#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2br5 h ASP 3 N 0.00 0.00 -0.26 6.41 3.32 -2.03 -2.95 116.42 120.92 2br5 h ASP 3 Ca 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 2br5 h ASP 3 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2br5 h ASP 3 CO 0.00 0.07 -0.07 0.10 -1.72 0.00 0.00 179.24 177.62 2br5 h TYR 4 N 0.00 0.67 -0.00 4.55 -0.00 -2.04 -2.56 116.97 117.59 2br5 h TYR 4 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 58.73 58.63 2br5 h TYR 4 Cb 0.27 -0.18 0.00 0.00 0.00 0.00 0.00 36.73 36.82 2br5 h TYR 4 CO 0.00 0.68 -0.06 -1.13 -0.00 0.00 0.00 178.16 177.65 2br5 n SER 5 N -4.21 0.21 -1.91 0.10 3.41 -1.11 -2.58 113.62 107.53 2br5 n SER 5 Ca 0.01 -0.29 0.03 0.00 -0.26 0.00 0.00 58.87 58.37 2br5 n SER 5 Cb 0.31 -0.19 0.38 0.00 -0.26 0.00 0.00 64.21 64.45 2br5 n SER 5 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2br5 n ARG 6 N -1.17 4.54 -3.74 4.33 5.12 -0.96 -4.96 116.66 119.81 2br5 n ARG 6 Ca 0.14 -3.15 -0.12 0.00 -1.93 0.00 0.00 57.85 52.79 2br5 n ARG 6 Cb 0.26 -2.25 -0.12 0.00 -1.16 0.00 0.00 32.46 29.19 2br5 n ARG 6 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 2br5 s GLN 7 N -2.85 0.27 -0.03 5.56 2.00 -1.06 -5.10 119.66 118.45 2br5 s GLN 7 Ca 0.55 0.50 0.00 0.00 -2.00 0.00 0.00 55.36 54.41 2br5 s GLN 7 Cb 0.42 0.00 -0.03 0.00 0.80 0.00 0.00 33.01 34.20 2br5 s GLN 7 CO 0.15 -0.11 0.00 1.21 -0.50 0.00 0.00 175.29 176.04 2br5 s ASN 8 N 0.82 5.17 -0.32 6.67 2.47 -1.26 -4.93 114.94 123.56 2br5 s ASN 8 Ca -0.06 0.05 -0.05 0.00 0.42 0.00 0.00 52.86 53.22 2br5 s ASN 8 Cb -0.07 -1.39 0.04 0.00 -1.45 0.00 0.00 41.25 38.38 2br5 s ASN 8 CO -0.05 0.31 0.06 -0.36 -3.72 0.00 0.00 177.10 173.34 2br5 s PHE 9 N -1.02 3.23 1.02 0.43 0.40 -1.26 -5.09 117.98 115.69 2br5 s PHE 9 Ca 0.18 -1.49 -0.19 0.00 -0.60 0.00 0.00 56.93 54.82 2br5 s PHE 9 Cb -0.11 -2.22 -0.06 0.00 0.51 0.00 0.00 43.02 41.14 2br5 s PHE 9 CO 0.08 -0.73 -0.56 1.04 0.70 0.00 0.00 175.22 175.75 2br5 n GLN 10 N 4.76 -0.42 -3.60 0.44 6.02 -1.26 -4.97 117.38 118.34 2br5 n GLN 10 Ca -0.13 -0.11 -0.38 0.00 -0.01 0.00 0.00 57.00 56.37 2br5 n GLN 10 Cb 0.45 -1.35 -0.11 0.00 1.02 0.00 0.00 30.24 30.25 2br5 n GLN 10 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2br5 s ASP 11 N -1.41 5.94 0.25 1.08 2.15 -1.26 -4.97 116.67 118.44 2br5 s ASP 11 Ca 0.46 -0.04 0.25 0.00 0.43 0.00 0.00 52.55 53.66 2br5 s ASP 11 Cb -0.10 -2.10 0.89 0.00 -0.30 0.00 0.00 42.92 41.31 2br5 s ASP 11 CO 0.71 -0.05 1.75 0.18 -0.17 0.00 0.00 175.17 177.59 2br5 n LEU 12 N 5.05 0.79 0.26 -1.34 4.32 -1.26 -3.17 117.00 121.65 2br5 n LEU 12 Ca -0.14 0.63 0.12 0.00 -0.02 0.00 0.00 56.01 56.60 2br5 n LEU 12 Cb 0.52 -0.44 0.78 0.00 -1.62 0.00 0.00 43.42 42.66 2br5 n LEU 12 CO 0.33 -0.37 1.11 0.78 -1.22 0.00 0.00 177.39 178.01 2br5 h ASN 13 N 0.00 0.00 0.01 -1.43 2.35 -2.01 -2.42 115.58 112.08 2br5 h ASN 13 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2br5 h ASN 13 Cb 0.57 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.94 2br5 h ASN 13 CO 0.00 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.96 2br5 n LEU 14 N -4.16 0.42 -0.81 1.61 4.32 -1.19 -1.75 117.00 115.44 2br5 n LEU 14 Ca -0.02 0.70 0.08 0.00 -0.02 0.00 0.00 56.01 56.75 2br5 n LEU 14 Cb 0.12 -0.75 0.15 0.00 -1.62 0.00 0.00 43.42 41.33 2br5 n LEU 14 CO 0.31 -0.83 0.61 0.49 -1.22 0.00 0.00 177.39 176.74 2br5 n PHE 15 N -2.06 0.38 -1.79 -1.77 0.99 -0.91 -4.87 117.46 107.42 2br5 n PHE 15 Ca -0.01 -0.28 -0.42 0.00 -0.00 0.00 0.00 57.45 56.74 2br5 n PHE 15 Cb 0.03 -0.01 -0.03 0.00 -1.00 0.00 0.00 39.48 38.47 2br5 n PHE 15 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2br5 s ARG 16 N -1.16 4.16 0.00 -1.08 0.52 -0.72 -1.95 118.95 118.72 2br5 s ARG 16 Ca 0.27 2.50 0.00 0.00 -0.52 0.00 0.00 55.73 57.99 2br5 s ARG 16 Cb 0.16 -3.56 0.00 0.00 0.52 0.00 0.00 34.95 32.07 2br5 s ARG 16 CO 0.22 -0.80 0.00 0.41 0.02 0.00 0.00 175.30 175.15 2br5 n GLY 17 N 4.13 1.90 1.00 -3.53 0.00 -1.26 -4.76 105.19 102.67 2br5 n GLY 17 Ca 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.18 2br5 n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2br5 n LEU 18 N 0.00 1.13 0.00 0.99 4.77 -0.82 -5.10 117.00 117.96 2br5 n LEU 18 Ca 0.00 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2br5 n LEU 18 Cb 0.00 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 2br5 n LEU 18 CO 0.00 -0.73 0.00 0.61 -1.33 0.00 0.00 177.39 175.94 2br5 n GLY 19 N 3.39 1.72 0.22 -0.72 0.00 -0.93 -4.84 105.19 104.02 2br5 n GLY 19 Ca -0.01 -2.15 0.07 0.00 0.00 0.00 0.00 46.02 43.93 2br5 n GLY 19 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2br5 h GLU 20 N 0.00 0.00 -3.50 1.61 5.08 -1.98 -3.44 114.58 112.35 2br5 h GLU 20 Ca 0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.01 2br5 h GLU 20 Cb 0.00 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 28.89 2br5 h GLU 20 CO 0.00 0.24 -0.74 0.34 -1.00 0.00 0.00 179.01 177.84 2br5 s ASP 21 N -6.63 0.74 0.48 1.42 2.15 -1.26 -5.02 116.67 108.55 2br5 s ASP 21 Ca -0.03 0.03 0.27 0.00 0.43 0.00 0.00 52.55 53.25 2br5 s ASP 21 Cb 0.14 -0.17 1.11 0.00 -0.30 0.00 0.00 42.92 43.70 2br5 s ASP 21 CO 0.66 -0.18 1.90 -0.65 -0.17 0.00 0.00 175.17 176.74 2br5 h PRO 22 N 7.85 0.00 -6.84 4.34 0.11 -1.91 -3.44 132.00 132.11 2br5 h PRO 22 Ca -0.29 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.31 2br5 h PRO 22 Cb 1.12 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.27 2br5 h PRO 22 CO 0.33 0.15 0.55 0.00 -0.21 0.00 0.00 178.00 178.82 2br5 s ALA 23 N -3.73 3.44 0.15 -0.75 0.00 -1.26 -4.41 121.76 115.21 2br5 s ALA 23 Ca 0.00 1.06 -0.29 0.00 0.00 0.00 0.00 51.96 52.73 2br5 s ALA 23 Cb 0.10 -3.39 -0.07 0.00 0.00 0.00 0.00 23.12 19.76 2br5 s ALA 23 CO 0.60 -0.38 0.91 -0.47 0.00 0.00 0.00 175.76 176.42 2br5 s TYR 24 N -1.16 3.87 -0.05 0.00 5.04 -1.26 -4.92 117.35 118.88 2br5 s TYR 24 Ca 0.47 1.78 0.00 0.00 -2.44 0.00 0.00 57.07 56.88 2br5 s TYR 24 Cb -0.35 -2.97 0.02 0.00 0.35 0.00 0.00 41.96 39.01 2br5 s TYR 24 CO 0.46 0.33 -0.02 -1.01 -1.34 0.00 0.00 175.55 173.97 2br5 s HIS 25 N -0.52 0.60 0.56 4.97 3.76 -1.26 -5.01 115.29 118.38 2br5 s HIS 25 Ca 0.43 -0.13 -0.21 0.00 -0.15 0.00 0.00 55.06 54.99 2br5 s HIS 25 Cb -0.24 -0.62 -0.04 0.00 1.11 0.00 0.00 32.58 32.79 2br5 s HIS 25 CO 0.29 -0.20 1.32 -1.25 -0.85 0.00 0.00 174.74 174.05 2br5 s PRO 26 N 1.18 3.09 1.08 8.40 0.04 -1.26 -4.97 135.00 142.56 2br5 s PRO 26 Ca -0.07 2.15 -0.13 0.00 0.04 0.00 0.00 61.00 62.99 2br5 s PRO 26 Cb -0.14 -2.19 0.24 0.00 0.04 0.00 0.00 34.50 32.46 2br5 s PRO 26 CO -0.02 -1.20 1.06 -1.25 0.04 0.00 0.00 177.00 175.63 2br5 s PRO 27 N -2.99 -0.27 -0.08 0.56 0.04 -1.26 -5.06 135.00 125.95 2br5 s PRO 27 Ca 0.73 0.61 -0.04 0.00 0.04 0.00 0.00 61.00 62.34 2br5 s PRO 27 Cb -0.38 -1.65 0.04 0.00 0.04 0.00 0.00 34.50 32.55 2br5 