#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1br1 s GLN 3 N 0.00 2.09 1.03 0.00 -1.52 -1.26 -5.12 119.66 114.89 1br1 s GLN 3 Ca 0.00 -1.92 -0.24 0.00 -1.95 0.00 0.00 55.36 51.25 1br1 s GLN 3 Cb 0.00 -1.85 -0.11 0.00 -0.22 0.00 0.00 33.01 30.84 1br1 s GLN 3 CO 0.00 -0.04 -1.05 1.17 -0.25 0.00 0.00 175.29 175.12 1br1 n LYS 4 N -1.08 -0.45 -3.88 2.91 4.81 -1.26 -4.91 118.16 114.30 1br1 n LYS 4 Ca -0.03 -0.13 -0.32 0.00 -0.87 0.00 0.00 58.31 56.96 1br1 n LYS 4 Cb 0.65 -1.21 -0.04 0.00 0.02 0.00 0.00 35.03 34.44 1br1 n LYS 4 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1br1 s PRO 5 N -2.43 3.46 -0.16 1.64 0.04 -1.26 -4.93 135.00 131.36 1br1 s PRO 5 Ca 0.42 -0.34 -0.04 0.00 0.04 0.00 0.00 61.00 61.08 1br1 s PRO 5 Cb 0.02 -3.05 -0.03 0.00 0.04 0.00 0.00 34.50 31.49 1br1 s PRO 5 CO 0.67 0.63 -0.04 -0.51 0.04 0.00 0.00 177.00 177.79 1br1 s LEU 6 N -2.25 3.21 0.52 -3.56 1.43 -1.26 -5.08 118.68 111.68 1br1 s LEU 6 Ca 0.32 -0.16 -0.23 0.00 -1.03 0.00 0.00 54.13 53.03 1br1 s LEU 6 Cb -0.13 -1.78 -0.06 0.00 0.03 0.00 0.00 46.19 44.25 1br1 s LEU 6 CO 0.23 0.14 1.36 -0.24 0.23 0.00 0.00 176.35 178.07 1br1 n SER 7 N 3.72 2.77 -0.55 2.29 2.88 -1.26 -4.77 113.62 118.70 1br1 n SER 7 Ca -0.17 1.01 0.44 0.00 -1.33 0.00 0.00 58.87 58.82 1br1 n SER 7 Cb 0.52 -1.57 0.73 0.00 -0.75 0.00 0.00 64.21 63.14 1br1 n SER 7 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 1br1 h ASP 8 N 1.64 0.12 0.01 -3.46 3.04 -1.99 0.90 116.42 116.67 1br1 h ASP 8 Ca -0.51 0.07 -0.00 0.00 -3.24 0.00 0.00 57.03 53.36 1br1 h ASP 8 Cb 1.30 0.07 0.00 0.00 -1.04 0.00 0.00 39.33 39.66 1br1 h ASP 8 CO 0.58 -0.11 -0.01 0.44 -2.04 0.00 0.00 179.24 178.11 1br1 h ASP 9 N 0.03 -0.01 0.00 4.15 5.19 -1.95 -3.23 116.42 120.60 1br1 h ASP 9 Ca 0.86 -0.74 0.00 0.00 -0.62 0.00 0.00 57.03 56.53 1br1 h ASP 9 Cb 3.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 42.59 1br1 h ASP 9 CO -0.23 0.75 0.23 -0.33 -3.12 0.00 0.00 179.24 176.54 1br1 h GLU 10 N -0.80 0.00 0.00 3.56 5.08 -1.17 0.53 114.58 121.79 1br1 h GLU 10 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1br1 h GLU 10 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1br1 h GLU 10 CO 0.00 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.64 1br1 n LYS 11 N -2.76 0.72 0.00 2.33 5.02 -0.90 0.57 118.16 123.14 1br1 n LYS 11 Ca -0.02 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.36 1br1 n LYS 11 Cb 0.28 -1.42 -0.02 0.00 -0.02 0.00 0.00 35.03 33.85 1br1 n LYS 11 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1br1 n PHE 12 N -0.92 0.00 -0.11 2.13 3.72 0.19 -4.45 117.46 118.02 1br1 n PHE 12 Ca 0.14 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.54 1br1 n PHE 12 Cb 0.07 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 1br1 n PHE 12 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1br1 n LEU 13 N -0.27 0.00 -4.43 4.37 4.77 -0.92 -4.13 117.00 116.39 1br1 n LEU 13 Ca 0.07 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.74 1br1 n LEU 13 Cb 0.39 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.34 1br1 n LEU 13 CO 0.26 0.00 -0.50 -0.36 -1.33 0.00 0.00 177.39 175.46 1br1 s PHE 14 N 0.00 2.52 0.05 -1.77 0.08 0.19 -4.70 117.98 114.36 1br1 s PHE 14 Ca 0.00 -0.28 -0.24 0.00 0.12 0.00 0.00 56.93 56.52 1br1 s PHE 14 Cb 0.00 -1.49 -0.06 0.00 -0.57 0.00 0.00 43.02 40.90 1br1 s PHE 14 CO 0.00 0.18 0.74 0.14 -0.10 0.00 0.00 175.22 176.19 1br1 s VAL 15 N -0.83 4.72 -0.55 -0.44 -7.23 -1.26 -4.42 120.40 110.39 1br1 s VAL 15 Ca 0.13 1.58 -0.26 0.00 -1.81 0.00 0.00 61.98 61.62 1br1 s VAL 15 Cb -0.10 -4.09 0.04 0.00 0.56 0.00 0.00 36.38 32.78 1br1 s VAL 15 CO 0.03 0.39 1.05 -1.81 -0.31 0.00 0.00 175.10 174.44 1br1 s ASP 16 N -0.17 6.41 -0.00 4.85 1.01 -1.26 -4.81 116.67 122.69 1br1 s ASP 16 Ca 0.37 -0.10 0.03 0.00 0.71 0.00 0.00 52.55 53.56 1br1 s ASP 16 Cb -0.20 -2.49 -0.03 0.00 1.01 0.00 0.00 42.92 41.20 1br1 s ASP 16 CO 0.22 -1.32 0.08 0.29 0.21 0.00 0.00 175.17 174.66 1br1 n LYS 17 N 7.85 3.34 -2.54 8.23 5.02 -1.26 -4.92 118.16 133.88 1br1 n LYS 17 Ca 0.05 -0.01 -0.40 0.00 -2.02 0.00 0.00 58.31 55.93 1br1 n LYS 17 Cb 0.48 -0.82 -0.03 0.00 -0.02 0.00 0.00 35.03 34.64 1br1 n LYS 17 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1br1 s ASN 18 N -1.73 6.40 0.19 4.39 -0.87 -1.26 -4.78 114.94 117.28 1br1 s ASN 18 Ca 0.00 -1.28 -0.01 0.00 -1.57 0.00 0.00 52.86 50.01 1br1 s ASN 18 Cb 0.02 -2.57 0.00 0.00 -0.02 0.00 0.00 41.25 38.68 1br1 s ASN 18 CO 0.11 -1.60 0.26 0.49 -2.57 0.00 0.00 177.10 173.78 1br1 n PHE 19 N 9.17 -0.97 -3.25 2.20 3.72 -1.26 -5.08 117.46 121.99 1br1 n PHE 19 Ca 0.29 -1.30 -0.34 0.00 -0.05 0.00 0.00 57.45 56.06 1br1 n PHE 19 Cb 0.51 0.30 -0.06 0.00 -0.94 0.00 0.00 39.48 39.28 1br1 n PHE 19 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1br1 s VAL 20 N -2.64 4.76 -1.04 -4.37 0.11 -1.26 -4.92 120.40 111.03 1br1 s VAL 20 Ca 0.16 0.86 -0.08 0.00 -2.93 0.00 0.00 61.98 59.98 1br1 s VAL 20 Cb -0.00 -3.68 -0.14 0.00 -1.53 0.00 0.00 36.38 31.02 1br1 s VAL 20 CO 0.12 0.01 3.06 -0.46 -3.33 0.00 0.00 175.10 174.50 1br1 n ASN 21 N 0.15 7.23 -4.63 3.54 6.94 -1.26 -4.94 115.26 122.28 1br1 n ASN 21 Ca -0.00 -2.50 -0.48 0.00 -0.02 0.00 0.00 54.58 51.57 1br1 n ASN 21 Cb 0.52 -1.45 -0.05 0.00 -2.36 0.00 0.00 39.78 36.44 1br1 n ASN 21 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 1br1 n ASN 22 N 3.29 2.40 -0.97 0.53 0.23 -1.26 -4.87 115.26 114.60 1br1 n ASN 22 Ca 0.64 1.11 0.08 0.00 -0.53 0.00 0.00 54.58 55.88 1br1 n ASN 22 Cb 0.43 -1.32 0.23 0.00 -2.08 0.00 0.00 39.78 37.04 1br1 n ASN 22 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1br1 n PRO 23 N 2.85 2.22 0.02 -0.53 -0.05 -1.26 -4.16 135.00 134.09 1br1 n PRO 23 Ca 0.17 -1.89 -0.12 0.00 -0.05 0.00 0.00 63.50 61.61 1br1 n PRO 23 Cb 0.25 -1.41 -0.08 0.00 -0.05 0.00 0.00 33.50 32.21 1br1 n PRO 23 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 175.50 175.38 1br1 h LEU 24 N 3.08 -0.00 -0.02 1.53 3.38 -1.98 0.58 115.31 121.88 1br1 h LEU 24 Ca 0.00 -0.15 -0.26 0.00 0.09 0.00 0.00 57.88 57.56 1br1 h LEU 24 Cb 0.70 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.47 1br1 h LEU 24 CO 0.00 0.15 -1.01 0.00 0.09 0.00 0.00 178.44 177.67 1br1 h ALA 25 N 0.84 0.15 0.00 1.53 0.00 -1.99 -0.30 119.26 119.49 1br1 h ALA 25 Ca -0.00 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.23 1br1 h ALA 25 Cb 0.16 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1br1 h ALA 25 CO 0.00 0.68 0.00 0.94 0.00 0.00 0.00 179.25 180.87 1br1 n GLN 26 N -3.87 0.02 -0.08 0.00 0.00 -1.14 -2.45 117.38 109.86 1br1 n GLN 26 Ca -0.11 0.31 -0.11 0.00 -0.00 0.00 0.00 57.00 57.09 1br1 n GLN 26 Cb 0.87 -1.50 -0.08 0.00 0.00 0.00 0.00 30.24 29.53 1br1 n GLN 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1br1 n ALA 27 N -1.46 1.64 0.31 1.69 0.00 0.20 -4.42 120.51 118.47 1br1 n ALA 27 Ca 0.03 -0.73 0.20 0.00 0.00 0.00 0.00 53.44 52.94 1br1 n ALA 27 Cb 0.11 0.10 1.05 0.00 0.00 0.00 0.00 19.45 20.71 1br1 n ALA 27 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1br1 h ASP 28 N 0.00 0.00 -0.35 0.00 1.82 -0.71 -2.56 116.42 114.62 1br1 h ASP 28 Ca -0.37 0.00 0.10 0.00 -0.39 0.00 0.00 57.03 56.37 1br1 h ASP 28 Cb 1.60 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.59 1br1 h ASP 28 CO -0.05 0.00 0.54 4.11 -1.61 0.00 0.00 179.24 182.23 1br1 h TRP 29 N 0.00 0.00 -0.09 0.28 5.08 -1.70 0.16 115.95 119.69 1br1 h TRP 29 Ca 0.00 0.00 0.03 0.00 1.08 0.00 0.00 58.89 60.00 1br1 h TRP 29 Cb 0.12 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.28 1br1 h TRP 29 CO 0.00 0.00 0.06 0.77 -1.28 0.00 0.00 178.44 177.99 1br1 h SER 30 N 0.00 0.00 0.00 0.11 0.02 -1.79 -0.45 113.55 111.45 1br1 h SER 30 Ca 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1br1 h SER 30 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1br1 h SER 30 CO -0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 1br1 n ALA 31 N -2.55 2.39 -0.31 3.77 0.00 0.58 -4.44 120.51 119.94 1br1 n ALA 31 Ca -0.01 0.00 0.25 0.00 0.00 0.00 0.00 53.44 53.68 1br1 n ALA 31 Cb 0.17 -1.16 0.41 0.00 0.00 0.00 0.00 19.45 18.88 1br1 n ALA 31 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1br1 n LYS 32 N 1.08 -0.01 0.00 0.00 5.02 -0.18 0.15 118.16 124.22 1br1 n LYS 32 Ca 0.00 0.68 0.00 0.00 -2.02 0.00 0.00 58.31 56.97 1br1 n LYS 32 Cb 0.29 -1.41 0.01 0.00 -0.02 0.00 0.00 35.03 33.90 1br1 n LYS 32 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1br1 n LYS 33 N -3.57 0.03 -2.23 1.97 4.76 -1.26 -4.69 118.16 113.18 1br1 n LYS 33 Ca 0.24 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.25 1br1 n LYS 33 Cb 0.98 -1.12 -0.03 0.00 -1.84 0.00 0.00 35.03 33.01 1br1 n LYS 33 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1br1 s LEU 34 N -1.25 4.30 0.00 -0.35 1.43 0.39 0.14 118.68 123.35 1br1 s LEU 34 Ca 0.00 2.07 0.03 0.00 -1.03 0.00 0.00 54.13 55.21 1br1 s LEU 34 Cb 0.00 -3.55 -0.01 0.00 0.03 0.00 0.00 46.19 42.65 1br1 s LEU 34 CO 0.00 -0.74 0.12 1.33 0.23 0.00 0.00 176.35 177.29 1br1 n VAL 35 N 4.83 0.00 -4.44 -1.59 0.24 0.19 -4.15 118.33 113.42 1br1 n VAL 35 Ca 0.14 -1.06 -0.30 0.00 -2.04 0.00 0.00 64.34 61.07 1br1 n VAL 35 Cb 0.44 0.53 -0.11 0.00 -1.47 0.00 0.00 33.84 33.22 1br1 n VAL 35 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1br1 s TRP 36 N -2.58 2.63 0.10 6.34 0.52 0.25 -2.40 118.94 123.80 1br1 s TRP 36 Ca 0.17 -0.21 -0.22 0.00 0.02 0.00 0.00 56.10 55.86 1br1 s TRP 36 Cb 0.01 -1.44 0.06 0.00 -1.15 0.00 0.00 33.47 30.94 1br1 s TRP 36 CO 0.12 0.34 0.53 0.14 0.02 0.00 0.00 176.95 178.11 1br1 s VAL 37 N -1.06 0.03 0.53 4.03 -7.23 -0.87 -0.22 120.40 115.61 1br1 s VAL 37 Ca 0.17 -0.21 -0.09 0.00 -1.81 0.00 0.00 61.98 60.04 1br1 s VAL 37 Cb -0.11 -1.03 -0.08 0.00 0.56 0.00 0.00 36.38 35.73 1br1 s VAL 37 CO 0.09 -0.12 -0.43 -2.65 -0.31 0.00 0.00 175.10 171.68 1br1 n PRO 38 N 0.03 0.00 -3.15 4.82 -0.01 -1.26 -0.46 135.00 134.97 1br1 n PRO 38 Ca -0.17 0.00 0.06 0.00 -0.01 0.00 0.00 63.50 63.37 1br1 n PRO 38 Cb 0.62 -0.54 -0.02 0.00 -0.01 0.00 0.00 33.50 33.56 1br1 n PRO 38 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 175.50 175.94 1br1 s SER 39 N -0.54 -0.29 0.00 2.55 0.15 -1.20 -4.22 113.70 110.15 1br1 s SER 39 Ca 0.22 0.18 0.00 0.00 0.70 0.00 0.00 55.95 57.05 1br1 s SER 39 Cb -0.10 1.24 0.00 0.00 -1.71 0.00 0.00 66.02 65.45 1br1 s SER 39 CO 0.45 -0.05 0.47 -0.62 1.20 0.00 0.00 173.24 174.68 1br1 n GLU 40 N 5.47 0.49 0.00 5.44 1.02 -1.26 -0.72 120.64 131.08 1br1 n GLU 40 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 1br1 n GLU 40 Cb 0.54 -1.02 0.00 0.00 -0.02 0.00 0.00 31.44 30.94 1br1 n GLU 40 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1br1 n LYS 41 N -0.43 0.94 0.00 3.49 4.76 -1.26 -4.87 118.16 120.78 1br1 n LYS 41 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1br1 n LYS 41 Cb 0.01 -0.08 0.00 0.00 -1.84 0.00 0.00 35.03 33.12 1br1 n LYS 41 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1br1 n HIS 42 N 0.00 0.00 0.00 2.13 8.25 -1.10 -4.79 115.22 119.71 1br1 n HIS 42 Ca 0.00 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 1br1 n HIS 42 Cb 0.00 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.10 1br1 n HIS 42 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1br1 n GLY 43 N -0.05 0.84 3.45 -1.41 0.00 0.10 -4.62 105.19 103.50 1br1 n GLY 43 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1br1 n GLY 43 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1br1 s PHE 44 N 0.00 -0.14 0.10 1.61 0.08 -1.26 -3.23 117.98 115.14 1br1 s PHE 44 Ca 0.00 -0.19 -0.23 0.00 0.12 0.00 0.00 56.93 56.63 1br1 s PHE 44 Cb 0.00 0.34 0.06 0.00 -0.57 0.00 0.00 43.02 42.85 1br1 s PHE 44 CO 0.00 -0.85 0.55 -1.83 -0.10 0.00 0.00 175.22 172.99 1br1 s GLU 45 N -3.85 1.14 0.34 0.44 -1.05 0.39 -4.80 118.70 111.31 1br1 s GLU 45 Ca 0.08 -0.36 -0.27 0.00 -0.15 0.00 0.00 54.97 54.27 1br1 s GLU 45 Cb -0.00 0.52 -0.09 0.00 -0.44 0.00 0.00 34.13 34.12 1br1 s GLU 45 CO -0.06 -0.45 1.14 0.00 0.95 0.00 0.00 175.26 176.84 1br1 s ALA 46 N -3.07 3.29 0.02 -0.84 0.00 -1.26 -2.04 121.76 117.86 1br1 s ALA 46 Ca -0.02 0.93 -0.28 0.00 0.00 0.00 0.00 51.96 52.59 1br1 s ALA 46 Cb -0.00 -3.35 0.10 0.00 0.00 0.00 0.00 23.12 19.86 1br1 s ALA 46 CO -0.07 -0.34 0.99 0.00 0.00 0.00 0.00 175.76 176.35 1br1 s ALA 47 N -1.31 -1.84 -0.04 0.00 0.00 -1.01 -2.24 121.76 115.32 1br1 s ALA 47 Ca 0.51 0.76 0.03 0.00 0.00 0.00 0.00 51.96 53.25 1br1 s ALA 47 Cb -0.31 0.42 0.01 0.00 0.00 0.00 0.00 23.12 23.24 1br1 s ALA 47 CO 0.40 -0.83 -0.10 0.45 0.00 0.00 0.00 175.76 175.67 1br1 s SER 48 N -2.65 1.44 0.26 0.00 0.15 -0.23 0.55 113.70 113.21 1br1 s SER 48 Ca 0.09 -0.23 -0.29 0.00 0.70 0.00 0.00 55.95 56.22 1br1 s SER 48 Cb -0.00 -0.48 -0.14 0.00 -1.71 0.00 0.00 66.02 63.68 1br1 s SER 48 CO -0.04 0.06 1.07 -0.38 1.20 0.00 0.00 173.24 175.14 1br1 n ILE 49 N 3.46 1.71 -0.03 6.45 5.41 0.38 -1.26 119.36 135.48 1br1 n ILE 49 Ca -0.20 -0.43 -0.04 0.00 1.00 0.00 0.00 62.75 63.08 1br1 n ILE 49 Cb 0.53 -1.00 -0.03 0.00 -0.71 0.00 0.00 39.64 38.43 1br1 n ILE 49 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1br1 n LYS 50 N 1.01 1.13 -3.42 0.38 4.76 0.52 -4.80 118.16 117.75 1br1 n LYS 50 Ca 0.11 0.02 0.01 0.00 -2.87 0.00 0.00 58.31 55.59 1br1 n LYS 50 Cb 0.30 -1.13 -0.03 0.00 -1.84 0.00 0.00 35.03 32.33 1br1 n LYS 50 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1br1 s GLU 51 N -2.13 0.43 -0.43 1.97 2.12 -0.60 -4.95 118.70 115.11 1br1 s GLU 51 Ca -0.07 0.99 -0.28 0.00 0.36 0.00 0.00 54.97 55.96 1br1 s GLU 51 Cb 0.02 0.58 0.03 0.00 0.26 0.00 0.00 34.13 35.02 1br1 s GLU 51 CO 0.17 -0.24 1.09 -1.21 -0.54 0.00 0.00 175.26 174.53 1br1 s GLU 52 N 2.73 3.80 -0.71 4.30 2.02 -1.26 0.42 118.70 130.00 1br1 s GLU 52 Ca 0.01 0.66 0.05 0.00 0.02 0.00 0.00 54.97 55.70 1br1 s GLU 52 Cb -0.10 -3.86 0.17 0.00 0.10 0.00 0.00 34.13 30.44 1br1 s GLU 52 CO -0.18 -1.22 0.51 1.63 0.02 0.00 0.00 175.26 176.02 1br1 n LYS 53 N 7.46 1.86 0.00 1.61 4.76 0.15 -4.98 118.16 129.03 1br1 n LYS 53 Ca 0.11 -4.50 0.00 0.00 -2.87 0.00 0.00 58.31 51.05 1br1 n LYS 53 Cb 0.48 -2.29 0.00 0.00 -1.84 0.00 0.00 35.03 31.39 1br1 n LYS 53 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1br1 n GLY 54 N 1.92 2.38 0.09 0.72 0.00 -1.26 -1.48 105.19 107.55 1br1 n GLY 54 Ca 0.20 -0.36 0.03 0.00 0.00 0.00 0.00 46.02 45.89 1br1 n GLY 54 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1br1 n ASP 55 N -0.14 0.14 -4.36 1.61 2.03 -1.26 -4.52 116.55 110.05 1br1 n ASP 55 Ca 0.00 0.37 -0.19 0.00 0.52 0.00 0.00 54.79 55.49 1br1 n ASP 55 Cb 0.00 -0.32 -0.10 0.00 -0.72 0.00 0.00 41.12 39.98 1br1 n ASP 55 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1br1 s GLU 56 N -2.89 1.38 -0.13 -0.67 8.01 -0.55 0.21 118.70 124.06 1br1 s GLU 56 Ca -0.01 -1.65 -0.13 0.00 0.01 0.00 0.00 54.97 53.20 1br1 s GLU 56 Cb 0.02 -1.05 0.04 0.00 -4.31 0.00 0.00 34.13 28.82 1br1 s GLU 56 CO 0.05 0.11 0.38 0.08 0.01 0.00 0.00 175.26 175.89 1br1 s VAL 57 N -3.05 0.00 -0.00 2.63 1.01 0.18 0.31 120.40 121.49 1br1 s VAL 57 Ca 0.25 -0.02 -0.21 0.00 0.00 0.00 0.00 61.98 62.00 1br1 s VAL 57 Cb 0.01 -0.53 -0.05 0.00 0.00 0.00 0.00 36.38 35.81 1br1 s VAL 57 CO 0.08 -0.01 0.60 0.42 0.00 0.00 0.00 175.10 176.19 1br1 s THR 58 N 0.12 4.91 0.02 3.92 -4.23 0.17 -1.55 115.64 118.99 1br1 s THR 58 Ca -0.01 1.26 -0.08 0.00 -1.18 0.00 0.00 61.69 61.68 1br1 s THR 58 Cb -0.03 -3.94 0.00 0.00 1.34 0.00 0.00 72.50 69.88 1br1 s THR 58 CO 0.01 0.42 0.15 -0.69 -0.54 0.00 0.00 174.62 173.97 1br1 s VAL 59 N -0.18 0.10 -0.13 2.29 1.01 -0.52 0.20 120.40 123.16 1br1 s VAL 59 Ca 0.31 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.49 1br1 s VAL 59 Cb -0.18 -0.67 -0.00 0.00 0.00 0.00 0.00 36.38 35.53 1br1 s VAL 59 CO 0.17 -0.45 -0.19 -0.70 0.00 0.00 0.00 175.10 173.93 1br1 s GLU 60 N -1.97 3.15 -0.05 2.72 2.12 -0.39 -0.71 118.70 123.58 1br1 s GLU 60 Ca -0.10 -0.80 -0.32 0.00 0.36 0.00 0.00 54.97 54.11 1br1 s GLU 60 Cb -0.04 -2.49 -0.10 0.00 0.26 0.00 0.00 34.13 31.75 1br1 s GLU 60 CO -0.01 0.09 1.94 1.28 -0.54 0.00 0.00 175.26 178.02 1br1 n LEU 61 N 3.81 3.73 -0.58 2.70 4.77 0.50 -1.07 117.00 130.86 1br1 n LEU 61 Ca -0.19 0.91 0.00 0.00 -0.03 0.00 0.00 56.01 56.70 1br1 n LEU 61 Cb 0.52 -1.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 1br1 n LEU 61 CO 0.28 0.02 0.18 0.00 -1.33 0.00 0.00 177.39 176.55 1br1 n GLN 62 N 7.14 0.63 0.00 3.23 10.64 -0.95 -1.70 117.38 136.37 1br1 n GLN 62 Ca 0.22 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.39 1br1 n GLN 62 Cb 0.35 -1.29 0.00 0.00 -0.86 0.00 0.00 30.24 28.43 1br1 n GLN 62 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 1br1 n GLU 63 N 0.27 0.00 0.00 2.61 4.07 -1.26 -4.83 120.64 121.50 1br1 n GLU 63 Ca 0.00 0.00 0.09 0.00 -0.06 0.00 0.00 57.16 57.19 1br1 n GLU 63 Cb 0.18 0.00 0.54 0.00 -0.06 0.00 0.00 31.44 32.11 1br1 n GLU 63 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1br1 n ASN 64 N -1.34 0.00 0.00 4.31 4.05 -1.24 -4.83 115.26 116.22 1br1 n ASN 64 Ca 0.00 -1.28 0.00 0.00 0.45 0.00 0.00 54.58 53.75 1br1 n ASN 64 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 1br1 n ASN 64 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1br1 n GLY 65 N 0.69 0.40 3.73 8.20 0.00 -0.69 -4.92 105.19 112.60 1br1 n GLY 65 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 1br1 n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1br1 s LYS 66 N -0.49 2.09 -0.28 1.61 2.36 -1.26 -4.71 119.74 119.05 1br1 s LYS 66 Ca 0.00 1.52 0.02 0.00 -2.55 0.00 0.00 55.97 54.96 1br1 s LYS 66 Cb 0.00 -1.85 0.08 0.00 -1.05 0.00 0.00 37.83 35.01 1br1 s LYS 66 CO 0.00 -1.83 -0.02 0.21 1.55 0.00 0.00 175.35 175.26 1br1 s LYS 67 N -4.29 1.65 0.04 4.03 2.20 -1.26 -0.37 119.74 121.74 1br1 s LYS 67 Ca 0.68 -1.37 0.05 0.00 -0.36 0.00 0.00 55.97 54.97 1br1 s LYS 67 Cb -0.23 -2.80 -0.02 0.00 -1.51 0.00 0.00 37.83 33.27 1br1 s LYS 67 CO 0.49 -0.74 -0.14 0.08 -0.36 0.00 0.00 175.35 174.68 1br1 s VAL 68 N 1.19 1.10 -0.14 4.02 1.01 0.11 -4.98 120.40 122.71 1br1 s VAL 68 Ca 0.00 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 60.94 1br1 s VAL 68 Cb -0.19 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 1br1 s VAL 68 CO -0.08 -0.02 -0.09 -0.89 0.00 0.00 0.00 175.10 174.01 1br1 s THR 69 N -0.89 3.42 0.30 3.92 2.01 -1.26 -1.44 115.64 121.69 1br1 s THR 69 Ca 0.01 -0.53 0.06 0.00 0.31 0.00 0.00 61.69 61.54 1br1 s THR 69 Cb -0.08 -2.46 -0.06 0.00 0.01 0.00 0.00 72.50 69.91 1br1 s THR 69 CO 0.01 0.51 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.67 1br1 s LEU 70 N 0.32 2.46 0.51 4.42 1.43 -0.60 -4.95 118.68 122.27 1br1 s LEU 70 Ca -0.08 -1.24 -0.22 0.00 -1.03 0.00 0.00 54.13 51.56 1br1 s LEU 70 Cb -0.15 -0.62 -0.07 0.00 0.03 0.00 0.00 46.19 45.38 1br1 s LEU 70 CO 0.04 -0.40 1.13 -0.24 0.23 0.00 0.00 176.35 177.12 1br1 n SER 71 N -0.64 1.71 -0.95 2.29 2.88 -1.26 -0.64 113.62 117.00 1br1 n SER 71 Ca -0.05 0.97 0.00 0.00 -1.33 0.00 0.00 58.87 58.46 1br1 n SER 71 Cb 0.64 -1.45 0.00 0.00 -0.75 0.00 0.00 64.21 62.66 1br1 n SER 71 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1br1 n LYS 72 N -0.49 0.51 0.00 -1.46 4.81 0.57 -1.42 118.16 120.68 1br1 n LYS 72 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.54 1br1 n LYS 72 Cb 0.43 -1.25 0.00 0.00 0.02 0.00 0.00 35.03 34.23 1br1 n LYS 72 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1br1 n ASP 73 N 0.70 0.00 -0.55 3.14 5.75 -1.26 -4.81 116.55 119.51 1br1 n ASP 73 Ca 0.00 -1.00 0.06 0.00 -0.01 0.00 0.00 54.79 53.84 1br1 n ASP 73 Cb 0.24 0.00 0.09 0.00 -1.03 0.00 0.00 41.12 40.42 1br1 n ASP 73 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1br1 n ASP 74 N 0.00 2.32 -4.86 -1.12 9.92 -0.50 -4.96 116.55 117.34 1br1 n ASP 74 Ca 0.00 -1.66 -0.31 0.00 -0.53 0.00 0.00 54.79 52.29 1br1 n ASP 74 Cb 0.48 -0.08 -0.05 0.00 -0.64 0.00 0.00 41.12 40.83 1br1 n ASP 74 CO 0.00 0.00 0.00 0.27 0.13 0.00 0.00 177.20 177.60 1br1 s ILE 75 N -1.00 5.04 -0.05 0.53 -4.36 -1.26 -4.26 121.20 115.84 1br1 s ILE 75 Ca 0.18 -0.51 0.01 0.00 -0.26 0.00 0.00 60.65 60.07 1br1 s ILE 75 Cb 0.11 -3.43 0.02 0.00 1.25 0.00 0.00 42.46 40.41 1br1 s ILE 75 CO 0.16 0.17 -0.06 -1.10 0.24 0.00 0.00 174.94 174.34 1br1 s GLN 76 N -2.36 1.04 0.24 0.37 -0.21 0.69 -4.88 119.66 114.55 1br1 s GLN 76 Ca 0.31 -0.18 -0.29 0.00 0.02 0.00 0.00 55.36 55.23 1br1 s GLN 76 Cb -0.13 -0.98 -0.15 0.00 1.00 0.00 0.00 33.01 32.75 1br1 s GLN 76 CO 0.24 -0.06 0.88 1.63 -2.12 0.00 0.00 175.29 175.86 1br1 n LYS 77 N 4.02 0.89 -3.92 2.91 4.01 -1.26 0.85 118.16 125.65 1br1 n LYS 77 Ca -0.24 0.31 -0.32 0.00 -0.51 0.00 0.00 58.31 57.55 1br1 n LYS 77 Cb 0.51 -1.59 -0.05 0.00 -0.51 0.00 0.00 35.03 33.40 1br1 n LYS 77 CO 0.00 0.00 0.00 1.41 -1.11 0.00 0.00 177.40 177.70 1br1 s MET 78 N -1.24 3.41 0.16 1.97 1.75 -1.26 -4.70 119.30 119.40 1br1 s MET 78 Ca 0.62 -0.39 -0.09 0.00 -1.25 0.00 0.00 55.69 54.58 1br1 s MET 78 Cb -0.80 -3.05 -0.06 0.00 2.84 0.00 0.00 34.83 33.75 1br1 s MET 78 CO 0.58 0.64 0.48 -0.80 -0.65 0.00 0.00 175.02 175.27 1br1 s ASN 79 N -2.19 6.63 0.88 1.11 0.02 -1.26 -4.95 114.94 115.17 1br1 s ASN 79 Ca 0.31 0.84 -0.12 0.00 -1.02 0.00 0.00 52.86 52.86 1br1 s ASN 79 Cb -0.13 -2.19 0.10 0.00 0.02 0.00 0.00 41.25 39.05 1br1 s ASN 79 CO 0.23 0.04 0.99 -2.65 0.02 0.00 0.00 177.10 175.72 1br1 n PRO 80 N 0.29 -0.21 0.23 -0.60 -0.02 -1.26 -4.85 135.00 128.57 1br1 n PRO 80 Ca -0.03 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.61 1br1 n PRO 80 Cb 0.52 -2.27 0.79 0.00 -0.02 0.00 0.00 33.50 32.53 1br1 n PRO 80 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1br1 h PRO 81 N -1.48 0.00 0.00 0.52 0.13 -1.97 -2.03 132.00 127.17 1br1 h PRO 81 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1br1 h PRO 81 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1br1 h PRO 81 CO 0.41 0.00 0.00 1.17 -0.23 0.00 0.00 178.00 179.35 1br1 n LYS 82 N -2.58 0.55 -0.01 0.86 0.00 -1.26 -2.64 118.16 113.07 1br1 n LYS 82 Ca -0.01 0.03 0.05 0.00 0.00 0.00 0.00 58.31 58.37 1br1 n LYS 82 Cb 0.09 -1.50 0.05 0.00 0.00 0.00 0.00 35.03 33.67 1br1 n LYS 82 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1br1 n PHE 83 N -1.08 0.03 -1.64 5.64 3.72 -0.76 -5.02 117.46 118.36 1br1 n PHE 83 Ca 0.14 -0.04 -0.49 0.00 -0.05 0.00 0.00 57.45 57.01 1br1 n PHE 83 Cb 0.09 -0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.58 1br1 n PHE 83 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1br1 n SER 84 N 0.55 2.53 -3.64 4.37 2.88 -1.08 -1.76 113.62 117.46 1br1 n SER 84 Ca 0.06 1.09 -0.23 0.00 -1.33 0.00 0.00 58.87 58.46 1br1 n SER 84 Cb 0.26 -1.33 0.07 0.00 -0.75 0.00 0.00 64.21 62.46 1br1 n SER 84 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1br1 n LYS 85 N 3.25 -6.77 -1.07 -1.46 5.02 -1.26 -4.96 118.16 110.91 1br1 n LYS 85 Ca 0.18 0.76 -0.34 0.00 -2.02 0.00 0.00 58.31 56.89 1br1 n LYS 85 Cb 0.25 -5.71 0.13 0.00 -0.02 0.00 0.00 35.03 29.67 1br1 n LYS 85 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1br1 n VAL 86 N -4.65 1.76 0.03 -0.18 3.14 -0.72 -4.95 118.33 112.76 1br1 n VAL 86 Ca -0.09 -0.21 -0.21 0.00 -2.96 0.00 0.00 64.34 60.87 1br1 n VAL 86 Cb 0.59 -1.11 -0.14 0.00 -1.06 0.00 0.00 33.84 32.12 1br1 n VAL 86 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1br1 h GLU 87 N -0.96 0.29 -3.39 1.45 4.39 -1.92 -3.45 114.58 110.98 1br1 h GLU 87 Ca -0.46 -0.49 -0.61 0.00 0.34 0.00 0.00 59.36 58.14 1br1 h GLU 87 Cb 1.30 0.18 -0.40 0.00 -0.10 0.00 0.00 28.75 29.73 1br1 h GLU 87 CO 0.45 1.20 -0.73 0.34 -1.16 0.00 0.00 179.01 179.11 1br1 s ASP 88 N -7.06 3.96 0.31 1.42 -1.08 -1.26 -1.35 116.67 111.62 1br1 s ASP 88 Ca -0.19 -2.36 0.20 0.00 -0.52 0.00 0.00 52.55 49.69 1br1 s ASP 88 Cb 0.06 -1.14 1.09 0.00 -1.46 0.00 0.00 42.92 41.48 1br1 s ASP 88 CO 0.80 -0.32 1.21 0.23 0.52 0.00 0.00 175.17 177.61 1br1 n MET 89 N 3.92 -0.04 0.00 4.34 2.81 -0.77 0.26 117.12 127.65 1br1 n MET 89 Ca 0.05 1.01 0.00 0.00 -1.81 0.00 0.00 57.70 56.95 1br1 n MET 89 Cb 0.37 -1.90 0.00 0.00 -0.71 0.00 0.00 33.22 30.98 1br1 n MET 89 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1br1 n ALA 90 N -2.49 1.38 -0.11 3.04 0.00 -1.26 -2.11 120.51 118.96 1br1 n ALA 90 Ca 0.30 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.51 1br1 n ALA 90 Cb 1.09 -0.92 -0.08 0.00 0.00 0.00 0.00 19.45 19.54 1br1 n ALA 90 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1br1 n GLU 91 N -0.60 0.49 -1.55 0.00 1.02 0.75 -4.93 120.64 115.82 1br1 n GLU 91 Ca 0.00 0.22 -0.57 0.00 -0.02 0.00 0.00 57.16 56.78 1br1 n GLU 91 Cb 0.00 -1.34 -0.07 0.00 -0.02 0.00 0.00 31.44 30.01 1br1 n GLU 91 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1br1 n LEU 92 N -4.10 0.69 0.00 -4.62 4.77 -0.90 -4.75 117.00 108.10 1br1 n LEU 92 Ca -0.42 1.15 0.04 0.00 -0.03 0.00 0.00 56.01 56.74 1br1 n LEU 92 Cb 0.78 -1.01 0.23 0.00 -2.33 0.00 0.00 43.42 41.09 1br1 n LEU 92 CO 0.05 -1.51 0.44 0.35 -1.33 0.00 0.00 177.39 175.39 1br1 n THR 93 N 2.12 0.00 -3.63 -5.08 -2.24 -1.26 -4.38 114.28 99.81 1br1 n THR 93 Ca 0.21 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.77 1br1 n THR 93 Cb 0.11 -0.61 -0.17 0.00 -2.10 0.00 0.00 70.33 67.56 1br1 n THR 93 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1br1 s LEU 95 N 2.18 4.21 0.07 0.00 1.43 -1.26 -4.80 118.68 120.51 1br1 s LEU 95 Ca 0.04 0.43 -0.20 0.00 -1.03 0.00 0.00 54.13 53.37 1br1 s LEU 95 Cb -0.14 -2.34 0.04 0.00 0.03 0.00 0.00 46.19 43.79 1br1 s LEU 95 CO -0.06 0.07 0.46 0.20 0.23 0.00 0.00 176.35 177.26 1br1 s ASN 96 N 0.63 -0.35 0.39 2.29 -0.87 -1.26 -4.97 114.94 110.80 1br1 s ASN 96 Ca 0.15 -0.01 0.28 0.00 -1.57 0.00 0.00 52.86 51.72 1br1 s ASN 96 Cb -0.13 0.47 1.20 0.00 -0.02 0.00 0.00 41.25 42.77 1br1 s ASN 96 CO 0.04 -0.75 1.84 -0.08 -2.57 0.00 0.00 177.10 175.58 1br1 h GLU 97 N 2.70 0.00 0.00 -0.60 4.81 -1.98 -2.06 114.58 117.46 1br1 h GLU 97 Ca -0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1br1 h GLU 97 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1br1 h GLU 97 CO 0.43 0.00 -0.10 0.00 -0.73 0.00 0.00 179.01 178.61 1br1 h ALA 98 N 2.14 0.00 0.53 2.92 0.00 -1.96 -3.18 119.26 119.71 1br1 h ALA 98 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1br1 h ALA 98 Cb 0.40 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1br1 h ALA 98 CO 0.00 0.10 -0.38 0.77 0.00 0.00 0.00 179.25 179.74 1br1 h SER 99 N -0.88 -0.99 -1.29 0.00 0.02 -1.87 0.50 113.55 109.03 1br1 h SER 99 Ca 0.00 0.06 0.46 0.00 -0.84 0.00 0.00 61.79 61.47 1br1 h SER 99 Cb 0.10 0.30 -0.15 0.00 0.14 0.00 0.00 62.40 62.80 1br1 h SER 99 CO 0.00 -0.55 0.81 0.58 -1.14 0.00 0.00 176.83 176.53 1br1 h VAL 100 N -0.87 0.03 0.27 2.27 2.07 -1.59 1.12 116.25 119.55 1br1 h VAL 100 Ca -0.07 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1br1 h VAL 100 Cb 0.72 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1br1 h VAL 100 CO 0.03 0.00 -0.13 0.25 0.02 0.00 0.00 177.57 177.75 1br1 h LEU 101 N 0.03 -0.31 0.00 2.57 5.85 -1.32 -3.03 115.31 119.09 1br1 h LEU 101 Ca 0.86 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 59.42 1br1 h LEU 101 Cb 2.66 0.08 0.00 0.00 0.37 0.00 0.00 40.66 43.77 1br1 h LEU 101 CO -0.52 0.18 0.00 1.57 -0.34 0.00 0.00 178.44 179.33 1br1 n HIS 102 N -5.02 