#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2brm s ASP 8 N 0.00 6.10 0.18 4.31 2.15 -1.26 -5.12 116.67 123.02 2brm s ASP 8 Ca 0.00 0.05 0.11 0.00 0.43 0.00 0.00 52.55 53.14 2brm s ASP 8 Cb 0.00 -1.76 -0.04 0.00 -0.30 0.00 0.00 42.92 40.82 2brm s ASP 8 CO 0.00 0.02 -0.23 0.26 -0.17 0.00 0.00 175.17 175.05 2brm s TRP 9 N -1.83 2.19 -0.15 -5.34 0.52 -1.26 -4.82 118.94 108.25 2brm s TRP 9 Ca 0.34 -0.38 -0.05 0.00 0.02 0.00 0.00 56.10 56.02 2brm s TRP 9 Cb -0.10 -1.10 -0.04 0.00 -1.15 0.00 0.00 33.47 31.09 2brm s TRP 9 CO 0.27 0.45 0.03 -0.51 0.02 0.00 0.00 176.95 177.21 2brm s ASP 10 N -2.61 5.37 -0.58 2.95 -0.00 -1.16 -4.98 116.67 115.65 2brm s ASP 10 Ca 0.19 0.06 -0.24 0.00 -0.00 0.00 0.00 52.55 52.55 2brm s ASP 10 Cb -0.08 -1.83 0.04 0.00 -0.00 0.00 0.00 42.92 41.06 2brm s ASP 10 CO 0.09 0.22 0.99 -0.76 -0.00 0.00 0.00 175.17 175.71 2brm s LEU 11 N 0.07 4.04 -0.03 1.23 1.02 -1.26 -2.05 118.68 121.70 2brm s LEU 11 Ca 0.03 -0.43 -0.00 0.00 0.02 0.00 0.00 54.13 53.75 2brm s LEU 11 Cb -0.13 -2.77 -0.00 0.00 0.02 0.00 0.00 46.19 43.32 2brm s LEU 11 CO 0.01 -1.32 0.02 0.58 0.02 0.00 0.00 176.35 175.66 2brm h VAL 12 N 6.02 0.00 -3.10 -1.59 2.07 -1.88 -3.50 116.25 114.27 2brm h VAL 12 Ca -0.27 -0.27 -0.52 0.00 0.82 0.00 0.00 66.70 66.46 2brm h VAL 12 Cb 1.07 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.71 2brm h VAL 12 CO 1.12 0.00 -0.52 0.00 0.02 0.00 0.00 177.57 178.19 2brm s GLN 13 N -1.19 1.84 -0.35 1.57 -2.07 -1.26 -5.00 119.66 113.20 2brm s GLN 13 Ca -0.00 -2.10 -0.06 0.00 -1.82 0.00 0.00 55.36 51.38 2brm s GLN 13 Cb 0.00 -0.44 0.05 0.00 -1.09 0.00 0.00 33.01 31.53 2brm s GLN 13 CO 0.00 -0.48 0.12 0.99 -1.32 0.00 0.00 175.29 174.60 2brm s THR 14 N -3.31 3.74 0.11 3.63 2.01 -1.26 -2.37 115.64 118.20 2brm s THR 14 Ca 0.28 -1.22 -0.16 0.00 0.31 0.00 0.00 61.69 60.90 2brm s THR 14 Cb 0.03 -3.16 -0.05 0.00 0.01 0.00 0.00 72.50 69.34 2brm s THR 14 CO 0.16 -0.23 1.55 -0.07 -0.69 0.00 0.00 174.62 175.34 2brm h LEU 15 N 8.21 0.59 0.00 4.42 -0.00 -1.60 -3.47 115.31 123.46 2brm h LEU 15 Ca -0.22 -0.31 0.00 0.00 -0.00 0.00 0.00 57.88 57.34 2brm h LEU 15 Cb 1.08 -0.16 0.00 0.00 -0.00 0.00 0.00 40.66 41.58 2brm h LEU 15 CO 0.62 0.76 0.00 0.61 -0.00 0.00 0.00 178.44 180.42 2brm n GLY 16 N -0.34 1.03 3.51 0.83 0.00 -1.19 -5.03 105.19 104.01 2brm n GLY 16 Ca -0.02 0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 2brm n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2brm s GLU 17 N -0.20 3.19 -0.88 1.61 2.02 -1.26 -2.22 118.70 120.97 2brm s GLU 17 Ca 0.00 -0.55 -0.10 0.00 0.02 0.00 0.00 54.97 54.34 2brm s GLU 17 Cb 0.00 -4.28 0.23 0.00 0.10 0.00 0.00 34.13 30.17 2brm s GLU 17 CO 0.00 -2.02 0.81 0.20 0.02 0.00 0.00 175.26 174.27 2brm s GLY 18 N 3.79 2.83 0.00 -1.39 0.00 -0.98 -4.94 107.32 106.63 2brm s GLY 18 Ca 0.31 -3.50 0.00 0.00 0.00 0.00 0.00 44.72 41.53 2brm s GLY 18 CO 0.11 1.25 0.00 0.00 0.00 0.00 0.00 173.10 174.46 2brm n ALA 19 N 3.42 0.00 -0.11 3.20 0.00 -1.26 -3.42 120.51 122.34 2brm n ALA 19 Ca 0.16 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.77 2brm n ALA 19 Cb 0.43 0.00 0.56 0.00 0.00 0.00 0.00 19.45 20.44 2brm n ALA 19 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 2brm h TYR 20 N 0.00 0.33 0.00 0.00 -0.00 -1.93 -3.46 116.97 111.90 2brm h TYR 20 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.74 2brm h TYR 20 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 36.73 36.63 2brm h TYR 20 CO 0.00 0.13 0.00 0.41 -0.00 0.00 0.00 178.16 178.70 2brm n GLY 21 N -1.56 1.14 3.21 0.10 0.00 -1.22 -4.22 105.19 102.64 2brm n GLY 21 Ca 0.13 0.35 -0.09 0.00 0.00 0.00 0.00 46.02 46.40 2brm n GLY 21 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2brm s GLU 22 N 3.39 0.95 -0.04 1.61 -1.05 -1.18 -2.32 118.70 120.07 2brm s GLU 22 Ca 0.00 -1.27 0.06 0.00 -0.15 0.00 0.00 54.97 53.61 2brm s GLU 22 Cb 0.00 0.29 -0.01 0.00 -0.44 0.00 0.00 34.13 33.97 2brm s GLU 22 CO 0.00 -0.29 -0.22 0.08 0.95 0.00 0.00 175.26 175.77 2brm s VAL 23 N -3.98 1.82 0.04 1.83 1.01 -0.94 -1.20 120.40 118.97 2brm s VAL 23 Ca 0.17 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.24 2brm s VAL 23 Cb 0.06 -1.53 -0.02 0.00 0.00 0.00 0.00 36.38 34.89 2brm s VAL 23 CO -0.02 0.51 -0.13 -1.10 0.00 0.00 0.00 175.10 174.36 2brm s GLN 24 N -0.28 0.86 -1.03 2.72 -0.21 -0.98 -1.48 119.66 119.26 2brm s GLN 24 Ca 0.02 -0.78 -0.20 0.00 0.02 0.00 0.00 55.36 54.42 2brm s GLN 24 Cb -0.11 -0.85 0.09 0.00 1.00 0.00 0.00 33.01 33.14 2brm s GLN 24 CO 0.01 0.20 1.37 -1.17 -2.12 0.00 0.00 175.29 173.59 2brm s LEU 25 N -1.26 4.20 -0.58 2.90 1.98 -1.00 -1.60 118.68 123.32 2brm s LEU 25 Ca -0.00 -1.89 -0.27 0.00 -2.89 0.00 0.00 54.13 49.08 2brm s LEU 25 Cb -0.08 -2.50 0.03 0.00 0.66 0.00 0.00 46.19 44.30 2brm s LEU 25 CO 0.01 -1.26 1.14 0.00 -1.89 0.00 0.00 176.35 174.36 2brm s ALA 26 N 3.83 3.02 -0.21 5.97 0.00 -0.70 -2.97 121.76 130.71 2brm s ALA 26 Ca 0.42 -0.93 -0.08 0.00 0.00 0.00 0.00 51.96 51.37 2brm s ALA 26 Cb -0.01 -3.98 -0.04 0.00 0.00 0.00 0.00 23.12 19.08 2brm s ALA 26 CO -0.07 -2.63 0.08 0.08 0.00 0.00 0.00 175.76 173.22 2brm s VAL 27 N 4.77 4.77 0.28 0.00 1.01 -0.87 -2.48 120.40 127.88 2brm s VAL 27 Ca 0.40 -0.03 -0.29 0.00 0.00 0.00 0.00 61.98 62.05 2brm s VAL 27 Cb -0.09 -3.18 -0.10 0.00 0.00 0.00 0.00 36.38 33.02 2brm s VAL 27 CO 0.24 0.41 1.14 0.21 0.00 0.00 0.00 175.10 177.10 2brm s ASN 28 N 0.78 7.17 -0.00 3.32 3.04 -1.18 -3.01 114.94 125.05 2brm s ASN 28 Ca 0.04 2.34 0.11 0.00 0.04 0.00 0.00 52.86 55.40 2brm s ASN 28 Cb -0.13 -2.63 0.33 0.00 -1.54 0.00 0.00 41.25 37.28 2brm s ASN 28 CO 0.02 -0.23 1.27 -2.11 -3.04 0.00 0.00 177.10 173.01 2brm n ARG 29 N 1.24 1.90 -0.01 0.43 0.00 -1.26 -2.30 116.66 116.66 2brm n ARG 29 Ca -0.00 -1.36 -0.05 0.00 -0.00 0.00 0.00 57.85 56.44 2brm n ARG 29 Cb 0.44 -1.31 -0.02 0.00 -0.00 0.00 0.00 32.46 31.58 2brm n ARG 29 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2brm n VAL 30 N 0.59 1.21 0.20 8.89 0.31 -1.26 -4.79 118.33 123.49 2brm n VAL 30 Ca 0.13 0.23 0.11 0.00 -0.01 0.00 0.00 64.34 64.80 2brm n VAL 30 Cb 0.33 -1.84 -0.01 0.00 -0.91 0.00 0.00 33.84 31.40 2brm n VAL 30 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2brm n THR 31 N -3.81 0.41 -2.25 2.52 -1.04 -1.26 -4.98 114.28 103.88 2brm n THR 31 Ca -0.08 -0.47 -0.16 0.00 -2.04 0.00 0.00 64.05 61.30 2brm n THR 31 Cb 0.28 -0.17 -0.01 0.00 -1.82 0.00 0.00 70.33 68.61 2brm n THR 31 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2brm n GLU 32 N -2.44 -1.30 -2.53 -2.82 -0.58 -0.97 -4.98 120.64 105.02 2brm n GLU 32 Ca -0.00 0.82 -0.43 0.00 -0.42 0.00 0.00 57.16 57.13 2brm n GLU 32 Cb 0.53 -5.21 -0.02 0.00 -0.57 0.00 0.00 31.44 26.16 2brm n GLU 32 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 2brm s GLU 33 N -4.71 4.33 -0.16 3.49 2.12 -1.26 -4.84 118.70 117.67 2brm s GLU 33 Ca 0.00 1.57 -0.13 0.00 0.36 0.00 0.00 54.97 56.77 2brm s GLU 33 Cb 0.00 -3.60 -0.05 0.00 0.26 0.00 0.00 34.13 30.74 2brm s GLU 33 CO 0.00 -0.49 0.28 0.00 -0.54 0.00 0.00 175.26 174.51 2brm s ALA 34 N 2.53 3.60 -0.06 6.30 0.00 -1.26 -3.11 121.76 129.76 2brm s ALA 34 Ca 0.53 -0.47 -0.05 0.00 0.00 0.00 0.00 51.96 51.97 2brm s ALA 34 Cb -0.22 -2.37 0.02 0.00 0.00 0.00 0.00 23.12 20.55 2brm s ALA 34 CO 0.18 0.11 0.15 0.14 0.00 0.00 0.00 175.76 176.33 2brm s VAL 35 N 0.41 -0.01 0.65 0.00 -7.23 -1.04 -4.34 120.40 108.85 2brm s VAL 35 Ca 0.16 0.03 -0.14 0.00 -1.81 0.00 0.00 61.98 60.22 2brm s VAL 35 Cb -0.13 -0.22 -0.01 0.00 0.56 0.00 0.00 36.38 36.59 2brm s VAL 35 CO 0.04 0.01 1.08 0.00 -0.31 0.00 0.00 175.10 175.92 2brm s ALA 36 N 0.26 2.59 -0.29 1.32 0.00 -0.83 -1.72 121.76 123.09 2brm s ALA 36 Ca -0.02 0.37 -0.03 0.00 0.00 0.00 0.00 51.96 52.29 2brm s ALA 36 Cb -0.03 -3.25 0.11 0.00 0.00 0.00 0.00 23.12 19.95 2brm s ALA 36 CO -0.01 -1.13 0.17 0.08 0.00 0.00 0.00 175.76 174.87 2brm s VAL 37 N -2.57 -0.13 0.28 0.00 1.01 -0.63 -1.72 120.40 116.65 2brm s VAL 37 Ca 0.63 -0.74 -0.29 0.00 0.00 0.00 0.00 61.98 61.58 2brm s VAL 37 Cb -0.17 -0.98 -0.10 0.00 0.00 0.00 0.00 36.38 35.13 2brm s VAL 37 CO 0.43 -0.68 1.14 -0.75 0.00 0.00 0.00 175.10 175.24 2brm s LYS 38 N 2.11 4.58 -0.24 2.72 2.20 -0.80 -2.33 119.74 127.99 2brm s LYS 38 Ca 0.09 1.88 -0.00 0.00 -0.36 0.00 0.00 55.97 57.58 2brm s LYS 38 Cb -0.16 -3.17 0.07 0.00 -1.51 0.00 0.00 37.83 33.05 2brm s LYS 38 CO -0.34 0.13 -0.01 0.42 -0.36 0.00 0.00 175.35 175.19 2brm s ILE 39 N -1.08 1.20 -0.12 5.43 1.01 -0.34 -2.04 121.20 125.26 2brm s ILE 39 Ca 0.46 -1.10 0.01 0.00 0.00 0.00 0.00 60.65 60.01 2brm s ILE 39 Cb -0.33 -1.60 -0.01 0.00 0.01 0.00 0.00 42.46 40.52 2brm s ILE 39 CO 0.43 -0.22 -0.16 -0.69 0.00 0.00 0.00 174.94 174.29 2brm s VAL 40 N 1.53 2.75 -0.39 2.92 1.01 -1.16 -3.08 120.40 123.98 2brm s VAL 40 Ca -0.02 -0.77 -0.23 0.00 0.00 0.00 0.00 61.98 60.96 2brm s VAL 40 Cb -0.18 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.08 2brm s VAL 40 CO -0.09 0.53 0.78 -0.62 0.00 0.00 0.00 175.10 175.71 2brm s ASP 41 N 0.37 6.50 0.57 3.32 -1.08 -1.26 -3.07 116.67 122.02 2brm s ASP 41 Ca -0.13 0.20 -0.15 0.00 -0.52 0.00 0.00 52.55 51.94 2brm s ASP 41 Cb -0.16 -2.39 -0.05 0.00 -1.46 0.00 0.00 42.92 38.85 2brm s ASP 41 CO 0.06 -0.79 1.03 -0.04 0.52 0.00 0.00 175.17 175.95 2brm s MET 42 N 3.17 3.53 -0.17 4.34 -1.94 -1.25 -5.07 119.30 121.91 2brm s MET 42 Ca 0.31 1.07 -0.04 0.00 -1.71 0.00 0.00 55.69 55.32 2brm s MET 42 Cb -0.13 -2.07 0.01 0.00 2.01 0.00 0.00 34.83 34.65 2brm s MET 42 CO 0.19 -0.63 0.10 0.00 -0.01 0.00 0.00 175.02 174.67 2brm n PRO 49 N -1.37 2.18 0.20 0.00 -0.04 -1.26 -4.15 135.00 130.56 2brm n PRO 49 Ca -0.02 -1.49 0.12 0.00 -0.04 0.00 0.00 63.50 62.07 2brm n PRO 49 Cb 0.09 -1.71 0.22 0.00 -0.04 0.00 0.00 33.50 32.06 2brm n PRO 49 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2brm h GLU 50 N 1.13 0.00 -0.22 0.54 4.22 -2.03 -3.02 114.58 115.20 2brm h GLU 50 Ca 0.17 0.00 -0.18 0.00 0.08 0.00 0.00 59.36 59.43 2brm h GLU 50 Cb 1.