 0.43 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.07 1br2 h MET 671 CO 0.09 0.06 -0.17 1.15 1.06 0.00 0.00 176.91 179.10 1br2 h THR 672 N 0.10 0.66 -0.58 2.22 2.02 -1.12 0.54 112.91 116.74 1br2 h THR 672 Ca 0.63 -0.11 0.11 0.00 0.77 0.00 0.00 66.41 67.82 1br2 h THR 672 Cb 1.39 0.72 -0.09 0.00 -1.74 0.00 0.00 68.15 68.43 1br2 h THR 672 CO -0.78 0.02 0.05 0.74 0.37 0.00 0.00 175.52 175.92 1br2 h THR 673 N -0.54 0.58 -0.91 3.16 2.02 0.21 0.25 112.91 117.69 1br2 h THR 673 Ca -0.05 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1br2 h THR 673 Cb 0.40 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 1br2 h THR 673 CO 0.08 0.03 0.58 -0.07 0.37 0.00 0.00 175.52 176.51 1br2 h LEU 674 N 0.17 1.06 -2.08 2.58 3.38 -0.28 -1.47 115.31 118.67 1br2 h LEU 674 Ca 0.30 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.27 1br2 h LEU 674 Cb 0.47 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1br2 h LEU 674 CO -0.45 0.78 0.09 0.03 0.09 0.00 0.00 178.44 178.98 1br2 h ARG 675 N 1.23 0.00 -0.93 1.13 -0.00 0.35 -1.78 114.38 114.39 1br2 h ARG 675 Ca 0.33 0.00 -0.38 0.00 -0.50 0.00 0.00 59.98 59.43 1br2 h ARG 675 Cb -0.11 0.00 -0.23 0.00 0.00 0.00 0.00 29.97 29.63 1br2 h ARG 675 CO -0.07 0.00 0.48 0.09 0.00 0.00 0.00 179.97 180.47 1br2 n ASN 676 N -4.36 3.99 -3.91 7.04 3.02 -0.55 -4.91 115.26 115.58 1br2 n ASN 676 Ca -0.00 -3.34 -0.10 0.00 -0.03 0.00 0.00 54.58 51.11 1br2 n ASN 676 Cb 0.21 -0.78 -0.10 0.00 -0.61 0.00 0.00 39.78 38.51 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 -2.91 0.11 -0.44 3.41 -4.23 -0.67 -4.61 115.64 106.30 1br2 s THR 677 Ca 0.51 -0.94 -0.29 0.00 -1.18 0.00 0.00 61.69 59.79 1br2 s THR 677 Cb 0.42 -0.69 0.02 0.00 1.34 0.00 0.00 72.50 73.60 1br2 s THR 677 CO 0.11 -0.52 1.19 0.21 -0.54 0.00 0.00 174.62 175.07 1br2 s ASN 678 N -1.82 6.62 0.42 3.99 2.47 0.64 -4.83 114.94 122.42 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 37.11 1br2 s ASN 678 CO -0.02 -1.24 0.98 -2.16 -3.72 0.00 0.00 177.10 170.94 1br2 s PRO 679 N 4.44 4.20 -0.28 0.43 0.04 -1.26 -1.23 135.00 141.34 1br2 s PRO 679 Ca 0.50 1.28 -0.03 0.00 0.04 0.00 0.00 61.00 62.79 1br2 s PRO 679 Cb -0.09 -2.34 0.09 0.00 0.04 0.00 0.00 34.50 32.20 1br2 s PRO 679 CO 0.30 -0.07 0.11 -0.80 0.04 0.00 0.00 177.00 176.58 1br2 s ASN 680 N -1.93 3.51 0.10 6.66 0.01 0.11 -4.90 114.94 118.51 1br2 s ASN 680 Ca 0.60 -1.28 -0.24 0.00 -0.71 0.00 0.00 52.86 51.22 1br2 s ASN 680 Cb -0.15 -0.49 -0.07 0.00 0.41 0.00 0.00 41.25 40.96 1br2 s ASN 680 CO 0.19 -0.42 0.74 -0.36 -1.51 0.00 0.00 177.10 175.74 1br2 s PHE 681 N 1.96 3.82 -0.20 2.20 0.40 -1.26 0.11 117.98 125.01 1br2 s PHE 681 Ca 0.08 1.51 0.01 0.00 -0.60 0.00 0.00 56.93 57.93 1br2 s PHE 681 Cb -0.16 -2.75 0.04 0.00 0.51 0.00 0.00 43.02 40.66 1br2 s PHE 681 CO -0.29 0.43 -0.12 0.08 0.70 0.00 0.00 175.22 176.02 1br2 s VAL 682 N -0.69 1.75 -0.45 -0.44 1.01 0.26 -2.87 120.40 118.96 1br2 s VAL 682 Ca 0.36 -1.05 -0.18 0.00 0.00 0.00 0.00 61.98 61.10 1br2 s VAL 682 Cb -0.22 -1.78 0.04 0.00 0.00 0.00 0.00 36.38 34.42 1br2 s VAL 682 CO 0.24 0.21 0.53 -0.13 0.00 0.00 0.00 175.10 175.95 1br2 s ARG 683 N 1.35 3.14 -0.26 2.72 1.81 0.15 -0.66 118.95 127.20 1br2 s ARG 683 Ca -0.01 -0.74 -0.21 0.00 -1.72 0.00 0.00 55.73 53.05 1br2 s ARG 683 Cb -0.16 -4.01 -0.02 0.00 -0.45 0.00 0.00 34.95 30.31 1br2 s ARG 683 CO -0.09 -1.00 0.66 0.00 -0.68 0.00 0.00 175.30 174.19 1br2 s ILE 685 N 2.58 5.41 -0.19 0.00 -1.09 0.22 -4.31 121.20 123.82 1br2 s ILE 685 Ca 0.27 0.17 -0.12 0.00 -2.23 0.00 0.00 60.65 58.75 1br2 s ILE 685 Cb -0.15 -3.36 -0.05 0.00 -1.58 0.00 0.00 42.46 37.32 1br2 s ILE 685 CO 0.09 0.61 0.22 -0.51 -1.23 0.00 0.00 174.94 174.11 1br2 s ILE 686 N -0.92 5.35 0.03 2.92 2.07 -1.26 -1.63 121.20 127.76 1br2 s ILE 686 Ca 0.14 0.36 -0.19 0.00 -1.41 0.00 0.00 60.65 59.56 1br2 s ILE 686 