0.00 -0.32 1.25 -0.00 0.36 -0.36 115.22 111.13 1br1 n HIS 102 Ca -0.07 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.03 1br1 n HIS 102 Cb 0.23 -0.42 -0.07 0.00 -0.12 0.00 0.00 29.99 29.62 1br1 n HIS 102 CO 0.00 0.00 0.00 -1.71 0.46 0.00 0.00 176.34 175.09 1br1 n ASN 103 N -2.62 -0.78 -0.34 0.26 5.15 0.51 0.23 115.26 117.68 1br1 n ASN 103 Ca 0.00 1.35 0.10 0.00 -0.60 0.00 0.00 54.58 55.43 1br1 n ASN 103 Cb 0.00 -0.19 0.27 0.00 -0.53 0.00 0.00 39.78 39.34 1br1 n ASN 103 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1br1 h LEU 104 N 0.00 0.73 0.23 1.20 3.38 -1.14 -1.68 115.31 118.03 1br1 h LEU 104 Ca 0.13 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1br1 h LEU 104 Cb 0.32 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1br1 h LEU 104 CO -0.72 0.30 -0.13 -0.09 0.09 0.00 0.00 178.44 177.90 1br1 h ARG 105 N 0.77 -0.32 0.00 1.13 2.43 0.59 -1.54 114.38 117.44 1br1 h ARG 105 Ca 0.52 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.72 1br1 h ARG 105 Cb 0.73 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 1br1 h ARG 105 CO -0.35 -0.22 0.00 0.39 -1.51 0.00 0.00 179.97 178.28 1br1 n GLU 106 N -5.24 0.00 -0.28 0.20 4.71 -0.33 -1.47 120.64 118.24 1br1 n GLU 106 Ca -0.09 0.32 0.27 0.00 -0.01 0.00 0.00 57.16 57.64 1br1 n GLU 106 Cb 0.16 -1.23 0.49 0.00 -1.01 0.00 0.00 31.44 29.86 1br1 n GLU 106 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1br1 n ARG 107 N -1.32 -0.05 0.11 3.49 1.74 -0.76 0.96 116.66 120.84 1br1 n ARG 107 Ca 0.00 1.19 -0.13 0.00 -0.77 0.00 0.00 57.85 58.14 1br1 n ARG 107 Cb 0.00 -2.13 -0.07 0.00 -1.02 0.00 0.00 32.46 29.25 1br1 n ARG 107 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 1br1 h TYR 108 N 0.00 -0.32 0.00 -1.55 3.20 -0.89 1.00 116.97 118.40 1br1 h TYR 108 Ca 0.72 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 62.50 1br1 h TYR 108 Cb 1.88 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 40.26 1br1 h TYR 108 CO -0.04 -0.19 -0.41 0.74 -1.64 0.00 0.00 178.16 176.62 1br1 h PHE 109 N -0.28 0.00 0.00 -3.82 0.04 0.17 -2.43 116.94 110.62 1br1 h PHE 109 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1br1 h PHE 109 Cb 0.26 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.41 1br1 h PHE 109 CO -0.12 0.41 0.00 0.77 -0.60 0.00 0.00 178.31 178.77 1br1 h SER 110 N 0.00 0.00 0.00 2.17 0.02 -0.48 -3.46 113.55 111.79 1br1 h SER 110 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1br1 h SER 110 Cb 0.89 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1br1 h SER 110 CO 0.05 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 1br1 n GLY 111 N 0.23 0.92 3.66 -3.77 0.00 -0.72 -4.81 105.19 100.70 1br1 n GLY 111 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 1br1 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1br1 s LEU 112 N 0.00 3.89 -0.19 0.99 1.43 0.27 -4.70 118.68 120.37 1br1 s LEU 112 Ca 0.00 0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.24 1br1 s LEU 112 Cb 0.00 -1.99 -0.13 0.00 0.03 0.00 0.00 46.19 44.10 1br1 s LEU 112 CO 0.00 0.18 -0.15 2.30 0.23 0.00 0.00 176.35 178.92 1br1 n ILE 113 N 3.47 1.08 -2.40 -0.59 -5.35 -1.26 -2.90 119.36 111.41 1br1 n ILE 113 Ca -0.17 -0.44 -0.41 0.00 -0.27 0.00 0.00 62.75 61.46 1br1 n ILE 113 Cb 0.52 -1.12 -0.03 0.00 -1.74 0.00 0.00 39.64 37.27 1br1 n ILE 113 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1br1 s TYR 114 N -2.38 3.45 -0.07 4.28 1.51 -1.26 -3.33 117.35 119.55 1br1 s TYR 114 Ca -0.24 1.41 -0.08 0.00 -1.01 0.00 0.00 57.07 57.16 1br1 s TYR 114 Cb 0.06 -3.41 0.02 0.00 -0.11 0.00 0.00 41.96 38.52 1br1 s TYR 114 CO 0.45 -1.16 0.21 0.99 -1.11 0.00 0.00 175.55 174.93 1br1 s THR 115 N 0.19 0.01 0.22 -0.71 2.01 -0.91 -4.73 115.64 111.72 1br1 s THR 115 Ca 0.54 -0.07 -0.14 0.00 0.31 0.00 0.00 61.69 62.33 1br1 s THR 115 Cb -0.32 -0.32 -0.08 0.00 0.01 0.00 0.00 72.50 71.80 1br1 s THR 115 CO 0.35 -0.04 0.62 -0.31 -0.69 0.00 0.00 174.62 174.55 1br1 s TYR 116 N -0.05 3.52 -0.41 4.92 2.02 -0.46 -0.44 117.35 126.45 1br1 s TYR 116 Ca -0.02 1.11 0.03 0.00 -0.37 0.00 0.00 57.07 57.82 1br1 s TYR 116 Cb -0.02 -2.42 0.16 0.00 -0.40 0.00 0.00 41.96 39.28 1br1 s TYR 116 CO 0.01 0.30 0.32 -1.54 -1.57 0.00 0.00 175.55 173.07 1br1 s SER 117 N -1.97 1.89 1.52 2.29 1.04 -0.43 -1.85 113.70 116.19 1br1 s SER 117 Ca 0.44 -2.94 0.00 0.00 0.48 0.00 0.00 55.95 53.93 1br1 s SER 117 Cb -0.13 -0.50 0.00 0.00 0.10 0.00 0.00 66.02 65.49 1br1 s SER 117 CO 0.20 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.83 1br1 n GLY 118 N 3.03 2.42 0.07 7.32 0.00 -1.26 -3.20 105.19 113.57 1br1 n GLY 118 Ca 0.26 -0.04 -0.06 0.00 0.00 0.00 0.00 46.02 46.18 1br1 n GLY 118 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1br1 h LEU 119 N 0.00 0.00-10.50 0.99 3.38 -1.97 -3.47 115.31 103.75 1br1 h LEU 119 Ca 0.00 -0.19 -0.44 0.00 0.09 0.00 0.00 57.88 57.34 1br1 h LEU 119 Cb 0.00 0.00 0.16 0.00 0.09 0.00 0.00 40.66 40.91 1br1 h LEU 119 CO 0.00 0.78 0.25 0.72 0.09 0.00 0.00 178.44 180.28 1br1 s PHE 120 N -1.99 1.58 -0.02 1.13 -0.71 -1.19 -4.92 117.98 111.86 1br1 s PHE 120 Ca -0.11 0.65 -0.01 0.00 -1.04 0.00 0.00 56.93 56.41 1br1 s PHE 120 Cb 0.01 -3.52 0.01 0.00 -1.21 0.00 0.00 43.02 38.31 1br1 s PHE 120 CO 0.24 -3.03 0.05 0.00 -1.34 0.00 0.00 175.22 171.14 1br1 s VAL 122 N 0.34 3.78 -0.48 0.00 1.01 0.41 -2.43 120.40 123.03 1br1 s VAL 122 Ca -0.03 0.43 0.06 0.00 0.00 0.00 0.00 61.98 62.45 1br1 s VAL 122 Cb -0.04 -3.55 0.24 0.00 0.00 0.00 0.00 36.38 33.03 1br1 s VAL 122 CO -0.01 -0.69 0.85 0.52 0.00 0.00 0.00 175.10 175.77 1br1 n VAL 123 N -2.85 -0.09 -1.61 2.92 0.31 -1.20 -2.14 118.33 113.68 1br1 n VAL 123 Ca 0.06 -1.81 -0.49 0.00 -0.01 0.00 0.00 64.34 62.09 1br1 n VAL 123 Cb 0.57 1.07 -0.05 0.00 -0.91 0.00 0.00 33.84 34.52 1br1 n VAL 123 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1br1 n ILE 124 N 1.59 0.42 -1.52 2.52 -0.00 -1.21 -3.62 119.36 117.54 1br1 n ILE 124 Ca 0.10 -0.20 -0.52 0.00 -0.00 0.00 0.00 62.75 62.14 1br1 n ILE 124 Cb 0.62 -1.87 -0.05 0.00 -0.00 0.00 0.00 39.64 38.34 1br1 n ILE 124 CO 0.00 0.00 0.00 -3.20 -0.00 0.00 0.00 176.55 173.35 1br1 n ASN 125 N 8.22 0.51 -0.01 4.38 2.85 -0.94 -4.76 115.26 125.50 1br1 n ASN 125 Ca 0.29 1.14 -0.21 0.00 -0.11 0.00 0.00 54.58 55.70 1br1 n ASN 125 Cb 0.29 -1.08 -0.13 0.00 1.24 0.00 0.00 39.78 40.09 1br1 n ASN 125 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1br1 h PRO 126 N 2.89 0.20 0.00 1.20 0.13 -1.93 -3.43 132.00 131.05 1br1 h PRO 126 Ca -0.43 -0.33 0.00 0.00 -0.87 0.00 0.00 66.00 64.37 1br1 h PRO 126 Cb 1.38 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.64 1br1 h PRO 126 CO 0.67 1.16 0.00 0.66 -0.23 0.00 0.00 178.00 180.26 1br1 n TYR 127 N -4.01 0.00 -4.44 1.56 4.01 -1.26 -4.13 117.16 108.89 1br1 n TYR 127 Ca -0.25 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.23 1br1 n TYR 127 Cb 0.85 -0.06 -0.11 0.00 -0.31 0.00 0.00 39.34 39.71 1br1 n TYR 127 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1br1 s LYS 128 N -0.04 1.65 -1.46 -0.72 2.20 -1.26 -4.82 119.74 115.29 1br1 s LYS 128 Ca 0.00 -1.63 -0.11 0.00 -0.36 0.00 0.00 55.97 53.87 1br1 s LYS 128 Cb 0.00 -1.83 0.04 0.00 -1.51 0.00 0.00 37.83 34.52 1br1 s LYS 128 CO 0.00 0.37 2.38 1.04 -0.36 0.00 0.00 175.35 178.78 1br1 n GLN 129 N -0.21 3.39 -1.01 4.03 3.00 -1.26 -4.98 117.38 120.32 1br1 n GLN 129 Ca -0.09 -2.74 -0.33 0.00 -0.01 0.00 0.00 57.00 53.83 1br1 n GLN 129 Cb 0.58 -3.03 0.13 0.00 0.00 0.00 0.00 30.24 27.92 1br1 n GLN 129 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1br1 n LEU 130 N 4.60 3.72 -3.80 1.08 4.77 -1.26 -4.94 117.00 121.18 1br1 n LEU 130 Ca 0.58 0.54 -0.37 0.00 -0.03 0.00 0.00 56.01 56.73 1br1 n LEU 130 Cb 0.33 -1.47 -0.02 0.00 -2.33 0.00 0.00 43.42 39.93 1br1 n LEU 130 CO 0.85 -1.99 0.76 -0.81 -1.33 0.00 0.00 177.39 174.87 1br1 n PRO 131 N -3.21 3.78 -0.86 3.23 -0.04 -1.26 -4.75 135.00 131.89 1br1 n PRO 131 Ca 0.13 -4.60 0.05 0.00 -0.04 0.00 0.00 63.50 59.04 1br1 n PRO 131 Cb 0.51 -2.42 0.12 0.00 -0.04 0.00 0.00 33.50 31.66 1br1 n PRO 131 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1br1 n ILE 132 N 1.16 1.18 -3.69 0.52 -5.35 -1.26 -4.92 119.36 107.00 1br1 n ILE 132 Ca 0.27 -2.05 -0.28 0.00 -0.27 0.00 0.00 62.75 60.43 1br1 n ILE 132 Cb 0.36 0.27 -0.16 0.00 -1.74 0.00 0.00 39.64 38.37 1br1 n ILE 132 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1br1 s TYR 133 N -1.74 0.82 -0.11 4.28 2.02 -1.26 -4.97 117.35 116.38 1br1 s TYR 133 Ca 0.33 -0.80 -0.30 0.00 -0.37 0.00 0.00 57.07 55.93 1br1 s TYR 133 Cb 0.34 -0.99 0.12 0.00 -0.40 0.00 0.00 41.96 41.02 1br1 s TYR 133 CO -0.09 -0.63 0.94 0.45 -1.57 0.00 0.00 175.55 174.66 1br1 s SER 134 N 1.93 -0.39 0.29 2.29 0.15 -1.26 -4.84 113.70 111.85 1br1 s SER 134 Ca 0.01 0.34 -0.03 0.00 0.70 0.00 0.00 55.95 56.97 1br1 s SER 134 Cb -0.17 0.34 0.60 0.00 -1.71 0.00 0.00 66.02 65.08 1br1 s SER 134 CO -0.12 -0.43 1.58 -0.08 1.20 0.00 0.00 173.24 175.39 1br1 h GLU 135 N 2.47 0.03 -0.37 5.44 4.57 0.49 0.56 114.58 127.76 1br1 h GLU 135 Ca -0.20 -0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.02 1br1 h GLU 135 Cb 1.18 -0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 29.69 1br1 h GLU 135 CO 0.32 0.02 -0.51 -0.22 -1.18 0.00 0.00 179.01 177.43 1br1 h LYS 136 N 0.03 -0.35 0.00 1.92 3.64 -1.91 0.08 116.57 119.98 1br1 h LYS 136 Ca 0.52 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.88 1br1 h LYS 136 Cb 0.98 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.87 1br1 h LYS 136 CO -0.89 -0.24 -0.20 0.82 -2.27 0.00 0.00 179.45 176.68 1br1 h ILE 137 N -0.37 0.96 0.28 2.00 1.08 -0.50 -2.69 117.51 118.27 1br1 h ILE 137 Ca 0.07 -0.73 -0.01 0.00 -0.39 0.00 0.00 64.86 63.79 1br1 h ILE 137 Cb 0.54 1.41 0.00 0.00 -3.07 0.00 0.00 36.82 35.71 1br1 h ILE 137 CO -0.54 0.20 -0.14 0.40 -0.69 0.00 0.00 178.15 177.38 1br1 h ILE 138 N 0.00 0.73 0.00 -0.67 1.08 0.16 -2.41 117.51 116.41 1br1 h ILE 138 Ca -0.00 -0.08 -0.02 0.00 -0.39 0.00 0.00 64.86 64.37 1br1 h ILE 138 Cb 0.40 0.78 -0.00 0.00 -3.07 0.00 0.00 36.82 34.92 1br1 h ILE 138 CO 0.03 0.02 -0.09 0.44 -0.69 0.00 0.00 178.15 177.86 1br1 h ASP 139 N -0.42 0.00 -0.37 1.72 3.32 -1.09 -0.80 116.42 118.77 1br1 h ASP 139 Ca -0.04 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 1br1 h ASP 139 Cb 0.32 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1br1 h ASP 139 CO 0.06 0.09 0.02 0.24 -1.72 0.00 0.00 179.24 177.93 1br1 h MET 140 N 0.00 0.64 0.00 3.56 2.86 -1.11 -3.13 114.93 117.76 1br1 h MET 140 Ca -0.00 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.42 1br1 h MET 140 Cb 0.38 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.97 1br1 h MET 140 CO 0.01 0.74 -0.41 1.88 1.06 0.00 0.00 176.91 180.18 1br1 h TYR 141 N 0.47 0.00 -1.11 -0.22 0.05 -1.08 -3.42 116.97 111.67 1br1 h TYR 141 Ca 0.11 0.00 -0.68 0.00 0.05 0.00 0.00 58.73 58.20 1br1 h TYR 141 Cb 0.43 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 1br1 h TYR 141 CO 0.03 0.09 1.34 1.17 -1.05 0.00 0.00 178.16 179.74 1br1 n LYS 142 N -2.99 1.06 0.00 4.88 4.81 -0.36 -0.65 118.16 124.92 1br1 n LYS 142 Ca 0.02 0.31 0.00 0.00 -0.87 0.00 0.00 58.31 57.77 1br1 n LYS 142 Cb 0.58 -2.36 0.00 0.00 0.02 0.00 0.00 35.03 33.27 1br1 n LYS 142 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1br1 n GLY 143 N 6.24 2.56 3.65 3.14 0.00 -1.26 -4.97 105.19 114.56 1br1 n GLY 143 Ca 0.40 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.92 1br1 n GLY 143 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1br1 n LYS 144 N -0.00 1.74 0.00 1.61 3.00 0.18 -4.95 118.16 119.73 1br1 n LYS 144 Ca 0.00 0.63 0.00 0.00 -0.00 0.00 0.00 58.31 58.94 1br1 n LYS 144 Cb 0.00 -2.37 0.00 0.00 0.00 0.00 0.00 35.03 32.66 1br1 n LYS 144 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1br1 n LYS 145 N 3.98 -0.16 0.02 1.64 4.81 -1.26 -4.90 118.16 122.29 1br1 n LYS 145 Ca 0.20 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.45 1br1 n LYS 145 Cb 0.24 0.00 -0.12 0.00 0.02 0.00 0.00 35.03 35.17 1br1 n LYS 145 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1br1 h ARG 146 N 0.00 0.41 0.00 1.64 -0.00 -1.92 -3.36 114.38 111.14 1br1 h ARG 146 Ca 0.00 -0.49 -0.04 0.00 -0.50 0.00 0.00 59.98 58.95 1br1 h ARG 146 Cb 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 29.97 30.11 1br1 h ARG 146 CO 0.00 1.16 -1.39 -2.39 0.00 0.00 0.00 179.97 177.35 1br1 n HIS 147 N -4.16 0.68 0.23 3.04 1.44 -1.26 -4.11 115.22 111.07 1br1 n HIS 147 Ca -0.11 0.20 0.01 0.00 -2.01 0.00 0.00 57.72 55.81 1br1 n HIS 147 Cb 0.73 -0.86 0.07 0.00 0.12 0.00 0.00 29.99 30.05 1br1 n HIS 147 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1br1 n GLU 148 N -2.60 0.11 -3.86 -1.40 -0.58 -1.26 -4.68 120.64 106.37 1br1 n GLU 148 Ca -0.04 0.00 -0.07 0.00 -0.42 0.00 0.00 57.16 56.63 1br1 n GLU 148 Cb 0.62 -1.33 -0.02 0.00 -0.57 0.00 0.00 31.44 30.14 1br1 n GLU 148 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 1br1 s MET 149 N -2.00 1.76 0.34 3.49 -1.94 -1.26 -4.90 119.30 114.79 1br1 s MET 149 Ca 0.04 -1.00 -0.08 0.00 -1.71 0.00 0.00 55.69 52.93 1br1 s MET 149 Cb 0.02 0.60 -0.06 0.00 2.01 0.00 0.00 34.83 37.39 1br1 s MET 149 CO 0.03 -0.80 0.66 -1.25 -0.01 0.00 0.00 175.02 173.65 1br1 s PRO 150 N -3.92 3.74 0.07 2.03 0.04 -1.26 -4.93 135.00 130.76 1br1 s PRO 150 Ca 0.12 0.28 -0.37 0.00 0.04 0.00 0.00 61.00 61.07 1br1 s PRO 150 Cb -0.05 -2.52 -0.17 0.00 0.04 0.00 0.00 34.50 31.80 1br1 s PRO 150 CO 0.07 0.11 1.32 -0.35 0.04 0.00 0.00 177.00 178.19 1br1 n PRO 151 N -0.98 1.04 -3.48 0.56 -0.04 -1.26 -4.92 135.00 125.92 1br1 n PRO 151 Ca 0.01 0.38 -0.12 0.00 -0.04 0.00 0.00 63.50 63.73 1br1 n PRO 151 Cb 0.54 -2.01 -0.03 0.00 -0.04 0.00 0.00 33.50 31.96 1br1 n PRO 151 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1br1 s HIS 152 N 0.50 -0.48 0.06 0.54 2.46 -1.26 -4.71 115.29 112.40 1br1 s HIS 152 Ca 0.85 0.47 -0.25 0.00 0.47 0.00 0.00 55.06 56.60 1br1 s HIS 152 Cb -0.99 0.51 -0.17 0.00 -0.13 0.00 0.00 32.58 31.81 1br1 s HIS 152 CO 0.48 -0.65 1.60 0.97 -2.47 0.00 0.00 174.74 174.67 1br1 h ILE 153 N 2.24 0.98 0.00 0.89 6.09 -1.96 -1.67 117.51 124.09 1br1 h ILE 153 Ca -0.27 -0.27 0.00 0.00 -1.37 0.00 0.00 64.86 62.95 1br1 h ILE 153 Cb 1.24 1.15 0.00 0.00 0.47 0.00 0.00 36.82 39.68 1br1 h ILE 153 CO 0.35 0.07 0.63 1.88 -3.07 0.00 0.00 178.15 178.00 1br1 h TYR 154 N -0.25 0.00 0.08 2.19 0.05 -1.95 0.34 116.97 117.43 1br1 h TYR 154 Ca -0.01 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.64 1br1 h TYR 154 Cb 0.21 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.96 1br1 h TYR 154 CO -0.03 0.00 -0.54 0.00 -1.05 0.00 0.00 178.16 176.54 1br1 h ALA 155 N 0.71 -0.05 -0.74 3.88 0.00 -1.66 -2.75 119.26 118.66 1br1 h ALA 155 Ca 0.00 -0.62 0.02 0.00 0.00 0.00 0.00 54.91 54.31 1br1 h ALA 155 Cb 1.25 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 1br1 h ALA 155 CO 0.00 0.25 0.48 0.82 0.00 0.00 0.00 179.25 180.80 1br1 h ILE 156 N -0.53 1.15 -0.07 0.00 2.04 -0.29 0.16 117.51 119.96 1br1 h ILE 156 Ca -0.09 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.45 1br1 h ILE 156 Cb 1.40 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1br1 h ILE 156 CO 0.10 0.17 -0.01 0.00 0.00 0.00 0.00 178.15 178.41 1br1 h ALA 157 N 1.29 0.05 -0.38 1.87 0.00 -1.50 -2.10 119.26 118.50 1br1 h ALA 157 Ca 0.28 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1br1 h ALA 157 Cb -0.05 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1br1 h ALA 157 CO -0.08 -0.49 -0.26 0.22 0.00 0.00 0.00 179.25 178.63 1br1 h ASP 158 N 0.00 0.81 -0.87 0.00 1.82 -1.15 -1.17 116.42 115.87 1br1 h ASP 158 Ca 0.03 -0.31 0.04 0.00 -0.39 0.00 0.00 57.03 56.40 1br1 h ASP 158 Cb 0.05 -0.22 -0.05 0.00 0.68 0.00 0.00 39.33 39.79 1br1 h ASP 158 CO -0.07 1.03 0.57 0.74 -1.61 0.00 0.00 179.24 179.90 1br1 h THR 159 N 0.68 1.14 0.17 2.25 2.02 -0.48 -1.85 112.91 116.84 1br1 h THR 159 Ca 0.08 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 1br1 h THR 159 Cb 0.79 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1br1 h THR 159 CO 0.07 0.19 -0.08 0.00 0.37 0.00 0.00 175.52 176.07 1br1 h ALA 160 N 1.50 -0.25 -0.58 6.16 0.00 -1.30 -2.47 119.26 122.31 1br1 h ALA 160 Ca 0.35 -0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.37 1br1 h ALA 160 Cb 0.04 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1br1 h ALA 160 CO -0.11 -0.24 0.88 -0.92 0.00 0.00 0.00 179.25 178.87 1br1 h TYR 161 N -0.97 0.00 0.00 0.00 3.20 -1.16 0.32 116.97 118.36 1br1 h TYR 161 Ca -0.02 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.76 1br1 h TYR 161 Cb 0.18 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 1br1 h TYR 161 CO 0.00 0.00 -0.79 -0.09 -1.64 0.00 0.00 178.16 175.65 1br1 h ARG 162 N 0.00 0.00 -1.00 1.82 9.65 -1.43 -3.31 114.38 120.11 1br1 h ARG 162 Ca 0.28 0.00 0.41 0.00 -1.10 0.00 0.00 59.98 59.56 1br1 h ARG 162 Cb 2.03 0.00 -0.18 0.00 -1.39 0.00 0.00 29.97 30.43 1br1 h ARG 162 CO -0.00 0.38 0.51 1.03 2.80 0.00 0.00 179.97 184.69 1br1 h SER 163 N -1.00 0.27 0.87 -3.80 0.87 -0.06 0.79 113.55 111.49 1br1 h SER 163 Ca -0.13 0.26 -0.04 0.00 -1.23 0.00 0.00 61.79 60.65 1br1 h SER 163 Cb 0.80 0.28 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1br1 h SER 163 CO -0.08 -0.43 -0.50 -0.03 -0.53 0.00 0.00 176.83 175.27 1br1 h MET 164 N 0.01 -1.22 0.00 2.24 1.85 -0.72 -2.43 114.93 114.66 1br1 h MET 164 Ca 0.83 0.08 0.00 0.00 -0.61 0.00 0.00 59.70 60.00 1br1 h MET 164 Cb 2.17 0.28 0.00 0.00 0.43 0.00 0.00 31.60 34.47 1br1 h MET 164 CO -0.78 -0.81 0.00 1.28 -0.40 0.00 0.00 176.91 176.20 1br1 n LEU 165 N -5.65 0.00 -0.05 3.39 4.77 0.25 -1.08 117.00 118.63 1br1 n LEU 165 Ca -0.16 0.40 -0.04 0.00 -0.03 0.00 0.00 56.01 56.19 1br1 n LEU 165 Cb 0.52 -0.40 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 1br1 n LEU 165 CO 0.37 -0.30 -0.30 0.00 -1.33 0.00 0.00 177.39 175.83 1br1 n GLN 166 N -1.40 0.34 -0.39 3.23 1.13 0.13 -4.47 117.38 115.95 1br1 n GLN 166 Ca 0.03 0.39 0.08 0.00 -1.94 0.00 0.00 57.00 55.56 1br1 n GLN 166 Cb 0.08 -1.39 0.27 0.00 0.11 0.00 0.00 30.24 29.31 1br1 n GLN 166 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 1br1 n ASP 167 N -3.96 3.48 -3.40 1.08 5.68 -0.96 -4.98 116.55 113.49 1br1 n ASP 167 Ca -0.06 -2.17 -0.33 0.00 -0.50 0.00 0.00 54.79 51.72 1br1 n ASP 167 Cb 0.23 -0.45 0.03 0.00 -1.14 0.00 0.00 41.12 39.79 1br1 n ASP 167 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1br1 n ARG 168 N 1.02 -1.94 -3.04 0.11 1.74 -0.24 -4.99 116.66 109.31 1br1 n ARG 168 Ca 0.20 1.51 0.03 0.00 -0.77 0.00 0.00 57.85 58.82 1br1 n ARG 168 Cb 0.61 -2.53 -0.00 0.00 -1.02 0.00 0.00 32.46 29.52 1br1 n ARG 168 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1br1 s GLU 169 N -2.41 0.38 0.15 5.56 2.12 -1.18 -5.07 118.70 118.24 1br1 s GLU 169 Ca 0.35 0.05 -0.05 0.00 0.36 0.00 0.00 54.97 55.68 1br1 s GLU 169 Cb -0.04 0.09 -0.05 0.00 0.26 0.00 0.00 34.13 34.39 1br1 s GLU 169 CO 0.83 -0.60 -0.03 -0.25 -0.54 0.00 0.00 175.26 174.66 1br1 n ASP 170 N 4.54 -1.09 -4.15 -1.70 8.00 -1.26 -4.56 116.55 116.34 1br1 n ASP 170 Ca 0.08 0.20 -0.10 0.00 0.71 0.00 0.00 54.79 55.68 1br1 n ASP 170 Cb 0.59 -0.26 -0.10 0.00 -0.02 0.00 0.00 41.12 41.33 1br1 n ASP 170 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1br1 s GLN 171 N -0.30 0.85 0.01 -1.24 -1.52 -1.16 -0.60 119.66 115.70 1br1 s GLN 171 Ca 0.17 -1.38 0.03 0.00 -1.95 0.00 0.00 55.36 52.23 1br1 s GLN 171 Cb -0.15 0.12 -0.01 0.00 -0.22 0.00 0.00 33.01 32.75 1br1 s GLN 171 CO 0.20 -0.18 -0.08 -1.54 -0.25 0.00 0.00 175.29 173.44 1br1 s SER 172 N -3.03 0.94 -0.30 5.90 1.04 0.22 0.14 113.70 118.61 1br1 s SER 172 Ca 0.18 -0.22 0.01 0.00 0.48 0.00 0.00 55.95 56.40 1br1 s SER 172 Cb 0.07 -0.08 0.07 0.00 0.10 0.00 0.00 66.02 66.18 1br1 s SER 172 CO -0.02 0.05 -0.02 -0.63 0.98 0.00 0.00 173.24 173.60 1br1 s ILE 173 N -0.40 2.57 -0.41 -1.02 1.01 0.58 0.83 121.20 124.37 1br1 s ILE 173 Ca 0.01 -1.70 -0.12 0.00 0.00 0.00 0.00 60.65 58.84 1br1 s ILE 173 Cb -0.04 -2.58 0.05 0.00 0.01 0.00 0.00 42.46 39.89 1br1 s ILE 173 CO -0.00 -0.20 0.26 -0.76 0.00 0.00 0.00 174.94 174.24 1br1 s LEU 174 N 1.13 5.02 -0.51 2.97 1.43 0.07 -1.46 118.68 127.33 1br1 s LEU 174 Ca -0.03 -1.17 -0.25 0.00 -1.03 0.00 0.00 54.13 51.64 1br1 s LEU 174 Cb -0.20 -2.05 0.03 0.00 0.03 0.00 0.00 46.19 44.00 1br1 s LEU 174 CO -0.04 -0.47 0.97 0.00 0.23 0.00 0.00 176.35 177.04 1br1 n THR 176 N 6.39 0.00 0.00 0.00 -2.24 -1.25 -4.61 114.28 112.57 1br1 n THR 176 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1br1 n THR 176 Cb 0.48 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 1br1 n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1br1 n GLY 177 N 5.00 0.00 3.61 3.38 0.00 -1.25 -3.74 105.19 112.19 1br1 n GLY 177 Ca 0.00 -1.44 -0.30 0.00 0.00 0.00 0.00 46.02 44.28 1br1 n GLY 177 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1br1 s GLU 178 N -5.05 0.38 0.04 1.61 -1.05 -1.26 -4.54 118.70 108.83 1br1 s GLU 178 Ca 0.00 1.28 -0.36 0.00 -0.15 0.00 0.00 54.97 55.74 1br1 s GLU 178 Cb 0.00 -1.67 -0.15 0.00 -0.44 0.00 0.00 34.13 31.87 1br1 s GLU 178 CO 0.00 -2.98 1.55 0.45 0.95 0.00 0.00 175.26 175.23 1br1 n SER 179 N -4.45 2.51 0.00 0.83 2.88 -0.69 -1.52 113.62 113.18 1br1 n SER 179 Ca 0.09 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 1br1 n SER 179 Cb 0.53 -1.30 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 1br1 n SER 179 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1br1 n GLY 180 N 3.31 3.17 0.00 0.46 0.00 -1.26 -4.92 105.19 105.95 1br1 n GLY 180 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1br1 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1br1 n ALA 181 N -0.78 1.19 -0.52 4.61 0.00 -0.58 -4.69 120.51 119.75 1br1 n ALA 181 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1br1 n ALA 181 Cb 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1br1 n ALA 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1br1 n GLY 182 N -0.62 0.78 0.33 0.00 0.00 -1.26 -3.92 105.19 100.51 1br1 n GLY 182 Ca 0.00 -0.49 0.13 0.00 0.00 0.00 0.00 46.02 45.65 1br1 n GLY 182 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1br1 h LYS 183 N 0.00 0.61 0.23 1.61 6.56 -1.83 -3.14 116.57 120.60 1br1 h LYS 183 Ca 0.00 -0.04 -0.01 0.00 -1.06 0.00 0.00 60.65 59.54 1br1 h LYS 183 Cb 0.06 -0.14 0.00 0.00 -0.57 0.00 0.00 32.23 31.58 1br1 h LYS 183 CO 0.00 0.40 -0.11 1.15 -2.06 0.00 0.00 179.45 178.83 1br1 h THR 184 N 0.63 0.00 -0.59 -0.16 2.02 -1.93 -3.29 112.91 109.59 1br1 h THR 184 Ca 0.56 -0.19 0.05 0.00 0.77 0.00 0.00 66.41 67.60 1br1 h THR 184 Cb 0.94 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.28 1br1 h THR 184 CO -0.43 0.00 -0.35 -0.62 0.37 0.00 0.00 175.52 174.50 1br1 n GLU 185 N -3.36 -0.26 0.24 6.66 -0.58 -1.21 0.19 120.64 122.32 1br1 n GLU 185 Ca -0.04 1.12 0.07 0.00 -0.42 0.00 0.00 57.16 57.89 1br1 n GLU 185 Cb 0.12 -1.65 0.37 0.00 -0.57 0.00 0.00 31.44 29.71 1br1 n GLU 185 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 1br1 h ASN 186 N 0.00 0.00 0.06 1.62 2.35 -1.69 0.66 115.58 118.58 1br1 h ASN 186 Ca 0.09 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.61 1br1 h ASN 186 Cb 0.24 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 1br1 h ASN 186 CO -0.55 0.00 -1.22 0.74 -1.65 0.00 0.00 177.43 174.75 1br1 h THR 187 N 0.00 1.05 -0.59 2.81 2.02 0.19 -3.14 112.91 115.25 1br1 h THR 187 Ca 0.00 -2.30 0.14 0.00 0.77 0.00 0.00 66.41 65.02 1br1 h THR 187 Cb 0.98 2.59 -0.03 0.00 -1.74 0.00 0.00 68.15 69.95 1br1 h THR 187 CO 0.00 0.55 0.41 0.11 0.37 0.00 0.00 175.52 176.96 1br1 h LYS 188 N -0.64 0.15 0.19 6.66 1.57 0.11 -1.12 116.57 123.49 1br1 h LYS 188 Ca -0.29 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 1br1 h LYS 188 Cb 1.50 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.78 1br1 h LYS 188 CO -0.05 0.10 -0.09 0.87 -0.57 0.00 0.00 179.45 179.71 1br1 h LYS 189 N 0.16 -0.25 -1.11 3.15 1.79 -1.43 -0.61 116.57 118.28 1br1 h LYS 189 Ca 0.28 0.02 0.31 0.00 -2.18 0.00 0.00 60.65 59.08 1br1 h LYS 189 Cb 0.90 0.06 -0.11 0.00 -1.58 0.00 0.00 32.23 31.50 1br1 h LYS 189 CO -0.04 0.15 0.70 0.28 -1.08 0.00 0.00 179.45 179.47 1br1 h VAL 190 N -0.79 0.40 0.01 0.50 2.07 -1.18 0.71 116.25 117.98 1br1 h VAL 190 Ca -0.03 -0.11 -0.09 0.00 0.82 0.00 0.00 66.70 67.30 1br1 h VAL 190 Cb 0.52 0.06 0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1br1 h VAL 190 CO 0.04 0.06 -0.35 0.40 0.02 0.00 0.00 177.57 177.74 1br1 h ILE 191 N 0.32 1.53 -0.79 4.57 2.04 -1.33 -2.66 117.51 121.19 1br1 h ILE 191 Ca 0.67 -2.04 0.18 0.00 1.00 0.00 0.00 64.86 64.67 1br1 h ILE 191 Cb 1.78 2.80 -0.14 0.00 -0.74 0.00 0.00 36.82 40.53 1br1 h ILE 191 CO -0.36 0.56 0.03 -0.61 0.00 0.00 0.00 178.15 177.77 1br1 h GLN 192 N -0.44 0.10 0.30 2.37 4.15 0.19 0.63 115.11 122.41 1br1 h GLN 192 Ca -0.05 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.35 1br1 h GLN 192 Cb 1.11 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.78 1br1 h GLN 192 CO 0.07 0.07 -0.15 -0.92 -1.93 0.00 0.00 178.83 175.97 1br1 h TYR 193 N 0.11 -0.38 0.00 3.99 5.03 -0.51 -3.15 116.97 122.06 1br1 h TYR 193 Ca 0.44 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.74 1br1 h TYR 193 Cb 0.79 0.13 0.00 0.00 1.55 0.00 0.00 36.73 39.20 1br1 h TYR 193 CO -0.42 -0.24 0.35 -0.07 -1.32 0.00 0.00 178.16 176.47 1br1 h LEU 194 N -0.65 0.00 -0.95 2.82 4.07 -1.07 0.43 115.31 119.96 1br1 h LEU 194 Ca -0.04 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.92 1br1 h LEU 194 Cb 0.31 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.05 1br1 h LEU 194 CO 0.07 0.00 0.00 0.00 -1.08 0.00 0.00 178.44 177.43 1br1 h ALA 195 N 1.29 1.00 0.00 1.53 0.00 0.30 -2.82 119.26 120.56 1br1 h ALA 195 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1br1 h ALA 195 Cb 0.70 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1br1 h ALA 195 CO 0.00 0.00 -1.30 1.55 0.00 0.00 0.00 179.25 179.50 1br1 n VAL 196 N -2.89 0.30 0.27 0.00 3.14 -0.02 -4.13 118.33 115.00 1br1 n VAL 196 Ca 0.02 -0.09 0.13 0.00 -2.96 0.00 0.00 64.34 61.43 1br1 n VAL 196 Cb 0.34 -1.15 0.73 0.00 -1.06 0.00 0.00 33.84 32.71 1br1 n VAL 196 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1br1 h VAL 197 N -0.10 0.52 0.00 1.55 2.07 -1.26 -3.26 116.25 115.76 1br1 h VAL 197 Ca -0.13 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1br1 h VAL 197 Cb 1.15 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 1br1 h VAL 197 CO -0.05 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.65 1br1 n ALA 198 N -2.26 1.93 -1.00 1.67 0.00 -1.06 -5.03 120.51 114.75 1br1 n ALA 198 Ca -0.02 -0.14 -0.29 0.00 0.00 0.00 0.00 53.44 53.00 1br1 n ALA 198 Cb 0.24 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.88 1br1 n ALA 198 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1br1 s SER 199 N -0.62 2.44 -0.00 0.00 1.04 -1.23 -2.99 113.70 112.34 1br1 s SER 199 Ca 0.00 1.40 -0.01 0.00 0.48 0.00 0.00 55.95 57.81 1br1 s SER 199 Cb 0.00 -2.08 -0.04 0.00 0.10 0.00 0.00 66.02 64.00 1br1 s SER 199 CO 0.00 -3.27 0.13 -0.55 0.98 0.00 0.00 173.24 170.53 1br1 s SER 200 N -3.18 6.02 0.20 7.02 0.15 -1.26 -4.86 113.70 117.79 1br1 s SER 200 Ca 0.66 0.24 0.05 0.00 0.70 0.00 0.00 55.95 57.60 