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.86 2brm h GLU 50 CO 0.41 0.00 -0.56 -0.91 -2.18 0.00 0.00 179.01 175.76 2brm h ASN 51 N 0.00 0.87 0.64 1.04 2.35 -1.93 -3.07 115.58 115.48 2brm h ASN 51 Ca 0.00 -0.57 -0.27 0.00 -0.55 0.00 0.00 56.30 54.91 2brm h ASN 51 Cb 0.95 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 39.04 2brm h ASN 51 CO 0.00 1.29 -1.42 -0.29 -1.65 0.00 0.00 177.43 175.36 2brm h ILE 52 N 0.50 1.23 -0.03 2.81 6.09 -1.88 -3.03 117.51 123.21 2brm h ILE 52 Ca -0.01 -2.97 -0.16 0.00 -1.37 0.00 0.00 64.86 60.35 2brm h ILE 52 Cb 1.18 2.67 -0.01 0.00 0.47 0.00 0.00 36.82 41.13 2brm h ILE 52 CO 0.12 0.77 -0.70 0.50 -3.07 0.00 0.00 178.15 175.77 2brm h LYS 53 N 0.02 0.17 -0.10 2.19 1.63 -1.66 -2.35 116.57 116.47 2brm h LYS 53 Ca -0.18 -0.14 -0.17 0.00 -0.85 0.00 0.00 60.65 59.31 2brm h LYS 53 Cb 1.93 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 33.59 2brm h LYS 53 CO 0.12 0.80 -0.65 -0.22 -3.45 0.00 0.00 179.45 176.05 2brm h LYS 54 N 0.12 0.40 -0.27 1.90 3.64 -1.66 -2.97 116.57 117.73 2brm h LYS 54 Ca -0.02 -0.30 -0.07 0.00 -1.27 0.00 0.00 60.65 59.00 2brm h LYS 54 Cb 1.25 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 2brm h LYS 54 CO 0.10 0.92 -0.12 1.49 -2.27 0.00 0.00 179.45 179.57 2brm h GLU 55 N 0.29 0.45 -0.12 1.90 4.81 -1.38 -2.51 114.58 118.02 2brm h GLU 55 Ca -0.02 -0.12 -0.23 0.00 -0.13 0.00 0.00 59.36 58.86 2brm h GLU 55 Cb 1.20 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 30.54 2brm h GLU 55 CO 0.11 0.57 -0.82 0.82 -0.73 0.00 0.00 179.01 178.97 2brm h ILE 56 N 0.42 1.28 -0.40 2.32 2.04 -1.41 -2.38 117.51 119.38 2brm h ILE 56 Ca 0.08 -2.02 -0.07 0.00 1.00 0.00 0.00 64.86 63.85 2brm h ILE 56 Cb 0.47 2.07 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 2brm h ILE 56 CO 0.03 0.64 -0.03 0.00 0.00 0.00 0.00 178.15 178.79 2brm h ILE 58 N 0.54 1.26 -0.00 0.00 2.04 -1.52 -2.90 117.51 116.93 2brm h ILE 58 Ca 0.11 -1.19 -0.07 0.00 1.00 0.00 0.00 64.86 64.71 2brm h ILE 58 Cb 0.52 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 2brm h ILE 58 CO 0.03 0.39 -0.32 0.78 0.00 0.00 0.00 178.15 179.02 2brm h ASN 59 N 0.57 0.00 1.26 1.72 2.35 -1.23 -2.66 115.58 117.59 2brm h ASN 59 Ca 0.09 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 2brm h ASN 59 Cb 0.61 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 2brm h ASN 59 CO 0.04 0.33 -0.24 0.11 -1.65 0.00 0.00 177.43 176.03 2brm h LYS 60 N 0.00 0.00 0.00 0.81 1.57 -1.21 -2.99 116.57 114.76 2brm h LYS 60 Ca -0.00 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 2brm h LYS 60 Cb 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 2brm h LYS 60 CO 0.04 0.24 -0.34 0.52 -0.57 0.00 0.00 179.45 179.34 2brm h MET 61 N 0.00 0.00 -6.57 3.15 2.86 -1.41 -3.47 114.93 109.49 2brm h MET 61 Ca -0.00 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 57.12 2brm h MET 61 Cb 0.93 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.56 2brm h MET 61 CO 0.03 0.34 0.18 -0.51 1.06 0.00 0.00 176.91 178.02 2brm s LEU 62 N -6.67 4.52 -0.41 1.22 1.43 -1.13 -5.02 118.68 112.63 2brm s LEU 62 Ca 0.02 1.62 0.02 0.00 -1.03 0.00 0.00 54.13 54.76 2brm s LEU 62 Cb 0.09 -3.42 0.19 0.00 0.03 0.00 0.00 46.19 43.08 2brm s LEU 62 CO 0.69 0.15 0.81 0.21 0.23 0.00 0.00 176.35 178.44 2brm s ASN 63 N -1.29 -1.07 0.06 2.29 2.47 -1.26 -4.78 114.94 111.36 2brm s ASN 63 Ca 0.39 -0.79 -0.16 0.00 0.42 0.00 0.00 52.86 52.72 2brm s ASN 63 Cb -0.21 1.38 0.03 0.00 -1.45 0.00 0.00 41.25 40.99 2brm s ASN 63 CO 0.25 -0.09 0.36 -2.28 -3.72 0.00 0.00 177.10 171.62 2brm s HIS 64 N 1.55 -0.17 0.25 0.43 2.46 -1.26 -5.06 115.29 113.50 2brm s HIS 64 Ca 0.20 0.01 0.28 0.00 0.47 0.00 0.00 55.06 56.02 2brm s HIS 64 Cb 0.01 0.17 1.27 0.00 -0.13 0.00 0.00 32.58 33.89 2brm s HIS 64 CO -0.09 -0.57 1.97 1.05 -2.47 0.00 0.00 174.74 174.63 2brm h GLU 65 N 2.93 0.00 -0.47 2.88 9.09 -1.98 -2.98 114.58 124.06 2brm h GLU 65 Ca -0.32 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 58.84 2brm h GLU 65 Cb 1.21 0.00 -0.15 0.00 -1.65 0.00 0.00 28.75 28.16 2brm h GLU 65 CO 0.46 0.13 0.02 0.09 0.05 0.00 0.00 179.01 179.76 2brm n ASN 66 N -3.39 2.76 -3.86 3.06 4.13 -1.26 -4.86 115.26 111.85 2brm n ASN 66 Ca -0.01 -3.77 -0.15 0.00 1.68 0.00 0.00 54.58 52.33 2brm n ASN 66 Cb 0.32 -0.67 -0.15 0.00 -1.54 0.00 0.00 39.78 37.74 2brm n ASN 66 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2brm s VAL 67 N -3.32 0.15 -0.08 2.41 1.01 -1.13 -1.67 120.40 117.78 2brm s VAL 67 Ca 0.47 0.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.16 2brm s VAL 67 Cb 0.42 -0.19 -0.07 0.00 0.00 0.00 0.00 36.38 36.54 2brm s VAL 67 CO 0.01 0.09 1.96 -0.69 0.00 0.00 0.00 175.10 176.48 2brm s VAL 68 N 0.48 3.15 0.55 2.92 1.01 -0.78 -4.63 120.40 123.11 2brm s VAL 68 Ca -0.04 0.18 -0.20 0.00 0.00 0.00 0.00 61.98 61.91 2brm s VAL 68 Cb -0.07 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 2brm s VAL 68 CO -0.01 -0.05 1.24 -0.54 0.00 0.00 0.00 175.10 175.74 2brm s LYS 69 N 4.98 3.18 -0.26 2.72 1.02 -1.26 -4.78 119.74 125.33 2brm s LYS 69 Ca 0.88 1.93 -0.02 0.00 0.02 0.00 0.00 55.97 58.79 2brm s LYS 69 Cb -0.37 -2.12 0.03 0.00 -0.52 0.00 0.00 37.83 34.85 2brm s LYS 69 CO 0.37 -1.07 -0.05 0.12 -0.92 0.00 0.00 175.35 173.81 2brm s PHE 70 N -1.50 3.11 -0.17 3.18 5.36 -1.26 -1.56 117.98 125.14 2brm s PHE 70 Ca 0.73 -1.60 -0.20 0.00 -0.96 0.00 0.00 56.93 54.90 2brm s PHE 70 Cb -0.33 -2.07 -0.17 0.00 -0.34 0.00 0.00 43.02 40.11 2brm s PHE 70 CO 0.37 -0.74 0.29 1.88 -1.46 0.00 0.00 175.22 175.57 2brm h TYR 71 N 8.01 0.00 -0.86 10.12 0.05 -1.84 -3.48 116.97 128.97 2brm h TYR 71 Ca -0.30 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.48 2brm h TYR 71 Cb 1.10 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.84 2brm h TYR 71 CO 0.59 1.01 0.00 0.41 -1.05 0.00 0.00 178.16 179.12 2brm n GLY 72 N 1.54 1.43 3.64 3.88 0.00 -1.24 -5.05 105.19 109.38 2brm n GLY 72 Ca -0.20 -0.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.97 2brm n GLY 72 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2brm s HIS 73 N -3.54 -0.06 -0.16 1.61 -3.43 -1.26 -1.95 115.29 106.50 2brm s HIS 73 Ca 0.00 -0.32 -0.06 0.00 -0.80 0.00 0.00 55.06 53.88 2brm s HIS 73 Cb 0.00 0.46 0.08 0.00 -1.43 0.00 0.00 32.58 31.69 2brm s HIS 73 CO 0.00 -1.03 0.34 1.03 -2.00 0.00 0.00 174.74 173.07 2brm s ARG 74 N -3.91 0.23 0.17 -0.38 0.52 -1.14 -5.00 118.95 109.44 2brm s ARG 74 Ca 0.12 0.86 -0.13 0.00 -0.52 0.00 0.00 55.73 56.07 2brm s ARG 74 Cb -0.02 0.10 0.06 0.00 0.52 0.00 0.00 34.95 35.61 2brm s ARG 74 CO 0.02 -0.29 1.72 0.07 0.02 0.00 0.00 175.30 176.85 2brm h ARG 75 N 8.23 0.84 -6.87 3.54 -0.00 -1.92 -2.60 114.38 115.61 2brm h ARG 75 Ca -0.15 -0.15 -0.58 0.00 -0.00 0.00 0.00 59.98 59.10 2brm h ARG 75 Cb 1.11 -0.14 -0.10 0.00 -0.00 0.00 0.00 29.97 30.85 2brm h ARG 75 CO 0.13 0.73 -0.97 -1.91 -0.00 0.00 0.00 179.97 177.95 2brm n GLU 76 N -4.50 -1.13 0.00 0.08 4.07 -1.26 -3.55 120.64 114.35 2brm n GLU 76 Ca 0.03 0.17 0.00 0.00 -0.06 0.00 0.00 57.16 57.29 2brm n GLU 76 Cb 0.16 -3.44 0.00 0.00 -0.06 0.00 0.00 31.44 28.10 2brm n GLU 76 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2brm n GLY 77 N -2.26 1.78 0.03 8.31 0.00 -1.26 -3.27 105.19 108.52 2brm n GLY 77 Ca -0.24 -0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.78 2brm n GLY 77 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2brm n ASN 78 N 7.64 2.05 -4.56 1.61 5.15 -1.25 -4.96 115.26 120.94 2brm n ASN 78 Ca 0.00 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.56 2brm n ASN 78 Cb 0.00 1.16 -0.06 0.00 -0.53 0.00 0.00 39.78 40.35 2brm n ASN 78 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2brm s ILE 79 N -2.57 4.85 0.13 -1.44 1.01 -1.20 -3.81 121.20 118.17 2brm s ILE 79 Ca -0.05 0.51 -0.24 0.00 0.00 0.00 0.00 60.65 60.86 2brm s ILE 79 Cb 0.06 -4.13 -0.07 0.00 0.01 0.00 0.00 42.46 38.33 2brm s ILE 