#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2br7 h ALA 2 N 0.00 1.65 0.20 -1.58 0.00 -2.04 -2.58 119.26 114.92 2br7 h ALA 2 Ca 0.00 -0.01 -0.33 0.00 0.00 0.00 0.00 54.91 54.57 2br7 h ALA 2 Cb 0.00 -0.21 0.02 0.00 0.00 0.00 0.00 17.79 17.60 2br7 h ALA 2 CO 0.00 0.20 -1.55 -0.91 0.00 0.00 0.00 179.25 176.98 2br7 h ASN 3 N 0.86 0.65 -0.52 0.00 2.35 -2.00 -2.90 115.58 114.02 2br7 h ASN 3 Ca 0.38 -0.81 -0.06 0.00 -0.55 0.00 0.00 56.30 55.26 2br7 h ASN 3 Cb 0.34 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 2br7 h ASN 3 CO -0.15 1.65 0.07 0.25 -1.65 0.00 0.00 177.43 177.61 2br7 h LEU 4 N 0.11 0.84 -0.53 1.61 5.85 -1.87 -1.13 115.31 120.20 2br7 h LEU 4 Ca -0.27 -0.27 0.11 0.00 0.84 0.00 0.00 57.88 58.29 2br7 h LEU 4 Cb 2.10 -0.22 -0.10 0.00 0.37 0.00 0.00 40.66 42.81 2br7 h LEU 4 CO 0.22 0.90 -0.09 -0.03 -0.34 0.00 0.00 178.44 179.09 2br7 h MET 5 N 0.76 0.03 -0.44 1.25 4.05 -1.51 0.14 114.93 119.21 2br7 h MET 5 Ca 0.16 -0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.53 2br7 h MET 5 Cb 0.42 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.19 2br7 h MET 5 CO 0.01 0.02 0.10 -0.09 0.23 0.00 0.00 176.91 177.19 2br7 h ARG 6 N 0.03 0.71 0.06 0.39 2.43 -1.28 -3.00 114.38 113.71 2br7 h ARG 6 Ca 0.26 -0.17 0.01 0.00 -0.81 0.00 0.00 59.98 59.27 2br7 h ARG 6 Cb 0.40 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 2br7 h ARG 6 CO -0.52 0.71 -0.14 1.25 -1.51 0.00 0.00 179.97 179.76 2br7 h LEU 7 N 0.58 -0.40 -1.09 3.80 5.85 0.02 -1.65 115.31 122.41 2br7 h LEU 7 Ca 0.14 0.05 0.11 0.00 0.84 0.00 0.00 57.88 59.02 2br7 h LEU 7 Cb 0.32 0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.44 2br7 h LEU 7 CO 0.00 -0.21 0.61 0.11 -0.34 0.00 0.00 178.44 178.62 2br7 h LYS 8 N -0.27 0.93 0.00 1.25 1.57 -0.83 -0.38 116.57 118.83 2br7 h LYS 8 Ca 0.03 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 2br7 h LYS 8 Cb 0.30 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 2br7 h LYS 8 CO -0.10 0.62 -0.45 0.66 -0.57 0.00 0.00 179.45 179.61 2br7 h SER 9 N 0.96 0.00 0.13 0.86 4.64 -1.37 -2.40 113.55 116.37 2br7 h SER 9 Ca 0.46 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.55 2br7 h SER 9 Cb 0.44 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.54 2br7 h SER 9 CO -0.22 0.45 -0.90 0.44 -0.87 0.00 0.00 176.83 175.73 2br7 h ASP 10 N 0.00 0.72 -0.03 4.97 3.32 -0.31 -1.91 116.42 123.17 2br7 h ASP 10 Ca -0.00 -0.54 -0.15 0.00 0.02 0.00 0.00 57.03 56.36 2br7 h ASP 10 Cb 1.22 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 40.56 2br7 h ASP 10 CO 0.06 1.33 -0.56 -0.07 -1.72 0.00 0.00 179.24 178.27 2br7 h LEU 11 N 0.35 0.55 -1.50 1.55 3.38 -1.16 -3.35 115.31 115.14 2br7 h LEU 11 Ca -0.08 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 57.17 2br7 h LEU 11 Cb 1.53 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.12 2br7 h LEU 11 CO 0.17 1.19 -0.14 0.49 0.09 0.00 0.00 178.44 180.24 2br7 n PHE 12 N -4.23 0.00 0.02 1.13 3.72 -0.91 -4.47 117.46 112.72 2br7 n PHE 12 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 2br7 n PHE 12 Cb 0.65 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.19 2br7 n PHE 12 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2br7 n ASN 13 N 0.73 0.23 -0.26 4.37 5.03 -0.73 -4.78 115.26 119.86 2br7 n ASN 13 Ca 0.11 0.05 0.07 0.00 0.87 0.00 0.00 54.58 55.67 2br7 n ASN 13 Cb 0.48 -0.06 0.19 0.00 -1.02 0.00 0.00 39.78 39.37 2br7 n ASN 13 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.26 175.34 2br7 h ARG 14 N 0.00 0.22 -6.46 3.52 2.43 -1.66 -3.41 114.38 109.03 2br7 h ARG 14 Ca 0.00 -0.01 -0.53 0.00 -0.81 0.00 0.00 59.98 58.62 2br7 h ARG 14 Cb 0.65 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 2br7 h ARG 14 CO 0.00 0.15 -0.11 -1.12 -1.51 0.00 0.00 179.97 177.37 2br7 s SER 15 N -5.21 6.59 0.52 -3.80 0.01 -1.26 -5.10 113.70 105.45 2br7 s SER 15 Ca -0.13 0.89 -0.18 0.00 1.31 0.00 0.00 55.95 57.84 2br7 s SER 15 Cb 0.22 -2.21 -0.07 0.00 0.21 0.00 0.00 66.02 64.17 2br7 s SER 15 CO 0.76 -0.10 1.01 -2.84 0.41 0.00 0.00 173.24 172.48 2br7 s PRO 16 N -2.98 3.76 0.07 12.44 0.02 -1.26 -4.80 135.00 142.25 2br7 s PRO 16 Ca 0.47 1.14 -0.24 0.00 0.02 0.00 0.00 61.00 62.39 2br7 s PRO 16 Cb -0.11 -2.10 -0.13 0.00 0.02 0.00 0.00 34.50 32.18 2br7 s PRO 16 CO 0.23 -0.44 0.56 -0.12 -0.33 0.00 0.00 177.00 176.90 2br7 n MET 17 N -1.47 0.00 -2.00 5.54 0.00 -1.26 -4.87 117.12 113.05 2br7 n MET 17 Ca 0.08 0.00 -0.42 0.00 -0.00 0.00 0.00 57.70 57.36 2br7 n MET 17 Cb 0.53 -0.88 -0.03 0.00 0.00 0.00 0.00 33.22 32.84 2br7 n MET 17 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 175.97 175.50 2br7 s TYR 18 N -0.36 3.00 -1.60 1.12 5.04 -1.26 -4.91 117.35 118.38 2br7 s TYR 18 Ca 0.55 0.67 0.10 0.00 -2.44 0.00 0.00 57.07 55.94 2br7 s TYR 18 Cb -0.78 -3.86 0.34 0.00 0.35 0.00 0.00 41.96 38.01 2br7 s TYR 18 CO 0.40 -3.19 1.22 -0.35 -1.34 0.00 0.00 175.55 172.28 2br7 n PRO 19 N 4.28 2.14 0.00 4.97 -0.04 -1.26 -4.80 135.00 140.29 2br7 n PRO 19 Ca 0.14 -1.35 0.00 0.00 -0.04 0.00 0.00 63.50 62.24 2br7 n PRO 19 Cb 0.40 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 2br7 n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2br7 n GLY 20 N 0.84 -1.86 3.71 0.55 0.00 -1.26 -4.97 105.19 102.21 2br7 n GLY 20 Ca 0.12 -1.52 -0.31 0.00 0.00 0.00 0.00 46.02 44.31 2br7 n GLY 20 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2br7 s PRO 21 N -2.21 1.55 0.00 1.61 0.04 -1.26 -5.04 135.00 129.69 2br7 s PRO 21 Ca 0.00 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.43 2br7 s PRO 21 Cb 0.00 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.74 2br7 s PRO 21 CO 0.00 -2.21 0.00 0.25 0.04 0.00 0.00 177.00 175.08 2br7 n THR 22 N -3.92 0.00 -0.08 1.26 -2.24 0.12 -4.94 114.28 104.47 2br7 n THR 22 Ca 0.11 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.75 2br7 n THR 22 Cb 0.52 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.70 2br7 n THR 22 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2br7 h LYS 23 N 0.00 0.67 0.00 -0.78 1.63 -1.93 -3.02 116.57 113.14 2br7 h LYS 23 Ca 0.00 -0.39 -0.09 0.00 -0.85 0.00 0.00 60.65 59.32 2br7 h LYS 23 Cb 0.00 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.65 2br7 h LYS 23 CO 0.00 1.00 -0.44 -0.44 -3.45 0.00 0.00 179.45 176.12 2br7 h ASP 24 N 0.39 0.00 -2.49 4.20 3.32 -1.96 -3.37 116.42 116.52 2br7 h ASP 24 Ca 0.03 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.48 2br7 h ASP 24 Cb 0.92 0.00 -0.42 0.00 0.22 0.00 0.00 39.33 40.05 2br7 h ASP 24 CO 0.08 0.44 -0.63 -0.67 -1.72 0.00 0.00 179.24 176.73 2br7 n ASP 25 N -3.56 3.11 -4.87 6.45 2.03 -1.18 -5.10 116.55 113.43 2br7 n ASP 25 Ca -0.00 -3.28 -0.30 0.00 0.52 0.00 0.00 54.79 51.73 2br7 n ASP 25 Cb 0.55 -0.69 0.06 0.00 -0.72 0.00 0.00 41.12 40.32 2br7 n ASP 25 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 2br7 s PRO 26 N -1.96 2.54 0.05 -0.67 0.02 -1.15 -0.70 135.00 133.13 2br7 s PRO 26 Ca 0.34 0.42 0.03 0.00 0.02 0.00 0.00 