1br1 s SER 200 Cb -0.20 -1.81 -0.04 0.00 -1.71 0.00 0.00 66.02 62.26 1br1 s SER 200 CO 0.59 0.26 0.23 -1.38 1.20 0.00 0.00 173.24 174.14 1br1 s HIS 201 N -1.27 3.26 -0.24 3.44 -3.43 -1.26 -4.26 115.29 111.52 1br1 s HIS 201 Ca 0.25 -0.02 -0.00 0.00 -0.80 0.00 0.00 55.06 54.49 1br1 s HIS 201 Cb -0.12 -1.52 0.19 0.00 -1.43 0.00 0.00 32.58 29.70 1br1 s HIS 201 CO 0.17 0.50 1.90 1.17 -2.00 0.00 0.00 174.74 176.48 1br1 n LYS 202 N -0.84 1.62 0.00 -0.38 4.81 -1.26 -4.92 118.16 117.20 1br1 n LYS 202 Ca -0.08 -1.25 0.00 0.00 -0.87 0.00 0.00 58.31 56.11 1br1 n LYS 202 Cb 0.56 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 34.12 1br1 n LYS 202 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1br1 n GLY 203 N 0.44 1.18 7.00 3.14 0.00 -1.26 -5.21 105.19 110.48 1br1 n GLY 203 Ca 0.24 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1br1 n GLY 203 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1br1 n LYS 204 N 2.12 0.00 0.00 1.61 4.76 -1.26 -5.20 118.16 120.18 1br1 n LYS 204 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1br1 n LYS 204 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1br1 n LYS 204 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1br1 n GLN 211 N 0.00 0.00 0.00 1.97 10.64 -1.23 -5.16 117.38 123.60 1br1 n GLN 211 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1br1 n GLN 211 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 1br1 n GLN 211 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1br1 n GLY 212 N 0.44 3.00 0.00 2.61 0.00 -1.26 -0.39 105.19 109.60 1br1 n GLY 212 Ca 0.00 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.87 1br1 n GLY 212 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1br1 n PRO 213 N 14.00 0.03 -1.55 1.61 -0.04 -1.26 0.11 135.00 147.90 1br1 n PRO 213 Ca 0.00 0.28 -0.42 0.00 -0.04 0.00 0.00 63.50 63.32 1br1 n PRO 213 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 1br1 n PRO 213 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1br1 n SER 214 N -1.46 2.60 0.00 3.54 7.64 0.48 -4.86 113.62 121.56 1br1 n SER 214 Ca 0.03 -0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1br1 n SER 214 Cb 0.13 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 61.84 1br1 n SER 214 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1br1 n PHE 215 N 12.94 0.00 -3.16 1.43 -0.00 -1.26 -3.53 117.46 123.88 1br1 n PHE 215 Ca 0.36 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 57.38 1br1 n PHE 215 Cb 0.43 0.00 -0.07 0.00 -0.00 0.00 0.00 39.48 39.84 1br1 n PHE 215 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 1br1 s SER 216 N 0.00 6.26 0.88 -2.13 1.04 -1.26 -5.05 113.70 113.44 1br1 s SER 216 Ca 0.00 -0.61 -0.13 0.00 0.48 0.00 0.00 55.95 55.69 1br1 s SER 216 Cb 0.00 -2.29 0.15 0.00 0.10 0.00 0.00 66.02 63.97 1br1 s SER 216 CO 0.00 -0.80 1.23 -0.31 0.98 0.00 0.00 173.24 174.35 1br1 s TYR 217 N 2.65 2.14 0.00 5.02 1.51 -1.26 -4.93 117.35 122.48 1br1 s TYR 217 Ca 0.18 0.43 0.00 0.00 -1.01 0.00 0.00 57.07 56.67 1br1 s TYR 217 Cb -0.16 -3.78 0.00 0.00 -0.11 0.00 0.00 41.96 37.90 1br1 s TYR 217 CO 0.15 -2.22 0.00 0.41 -1.11 0.00 0.00 175.55 172.78 1br1 n GLY 218 N -3.50 -3.61 0.14 0.71 0.00 -1.26 -4.84 105.19 92.82 1br1 n GLY 218 Ca 0.12 -1.22 -0.22 0.00 0.00 0.00 0.00 46.02 44.70 1br1 n GLY 218 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1br1 h GLU 219 N 0.00 0.34 0.19 1.61 3.07 -1.98 -3.28 114.58 114.53 1br1 h GLU 219 Ca 0.00 -0.58 -0.29 0.00 -0.50 0.00 0.00 59.36 58.00 1br1 h GLU 219 Cb 0.00 0.21 0.02 0.00 -0.84 0.00 0.00 28.75 28.15 1br1 h GLU 219 CO 0.00 1.25 -1.34 1.25 -1.40 0.00 0.00 179.01 178.77 1br1 h LEU 220 N 0.09 0.63 -2.87 1.33 5.85 -1.97 -3.21 115.31 115.16 1br1 h LEU 220 Ca -0.35 -0.92 0.00 0.00 0.84 0.00 0.00 57.88 57.44 1br1 h LEU 220 Cb 2.07 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.90 1br1 h LEU 220 CO 0.15 1.63 0.02 -0.33 -0.34 0.00 0.00 178.44 179.57 1br1 h GLU 221 N -0.08 0.00 0.05 1.25 3.07 -1.91 0.31 114.58 117.27 1br1 h GLU 221 Ca -0.25 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.61 1br1 h GLU 221 Cb 1.95 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.86 1br1 h GLU 221 CO 0.19 0.00 -0.02 -0.22 -1.40 0.00 0.00 179.01 177.56 1br1 h LYS 222 N 0.00 -0.06 -0.03 2.33 3.64 -1.61 -2.57 116.57 118.27 1br1 h LYS 222 Ca 0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1br1 h LYS 222 Cb 0.05 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1br1 h LYS 222 CO -0.00 0.15 -0.05 1.96 -2.27 0.00 0.00 179.45 179.24 1br1 h GLN 223 N -0.26 0.09 -0.97 1.90 4.20 -0.70 -2.89 115.11 116.48 1br1 h GLN 223 Ca -0.01 -0.06 0.28 0.00 0.06 0.00 0.00 58.65 58.93 1br1 h GLN 223 Cb 0.24 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 1br1 h GLN 223 CO 0.01 0.61 0.91 1.25 -0.67 0.00 0.00 178.83 180.94 1br1 h LEU 224 N -0.42 0.00 0.23 1.46 5.85 -0.57 0.56 115.31 122.42 1br1 h LEU 224 Ca 0.00 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.38 1br1 h LEU 224 Cb 0.61 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.66 1br1 h LEU 224 CO 0.01 0.00 -1.59 0.25 -0.34 0.00 0.00 178.44 176.77 1br1 h LEU 225 N 0.00 0.77 -0.24 2.25 5.85 -1.30 -3.35 115.31 119.29 1br1 h LEU 225 Ca 0.46 -0.93 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1br1 h LEU 225 Cb 2.27 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 43.05 1br1 h LEU 225 CO -0.00 1.75 -0.03 1.67 -0.34 0.00 0.00 178.44 181.48 1br1 n GLN 226 N -3.67 0.98 0.14 1.25 -0.06 0.19 -4.31 117.38 111.89 1br1 n GLN 226 Ca -0.20 -0.24 -0.06 0.00 -2.00 0.00 0.00 57.00 54.50 1br1 n GLN 226 Cb 1.10 -1.50 -0.03 0.00 -4.06 0.00 0.00 30.24 25.75 1br1 n GLN 226 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1br1 h ALA 227 N 3.90 -0.54 -1.13 1.69 0.00 -1.42 -3.31 119.26 118.45 1br1 h ALA 227 Ca 0.00 -0.09 0.32 0.00 0.00 0.00 0.00 54.91 55.14 1br1 h ALA 227 Cb 0.22 0.16 -0.10 0.00 0.00 0.00 0.00 17.79 18.07 1br1 h ALA 227 CO 0.00 -0.51 0.73 -0.97 0.00 0.00 0.00 179.25 178.51 1br1 h ASN 228 N -0.80 0.36 0.45 0.00 -0.73 -1.80 0.77 115.58 113.81 1br1 h ASN 228 Ca -0.04 0.09 0.00 0.00 1.87 0.00 0.00 56.30 58.22 1br1 h ASN 228 Cb 0.31 0.04 0.00 0.00 0.27 0.00 0.00 38.32 38.94 1br1 h ASN 228 CO 0.07 0.00 0.00 -0.81 -0.37 0.00 0.00 177.43 176.32 1br1 n PRO 229 N -4.61 0.12 -0.08 6.67 -0.04 -1.25 -2.12 135.00 133.69 1br1 n PRO 229 Ca 0.29 0.17 -0.07 0.00 -0.04 0.00 0.00 63.50 63.85 1br1 n PRO 229 Cb 1.06 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 33.00 1br1 n PRO 229 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1br1 n ILE 230 N -1.40 1.44 0.33 0.52 5.41 0.26 -4.06 119.36 121.87 1br1 n ILE 230 Ca 0.06 0.18 0.17 0.00 1.00 0.00 0.00 62.75 64.16 1br1 n ILE 230 Cb 0.16 -2.36 0.91 0.00 -0.71 0.00 0.00 39.64 37.64 1br1 n ILE 230 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1br1 h LEU 231 N -1.00 0.00 -1.18 1.39 3.38 -1.52 0.58 115.31 116.96 1br1 h LEU 231 Ca -0.03 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1br1 h LEU 231 Cb 0.65 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1br1 h LEU 231 CO -0.02 0.00 -0.22 -0.33 0.09 0.00 0.00 178.44 177.96 1br1 h GLU 232 N 0.00 0.00 0.00 1.13 5.08 -1.57 -3.22 114.58 116.00 1br1 h GLU 232 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1br1 h GLU 232 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1br1 h GLU 232 CO -0.00 0.22 0.00 0.00 -1.00 0.00 0.00 179.01 178.23 1br1 n ALA 233 N -2.23 0.00 -2.01 3.43 0.00 0.20 -2.68 120.51 117.22 1br1 n ALA 233 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1br1 n ALA 233 Cb 0.42 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.84 1br1 n ALA 233 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1br1 n PHE 234 N -0.37 3.32 0.00 0.00 3.72 -1.24 -3.15 117.46 119.74 1br1 n PHE 234 Ca 0.00 -2.21 0.00 0.00 -0.05 0.00 0.00 57.45 55.19 1br1 n PHE 234 Cb 0.00 -2.45 0.00 0.00 -0.94 0.00 0.00 39.48 36.09 1br1 n PHE 234 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1br1 n GLY 235 N 5.16 0.00 3.44 1.37 0.00 -1.22 -4.88 105.19 109.06 1br1 n GLY 235 Ca 0.48 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.20 1br1 n GLY 235 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1br1 s ASN 236 N 0.00 3.64 -0.14 1.61 -0.87 -1.09 -0.87 114.94 117.22 1br1 s ASN 236 Ca 0.00 -0.57 -0.29 0.00 -1.57 0.00 0.00 52.86 50.43 1br1 s ASN 236 Cb 0.00 -0.46 0.10 0.00 -0.02 0.00 0.00 41.25 40.87 1br1 s ASN 236 CO 0.00 0.21 0.85 0.00 -2.57 0.00 0.00 177.10 175.59 1br1 s ALA 237 N -1.02 -1.86 0.11 0.60 0.00 -0.34 -1.76 121.76 117.49 1br1 s ALA 237 Ca 0.15 1.56 -0.33 0.00 0.00 0.00 0.00 51.96 53.34 1br1 s ALA 237 Cb -0.10 -0.56 -0.13 0.00 0.00 0.00 0.00 23.12 22.33 1br1 s ALA 237 CO 0.07 -0.33 1.70 1.17 0.00 0.00 0.00 175.76 178.37 1br1 n LYS 238 N 1.16 2.34 -4.17 0.00 4.81 -1.06 -2.78 118.16 118.46 1br1 n LYS 238 Ca -0.14 0.85 -0.10 0.00 -0.87 0.00 0.00 58.31 58.04 1br1 n LYS 238 Cb 0.57 -2.66 -0.10 0.00 0.02 0.00 0.00 35.03 32.86 1br1 n LYS 238 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1br1 s THR 239 N 1.89 0.36 -1.72 3.15 -4.23 -0.47 -1.79 115.64 112.83 1br1 s THR 239 Ca 0.82 -1.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.41 1br1 s THR 239 Cb -0.63 -1.92 0.00 0.00 1.34 0.00 0.00 72.50 71.29 1br1 s THR 239 CO 0.40 -0.62 0.32 1.33 -0.54 0.00 0.00 174.62 175.51 1br1 n VAL 240 N -0.09 0.00 0.00 2.29 0.24 -1.26 -0.35 118.33 119.16 1br1 n VAL 240 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.22 1br1 n VAL 240 Cb 0.63 -0.87 0.00 0.00 -1.47 0.00 0.00 33.84 32.13 1br1 n VAL 240 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1br1 n LYS 241 N -0.80 3.08 -3.30 7.34 5.02 -1.26 -5.06 118.16 123.18 1br1 n LYS 241 Ca 0.00 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 1br1 n LYS 241 Cb 0.00 -0.62 -0.03 0.00 -0.02 0.00 0.00 35.03 34.36 1br1 n LYS 241 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1br1 s ASN 242 N -1.04 -0.69 0.50 4.39 2.47 0.53 -4.74 114.94 116.36 1br1 s ASN 242 Ca 0.00 0.70 0.32 0.00 0.42 0.00 0.00 52.86 54.30 1br1 s ASN 242 Cb 0.00 1.69 1.43 0.00 -1.45 0.00 0.00 41.25 42.92 1br1 s ASN 242 CO 0.00 -0.13 1.78 0.44 -3.72 0.00 0.00 177.10 175.46 1br1 h ASP 243 N 7.75 0.14 -2.13 -4.21 3.32 -1.88 -1.11 116.42 118.29 1br1 h ASP 243 Ca -0.16 0.03 -0.58 0.00 0.02 0.00 0.00 57.03 56.34 1br1 h ASP 243 Cb 1.14 0.01 -0.40 0.00 0.22 0.00 0.00 39.33 40.30 1br1 h ASP 243 CO 0.06 0.01 -0.95 -3.20 -1.72 0.00 0.00 179.24 173.43 1br1 n ASN 244 N -4.33 1.05 -4.78 6.45 5.15 -1.26 -2.55 115.26 114.98 1br1 n ASN 244 Ca 0.27 -2.85 -0.37 0.00 -0.60 0.00 0.00 54.58 51.03 1br1 n ASN 244 Cb 1.19 -0.64 -0.06 0.00 -0.53 0.00 0.00 39.78 39.73 1br1 n ASN 244 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1br1 s SER 245 N -1.35 7.31 -0.56 1.20 0.15 -0.91 -4.79 113.70 114.75 1br1 s SER 245 Ca 0.35 1.74 -0.28 0.00 0.70 0.00 0.00 55.95 58.46 1br1 s SER 245 Cb 0.14 -2.54 0.03 0.00 -1.71 0.00 0.00 66.02 61.94 1br1 s SER 245 CO -0.10 0.00 1.23 -0.44 1.20 0.00 0.00 173.24 175.14 1br1 s SER 246 N -1.54 6.41 -0.03 5.45 0.01 -1.26 -1.20 113.70 121.55 1br1 s SER 246 Ca 0.46 0.20 0.02 0.00 1.31 0.00 0.00 55.95 57.95 1br1 s SER 246 Cb -0.19 -2.55 0.12 0.00 0.21 0.00 0.00 66.02 63.60 1br1 s SER 246 CO 0.24 -1.49 0.73 0.54 0.41 0.00 0.00 173.24 173.67 1br1 n ARG 247 N 8.41 1.53 -3.64 12.44 3.00 -0.05 -4.76 116.66 133.59 1br1 n ARG 247 Ca 0.10 -0.45 -0.07 0.00 -0.01 0.00 0.00 57.85 57.41 1br1 n ARG 247 Cb 0.49 -1.55 -0.07 0.00 0.00 0.00 0.00 32.46 31.33 1br1 n ARG 247 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.63 177.04 1br1 s PHE 248 N -1.33 -0.54 0.65 -1.55 -0.71 -1.26 -2.35 117.98 110.88 1br1 s PHE 248 Ca 0.08 1.23 -0.17 0.00 -1.04 0.00 0.00 56.93 57.03 1br1 s PHE 248 Cb 0.06 0.37 -0.01 0.00 -1.21 0.00 0.00 43.02 42.23 1br1 s PHE 248 CO 0.03 -0.27 1.22 0.20 -1.34 0.00 0.00 175.22 175.06 1br1 s GLY 249 N 0.63 2.63 -0.13 1.99 0.00 -1.26 -4.66 107.32 106.51 1br1 s GLY 249 Ca -0.01 0.99 -0.10 0.00 0.00 0.00 0.00 44.72 45.60 1br1 s GLY 249 CO -0.09 1.40 0.34 -1.59 0.00 0.00 0.00 173.10 173.15 1br1 s LYS 250 N -3.54 0.36 -0.30 2.90 -2.85 0.22 -1.81 119.74 114.73 1br1 s LYS 250 Ca 0.77 0.54 0.00 0.00 -1.00 0.00 0.00 55.97 56.28 1br1 s LYS 250 Cb -0.31 0.10 0.09 0.00 -2.06 0.00 0.00 37.83 35.65 1br1 s LYS 250 CO 0.38 -0.09 0.06 0.12 0.10 0.00 0.00 175.35 175.93 1br1 s PHE 251 N 0.58 2.14 0.07 1.78 2.19 -0.76 0.18 117.98 124.15 1br1 s PHE 251 Ca -0.03 -1.91 -0.22 0.00 0.33 0.00 0.00 56.93 55.09 1br1 s PHE 251 Cb -0.05 -1.88 -0.06 0.00 -1.31 0.00 0.00 43.02 39.72 1br1 s PHE 251 CO -0.03 -0.86 0.68 0.42 1.83 0.00 0.00 175.22 177.25 1br1 s ILE 252 N 1.47 4.70 -0.17 3.12 1.09 -0.58 -1.57 121.20 129.25 1br1 s ILE 252 Ca 0.07 1.45 0.01 0.00 -1.10 0.00 0.00 60.65 61.07 1br1 s ILE 252 Cb -0.18 -4.02 0.03 0.00 -1.06 0.00 0.00 42.46 37.23 1br1 s ILE 252 CO -0.18 0.46 -0.15 -0.60 -0.10 0.00 0.00 174.94 174.37 1br1 s ARG 253 N -0.59 2.40 -0.15 2.79 3.52 0.02 -1.55 118.95 125.39 1br1 s ARG 253 Ca 0.34 -0.71 -0.05 0.00 -0.13 0.00 0.00 55.73 55.18 1br1 s ARG 253 Cb -0.20 -2.31 -0.03 0.00 -1.56 0.00 0.00 34.95 30.84 1br1 s ARG 253 CO 0.21 -0.28 0.01 0.42 -0.81 0.00 0.00 175.30 174.85 1br1 s ILE 254 N 1.41 4.38 -0.17 4.11 1.01 -0.56 -0.50 121.20 130.88 1br1 s ILE 254 Ca 0.03 -0.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.44 1br1 s ILE 254 Cb -0.14 -2.92 -0.03 0.00 0.01 0.00 0.00 42.46 39.38 1br1 s ILE 254 CO -0.11 0.51 -0.00 0.20 0.00 0.00 0.00 174.94 175.54 1br1 s ASN 255 N 0.01 5.05 0.09 3.58 0.01 0.01 -0.20 114.94 123.50 1br1 s ASN 255 Ca 0.03 -0.07 0.09 0.00 -0.71 0.00 0.00 52.86 52.20 1br1 s ASN 255 Cb -0.13 -1.84 -0.04 0.00 0.41 0.00 0.00 41.25 39.65 1br1 s ASN 255 CO 0.02 0.16 -0.20 -0.36 -1.51 0.00 0.00 177.10 175.21 1br1 s PHE 256 N 0.44 2.50 0.00 2.20 0.08 0.13 0.25 117.98 123.58 1br1 s PHE 256 Ca -0.01 -0.28 0.00 0.00 0.12 0.00 0.00 56.93 56.75 1br1 s PHE 256 Cb -0.14 -1.37 0.00 0.00 -0.57 0.00 0.00 43.02 40.94 1br1 s PHE 256 CO 0.02 0.33 0.00 -0.40 -0.10 0.00 0.00 175.22 175.07 1br1 n ASP 257 N 1.08 0.00 0.09 1.36 5.68 -0.29 -2.17 116.55 122.30 1br1 n ASP 257 Ca -0.16 -0.34 -0.14 0.00 -0.50 0.00 0.00 54.79 53.64 1br1 n ASP 257 Cb 0.53 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.41 1br1 n ASP 257 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1br1 h VAL 258 N -0.31 1.47 0.00 2.12 2.07 -1.99 -3.14 116.25 116.47 1br1 h VAL 258 Ca 0.00 -2.83 0.00 0.00 0.82 0.00 0.00 66.70 64.69 1br1 h VAL 258 Cb 0.00 2.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.51 1br1 h VAL 258 CO 0.00 0.83 0.00 0.35 0.02 0.00 0.00 177.57 178.77 1br1 n THR 259 N -3.61 0.90 -0.12 2.57 -2.24 -1.26 -4.86 114.28 105.66 1br1 n THR 259 Ca -0.07 0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 1br1 n THR 259 Cb 0.94 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 1br1 n THR 259 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1br1 n GLY 260 N 0.10 0.93 3.85 3.38 0.00 -1.19 -5.09 105.19 107.17 1br1 n GLY 260 Ca 0.04 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 1br1 n GLY 260 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1br1 s TYR 261 N -2.00 3.34 0.25 1.61 1.51 -1.26 -4.83 117.35 115.97 1br1 s TYR 261 Ca 0.00 0.13 -0.30 0.00 -1.01 0.00 0.00 57.07 55.90 1br1 s TYR 261 Cb 0.00 -1.66 -0.09 0.00 -0.11 0.00 0.00 41.96 40.10 1br1 s TYR 261 CO 0.00 0.54 1.24 0.42 -1.11 0.00 0.00 175.55 176.65 1br1 s ILE 262 N -1.52 3.19 0.00 2.71 1.01 -1.16 -1.13 121.20 124.30 1br1 s ILE 262 Ca 0.32 1.09 0.00 0.00 0.00 0.00 0.00 60.65 62.06 1br1 s ILE 262 Cb -0.12 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.66 1br1 s ILE 262 CO 0.25 0.21 0.00 0.55 0.00 0.00 0.00 174.94 175.95 1br1 n VAL 263 N 1.77 0.00 -4.07 2.92 3.14 0.14 -4.76 118.33 117.47 1br1 n VAL 263 Ca 0.02 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.29 1br1 n VAL 263 Cb 0.43 -0.02 -0.06 0.00 -1.06 0.00 0.00 33.84 33.13 1br1 n VAL 263 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1br1 s GLY 264 N -0.68 1.03 -0.29 7.55 0.00 -1.00 -4.88 107.32 109.05 1br1 s GLY 264 Ca 0.00 -1.26 -0.14 0.00 0.00 0.00 0.00 44.72 43.32 1br1 s GLY 264 CO 0.00 -0.92 0.81 0.00 0.00 0.00 0.00 173.10 172.99 1br1 s ALA 265 N -3.77 -2.19 0.28 3.20 0.00 0.87 -0.81 121.76 119.34 1br1 s ALA 265 Ca 0.29 2.27 0.09 0.00 0.00 0.00 0.00 51.96 54.61 1br1 s ALA 265 Cb 0.01 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.37 1br1 s ALA 265 CO 0.13 -0.64 0.06 1.21 0.00 0.00 0.00 175.76 176.53 1br1 s ASN 266 N 2.07 4.74 -0.17 0.00 3.04 0.35 -3.73 114.94 121.23 1br1 s ASN 266 Ca -0.07 -0.61 -0.04 0.00 0.04 0.00 0.00 52.86 52.18 1br1 s ASN 266 Cb -0.07 -0.91 0.08 0.00 -1.54 0.00 0.00 41.25 38.81 1br1 s ASN 266 CO -0.18 -0.07 0.18 -0.63 -3.04 0.00 0.00 177.10 173.36 1br1 s ILE 267 N -2.32 -0.26 -0.54 -5.21 1.09 -1.26 -0.80 121.20 111.90 1br1 s ILE 267 Ca 0.33 -0.02 -0.17 0.00 -1.10 0.00 0.00 60.65 59.69 1br1 s ILE 267 Cb -0.06 -0.57 0.11 0.00 -1.06 0.00 0.00 42.46 40.88 1br1 s ILE 267 CO 0.21 -0.15 0.54 -0.70 -0.10 0.00 0.00 174.94 174.75 1br1 s GLU 268 N 2.28 3.01 0.42 2.79 2.56 -0.61 -4.96 118.70 124.20 1br1 s GLU 268 Ca 0.05 -1.48 -0.14 0.00 0.00 0.00 0.00 54.97 53.39 1br1 s GLU 268 Cb -0.15 -4.24 -0.08 0.00 2.00 0.00 0.00 34.13 31.66 1br1 s GLU 268 CO -0.10 -1.31 0.85 -0.08 -0.56 0.00 0.00 175.26 174.05 1br1 s THR 269 N 1.95 4.64 0.00 -1.70 -1.32 -1.26 -1.82 115.64 116.13 1br1 s THR 269 Ca 0.06 0.96 0.00 0.00 -1.21 0.00 0.00 61.69 61.51 1br1 s THR 269 Cb -0.27 -3.69 0.00 0.00 -1.51 0.00 0.00 72.50 67.04 1br1 s THR 269 CO 0.05 -0.48 0.00 -1.22 -2.21 0.00 0.00 174.62 170.76 1br1 n TYR 270 N -1.12 0.00 -1.76 9.09 4.01 -0.75 -4.98 117.16 121.65 1br1 n TYR 270 Ca 0.04 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.59 1br1 n TYR 270 Cb 0.54 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.48 1br1 n TYR 270 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1br1 s LEU 271 N 0.00 2.74 -0.81 7.72 1.43 -1.26 -4.81 118.68 123.68 1br1 s LEU 271 Ca 0.00 -0.85 -0.26 0.00 -1.03 0.00 0.00 54.13 52.00 1br1 s LEU 271 Cb 0.00 -2.58 0.03 0.00 0.03 0.00 0.00 46.19 43.67 1br1 s LEU 271 CO 0.00 -3.92 1.40 -0.22 0.23 0.00 0.00 176.35 173.84 1br1 s LEU 272 N 14.26 3.27 -0.19 1.79 2.96 -1.26 -4.32 118.68 135.19 1br1 s LEU 272 Ca 0.80 -0.67 -0.22 0.00 -0.22 0.00 0.00 54.13 53.81 1br1 s LEU 272 Cb -0.06 -2.56 -0.25 0.00 0.50 0.00 0.00 46.19 43.82 1br1 s LEU 272 CO 0.12 -1.83 1.57 1.21 -1.32 0.00 0.00 176.35 176.10 1br1 n GLU 273 N 9.21 0.39 0.00 1.98 2.13 -0.99 -4.54 120.64 128.82 1br1 n GLU 273 Ca 0.14 -1.09 0.11 0.00 0.66 0.00 0.00 57.16 56.99 1br1 n GLU 273 Cb 0.50 -2.48 0.65 0.00 0.27 0.00 0.00 31.44 30.38 1br1 n GLU 273 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1br1 n LYS 274 N 7.04 0.77 0.10 5.31 -0.00 -1.26 -3.56 118.16 126.56 1br1 n LYS 274 Ca 0.38 0.00 -0.07 0.00 -0.00 0.00 0.00 58.31 58.62 1br1 n LYS 274 Cb 0.32 -1.44 -0.04 0.00 -0.00 0.00 0.00 35.03 33.87 1br1 n LYS 274 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.40 178.17 1br1 h SER 275 N 0.00 -0.57 0.00 -5.58 0.02 -1.91 -2.14 113.55 103.38 1br1 h SER 275 Ca 0.00 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1br1 h SER 275 Cb 0.00 0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.73 1br1 h SER 275 CO 0.00 -0.26 0.30 -2.11 -1.14 0.00 0.00 176.83 173.62 1br1 n ARG 276 N -3.56 0.00 0.19 3.45 1.85 -1.23 -1.35 116.66 116.01 1br1 n ARG 276 Ca -0.04 0.04 0.14 0.00 -1.00 0.00 0.00 57.85 56.98 1br1 n ARG 276 Cb 0.18 -1.80 0.61 0.00 -1.05 0.00 0.00 32.46 30.40 1br1 n ARG 276 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1br1 h ALA 277 N 0.21 1.00 0.00 2.89 0.00 -1.64 -3.26 119.26 118.47 1br1 h ALA 277 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.70 1br1 h ALA 277 Cb 0.60 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1br1 h ALA 277 CO 0.00 0.00 -1.79 0.44 0.00 0.00 0.00 179.25 177.90 1br1 n ILE 278 N -2.54 0.80 -3.60 0.00 -5.35 -0.46 -4.90 119.36 103.31 1br1 n ILE 278 Ca 0.01 -0.33 -0.15 0.00 -0.27 0.00 0.00 62.75 62.01 1br1 n ILE 278 Cb 0.21 -0.95 -0.13 0.00 -1.74 0.00 0.00 39.64 37.03 1br1 n ILE 278 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1br1 s ARG 279 N -2.28 0.15 -0.03 6.28 0.52 -1.23 -4.40 118.95 117.97 1br1 s ARG 279 Ca -0.17 0.58 -0.08 0.00 -0.52 0.00 0.00 55.73 55.53 1br1 s ARG 279 Cb 0.05 -0.38 -0.05 0.00 0.52 0.00 0.00 34.95 35.08 1br1 s ARG 279 CO 0.35 -0.40 0.26 -0.65 0.02 0.00 0.00 175.30 174.88 1br1 s GLN 280 N 2.39 3.61 0.00 3.54 1.11 -1.26 -4.37 119.66 124.68 1br1 s GLN 280 Ca 0.03 0.01 0.00 0.00 0.01 0.00 0.00 55.36 55.42 1br1 s GLN 280 Cb -0.13 -3.14 0.00 0.00 -1.01 0.00 0.00 33.01 28.73 1br1 s GLN 280 CO -0.09 0.69 0.00 0.00 0.01 0.00 0.00 175.29 175.90 1br1 n ALA 281 N 1.50 0.00 -2.59 6.09 0.00 -1.26 -4.67 120.51 119.58 1br1 n ALA 281 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.88 1br1 n ALA 281 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.95 1br1 n ALA 281 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1br1 s LYS 282 N -2.23 4.57 0.00 0.00 2.36 -1.26 -3.58 119.74 119.60 1br1 s LYS 282 Ca 0.00 1.46 0.00 0.00 -2.55 0.00 0.00 55.97 54.88 1br1 s LYS 282 Cb 0.00 -3.43 0.00 0.00 -1.05 0.00 0.00 37.83 33.35 1br1 s LYS 282 CO 0.00 -0.02 0.00 -0.25 1.55 0.00 0.00 175.35 176.63 1br1 n ASP 283 N 3.68 -2.95 -4.81 1.43 8.00 -1.26 -4.86 116.55 115.78 1br1 n ASP 283 Ca 0.06 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.36 1br1 n ASP 283 Cb 0.50 -1.70 0.06 0.00 -0.02 0.00 0.00 41.12 39.96 1br1 n ASP 283 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1br1 n GLU 284 N -1.38 0.63 -4.25 -1.24 1.02 -1.23 -4.73 120.64 109.45 1br1 n GLU 284 Ca 0.00 -3.04 -0.15 0.00 -0.02 0.00 0.00 57.16 53.95 1br1 n GLU 284 Cb 0.16 -0.15 -0.10 0.00 -0.02 0.00 0.00 31.44 31.33 1br1 n GLU 284 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1br1 s ARG 285 N -4.47 1.36 0.00 3.49 0.52 -0.74 -4.85 118.95 114.26 1br1 s ARG 285 Ca 0.54 -1.74 0.00 0.00 -0.52 0.00 0.00 55.73 54.01 1br1 s ARG 285 Cb -0.04 0.11 0.00 0.00 0.52 0.00 0.00 34.95 35.53 1br1 s ARG 285 CO 0.35 -0.41 0.00 0.25 0.02 0.00 0.00 175.30 175.51 1br1 n THR 286 N -0.39 0.00 -1.79 0.02 -2.24 -1.26 -4.50 114.28 104.11 1br1 n THR 286 Ca 0.02 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.37 1br1 n THR 286 Cb 0.66 -1.32 -0.03 0.00 -2.10 0.00 0.00 70.33 67.54 1br1 n THR 286 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1br1 s PHE 287 N 0.43 1.47 0.00 4.78 0.40 -1.26 -4.44 117.98 119.36 1br1 s PHE 287 Ca 0.00 0.45 0.00 0.00 -0.60 0.00 0.00 56.93 56.78 1br1 s PHE 287 Cb 0.00 -4.03 0.00 0.00 0.51 0.00 0.00 43.02 39.50 1br1 s PHE 287 CO 0.00 -3.79 0.00 0.72 0.70 0.00 0.00 175.22 172.85 1br1 n HIS 288 N 10.43 0.00 -0.20 0.36 8.25 -0.72 0.31 115.22 133.65 1br1 n HIS 288 Ca 0.25 0.00 0.20 0.00 -0.26 0.00 0.00 57.72 57.91 1br1 n HIS 288 Cb 0.45 -0.17 0.36 0.00 1.12 0.00 0.00 29.99 31.75 1br1 n HIS 288 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 1br1 n ILE 289 N -2.43 -0.26 0.08 1.59 0.13 -1.24 -0.66 119.36 116.56 1br1 n ILE 289 Ca 0.00 1.28 -0.06 0.00 -1.10 0.00 0.00 62.75 62.87 1br1 n ILE 289 Cb 0.00 -2.07 -0.03 0.00 -0.84 0.00 0.00 39.64 36.69 1br1 n ILE 289 CO 0.00 0.00 0.00 -0.26 2.80 0.00 0.00 176.55 179.09 1br1 h PHE 290 N 0.00 -0.51 -0.63 9.51 0.04 -0.49 0.23 116.94 125.09 1br1 h PHE 290 Ca 0.53 0.01 0.09 0.00 2.80 0.00 0.00 57.97 61.40 1br1 h PHE 290 Cb 1.39 0.20 -0.07 0.00 2.20 0.00 0.00 35.95 39.68 1br1 h PHE 290 CO -0.02 -0.23 0.26 1.88 -0.60 0.00 0.00 178.31 179.60 1br1 h TYR 291 N -0.32 0.45 -0.46 -0.55 -1.99 -1.08 -0.18 116.97 112.85 1br1 h TYR 291 Ca -0.02 0.03 0.09 0.00 2.00 0.00 0.00 58.73 60.84 1br1 h TYR 291 Cb 0.29 -0.11 -0.10 0.00 2.00 0.00 0.00 36.73 38.82 1br1 h TYR 291 CO -0.21 0.13 -0.24 1.88 -0.00 0.00 0.00 178.16 179.72 1br1 h TYR 292 N 0.45 -0.63 0.10 4.88 -1.99 -0.91 -1.79 116.97 117.08 1br1 h TYR 292 Ca 0.32 0.05 -0.00 0.00 2.00 0.00 0.00 58.73 61.10 1br1 h TYR 292 Cb 0.38 0.35 0.00 0.00 2.00 0.00 0.00 36.73 39.45 1br1 h TYR 292 CO -0.15 -0.32 -0.05 1.25 -0.00 0.00 0.00 178.16 178.89 1br1 h LEU 293 N -0.15 -0.12 -1.60 3.88 5.85 0.89 1.67 115.31 125.74 1br1 h LEU 293 Ca 0.21 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1br1 h LEU 293 Cb 0.48 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.54 1br1 h LEU 293 CO -0.55 0.02 0.23 0.40 -0.34 0.00 0.00 178.44 178.21 1br1 h ILE 294 N -0.25 0.00 0.00 4.05 2.04 -0.63 -2.00 117.51 120.72 1br1 h ILE 294 Ca -0.01 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.76 1br1 h ILE 294 Cb 0.21 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1br1 h ILE 294 CO 0.02 0.00 -1.03 0.00 0.00 0.00 0.00 178.15 177.15 1br1 n ALA 295 N -1.77 2.43 0.69 1.87 0.00 -0.71 -4.65 120.51 118.36 1br1 n ALA 295 Ca -0.02 -0.30 0.06 0.00 0.00 0.00 0.00 53.44 53.19 1br1 n ALA 295 Cb 0.27 0.32 0.35 0.00 0.00 0.00 0.00 19.45 20.38 1br1 n ALA 295 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1br1 n GLY 296 N 2.63 -0.57 3.74 0.00 0.00 0.56 -4.77 105.19 106.78 1br1 n GLY 296 Ca -0.12 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1br1 n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1br1 s ALA 297 N -2.32 3.83 0.38 4.61 0.00 -0.75 -4.94 121.76 122.57 1br1 s ALA 297 Ca 0.15 1.58 -0.25 0.00 0.00 0.00 0.00 51.96 53.44 1br1 s ALA 297 Cb 0.09 -3.67 -0.09 0.00 0.00 0.00 0.00 23.12 19.45 1br1 s ALA 297 CO 0.17 -0.96 1.06 -1.54 0.00 0.00 0.00 175.76 174.49 1br1 s SER 298 N 0.78 6.82 0.18 0.00 1.04 -1.26 -4.77 113.70 116.49 1br1 s SER 298 Ca 0.68 2.08 -0.26 0.00 0.48 0.00 0.00 55.95 58.94 1br1 s SER 298 Cb -0.49 -2.59 0.05 0.00 0.10 0.00 0.00 66.02 63.09 1br1 s SER 298 CO 0.41 -0.45 1.55 -0.08 0.98 0.00 0.00 173.24 175.65 1br1 h GLU 299 N 2.69 -0.04 0.00 4.02 4.22 -1.97 2.18 114.58 125.68 1br1 h GLU 299 Ca -0.48 0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.96 1br1 h GLU 299 Cb 1.22 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1br1 h GLU 299 CO 0.63 -0.03 0.00 0.94 -2.18 0.00 0.00 179.01 178.37 1br1 n GLN 300 N -5.35 0.00 0.27 1.92 0.00 -1.26 -1.72 117.38 111.24 1br1 n GLN 300 Ca 0.05 0.37 0.10 0.00 -0.00 0.00 0.00 57.00 57.52 1br1 n GLN 300 Cb 0.32 -1.25 0.52 0.00 0.00 0.00 0.00 30.24 29.83 1br1 n GLN 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1br1 h MET 301 N 0.00 0.00 0.19 3.69 -0.00 -1.89 -1.37 114.93 115.55 1br1 h MET 301 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 59.70 59.71 1br1 h MET 301 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 31.60 31.56 1br1 h MET 301 CO 0.00 0.00 -0.51 -0.09 -0.00 0.00 0.00 176.91 176.31 1br1 h ARG 302 N 0.00 -0.75 -0.39 -0.10 1.12 0.45 -2.46 114.38 112.25 1br1 h ARG 302 Ca 0.00 0.05 -0.14 0.00 -1.11 0.00 0.00 59.98 58.79 1br1 h ARG 302 Cb 0.86 0.17 -0.01 0.00 -0.01 0.00 0.00 29.97 30.98 1br1 h ARG 302 CO 0.00 -0.50 -0.29 -2.95 -3.11 0.00 0.00 179.97 173.12 1br1 h ASN 303 N -0.78 0.93 -0.55 -3.80 7.08 -1.23 -1.60 115.58 115.63 1br1 h ASN 303 Ca -0.02 -0.44 0.16 0.00 -3.08 0.00 0.00 56.30 52.92 1br1 h ASN 303 Cb 0.76 -0.26 -0.02 0.00 -2.08 0.00 0.00 