79 CO 0.51 -0.40 0.74 -1.10 0.00 0.00 0.00 174.94 174.69 2brm s GLN 80 N 2.80 4.49 -0.37 2.79 -1.52 -1.18 -4.12 119.66 122.56 2brm s GLN 80 Ca 0.25 1.07 0.02 0.00 -1.95 0.00 0.00 55.36 54.75 2brm s GLN 80 Cb -0.14 -3.28 0.11 0.00 -0.22 0.00 0.00 33.01 29.48 2brm s GLN 80 CO 0.16 0.53 0.12 0.71 -0.25 0.00 0.00 175.29 176.57 2brm s TYR 81 N -0.95 2.64 -0.40 0.91 2.02 -0.98 -2.98 117.35 117.61 2brm s TYR 81 Ca 0.35 -2.46 -0.28 0.00 -0.37 0.00 0.00 57.07 54.31 2brm s TYR 81 Cb -0.22 -2.29 0.02 0.00 -0.40 0.00 0.00 41.96 39.07 2brm s TYR 81 CO 0.24 -0.87 1.04 -0.51 -1.57 0.00 0.00 175.55 173.89 2brm s LEU 82 N 0.94 3.85 -0.02 -1.29 1.43 -0.86 -2.87 118.68 119.86 2brm s LEU 82 Ca 0.12 0.65 -0.24 0.00 -1.03 0.00 0.00 54.13 53.64 2brm s LEU 82 Cb -0.20 -3.44 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 2brm s LEU 82 CO -0.12 -1.01 0.73 -0.36 0.23 0.00 0.00 176.35 175.82 2brm s PHE 83 N 3.88 3.65 0.21 0.29 0.40 -0.82 -1.90 117.98 123.69 2brm s PHE 83 Ca 0.44 1.35 -0.05 0.00 -0.60 0.00 0.00 56.93 58.07 2brm s PHE 83 Cb -0.10 -2.81 -0.03 0.00 0.51 0.00 0.00 43.02 40.59 2brm s PHE 83 CO 0.23 0.17 0.24 -0.51 0.70 0.00 0.00 175.22 176.04 2brm s LEU 84 N 0.42 0.93 0.05 -0.37 1.43 -0.70 -2.53 118.68 117.91 2brm s LEU 84 Ca 0.38 -1.22 -0.31 0.00 -1.03 0.00 0.00 54.13 51.95 2brm s LEU 84 Cb -0.19 0.82 -0.07 0.00 0.03 0.00 0.00 46.19 46.78 2brm s LEU 84 CO 0.20 -0.93 1.41 -0.70 0.23 0.00 0.00 176.35 176.57 2brm s GLU 85 N -4.10 4.30 0.11 1.70 2.12 -0.60 -1.97 118.70 120.25 2brm s GLU 85 Ca 0.32 2.03 -0.30 0.00 0.36 0.00 0.00 54.97 57.39 2brm s GLU 85 Cb 0.05 -3.44 -0.06 0.00 0.26 0.00 0.00 34.13 30.93 2brm s GLU 85 CO 0.10 -0.52 1.09 -0.47 -0.54 0.00 0.00 175.26 174.92 2brm s TYR 86 N 1.87 3.59 -0.37 5.30 5.04 -1.26 -4.51 117.35 127.00 2brm s TYR 86 Ca 0.65 1.55 0.03 0.00 -2.44 0.00 0.00 57.07 56.86 2brm s TYR 86 Cb -0.34 -3.27 0.11 0.00 0.35 0.00 0.00 41.96 38.81 2brm s TYR 86 CO 0.29 -0.61 0.11 0.00 -1.34 0.00 0.00 175.55 174.00 2brm h SER 88 N 7.47 0.00 1.21 0.00 4.64 -1.82 -3.07 113.55 121.98 2brm h SER 88 Ca -0.07 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.24 2brm h SER 88 Cb 0.99 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2brm h SER 88 CO 0.53 0.00 -0.08 1.23 -0.87 0.00 0.00 176.83 177.64 2brm h GLY 89 N 2.74 0.00 0.00 -0.77 0.00 -1.00 -3.48 103.07 100.55 2brm h GLY 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2brm h GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2brm n GLY 90 N 0.33 -1.70 3.83 4.60 0.00 -1.16 -4.75 105.19 106.34 2brm n GLY 90 Ca 0.01 -1.38 -0.33 0.00 0.00 0.00 0.00 46.02 44.32 2brm n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2brm s GLU 91 N 0.00 3.87 0.42 1.61 2.02 -1.26 -0.84 118.70 124.53 2brm s GLU 91 Ca 0.00 1.06 0.20 0.00 0.02 0.00 0.00 54.97 56.25 2brm s GLU 91 Cb 0.00 -2.12 0.92 0.00 0.10 0.00 0.00 34.13 33.03 2brm s GLU 91 CO 0.00 -0.34 1.86 1.25 0.02 0.00 0.00 175.26 178.05 2brm h LEU 92 N 1.06 0.00 -0.91 1.80 5.85 -0.69 -2.99 115.31 119.42 2brm h LEU 92 Ca -0.47 0.00 0.19 0.00 0.84 0.00 0.00 57.88 58.44 2brm h LEU 92 Cb 1.19 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 42.11 2brm h LEU 92 CO 0.60 0.29 0.48 0.15 -0.34 0.00 0.00 178.44 179.62 2brm h PHE 93 N 0.00 0.82 0.00 1.25 3.04 -1.75 -2.23 116.94 118.06 2brm h PHE 93 Ca -0.00 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.98 2brm h PHE 93 Cb 0.67 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 38.96 2brm h PHE 93 CO 0.00 0.10 -0.06 -0.25 -2.02 0.00 0.00 178.31 176.08 2brm n ASP 94 N -4.91 0.09 -0.27 0.41 10.43 -1.13 -2.66 116.55 118.52 2brm n ASP 94 Ca 0.21 0.42 0.14 0.00 2.57 0.00 0.00 54.79 58.13 2brm n ASP 94 Cb 0.58 -0.43 0.48 0.00 1.84 0.00 0.00 41.12 43.58 2brm n ASP 94 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2brm n ARG 95 N -1.54 1.02 -3.39 -1.24 5.12 -0.84 -4.76 116.66 111.02 2brm n ARG 95 Ca 0.07 -0.54 -0.44 0.00 -1.93 0.00 0.00 57.85 55.00 2brm n ARG 95 Cb 0.34 -1.49 -0.08 0.00 -1.16 0.00 0.00 32.46 30.08 2brm n ARG 95 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2brm s ILE 96 N -2.35 5.23 0.08 0.55 1.01 -1.09 -4.74 121.20 119.89 2brm s ILE 96 Ca 0.30 -1.00 -0.31 0.00 0.00 0.00 0.00 60.65 59.64 2brm s ILE 96 Cb 0.20 -4.10 -0.07 0.00 0.01 0.00 0.00 42.46 38.50 2brm s ILE 96 CO 0.46 -0.55 1.34 -0.70 0.00 0.00 0.00 174.94 175.49 2brm s GLU 97 N 1.66 4.34 0.27 2.79 2.56 -0.96 -4.90 118.70 124.47 2brm s GLU 97 Ca 0.04 1.97 -0.30 0.00 0.00 0.00 0.00 54.97 56.68 2brm s GLU 97 Cb -0.23 -3.34 -0.13 0.00 2.00 0.00 0.00 34.13 32.43 2brm s GLU 97 CO 0.07 -0.42 1.44 -2.30 -0.56 0.00 0.00 175.26 173.50 2brm n PRO 98 N 4.24 2.24 0.00 4.30 -0.02 -1.26 -1.45 135.00 143.05 2brm n PRO 98 Ca 0.11 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2brm n PRO 98 Cb 0.44 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 2brm n PRO 98 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2brm n ASP 99 N 1.91 0.00 -0.02 2.55 2.03 -0.65 -4.69 116.55 117.67 2brm n ASP 99 Ca 0.09 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.38 2brm n ASP 99 Cb 0.34 -0.36 -0.02 0.00 -0.72 0.00 0.00 41.12 40.36 2brm n ASP 99 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2brm n ILE 100 N -1.97 0.21 0.00 5.18 5.41 -1.05 -4.64 119.36 122.50 2brm n ILE 100 Ca 0.00 -0.07 0.00 0.00 1.00 0.00 0.00 62.75 63.68 2brm n ILE 100 Cb 0.00 -0.88 0.00 0.00 -0.71 0.00 0.00 39.64 38.05 2brm n ILE 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2brm n GLY 101 N 3.17 1.02 3.56 7.39 0.00 -0.53 -4.09 105.19 115.71 2brm n GLY 101 Ca -0.07 -1.05 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 2brm n GLY 101 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2brm s MET 102 N 0.00 1.45 0.34 1.61 0.23 -0.04 -2.26 119.30 120.62 2brm s MET 102 Ca 0.00 -1.04 -0.28 0.00 -1.03 0.00 0.00 55.69 53.34 2brm s MET 102 Cb 0.00 0.50 -0.13 0.00 -1.53 0.00 0.00 34.83 33.67 2brm s MET 102 CO 0.00 -0.61 1.23 -2.30 -2.03 0.00 0.00 175.02 171.31 2brm n PRO 103 N -0.35 1.96 -0.24 3.16 -0.02 -1.26 -4.77 135.00 133.48 2brm n PRO 103 Ca -0.06 0.69 -0.01 0.00 -2.02 0.00 0.00 63.50 62.09 2brm n PRO 103 Cb 0.62 -2.23 0.11 0.00 -0.02 0.00 0.00 33.50 31.98 2brm n PRO 103 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2brm h GLU 104 N 2.41 0.69 -1.00 -0.52 4.81 -1.98 -2.06 114.58 116.92 2brm h GLU 104 Ca -0.45 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 58.79 2brm h GLU 104 Cb 1.30 -0.16 -0.06 0.00 0.63 0.00 0.00 28.75 30.46 2brm h GLU 104 CO 0.62 0.45 0.65 -1.35 -0.73 0.00 0.00 179.01 178.65 2brm h PRO 105 N 0.71 1.18 -0.53 0.92 0.11 -1.90 -1.19 132.00 131.28 2brm h PRO 105 Ca 0.31 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 66.30 2brm h PRO 105 Cb 0.20 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 31.02 2brm h PRO 105 CO -0.19 0.78 0.15 -0.44 -0.21 0.00 0.00 178.00 178.09 2brm h ASP 106 N 1.21 0.79 -0.29 -2.05 5.19 -1.76 -2.52 116.42 116.99 2brm h ASP 106 Ca 0.42 -0.22 -0.06 0.00 -0.62 0.00 0.00 57.03 56.55 2brm h ASP 106 Cb 0.10 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.38 2brm h ASP 106 CO -0.15 0.80 -0.02 0.00 -3.12 0.00 0.00 179.24 176.75 2brm h ALA 107 N 1.02 1.23 -0.30 3.45 0.00 -0.92 -2.15 119.26 121.60 2brm h ALA 107 Ca 0.17 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 2brm h ALA 107 Cb 0.30 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2brm h ALA 107 CO -0.00 0.51 -0.32 0.37 0.00 0.00 0.00 179.25 179.81 2brm h GLN 108 N 0.60 0.74 -0.41 0.00 4.15 -1.15 -1.73 115.11 117.32 2brm h GLN 108 Ca 0.12 -0.40 -0.02 0.00 0.77 0.00 0.00 58.65 59.12 2brm h GLN 108 Cb 0.41 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 2brm h GLN 108 CO 0.02 1.02 0.16 -0.09 -1.93 0.00 0.00 178.83 178.01 2brm h ARG 109 N 0.49 0.62 -0.45 1.69 2.43 -1.27 -0.04 114.38 117.86 2brm h ARG 109 Ca 0.04 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.06 2brm h ARG 109 Cb 0.90 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 2brm h ARG 109 CO 0.08 0.58 0.11 0.74 -1.51 0.00 0.00 179.97 179.96 2brm h PHE 110 N 0.52 0.69 -0.35 2.20 0.04 -1.39 -2.10 116.94 116.56 2brm h PHE 110 Ca 0.14 -0.05 -0.14 0.00 2.80 0.00 0.00 57.97 60.71 2brm h PHE 110 Cb 0.19 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.13 2brm h PHE 110 CO 0.00 0.59 -0.36 0.35 -0.60 0.00 0.00 178.31 178.30 2brm h PHE 111 N 0.66 0.94 -0.55 -0.55 3.57 -0.95 -0.30 116.94 119.76 2brm h PHE 111 Ca 0.15 -0.27 0.01 0.00 3.53 0.00 0.00 57.97 61.39 2brm h PHE 111 Cb 0.25 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 2brm h PHE 111 CO 0.01 1.04 0.36 0.45 -2.23 0.00 0.00 178.31 177.93 2brm h HIS 112 N 0.66 0.67 -0.10 0.41 3.86 -0.69 -0.87 115.15 119.11 2brm h HIS 112 Ca 0.06 0.02 -0.17 0.00 -1.16 0.00 0.00 60.37 59.12 2brm h HIS 112 Cb 0.91 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 29.15 2brm h HIS 112 CO 0.05 0.41 -0.66 1.96 0.86 0.00 0.00 