s PRO 27 CO 0.45 -3.23 0.18 0.08 0.04 0.00 0.00 177.00 174.51 2br5 s VAL 28 N -2.75 -0.04 -0.17 -0.36 1.01 -1.26 -5.12 120.40 111.70 2br5 s VAL 28 Ca 0.67 0.15 -0.26 0.00 0.00 0.00 0.00 61.98 62.53 2br5 s VAL 28 Cb -0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 36.38 35.88 2br5 s VAL 28 CO 0.61 0.06 0.88 -0.76 0.00 0.00 0.00 175.10 175.89 2br5 s LEU 29 N 1.05 4.17 -0.22 3.92 1.02 -1.26 -4.76 118.68 122.60 2br5 s LEU 29 Ca -0.08 1.23 -0.15 0.00 0.02 0.00 0.00 54.13 55.15 2br5 s LEU 29 Cb -0.10 -3.31 -0.18 0.00 0.02 0.00 0.00 46.19 42.63 2br5 s LEU 29 CO -0.06 -0.45 0.02 1.07 0.02 0.00 0.00 176.35 176.95 2br5 n THR 30 N 4.82 1.57 -1.62 5.49 5.66 -1.26 -4.66 114.28 124.29 2br5 n THR 30 Ca 0.06 -0.28 -0.16 0.00 -3.05 0.00 0.00 64.05 60.61 2br5 n THR 30 Cb 0.48 -1.89 0.12 0.00 -1.55 0.00 0.00 70.33 67.49 2br5 n THR 30 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 2br5 n ASP 31 N -4.13 4.20 0.00 1.09 5.75 -1.26 -4.99 116.55 117.22 2br5 n ASP 31 Ca -0.40 -3.78 0.00 0.00 -0.01 0.00 0.00 54.79 50.59 2br5 n ASP 31 Cb 0.83 -0.61 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 2br5 n ASP 31 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2br5 n ARG 32 N -0.96 0.00 -2.26 0.11 1.85 -1.26 -5.12 116.66 109.02 2br5 n ARG 32 Ca 0.42 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.92 2br5 n ARG 32 Cb 0.95 0.00 -0.00 0.00 -1.05 0.00 0.00 32.46 32.36 2br5 n ARG 32 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2br5 s PRO 33 N -2.00 3.48 0.32 2.89 0.04 -1.26 -4.81 135.00 133.65 2br5 s PRO 33 Ca 0.00 1.66 0.03 0.00 0.04 0.00 0.00 61.00 62.73 2br5 s PRO 33 Cb 0.00 -2.12 0.55 0.00 0.04 0.00 0.00 34.50 32.97 2br5 s PRO 33 CO 0.00 -0.76 1.86 -0.09 0.04 0.00 0.00 177.00 178.05 2br5 h ARG 34 N 1.45 0.60 -3.82 4.56 2.43 -2.01 -3.37 114.38 114.22 2br5 h ARG 34 Ca -0.50 -0.13 -0.77 0.00 -0.81 0.00 0.00 59.98 57.77 2br5 h ARG 34 Cb 1.26 -0.09 -0.27 0.00 -0.42 0.00 0.00 29.97 30.45 2br5 h ARG 34 CO 0.58 0.60 0.01 -0.51 -1.51 0.00 0.00 179.97 179.14 2br5 s ASP 35 N -6.70 6.50 0.00 -3.80 1.01 -1.26 -5.05 116.67 107.37 2br5 s ASP 35 Ca -0.08 -2.65 -0.30 0.00 0.71 0.00 0.00 52.55 50.23 2br5 s ASP 35 Cb 0.15 -2.16 -0.03 0.00 1.01 0.00 0.00 42.92 41.89 2br5 s ASP 35 CO 0.77 -0.56 1.03 0.86 0.21 0.00 0.00 175.17 177.48 2br5 s TRP 36 N 0.23 3.60 0.34 4.23 -0.11 -1.26 -5.02 118.94 120.95 2br5 s TRP 36 Ca 0.17 1.61 -0.26 0.00 1.22 0.00 0.00 56.10 58.84 2br5 s TRP 36 Cb -0.13 -3.18 -0.09 0.00 -1.50 0.00 0.00 33.47 28.56 2br5 s TRP 36 CO -0.07 -0.28 1.02 -1.25 -4.62 0.00 0.00 176.95 171.75 2br5 s PRO 37 N 1.11 4.42 0.50 5.86 0.04 -1.26 -4.96 135.00 140.71 2br5 s PRO 37 Ca 0.53 1.52 0.29 0.00 0.04 0.00 0.00 61.00 63.38 2br5 s PRO 37 Cb -0.22 -2.79 1.05 0.00 0.04 0.00 0.00 34.50 32.58 2br5 s PRO 37 CO 0.27 0.08 1.87 -0.07 0.04 0.00 0.00 177.00 179.20 2br5 h LEU 38 N 3.04 0.00 -1.57 -3.56 4.07 -1.99 -2.29 115.31 113.01 2br5 h LEU 38 Ca -0.47 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.44 2br5 h LEU 38 Cb 1.21 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.94 2br5 h LEU 38 CO 0.64 0.05 -0.23 -2.24 -1.08 0.00 0.00 178.44 175.59 2br5 h ASP 39 N 0.00 0.00 -0.59 -0.43 -0.00 -2.05 -2.97 116.42 110.38 2br5 h ASP 39 Ca -0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.03 56.71 2br5 h ASP 39 Cb 0.67 0.00 -0.19 0.00 -0.00 0.00 0.00 39.33 39.81 2br5 h ASP 39 CO 0.01 0.23 0.15 0.54 -0.00 0.00 0.00 179.24 180.16 2br5 n ARG 40 N -4.08 2.07 -0.14 4.15 1.74 -0.86 -4.79 116.66 114.74 2br5 n ARG 40 Ca -0.02 -3.19 0.02 0.00 -0.77 0.00 0.00 57.85 53.89 2br5 n ARG 40 Cb 0.30 -1.97 0.31 0.00 -1.02 0.00 0.00 32.46 30.08 2br5 n ARG 40 CO 0.00 0.00 0.00 2.35 -1.52 0.00 0.00 177.63 178.46 2br5 h TRP 41 N 1.10 0.79 -0.42 -1.55 7.01 -1.54 -1.73 115.95 119.60 2br5 h TRP 41 Ca 0.37 0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.34 2br5 h TRP 41 Cb 1.97 -0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 28.74 2br5 h TRP 41 CO 1.23 0.49 0.07 0.00 -2.79 0.00 0.00 178.44 177.43 2br5 h ALA 42 N 1.61 1.33 0.00 2.65 0.00 -1.87 -3.01 119.26 119.96 2br5 h ALA 42 Ca 0.24 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2br5 h ALA 42 Cb -0.07 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2br5 h ALA 42 CO -0.05 0.47 0.00 0.39 0.00 0.00 0.00 179.25 180.06 2br5 n GLU 43 N -4.29 0.49 -2.05 0.00 1.02 -0.65 -4.87 120.64 110.29 2br5 n GLU 43 Ca 0.03 0.03 -0.40 0.00 -0.02 0.00 0.00 57.16 56.79 2br5 n GLU 43 Cb 0.23 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.14 2br5 n GLU 43 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2br5 s ALA 44 N -2.44 3.38 0.45 0.62 0.00 -1.14 -4.98 121.76 117.65 2br5 s ALA 44 Ca 0.29 1.28 -0.24 0.00 0.00 0.00 0.00 51.96 53.29 2br5 s ALA 44 Cb 0.18 -3.49 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 2br5 s ALA 44 CO 0.39 -0.77 1.20 -1.25 0.00 0.00 0.00 175.76 175.33 2br5 s PRO 45 N -2.06 3.78 0.00 0.00 0.04 -1.26 -4.96 135.00 130.55 2br5 s PRO 45 Ca 0.53 1.88 0.22 0.00 0.04 0.00 0.00 61.00 63.67 2br5 s PRO 45 Cb -0.39 -2.49 -0.10 0.00 0.04 0.00 0.00 34.50 31.56 2br5 s PRO 45 CO 0.52 -0.56 1.01 0.54 0.04 0.00 0.00 177.00 178.55 2br5 n ARG 46 N -0.35 0.75 -2.02 4.56 5.12 -1.26 -4.96 116.66 118.50 2br5 n ARG 46 Ca 0.07 -0.61 -0.28 0.00 -1.93 0.00 0.00 57.85 55.09 2br5 n ARG 46 Cb 0.47 -1.48 0.07 0.00 -1.16 0.00 0.00 32.46 30.35 2br5 n ARG 46 CO 0.00 0.00 0.00 0.16 -1.93 0.00 0.00 177.63 175.86 2br5 s ASP 47 N -2.68 4.96 0.31 0.55 1.47 -1.26 -4.99 116.67 115.03 2br5 s ASP 47 Ca 0.14 0.80 0.00 0.00 1.18 0.00 0.00 52.55 54.68 2br5 s ASP 47 Cb 0.17 -1.47 0.49 0.00 -0.34 0.00 0.00 42.92 41.77 2br5 s ASP 47 CO 0.69 -1.58 1.88 0.25 0.68 0.00 0.00 175.17 177.08 2br5 h LEU 48 N -0.74 0.72 0.00 2.11 5.85 -2.03 -3.46 115.31 117.75 2br5 h LEU 48 Ca -0.45 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.16 2br5 h LEU 48 Cb 1.30 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.14 2br5 h LEU 48 CO 0.64 0.67 0.00 0.61 -0.34 0.00 0.00 178.44 180.02 2br5 n GLY 49 N -0.99 2.14 3.35 3.75 0.00 -1.26 -5.00 105.19 107.18 2br5 n GLY 49 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 2br5 n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2br5 s TYR 50 N -2.33 1.02 0.21 1.61 -0.85 -1.26 -4.40 117.35 111.34 2br5 s TYR 50 Ca 0.00 -1.24 -0.30 0.00 -0.52 0.00 0.00 57.07 55.01 2br5 s TYR 50 Cb 0.00 -0.32 -0.08 0.00 0.38 0.00 0.00 41.96 41.93 2br5 s TYR 50 CO 0.00 -0.82 1.20 0.45 -1.52 0.00 0.00 175.55 174.85 2br5 s SER 51 N -3.16 7.08 -0.27 -0.18 0.15 -1.26 -4.93 113.70 111.12 2br5 s SER 51 Ca 0.34 2.28 0.06 0.00 0.70 0.00 0.00 55.95 59.33 2br5 s SER 51 Cb 0.03 -2.61 0.56 0.00 -1.71 0.00 0.00 66.02 62.29 2br5 s SER 51 CO 0.14 -0.36 1.60 -0.90 1.20 0.00 0.00 173.24 174.92 2br5 n ASP 52 N 2.23 4.01 0.27 5.45 5.68 -1.26 -4.62 116.55 128.31 2br5 n ASP 52 Ca 0.03 -3.01 -0.11 0.00 -0.50 0.00 0.00 54.79 51.21 2br5 n ASP 52 Cb 0.44 -0.71 -0.05 0.00 -1.14 0.00 0.00 41.12 39.66 2br5 n ASP 52 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 2br5 h PHE 53 N 1.71 -0.65 -1.63 2.11 -0.00 -2.05 -3.41 116.94 113.03 2br5 h PHE 53 Ca 0.28 -0.02 -0.38 0.00 -0.00 0.00 0.00 57.97 57.85 2br5 h PHE 53 Cb 2.10 0.21 -0.27 0.00 -0.00 0.00 0.00 35.95 37.99 2br5 h PHE 53 CO 1.06 -0.40 -0.76 0.45 -0.00 0.00 0.00 178.31 178.66 2br5 n SER 54 N -4.37 -1.83 -0.67 0.41 2.88 -1.26 -4.98 113.62 103.79 2br5 n SER 54 Ca -0.09 -2.68 0.10 0.00 -1.33 0.00 0.00 58.87 54.88 2br5 n SER 54 Cb 0.28 0.55 0.32 0.00 -0.75 0.00 0.00 64.21 64.60 2br5 n SER 54 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2br5 n PRO 55 N 2.71 1.88 -3.37 -1.46 -0.04 -1.26 -4.95 135.00 128.51 2br5 n PRO 55 Ca 0.23 -1.33 -0.32 0.00 -0.04 0.00 0.00 63.50 62.05 2br5 n PRO 55 Cb 0.53 -1.40 -0.05 0.00 -0.04 0.00 0.00 33.50 32.54 2br5 n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2br5 s TYR 56 N -1.69 3.42 0.31 0.54 1.51 -1.26 -4.99 117.35 115.20 2br5 s TYR 56 Ca 0.32 0.89 0.03 0.00 -1.01 0.00 0.00 57.07 57.30 2br5 s TYR 56 Cb 0.18 -2.28 -0.02 0.00 -0.11 0.00 0.00 41.96 39.73 2br5 s TYR 56 CO 0.26 0.24 0.32 1.14 -1.11 0.00 0.00 175.55 176.40 2br5 s GLN 57 N -2.91 1.72 -0.27 -0.62 -2.07 -1.26 -1.47 119.66 112.79 2br5 s GLN 57 Ca 0.48 -1.87 -0.02 0.00 -1.82 0.00 0.00 55.36 52.13 2br5 s GLN 57 Cb -0.11 0.36 0.16 0.00 -1.09 0.00 0.00 33.01 32.32 2br5 s GLN 57 CO 0.22 -0.66 0.47 -0.46 -1.32 0.00 0.00 175.29 173.54 2br5 s TRP 58 N -3.44 -1.14 -1.41 9.60 -0.11 0.55 -4.69 118.94 118.29 2br5 s TRP 58 Ca 0.37 1.15 -0.10 0.00 1.22 0.00 0.00 56.10 58.74 2br5 s TRP 58 Cb 0.02 0.22 0.06 0.00 -1.50 0.00 0.00 33.47 32.28 2br5 s TRP 58 CO 0.23 -0.80 0.64 0.54 -4.62 0.00 0.00 176.95 172.94 2br5 n ARG 59 N 5.39 -4.23 -0.80 5.86 1.74 -1.26 -1.15 116.66 122.20 2br5 n ARG 59 Ca -0.02 0.60 0.00 0.00 -0.77 0.00 0.00 57.85 57.65 2br5 n ARG 59 Cb 0.50 -5.39 0.00 0.00 -1.02 0.00 0.00 32.46 26.56 2br5 n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2br5 n GLY 60 N -1.38 0.90 3.89 -0.13 0.00 -1.26 -5.04 105.19 102.17 2br5 n GLY 60 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 2br5 n GLY 60 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2br5 s LEU 61 N 0.00 4.21 0.48 0.99 1.43 -0.30 -4.32 118.68 121.16 2br5 s LEU 61 Ca 0.00 0.70 -0.22 0.00 -1.03 0.00 0.00 54.13 53.58 2br5 s LEU 61 Cb 0.00 -3.45 -0.07 0.00 0.03 0.00 0.00 46.19 42.70 2br5 s LEU 61 CO 0.00 -0.02 1.16 -0.13 0.23 0.00 0.00 176.35 177.60 2br5 s ARG 62 N -2.83 3.67 -0.17 1.70 0.52 -1.26 -0.33 118.95 120.25 2br5 s ARG 62 Ca 0.43 1.76 0.00 0.00 -0.52 0.00 0.00 55.73 57.41 2br5 s ARG 62 Cb -0.12 -2.34 0.04 0.00 0.52 0.00 0.00 34.95 33.06 2br5 s ARG 62 CO 0.24 -0.62 -0.09 -1.64 0.02 0.00 0.00 175.30 173.21 2br5 s MET 63 N -2.80 1.83 0.00 3.54 -1.94 -0.54 -3.70 119.30 115.69 2br5 s MET 63 Ca 0.65 -0.62 0.26 0.00 -1.71 0.00 0.00 55.69 54.27 2br5 s MET 63 Cb -0.28 -2.14 0.62 0.00 2.01 0.00 0.00 34.83 35.04 2br5 s MET 63 CO 0.34 -0.38 1.49 1.28 -0.01 0.00 0.00 175.02 177.74 2br5 n LEU 64 N 4.79 0.68 -4.56 -0.03 4.77 -1.26 -4.21 117.00 117.19 2br5 n LEU 64 Ca -0.14 -0.09 -0.41 0.00 -0.03 0.00 0.00 56.01 55.34 2br5 n LEU 64 Cb 0.48 -0.20 -0.08 0.00 -2.33 0.00 0.00 43.42 41.28 2br5 n LEU 64 CO 0.19 0.15 0.16 -0.54 -1.33 0.00 0.00 177.39 176.01 2br5 s LYS 65 N -2.81 3.64 0.82 3.23 1.02 -1.26 -5.07 119.74 119.32 2br5 s LYS 65 Ca 0.16 -0.21 -0.12 0.00 0.02 0.00 0.00 55.97 55.82 2br5 s LYS 65 Cb 0.18 -3.79 0.09 0.00 -0.52 0.00 0.00 37.83 33.79 2br5 s LYS 65 CO 0.63 -0.57 1.17 0.16 -0.92 0.00 0.00 175.35 175.82 2br5 s ASP 66 N 1.74 4.36 0.52 2.83 1.47 -1.26 -4.69 116.67 121.64 2br5 s ASP 66 Ca 0.16 0.80 0.19 0.00 1.18 0.00 0.00 52.55 54.89 2br5 s ASP 66 Cb -0.16 -1.31 1.31 0.00 -0.34 0.00 0.00 42.92 42.43 2br5 s ASP 66 CO 0.12 -2.00 2.10 1.55 0.68 0.00 0.00 175.17 177.62 2br5 h PRO 67 N -1.12 0.00 -0.20 2.11 0.13 -1.97 -1.63 132.00 129.31 2br5 h PRO 67 Ca -0.47 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 2br5 h PRO 67 Cb 1.33 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 2br5 h PRO 67 CO 0.65 0.00 -0.10 -0.44 -0.23 0.00 0.00 178.00 177.88 2br5 h ASP 68 N 0.00 0.44 -0.81 1.44 5.19 -1.93 -2.22 116.42 118.53 2br5 h ASP 68 Ca 0.09 -0.41 0.11 0.00 -0.62 0.00 0.00 57.03 56.19 2br5 h ASP 68 Cb 0.35 -0.12 -0.08 0.00 0.18 0.00 0.00 39.33 39.66 2br5 h ASP 68 CO -0.00 0.76 0.44 0.74 -3.12 0.00 0.00 179.24 178.06 2br5 h THR 69 N 0.13 0.84 -0.42 0.35 2.02 -1.62 -2.27 112.91 111.94 2br5 h THR 69 Ca 0.04 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 2br5 h THR 69 Cb 0.60 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 2br5 h THR 69 CO 0.03 0.13 0.17 1.56 0.37 0.00 0.00 175.52 177.78 2br5 h GLN 70 N 0.71 0.59 -0.28 6.66 4.20 -0.96 -1.28 115.11 124.76 2br5 h GLN 70 Ca 0.41 -0.08 -0.14 0.00 0.06 0.00 0.00 58.65 58.91 2br5 h GLN 70 Cb 0.45 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 2br5 h GLN 70 CO -0.29 0.49 -0.39 0.00 -0.67 0.00 0.00 178.83 177.98 2br5 h ALA 71 N 1.59 0.80 0.30 3.87 0.00 -0.85 -0.81 119.26 124.16 2br5 h ALA 71 Ca 0.15 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2br5 h ALA 71 Cb 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2br5 h ALA 71 CO -0.01 0.65 -0.14 0.28 0.00 0.00 0.00 179.25 180.02 2br5 h VAL 72 N 0.54 0.72 -0.21 0.00 2.07 -1.03 -2.08 116.25 116.26 2br5 h VAL 72 Ca 0.05 -0.59 0.06 0.00 0.82 0.00 0.00 66.70 67.04 2br5 h VAL 72 Cb 0.91 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2br5 h VAL 72 CO 0.08 0.11 0.20 1.88 0.02 0.00 0.00 177.57 179.87 2br5 h TYR 73 N -0.73 0.00 -0.07 1.57 -1.99 -1.20 -0.16 116.97 114.39 2br5 h TYR 73 Ca -0.04 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.65 2br5 h TYR 73 Cb 0.49 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.22 2br5 h TYR 73 CO 0.02 0.00 -0.12 1.25 -0.00 0.00 0.00 178.16 179.31 2br5 h HIS 74 N 0.00 0.27 -0.67 4.88 2.76 -0.98 -0.77 115.15 120.64 2br5 h HIS 74 Ca 0.10 -0.09 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 2br5 h HIS 74 Cb 0.50 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.38 2br5 h HIS 74 CO 0.00 0.71 0.38 -0.44 -1.30 0.00 0.00 177.93 177.28 2br5 h ASP 75 N -0.25 0.82 -0.44 3.26 5.19 -0.65 -1.45 116.42 122.90 2br5 h ASP 75 Ca 0.01 -0.08 -0.11 0.00 -0.62 0.00 0.00 57.03 56.22 2br5 h ASP 75 Cb 0.69 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.97 2br5 h ASP 75 CO 0.03 0.67 -0.15 -0.03 -3.12 0.00 0.00 179.24 176.64 2br5 h MET 76 N 0.91 0.92 -0.42 3.56 4.05 -1.05 -1.59 114.93 121.32 2br5 h MET 76 Ca 0.24 -0.35 -0.13 0.00 -0.28 0.00 0.00 59.70 59.17 2br5 h MET 76 Cb 0.02 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.75 