Cb -0.12 -3.56 -0.18 0.00 0.13 0.00 0.00 42.46 38.73 1br2 s ILE 686 CO 0.03 0.39 1.22 1.55 -1.91 0.00 0.00 174.94 176.22 1br2 h PRO 687 N 6.87 0.48 -4.34 3.50 0.13 -1.86 -3.42 132.00 133.37 1br2 h PRO 687 Ca -0.40 -0.39 -0.33 0.00 -0.87 0.00 0.00 66.00 64.01 1br2 h PRO 687 Cb 1.16 0.08 -0.09 0.00 0.13 0.00 0.00 31.00 32.28 1br2 h PRO 687 CO 0.74 1.02 -0.27 0.54 -0.23 0.00 0.00 178.00 179.80 1br2 s ASN 688 N -6.60 1.14 -0.03 1.44 2.20 -1.24 -0.36 114.94 111.48 1br2 s ASN 688 Ca -0.13 -1.57 0.13 0.00 -0.94 0.00 0.00 52.86 50.35 1br2 s ASN 688 Cb 0.05 0.64 0.41 0.00 -2.00 0.00 0.00 41.25 40.35 1br2 s ASN 688 CO 0.81 -1.24 1.34 1.41 -2.94 0.00 0.00 177.10 176.48 1br2 n HIS 689 N -0.58 0.66 -1.10 1.54 8.25 -1.26 -4.45 115.22 118.28 1br2 n HIS 689 Ca 0.03 -0.56 -0.01 0.00 -0.26 0.00 0.00 57.72 56.92 1br2 n HIS 689 Cb 0.62 -0.08 0.28 0.00 1.12 0.00 0.00 29.99 31.93 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 0.57 3.20 -3.02 -0.41 4.71 -1.26 -4.90 120.64 119.54 1br2 n GLU 690 Ca 0.15 -3.04 -0.13 0.00 -0.01 0.00 0.00 57.16 54.14 1br2 n GLU 690 Cb 0.54 -2.05 -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 -0.41 -2.49 -3.79 3.49 5.02 -1.26 -4.85 118.16 113.87 1br2 n LYS 691 Ca 0.34 0.13 -0.37 0.00 -2.02 0.00 0.00 58.31 56.39 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 -5.58 3.67 0.04 1.97 3.52 -1.26 -5.02 118.95 116.29 1br2 s ARG 692 Ca 0.22 -0.06 -0.17 0.00 -0.13 0.00 0.00 55.73 55.58 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 0.27 0.66 0.50 0.00 -0.81 0.00 0.00 175.30 175.92 1br2 s ALA 693 N -0.71 3.63 0.00 6.12 0.00 -1.26 -4.02 121.76 125.51 1br2 s ALA 693 Ca 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1br2 s ALA 693 Cb -0.12 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.46 1br2 s ALA 693 CO 0.04 0.42 0.00 0.41 0.00 0.00 0.00 175.76 176.63 1br2 n GLY 694 N 1.82 0.52 3.03 0.00 0.00 -1.26 -5.00 105.19 104.30 1br2 n GLY 694 Ca -0.12 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.06 1.65 -0.45 1.61 2.20 -1.26 -5.06 119.74 118.38 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 -3.30 0.03 0.00 -1.51 0.00 0.00 37.83 33.05 1br2 s LYS 695 CO 0.00 -0.99 0.54 -1.17 -0.36 0.00 0.00 175.35 173.37 1br2 s LEU 696 N 0.79 4.82 -1.06 5.43 0.20 -1.26 -3.71 118.68 123.89 1br2 s LEU 696 Ca 0.11 -0.67 -0.22 0.00 0.69 0.00 0.00 54.13 54.04 1br2 s LEU 696 Cb -0.20 -2.48 0.05 0.00 -0.43 0.00 0.00 46.19 43.12 1br2 s LEU 696 CO -0.06 -0.72 1.52 -0.62 -0.29 0.00 0.00 176.35 176.18 1br2 s ASP 697 N 2.11 6.47 0.25 3.68 -1.08 0.51 -4.88 116.67 123.73 1br2 s ASP 697 Ca 0.15 -1.56 0.08 0.00 -0.52 0.00 0.00 52.55 50.70 1br2 s ASP 697 Cb -0.17 -2.57 0.75 0.00 -1.46 0.00 0.00 42.92 39.47 1br2 s ASP 697 CO 0.14 -1.54 1.14 0.00 0.52 0.00 0.00 175.17 175.44 1br2 n ALA 698 N 9.13 0.55 0.09 3.66 0.00 -1.26 -0.04 120.51 132.64 1br2 n ALA 698 Ca 0.36 0.76 -0.16 0.00 0.00 0.00 0.00 53.44 54.40 1br2 n ALA 698 Cb 0.50 -0.65 -0.14 0.00 0.00 0.00 0.00 19.45 19.16 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 0.45 -0.34 0.00 3.86 -1.90 -0.81 115.15 116.41 1br2 h HIS 699 Ca 0.52 -0.33 -0.07 0.00 -1.16 0.00 0.00 60.37 59.33 1br2 h HIS 699 Cb 1.24 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.68 1br2 h HIS 699 CO -0.20 1.29 -0.10 1.25 0.86 0.00 0.00 177.93 181.03 1br2 h LEU 700 N 0.07 0.56 -0.06 2.43 5.85 -0.78 0.68 115.31 124.06 1br2 h LEU 700 Ca -0.17 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.37 1br2 h LEU 700 Cb 1.98 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.86 1br2 h LEU 700 CO 0.18 0.70 -0.11 0.58 -0.34 0.00 0.00 178.44 179.45 1br2 h VAL 701 N 0.53 1.42 -0.48 1.05 2.07 -0.88 -2.42 116.25 117.54 1br2 h VAL 701 Ca 0.10 -1.41 0.06 0.00 0.82 0.00 0.00 66.70 66.27 1br2 h VAL 701 Cb 0.49 2.21 -0.05 0.00 -1.52 0.00 0.00 31.29 32.42 1br2 h VAL 