#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2br8 n ALA 2 N 0.00 0.00 0.19 -1.58 0.00 -1.26 -2.11 120.51 115.74 2br8 n ALA 2 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 2br8 n ALA 2 Cb 0.00 0.00 0.34 0.00 0.00 0.00 0.00 19.45 19.79 2br8 n ALA 2 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2br8 h ASN 3 N 0.00 0.00 -0.33 0.00 2.35 -1.99 -3.18 115.58 112.43 2br8 h ASN 3 Ca 0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 2br8 h ASN 3 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2br8 h ASN 3 CO 0.00 0.38 0.05 0.25 -1.65 0.00 0.00 177.43 176.46 2br8 h LEU 4 N 0.00 0.53 -0.67 1.61 5.85 -1.75 -0.06 115.31 120.82 2br8 h LEU 4 Ca -0.00 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.55 2br8 h LEU 4 Cb 0.88 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.70 2br8 h LEU 4 CO 0.05 0.66 0.31 0.24 -0.34 0.00 0.00 178.44 179.35 2br8 h MET 5 N 0.38 0.51 -0.04 1.25 0.00 -1.53 -1.83 114.93 113.66 2br8 h MET 5 Ca 0.10 -0.03 -0.00 0.00 0.00 0.00 0.00 59.70 59.77 2br8 h MET 5 Cb 0.36 -0.12 -0.00 0.00 0.00 0.00 0.00 31.60 31.84 2br8 h MET 5 CO 0.01 0.34 0.02 -0.09 0.00 0.00 0.00 176.91 177.19 2br8 h ARG 6 N 0.53 0.06 -0.47 1.72 2.43 -1.49 -2.10 114.38 115.06 2br8 h ARG 6 Ca 0.33 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.55 2br8 h ARG 6 Cb 0.37 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 2br8 h ARG 6 CO -0.28 0.13 0.18 1.25 -1.51 0.00 0.00 179.97 179.74 2br8 h LEU 7 N -0.02 0.22 -0.72 3.80 5.85 -0.82 0.00 115.31 123.62 2br8 h LEU 7 Ca 0.02 0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.66 2br8 h LEU 7 Cb 0.09 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2br8 h LEU 7 CO -0.00 0.16 -0.35 0.11 -0.34 0.00 0.00 178.44 178.02 2br8 h LYS 8 N 0.37 0.59 -0.02 1.25 1.57 -1.27 -1.41 116.57 117.64 2br8 h LYS 8 Ca 0.22 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2br8 h LYS 8 Cb 0.19 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 2br8 h LYS 8 CO -0.20 0.85 -0.01 1.03 -0.57 0.00 0.00 179.45 180.55 2br8 h SER 9 N 0.50 0.05 -0.84 0.86 0.87 -1.08 -1.52 113.55 112.37 2br8 h SER 9 Ca 0.05 -0.42 0.12 0.00 -1.23 0.00 0.00 61.79 60.32 2br8 h SER 9 Cb 0.83 -0.01 -0.08 0.00 -0.44 0.00 0.00 62.40 62.70 2br8 h SER 9 CO 0.07 0.45 0.46 0.44 -0.53 0.00 0.00 176.83 177.72 2br8 h ASP 10 N -0.36 0.60 -0.06 6.23 3.32 -0.91 0.31 116.42 125.56 2br8 h ASP 10 Ca 0.00 0.07 -0.20 0.00 0.02 0.00 0.00 57.03 56.92 2br8 h ASP 10 Cb 0.43 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 39.96 2br8 h ASP 10 CO 0.00 0.30 -0.76 -0.07 -1.72 0.00 0.00 179.24 176.99 2br8 h LEU 11 N 0.70 0.77 0.00 1.55 3.38 -1.24 -3.35 115.31 117.13 2br8 h LEU 11 Ca 0.44 -0.70 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 2br8 h LEU 11 Cb 0.53 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2br8 h LEU 11 CO -0.31 1.36 -1.87 0.49 0.09 0.00 0.00 178.44 178.19 2br8 n PHE 12 N -4.04 0.00 0.85 1.13 0.99 -0.58 -4.62 117.46 111.19 2br8 n PHE 12 Ca -0.09 0.00 0.09 0.00 -0.00 0.00 0.00 57.45 57.45 2br8 n PHE 12 Cb 0.74 -0.49 -0.02 0.00 -1.00 0.00 0.00 39.48 38.71 2br8 n PHE 12 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 2br8 n ASN 13 N -2.22 1.70 -2.23 4.37 5.03 0.11 -4.17 115.26 117.84 2br8 n ASN 13 Ca -0.09 -1.35 -0.16 0.00 0.87 0.00 0.00 54.58 53.85 2br8 n ASN 13 Cb 0.59 0.54 -0.14 0.00 -1.02 0.00 0.00 39.78 39.75 2br8 n ASN 13 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2br8 n ARG 14 N -0.24 2.27 0.00 3.52 1.74 -1.24 -4.94 116.66 117.77 2br8 n ARG 14 Ca 0.07 -1.19 0.00 0.00 -0.77 0.00 0.00 57.85 55.96 2br8 n ARG 14 Cb 0.39 -2.13 0.00 0.00 -1.02 0.00 0.00 32.46 29.70 2br8 n ARG 14 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2br8 n SER 15 N 2.69 0.00 -4.73 0.55 7.64 -1.26 -5.00 113.62 113.51 2br8 n SER 15 Ca 0.49 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 60.02 2br8 n SER 15 Cb 0.80 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.91 2br8 n SER 15 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2br8 s PRO 16 N 0.00 3.06 0.84 1.43 0.05 -1.26 -4.67 135.00 134.44 2br8 s PRO 16 Ca 0.00 -0.39 -0.12 0.00 0.05 0.00 0.00 61.00 60.54 2br8 s PRO 16 Cb 0.00 -2.86 0.10 0.00 0.05 0.00 0.00 34.50 31.79 2br8 s PRO 16 CO 0.00 0.70 1.19 1.41 0.05 0.00 0.00 177.00 180.35 2br8 s MET 17 N -1.08 1.46 0.27 4.56 1.75 -1.26 -4.92 119.30 120.08 2br8 s MET 17 Ca 0.15 1.71 -0.30 0.00 -1.25 0.00 0.00 55.69 56.00 2br8 s MET 17 Cb -0.12 -1.76 -0.12 0.00 2.84 0.00 0.00 34.83 35.68 2br8 s MET 17 CO 0.05 -2.34 1.63 -0.47 -0.65 0.00 0.00 175.02 173.24 2br8 s TYR 18 N -2.28 2.78 -1.40 4.11 5.04 -1.26 -4.92 117.35 119.41 2br8 s TYR 18 Ca 0.71 0.66 0.11 0.00 -2.44 0.00 0.00 57.07 56.11 2br8 s TYR 18 Cb -0.27 -4.10 0.41 0.00 0.35 0.00 0.00 41.96 38.34 2br8 s TYR 18 CO 0.53 -3.83 1.26 -0.35 -1.34 0.00 0.00 175.55 171.82 2br8 n PRO 19 N 2.64 2.48 0.00 4.97 -0.04 -1.26 -4.81 135.00 138.97 2br8 n PRO 19 Ca 0.10 -1.61 0.00 0.00 -0.04 0.00 0.00 63.50 61.95 2br8 n PRO 19 Cb 0.37 -1.58 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 2br8 n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2br8 n GLY 20 N 0.82 -0.76 3.88 0.55 0.00 -1.26 -5.04 105.19 103.38 2br8 n GLY 20 Ca 0.15 -1.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.20 2br8 n GLY 20 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2br8 s PRO 21 N -2.14 1.22 0.33 1.61 0.04 -1.26 -5.06 135.00 129.73 2br8 s PRO 21 Ca 0.00 -0.06 0.07 0.00 0.04 0.00 0.00 61.00 61.05 2br8 s PRO 21 Cb 0.00 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.63 2br8 s PRO 21 CO 0.00 -2.08 0.29 0.95 0.04 0.00 0.00 177.00 176.20 2br8 s THR 22 N -3.62 0.00 0.28 1.26 -4.23 -0.89 -4.96 115.64 103.48 2br8 s THR 22 Ca 0.67 -1.98 -0.02 0.00 -1.18 0.00 0.00 61.69 59.17 2br8 s THR 22 Cb -0.09 -2.51 0.27 0.00 1.34 0.00 0.00 72.50 71.51 2br8 s THR 22 CO 0.51 0.00 1.93 0.11 -0.54 0.00 0.00 174.62 176.63 2br8 h LYS 23 N 2.13 1.13 0.01 3.99 1.57 -1.92 -2.68 116.57 120.80 2br8 h LYS 23 Ca -0.25 -0.07 -0.20 0.00 -1.87 0.00 0.00 60.65 58.26 2br8 h LYS 23 Cb 1.23 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 33.26 2br8 h LYS 23 CO 0.36 0.75 -0.95 -0.44 -0.57 0.00 0.00 179.45 178.60 2br8 h ASP 24 N 1.16 0.08 -2.27 0.86 3.32 -1.96 -3.37 116.42 114.24 2br8 h ASP 24 Ca 0.37 -0.07 -0.59 0.00 0.02 0.00 0.00 57.03 56.75 2br8 h ASP 24 Cb 0.02 -0.02 -0.41 0.00 0.22 0.00 0.00 39.33 39.13 2br8 h ASP 24 CO -0.11 0.98 -0.72 -0.67 -1.72 0.00 0.00 179.24 177.00 2br8 n ASP 25 N -3.48 2.70 -4.81 6.45 2.03 -1.16 -5.11 116.55 113.16 2br8 n ASP 25 Ca -0.01 -3.20 -0.30 0.00 0.52 0.00 0.00 54.79 51.79 2br8 n ASP 25 Cb 0.88 -0.67 0.09 0.00 -0.72 0.00 0.00 41.12 40.70 2br8 n ASP 25 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2br8 s PRO 26 N -1.96 2.09 0.01 -0.67 0.04 -1.02 -2.09 135.00 131.41 2br8 s PRO 26 Ca 0.37 0.59 0.01 0.00 0.04 0.00 0.00 61.00 62.01 2br8 s PRO 26 Cb 0.13 