177.93 180.55 2brm h GLN 113 N 0.72 0.38 -0.32 2.45 4.20 -1.25 -1.77 115.11 119.53 2brm h GLN 113 Ca 0.21 -0.28 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 2brm h GLN 113 Cb -0.05 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 2brm h GLN 113 CO -0.06 0.91 0.09 1.25 -0.67 0.00 0.00 178.83 180.35 2brm h LEU 114 N 0.27 0.48 -0.88 1.46 5.85 -0.86 -2.14 115.31 119.49 2brm h LEU 114 Ca -0.02 -0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.43 2brm h LEU 114 Cb 1.21 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 2brm h LEU 114 CO 0.11 0.57 0.16 0.24 -0.34 0.00 0.00 178.44 179.19 2brm h MET 115 N 0.36 0.99 -0.78 1.25 2.86 -1.07 -0.58 114.93 117.96 2brm h MET 115 Ca 0.10 -0.22 -0.03 0.00 -2.06 0.00 0.00 59.70 57.50 2brm h MET 115 Cb 0.27 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 2brm h MET 115 CO -0.00 0.87 0.39 0.00 1.06 0.00 0.00 176.91 179.23 2brm h ALA 116 N 1.23 1.01 -0.20 6.32 0.00 -1.16 0.11 119.26 126.56 2brm h ALA 116 Ca 0.20 -0.15 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 2brm h ALA 116 Cb 0.32 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2brm h ALA 116 CO -0.00 0.56 -0.68 0.78 0.00 0.00 0.00 179.25 179.91 2brm h GLY 117 N 1.10 0.86 1.76 0.00 0.00 -1.10 -2.56 103.07 103.14 2brm h GLY 117 Ca 0.27 -1.12 -0.14 0.00 0.00 0.00 0.00 47.33 46.34 2brm h GLY 117 CO -0.04 1.00 -0.58 -2.08 0.00 0.00 0.00 176.54 174.84 2brm h VAL 118 N 0.56 1.38 -0.73 4.60 2.07 -0.96 -2.14 116.25 121.03 2brm h VAL 118 Ca -0.02 -1.92 -0.06 0.00 0.82 0.00 0.00 66.70 65.52 2brm h VAL 118 Cb 1.29 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.99 2brm h VAL 118 CO 0.14 0.57 0.23 0.58 0.02 0.00 0.00 177.57 179.11 2brm h VAL 119 N 0.19 1.26 -0.05 2.57 2.07 -0.79 -1.79 116.25 119.71 2brm h VAL 119 Ca -0.00 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.61 2brm h VAL 119 Cb 1.07 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 31.29 2brm h VAL 119 CO 0.09 0.35 0.02 0.22 0.02 0.00 0.00 177.57 178.27 2brm h TYR 120 N 1.09 0.08 -0.05 1.57 3.20 -1.20 -1.75 116.97 119.92 2brm h TYR 120 Ca 0.24 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 2brm h TYR 120 Cb 0.30 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.55 2brm h TYR 120 CO 0.02 0.24 0.03 -0.07 -1.64 0.00 0.00 178.16 176.74 2brm h LEU 121 N -0.10 0.06 -1.88 2.82 3.38 -1.33 -2.41 115.31 115.85 2brm h LEU 121 Ca 0.02 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2brm h LEU 121 Cb 0.19 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2brm h LEU 121 CO -0.00 0.11 -0.12 0.45 0.09 0.00 0.00 178.44 178.97 2brm h HIS 122 N 0.00 0.00 -0.11 1.13 3.86 -1.26 -0.33 115.15 118.44 2brm h HIS 122 Ca 0.02 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.09 2brm h HIS 122 Cb 0.06 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 2brm h HIS 122 CO -0.05 0.12 -0.54 0.78 0.86 0.00 0.00 177.93 179.09 2brm h GLY 123 N 0.46 0.35 -2.20 2.45 0.00 -0.83 -2.94 103.07 100.36 2brm h GLY 123 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 46.92 2brm h GLY 123 CO 0.02 0.37 0.00 0.29 0.00 0.00 0.00 176.54 177.21 2brm n ILE 124 N -3.93 0.85 -1.02 2.60 -5.35 -0.95 -4.94 119.36 106.61 2brm n ILE 124 Ca -0.02 -0.80 0.00 0.00 -0.27 0.00 0.00 62.75 61.66 2brm n ILE 124 Cb 0.58 0.36 0.00 0.00 -1.74 0.00 0.00 39.64 38.84 2brm n ILE 124 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2brm n GLY 125 N 1.39 0.49 3.53 3.28 0.00 -0.94 -4.93 105.19 108.02 2brm n GLY 125 Ca 0.20 -0.91 -0.34 0.00 0.00 0.00 0.00 46.02 44.97 2brm n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2brm s ILE 126 N -2.00 3.67 -0.09 -0.61 -1.09 -0.18 -1.12 121.20 119.77 2brm s ILE 126 Ca 0.00 -0.47 0.01 0.00 -2.23 0.00 0.00 60.65 57.96 2brm s ILE 126 Cb 0.00 -2.54 -0.02 0.00 -1.58 0.00 0.00 42.46 38.32 2brm s ILE 126 CO 0.00 0.56 -0.12 0.28 -1.23 0.00 0.00 174.94 174.43 2brm s THR 127 N -0.28 3.22 0.00 2.92 -1.32 -0.74 -3.12 115.64 116.32 2brm s THR 127 Ca 0.04 -0.63 -0.22 0.00 -1.21 0.00 0.00 61.69 59.67 2brm s THR 127 Cb -0.13 -2.32 -0.19 0.00 -1.51 0.00 0.00 72.50 68.36 2brm s THR 127 CO 0.02 0.56 1.21 -0.74 -2.21 0.00 0.00 174.62 173.47 2brm h HIS 128 N 5.98 0.35 0.00 9.09 2.76 -1.92 -2.47 115.15 128.94 2brm h HIS 128 Ca -0.37 -0.14 0.00 0.00 -2.20 0.00 0.00 60.37 57.66 2brm h HIS 128 Cb 1.18 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 30.08 2brm h HIS 128 CO 0.51 0.82 0.00 0.54 -1.30 0.00 0.00 177.93 178.50 2brm n ARG 129 N -4.54 0.00 -2.72 5.26 1.74 -1.26 -3.25 116.66 111.89 2brm n ARG 129 Ca -0.08 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.92 2brm n ARG 129 Cb 0.43 -2.49 0.08 0.00 -1.02 0.00 0.00 32.46 29.46 2brm n ARG 129 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2brm n ASP 130 N 0.00 -0.85 -4.68 0.55 4.64 -1.26 -3.87 116.55 111.08 2brm n ASP 130 Ca 0.00 -2.69 -0.43 0.00 -1.38 0.00 0.00 54.79 50.30 2brm n ASP 130 Cb 0.00 0.58 -0.02 0.00 -1.04 0.00 0.00 41.12 40.64 2brm n ASP 130 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2brm s ILE 131 N -0.88 4.33 0.18 5.18 1.01 -1.26 -4.82 121.20 124.94 2brm s ILE 131 Ca 0.24 1.63 -0.23 0.00 0.00 0.00 0.00 60.65 62.30 2brm s ILE 131 Cb 0.40 -4.05 0.06 0.00 0.01 0.00 0.00 42.46 38.88 2brm s ILE 131 CO -0.05 -0.06 0.65 -1.59 0.00 0.00 0.00 174.94 173.90 2brm s LYS 132 N 2.69 1.40 0.54 2.79 -2.85 -1.26 -4.78 119.74 118.27 2brm s LYS 132 Ca 0.54 -0.61 0.26 0.00 -1.00 0.00 0.00 55.97 55.17 2brm s LYS 132 Cb -0.23 0.58 1.42 0.00 -2.06 0.00 0.00 37.83 37.55 2brm s LYS 132 CO 0.18 -0.62 1.98 -1.35 0.10 0.00 0.00 175.35 175.64 2brm h PRO 133 N 2.00 0.00 0.00 1.78 0.11 -1.94 -0.87 132.00 133.08 2brm h PRO 133 Ca -0.29 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.72 2brm h PRO 133 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2brm h PRO 133 CO 0.33 0.00 -0.47 0.93 -0.21 0.00 0.00 178.00 178.59 2brm h GLU 134 N 0.00 0.00 -0.02 1.05 3.07 -1.96 -2.74 114.58 113.98 2brm h GLU 134 Ca 0.27 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 2brm h GLU 134 Cb 1.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 2brm h GLU 134 CO -0.00 0.47 -0.06 0.09 -1.40 0.00 0.00 179.01 178.11 2brm n ASN 135 N -3.89 1.85 -4.29 1.42 3.02 -0.35 -4.80 115.26 108.22 2brm n ASN 135 Ca -0.01 -1.55 -0.41 0.00 -0.03 0.00 0.00 54.58 52.58 2brm n ASN 135 Cb 0.50 0.04 -0.10 0.00 -0.61 0.00 0.00 39.78 39.61 2brm n ASN 135 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2brm s LEU 136 N -2.09 5.13 0.36 3.41 1.43 -1.09 -1.27 118.68 124.57 2brm s LEU 136 Ca 0.33 -1.42 0.01 0.00 -1.03 0.00 0.00 54.13 52.02 2brm s LEU 136 Cb 0.20 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 2brm s LEU 136 CO 0.36 -0.53 0.55 -0.76 0.23 0.00 0.00 176.35 176.20 2brm s LEU 137 N 1.46 3.97 -0.09 1.79 1.43 -0.44 -0.78 118.68 126.02 2brm s LEU 137 Ca 0.03 0.34 0.04 0.00 -1.03 0.00 0.00 54.13 53.51 2brm s LEU 137 Cb -0.23 -3.21 0.00 0.00 0.03 0.00 0.00 46.19 42.79 2brm s LEU 137 CO 0.03 -0.36 -0.22 -0.76 0.23 0.00 0.00 176.35 175.27 2brm s LEU 138 N -4.32 2.02 0.00 1.79 1.02 -0.02 -0.68 118.68 118.49 2brm s LEU 138 Ca 0.41 -0.52 0.00 0.00 0.02 0.00 0.00 54.13 54.04 2brm s LEU 138 Cb -0.10 -1.32 0.00 0.00 0.02 0.00 0.00 46.19 44.79 2brm s LEU 138 CO 0.35 0.14 0.00 -0.90 0.02 0.00 0.00 176.35 175.97 2brm n ASP 139 N 3.56 0.00 -0.11 2.29 3.85 -0.88 -0.71 116.55 124.55 2brm n ASP 139 Ca -0.20 -0.77 -0.04 0.00 -0.71 0.00 0.00 54.79 53.08 2brm n ASP 139 Cb 0.53 0.00 0.18 0.00 -1.35 0.00 0.00 41.12 40.48 2brm n ASP 139 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 2brm h GLU 140 N 0.00 0.78 -0.93 0.11 9.09 -1.90 -2.61 114.58 119.12 2brm h GLU 140 Ca 0.00 -0.19 -0.38 0.00 0.05 0.00 0.00 59.36 58.83 2brm h GLU 140 Cb 0.00 -0.10 -0.23 0.00 -1.65 0.00 0.00 28.75 26.77 2brm h GLU 140 CO 0.00 0.77 0.49 0.54 0.05 0.00 0.00 179.01 180.85 2brm n ARG 141 N -4.23 2.60 -1.85 1.06 1.74 -1.26 -4.92 116.66 109.79 2brm n ARG 141 Ca 0.03 -2.77 -0.18 0.00 -0.77 0.00 0.00 57.85 54.16 2brm n ARG 141 Cb 0.28 -2.10 -0.05 0.00 -1.02 0.00 0.00 32.46 29.57 2brm n ARG 141 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2brm n ASP 142 N -0.70 -5.16 -4.73 0.55 8.00 -0.98 -4.99 116.55 108.54 2brm n ASP 142 Ca 0.49 0.25 -0.41 0.00 0.71 0.00 0.00 54.79 55.83 2brm n ASP 142 Cb 1.49 -4.23 -0.04 0.00 -0.02 0.00 0.00 41.12 38.32 2brm n ASP 142 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2brm s ASN 143 N -2.56 7.39 0.28 -2.24 0.02 -1.26 -4.80 114.94 111.76 2brm s ASN 143 Ca 0.00 1.67 -0.29 0.00 -1.02 0.00 0.00 52.86 53.22 2brm s ASN 143 Cb 0.00 -2.55 -0.09 0.00 0.02 0.00 0.00 41.25 38.62 2brm s ASN 143 CO 0.00 -0.10 0.99 -0.22 0.02 0.00 0.00 177.10 177.80 2brm s LEU 144 N 0.25 4.54 -0.04 0.60 0.20 -1.26 -2.08 118.68 120.89 2brm s LEU 144 Ca 0.46 2.03 -0.02 0.00 0.69 0.00 0.00 54.13 57.29 2brm s LEU 144 Cb -0.22 -3.72 0.03 0.00 -0.43 0.00 0.00 46.19 41.85 2brm s LEU 