701 CO 0.03 0.39 0.19 -0.07 0.02 0.00 0.00 177.57 178.13 1br2 h LEU 702 N -0.32 0.23 -0.72 2.57 3.38 -0.75 0.77 115.31 120.47 1br2 h LEU 702 Ca 0.00 0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1br2 h LEU 702 Cb 0.68 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 1br2 h LEU 702 CO 0.02 0.17 0.45 -0.33 0.09 0.00 0.00 178.44 178.84 1br2 h GLU 703 N 0.39 0.87 -0.33 1.13 5.08 -0.88 -0.41 114.58 120.42 1br2 h GLU 703 Ca 0.22 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.50 1br2 h GLU 703 Cb 0.20 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1br2 h GLU 703 CO -0.21 0.57 0.09 1.96 -1.00 0.00 0.00 179.01 180.43 1br2 h GLN 704 N 0.89 0.52 -0.32 2.33 4.20 -0.84 -1.24 115.11 120.66 1br2 h GLN 704 Ca 0.29 -0.12 0.09 0.00 0.06 0.00 0.00 58.65 58.97 1br2 h GLN 704 Cb 0.00 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1br2 h GLN 704 CO -0.10 0.57 0.25 -0.07 -0.67 0.00 0.00 178.83 178.80 1br2 h LEU 705 N 0.38 0.00 0.42 1.46 3.38 -0.18 -2.36 115.31 118.41 1br2 h LEU 705 Ca 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1br2 h LEU 705 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1br2 h LEU 705 CO -0.00 0.00 -0.20 0.03 0.09 0.00 0.00 178.44 178.36 1br2 h ARG 706 N 0.00 -0.54 0.00 1.13 3.08 0.10 -2.83 114.38 115.32 1br2 h ARG 706 Ca 0.15 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1br2 h ARG 706 Cb 0.65 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.82 1br2 h ARG 706 CO -0.00 -0.34 0.00 0.00 -1.07 0.00 0.00 179.97 178.56 1br2 n ASN 708 N -1.42 0.68 -0.57 0.00 5.03 -0.90 -4.92 115.26 113.16 1br2 n ASN 708 Ca 0.06 -0.48 -0.07 0.00 0.87 0.00 0.00 54.58 54.95 1br2 n ASN 708 Cb 0.18 0.38 -0.03 0.00 -1.02 0.00 0.00 39.78 39.29 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 1.48 0.90 0.29 7.41 0.00 -0.85 -4.91 105.19 109.51 1br2 n GLY 709 Ca 0.06 -0.34 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 0.48 -0.36 1.61 2.07 -1.75 0.83 116.25 119.14 1br2 h VAL 710 Ca -0.15 -0.10 -0.16 0.00 0.82 0.00 0.00 66.70 67.11 1br2 h VAL 710 Cb 0.66 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1br2 h VAL 710 CO 0.22 0.05 -0.40 -0.07 0.02 0.00 0.00 177.57 177.40 1br2 h LEU 711 N 0.30 0.97 -1.02 2.57 3.38 -1.91 -1.61 115.31 117.99 1br2 h LEU 711 Ca 0.47 -0.48 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 1br2 h LEU 711 Cb 0.84 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1br2 h LEU 711 CO -0.53 1.25 -0.42 -0.33 0.09 0.00 0.00 178.44 178.49 1br2 h GLU 712 N 0.70 0.14 0.00 1.13 3.07 -1.60 0.96 114.58 118.99 1br2 h GLU 712 Ca 0.05 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 58.82 1br2 h GLU 712 Cb 1.00 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.90 1br2 h GLU 712 CO 0.10 0.54 -0.10 0.78 -1.40 0.00 0.00 179.01 178.93 1br2 h GLY 713 N 1.26 0.00 0.73 -3.84 0.00 0.96 -2.07 103.07 100.10 1br2 h GLY 713 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.02 1br2 h GLY 713 CO 0.06 0.00 -1.89 1.39 0.00 0.00 0.00 176.54 176.10 1br2 n ILE 714 N -3.24 1.57 0.25 2.60 5.41 -0.63 -3.62 119.36 121.68 1br2 n ILE 714 Ca 0.00 -0.80 -0.15 0.00 1.00 0.00 0.00 62.75 62.80 1br2 n ILE 714 Cb 0.36 -0.94 -0.08 0.00 -0.71 0.00 0.00 39.64 38.27 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 -0.58 -0.49 0.38 2.47 -0.57 -2.22 114.38 113.37 1br2 h ARG 715 Ca -0.36 0.04 0.09 0.00 -1.26 0.00 0.00 59.98 58.49 1br2 h ARG 715 Cb 2.07 0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 30.49 1br2 h ARG 715 CO 0.07 -0.32 0.33 0.97 0.56 0.00 0.00 179.97 181.58 1br2 h ILE 716 N -0.75 0.90 0.00 2.04 6.09 -1.57 0.87 117.51 125.09 1br2 h ILE 716 Ca -0.06 -0.10 0.00 0.00 -1.37 0.00 0.00 64.86 63.33 1br2 h ILE 716 Cb 0.53 0.58 0.00 0.00 0.47 0.00 0.00 36.82 38.41 1br2 h ILE 716 CO 0.10 0.05 0.00 0.00 -3.07 0.00 0.00 178.15 175.23 1br2 n ARG 718 