2br5 h MET 76 CO -0.04 1.00 -0.26 -0.07 0.23 0.00 0.00 176.91 177.77 2br5 h LEU 77 N 0.81 0.91 -0.29 3.39 4.07 -0.98 -0.72 115.31 122.49 2br5 h LEU 77 Ca 0.12 -0.36 -0.04 0.00 0.08 0.00 0.00 57.88 57.68 2br5 h LEU 77 Cb 0.69 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.17 2br5 h LEU 77 CO 0.05 1.11 0.01 -0.25 -1.08 0.00 0.00 178.44 178.29 2br5 h TRP 78 N 0.75 0.55 0.40 1.13 2.91 -1.03 0.75 115.95 121.40 2br5 h TRP 78 Ca 0.09 -0.09 -0.02 0.00 1.13 0.00 0.00 58.89 60.00 2br5 h TRP 78 Cb 0.82 -0.14 0.00 0.00 -0.51 0.00 0.00 29.16 29.33 2br5 h TRP 78 CO 0.05 0.64 -0.19 1.49 -1.03 0.00 0.00 178.44 179.39 2br5 h GLU 79 N 0.30 -0.51 -0.09 2.65 4.81 -1.29 -3.35 114.58 117.10 2br5 h GLU 79 Ca 0.08 0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 59.16 2br5 h GLU 79 Cb 0.41 0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.90 2br5 h GLU 79 CO 0.01 -0.21 -0.73 1.25 -0.73 0.00 0.00 179.01 178.60 2br5 h LEU 80 N -1.00 0.53 -3.17 1.64 6.46 -1.19 -3.48 115.31 115.10 2br5 h LEU 80 Ca -0.05 -0.35 -0.32 0.00 -0.12 0.00 0.00 57.88 57.04 2br5 h LEU 80 Cb 0.53 -0.16 0.03 0.00 -0.73 0.00 0.00 40.66 40.33 2br5 h LEU 80 CO 0.09 1.09 -0.71 0.54 -0.62 0.00 0.00 178.44 178.83 2br5 n ARG 81 N -3.85 -1.35 -2.04 1.25 1.74 0.25 -4.84 116.66 107.82 2br5 n ARG 81 Ca -0.05 0.89 -0.41 0.00 -0.77 0.00 0.00 57.85 57.51 2br5 n ARG 81 Cb 0.71 -3.92 -0.02 0.00 -1.02 0.00 0.00 32.46 28.21 2br5 n ARG 81 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2br5 s PRO 82 N -4.69 4.29 0.26 5.56 0.04 -1.26 -4.64 135.00 134.56 2br5 s PRO 82 Ca 0.15 2.29 0.14 0.00 0.04 0.00 0.00 61.00 63.62 2br5 s PRO 82 Cb -0.06 -3.08 0.03 0.00 0.04 0.00 0.00 34.50 31.44 2br5 s PRO 82 CO 0.84 -0.32 1.42 0.00 0.04 0.00 0.00 177.00 178.99 2br5 h ARG 83 N 4.00 0.00 -3.67 4.56 -0.00 -0.55 -3.39 114.38 115.32 2br5 h ARG 83 Ca -0.48 0.00 -0.20 0.00 -0.50 0.00 0.00 59.98 58.80 2br5 h ARG 83 Cb 1.22 0.00 -0.26 0.00 0.00 0.00 0.00 29.97 30.94 2br5 h ARG 83 CO 0.70 0.57 -0.66 0.99 0.00 0.00 0.00 179.97 181.57 2br5 s THR 84 N -2.93 0.03 -0.07 2.04 2.01 -0.80 -1.36 115.64 114.56 2br5 s THR 84 Ca 0.04 -0.22 0.03 0.00 0.31 0.00 0.00 61.69 61.85 2br5 s THR 84 Cb 0.08 -0.14 0.01 0.00 0.01 0.00 0.00 72.50 72.46 2br5 s THR 84 CO 0.75 -0.12 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.78 2br5 s ILE 85 N -0.35 1.39 -0.32 1.82 1.01 -0.07 -1.55 121.20 123.13 2br5 s ILE 85 Ca -0.04 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 59.98 2br5 s ILE 85 Cb -0.03 -1.23 0.08 0.00 0.01 0.00 0.00 42.46 41.29 2br5 s ILE 85 CO -0.00 0.41 0.02 -0.69 0.00 0.00 0.00 174.94 174.67 2br5 s VAL 86 N 0.45 2.63 0.06 2.92 1.01 0.65 0.13 120.40 128.26 2br5 s VAL 86 Ca -0.13 -1.82 -0.26 0.00 0.00 0.00 0.00 61.98 59.78 2br5 s VAL 86 Cb -0.15 -2.68 -0.06 0.00 0.00 0.00 0.00 36.38 33.49 2br5 s VAL 86 CO 0.04 -0.31 0.79 -1.61 0.00 0.00 0.00 175.10 174.02 2br5 s GLU 87 N 1.10 4.53 -0.29 2.72 0.41 0.59 -0.64 118.70 127.12 2br5 s GLU 87 Ca 0.00 1.12 -0.05 0.00 -0.41 0.00 0.00 54.97 55.64 2br5 s GLU 87 Cb -0.20 -3.36 0.02 0.00 -1.78 0.00 0.00 34.13 28.81 2br5 s GLU 87 CO -0.04 0.30 0.04 -1.17 -0.49 0.00 0.00 175.26 173.90 2br5 s LEU 88 N -0.15 3.76 0.00 1.80 0.20 -0.21 -1.58 118.68 122.50 2br5 s LEU 88 Ca 0.39 -0.85 0.00 0.00 0.69 0.00 0.00 54.13 54.36 2br5 s LEU 88 Cb -0.21 -1.81 0.00 0.00 -0.43 0.00 0.00 46.19 43.74 2br5 s LEU 88 CO 0.24 -0.20 0.00 0.61 -0.29 0.00 0.00 176.35 176.71 2br5 n GLY 89 N 4.79 -1.57 0.13 7.98 0.00 0.04 -1.44 105.19 115.13 2br5 n GLY 89 Ca -0.15 -0.59 -0.18 0.00 0.00 0.00 0.00 46.02 45.10 2br5 n GLY 89 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2br5 n VAL 90 N 0.50 1.59 0.00 1.61 0.31 -1.23 -4.77 118.33 116.34 2br5 n VAL 90 Ca 0.00 -0.63 0.00 0.00 -0.01 0.00 0.00 64.34 63.70 2br5 n VAL 90 Cb 0.00 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 2br5 n VAL 90 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2br5 n TYR 91 N -3.29 0.00 0.24 3.52 9.36 -1.26 -2.15 117.16 123.58 2br5 n TYR 91 Ca -0.39 0.00 0.10 0.00 3.32 0.00 0.00 57.90 60.93 2br5 n TYR 91 Cb 1.02 0.00 -0.15 0.00 -0.63 0.00 0.00 39.34 39.58 2br5 n TYR 91 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 2br5 n ASN 92 N 8.00 0.40 0.00 2.98 6.94 -1.26 -2.73 115.26 129.59 2br5 n ASN 92 Ca 0.00 -0.26 0.00 0.00 -0.02 0.00 0.00 54.58 54.30 2br5 n ASN 92 Cb 0.00 1.71 0.00 0.00 -2.36 0.00 0.00 39.78 39.13 2br5 n ASN 92 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2br5 n GLY 93 N 1.36 0.55 0.27 4.83 0.00 -0.91 -0.53 105.19 110.75 2br5 n GLY 93 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 2br5 n GLY 93 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2br5 h GLY 94 N 0.00 -0.50 1.85 -0.02 0.00 -1.78 -2.31 103.07 100.31 2br5 h GLY 94 Ca 0.00 0.28 -0.14 0.00 0.00 0.00 0.00 47.33 47.46 2br5 h GLY 94 CO 0.00 -0.22 -0.63 1.48 0.00 0.00 0.00 176.54 177.18 2br5 h SER 95 N -0.48 0.18 -0.34 0.19 4.64 -1.87 -0.40 113.55 115.47 2br5 h SER 95 Ca 0.01 -0.11 0.07 0.00 -0.47 0.00 0.00 61.79 61.30 2br5 h SER 95 Cb 0.47 -0.05 -0.08 0.00 -0.31 0.00 0.00 62.40 62.43 2br5 h SER 95 CO -0.08 0.76 -0.27 -0.07 -0.87 0.00 0.00 176.83 176.30 2br5 h LEU 96 N 0.11 -0.88 -0.72 5.97 4.07 -1.88 0.16 115.31 122.15 2br5 h LEU 96 Ca -0.01 0.16 -0.09 0.00 0.08 0.00 0.00 57.88 58.02 2br5 h LEU 96 Cb 1.13 0.42 -0.02 0.00 1.08 0.00 0.00 40.66 43.27 2br5 h LEU 96 CO 0.09 -0.29 -0.03 0.00 -1.08 0.00 0.00 178.44 177.13 2br5 h ALA 97 N 0.85 0.92 -0.22 1.53 0.00 -1.05 -1.65 119.26 119.65 2br5 h ALA 97 Ca 0.17 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2br5 h ALA 97 Cb 0.49 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2br5 h ALA 97 CO -0.47 0.64 0.14 2.35 0.00 0.00 0.00 179.25 181.91 2br5 h TRP 98 N 0.87 0.27 -0.62 0.00 7.01 -0.69 0.29 115.95 123.07 2br5 h TRP 98 Ca 0.15 0.01 -0.07 0.00 2.11 0.00 0.00 58.89 61.09 2br5 h TRP 98 Cb 0.56 -0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 27.50 2br5 h TRP 98 CO 0.03 0.17 0.12 0.74 -2.79 0.00 0.00 178.44 176.71 2br5 h PHE 99 N 0.29 1.05 -0.21 2.65 0.05 -0.50 -1.14 116.94 119.13 2br5 h PHE 99 Ca 0.08 -0.13 -0.19 0.00 3.82 0.00 0.00 57.97 61.55 2br5 h PHE 99 Cb -0.03 -0.30 0.01 0.00 2.00 0.00 0.00 35.95 37.63 2br5 h PHE 99 CO -0.06 0.88 -0.62 -0.09 -0.18 0.00 0.00 178.31 178.24 2br5 h ARG 100 N 0.95 0.79 -0.22 1.51 1.12 -1.01 -2.29 114.38 115.24 2br5 h ARG 100 Ca 0.19 -0.57 -0.05 0.00 -1.11 0.00 0.00 59.98 58.44 2br5 h ARG 100 Cb 0.39 0.10 -0.01 0.00 -0.01 0.00 0.00 29.97 30.43 2br5 h ARG 100 CO 0.01 1.19 -0.06 -0.44 -3.11 0.00 0.00 179.97 177.56 2br5 h ASP 101 N 0.54 0.42 -0.58 -3.80 3.32 -0.86 -1.71 116.42 113.75 2br5 h ASP 101 Ca -0.02 -0.37 -0.03 0.00 0.02 0.00 0.00 57.03 56.63 2br5 h ASP 101 Cb 1.24 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.65 