38.32 36.72 1br1 h ASN 303 CO -0.24 1.17 1.07 0.44 -2.08 0.00 0.00 177.43 177.79 1br1 h ASP 304 N 0.69 0.00 0.00 6.14 5.19 -1.18 2.92 116.42 130.18 1br1 h ASP 304 Ca 0.07 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.48 1br1 h ASP 304 Cb 0.87 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.38 1br1 h ASP 304 CO 0.08 0.00 -0.00 0.18 -3.12 0.00 0.00 179.24 176.38 1br1 n LEU 305 N -2.94 1.69 -3.47 1.55 4.77 -1.10 -5.00 117.00 112.49 1br1 n LEU 305 Ca 0.12 -1.70 -0.23 0.00 -0.03 0.00 0.00 56.01 54.17 1br1 n LEU 305 Cb 1.24 -0.00 0.05 0.00 -2.33 0.00 0.00 43.42 42.38 1br1 n LEU 305 CO 0.13 0.42 -0.01 0.18 -1.33 0.00 0.00 177.39 176.79 1br1 n LEU 306 N -0.43 -4.20 -4.19 2.23 4.77 0.98 -4.72 117.00 111.42 1br1 n LEU 306 Ca 0.00 -0.85 -0.44 0.00 -0.03 0.00 0.00 56.01 54.69 1br1 n LEU 306 Cb 0.29 -2.78 0.00 0.00 -2.33 0.00 0.00 43.42 38.61 1br1 n LEU 306 CO 0.00 0.25 1.03 0.18 -1.33 0.00 0.00 177.39 177.52 1br1 n LEU 307 N -3.66 5.92 -4.65 2.23 4.77 -0.61 -4.99 117.00 116.01 1br1 n LEU 307 Ca -0.08 -5.05 -0.31 0.00 -0.03 0.00 0.00 56.01 50.54 1br1 n LEU 307 Cb 0.60 -1.41 0.18 0.00 -2.33 0.00 0.00 43.42 40.46 1br1 n LEU 307 CO 0.63 1.44 0.66 -1.61 -1.33 0.00 0.00 177.39 177.18 1br1 s GLU 308 N -1.59 0.77 0.16 3.23 2.02 -1.26 -4.85 118.70 117.18 1br1 s GLU 308 Ca 0.32 1.47 -0.03 0.00 0.02 0.00 0.00 54.97 56.76 1br1 s GLU 308 Cb -0.03 -1.70 0.04 0.00 0.10 0.00 0.00 34.13 32.54 1br1 s GLU 308 CO 0.00 -2.78 0.09 0.41 0.02 0.00 0.00 175.26 173.01 1br1 n GLY 309 N 0.30 -3.67 3.80 -1.39 0.00 -1.26 -4.89 105.19 98.07 1br1 n GLY 309 Ca 0.11 -1.21 -0.33 0.00 0.00 0.00 0.00 46.02 44.59 1br1 n GLY 309 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1br1 s PHE 310 N -1.10 2.98 -0.71 1.61 0.40 -1.26 -3.35 117.98 116.55 1br1 s PHE 310 Ca 0.07 1.52 0.00 0.00 -0.60 0.00 0.00 56.93 57.92 1br1 s PHE 310 Cb -0.01 -3.02 0.00 0.00 0.51 0.00 0.00 43.02 40.50 1br1 s PHE 310 CO 0.06 -1.09 0.00 0.09 0.70 0.00 0.00 175.22 174.98 1br1 n ASN 311 N -1.90 -4.55 -0.23 1.36 5.03 -1.26 -4.76 115.26 108.94 1br1 n ASN 311 Ca 0.09 0.17 0.06 0.00 0.87 0.00 0.00 54.58 55.77 1br1 n ASN 311 Cb 0.53 -2.65 -0.02 0.00 -1.02 0.00 0.00 39.78 36.62 1br1 n ASN 311 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1br1 n ASN 312 N -0.21 1.25 -4.41 6.41 5.03 -1.21 -4.93 115.26 117.19 1br1 n ASN 312 Ca -0.07 -1.12 -0.32 0.00 0.87 0.00 0.00 54.58 53.94 1br1 n ASN 312 Cb 0.34 0.59 -0.14 0.00 -1.02 0.00 0.00 39.78 39.56 1br1 n ASN 312 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1br1 s TYR 313 N -1.78 2.54 -1.41 3.10 1.51 -1.26 -4.96 117.35 115.08 1br1 s TYR 313 Ca 0.10 -0.28 0.24 0.00 -1.01 0.00 0.00 57.07 56.12 1br1 s TYR 313 Cb 0.11 -1.55 0.35 0.00 -0.11 0.00 0.00 41.96 40.76 1br1 s TYR 313 CO 0.38 0.12 1.30 2.41 -1.11 0.00 0.00 175.55 178.66 1br1 n THR 314 N 2.18 0.00 0.90 -0.71 -1.04 -1.26 -3.94 114.28 110.41 1br1 n THR 314 Ca -0.17 -0.08 0.12 0.00 -2.04 0.00 0.00 64.05 61.88 1br1 n THR 314 Cb 0.52 0.62 0.55 0.00 -1.82 0.00 0.00 70.33 70.20 1br1 n THR 314 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1br1 n PHE 315 N -0.98 0.00 -3.38 -1.42 3.72 -1.26 -4.39 117.46 109.74 1br1 n PHE 315 Ca 0.08 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 57.03 1br1 n PHE 315 Cb 0.36 -0.49 -0.02 0.00 -0.94 0.00 0.00 39.48 38.39 1br1 n PHE 315 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1br1 s LEU 316 N -2.98 6.45 0.76 4.37 1.43 -1.25 -4.26 118.68 123.19 1br1 s LEU 316 Ca 0.13 -3.02 -0.13 0.00 -1.03 0.00 0.00 54.13 50.08 1br1 s LEU 316 Cb 0.17 -2.16 0.05 0.00 0.03 0.00 0.00 46.19 44.28 1br1 s LEU 316 CO 0.47 -0.45 1.14 -0.94 0.23 0.00 0.00 176.35 176.79 1br1 s SER 317 N 1.66 4.29 -1.77 2.29 1.04 -1.26 -2.47 113.70 117.48 1br1 s SER 317 Ca 0.22 2.08 -0.00 0.00 0.48 0.00 0.00 55.95 58.73 1br1 s SER 317 Cb -0.11 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.46 1br1 s SER 317 CO -0.08 -2.19 0.00 0.59 0.98 0.00 0.00 173.24 172.54 1br1 n ASN 318 N -3.14 -5.90 0.00 7.02 3.02 -1.26 -4.74 115.26 110.26 1br1 n ASN 318 Ca 0.11 -0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 1br1 n ASN 318 Cb 0.52 -4.91 0.00 0.00 -0.61 0.00 0.00 39.78 34.78 1br1 n ASN 318 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1br1 n GLY 319 N -1.02 1.13 3.49 7.41 0.00 -1.03 -3.81 105.19 111.37 1br1 n GLY 319 Ca -0.25 -0.31 -0.43 0.00 0.00 0.00 0.00 46.02 45.04 1br1 n GLY 319 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1br1 s HIS 320 N 0.00 3.02 -0.04 1.61 5.65 -1.26 -4.92 115.29 119.35 1br1 s HIS 320 Ca 0.00 -0.24 -0.04 0.00 0.25 0.00 0.00 55.06 55.03 1br1 s HIS 320 Cb 0.00 -3.53 -0.04 0.00 -1.18 0.00 0.00 32.58 27.83 1br1 s HIS 320 CO 0.00 -1.01 0.17 0.08 -0.65 0.00 0.00 174.74 173.34 1br1 s VAL 321 N 2.92 5.45 0.25 0.89 1.01 -1.25 -5.10 120.40 124.57 1br1 s VAL 321 Ca 0.21 -0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.16 1br1 s VAL 321 Cb -0.16 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 1br1 s VAL 321 CO 0.16 0.41 0.40 -2.16 0.00 0.00 0.00 175.10 173.91 1br1 s PRO 322 N -1.69 3.47 -0.18 2.72 0.04 -1.26 -5.07 135.00 133.02 1br1 s PRO 322 Ca 0.24 -0.56 -0.02 0.00 0.04 0.00 0.00 61.00 60.70 1br1 s PRO 322 Cb -0.12 -2.83 -0.01 0.00 0.04 0.00 0.00 34.50 31.57 1br1 s PRO 322 CO 0.15 0.37 -0.08 -1.50 0.04 0.00 0.00 177.00 175.97 1br1 s ILE 323 N -2.01 3.23 0.29 0.56 2.07 -1.26 -5.09 121.20 118.98 1br1 s ILE 323 Ca 0.36 -0.56 -0.30 0.00 -1.41 0.00 0.00 60.65 58.74 1br1 s ILE 323 Cb -0.10 -2.42 -0.13 0.00 0.13 0.00 0.00 42.46 39.94 1br1 s ILE 323 CO 0.31 0.47 1.42 -0.81 -1.91 0.00 0.00 174.94 174.41 1br1 n PRO 324 N 4.26 2.23 -0.66 3.50 -0.04 -1.26 -2.31 135.00 140.71 1br1 n PRO 324 Ca -0.18 0.79 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 1br1 n PRO 324 Cb 0.52 -2.45 0.00 0.00 -0.04 0.00 0.00 33.50 31.52 1br1 n PRO 324 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1br1 n ALA 325 N 1.45 0.00 -2.91 0.55 0.00 -1.26 -4.94 120.51 113.40 1br1 n ALA 325 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.23 1br1 n ALA 325 Cb 0.34 -0.86 -0.16 0.00 0.00 0.00 0.00 19.45 18.77 1br1 n ALA 325 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1br1 s GLN 326 N -0.93 2.34 -0.39 0.00 0.74 -0.98 -5.10 119.66 115.35 1br1 s GLN 326 Ca 0.00 -0.78 -0.05 0.00 0.05 0.00 0.00 55.36 54.58 1br1 s GLN 326 Cb 0.00 -1.95 0.09 0.00 1.10 0.00 0.00 33.01 32.25 1br1 s GLN 326 CO 0.00 0.29 0.19 -1.14 -0.55 0.00 0.00 175.29 174.08 1br1 s GLN 327 N 0.03 2.26 0.35 1.67 0.74 -1.26 -4.53 119.66 118.93 1br1 s GLN 327 Ca -0.07 -1.62 0.10 0.00 0.05 0.00 0.00 55.36 53.82 1br1 s GLN 327 Cb -0.14 -3.58 0.85 0.00 1.10 0.00 0.00 33.01 31.24 1br1 s GLN 327 CO 0.04 -0.97 1.84 -0.44 -0.55 0.00 0.00 175.29 175.21 1br1 h ASP 328 N 8.16 0.64 -0.58 6.67 3.32 -1.97 0.26 116.42 132.91 1br1 h ASP 328 Ca -0.17 0.06 0.06 0.00 0.02 0.00 0.00 57.03 56.99 1br1 h ASP 328 Cb 1.06 -0.07 -0.09 0.00 0.22 0.00 0.00 39.33 40.46 1br1 h ASP 328 CO 0.69 0.28 -0.52 0.44 -1.72 0.00 0.00 179.24 178.41 1br1 h ASP 329 N 0.65 -1.82 -0.13 6.45 5.19 -1.92 -1.65 116.42 123.19 1br1 h ASP 329 Ca 0.49 0.25 -0.17 0.00 -0.62 0.00 0.00 57.03 56.99 1br1 h ASP 329 Cb 0.88 0.77 0.01 0.00 0.18 0.00 0.00 39.33 41.17 1br1 h ASP 329 CO -0.25 -0.31 -0.58 1.05 -3.12 0.00 0.00 179.24 176.04 1br1 h GLU 330 N -0.23 0.62 -0.74 3.56 4.11 -1.85 -3.23 114.58 116.83 1br1 h GLU 330 Ca 0.10 -0.49 0.31 0.00 0.07 0.00 0.00 59.36 59.34 1br1 h GLU 330 Cb 0.48 0.10 -0.13 0.00 0.50 0.00 0.00 28.75 29.70 1br1 h GLU 330 CO -0.67 1.11 0.40 -1.33 0.07 0.00 0.00 179.01 178.60 1br1 n MET 331 N -4.14 -0.04 0.00 1.06 2.81 0.03 0.05 117.12 116.88 1br1 n MET 331 Ca -0.08 1.01 0.00 0.00 -1.81 0.00 0.00 57.70 56.83 1br1 n MET 331 Cb 0.64 -1.82 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 1br1 n MET 331 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1br1 n PHE 332 N -4.65 0.00 -0.27 2.03 7.35 -0.76 -1.86 117.46 119.29 1br1 n PHE 332 Ca 0.28 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 57.01 1br1 n PHE 332 Cb 0.95 -0.46 0.13 0.00 0.35 0.00 0.00 39.48 40.44 1br1 n PHE 332 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 1br1 h GLN 333 N 0.00 0.03 -0.55 -4.13 5.75 -0.58 0.89 115.11 116.51 1br1 h GLN 333 Ca 0.00 -0.00 0.10 0.00 -0.15 0.00 0.00 58.65 58.60 1br1 h GLN 333 Cb 0.00 -0.01 -0.11 0.00 1.07 0.00 0.00 27.48 28.43 1br1 h GLN 333 CO 0.00 0.02 -0.31 1.49 -2.65 0.00 0.00 178.83 177.38 1br1 h GLU 334 N 0.03 -0.16 -0.12 1.69 4.81 -1.21 3.60 114.58 123.23 1br1 h GLU 334 Ca 0.40 0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.46 1br1 h GLU 334 Cb 0.66 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.07 1br1 h GLU 334 CO -0.77 -0.11 -0.68 1.79 -0.73 0.00 0.00 179.01 178.51 1br1 h THR 335 N -0.17 1.35 0.10 0.32 1.35 -0.11 0.13 112.91 115.88 1br1 h THR 335 Ca 0.22 -2.01 -0.00 0.00 -0.55 0.00 0.00 66.41 64.07 1br1 h THR 335 Cb 0.54 1.99 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 1br1 h THR 335 CO -0.64 0.61 -0.05 -0.07 -0.25 0.00 0.00 175.52 175.12 1br1 h LEU 336 N 0.35 -0.13 -0.71 3.87 -0.00 0.32 0.14 115.31 119.15 1br1 h LEU 336 Ca -0.02 0.01 0.11 0.00 -0.00 0.00 0.00 57.88 57.98 1br1 h LEU 336 Cb 1.25 0.03 -0.08 0.00 -0.00 0.00 0.00 40.66 41.86 1br1 h LEU 336 CO 0.12 -0.09 0.31 -0.33 -0.00 0.00 0.00 178.44 178.45 1br1 h GLU 337 N -0.14 0.48 0.75 1.13 5.08 0.69 -2.30 114.58 120.27 1br1 h GLU 337 Ca -0.01 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1br1 h GLU 337 Cb 0.11 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1br1 h GLU 337 CO 0.02 0.32 -0.43 0.00 -1.00 0.00 0.00 179.01 177.92 1br1 h ALA 338 N 1.48 -1.26 -0.90 3.43 0.00 -0.04 -2.13 119.26 119.85 1br1 h ALA 338 Ca 0.37 -0.23 0.29 0.00 0.00 0.00 0.00 54.91 55.34 1br1 h ALA 338 Cb 0.48 0.52 -0.17 0.00 0.00 0.00 0.00 17.79 18.63 1br1 h ALA 338 CO -0.33 -1.20 0.18 -1.33 0.00 0.00 0.00 179.25 176.56 1br1 n MET 339 N -5.15 -0.07 0.05 0.00 2.81 0.42 0.35 117.12 115.53 1br1 n MET 339 Ca -0.13 1.31 -0.13 0.00 -1.81 0.00 0.00 57.70 56.93 1br1 n MET 339 Cb 0.45 -2.16 -0.09 0.00 -0.71 0.00 0.00 33.22 30.71 1br1 n MET 339 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1br1 h THR 340 N 0.00 1.08 -0.66 2.03 1.35 -1.18 0.71 112.91 116.24 1br1 h THR 340 Ca 0.62 -0.65 0.14 0.00 -0.55 0.00 0.00 66.41 65.97 1br1 h THR 340 Cb 1.43 1.50 -0.11 0.00 -1.73 0.00 0.00 68.15 69.24 1br1 h THR 340 CO -0.79 0.16 0.03 0.40 -0.25 0.00 0.00 175.52 175.07 1br1 h ILE 341 N -0.42 0.47 0.58 6.82 1.08 0.56 -1.45 117.51 125.16 1br1 h ILE 341 Ca -0.01 -0.05 -0.02 0.00 -0.39 0.00 0.00 64.86 64.39 1br1 h ILE 341 Cb 0.35 0.32 -0.01 0.00 -3.07 0.00 0.00 36.82 34.41 1br1 h ILE 341 CO 0.02 0.03 -0.38 0.24 -0.69 0.00 0.00 178.15 177.36 1br1 h MET 342 N 0.14 -0.89 0.00 2.37 2.86 -0.64 -3.45 114.93 115.32 1br1 h MET 342 Ca 0.35 0.06 0.00 0.00 -2.06 0.00 0.00 59.70 58.05 1br1 h MET 342 Cb 0.58 0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.45 1br1 h MET 342 CO -0.55 -0.59 0.00 0.41 1.06 0.00 0.00 176.91 177.24 1br1 n GLY 343 N -1.51 0.25 3.52 8.32 0.00 0.18 -4.96 105.19 110.99 1br1 n GLY 343 Ca -0.12 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.44 1br1 n GLY 343 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1br1 n PHE 344 N 0.00 1.72 -1.31 1.61 3.72 -0.85 -4.87 117.46 117.47 1br1 n PHE 344 Ca 0.00 0.08 -0.43 0.00 -0.05 0.00 0.00 57.45 57.06 1br1 n PHE 344 Cb 0.00 -2.63 -0.01 0.00 -0.94 0.00 0.00 39.48 35.91 1br1 n PHE 344 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1br1 n THR 345 N 7.55 0.83 -0.32 4.37 -1.04 -1.26 -4.57 114.28 119.83 1br1 n THR 345 Ca 0.37 -0.50 -0.07 0.00 -2.04 0.00 0.00 64.05 61.80 1br1 n THR 345 Cb 0.35 -0.01 -0.06 0.00 -1.82 0.00 0.00 70.33 68.80 1br1 n THR 345 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1br1 n GLU 346 N 1.29 -0.31 0.09 -2.82 0.00 -1.26 0.34 120.64 117.96 1br1 n GLU 346 Ca 0.12 1.18 -0.13 0.00 0.00 0.00 0.00 57.16 58.33 1br1 n GLU 346 Cb 0.38 -1.74 -0.08 0.00 0.00 0.00 0.00 31.44 29.99 1br1 n GLU 346 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 1br1 h GLU 347 N 0.00 0.29 0.00 3.44 -0.00 -2.01 -3.16 114.58 113.14 1br1 h GLU 347 Ca 0.15 -0.39 0.00 0.00 -0.00 0.00 0.00 59.36 59.12 1br1 h GLU 347 Cb 0.35 0.13 0.00 0.00 -0.00 0.00 0.00 28.75 29.23 1br1 h GLU 347 CO -0.74 1.12 0.56 1.49 -0.00 0.00 0.00 179.01 181.45 1br1 h GLU 348 N 0.13 0.00 0.00 1.06 4.81 -0.40 0.14 114.58 120.32 1br1 h GLU 348 Ca -0.09 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.00 1br1 h GLU 348 Cb 1.75 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.11 1br1 h GLU 348 CO 0.17 0.00 -1.33 1.04 -0.73 0.00 0.00 179.01 178.17 1br1 n GLN 349 N -1.99 0.53 -0.26 1.92 6.02 -0.78 -3.82 117.38 119.01 1br1 n GLN 349 Ca -0.00 0.31 0.25 0.00 -0.01 0.00 0.00 57.00 57.54 1br1 n GLN 349 Cb 0.58 -1.52 0.46 0.00 1.02 0.00 0.00 30.24 30.77 1br1 n GLN 349 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1br1 n THR 350 N -4.43 -0.34 0.35 5.09 -2.24 0.41 0.13 114.28 113.25 1br1 n THR 350 Ca -0.25 1.64 -0.14 0.00 -2.27 0.00 0.00 64.05 63.03 1br1 n THR 350 Cb 0.58 -2.64 -0.07 0.00 -2.10 0.00 0.00 70.33 66.10 1br1 n THR 350 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1br1 h SER 351 N 0.00 -0.76 0.00 3.42 0.02 -1.58 -2.14 113.55 112.52 1br1 h SER 351 Ca 0.67 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.64 1br1 h SER 351 Cb 1.75 0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.48 1br1 h SER 351 CO -0.63 -0.48 0.29 -0.38 -1.14 0.00 0.00 176.83 174.49 1br1 n ILE 352 N -4.75 0.86 -0.09 3.27 5.41 0.35 -0.21 119.36 124.19 1br1 n ILE 352 Ca -0.11 0.51 -0.23 0.00 1.00 0.00 0.00 62.75 63.92 1br1 n ILE 352 Cb 0.35 -1.51 -0.12 0.00 -0.71 0.00 0.00 39.64 37.66 1br1 n ILE 352 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1br1 n LEU 353 N -1.24 2.35 -0.12 1.39 4.77 -0.64 -3.98 117.00 119.53 1br1 n LEU 353 Ca -0.00 0.21 -0.06 0.00 -0.03 0.00 0.00 56.01 56.13 1br1 n LEU 353 Cb 0.29 -0.95 0.02 0.00 -2.33 0.00 0.00 43.42 40.45 1br1 n LEU 353 CO 0.00 0.66 0.96 0.08 -1.33 0.00 0.00 177.39 177.76 1br1 h ARG 354 N -0.50 0.32 0.00 3.23 0.11 0.03 0.38 114.38 117.94 1br1 h ARG 354 Ca -0.52 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.54 1br1 h ARG 354 Cb 1.71 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 32.72 1br1 h ARG 354 CO -0.17 0.21 0.28 0.28 0.10 0.00 0.00 179.97 180.66 1br1 h VAL 355 N 0.32 0.00 0.00 0.08 2.07 -1.62 0.42 116.25 117.53 1br1 h VAL 355 Ca 0.18 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.66 1br1 h VAL 355 Cb 0.14 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1br1 h VAL 355 CO -0.17 0.00 -0.34 0.58 0.02 0.00 0.00 177.57 177.66 1br1 h VAL 356 N 0.00 0.56 -0.81 2.57 2.07 -0.39 -2.82 116.25 117.42 1br1 h VAL 356 Ca 0.00 -1.50 0.16 0.00 0.82 0.00 0.00 66.70 66.18 1br1 h VAL 356 Cb 0.55 1.13 -0.10 0.00 -1.52 0.00 0.00 31.29 31.36 1br1 h VAL 356 CO 0.00 0.19 0.35 0.77 0.02 0.00 0.00 177.57 178.90 1br1 h SER 357 N -1.00 0.34 0.09 0.57 4.64 -0.27 0.13 113.55 118.05 1br1 h SER 357 Ca -0.06 0.12 0.02 0.00 -0.47 0.00 0.00 61.79 61.40 1br1 h SER 357 Cb 0.57 0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 62.70 1br1 h SER 357 CO -0.04 0.11 -0.46 0.77 -0.87 0.00 0.00 176.83 176.34 1br1 h SER 358 N 0.47 -1.38 0.00 4.97 4.64 -0.38 0.40 113.55 122.26 1br1 h SER 358 Ca 0.46 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 1br1 h SER 358 Cb 0.73 0.52 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1br1 h SER 358 CO -0.42 -0.51 0.11 0.52 -0.87 0.00 0.00 176.83 175.65 1br1 n VAL 359 N -5.47 1.03 -0.08 0.95 0.31 0.41 -1.65 118.33 113.83 1br1 n VAL 359 Ca -0.07 0.36 -0.13 0.00 -0.01 0.00 0.00 64.34 64.49 1br1 n VAL 359 Cb 0.39 -1.36 -0.07 0.00 -0.91 0.00 0.00 33.84 31.89 1br1 n VAL 359 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1br1 n LEU 360 N -1.22 2.53 -0.06 7.52 4.77 0.10 -4.61 117.00 126.03 1br1 n LEU 360 Ca 0.00 -0.01 -0.09 0.00 -0.03 0.00 0.00 56.01 55.88 1br1 n LEU 360 Cb 0.11 -0.54 -0.02 0.00 -2.33 0.00 0.00 43.42 40.64 1br1 n LEU 360 CO 0.00 0.66 0.93 -0.61 -1.33 0.00 0.00 177.39 177.04 1br1 h GLN 361 N -0.15 0.22 0.00 3.23 5.75 0.41 -0.84 115.11 123.73 1br1 h GLN 361 Ca -0.37 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.11 1br1 h GLN 361 Cb 1.51 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 30.00 1br1 h GLN 361 CO -0.11 0.15 0.12 -0.11 -2.65 0.00 0.00 178.83 176.23 1br1 n LEU 362 N -5.01 0.00 -0.01 -2.39 0.00 -0.85 0.19 117.00 108.94 1br1 n LEU 362 Ca -0.02 0.09 0.01 0.00 0.00 0.00 0.00 56.01 56.10 1br1 n LEU 362 Cb 0.07 -0.09 -0.12 0.00 0.00 0.00 0.00 43.42 43.28 1br1 n LEU 362 CO 0.30 -0.09 -0.64 0.61 0.00 0.00 0.00 177.39 177.58 1br1 n GLY 363 N -0.92 -1.11 0.23 -3.96 0.00 -0.32 -4.19 105.19 94.92 1br1 n GLY 363 Ca 0.00 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 1br1 n GLY 363 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1br1 h ASN 364 N 0.00 0.91 -0.90 1.61 2.35 0.20 -3.43 115.58 116.33 1br1 h ASN 364 Ca -0.21 -0.53 -0.76 0.00 -0.55 0.00 0.00 56.30 54.26 1br1 h ASN 364 Cb 1.54 -0.26 0.02 0.00 0.05 0.00 0.00 38.32 39.67 1br1 h ASN 364 CO 0.02 1.32 0.39 -0.38 -1.65 0.00 0.00 177.43 177.13 1br1 n ILE 365 N -3.97 0.00 -4.28 2.81 5.41 -1.21 -4.94 119.36 113.18 1br1 n ILE 365 Ca -0.05 0.00 -0.24 0.00 1.00 0.00 0.00 62.75 63.46 1br1 n ILE 365 Cb 0.67 -0.27 -0.08 0.00 -0.71 0.00 0.00 39.64 39.26 1br1 n ILE 365 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1br1 s VAL 366 N 1.60 3.46 -0.37 1.39 1.01 -1.26 -5.08 120.40 121.14 1br1 s VAL 366 Ca 0.89 -1.81 0.03 0.00 0.00 0.00 0.00 61.98 61.09 1br1 s VAL 366 Cb -1.26 -2.82 0.16 0.00 0.00 0.00 0.00 36.38 32.45 1br1 s VAL 366 CO 0.65 -0.31 0.37 -0.36 0.00 0.00 0.00 175.10 175.45 1br1 s PHE 367 N -2.16 -0.29 -0.06 5.22 0.08 -1.26 -4.55 117.98 114.97 1br1 s PHE 367 Ca 0.30 -0.82 -0.23 0.00 0.12 0.00 0.00 56.93 56.30 1br1 s PHE 367 Cb -0.07 -0.41 -0.04 0.00 -0.57 0.00 0.00 43.02 41.93 1br1 s PHE 367 CO 0.19 -0.97 0.69 0.21 -0.10 0.00 0.00 175.22 175.24 1br1 s LYS 368 N 1.45 4.43 0.95 0.44 2.20 -1.25 -4.79 119.74 123.17 1br1 s LYS 368 Ca 0.17 0.87 -0.15 0.00 -0.36 0.00 0.00 55.97 56.49 1br1 s LYS 368 Cb -0.15 -3.43 -0.08 0.00 -1.51 0.00 0.00 37.83 32.66 1br1 s LYS 368 CO -0.04 0.10 -0.29 1.17 -0.36 0.00 0.00 175.35 175.94 1br1 n LYS 369 N 3.64 -0.09 -3.69 4.03 3.00 -1.26 -2.93 118.16 120.85 1br1 n LYS 369 Ca -0.02 -0.01 -0.30 0.00 -0.00 0.00 0.00 58.31 57.98 1br1 n LYS 369 Cb 0.51 -1.35 -0.14 0.00 0.00 0.00 0.00 35.03 34.05 1br1 n LYS 369 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1br1 s GLU 370 N -2.59 0.79 0.00 1.64 -6.30 -1.26 -4.72 118.70 106.26 1br1 s GLU 370 Ca 0.48 -1.27 0.05 0.00 -2.50 0.00 0.00 54.97 51.73 1br1 s GLU 370 Cb -0.21 -1.96 0.28 0.00 0.00 0.00 0.00 34.13 32.25 1br1 s GLU 370 CO 0.76 -1.05 0.76 0.54 0.02 0.00 0.00 175.26 176.29 1br1 n ARG 371 N 4.51 0.15 -0.08 4.30 1.74 -1.26 0.40 116.66 126.42 1br1 n ARG 371 Ca 0.01 0.01 -0.08 0.00 -0.77 0.00 0.00 57.85 57.02 1br1 n ARG 371 Cb 0.40 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.31 1br1 n ARG 371 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1br1 n ASN 372 N -1.01 1.84 -0.10 0.55 3.02 -1.26 -4.69 115.26 113.62 1br1 n ASN 372 Ca 0.04 0.54 -0.10 0.00 -0.03 0.00 0.00 54.58 55.02 1br1 n ASN 372 Cb 0.02 -0.85 -0.15 0.00 -0.61 0.00 0.00 39.78 38.18 1br1 n ASN 372 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1br1 n THR 373 N -4.55 1.36 -1.69 3.41 -2.24 -1.05 -5.01 114.28 104.50 1br1 n THR 373 Ca -0.13 -0.81 0.00 0.00 -2.27 0.00 0.00 64.05 60.84 1br1 n THR 373 Cb 0.38 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1br1 n THR 373 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1br1 n ASP 374 N -2.78 -1.37 -3.64 3.42 8.00 1.32 -5.02 116.55 116.49 1br1 n ASP 374 Ca -0.33 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 54.88 1br1 n ASP 374 Cb 1.12 -0.48 -0.12 0.00 -0.02 0.00 0.00 41.12 41.63 1br1 n ASP 374 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1br1 s GLN 375 N -3.43 1.28 0.32 -1.24 1.11 -1.25 -4.61 119.66 111.85 1br1 s GLN 375 Ca 0.00 -2.14 -0.14 0.00 0.01 0.00 0.00 55.36 53.09 1br1 s GLN 375 Cb 0.00 -2.16 -0.11 0.00 -1.01 0.00 0.00 33.01 29.73 1br1 s GLN 375 CO 0.00 -1.24 -0.02 0.00 0.01 0.00 0.00 175.29 174.04 1br1 n ALA 376 N 3.22 -2.57 -3.70 6.09 0.00 -1.26 -4.67 120.51 117.63 1br1 n ALA 376 Ca 0.15 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1br1 n ALA 376 Cb 0.38 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1br1 n ALA 376 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1br1 n SER 377 N 1.72 1.66 -4.02 0.00 2.88 -1.15 -4.68 113.62 110.03 1br1 n SER 377 Ca 0.07 -0.84 -0.41 0.00 -1.33 0.00 0.00 58.87 56.36 1br1 n SER 377 Cb 0.31 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.76 1br1 n SER 377 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 1br1 n MET 378 N 0.00 3.85 0.24 -1.46 1.56 -1.26 -3.80 117.12 116.24 1br1 n MET 378 Ca 0.00 -4.54 0.16 0.00 -0.27 0.00 0.00 57.70 53.05 1br1 n MET 378 Cb 0.00 -2.48 0.84 0.00 2.15 0.00 0.00 33.22 33.73 1br1 n MET 378 CO 0.00 0.00 0.00 -1.35 -0.73 0.00 0.00 175.97 173.89 1br1 h PRO 379 N 5.62 0.00 -4.12 2.12 0.11 -1.96 -3.41 132.00 130.36 1br1 h PRO 379 Ca 0.19 0.00 -0.42 0.00 0.11 0.00 0.00 66.00 65.88 1br1 h PRO 379 Cb 0.70 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 31.47 1br1 h PRO 379 CO 1.15 0.00 -0.78 0.34 -0.21 0.00 0.00 178.00 178.51 1br1 s ASP 380 N -4.53 1.05 -0.11 -2.05 2.15 -1.26 -5.06 116.67 106.86 1br1 s ASP 380 Ca -0.03 -0.15 -0.05 0.00 0.43 0.00 0.00 52.55 52.74 1br1 s ASP 380 Cb 0.09 -0.50 -0.05 0.00 -0.30 0.00 0.00 42.92 42.17 1br1 s ASP 380 CO 0.30 -0.03 0.13 0.78 -0.17 0.00 0.00 175.17 176.18 1br1 h ASN 381 N 7.08 0.00 -0.09 -0.34 2.35 -2.01 -3.38 115.58 119.18 1br1 h ASN 381 Ca -0.37 -0.18 0.01 0.00 -0.55 0.00 0.00 56.30 55.21 1br1 h ASN 381 Cb 1.16 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.52 1br1 h ASN 381 CO 0.48 0.59 -0.05 0.35 -1.65 0.00 0.00 177.43 177.15 1br1 n THR 382 N -4.75 -0.06 0.00 2.81 -2.24 -1.26 0.92 114.28 109.71 1br1 n THR 382 Ca -0.02 0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 1br1 n THR 382 Cb 0.09 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1br1 n THR 382 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1br1 n ALA 383 N -3.94 0.00 0.25 6.98 0.00 -1.26 0.12 120.51 122.66 1br1 n ALA 383 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 1br1 n ALA 383 Cb 0.03 0.00 0.89 0.00 0.00 0.00 0.00 19.45 20.37 1br1 n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1br1 h ALA 384 N -2.91 1.57 0.09 0.00 0.00 -1.72 0.54 119.26 116.83 1br1 h ALA 384 Ca 0.00 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1br1 h ALA 384 Cb 0.00 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1br1 h ALA 384 CO 0.00 -0.28 -0.37 0.37 0.00 0.00 0.00 179.25 178.96 1br1 h GLN 385 N 0.00 -0.56 0.39 0.00 4.15 0.14 0.01 115.11 119.24 1br1 h GLN 385 Ca 0.06 0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.50 1br1 h GLN 385 Cb 0.50 0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.32 1br1 h GLN 385 CO -0.00 -0.38 -0.19 0.87 -1.93 0.00 0.00 178.83 177.21 1br1 h LYS 386 N -0.58 -0.50 -0.68 1.69 1.57 0.20 -3.23 116.57 115.03 1br1 h LYS 386 Ca 0.03 0.03 0.12 0.00 -1.87 0.00 0.00 60.65 58.97 1br1 h LYS 386 Cb 0.63 0.11 -0.12 0.00 0.08 0.00 0.00 32.23 32.94 1br1 h LYS 386 CO -0.24 -0.34 -0.22 0.28 -0.57 0.00 0.00 179.45 178.37 1br1 n VAL 387 N -3.53 -0.32 0.29 0.50 0.31 -0.88 0.18 118.33 114.87 1br1 n VAL 387 Ca -0.06 1.57 0.17 0.00 -0.01 0.00 0.00 64.34 66.00 1br1 n VAL 387 Cb 0.21 -2.12 0.83 0.00 -0.91 0.00 0.00 33.84 31.85 1br1 n VAL 387 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1br1 h HIS 389 N 0.00 0.35 0.00 0.00 6.17 0.18 -2.45 115.15 119.40 1br1 h HIS 389 Ca 0.00 -0.21 -0.04 0.00 0.71 0.00 0.00 60.37 60.83 1br1 h HIS 389 Cb 0.17 -0.03 -0.01 0.00 2.52 0.00 0.00 27.41 30.06 1br1 h HIS 389 CO 0.00 1.07 -0.17 -0.07 0.71 0.00 0.00 177.93 179.47 1br1 h LEU 390 N -0.47 0.00 -0.02 0.26 3.38 -1.19 -2.08 115.31 115.19 1br1 h LEU 390 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1br1 h LEU 390 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1br1 h LEU 390 CO 0.08 0.17 -0.11 0.23 0.09 0.00 0.00 178.44 178.90 1br1 n MET 391 N -3.84 0.11 -1.44 1.13 2.81 -0.81 -4.87 117.12 110.20 1br1 n MET 391 Ca -0.02 -0.02 -0.13 0.00 -1.81 0.00 0.00 57.70 55.72 1br1 n MET 391 Cb 0.27 -1.50 -0.05 0.00 -0.71 0.00 0.00 33.22 31.23 1br1 n MET 391 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1br1 n GLY 392 N 1.46 1.25 0.00 3.03 0.00 -0.78 -4.44 105.19 105.70 1br1 n GLY 392 Ca 0.08 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1br1 n GLY 392 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1br1 n ILE 393 N -2.74 0.00 -4.36 -0.61 -5.35 -0.93 0.02 119.36 105.39 1br1 n ILE 393 Ca -0.13 0.00 -0.20 0.00 -0.27 0.00 0.00 62.75 62.15 1br1 n ILE 393 Cb 0.44 -0.32 -0.13 0.00 -1.74 0.00 0.00 39.64 37.88 1br1 n ILE 393 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1br1 s ASN 394 N 0.05 1.59 0.00 7.28 3.84 -1.26 -4.69 114.94 121.76 1br1 s ASN 394 Ca 0.00 -0.43 0.00 0.00 0.21 0.00 0.00 52.86 52.64 1br1 s ASN 394 Cb 0.00 -0.11 0.00 0.00 -0.55 0.00 0.00 41.25 40.59 1br1 s ASN 394 CO 0.00 0.04 0.00 1.33 -2.79 0.00 0.00 177.10 175.68 1br1 n VAL 395 N 1.99 0.00 -0.09 -5.21 0.24 -1.26 -0.92 118.33 113.09 1br1 n VAL 395 Ca -0.18 0.34 -0.01 0.00 -2.04 0.00 0.00 64.34 62.45 1br1 n VAL 395 Cb 0.55 -1.18 -0.01 0.00 -1.47 0.00 0.00 33.84 31.73 1br1 n VAL 395 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1br1 n THR 396 N 0.00 -0.13 0.11 3.34 -2.24 -1.26 0.18 114.28 114.28 1br1 n THR 396 Ca 0.00 0.53 -0.06 0.00 -2.27 0.00 0.00 64.05 62.24 1br1 n THR 396 Cb 0.00 -0.67 -0.03 0.00 -2.10 0.00 0.00 70.33 67.52 1br1 n THR 396 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1br1 h ASP 397 N 0.00 -0.47 -0.85 3.42 3.32 -2.00 -0.71 116.42 119.14 1br1 h ASP 397 Ca 0.06 0.04 0.08 0.00 0.02 0.00 0.00 57.03 57.22 1br1 h ASP 397 Cb 0.11 0.15 -0.10 0.00 0.22 0.00 0.00 39.33 39.71 1br1 h ASP 397 CO -0.21 -0.23 -0.50 0.33 -1.72 0.00 0.00 179.24 176.90 1br1 n PHE 398 N -3.35 -0.37 -0.16 4.55 7.35 0.48 -1.10 117.46 124.85 1br1 n PHE 398 Ca -0.04 1.06 -0.08 0.00 -0.76 0.00 0.00 57.45 57.63 1br1 n PHE 398 Cb 0.16 -0.56 -0.06 0.00 0.35 0.00 0.00 39.48 39.36 1br1 n PHE 398 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 1br1 h THR 399 N 0.00 0.00 -0.10 -2.13 2.02 -0.07 1.10 112.91 113.73 1br1 h THR 399 Ca 0.14 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.33 1br1 h THR 399 Cb 0.35 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.72 1br1 h THR 399 CO -0.79 0.00 -0.26 -0.09 0.37 0.00 0.00 175.52 174.74 1br1 h ARG 400 N -0.14 -0.25 -0.95 6.66 2.43 -0.09 0.74 114.38 122.78 1br1 h ARG 400 Ca 0.07 0.02 0.30 0.00 -0.81 0.00 0.00 59.98 59.55 1br1 h ARG 400 Cb 0.32 0.06 -0.16 0.00 -0.42 0.00 0.00 29.97 29.77 1br1 h ARG 400 CO -0.45 -0.17 0.33 0.77 -1.51 0.00 0.00 179.97 178.94 1br1 h SER 401 N -0.26 0.08 0.62 -3.80 