N -2.67 0.52 0.27 0.00 1.74 0.15 -4.22 116.66 112.46 1br2 n ARG 718 Ca 0.02 0.29 0.18 0.00 -0.77 0.00 0.00 57.85 57.57 1br2 n ARG 718 Cb 0.28 -1.50 0.98 0.00 -1.02 0.00 0.00 32.46 31.20 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 0.44 -3.44 115.11 120.87 1br2 h GLN 719 Ca -0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1br2 h GLN 719 Cb 0.98 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.76 1br2 h GLN 719 CO -0.05 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.52 1br2 n GLY 720 N -1.14 4.66 2.66 3.46 0.00 -0.25 -5.04 105.19 109.55 1br2 n GLY 720 Ca -0.02 -1.88 -0.29 0.00 0.00 0.00 0.00 46.02 43.82 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 2.04 1.70 0.08 1.61 0.40 -1.26 -4.63 117.98 117.91 1br2 s PHE 721 Ca 0.00 -2.19 -0.30 0.00 -0.60 0.00 0.00 56.93 53.85 1br2 s PHE 721 Cb 0.00 -1.68 -0.17 0.00 0.51 0.00 0.00 43.02 41.69 1br2 s PHE 721 CO 0.00 -0.80 1.66 -1.00 0.70 0.00 0.00 175.22 175.78 1br2 h PRO 722 N 6.94 -0.58 -7.25 0.24 0.13 -1.75 -3.42 132.00 126.32 1br2 h PRO 722 Ca -0.01 0.04 -0.49 0.00 -0.87 0.00 0.00 66.00 64.67 1br2 h PRO 722 Cb 0.95 0.13 0.04 0.00 0.13 0.00 0.00 31.00 32.25 1br2 h PRO 722 CO 0.44 -0.39 0.39 -0.80 -0.23 0.00 0.00 178.00 177.41 1br2 s ASN 723 N -4.66 6.35 -0.30 1.44 0.01 -1.20 -4.94 114.94 111.63 1br2 s ASN 723 Ca -0.16 1.56 -0.13 0.00 -0.71 0.00 0.00 52.86 53.42 1br2 s ASN 723 Cb 0.05 -2.50 0.17 0.00 0.41 0.00 0.00 41.25 39.38 1br2 s ASN 723 CO 0.63 -0.78 0.98 0.00 -1.51 0.00 0.00 177.10 176.43 1br2 s ARG 724 N -4.43 0.27 0.19 -0.60 1.70 -1.26 -1.10 118.95 113.72 1br2 s ARG 724 Ca 0.58 0.60 0.11 0.00 -0.47 0.00 0.00 55.73 56.56 1br2 s ARG 724 Cb -0.11 0.35 -0.04 0.00 -0.57 0.00 0.00 34.95 34.58 1br2 s ARG 724 CO 0.40 -0.18 -0.24 0.96 -1.08 0.00 0.00 175.30 175.16 1br2 s ILE 725 N 2.64 2.32 0.38 4.99 -4.36 -0.83 -4.92 121.20 121.42 1br2 s ILE 725 Ca 0.00 -2.03 -0.25 0.00 -0.26 0.00 0.00 60.65 58.11 1br2 s ILE 725 Cb -0.08 -2.11 -0.09 0.00 1.25 0.00 0.00 42.46 41.43 1br2 s ILE 725 CO -0.16 -0.13 1.09 0.68 0.24 0.00 0.00 174.94 176.66 1br2 s VAL 726 N -1.69 3.54 0.05 8.37 -7.23 -1.26 -0.95 120.40 121.22 1br2 s VAL 726 Ca 0.20 1.27 -0.09 0.00 -1.81 0.00 0.00 61.98 61.56 1br2 s VAL 726 Cb -0.08 -3.70 -0.02 0.00 0.56 0.00 0.00 36.38 33.14 1br2 s VAL 726 CO 0.10 0.10 0.96 0.49 -0.31 0.00 0.00 175.10 176.43 1br2 n PHE 727 N 0.20 -0.12 -0.24 2.82 3.72 -1.17 -0.85 117.46 121.81 1br2 n PHE 727 Ca 0.04 0.35 -0.03 0.00 -0.05 0.00 0.00 57.45 57.76 1br2 n PHE 727 Cb 0.48 -0.46 0.03 0.00 -0.94 0.00 0.00 39.48 38.59 1br2 n PHE 727 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1br2 h GLN 728 N 0.00 -0.10 -0.67 -1.08 4.15 -1.90 0.17 115.11 115.68 1br2 h GLN 728 Ca 0.05 0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.55 1br2 h GLN 728 Cb 0.12 0.02 -0.06 0.00 0.21 0.00 0.00 27.48 27.77 1br2 h GLN 728 CO -0.27 -0.07 0.34 1.49 -1.93 0.00 0.00 178.83 178.40 1br2 h GLU 729 N -0.10 0.60 -0.54 1.69 4.81 -1.37 0.31 114.58 119.96 1br2 h GLU 729 Ca 0.28 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.46 1br2 h GLU 729 Cb 0.56 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1br2 h GLU 729 CO -0.74 0.40 0.30 0.35 -0.73 0.00 0.00 179.01 178.59 1br2 h PHE 730 N 0.62 0.74 -0.01 0.92 3.57 0.20 0.26 116.94 123.24 1br2 h PHE 730 Ca 0.31 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.81 1br2 h PHE 730 Cb 0.27 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 1br2 h PHE 730 CO -0.10 0.54 -0.07 -0.09 -2.23 0.00 0.00 178.31 176.36 1br2 h ARG 731 N 0.73 -0.12 -0.16 1.11 1.12 0.11 -1.54 114.38 115.63 1br2 h ARG 731 Ca 0.19 0.01 -0.08 0.00 -1.11 0.00 0.00 59.98 58.99 1br2 h ARG 731 Cb 0.04 0.03 -0.00 0.00 -0.01 0.00 0.00 29.97 30.02 1br2 h ARG 731 CO -0.03 -0.08 -0.21 -0.56 -3.11 0.00 0.00 179.97 175.98 1br2 h GLN 732 N -0.12 