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.73 2br8 s PRO 26 CO -0.06 -1.60 -0.04 -1.17 0.04 0.00 0.00 177.00 174.17 2br8 s LEU 27 N -5.75 2.10 -0.22 -3.56 2.96 -0.04 -4.93 118.68 109.23 2br8 s LEU 27 Ca 0.61 -0.23 -0.06 0.00 -0.22 0.00 0.00 54.13 54.23 2br8 s LEU 27 Cb -0.14 -0.09 -0.03 0.00 0.50 0.00 0.00 46.19 46.43 2br8 s LEU 27 CO 0.54 -0.08 0.04 -0.89 -1.32 0.00 0.00 176.35 174.64 2br8 s THR 28 N -0.58 4.14 -0.19 3.68 2.01 -1.26 -0.04 115.64 123.40 2br8 s THR 28 Ca -0.04 -0.24 -0.04 0.00 0.31 0.00 0.00 61.69 61.68 2br8 s THR 28 Cb -0.04 -2.91 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 2br8 s THR 28 CO -0.00 0.39 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.58 2br8 s VAL 29 N 1.30 3.54 -0.22 3.82 1.01 -0.21 -4.34 120.40 125.30 2br8 s VAL 29 Ca 0.04 -0.46 -0.13 0.00 0.00 0.00 0.00 61.98 61.44 2br8 s VAL 29 Cb -0.15 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 2br8 s VAL 29 CO 0.02 0.45 0.26 -0.89 0.00 0.00 0.00 175.10 174.94 2br8 s THR 30 N 1.05 5.30 0.13 3.92 2.01 0.24 -0.70 115.64 127.59 2br8 s THR 30 Ca 0.01 0.41 0.06 0.00 0.31 0.00 0.00 61.69 62.48 2br8 s THR 30 Cb -0.15 -3.60 -0.04 0.00 0.01 0.00 0.00 72.50 68.73 2br8 s THR 30 CO 0.00 0.31 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.02 2br8 s LEU 31 N 1.10 3.36 -0.22 4.42 2.96 0.32 -1.73 118.68 128.89 2br8 s LEU 31 Ca 0.13 -0.30 -0.27 0.00 -0.22 0.00 0.00 54.13 53.47 2br8 s LEU 31 Cb -0.14 -2.06 0.08 0.00 0.50 0.00 0.00 46.19 44.57 2br8 s LEU 31 CO 0.06 0.13 0.77 -0.83 -1.32 0.00 0.00 176.35 175.16 2br8 s GLY 32 N -2.60 -0.47 -0.03 7.98 0.00 -0.62 -4.33 107.32 107.25 2br8 s GLY 32 Ca 0.26 1.98 0.07 0.00 0.00 0.00 0.00 44.72 47.04 2br8 s GLY 32 CO 0.18 1.56 -0.24 -1.36 0.00 0.00 0.00 173.10 173.24 2br8 s PHE 33 N -0.05 2.38 -0.35 1.90 0.08 -1.26 -0.42 117.98 120.27 2br8 s PHE 33 Ca -0.02 -0.41 0.01 0.00 0.12 0.00 0.00 56.93 56.63 2br8 s PHE 33 Cb -0.04 -1.52 0.09 0.00 -0.57 0.00 0.00 43.02 40.99 2br8 s PHE 33 CO 0.02 -0.02 0.08 0.99 -0.10 0.00 0.00 175.22 176.19 2br8 s THR 34 N -0.61 2.71 -0.27 0.64 2.01 -0.65 -2.15 115.64 117.32 2br8 s THR 34 Ca 0.10 -2.05 -0.29 0.00 0.31 0.00 0.00 61.69 59.75 2br8 s THR 34 Cb -0.10 -2.85 0.01 0.00 0.01 0.00 0.00 72.50 69.57 2br8 s THR 34 CO -0.01 -0.51 1.14 -0.22 -0.69 0.00 0.00 174.62 174.33 2br8 s LEU 35 N 1.05 3.99 -0.17 4.42 2.96 -1.00 -0.87 118.68 129.05 2br8 s LEU 35 Ca 0.06 1.24 0.05 0.00 -0.22 0.00 0.00 54.13 55.27 2br8 s LEU 35 Cb -0.21 -3.54 -0.22 0.00 0.50 0.00 0.00 46.19 42.72 2br8 s LEU 35 CO -0.05 -0.86 0.16 1.67 -1.32 0.00 0.00 176.35 175.95 2br8 n GLN 36 N 6.81 0.68 -3.64 1.98 7.27 0.41 -3.64 117.38 127.27 2br8 n GLN 36 Ca 0.13 0.17 -0.09 0.00 0.07 0.00 0.00 57.00 57.28 2br8 n GLN 36 Cb 0.46 -1.62 -0.07 0.00 2.41 0.00 0.00 30.24 31.42 2br8 n GLN 36 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2br8 s ASP 37 N -6.33 -0.44 -0.56 1.69 2.15 -0.99 -0.59 116.67 111.59 2br8 s ASP 37 Ca -0.20 0.85 -0.21 0.00 0.43 0.00 0.00 52.55 53.41 2br8 s ASP 37 Cb 0.07 0.87 0.06 0.00 -0.30 0.00 0.00 42.92 43.63 2br8 s ASP 37 CO 0.74 -0.15 0.79 -0.63 -0.17 0.00 0.00 175.17 175.75 2br8 s ILE 38 N 0.26 4.63 -0.08 4.11 1.01 -1.26 -1.31 121.20 128.56 2br8 s ILE 38 Ca 0.03 -0.37 -0.24 0.00 0.00 0.00 0.00 60.65 60.07 2br8 s ILE 38 Cb -0.05 -4.47 -0.20 0.00 0.01 0.00 0.00 42.46 37.75 2br8 s ILE 38 CO -0.07 -1.07 0.90 0.58 0.00 0.00 0.00 174.94 175.28 2br8 h VAL 39 N 5.93 1.30 -3.45 2.92 2.07 -1.82 -3.41 116.25 119.79 2br8 h VAL 39 Ca -0.28 -1.57 -0.20 0.00 0.82 0.00 0.00 66.70 65.48 2br8 h VAL 39 Cb 1.08 2.27 -0.27 0.00 -1.52 0.00 0.00 31.29 32.86 2br8 h VAL 39 CO 1.06 0.37 -0.58 -0.75 0.02 0.00 0.00 177.57 177.70 2br8 s LYS 40 N -3.12 0.15 -0.05 1.57 2.20 -1.24 -4.95 119.74 114.30 2br8 s LYS 40 Ca -0.15 0.15 0.05 0.00 -0.36 0.00 0.00 55.97 55.66 2br8 s LYS 40 Cb -0.00 0.07 -0.02 0.00 -1.51 0.00 0.00 37.83 36.36 2br8 s LYS 40 CO 0.58 -0.02 -0.19 0.08 -0.36 0.00 0.00 175.35 175.44 2br8 s VAL 41 N 0.02 2.63 -0.18 4.02 1.01 -1.26 -0.49 120.40 126.16 2br8 s VAL 41 Ca -0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.09 2br8 s VAL 41 Cb -0.01 -2.00 0.05 0.00 0.00 0.00 0.00 36.38 34.42 2br8 s VAL 41 CO 0.00 0.58 -0.03 -0.62 0.00 0.00 0.00 175.10 175.03 2br8 s ASP 42 N -0.57 2.97 0.07 3.32 -1.08 0.35 -5.00 116.67 116.73 2br8 s ASP 42 Ca 0.08 -0.76 0.24 0.00 -0.52 0.00 0.00 52.55 51.60 2br8 s ASP 42 Cb -0.11 -0.87 0.38 0.00 -1.46 0.00 0.00 42.92 40.86 2br8 s ASP 42 CO 0.01 -0.22 1.33 -1.54 0.52 0.00 0.00 175.17 175.27 2br8 n SER 43 N 4.89 0.61 -0.04 -0.34 3.41 -1.26 -2.92 113.62 117.97 2br8 n SER 43 Ca -0.11 -0.02 -0.15 0.00 -0.26 0.00 0.00 58.87 58.33 2br8 n SER 43 Cb 0.47 0.24 -0.13 0.00 -0.26 0.00 0.00 64.21 64.53 2br8 n SER 43 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2br8 h SER 44 N 0.00 0.11 -3.22 4.04 4.64 -1.96 -3.44 113.55 113.72 2br8 h SER 44 Ca 0.00 -0.97 -0.14 0.00 -0.47 0.00 0.00 61.79 60.20 2br8 h SER 44 Cb 0.66 -0.04 0.04 0.00 -0.31 0.00 0.00 62.40 62.76 2br8 h SER 44 CO 0.00 1.08 0.09 0.35 -0.87 0.00 0.00 176.83 177.48 2br8 n THR 45 N -4.50 0.00 -3.43 2.95 -2.24 -1.26 -5.03 114.28 100.77 2br8 n THR 45 Ca -0.11 -0.40 -0.27 0.00 -2.27 0.00 0.00 64.05 61.00 2br8 n THR 45 Cb 0.55 -1.56 -0.08 0.00 -2.10 0.00 0.00 70.33 67.14 2br8 n THR 45 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2br8 n ASN 46 N -3.14 3.52 -4.39 3.42 5.03 -1.26 -4.83 115.26 113.61 2br8 n ASN 46 Ca 0.05 -3.39 -0.31 0.00 0.87 0.00 0.00 54.58 51.81 2br8 n ASN 46 Cb 0.19 -0.67 -0.14 0.00 -1.02 0.00 0.00 39.78 38.13 2br8 n ASN 46 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2br8 s GLU 47 N -2.35 1.98 -0.02 3.52 2.02 -1.15 0.04 118.70 122.74 2br8 s GLU 47 Ca 0.39 -1.01 0.01 0.00 0.02 0.00 0.00 54.97 54.37 2br8 s GLU 47 Cb 0.14 -2.09 0.01 0.00 0.10 0.00 0.00 34.13 32.30 2br8 s GLU 47 CO -0.02 0.54 -0.03 0.08 0.02 0.00 0.00 175.26 175.84 2br8 s VAL 48 N -0.82 0.35 -0.16 2.63 1.01 -1.06 -0.50 120.40 121.86 2br8 s VAL 48 Ca 0.13 -0.08 -0.07 0.00 0.00 0.00 0.00 61.98 61.95 2br8 s VAL 48 Cb -0.10 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 2br8 s VAL 48 CO 0.03 0.15 0.09 -1.81 0.00 0.00 0.00 175.10 173.55 2br8 s ASP 49 N 0.55 5.89 0.01 3.32 1.11 0.36 -2.83 116.67 125.07 2br8 s ASP 49 Ca -0.06 0.22 0.07 0.00 0.18 0.00 0.00 52.55 52.96 2br8 s ASP 49 Cb -0.09 -1.95 -0.02 0.00 1.07 0.00 0.00 42.92 41.93 2br8 s ASP 49 CO -0.01 0.26 -0.21 -0.76 1.18 0.00 0.00 175.17 175.64 2br8 s LEU 50 N -0.17 2.10 -0.30 1.23 1.43 0.88 -2.21 118.68 121.65 2br8 s LEU 50 Ca 0.09 -0.45 -0.03 0.00 -1.03 0.00 0.00 54.13 52.70 2br8 s LEU 50 Cb -0.12 -1.02 0.04 0.00 0.03 0.00 0.00 46.19 45.12 2br8 s LEU 50 CO 0.01 0.21 0.02 -0.69 0.23 0.00 0.00 176.35 176.13 2br8 s VAL 51 N -0.64 3.26 0.22 -1.59 1.01 -0.43 -0.45 120.40 121.78 2br8 s VAL 51 Ca 0.08 -1.20 0.02 0.00 0.00 0.00 0.00 61.98 60.88 2br8 s VAL 51 Cb -0.08 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2br8 s VAL 