61.00 61.81 2br7 s PRO 26 Cb 0.08 -1.99 -0.02 0.00 0.02 0.00 0.00 34.50 32.59 2br7 s PRO 26 CO -0.08 -1.25 -0.09 -1.17 -0.33 0.00 0.00 177.00 174.08 2br7 s LEU 27 N -5.48 2.26 -0.23 -5.54 2.96 0.64 -4.90 118.68 108.39 2br7 s LEU 27 Ca 0.59 -0.55 0.02 0.00 -0.22 0.00 0.00 54.13 53.97 2br7 s LEU 27 Cb -0.12 -0.22 0.04 0.00 0.50 0.00 0.00 46.19 46.40 2br7 s LEU 27 CO 0.52 -0.18 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.34 2br7 s THR 28 N -1.35 2.20 -0.08 3.68 2.01 -1.26 -0.22 115.64 120.62 2br7 s THR 28 Ca -0.09 -1.30 -0.12 0.00 0.31 0.00 0.00 61.69 60.49 2br7 s THR 28 Cb -0.10 -2.13 -0.05 0.00 0.01 0.00 0.00 72.50 70.23 2br7 s THR 28 CO 0.01 0.22 0.29 -0.69 -0.69 0.00 0.00 174.62 173.75 2br7 s VAL 29 N 1.20 5.26 -0.28 3.82 1.01 -0.21 -4.52 120.40 126.68 2br7 s VAL 29 Ca -0.03 0.55 -0.09 0.00 0.00 0.00 0.00 61.98 62.41 2br7 s VAL 29 Cb -0.17 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 2br7 s VAL 29 CO -0.08 0.54 0.13 -0.89 0.00 0.00 0.00 175.10 174.80 2br7 s THR 30 N -0.63 4.70 -0.09 3.92 2.01 -0.31 -3.12 115.64 122.12 2br7 s THR 30 Ca 0.19 -0.16 -0.03 0.00 0.31 0.00 0.00 61.69 62.00 2br7 s THR 30 Cb -0.14 -3.28 -0.03 0.00 0.01 0.00 0.00 72.50 69.05 2br7 s THR 30 CO 0.08 0.22 0.03 -0.76 -0.69 0.00 0.00 174.62 173.50 2br7 s LEU 31 N 1.66 3.75 0.04 4.42 1.02 0.39 -2.51 118.68 127.45 2br7 s LEU 31 Ca 0.06 0.21 -0.04 0.00 0.02 0.00 0.00 54.13 54.38 2br7 s LEU 31 Cb -0.16 -1.88 -0.02 0.00 0.02 0.00 0.00 46.19 44.15 2br7 s LEU 31 CO 0.07 0.38 0.05 -0.83 0.02 0.00 0.00 176.35 176.03 2br7 s GLY 32 N -0.95 0.26 -0.04 -3.19 0.00 -0.99 -4.24 107.32 98.17 2br7 s GLY 32 Ca 0.14 -0.73 0.05 0.00 0.00 0.00 0.00 44.72 44.19 2br7 s GLY 32 CO 0.03 -0.85 -0.21 -1.36 0.00 0.00 0.00 173.10 170.72 2br7 s PHE 33 N -2.80 1.97 -0.24 1.90 0.08 -1.26 -0.51 117.98 117.10 2br7 s PHE 33 Ca -0.03 -0.52 -0.05 0.00 0.12 0.00 0.00 56.93 56.46 2br7 s PHE 33 Cb -0.00 -1.30 -0.00 0.00 -0.57 0.00 0.00 43.02 41.15 2br7 s PHE 33 CO -0.06 -0.14 -0.01 0.99 -0.10 0.00 0.00 175.22 175.91 2br7 s THR 34 N -0.18 3.55 -0.30 0.64 2.01 0.65 -1.71 115.64 120.30 2br7 s THR 34 Ca -0.00 -0.56 -0.09 0.00 0.31 0.00 0.00 61.69 61.35 2br7 s THR 34 Cb -0.11 -2.69 -0.00 0.00 0.01 0.00 0.00 72.50 69.70 2br7 s THR 34 CO 0.02 0.31 0.13 -0.22 -0.69 0.00 0.00 174.62 174.17 2br7 s LEU 35 N 1.48 4.00 -0.17 4.42 2.96 -0.99 -0.16 118.68 130.23 2br7 s LEU 35 Ca 0.04 -0.54 0.18 0.00 -0.22 0.00 0.00 54.13 53.59 2br7 s LEU 35 Cb -0.15 -1.97 -0.25 0.00 0.50 0.00 0.00 46.19 44.32 2br7 s LEU 35 CO -0.01 -0.18 0.12 1.67 -1.32 0.00 0.00 176.35 176.62 2br7 n GLN 36 N 4.95 0.84 -3.64 1.98 7.27 0.42 -4.24 117.38 124.96 2br7 n GLN 36 Ca -0.14 -0.03 -0.08 0.00 0.07 0.00 0.00 57.00 56.81 2br7 n GLN 36 Cb 0.49 -1.49 -0.07 0.00 2.41 0.00 0.00 30.24 31.58 2br7 n GLN 36 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2br7 s ASP 37 N -5.21 -0.36 -0.54 1.69 2.15 -0.60 -0.03 116.67 113.77 2br7 s ASP 37 Ca -0.09 0.69 -0.18 0.00 0.43 0.00 0.00 52.55 53.40 2br7 s ASP 37 Cb 0.07 0.70 0.09 0.00 -0.30 0.00 0.00 42.92 43.47 2br7 s ASP 37 CO 0.79 -0.13 0.61 -0.63 -0.17 0.00 0.00 175.17 175.64 2br7 s ILE 38 N 0.13 4.95 0.10 4.11 1.01 -1.26 0.10 121.20 130.34 2br7 s ILE 38 Ca 0.04 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 59.63 2br7 s ILE 38 Cb -0.05 -4.36 -0.07 0.00 0.01 0.00 0.00 42.46 38.00 2br7 s ILE 38 CO -0.08 -0.91 1.47 0.58 0.00 0.00 0.00 174.94 176.00 2br7 h VAL 39 N 5.88 1.29 -2.84 2.92 2.07 -1.13 -3.42 116.25 121.02 2br7 h VAL 39 Ca -0.29 -1.29 -0.12 0.00 0.82 0.00 0.00 66.70 65.83 2br7 h VAL 39 Cb 1.09 1.44 -0.22 0.00 -1.52 0.00 0.00 31.29 32.08 2br7 h VAL 39 CO 1.02 0.42 -0.24 -0.75 0.02 0.00 0.00 177.57 178.03 2br7 s LYS 40 N -4.58 0.57 -0.08 1.57 2.20 -1.21 -4.92 119.74 113.29 2br7 s LYS 40 Ca -0.13 0.24 0.02 0.00 -0.36 0.00 0.00 55.97 55.75 2br7 s LYS 40 Cb 0.09 0.27 0.01 0.00 -1.51 0.00 0.00 37.83 36.69 2br7 s LYS 40 CO 0.81 -0.12 -0.13 0.08 -0.36 0.00 0.00 175.35 175.63 2br7 s VAL 41 N -0.47 1.25 -0.20 4.02 1.01 -1.26 -1.03 120.40 123.71 2br7 s VAL 41 Ca -0.06 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.41 2br7 s VAL 41 Cb -0.04 -1.15 0.05 0.00 0.00 0.00 0.00 36.38 35.24 2br7 s VAL 41 CO 0.03 0.39 -0.09 -0.62 0.00 0.00 0.00 175.10 174.80 2br7 s ASP 42 N 0.84 3.44 0.00 3.32 -1.08 -0.68 -5.00 116.67 117.51 2br7 s ASP 42 Ca -0.11 -0.92 0.24 0.00 -0.52 0.00 0.00 52.55 51.24 2br7 s ASP 42 Cb -0.15 -1.20 0.24 0.00 -1.46 0.00 0.00 42.92 40.34 2br7 s ASP 42 CO 0.01 -0.16 1.27 -1.54 0.52 0.00 0.00 175.17 175.27 2br7 n SER 43 N 4.69 2.47 0.03 -0.34 3.41 -1.26 -2.21 113.62 120.41 2br7 n SER 43 Ca -0.14 -1.75 -0.08 0.00 -0.26 0.00 0.00 58.87 56.64 2br7 n SER 43 Cb 0.46 0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 64.51 2br7 n SER 43 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2br7 h SER 44 N 3.63 -0.15 -3.66 4.04 4.64 -1.97 -3.43 113.55 116.65 2br7 h SER 44 Ca 0.00 -0.28 -0.46 0.00 -0.47 0.00 0.00 61.79 60.58 2br7 h SER 44 Cb 0.86 0.04 0.08 0.00 -0.31 0.00 0.00 62.40 63.07 2br7 h SER 44 CO 0.00 0.43 0.22 0.42 -0.87 0.00 0.00 176.83 177.04 2br7 s THR 45 N -2.67 2.26 -0.88 2.95 -4.23 -1.26 -5.02 115.64 106.80 2br7 s THR 45 Ca -0.09 -0.29 0.00 0.00 -1.18 0.00 0.00 61.69 60.14 2br7 s THR 45 Cb -0.00 -2.98 0.28 0.00 1.34 0.00 0.00 72.50 71.14 2br7 s THR 45 CO 0.33 0.00 1.12 0.59 -0.54 0.00 0.00 174.62 176.12 2br7 n ASN 46 N -2.94 5.14 -4.19 3.99 5.03 -1.25 -4.71 115.26 116.32 2br7 n ASN 46 Ca 0.09 -3.41 -0.32 0.00 0.87 0.00 0.00 54.58 51.81 2br7 n ASN 46 Cb 0.60 -1.00 -0.17 0.00 -1.02 0.00 0.00 39.78 38.20 2br7 n ASN 46 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2br7 s GLU 47 N -2.58 2.94 0.01 3.52 2.02 -0.94 -0.21 118.70 123.47 2br7 s GLU 47 Ca 0.35 -0.84 0.02 0.00 0.02 0.00 0.00 54.97 54.52 2br7 s GLU 47 Cb 0.09 -2.26 -0.04 0.00 0.10 0.00 0.00 34.13 32.02 2br7 s GLU 47 CO 0.04 0.13 -0.02 0.08 0.02 0.00 0.00 175.26 175.51 2br7 s VAL 48 N 0.47 3.99 -0.22 2.63 1.01 -0.88 -1.69 120.40 125.70 2br7 s VAL 48 Ca -0.16 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.08 2br7 s VAL 48 Cb -0.17 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 2br7 s VAL 48 CO 0.06 0.36 0.00 -1.81 0.00 0.00 0.00 175.10 173.71 2br7 s ASP 49 N -1.58 4.73 0.01 3.32 1.11 -0.20 -1.47 116.67 122.59 2br7 s ASP 49 Ca 0.19 -0.26 0.03 0.00 0.18 0.00 0.00 52.55 52.69 2br7 s ASP 49 Cb -0.11 -1.82 -0.03 0.00 1.07 0.00 0.00 42.92 42.02 2br7 s ASP 49 CO 0.10 0.02 -0.07 -0.76 1.18 0.00 0.00 175.17 175.64 2br7 s LEU 50 N 1.29 3.18 -0.26 1.23 1.43 -0.57 -0.48 118.68 124.50 2br7 s LEU 50 Ca 0.04 -0.15 -0.04 0.00 -1.03 0.00 0.00 54.13 52.95 2br7 s LEU 50 Cb -0.15 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.26 2br7 s LEU 50 CO 0.01 0.28 -0.00 -0.69 0.23 0.00 0.00 176.35 176.18 2br7 s VAL 51 N -1.00 3.48 0.14 -1.59 1.01 0.11 -1.16 120.40 121.39 2br7 s VAL 51 Ca 0.17 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.46 