0.42 -0.59 0.20 3.07 -0.28 0.53 115.11 118.35 1br2 h GLN 732 Ca 0.03 -0.24 -0.01 0.00 0.09 0.00 0.00 58.65 58.52 1br2 h GLN 732 Cb 0.16 0.02 -0.03 0.00 0.08 0.00 0.00 27.48 27.71 1br2 h GLN 732 CO -0.08 0.82 0.33 -0.09 0.09 0.00 0.00 178.83 179.90 1br2 h ARG 733 N 0.06 0.82 -0.14 0.06 2.43 -0.93 -3.33 114.38 113.35 1br2 h ARG 733 Ca 0.02 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1br2 h ARG 733 Cb 0.77 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1br2 h ARG 733 CO 0.05 0.62 0.00 0.66 -1.51 0.00 0.00 179.97 179.79 1br2 n TYR 734 N -4.59 0.30 0.21 2.20 4.01 -0.58 -4.60 117.16 114.11 1br2 n TYR 734 Ca 0.04 -0.70 0.06 0.00 -0.16 0.00 0.00 57.90 57.13 1br2 n TYR 734 Cb 0.08 -0.12 0.53 0.00 -0.31 0.00 0.00 39.34 39.52 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 0.85 0.05 -0.09 -0.72 4.57 -0.99 -1.11 114.58 117.14 1br2 h GLU 735 Ca 0.00 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.18 1br2 h GLU 735 Cb 0.87 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.45 1br2 h GLU 735 CO 0.05 0.16 0.06 0.82 -1.18 0.00 0.00 179.01 178.91 1br2 h ILE 736 N 0.05 1.00 0.00 2.32 5.03 -1.82 0.20 117.51 124.29 1br2 h ILE 736 Ca 0.01 -0.03 0.00 0.00 -0.12 0.00 0.00 64.86 64.72 1br2 h ILE 736 Cb 0.21 0.91 0.00 0.00 -3.03 0.00 0.00 36.82 34.92 1br2 h ILE 736 CO 0.01 0.01 0.00 0.18 -0.68 0.00 0.00 178.15 177.68 1br2 n LEU 737 N -4.52 0.67 -2.95 1.44 4.77 -0.42 -3.82 117.00 112.16 1br2 n LEU 737 Ca -0.01 0.61 -0.14 0.00 -0.03 0.00 0.00 56.01 56.43 1br2 n LEU 737 Cb 0.11 -0.46 0.01 0.00 -2.33 0.00 0.00 43.42 40.76 1br2 n LEU 737 CO 0.34 -0.35 0.02 0.00 -1.33 0.00 0.00 177.39 176.07 1br2 n ALA 738 N -1.75 0.48 -0.28 -1.18 0.00 0.02 -4.92 120.51 112.87 1br2 n ALA 738 Ca 0.04 -2.37 0.04 0.00 0.00 0.00 0.00 53.44 51.15 1br2 n ALA 738 Cb 0.32 -1.07 0.18 0.00 0.00 0.00 0.00 19.45 18.89 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 1.15 -0.50 0.00 0.00 -0.82 0.49 119.26 123.07 1br2 h ALA 739 Ca -0.02 0.07 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 1br2 h ALA 739 Cb 1.00 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.61 1br2 h ALA 739 CO 0.35 -0.04 0.30 0.09 0.00 0.00 0.00 179.25 179.95 1br2 n ASN 740 N -4.85 3.43 -0.09 0.00 3.02 -1.26 -4.27 115.26 111.23 1br2 n ASN 740 Ca 0.14 -2.81 -0.18 0.00 -0.03 0.00 0.00 54.58 51.71 1br2 n ASN 740 Cb 0.35 -0.67 -0.11 0.00 -0.61 0.00 0.00 39.78 38.74 1br2 n ASN 740 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1br2 h ALA 741 N 1.71 0.18 -2.76 5.41 0.00 -1.22 -3.48 119.26 119.09 1br2 h ALA 741 Ca 0.29 -0.96 -0.59 0.00 0.00 0.00 0.00 54.91 53.66 1br2 h ALA 741 Cb 1.90 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 20.19 1br2 h ALA 741 CO 0.55 0.51 -0.36 0.42 0.00 0.00 0.00 179.25 180.37 1br2 s ILE 742 N -2.29 5.22 0.60 0.00 1.09 -1.26 -4.57 121.20 119.98 1br2 s ILE 742 Ca -0.25 -0.08 -0.20 0.00 -1.10 0.00 0.00 60.65 59.03 1br2 s ILE 742 Cb 0.03 -3.63 -0.03 0.00 -1.06 0.00 0.00 42.46 37.78 1br2 s ILE 742 CO 0.56 0.06 1.29 -2.16 -0.10 0.00 0.00 174.94 174.59 1br2 s PRO 743 N -2.63 2.88 -0.70 2.79 0.04 -1.26 -4.89 135.00 131.23 1br2 s PRO 743 Ca 0.40 2.05 -0.27 0.00 0.04 0.00 0.00 61.00 63.22 1br2 s PRO 743 Cb -0.12 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.41 1br2 s PRO 743 CO 0.26 -1.34 1.53 -1.59 0.04 0.00 0.00 177.00 175.89 1br2 s LYS 744 N -3.20 2.97 0.00 4.56 0.00 -1.26 -4.63 119.74 118.18 1br2 s LYS 744 Ca 0.77 0.06 0.00 0.00 0.00 0.00 0.00 55.97 56.80 1br2 s LYS 744 Cb -0.36 -4.33 0.00 0.00 0.00 0.00 0.00 37.83 33.14 1br2 s LYS 744 CO 0.40 -2.41 0.00 0.41 0.00 0.00 0.00 175.35 173.75 1br2 n GLY 745 N 5.60 0.46 3.65 0.59 0.00 -1.26 -5.06 105.19 109.17 1br2 n GLY 745 Ca 0.12 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.40 1br2 n GLY 745 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1br2 