51 CO 0.01 -0.06 0.02 -0.72 0.00 0.00 0.00 175.10 174.35 2br8 s TYR 52 N 1.32 1.42 -0.15 5.22 -0.85 -0.82 -0.44 117.35 123.04 2br8 s TYR 52 Ca -0.03 -1.03 -0.05 0.00 -0.52 0.00 0.00 57.07 55.45 2br8 s TYR 52 Cb -0.19 -0.82 -0.03 0.00 0.38 0.00 0.00 41.96 41.30 2br8 s TYR 52 CO -0.00 -0.18 0.00 0.71 -1.52 0.00 0.00 175.55 174.56 2br8 s TYR 53 N -3.60 3.13 -0.41 -3.49 2.02 -0.05 -1.26 117.35 113.68 2br8 s TYR 53 Ca 0.29 -0.09 -0.07 0.00 -0.37 0.00 0.00 57.07 56.83 2br8 s TYR 53 Cb 0.06 -1.97 0.09 0.00 -0.40 0.00 0.00 41.96 39.74 2br8 s TYR 53 CO 0.08 0.11 0.23 -2.00 -1.57 0.00 0.00 175.55 172.40 2br8 s GLU 54 N 0.16 2.45 -0.22 -0.62 2.12 -0.36 -1.64 118.70 120.60 2br8 s GLU 54 Ca 0.01 -1.54 -0.25 0.00 0.36 0.00 0.00 54.97 53.55 2br8 s GLU 54 Cb -0.13 -3.69 -0.01 0.00 0.26 0.00 0.00 34.13 30.56 2br8 s GLU 54 CO 0.02 -0.97 0.85 -1.14 -0.54 0.00 0.00 175.26 173.48 2br8 s GLN 55 N 1.34 4.22 -0.07 4.30 0.74 0.44 -3.30 119.66 127.34 2br8 s GLN 55 Ca 0.03 0.99 0.05 0.00 0.05 0.00 0.00 55.36 56.49 2br8 s GLN 55 Cb -0.23 -3.63 -0.00 0.00 1.10 0.00 0.00 33.01 30.25 2br8 s GLN 55 CO 0.00 -0.48 -0.22 -0.65 -0.55 0.00 0.00 175.29 173.39 2br8 s GLN 56 N 2.71 2.50 -0.02 1.67 -0.21 -0.16 -1.59 119.66 124.56 2br8 s GLN 56 Ca 0.36 -0.80 0.03 0.00 0.02 0.00 0.00 55.36 54.98 2br8 s GLN 56 Cb -0.16 -2.02 -0.01 0.00 1.00 0.00 0.00 33.01 31.82 2br8 s GLN 56 CO 0.08 0.26 -0.11 1.03 -2.12 0.00 0.00 175.29 174.42 2br8 s ARG 57 N 0.12 1.02 0.23 2.91 0.52 -0.70 -1.66 118.95 121.38 2br8 s ARG 57 Ca -0.10 -0.41 -0.18 0.00 -0.52 0.00 0.00 55.73 54.53 2br8 s ARG 57 Cb -0.15 -0.96 0.02 0.00 0.52 0.00 0.00 34.95 34.38 2br8 s ARG 57 CO 0.05 0.22 0.58 1.67 0.02 0.00 0.00 175.30 177.84 2br8 s TRP 58 N -0.14 -0.08 -0.03 -0.53 -2.14 -1.08 -0.59 118.94 114.36 2br8 s TRP 58 Ca 0.02 -0.29 0.01 0.00 2.66 0.00 0.00 56.10 58.50 2br8 s TRP 58 Cb -0.06 0.46 0.01 0.00 -3.10 0.00 0.00 33.47 30.78 2br8 s TRP 58 CO -0.00 -1.02 -0.05 0.21 -2.66 0.00 0.00 176.95 173.42 2br8 s LYS 59 N -3.91 0.75 -0.07 3.25 2.20 -1.26 -0.10 119.74 120.61 2br8 s LYS 59 Ca 0.12 -0.15 0.06 0.00 -0.36 0.00 0.00 55.97 55.63 2br8 s LYS 59 Cb -0.02 -0.75 -0.01 0.00 -1.51 0.00 0.00 37.83 35.54 2br8 s LYS 59 CO 0.02 -0.00 -0.25 -0.51 -0.36 0.00 0.00 175.35 174.25 2br8 s LEU 60 N 0.56 2.07 0.38 5.43 1.43 0.15 -4.92 118.68 123.78 2br8 s LEU 60 Ca -0.07 -0.52 0.05 0.00 -1.03 0.00 0.00 54.13 52.56 2br8 s LEU 60 Cb -0.11 -1.38 0.75 0.00 0.03 0.00 0.00 46.19 45.49 2br8 s LEU 60 CO 0.00 0.22 2.00 0.78 0.23 0.00 0.00 176.35 179.59 2br8 h ASN 61 N 6.23 0.52 0.22 2.29 2.35 -1.87 -2.59 115.58 122.73 2br8 h ASN 61 Ca -0.29 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 2br8 h ASN 61 Cb 1.19 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.43 2br8 h ASN 61 CO 0.47 0.43 0.00 -1.54 -1.65 0.00 0.00 177.43 175.14 2br8 n SER 62 N -4.42 0.00 -0.71 5.81 3.41 -1.26 -2.52 113.62 113.93 2br8 n SER 62 Ca 0.03 -0.17 0.08 0.00 -0.26 0.00 0.00 58.87 58.56 2br8 n SER 62 Cb 0.10 -0.19 0.09 0.00 -0.26 0.00 0.00 64.21 63.95 2br8 n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2br8 n LEU 63 N -1.19 2.53 -4.77 1.04 4.77 -0.98 -5.01 117.00 113.39 2br8 n LEU 63 Ca 0.10 -1.12 -0.34 0.00 -0.03 0.00 0.00 56.01 54.62 2br8 n LEU 63 Cb 0.12 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.18 2br8 n LEU 63 CO 0.13 0.48 0.77 -0.04 -1.33 0.00 0.00 177.39 177.39 2br8 s MET 64 N -1.37 3.15 0.25 3.23 -1.94 -1.05 -4.20 119.30 117.39 2br8 s MET 64 Ca 0.22 1.55 -0.20 0.00 -1.71 0.00 0.00 55.69 55.55 2br8 s MET 64 Cb 0.15 -1.98 0.02 0.00 2.01 0.00 0.00 34.83 35.03 2br8 s MET 64 CO 0.22 -1.00 0.66 1.67 -0.01 0.00 0.00 175.02 176.56 2br8 s TRP 65 N -1.95 -0.16 -0.43 -0.03 -2.14 -0.17 -4.96 118.94 109.11 2br8 s TRP 65 Ca 0.71 -0.25 -0.12 0.00 2.66 0.00 0.00 56.10 59.10 2br8 s TRP 65 Cb -0.23 0.60 0.07 0.00 -3.10 0.00 0.00 33.47 30.80 2br8 s TRP 65 CO 0.32 -1.13 0.30 0.34 -2.66 0.00 0.00 176.95 174.11 2br8 s ASP 66 N -2.91 5.83 0.56 -2.66 -1.08 -1.26 -4.70 116.67 110.44 2br8 s ASP 66 Ca 0.11 -1.35 0.29 0.00 -0.52 0.00 0.00 52.55 51.08 2br8 s ASP 66 Cb -0.04 -2.06 1.46 0.00 -1.46 0.00 0.00 42.92 40.82 2br8 s ASP 66 CO 0.04 -0.55 1.93 -0.65 0.52 0.00 0.00 175.17 176.46 2br8 h PRO 67 N 8.53 0.00 0.00 4.34 0.11 -1.93 0.57 132.00 143.61 2br8 h PRO 67 Ca -0.25 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.84 2br8 h PRO 67 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2br8 h PRO 67 CO 0.78 0.00 -0.10 -0.97 -0.21 0.00 0.00 178.00 177.50 2br8 h ASN 68 N 0.00 0.00 0.61 -2.05 -0.00 -1.92 0.35 115.58 112.57 2br8 h ASN 68 Ca 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.59 2br8 h ASN 68 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.60 2br8 h ASN 68 CO -0.00 0.10 -0.32 1.21 -0.00 0.00 0.00 177.43 178.42 2br8 n GLU 69 N -3.31 0.10 -2.81 6.67 4.07 0.20 -4.41 120.64 121.15 2br8 n GLU 69 Ca -0.00 -0.05 -0.14 0.00 -0.06 0.00 0.00 57.16 56.91 2br8 n GLU 69 Cb 0.31 -1.50 0.01 0.00 -0.06 0.00 0.00 31.44 30.19 2br8 n GLU 69 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2br8 n TYR 70 N -1.41 1.20 -2.60 4.31 4.01 -0.83 -4.99 117.16 116.84 2br8 n TYR 70 Ca 0.07 -3.17 -0.17 0.00 -0.16 0.00 0.00 57.90 54.47 2br8 n TYR 70 Cb 0.33 -0.37 -0.00 0.00 -0.31 0.00 0.00 39.34 38.99 2br8 n TYR 70 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2br8 n GLY 71 N -0.01 -0.50 2.29 2.72 0.00 -1.20 -2.36 105.19 106.13 2br8 n GLY 71 Ca 0.17 0.03 -0.13 0.00 0.00 0.00 0.00 46.02 46.09 2br8 n GLY 71 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2br8 n ASN 72 N -2.01 -4.20 -4.67 1.61 5.03 0.12 -5.01 115.26 106.13 2br8 n ASN 72 Ca -0.16 0.11 -0.43 0.00 0.87 0.00 0.00 54.58 54.97 2br8 n ASN 72 Cb 0.63 -3.19 -0.02 0.00 -1.02 0.00 0.00 39.78 36.18 2br8 n ASN 72 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2br8 s ILE 73 N -2.58 4.31 -0.10 2.41 1.01 -0.99 -4.91 121.20 120.35 2br8 s ILE 73 Ca 0.00 1.60 0.18 0.00 0.00 0.00 0.00 60.65 62.44 2br8 s ILE 73 Cb 0.00 -4.03 -0.27 0.00 0.01 0.00 0.00 42.46 38.16 2br8 s ILE 73 CO 0.00 -0.09 0.27 0.35 0.00 0.00 0.00 174.94 175.46 2br8 n THR 74 N 5.11 0.58 -3.70 2.92 -2.24 -1.26 -4.36 114.28 111.33 2br8 n THR 74 Ca 0.13 -0.61 -0.10 0.00 -2.27 0.00 0.00 64.05 61.20 2br8 n THR 74 Cb 0.45 -0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 68.43 2br8 n THR 74 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2br8 s ASP 75 N -4.74 -0.21 0.01 3.42 1.47 -1.26 -0.39 116.67 114.97 2br8 s ASP 75 Ca -0.08 -0.42 -0.16 0.00 1.18 0.00 0.00 52.55 53.07 2br8 s ASP 75 Cb 0.09 0.50 0.03 0.00 -0.34 0.00 0.00 42.92 43.20 2br8 s ASP 75 CO 0.80 -0.92 0.35 0.72 0.68 0.00 0.00 175.17 176.79 2br8 s PHE 76 N -3.84 -0.19 0.27 2.11 -0.12 -0.35 -5.00 117.98 110.85 2br8 s PHE 76 Ca 0.06 0.20 -0.15 0.00 -0.05 0.00 0.00 56.93 56.99 2br8 s PHE 76 Cb 0.01 0.13 -0.08 0.00 -0.63 0.00 0.00 43.02 42.45 2br8 s PHE 76 CO -0.08 -0.47 0.68 1.03 -0.05 0.00 0.00 175.22 