2br5 h ASP 101 CO 0.13 0.69 0.24 -0.07 -1.72 0.00 0.00 179.24 178.52 2br5 h LEU 102 N 0.15 0.82 -0.40 1.55 3.38 -1.23 -1.94 115.31 117.63 2br5 h LEU 102 Ca 0.05 -0.11 -0.18 0.00 0.09 0.00 0.00 57.88 57.73 2br5 h LEU 102 Cb 0.51 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2br5 h LEU 102 CO 0.02 0.73 -0.67 0.71 0.09 0.00 0.00 178.44 179.32 2br5 h THR 103 N 0.88 1.34 -0.95 0.22 1.35 -1.32 -2.76 112.91 111.67 2br5 h THR 103 Ca 0.21 -1.99 0.05 0.00 -0.55 0.00 0.00 66.41 64.12 2br5 h THR 103 Cb 0.17 1.97 -0.06 0.00 -1.73 0.00 0.00 68.15 68.50 2br5 h THR 103 CO -0.02 0.61 0.62 0.50 -0.25 0.00 0.00 175.52 176.98 2br5 h LYS 104 N 0.37 1.13 0.00 4.72 3.64 -0.89 0.17 116.57 125.72 2br5 h LYS 104 Ca -0.02 -0.07 -0.17 0.00 -1.27 0.00 0.00 60.65 59.12 2br5 h LYS 104 Cb 1.25 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 32.79 2br5 h LYS 104 CO 0.12 0.75 -0.80 0.82 -2.27 0.00 0.00 179.45 178.07 2br5 h ILE 105 N 1.17 1.50 -0.00 2.00 2.04 -1.17 -2.48 117.51 120.57 2br5 h ILE 105 Ca 0.39 -2.81 0.00 0.00 1.00 0.00 0.00 64.86 63.45 2br5 h ILE 105 Cb 0.06 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 2br5 h ILE 105 CO -0.14 0.78 0.00 0.23 0.00 0.00 0.00 178.15 179.02 2br5 n MET 106 N -3.48 1.03 -2.06 2.37 2.81 -1.06 -4.90 117.12 111.82 2br5 n MET 106 Ca -0.00 -0.04 -0.09 0.00 -1.81 0.00 0.00 57.70 55.76 2br5 n MET 106 Cb 0.80 -1.47 -0.01 0.00 -0.71 0.00 0.00 33.22 31.83 2br5 n MET 106 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2br5 n GLY 107 N 0.98 0.12 3.67 3.03 0.00 -0.93 -5.02 105.19 107.05 2br5 n GLY 107 Ca 0.23 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 2br5 n GLY 107 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2br5 s ILE 108 N -2.44 5.36 -1.01 -0.61 1.01 0.55 -5.01 121.20 119.05 2br5 s ILE 108 Ca 0.00 0.21 -0.22 0.00 0.00 0.00 0.00 60.65 60.65 2br5 s ILE 108 Cb 0.00 -3.51 0.07 0.00 0.01 0.00 0.00 42.46 39.04 2br5 s ILE 108 CO 0.00 0.36 1.38 -0.62 0.00 0.00 0.00 174.94 176.06 2br5 s ASP 109 N 0.92 6.56 -0.10 3.58 2.15 -1.26 -4.12 116.67 124.38 2br5 s ASP 109 Ca 0.08 -1.67 0.03 0.00 0.43 0.00 0.00 52.55 51.42 2br5 s ASP 109 Cb -0.13 -2.52 -0.01 0.00 -0.30 0.00 0.00 42.92 39.96 2br5 s ASP 109 CO 0.03 -1.37 -0.20 0.00 -0.17 0.00 0.00 175.17 173.47 2br5 s GLN 111 N 0.23 4.17 -0.21 0.00 2.00 -0.46 -4.93 119.66 120.46 2br5 s GLN 111 Ca -0.13 0.51 -0.12 0.00 -2.00 0.00 0.00 55.36 53.62 2br5 s GLN 111 Cb -0.16 -3.59 -0.05 0.00 0.80 0.00 0.00 33.01 30.01 2br5 s GLN 111 CO 0.07 -0.24 0.20 0.08 -0.50 0.00 0.00 175.29 174.90 2br5 s VAL 112 N 1.94 5.35 -0.17 1.34 1.01 -0.75 -0.89 120.40 128.23 2br5 s VAL 112 Ca 0.26 0.32 0.01 0.00 0.00 0.00 0.00 61.98 62.56 2br5 s VAL 112 Cb -0.16 -3.54 0.03 0.00 0.00 0.00 0.00 36.38 32.71 2br5 s VAL 112 CO 0.10 0.37 -0.12 -0.63 0.00 0.00 0.00 175.10 174.82 2br5 s ILE 113 N 0.74 1.61 -0.19 2.22 1.01 0.12 -2.14 121.20 124.57 2br5 s ILE 113 Ca 0.11 -0.82 -0.08 0.00 0.00 0.00 0.00 60.65 59.86 2br5 s ILE 113 Cb -0.13 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 2br5 s ILE 113 CO 0.03 0.32 0.07 -0.83 0.00 0.00 0.00 174.94 174.53 2br5 s GLY 114 N 1.44 1.91 0.04 6.18 0.00 -0.13 -0.30 107.32 116.46 2br5 s GLY 114 Ca 0.02 -0.77 0.07 0.00 0.00 0.00 0.00 44.72 44.04 2br5 s GLY 114 CO -0.10 0.10 -0.16 -0.42 0.00 0.00 0.00 173.10 172.52 2br5 s ILE 115 N 0.45 2.96 -0.15 0.90 1.01 -0.61 -0.73 121.20 125.03 2br5 s ILE 115 Ca 0.04 -1.15 -0.30 0.00 0.00 0.00 0.00 60.65 59.24 2br5 s ILE 115 Cb -0.12 -2.27 0.12 0.00 0.01 0.00 0.00 42.46 40.20 2br5 s ILE 115 CO 0.00 0.32 0.97 -0.62 0.00 0.00 0.00 174.94 175.61 2br5 s ASP 116 N -1.53 -0.39 0.27 3.58 -1.08 -0.50 -0.78 116.67 116.24 2br5 s ASP 116 Ca 0.16 0.42 -0.02 0.00 -0.52 0.00 0.00 52.55 52.59 2br5 s ASP 116 Cb -0.11 0.32 0.58 0.00 -1.46 0.00 0.00 42.92 42.26 2br5 s ASP 116 CO 0.06 -0.37 1.67 0.03 0.52 0.00 0.00 175.17 177.09 2br5 h ARG 117 N 2.59 0.25 -1.96 4.34 3.08 -1.74 0.46 114.38 121.40 2br5 h ARG 117 Ca -0.19 -0.01 -0.32 0.00 0.07 0.00 0.00 59.98 59.52 2br5 h ARG 117 Cb 1.16 -0.06 -0.31 0.00 0.08 0.00 0.00 29.97 30.84 2br5 h ARG 117 CO 0.32 0.16 -0.64 0.34 -1.07 0.00 0.00 179.97 179.08 2br5 s ASP 118 N -5.18 1.16 0.00 7.04 2.15 -1.26 -4.46 116.67 116.12 2br5 s ASP 118 Ca -0.12 -1.12 0.28 0.00 0.43 0.00 0.00 52.55 52.01 2br5 s ASP 118 Cb 0.23 0.65 1.03 0.00 -0.30 0.00 0.00 42.92 44.54 2br5 s ASP 118 CO 0.76 -0.31 1.73 0.18 -0.17 0.00 0.00 175.17 177.36 2br5 n LEU 119 N 4.76 1.52 0.32 -1.34 4.77 -1.26 -3.96 117.00 121.81 2br5 n LEU 119 Ca 0.05 -0.52 0.21 0.00 -0.03 0.00 0.00 56.01 55.73 2br5 n LEU 119 Cb 0.46 -0.01 1.06 0.00 -2.33 0.00 0.00 43.42 42.60 2br5 n LEU 119 CO 0.04 0.26 1.13 0.77 -1.33 0.00 0.00 177.39 178.26 2br5 h SER 120 N 2.36 0.00 0.72 -1.43 4.64 -1.93 -2.03 113.55 115.87 2br5 h SER 120 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2br5 h SER 120 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2br5 h SER 120 CO 0.00 0.00 -0.34 0.54 -0.87 0.00 0.00 176.83 176.16 2br5 n ARG 121 N -3.08 0.03 -2.02 4.77 3.00 -1.25 -4.90 116.66 113.21 2br5 n ARG 121 Ca -0.02 0.01 -0.41 0.00 -0.01 0.00 0.00 57.85 57.42 2br5 n ARG 121 Cb 0.14 -1.53 -0.02 0.00 0.00 0.00 0.00 32.46 31.06 2br5 n ARG 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2br5 n GLN 123 N 1.77 2.32 -2.64 0.00 1.13 0.31 -4.99 117.38 115.29 2br5 n GLN 123 Ca 0.04 -1.33 -0.42 0.00 -1.94 0.00 0.00 57.00 53.35 2br5 n GLN 123 Cb 0.41 -1.00 -0.03 0.00 0.11 0.00 0.00 30.24 29.73 2br5 n GLN 123 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2br5 s ILE 124 N -0.83 4.66 0.28 5.09 1.01 -1.26 -4.98 121.20 125.17 2br5 s ILE 124 Ca 0.00 1.94 -0.28 0.00 0.00 0.00 0.00 60.65 62.31 2br5 s ILE 124 Cb 0.00 -4.25 -0.15 0.00 0.01 0.00 0.00 42.46 38.08 2br5 s ILE 124 CO 0.00 -0.00 0.91 -2.65 0.00 0.00 0.00 174.94 173.19 2br5 n PRO 125 N 5.10 1.07 0.23 2.79 -0.02 -1.26 -4.80 135.00 138.12 2br5 n PRO 125 Ca 0.09 0.38 0.16 0.00 -2.02 0.00 0.00 63.50 62.11 2br5 n PRO 125 Cb 0.48 -1.67 0.80 0.00 -0.02 0.00 0.00 33.50 33.09 2br5 n PRO 125 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2br5 h ALA 126 N 1.77 1.00 0.00 3.55 0.00 -2.02 -1.21 119.26 122.35 2br5 h ALA 126 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2br5 h ALA 126 Cb 1.