s PHE 746 N -3.65 3.34 -0.19 1.61 5.36 -1.26 -5.01 117.98 118.18 1br2 s PHE 746 Ca 0.00 1.27 -0.04 0.00 -0.96 0.00 0.00 56.93 57.20 1br2 s PHE 746 Cb 0.00 -3.12 0.06 0.00 -0.34 0.00 0.00 43.02 39.62 1br2 s PHE 746 CO 0.00 -0.41 0.08 1.41 -1.46 0.00 0.00 175.22 174.84 1br2 s MET 747 N 2.87 0.22 0.34 10.12 -2.45 -1.26 -4.94 119.30 124.20 1br2 s MET 747 Ca 0.39 -0.21 -0.26 0.00 -1.25 0.00 0.00 55.69 54.36 1br2 s MET 747 Cb -0.15 -1.86 -0.13 0.00 1.25 0.00 0.00 34.83 33.93 1br2 s MET 747 CO 0.08 -0.69 0.93 -0.40 1.05 0.00 0.00 175.02 175.99 1br2 n ASP 748 N 5.22 0.91 -0.31 1.11 5.75 -1.26 -4.60 116.55 123.37 1br2 n ASP 748 Ca -0.07 1.11 -0.04 0.00 -0.01 0.00 0.00 54.79 55.78 1br2 n ASP 748 Cb 0.48 -1.27 0.01 0.00 -1.03 0.00 0.00 41.12 39.31 1br2 n ASP 748 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1br2 h GLY 749 N 1.69 -0.10 0.80 6.12 0.00 -1.98 0.42 103.07 110.02 1br2 h GLY 749 Ca -0.40 0.52 -0.04 0.00 0.00 0.00 0.00 47.33 47.40 1br2 h GLY 749 CO 0.58 -0.18 -0.39 1.70 0.00 0.00 0.00 176.54 178.25 1br2 h LYS 750 N -0.08 -1.04 -0.09 4.80 3.64 -1.92 0.07 116.57 121.95 1br2 h LYS 750 Ca 0.28 0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.76 1br2 h LYS 750 Cb 0.57 0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1br2 h LYS 750 CO -0.86 -0.69 0.07 1.96 -2.27 0.00 0.00 179.45 177.66 1br2 h GLN 751 N -1.13 0.00 -0.21 1.90 1.08 -1.83 -0.19 115.11 114.73 1br2 h GLN 751 Ca -0.11 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.03 1br2 h GLN 751 Cb 0.83 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.25 1br2 h GLN 751 CO 0.18 0.00 -0.10 0.00 -0.95 0.00 0.00 178.83 177.96 1br2 h ALA 752 N 1.95 0.29 0.45 3.87 0.00 0.02 -1.20 119.26 124.65 1br2 h ALA 752 Ca 0.04 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1br2 h ALA 752 Cb 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1br2 h ALA 752 CO -0.00 0.13 -0.22 0.00 0.00 0.00 0.00 179.25 179.17 1br2 h ILE 754 N -0.73 0.39 0.62 0.00 2.04 -1.02 0.19 117.51 119.01 1br2 h ILE 754 Ca -0.06 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1br2 h ILE 754 Cb 0.53 -0.05 0.01 0.00 -0.74 0.00 0.00 36.82 36.56 1br2 h ILE 754 CO 0.10 0.07 -0.30 -0.07 0.00 0.00 0.00 178.15 177.96 1br2 h LEU 755 N 0.41 -0.71 -0.49 1.44 3.38 -0.68 -2.53 115.31 116.12 1br2 h LEU 755 Ca 0.70 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.76 1br2 h LEU 755 Cb 1.55 0.18 -0.09 0.00 0.09 0.00 0.00 40.66 42.40 1br2 h LEU 755 CO -0.52 -0.33 -0.06 0.24 0.09 0.00 0.00 178.44 177.85 1br2 h MET 756 N -1.16 0.05 -0.28 1.13 2.86 0.19 0.32 114.93 118.04 1br2 h MET 756 Ca -0.09 -0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1br2 h MET 756 Cb 0.68 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.26 1br2 h MET 756 CO 0.14 0.03 -0.12 0.82 1.06 0.00 0.00 176.91 178.85 1br2 h ILE 757 N 0.05 0.61 -0.48 -1.22 2.04 -0.74 0.79 117.51 118.57 1br2 h ILE 757 Ca 0.24 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.17 1br2 h ILE 757 Cb 0.37 0.61 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 1br2 h ILE 757 CO -0.46 0.00 0.16 0.11 0.00 0.00 0.00 178.15 177.95 1br2 h LYS 758 N -0.07 0.31 -0.46 2.37 1.57 -0.71 0.15 116.57 119.74 1br2 h LYS 758 Ca 0.15 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.97 1br2 h LYS 758 Cb 0.29 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 1br2 h LYS 758 CO -0.33 0.21 0.31 0.00 -0.57 0.00 0.00 179.45 179.06 1br2 h ALA 759 N 1.33 1.95 0.00 3.86 0.00 0.23 0.90 119.26 127.53 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 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1br2 h ALA 759 CO -0.25 -0.03 -0.18 1.28 0.00 0.00 0.00 179.25 180.08 1br2 n LEU 760 N -4.47 0.22 -3.48 0.00 4.77 0.25 -4.93 117.00 109.35 1br2 n LEU 760 Ca 0.06 0.34 -0.21 0.00 -0.03 0.00 0.00 56.01 56.17 1br2 n LEU 760 