0.02 -0.29 2.56 113.55 112.47 1br1 h SER 401 Ca 0.02 0.22 -0.13 0.00 -0.84 0.00 0.00 61.79 61.06 1br1 h SER 401 Cb 0.32 0.28 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 1br1 h SER 401 CO -0.23 -0.25 -0.63 0.40 -1.14 0.00 0.00 176.83 174.98 1br1 h ILE 402 N 0.15 1.45 0.00 3.27 5.03 0.33 -3.35 117.51 124.40 1br1 h ILE 402 Ca 0.66 -2.16 -0.35 0.00 -0.12 0.00 0.00 64.86 62.89 1br1 h ILE 402 Cb 1.48 2.16 -0.05 0.00 -3.03 0.00 0.00 36.82 37.38 1br1 h ILE 402 CO -0.72 0.62 -2.14 0.18 -0.68 0.00 0.00 178.15 175.41 1br1 n LEU 403 N -3.79 1.83 -4.13 1.44 4.77 0.24 -4.69 117.00 112.67 1br1 n LEU 403 Ca -0.01 0.32 -0.37 0.00 -0.03 0.00 0.00 56.01 55.91 1br1 n LEU 403 Cb 0.63 -0.75 -0.10 0.00 -2.33 0.00 0.00 43.42 40.87 1br1 n LEU 403 CO 0.42 0.37 -0.01 0.42 -1.33 0.00 0.00 177.39 177.26 1br1 s THR 404 N -2.55 3.74 -0.53 -5.08 -4.23 0.81 -2.55 115.64 105.25 1br1 s THR 404 Ca -0.34 -2.52 -0.27 0.00 -1.18 0.00 0.00 61.69 57.38 1br1 s THR 404 Cb 0.12 -3.47 -0.04 0.00 1.34 0.00 0.00 72.50 70.45 1br1 s THR 404 CO 0.44 -0.82 2.02 -2.16 -0.54 0.00 0.00 174.62 173.57 1br1 s PRO 405 N 0.49 2.59 0.00 3.99 0.04 0.12 -3.91 135.00 138.31 1br1 s PRO 405 Ca 0.13 1.00 -0.01 0.00 0.04 0.00 0.00 61.00 62.16 1br1 s PRO 405 Cb -0.21 -4.42 -0.05 0.00 0.04 0.00 0.00 34.50 29.86 1br1 s PRO 405 CO -0.04 -2.75 1.68 0.54 0.04 0.00 0.00 177.00 176.48 1br1 n ARG 406 N 9.02 0.85 -0.26 4.56 5.12 -1.26 -2.21 116.66 132.48 1br1 n ARG 406 Ca 0.26 -0.18 -0.21 0.00 -1.93 0.00 0.00 57.85 55.79 1br1 n ARG 406 Cb 0.52 -1.35 0.20 0.00 -1.16 0.00 0.00 32.46 30.67 1br1 n ARG 406 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 1br1 n ILE 407 N 1.94 0.00 -3.01 0.55 -6.64 -1.25 -4.85 119.36 106.10 1br1 n ILE 407 Ca 0.08 0.00 -0.14 0.00 -1.77 0.00 0.00 62.75 60.91 1br1 n ILE 407 Cb 0.41 -0.66 -0.03 0.00 -1.44 0.00 0.00 39.64 37.92 1br1 n ILE 407 CO 0.00 0.00 0.00 1.17 -1.77 0.00 0.00 176.55 175.95 1br1 n LYS 408 N -3.73 0.49 -2.20 6.28 4.81 -1.26 -3.52 118.16 119.02 1br1 n LYS 408 Ca 0.09 -2.49 -0.36 0.00 -0.87 0.00 0.00 58.31 54.68 1br1 n LYS 408 Cb 0.40 -1.50 0.01 0.00 0.02 0.00 0.00 35.03 33.96 1br1 n LYS 408 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1br1 s VAL 409 N 0.33 3.01 0.00 3.15 1.01 -0.40 -4.76 120.40 122.74 1br1 s VAL 409 Ca 0.32 0.67 0.00 0.00 0.00 0.00 0.00 61.98 62.97 1br1 s VAL 409 Cb 0.07 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 33.15 1br1 s VAL 409 CO -0.14 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.48 1br1 n GLY 410 N 0.33 0.88 1.80 4.51 0.00 -1.26 0.26 105.19 111.71 1br1 n GLY 410 Ca 0.11 0.05 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 1br1 n GLY 410 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1br1 n ARG 411 N 5.17 1.78 -3.78 1.61 1.85 -1.26 -4.87 116.66 117.17 1br1 n ARG 411 Ca 0.00 -1.66 -0.13 0.00 -1.00 0.00 0.00 57.85 55.06 1br1 n ARG 411 Cb 0.00 -1.65 -0.10 0.00 -1.05 0.00 0.00 32.46 29.66 1br1 n ARG 411 CO 0.00 0.00 0.00 0.16 -0.01 0.00 0.00 177.63 177.78 1br1 s ASP 412 N -0.11 -0.24 -0.77 2.89 -4.77 0.14 -5.03 116.67 108.78 1br1 s ASP 412 Ca 0.32 0.35 -0.04 0.00 -3.30 0.00 0.00 52.55 49.88 1br1 s ASP 412 Cb 0.26 0.47 0.08 0.00 -1.09 0.00 0.00 42.92 42.64 1br1 s ASP 412 CO 0.02 -0.25 2.64 0.52 0.70 0.00 0.00 175.17 178.81 1br1 n VAL 413 N 2.20 4.04 -1.40 2.11 0.31 -1.26 -1.27 118.33 123.06 1br1 n VAL 413 Ca -0.17 -3.47 -0.12 0.00 -0.01 0.00 0.00 64.34 60.57 1br1 n VAL 413 Cb 0.57 -1.78 -0.11 0.00 -0.91 0.00 0.00 33.84 31.61 1br1 n VAL 413 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1br1 n VAL 414 N 1.21 0.00 -2.67 2.52 0.31 -1.23 -4.79 118.33 113.68 1br1 n VAL 414 Ca 0.54 -0.40 -0.42 0.00 -0.01 0.00 0.00 64.34 64.05 1br1 n VAL 414 Cb 0.44 -0.88 -0.03 0.00 -0.91 0.00 0.00 33.84 32.47 1br1 n VAL 414 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1br1 s GLN 415 N 7.26 4.41 0.26 5.55 2.00 -1.26 -3.83 119.66 134.06 1br1 s GLN 415 Ca 0.78 1.41 -0.05 0.00 -2.00 0.00 0.00 55.36 55.50 1br1 s GLN 415 Cb -0.29 -3.55 -0.01 0.00 0.80 0.00 0.00 33.01 29.95 1br1 s GLN 415 CO 0.23 -0.34 0.36 -1.59 -0.50 0.00 0.00 175.29 173.45 1br1 s LYS 416 N 2.08 1.55 -0.08 1.67 -2.85 -0.94 -5.00 119.74 116.17 1br1 s LYS 416 Ca 0.49 -1.54 0.01 0.00 -1.00 0.00 0.00 55.97 53.92 1br1 s LYS 416 Cb -0.19 0.39 0.02 0.00 -2.06 0.00 0.00 37.83 36.00 1br1 s LYS 416 CO 0.18 -0.61 -0.08 0.00 0.10 0.00 0.00 175.35 174.94 1br1 s ALA 417 N -3.78 1.09 0.98 0.59 0.00 -1.26 -0.70 121.76 118.69 1br1 s ALA 417 Ca 0.31 -0.34 -0.16 0.00 0.00 0.00 0.00 51.96 51.77 1br1 s ALA 417 Cb 0.02 -0.66 0.19 0.00 0.00 0.00 0.00 23.12 22.68 1br1 s ALA 417 CO 0.14 -0.13 1.23 -0.65 0.00 0.00 0.00 175.76 176.35 1br1 s GLN 418 N 1.17 0.51 -0.05 0.00 -0.21 -1.06 -4.99 119.66 115.04 1br1 s GLN 418 Ca -0.06 -0.16 -0.03 0.00 0.02 0.00 0.00 55.36 55.14 1br1 s GLN 418 Cb -0.14 -1.81 -0.04 0.00 1.00 0.00 0.00 33.01 32.02 1br1 s GLN 418 CO -0.02 -2.54 0.10 0.95 -2.12 0.00 0.00 175.29 171.66 1br1 s THR 419 N -3.57 4.95 0.00 -0.19 -4.23 -1.26 -4.65 115.64 106.68 1br1 s THR 419 Ca 0.70 -0.20 0.00 0.00 -1.18 0.00 0.00 61.69 61.01 1br1 s THR 419 Cb -0.08 -3.22 0.00 0.00 1.34 0.00 0.00 72.50 70.55 1br1 s THR 419 CO 0.53 0.45 0.00 1.17 -0.54 0.00 0.00 174.62 176.23 1br1 n LYS 420 N 1.49 0.00 0.00 3.99 0.00 -1.26 0.18 118.16 122.56 1br1 n LYS 420 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 58.31 58.15 1br1 n LYS 420 Cb 0.53 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.56 1br1 n LYS 420 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1br1 h GLU 421 N 0.00 -0.02 -1.25 1.64 3.07 -1.94 -1.07 114.58 115.01 1br1 h GLU 421 Ca 0.00 0.00 0.37 0.00 -0.50 0.00 0.00 59.36 59.23 1br1 h GLU 421 Cb 0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 27.82 1br1 h GLU 421 CO 0.00 -0.01 0.84 1.96 -1.40 0.00 0.00 179.01 180.40 1br1 h GLN 422 N -0.02 0.16 0.00 2.33 4.20 0.15 1.73 115.11 123.65 1br1 h GLN 422 Ca 0.00 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1br1 h GLN 422 Cb 0.02 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 27.77 1br1 h GLN 422 CO -0.01 0.11 -0.00 0.00 -0.67 0.00 0.00 178.83 178.25 1br1 h ALA 423 N 1.51 1.04 0.00 3.87 0.00 0.10 -2.66 119.26 123.12 1br1 h ALA 423 Ca 0.69 -0.00 -0.29 0.00 0.00 0.00 0.00 54.91 55.31 1br1 h ALA 423 Cb 2.24 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.98 1br1 h ALA 423 CO -0.24 0.01 -1.95 -0.25 0.00 0.00 0.00 179.25 176.82 1br1 n ASP 424 N -3.15 1.27 0.33 0.00 9.92 0.57 -3.60 116.55 121.88 1br1 n ASP 424 Ca -0.02 0.22 0.05 0.00 -0.53 0.00 0.00 54.79 54.51 1br1 n ASP 424 Cb 0.12 -0.53 0.28 0.00 -0.64 0.00 0.00 41.12 40.35 1br1 n ASP 424 CO 0.00 0.00 0.00 0.15 0.13 0.00 0.00 177.20 177.48 1br1 h PHE 425 N -0.64 0.00 0.00 1.24 3.04 -0.84 1.50 116.94 121.24 1br1 h PHE 425 Ca -0.44 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.51 1br1 h PHE 425 Cb 1.37 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.88 1br1 h PHE 425 CO -0.07 0.00 -0.53 0.00 -2.02 0.00 0.00 178.31 175.69 1br1 n ALA 426 N -1.63 0.47 0.23 2.41 0.00 -1.01 -2.23 120.51 118.75 1br1 n ALA 426 Ca -0.01 -0.47 0.17 0.00 0.00 0.00 0.00 53.44 53.13 1br1 n ALA 426 Cb 0.78 0.02 0.75 0.00 0.00 0.00 0.00 19.45 20.99 1br1 n ALA 426 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1br1 h ILE 427 N -0.81 0.15 0.00 0.00 6.09 -0.89 0.43 117.51 122.48 1br1 h ILE 427 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1br1 h ILE 427 Cb 0.53 0.62 0.00 0.00 0.47 0.00 0.00 36.82 38.44 1br1 h ILE 427 CO 0.00 0.00 -0.04 -0.08 -3.07 0.00 0.00 178.15 174.96 1br1 h GLU 428 N 0.00 0.00 0.00 2.19 4.22 0.18 -3.19 114.58 117.98 1br1 h GLU 428 Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.53 1br1 h GLU 428 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.17 1br1 h GLU 428 CO -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 179.01 176.83 1br1 n ALA 429 N -2.31 1.64 -0.08 2.92 0.00 -0.87 -0.91 120.51 120.90 1br1 n ALA 429 Ca -0.01 -0.01 -0.07 0.00 0.00 0.00 0.00 53.44 53.36 1br1 n ALA 429 Cb 0.02 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.43 1br1 n ALA 429 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1br1 n LEU 430 N -0.65 1.87 -0.03 0.00 7.94 0.15 -3.67 117.00 122.60 1br1 n LEU 430 Ca 0.01 0.48 -0.08 0.00 -1.11 0.00 0.00 56.01 55.31 1br1 n LEU 430 Cb 0.00 -0.81 -0.03 0.00 0.53 0.00 0.00 43.42 43.12 1br1 n LEU 430 CO 0.01 -0.37 0.81 0.00 -1.11 0.00 0.00 177.39 176.73 1br1 h ALA 431 N -1.00 0.10 -1.12 1.96 0.00 -1.31 0.53 119.26 118.41 1br1 h ALA 431 Ca 0.00 0.07 0.33 0.00 0.00 0.00 0.00 54.91 55.31 1br1 h ALA 431 Cb 0.75 0.18 -0.11 0.00 0.00 0.00 0.00 17.79 18.61 1br1 h ALA 431 CO 0.00 -0.50 0.71 -0.22 0.00 0.00 0.00 179.25 179.24 1br1 h LYS 432 N -0.04 0.28 0.00 0.00 3.64 -1.23 0.50 116.57 119.72 1br1 h LYS 432 Ca 0.10 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 1br1 h LYS 432 Cb 0.18 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1br1 h LYS 432 CO -0.22 0.19 -1.48 0.00 -2.27 0.00 0.00 179.45 175.67 1br1 n ALA 433 N -2.45 2.46 0.22 5.00 0.00 -0.45 -3.59 120.51 121.70 1br1 n ALA 433 Ca 0.30 -0.44 0.06 0.00 0.00 0.00 0.00 53.44 53.36 1br1 n ALA 433 Cb 1.07 -0.91 0.49 0.00 0.00 0.00 0.00 19.45 20.09 1br1 n ALA 433 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1br1 h LYS 434 N 0.00 0.00 0.46 0.00 3.64 0.47 -2.34 116.57 118.81 1br1 h LYS 434 Ca -0.06 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1br1 h LYS 434 Cb 1.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1br1 h LYS 434 CO 0.01 0.25 -0.22 0.35 -2.27 0.00 0.00 179.45 177.57 1br1 h PHE 435 N 0.00 -0.58 -1.23 1.91 3.57 -0.93 -3.11 116.94 116.57 1br1 h PHE 435 Ca -0.00 -0.01 0.36 0.00 3.53 0.00 0.00 57.97 61.84 1br1 h PHE 435 Cb 0.49 0.19 -0.09 0.00 2.79 0.00 0.00 35.95 39.34 1br1 h PHE 435 CO 0.00 -0.36 0.83 1.49 -2.23 0.00 0.00 178.31 178.04 1br1 h GLU 436 N -0.84 0.16 0.00 1.11 4.81 -1.59 2.86 114.58 121.09 1br1 h GLU 436 Ca -0.06 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1br1 h GLU 436 Cb 0.48 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.82 1br1 h GLU 436 CO 0.10 0.11 -0.03 0.00 -0.73 0.00 0.00 179.01 178.46 1br1 h ARG 437 N 0.16 0.00 0.00 1.92 2.47 -1.35 -2.20 114.38 115.38 1br1 h ARG 437 Ca 0.67 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 59.36 1br1 h ARG 437 Cb 2.18 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 30.50 1br1 h ARG 437 CO -0.21 0.03 -0.26 1.25 0.56 0.00 0.00 179.97 181.33 1br1 h LEU 438 N 0.00 0.00 -0.18 3.04 5.85 0.52 -3.17 115.31 121.36 1br1 h LEU 438 Ca -0.00 -0.35 0.02 0.00 0.84 0.00 0.00 57.88 58.40 1br1 h LEU 438 Cb 0.18 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1br1 h LEU 438 CO 0.00 0.82 -0.26 0.15 -0.34 0.00 0.00 178.44 178.82 1br1 h PHE 439 N -1.00 -0.79 -0.91 1.25 3.57 -1.22 0.48 116.94 118.32 1br1 h PHE 439 Ca -0.05 0.04 0.26 0.00 3.53 0.00 0.00 57.97 61.75 1br1 h PHE 439 Cb 0.55 0.37 -0.04 0.00 2.79 0.00 0.00 35.95 39.62 1br1 h PHE 439 CO 0.05 -0.23 0.82 0.00 -2.23 0.00 0.00 178.31 176.73 1br1 h ARG 440 N -0.19 0.00 0.19 1.11 2.47 -1.60 -0.25 114.38 116.11 1br1 h ARG 440 Ca 0.03 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.74 1br1 h ARG 440 Cb 0.28 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.60 1br1 h ARG 440 CO -0.27 0.00 -0.09 2.35 0.56 0.00 0.00 179.97 182.51 1br1 h TRP 441 N 0.00 -0.24 -0.17 3.04 7.01 -0.13 -3.18 115.95 122.28 1br1 h TRP 441 Ca 0.43 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.47 1br1 h TRP 441 Cb 2.08 0.08 -0.07 0.00 -2.10 0.00 0.00 29.16 29.15 1br1 h TRP 441 CO 0.00 0.03 -0.40 0.82 -2.79 0.00 0.00 178.44 176.11 1br1 h ILE 442 N -1.01 0.17 -0.63 2.65 1.08 0.16 0.47 117.51 120.41 1br1 h ILE 442 Ca -0.03 0.00 0.18 0.00 -0.39 0.00 0.00 64.86 64.63 1br1 h ILE 442 Cb 0.38 0.17 -0.03 0.00 -3.07 0.00 0.00 36.82 34.28 1br1 h ILE 442 CO 0.04 0.00 0.87 0.25 -0.69 0.00 0.00 178.15 178.62 1br1 h LEU 443 N -0.45 0.00 -0.24 1.44 6.46 -1.20 2.76 115.31 124.08 1br1 h LEU 443 Ca 0.09 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.85 1br1 h LEU 443 Cb 0.60 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.53 1br1 h LEU 443 CO -0.41 0.00 -0.85 0.35 -0.62 0.00 0.00 178.44 176.91 1br1 n THR 444 N -3.28 0.00 0.02 1.05 -2.24 0.08 -2.20 114.28 107.71 1br1 n THR 444 Ca 0.13 -0.06 -0.22 0.00 -2.27 0.00 0.00 64.05 61.63 1br1 n THR 444 Cb 1.08 1.02 -0.14 0.00 -2.10 0.00 0.00 70.33 70.19 1br1 n THR 444 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1br1 h ARG 445 N 0.59 0.28 0.55 -0.78 2.47 0.54 -2.91 114.38 115.12 1br1 h ARG 445 Ca 0.00 -0.48 -0.03 0.00 -1.26 0.00 0.00 59.98 58.21 1br1 h ARG 445 Cb 0.56 0.18 0.01 0.00 -1.65 0.00 0.00 29.97 29.07 1br1 h ARG 445 CO 0.00 1.23 -0.26 0.28 0.56 0.00 0.00 179.97 181.78 1br1 h VAL 446 N -0.16 0.40 0.00 2.04 2.07 -0.38 -2.40 116.25 117.83 1br1 h VAL 446 Ca -0.33 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 66.94 1br1 h VAL 446 Cb 1.88 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 32.15 1br1 h VAL 446 CO 0.09 0.04 0.00 0.59 0.02 0.00 0.00 177.57 178.31 1br1 n ASN 447 N -5.34 0.00 0.11 0.57 3.02 -0.93 -1.25 115.26 111.43 1br1 n ASN 447 Ca -0.12 0.31 0.04 0.00 -0.03 0.00 0.00 54.58 54.79 1br1 n ASN 447 Cb 0.33 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 1br1 n ASN 447 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1br1 h LYS 448 N 0.00 0.00 0.01 3.52 1.63 -1.21 -3.28 116.57 117.24 1br1 h LYS 448 Ca 0.00 0.00 -0.40 0.00 -0.85 0.00 0.00 60.65 59.40 1br1 h LYS 448 Cb 0.01 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.58 1br1 h LYS 448 CO 0.00 0.31 -2.23 0.00 -3.45 0.00 0.00 179.45 174.08 1br1 n ALA 449 N -2.26 1.13 0.00 5.00 0.00 -0.38 -4.12 120.51 119.87 1br1 n ALA 449 Ca -0.02 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.48 1br1 n ALA 449 Cb 0.72 -0.10 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1br1 n ALA 449 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1br1 n LEU 450 N -4.08 0.00 -3.92 0.00 4.77 -1.01 -4.93 117.00 107.83 1br1 n LEU 450 Ca -0.47 0.27 -0.10 0.00 -0.03 0.00 0.00 56.01 55.68 1br1 n LEU 450 Cb 0.87 -0.27 -0.12 0.00 -2.33 0.00 0.00 43.42 41.57 1br1 n LEU 450 CO 0.13 -0.27 -0.32 -0.62 -1.33 0.00 0.00 177.39 174.97 1br1 s ASP 451 N -2.49 0.10 0.00 -1.43 -1.08 -1.23 0.30 116.67 110.83 1br1 s ASP 451 Ca 0.00 -0.24 0.00 0.00 -0.52 0.00 0.00 52.55 51.79 1br1 s ASP 451 Cb 0.00 0.11 0.00 0.00 -1.46 0.00 0.00 42.92 41.57 1br1 s ASP 451 CO 0.00 -0.20 0.88 0.00 0.52 0.00 0.00 175.17 176.37 1br1 n ALA 458 N 2.15 0.96 -2.58 3.66 0.00 -1.20 -4.95 120.51 118.54 1br1 n ALA 458 Ca -0.19 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.12 1br1 n ALA 458 Cb 0.57 -0.90 -0.11 0.00 0.00 0.00 0.00 19.45 19.01 1br1 n ALA 458 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1br1 s SER 459 N -2.76 1.03 -0.04 0.00 1.04 -0.92 -4.95 113.70 107.10 1br1 s SER 459 Ca 0.00 -0.73 -0.05 0.00 0.48 0.00 0.00 55.95 55.64 1br1 s SER 459 Cb 0.00 0.05 0.01 0.00 0.10 0.00 0.00 66.02 66.18 1br1 s SER 459 CO 0.00 -0.30 0.14 0.72 0.98 0.00 0.00 173.24 174.78 1br1 s PHE 460 N -2.25 -0.10 -0.11 5.02 -0.12 -1.26 0.22 117.98 119.38 1br1 s PHE 460 Ca -0.01 0.25 -0.01 0.00 -0.05 0.00 0.00 56.93 57.11 1br1 s PHE 460 Cb -0.04 0.03 -0.03 0.00 -0.63 0.00 0.00 43.02 42.35 1br1 s PHE 460 CO -0.01 -0.12 -0.07 -1.17 -0.05 0.00 0.00 175.22 173.80 1br1 s LEU 461 N -0.26 3.13 -0.17 -1.99 2.96 0.72 -2.97 118.68 120.10 1br1 s LEU 461 Ca -0.03 -0.11 -0.03 0.00 -0.22 0.00 0.00 54.13 53.73 1br1 s LEU 461 Cb -0.03 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.93 1br1 s LEU 461 CO 0.00 0.25 -0.05 -0.83 -1.32 0.00 0.00 176.35 174.41 1br1 s GLY 462 N -0.16 1.66 -0.21 7.98 0.00 0.37 -1.50 107.32 115.45 1br1 s GLY 462 Ca 0.02 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 43.80 1br1 s GLY 462 CO 0.03 0.07 -0.13 -0.42 0.00 0.00 0.00 173.10 172.64 1br1 s ILE 463 N 0.72 2.43 -0.27 0.90 1.01 -0.60 0.22 121.20 125.60 1br1 s ILE 463 Ca -0.02 -1.02 -0.07 0.00 0.00 0.00 0.00 60.65 59.54 1br1 s ILE 463 Cb -0.15 -2.15 -0.01 0.00 0.01 0.00 0.00 42.46 40.17 1br1 s ILE 463 CO 0.02 0.36 0.06 -0.22 0.00 0.00 0.00 174.94 175.16 1br1 s LEU 464 N 1.29 3.59 -0.66 2.97 2.96 -0.53 -1.53 118.68 126.76 1br1 s LEU 464 Ca 0.02 -0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 1br1 s LEU 464 Cb -0.15 -1.88 0.17 0.00 0.50 0.00 0.00 46.19 44.83 1br1 s LEU 464 CO -0.09 -0.12 0.47 -0.62 -1.32 0.00 0.00 176.35 174.68 1br1 s ASP 465 N 1.54 5.14 0.48 3.68 2.15 0.13 -2.79 116.67 127.00 1br1 s ASP 465 Ca 0.04 -3.14 -0.02 0.00 0.43 0.00 0.00 52.55 49.86 1br1 s ASP 465 Cb -0.16 -1.80 -0.01 0.00 -0.30 0.00 0.00 42.92 40.65 1br1 s ASP 465 CO 0.02 -0.28 0.74 0.27 -0.17 0.00 0.00 175.17 175.75 1br1 s ILE 466 N -0.48 4.17 0.23 4.11 -5.25 -1.26 0.69 121.20 123.41 1br1 s ILE 466 Ca 0.20 -0.24 -0.30 0.00 -0.99 0.00 0.00 60.65 59.32 1br1 s ILE 466 Cb -0.18 -3.58 -0.09 0.00 2.95 0.00 0.00 42.46 41.57 1br1 s ILE 466 CO -0.05 -0.48 1.09 0.00 -1.79 0.00 0.00 174.94 173.70 1br1 s ALA 467 N -2.68 3.39 0.33 2.27 0.00 -1.26 -4.88 121.76 118.93 1br1 s ALA 467 Ca 0.49 0.84 -0.18 0.00 0.00 0.00 0.00 51.96 53.10 1br1 s ALA 467 Cb -0.10 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.59 1br1 s ALA 467 CO 0.41 -0.16 0.81 0.20 0.00 0.00 0.00 175.76 177.02 1br1 s GLY 468 N -0.53 2.45 -0.38 0.00 0.00 -1.26 -4.76 107.32 102.83 1br1 s GLY 468 Ca 0.47 0.20 -0.36 0.00 0.00 0.00 0.00 44.72 45.03 1br1 s GLY 468 CO 0.37 0.48 1.23 0.33 0.00 0.00 0.00 173.10 175.51 1br1 n PHE 469 N -0.13 1.34 -4.03 1.90 -0.00 -1.26 -4.11 117.46 111.16 1br1 n PHE 469 Ca 0.03 0.87 -0.15 0.00 -0.00 0.00 0.00 57.45 58.20 1br1 n PHE 469 Cb 0.53 -1.71 -0.15 0.00 -0.00 0.00 0.00 39.48 38.15 1br1 n PHE 469 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.76 174.93 1br1 s GLU 470 N 2.34 0.28 -0.35 -4.13 -1.05 -1.26 -1.71 118.70 112.82 1br1 s GLU 470 Ca 0.80 -0.08 0.04 0.00 -0.15 0.00 0.00 54.97 55.58 1br1 s GLU 470 Cb -1.15 -0.30 0.16 0.00 -0.44 0.00 0.00 34.13 32.40 1br1 s GLU 470 CO 0.62 0.03 0.43 0.96 0.95 0.00 0.00 175.26 178.26 1br1 s ILE 471 N 0.14 -0.55 0.00 1.83 -4.36 -1.26 -4.82 121.20 112.18 1br1 s ILE 471 Ca -0.01 -0.59 0.00 0.00 -0.26 0.00 0.00 60.65 59.79 1br1 s ILE 471 Cb -0.04 -0.64 0.00 0.00 1.25 0.00 0.00 42.46 43.03 1br1 s ILE 471 CO -0.00 -0.38 0.00 0.49 0.24 0.00 0.00 174.94 175.28 1br1 n PHE 472 N 4.62 0.00 -0.03 1.37 3.72 -1.26 -5.06 117.46 120.82 1br1 n PHE 472 Ca 0.08 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.46 1br1 n PHE 472 Cb 0.49 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.02 1br1 n PHE 472 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1br1 h GLU 473 N 0.00 0.00 -6.28 -1.08 4.39 -2.00 -3.44 114.58 106.17 1br1 h GLU 473 Ca 0.00 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.12 1br1 h GLU 473 Cb 0.00 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.56 1br1 h GLU 473 CO 0.00 0.00 0.78 0.42 -1.16 0.00 0.00 179.01 179.05 1br1 s ILE 474 N -1.47 4.21 -1.23 3.13 1.01 -1.26 -4.94 121.20 120.65 1br1 s ILE 474 Ca -0.05 0.68 -0.07 0.00 0.00 0.00 0.00 60.65 61.21 1br1 s ILE 474 Cb 0.01 -4.62 0.20 0.00 0.01 0.00 0.00 42.46 38.06 1br1 s ILE 474 CO 0.08 -1.18 1.91 0.59 0.00 0.00 0.00 174.94 176.33 1br1 n ASN 475 N 7.91 6.22 -3.17 3.58 3.02 -1.26 -4.97 115.26 126.58 1br1 n ASN 475 Ca 0.06 -3.23 -0.14 0.00 -0.03 0.00 0.00 54.58 51.24 1br1 n ASN 475 Cb 0.48 -1.38 0.14 0.00 -0.61 0.00 0.00 39.78 38.41 1br1 n ASN 475 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1br1 n SER 476 N 2.53 -2.87 0.22 6.41 2.88 -1.26 -2.39 113.62 119.14 1br1 n SER 476 Ca 0.42 -0.41 -0.15 0.00 -1.33 0.00 0.00 58.87 57.41 1br1 n SER 476 Cb 0.32 -0.51 -0.07 0.00 -0.75 0.00 0.00 64.21 63.20 1br1 n SER 476 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1br1 h PHE 477 N -2.69 -0.85 -0.91 0.66 3.57 -1.92 -2.88 116.94 111.92 1br1 h PHE 477 Ca -0.18 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.42 1br1 h PHE 477 Cb 0.61 0.32 -0.12 0.00 2.79 0.00 0.00 35.95 39.56 1br1 h PHE 477 CO 0.00 -0.46 -0.48 0.39 -2.23 0.00 0.00 178.31 175.53 1br1 n GLU 478 N -5.44 -0.35 0.18 1.11 4.71 -1.26 0.32 120.64 119.92 1br1 n GLU 478 Ca -0.10 1.38 0.18 0.00 -0.01 0.00 0.00 57.16 58.61 1br1 n GLU 478 Cb 0.34 -2.03 0.81 0.00 -1.01 0.00 0.00 31.44 29.55 1br1 n GLU 478 CO 0.00 0.00 0.00 1.96 0.09 0.00 0.00 177.13 179.18 1br1 h GLN 479 N 0.00 0.00 -0.03 3.49 7.50 -1.85 0.41 115.11 124.63 1br1 h GLN 479 Ca 0.19 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 59.26 1br1 h GLN 479 Cb 0.42 0.00 0.01 0.00 0.05 0.00 0.00 27.48 27.95 1br1 h GLN 479 CO -0.86 0.00 -0.29 1.25 -1.50 0.00 0.00 178.83 177.42 1br1 h LEU 480 N 0.00 0.31 -0.40 1.46 5.85 0.54 -1.75 115.31 121.32 1br1 h LEU 480 Ca 0.12 -0.71 -0.18 0.00 0.84 0.00 0.00 57.88 57.94 1br1 h LEU 480 Cb 0.72 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.66 1br1 h LEU 480 CO -0.00 0.97 -0.69 0.00 -0.34 0.00 0.00 178.44 178.38 1br1 h ILE 482 N 0.34 0.22 0.00 0.00 2.04 -1.01 0.19 117.51 119.29 1br1 h ILE 482 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1br1 h ILE 482 Cb 1.27 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1br1 h ILE 482 CO 0.12 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.86 1br1 n ASN 483 N -5.55 0.00 0.07 1.72 4.13 -0.66 -1.94 115.26 113.03 1br1 n ASN 483 Ca -0.15 0.37 -0.04 0.00 1.68 0.00 0.00 54.58 56.44 1br1 n ASN 483 Cb 0.42 -0.43 -0.02 0.00 -1.54 0.00 0.00 39.78 38.22 1br1 n ASN 483 CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 1br1 h TYR 484 N 0.00 -0.24 -0.70 3.10 3.20 -0.05 -2.74 116.97 119.53 1br1 h TYR 484 Ca 0.00 -0.01 0.15 0.00 3.14 0.00 0.00 58.73 62.01 1br1 h TYR 484 Cb 0.18 0.08 -0.10 0.00 1.54 0.00 0.00 36.73 38.43 1br1 h TYR 484 CO 0.00 -0.15 0.16 1.15 -1.64 0.00 0.00 178.16 177.68 1br1 h THR 485 N -0.99 0.55 -0.67 1.81 2.02 -0.34 0.38 112.91 115.66 1br1 h THR 485 Ca -0.03 -0.09 0.08 0.00 0.77 0.00 0.00 66.41 67.14 1br1 h THR 485 Cb 0.20 0.26 -0.06 0.00 -1.74 0.00 0.00 68.15 66.80 1br1 h THR 485 CO 0.04 0.05 0.34 0.78 0.37 0.00 0.00 175.52 177.10 1br1 h ASN 486 N 0.27 0.46 -0.11 4.18 -0.26 -1.49 0.85 115.58 119.47 1br1 h ASN 486 Ca 0.39 0.05 -0.11 0.00 -0.56 0.00 0.00 56.30 56.07 1br1 h ASN 486 Cb 0.64 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.85 1br1 h ASN 486 CO -0.48 0.28 -0.29 -0.08 -1.06 0.00 0.00 177.43 175.80 1br1 h GLU 487 N 0.60 0.58 0.56 0.81 4.57 -0.44 -2.46 114.58 118.80 1br1 h GLU 487 Ca 0.32 -0.24 -0.03 0.00 -1.18 0.00 0.00 59.36 58.23 1br1 h GLU 487 Cb 0.30 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.87 1br1 h GLU 487 CO -0.24 0.81 -0.28 0.87 -1.18 0.00 0.00 179.01 178.99 1br1 h LYS 488 N 0.50 -0.74 -0.49 1.92 1.79 0.31 -2.89 116.57 116.98 1br1 h LYS 488 Ca 0.06 0.05 0.10 0.00 -2.18 0.00 0.00 60.65 58.68 1br1 h LYS 488 Cb 0.75 0.17 -0.10 0.00 -1.58 0.00 0.00 32.23 31.47 1br1 h LYS 488 CO 0.06 -0.49 -0.27 1.25 -1.08 0.00 0.00 179.45 178.91 1br1 h LEU 489 N -0.77 -0.94 -0.58 2.94 7.12 0.50 -1.80 115.31 121.80 1br1 h LEU 489 Ca -0.08 0.19 0.11 0.00 0.13 0.00 0.00 57.88 58.24 1br1 h LEU 489 Cb 0.59 0.48 -0.11 0.00 -0.53 0.00 0.00 40.66 41.08 1br1 h LEU 489 CO 0.12 -0.28 -0.25 -0.61 -0.13 0.00 0.00 178.44 177.29 1br1 h GLN 490 N -0.16 -0.10 -0.65 1.25 5.75 -1.45 0.78 115.11 120.53 1br1 h GLN 490 Ca 0.22 0.01 0.18 0.00 -0.15 0.00 0.00 58.65 58.90 1br1 h GLN 490 Cb 0.51 0.02 -0.03 0.00 1.07 0.00 0.00 27.48 29.05 1br1 h GLN 490 CO -0.58 -0.06 0.46 0.37 -2.65 0.00 0.00 178.83 176.36 1br1 h GLN 491 N -0.10 0.05 0.01 1.69 5.75 -1.11 0.98 115.11 122.39 1br1 h GLN 491 Ca 0.26 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.75 1br1 h GLN 491 Cb 0.51 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.05 1br1 h GLN 491 CO -0.64 0.04 -0.00 1.25 -2.65 0.00 0.00 178.83 176.82 1br1 h LEU 492 N 0.06 -0.01 -0.92 -2.39 5.85 0.86 0.10 115.31 118.86 1br1 h LEU 492 Ca 0.31 -0.02 0.06 0.00 0.84 0.00 0.00 57.88 59.07 1br1 h LEU 492 Cb 1.15 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.12 1br1 h LEU 492 CO -0.02 0.01 0.58 0.15 -0.34 0.00 0.00 178.44 178.82 1br1 h PHE 493 N -0.03 1.08 -0.75 1.25 3.57 -0.53 -0.79 116.94 120.76 1br1 h PHE 493 Ca -0.00 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 1br1 h PHE 493 Cb 0.02 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 38.37 1br1 h PHE 493 CO -0.07 0.57 0.38 -0.91 -2.23 0.00 0.00 178.31 176.05 1br1 h ASN 494 N 1.08 0.96 0.65 0.41 -0.26 -0.70 0.03 115.58 117.75 1br1 h ASN 494 Ca 0.39 -0.12 -0.03 0.00 -0.56 0.00 0.00 56.30 55.98 1br1 h ASN 494 Cb 0.14 -0.25 0.01 0.00 -1.06 0.00 0.00 38.32 37.16 1br1 h ASN 494 CO -0.16 0.80 -0.31 -0.74 -1.06 0.00 0.00 177.43 175.96 1br1 h HIS 495 N 1.04 -0.81 0.00 1.19 2.76 0.13 -1.46 115.15 118.00 1br1 h HIS 495 Ca 0.26 -0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.40 1br1 h HIS 495 Cb 0.08 0.27 -0.00 0.00 1.55 0.00 0.00 27.41 29.31 1br1 h HIS 495 CO 0.00 -0.51 -0.03 1.79 -1.30 0.00 0.00 177.93 177.89 1br1 h THR 496 N -1.14 0.28 0.09 6.26 1.35 -1.24 0.32 112.91 118.84 1br1 h THR 496 Ca -0.09 -0.18 -0.29 0.00 -0.55 0.00 0.00 66.41 65.30 1br1 h THR 496 Cb 0.67 1.14 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 1br1 h THR 496 CO 0.15 0.03 -1.51 -0.03 -0.25 0.00 0.00 175.52 173.91 1br1 h MET 497 N 0.00 0.19 0.00 4.72 -1.53 -0.94 -3.37 114.93 114.01 1br1 h MET 497 Ca -0.00 -0.32 -0.13 0.00 -3.44 0.00 0.00 59.70 55.81 1br1 h MET 497 Cb 0.13 0.12 -0.02 0.00 -0.55 0.00 0.00 31.60 31.29 1br1 h MET 497 CO 0.00 1.16 -1.41 1.19 0.14 0.00 0.00 176.91 177.99 1br1 n PHE 498 N -3.94 0.00 0.04 1.39 3.72 -0.56 -4.60 117.46 113.51 1br1 n PHE 498 Ca -0.28 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.10 1br1 n PHE 498 Cb 0.88 -0.28 -0.01 0.00 -0.94 0.00 0.00 39.48 39.13 1br1 n PHE 498 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1br1 h ILE 499 N -0.29 0.00 -0.13 4.37 2.04 -1.33 -3.00 117.51 119.17 1br1 h ILE 499 Ca -0.20 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.71 1br1 h ILE 499 Cb 1.15 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.16 1br1 h ILE 499 CO -0.12 0.00 -0.29 -0.07 0.00 0.00 0.00 178.15 177.67 1br1 h LEU 500 N -0.10 -0.91 -0.76 1.44 3.38 -0.64 -2.80 115.31 114.92 1br1 h LEU 500 Ca -0.01 0.14 0.17 0.00 0.09 0.00 0.00 57.88 58.27 1br1 h LEU 500 Cb 0.08 0.39 -0.12 0.00 0.09 0.00 0.00 40.66 41.10 1br1 h LEU 500 CO 0.01 -0.34 0.11 -0.08 0.09 0.00 0.00 178.44 178.23 1br1 h GLU 501 N -0.36 0.18 0.00 1.13 4.57 -1.72 -0.16 114.58 118.22 1br1 h GLU 501 Ca 0.10 -0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.17 1br1 h GLU 501 Cb 0.52 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 1br1 h GLU 501 CO -0.34 0.12 -0.45 1.96 -1.18 0.00 0.00 179.01 179.12 1br1 h GLN 502 N 0.19 0.00 -0.11 1.92 4.20 -1.35 -3.14 115.11 116.82 1br1 h GLN 502 Ca 0.43 0.00 0.01 0.00 0.06 0.00 0.00 58.65 59.15 1br1 h GLN 502 Cb 0.77 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 1br1 h GLN 502 CO -0.59 0.45 0.02 0.93 -0.67 0.00 0.00 178.83 178.97 1br1 h GLU 503 N 0.00 0.06 0.00 1.46 4.39 -0.78 -2.22 114.58 117.49 1br1 h GLU 503 