144 CO 0.28 -0.01 0.05 -0.54 -0.29 0.00 0.00 176.35 175.84 2brm s LYS 145 N -1.49 -0.06 0.24 1.98 1.02 0.14 -4.45 119.74 117.12 2brm s LYS 145 Ca 0.45 0.35 -0.30 0.00 0.02 0.00 0.00 55.97 56.48 2brm s LYS 145 Cb -0.26 -0.47 -0.09 0.00 -0.52 0.00 0.00 37.83 36.48 2brm s LYS 145 CO 0.33 -0.30 1.33 0.42 -0.92 0.00 0.00 175.35 176.20 2brm s ILE 146 N 1.99 3.01 0.22 2.17 1.01 -0.67 -1.33 121.20 127.60 2brm s ILE 146 Ca 0.03 0.87 0.01 0.00 0.00 0.00 0.00 60.65 61.56 2brm s ILE 146 Cb -0.12 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.74 2brm s ILE 146 CO -0.03 0.15 0.08 -0.94 0.00 0.00 0.00 174.94 174.20 2brm s SER 147 N 0.13 0.95 -0.24 3.58 1.04 -0.39 -1.86 113.70 116.91 2brm s SER 147 Ca 0.55 -1.33 -0.02 0.00 0.48 0.00 0.00 55.95 55.63 2brm s SER 147 Cb -0.38 0.20 0.01 0.00 0.10 0.00 0.00 66.02 65.95 2brm s SER 147 CO 0.42 -0.72 0.03 -0.67 0.98 0.00 0.00 173.24 173.29 2brm n ASP 148 N -0.36 -5.94 -1.70 7.02 4.64 -1.26 -4.84 116.55 114.11 2brm n ASP 148 Ca -0.01 1.17 -0.13 0.00 -1.38 0.00 0.00 54.79 54.43 2brm n ASP 148 Cb 0.65 -4.54 0.20 0.00 -1.04 0.00 0.00 41.12 36.39 2brm n ASP 148 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 2brm n PHE 149 N 0.71 2.09 0.39 -0.67 3.01 -1.26 -4.55 117.46 117.17 2brm n PHE 149 Ca -0.06 -1.67 0.13 0.00 1.01 0.00 0.00 57.45 56.87 2brm n PHE 149 Cb 0.09 -0.71 0.41 0.00 -0.01 0.00 0.00 39.48 39.25 2brm n PHE 149 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2brm h GLY 150 N 1.14 0.00 -1.21 1.37 0.00 -1.91 -2.87 103.07 99.59 2brm h GLY 150 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.74 2brm h GLY 150 CO 0.74 0.00 0.00 1.04 0.00 0.00 0.00 176.54 178.32 2brm n LEU 151 N -2.67 2.28 -4.81 3.11 4.77 -1.26 -4.87 117.00 113.56 2brm n LEU 151 Ca 0.03 -1.05 -0.34 0.00 -0.03 0.00 0.00 56.01 54.63 2brm n LEU 151 Cb 0.40 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 2brm n LEU 151 CO 0.29 0.42 0.69 0.00 -1.33 0.00 0.00 177.39 177.46 2brm s ALA 152 N -1.22 2.94 0.13 -1.18 0.00 -1.08 -4.69 121.76 116.65 2brm s ALA 152 Ca 0.18 0.51 -0.10 0.00 0.00 0.00 0.00 51.96 52.55 2brm s ALA 152 Cb 0.13 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 20.04 2brm s ALA 152 CO 0.19 -0.13 0.27 -0.08 0.00 0.00 0.00 175.76 176.01 2brm s THR 153 N -2.08 0.10 -0.13 0.00 -1.32 -0.93 -4.92 115.64 106.37 2brm s THR 153 Ca 0.65 -1.15 -0.29 0.00 -1.21 0.00 0.00 61.69 59.68 2brm s THR 153 Cb -0.13 -1.52 -0.01 0.00 -1.51 0.00 0.00 72.50 69.33 2brm s THR 153 CO 0.17 -0.44 1.11 -0.69 -2.21 0.00 0.00 174.62 172.56 2brm s VAL 154 N -3.89 4.53 -0.74 5.08 1.01 -1.26 -1.79 120.40 123.33 2brm s VAL 154 Ca 0.09 1.83 0.12 0.00 0.00 0.00 0.00 61.98 64.03 2brm s VAL 154 Cb 0.04 -4.18 -0.10 0.00 0.00 0.00 0.00 36.38 32.14 2brm s VAL 154 CO -0.07 -0.06 0.58 2.22 0.00 0.00 0.00 175.10 177.78 2brm n PHE 155 N 5.59 0.00 -3.75 5.22 -1.74 -0.28 -4.95 117.46 117.54 2brm n PHE 155 Ca 0.11 0.00 -0.15 0.00 -0.56 0.00 0.00 57.45 56.85 2brm n PHE 155 Cb 0.47 0.00 -0.16 0.00 1.52 0.00 0.00 39.48 41.31 2brm n PHE 155 CO 0.00 0.00 0.00 0.50 -0.56 0.00 0.00 176.76 176.70 2brm s ARG 156 N -2.03 0.00 -0.09 3.97 3.52 -1.11 -1.14 118.95 122.07 2brm s ARG 156 Ca 0.06 0.27 -0.05 0.00 -0.13 0.00 0.00 55.73 55.88 2brm s ARG 156 Cb 0.10 -0.24 0.04 0.00 -1.56 0.00 0.00 34.95 33.28 2brm s ARG 156 CO 0.46 -0.18 0.22 -0.47 -0.81 0.00 0.00 175.30 174.52 2brm s TYR 157 N 1.20 -0.28 -1.49 5.12 5.04 -1.09 -4.57 117.35 121.29 2brm s TYR 157 Ca -0.08 0.68 -0.10 0.00 -2.44 0.00 0.00 57.07 55.13 2brm s TYR 157 Cb -0.12 0.03 0.07 0.00 0.35 0.00 0.00 41.96 42.28 2brm s TYR 157 CO -0.04 -0.20 0.86 0.09 -1.34 0.00 0.00 175.55 174.92 2brm n ASN 158 N 4.00 -3.50 -1.49 4.32 5.03 -1.26 -2.34 115.26 120.02 2brm n ASN 158 Ca -0.23 -0.83 -0.17 0.00 0.87 0.00 0.00 54.58 54.21 2brm n ASN 158 Cb 0.54 -3.75 -0.06 0.00 -1.02 0.00 0.00 39.78 35.49 2brm n ASN 158 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 2brm n ASN 159 N -2.88 -5.10 -4.01 6.41 5.15 -1.26 -4.98 115.26 108.58 2brm n ASN 159 Ca -0.06 0.33 -0.30 0.00 -0.60 0.00 0.00 54.58 53.94 2brm n ASN 159 Cb 0.57 -4.15 -0.16 0.00 -0.53 0.00 0.00 39.78 35.51 2brm n ASN 159 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 2brm s ARG 160 N -3.80 2.15 0.45 1.20 6.06 -0.99 -5.11 118.95 118.90 2brm s ARG 160 Ca 0.00 -0.77 -0.23 0.00 -2.50 0.00 0.00 55.73 52.23 2brm s ARG 160 Cb 0.00 -2.34 -0.08 0.00 0.06 0.00 0.00 34.95 32.60 2brm s ARG 160 CO 0.00 -0.36 1.15 -2.00 -2.50 0.00 0.00 175.30 171.59 2brm s GLU 161 N 1.41 3.82 -0.03 5.12 2.12 -1.26 -2.65 118.70 127.23 2brm s GLU 161 Ca 0.01 1.74 0.04 0.00 0.36 0.00 0.00 54.97 57.12 2brm s GLU 161 Cb -0.15 -2.43 -0.00 0.00 0.26 0.00 0.00 34.13 31.80 2brm s GLU 161 CO -0.09 -0.49 -0.15 -0.98 -0.54 0.00 0.00 175.26 173.01 2brm s ARG 162 N -2.66 1.40 0.52 4.30 1.70 -0.29 -4.99 118.95 118.93 2brm s ARG 162 Ca 0.63 -0.52 -0.18 0.00 -0.47 0.00 0.00 55.73 55.19 2brm s ARG 162 Cb -0.28 -1.28 -0.07 0.00 -0.57 0.00 0.00 34.95 32.75 2brm s ARG 162 CO 0.34 0.25 1.02 -0.51 -1.08 0.00 0.00 175.30 175.31 2brm s LEU 163 N -0.08 3.68 0.07 -1.89 1.43 -1.26 -4.79 118.68 115.85 2brm s LEU 163 Ca -0.00 1.76 -0.05 0.00 -1.03 0.00 0.00 54.13 54.81 2brm s LEU 163 Cb -0.09 -4.53 -0.05 0.00 0.03 0.00 0.00 46.19 41.55 2brm s LEU 163 CO 0.01 -0.80 0.30 -0.76 0.23 0.00 0.00 176.35 175.33 2brm s LEU 164 N -3.94 4.33 0.00 1.79 1.43 -0.80 -4.90 118.68 116.59 2brm s LEU 164 Ca 0.63 0.52 0.00 0.00 -1.03 0.00 0.00 54.13 54.25 2brm s LEU 164 Cb -0.13 -2.98 0.00 0.00 0.03 0.00 0.00 46.19 43.11 2brm s LEU 164 CO 0.28 0.16 0.00 -0.46 0.23 0.00 0.00 176.35 176.56 2brm n ASN 165 N 0.57 1.31 -4.69 2.29 2.04 -1.26 -2.35 115.26 113.17 2brm n ASN 165 Ca -0.07 -0.20 -0.42 0.00 -0.44 0.00 0.00 54.58 53.45 2brm n ASN 165 Cb 0.52 0.66 -0.03 0.00 -2.53 0.00 0.00 39.78 38.41 2brm n ASN 165 CO 0.00 0.00 0.00 -0.75 -0.44 0.00 0.00 177.26 176.07 2brm s LYS 166 N -0.93 4.42 -0.25 -3.83 2.20 -1.26 -4.93 119.74 115.16 2brm s LYS 166 Ca 0.00 1.38 -0.29 0.00 -0.36 0.00 0.00 55.97 56.70 2brm s LYS 166 Cb 0.00 -3.54 0.01 0.00 -1.51 0.00 0.00 37.83 32.79 2brm s LYS 166 CO 0.00 -0.31 1.03 -1.64 -0.36 0.00 0.00 175.35 174.08 2brm s MET 167 N 1.98 4.21 0.32 4.03 -1.94 -1.26 -5.02 119.30 121.61 2brm s MET 167 Ca 0.48 1.26 -0.16 0.00 -1.71 0.00 0.00 55.69 55.56 2brm s MET 167 Cb -0.18 -3.66 0.03 0.00 2.01 0.00 0.00 34.83 33.02 2brm s MET 167 CO 0.18 -0.69 0.69 0.00 -0.01 0.00 0.00 175.02 175.19 2brm n GLY 169 N -0.48 0.38 2.83 0.00 0.00 -1.25 -4.91 105.19 101.75 2brm n GLY 169 Ca -0.05 -1.81 -0.17 0.00 0.00 0.00 0.00 46.02 43.99 2brm n GLY 169 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2brm s THR 170 N 0.00 0.21 0.17 2.61 2.01 -1.26 -5.04 115.64 114.34 2brm s THR 170 Ca 0.00 0.06 -0.15 0.00 0.31 0.00 0.00 61.69 61.91 2brm s THR 170 Cb 0.00 -0.29 0.07 0.00 0.01 0.00 0.00 72.50 72.29 2brm s THR 170 CO 0.00 0.15 1.73 -0.07 -0.69 0.00 0.00 174.62 175.73 2brm h LEU 171 N 7.19 0.03 -1.55 4.42 4.07 -1.95 -0.61 115.31 126.91 2brm h LEU 171 Ca -0.42 0.07 0.08 0.00 0.08 0.00 0.00 57.88 57.69 2brm h LEU 171 Cb 1.14 0.09 -0.04 0.00 1.08 0.00 0.00 40.66 42.93 2brm h LEU 171 CO 0.48 0.05 0.42 -0.65 -1.08 0.00 0.00 178.44 177.66 2brm h PRO 172 N 0.23 0.51 -0.01 1.13 0.11 -1.66 -2.94 132.00 129.38 2brm h PRO 172 Ca 0.21 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2brm h PRO 172 Cb 0.25 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.24 2brm h PRO 172 CO -0.26 0.34 -0.48 0.66 -0.21 0.00 0.00 178.00 178.05 2brm n TYR 173 N -4.48 0.00 -2.90 0.65 4.01 -0.39 -4.85 117.16 109.21 2brm n TYR 173 Ca 0.10 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.47 2brm n TYR 173 Cb 0.31 -0.06 -0.06 0.00 -0.31 0.00 0.00 39.34 39.22 2brm n TYR 173 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2brm s VAL 174 N -2.59 4.34 0.44 -0.72 0.11 -0.38 -3.85 120.40 117.75 2brm s VAL 174 Ca 0.18 1.63 -0.21 0.00 -2.93 0.00 0.00 61.98 60.66 2brm s VAL 174 Cb 0.18 -3.97 -0.10 0.00 -1.53 0.00 0.00 36.38 30.96 2brm s VAL 174 CO 0.60 0.19 0.99 0.00 -3.33 0.00 0.00 175.10 173.55 2brm s ALA 175 N -1.55 2.99 0.44 1.54 0.00 -1.26 -4.61 121.76 119.30 2brm s ALA 175 Ca 0.47 0.51 0.22 0.00 0.00 0.00 0.00 51.96 53.16 2brm s ALA 175 Cb -0.18 -3.20 1.28 0.00 0.00 0.00 0.00 23.12 21.02 2brm s ALA 175 CO 0.23 -0.06 2.04 -1.00 0.00 0.00 0.00 175.76 176.98 2brm h PRO 176 N 1.91 0.00 0.00 0.00 0.13 -1.88 -2.99 132.00 129.17 2brm h PRO 176 Ca -0.49 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.58 2brm h PRO 176 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2brm h PRO 176 CO 0.61 0.15 -0.29 1.05 -0.23 0.00 0.00 178.00 179.28 2brm h GLU 177 N 0.00 0.00 0.00 0.86 9.09 -1.92 -2.54 114.58 120.08 2brm h GLU 177 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2brm h GLU 177 Cb 0.32 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.42 2brm h GLU 177 CO 0.02 0.29 0.00 1.47 0.05 0.00 