Cb 0.25 -0.40 0.08 0.00 -2.33 0.00 0.00 43.42 41.02 1br2 n LEU 760 CO 0.35 0.03 0.19 -0.62 -1.33 0.00 0.00 177.39 176.01 1br2 n GLU 761 N -1.55 -7.34 -2.42 3.23 1.02 0.31 -4.93 120.64 108.96 1br2 n GLU 761 Ca 0.06 0.82 -0.42 0.00 -0.02 0.00 0.00 57.16 57.60 1br2 n GLU 761 Cb 0.35 -5.81 -0.03 0.00 -0.02 0.00 0.00 31.44 25.92 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 -6.84 4.35 0.08 -4.62 1.43 -1.08 -4.96 118.68 107.04 1br2 s LEU 762 Ca 0.36 1.98 -0.31 0.00 -1.03 0.00 0.00 54.13 55.13 1br2 s LEU 762 Cb -0.16 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.40 1br2 s LEU 762 CO 0.71 -0.50 1.67 -0.62 0.23 0.00 0.00 176.35 177.85 1br2 s ASP 763 N 1.18 6.58 0.62 2.29 2.15 -1.26 -4.82 116.67 123.40 1br2 s ASP 763 Ca 0.58 2.53 0.26 0.00 0.43 0.00 0.00 52.55 56.35 1br2 s ASP 763 Cb -0.29 -2.57 1.23 0.00 -0.30 0.00 0.00 42.92 41.00 1br2 s ASP 763 CO 0.28 -0.90 1.67 1.55 -0.17 0.00 0.00 175.17 177.60 1br2 h PRO 764 N 8.27 0.00 0.00 4.34 0.13 -1.93 0.58 132.00 143.39 1br2 h PRO 764 Ca -0.43 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.61 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 -0.43 -0.97 -0.23 0.00 0.00 178.00 177.30 1br2 h ASN 765 N 0.00 0.00 0.56 1.44 -1.24 -2.03 -3.09 115.58 111.21 1br2 h ASN 765 Ca 0.21 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.22 1br2 h ASN 765 Cb 1.55 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.60 1br2 h ASN 765 CO -0.00 0.43 0.00 0.18 -1.29 0.00 0.00 177.43 176.75 1br2 n LEU 766 N -3.56 0.29 0.00 0.34 4.77 0.20 -4.83 117.00 114.22 1br2 n LEU 766 Ca -0.00 0.58 -0.10 0.00 -0.03 0.00 0.00 56.01 56.46 1br2 n LEU 766 Cb 0.54 -0.54 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1br2 n LEU 766 CO 0.38 -0.41 0.39 0.00 -1.33 0.00 0.00 177.39 176.41 1br2 n TYR 767 N -1.83 -1.99 -3.71 -1.77 0.18 -1.17 -1.04 117.16 105.84 1br2 n TYR 767 Ca 0.03 -1.82 -0.13 0.00 1.88 0.00 0.00 57.90 57.85 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 -2.27 0.56 -0.40 -3.48 1.81 0.03 -4.94 118.95 110.26 1br2 s ARG 768 Ca 0.18 0.68 -0.14 0.00 -1.72 0.00 0.00 55.73 54.72 1br2 s ARG 768 Cb -0.03 0.27 0.02 0.00 -0.45 0.00 0.00 34.95 34.76 1br2 s ARG 768 CO 0.13 -0.07 0.28 0.42 -0.68 0.00 0.00 175.30 175.38 1br2 s ILE 769 N 0.27 5.11 0.16 1.52 -1.09 -1.26 0.66 121.20 126.58 1br2 s ILE 769 Ca -0.00 -0.70 -0.00 0.00 -2.23 0.00 0.00 60.65 57.72 1br2 s ILE 769 Cb -0.03 -3.85 0.03 0.00 -1.58 0.00 0.00 42.46 37.03 1br2 s ILE 769 CO 0.00 -0.29 0.22 0.61 -1.23 0.00 0.00 174.94 174.25 1br2 n GLY 770 N 5.12 0.61 0.37 6.18 0.00 0.10 -4.83 105.19 112.74 1br2 n GLY 770 Ca -0.11 -1.95 -0.13 0.00 0.00 0.00 0.00 46.02 43.82 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 -0.55 -0.01 1.61 5.75 -0.83 -3.34 115.11 117.75 1br2 h GLN 771 Ca -0.07 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1br2 h GLN 771 Cb 0.26 0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.94 1br2 h GLN 771 CO 0.08 -0.37 -0.13 -1.13 -2.65 0.00 0.00 178.83 174.63 1br2 n SER 772 N -5.44 1.03 -3.60 -0.69 3.41 -1.26 -5.04 113.62 102.04 1br2 n SER 772 Ca -0.06 -1.02 -0.11 0.00 -0.26 0.00 0.00 58.87 57.42 1br2 n SER 772 Cb 0.35 0.44 -0.04 0.00 -0.26 0.00 0.00 64.21 64.70 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 -1.04 1.20 -0.15 4.33 -2.85 -1.25 -3.05 119.74 116.94 1br2 s LYS 773 Ca 0.06 -0.68 -0.13 0.00 -1.00 0.00 0.00 55.97 54.22 1br2 s LYS 773 Cb 0.05 0.52 -0.05 0.00 -2.06 0.00 0.00 37.83 36.29 1br2 s LYS 773 CO 0.16 -0.50 0.28 0.42 0.10 0.00 0.00 175.35 175.81 1br2 s ILE 774 N -3.80 5.31 -0.14 3.79 1.01 -0.13 0.00 121.20 127.23 1br2 s ILE 774 Ca 0.04 0.52 -0.13 0.00 0.00 0.00 0.00 60.65 61.07 1br2 s ILE 774 Cb 0.00 -3.61 -0.05 0.00 0.01 0.00 0.00 42.46 38.82 1br2 s ILE 774 CO -0.10 0.43 0.29 -0.36 0.00 0.00 0.00 174.94 175.20 1br2 s PHE 775 N 0.20 3.50 0.14 