176.33 2br8 s ARG 77 N -1.96 4.01 0.12 1.99 1.81 -1.26 -1.06 118.95 122.61 2br8 s ARG 77 Ca -0.09 0.62 -0.19 0.00 -1.72 0.00 0.00 55.73 54.35 2br8 s ARG 77 Cb -0.03 -2.61 0.05 0.00 -0.45 0.00 0.00 34.95 31.91 2br8 s ARG 77 CO 0.01 0.26 0.47 -0.08 -0.68 0.00 0.00 175.30 175.29 2br8 s THR 78 N -1.81 0.04 0.28 0.02 -1.32 -0.06 -4.98 115.64 107.82 2br8 s THR 78 Ca 0.49 -0.36 -0.30 0.00 -1.21 0.00 0.00 61.69 60.31 2br8 s THR 78 Cb -0.12 -1.09 -0.11 0.00 -1.51 0.00 0.00 72.50 69.68 2br8 s THR 78 CO 0.19 -0.20 1.48 -0.55 -2.21 0.00 0.00 174.62 173.33 2br8 s SER 79 N -2.66 6.55 0.66 8.08 0.15 -1.26 0.49 113.70 125.71 2br8 s SER 79 Ca 0.01 2.79 0.40 0.00 0.70 0.00 0.00 55.95 59.85 2br8 s SER 79 Cb 0.01 -2.63 2.18 0.00 -1.71 0.00 0.00 66.02 63.86 2br8 s SER 79 CO -0.11 -0.76 2.25 0.00 1.20 0.00 0.00 173.24 175.82 2br8 h ALA 80 N 4.63 1.16 0.00 5.45 0.00 -1.02 -0.84 119.26 128.64 2br8 h ALA 80 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2br8 h ALA 80 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2br8 h ALA 80 CO 0.76 -0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.91 2br8 h ALA 81 N 1.83 1.00 0.00 0.00 0.00 -1.90 -2.76 119.26 117.44 2br8 h ALA 81 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2br8 h ALA 81 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2br8 h ALA 81 CO -0.00 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.00 2br8 n ASP 82 N -2.33 0.63 -4.21 0.00 8.00 -0.32 -4.90 116.55 113.42 2br8 n ASP 82 Ca 0.03 0.57 -0.14 0.00 0.71 0.00 0.00 54.79 55.95 2br8 n ASP 82 Cb 0.28 -0.73 -0.10 0.00 -0.02 0.00 0.00 41.12 40.54 2br8 n ASP 82 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2br8 s ILE 83 N -3.10 1.06 0.28 0.53 -4.36 -1.04 -4.99 121.20 109.58 2br8 s ILE 83 Ca 0.11 -1.85 -0.30 0.00 -0.26 0.00 0.00 60.65 58.35 2br8 s ILE 83 Cb 0.13 -1.61 -0.10 0.00 1.25 0.00 0.00 42.46 42.13 2br8 s ILE 83 CO 0.56 -0.65 1.41 0.86 0.24 0.00 0.00 174.94 177.36 2br8 s TRP 84 N -2.89 2.99 0.07 1.37 -0.00 -1.26 -4.97 118.94 114.25 2br8 s TRP 84 Ca 0.11 1.14 0.06 0.00 -0.00 0.00 0.00 56.10 57.41 2br8 s TRP 84 Cb -0.00 -3.80 -0.03 0.00 -0.00 0.00 0.00 33.47 29.64 2br8 s TRP 84 CO 0.00 -2.48 -0.17 0.95 -0.00 0.00 0.00 176.95 175.25 2br8 s THR 85 N -0.38 1.34 0.64 5.86 -4.23 -1.26 -5.11 115.64 112.50 2br8 s THR 85 Ca 0.56 -1.27 -0.18 0.00 -1.18 0.00 0.00 61.69 59.62 2br8 s THR 85 Cb -0.42 -1.23 -0.02 0.00 1.34 0.00 0.00 72.50 72.18 2br8 s THR 85 CO 0.47 -0.07 1.27 -2.16 -0.54 0.00 0.00 174.62 173.59 2br8 s PRO 86 N -1.56 2.65 -0.67 3.99 0.04 -1.26 -4.94 135.00 133.25 2br8 s PRO 86 Ca 0.02 1.99 -0.02 0.00 0.04 0.00 0.00 61.00 63.03 2br8 s PRO 86 Cb -0.09 -1.87 0.30 0.00 0.04 0.00 0.00 34.50 32.88 2br8 s PRO 86 CO 0.02 -1.50 2.20 -0.40 0.04 0.00 0.00 177.00 177.36 2br8 n ASP 87 N -1.86 7.24 -4.66 6.66 5.75 -1.26 -4.96 116.55 123.47 2br8 n ASP 87 Ca 0.15 -3.61 -0.43 0.00 -0.01 0.00 0.00 54.79 50.89 2br8 n ASP 87 Cb 0.49 -1.08 -0.02 0.00 -1.03 0.00 0.00 41.12 39.47 2br8 n ASP 87 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2br8 s ILE 88 N -4.12 3.89 0.06 2.12 -1.09 -1.26 -1.25 121.20 119.55 2br8 s ILE 88 Ca 0.55 1.06 0.06 0.00 -2.23 0.00 0.00 60.65 60.09 2br8 s ILE 88 Cb 0.42 -3.72 -0.03 0.00 -1.58 0.00 0.00 42.46 37.56 2br8 s ILE 88 CO -0.24 -0.13 -0.17 -0.89 -1.23 0.00 0.00 174.94 172.28 2br8 s THR 89 N 3.98 1.37 0.06 2.92 2.01 0.13 -4.84 115.64 121.26 2br8 s THR 89 Ca 0.65 -1.23 -0.31 0.00 0.31 0.00 0.00 61.69 61.11 2br8 s THR 89 Cb -0.27 -1.24 -0.06 0.00 0.01 0.00 0.00 72.50 70.94 2br8 s THR 89 CO 0.23 -0.02 1.22 0.00 -0.69 0.00 0.00 174.62 175.36 2br8 s ALA 90 N -1.00 3.41 -0.36 7.40 0.00 -1.26 -0.72 121.76 129.24 2br8 s ALA 90 Ca 0.03 0.85 0.22 0.00 0.00 0.00 0.00 51.96 53.06 2br8 s ALA 90 Cb -0.09 -3.46 0.33 0.00 0.00 0.00 0.00 23.12 19.91 2br8 s ALA 90 CO 0.02 -0.47 1.60 1.88 0.00 0.00 0.00 175.76 178.78 2br8 h TYR 91 N 6.86 0.00 -0.53 0.00 0.05 -0.75 -3.35 116.97 119.25 2br8 h TYR 91 Ca -0.41 0.00 -0.37 0.00 0.05 0.00 0.00 58.73 58.00 2br8 h TYR 91 Cb 1.21 0.00 -0.39 0.00 1.01 0.00 0.00 36.73 38.56 2br8 h TYR 91 CO 0.67 0.10 -0.94 -1.13 -1.05 0.00 0.00 178.16 175.82 2br8 n SER 92 N -3.13 3.13 -4.70 3.88 3.41 -1.26 -5.04 113.62 109.91 2br8 n SER 92 Ca 0.03 -2.95 -0.30 0.00 -0.26 0.00 0.00 58.87 55.39 2br8 n SER 92 Cb 0.56 -0.41 0.14 0.00 -0.26 0.00 0.00 64.21 64.24 2br8 n SER 92 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2br8 s SER 93 N -3.58 3.45 0.00 4.04 1.04 -1.26 -2.40 113.70 115.00 2br8 s SER 93 Ca 0.39 1.74 0.00 0.00 0.48 0.00 0.00 55.95 58.56 2br8 s SER 93 Cb 0.37 -2.37 0.00 0.00 0.10 0.00 0.00 66.02 64.12 2br8 s SER 93 CO -0.01 -2.69 0.13 0.35 0.98 0.00 0.00 173.24 172.00 2br8 n THR 94 N -3.94 0.00 -3.77 2.02 -2.24 0.34 -4.81 114.28 101.88 2br8 n THR 94 Ca 0.08 -0.39 -0.11 0.00 -2.27 0.00 0.00 64.05 61.36 2br8 n THR 94 Cb 0.54 1.08 -0.07 0.00 -2.10 0.00 0.00 70.33 69.77 2br8 n THR 94 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2br8 s ARG 95 N -0.51 0.81 0.12 -0.78 0.52 -1.25 -5.02 118.95 112.83 2br8 s ARG 95 Ca 0.00 -0.58 -0.35 0.00 -0.52 0.00 0.00 55.73 54.27 2br8 s ARG 95 Cb 0.00 0.35 -0.15 0.00 0.52 0.00 0.00 34.95 35.67 2br8 s ARG 95 CO 0.00 -0.26 1.47 -2.30 0.02 0.00 0.00 175.30 174.23 2br8 n PRO 96 N 0.48 1.69 -1.77 3.54 -0.02 -1.26 -4.66 135.00 133.00 2br8 n PRO 96 Ca -0.18 0.61 -0.41 0.00 -2.02 0.00 0.00 63.50 61.50 2br8 n PRO 96 Cb 0.60 -2.32 0.01 0.00 -0.02 0.00 0.00 33.50 31.76 2br8 n PRO 96 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2br8 n VAL 97 N 3.03 2.30 -4.34 -1.45 3.14 -1.26 -4.87 118.33 114.88 2br8 n VAL 97 Ca 0.18 -0.50 -0.34 0.00 -2.96 0.00 0.00 64.34 60.72 2br8 n VAL 97 Cb 0.24 -1.92 -0.14 0.00 -1.06 0.00 0.00 33.84 30.96 2br8 n VAL 97 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2br8 s GLN 98 N -2.23 3.44 0.03 1.45 -0.21 -0.72 -4.98 119.66 116.43 2br8 s GLN 98 Ca 0.56 -0.63 -0.30 0.00 0.02 0.00 0.00 55.36 55.02 2br8 s GLN 98 Cb -0.47 -2.84 -0.04 0.00 1.00 0.00 0.00 33.01 30.66 2br8 s GLN 98 CO 0.61 0.05 0.96 0.08 -2.12 0.00 0.00 175.29 174.88 2br8 s VAL 99 N 0.81 4.77 -0.82 1.09 1.01 -1.26 -0.80 120.40 125.20 2br8 s VAL 99 Ca -0.03 2.03 0.09 0.00 0.00 0.00 0.00 61.98 64.08 2br8 s VAL 99 Cb -0.15 -4.31 -0.01 0.00 0.00 0.00 0.00 36.38 31.92 2br8 s VAL 99 CO 0.01 0.21 0.59 0.18 0.00 0.00 0.00 175.10 176.09 2br8 n LEU 100 N 3.57 1.13 -4.20 3.92 4.32 0.11 -4.95 117.00 120.90 2br8 n LEU 100 Ca 0.05 -0.76 -0.12 0.00 -0.02 0.00 0.00 56.01 55.16 2br8 n LEU 100 Cb 0.50 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.20 2br8 n LEU 100 CO 0.51 0.23 -0.31 -0.94 -1.22 0.00 0.00 177.39 175.66 2br8 s SER 101 N -1.30 0.78 0.58 -1.43 1.04 -1.24 -4.92 113.70 107.21 2br8 s SER 101 Ca 0.07 -1.19 -0.19 0.00 0.48 0.00 0.00 55.95 55.12 2br8 s SER 101 Cb 0.07 0.20 -0.05 0.00 0.10 0.00 0.00 66.02 66.35 2br8 s SER 101 CO 0.23 -0.64 1.07 -2.65 0.98 0.00 0.00 173.24 172.23 2br8 n PRO 