0.00 179.01 180.84 2brm n LEU 178 N -3.74 0.79 0.04 3.06 -0.00 -1.13 -1.05 117.00 114.97 2brm n LEU 178 Ca -0.01 0.58 -0.01 0.00 -0.00 0.00 0.00 56.01 56.56 2brm n LEU 178 Cb 0.39 -0.33 -0.08 0.00 -0.00 0.00 0.00 43.42 43.40 2brm n LEU 178 CO 0.35 -0.19 -0.18 -0.07 -0.00 0.00 0.00 177.39 177.31 2brm h LEU 179 N 0.00 0.00 0.00 1.47 3.38 -1.64 -3.41 115.31 115.10 2brm h LEU 179 Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 2brm h LEU 179 Cb 0.72 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2brm h LEU 179 CO 0.00 0.65 -2.08 0.29 0.09 0.00 0.00 178.44 177.39 2brm n LYS 180 N -2.99 0.72 -4.37 1.13 5.02 -0.98 -5.00 118.16 111.69 2brm n LYS 180 Ca -0.08 -0.12 -0.29 0.00 -2.02 0.00 0.00 58.31 55.80 2brm n LYS 180 Cb 0.86 -1.49 -0.12 0.00 -0.02 0.00 0.00 35.03 34.26 2brm n LYS 180 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2brm s ARG 181 N -3.05 1.54 0.11 1.97 0.52 -0.22 -5.04 118.95 114.78 2brm s ARG 181 Ca -0.08 -1.32 -0.13 0.00 -0.52 0.00 0.00 55.73 53.68 2brm s ARG 181 Cb 0.10 -1.96 -0.09 0.00 0.52 0.00 0.00 34.95 33.52 2brm s ARG 181 CO 0.83 0.45 1.41 0.00 0.02 0.00 0.00 175.30 178.01 2brm h ARG 182 N 3.73 0.79 -4.92 3.54 3.08 -1.92 -3.44 114.38 115.23 2brm h ARG 182 Ca -0.50 -0.46 -0.33 0.00 0.07 0.00 0.00 59.98 58.76 2brm h ARG 182 Cb 1.17 0.04 -0.20 0.00 0.08 0.00 0.00 29.97 31.06 2brm h ARG 182 CO 0.42 1.09 -0.75 -1.21 -1.07 0.00 0.00 179.97 178.46 2brm s GLU 183 N -4.23 0.71 -0.03 0.04 2.02 -1.26 -4.45 118.70 111.49 2brm s GLU 183 Ca -0.12 -0.94 -0.29 0.00 0.02 0.00 0.00 54.97 53.64 2brm s GLU 183 Cb 0.09 -0.53 0.08 0.00 0.10 0.00 0.00 34.13 33.88 2brm s GLU 183 CO 0.86 0.10 0.75 -0.59 0.02 0.00 0.00 175.26 176.40 2brm s PHE 184 N -1.68 -0.55 0.46 1.61 -0.12 -0.99 -4.98 117.98 111.72 2brm s PHE 184 Ca -0.03 0.82 -0.23 0.00 -0.05 0.00 0.00 56.93 57.43 2brm s PHE 184 Cb -0.08 0.45 -0.07 0.00 -0.63 0.00 0.00 43.02 42.69 2brm s PHE 184 CO 0.01 -0.59 1.19 -1.01 -0.05 0.00 0.00 175.22 174.77 2brm s HIS 185 N -1.77 2.85 -0.00 3.49 3.76 -1.26 -1.90 115.29 120.46 2brm s HIS 185 Ca -0.06 1.52 -0.19 0.00 -0.15 0.00 0.00 55.06 56.18 2brm s HIS 185 Cb -0.00 -3.43 -0.33 0.00 1.11 0.00 0.00 32.58 29.92 2brm s HIS 185 CO 0.03 -1.63 0.96 0.00 -0.85 0.00 0.00 174.74 173.25 2brm h ALA 186 N 2.12 -0.12 -0.26 -1.40 0.00 -1.97 -3.37 119.26 114.26 2brm h ALA 186 Ca -0.49 -0.78 -0.01 0.00 0.00 0.00 0.00 54.91 53.63 2brm h ALA 186 Cb 1.25 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 2brm h ALA 186 CO 0.60 0.54 0.11 0.93 0.00 0.00 0.00 179.25 181.43 2brm h GLU 187 N -0.09 0.38 -0.13 0.00 5.08 -1.99 -2.56 114.58 115.27 2brm h GLU 187 Ca -0.20 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.13 2brm h GLU 187 Cb 1.91 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 31.09 2brm h GLU 187 CO 0.22 0.42 0.10 -1.35 -1.00 0.00 0.00 179.01 177.39 2brm h PRO 188 N 0.27 0.00 -0.32 2.33 0.11 -1.92 -1.97 132.00 130.49 2brm h PRO 188 Ca 0.09 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.15 2brm h PRO 188 Cb 0.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 2brm h PRO 188 CO -0.01 0.00 0.00 0.28 -0.21 0.00 0.00 178.00 178.06 2brm h VAL 189 N 0.00 1.26 -0.63 3.15 2.07 -1.61 -1.69 116.25 118.80 2brm h VAL 189 Ca 0.06 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.59 2brm h VAL 189 Cb 0.26 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 2brm h VAL 189 CO -0.00 0.31 0.21 0.44 0.02 0.00 0.00 177.57 178.55 2brm h ASP 190 N 0.36 0.87 -0.47 0.57 3.32 -1.25 -2.67 116.42 117.15 2brm h ASP 190 Ca 0.09 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 2brm h ASP 190 Cb 0.44 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 2brm h ASP 190 CO 0.02 0.81 0.11 0.58 -1.72 0.00 0.00 179.24 179.03 2brm h VAL 191 N 0.92 1.24 -0.12 -1.35 2.07 -1.26 -2.22 116.25 115.53 2brm h VAL 191 Ca 0.21 -0.84 0.03 0.00 0.82 0.00 0.00 66.70 66.92 2brm h VAL 191 Cb 0.24 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 2brm h VAL 191 CO -0.01 0.30 -0.09 -0.25 0.02 0.00 0.00 177.57 177.53 2brm h TRP 192 N 0.63 -0.23 -0.20 1.57 2.91 -1.15 -2.07 115.95 117.42 2brm h TRP 192 Ca 0.15 0.02 -0.06 0.00 1.13 0.00 0.00 58.89 60.12 2brm h TRP 192 Cb 0.33 0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 29.09 2brm h TRP 192 CO 0.02 -0.15 -0.13 0.66 -1.03 0.00 0.00 178.44 177.82 2brm h SER 193 N -0.11 0.32 -0.27 2.65 4.64 -1.39 -1.23 113.55 118.17 2brm h SER 193 Ca 0.08 -0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 61.29 2brm h SER 193 Cb 0.22 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 2brm h SER 193 CO -0.18 0.48 0.06 0.00 -0.87 0.00 0.00 176.83 176.31 2brm h GLY 195 N 0.78 0.30 1.50 0.00 0.00 -0.54 -1.59 103.07 103.52 2brm h GLY 195 Ca 0.12 -0.30 -0.19 0.00 0.00 0.00 0.00 47.33 46.96 2brm h GLY 195 CO 0.00 0.27 -0.70 -2.22 0.00 0.00 0.00 176.54 173.89 2brm h ILE 196 N 0.22 1.35 -0.69 2.60 1.08 -0.99 -2.29 117.51 118.80 2brm h ILE 196 Ca 0.01 -2.05 -0.04 0.00 -0.39 0.00 0.00 64.86 62.39 2brm h ILE 196 Cb 0.90 2.03 -0.03 0.00 -3.07 0.00 0.00 36.82 36.64 2brm h ILE 196 CO 0.07 0.62 0.25 0.58 -0.69 0.00 0.00 178.15 178.99 2brm h VAL 197 N 0.35 1.25 -0.47 1.67 2.07 -1.11 -1.88 116.25 118.13 2brm h VAL 197 Ca -0.03 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 2brm h VAL 197 Cb 1.28 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2brm h VAL 197 CO 0.13 0.32 0.22 0.25 0.02 0.00 0.00 177.57 178.51 2brm h LEU 198 N 0.98 0.61 -0.32 2.57 6.46 -1.23 -0.91 115.31 123.48 2brm h LEU 198 Ca 0.23 -0.13 0.05 0.00 -0.12 0.00 0.00 57.88 57.91 2brm h LEU 198 Cb 0.24 -0.16 -0.05 0.00 -0.73 0.00 0.00 40.66 39.97 2brm h LEU 198 CO -0.01 0.57 0.03 0.74 -0.62 0.00 0.00 178.44 179.14 2brm h THR 199 N 0.61 0.80 -0.81 1.05 2.02 -1.25 -1.79 112.91 113.54 2brm h THR 199 Ca 0.16 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 67.27 2brm h THR 199 Cb 0.12 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 2brm h THR 199 CO -0.02 0.02 0.39 0.00 0.37 0.00 0.00 175.52 176.29 2brm h ALA 200 N 1.26 1.17 -0.13 6.16 0.00 -1.00 -1.05 119.26 125.67 2brm h ALA 200 Ca 0.15 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2brm h ALA 200 Cb 0.19 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2brm h ALA 200 CO -0.23 0.63 -0.31 0.52 0.00 0.00 0.00 179.25 179.87 2brm h MET 201 N 1.15 0.24 -0.01 0.00 2.07 -0.83 -0.64 114.93 116.90 2brm h MET 201 Ca 0.28 -0.09 0.00 0.00 -2.07 0.00 0.00 59.70 57.82 2brm h MET 201 Cb 0.10 -0.01 0.00 0.00 -1.87 0.00 0.00 31.60 29.82 2brm h MET 201 CO -0.04 0.53 -0.51 1.28 1.07 0.00 0.00 176.91 179.24 2brm n LEU 202 N -4.12 1.64 0.00 1.22 4.77 -0.70 -0.86 117.00 118.95 2brm n LEU 202 Ca -0.01 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.37 2brm n LEU 202 Cb 0.40 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 2brm n LEU 202 CO 0.40 0.32 -0.18 0.00 -1.33 0.00 0.00 177.39 176.60 2brm n ALA 203 N -0.40 1.04 -1.01 -1.18 0.00 -0.44 -4.55 120.51 113.97 2brm n ALA 203 Ca 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.53 2brm n ALA 203 Cb 0.42 0.04 -0.00 0.00 0.00 0.00 0.00 19.45 19.91 2brm n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2brm n GLY 204 N 1.16 0.46 3.31 0.00 0.00 -0.25 -2.80 105.19 107.07 2brm n GLY 204 Ca 0.00 -0.44 -0.12 0.00 0.00 0.00 0.00 46.02 45.46 2brm n GLY 204 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2brm s GLU 205 N -0.88 0.93 0.13 1.61 -1.05 -1.26 -1.64 118.70 116.53 2brm s GLU 205 Ca 0.00 -0.46 -0.21 0.00 -0.15 0.00 0.00 54.97 54.14 2brm s GLU 205 Cb 0.00 0.41 -0.07 0.00 -0.44 0.00 0.00 34.13 34.03 2brm s GLU 205 CO 0.00 -0.33 0.66 -0.51 0.95 0.00 0.00 175.26 176.04 2brm s LEU 206 N -2.18 4.52 0.44 1.83 1.02 -1.26 -4.12 118.68 118.93 2brm s LEU 206 Ca -0.03 1.42 0.24 0.00 0.02 0.00 0.00 54.13 55.77 2brm s LEU 206 Cb -0.00 -3.14 0.88 0.00 0.02 0.00 0.00 46.19 43.95 2brm s LEU 206 CO -0.05 0.22 1.81 1.55 0.02 0.00 0.00 176.35 179.90 2brm h PRO 207 N 4.28 0.00 -2.38 1.29 0.13 -1.93 -3.47 132.00 129.92 2brm h PRO 207 Ca -0.48 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.70 2brm h PRO 207 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 2brm h PRO 207 CO 0.65 0.22 0.40 1.67 -0.23 0.00 0.00 178.00 180.71 2brm s TRP 208 N -3.61 -0.42 0.18 1.56 -2.14 -1.26 -4.66 118.94 108.58 2brm s TRP 208 Ca 0.01 0.35 -0.06 0.00 2.66 0.00 0.00 56.10 59.06 2brm s TRP 208 Cb 0.10 0.53 0.07 0.00 -3.10 0.00 0.00 33.47 31.07 2brm s TRP 208 CO 0.64 -0.61 1.52 -0.44 -2.66 0.00 0.00 176.95 175.39 2brm h ASP 209 N 2.13 0.79 -4.89 -2.66 3.32 -1.92 -3.41 116.42 109.79 2brm h ASP 209 Ca -0.25 -0.37 -0.05 0.00 0.02 0.00 0.00 57.03 56.38 2brm h ASP 209 Cb 1.24 -0.22 -0.19 0.00 0.22 0.00 0.00 39.33 40.38 2brm h ASP 209 CO 0.33 1.11 0.22 0.00 -1.72 0.00 0.00 179.24 179.19 2brm s GLN 210 N -4.26 1.01 -1.39 3.56 -2.07 -1.26 -2.12 119.66 113.14 2brm s GLN 210 Ca -0.09 0.26 -0.11 0.00 -1.82 0.00 0.00 