3.97 0.40 0.21 -1.96 117.98 124.44 1br2 s PHE 775 Ca 0.16 0.62 0.08 0.00 -0.60 0.00 0.00 56.93 57.20 1br2 s PHE 775 Cb -0.13 -2.30 -0.04 0.00 0.51 0.00 0.00 43.02 41.06 1br2 s PHE 775 CO 0.04 0.32 -0.11 -0.06 0.70 0.00 0.00 175.22 176.12 1br2 s PHE 776 N 0.19 2.67 0.78 0.36 0.08 -0.26 -0.79 117.98 121.02 1br2 s PHE 776 Ca 0.17 -0.20 -0.11 0.00 0.12 0.00 0.00 56.93 56.91 1br2 s PHE 776 Cb -0.13 -1.36 0.06 0.00 -0.57 0.00 0.00 43.02 41.02 1br2 s PHE 776 CO 0.05 0.46 1.08 1.03 -0.10 0.00 0.00 175.22 177.74 1br2 s ARG 777 N -2.48 2.19 0.24 0.44 1.81 -0.20 -2.96 118.95 117.99 1br2 s ARG 777 Ca 0.23 0.89 -0.31 0.00 -1.72 0.00 0.00 55.73 54.82 1br2 s ARG 777 Cb -0.10 -1.91 -0.14 0.00 -0.45 0.00 0.00 34.95 32.35 1br2 s ARG 777 CO 0.14 -1.61 1.31 -2.37 -0.68 0.00 0.00 175.30 172.09 1br2 n THR 778 N -3.46 1.14 -1.26 0.02 5.66 -1.26 -2.04 114.28 113.07 1br2 n THR 778 Ca 0.08 -0.28 -0.09 0.00 -3.05 0.00 0.00 64.05 60.70 1br2 n THR 778 Cb 0.54 -1.31 -0.04 0.00 -1.55 0.00 0.00 70.33 67.97 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 1.91 0.95 0.06 1.09 0.00 -1.26 -4.88 105.19 103.06 1br2 n GLY 779 Ca 0.11 -0.14 -0.09 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 1.06 -0.33 1.61 2.07 -1.77 -3.05 116.25 115.84 1br2 h VAL 780 Ca -0.18 -1.81 0.02 0.00 0.82 0.00 0.00 66.70 65.54 1br2 h VAL 780 Cb 0.92 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 32.69 1br2 h VAL 780 CO 0.27 0.36 0.22 -0.07 0.02 0.00 0.00 177.57 178.37 1br2 h LEU 781 N -1.00 0.32 0.06 2.57 3.38 -1.90 -1.24 115.31 117.50 1br2 h LEU 781 Ca -0.01 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1br2 h LEU 781 Cb 0.63 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1br2 h LEU 781 CO -0.01 0.23 -0.29 0.00 0.09 0.00 0.00 178.44 178.45 1br2 h ALA 782 N 1.81 -0.80 -0.96 1.53 0.00 -1.94 0.59 119.26 119.50 1br2 h ALA 782 Ca 0.13 -0.06 0.16 0.00 0.00 0.00 0.00 54.91 55.14 1br2 h ALA 782 Cb 0.06 0.70 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 1br2 h ALA 782 CO -0.03 -0.87 0.60 1.25 0.00 0.00 0.00 179.25 180.20 1br2 h HIS 783 N -0.41 0.94 -0.84 0.00 -0.00 -1.28 0.42 115.15 113.98 1br2 h HIS 783 Ca -0.00 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.39 1br2 h HIS 783 Cb 0.42 -0.29 -0.04 0.00 -0.00 0.00 0.00 27.41 27.49 1br2 h HIS 783 CO -0.39 0.31 0.52 -0.07 -0.00 0.00 0.00 177.93 178.29 1br2 h LEU 784 N 0.76 0.99 0.20 0.26 3.38 -0.06 0.55 115.31 121.39 1br2 h LEU 784 Ca 0.50 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.40 1br2 h LEU 784 Cb 0.77 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1br2 h LEU 784 CO -0.27 0.76 -0.10 -0.08 0.09 0.00 0.00 178.44 178.84 1br2 h GLU 785 N 1.14 -0.26 -0.78 1.13 4.57 0.45 -0.15 114.58 120.67 1br2 h GLU 785 Ca 0.30 0.02 0.12 0.00 -1.18 0.00 0.00 59.36 58.62 1br2 h GLU 785 Cb -0.06 0.06 -0.08 0.00 -0.16 0.00 0.00 28.75 28.50 1br2 h GLU 785 CO -0.06 -0.02 0.39 0.93 -1.18 0.00 0.00 179.01 179.08 1br2 h GLU 786 N -0.48 0.60 -0.37 1.92 5.08 -0.74 0.13 114.58 120.72 1br2 h GLU 786 Ca -0.03 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 1br2 h GLU 786 Cb 0.36 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1br2 h GLU 786 CO 0.05 0.40 -0.10 0.93 -1.00 0.00 0.00 179.01 179.28 1br2 h GLU 787 N 0.62 0.64 -0.09 2.33 5.08 -0.75 -2.65 114.58 119.76 1br2 h GLU 787 Ca 0.41 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.60 1br2 h GLU 787 Cb 0.50 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1br2 h GLU 787 CO -0.32 0.74 0.09 -0.09 -1.00 0.00 0.00 179.01 178.43 1br2 h ARG 788 N 0.59 0.00 -0.02 2.33 2.43 0.12 -3.51 114.38 116.31 1br2 h ARG 788 Ca 0.11 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1br2 h ARG 788 Cb 0.53 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1br2 h ARG 788 CO 0.03 0.00 0.00 -0.25 -1.51 0.00 0.00 179.97 178.24