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2br5 h ALA 126 CO 0.60 0.00 -0.94 -1.13 0.00 0.00 0.00 179.25 177.77 2br5 n SER 127 N -2.64 0.72 -2.09 0.00 3.41 -1.26 -4.26 113.62 107.49 2br5 n SER 127 Ca -0.01 0.14 -0.26 0.00 -0.26 0.00 0.00 58.87 58.49 2br5 n SER 127 Cb 0.11 0.50 0.13 0.00 -0.26 0.00 0.00 64.21 64.70 2br5 n SER 127 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2br5 n ASP 128 N -2.35 5.27 -0.12 4.04 2.03 -0.46 -4.57 116.55 120.39 2br5 n ASP 128 Ca 0.01 -3.73 0.01 0.00 0.52 0.00 0.00 54.79 51.61 2br5 n ASP 128 Cb 0.50 -0.82 0.03 0.00 -0.72 0.00 0.00 41.12 40.11 2br5 n ASP 128 CO 0.00 0.00 0.00 0.80 -1.92 0.00 0.00 177.20 176.08 2br5 n MET 129 N -1.01 2.59 -1.70 -0.67 1.56 -1.25 -4.85 117.12 111.79 2br5 n MET 129 Ca 0.56 -1.51 -0.39 0.00 -0.27 0.00 0.00 57.70 56.09 2br5 n MET 129 Cb 1.10 -1.05 0.03 0.00 2.15 0.00 0.00 33.22 35.45 2br5 n MET 129 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 2br5 n GLU 130 N -0.26 1.59 -1.61 2.12 2.13 -1.26 -2.28 120.64 121.07 2br5 n GLU 130 Ca 0.02 0.58 -0.18 0.00 0.66 0.00 0.00 57.16 58.24 2br5 n GLU 130 Cb 0.26 -2.41 -0.07 0.00 0.27 0.00 0.00 31.44 29.49 2br5 n GLU 130 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2br5 n ASN 131 N -0.50 -4.87 -4.22 4.31 3.02 -1.26 -4.97 115.26 106.78 2br5 n ASN 131 Ca 0.10 0.42 -0.25 0.00 -0.03 0.00 0.00 54.58 54.82 2br5 n ASN 131 Cb 0.43 -4.33 -0.14 0.00 -0.61 0.00 0.00 39.78 35.13 2br5 n ASN 131 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2br5 s ILE 132 N -2.58 1.53 -0.03 2.41 1.01 -0.97 -1.81 121.20 120.76 2br5 s ILE 132 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 60.65 59.61 2br5 s ILE 132 Cb 0.00 -1.32 0.03 0.00 0.01 0.00 0.00 42.46 41.18 2br5 s ILE 132 CO 0.00 0.24 -0.01 -0.89 0.00 0.00 0.00 174.94 174.28 2br5 s THR 133 N -0.70 0.23 0.09 2.92 2.01 -0.91 -5.00 115.64 114.29 2br5 s THR 133 Ca 0.07 0.06 0.01 0.00 0.31 0.00 0.00 61.69 62.14 2br5 s THR 133 Cb -0.08 -0.32 -0.04 0.00 0.01 0.00 0.00 72.50 72.07 2br5 s THR 133 CO 0.01 0.16 0.20 -0.76 -0.69 0.00 0.00 174.62 173.54 2br5 s LEU 134 N 1.03 4.21 -0.10 4.42 1.02 -1.26 -0.96 118.68 127.04 2br5 s LEU 134 Ca -0.10 0.17 -0.04 0.00 0.02 0.00 0.00 54.13 54.19 2br5 s LEU 134 Cb -0.14 -2.82 0.05 0.00 0.02 0.00 0.00 46.19 43.30 2br5 s LEU 134 CO -0.01 0.14 0.18 -1.00 0.02 0.00 0.00 176.35 175.67 2br5 s HIS 135 N -1.56 -0.22 0.22 0.29 3.76 0.09 -4.94 115.29 112.93 2br5 s HIS 135 Ca 0.34 0.62 -0.26 0.00 -0.15 0.00 0.00 55.06 55.61 2br5 s HIS 135 Cb -0.12 -0.24 -0.09 0.00 1.11 0.00 0.00 32.58 33.24 2br5 s HIS 135 CO 0.27 -0.32 0.83 -0.65 -0.85 0.00 0.00 174.74 174.03 2br5 s GLN 136 N 2.31 4.60 0.00 1.40 -0.21 -1.26 -1.41 119.66 125.10 2br5 s GLN 136 Ca 0.03 1.22 0.00 0.00 0.02 0.00 0.00 55.36 56.64 2br5 s GLN 136 Cb -0.12 -3.14 0.00 0.00 1.00 0.00 0.00 33.01 30.74 2br5 s GLN 136 CO -0.07 0.49 0.00 0.41 -2.12 0.00 0.00 175.29 174.00 2br5 n GLY 137 N 1.29 3.12 3.81 3.09 0.00 0.15 -4.90 105.19 111.75 2br5 n GLY 137 Ca -0.03 -0.45 -0.36 0.00 0.00 0.00 0.00 46.02 45.18 2br5 n GLY 137 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2br5 s ASP 138 N 0.00 6.35 0.46 1.61 -1.08 -1.26 -2.17 116.67 120.58 2br5 s ASP 138 Ca 0.00 0.41 0.14 0.00 -0.52 0.00 0.00 52.55 52.58 2br5 s ASP 138 Cb 0.00 -2.10 1.06 0.00 -1.46 0.00 0.00 42.92 40.42 2br5 s ASP 138 CO 0.00 0.29 2.04 0.00 0.52 0.00 0.00 175.17 178.03 2br5 h SER 140 N 0.08 0.00 -3.53 0.00 4.64 -1.94 -3.39 113.55 109.40 2br5 h SER 140 Ca 0.02 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.92 2br5 h SER 140 Cb 0.18 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 61.94 2br5 h SER 140 CO 0.01 0.00 -0.78 -0.62 -0.87 0.00 0.00 176.83 174.57 2br5 s ASP 141 N -5.14 1.02 0.15 4.97 2.15 -1.19 -5.00 116.67 113.64 2br5 s ASP 141 Ca -0.04 -0.15 0.19 0.00 0.43 0.00 0.00 52.55 52.98 2br5 s ASP 141 Cb 0.15 -0.45 0.81 0.00 -0.30 0.00 0.00 42.92 43.13 2br5 s ASP 141 CO 0.54 -0.02 1.58 0.18 -0.17 0.00 0.00 175.17 177.29 2br5 n LEU 142 N 3.83 0.37 0.30 -1.34 4.77 -1.26 -2.92 117.00 120.75 2br5 n LEU 142 Ca -0.24 0.60 0.16 0.00 -0.03 0.00 0.00 56.01 56.50 2br5 n LEU 142 Cb 0.52 -0.55 0.94 0.00 -2.33 0.00 0.00 43.42 42.00 2br5 n LEU 142 CO 0.24 -0.45 1.11 0.71 -1.33 0.00 0.00 177.39 177.67 2br5 h THR 143 N 0.00 0.42 -0.66 -5.08 1.35 -1.94 0.29 112.91 107.29 2br5 h THR 143 Ca 0.00 -0.11 0.17 0.00 -0.55 0.00 0.00 66.41 65.93 2br5 h THR 143 Cb 0.29 1.07 -0.03 0.00 -1.73 0.00 0.00 68.15 67.75 2br5 h THR 143 CO 0.00 0.02 0.46 0.74 -0.25 0.00 0.00 175.52 176.49 2br5 h THR 144 N 0.00 0.71 0.00 6.82 2.02 -1.78 -2.08 112.91 118.61 2br5 h THR 144 Ca -0.00 -0.03 -0.12 0.00 0.77 0.00 0.00 66.41 67.02 2br5 h THR 144 Cb 0.07 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 2br5 h THR 144 CO 0.00 0.02 -2.08 0.49 0.37 0.00 0.00 175.52 174.32 2br5 n PHE 145 N -4.38 0.00 -0.14 3.16 3.01 0.96 -4.24 117.46 115.83 2br5 n PHE 145 Ca 0.13 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.48 2br5 n PHE 145 Cb 0.66 -0.64 -0.01 0.00 -0.01 0.00 0.00 39.48 39.47 2br5 n PHE 145 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2br5 h GLU 146 N 0.00 0.79 -0.97 -1.08 3.07 -1.17 -3.28 114.58 111.95 2br5 h GLU 146 Ca -0.19 -0.29 0.06 0.00 -0.50 0.00 0.00 59.36 58.44 2br5 h GLU 146 Cb 1.39 -0.05 -0.06 0.00 -0.84 0.00 0.00 28.75 29.19 2br5 h GLU 146 CO 0.01 0.91 0.62 0.45 -1.40 0.00 0.00 179.01 179.60 2br5 h HIS 147 N 0.62 1.16 -3.87 4.33 3.86 -1.57 -3.43 115.15 116.24 2br5 h HIS 147 Ca 0.11 0.03 -0.50 0.00 -1.16 0.00 0.00 60.37 58.85 2br5 h HIS 147 Cb 0.60 -0.38 0.05 0.00 1.06 0.00 0.00 27.41 28.73 2br5 h HIS 147 CO 0.05 0.62 0.23 -0.48 0.86 0.00 0.00 177.93 179.21 2br5 s LEU 148 N -10.17 3.45 0.00 2.43 0.05 -1.24 -5.06 118.68 108.14 2br5 s LEU 148 Ca -0.13 1.09 0.00 0.00 0.05 0.00 0.00 54.13 55.15 2br5 s LEU 148 Cb 0.19 -4.07 0.00 0.00 -2.05 0.00 0.00 46.19 40.26 2br5 s LEU 148 CO 0.81 -0.72 0.00 -1.14 -0.55 0.00 0.00 176.35 174.75 2br5 n ARG 149 N -2.47 0.00 -0.05 1.48 0.00 -1.26 -4.98 116.66 109.38 2br5 n ARG 149 Ca 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 57.85 57.86 2br5 n ARG 149 Cb 0.55 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 33.00 2br5 n ARG 149 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2br5 n GLU 150 N 0.00 0.00 -4.03 -0.14 1.02 -1.26 -4.93 120.64 111.30 2br5 n GLU 150 Ca 0.00 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.78 2br5 n GLU 150 Cb 0.00 -0.05 -0.08 0.00 -0.02 0.00 0.00 31.44 31.29 2br5 n GLU 150 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2br5 s MET 151 N 0.27 3.47 0.82 3.49 -1.94 -1.26 -5.10 119.30 119.04 2br5 s MET 151 Ca 0.04 -0.25 -0.11 0.00 -1.71 0.00 0.00 55.69 53.66 2br5 s MET 151 Cb -0.04 -3.10 0.08 0.00 2.01 0.00 0.00 34.83 33.78 2br5 s MET 151 CO 0.02 0.63 1.09 0.00 -0.01 0.00 0.00 175.02 176.75 2br5 s ALA 152 N -0.63 2.04 0.21 3.03 0.00 -1.26 -5.04 121.76 120.11 2br5 s ALA 152 Ca 0.12 -0.04 0.08 0.00 0.00 0.00 0.00 51.96 52.12 2br5 s ALA 152 Cb -0.12 -3.17 -0.05 0.00 0.00 0.00 0.00 23.12 19.78 2br5 s ALA 152 CO 0.02 -1.91 -0.15 -1.01 0.00 0.00 0.00 175.76 172.72 2br5 s HIS 153 N -3.02 1.74 1.09 0.00 3.76 -1.26 -3.82 115.29 113.77 2br5 s HIS 153 Ca 0.61 -0.56 -0.12 0.00 -0.15 0.00 0.00 55.06 54.84 2br5 s HIS 153 Cb -0.16 -0.80 0.24 0.00 1.11 0.00 0.00 32.58 32.96 2br5 s HIS 153 CO 