55.36 53.60 2brm s GLN 210 Cb 0.12 0.48 0.09 0.00 -1.09 0.00 0.00 33.01 32.60 2brm s GLN 210 CO 0.86 -0.31 2.14 -0.35 -1.32 0.00 0.00 175.29 176.30 2brm n PRO 211 N 0.92 3.33 -4.45 9.60 -0.04 -1.26 -4.75 135.00 138.35 2brm n PRO 211 Ca -0.18 -3.01 -0.24 0.00 -0.04 0.00 0.00 63.50 60.02 2brm n PRO 211 Cb 0.57 -3.07 -0.10 0.00 -0.04 0.00 0.00 33.50 30.86 2brm n PRO 211 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2brm s SER 212 N 1.98 3.65 0.38 3.54 0.01 -1.26 -4.57 113.70 117.43 2brm s SER 212 Ca 0.46 -0.98 0.28 0.00 1.31 0.00 0.00 55.95 57.02 2brm s SER 212 Cb 0.13 -0.34 1.18 0.00 0.21 0.00 0.00 66.02 67.20 2brm s SER 212 CO -0.05 0.05 1.83 0.44 0.41 0.00 0.00 173.24 175.92 2brm h ASP 213 N 2.37 0.00 -0.31 2.44 3.45 -1.98 -2.41 116.42 119.98 2brm h ASP 213 Ca -0.41 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 56.99 2brm h ASP 213 Cb 1.25 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.99 2brm h ASP 213 CO 0.58 0.00 0.07 -1.54 -1.57 0.00 0.00 179.24 176.79 2brm n SER 214 N -2.57 3.21 -3.94 6.45 3.41 -1.26 -4.75 113.62 114.17 2brm n SER 214 Ca 0.01 -2.50 -0.30 0.00 -0.26 0.00 0.00 58.87 55.83 2brm n SER 214 Cb 0.24 -0.60 -0.16 0.00 -0.26 0.00 0.00 64.21 63.43 2brm n SER 214 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2brm h GLN 216 N 8.02 1.10 -0.49 0.00 5.75 -1.86 -2.39 115.11 125.24 2brm h GLN 216 Ca -0.23 -0.07 -0.11 0.00 -0.15 0.00 0.00 58.65 58.10 2brm h GLN 216 Cb 1.09 -0.25 -0.02 0.00 1.07 0.00 0.00 27.48 29.38 2brm h GLN 216 CO 0.43 0.73 -0.12 0.93 -2.65 0.00 0.00 178.83 178.14 2brm h GLU 217 N 1.13 0.91 -0.49 1.69 3.07 -1.94 -1.80 114.58 117.14 2brm h GLU 217 Ca 0.42 -0.32 -0.11 0.00 -0.50 0.00 0.00 59.36 58.84 2brm h GLU 217 Cb 0.16 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.99 2brm h GLU 217 CO -0.17 0.97 -0.14 -0.92 -1.40 0.00 0.00 179.01 177.35 2brm h TYR 218 N 0.81 1.05 -0.11 4.33 3.20 -1.74 -2.82 116.97 121.69 2brm h TYR 218 Ca 0.13 -0.22 -0.08 0.00 3.14 0.00 0.00 58.73 61.70 2brm h TYR 218 Cb 0.65 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 2brm h TYR 218 CO 0.04 1.01 -0.28 0.77 -1.64 0.00 0.00 178.16 178.06 2brm h SER 219 N 0.83 0.21 -0.51 -2.11 0.02 -1.15 -2.43 113.55 108.41 2brm h SER 219 Ca 0.13 -0.06 -0.11 0.00 -0.84 0.00 0.00 61.79 60.90 2brm h SER 219 Cb 0.69 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 2brm h SER 219 CO 0.05 0.49 -0.10 0.44 -1.14 0.00 0.00 176.83 176.57 2brm h ASP 220 N 0.19 0.99 -0.31 3.07 3.45 -1.21 -2.55 116.42 120.05 2brm h ASP 220 Ca 0.03 -0.32 -0.10 0.00 0.43 0.00 0.00 57.03 57.07 2brm h ASP 220 Cb 0.60 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 39.08 2brm h ASP 220 CO 0.04 1.10 -0.15 -0.25 -1.57 0.00 0.00 179.24 178.42 2brm h TRP 221 N 0.89 0.83 0.00 4.55 2.91 -1.22 -2.20 115.95 121.70 2brm h TRP 221 Ca 0.14 -0.16 -0.07 0.00 1.13 0.00 0.00 58.89 59.93 2brm h TRP 221 Cb 0.66 -0.21 -0.01 0.00 -0.51 0.00 0.00 29.16 29.09 2brm h TRP 221 CO 0.04 0.85 -0.33 0.87 -1.03 0.00 0.00 178.44 178.84 2brm h LYS 222 N 0.67 0.00 -0.15 2.65 1.57 -1.37 -2.55 116.57 117.39 2brm h LYS 222 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2brm h LYS 222 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 2brm h LYS 222 CO 0.04 0.33 0.00 0.39 -0.57 0.00 0.00 179.45 179.64 2brm n GLU 223 N -3.56 1.52 -3.54 3.15 1.02 -0.97 -4.94 120.64 113.32 2brm n GLU 223 Ca -0.00 -0.80 -0.23 0.00 -0.02 0.00 0.00 57.16 56.11 2brm n GLU 223 Cb 0.47 -1.31 0.08 0.00 -0.02 0.00 0.00 31.44 30.65 2brm n GLU 223 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2brm n LYS 224 N 0.05 -7.62 -2.62 3.49 4.01 -0.96 -4.92 118.16 109.59 2brm n LYS 224 Ca 0.13 0.79 -0.43 0.00 -0.51 0.00 0.00 58.31 58.30 2brm n LYS 224 Cb 0.24 -5.73 0.01 0.00 -0.51 0.00 0.00 35.03 29.03 2brm n LYS 224 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2brm n LYS 225 N -4.80 3.92 -0.14 1.97 5.02 -0.85 -4.79 118.16 118.48 2brm n LYS 225 Ca 0.01 -3.93 0.03 0.00 -2.02 0.00 0.00 58.31 52.40 2brm n LYS 225 Cb 0.56 -2.77 0.09 0.00 -0.02 0.00 0.00 35.03 32.88 2brm n LYS 225 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2brm n THR 226 N 2.66 0.39 1.34 -0.18 -2.24 -1.26 -3.19 114.28 111.80 2brm n THR 226 Ca 0.34 -0.28 0.13 0.00 -2.27 0.00 0.00 64.05 61.97 2brm n THR 226 Cb 0.35 -0.04 0.47 0.00 -2.10 0.00 0.00 70.33 69.01 2brm n THR 226 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2brm n TYR 227 N 0.09 0.00 -3.91 4.78 0.18 -1.26 -3.49 117.16 113.55 2brm n TYR 227 Ca 0.07 0.00 -0.21 0.00 1.88 0.00 0.00 57.90 59.64 2brm n TYR 227 Cb 0.26 -0.11 -0.02 0.00 -0.38 0.00 0.00 39.34 39.09 2brm n TYR 227 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2brm s LEU 228 N -2.39 4.28 0.53 -3.48 1.43 -1.19 -4.76 118.68 113.09 2brm s LEU 228 Ca 0.28 0.04 -0.21 0.00 -1.03 0.00 0.00 54.13 53.22 2brm s LEU 228 Cb 0.20 -2.85 -0.06 0.00 0.03 0.00 0.00 46.19 43.51 2brm s LEU 228 CO 0.47 -0.12 1.19 0.20 0.23 0.00 0.00 176.35 178.33 2brm s ASN 229 N -4.00 5.65 0.00 2.29 0.01 -1.26 -1.90 114.94 115.73 2brm s ASN 229 Ca 0.35 2.36 0.29 0.00 -0.71 0.00 0.00 52.86 55.15 2brm s ASN 229 Cb -0.09 -2.60 1.21 0.00 0.41 0.00 0.00 41.25 40.18 2brm s ASN 229 CO 0.29 -1.28 1.83 -0.81 -1.51 0.00 0.00 177.10 175.63 2brm n PRO 230 N -1.09 1.36 0.23 -0.60 -0.04 -1.26 -4.89 135.00 128.70 2brm n PRO 230 Ca 0.11 -0.66 0.08 0.00 -0.04 0.00 0.00 63.50 62.99 2brm n PRO 230 Cb 0.49 -1.49 0.54 0.00 -0.04 0.00 0.00 33.50 33.00 2brm n PRO 230 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2brm h TRP 231 N 1.60 0.00 0.00 0.54 4.06 -1.65 -2.56 115.95 117.93 2brm h TRP 231 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2brm h TRP 231 Cb 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.55 2brm h TRP 231 CO 0.00 0.22 0.00 1.57 -3.56 0.00 0.00 178.44 176.67 2brm h LYS 232 N 0.00 0.00 -0.01 0.49 2.10 -1.51 -2.89 116.57 114.75 2brm h LYS 232 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2brm h LYS 232 Cb 0.48 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.81 2brm h LYS 232 CO 0.03 0.00 -0.22 1.63 -2.00 0.00 0.00 179.45 178.89 2brm n LYS 233 N -2.45 0.93 -0.04 0.07 5.02 -0.96 -4.75 118.16 115.97 2brm n LYS 233 Ca 0.02 -0.53 -0.02 0.00 -2.02 0.00 0.00 58.31 55.75 2brm n LYS 233 Cb 0.25 -1.49 -0.01 0.00 -0.02 0.00 0.00 35.03 33.76 2brm n LYS 233 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2brm h ILE 234 N 1.30 0.00 0.00 -0.18 2.04 -1.66 -3.46 117.51 115.55 2brm h ILE 234 Ca 0.00 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.22 2brm h ILE 234 Cb 0.50 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2brm h ILE 234 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 178.15 177.48 2brm n ASP 235 N -3.76 0.00 -0.35 1.72 -0.08 -1.26 -4.90 116.55 107.92 2brm n ASP 235 Ca -0.04 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.31 2brm n ASP 235 Cb 0.14 0.00 0.23 0.00 2.34 0.00 0.00 41.12 43.83 2brm n ASP 235 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2brm h SER 236 N 0.00 0.87 0.76 1.67 4.64 -1.98 -1.76 113.55 117.75 2brm h SER 236 Ca 0.00 0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.34 2brm h SER 236 Cb 0.00 -0.12 0.01 0.00 -0.31 0.00 0.00 62.40 61.98 2brm h SER 236 CO 0.00 0.45 -0.37 0.00 -0.87 0.00 0.00 176.83 176.05 2brm h ALA 237 N 1.53 -1.13 0.00 5.18 0.00 -2.00 -1.59 119.26 121.26 2brm h ALA 237 Ca 0.49 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 2brm h ALA 237 Cb 0.50 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2brm h ALA 237 CO -0.27 -1.05 -0.21 -1.00 0.00 0.00 0.00 179.25 176.71 2brm h PRO 238 N -1.16 0.00 -0.40 0.00 0.13 -1.89 -2.77 132.00 125.91 2brm h PRO 238 Ca -0.10 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.95 2brm h PRO 238 Cb 0.79 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.90 2brm h PRO 238 CO 0.17 0.21 -0.07 1.25 -0.23 0.00 0.00 178.00 179.33 2brm h LEU 239 N 0.00 0.65 -0.90 1.56 6.46 -1.29 -1.51 115.31 120.29 2brm h LEU 239 Ca -0.00 -0.17 -0.09 0.00 -0.12 0.00 0.00 57.88 57.49 2brm h LEU 239 Cb 0.40 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.14 2brm h LEU 239 CO 0.03 0.77 -0.20 0.00 -0.62 0.00 0.00 178.44 178.42 2brm h ALA 240 N 1.30 1.07 -0.43 1.25 0.00 -1.00 0.14 119.26 121.59 2brm h ALA 240 Ca 0.12 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.57 2brm h ALA 240 Cb 0.49 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2brm h ALA 240 CO 0.03 0.57 -0.22 1.25 0.00 0.00 0.00 179.25 180.88 2brm h LEU 241 N 0.52 0.87 -1.24 0.00 5.85 -1.38 -2.92 115.31 117.02 2brm h LEU 241 Ca 0.08 -0.32 -0.07 0.00 0.84 0.00 0.00 57.88 58.41 2brm h LEU 241 Cb 0.64 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2brm h LEU 241 CO 0.05 1.06 -0.26 -0.07 -0.34 0.00 0.00 178.44 178.88 2brm h LEU 242 N 0.74 0.19 -1.56 2.25 4.07 -0.79 -1.97 115.31 118.25 2brm h LEU 242 Ca 0.10 -0.06 -0.05 0.00 0.08 0.00 0.00 57.88 57.96 2brm h LEU 242 Cb 0.76 