Ca -0.00 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 1br1 h GLU 503 Cb 0.95 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.58 1br1 h GLU 503 CO 0.06 0.04 -0.07 1.49 -1.16 0.00 0.00 179.01 179.36 1br1 h GLU 504 N 0.06 0.00 -0.60 2.33 4.57 -1.49 0.30 114.58 119.75 1br1 h GLU 504 Ca 0.05 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.13 1br1 h GLU 504 Cb 0.04 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 1br1 h GLU 504 CO -0.07 0.07 -0.01 1.88 -1.18 0.00 0.00 179.01 179.71 1br1 h TYR 505 N 0.00 1.17 0.59 0.92 0.05 -1.38 -1.80 116.97 116.52 1br1 h TYR 505 Ca -0.00 -0.21 -0.03 0.00 0.05 0.00 0.00 58.73 58.54 1br1 h TYR 505 Cb 0.15 -0.30 0.01 0.00 1.01 0.00 0.00 36.73 37.59 1br1 h TYR 505 CO 0.00 1.03 -0.28 1.96 -1.05 0.00 0.00 178.16 179.82 1br1 h GLN 506 N 0.98 -0.76 -0.65 4.88 4.20 -0.10 -1.94 115.11 121.70 1br1 h GLN 506 Ca 0.17 0.05 0.06 0.00 0.06 0.00 0.00 58.65 58.99 1br1 h GLN 506 Cb 0.57 0.17 -0.09 0.00 0.30 0.00 0.00 27.48 28.44 1br1 h GLN 506 CO 0.03 -0.46 -0.45 0.00 -0.67 0.00 0.00 178.83 177.28 1br1 h ARG 507 N -1.11 -0.08 0.00 1.46 3.08 -0.47 1.07 114.38 118.33 1br1 h ARG 507 Ca -0.08 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1br1 h ARG 507 Cb 0.65 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.72 1br1 h ARG 507 CO 0.13 -0.05 0.00 0.93 -1.07 0.00 0.00 179.97 179.91 1br1 h GLU 508 N -0.08 0.00 -4.32 0.04 4.39 -1.43 -3.47 114.58 109.72 1br1 h GLU 508 Ca 0.11 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.61 1br1 h GLU 508 Cb 0.35 0.00 0.11 0.00 -0.10 0.00 0.00 28.75 29.11 1br1 h GLU 508 CO -0.66 0.00 -0.49 0.41 -1.16 0.00 0.00 179.01 177.11 1br1 n GLY 509 N -0.96 -0.13 3.91 -3.84 0.00 0.37 -2.37 105.19 102.17 1br1 n GLY 509 Ca -0.01 -0.03 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 1br1 n GLY 509 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1br1 s ILE 510 N -3.23 5.01 -0.76 -0.61 -4.36 -0.77 -4.87 121.20 111.60 1br1 s ILE 510 Ca 0.07 -0.04 -0.26 0.00 -0.26 0.00 0.00 60.65 60.17 1br1 s ILE 510 Cb -0.01 -3.81 -0.11 0.00 1.25 0.00 0.00 42.46 39.79 1br1 s ILE 510 CO 0.45 -0.54 2.29 -0.70 0.24 0.00 0.00 174.94 176.69 1br1 s GLU 511 N -4.09 1.89 -0.10 0.37 2.12 -1.26 -4.84 118.70 112.78 1br1 s GLU 511 Ca 0.44 0.46 -0.11 0.00 0.36 0.00 0.00 54.97 56.12 1br1 s GLU 511 Cb -0.10 -4.80 0.03 0.00 0.26 0.00 0.00 34.13 29.52 1br1 s GLU 511 CO 0.35 -4.02 0.31 -0.46 -0.54 0.00 0.00 175.26 170.91 1br1 s TRP 512 N 13.29 -0.32 -0.02 5.30 -0.11 -1.26 -5.15 118.94 130.67 1br1 s TRP 512 Ca 0.88 0.76 0.05 0.00 1.22 0.00 0.00 56.10 59.00 1br1 s TRP 512 Cb -0.12 0.11 -0.03 0.00 -1.50 0.00 0.00 33.47 31.93 1br1 s TRP 512 CO 0.09 -0.20 -0.15 0.54 -4.62 0.00 0.00 176.95 172.61 1br1 s ASN 513 N -0.05 4.00 0.93 5.86 6.03 -1.26 -4.98 114.94 125.47 1br1 s ASN 513 Ca -0.02 -0.26 -0.10 0.00 -1.03 0.00 0.00 52.86 51.44 1br1 s ASN 513 Cb -0.03 -0.79 0.15 0.00 -3.03 0.00 0.00 41.25 37.56 1br1 s ASN 513 CO 0.01 0.31 1.12 0.12 -2.03 0.00 0.00 177.10 176.64 1br1 s PHE 514 N -0.81 1.70 -0.09 1.54 2.19 -1.26 -5.05 117.98 116.20 1br1 s PHE 514 Ca 0.13 1.67 -0.04 0.00 0.33 0.00 0.00 56.93 59.03 1br1 s PHE 514 Cb -0.11 -3.27 0.05 0.00 -1.31 0.00 0.00 43.02 38.38 1br1 s PHE 514 CO 0.03 -2.83 0.18 0.42 1.83 0.00 0.00 175.22 174.84 1br1 s ILE 515 N -2.66 -0.21 -0.56 3.12 1.09 -1.26 -5.11 121.20 115.60 1br1 s ILE 515 Ca 0.66 0.28 -0.19 0.00 -1.10 0.00 0.00 60.65 60.30 1br1 s ILE 515 Cb -0.22 -0.31 0.08 0.00 -1.06 0.00 0.00 42.46 40.95 1br1 s ILE 515 CO 0.59 0.12 0.70 -0.62 -0.10 0.00 0.00 174.94 175.62 1br1 s ASP 516 N 1.95 6.20 0.00 3.58 2.15 -1.26 -4.88 116.67 124.42 1br1 s ASP 516 Ca -0.01 -1.15 0.30 0.00 0.43 0.00 0.00 52.55 52.11 1br1 s ASP 516 Cb -0.12 -2.31 1.72 0.00 -0.30 0.00 0.00 42.92 41.91 1br1 s ASP 516 CO -0.06 -1.06 2.10 0.49 -0.17 0.00 0.00 175.17 176.47 1br1 n PHE 517 N 6.41 0.00 -3.57 -5.34 3.72 -1.26 -4.93 117.46 112.49 1br1 n PHE 517 Ca -0.07 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.11 1br1 n PHE 517 Cb 0.44 -0.07 0.02 0.00 -0.94 0.00 0.00 39.48 38.92 1br1 n PHE 517 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1br1 n GLY 518 N 0.96 -1.17 2.54 1.37 0.00 -1.26 -4.98 105.19 102.65 1br1 n GLY 518 Ca 0.20 0.51 -0.26 0.00 0.00 0.00 0.00 46.02 46.47 1br1 n GLY 518 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1br1 s LEU 519 N -5.31 0.68 -0.09 0.99 1.43 -1.26 -5.11 118.68 110.01 1br1 s LEU 519 Ca 0.18 -1.95 -0.07 0.00 -1.03 0.00 0.00 54.13 51.27 1br1 s LEU 519 Cb -0.07 -0.16 0.03 0.00 0.03 0.00 0.00 46.19 46.02 1br1 s LEU 519 CO 0.85 -0.31 0.22 -0.62 0.23 0.00 0.00 176.35 176.72 1br1 s ASP 520 N 1.27 -0.23 -0.01 2.29 -1.08 -1.26 -4.85 116.67 112.80 1br1 s ASP 520 Ca 0.17 0.45 0.01 0.00 -0.52 0.00 0.00 52.55 52.65 1br1 s ASP 520 Cb -0.21 0.42 0.01 0.00 -1.46 0.00 0.00 42.92 41.68 1br1 s ASP 520 CO -0.04 -0.10 0.82 0.18 0.52 0.00 0.00 175.17 176.56 1br1 n LEU 521 N 3.35 1.23 -0.28 -1.34 4.77 -1.26 -4.79 117.00 118.68 1br1 n LEU 521 Ca -0.17 -1.29 -0.03 0.00 -0.03 0.00 0.00 56.01 54.49 1br1 n LEU 521 Cb 0.57 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.66 1br1 n LEU 521 CO 0.18 0.32 0.61 -0.61 -1.33 0.00 0.00 177.39 176.56 1br1 h GLN 522 N 0.00 -0.09 -0.02 3.23 5.75 -1.95 -1.27 115.11 120.75 1br1 h GLN 522 Ca 0.00 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1br1 h GLN 522 Cb 0.73 0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.30 1br1 h GLN 522 CO 0.00 -0.06 -0.01 -1.35 -2.65 0.00 0.00 178.83 174.76 1br1 h PRO 523 N -0.09 -0.00 0.00 -2.39 0.10 -2.00 0.69 132.00 128.30 1br1 h PRO 523 Ca 0.28 0.00 0.00 0.00 0.10 0.00 0.00 66.00 66.38 1br1 h PRO 523 Cb 0.57 0.00 0.00 0.00 0.10 0.00 0.00 31.00 31.67 1br1 h PRO 523 CO -0.81 -0.00 0.29 0.00 0.10 0.00 0.00 178.00 177.58 1br1 h ILE 525 N 0.00 0.73 -0.49 0.00 2.04 0.84 -3.37 117.51 117.25 1br1 h ILE 525 Ca 0.00 -2.29 0.07 0.00 1.00 0.00 0.00 64.86 63.64 1br1 h ILE 525 Cb 0.58 2.41 -0.06 0.00 -0.74 0.00 0.00 36.82 39.02 1br1 h ILE 525 CO 0.00 0.69 0.17 -0.33 0.00 0.00 0.00 178.15 178.68 1br1 h GLU 526 N -0.30 0.33 0.00 2.37 4.39 0.11 2.76 114.58 124.23 1br1 h GLU 526 Ca -0.40 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.28 1br1 h GLU 526 Cb 1.78 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 30.36 1br1 h GLU 526 CO -0.01 0.22 0.24 -0.11 -1.16 0.00 0.00 179.01 178.18 1br1 n LEU 527 N -5.02 0.16 0.00 1.33 0.00 -0.88 -2.05 117.00 110.55 1br1 n LEU 527 Ca 0.05 0.43 0.00 0.00 0.00 0.00 0.00 56.01 56.49 1br1 n LEU 527 Cb 0.20 -0.40 0.00 0.00 0.00 0.00 0.00 43.42 43.22 1br1 n LEU 527 CO 0.24 -0.48 -0.00 0.00 0.00 0.00 0.00 177.39 177.15 1br1 n ILE 528 N -1.66 0.00 -0.04 1.96 3.06 0.17 0.11 119.36 122.98 1br1 n ILE 528 Ca -0.00 -0.01 -0.04 0.00 -2.50 0.00 0.00 62.75 60.19 1br1 n ILE 528 Cb 0.25 0.90 -0.01 0.00 0.54 0.00 0.00 39.64 41.32 1br1 n ILE 528 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 1br1 n GLU 529 N -0.03 0.23 -1.29 9.51 2.13 0.90 -3.54 120.64 128.56 1br1 n GLU 529 Ca 0.00 0.09 -0.44 0.00 0.66 0.00 0.00 57.16 57.47 1br1 n GLU 529 Cb 0.00 -0.87 -0.03 0.00 0.27 0.00 0.00 31.44 30.81 1br1 n GLU 529 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1br1 n ARG 530 N -3.45 0.00 0.00 5.31 3.00 -1.04 -4.68 116.66 115.81 1br1 n ARG 530 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.79 1br1 n ARG 530 Cb 0.23 -0.93 0.00 0.00 0.00 0.00 0.00 32.46 31.76 1br1 n ARG 530 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1br1 n PRO 531 N 0.97 0.00 -0.36 -0.14 -0.04 -1.26 -0.46 135.00 133.70 1br1 n PRO 531 Ca 0.16 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.31 1br1 n PRO 531 Cb 0.25 0.00 0.29 0.00 -0.04 0.00 0.00 33.50 34.00 1br1 n PRO 531 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1br1 s THR 532 N 0.29 1.10 0.08 0.52 -4.23 -1.26 -3.43 115.64 108.72 1br1 s THR 532 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 1br1 s THR 532 Cb 0.00 -2.08 0.00 0.00 1.34 0.00 0.00 72.50 71.76 1br1 s THR 532 CO 0.00 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 174.67 1br1 n ASN 533 N -5.72 -6.12 -4.18 3.99 3.02 -1.26 -4.20 115.26 100.79 1br1 n ASN 533 Ca 0.14 0.39 -0.44 0.00 -0.03 0.00 0.00 54.58 54.64 1br1 n ASN 533 Cb 0.61 -1.12 -0.13 0.00 -0.61 0.00 0.00 39.78 38.53 1br1 n ASN 533 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1br1 n PRO 534 N -2.40 0.00 -0.72 3.52 -0.01 -1.26 -4.79 135.00 129.33 1br1 n PRO 534 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 63.50 63.18 1br1 n PRO 534 Cb 0.17 -1.42 0.16 0.00 -0.01 0.00 0.00 33.50 32.40 1br1 n PRO 534 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 175.50 173.19 1br1 n PRO 535 N 7.76 -0.39 -4.11 0.52 -0.02 -1.22 -4.61 135.00 132.92 1br1 n PRO 535 Ca 0.59 -0.05 -0.23 0.00 -2.02 0.00 0.00 63.50 61.80 1br1 n PRO 535 Cb 0.01 -2.28 -0.04 0.00 -0.02 0.00 0.00 33.50 31.17 1br1 n PRO 535 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1br1 s GLY 536 N -2.48 1.45 0.30 -1.23 0.00 0.39 -4.80 107.32 100.96 1br1 s GLY 536 Ca 0.65 -1.39 0.05 0.00 0.00 0.00 0.00 44.72 44.04 1br1 s GLY 536 CO 0.59 -1.42 1.66 -2.08 0.00 0.00 0.00 173.10 171.85 1br1 h VAL 537 N 1.58 0.33 -0.52 1.40 2.07 -0.50 0.22 116.25 120.82 1br1 h VAL 537 Ca -0.48 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 66.89 1br1 h VAL 537 Cb 1.23 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1br1 h VAL 537 CO 0.61 0.05 0.12 -0.07 0.02 0.00 0.00 177.57 178.29 1br1 h LEU 538 N 0.26 0.80 -0.03 2.57 3.38 -1.83 -3.02 115.31 117.44 1br1 h LEU 538 Ca 0.60 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 58.33 1br1 h LEU 538 Cb 1.23 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1br1 h LEU 538 CO -0.63 0.83 -0.16 0.00 0.09 0.00 0.00 178.44 178.57 1br1 h ALA 539 N 1.00 -0.59 -0.09 1.53 0.00 -0.83 -2.29 119.26 117.98 1br1 h ALA 539 Ca 0.16 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1br1 h ALA 539 Cb 0.35 0.68 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1br1 h ALA 539 CO 0.00 -0.65 -0.18 -0.07 0.00 0.00 0.00 179.25 178.36 1br1 h LEU 540 N -0.18 -0.59 -0.16 0.00 3.38 -1.52 0.27 115.31 116.51 1br1 h LEU 540 Ca 0.01 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1br1 h LEU 540 Cb 0.21 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1br1 h LEU 540 CO -0.12 -0.14 0.42 -0.11 0.09 0.00 0.00 178.44 178.57 1br1 n LEU 541 N -3.54 0.06 -0.08 1.67 7.94 -1.14 -1.15 117.00 120.76 1br1 n LEU 541 Ca -0.02 0.24 -0.12 0.00 -1.11 0.00 0.00 56.01 55.01 1br1 n LEU 541 Cb 0.12 -0.18 -0.07 0.00 0.53 0.00 0.00 43.42 43.81 1br1 n LEU 541 CO 0.01 -0.26 -0.21 0.44 -1.11 0.00 0.00 177.39 176.26 1br1 h ASP 542 N 0.00 0.00 -0.00 1.96 3.32 0.14 -3.28 116.42 118.56 1br1 h ASP 542 Ca 0.00 -0.36 -0.03 0.00 0.02 0.00 0.00 57.03 56.66 1br1 h ASP 542 Cb 0.84 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.39 1br1 h ASP 542 CO 0.00 1.01 -0.11 1.05 -1.72 0.00 0.00 179.24 179.47 1br1 h GLU 543 N -1.00 0.08 0.00 3.56 9.09 -1.12 -3.01 114.58 122.18 1br1 h GLU 543 Ca -0.12 -0.09 0.00 0.00 0.05 0.00 0.00 59.36 59.20 1br1 h GLU 543 Cb 0.79 0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.91 1br1 h GLU 543 CO -0.07 0.83 0.07 0.39 0.05 0.00 0.00 179.01 180.27 1br1 n GLU 544 N -4.62 0.00 0.03 1.06 -0.58 -0.30 0.26 120.64 116.48 1br1 n GLU 544 Ca -0.09 0.30 0.12 0.00 -0.42 0.00 0.00 57.16 57.07 1br1 n GLU 544 Cb 0.43 -1.57 0.16 0.00 -0.57 0.00 0.00 31.44 29.90 1br1 n GLU 544 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1br1 n TRP 546 N -1.89 3.82 -3.50 0.00 8.01 0.71 -4.94 117.44 119.64 1br1 n TRP 546 Ca 0.04 -3.75 0.00 0.00 -1.31 0.00 0.00 57.50 52.49 1br1 n TRP 546 Cb 0.41 -0.62 -0.04 0.00 -2.01 0.00 0.00 31.31 29.05 1br1 n TRP 546 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.69 176.80 1br1 s PHE 547 N -3.60 -1.01 0.06 -5.99 5.36 -1.26 -5.03 117.98 106.51 1br1 s PHE 547 Ca 0.47 1.72 -0.13 0.00 -0.96 0.00 0.00 56.93 58.02 1br1 s PHE 547 Cb 0.26 0.59 -0.04 0.00 -0.34 0.00 0.00 43.02 43.49 1br1 s PHE 547 CO -0.13 -0.50 1.23 -1.00 -1.46 0.00 0.00 175.22 173.35 1br1 h PRO 548 N 7.75 -0.09 -2.26 10.12 0.13 -1.92 -2.83 132.00 142.90 1br1 h PRO 548 Ca -0.17 0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.91 1br1 h PRO 548 Cb 1.11 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 1br1 h PRO 548 CO 0.09 -0.06 0.02 1.63 -0.23 0.00 0.00 178.00 179.45 1br1 n LYS 549 N -3.87 0.81 -4.27 0.86 5.02 -1.26 -4.72 118.16 110.72 1br1 n LYS 549 Ca -0.00 -0.29 -0.17 0.00 -2.02 0.00 0.00 58.31 55.82 1br1 n LYS 549 Cb 0.13 -1.53 -0.14 0.00 -0.02 0.00 0.00 35.03 33.47 1br1 n LYS 549 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1br1 s ALA 550 N 1.51 0.76 0.04 7.82 0.00 -1.07 -5.01 121.76 125.81 1br1 s ALA 550 Ca 0.19 -0.53 -0.04 0.00 0.00 0.00 0.00 51.96 51.58 1br1 s ALA 550 Cb 0.09 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 1br1 s ALA 550 CO 0.00 0.14 0.06 0.95 0.00 0.00 0.00 175.76 176.92 1br1 s THR 551 N -0.57 0.15 0.22 0.00 -4.23 -1.26 -4.95 115.64 105.00 1br1 s THR 551 Ca 0.00 -1.22 0.01 0.00 -1.18 0.00 0.00 61.69 59.31 1br1 s THR 551 Cb -0.05 -0.98 0.30 0.00 1.34 0.00 0.00 72.50 73.11 1br1 s THR 551 CO 0.00 -0.67 1.11 0.47 -0.54 0.00 0.00 174.62 174.99 1br1 n ASP 552 N 0.68 -0.09 0.08 3.99 8.00 -1.26 0.22 116.55 128.17 1br1 n ASP 552 Ca -0.18 1.20 -0.04 0.00 0.71 0.00 0.00 54.79 56.48 1br1 n ASP 552 Cb 0.59 -0.44 -0.02 0.00 -0.02 0.00 0.00 41.12 41.23 1br1 n ASP 552 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1br1 h THR 553 N 0.00 0.00 -0.79 -3.53 2.02 -1.93 -0.12 112.91 108.56 1br1 h THR 553 Ca 0.43 0.00 0.20 0.00 0.77 0.00 0.00 66.41 67.81 1br1 h THR 553 Cb 0.88 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 67.14 1br1 h THR 553 CO -0.67 0.00 -0.05 -1.54 0.37 0.00 0.00 175.52 173.64 1br1 n SER 554 N -2.81 -0.15 0.00 4.18 3.41 0.59 -0.02 113.62 118.82 1br1 n SER 554 Ca -0.03 1.35 0.00 0.00 -0.26 0.00 0.00 58.87 59.93 1br1 n SER 554 Cb 0.10 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 1br1 n SER 554 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1br1 n PHE 555 N -5.17 0.00 -0.34 7.33 7.35 0.30 -1.63 117.46 125.30 1br1 n PHE 555 Ca 0.17 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.87 1br1 n PHE 555 Cb 0.55 -0.43 0.06 0.00 0.35 0.00 0.00 39.48 40.01 1br1 n PHE 555 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1br1 n VAL 556 N -2.17 -0.44 -0.16 -2.13 0.31 0.98 0.91 118.33 115.61 1br1 n VAL 556 Ca 0.00 2.08 -0.02 0.00 -0.01 0.00 0.00 64.34 66.39 1br1 n VAL 556 Cb 0.00 -2.79 0.07 0.00 -0.91 0.00 0.00 33.84 30.21 1br1 n VAL 556 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1br1 h GLU 557 N 0.00 0.16 -0.62 5.55 4.39 -1.05 0.74 114.58 123.74 1br1 h GLU 557 Ca 0.35 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 60.00 1br1 h GLU 557 Cb 0.57 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.16 1br1 h GLU 557 CO -0.90 0.11 0.24 -0.22 -1.16 0.00 0.00 179.01 177.07 1br1 h LYS 558 N 0.17 0.94 -0.59 2.33 3.64 0.15 -1.45 116.57 121.75 1br1 h LYS 558 Ca 0.26 -0.18 0.12 0.00 -1.27 0.00 0.00 60.65 59.58 1br1 h LYS 558 Cb 0.38 -0.15 -0.11 0.00 -0.41 0.00 0.00 32.23 31.95 1br1 h LYS 558 CO -0.39 0.81 -0.10 1.25 -2.27 0.00 0.00 179.45 178.75 1br1 h LEU 559 N 0.88 -0.45 -1.41 5.20 5.85 0.61 1.36 115.31 127.36 1br1 h LEU 559 Ca 0.21 0.17 0.02 0.00 0.84 0.00 0.00 57.88 59.11 1br1 h LEU 559 Cb 0.23 0.33 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 1br1 h LEU 559 CO -0.01 -0.17 0.42 0.40 -0.34 0.00 0.00 178.44 178.74 1br1 h ILE 560 N 0.04 1.12 0.09 4.05 1.08 0.69 -2.77 117.51 121.80 1br1 h ILE 560 Ca 0.29 -0.27 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1br1 h ILE 560 Cb 0.46 0.25 -0.02 0.00 -3.07 0.00 0.00 36.82 34.44 1br1 h ILE 560 CO -0.57 0.15 -0.21 -0.61 -0.69 0.00 0.00 178.15 176.21 1br1 h GLN 561 N 0.80 -0.32 0.00 2.37 -0.00 0.28 -1.46 115.11 116.78 1br1 h GLN 561 Ca 0.24 0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.92 1br1 h GLN 561 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 27.48 27.56 1br1 h GLN 561 CO -0.06 -0.21 0.00 0.39 0.00 0.00 0.00 178.83 178.94 1br1 n GLU 562 N -3.65 0.00 0.00 1.69 -0.58 -0.66 -4.38 120.64 113.06 1br1 n GLU 562 Ca -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 1br1 n GLU 562 Cb 0.17 -0.90 0.00 0.00 -0.57 0.00 0.00 31.44 30.15 1br1 n GLU 562 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1br1 n GLN 563 N -0.44 0.00 0.00 3.49 3.00 -1.06 -4.60 117.38 117.76 1br1 n GLN 563 Ca 0.00 0.42 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 1br1 n GLN 563 Cb 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 30.24 29.01 1br1 n GLN 563 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1br1 n GLY 564 N -0.83 0.00 1.87 1.08 0.00 -0.55 -2.36 105.19 104.40 1br1 n GLY 564 Ca 0.00 0.32 0.03 0.00 0.00 0.00 0.00 46.02 46.38 1br1 n GLY 564 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1br1 n ASN 565 N 0.40 5.33 -4.69 1.61 2.04 -1.26 -4.65 115.26 114.03 1br1 n ASN 565 Ca 0.00 -2.96 -0.42 0.00 -0.44 0.00 0.00 54.58 50.76 1br1 n ASN 565 Cb 0.00 -0.69 -0.03 0.00 -2.53 0.00 0.00 39.78 36.53 1br1 n ASN 565 CO 0.00 0.00 0.00 -2.28 -0.44 0.00 0.00 177.26 174.54 1br1 s HIS 566 N -2.73 2.23 0.61 -2.53 2.46 -0.99 -4.81 115.29 109.53 1br1 s HIS 566 Ca 0.52 0.09 0.25 0.00 0.47 0.00 0.00 55.06 56.40 1br1 s HIS 566 Cb 0.40 -4.10 1.05 0.00 -0.13 0.00 0.00 32.58 29.80 1br1 s HIS 566 CO 0.15 -4.51 1.49 0.00 -2.47 0.00 0.00 174.74 169.39 1br1 h ALA 567 N 8.53 2.54 -0.33 1.58 0.00 -1.93 1.50 119.26 131.16 1br1 h ALA 567 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1br1 h ALA 567 Cb 1.21 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1br1 h ALA 567 CO 0.94 -1.29 0.00 1.63 0.00 0.00 0.00 179.25 180.53 1br1 n LYS 568 N -3.28 2.26 -4.21 0.00 4.76 -1.26 -4.91 118.16 111.51 1br1 n LYS 568 Ca 0.15 -1.98 -0.24 0.00 -2.87 0.00 0.00 58.31 53.37 1br1 n LYS 568 Cb 1.16 -1.35 -0.06 0.00 -1.84 0.00 0.00 35.03 32.93 1br1 n LYS 568 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1br1 s PHE 569 N -1.10 2.88 -0.23 2.13 5.36 0.51 -0.82 117.98 126.71 1br1 s PHE 569 Ca 0.27 -0.16 -0.27 0.00 -0.96 0.00 0.00 56.93 55.82 1br1 s PHE 569 Cb 0.15 -1.32 0.09 0.00 -0.34 0.00 0.00 43.02 41.61 1br1 s PHE 569 CO 0.21 0.56 0.85 -1.14 -1.46 0.00 0.00 175.22 174.24 1br1 s GLN 570 N -3.48 0.74 0.29 10.12 0.74 -0.78 -4.66 119.66 122.63 1br1 s GLN 570 Ca 0.31 0.66 -0.14 0.00 0.05 0.00 0.00 55.36 56.24 1br1 s GLN 570 Cb -0.08 0.35 -0.08 0.00 1.10 0.00 0.00 33.01 34.30 1br1 s GLN 570 CO 0.21 -0.13 0.68 -1.59 -0.55 0.00 0.00 175.29 173.91 1br1 s LYS 571 N -0.08 3.95 0.00 1.67 -2.85 -1.26 -0.05 119.74 121.12 1br1 s LYS 571 Ca -0.01 0.56 0.00 0.00 -1.00 0.00 0.00 55.97 55.53 1br1 s LYS 571 Cb -0.04 -2.50 0.00 0.00 -2.06 0.00 0.00 37.83 33.23 1br1 s LYS 571 CO 0.00 0.21 0.00 -1.13 0.10 0.00 0.00 175.35 174.53 1br1 n SER 572 N -0.27 -1.77 -3.51 0.03 3.41 -1.22 -4.75 113.62 105.53 1br1 n SER 572 Ca 0.02 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.23 1br1 n SER 572 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1br1 n SER 572 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1br1 n LYS 573 N -1.77 4.77 -4.15 4.33 4.01 -1.26 -4.72 118.16 119.38 1br1 n LYS 573 Ca 0.00 -3.70 -0.29 0.00 -0.51 0.00 0.00 58.31 53.80 1br1 n LYS 573 Cb 0.00 -2.60 -0.06 0.00 -0.51 0.00 0.00 35.03 31.86 1br1 n LYS 573 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1br1 n GLN 574 N 1.37 -1.87 -2.46 1.97 6.02 -1.26 -4.85 117.38 116.30 1br1 n GLN 574 Ca 0.59 0.22 -0.15 0.00 -0.01 0.00 0.00 57.00 57.65 1br1 n GLN 574 Cb 0.25 -3.93 0.03 0.00 1.02 0.00 0.00 30.24 27.61 1br1 n GLN 574 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1br1 n LEU 575 N -4.53 3.33 0.00 1.08 4.32 -1.26 -4.74 117.00 115.20 1br1 n LEU 575 Ca -0.31 -4.20 0.06 0.00 -0.02 0.00 0.00 56.01 51.54 1br1 n LEU 575 Cb 0.69 -0.00 0.31 0.00 -1.62 0.00 0.00 43.42 42.79 1br1 n LEU 575 CO 0.80 1.75 0.60 2.29 -1.22 0.00 0.00 177.39 181.61 1br1 n LYS 576 N -0.51 0.24 -0.15 3.23 -0.00 -1.26 0.88 118.16 120.60 1br1 n LYS 576 Ca 0.26 0.11 -0.09 0.00 -0.00 0.00 0.00 58.31 58.59 1br1 n LYS 576 Cb 0.83 -1.50 -0.01 0.00 -0.00 0.00 0.00 35.03 34.35 1br1 n LYS 576 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.40 177.78 1br1 h ASP 577 N 0.00 0.64 1.07 -5.58 3.04 -1.99 -1.34 116.42 112.26 1br1 h ASP 577 Ca 0.00 -0.24 -0.05 0.00 -3.24 0.00 0.00 57.03 53.51 1br1 h ASP 577 Cb 0.06 -0.17 -0.01 0.00 -1.04 0.00 0.00 39.33 38.18 1br1 h ASP 577 CO 0.00 0.71 -0.96 0.11 -2.04 0.00 0.00 179.24 177.06 1br1 h LYS 578 N 0.54 0.00 -5.42 4.15 1.57 -1.32 -3.50 116.57 112.60 1br1 h LYS 578 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1br1 h LYS 578 Cb 0.32 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1br1 h LYS 578 CO 0.00 0.10 -1.02 0.25 -0.57 0.00 0.00 179.45 178.21 1br1 n THR 579 N -2.81 -9.79 -4.31 -0.16 -2.24 0.25 -4.32 114.28 90.91 1br1 n THR 579 Ca -0.02 1.60 -0.18 0.00 -2.27 0.00 0.00 64.05 63.18 1br1 n THR 579 Cb 0.63 -6.00 -0.10 0.00 -2.10 0.00 0.00 70.33 62.76 1br1 n THR 579 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1br1 s GLU 580 N -1.41 1.21 0.17 -0.78 -1.05 -1.23 -2.84 118.70 112.77 1br1 s GLU 580 Ca -0.02 -1.48 -0.00 0.00 -0.15 0.00 0.00 54.97 53.32 1br1 s GLU 580 Cb 0.00 -1.00 -0.04 0.00 -0.44 0.00 0.00 34.13 32.65 1br1 s GLU 580 CO 0.61 0.17 0.07 -0.59 0.95 0.00 0.00 175.26 176.46 1br1 s PHE 581 N -2.80 1.09 0.15 4.83 -0.71 -0.57 -3.44 117.98 116.54 1br1 s PHE 581 Ca 0.18 -1.21 0.08 0.00 -1.04 0.00 0.00 56.93 54.94 1br1 s PHE 581 Cb -0.01 -0.60 -0.04 0.00 -1.21 0.00 0.00 43.02 41.16 1br1 s PHE 581 CO 0.05 -0.46 -0.18 0.00 -1.34 0.00 0.00 175.22 173.29 1br1 s ILE 583 N -1.92 -0.02 -1.05 0.00 -4.36 -1.16 -1.86 121.20 110.83 1br1 s ILE 583 Ca 0.14 0.06 -0.20 0.00 -0.26 0.00 0.00 60.65 60.39 1br1 s ILE 583 Cb -0.06 -0.30 0.10 0.00 1.25 0.00 0.00 42.46 43.44 1br1 s ILE 583 CO 0.06 0.02 1.37 -0.76 0.24 0.00 0.00 174.94 175.87 1br1 s LEU 584 N 0.53 4.31 0.00 0.37 1.43 -0.00 -3.27 118.68 122.05 1br1 s LEU 584 Ca -0.04 -2.01 0.00 0.00 -1.03 0.00 0.00 54.13 51.06 1br1 s LEU 584 Cb -0.05 -2.49 0.00 0.00 0.03 0.00 0.00 46.19 43.68 1br1 s LEU 584 CO -0.03 -1.20 0.00 1.41 0.23 0.00 0.00 176.35 176.76 1br1 n HIS 585 N 7.55 -2.15 -0.02 0.29 8.25 -0.90 -4.90 115.22 123.34 1br1 n HIS 585 Ca 0.32 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.65 1br1 n HIS 585 Cb 0.49 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.45 1br1 n HIS 585 CO 0.00 0.00 0.00 2.48 0.64 0.00 0.00 176.34 179.46 1br1 n TYR 586 N -2.19 1.05 1.84 4.41 4.11 -1.26 -3.69 117.16 121.43 1br1 n TYR 586 Ca 0.00 0.31 0.14 0.00 -0.00 0.00 0.00 57.90 58.36 1br1 n TYR 586 Cb 0.00 -1.17 0.77 0.00 -0.00 0.00 0.00 39.34 38.94 1br1 n TYR 586 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1br1 n ALA 587 N -2.73 2.64 0.00 -3.48 0.00 -1.26 -4.83 120.51 110.86 1br1 n ALA 587 Ca -0.23 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1br1 n ALA 587 Cb 1.05 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 19.12 1br1 n ALA 587 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1br1 n GLY 588 N 1.03 1.52 3.81 0.00 0.00 -1.24 -5.09 105.19 105.21 1br1 n GLY 588 Ca 0.21 -2.21 -0.33 0.00 0.00 0.00 0.00 46.02 43.68 1br1 n GLY 588 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1br1 s LYS 589 N -1.36 3.79 -0.09 1.61 2.20 -1.26 -2.11 119.74 122.51 1br1 s LYS 589 Ca 0.00 1.27 -0.08 0.00 -0.36 0.00 0.00 55.97 56.79 1br1 s LYS 589 Cb 0.00 -2.10 0.03 0.00 -1.51 0.00 0.00 37.83 34.25 1br1 s LYS 589 CO 0.00 -0.43 0.25 0.08 -0.36 0.00 0.00 175.35 174.89 1br1 s VAL 590 N -2.15 -0.00 -0.46 4.02 1.01 -1.20 -4.96 120.40 116.66 1br1 s VAL 590 Ca 0.65 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 62.55 1br1 s VAL 590 Cb -0.15 -0.35 0.11 0.00 0.00 0.00 0.00 36.38 35.99 1br1 s VAL 590 CO 0.23 0.00 0.32 -0.89 0.00 0.00 0.00 175.10 174.77 1br1 s THR 591 N 0.20 4.22 0.31 3.92 2.01 -1.26 -2.97 115.64 122.06 1br1 s THR 591 Ca -0.01 -1.69 -0.17 0.00 0.31 0.00 0.00 61.69 60.14 1br1 s THR 591 Cb -0.02 -3.73 -0.09 0.00 0.01 0.00 0.00 72.50 68.67 1br1 s THR 591 CO -0.00 -0.71 0.76 -0.31 -0.69 0.00 0.00 174.62 173.67 1br1 s TYR 592 N 1.38 3.45 -0.61 4.92 2.02 0.94 -4.19 117.35 125.25 1br1 s TYR 592 Ca 0.05 1.31 -0.08 0.00 -0.37 0.00 0.00 57.07 57.98 1br1 s TYR 592 Cb -0.25 -2.59 0.16 0.00 -0.40 0.00 0.00 41.96 38.87 1br1 s TYR 592 CO -0.00 0.14 0.48 1.21 -1.57 0.00 0.00 175.55 175.81 1br1 s ASN 593 N -2.08 5.77 0.00 2.29 3.04 -1.01 -1.51 114.94 121.44 1br1 s ASN 593 Ca 0.52 -2.46 0.00 0.00 0.04 0.00 0.00 52.86 50.96 1br1 s ASN 593 Cb -0.12 -1.99 0.00 0.00 -1.54 0.00 0.00 41.25 37.60 1br1 s ASN 593 CO 0.18 -0.54 0.84 0.00 -3.04 0.00 0.00 177.10 174.54 1br1 n ALA 594 N 4.14 0.90 -1.69 1.71 0.00 -1.13 -4.63 120.51 119.81 1br1 n ALA 594 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.03 1br1 n ALA 594 Cb 0.41 -0.