0.56 0.38 1.06 -2.14 -0.85 0.00 0.00 174.74 173.75 2br5 s PRO 154 N -3.64 -0.30 -0.06 8.40 0.02 -1.26 -4.41 135.00 133.74 2br5 s PRO 154 Ca 0.23 0.99 -0.02 0.00 0.02 0.00 0.00 61.00 62.22 2br5 s PRO 154 Cb -0.01 -1.61 0.04 0.00 0.02 0.00 0.00 34.50 32.93 2br5 s PRO 154 CO 0.07 -3.36 0.13 -1.17 -0.33 0.00 0.00 177.00 172.35 2br5 s LEU 155 N -6.99 0.72 -0.25 -5.54 0.20 -1.26 0.10 118.68 105.65 2br5 s LEU 155 Ca 0.68 0.27 -0.06 0.00 0.69 0.00 0.00 54.13 55.70 2br5 s LEU 155 Cb -0.24 0.30 -0.01 0.00 -0.43 0.00 0.00 46.19 45.81 2br5 s LEU 155 CO 0.62 -0.15 0.04 -0.63 -0.29 0.00 0.00 176.35 175.94 2br5 s ILE 156 N 1.22 3.92 -0.23 6.68 1.01 -0.60 -1.97 121.20 131.24 2br5 s ILE 156 Ca -0.08 -0.43 -0.07 0.00 0.00 0.00 0.00 60.65 60.06 2br5 s ILE 156 Cb -0.12 -2.88 -0.03 0.00 0.01 0.00 0.00 42.46 39.44 2br5 s ILE 156 CO -0.06 0.28 0.06 0.12 0.00 0.00 0.00 174.94 175.34 2br5 s PHE 157 N 1.54 3.11 -0.10 3.97 5.36 -0.84 -0.25 117.98 130.77 2br5 s PHE 157 Ca 0.05 -0.31 0.03 0.00 -0.96 0.00 0.00 56.93 55.74 2br5 s PHE 157 Cb -0.15 -2.18 0.00 0.00 -0.34 0.00 0.00 43.02 40.35 2br5 s PHE 157 CO 0.01 -0.23 -0.21 0.42 -1.46 0.00 0.00 175.22 173.76 2br5 s ILE 158 N 1.24 1.85 -0.46 3.12 1.01 0.19 -0.51 121.20 127.63 2br5 s ILE 158 Ca 0.04 -0.89 -0.14 0.00 0.00 0.00 0.00 60.65 59.67 2br5 s ILE 158 Cb -0.14 -1.62 0.08 0.00 0.01 0.00 0.00 42.46 40.78 2br5 s ILE 158 CO 0.03 0.51 0.36 -0.62 0.00 0.00 0.00 174.94 175.23 2br5 s ASP 159 N 0.48 6.01 0.00 3.58 3.68 0.42 -1.04 116.67 129.79 2br5 s ASP 159 Ca -0.16 -1.39 0.20 0.00 2.13 0.00 0.00 52.55 53.32 2br5 s ASP 159 Cb -0.17 -2.13 0.18 0.00 -1.45 0.00 0.00 42.92 39.35 2br5 s ASP 159 CO 0.06 -0.62 1.14 0.59 0.13 0.00 0.00 175.17 176.47 2br5 n ASN 160 N 5.13 2.70 -0.00 -0.34 3.02 -0.52 -1.76 115.26 123.48 2br5 n ASN 160 Ca -0.12 -1.83 -0.15 0.00 -0.03 0.00 0.00 54.58 52.45 2br5 n ASN 160 Cb 0.43 -0.02 -0.14 0.00 -0.61 0.00 0.00 39.78 39.44 2br5 n ASN 160 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2br5 h ALA 161 N 3.85 0.57 -5.81 5.41 0.00 -1.74 -3.45 119.26 118.09 2br5 h ALA 161 Ca 0.00 -1.41 -0.37 0.00 0.00 0.00 0.00 54.91 53.13 2br5 h ALA 161 Cb 0.83 0.58 0.13 0.00 0.00 0.00 0.00 17.79 19.33 2br5 h ALA 161 CO 0.00 1.42 -0.76 0.72 0.00 0.00 0.00 179.25 180.63 2br5 n HIS 162 N -3.29 -2.32 -3.73 0.00 8.25 -1.26 -5.02 115.22 107.85 2br5 n HIS 162 Ca -0.24 0.94 -0.17 0.00 -0.26 0.00 0.00 57.72 57.99 2br5 n HIS 162 Cb 1.05 -4.89 -0.16 0.00 1.12 0.00 0.00 29.99 27.10 2br5 n HIS 162 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2br5 s ALA 163 N -3.40 0.07 -1.81 -1.41 0.00 -1.26 -4.80 121.76 109.15 2br5 s ALA 163 Ca 0.18 0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.47 2br5 s ALA 163 Cb -0.08 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.60 2br5 s ALA 163 CO 0.75 -0.27 0.00 -1.71 0.00 0.00 0.00 175.76 174.53 2br5 n ASN 164 N 4.64 -5.91 -0.08 0.00 4.05 -1.26 -4.59 115.26 112.11 2br5 n ASN 164 Ca -0.18 0.01 -0.08 0.00 0.45 0.00 0.00 54.58 54.78 2br5 n ASN 164 Cb 0.50 -4.93 -0.01 0.00 1.23 0.00 0.00 39.78 36.57 2br5 n ASN 164 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 2br5 h THR 165 N 0.00 0.99 -0.24 -0.44 2.02 -1.93 -2.13 112.91 111.17 2br5 h THR 165 Ca -0.49 -0.10 -0.11 0.00 0.77 0.00 0.00 66.41 66.48 2br5 h THR 165 Cb 1.37 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 2br5 h THR 165 CO 0.59 0.05 -0.32 -0.26 0.37 0.00 0.00 175.52 175.96 2br5 h PHE 166 N 0.30 0.57 -0.13 3.16 -1.00 -1.98 -0.74 116.94 117.12 2br5 h PHE 166 Ca 0.12 -0.14 -0.12 0.00 2.81 0.00 0.00 57.97 60.64 2br5 h PHE 166 Cb 0.04 -0.13 -0.01 0.00 3.61 0.00 0.00 35.95 39.46 2br5 h PHE 166 CO -0.10 0.76 -0.44 -0.91 -1.61 0.00 0.00 178.31 176.02 2br5 h ASN 167 N 0.43 0.34 0.12 2.17 2.35 -1.87 -1.40 115.58 117.72 2br5 h ASN 167 Ca 0.05 -0.15 -0.13 0.00 -0.55 0.00 0.00 56.30 55.52 2br5 h ASN 167 Cb 0.76 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 2br5 h ASN 167 CO 0.06 0.73 -0.46 0.40 -1.65 0.00 0.00 177.43 176.51 2br5 h ILE 168 N 0.26 1.32 -0.15 2.81 2.04 -1.19 -1.60 117.51 121.01 2br5 h ILE 168 Ca 0.02 -1.66 -0.14 0.00 1.00 0.00 0.00 64.86 64.08 2br5 h ILE 168 Cb 0.88 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 2br5 h ILE 168 CO 0.07 0.51 -0.51 -0.03 0.00 0.00 0.00 178.15 178.19 2br5 h MET 169 N 0.33 0.40 -0.14 2.37 4.05 -0.77 -0.34 114.93 120.83 2br5 h MET 169 Ca 0.02 -0.24 -0.19 0.00 -0.28 0.00 0.00 59.70 59.02 2br5 h MET 169 Cb 0.94 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.76 2br5 h MET 169 CO 0.08 0.82 -0.68 -0.22 0.23 0.00 0.00 176.91 177.14 2br5 h LYS 170 N 0.32 0.59 -0.63 0.39 3.64 -1.20 -1.98 116.57 117.69 2br5 h LYS 170 Ca 0.01 -0.44 -0.02 0.00 -1.27 0.00 0.00 60.65 58.93 2br5 h LYS 170 Cb 1.01 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.88 2br5 h LYS 170 CO 0.09 1.06 0.31 2.35 -2.27 0.00 0.00 179.45 180.99 2br5 h TRP 171 N 0.42 0.90 -0.25 1.91 7.01 -0.98 -2.03 115.95 122.92 2br5 h TRP 171 Ca -0.02 -0.04 -0.06 0.00 2.11 0.00 0.00 58.89 60.88 2br5 h TRP 171 Cb 1.26 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 28.03 2br5 h TRP 171 CO 0.06 0.67 -0.06 0.00 -2.79 0.00 0.00 178.44 176.32 2br5 h ALA 172 N 1.14 0.35 -0.81 2.65 0.00 -0.92 -1.03 119.26 120.64 2br5 h ALA 172 Ca 0.22 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2br5 h ALA 172 Cb 0.10 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2br5 h ALA 172 CO -0.03 0.15 0.47 0.28 0.00 0.00 0.00 179.25 180.11 2br5 h VAL 173 N 0.23 1.23 0.00 0.00 2.07 -1.31 0.28 116.25 118.75 2br5 h VAL 173 Ca 0.06 -0.55 -0.11 0.00 0.82 0.00 0.00 66.70 66.92 2br5 h VAL 173 Cb 0.52 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 2br5 h VAL 173 CO 0.02 0.25 -0.53 0.44 0.02 0.00 0.00 177.57 177.77 2br5 h ASP 174 N 1.12 0.00 0.00 0.57 3.32 -1.20 -3.41 116.42 116.82 2br5 h ASP 174 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 2br5 h ASP 174 Cb -0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2br5 h ASP 174 CO -0.05 0.53 0.00 1.41 -1.72 0.00 0.00 179.24 179.41 2br5 n HIS 175 N -3.27 0.00 0.12 4.55 8.25 -0.40 -4.99 115.22 119.47 2br5 n HIS 175 Ca 0.02 -0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 2br5 n HIS 175 Cb 0.73 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.83 2br5 n HIS 175 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2br5 n LEU 176 N -0.09 -1.61 -4.68 2.41 7.94 -0.66 -4.99 117.00 115.32 2br5 n LEU 176 Ca 0.00 0.45 -0.42 0.00 -1.11 0.00 0.00 56.01 54.93 2br5 n LEU 176 Cb 0.43 1.67 -0.03 0.00 0.53 0.00 0.00 43.42 46.02 2br5 n LEU 176 CO 0.00 -0.27 1.46 -0.76 -1.11 0.00 0.00 177.39 176.71 2br5 s LEU 177 N -6.14 4.39 0.44 -1.96 1.43 -0.00 -5.02 118.68 111.82 2br5 s LEU 177 Ca 0.00 2.66 0.04 0.00 -1.03 0.00 0.00 54.13 55.79 2br5 s LEU 177 Cb 0.00 -3.56 0.01 0.00 0.03 