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.44 2brm h LEU 242 CO 0.06 0.46 -0.22 0.45 -1.08 0.00 0.00 178.44 178.11 2brm h HIS 243 N 0.18 0.00 0.00 1.13 3.86 -0.80 -1.80 115.15 117.72 2brm h HIS 243 Ca 0.03 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.08 2brm h HIS 243 Cb 0.56 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.00 2brm h HIS 243 CO 0.01 0.22 -1.04 0.87 0.86 0.00 0.00 177.93 178.85 2brm h LYS 244 N 0.00 0.00 0.08 2.45 1.57 -1.24 -3.39 116.57 116.03 2brm h LYS 244 Ca -0.00 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.56 2brm h LYS 244 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 2brm h LYS 244 CO 0.03 0.48 -1.10 0.82 -0.57 0.00 0.00 179.45 179.11 2brm h ILE 245 N 0.00 1.17 -1.02 1.86 2.04 -1.23 -2.64 117.51 117.70 2brm h ILE 245 Ca -0.09 -2.36 -0.49 0.00 1.00 0.00 0.00 64.86 62.92 2brm h ILE 245 Cb 1.57 2.77 -0.17 0.00 -0.74 0.00 0.00 36.82 40.25 2brm h ILE 245 CO 0.07 0.61 0.42 0.18 0.00 0.00 0.00 178.15 179.43 2brm n LEU 246 N -4.15 6.47 -4.73 1.44 4.77 -0.69 -4.69 117.00 115.42 2brm n LEU 246 Ca -0.23 -4.05 -0.38 0.00 -0.03 0.00 0.00 56.01 51.32 2brm n LEU 246 Cb 0.78 -1.25 -0.06 0.00 -2.33 0.00 0.00 43.42 40.56 2brm n LEU 246 CO 0.36 1.74 0.15 -0.69 -1.33 0.00 0.00 177.39 177.62 2brm s VAL 247 N -2.05 5.19 0.15 4.08 1.01 -1.26 -4.97 120.40 122.55 2brm s VAL 247 Ca 0.59 0.91 -0.17 0.00 0.00 0.00 0.00 61.98 63.32 2brm s VAL 247 Cb 0.37 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.98 2brm s VAL 247 CO -0.21 0.34 1.73 -0.08 0.00 0.00 0.00 175.10 176.88 2brm h GLU 248 N 6.62 0.15 -6.30 2.72 4.81 -1.96 -3.40 114.58 117.22 2brm h GLU 248 Ca -0.42 -0.01 -0.57 0.00 -0.13 0.00 0.00 59.36 58.23 2brm h GLU 248 Cb 1.18 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 30.47 2brm h GLU 248 CO 0.75 0.10 0.89 1.21 -0.73 0.00 0.00 179.01 181.23 2brm s ASN 249 N -5.29 6.86 0.39 1.04 2.47 -1.26 -4.68 114.94 114.48 2brm s ASN 249 Ca -0.13 1.17 0.28 0.00 0.42 0.00 0.00 52.86 54.59 2brm s ASN 249 Cb 0.12 -2.54 1.36 0.00 -1.45 0.00 0.00 41.25 38.74 2brm s ASN 249 CO 0.70 -0.92 1.85 1.55 -3.72 0.00 0.00 177.10 176.56 2brm h PRO 250 N 8.44 0.00 0.00 0.43 0.13 -1.96 -2.18 132.00 136.86 2brm h PRO 250 Ca -0.23 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.68 2brm h PRO 250 Cb 1.08 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 2brm h PRO 250 CO 1.03 0.00 -1.15 0.66 -0.23 0.00 0.00 178.00 178.31 2brm h SER 251 N 0.00 0.00 0.67 1.44 4.64 -1.94 -3.23 113.55 115.13 2brm h SER 251 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2brm h SER 251 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2brm h SER 251 CO 0.00 0.95 -0.34 0.00 -0.87 0.00 0.00 176.83 176.58 2brm n ALA 252 N -2.39 3.14 -1.77 5.18 0.00 -0.93 -4.93 120.51 118.80 2brm n ALA 252 Ca -0.04 -0.27 -0.37 0.00 0.00 0.00 0.00 53.44 52.76 2brm n ALA 252 Cb 0.95 -1.24 -0.02 0.00 0.00 0.00 0.00 19.45 19.14 2brm n ALA 252 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2brm s ARG 253 N -3.00 4.00 0.42 0.00 3.52 -0.87 -4.99 118.95 118.04 2brm s ARG 253 Ca 0.12 1.71 -0.25 0.00 -0.13 0.00 0.00 55.73 57.18 2brm s ARG 253 Cb 0.18 -2.55 -0.08 0.00 -1.56 0.00 0.00 34.95 30.94 2brm s ARG 253 CO 0.65 -0.33 1.23 -1.50 -0.81 0.00 0.00 175.30 174.54 2brm s ILE 254 N -1.53 2.87 0.39 4.11 2.07 -0.99 -5.02 121.20 123.10 2brm s ILE 254 Ca 0.59 0.73 0.06 0.00 -1.41 0.00 0.00 60.65 60.63 2brm s ILE 254 Cb -0.27 -3.41 0.00 0.00 0.13 0.00 0.00 42.46 38.91 2brm s ILE 254 CO 0.34 0.06 0.55 0.42 -1.91 0.00 0.00 174.94 174.40 2brm s THR 255 N -1.37 3.56 0.18 4.00 -4.23 -1.26 -4.93 115.64 111.59 2brm s THR 255 Ca 0.59 -0.93 -0.10 0.00 -1.18 0.00 0.00 61.69 60.07 2brm s THR 255 Cb -0.34 -3.23 0.08 0.00 1.34 0.00 0.00 72.50 70.36 2brm s THR 255 CO 0.42 -0.10 1.69 0.40 -0.54 0.00 0.00 174.62 176.50 2brm h ILE 256 N 0.69 1.25 -0.85 2.99 2.04 -1.97 -1.59 117.51 120.07 2brm h ILE 256 Ca -0.43 -0.92 0.16 0.00 1.00 0.00 0.00 64.86 64.67 2brm h ILE 256 Cb 1.27 0.64 -0.10 0.00 -0.74 0.00 0.00 36.82 37.89 2brm h ILE 256 CO 0.50 0.35 0.43 -0.65 0.00 0.00 0.00 178.15 178.78 2brm h PRO 257 N 0.92 0.57 0.00 2.37 0.11 -2.00 -1.96 132.00 132.02 2brm h PRO 257 Ca 0.20 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.22 2brm h PRO 257 Cb 0.35 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 2brm h PRO 257 CO 0.00 0.38 -0.27 -0.44 -0.21 0.00 0.00 178.00 177.46 2brm h ASP 258 N 0.59 0.00 0.32 -2.05 3.45 -1.83 -3.07 116.42 113.83 2brm h ASP 258 Ca 0.48 0.00 -0.11 0.00 0.43 0.00 0.00 57.03 57.83 2brm h ASP 258 Cb 0.71 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.47 2brm h ASP 258 CO -0.38 0.27 -0.44 0.40 -1.57 0.00 0.00 179.24 177.51 2brm h ILE 259 N 0.00 1.32 0.00 0.35 2.04 -0.56 -2.82 117.51 117.85 2brm h ILE 259 Ca -0.00 -1.58 0.00 0.00 1.00 0.00 0.00 64.86 64.27 2brm h ILE 259 Cb 0.96 1.77 0.00 0.00 -0.74 0.00 0.00 36.82 38.81 2brm h ILE 259 CO 0.03 0.47 0.00 0.11 0.00 0.00 0.00 178.15 178.76 2brm h LYS 260 N 0.14 0.00 -0.02 2.37 1.57 -1.34 -2.77 116.57 116.51 2brm h LYS 260 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2brm h LYS 260 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.15 2brm h LYS 260 CO 0.07 0.00 -0.16 1.63 -0.57 0.00 0.00 179.45 180.42 2brm n LYS 261 N -2.43 1.92 -2.20 3.15 5.02 -1.07 -4.76 118.16 117.79 2brm n LYS 261 Ca 0.02 -1.58 -0.35 0.00 -2.02 0.00 0.00 58.31 54.38 2brm n LYS 261 Cb 0.27 -1.47 0.01 0.00 -0.02 0.00 0.00 35.03 33.82 2brm n LYS 261 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2brm s ASP 262 N -2.16 5.61 0.05 4.39 -1.08 -1.05 -4.94 116.67 117.48 2brm s ASP 262 Ca 0.25 2.20 -0.25 0.00 -0.52 0.00 0.00 52.55 54.23 2brm s ASP 262 Cb 0.19 -2.58 -0.17 0.00 -1.46 0.00 0.00 42.92 38.90 2brm s ASP 262 CO 0.39 -1.30 1.56 -0.09 0.52 0.00 0.00 175.17 176.26 2brm h ARG 263 N 1.09 -0.11 -0.60 4.34 2.43 -1.93 -2.56 114.38 117.03 2brm h ARG 263 Ca -0.50 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 58.62 2brm h ARG 263 Cb 1.27 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.82 2brm h ARG 263 CO 0.56 0.07 0.13 2.35 -1.51 0.00 0.00 179.97 181.57 2brm h TRP 264 N -0.27 0.98 -0.50 2.20 7.01 -1.94 -1.85 115.95 121.57 2brm h TRP 264 Ca -0.01 -0.11 0.04 0.00 2.11 0.00 0.00 58.89 60.92 2brm h TRP 264 Cb 0.23 -0.28 -0.03 0.00 -2.10 0.00 0.00 29.16 26.98 2brm h TRP 264 CO -0.02 0.82 0.33 -0.92 -2.79 0.00 0.00 178.44 175.86 2brm h TYR 265 N 0.90 0.53 -0.55 2.65 5.03 -1.82 -2.45 116.97 121.26 2brm h TYR 265 Ca 0.19 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.51 2brm h TYR 265 Cb 0.34 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 38.45 2brm h TYR 265 CO 0.02 0.31 0.00 0.09 -1.32 0.00 0.00 178.16 177.26 2brm n ASN 266 N -4.47 4.16 -4.68 -2.11 3.02 -0.98 -4.97 115.26 105.23 2brm n ASN 266 Ca 0.06 -2.36 -0.42 0.00 -0.03 0.00 0.00 54.58 51.82 2brm n ASN 266 Cb 0.16 -0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 38.81 2brm n ASN 266 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2brm s LYS 267 N -1.67 4.40 0.14 3.52 2.20 -0.72 -5.01 119.74 122.59 2brm s LYS 267 Ca 0.44 1.35 -0.31 0.00 -0.36 0.00 0.00 55.97 57.09 2brm s LYS 267 Cb 0.28 -3.55 -0.09 0.00 -1.51 0.00 0.00 37.83 32.95 2brm s LYS 267 CO 0.22 -0.34 1.57 -2.14 -0.36 0.00 0.00 175.35 174.30 2brm s PRO 268 N 2.13 4.22 0.00 4.03 0.02 -1.26 -4.83 135.00 139.31 2brm s PRO 268 Ca 0.47 2.33 0.00 0.00 0.02 0.00 0.00 61.00 63.81 2brm s PRO 268 Cb -0.18 -3.26 0.00 0.00 0.02 0.00 0.00 34.50 31.08 2brm s PRO 268 CO 0.16 -0.62 0.00 1.28 -0.33 0.00 0.00 177.00 177.49 2brm n LEU 269 N 4.33 0.00 -4.86 -5.54 4.77 -1.26 -5.13 117.00 109.31 2brm n LEU 269 Ca 0.14 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.80 2brm n LEU 269 Cb 0.39 0.08 -0.05 0.00 -2.33 0.00 0.00 43.42 41.50 2brm n LEU 269 CO 0.61 -0.48 -0.19 -0.75 -1.33 0.00 0.00 177.39 175.25 2brm s LYS 270 N -1.96 3.28 0.80 3.23 2.20 -1.26 -4.87 119.74 121.16 2brm s LYS 270 Ca 0.00 -0.43 -0.06 0.00 -0.36 0.00 0.00 55.97 55.12 2brm s LYS 270 Cb 0.00 -2.98 0.15 0.00 -1.51 0.00 0.00 37.83 33.48 2brm s LYS 270 CO 0.00 0.64 1.10 0.15 -0.36 0.00 0.00 175.35 176.89 2brm s LYS 271 N -2.06 1.37 0.00 4.03 -0.14 -1.26 -5.11 119.74 116.57 2brm s LYS 271 Ca 0.28 -0.82 0.00 0.00 -1.36 0.00 0.00 55.97 54.07 2brm s LYS 271 Cb -0.12 -2.16 0.00 0.00 -1.68 0.00 0.00 37.83 33.87 2brm s LYS 271 CO 0.20 -1.75 0.00 0.41 -0.76 0.00 0.00 175.35 173.44 2brm n GLY 272 N -3.15 -1.64 3.74 -3.33 0.00 -1.26 -5.00 105.19 94.54 2brm n GLY 272 Ca 0.15 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.29 2brm n GLY 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2brm s ALA 273 N -3.46 2.31 -2.00 4.61 0.00 -1.26 -5.30 121.76 116.67 2brm s ALA 273 Ca 0.00 0.93 0.12 0.00 0.00 0.00 0.00 51.96 53.02 2brm s ALA 273 Cb 0.00 -3.46 0.74 0.00 0.00 0.00 0.00 23.12 20.40 2brm s ALA 273 CO 0.00 -1.57 1.17 1.63 0.00 0.00 0.00 175.76 177.00