102 N -0.17 1.10 -3.48 4.02 -0.02 -1.26 -4.85 135.00 130.35 2br8 n PRO 102 Ca -0.06 0.42 -0.41 0.00 -2.02 0.00 0.00 63.50 61.43 2br8 n PRO 102 Cb 0.63 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.81 2br8 n PRO 102 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2br8 s GLN 103 N -2.78 3.70 -0.04 -0.52 -0.21 -1.26 -4.82 119.66 113.74 2br8 s GLN 103 Ca 0.75 -3.15 0.03 0.00 0.02 0.00 0.00 55.36 53.01 2br8 s GLN 103 Cb -0.43 -4.26 0.00 0.00 1.00 0.00 0.00 33.01 29.32 2br8 s GLN 103 CO 0.48 -1.25 -0.11 0.42 -2.12 0.00 0.00 175.29 172.70 2br8 s ILE 104 N -1.12 0.98 0.31 1.08 1.01 -1.26 -0.37 121.20 121.83 2br8 s ILE 104 Ca 0.28 -0.45 0.09 0.00 0.00 0.00 0.00 60.65 60.57 2br8 s ILE 104 Cb -0.09 -0.87 -0.05 0.00 0.01 0.00 0.00 42.46 41.46 2br8 s ILE 104 CO -0.10 0.30 0.05 0.00 0.00 0.00 0.00 174.94 175.20 2br8 s ALA 105 N 0.28 3.29 -0.12 9.38 0.00 0.18 -4.54 121.76 130.23 2br8 s ALA 105 Ca -0.06 -1.80 -0.04 0.00 0.00 0.00 0.00 51.96 50.06 2br8 s ALA 105 Cb -0.11 -0.64 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 2br8 s ALA 105 CO 0.01 0.13 0.03 0.54 0.00 0.00 0.00 175.76 176.47 2br8 s VAL 106 N -2.42 4.50 -0.08 0.00 0.11 -0.34 -0.88 120.40 121.30 2br8 s VAL 106 Ca 0.35 -0.16 0.04 0.00 -2.93 0.00 0.00 61.98 59.28 2br8 s VAL 106 Cb -0.03 -2.94 -0.01 0.00 -1.53 0.00 0.00 36.38 31.88 2br8 s VAL 106 CO 0.21 0.57 -0.23 -0.69 -3.33 0.00 0.00 175.10 171.62 2br8 s VAL 107 N -0.54 2.17 0.20 2.04 1.01 -0.22 -1.67 120.40 123.39 2br8 s VAL 107 Ca 0.10 -1.00 0.08 0.00 0.00 0.00 0.00 61.98 61.15 2br8 s VAL 107 Cb -0.12 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 2br8 s VAL 107 CO 0.02 0.56 0.04 -0.89 0.00 0.00 0.00 175.10 174.83 2br8 s THR 108 N 0.11 3.83 0.58 3.92 2.01 -0.29 -1.22 115.64 124.58 2br8 s THR 108 Ca -0.11 -1.50 0.27 0.00 0.31 0.00 0.00 61.69 60.66 2br8 s THR 108 Cb -0.16 -2.97 0.34 0.00 0.01 0.00 0.00 72.50 69.72 2br8 s THR 108 CO 0.06 -0.20 2.20 1.12 -0.69 0.00 0.00 174.62 177.11 2br8 h HIS 109 N 2.33 0.00 0.00 4.92 2.07 -1.03 0.27 115.15 123.71 2br8 h HIS 109 Ca -0.47 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 2br8 h HIS 109 Cb 1.22 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.20 2br8 h HIS 109 CO 0.62 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.08 2br8 n ASP 110 N -3.96 0.00 0.00 3.10 5.75 -1.26 -1.00 116.55 119.19 2br8 n ASP 110 Ca -0.02 -0.73 0.00 0.00 -0.01 0.00 0.00 54.79 54.03 2br8 n ASP 110 Cb 0.15 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 2br8 n ASP 110 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2br8 n GLY 111 N 0.83 0.75 3.78 6.12 0.00 0.95 -4.66 105.19 112.96 2br8 n GLY 111 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 2br8 n GLY 111 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2br8 s SER 112 N -2.46 6.82 -0.01 1.61 1.04 -1.23 -0.67 113.70 118.80 2br8 s SER 112 Ca 0.00 2.03 0.04 0.00 0.48 0.00 0.00 55.95 58.50 2br8 s SER 112 Cb 0.00 -2.59 -0.01 0.00 0.10 0.00 0.00 66.02 63.52 2br8 s SER 112 CO 0.00 -0.45 -0.13 -0.69 0.98 0.00 0.00 173.24 172.95 2br8 s VAL 113 N -1.64 1.04 -0.04 5.02 1.01 0.85 -1.14 120.40 125.51 2br8 s VAL 113 Ca 0.57 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.99 2br8 s VAL 113 Cb -0.22 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.30 2br8 s VAL 113 CO 0.28 0.28 -0.10 -0.32 0.00 0.00 0.00 175.10 175.24 2br8 s MET 114 N -0.34 1.20 -0.04 2.72 0.00 -0.67 -2.62 119.30 119.54 2br8 s MET 114 Ca 0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 55.69 55.40 2br8 s MET 114 Cb -0.05 -1.07 0.03 0.00 0.00 0.00 0.00 34.83 33.73 2br8 s MET 114 CO -0.00 0.08 0.03 0.12 0.00 0.00 0.00 175.02 175.25 2br8 s PHE 115 N 0.40 0.18 -0.57 4.11 5.36 -0.67 -1.19 117.98 125.60 2br8 s PHE 115 Ca -0.07 0.12 0.05 0.00 -0.96 0.00 0.00 56.93 56.07 2br8 s PHE 115 Cb -0.12 -0.45 0.19 0.00 -0.34 0.00 0.00 43.02 42.30 2br8 s PHE 115 CO 0.01 -0.17 0.48 -0.89 -1.46 0.00 0.00 175.22 173.19 2br8 n ILE 116 N 4.80 0.58 -2.63 3.12 5.41 -1.26 -0.99 119.36 128.39 2br8 n ILE 116 Ca -0.14 -4.36 -0.42 0.00 1.00 0.00 0.00 62.75 58.83 2br8 n ILE 116 Cb 0.50 -1.98 -0.03 0.00 -0.71 0.00 0.00 39.64 37.42 2br8 n ILE 116 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2br8 s PRO 117 N -1.07 4.57 0.19 0.38 0.04 -1.21 -4.75 135.00 133.15 2br8 s PRO 117 Ca 0.30 1.54 -0.28 0.00 0.04 0.00 0.00 61.00 62.60 2br8 s PRO 117 Cb 0.03 -3.39 -0.08 0.00 0.04 0.00 0.00 34.50 31.10 2br8 s PRO 117 CO -0.15 -0.01 0.89 0.00 0.04 0.00 0.00 177.00 177.77 2br8 s ALA 118 N 0.60 3.35 -0.02 8.56 0.00 -1.26 -1.22 121.76 131.77 2br8 s ALA 118 Ca 0.52 0.53 -0.09 0.00 0.00 0.00 0.00 51.96 52.92 2br8 s ALA 118 Cb -0.24 -3.14 0.01 0.00 0.00 0.00 0.00 23.12 19.74 2br8 s ALA 118 CO 0.30 0.18 0.19 -0.65 0.00 0.00 0.00 175.76 175.77 2br8 s GLN 119 N -0.91 0.48 -0.21 0.00 -0.21 -0.39 0.07 119.66 118.49 2br8 s GLN 119 Ca 0.40 -0.23 -0.05 0.00 0.02 0.00 0.00 55.36 55.50 2br8 s GLN 119 Cb -0.24 0.20 -0.02 0.00 1.00 0.00 0.00 33.01 33.95 2br8 s GLN 119 CO 0.30 -0.11 0.01 0.50 -2.12 0.00 0.00 175.29 173.86 2br8 s ARG 120 N -1.09 3.59 -0.10 2.91 3.52 0.02 -1.95 118.95 125.85 2br8 s ARG 120 Ca -0.12 -0.52 0.03 0.00 -0.13 0.00 0.00 55.73 54.99 2br8 s ARG 120 Cb -0.06 -3.12 -0.01 0.00 -1.56 0.00 0.00 34.95 30.20 2br8 s ARG 120 CO 0.02 -0.06 -0.20 -1.17 -0.81 0.00 0.00 175.30 173.08 2br8 s LEU 121 N 1.20 2.35 -0.18 -0.88 2.96 0.40 -1.75 118.68 122.78 2br8 s LEU 121 Ca 0.03 -0.45 -0.09 0.00 -0.22 0.00 0.00 54.13 53.41 2br8 s LEU 121 Cb -0.15 -1.48 -0.05 0.00 0.50 0.00 0.00 46.19 45.02 2br8 s LEU 121 CO 0.01 0.19 0.11 -0.44 -1.32 0.00 0.00 176.35 174.90 2br8 s SER 122 N 0.19 6.08 0.28 3.68 0.01 -1.26 -0.08 113.70 122.60 2br8 s SER 122 Ca -0.12 0.24 -0.06 0.00 1.31 0.00 0.00 55.95 57.32 2br8 s SER 122 Cb -0.16 -2.04 -0.01 0.00 0.21 0.00 0.00 66.02 64.02 2br8 s SER 122 CO 0.06 0.23 0.41 0.72 0.41 0.00 0.00 173.24 175.07 2br8 s PHE 123 N 0.06 0.83 -0.33 2.43 -0.12 -1.13 -0.51 117.98 119.22 2br8 s PHE 123 Ca 0.08 -1.10 -0.28 0.00 -0.05 0.00 0.00 56.93 55.58 2br8 s PHE 123 Cb -0.11 -0.07 0.01 0.00 -0.63 0.00 0.00 43.02 42.21 2br8 s PHE 123 CO -0.00 -0.99 1.01 -1.64 -0.05 0.00 0.00 175.22 173.54 2br8 s MET 124 N -3.61 4.00 -0.30 1.99 -1.94 -1.01 -2.56 119.30 115.88 2br8 s MET 124 Ca 0.29 0.90 -0.12 0.00 -1.71 0.00 0.00 55.69 55.06 2br8 s MET 124 Cb 0.01 -3.75 0.12 0.00 2.01 0.00 0.00 34.83 33.22 2br8 s MET 124 CO 0.15 -0.89 0.66 0.00 -0.01 0.00 0.00 175.02 174.94 2br8 s ASP 126 N 2.59 6.75 0.00 0.00 -1.08 -1.26 -3.34 116.67 120.33 2br8 s ASP 126 Ca -0.07 0.71 0.29 0.00 -0.52 0.00 0.00 52.55 52.95 2br8 s ASP 126 Cb -0.10 -2.50 1.20 0.00 -1.46 0.00 0.00 42.92 40.06 2br8 s ASP 126 CO -0.19 -0.91 1.83 -0.81 0.52 0.00 0.00 175.17 175.61 2br8 n PRO 127 N 6.92 1.25 -1.71 4.34 -0.04 -1.26 -4.87 135.00 139.64 2br8 n PRO 127 Ca 0.09 -0.59 -0.56 0.00 -0.04 0.00 0.00 63.50 62.40 2br8 n PRO 127 Cb 0.48 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 32.38 2br8 n PRO 127 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2br8 n THR 128 N -0.36 0.33 0.00 0.52 -1.04 -1.26 -0.81 114.28 111.67 2br8 n THR 128 Ca 0.18 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 2br8 n THR 128 Cb 0.29 -1.29 0.00 0.00 -1.82 0.00 0.00 70.33 67.51 2br8 n THR 128 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2br8 n GLY 129 N 4.19 0.81 0.24 3.41 0.00 -1.26 -4.85 105.19 107.74 2br8 n GLY 129 Ca 0.26 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.44 2br8 n GLY 129 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2br8 h VAL 130 N 0.00 0.00 0.00 1.61 3.04 -1.22 -2.98 116.25 116.70 2br8 h VAL 130 Ca 0.00 -0.51 0.00 0.00 -1.01 0.00 0.00 66.70 65.18 2br8 h VAL 130 Cb 0.00 1.