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.99 1br1 n ALA 594 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1br1 n SER 595 N -1.34 3.47 0.00 0.00 2.88 -1.26 -2.21 113.62 115.16 1br1 n SER 595 Ca 0.00 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.62 1br1 n SER 595 Cb 0.07 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.03 1br1 n SER 595 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1br1 n ALA 596 N 3.47 0.00 -0.08 -1.46 0.00 -1.26 -4.90 120.51 116.28 1br1 n ALA 596 Ca 0.16 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.62 1br1 n ALA 596 Cb 0.32 -0.52 0.34 0.00 0.00 0.00 0.00 19.45 19.58 1br1 n ALA 596 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1br1 h TRP 597 N 0.00 0.69 -0.50 0.00 4.06 -1.77 -2.02 115.95 116.41 1br1 h TRP 597 Ca 0.00 0.01 -0.07 0.00 2.06 0.00 0.00 58.89 60.89 1br1 h TRP 597 Cb 0.25 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.16 1br1 h TRP 597 CO 0.16 0.46 0.04 -0.07 -3.56 0.00 0.00 178.44 175.47 1br1 h LEU 598 N 0.73 0.77 0.47 -4.49 3.38 -1.88 0.19 115.31 114.48 1br1 h LEU 598 Ca 0.19 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1br1 h LEU 598 Cb -0.03 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.52 1br1 h LEU 598 CO -0.04 0.82 -0.22 0.74 0.09 0.00 0.00 178.44 179.82 1br1 h THR 599 N 0.76 0.41 -0.17 0.22 2.02 -1.78 -2.57 112.91 111.79 1br1 h THR 599 Ca 0.15 -0.47 0.03 0.00 0.77 0.00 0.00 66.41 66.90 1br1 h THR 599 Cb 0.41 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 1br1 h THR 599 CO 0.01 0.06 -0.00 0.11 0.37 0.00 0.00 175.52 176.08 1br1 h LYS 600 N -0.95 0.05 0.00 6.66 1.57 -1.44 0.18 116.57 122.65 1br1 h LYS 600 Ca -0.06 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1br1 h LYS 600 Cb 0.59 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1br1 h LYS 600 CO 0.11 0.03 0.11 -0.97 -0.57 0.00 0.00 179.45 178.16 1br1 h ASN 601 N 0.05 0.00 0.00 0.86 -0.73 -0.65 -2.30 115.58 112.81 1br1 h ASN 601 Ca 0.08 0.00 -0.30 0.00 1.87 0.00 0.00 56.30 57.95 1br1 h ASN 601 Cb 0.10 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 38.63 1br1 h ASN 601 CO -0.14 0.00 -2.12 0.80 -0.37 0.00 0.00 177.43 175.61 1br1 n MET 602 N -2.26 0.95 -3.32 6.67 1.56 -0.34 -2.49 117.12 117.90 1br1 n MET 602 Ca -0.01 0.06 -0.11 0.00 -0.27 0.00 0.00 57.70 57.36 1br1 n MET 602 Cb 0.14 -1.40 0.00 0.00 2.15 0.00 0.00 33.22 34.11 1br1 n MET 602 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 1br1 n ASP 603 N -2.84 -6.68 -4.98 6.12 2.03 0.50 -4.88 116.55 105.82 1br1 n ASP 603 Ca -0.31 -0.34 -0.20 0.00 0.52 0.00 0.00 54.79 54.46 1br1 n ASP 603 Cb 0.95 -3.89 0.02 0.00 -0.72 0.00 0.00 41.12 37.48 1br1 n ASP 603 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1br1 s PRO 604 N -3.62 2.81 0.00 -0.67 0.05 -1.26 -4.79 135.00 127.51 1br1 s PRO 604 Ca 0.04 -0.87 0.00 0.00 0.05 0.00 0.00 61.00 60.22 1br1 s PRO 604 Cb -0.01 -2.62 0.00 0.00 0.05 0.00 0.00 34.50 31.92 1br1 s PRO 604 CO 0.81 -0.40 0.00 -0.11 0.05 0.00 0.00 177.00 177.35 1br1 n LEU 605 N -2.06 0.00 -4.55 -3.56 7.94 -1.26 -4.95 117.00 108.56 1br1 n LEU 605 Ca 0.05 0.00 -0.22 0.00 -1.11 0.00 0.00 56.01 54.73 1br1 n LEU 605 Cb 0.59 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.48 1br1 n LEU 605 CO 0.44 0.00 1.55 -3.20 -1.11 0.00 0.00 177.39 175.06 1br1 n ASN 606 N 0.00 1.88 0.29 1.96 2.85 -1.26 -4.23 115.26 116.76 1br1 n ASN 606 Ca 0.00 -1.09 0.14 0.00 -0.11 0.00 0.00 54.58 53.53 1br1 n ASN 606 Cb 0.00 -1.60 0.89 0.00 1.24 0.00 0.00 39.78 40.31 1br1 n ASN 606 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 1br1 h ASP 607 N 15.18 0.00 -0.10 1.20 2.03 -1.97 -1.26 116.42 131.50 1br1 h ASP 607 Ca -0.09 0.00 0.04 0.00 -0.73 0.00 0.00 57.03 56.25 1br1 h ASP 607 Cb 1.11 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 39.54 1br1 h ASP 607 CO 1.08 0.01 -0.39 0.78 -1.03 0.00 0.00 179.24 179.69 1br1 h ASN 608 N 0.00 -1.22 0.71 4.15 4.21 -1.90 0.39 115.58 121.92 1br1 h ASN 608 Ca -0.00 0.16 -0.17 0.00 1.21 0.00 0.00 56.30 57.50 1br1 h ASN 608 Cb 0.03 0.50 -0.02 0.00 -1.12 0.00 0.00 38.32 37.71 1br1 h ASN 608 CO 0.00 -0.41 -0.81 1.62 -1.29 0.00 0.00 177.43 176.54 1br1 h VAL 609 N -0.48 1.54 0.00 2.81 3.04 -1.76 -2.59 116.25 118.81 1br1 h VAL 609 Ca 0.08 -2.64 0.00 0.00 -1.01 0.00 0.00 66.70 63.12 1br1 h VAL 609 Cb 0.61 2.44 0.00 0.00 -2.01 0.00 0.00 31.29 32.33 1br1 h VAL 609 CO -0.37 0.76 0.00 0.41 -1.01 0.00 0.00 177.57 177.36 1br1 n THR 610 N -3.63 0.00 0.02 3.17 -1.04 -0.33 -1.50 114.28 110.97 1br1 n THR 610 Ca -0.02 1.23 0.14 0.00 -2.04 0.00 0.00 64.05 63.36 1br1 n THR 610 Cb 0.77 -1.88 0.59 0.00 -1.82 0.00 0.00 70.33 67.99 1br1 n THR 610 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1br1 h SER 611 N 0.00 0.17 -0.90 8.00 4.64 -1.10 -0.28 113.55 124.07 1br1 h SER 611 Ca 0.00 0.00 0.23 0.00 -0.47 0.00 0.00 61.79 61.56 1br1 h SER 611 Cb 0.00 -0.03 -0.13 0.00 -0.31 0.00 0.00 62.40 61.93 1br1 h SER 611 CO 0.00 0.10 0.37 0.25 -0.87 0.00 0.00 176.83 176.68 1br1 h LEU 612 N 0.19 0.27 0.05 5.97 5.85 -0.84 0.86 115.31 127.66 1br1 h LEU 612 Ca 0.21 0.17 -0.12 0.00 0.84 0.00 0.00 57.88 58.98 1br1 h LEU 612 Cb 0.59 0.17 0.01 0.00 0.37 0.00 0.00 40.66 41.80 1br1 h LEU 612 CO -0.03 -0.05 -0.52 -0.07 -0.34 0.00 0.00 178.44 177.43 1br1 h LEU 613 N 0.35 0.37 -0.09 2.25 3.38 -0.20 -3.29 115.31 118.08 1br1 h LEU 613 Ca 0.57 -0.86 0.03 0.00 0.09 0.00 0.00 57.88 57.71 1br1 h LEU 613 Cb 1.13 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.76 1br1 h LEU 613 CO -0.57 1.19 0.59 -3.20 0.09 0.00 0.00 178.44 176.55 1br1 n ASN 614 N -4.30 0.00 -0.19 -0.43 2.85 0.29 0.42 115.26 113.90 1br1 n ASN 614 Ca -0.11 0.31 0.02 0.00 -0.11 0.00 0.00 54.58 54.68 1br1 n ASN 614 Cb 0.66 -0.02 0.03 0.00 1.24 0.00 0.00 39.78 41.68 1br1 n ASN 614 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1br1 n GLN 615 N -1.76 0.72 -0.82 1.20 6.02 -1.19 -4.79 117.38 116.77 1br1 n GLN 615 Ca 0.02 -1.23 -0.33 0.00 -0.01 0.00 0.00 57.00 55.45 1br1 n GLN 615 Cb 0.62 -0.77 0.11 0.00 1.02 0.00 0.00 30.24 31.22 1br1 n GLN 615 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1br1 n SER 616 N -0.35 -2.63 -0.12 1.08 3.41 1.41 -4.90 113.62 111.53 1br1 n SER 616 Ca 0.03 0.30 -0.06 0.00 -0.26 0.00 0.00 58.87 58.87 1br1 n SER 616 Cb 0.56 -1.14 0.11 0.00 -0.26 0.00 0.00 64.21 63.48 1br1 n SER 616 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1br1 h SER 617 N -1.50 0.83 -2.18 4.04 0.87 -0.68 -3.41 113.55 111.51 1br1 h SER 617 Ca -0.44 -0.24 -0.52 0.00 -1.23 0.00 0.00 61.79 59.36 1br1 h SER 617 Cb 1.29 -0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 62.99 1br1 h SER 617 CO 0.33 0.94 1.31 -0.62 -0.53 0.00 0.00 176.83 178.26 1br1 s ASP 618 N -6.67 5.48 0.20 6.23 -1.08 -1.25 -4.89 116.67 114.68 1br1 s ASP 618 Ca -0.10 0.46 -0.14 0.00 -0.52 0.00 0.00 52.55 52.25 1br1 s ASP 618 Cb 0.14 -2.53 0.20 0.00 -1.46 0.00 0.00 42.92 39.27 1br1 s ASP 618 CO 0.83 -2.19 1.65 0.50 0.52 0.00 0.00 175.17 176.48 1br1 h LYS 619 N 14.12 0.03 -0.44 4.34 3.64 -1.95 0.56 116.57 136.87 1br1 h LYS 619 Ca -0.27 -0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.19 1br1 h LYS 619 Cb 1.15 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.88 1br1 h LYS 619 CO 1.19 0.02 -0.12 0.35 -2.27 0.00 0.00 179.45 178.62 1br1 h PHE 620 N 0.03 -0.27 0.00 1.91 3.57 -1.97 1.08 116.94 121.30 1br1 h PHE 620 Ca 0.27 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.77 1br1 h PHE 620 Cb 0.42 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 1br1 h PHE 620 CO -0.42 -0.20 -0.21 0.28 -2.23 0.00 0.00 178.31 175.53 1br1 h VAL 621 N -0.02 0.69 0.45 1.41 2.07 -1.54 -0.96 116.25 118.35 1br1 h VAL 621 Ca 0.21 -0.92 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 1br1 h VAL 621 Cb 0.34 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 1br1 h VAL 621 CO -0.46 0.21 -0.22 0.00 0.02 0.00 0.00 177.57 177.12 1br1 h ALA 622 N 1.79 -1.05 0.00 1.67 0.00 0.62 -2.30 119.26 119.98 1br1 h ALA 622 Ca -0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1br1 h ALA 622 Cb 0.56 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1br1 h ALA 622 CO 0.03 -1.00 -0.07 -0.44 0.00 0.00 0.00 179.25 177.76 1br1 h ASP 623 N -0.66 0.00 0.05 0.00 3.32 0.01 0.13 116.42 119.28 1br1 h ASP 623 Ca -0.06 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.00 1br1 h ASP 623 Cb 0.46 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 1br1 h ASP 623 CO 0.10 0.07 -0.13 0.25 -1.72 0.00 0.00 179.24 177.81 1br1 h LEU 624 N 0.00 -0.36 -3.68 1.55 6.46 -1.11 -2.89 115.31 115.29 1br1 h LEU 624 Ca -0.00 0.05 -0.27 0.00 -0.12 0.00 0.00 57.88 57.54 1br1 h LEU 624 Cb 0.14 0.14 -0.16 0.00 -0.73 0.00 0.00 40.66 40.05 1br1 h LEU 624 CO 0.01 -0.19 0.27 0.79 -0.62 0.00 0.00 178.44 178.71 1br1 n TRP 625 N -5.26 2.18 0.36 1.25 7.02 -0.87 -4.65 117.44 117.46 1br1 n TRP 625 Ca -0.06 -1.44 0.12 0.00 -1.02 0.00 0.00 57.50 55.10 1br1 n TRP 625 Cb 0.18 -0.68 0.53 0.00 -2.42 0.00 0.00 31.31 28.91 1br1 n TRP 625 CO 0.00 0.00 0.00 1.57 -2.02 0.00 0.00 177.69 177.24 1br1 h LYS 626 N 1.75 0.00 -2.89 -0.99 2.10 -0.52 -3.34 116.57 112.68 1br1 h LYS 626 Ca 0.33 0.00 -0.61 0.00 -2.00 0.00 0.00 60.65 58.37 1br1 h LYS 626 Cb 2.25 0.00 -0.40 0.00 -0.90 0.00 0.00 32.23 33.18 1br1 h LYS 626 CO 0.71 0.00 -0.73 0.16 -2.00 0.00 0.00 179.45 177.59 1br1 s ASP 627 N -4.34 3.56 -0.25 7.07 -4.77 -1.26 -4.92 116.67 111.75 1br1 s ASP 627 Ca 0.03 -3.21 0.12 0.00 -3.30 0.00 0.00 52.55 46.19 1br1 s ASP 627 Cb 0.09 -1.14 0.51 0.00 -1.09 0.00 0.00 42.92 41.30 1br1 s ASP 627 CO 0.38 -0.17 1.45 0.52 0.70 0.00 0.00 175.17 178.05 1br1 n VAL 628 N 2.77 2.45 0.62 2.11 0.31 -1.25 -4.70 118.33 120.64 1br1 n VAL 628 Ca 0.18 -2.37 0.09 0.00 -0.01 0.00 0.00 64.34 62.23 1br1 n VAL 628 Cb 0.38 -0.30 0.40 0.00 -0.91 0.00 0.00 33.84 33.41 1br1 n VAL 628 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1br1 n ASP 629 N -0.91 0.06 -0.00 4.52 9.92 -1.26 -2.98 116.55 125.90 1br1 n ASP 629 Ca 0.29 0.51 0.08 0.00 -0.53 0.00 0.00 54.79 55.15 1br1 n ASP 629 Cb 0.99 -0.53 -0.10 0.00 -0.64 0.00 0.00 41.12 40.84 1br1 n ASP 629 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1br1 n ARG 630 N -1.57 1.15 -0.95 -1.24 0.63 -1.26 -5.01 116.66 108.41 1br1 n ARG 630 Ca 0.04 -0.01 -0.35 0.00 -0.92 0.00 0.00 57.85 56.61 1br1 n ARG 630 Cb 0.22 -1.34 0.06 0.00 0.45 0.00 0.00 32.46 31.86 1br1 n ARG 630 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1br1 n ILE 631 N -1.47 0.04 -4.31 5.15 2.08 -1.16 -4.80 119.36 114.90 1br1 n ILE 631 Ca 0.03 -0.41 -0.34 0.00 0.56 0.00 0.00 62.75 62.59 1br1 n ILE 631 Cb 0.29 -0.20 -0.13 0.00 -0.75 0.00 0.00 39.64 38.85 1br1 n ILE 631 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1br1 s VAL 632 N -2.11 3.52 -0.41 1.39 1.01 -1.26 -4.99 120.40 117.54 1br1 s VAL 632 Ca 0.46 -0.47 0.07 0.00 0.00 0.00 0.00 61.98 62.03 1br1 s VAL 632 Cb -0.20 -2.55 0.22 0.00 0.00 0.00 0.00 36.38 33.85 1br1 s VAL 632 CO 0.77 0.47 0.51 0.61 0.00 0.00 0.00 175.10 177.47 1br1 n GLY 633 N 4.00 2.27 0.60 4.51 0.00 -1.26 -4.01 105.19 111.29 1br1 n GLY 633 Ca -0.18 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.58 1br1 n GLY 633 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1br1 n LEU 634 N 1.89 0.00 0.00 0.99 7.94 -1.26 -4.58 117.00 121.98 1br1 n LEU 634 Ca 0.22 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.12 1br1 n LEU 634 Cb 0.53 0.15 0.00 0.00 0.53 0.00 0.00 43.42 44.62 1br1 n LEU 634 CO 0.13 -0.15 0.00 0.33 -1.11 0.00 0.00 177.39 176.59 1br1 n PHE 656 N -1.59 0.00 -3.75 1.96 7.35 -1.26 -4.99 117.46 115.17 1br1 n PHE 656 Ca 0.00 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.35 1br1 n PHE 656 Cb 0.00 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 39.78 1br1 n PHE 656 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1br1 s ARG 657 N 0.39 3.59 0.29 -4.13 6.06 -1.26 -5.09 118.95 118.80 1br1 s ARG 657 Ca 0.00 -0.07 -0.28 0.00 -2.50 0.00 0.00 55.73 52.87 1br1 s ARG 657 Cb 0.00 -3.07 -0.09 0.00 0.06 0.00 0.00 34.95 31.85 1br1 s ARG 657 CO 0.00 0.64 0.98 -0.08 -2.50 0.00 0.00 175.30 174.34 1br1 s THR 658 N -1.32 3.98 0.09 4.11 -1.32 -1.26 -4.90 115.64 115.02 1br1 s THR 658 Ca 0.28 1.83 -0.32 0.00 -1.21 0.00 0.00 61.69 62.27 1br1 s THR 658 Cb -0.13 -4.10 -0.14 0.00 -1.51 0.00 0.00 72.50 66.62 1br1 s THR 658 CO 0.17 0.32 1.51 0.58 -2.21 0.00 0.00 174.62 174.98 1br1 h VAL 659 N 2.88 0.00 -1.16 5.08 2.07 -1.81 0.55 116.25 123.85 1br1 h VAL 659 Ca -0.46 0.00 0.34 0.00 0.82 0.00 0.00 66.70 67.39 1br1 h VAL 659 Cb 1.20 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1br1 h VAL 659 CO 0.66 0.00 0.89 1.23 0.02 0.00 0.00 177.57 180.37 1br1 h GLY 660 N -0.71 0.00 0.13 2.17 0.00 -1.95 0.16 103.07 102.87 1br1 h GLY 660 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 1br1 h GLY 660 CO -0.25 0.00 -1.98 -0.18 0.00 0.00 0.00 176.54 174.13 1br1 n GLN 661 N -4.03 0.66 -0.02 4.80 -0.06 -0.69 -2.16 117.38 115.88 1br1 n GLN 661 Ca 0.25 -0.11 -0.12 0.00 -2.00 0.00 0.00 57.00 55.03 1br1 n GLN 661 Cb 1.27 -1.56 -0.06 0.00 -4.06 0.00 0.00 30.24 25.83 1br1 n GLN 661 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 1br1 h LEU 662 N 0.00 0.15 0.00 1.69 5.85 0.28 -1.59 115.31 121.69 1br1 h LEU 662 Ca -0.13 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1br1 h LEU 662 Cb 1.31 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.30 1br1 h LEU 662 CO 0.01 0.30 0.00 0.00 -0.34 0.00 0.00 178.44 178.41 1br1 n TYR 663 N -4.90 0.00 0.00 1.25 9.36 0.00 -3.18 117.16 119.70 1br1 n TYR 663 Ca -0.06 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.16 1br1 n TYR 663 Cb 0.13 -0.02 0.00 0.00 -0.63 0.00 0.00 39.34 38.82 1br1 n TYR 663 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 1br1 n LYS 664 N -0.55 0.00 -0.08 2.98 0.00 -0.92 0.12 118.16 119.73 1br1 n LYS 664 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 58.31 58.08 1br1 n LYS 664 Cb 0.00 -1.44 -0.12 0.00 0.00 0.00 0.00 35.03 33.47 1br1 n LYS 664 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1br1 n GLU 665 N -0.70 0.64 0.09 1.64 4.07 -0.60 -4.13 120.64 121.66 1br1 n GLU 665 Ca 0.00 0.38 -0.05 0.00 -0.06 0.00 0.00 57.16 57.42 1br1 n GLU 665 Cb 0.33 -1.67 0.09 0.00 -0.06 0.00 0.00 31.44 30.13 1br1 n GLU 665 CO 0.00 0.00 0.00 -0.56 -0.06 0.00 0.00 177.13 176.51 1br1 h GLN 666 N -0.53 0.17 0.00 5.31 3.07 0.10 -2.74 115.11 120.49 1br1 h GLN 666 Ca -0.46 -0.14 0.00 0.00 0.09 0.00 0.00 58.65 58.15 1br1 h GLN 666 Cb 1.66 0.03 0.00 0.00 0.08 0.00 0.00 27.48 29.25 1br1 h GLN 666 CO -0.13 0.80 0.00 -0.11 0.09 0.00 0.00 178.83 179.47 1br1 n LEU 667 N -3.78 0.00 -0.01 0.06 7.94 -0.93 -0.23 117.00 120.05 1br1 n LEU 667 Ca -0.02 0.06 0.08 0.00 -1.11 0.00 0.00 56.01 55.02 1br1 n LEU 667 Cb 0.68 -0.06 -0.13 0.00 0.53 0.00 0.00 43.42 44.43 1br1 n LEU 667 CO 0.45 -0.03 -0.72 0.41 -1.11 0.00 0.00 177.39 176.39 1br1 n THR 668 N -1.06 0.05 0.15 1.96 -1.04 -1.04 -2.97 114.28 110.33 1br1 n THR 668 Ca 0.11 -0.41 -0.12 0.00 -2.04 0.00 0.00 64.05 61.59 1br1 n THR 668 Cb 0.07 0.07 -0.07 0.00 -1.82 0.00 0.00 70.33 68.58 1br1 n THR 668 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 1br1 h LYS 669 N 0.00 -0.42 0.13 -2.82 3.64 -0.53 -2.30 116.57 114.27 1br1 h LYS 669 Ca -0.02 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1br1 h LYS 669 Cb 0.84 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.72 1br1 h LYS 669 CO 0.00 -0.09 -0.37 1.25 -2.27 0.00 0.00 179.45 177.98 1br1 h LEU 670 N -0.90 -1.07 -1.55 5.20 5.85 -1.26 0.88 115.31 122.45 1br1 h LEU 670 Ca -0.04 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1br1 h LEU 670 Cb 0.52 0.40 0.00 0.00 0.37 0.00 0.00 40.66 41.95 1br1 h LEU 670 CO 0.07 -0.45 0.33 -0.03 -0.34 0.00 0.00 178.44 178.02 1br1 h MET 671 N -0.61 0.00 0.02 1.25 4.05 -1.58 -1.87 114.93 116.20 1br1 h MET 671 Ca 0.03 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.41 1br1 h MET 671 Cb 0.63 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.43 1br1 h MET 671 CO -0.21 0.00 -0.17 1.15 0.23 0.00 0.00 176.91 177.92 1br1 h THR 672 N 0.00 1.71 -0.53 -0.77 2.02 -0.22 -3.17 112.91 111.96 1br1 h THR 672 Ca 0.00 -2.36 -0.10 0.00 0.77 0.00 0.00 66.41 64.72 1br1 h THR 672 Cb 0.67 3.31 -0.02 0.00 -1.74 0.00 0.00 68.15 70.37 1br1 h THR 672 CO 0.00 0.60 -0.08 0.71 0.37 0.00 0.00 175.52 177.12 1br1 h THR 673 N -0.93 1.26 -0.86 3.16 1.35 -1.02 -2.55 112.91 113.32 1br1 h THR 673 Ca -0.04 -1.21 0.07 0.00 -0.55 0.00 0.00 66.41 64.68 1br1 h THR 673 Cb 1.09 0.95 -0.06 0.00 -1.73 0.00 0.00 68.15 68.40 1br1 h THR 673 CO 0.00 0.43 0.56 -0.07 -0.25 0.00 0.00 175.52 176.19 1br1 h LEU 674 N 0.86 0.83 0.00 3.87 3.38 -1.59 0.71 115.31 123.37 1br1 h LEU 674 Ca 0.14 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1br1 h LEU 674 Cb 0.62 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1br1 h LEU 674 CO 0.04 0.52 0.00 0.54 0.09 0.00 0.00 178.44 179.64 1br1 n ARG 675 N -4.49 0.36 -0.12 1.13 1.74 -0.98 -2.34 116.66 111.96 1br1 n ARG 675 Ca 0.13 0.07 0.05 0.00 -0.77 0.00 0.00 57.85 57.33 1br1 n ARG 675 Cb 0.22 -1.50 0.12 0.00 -1.02 0.00 0.00 32.46 30.28 1br1 n ARG 675 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1br1 n ASN 676 N -1.25 2.61 -3.56 0.55 3.02 0.24 -5.00 115.26 111.87 1br1 n ASN 676 Ca 0.11 -1.84 -0.20 0.00 -0.03 0.00 0.00 54.58 52.63 1br1 n ASN 676 Cb 0.16 -0.16 -0.04 0.00 -0.61 0.00 0.00 39.78 39.13 1br1 n ASN 676 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1br1 n THR 677 N 0.52 0.00 -3.75 3.41 -2.24 -0.80 -4.87 114.28 106.54 1br1 n THR 677 Ca 0.10 -1.48 -0.37 0.00 -2.27 0.00 0.00 64.05 60.03 1br1 n THR 677 Cb 0.38 0.33 -0.13 0.00 -2.10 0.00 0.00 70.33 68.81 1br1 n THR 677 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1br1 s ASN 678 N -2.70 5.12 0.32 3.42 3.04 0.23 -4.90 114.94 119.47 1br1 s ASN 678 Ca 0.02 -0.55 -0.27 0.00 0.04 0.00 0.00 52.86 52.10 1br1 s ASN 678 Cb 0.00 -1.90 -0.09 0.00 -1.54 0.00 0.00 41.25 37.72 1br1 s ASN 678 CO 0.01 -0.14 1.04 -2.16 -3.04 0.00 0.00 177.10 172.81 1br1 s PRO 679 N 1.54 4.51 -0.26 0.43 0.04 -1.26 0.72 135.00 140.72 1br1 s PRO 679 Ca 0.04 1.61 -0.02 0.00 0.04 0.00 0.00 61.00 62.66 1br1 s PRO 679 Cb -0.16 -2.94 0.08 0.00 0.04 0.00 0.00 34.50 31.52 1br1 s PRO 679 CO 0.03 0.15 0.08 -0.80 0.04 0.00 0.00 177.00 176.50 1br1 s ASN 680 N -1.24 3.43 -0.09 6.66 0.01 0.24 -4.88 114.94 119.08 1br1 s ASN 680 Ca 0.49 -1.21 -0.24 0.00 -0.71 0.00 0.00 52.86 51.18 1br1 s ASN 680 Cb -0.26 -0.62 -0.03 0.00 0.41 0.00 0.00 41.25 40.75 1br1 s ASN 680 CO 0.33 -0.38 0.76 -0.36 -1.51 0.00 0.00 177.10 175.94 1br1 s PHE 681 N 1.84 3.54 -0.66 2.20 0.08 -1.26 -0.75 117.98 122.97 1br1 s PHE 681 Ca 0.05 1.28 0.06 0.00 0.12 0.00 0.00 56.93 58.44 1br1 s PHE 681 Cb -0.17 -2.89 0.26 0.00 -0.57 0.00 0.00 43.02 39.65 1br1 s PHE 681 CO -0.21 -0.02 0.79 0.28 -0.10 0.00 0.00 175.22 175.97 1br1 n VAL 682 N 4.08 2.55 -1.38 -0.44 0.31 -0.98 -2.83 118.33 119.63 1br1 n VAL 682 Ca 0.01 -5.28 -0.10 0.00 -0.01 0.00 0.00 64.34 58.96 1br1 n VAL 682 Cb 0.51 -2.06 -0.08 0.00 -0.91 0.00 0.00 33.84 31.30 1br1 n VAL 682 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1br1 n ARG 683 N 0.79 0.10 -1.63 5.55 5.12 -1.02 -3.84 116.66 121.74 1br1 n ARG 683 Ca 0.30 -0.95 -0.37 0.00 -1.93 0.00 0.00 57.85 54.90 1br1 n ARG 683 Cb 0.41 -2.75 0.06 0.00 -1.16 0.00 0.00 32.46 29.01 1br1 n ARG 683 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1br1 s ILE 685 N -1.51 -0.05 0.10 0.00 1.01 -1.24 -3.97 121.20 115.55 1br1 s ILE 685 Ca 0.77 0.38 -0.30 0.00 0.00 0.00 0.00 60.65 61.50 1br1 s ILE 685 Cb -0.41 -0.19 -0.06 0.00 0.01 0.00 0.00 42.46 41.81 1br1 s ILE 685 CO 0.46 0.18 1.14 -0.63 0.00 0.00 0.00 174.94 176.09 1br1 s ILE 686 N 2.09 4.04 0.01 2.92 -1.09 -1.26 -2.23 121.20 125.69 1br1 s ILE 686 Ca 0.04 1.57 -0.01 0.00 -2.23 0.00 0.00 60.65 60.03 1br1 s ILE 686 Cb -0.12 -4.00 -0.26 0.00 -1.58 0.00 0.00 42.46 36.49 1br1 s ILE 686 CO -0.03 0.18 0.87 1.55 -1.23 0.00 0.00 174.94 176.28 1br1 h PRO 687 N 6.15 0.20 -2.50 2.79 0.13 -1.89 -3.42 132.00 133.47 1br1 h PRO 687 Ca -0.43 -0.34 0.07 0.00 -0.87 0.00 0.00 66.00 64.44 1br1 h PRO 687 Cb 1.21 0.13 -0.14 0.00 0.13 0.00 0.00 31.00 32.33 1br1 h PRO 687 CO 0.77 1.04 0.41 0.54 -0.23 0.00 0.00 178.00 180.53 1br1 s ASN 688 N -6.86 -0.42 0.00 1.44 2.20 -1.26 -0.86 114.94 109.17 1br1 s ASN 688 Ca -0.08 -0.00 0.24 0.00 -0.94 0.00 0.00 52.86 52.07 1br1 s ASN 688 Cb 0.07 0.45 0.19 0.00 -2.00 0.00 0.00 41.25 39.96 1br1 s ASN 688 CO 0.84 -0.73 1.21 1.41 -2.94 0.00 0.00 177.10 176.90 1br1 n HIS 689 N -0.29 0.00 1.97 1.54 8.25 -1.26 -4.04 115.22 121.39 1br1 n HIS 689 Ca -0.11 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.48 1br1 n HIS 689 Cb 0.63 -0.04 0.80 0.00 1.12 0.00 0.00 29.99 32.49 1br1 n HIS 689 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1br1 n GLU 690 N -0.34 1.03 -2.32 -0.41 1.02 -1.26 -4.85 120.64 113.51 1br1 n GLU 690 Ca 0.09 -0.05 -0.18 0.00 -0.02 0.00 0.00 57.16 57.00 1br1 n GLU 690 Cb 0.42 -1.43 -0.02 0.00 -0.02 0.00 0.00 31.44 30.40 1br1 n GLU 690 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1br1 n LYS 691 N -0.87 -1.82 -3.64 3.49 4.81 -1.26 -4.93 118.16 113.95 1br1 n LYS 691 Ca 0.20 0.90 -0.37 0.00 -0.87 0.00 0.00 58.31 58.17 1br1 n LYS 691 Cb 0.11 -5.51 -0.06 0.00 0.02 0.00 0.00 35.03 29.59 1br1 n LYS 691 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1br1 s ARG 692 N -4.89 3.74 0.08 1.64 1.81 -1.26 -5.08 118.95 114.99 1br1 s ARG 692 Ca 0.00 0.19 -0.09 0.00 -1.72 0.00 0.00 55.73 54.11 1br1 s ARG 692 Cb 0.00 -3.18 -0.06 0.00 -0.45 0.00 0.00 34.95 31.26 1br1 s ARG 692 CO 0.00 0.70 0.40 0.00 -0.68 0.00 0.00 175.30 175.72 1br1 s ALA 693 N -1.11 3.73 0.00 2.13 0.00 -1.26 -3.94 121.76 121.31 1br1 s ALA 693 Ca 0.22 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.79 1br1 s ALA 693 Cb -0.15 -2.26 0.00 0.00 0.00 0.00 0.00 23.12 20.71 1br1 s ALA 693 CO 0.11 0.57 0.00 0.41 0.00 0.00 0.00 175.76 176.86 1br1 n GLY 694 N 0.83 2.59 3.71 0.00 0.00 -1.26 -4.98 105.19 106.08 1br1 n GLY 694 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 1br1 n GLY 694 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1br1 s LYS 695 N -0.01 4.17 -0.27 1.61 2.20 -1.25 -5.06 119.74 121.13 1br1 s LYS 695 Ca 0.00 -0.13 -0.03 0.00 -0.36 0.00 0.00 55.97 55.45 1br1 s LYS 695 Cb 0.00 -3.46 0.09 0.00 -1.51 0.00 0.00 37.83 32.95 1br1 s LYS 695 CO 0.00 0.19 0.10 -1.17 -0.36 0.00 0.00 175.35 174.11 1br1 s LEU 696 N 0.65 1.23 -0.21 5.43 2.96 -1.26 -4.42 118.68 123.06 1br1 s LEU 696 Ca 0.11 -1.27 -0.29 0.00 -0.22 0.00 0.00 54.13 52.46 1br1 s LEU 696 Cb -0.12 -0.56 -0.03 0.00 0.50 0.00 0.00 46.19 45.97 1br1 s LEU 696 CO 0.02 -0.40 1.62 -0.62 -1.32 0.00 0.00 176.35 175.65 1br1 s ASP 697 N 1.89 6.39 0.08 3.68 -1.08 -0.04 -4.95 116.67 122.64 1br1 s ASP 697 Ca 0.07 1.65 -0.29 0.00 -0.52 0.00 0.00 52.55 53.46 1br1 s ASP 697 Cb -0.17 -2.53 -0.13 0.00 -1.46 0.00 0.00 42.92 38.63 1br1 s ASP 697 CO -0.25 -1.25 1.45 0.00 0.52 0.00 0.00 175.17 175.64 1br1 h ALA 698 N 10.69 -0.99 -0.46 3.66 0.00 -1.87 -2.11 119.26 128.18 1br1 h ALA 698 Ca -0.34 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.33 1br1 h ALA 698 Cb 1.15 0.75 -0.02 0.00 0.00 0.00 0.00 17.79 19.68 1br1 h ALA 698 CO 1.00 -1.06 -0.19 0.45 0.00 0.00 0.00 179.25 179.45 1br1 h HIS 699 N -0.71 1.02 -0.90 0.00 3.86 -1.92 0.33 115.15 116.83 1br1 h HIS 699 Ca -0.03 -0.23 0.12 0.00 -1.16 0.00 0.00 60.37 59.07 1br1 h HIS 699 Cb 0.66 -0.24 -0.07 0.00 1.06 0.00 0.00 27.41 28.82 1br1 h HIS 699 CO -0.34 1.00 0.58 1.25 0.86 0.00 0.00 177.93 181.28 1br1 h LEU 700 N 0.79 0.75 0.00 2.43 6.46 -1.90 0.79 115.31 124.63 1br1 h LEU 700 Ca 0.11 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1br1 h LEU 700 Cb 0.73 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.54 1br1 h LEU 700 CO 0.06 0.42 -0.47 0.58 -0.62 0.00 0.00 178.44 178.40 1br1 h VAL 701 N 0.82 0.00 0.02 1.05 2.07 -1.01 -3.08 116.25 116.11 1br1 h VAL 701 Ca 0.43 -0.58 -0.27 0.00 0.82 0.00 0.00 66.70 67.10 1br1 h VAL 701 Cb 0.54 1.28 0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1br1 h VAL 701 CO -0.20 0.00 -1.08 0.25 0.02 0.00 0.00 177.57 176.56 1br1 h LEU 702 N 0.00 0.91 -0.09 2.57 5.85 0.44 -3.03 115.31 121.97 1br1 h LEU 702 Ca 0.00 -0.75 -0.01 0.00 0.84 0.00 0.00 57.88 57.96 1br1 h LEU 702 Cb 0.79 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.54 1br1 h LEU 702 CO 0.00 1.55 0.00 -0.08 -0.34 0.00 0.00 178.44 179.57 1br1 h GLU 703 N 0.38 0.15 -0.52 1.25 4.22 -0.43 -2.82 114.58 116.79 1br1 h GLU 703 Ca -0.14 -0.05 0.10 0.00 0.08 0.00 0.00 59.36 59.35 1br1 h GLU 703 Cb 1.74 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 30.87 1br1 h GLU 703 CO 0.21 0.40 -0.29 1.96 -2.18 0.00 0.00 179.01 179.11 1br1 h GLN 704 N -0.12 -0.16 0.00 1.92 4.20 -1.62 2.70 115.11 122.03 1br1 h GLN 704 Ca 0.02 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1br1 h GLN 704 Cb 0.33 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1br1 h GLN 704 CO 0.00 -0.10 0.00 1.28 -0.67 0.00 0.00 178.83 179.34 1br1 n LEU 705 N -5.43 0.00 -0.09 1.46 4.77 -1.14 -1.62 117.00 114.96 1br1 n LEU 705 Ca 0.04 0.43 -0.12 0.00 -0.03 0.00 0.00 56.01 56.32 1br1 n LEU 705 Cb 0.34 -0.43 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 1br1 n LEU 705 CO 0.04 -0.40 -0.57 0.54 -1.33 0.00 0.00 177.39 175.67 1br1 n ARG 706 N -1.43 0.51 0.01 3.23 1.74 0.88 -3.24 116.66 118.36 1br1 n ARG 706 Ca 0.01 0.45 0.09 0.00 -0.77 0.00 0.00 57.85 57.63 1br1 n ARG 706 Cb 0.02 -1.64 0.38 0.00 -1.02 0.00 0.00 32.46 30.20 1br1 n ARG 706 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1br1 n ASN 708 N -1.54 0.54 -0.07 0.00 3.02 -0.64 -4.90 115.26 111.67 1br1 n ASN 708 Ca 0.04 -0.09 -0.01 0.00 -0.03 0.00 0.00 54.58 54.49 1br1 n ASN 708 Cb 0.21 1.01 -0.00 0.00 -0.61 0.00 0.00 39.78 40.39 1br1 n ASN 708 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1br1 n GLY 709 N 1.31 0.37 0.31 7.41 0.00 -1.12 -4.98 105.19 108.49 1br1 n GLY 709 Ca 0.00 -0.92 -0.11 0.00 0.00 0.00 0.00 46.02 44.99 1br1 n GLY 709 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1br1 h VAL 710 N 0.00 0.00 -0.49 1.61 2.07 -1.82 0.35 116.25 117.97 1br1 h VAL 710 Ca -0.02 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.57 1br1 h VAL 710 Cb 0.71 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.39 1br1 h VAL 710 CO 0.02 0.00 -0.51 -0.07 0.02 0.00 0.00 177.57 177.03 1br1 h LEU 711 N -0.64 -1.72 -0.56 2.57 -0.00 -1.95 0.40 115.31 113.42 1br1 h LEU 711 Ca -0.04 0.25 0.07 0.00 -0.00 0.00 0.00 57.88 58.15 1br1 h LEU 711 Cb 0.55 0.73 -0.06 0.00 -0.00 0.00 0.00 40.66 41.88 1br1 h LEU 711 CO -0.03 -0.37 0.24 -0.33 -0.00 0.00 0.00 178.44 177.96 1br1 h GLU 712 N -0.32 0.44 0.00 1.13 3.07 -1.93 0.67 114.58 117.64 1br1 h GLU 712 Ca 0.12 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 1br1 h GLU 712 Cb 0.58 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 1br1 h GLU 712 CO -0.64 0.29 0.38 0.78 -1.40 0.00 0.00 179.01 178.42 1br1 h GLY 713 N 0.46 0.00 0.00 -3.84 0.00 0.40 0.33 103.07 100.41 1br1 h GLY 713 Ca 0.27 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.30 1br1 h GLY 713 CO -0.23 0.00 -2.11 1.39 0.00 0.00 0.00 176.54 175.59 1br1 n ILE 714 N -2.44 1.11 -0.08 2.60 5.41 0.22 -4.43 119.36 121.75 1br1 n ILE 714 Ca -0.01 -0.64 -0.07 0.00 1.00 0.00 0.00 62.75 63.03 1br1 n ILE 714 Cb 0.41 -0.67 -0.00 0.00 -0.71 0.00 0.00 39.64 38.66 1br1 n ILE 714 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1br1 h ARG 715 N 0.00 -0.09 -0.40 0.38 3.08 0.77 -1.25 114.38 116.86 1br1 h ARG 715 Ca -0.44 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.59 1br1 h ARG 715 Cb 1.94 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.99 1br1 h ARG 715 CO 0.01 -0.06 0.14 0.97 -1.07 0.00 0.00 179.97 179.96 1br1 h ILE 716 N -0.10 1.16 -0.24 2.04 6.09 -1.79 3.28 117.51 127.95 1br1 h ILE 716 Ca 0.16 -0.54 -0.02 0.00 -1.37 0.00 0.00 64.86 63.09 1br1 h ILE 716 Cb 0.34 0.71 -0.01 0.00 0.47 0.00 0.00 36.82 38.32 1br1 h ILE 716 CO -0.37 0.20 0.07 0.00 -3.07 0.00 0.00 178.15 174.98 1br1 n ARG 718 N -4.41 0.70 0.28 0.00 1.85 -0.20 -4.59 116.66 110.30 1br1 n ARG 718 Ca 0.01 0.31 -0.12 0.00 -1.00 0.00 0.00 57.85 57.05 1br1 n ARG 718 Cb 0.15 -1.68 -0.05 0.00 -1.05 0.00 0.00 32.46 29.82 1br1 n ARG 718 CO 0.00 0.00 0.00 1.96 -0.01 0.00 0.00 177.63 179.58 1br1 h GLN 719 N -0.19 -0.73 0.00 2.89 1.08 0.62 -3.47 115.11 115.31 1br1 h GLN 719 Ca -0.44 0.05 0.00 0.00 -1.45 0.00 0.00 58.65 56.81 1br1 h GLN 719 Cb 1.86 0.16 0.00 0.00 -0.05 0.00 0.00 27.48 29.45 1br1 h GLN 719 CO -0.02 -0.48 0.00 0.41 -0.95 0.00 0.00 178.83 177.79 1br1 n GLY 720 N -0.47 -0.03 2.90 3.46 0.00 0.26 -5.01 105.19 106.30 1br1 n GLY 720 Ca -0.09 -1.77 -0.28 0.00 0.00 0.00 0.00 46.02 43.88 1br1 n GLY 720 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1br1 s PHE 721 N 0.31 3.57 -2.00 1.61 0.40 -1.26 -4.76 117.98 115.85 1br1 s PHE 721 Ca 0.00 -3.34 0.03 0.00 -0.60 0.00 0.00 56.93 53.02 1br1 s PHE 721 Cb 0.00 -2.71 0.19 0.00 0.51 0.00 0.00 43.02 41.01 1br1 s PHE 721 CO 0.00 -0.55 0.63 -2.30 0.70 0.00 0.00 175.22 173.70 1br1 n PRO 722 N 1.97 0.11 -4.96 0.24 -0.02 -1.25 -4.52 135.00 126.57 1br1 n PRO 722 Ca 0.20 0.00 -0.28 0.00 -2.02 0.00 0.00 63.50 61.40 1br1 n PRO 722 Cb 0.35 -1.45 -0.16 0.00 -0.02 0.00 0.00 33.50 32.22 1br1 n PRO 722 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1br1 s ASN 723 N -1.99 2.46 0.02 2.55 0.01 -1.21 -5.05 114.94 111.73 1br1 s ASN 723 Ca 0.05 -0.42 -0.03 0.00 -0.71 0.00 0.00 52.86 51.75 1br1 s ASN 723 Cb 0.02 -0.83 -0.01 0.00 0.41 0.00 0.00 41.25 40.83 1br1 s ASN 723 CO 0.04 0.15 0.04 0.00 -1.51 0.00 0.00 177.10 175.82 1br1 s ARG 724 N 0.15 0.41 -0.16 -0.60 1.70 -1.26 0.45 118.95 119.64 1br1 s ARG 724 Ca -0.08 -0.56 -0.11 0.00 -0.47 0.00 0.00 55.73 54.50 1br1 s ARG 724 Cb -0.14 0.16 0.05 0.00 -0.57 0.00 0.00 34.95 34.45 1br1 s ARG 724 CO 0.04 -0.08 0.41 -1.50 -1.08 0.00 0.00 175.30 173.08 1br1 s ILE 725 N -1.59 -0.01 0.32 4.99 2.07 -0.01 -4.95 121.20 122.02 1br1 s ILE 725 Ca -0.14 0.05 -0.29 0.00 -1.41 0.00 0.00 60.65 58.86 1br1 s ILE 725 Cb -0.08 -0.59 -0.10 0.00 0.13 0.00 0.00 42.46 41.83 1br1 s ILE 725 CO -0.01 0.02 1.20 0.54 -1.91 0.00 0.00 174.94 174.78 1br1 s VAL 726 N 0.84 3.11 0.59 4.00 0.11 -1.26 0.25 120.40 128.04 1br1 s VAL 726 Ca -0.05 1.10 0.27 0.00 -2.93 0.00 0.00 61.98 60.37 1br1 s VAL 726 Cb -0.06 -3.69 0.40 0.00 -1.53 0.00 0.00 36.38 31.51 1br1 s VAL 726 CO -0.06 0.24 1.28 0.49 -3.33 0.00 0.00 175.10 173.72 1br1 n PHE 727 N 0.87 0.00 -0.08 1.54 3.72 -0.50 -1.60 117.46 121.41 1br1 n PHE 727 Ca 0.00 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.20 1br1 n PHE 727 Cb 0.44 -0.27 -0.12 0.00 -0.94 0.00 0.00 39.48 38.59 1br1 n PHE 727 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1br1 h GLN 728 N 0.00 0.05 0.00 -1.08 5.75 -1.90 -3.12 115.11 114.81 1br1 h GLN 728 Ca 0.51 -0.08 -0.02 0.00 -0.15 0.00 0.00 58.65 58.91 1br1 h GLN 728 Cb 2.93 0.03 -0.00 0.00 1.07 0.00 0.00 27.48 31.51 1br1 h GLN 728 CO -0.01 1.04 -0.12 0.93 -2.65 0.00 0.00 178.83 178.02 1br1 h GLU 729 N -0.86 0.00 -0.00 1.69 3.07 -1.68 -1.60 114.58 115.20 1br1 h GLU 729 Ca -0.27 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.58 1br1 h GLU 729 Cb 1.