2br7 s VAL 51 Cb -0.11 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 2br7 s VAL 51 CO 0.08 0.24 0.02 -0.72 0.00 0.00 0.00 175.10 174.71 2br7 s TYR 52 N 1.45 0.96 0.09 5.22 -0.85 -1.05 -0.44 117.35 122.74 2br7 s TYR 52 Ca 0.03 -1.12 0.10 0.00 -0.52 0.00 0.00 57.07 55.56 2br7 s TYR 52 Cb -0.16 -0.56 -0.03 0.00 0.38 0.00 0.00 41.96 41.59 2br7 s TYR 52 CO -0.01 -0.37 -0.26 1.52 -1.52 0.00 0.00 175.55 174.91 2br7 s TYR 53 N -3.86 2.21 -0.12 -3.49 -0.85 0.78 -1.79 117.35 110.22 2br7 s TYR 53 Ca 0.22 -0.39 0.02 0.00 -0.52 0.00 0.00 57.07 56.39 2br7 s TYR 53 Cb 0.07 -1.25 0.01 0.00 0.38 0.00 0.00 41.96 41.17 2br7 s TYR 53 CO 0.01 0.23 -0.18 -2.00 -1.52 0.00 0.00 175.55 172.10 2br7 s GLU 54 N -1.69 2.49 -0.26 -3.49 2.12 -0.48 -0.25 118.70 117.15 2br7 s GLU 54 Ca 0.12 -0.66 -0.11 0.00 0.36 0.00 0.00 54.97 54.68 2br7 s GLU 54 Cb -0.10 -2.07 -0.05 0.00 0.26 0.00 0.00 34.13 32.17 2br7 s GLU 54 CO 0.04 -0.04 0.18 -1.14 -0.54 0.00 0.00 175.26 173.75 2br7 s GLN 55 N 0.92 4.02 -0.05 4.30 0.74 0.33 -3.12 119.66 126.79 2br7 s GLN 55 Ca -0.07 -0.28 0.05 0.00 0.05 0.00 0.00 55.36 55.10 2br7 s GLN 55 Cb -0.15 -3.59 -0.02 0.00 1.10 0.00 0.00 33.01 30.35 2br7 s GLN 55 CO -0.01 -0.04 -0.18 -0.65 -0.55 0.00 0.00 175.29 173.86 2br7 s GLN 56 N 1.35 2.51 0.01 1.67 -0.21 0.14 -2.34 119.66 122.78 2br7 s GLN 56 Ca 0.07 -0.78 0.01 0.00 0.02 0.00 0.00 55.36 54.69 2br7 s GLN 56 Cb -0.15 -2.30 -0.01 0.00 1.00 0.00 0.00 33.01 31.55 2br7 s GLN 56 CO 0.07 0.54 -0.04 1.03 -2.12 0.00 0.00 175.29 174.77 2br7 s ARG 57 N -0.52 0.29 0.05 2.91 0.52 -1.04 -0.45 118.95 120.70 2br7 s ARG 57 Ca 0.07 -0.39 -0.28 0.00 -0.52 0.00 0.00 55.73 54.61 2br7 s ARG 57 Cb -0.11 -0.10 0.09 0.00 0.52 0.00 0.00 34.95 35.34 2br7 s ARG 57 CO 0.01 0.01 0.95 1.67 0.02 0.00 0.00 175.30 177.97 2br7 s TRP 58 N -0.79 -0.23 -0.06 -0.53 -2.14 -1.11 -1.16 118.94 112.93 2br7 s TRP 58 Ca -0.07 0.03 0.04 0.00 2.66 0.00 0.00 56.10 58.76 2br7 s TRP 58 Cb -0.06 0.58 -0.00 0.00 -3.10 0.00 0.00 33.47 30.89 2br7 s TRP 58 CO -0.00 -0.63 -0.19 0.21 -2.66 0.00 0.00 176.95 173.67 2br7 s LYS 59 N -3.12 2.10 0.02 3.25 2.20 -1.26 0.27 119.74 123.20 2br7 s LYS 59 Ca 0.09 -0.69 0.07 0.00 -0.36 0.00 0.00 55.97 55.08 2br7 s LYS 59 Cb -0.01 -1.76 -0.03 0.00 -1.51 0.00 0.00 37.83 34.52 2br7 s LYS 59 CO -0.04 0.24 -0.21 -0.51 -0.36 0.00 0.00 175.35 174.48 2br7 s LEU 60 N 0.10 2.43 0.19 5.43 1.43 0.20 -4.95 118.68 123.50 2br7 s LEU 60 Ca -0.07 -0.44 -0.04 0.00 -1.03 0.00 0.00 54.13 52.55 2br7 s LEU 60 Cb -0.13 -1.44 0.10 0.00 0.03 0.00 0.00 46.19 44.75 2br7 s LEU 60 CO 0.04 0.28 1.51 0.78 0.23 0.00 0.00 176.35 179.18 2br7 h ASN 61 N 4.87 0.66 0.00 2.29 2.35 -1.89 -3.03 115.58 120.83 2br7 h ASN 61 Ca -0.46 -0.34 0.00 0.00 -0.55 0.00 0.00 56.30 54.94 2br7 h ASN 61 Cb 1.15 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.33 2br7 h ASN 61 CO 0.47 1.06 0.00 -1.54 -1.65 0.00 0.00 177.43 175.77 2br7 n SER 62 N -3.98 0.00 -0.16 5.81 3.41 -1.26 -1.73 113.62 115.71 2br7 n SER 62 Ca -0.03 -0.50 0.03 0.00 -0.26 0.00 0.00 58.87 58.11 2br7 n SER 62 Cb 0.59 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.61 2br7 n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2br7 n LEU 63 N -0.82 2.32 -4.85 1.04 4.77 -1.15 -5.01 117.00 113.30 2br7 n LEU 63 Ca 0.06 -2.29 -0.30 0.00 -0.03 0.00 0.00 56.01 53.45 2br7 n LEU 63 Cb 0.03 -0.16 0.09 0.00 -2.33 0.00 0.00 43.42 41.04 2br7 n LEU 63 CO 0.04 0.59 0.74 -0.04 -1.33 0.00 0.00 177.39 177.39 2br7 s MET 64 N -1.50 2.11 -0.10 3.23 -1.94 -0.71 -3.61 119.30 116.78 2br7 s MET 64 Ca 0.13 0.39 -0.32 0.00 -1.71 0.00 0.00 55.69 54.18 2br7 s MET 64 Cb 0.10 -1.94 0.12 0.00 2.01 0.00 0.00 34.83 35.12 2br7 s MET 64 CO 0.03 -1.55 1.10 1.67 -0.01 0.00 0.00 175.02 176.26 2br7 s TRP 65 N -3.34 -0.19 -0.44 -0.03 -2.14 -0.23 -4.90 118.94 107.67 2br7 s TRP 65 Ca 0.61 0.10 -0.14 0.00 2.66 0.00 0.00 56.10 59.33 2br7 s TRP 65 Cb -0.13 0.53 0.06 0.00 -3.10 0.00 0.00 33.47 30.84 2br7 s TRP 65 CO 0.52 -0.36 0.34 0.34 -2.66 0.00 0.00 176.95 175.13 2br7 s ASP 66 N -2.39 6.00 0.55 -2.66 -1.08 -1.26 -4.64 116.67 111.19 2br7 s ASP 66 Ca 0.09 -1.28 0.35 0.00 -0.52 0.00 0.00 52.55 51.18 2br7 s ASP 66 Cb -0.00 -2.13 1.50 0.00 -1.46 0.00 0.00 42.92 40.83 2br7 s ASP 66 CO -0.06 -0.58 1.79 -0.65 0.52 0.00 0.00 175.17 176.20 2br7 h PRO 67 N 8.64 0.00 -0.94 4.34 0.11 -1.93 -0.51 132.00 141.71 2br7 h PRO 67 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2br7 h PRO 67 Cb 1.11 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 2br7 h PRO 67 CO 0.82 0.00 0.60 -0.91 -0.21 0.00 0.00 178.00 178.30 2br7 h ASN 68 N 0.00 1.09 0.82 -2.05 2.35 -1.92 0.81 115.58 116.68 2br7 h ASN 68 Ca 0.50 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 56.21 2br7 h ASN 68 Cb 2.13 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 40.22 2br7 h ASN 68 CO -0.01 0.81 0.00 -0.33 -1.65 0.00 0.00 177.43 176.25 2br7 h GLU 69 N 1.28 0.00 -1.61 0.81 5.08 -1.52 -3.29 114.58 115.33 2br7 h GLU 69 Ca 0.34 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 58.18 2br7 h GLU 69 Cb -0.12 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.72 2br7 h GLU 69 CO -0.07 0.00 -0.87 0.66 -1.00 0.00 0.00 179.01 177.73 2br7 n TYR 70 N -2.78 2.68 -4.01 4.33 4.01 -0.95 -4.97 117.16 115.47 2br7 n TYR 70 Ca 0.01 -3.30 -0.32 0.00 -0.16 0.00 0.00 57.90 54.13 2br7 n TYR 70 Cb 0.25 -0.27 0.01 0.00 -0.31 0.00 0.00 39.34 39.02 2br7 n TYR 70 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2br7 n GLY 71 N -0.25 -0.46 2.37 2.72 0.00 -1.17 -2.61 105.19 105.79 2br7 n GLY 71 Ca 0.29 0.17 -0.14 0.00 0.00 0.00 0.00 46.02 46.34 2br7 n GLY 71 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2br7 n ASN 72 N -2.79 -4.60 -4.66 1.61 5.03 0.28 -4.98 115.26 105.14 2br7 n ASN 72 Ca 0.02 0.26 -0.42 0.00 0.87 0.00 0.00 54.58 55.31 2br7 n ASN 72 Cb 0.53 -3.43 -0.03 0.00 -1.02 0.00 0.00 39.78 35.83 2br7 n ASN 72 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2br7 s ILE 73 N -2.56 3.73 -0.08 2.41 1.01 -1.07 -4.89 121.20 119.75 2br7 s ILE 73 Ca 0.00 0.90 0.14 0.00 0.00 0.00 0.00 60.65 61.69 2br7 s ILE 73 Cb 0.00 -3.58 -0.22 0.00 0.01 0.00 0.00 42.46 38.67 2br7 s ILE 73 CO 0.00 -0.08 0.61 0.35 0.00 0.00 0.00 174.94 175.83 2br7 n THR 74 N 5.41 1.49 -3.51 2.92 -2.24 -1.26 -4.40 114.28 112.68 2br7 n THR 74 Ca 0.16 -0.78 -0.13 0.00 -2.27 0.00 0.00 64.05 61.03 2br7 n THR 74 Cb 0.43 -0.90 -0.04 0.00 -2.10 0.00 0.00 70.33 67.72 2br7 n THR 74 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2br7 s ASP 75 N -5.94 -0.51 0.10 3.42 1.47 -1.26 0.27 116.67 114.22 2br7 s ASP 75 Ca -0.05 0.37 0.01 0.00 1.18 0.00 0.00 52.55 54.05 2br7 s ASP 75 Cb 0.08 0.46 -0.04 0.00 -0.34 0.00 0.00 42.92 43.08 2br7 s ASP 75 CO 0.82 -0.61 -0.03 0.72 0.68 0.00 0.00 175.17 176.75 2br7 s PHE 76 N -2.01 0.84 -0.10 2.11 -0.71 -0.95 -5.01 117.98 112.13 2br7 s PHE 76 Ca -0.03 -1.01 -0.02 0.00 -1.04 0.00 0.00 56.93 54.83 2br7 s PHE 76 Cb -0.00 -0.50 -0.03 0.00 -1.21 0.00 0.00 43.02 41.27 2br7 s PHE 76 CO -0.00 -0.26 -0.01 1.03 -1.34 0.00 0.00 175.22 174.64 2br7 s ARG 77 N -3.89 3.13 0.02 1.99 0.52 -1.26 -1.08 118.95 118.38 2br7 s ARG 77 Ca 0.14 -0.44 -0.03 0.00 -0.52 0.00 0.00 55.73 54.87 2br7 s ARG 77 Cb 0.06 -2.81 -0.01 0.00 0.52 0.00 0.00 34.95 32.71 2br7 s ARG 77 CO -0.04 0.59 0.04 -0.08 0.02 0.00 0.00 175.30 175.83 2br7 s THR 78 N -0.58 0.11 0.40 0.02 -1.32 0.57 -4.98 115.64 109.86 2br7 s THR 78 Ca 0.09 -0.95 -0.27 0.00 -1.21 0.00 0.00 61.69 59.36 2br7 s THR 78 Cb -0.12 -0.52 -0.10 0.00 -1.51 0.00 0.00 72.50 70.25 2br7 s THR 78 CO 0.02 -0.52 1.43 -0.24 -2.21 0.00 0.00 174.62 173.10 2br7 n SER 79 N 1.29 3.41 0.16 8.08 2.88 -1.26 -0.34 113.62 127.84 2br7 n SER 79 Ca -0.22 1.18 0.12 0.00 -1.33 0.00 0.00 58.87 58.63 2br7 n SER 79 Cb 0.56 -1.59 0.56 0.00 -0.75 0.00 0.00 64.21 63.00 2br7 n SER 79 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2br7 h ALA 80 N 2.63 1.00 0.00 -1.46 0.00 -1.06 -2.15 119.26 118.23 2br7 h ALA 80 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2br7 h ALA 80 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2br7 h ALA 80 CO 0.63 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.88 2br7 n ALA 81 N -1.80 2.17 -0.03 0.00 0.00 -1.26 -2.83 120.51 116.75 2br7 n ALA 81 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 53.44 53.27 2br7 n ALA 81 Cb 0.15 -1.36 -0.14 0.00 0.00 0.00 0.00 19.45 18.10 2br7 n ALA 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2br7 n ASP 82 N -1.25 0.62 -4.61 0.00 9.92 -0.81 -4.98 116.55 115.43 2br7 n ASP 82 Ca 0.11 0.29 -0.24 0.00 -0.53 0.00 0.00 54.79 54.42 2br7 n ASP 82 Cb 0.17 0.32 -0.08 0.00 -0.64 0.00 0.00 41.12 40.88 2br7 n ASP 82 CO 0.00 0.00 0.00 0.27 0.13 0.00 0.00 177.20 177.60 2br7 s ILE 83 N -2.66 2.99 0.27 0.53 -4.36 -1.13 -5.00 121.20 111.85 2br7 s ILE 83 Ca -0.06 -2.01 -0.29 0.00 -0.26 0.00 0.00 60.65 58.03 2br7 s ILE 83 Cb 0.08 -2.74 -0.09 0.00 1.25 0.00 0.00 42.46 40.96 2br7 s ILE 83 CO 0.83 -0.32 1.21 0.86 0.24 0.00 0.00 174.94 177.76 2br7 s TRP 84 N -2.42 3.35 0.09 1.37 -0.00 -1.26 -4.96 118.94 115.11 2br7 s TRP 84 Ca 0.33 1.50 0.05 0.00 -0.00 0.00 0.00 56.10 57.97 2br7 s TRP 84 Cb -0.04 -3.47 -0.03 0.00 -0.00 0.00 0.00 33.47 29.93 2br7 s TRP 84 CO 0.19 -1.24 -0.13 0.95 -0.00 0.00 0.00 176.95 176.73 2br7 s THR 85 N -0.77 1.09 0.44 5.86 -4.23 -1.26 -5.13 115.64 111.64 2br7 s THR 85 Ca 0.49 -1.50 -0.23 0.00 -1.18 0.00 0.00 61.69 59.27 2br7 s THR 85 Cb -0.35 -1.25 -0.08 0.00 1.34 0.00 0.00 72.50 72.16 2br7 s THR 85 CO 0.43 -0.38 1.11 -2.16 -0.54 0.00 0.00 174.62 173.09 2br7 s PRO 86 N -2.27 3.89 -0.22 3.99 0.04 -1.26 -4.93 135.00 134.25 2br7 s PRO 86 Ca 0.03 1.64 -0.04 0.00 0.04 0.00 0.00 61.00 62.67 2br7 s PRO 86 Cb -0.07 -2.42 -0.05 0.00 0.04 0.00 0.00 34.50 32.01 2br7 s PRO 86 CO 0.02 -0.41 2.91 -0.40 0.04 0.00 0.00 177.00 179.16 2br7 n ASP 87 N -0.40 5.89 -4.62 6.66 5.75 -1.26 -4.95 116.55 123.62 2br7 n ASP 87 Ca 0.07 -2.83 -0.43 0.00 -0.01 0.00 0.00 54.79 51.59 2br7 n ASP 87 Cb 0.49 -1.27 -0.03 0.00 -1.03 0.00 0.00 41.12 39.29 2br7 n ASP 87 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2br7 s ILE 88 N -0.81 3.51 0.14 2.12 -1.09 -1.26 -2.63 121.20 121.19 2br7 s ILE 88 Ca 0.52 0.57 0.11 0.00 -2.23 0.00 0.00 60.65 59.61 2br7 s ILE 88 Cb 0.30 -3.56 -0.04 0.00 -1.58 0.00 0.00 42.46 37.58 2br7 s ILE 88 CO -0.09 -0.27 -0.26 -0.89 -1.23 0.00 0.00 174.94 172.21 2br7 s THR 89 N 5.86 2.31 -0.38 2.92 2.01 0.16 -4.82 115.64 123.70 2br7 s THR 89 Ca 0.78 -1.81 -0.29 0.00 0.31 0.00 0.00 61.69 60.68 2br7 s THR 89 Cb -0.27 -2.04 0.01 0.00 0.01 0.00 0.00 72.50 70.21 2br7 s THR 89 CO 0.32 0.04 1.36 0.00 -0.69 0.00 0.00 174.62 175.65 2br7 s ALA 90 N -1.21 3.16 0.55 7.40 0.00 -1.26 -1.67 121.76 128.73 2br7 s ALA 90 Ca 0.16 -0.09 0.23 0.00 0.00 0.00 0.00 51.96 52.27 2br7 s ALA 90 Cb -0.10 -3.88 1.45 0.00 0.00 0.00 0.00 23.12 20.59 2br7 s ALA 90 CO 0.07 -2.18 2.08 1.88 0.00 0.00 0.00 175.76 177.62 2br7 h TYR 91 N 10.14 0.00 -1.63 0.00 0.05 -1.03 -3.22 116.97 121.28 2br7 h TYR 91 Ca -0.27 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.00 2br7 h TYR 91 Cb 1.10 0.00 -0.41 0.00 1.01 0.00 0.00 36.73 38.43 2br7 h TYR 91 CO 0.94 0.00 -0.90 -1.13 -1.05 0.00 0.00 178.16 176.02 2br7 n SER 92 N -4.25 3.25 -4.86 3.88 3.41 -1.26 -5.01 113.62 108.77 2br7 n SER 92 Ca 0.03 -3.35 -0.31 0.00 -0.26 0.00 0.00 58.87 54.98 2br7 n SER 92 Cb 0.34 -0.52 0.02 0.00 -0.26 0.00 0.00 64.21 63.79 2br7 n SER 92 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2br7 s SER 93 N -3.25 5.95 -0.10 4.04 1.04 -1.22 -2.11 113.70 118.05 2br7 s SER 93 Ca 0.42 1.40 0.15 0.00 0.48 0.00 0.00 55.95 58.39 2br7 s SER 93 Cb 0.38 -2.38 0.22 0.00 0.10 0.00 0.00 66.02 64.35 2br7 s SER 93 CO -0.10 -1.05 1.11 0.35 0.98 0.00 0.00 173.24 174.53 2br7 n THR 94 N -2.86 1.53 -3.63 2.02 -2.24 -0.67 -4.85 114.28 103.58 2br7 n THR 94 Ca 0.06 -1.82 -0.04 0.00 -2.27 0.00 0.00 64.05 59.98 2br7 n THR 94 Cb 0.54 -0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.66 2br7 n THR 94 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2br7 s ARG 95 N -2.29 0.19 0.13 -0.78 0.52 -1.26 -5.04 118.95 110.42 2br7 s ARG 95 Ca 0.25 0.12 -0.31 0.00 -0.52 0.00 0.00 55.73 55.26 2br7 s ARG 95 Cb 0.22 0.09 -0.09 0.00 0.52 0.00 0.00 34.95 35.68 2br7 s ARG 95 CO 0.02 -0.04 1.60 -2.14 0.02 0.00 0.00 175.30 174.76 2br7 s PRO 96 N -0.53 4.21 0.25 3.54 0.02 -1.26 -4.70 135.00 136.53 2br7 s PRO 96 Ca 0.06 2.35 -0.31 0.00 0.02 0.00 0.00 61.00 63.13 2br7 s PRO 96 Cb -0.03 -3.33 -0.14 0.00 0.02 0.00 0.00 34.50 31.03 2br7 s PRO 96 CO -0.09 -0.66 1.35 1.55 -0.33 0.00 0.00 177.00 178.82 2br7 n VAL 97 N 4.26 1.12 -4.08 3.83 3.14 -1.26 -4.91 118.33 120.43 2br7 n VAL 97 Ca 0.15 -0.28 -0.35 0.00 -2.96 0.00 0.00 64.34 60.90 2br7 n VAL 97 Cb 0.39 -1.40 -0.09 0.00 -1.06 0.00 0.00 33.84 31.68 2br7 n VAL 97 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2br7 s GLN 98 N -0.64 3.74 -0.08 1.45 -0.21 -0.74 -4.96 119.66 118.22 2br7 s GLN 98 Ca 0.67 -0.35 -0.25 0.00 0.02 0.00 0.00 55.36 55.45 2br7 s GLN 98 Cb -0.66 -3.12 -0.03 0.00 1.00 0.00 0.00 33.01 30.20 2br7 s GLN 98 CO 0.52 0.39 0.77 0.08 -2.12 0.00 0.00 175.29 174.93 2br7 s VAL 99 N 0.02 4.98 -0.66 1.09 1.01 -1.26 -1.07 120.40 124.50 2br7 s VAL 99 Ca 0.05 1.58 0.13 0.00 0.00 0.00 0.00 61.98 63.73 2br7 s VAL 99 Cb -0.12 -4.10 -0.12 0.00 0.00 0.00 0.00 36.38 32.03 2br7 s VAL 99 CO 0.01 0.18 0.56 0.18 0.00 0.00 0.00 175.10 176.03 2br7 n LEU 100 N 4.17 0.69 -4.35 3.92 4.32 -0.03 -4.95 117.00 120.77 2br7 n LEU 100 Ca 0.01 -0.53 -0.19 0.00 -0.02 0.00 0.00 56.01 55.29 2br7 n LEU 100 Cb 0.51 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.21 2br7 n LEU 100 CO 0.48 0.16 -0.44 -0.94 -1.22 0.00 0.00 177.39 175.43 2br7 s SER 101 N -2.12 2.61 0.20 -1.43 1.04 -1.24 -4.92 113.70 107.83 2br7 s SER 101 Ca 0.05 -1.02 -0.32 0.00 0.48 0.00 0.00 55.95 55.15 2br7 s SER 101 Cb 0.10 -0.14 -0.15 0.00 0.10 0.00 0.00 66.02 65.92 2br7 s SER 101 CO 0.49 -0.16 1.12 -2.65 0.98 0.00 0.00 173.24 173.02 2br7 n PRO 102 N -0.38 1.18 -1.80 4.02 -0.02 -1.26 -4.82 135.00 131.91 2br7 n PRO 102 Ca -0.08 0.42 -0.42 0.00 -2.02 0.00 0.00 63.50 61.40 2br7 n PRO 102 Cb 0.60 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 2br7 n PRO 102 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2br7 n GLN 103 N 1.55 2.96 -4.55 -0.52 1.13 -1.26 -4.89 117.38 111.80 2br7 n GLN 103 Ca 0.14 -2.72 -0.23 0.00 -1.94 0.00 0.00 57.00 52.25 2br7 n GLN 103 Cb 0.26 -3.24 -0.16 0.00 0.11 0.00 0.00 30.24 27.21 2br7 n GLN 103 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2br7 s ILE 104 N 2.82 1.04 0.28 5.09 1.01 -1.26 -0.41 121.20 129.77 2br7 s ILE 104 Ca 0.46 -0.47 0.09 0.00 0.00 0.00 0.00 60.65 60.74 2br7 s ILE 104 Cb 0.13 -0.93 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 2br7 s ILE 104 CO -0.08 0.32 0.03 0.00 0.00 0.00 0.00 174.94 175.21 2br7 s ALA 105 N 0.40 3.24 -0.19 9.38 0.00 0.54 -4.69 121.76 130.44 2br7 s ALA 105 Ca -0.08 -1.68 -0.01 0.00 0.00 0.00 0.00 51.96 50.19 2br7 s ALA 105 Cb -0.12 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.22 2br7 s ALA 105 CO 0.02 0.22 -0.13 0.54 0.00 0.00 0.00 175.76 176.41 2br7 s VAL 106 N -2.34 2.72 -0.05 0.00 0.11 -1.12 -0.31 120.40 119.40 2br7 s VAL 106 Ca 0.33 -0.73 -0.04 0.00 -2.93 0.00 0.00 61.98 58.61 2br7 s VAL 106 Cb -0.06 -2.18 -0.04 0.00 -1.53 0.00 0.00 36.38 32.57 2br7 s VAL 106 CO 0.21 0.49 0.13 -0.69 -3.33 0.00 0.00 175.10 171.91 2br7 s VAL 107 N 1.21 5.25 0.12 2.04 1.01 -0.24 -1.01 120.40 128.77 2br7 s VAL 107 Ca 0.02 -0.08 0.10 0.00 0.00 0.00 0.00 61.98 62.02 2br7 s VAL 107 Cb -0.14 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 2br7 s VAL 107 CO -0.06 0.46 -0.23 -0.89 0.00 0.00 0.00 175.10 174.38 2br7 s THR 108 N -1.16 2.50 0.59 3.92 2.01 0.11 -2.25 115.64 121.36 2br7 s THR 108 Ca 0.21 -1.64 0.30 0.00 0.31 0.00 0.00 61.69 60.87 2br7 s THR 108 Cb -0.12 -2.12 0.42 0.00 0.01 0.00 0.00 72.50 70.69 2br7 s THR 108 CO 0.11 0.10 1.64 1.12 -0.69 0.00 0.00 174.62 176.91 2br7 h HIS 109 N 3.85 0.00 -0.36 4.92 2.07 -0.50 0.99 115.15 126.13 2br7 h HIS 109 Ca -0.50 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.02 2br7 h HIS 109 Cb 1.17 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.15 2br7 h HIS 109 CO 0.60 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.06 2br7 n ASP 110 N -3.58 3.00 0.00 3.10 5.75 -1.26 -1.06 116.55 122.50 2br7 n ASP 110 Ca 0.18 -2.29 0.00 0.00 -0.01 0.00 0.00 54.79 52.66 2br7 n ASP 110 Cb 1.13 -0.46 0.00 0.00 -1.03 0.00 0.00 41.12 40.76 2br7 n ASP 110 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2br7 n GLY 111 N 0.69 0.51 3.86 6.12 0.00 0.34 -4.71 105.19 112.00 2br7 n GLY 111 Ca 0.15 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 2br7 n GLY 111 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2br7 s SER 112 N -2.31 6.72 0.06 1.61 1.04 -1.14 0.60 113.70 120.28 2br7 s SER 112 Ca 0.00 0.91 0.09 0.00 0.48 0.00 0.00 55.95 57.43 2br7 s SER 112 Cb 0.00 -2.22 -0.03 0.00 0.10 0.00 0.00 66.02 63.87 2br7 s SER 112 CO 0.00 0.15 -0.24 -0.69 0.98 0.00 0.00 173.24 173.43 2br7 s VAL 113 N -1.42 1.96 -0.15 5.02 1.01 0.14 0.08 120.40 127.05 2br7 s VAL 113 Ca 0.35 -1.39 -0.02 0.00 0.00 0.00 0.00 61.98 60.91 2br7 s VAL 113 Cb -0.14 -1.70 0.05 0.00 0.00 0.00 0.00 36.38 34.58 2br7 s VAL 113 CO 0.18 0.24 0.02 -0.32 0.00 0.00 0.00 175.10 175.22 2br7 s MET 114 N -1.39 0.62 -0.11 2.72 0.00 -0.18 -2.73 119.30 118.22 2br7 s MET 114 Ca 0.10 -0.20 0.02 0.00 0.00 0.00 0.00 55.69 55.60 2br7 s MET 114 Cb -0.10 -1.66 0.02 0.00 0.00 0.00 0.00 34.83 33.09 2br7 s MET 114 CO 0.03 -0.51 -0.15 0.12 0.00 0.00 0.00 175.02 174.51 2br7 s PHE 115 N 1.91 1.94 -0.62 4.11 5.36 0.40 -2.79 117.98 128.29 2br7 s PHE 115 Ca 0.02 -0.92 0.05 0.00 -0.96 0.00 0.00 56.93 55.12 2br7 s PHE 115 Cb -0.15 -1.41 0.20 0.00 -0.34 0.00 0.00 43.02 41.32 2br7 s PHE 115 CO -0.07 -0.48 0.57 -0.89 -1.46 0.00 0.00 175.22 172.88 2br7 n ILE 116 N 4.25 1.34 -1.69 3.12 5.41 -1.26 0.24 119.36 130.78 2br7 n ILE 116 Ca -0.19 -4.74 -0.43 0.00 1.00 0.00 0.00 62.75 58.39 2br7 n ILE 116 Cb 0.51 -2.07 -0.03 0.00 -0.71 0.00 0.00 39.64 37.33 2br7 n ILE 116 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2br7 n PRO 117 N 1.64 2.63 -3.25 0.38 -0.02 -1.18 -4.79 135.00 130.40 2br7 n PRO 117 Ca 0.25 0.96 -0.39 0.00 -2.02 0.00 0.00 63.50 62.29 2br7 n PRO 117 Cb 0.40 -2.81 -0.06 0.00 -0.02 0.00 0.00 33.50 31.01 2br7 n PRO 117 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2br7 s ALA 118 N 2.09 3.56 -0.04 3.55 0.00 -1.26 -1.38 121.76 128.28 2br7 s ALA 118 Ca 0.80 0.03 -0.06 0.00 0.00 0.00 0.00 51.96 52.73 2br7 s ALA 118 Cb -0.54 -2.67 0.01 0.00 0.00 0.00 0.00 23.12 19.93 2br7 s ALA 118 CO 0.37 0.32 0.16 -0.65 0.00 0.00 0.00 175.76 175.96 2br7 s GLN 119 N -0.81 0.30 -0.20 0.00 -0.21 -0.74 -0.85 119.66 117.15 2br7 s GLN 119 Ca 0.30 0.01 -0.07 0.00 0.02 0.00 0.00 55.36 55.61 2br7 s GLN 119 Cb -0.19 0.14 -0.04 0.00 1.00 0.00 0.00 33.01 33.92 2br7 s GLN 119 CO 0.18 -0.06 0.06 0.50 -2.12 0.00 0.00 175.29 173.86 2br7 s ARG 120 N -0.44 3.86 -0.09 2.91 3.52 -0.23 -2.51 118.95 125.96 2br7 s ARG 120 Ca -0.05 -0.40 0.01 0.00 -0.13 0.00 0.00 55.73 55.17 2br7 s ARG 120 Cb -0.03 -3.25 0.02 0.00 -1.56 0.00 0.00 34.95 30.13 2br7 s ARG 120 CO 0.01 0.11 -0.12 -1.17 -0.81 0.00 0.00 175.30 173.32 2br7 s LEU 121 N 0.80 1.56 -0.03 -0.88 2.96 -0.31 -1.79 118.68 120.99 2br7 s LEU 121 Ca 0.03 -0.34 -0.21 0.00 -0.22 0.00 0.00 54.13 53.39 2br7 s LEU 121 Cb -0.14 -0.91 -0.05 0.00 0.50 0.00 0.00 46.19 45.60 2br7 s LEU 121 CO 0.02 -0.01 0.62 -0.44 -1.32 0.00 0.00 176.35 175.22 2br7 s SER 122 N 1.02 6.96 0.23 3.68 0.01 -1.26 -1.50 113.70 122.84 2br7 s SER 122 Ca -0.07 1.15 -0.05 0.00 1.31 0.00 0.00 55.95 58.28 2br7 s SER 122 Cb -0.15 -2.37 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 2br7 s SER 122 CO -0.01 0.03 0.30 0.72 0.41 0.00 0.00 173.24 174.69 2br7 s PHE 123 N 0.14 0.88 -0.26 2.43 -0.71 -0.54 -1.66 117.98 118.25 2br7 s PHE 123 Ca 0.33 -1.14 -0.29 0.00 -1.04 0.00 0.00 56.93 54.79 2br7 s PHE 123 Cb -0.18 -0.25 0.00 0.00 -1.21 0.00 0.00 43.02 41.39 2br7 s PHE 123 CO 0.17 -0.82 1.23 -1.64 -1.34 0.00 0.00 175.22 172.82 2br7 s MET 124 N -3.99 4.05 -0.28 1.99 -1.94 -0.89 -2.08 119.30 116.16 2br7 s MET 124 Ca 0.32 1.34 -0.06 0.00 -1.71 0.00 0.00 55.69 55.57 2br7 s MET 124 Cb 0.03 -3.81 0.14 0.00 2.01 0.00 0.00 34.83 33.21 2br7 s MET 124 CO 0.12 -0.94 0.58 0.00 -0.01 0.00 0.00 175.02 174.78 2br7 s ASP 126 N 2.82 6.66 0.00 0.00 2.15 -1.26 -3.60 116.67 123.44 2br7 s ASP 126 Ca 0.04 0.52 0.29 0.00 0.43 0.00 0.00 52.55 53.82 2br7 s ASP 126 Cb -0.13 -2.46 1.21 0.00 -0.30 0.00 0.00 42.92 41.24 2br7 s ASP 126 CO -0.18 -0.89 1.84 -0.81 -0.17 0.00 0.00 175.17 174.95 2br7 n PRO 127 N 6.85 1.46 -1.72 4.34 -0.04 -1.26 -4.84 135.00 139.79 2br7 n PRO 127 Ca 0.07 -0.72 -0.61 0.00 -0.04 0.00 0.00 63.50 62.20 2br7 n PRO 127 Cb 0.48 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 32.37 2br7 n PRO 127 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2br7 n THR 128 N -0.14 0.21 0.00 0.52 -1.04 -1.26 0.07 114.28 112.64 2br7 n THR 128 Ca 0.20 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 2br7 n THR 128 Cb 0.30 -0.99 0.00 0.00 -1.82 0.00 0.00 70.33 67.82 2br7 n THR 128 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2br7 n GLY 129 N 4.20 1.28 0.32 3.41 0.00 -1.26 -4.85 105.19 108.30 2br7 n GLY 129 Ca 0.28 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.46 2br7 n GLY 129 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2br7 h VAL 130 N 0.00 0.65 -0.01 1.61 3.04 -0.62 -2.38 116.25 118.55 2br7 h VAL 130 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2br7 h VAL 130 Cb 0.00 0.88 0.00 0.00 -2.01 0.00 0.00 31.29 30.16 2br7 h VAL 130 CO 0.00 0.00 -0.04 -0.90 -1.01 0.00 0.00 177.57 175.62 2br7 n ASP 131 N -4.08 0.71 -1.56 3.17 5.75 -1.26 -1.30 116.55 117.98 2br7 n ASP 131 Ca 0.01 -1.07 0.00 0.00 -0.01 0.00 0.00 54.79 53.73 2br7 n ASP 131 Cb 0.29 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.37 2br7 n ASP 131 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2br7 n SER 132 N -0.54 0.00 -0.09 -1.12 3.41 -0.89 -4.91 113.62 109.48 2br7 n SER 132 Ca 0.19 -0.45 -0.23 0.00 -0.26 0.00 0.00 58.87 58.13 2br7 n SER 132 Cb 0.25 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.08 2br7 n SER 132 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2br7 n GLU 133 N -0.45 0.64 0.32 4.33 2.13 -1.26 -4.25 120.64 122.11 2br7 n GLU 133 Ca 0.00 0.34 0.21 0.00 0.66 0.00 0.00 57.16 58.37 2br7 n GLU 133 Cb 0.00 -1.64 1.06 0.00 0.27 0.00 0.00 31.44 31.13 2br7 n GLU 133 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2br7 h GLU 134 N -0.50 0.00 0.00 5.31 4.39 -1.97 -3.48 114.58 118.32 2br7 h GLU 134 Ca -0.49 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.21 2br7 h GLU 134 Cb 1.70 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.35 2br7 h GLU 134 CO -0.15 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.11 2br7 n GLY 135 N -0.74 -0.17 3.33 -3.84 0.00 -1.26 -4.90 105.19 97.61 2br7 n GLY 135 Ca -0.02 -1.02 -0.17 0.00 0.00 0.00 0.00 46.02 44.81 2br7 n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2br7 s VAL 136 N 0.00 0.84 0.06 1.61 0.11 -0.24 -4.60 120.40 118.18 2br7 s VAL 136 Ca 0.00 -2.01 0.07 0.00 -2.93 0.00 0.00 61.98 57.11 2br7 s VAL 136 Cb 0.00 -2.47 -0.03 0.00 -1.53 0.00 0.00 36.38 32.35 2br7 s VAL 136 CO 0.00 -0.19 -0.18 -0.89 -3.33 0.00 0.00 175.10 170.51 2br7 s THR 137 N -3.55 1.43 -0.06 5.04 2.01 -1.26 -0.82 115.64 118.44 2br7 s THR 137 Ca 0.32 -1.26 -0.18 0.00 0.31 0.00 0.00 61.69 60.88 2br7 s THR 137 Cb 0.07 -1.29 0.04 0.00 0.01 0.00 0.00 72.50 71.32 2br7 s THR 137 CO 0.11 -0.00 0.40 0.00 -0.69 0.00 0.00 174.62 174.44 2br7 s ALA 139 N -0.94 0.30 -0.02 0.00 0.00 -1.26 -0.15 121.76 119.69 2br7 s ALA 139 Ca -0.10 -0.62 -0.01 0.00 0.00 0.00 0.00 51.96 51.23 2br7 s ALA 139 Cb -0.04 0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.20 2br7 s ALA 139 CO 0.04 -0.09 0.04 0.54 0.00 0.00 0.00 175.76 176.30 2br7 s VAL 140 N -1.34 -0.03 0.07 0.00 0.11 -0.53 -4.89 120.40 113.78 2br7 s VAL 140 Ca -0.13 0.11 -0.15 0.00 -2.93 0.00 0.00 61.98 58.89 2br7 s VAL 140 Cb -0.09 -0.09 -0.06 0.00 -1.53 0.00 0.00 36.38 34.61 2br7 s VAL 140 CO -0.00 0.05 0.47 -0.54 -3.33 0.00 0.00 175.10 171.75 2br7 s LYS 141 N 0.61 3.96 -0.00 1.54 1.02 -1.26 -1.48 119.74 124.12 2br7 s LYS 141 Ca -0.05 0.45 0.07 0.00 0.02 0.00 0.00 55.97 56.46 2br7 s LYS 141 Cb -0.07 -3.11 -0.02 0.00 -0.52 0.00 0.00 37.83 34.11 2br7 s LYS 141 CO -0.02 0.60 -0.21 -0.06 -0.92 0.00 0.00 175.35 174.74 2br7 s PHE 142 N -1.24 1.92 0.00 3.18 0.08 -0.08 -0.34 117.98 121.50 2br7 s PHE 142 Ca 0.30 -0.37 0.00 0.00 0.12 0.00 0.00 56.93 56.98 2br7 s PHE 142 Cb -0.16 -1.22 0.00 0.00 -0.57 0.00 0.00 43.02 41.07 2br7 s PHE 142 CO 0.17 -0.01 0.00 0.41 -0.10 0.00 0.00 175.22 175.69 2br7 n GLY 143 N 2.41 0.02 3.76 4.36 0.00 -0.67 0.50 105.19 115.57 2br7 n GLY 143 Ca -0.16 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 2br7 n GLY 143 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2br7 s SER 144 N 0.00 7.02 0.11 1.61 0.15 -1.26 0.38 113.70 121.71 2br7 s SER 144 Ca 0.00 2.43 0.05 0.00 0.70 0.00 0.00 55.95 59.13 2br7 s SER 144 Cb 0.00 -2.63 -0.22 0.00 -1.71 0.00 0.00 66.02 61.46 2br7 s SER 144 CO 0.00 -0.37 1.26 -0.25 1.20 0.00 0.00 173.24 175.08 2br7 h TRP 145 N 4.13 0.09 0.00 3.44 2.91 -1.85 -3.40 115.95 121.26 2br7 h TRP 145 Ca -0.47 -0.06 0.00 0.00 1.13 0.00 0.00 58.89 59.49 2br7 h TRP 145 Cb 1.22 -0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.86 2br7 h TRP 145 CO 0.59 1.05 -0.32 1.33 -1.03 0.00 0.00 178.44 180.06 2br7 n VAL 146 N -3.38 0.00 -3.54 2.65 0.24 -1.26 -5.02 118.33 108.01 2br7 n VAL 146 Ca -0.01 -0.26 -0.36 0.00 -2.04 0.00 0.00 64.34 61.67 2br7 n VAL 146 Cb 0.95 0.78 -0.07 0.00 -1.47 0.00 0.00 33.84 34.03 2br7 n VAL 146 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2br7 s TYR 147 N -1.15 3.46 0.88 6.34 2.02 -1.26 -5.07 117.35 122.56 2br7 s TYR 147 Ca 0.00 0.58 -0.13 0.00 -0.37 0.00 0.00 57.07 57.15 2br7 s TYR 147 Cb 0.00 -2.33 0.12 0.00 -0.40 0.00 0.00 41.96 39.35 2br7 s TYR 147 CO 0.00 0.24 1.17 -1.54 -1.57 0.00 0.00 175.55 173.85 2br7 s SER 148 N 0.48 3.86 0.00 2.29 1.04 -1.26 -4.62 113.70 115.48 2br7 s SER 148 Ca 0.16 0.81 0.11 0.00 0.48 0.00 0.00 55.95 57.51 2br7 s SER 148 Cb -0.13 -1.29 0.67 0.00 0.10 0.00 0.00 66.02 65.37 2br7 s SER 148 CO 0.03 -2.31 1.11 0.61 0.98 0.00 0.00 173.24 173.66 2br7 n GLY 149 N -2.82 -0.36 0.76 7.32 0.00 0.25 -0.43 105.19 109.91 2br7 n GLY 149 Ca 0.08 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.15 2br7 n GLY 149 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2br7 n PHE 150 N -1.00 0.00 -0.04 1.61 3.72 -1.26 -4.56 117.46 115.92 2br7 n PHE 150 Ca 0.08 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.39 2br7 n PHE 150 Cb 0.04 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.55 2br7 n PHE 150 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2br7 n GLU 151 N 0.76 0.21 -5.12 -1.08 1.02 0.42 -4.35 120.64 112.50 2br7 n GLU 151 Ca 0.12 0.09 -0.29 0.00 -0.02 0.00 0.00 57.16 57.06 2br7 n GLU 151 Cb 0.54 -0.85 -0.16 0.00 -0.02 0.00 0.00 31.44 30.95 2br7 n GLU 151 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2br7 s ILE 152 N -2.20 1.79 -0.03 -3.67 1.01 -0.52 -0.26 121.20 117.32 2br7 s ILE 152 Ca -0.14 -0.96 0.03 0.00 0.00 0.00 0.00 60.65 59.59 2br7 s ILE 152 Cb 0.05 -1.49 0.00 0.00 0.01 0.00 0.00 42.46 41.03 2br7 s ILE 152 CO 0.17 0.50 -0.10 -0.62 0.00 0.00 0.00 174.94 174.89 2br7 s ASP 153 N -0.44 1.37 0.55 3.58 2.15 0.69 -3.66 116.67 120.91 2br7 s ASP 153 Ca 0.06 -0.21 0.07 0.00 0.43 0.00 0.00 52.55 52.90 2br7 s ASP 153 Cb -0.10 -0.35 0.09 0.00 -0.30 0.00 0.00 42.92 42.27 