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.75 2br8 h VAL 130 CO 0.00 0.00 -0.42 0.44 -1.01 0.00 0.00 177.57 176.58 2br8 h ASP 131 N 0.00 0.00 -3.37 3.17 3.32 -1.93 -0.58 116.42 117.02 2br8 h ASP 131 Ca 0.00 -0.03 -0.34 0.00 0.02 0.00 0.00 57.03 56.67 2br8 h ASP 131 Cb 0.55 0.00 0.15 0.00 0.22 0.00 0.00 39.33 40.25 2br8 h ASP 131 CO 0.00 0.02 0.27 -1.54 -1.72 0.00 0.00 179.24 176.27 2br8 n SER 132 N -2.71 -0.48 0.14 6.45 3.41 -1.13 -4.85 113.62 114.45 2br8 n SER 132 Ca 0.03 -1.29 0.08 0.00 -0.26 0.00 0.00 58.87 57.42 2br8 n SER 132 Cb 0.51 -0.83 0.05 0.00 -0.26 0.00 0.00 64.21 63.68 2br8 n SER 132 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2br8 h GLU 133 N 0.00 0.00 0.00 4.33 4.81 -1.91 -3.28 114.58 118.53 2br8 h GLU 133 Ca -0.35 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 58.73 2br8 h GLU 133 Cb 0.99 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 2br8 h GLU 133 CO 0.24 0.15 -0.78 0.93 -0.73 0.00 0.00 179.01 178.83 2br8 h GLU 134 N 0.00 0.00 0.00 1.92 3.07 -1.94 -3.50 114.58 114.13 2br8 h GLU 134 Ca -0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 2br8 h GLU 134 Cb 1.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.09 2br8 h GLU 134 CO 0.02 0.70 0.00 0.41 -1.40 0.00 0.00 179.01 178.74 2br8 n GLY 135 N 1.29 0.15 3.03 -3.84 0.00 -1.22 -4.82 105.19 99.79 2br8 n GLY 135 Ca 0.00 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.93 2br8 n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2br8 s VAL 136 N 0.00 0.39 -0.13 1.61 0.11 0.40 -4.58 120.40 118.20 2br8 s VAL 136 Ca 0.00 -1.01 -0.04 0.00 -2.93 0.00 0.00 61.98 58.00 2br8 s VAL 136 Cb 0.00 -0.48 -0.03 0.00 -1.53 0.00 0.00 36.38 34.33 2br8 s VAL 136 CO 0.00 -0.42 0.02 -0.89 -3.33 0.00 0.00 175.10 170.48 2br8 s THR 137 N -1.39 4.41 0.05 5.04 2.01 -1.26 -0.69 115.64 123.81 2br8 s THR 137 Ca -0.12 -0.19 0.04 0.00 0.31 0.00 0.00 61.69 61.73 2br8 s THR 137 Cb -0.10 -2.91 -0.02 0.00 0.01 0.00 0.00 72.50 69.48 2br8 s THR 137 CO -0.00 0.54 -0.11 0.00 -0.69 0.00 0.00 174.62 174.37 2br8 s ALA 139 N -1.17 0.49 -0.03 0.00 0.00 -1.26 -0.30 121.76 119.48 2br8 s ALA 139 Ca -0.05 -0.38 -0.01 0.00 0.00 0.00 0.00 51.96 51.52 2br8 s ALA 139 Cb -0.09 -0.07 0.03 0.00 0.00 0.00 0.00 23.12 22.99 2br8 s ALA 139 CO 0.01 0.08 0.03 0.54 0.00 0.00 0.00 175.76 176.41 2br8 s VAL 140 N -0.48 0.05 -0.01 0.00 0.11 -0.35 -4.90 120.40 114.82 2br8 s VAL 140 Ca -0.01 0.22 -0.22 0.00 -2.93 0.00 0.00 61.98 59.04 2br8 s VAL 140 Cb -0.04 -0.21 -0.05 0.00 -1.53 0.00 0.00 36.38 34.55 2br8 s VAL 140 CO -0.00 0.15 0.66 -0.54 -3.33 0.00 0.00 175.10 172.04 2br8 s LYS 141 N 1.45 4.39 -0.01 1.54 1.02 -1.26 -1.53 119.74 125.34 2br8 s LYS 141 Ca -0.04 0.85 0.04 0.00 0.02 0.00 0.00 55.97 56.83 2br8 s LYS 141 Cb -0.13 -3.37 -0.03 0.00 -0.52 0.00 0.00 37.83 33.78 2br8 s LYS 141 CO -0.03 0.28 -0.10 -0.06 -0.92 0.00 0.00 175.35 174.52 2br8 s PHE 142 N 0.06 2.81 -0.02 3.18 0.08 0.09 0.05 117.98 124.24 2br8 s PHE 142 Ca 0.34 -0.08 -0.30 0.00 0.12 0.00 0.00 56.93 57.00 2br8 s PHE 142 Cb -0.19 -1.60 0.12 0.00 -0.57 0.00 0.00 43.02 40.78 2br8 s PHE 142 CO 0.19 0.32 1.25 0.20 -0.10 0.00 0.00 175.22 177.08 2br8 s GLY 143 N -1.26 -0.39 0.32 4.36 0.00 0.11 -1.63 107.32 108.83 2br8 s GLY 143 Ca 0.15 0.73 -0.29 0.00 0.00 0.00 0.00 44.72 45.31 2br8 s GLY 143 CO 0.05 0.15 1.40 -1.26 0.00 0.00 0.00 173.10 173.44 2br8 n SER 144 N -0.45 3.12 0.10 1.64 2.88 -1.26 0.18 113.62 119.83 2br8 n SER 144 Ca -0.08 1.19 -0.05 0.00 -1.33 0.00 0.00 58.87 58.60 2br8 n SER 144 Cb 0.62 -1.51 0.10 0.00 -0.75 0.00 0.00 64.21 62.67 2br8 n SER 144 CO 0.00 0.00 0.00 -0.25 -1.23 0.00 0.00 175.04 173.56 2br8 h TRP 145 N 3.32 0.22 0.00 0.66 2.91 -1.53 -3.41 115.95 118.12 2br8 h TRP 145 Ca -0.47 -0.09 0.00 0.00 1.13 0.00 0.00 58.89 59.46 2br8 h TRP 145 Cb 1.26 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 29.88 2br8 h TRP 145 CO 0.53 0.78 -0.94 1.33 -1.03 0.00 0.00 178.44 179.12 2br8 n VAL 146 N -3.80 0.00 -3.38 2.65 0.24 -1.26 -5.07 118.33 107.72 2br8 n VAL 146 Ca -0.02 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.90 2br8 n VAL 146 Cb 0.66 0.04 -0.06 0.00 -1.47 0.00 0.00 33.84 33.01 2br8 n VAL 146 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2br8 s TYR 147 N -1.90 3.62 0.94 6.34 2.02 -1.26 -5.09 117.35 122.02 2br8 s TYR 147 Ca 0.00 0.96 -0.15 0.00 -0.37 0.00 0.00 57.07 57.51 2br8 s TYR 147 Cb 0.00 -2.45 0.19 0.00 -0.40 0.00 0.00 41.96 39.29 2br8 s TYR 147 CO 0.00 0.38 1.30 -1.54 -1.57 0.00 0.00 175.55 174.12 2br8 s SER 148 N -0.14 3.28 0.54 2.29 1.04 -1.26 -4.66 113.70 114.79 2br8 s SER 148 Ca 0.25 0.30 0.21 0.00 0.48 0.00 0.00 55.95 57.19 2br8 s SER 148 Cb -0.16 -0.39 1.39 0.00 0.10 0.00 0.00 66.02 66.95 2br8 s SER 148 CO 0.12 -2.63 2.11 1.23 0.98 0.00 0.00 173.24 175.05 2br8 h GLY 149 N -1.55 0.00 2.00 7.32 0.00 -0.57 -0.04 103.07 110.23 2br8 h GLY 149 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2br8 h GLY 149 CO 0.41 0.00 0.00 0.74 0.00 0.00 0.00 176.54 177.69 2br8 h PHE 150 N 0.00 0.00 0.00 5.60 0.04 -1.94 -3.36 116.94 117.29 2br8 h PHE 150 Ca 0.08 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.75 2br8 h PHE 150 Cb 0.33 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.46 2br8 h PHE 150 CO 0.00 0.00 -1.36 0.39 -0.60 0.00 0.00 178.31 176.74 2br8 n GLU 151 N -2.30 0.14 -4.20 1.51 1.02 -0.51 -4.27 120.64 112.04 2br8 n GLU 151 Ca 0.03 0.05 -0.33 0.00 -0.02 0.00 0.00 57.16 56.89 2br8 n GLU 151 Cb 0.27 -0.87 -0.16 0.00 -0.02 0.00 0.00 31.44 30.65 2br8 n GLU 151 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2br8 s ILE 152 N -2.12 2.07 -0.27 -3.67 1.01 -0.15 -0.87 121.20 117.21 2br8 s ILE 152 Ca -0.09 -0.94 -0.16 0.00 0.00 0.00 0.00 60.65 59.46 2br8 s ILE 152 Cb 0.03 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 2br8 s ILE 152 CO 0.12 0.54 0.44 -0.62 0.00 0.00 0.00 174.94 175.43 2br8 s ASP 153 N 1.22 6.33 -0.06 3.58 2.15 0.95 -4.05 116.67 126.79 2br8 s ASP 153 Ca 0.03 0.34 -0.11 0.00 0.43 0.00 0.00 52.55 53.24 2br8 s ASP 153 Cb -0.13 -2.24 -0.05 0.00 -0.30 0.00 0.00 42.92 40.19 2br8 s ASP 153 CO -0.11 -0.25 0.28 -0.22 -0.17 0.00 0.00 175.17 174.69 2br8 s LEU 