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 1br1 h GLU 729 CO -0.11 0.12 -0.03 0.35 -1.40 0.00 0.00 179.01 177.93 1br1 h PHE 730 N 0.00 0.04 0.00 4.33 3.04 -1.55 0.11 116.94 122.92 1br1 h PHE 730 Ca -0.00 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.93 1br1 h PHE 730 Cb 0.28 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 38.78 1br1 h PHE 730 CO 0.00 0.75 0.00 -2.13 -2.02 0.00 0.00 178.31 174.91 1br1 n ARG 731 N -4.71 0.37 -0.09 1.11 3.00 -1.12 -2.70 116.66 112.51 1br1 n ARG 731 Ca -0.09 0.07 -0.13 0.00 -0.00 0.00 0.00 57.85 57.70 1br1 n ARG 731 Cb 0.37 -1.50 -0.05 0.00 0.00 0.00 0.00 32.46 31.28 1br1 n ARG 731 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 1br1 n GLN 732 N -1.16 0.51 0.06 -0.14 -0.06 -0.62 -4.03 117.38 111.95 1br1 n GLN 732 Ca 0.10 0.44 -0.13 0.00 -2.00 0.00 0.00 57.00 55.41 1br1 n GLN 732 Cb 0.10 -1.63 -0.09 0.00 -4.06 0.00 0.00 30.24 24.57 1br1 n GLN 732 CO 0.00 0.00 0.00 -0.09 -0.20 0.00 0.00 177.06 176.77 1br1 h ARG 733 N -1.00 -0.14 -0.93 3.69 2.43 -0.93 -3.35 114.38 114.14 1br1 h ARG 733 Ca -0.18 0.01 -0.45 0.00 -0.81 0.00 0.00 59.98 58.55 1br1 h ARG 733 Cb 0.95 0.03 -0.27 0.00 -0.42 0.00 0.00 29.97 30.26 1br1 h ARG 733 CO -0.11 0.16 0.56 0.66 -1.51 0.00 0.00 179.97 179.73 1br1 n TYR 734 N -5.02 2.91 0.08 2.20 4.01 -1.10 -4.40 117.16 115.84 1br1 n TYR 734 Ca -0.09 -1.72 -0.09 0.00 -0.16 0.00 0.00 57.90 55.85 1br1 n TYR 734 Cb 0.20 -0.89 -0.04 0.00 -0.31 0.00 0.00 39.34 38.30 1br1 n TYR 734 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 1br1 h GLU 735 N 1.33 0.16 0.00 -0.72 4.81 -1.70 -2.96 114.58 115.49 1br1 h GLU 735 Ca 0.56 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.59 1br1 h GLU 735 Cb 2.74 0.06 0.00 0.00 0.63 0.00 0.00 28.75 32.18 1br1 h GLU 735 CO 1.02 0.99 0.27 0.97 -0.73 0.00 0.00 179.01 181.52 1br1 h ILE 736 N 0.07 0.00 0.23 2.32 2.10 -1.85 0.31 117.51 120.69 1br1 h ILE 736 Ca -0.05 0.00 -0.33 0.00 1.08 0.00 0.00 64.86 65.56 1br1 h ILE 736 Cb 1.61 0.60 0.03 0.00 -1.09 0.00 0.00 36.82 37.97 1br1 h ILE 736 CO 0.14 0.00 -1.46 -0.07 -1.08 0.00 0.00 178.15 175.68 1br1 h LEU 737 N 0.00 0.76 -7.08 2.19 3.38 -1.85 -3.40 115.31 109.31 1br1 h LEU 737 Ca 0.00 -0.83 -0.62 0.00 0.09 0.00 0.00 57.88 56.52 1br1 h LEU 737 Cb 0.54 -0.25 -0.41 0.00 0.09 0.00 0.00 40.66 40.63 1br1 h LEU 737 CO 0.00 1.65 -0.68 0.00 0.09 0.00 0.00 178.44 179.50 1br1 s ALA 738 N -2.61 2.92 0.10 1.53 0.00 0.11 -4.94 121.76 118.87 1br1 s ALA 738 Ca -0.08 -3.15 0.33 0.00 0.00 0.00 0.00 51.96 49.05 1br1 s ALA 738 Cb 0.05 -2.03 1.33 0.00 0.00 0.00 0.00 23.12 22.47 1br1 s ALA 738 CO 0.93 -2.05 1.97 0.00 0.00 0.00 0.00 175.76 176.61 1br1 h ALA 739 N 6.18 1.00 0.00 0.00 0.00 -1.75 -3.23 119.26 121.47 1br1 h ALA 739 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1br1 h ALA 739 Cb 0.86 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1br1 h ALA 739 CO 0.60 0.02 -0.04 0.09 0.00 0.00 0.00 179.25 179.92 1br1 n ASN 740 N -3.12 1.95 0.09 0.00 3.02 -1.26 -4.66 115.26 111.29 1br1 n ASN 740 Ca 0.01 -2.56 -0.22 0.00 -0.03 0.00 0.00 54.58 51.77 1br1 n ASN 740 Cb 0.31 -0.25 -0.14 0.00 -0.61 0.00 0.00 39.78 39.09 1br1 n ASN 740 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1br1 h ALA 741 N 0.00 -0.09 -2.92 5.41 0.00 -1.94 -3.43 119.26 116.30 1br1 h ALA 741 Ca 0.00 -0.76 -0.60 0.00 0.00 0.00 0.00 54.91 53.54 1br1 h ALA 741 Cb 0.87 0.13 -0.12 0.00 0.00 0.00 0.00 17.79 18.67 1br1 h ALA 741 CO 0.00 0.56 -0.26 0.42 0.00 0.00 0.00 179.25 179.97 1br1 s ILE 742 N -2.69 5.23 1.05 0.00 1.09 -1.26 -4.75 121.20 119.87 1br1 s ILE 742 Ca -0.11 0.60 -0.11 0.00 -1.10 0.00 0.00 60.65 59.93 1br1 s ILE 742 Cb 0.03 -3.68 0.22 0.00 -1.06 0.00 0.00 42.46 37.97 1br1 s ILE 742 CO 0.90 0.28 1.08 -2.84 -0.10 0.00 0.00 174.94 174.26 1br1 s PRO 743 N 1.21 -0.01 0.43 2.79 0.02 -1.26 -4.91 135.00 133.26 1br1 s PRO 743 Ca 0.17 1.20 0.11 0.00 0.02 0.00 0.00 61.00 62.50 1br1 s PRO 743 Cb -0.14 -1.63 0.98 0.00 0.02 0.00 0.00 34.50 33.72 1br1 s PRO 743 CO 0.07 -3.22 2.04 -0.22 -0.33 0.00 0.00 177.00 175.33 1br1 h LYS 744 N -2.28 0.42 -7.49 5.54 3.64 -1.97 -3.43 116.57 111.00 1br1 h LYS 744 Ca -0.53 -0.03 -0.45 0.00 -1.27 0.00 0.00 60.65 58.38 1br1 h LYS 744 Cb 1.30 -0.09 0.15 0.00 -0.41 0.00 0.00 32.23 33.18 1br1 h LYS 744 CO 0.46 0.28 0.26 0.20 -2.27 0.00 0.00 179.45 178.37 1br1 s GLY 745 N -3.77 1.60 0.45 5.01 0.00 -1.26 -5.06 107.32 104.29 1br1 s GLY 745 Ca -0.08 -0.66 -0.08 0.00 0.00 0.00 0.00 44.72 43.91 1br1 s GLY 745 CO 0.73 0.00 0.42 0.69 0.00 0.00 0.00 173.10 174.94 1br1 n PHE 746 N -4.04 -3.40 0.00 1.90 3.72 -1.26 -5.09 117.46 109.29 1br1 n PHE 746 Ca 0.08 -0.38 0.00 0.00 -0.05 0.00 0.00 57.45 57.11 1br1 n PHE 746 Cb 0.59 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 1br1 n PHE 746 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 1br1 n MET 747 N -2.69 0.00 -1.66 -1.08 1.56 -1.26 -4.95 117.12 107.04 1br1 n MET 747 Ca 0.06 0.00 -0.42 0.00 -0.27 0.00 0.00 57.70 57.06 1br1 n MET 747 Cb 0.22 0.00 -0.03 0.00 2.15 0.00 0.00 33.22 35.56 1br1 n MET 747 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 1br1 n ASP 748 N 0.00 4.11 -0.28 6.12 2.03 -1.26 -4.75 116.55 122.53 1br1 n ASP 748 Ca 0.00 0.89 -0.04 0.00 0.52 0.00 0.00 54.79 56.15 1br1 n ASP 748 Cb 0.00 -1.52 -0.02 0.00 -0.72 0.00 0.00 41.12 38.86 1br1 n ASP 748 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1br1 n GLY 749 N 4.58 -1.60 0.00 0.27 0.00 -1.26 0.13 105.19 107.31 1br1 n GLY 749 Ca 0.20 0.79 0.00 0.00 0.00 0.00 0.00 46.02 47.01 1br1 n GLY 749 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1br1 n LYS 750 N -4.92 0.00 -0.34 1.61 4.81 -1.26 -1.56 118.16 116.49 1br1 n LYS 750 Ca 0.04 0.08 0.03 0.00 -0.87 0.00 0.00 58.31 57.59 1br1 n LYS 750 Cb 0.22 -0.86 0.10 0.00 0.02 0.00 0.00 35.03 34.51 1br1 n LYS 750 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1br1 n GLN 751 N -0.44 -0.13 -0.04 1.64 0.00 -0.96 0.66 117.38 118.11 1br1 n GLN 751 Ca 0.00 1.45 0.23 0.00 -0.00 0.00 0.00 57.00 58.68 1br1 n GLN 751 Cb 0.00 -2.16 0.71 0.00 0.00 0.00 0.00 30.24 28.79 1br1 n GLN 751 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1br1 h ALA 752 N 1.66 2.55 0.00 1.69 0.00 0.11 -0.64 119.26 124.63 1br1 h ALA 752 Ca 0.40 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.21 1br1 h ALA 752 Cb 0.64 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1br1 h ALA 752 CO -0.95 -0.79 -1.52 0.00 0.00 0.00 0.00 179.25 175.99 1br1 h ILE 754 N 0.00 0.49 0.44 0.00 5.03 0.19 -2.41 117.51 121.26 1br1 h ILE 754 Ca -0.09 -0.69 -0.02 0.00 -0.12 0.00 0.00 64.86 63.94 1br1 h ILE 754 Cb 1.27 1.47 0.00 0.00 -3.03 0.00 0.00 36.82 36.53 1br1 h ILE 754 CO 0.01 0.13 -0.21 -0.07 -0.68 0.00 0.00 178.15 177.34 1br1 h LEU 755 N 0.00 -0.50 0.00 1.44 4.07 -1.54 -2.60 115.31 116.18 1br1 h LEU 755 Ca -0.00 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.89 1br1 h LEU 755 Cb 0.46 0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.33 1br1 h LEU 755 CO 0.02 -0.22 0.00 1.15 -1.08 0.00 0.00 178.44 178.31 1br1 n MET 756 N -5.27 0.13 0.04 1.13 0.00 -0.94 -0.84 117.12 111.38 1br1 n MET 756 Ca -0.11 0.20 -0.11 0.00 0.00 0.00 0.00 57.70 57.68 1br1 n MET 756 Cb 0.29 -1.50 -0.13 0.00 0.00 0.00 0.00 33.22 31.88 1br1 n MET 756 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 175.97 176.79 1br1 h ILE 757 N 0.00 1.33 0.00 3.17 2.04 -1.14 -3.02 117.51 119.89 1br1 h ILE 757 Ca 0.00 -3.04 -0.15 0.00 1.00 0.00 0.00 64.86 62.66 1br1 h ILE 757 Cb 0.11 2.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.89 1br1 h ILE 757 CO 0.00 0.81 -0.72 0.11 0.00 0.00 0.00 178.15 178.34 1br1 h LYS 758 N 0.02 0.00 0.00 2.37 1.79 -0.81 -2.31 116.57 117.64 1br1 h LYS 758 Ca -0.15 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.30 1br1 h LYS 758 Cb 1.91 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.56 1br1 h LYS 758 CO 0.13 0.72 -0.09 0.00 -1.08 0.00 0.00 179.45 179.14 1br1 h ALA 759 N 1.28 1.16 -0.05 3.86 0.00 -1.20 -0.21 119.26 124.09 1br1 h ALA 759 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1br1 h ALA 759 Cb 1.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1br1 h ALA 759 CO 0.09 0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.73 1br1 n LEU 760 N -3.42 2.56 -4.25 0.00 4.77 -1.07 -4.96 117.00 110.64 1br1 n LEU 760 Ca -0.01 -1.05 -0.37 0.00 -0.03 0.00 0.00 56.01 54.55 1br1 n LEU 760 Cb 0.24 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 1br1 n LEU 760 CO 0.28 0.46 -0.04 -0.62 -1.33 0.00 0.00 177.39 176.15 1br1 n GLU 761 N 1.03 -3.01 -1.83 3.23 1.02 -0.09 -4.86 120.64 116.13 1br1 n GLU 761 Ca 0.11 0.36 -0.41 0.00 -0.02 0.00 0.00 57.16 57.19 1br1 n GLU 761 Cb 0.46 -5.07 -0.01 0.00 -0.02 0.00 0.00 31.44 26.79 1br1 n GLU 761 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1br1 s LEU 762 N -7.27 4.34 0.15 -4.62 2.01 -1.06 -4.93 118.68 107.31 1br1 s LEU 762 Ca 0.75 2.95 -0.31 0.00 0.01 0.00 0.00 54.13 57.53 1br1 s LEU 762 Cb -0.41 -3.65 -0.08 0.00 0.01 0.00 0.00 46.19 42.06 1br1 s LEU 762 CO 0.94 -0.85 1.37 -0.62 1.01 0.00 0.00 176.35 178.19 1br1 s ASP 763 N 0.14 6.84 0.00 2.29 -1.08 -1.26 -4.85 116.67 118.75 1br1 s ASP 763 Ca 0.57 2.36 0.00 0.00 -0.52 0.00 0.00 52.55 54.97 1br1 s ASP 763 Cb -0.46 -2.60 0.00 0.00 -1.46 0.00 0.00 42.92 38.40 1br1 s ASP 763 CO 0.54 -0.61 0.07 -0.81 0.52 0.00 0.00 175.17 174.88 1br1 n PRO 764 N 3.47 0.09 0.00 4.34 -0.04 -1.26 -0.89 135.00 140.71 1br1 n PRO 764 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1br1 n PRO 764 Cb 0.42 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.64 1br1 n PRO 764 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1br1 n ASN 765 N 0.70 0.69 -0.02 3.54 2.85 -1.26 -4.72 115.26 117.04 1br1 n ASN 765 Ca 0.00 -0.14 -0.16 0.00 -0.11 0.00 0.00 54.58 54.17 1br1 n ASN 765 Cb 0.04 0.42 -0.13 0.00 1.24 0.00 0.00 39.78 41.34 1br1 n ASN 765 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1br1 h LEU 766 N 0.00 0.20-10.51 1.20 3.38 -1.39 -3.46 115.31 104.73 1br1 h LEU 766 Ca 0.00 -0.95 -0.48 0.00 0.09 0.00 0.00 57.88 56.55 1br1 h LEU 766 Cb 0.00 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 40.70 1br1 h LEU 766 CO 0.00 1.13 -0.20 -0.72 0.09 0.00 0.00 178.44 178.74 1br1 s TYR 767 N -2.45 2.00 -0.28 1.13 -0.85 -1.23 -0.01 117.35 115.65 1br1 s TYR 767 Ca -0.17 -0.61 0.00 0.00 -0.52 0.00 0.00 57.07 55.78 1br1 s TYR 767 Cb -0.01 -2.23 0.17 0.00 0.38 0.00 0.00 41.96 40.27 1br1 s TYR 767 CO 0.75 -0.76 0.50 1.03 -1.52 0.00 0.00 175.55 175.55 1br1 s ARG 768 N -4.48 0.48 0.19 -3.49 3.00 0.12 -4.91 118.95 109.86 1br1 s ARG 768 Ca 0.56 0.62 -0.30 0.00 0.00 0.00 0.00 55.73 56.61 1br1 s ARG 768 Cb -0.06 0.05 -0.08 0.00 0.00 0.00 0.00 34.95 34.86 1br1 s ARG 768 CO 0.34 -0.79 1.14 0.42 0.00 0.00 0.00 175.30 176.42 1br1 s ILE 769 N 2.71 3.69 0.00 1.52 -1.09 -1.26 0.13 121.20 126.89 1br1 s ILE 769 Ca 0.14 1.47 0.00 0.00 -2.23 0.00 0.00 60.65 60.03 1br1 s ILE 769 Cb -0.14 -3.94 0.00 0.00 -1.58 0.00 0.00 42.46 36.81 1br1 s ILE 769 CO -0.22 0.26 0.00 0.61 -1.23 0.00 0.00 174.94 174.35 1br1 n GLY 770 N 2.00 4.27 0.10 6.18 0.00 -0.52 -4.72 105.19 112.50 1br1 n GLY 770 Ca 0.03 -1.66 -0.20 0.00 0.00 0.00 0.00 46.02 44.19 1br1 n GLY 770 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1br1 n GLN 771 N 0.00 0.55 -0.00 1.61 0.00 -1.00 -4.74 117.38 113.80 1br1 n GLN 771 Ca 0.00 0.52 0.01 0.00 -0.00 0.00 0.00 57.00 57.52 1br1 n GLN 771 Cb 0.00 -1.69 -0.01 0.00 0.00 0.00 0.00 30.24 28.53 1br1 n GLN 771 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1br1 n SER 772 N -4.43 4.50 -4.27 1.69 3.41 -1.26 -5.00 113.62 108.25 1br1 n SER 772 Ca -0.31 -0.01 -0.15 0.00 -0.26 0.00 0.00 58.87 58.14 1br1 n SER 772 Cb 0.65 1.08 -0.10 0.00 -0.26 0.00 0.00 64.21 65.58 1br1 n SER 772 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1br1 s LYS 773 N -2.11 1.17 -0.08 4.33 -2.85 -1.26 -1.41 119.74 117.53 1br1 s LYS 773 Ca -0.01 -1.56 -0.03 0.00 -1.00 0.00 0.00 55.97 53.38 1br1 s LYS 773 Cb 0.01 -0.50 -0.04 0.00 -2.06 0.00 0.00 37.83 35.25 1br1 s LYS 773 CO 0.08 -0.06 0.06 0.42 0.10 0.00 0.00 175.35 175.95 1br1 s ILE 774 N -3.47 4.76 -0.35 3.79 1.01 0.14 -1.44 121.20 125.64 1br1 s ILE 774 Ca 0.23 -0.15 -0.07 0.00 0.00 0.00 0.00 60.65 60.65 1br1 s ILE 774 Cb 0.05 -3.07 0.04 0.00 0.01 0.00 0.00 42.46 39.49 1br1 s ILE 774 CO 0.04 0.55 0.14 -0.36 0.00 0.00 0.00 174.94 175.31 1br1 s PHE 775 N -1.00 3.27 0.47 3.97 0.40 0.34 -0.83 117.98 124.60 1br1 s PHE 775 Ca 0.16 -1.37 0.04 0.00 -0.60 0.00 0.00 56.93 55.16 1br1 s PHE 775 Cb -0.12 -2.38 0.02 0.00 0.51 0.00 0.00 43.02 41.05 1br1 s PHE 775 CO 0.06 -0.73 0.66 -0.06 0.70 0.00 0.00 175.22 175.85 1br1 s PHE 776 N 1.43 2.94 0.29 0.36 0.08 0.17 0.12 117.98 123.38 1br1 s PHE 776 Ca -0.00 -0.10 -0.00 0.00 0.12 0.00 0.00 56.93 56.94 1br1 s PHE 776 Cb -0.20 -2.48 -0.04 0.00 -0.57 0.00 0.00 43.02 39.74 1br1 s PHE 776 CO 0.03 -0.55 0.50 0.50 -0.10 0.00 0.00 175.22 175.60 1br1 s ARG 777 N -4.54 3.51 0.25 0.44 6.06 0.99 -3.28 118.95 122.37 1br1 s ARG 777 Ca 0.53 -0.32 -0.30 0.00 -2.50 0.00 0.00 55.73 53.14 1br1 s ARG 777 Cb -0.10 -2.72 -0.15 0.00 0.06 0.00 0.00 34.95 32.04 1br1 s ARG 777 CO 0.36 0.24 1.07 2.41 -2.50 0.00 0.00 175.30 176.88 1br1 n THR 778 N -1.36 1.58 0.00 4.11 -1.04 -1.26 -1.48 114.28 114.82 1br1 n THR 778 Ca -0.05 -0.39 0.00 0.00 -2.04 0.00 0.00 64.05 61.57 1br1 n THR 778 Cb 0.55 -0.95 0.00 0.00 -1.82 0.00 0.00 70.33 68.12 1br1 n THR 778 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1br1 n GLY 779 N 1.56 2.33 0.37 3.41 0.00 -1.26 -4.80 105.19 106.79 1br1 n GLY 779 Ca 0.12 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.23 1br1 n GLY 779 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1br1 h VAL 780 N 0.00 0.88 0.00 1.61 2.07 -1.66 -0.71 116.25 118.44 1br1 h VAL 780 Ca 0.00 -0.28 -0.19 0.00 0.82 0.00 0.00 66.70 67.05 1br1 h VAL 780 Cb 0.00 -0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.74 1br1 h VAL 780 CO 0.00 0.15 -0.92 0.25 0.02 0.00 0.00 177.57 177.07 1br1 h LEU 781 N 0.81 0.00 -0.14 2.57 5.85 -1.87 -3.07 115.31 119.45 1br1 h LEU 781 Ca 0.46 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.18 1br1 h LEU 781 Cb 0.60 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1br1 h LEU 781 CO -0.22 0.92 0.09 0.00 -0.34 0.00 0.00 178.44 178.89 1br1 h ALA 782 N 1.08 0.18 -0.77 1.25 0.00 -1.51 -1.21 119.26 118.29 1br1 h ALA 782 Ca -0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1br1 h ALA 782 Cb 1.66 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.36 1br1 h ALA 782 CO 0.12 -0.31 0.40 1.25 0.00 0.00 0.00 179.25 180.71 1br1 h HIS 783 N 0.17 1.08 -1.01 0.00 -0.00 -1.52 -0.19 115.15 113.68 1br1 h HIS 783 Ca 0.05 -0.04 0.02 0.00 -0.00 0.00 0.00 60.37 60.40 1br1 h HIS 783 Cb 0.02 -0.34 -0.05 0.00 -0.00 0.00 0.00 27.41 27.04 1br1 h HIS 783 CO -0.06 0.77 0.67 -0.07 -0.00 0.00 0.00 177.93 179.25 1br1 h LEU 784 N 1.07 1.14 -0.14 0.26 -0.00 -1.37 -1.82 115.31 114.46 1br1 h LEU 784 Ca 0.27 -0.02 -0.02 0.00 -0.00 0.00 0.00 57.88 58.10 1br1 h LEU 784 Cb 0.07 -0.28 -0.00 0.00 -0.00 0.00 0.00 40.66 40.45 1br1 h LEU 784 CO -0.04 0.81 -0.00 -0.08 -0.00 0.00 0.00 178.44 179.13 1br1 h GLU 785 N 1.34 0.24 -0.10 1.13 4.57 -0.50 -2.90 114.58 118.36 1br1 h GLU 785 Ca 0.38 -0.08 0.02 0.00 -1.18 0.00 0.00 59.36 58.50 1br1 h GLU 785 Cb -0.10 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.43 1br1 h GLU 785 CO -0.10 0.48 -0.25 1.49 -1.18 0.00 0.00 179.01 179.45 1br1 h GLU 786 N -0.03 -0.23 -1.00 1.92 4.81 -0.55 -1.03 114.58 118.48 1br1 h GLU 786 Ca 0.04 0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.39 1br1 h GLU 786 Cb 0.37 0.05 -0.13 0.00 0.63 0.00 0.00 28.75 29.67 1br1 h GLU 786 CO 0.01 -0.15 -0.53 0.93 -0.73 0.00 0.00 179.01 178.53 1br1 h GLU 787 N -0.24 -0.00 -0.97 1.92 4.39 -1.38 0.36 114.58 118.66 1br1 h GLU 787 Ca 0.02 0.00 0.16 0.00 0.34 0.00 0.00 59.36 59.88 1br1 h GLU 787 Cb 0.30 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.86 1br1 h GLU 787 CO -0.22 -0.00 0.61 -0.09 -1.16 0.00 0.00 179.01 178.15 1br1 h ARG 788 N -0.00 0.75 0.00 2.33 2.43 -1.24 0.45 114.38 119.10 1br1 h ARG 788 Ca 0.22 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1br1 h ARG 788 Cb 0.47 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 1br1 h ARG 788 CO -0.96 0.50 0.00 -0.44 -1.51 0.00 0.00 179.97 177.56 1br1 h ASP 789 N 0.78 0.00 0.03 -3.80 5.19 0.99 -2.66 116.42 116.95 1br1 h ASP 789 Ca 0.51 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.73 1br1 h ASP 789 Cb 0.77 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.26 1br1 h ASP 789 CO -0.28 0.00 -1.02 -0.07 -3.12 0.00 0.00 179.24 174.74 1br1 h LEU 790 N 0.00 0.09 -1.31 1.55 4.07 0.83 -2.72 115.31 117.81 1br1 h LEU 790 Ca 0.00 -0.70 0.00 0.00 0.08 0.00 0.00 57.88 57.26 1br1 h LEU 790 Cb 0.54 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.25 1br1 h LEU 790 CO 0.00 1.42 0.38 0.11 -1.08 0.00 0.00 178.44 179.27 1br1 h LYS 791 N -0.83 0.00 0.00 1.13 1.79 -0.12 -1.95 116.57 116.59 1br1 h LYS 791 Ca -0.26 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 1br1 h LYS 791 Cb 1.34 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.99 1br1 h LYS 791 CO -0.10 0.00 0.00 0.44 -1.08 0.00 0.00 179.45 178.71 1br1 n ILE 792 N -2.47 0.00 0.04 1.86 -5.35 -1.02 -4.85 119.36 107.56 1br1 n ILE 792 Ca -0.01 -0.47 -0.08 0.00 -0.27 0.00 0.00 62.75 61.92 1br1 n ILE 792 Cb 0.41 1.05 -0.05 0.00 -1.74 0.00 0.00 39.64 39.31 1br1 n ILE 792 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1br1 h THR 793 N 0.05 0.00 -0.97 7.28 2.02 -1.01 -1.10 112.91 119.18 1br1 h THR 793 Ca 0.00 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.27 1br1 h THR 793 Cb 0.02 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.32 1br1 h THR 793 CO 0.00 0.00 -0.57 -0.90 0.37 0.00 0.00 175.52 174.42 1br1 n ASP 794 N -3.98 -1.03 -0.24 4.18 5.68 -1.26 0.84 116.55 120.73 1br1 n ASP 794 Ca -0.04 1.74 0.04 0.00 -0.50 0.00 0.00 54.79 56.03 1br1 n ASP 794 Cb 0.20 -0.23 0.15 0.00 -1.14 0.00 0.00 41.12 40.10 1br1 n ASP 794 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1br1 h VAL 795 N 0.00 0.41 -0.25 2.12 2.07 -1.84 1.77 116.25 120.52 1br1 h VAL 795 Ca 0.15 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 67.64 1br1 h VAL 795 Cb 0.40 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1br1 h VAL 795 CO -0.91 0.02 0.14 0.40 0.02 0.00 0.00 177.57 177.25 1br1 h ILE 796 N 0.13 1.02 -0.28 4.57 1.08 0.11 0.43 117.51 124.58 1br1 h ILE 796 Ca 0.39 -0.10 0.05 0.00 -0.39 0.00 0.00 64.86 64.81 1br1 h ILE 796 Cb 0.68 0.70 -0.05 0.00 -3.07 0.00 0.00 36.82 35.07 1br1 h ILE 796 CO -0.60 0.05 -0.04 0.40 -0.69 0.00 0.00 178.15 177.27 1br1 h ILE 797 N 0.30 0.76 0.32 -0.67 2.04 0.60 0.79 117.51 121.64 1br1 h ILE 797 Ca 0.10 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 65.95 1br1 h ILE 797 Cb 0.00 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 1br1 h ILE 797 CO -0.05 0.01 -0.52 0.00 0.00 0.00 0.00 178.15 177.58 1br1 h ALA 798 N 1.26 -1.08 0.12 1.87 0.00 0.33 -2.54 119.26 119.23 1br1 h ALA 798 Ca 0.13 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1br1 h ALA 798 Cb 0.19 0.82 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1br1 h ALA 798 CO -0.26 -1.16 -0.21 0.35 0.00 0.00 0.00 179.25 177.96 1br1 h PHE 799 N -0.89 -0.57 -1.00 0.00 3.57 0.22 -2.10 116.94 116.17 1br1 h PHE 799 Ca -0.04 0.01 0.37 0.00 3.53 0.00 0.00 57.97 61.84 1br1 h PHE 799 Cb 0.83 0.23 -0.18 0.00 2.79 0.00 0.00 35.95 39.62 1br1 h PHE 799 CO -0.35 -0.31 0.37 1.96 -2.23 0.00 0.00 178.31 177.74 1br1 h GLN 800 N -0.41 0.02 0.15 1.11 4.20 0.76 -1.01 115.11 119.92 1br1 h GLN 800 Ca 0.02 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1br1 h GLN 800 Cb 0.42 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 1br1 h GLN 800 CO -0.11 0.01 -0.14 0.00 -0.67 0.00 0.00 178.83 177.92 1br1 h ALA 801 N 1.99 -0.87 -1.33 3.87 0.00 -0.95 -1.66 119.26 120.30 1br1 h ALA 801 Ca 0.76 -0.06 0.40 0.00 0.00 0.00 0.00 54.91 56.01 1br1 h ALA 801 Cb 1.88 0.38 -0.10 0.00 0.00 0.00 0.00 17.79 19.95 1br1 h ALA 801 CO -0.81 -0.88 0.90 1.96 0.00 0.00 0.00 179.25 180.41 1br1 h GLN 802 N -0.29 0.12 -0.20 0.00 1.08 -1.18 0.80 115.11 115.44 1br1 h GLN 802 Ca -0.02 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.14 1br1 h GLN 802 Cb 0.25 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 1br1 h GLN 802 CO -0.01 0.08 -0.00 0.00 -0.95 0.00 0.00 178.83 177.94 1br1 h ARG 804 N 0.12 0.57 0.00 0.00 3.08 0.13 0.79 114.38 119.07 1br1 h ARG 804 Ca 0.06 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1br1 h ARG 804 Cb 0.40 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1br1 h ARG 804 CO 0.01 0.56 0.00 0.41 -1.07 0.00 0.00 179.97 179.89 1br1 n GLY 805 N -0.93 -2.41 0.14 0.04 0.00 0.84 -1.19 105.19 101.69 1br1 n GLY 805 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.00 1br1 n GLY 805 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1br1 h TYR 806 N 0.00 -0.61 0.00 1.61 5.03 0.60 0.89 116.97 124.49 1br1 h TYR 806 Ca 0.00 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.35 1br1 h TYR 806 Cb 0.00 0.30 0.00 0.00 1.55 0.00 0.00 36.73 38.58 1br1 h TYR 806 CO 0.14 -0.14 0.71 1.25 -1.32 0.00 0.00 178.16 178.80 1br1 h LEU 807 N -0.05 0.00 0.00 2.82 6.46 0.52 -2.68 115.31 122.38 1br1 h LEU 807 Ca 0.04 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 1br1 h LEU 807 Cb 0.16 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.09 1br1 h LEU 807 CO -0.27 0.00 -0.39 0.00 -0.62 0.00 0.00 178.44 177.16 1br1 n ALA 808 N -1.59 0.34 -0.50 1.25 0.00 0.29 -3.78 120.51 116.52 1br1 n ALA 808 Ca -0.01 -0.41 0.41 0.00 0.00 0.00 0.00 53.44 53.43 1br1 n ALA 808 Cb 0.73 0.01 0.69 0.00 0.00 0.00 0.00 19.45 20.88 1br1 n ALA 808 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1br1 h ARG 809 N -0.51 0.04 0.01 0.00 -0.00 -0.76 -1.01 114.38 112.14 1br1 h ARG 809 Ca 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.98 1br1 h ARG 809 Cb 0.39 -0.01 0.00 0.00 -0.00 0.00 0.00 29.97 30.35 1br1 h ARG 809 CO 0.00 0.03 -0.00 0.87 -0.00 0.00 0.00 179.97 180.86 1br1 h LYS 810 N 0.04 -0.01 0.00 0.08 1.79 -1.70 -2.45 116.57 114.32 1br1 h LYS 810 Ca 0.86 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.33 1br1 h LYS 810 Cb 2.88 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 33.53 1br1 h LYS 810 CO -0.35 0.71 0.00 0.00 -1.08 0.00 0.00 179.45 178.72 1br1 n ALA 811 N -2.49 1.66 -0.10 3.86 0.00 -0.43 -2.31 120.51 120.70 1br1 n ALA 811 Ca -0.09 0.01 -0.20 0.00 0.00 0.00 0.00 53.44 53.16 1br1 n ALA 811 Cb 0.36 -1.30 -0.12 0.00 0.00 0.00 0.00 19.45 18.39 1br1 n ALA 811 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1br1 h PHE 812 N 0.00 0.00 0.00 0.00 3.57 -1.51 -3.25 116.94 115.75 1br1 h PHE 812 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1br1 h PHE 812 Cb 0.30 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.04 1br1 h PHE 812 CO 0.00 1.36 0.00 0.00 -2.23 0.00 0.00 178.31 177.44 1br1 n ALA 813 N -3.25 1.62 -0.12 2.41 0.00 -0.92 -1.21 120.51 119.03 1br1 n ALA 813 Ca -0.27 -0.01 -0.24 0.00 0.00 0.00 0.00 53.44 52.92 1br1 n ALA 813 Cb 0.63 -1.02 -0.09 0.00 0.00 0.00 0.00 19.45 18.97 1br1 n ALA 813 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1br1 n LYS 814 N -0.67 0.57 0.21 0.00 -0.00 -0.98 -4.15 118.16 113.14 1br1 n LYS 814 Ca 0.01 0.31 0.12 0.00 -0.00 0.00 0.00 58.31 58.74 1br1 n LYS 814 Cb 0.00 -1.53 0.62 0.00 -0.00 0.00 0.00 35.03 34.13 1br1 n LYS 814 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 1br1 h ARG 815 N -1.00 0.00 -0.02 -1.58 9.65 -1.21 0.42 114.38 120.65 1br1 h ARG 815 Ca -0.49 0.00 -0.14 0.00 -1.10 0.00 0.00 59.98 58.24 1br1 h ARG 815 Cb 1.41 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.97 1br1 h ARG 815 CO -0.30 0.00 -0.66 0.37 2.80 0.00 0.00 179.97 182.18 1br1 h GLN 816 N 0.00 0.08 -0.05 0.20 4.15 -1.66 -2.84 115.11 114.99 1br1 h GLN 816 Ca 0.00 -0.06 -0.18 0.00 0.77 0.00 0.00 58.65 59.18 1br1 h GLN 816 Cb 0.31 0.01 0.01 0.00 0.21 0.00 0.00 27.48 28.02 1br1 h GLN 816 CO 0.00 0.71 -0.66 -0.56 -1.93 0.00 0.00 178.83 176.39 1br1 h GLN 817 N 0.05 0.53 0.00 1.69 3.07 -0.32 0.26 115.11 120.39 1br1 h GLN 817 Ca -0.01 -0.51 -0.01 0.00 0.09 0.00 0.00 58.65 58.21 1br1 h GLN 817 Cb 1.17 0.13 -0.00 0.00 0.08 0.00 0.00 27.48 28.86 1br1 h GLN 817 CO 0.09 1.14 -0.04 -0.56 0.09 0.00 0.00 178.83 179.55 1br1 h GLN 818 N 0.12 0.00 0.02 0.06 -0.00 -1.58 0.45 115.11 114.18 1br1 h GLN 818 Ca -0.07 0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 58.53 1br1 h GLN 818 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.81 1br1 h GLN 818 CO 0.13 0.04 -0.24 1.25 -0.00 0.00 0.00 178.83 180.01 1br1 h LEU 819 N 0.00 0.08 -0.43 0.06 5.85 -1.31 -3.22 115.31 116.34 1br1 h LEU 819 Ca -0.00 -0.96 0.00 0.00 0.84 0.00 0.00 57.88 57.76 1br1 h LEU 819 Cb 0.27 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1br1 h LEU 819 CO 0.01 1.11 0.00 0.61 -0.34 0.00 0.00 178.44 179.82 1br1 n GLY 820 N 1.61 0.08 0.81 3.75 0.00 0.90 -5.10 105.19 107.23 1br1 n GLY 820 Ca -0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.02 1br1 n GLY 820 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76