2br7 s ASP 153 CO -0.00 0.08 0.75 0.18 -0.17 0.00 0.00 175.17 176.02 2br7 n LEU 154 N 3.23 0.00 0.00 -1.34 4.32 -1.26 -1.04 117.00 120.90 2br7 n LEU 154 Ca -0.18 -2.18 0.00 0.00 -0.02 0.00 0.00 56.01 53.63 2br7 n LEU 154 Cb 0.54 -0.42 0.00 0.00 -1.62 0.00 0.00 43.42 41.92 2br7 n LEU 154 CO 0.25 -0.74 0.00 1.17 -1.22 0.00 0.00 177.39 176.85 2br7 n LYS 155 N -2.23 0.00 -4.13 3.23 4.81 -1.18 -4.89 118.16 113.77 2br7 n LYS 155 Ca 0.15 0.00 -0.23 0.00 -0.87 0.00 0.00 58.31 57.36 2br7 n LYS 155 Cb 0.54 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.52 2br7 n LYS 155 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2br7 s THR 156 N -0.40 3.04 -1.42 3.15 -4.23 -1.26 -0.46 115.64 114.06 2br7 s THR 156 Ca 0.00 -1.73 0.27 0.00 -1.18 0.00 0.00 61.69 59.05 2br7 s THR 156 Cb 0.00 -2.96 0.23 0.00 1.34 0.00 0.00 72.50 71.11 2br7 s THR 156 CO 0.00 -0.20 1.63 0.47 -0.54 0.00 0.00 174.62 175.98 2br7 n ASP 157 N -1.12 0.63 -3.65 3.99 8.00 -1.26 -4.96 116.55 118.19 2br7 n ASP 157 Ca -0.03 -0.48 -0.01 0.00 0.71 0.00 0.00 54.79 54.97 2br7 n ASP 157 Cb 0.61 0.06 -0.04 0.00 -0.02 0.00 0.00 41.12 41.73 2br7 n ASP 157 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2br7 s THR 158 N -2.69 0.00 -1.24 -3.53 -1.32 -1.26 -5.03 115.64 100.57 2br7 s THR 158 Ca 0.20 0.00 0.26 0.00 -1.21 0.00 0.00 61.69 60.94 2br7 s THR 158 Cb 0.19 -1.00 0.12 0.00 -1.51 0.00 0.00 72.50 70.30 2br7 s THR 158 CO 0.57 0.00 1.52 0.47 -2.21 0.00 0.00 174.62 174.96 2br7 n ASP 159 N 0.42 0.60 -4.58 8.08 9.92 -1.26 -4.75 116.55 124.97 2br7 n ASP 159 Ca 0.02 -0.39 -0.42 0.00 -0.53 0.00 0.00 54.79 53.46 2br7 n ASP 159 Cb 0.58 0.15 -0.02 0.00 -0.64 0.00 0.00 41.12 41.19 2br7 n ASP 159 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 2br7 s GLN 160 N -2.84 3.51 0.54 -1.24 0.74 -1.26 0.31 119.66 119.42 2br7 s GLN 160 Ca 0.16 0.40 -0.22 0.00 0.05 0.00 0.00 55.36 55.75 2br7 s GLN 160 Cb 0.18 -4.02 -0.05 0.00 1.10 0.00 0.00 33.01 30.22 2br7 s GLN 160 CO 0.63 -1.67 1.37 0.08 -0.55 0.00 0.00 175.29 175.15 2br7 s VAL 161 N 5.13 2.05 -0.49 1.34 1.01 -0.70 -4.89 120.40 123.84 2br7 s VAL 161 Ca 0.47 0.04 -0.28 0.00 0.00 0.00 0.00 61.98 62.20 2br7 s VAL 161 Cb -0.08 -3.02 0.03 0.00 0.00 0.00 0.00 36.38 33.31 2br7 s VAL 161 CO 0.27 0.00 1.12 -0.62 0.00 0.00 0.00 175.10 175.87 2br7 s ASP 162 N -0.89 6.59 0.00 3.32 -1.08 -0.69 -4.85 116.67 119.07 2br7 s ASP 162 Ca 0.70 0.36 0.10 0.00 -0.52 0.00 0.00 52.55 53.20 2br7 s ASP 162 Cb -0.41 -2.54 0.21 0.00 -1.46 0.00 0.00 42.92 38.72 2br7 s ASP 162 CO 0.49 -1.26 1.09 0.18 0.52 0.00 0.00 175.17 176.19 2br7 n LEU 163 N 7.84 2.51 0.25 -1.34 4.77 -1.26 -2.33 117.00 127.44 2br7 n LEU 163 Ca 0.11 -1.66 0.12 0.00 -0.03 0.00 0.00 56.01 54.55 2br7 n LEU 163 Cb 0.49 -0.14 0.67 0.00 -2.33 0.00 0.00 43.42 42.11 2br7 n LEU 163 CO 0.71 0.59 0.94 0.77 -1.33 0.00 0.00 177.39 179.07 2br7 h SER 164 N 1.91 0.00 -0.28 -1.43 4.64 -1.91 -2.01 113.55 114.48 2br7 h SER 164 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 2br7 h SER 164 Cb 0.61 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.62 2br7 h SER 164 CO 0.00 0.14 -0.15 -1.54 -0.87 0.00 0.00 176.83 174.42 2br7 n SER 165 N -3.68 2.41 -4.69 4.97 3.41 -1.26 -5.01 113.62 109.77 2br7 n SER 165 Ca -0.02 -3.74 -0.42 0.00 -0.26 0.00 0.00 58.87 54.43 2br7 n SER 165 Cb 0.26 -0.61 -0.03 0.00 -0.26 0.00 0.00 64.21 63.58 2br7 n SER 165 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2br7 s TYR 166 N -3.22 3.17 -0.27 7.33 5.04 -0.76 -4.75 117.35 123.90 2br7 s TYR 166 Ca 0.43 1.16 -0.43 0.00 -2.44 0.00 0.00 57.07 55.79 2br7 s TYR 166 Cb 0.39 -3.46 -0.20 0.00 0.35 0.00 0.00 41.96 39.05 2br7 s TYR 166 CO -0.01 -1.49 1.40 0.98 -1.34 0.00 0.00 175.55 175.09 2br7 n TYR 167 N 5.06 1.35 0.19 4.97 9.36 0.96 -4.87 117.16 134.18 2br7 n TYR 167 Ca 0.11 1.05 0.08 0.00 3.32 0.00 0.00 57.90 62.46 2br7 n TYR 167 Cb 0.46 -2.20 0.18 0.00 -0.63 0.00 0.00 39.34 37.15 2br7 n TYR 167 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2br7 h ALA 168 N 4.38 0.87 -0.42 2.98 0.00 -1.91 -3.24 119.26 121.92 2br7 h ALA 168 Ca -0.47 -0.20 -0.26 0.00 0.00 0.00 0.00 54.91 53.98 2br7 h ALA 168 Cb 1.39 -0.04 -0.16 0.00 0.00 0.00 0.00 17.79 18.98 2br7 h ALA 168 CO 0.84 0.28 -0.18 0.43 0.00 0.00 0.00 179.25 180.62 2br7 n SER 169 N -3.18 3.12 -4.76 0.00 7.64 -1.26 -5.02 113.62 110.16 2br7 n SER 169 Ca 0.03 -3.81 -0.34 0.00 1.01 0.00 0.00 58.87 55.76 2br7 n SER 169 Cb 0.58 -0.60 0.04 0.00 -1.01 0.00 0.00 64.21 63.22 2br7 n SER 169 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2br7 s SER 170 N -2.74 5.13 0.54 6.43 0.15 -1.23 -4.90 113.70 117.09 2br7 s SER 170 Ca 0.46 2.14 0.33 0.00 0.70 0.00 0.00 55.95 59.59 2br7 s SER 170 Cb 0.41 -2.57 1.37 0.00 -1.71 0.00 0.00 66.02 63.52 2br7 s SER 170 CO -0.01 -1.62 1.99 0.11 1.20 0.00 0.00 173.24 174.92 2br7 h LYS 171 N 0.38 0.00 -6.70 5.44 1.57 -1.91 -3.44 116.57 111.92 2br7 h LYS 171 Ca -0.48 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 57.62 2br7 h LYS 171 Cb 1.26 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.38 2br7 h LYS 171 CO 0.54 0.03 -0.81 0.71 -0.57 0.00 0.00 179.45 179.36 2br7 s TYR 172 N -3.71 2.53 -0.11 -1.35 2.02 -1.26 -2.45 117.35 113.02 2br7 s TYR 172 Ca 0.01 -0.27 0.03 0.00 -0.37 0.00 0.00 57.07 56.47 2br7 s TYR 172 Cb 0.09 -1.37 -0.00 0.00 -0.40 0.00 0.00 41.96 40.28 2br7 s TYR 172 CO 0.55 0.35 -0.21 -2.00 -1.57 0.00 0.00 175.55 172.66 2br7 s GLU 173 N -1.95 3.11 -0.13 -0.62 2.12 0.17 -4.83 118.70 116.57 2br7 s GLU 173 Ca 0.17 -0.83 -0.18 0.00 0.36 0.00 0.00 54.97 54.48 2br7 s GLU 173 Cb -0.11 -2.37 -0.04 0.00 0.26 0.00 0.00 34.13 31.87 2br7 s GLU 173 CO 0.09 0.20 0.49 0.42 -0.54 0.00 0.00 175.26 175.92 2br7 s ILE 174 N 0.32 5.17 -0.14 -3.70 -1.09 -1.26 -1.58 121.20 118.92 2br7 s ILE 174 Ca -0.16 0.97 0.16 0.00 -2.23 0.00 0.00 60.65 59.39 2br7 s ILE 174 Cb -0.17 -3.83 -0.23 0.00 -1.58 0.00 0.00 42.46 36.64 2br7 s ILE 174 CO 0.08 0.30 0.14 0.18 -1.23 0.00 0.00 174.94 174.41 2br7 n LEU 175 N 3.84 0.00 -3.57 2.97 4.77 0.86 -4.99 117.00 120.88 2br7 n LEU 175 Ca -0.06 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.84 2br7 n LEU 175 Cb 0.51 0.34 -0.04 0.00 -2.33 0.00 0.00 43.42 41.91 2br7 n LEU 175 CO 0.43 0.34 0.84 -0.94 -1.33 0.00 0.00 177.39 176.73 2br7 s SER 176 N -4.95 -0.29 -0.05 -1.43 1.04 -0.92 -4.98 113.70 102.11 2br7 s SER 176 Ca -0.08 0.19 -0.02 0.00 0.48 0.00 0.00 55.95 56.52 2br7 s SER 176 Cb 0.07 0.26 0.04 0.00 0.10 0.00 0.00 66.02 66.49 2br7 s SER 176 CO 0.73 -0.36 0.09 0.00 0.98 0.00 0.00 173.24 174.69 2br7 s ALA 177 N -1.83 0.04 0.08 5.32 0.00 -1.26 -0.11 121.76 124.01 2br7 s ALA 177 Ca 0.03 0.37 0.09 0.00 0.00 0.00 0.00 51.96 52.45 2br7 s ALA 177 Cb -0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 2br7 s ALA 177 CO -0.03 -0.41 -0.23 0.99 0.00 0.00 0.00 175.76 176.08 2br7 s THR 178 N 1.90 2.44 -0.21 0.00 2.01 0.25 -1.72 115.64 120.30 2br7 s THR 178 Ca 0.00 -1.48 -0.01 0.00 0.31 