154 N 2.19 4.42 0.09 -1.34 2.96 -1.26 -1.04 118.68 124.70 2br8 s LEU 154 Ca 0.18 0.72 -0.10 0.00 -0.22 0.00 0.00 54.13 54.71 2br8 s LEU 154 Cb -0.16 -2.34 0.00 0.00 0.50 0.00 0.00 46.19 44.19 2br8 s LEU 154 CO 0.10 0.35 0.21 -0.75 -1.32 0.00 0.00 176.35 174.94 2br8 s LYS 155 N -0.95 0.85 0.15 1.98 2.20 0.12 -4.94 119.74 119.15 2br8 s LYS 155 Ca 0.19 -0.90 0.02 0.00 -0.36 0.00 0.00 55.97 54.93 2br8 s LYS 155 Cb -0.14 0.35 -0.05 0.00 -1.51 0.00 0.00 37.83 36.48 2br8 s LYS 155 CO 0.09 -0.27 -0.03 0.95 -0.36 0.00 0.00 175.35 175.72 2br8 s THR 156 N -3.71 0.77 -0.08 3.43 -4.23 -1.26 0.12 115.64 110.68 2br8 s THR 156 Ca 0.04 -1.98 0.21 0.00 -1.18 0.00 0.00 61.69 58.77 2br8 s THR 156 Cb 0.04 -1.99 -0.30 0.00 1.34 0.00 0.00 72.50 71.59 2br8 s THR 156 CO -0.10 -0.60 0.41 0.47 -0.54 0.00 0.00 174.62 174.26 2br8 n ASP 157 N -0.20 0.05 -3.76 3.99 8.00 -1.26 -4.97 116.55 118.41 2br8 n ASP 157 Ca -0.08 0.02 -0.13 0.00 0.71 0.00 0.00 54.79 55.31 2br8 n ASP 157 Cb 0.62 1.65 -0.09 0.00 -0.02 0.00 0.00 41.12 43.29 2br8 n ASP 157 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2br8 s THR 158 N -3.25 0.05 -2.01 -3.53 -1.32 -1.26 -5.02 115.64 99.30 2br8 s THR 158 Ca -0.08 -0.43 0.08 0.00 -1.21 0.00 0.00 61.69 60.05 2br8 s THR 158 Cb 0.12 -0.61 0.23 0.00 -1.51 0.00 0.00 72.50 70.73 2br8 s THR 158 CO 0.88 -0.24 1.20 -0.90 -2.21 0.00 0.00 174.62 173.36 2br8 n ASP 159 N 1.39 1.34 -4.33 8.08 5.75 -1.26 -4.76 116.55 122.76 2br8 n ASP 159 Ca -0.21 -1.98 -0.37 0.00 -0.01 0.00 0.00 54.79 52.22 2br8 n ASP 159 Cb 0.56 -0.16 -0.13 0.00 -1.03 0.00 0.00 41.12 40.36 2br8 n ASP 159 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2br8 s GLN 160 N -1.67 3.07 0.17 0.11 -1.52 -1.26 -1.14 119.66 117.41 2br8 s GLN 160 Ca 0.18 -0.87 -0.32 0.00 -1.95 0.00 0.00 55.36 52.40 2br8 s GLN 160 Cb 0.09 -3.35 -0.11 0.00 -0.22 0.00 0.00 33.01 29.42 2br8 s GLN 160 CO 0.12 -0.44 1.76 0.08 -0.25 0.00 0.00 175.29 176.56 2br8 s VAL 161 N 1.49 2.29 0.02 1.09 1.01 -0.78 -4.86 120.40 120.66 2br8 s VAL 161 Ca 0.02 0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 2br8 s VAL 161 Cb -0.17 -3.04 -0.08 0.00 0.00 0.00 0.00 36.38 33.09 2br8 s VAL 161 CO 0.02 0.00 1.90 -0.62 0.00 0.00 0.00 175.10 176.40 2br8 s ASP 162 N 1.88 6.49 0.00 3.32 -1.08 -0.91 -4.87 116.67 121.50 2br8 s ASP 162 Ca 0.77 2.58 0.00 0.00 -0.52 0.00 0.00 52.55 55.39 2br8 s ASP 162 Cb -0.48 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.45 2br8 s ASP 162 CO 0.34 -1.03 0.77 0.18 0.52 0.00 0.00 175.17 175.95 2br8 n LEU 163 N 7.39 1.45 0.22 -1.34 4.77 -1.26 -2.39 117.00 125.84 2br8 n LEU 163 Ca 0.19 -1.45 0.15 0.00 -0.03 0.00 0.00 56.01 54.88 2br8 n LEU 163 Cb 0.41 0.00 0.73 0.00 -2.33 0.00 0.00 43.42 42.23 2br8 n LEU 163 CO 0.67 0.36 0.95 0.77 -1.33 0.00 0.00 177.39 178.81 2br8 h SER 164 N 0.00 0.00 0.00 -1.43 4.64 -1.89 -2.17 113.55 112.70 2br8 h SER 164 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2br8 h SER 164 Cb 0.41 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 2br8 h SER 164 CO 0.00 0.00 -0.21 -1.54 -0.87 0.00 0.00 176.83 174.21 2br8 n SER 165 N -2.62 1.78 -4.74 4.97 3.41 -1.26 -5.04 113.62 110.12 2br8 n SER 165 Ca -0.00 -2.97 -0.41 0.00 -0.26 0.00 0.00 58.87 55.22 2br8 n SER 165 Cb 0.16 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 2br8 n SER 165 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2br8 n TYR 166 N -1.05 2.64 -1.93 7.33 9.36 -0.82 -4.72 117.16 127.97 2br8 n TYR 166 Ca 0.13 0.49 -0.43 0.00 3.32 0.00 0.00 57.90 61.41 2br8 n TYR 166 Cb 0.68 -2.47 -0.03 0.00 -0.63 0.00 0.00 39.34 36.89 2br8 n TYR 166 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 2br8 s TYR 167 N -1.13 1.76 -0.72 2.98 5.04 0.24 -4.87 117.35 120.66 2br8 s TYR 167 Ca 0.56 0.34 0.17 0.00 -2.44 0.00 0.00 57.07 55.69 2br8 s TYR 167 Cb -0.51 -4.02 0.74 0.00 0.35 0.00 0.00 41.96 38.52 2br8 s TYR 167 CO 0.62 -3.69 1.52 0.00 -1.34 0.00 0.00 175.55 172.66 2br8 n ALA 168 N 8.84 1.50 -0.37 3.97 0.00 -1.26 -2.13 120.51 131.06 2br8 n ALA 168 Ca 0.21 0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.73 2br8 n ALA 168 Cb 0.44 -1.27 0.08 0.00 0.00 0.00 0.00 19.45 18.71 2br8 n ALA 168 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2br8 n SER 169 N -1.86 2.41 -4.52 0.00 7.64 -1.26 -5.05 113.62 110.98 2br8 n SER 169 Ca 0.02 -2.35 -0.40 0.00 1.01 0.00 0.00 58.87 57.15 2br8 n SER 169 Cb 0.15 -0.19 0.02 0.00 -1.01 0.00 0.00 64.21 63.18 2br8 n SER 169 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2br8 n SER 170 N -0.55 -0.07 0.16 6.43 2.88 -0.90 -4.87 113.62 116.69 2br8 n SER 170 Ca 0.08 0.90 0.13 0.00 -1.33 0.00 0.00 58.87 58.64 2br8 n SER 170 Cb 0.43 -1.23 0.66 0.00 -0.75 0.00 0.00 64.21 63.32 2br8 n SER 170 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2br8 h LYS 171 N 0.86 0.01 -6.41 -1.46 1.79 -1.92 -3.44 116.57 106.01 2br8 h LYS 171 Ca -0.44 -0.00 -0.63 0.00 -2.18 0.00 0.00 60.65 57.41 2br8 h LYS 171 Cb 1.38 -0.00 -0.13 0.00 -1.58 0.00 0.00 32.23 31.90 2br8 h LYS 171 CO 0.52 0.00 -0.69 0.71 -1.08 0.00 0.00 179.45 178.92 2br8 s TYR 172 N -5.05 2.81 -0.02 -1.35 2.02 -1.26 -0.29 117.35 114.20 2br8 s TYR 172 Ca -0.05 -0.14 0.08 0.00 -0.37 0.00 0.00 57.07 56.59 2br8 s TYR 172 Cb 0.18 -1.40 -0.02 0.00 -0.40 0.00 0.00 41.96 40.32 2br8 s TYR 172 CO 0.69 0.49 -0.26 -2.00 -1.57 0.00 0.00 175.55 172.91 2br8 s GLU 173 N -2.67 2.12 -0.20 -0.62 2.12 0.16 -4.82 118.70 114.79 2br8 s GLU 173 Ca 0.25 -0.92 -0.16 0.00 0.36 0.00 0.00 54.97 54.50 2br8 s GLU 173 Cb -0.10 -2.03 -0.04 0.00 0.26 0.00 0.00 34.13 32.22 2br8 s GLU 173 CO 0.17 0.54 0.42 0.42 -0.54 0.00 0.00 175.26 176.27 2br8 s ILE 174 N -0.57 5.18 -0.21 -3.70 -1.09 -1.26 -1.82 121.20 117.72 2br8 s ILE 174 Ca 0.09 0.76 -0.15 0.00 -2.23 0.00 0.00 60.65 59.12 2br8 s ILE 174 Cb -0.10 -3.75 -0.19 0.00 -1.58 0.00 0.00 42.46 36.84 2br8 s ILE 174 CO -0.01 0.24 0.08 0.18 -1.23 0.00 0.00 174.94 174.20 2br8 n LEU 175 N 4.53 2.14 -3.69 2.97 4.77 0.50 -4.99 117.00 123.22 2br8 n LEU 175 Ca -0.08 0.31 -0.14 0.00 -0.03 0.00 0.00 56.01 56.08 2br8 n LEU 175 Cb 0.51 -0.96 -0.08 0.00 -2.33 0.00 0.00 43.42 40.56 2br8 n LEU 175 CO 0.40 0.52 0.13 -0.94 -1.33 0.00 0.00 177.39 176.17 2br8 s SER 176 N -7.02 -0.29 -0.10 -1.43 1.04 -0.86 -4.98 113.70 100.07 2br8 s SER 176 Ca -0.30 0.16 -0.04 0.00 0.48 0.00 0.00 55.95 56.25 2br8 s SER 176 Cb 0.08 0.38 0.05 0.00 0.10 0.00 0.00 66.02 66.64 2br8 s SER 176 CO 0.61 -0.54 0.20 0.00 0.98 0.00 0.00 173.24 174.49 2br8 s ALA 177 N -1.64 -0.33 0.00 5.32 0.00 -1.26 -0.73 121.76 123.12 2br8 s ALA 177 Ca -0.11 0.72 0.02 0.00 0.00 0.00 0.00 51.96 52.60 2br8 s ALA 177 Cb -0.03 -0.89 -0.01 0.00 0.00 0.00 0.00 23.12 22.19 2br8 s ALA 177 CO 0.03 -0.58 -0.08 0.99 0.00 0.00 0.00 175.76 176.12 2br8 s THR 178 N 2.31 0.59 -0.21 0.00 2.01 -0.47 -1.86 115.64 118.01 2br8 s THR 178 Ca 0.02 -0.44 -0.01 0.00 0.31 0.00 0.00 61.69 61.57 2br8 s THR 178 Cb -0.12 -0.52 0.06 0.00 0.01 0.00 0.00 72.50 71.93 2br8 s THR 178 CO -0.07 0.08 -0.00 0.00 -0.69 0.00 0.00 174.62 173.94 2br8 s GLN 179 N -0.40 1.03 -0.08 4.92 -2.07 -0.29 -1.17 119.66 121.60 2br8 s GLN 179 Ca 0.01 -0.62 0.02 0.00 -1.82 0.00 0.00 55.36 52.95 2br8 s GLN 179 Cb -0.04 -2.26 0.01 0.00 -1.09 0.00 0.00 33.01 29.63 2br8 s GLN 179 CO -0.00 -0.61 -0.15 0.99 -1.32 0.00 0.00 175.29 174.20 2br8 s THR 180 N 1.69 1.38 -0.06 3.63 2.01 -0.42 -4.13 115.64 119.73 2br8 s THR 180 Ca -0.03 -0.60 -0.29 0.00 0.31 0.00 0.00 61.69 61.08 2br8 s THR 180 Cb -0.18 -1.25 -0.02 0.00 0.01 0.00 0.00 72.50 71.06 2br8 s THR 180 CO -0.07 0.41 0.97 -0.60 -0.69 0.00 0.00 174.62 174.64 2br8 s ARG 181 N 0.74 4.47 0.00 4.92 3.52 -1.26 -0.84 118.95 130.51 2br8 s ARG 181 Ca -0.12 1.35 0.08 0.00 -0.13 0.00 0.00 55.73 56.91 2br8 s ARG 181 Cb -0.16 -3.50 -0.02 0.00 -1.56 0.00 0.00 34.95 29.70 2br8 s ARG 181 CO 0.03 -0.18 -0.25 -0.65 -0.81 0.00 0.00 175.30 173.43 2br8 s GLN 182 N 1.54 1.94 -0.09 5.12 -0.21 0.77 -4.99 119.66 123.74 2br8 s GLN 182 Ca 0.49 -0.97 0.04 0.00 0.02 0.00 0.00 55.36 54.94 2br8 s GLN 182 Cb -0.19 -1.96 -0.00 0.00 1.00 0.00 0.00 33.01 31.86 2br8 s GLN 182 CO 0.22 0.53 -0.24 0.08 -2.12 0.00 0.00 175.29 173.76 2br8 s VAL 183 N -0.66 2.12 0.06 1.09 1.01 -1.26 -1.77 120.40 120.99 2br8 s VAL 183 Ca 0.10 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.09 2br8 s VAL 183 Cb -0.10 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 2br8 s VAL 183 CO 0.00 0.56 -0.07 0.00 0.00 0.00 0.00 175.10 175.59 2br8 s GLN 184 N 0.22 0.62 0.13 2.72 -2.07 0.04 -4.97 119.66 116.34 2br8 s GLN 184 Ca -0.15 -0.97 0.09 0.00 -1.82 0.00 0.00 55.36 52.51 2br8 s GLN 184 Cb -0.17 -0.19 -0.04 0.00 -1.09 0.00 0.00 33.01 31.52 2br8 s GLN 184 CO 0.08 0.01 -0.17 -1.01 -1.32 0.00 0.00 175.29 172.87 2br8 s HIS 185 N -2.33 2.54 0.12 9.60 3.76 -1.26 -0.71 115.29 127.01 2br8 s HIS 185 Ca -0.02 -0.26 0.04 0.00 -0.15 0.00 0.00 55.06 54.67 2br8 s HIS 185 Cb -0.04 -1.33 -0.04 0.00 1.11 0.00 0.00 32.58 32.28 2br8 s HIS 185 CO -0.02 0.40 0.11 0.71 -0.85 0.00 0.00 174.74 175.10 2br8 s TYR 186 N -1.22 3.19 0.37 1.40 2.02 -1.26 -5.02 117.35 116.83 2br8 s TYR 186 Ca 0.19 0.04 0.10 0.00 -0.37 0.00 0.00 57.07 57.04 2br8 s TYR 186 Cb -0.10 -1.58 0.87 0.00 -0.40 0.00 0.00 41.96 40.75 2br8 s TYR 186 CO 0.11 0.52 1.87 0.77 -1.57 0.00 0.00 175.55 177.25 2br8 h SER 187 N 2.87 0.60 1.02 2.29 0.02 -2.01 -2.60 113.55 115.74 2br8 h SER 187 Ca -0.47 0.04 -0.11 0.00 -0.84 0.00 0.00 61.79 60.41 2br8 h SER 187 Cb 1.18 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.63 2br8 h SER 187 CO 0.65 0.30 -0.53 0.00 -1.14 0.00 0.00 176.83 176.11 2br8 h PRO 190 N 6.43 0.00 -6.77 0.00 0.13 -1.91 -3.38 132.00 126.50 2br8 h PRO 190 Ca -0.33 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.32 2br8 h PRO 190 Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 2br8 h PRO 190 CO 0.49 0.30 0.26 -1.83 -0.23 0.00 0.00 178.00 177.00 2br8 s GLU 191 N -3.40 4.48 0.51 0.86 1.03 -1.26 -5.04 118.70 115.88 2br8 s GLU 191 Ca 0.02 1.17 -0.16 0.00 0.03 0.00 0.00 54.97 56.03 2br8 s GLU 191 Cb 0.09 -2.84 -0.08 0.00 -0.80 0.00 0.00 34.13 30.50 2br8 s GLU 191 CO 0.68 0.33 0.98 -1.25 -1.33 0.00 0.00 175.26 174.66 2br8 s PRO 192 N -2.00 3.94 -0.01 -4.83 0.04 -1.26 -4.65 135.00 126.23 2br8 s PRO 192 Ca 0.47 0.93 0.04 0.00 0.04 0.00 0.00 61.00 62.49 2br8 s PRO 192 Cb -0.18 -2.14 -0.01 0.00 0.04 0.00 0.00 34.50 32.20 2br8 s PRO 192 CO 0.23 -0.27 -0.13 0.71 0.04 0.00 0.00 177.00 177.58 2br8 s TYR 193 N -2.63 1.19 0.02 0.56 1.51 0.11 -0.00 117.35 118.11 2br8 s TYR 193 Ca 0.59 -0.22 0.06 0.00 -1.01 0.00 0.00 57.07 56.48 2br8 s TYR 193 Cb -0.10 -0.76 -0.02 0.00 -0.11 0.00 0.00 41.96 40.97 2br8 s TYR 193 CO 0.32 -0.02 -0.18 0.42 -1.11 0.00 0.00 175.55 174.98 2br8 s ILE 194 N -0.31 1.40 0.13 2.71 1.01 -1.26 -0.78 121.20 124.10 2br8 s ILE 194 Ca 0.05 -0.95 -0.09 0.00 0.00 0.00 0.00 60.65 59.66 2br8 s ILE 194 Cb -0.05 -1.20 -0.00 0.00 0.01 0.00 0.00 42.46 41.21 2br8 s ILE 194 CO -0.01 0.24 0.25 1.51 0.00 0.00 0.00 174.94 176.93 2br8 s ASP 195 N -0.83 0.07 -0.16 3.58 -4.77 -0.73 -4.60 116.67 109.24 2br8 s ASP 195 Ca 0.06 -0.75 -0.00 0.00 -3.30 0.00 0.00 52.55 48.55 2br8 s ASP 195 Cb -0.08 0.39 -0.00 0.00 -1.09 0.00 0.00 42.92 42.14 2br8 s ASP 195 CO 0.01 -0.82 -0.14 -0.69 0.70 0.00 0.00 175.17 174.23 2br8 s VAL 196 N -3.91 2.82 -0.31 2.11 1.01 -0.65 -0.16 120.40 121.32 2br8 s VAL 196 Ca 0.11 -0.72 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 2br8 s VAL 196 Cb 0.04 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 2br8 s VAL 196 CO -0.05 0.51 0.17 0.21 0.00 0.00 0.00 175.10 175.93 2br8 s ASN 197 N 0.80 5.66 -0.40 3.32 2.47 -0.02 -0.73 114.94 126.05 2br8 s ASN 197 Ca -0.05 -0.41 -0.19 0.00 0.42 0.00 0.00 52.86 52.63 2br8 s ASN 197 Cb -0.15 -2.03 0.01 0.00 -1.45 0.00 0.00 41.25 37.63 2br8 s ASN 197 CO 0.00 -0.17 0.54 -0.22 -3.72 0.00 0.00 177.10 173.53 2br8 s LEU 198 N 1.65 4.55 -0.21 3.21 2.96 -0.58 -1.30 118.68 128.95 2br8 s LEU 198 Ca 0.05 -0.33 -0.02 0.00 -0.22 0.00 0.00 54.13 53.61 2br8 s LEU 198 Cb -0.17 -2.58 0.00 0.00 0.50 0.00 0.00 46.19 43.95 2br8 s LEU 198 CO 0.07 -0.62 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.71 2br8 s VAL 199 N 2.48 2.98 -0.16 1.68 1.01 -0.32 -1.21 120.40 126.86 2br8 s VAL 199 Ca 0.18 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.51 2br8 s VAL 199 Cb -0.15 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 33.89 2br8 s VAL 199 CO 0.15 0.43 -0.20 0.68 0.00 0.00 0.00 175.10 176.16 2br8 s VAL 200 N 1.41 1.99 -0.21 2.92 -7.23 0.58 -1.37 120.40 118.49 2br8 s VAL 200 Ca 0.05 -0.91 -0.09 0.00 -1.81 0.00 0.00 61.98 59.22 2br8 s VAL 200 Cb -0.14 -1.79 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 2br8 s VAL 200 CO -0.06 0.53 0.11 -0.75 -0.31 0.00 0.00 175.10 174.62 2br8 s LYS 201 N 1.18 4.03 0.21 4.82 2.20 0.09 -0.75 119.74 131.51 2br8 s LYS 201 Ca 0.01 -0.30 -0.17 0.00 -0.36 0.00 0.00 55.97 55.15 2br8 s LYS 201 Cb -0.14 -3.38 0.02 0.00 -1.51 0.00 0.00 37.83 32.83 2br8 s LYS 201 CO -0.09 0.17 0.52 -0.59 -0.36 0.00 0.00 175.35 174.99 2br8 s PHE 202 N 0.71 -0.03 0.22 4.03 -0.12 0.14 -0.37 117.98 122.55 2br8 s PHE 202 Ca 0.06 -0.33 -0.12 0.00 -0.05 0.00 0.00 56.93 56.49 2br8 s PHE 202 Cb -0.13 0.37 -0.00 0.00 -0.63 0.00 0.00 43.02 42.63 2br8 s PHE 202 CO 0.02 -0.94 0.42 -0.98 -0.05 0.00 0.00 175.22 173.69 2br8 s ARG 203 N -3.90 1.43 0.36 1.99 1.70 -0.76 -0.45 118.95 119.31 2br8 s ARG 203 Ca 0.12 -1.21 -0.28 0.00 -0.47 0.00 0.00 55.73 53.89 2br8 s ARG 203 Cb -0.01 0.45 -0.10 0.00 -0.57 0.00 0.00 34.95 34.72 2br8 s ARG 203 CO -0.00 -0.58 1.30 -2.00 -1.08 0.00 0.00 175.30 172.95 2br8 s GLU 204 N -4.00 4.21 0.00 3.89 2.12 -0.23 0.38 118.70 125.08 2br8 s GLU 204 Ca 0.20 2.19 0.32 0.00 0.36 0.00 0.00 54.97 58.04 2br8 s GLU 204 Cb 0.01 -2.95 1.89 0.00 0.26 0.00 0.00 34.13 33.34 2br8 s GLU 204 CO 0.06 -0.30 2.21 -2.13 -0.54 0.00 0.00 175.26 174.55