0.00 0.00 61.69 60.51 2br7 s THR 178 Cb -0.12 -2.04 0.06 0.00 0.01 0.00 0.00 72.50 70.41 2br7 s THR 178 CO -0.04 0.23 -0.01 0.00 -0.69 0.00 0.00 174.62 174.10 2br7 s GLN 179 N -1.70 1.17 -0.07 4.92 -2.07 0.15 -0.41 119.66 121.65 2br7 s GLN 179 Ca 0.14 -0.70 0.01 0.00 -1.82 0.00 0.00 55.36 52.99 2br7 s GLN 179 Cb -0.10 -2.34 0.02 0.00 -1.09 0.00 0.00 33.01 29.50 2br7 s GLN 179 CO 0.05 -0.61 -0.09 0.95 -1.32 0.00 0.00 175.29 174.27 2br7 s THR 180 N 1.62 0.95 0.03 3.63 -4.23 -0.90 -4.10 115.64 112.64 2br7 s THR 180 Ca -0.03 -0.34 -0.30 0.00 -1.18 0.00 0.00 61.69 59.84 2br7 s THR 180 Cb -0.18 -0.91 -0.05 0.00 1.34 0.00 0.00 72.50 72.70 2br7 s THR 180 CO -0.07 0.32 1.18 -0.60 -0.54 0.00 0.00 174.62 174.91 2br7 s ARG 181 N 0.97 4.43 0.14 3.99 3.52 -1.26 -0.29 118.95 130.44 2br7 s ARG 181 Ca -0.09 1.71 -0.01 0.00 -0.13 0.00 0.00 55.73 57.21 2br7 s ARG 181 Cb -0.15 -3.41 -0.04 0.00 -1.56 0.00 0.00 34.95 29.80 2br7 s ARG 181 CO 0.00 -0.28 0.07 1.14 -0.81 0.00 0.00 175.30 175.43 2br7 s GLN 182 N 1.33 0.97 -0.06 5.12 -2.07 0.94 -4.94 119.66 120.96 2br7 s GLN 182 Ca 0.57 -1.46 0.04 0.00 -1.82 0.00 0.00 55.36 52.70 2br7 s GLN 182 Cb -0.27 0.25 -0.00 0.00 -1.09 0.00 0.00 33.01 31.89 2br7 s GLN 182 CO 0.27 -0.28 -0.19 0.54 -1.32 0.00 0.00 175.29 174.31 2br7 s VAL 183 N -4.06 1.61 0.22 3.63 0.11 -1.26 -0.15 120.40 120.50 2br7 s VAL 183 Ca 0.26 -0.80 0.10 0.00 -2.93 0.00 0.00 61.98 58.61 2br7 s VAL 183 Cb 0.07 -1.38 -0.04 0.00 -1.53 0.00 0.00 36.38 33.49 2br7 s VAL 183 CO 0.03 0.46 -0.12 -1.10 -3.33 0.00 0.00 175.10 171.04 2br7 s GLN 184 N 0.12 1.94 -0.08 1.54 -1.52 -0.42 -4.98 119.66 116.26 2br7 s GLN 184 Ca -0.07 -1.44 0.02 0.00 -1.95 0.00 0.00 55.36 51.92 2br7 s GLN 184 Cb -0.13 -2.03 0.01 0.00 -0.22 0.00 0.00 33.01 30.64 2br7 s GLN 184 CO 0.04 0.39 -0.12 -1.01 -0.25 0.00 0.00 175.29 174.34 2br7 s HIS 185 N -1.97 1.55 0.11 0.91 3.76 -1.26 -1.00 115.29 117.38 2br7 s HIS 185 Ca 0.26 -0.62 0.09 0.00 -0.15 0.00 0.00 55.06 54.64 2br7 s HIS 185 Cb -0.07 -1.15 -0.04 0.00 1.11 0.00 0.00 32.58 32.43 2br7 s HIS 185 CO 0.15 -0.33 -0.17 0.71 -0.85 0.00 0.00 174.74 174.25 2br7 s TYR 186 N 0.82 2.57 0.26 1.40 2.02 -1.26 -5.03 117.35 118.12 2br7 s TYR 186 Ca -0.11 -0.25 -0.03 0.00 -0.37 0.00 0.00 57.07 56.31 2br7 s TYR 186 Cb -0.15 -1.36 0.42 0.00 -0.40 0.00 0.00 41.96 40.47 2br7 s TYR 186 CO 0.02 0.39 1.84 1.03 -1.57 0.00 0.00 175.55 177.26 2br7 h SER 187 N 3.71 0.86 0.40 2.29 0.87 -2.00 -2.80 113.55 116.88 2br7 h SER 187 Ca -0.50 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.09 2br7 h SER 187 Cb 1.17 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.98 2br7 h SER 187 CO 0.47 0.51 -0.04 0.00 -0.53 0.00 0.00 176.83 177.24 2br7 h PRO 190 N 6.19 0.00 -6.25 0.00 0.13 -1.89 -3.40 132.00 126.78 2br7 h PRO 190 Ca -0.29 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.27 2br7 h PRO 190 Cb 1.19 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.10 2br7 h PRO 190 CO 0.50 0.14 -0.83 -1.83 -0.23 0.00 0.00 178.00 175.75 2br7 s GLU 191 N -3.81 1.16 0.22 0.86 1.03 -1.26 -5.06 118.70 111.85 2br7 s GLU 191 Ca -0.00 -1.19 -0.30 0.00 0.03 0.00 0.00 54.97 53.50 2br7 s GLU 191 Cb 0.11 -1.45 -0.08 0.00 -0.80 0.00 0.00 34.13 31.90 2br7 s GLU 191 CO 0.59 0.34 1.10 -1.25 -1.33 0.00 0.00 175.26 174.71 2br7 s PRO 192 N -1.96 4.62 0.19 -4.83 0.04 -1.26 -4.74 135.00 127.05 2br7 s PRO 192 Ca 0.08 1.75 -0.02 0.00 0.04 0.00 0.00 61.00 62.84 2br7 s PRO 192 Cb -0.10 -3.24 -0.05 0.00 0.04 0.00 0.00 34.50 31.15 2br7 s PRO 192 CO 0.05 0.14 0.39 0.71 0.04 0.00 0.00 177.00 178.33 2br7 s TYR 193 N -0.62 3.48 0.01 0.56 1.51 -0.17 0.86 117.35 122.98 2br7 s TYR 193 Ca 0.47 0.42 0.08 0.00 -1.01 0.00 0.00 57.07 57.04 2br7 s TYR 193 Cb -0.30 -1.91 -0.02 0.00 -0.11 0.00 0.00 41.96 39.61 2br7 s TYR 193 CO 0.37 0.39 -0.25 0.96 -1.11 0.00 0.00 175.55 175.91 2br7 s ILE 194 N -1.81 2.01 0.11 2.71 -5.25 -1.26 -1.30 121.20 116.41 2br7 s ILE 194 Ca 0.39 -1.19 0.03 0.00 -0.99 0.00 0.00 60.65 58.90 2br7 s ILE 194 Cb -0.11 -1.69 -0.04 0.00 2.95 0.00 0.00 42.46 43.57 2br7 s ILE 194 CO 0.28 0.47 -0.09 1.51 -1.79 0.00 0.00 174.94 175.32 2br7 s ASP 195 N -0.85 1.41 -0.19 4.36 1.47 0.79 -4.22 116.67 119.44 2br7 s ASP 195 Ca 0.10 -0.91 -0.06 0.00 1.18 0.00 0.00 52.55 52.86 2br7 s ASP 195 Cb -0.10 0.03 -0.03 0.00 -0.34 0.00 0.00 42.92 42.49 2br7 s ASP 195 CO 0.00 -0.34 0.02 -0.69 0.68 0.00 0.00 175.17 174.83 2br7 s VAL 196 N -3.00 4.16 -0.43 2.11 1.01 0.18 -0.04 120.40 124.39 2br7 s VAL 196 Ca 0.10 -0.25 -0.16 0.00 0.00 0.00 0.00 61.98 61.68 2br7 s VAL 196 Cb 0.01 -2.88 0.03 0.00 0.00 0.00 0.00 36.38 33.54 2br7 s VAL 196 CO -0.01 0.43 0.36 0.21 0.00 0.00 0.00 175.10 176.09 2br7 s ASN 197 N 0.83 6.14 -0.37 3.32 2.47 0.60 -0.90 114.94 127.03 2br7 s ASN 197 Ca 0.01 -0.96 -0.26 0.00 0.42 0.00 0.00 52.86 52.08 2br7 s ASN 197 Cb -0.14 -2.18 0.02 0.00 -1.45 0.00 0.00 41.25 37.49 2br7 s ASN 197 CO 0.02 -0.53 0.95 -0.22 -3.72 0.00 0.00 177.10 173.60 2br7 s LEU 198 N 1.79 3.98 -0.17 3.21 2.96 -0.55 -2.12 118.68 127.78 2br7 s LEU 198 Ca 0.06 0.62 -0.01 0.00 -0.22 0.00 0.00 54.13 54.58 2br7 s LEU 198 Cb -0.20 -3.30 -0.01 0.00 0.50 0.00 0.00 46.19 43.19 2br7 s LEU 198 CO 0.10 -0.88 -0.11 -0.69 -1.32 0.00 0.00 176.35 173.46 2br7 s VAL 199 N 3.53 3.04 -0.05 1.68 1.01 0.45 -1.46 120.40 128.61 2br7 s VAL 199 Ca 0.39 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.80 2br7 s VAL 199 Cb -0.12 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 2br7 s VAL 199 CO 0.19 0.49 -0.23 0.68 0.00 0.00 0.00 175.10 176.23 2br7 s VAL 200 N 0.86 2.23 -0.17 2.92 -7.23 0.79 -0.58 120.40 119.21 2br7 s VAL 200 Ca -0.03 -1.02 0.01 0.00 -1.81 0.00 0.00 61.98 59.13 2br7 s VAL 200 Cb -0.15 -1.81 0.02 0.00 0.56 0.00 0.00 36.38 35.00 2br7 s VAL 200 CO 0.00 0.57 -0.19 -0.75 -0.31 0.00 0.00 175.10 174.42 2br7 s LYS 201 N -0.33 3.02 0.14 4.82 2.20 0.84 -1.07 119.74 129.36 2br7 s LYS 201 Ca 0.02 -0.82 -0.09 0.00 -0.36 0.00 0.00 55.97 54.72 2br7 s LYS 201 Cb -0.12 -2.57 -0.01 0.00 -1.51 0.00 0.00 37.83 33.62 2br7 s LYS 201 CO 0.02 -0.17 0.27 -0.59 -0.36 0.00 0.00 175.35 174.52 2br7 s PHE 202 N 1.20 0.32 0.31 4.03 -0.71 0.00 -0.10 117.98 123.03 2br7 s PHE 202 Ca 0.03 -0.69 -0.05 0.00 -1.04 0.00 0.00 56.93 55.17 2br7 s PHE 202 Cb -0.14 -0.04 -0.00 0.00 -1.21 0.00 0.00 43.02 41.63 2br7 s PHE 202 CO -0.10 -0.68 0.46 -0.98 -1.34 0.00 0.00 175.22 172.58 2br7 s ARG 203 N -3.94 1.80 0.67 1.99 1.70 -0.61 -1.08 118.95 119.48 2br7 s ARG 203 Ca 0.14 -1.64 -0.07 0.00 -0.47 0.00 0.00 55.73 53.69 2br7 s ARG 203 Cb 0.04 0.44 0.04 0.00 -0.57 0.00 0.00 34.95 34.90 2br7 s ARG 203 CO -0.03 -0.74 0.99 -1.21 -1.08 0.00 0.00 175.30 173.23 2br7 s GLU 204 N -3.31 2.43 0.00 3.89 2.02 -0.42 0.45 118.70 123.77 2br7 s GLU 204 Ca 0.29 -0.15 0.15 0.00 0.02 0.00 0.00 54.97 55.29 2br7 s GLU 204 Cb -0.00 -2.19 0.91 0.00 0.10 0.00 0.00 34.13 32.95 2br7 s GLU 204 CO 0.17 -1.08 1.32 0.54 0.02 0.00 0.00 175.26 176.23