0.00 0.00 46.19 42.67 2br5 s LEU 177 CO 0.00 -0.98 0.63 -1.61 0.23 0.00 0.00 176.35 174.62 2br5 s GLU 178 N 3.09 2.89 0.04 1.70 2.02 -1.26 -4.87 118.70 122.31 2br5 s GLU 178 Ca 0.80 -0.84 -0.36 0.00 0.02 0.00 0.00 54.97 54.59 2br5 s GLU 178 Cb -0.43 -2.64 -0.15 0.00 0.10 0.00 0.00 34.13 31.00 2br5 s GLU 178 CO 0.36 -0.31 1.53 -1.91 0.02 0.00 0.00 175.26 174.96 2br5 n GLU 179 N -2.00 1.59 -0.26 1.61 2.13 -1.26 -1.67 120.64 120.79 2br5 n GLU 179 Ca 0.04 0.58 0.00 0.00 0.66 0.00 0.00 57.16 58.44 2br5 n GLU 179 Cb 0.59 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 30.01 2br5 n GLU 179 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2br5 n GLY 180 N 3.25 0.98 3.78 8.31 0.00 -0.73 -4.96 105.19 115.82 2br5 n GLY 180 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2br5 n GLY 180 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2br5 s ASP 181 N -2.95 7.05 0.22 1.61 1.01 -0.67 -4.75 116.67 118.20 2br5 s ASP 181 Ca 0.00 1.98 -0.10 0.00 0.71 0.00 0.00 52.55 55.14 2br5 s ASP 181 Cb 0.00 -2.59 -0.07 0.00 1.01 0.00 0.00 42.92 41.27 2br5 s ASP 181 CO 0.00 -0.28 0.54 -0.31 0.21 0.00 0.00 175.17 175.34 2br5 s TYR 182 N -1.60 3.43 -0.18 4.23 1.51 -0.83 -1.47 117.35 122.44 2br5 s TYR 182 Ca 0.53 0.87 -0.01 0.00 -1.01 0.00 0.00 57.07 57.46 2br5 s TYR 182 Cb -0.21 -2.26 0.05 0.00 -0.11 0.00 0.00 41.96 39.43 2br5 s TYR 182 CO 0.27 0.28 -0.03 0.12 -1.11 0.00 0.00 175.55 175.08 2br5 s PHE 183 N -1.80 1.63 -0.16 2.71 5.36 0.98 -1.98 117.98 124.73 2br5 s PHE 183 Ca 0.47 -1.12 -0.01 0.00 -0.96 0.00 0.00 56.93 55.31 2br5 s PHE 183 Cb -0.11 -1.27 -0.01 0.00 -0.34 0.00 0.00 43.02 41.28 2br5 s PHE 183 CO 0.21 -0.63 -0.13 0.42 -1.46 0.00 0.00 175.22 173.63 2br5 s ILE 184 N 1.66 2.92 -0.38 3.12 1.01 0.33 -1.78 121.20 128.07 2br5 s ILE 184 Ca -0.01 -0.68 -0.08 0.00 0.00 0.00 0.00 60.65 59.87 2br5 s ILE 184 Cb -0.16 -2.25 0.05 0.00 0.01 0.00 0.00 42.46 40.11 2br5 s ILE 184 CO -0.07 0.50 0.19 -0.63 0.00 0.00 0.00 174.94 174.93 2br5 s ILE 185 N 0.78 4.11 0.39 2.92 1.01 -0.74 -0.44 121.20 129.24 2br5 s ILE 185 Ca -0.05 -1.21 -0.22 0.00 0.00 0.00 0.00 60.65 59.16 2br5 s ILE 185 Cb -0.15 -3.42 -0.11 0.00 0.01 0.00 0.00 42.46 38.80 2br5 s ILE 185 CO 0.01 -0.34 0.94 -1.61 0.00 0.00 0.00 174.94 173.94 2br5 s GLU 186 N 1.43 4.33 0.00 2.79 2.02 -0.72 -4.46 118.70 124.09 2br5 s GLU 186 Ca 0.01 1.17 0.00 0.00 0.02 0.00 0.00 54.97 56.18 2br5 s GLU 186 Cb -0.21 -2.38 0.00 0.00 0.10 0.00 0.00 34.13 31.64 2br5 s GLU 186 CO 0.03 0.07 0.00 -0.25 0.02 0.00 0.00 175.26 175.13 2br5 n ASP 187 N -0.26 0.00 0.02 -0.19 8.00 0.16 -4.58 116.55 119.70 2br5 n ASP 187 Ca 0.05 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.61 2br5 n ASP 187 Cb 0.53 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.53 2br5 n ASP 187 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 2br5 n MET 188 N 0.00 0.64 -0.21 -1.24 1.56 -1.26 -4.37 117.12 112.24 2br5 n MET 188 Ca 0.00 0.02 -0.06 0.00 -0.27 0.00 0.00 57.70 57.40 2br5 n MET 188 Cb 0.00 -1.68 0.10 0.00 2.15 0.00 0.00 33.22 33.80 2br5 n MET 188 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 2br5 h ILE 189 N 0.00 1.25 -0.30 1.12 2.04 -1.81 -1.52 117.51 118.29 2br5 h ILE 189 Ca -0.12 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 2br5 h ILE 189 Cb 1.32 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.96 2br5 h ILE 189 CO 0.02 0.35 0.13 -0.65 0.00 0.00 0.00 178.15 178.00 2br5 h PRO 190 N 0.98 0.41 -0.09 2.37 0.11 -1.80 -2.74 132.00 131.24 2br5 h PRO 190 Ca 0.21 -0.04 -0.23 0.00 0.11 0.00 0.00 66.00 66.05 2br5 h PRO 190 Cb 0.34 -0.08 0.01 0.00 0.11 0.00 0.00 31.00 31.38 2br5 h PRO 190 CO 0.00 0.33 -0.84 1.88 -0.21 0.00 0.00 178.00 179.16 2br5 h TYR 191 N 0.42 0.93 -0.17 0.65 -1.99 -1.53 -2.86 116.97 112.41 2br5 h TYR 191 Ca 0.11 -0.44 -0.05 0.00 2.00 0.00 0.00 58.73 60.34 2br5 h TYR 191 Cb 0.07 -0.13 -0.01 0.00 2.00 0.00 0.00 36.73 38.65 2br5 h TYR 191 CO 0.00 1.26 -0.13 -1.49 -0.00 0.00 0.00 178.16 177.81 2br5 h TRP 192 N 0.43 0.28 -0.25 4.88 6.55 -1.35 -0.63 115.95 125.87 2br5 h TRP 192 Ca -0.07 -0.03 -0.15 0.00 0.95 0.00 0.00 58.89 59.59 2br5 h TRP 192 Cb 1.47 -0.08 -0.01 0.00 -0.86 0.00 0.00 29.16 29.68 2br5 h TRP 192 CO 0.08 0.40 -0.46 -0.92 -1.05 0.00 0.00 178.44 176.49 2br5 h TYR 193 N 0.26 0.78 -0.28 0.49 3.20 -1.47 0.41 116.97 120.35 2br5 h TYR 193 Ca 0.05 -0.25 -0.12 0.00 3.14 0.00 0.00 58.73 61.55 2br5 h TYR 193 Cb 0.39 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.50 2br5 h TYR 193 CO 0.01 0.98 -0.30 -0.09 -1.64 0.00 0.00 178.16 177.12 2br5 h ARG 194 N 0.51 0.70 0.08 1.82 2.43 -1.17 -2.71 114.38 116.04 2br5 h ARG 194 Ca 0.03 -0.38 -0.29 0.00 -0.81 0.00 0.00 59.98 58.54 2br5 h ARG 194 Cb 1.00 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 2br5 h ARG 194 CO 0.09 0.99 -1.46 1.88 -1.51 0.00 0.00 179.97 179.96 2br5 h TYR 195 N 0.44 0.30 -1.69 2.20 0.99 -1.15 -3.41 116.97 114.66 2br5 h TYR 195 Ca 0.04 -0.22 -0.45 0.00 2.00 0.00 0.00 58.73 60.10 2br5 h TYR 195 Cb 0.87 -0.01 -0.36 0.00 1.00 0.00 0.00 36.73 38.23 2br5 h TYR 195 CO 0.07 1.25 -1.07 0.00 -0.00 0.00 0.00 178.16 178.42 2br5 n ALA 196 N -2.59 1.61 0.06 3.88 0.00 0.13 -5.00 120.51 118.60 2br5 n ALA 196 Ca -0.13 -3.09 -0.12 0.00 0.00 0.00 0.00 53.44 50.09 2br5 n ALA 196 Cb 1.02 -0.95 -0.05 0.00 0.00 0.00 0.00 19.45 19.47 2br5 n ALA 196 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2br5 h PRO 197 N 3.19 -0.44 -0.65 0.00 0.13 -1.60 0.87 132.00 133.50 2br5 h PRO 197 Ca 0.06 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2br5 h PRO 197 Cb 0.97 0.10 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 2br5 h PRO 197 CO 0.44 -0.29 0.43 0.37 -0.23 0.00 0.00 178.00 178.72 2br5 h GLN 198 N -0.45 0.86 0.20 0.86 4.15 -1.93 -1.84 115.11 116.95 2br5 h GLN 198 Ca 0.06 -0.05 -0.33 0.00 0.77 0.00 0.00 58.65 59.09 2br5 h GLN 198 Cb 0.54 -0.19 0.02 0.00 0.21 0.00 0.00 27.48 28.06 2br5 h GLN 198 CO -0.26 0.58 -1.59 -0.07 -1.93 0.00 0.00 178.83 175.55 2br5 h LEU 199 N 0.89 0.65 0.23 -2.39 3.38 -1.92 -3.21 115.31 112.92 2br5 h LEU 199 Ca 0.24 -0.83 -0.01 0.00 0.09 0.00 0.00 57.88 57.38 2br5 h LEU 199 Cb -0.09 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 2br5 h LEU 199 CO -0.05 1.68 -0.15 0.15 0.09 0.00 0.00 178.44 180.16 2br5 h PHE 200 N 0.11 -0.39 -0.96 1.13 3.57 -0.63 -1.22 116.94 118.56 2br5 h PHE 200 Ca -0.28 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.23 2br5 h PHE 200 Cb 2.10 0.14 -0.05 0.00 2.79 0.00 0.00 35.95 40.94 2br5 h PHE 200 CO 0.10 -0.23 0.63 0.77 -2.23 0.00 0.00 178.31 177.35 2br5 h SER 201 N -0.37 1.08 -0.57 0.41 0.02 -1.50 -0.40 113.55 112.23 2br5 h SER 201 Ca -0.02 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.87 2br5 h SER 201 Cb 0.32 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 2br5 h SER 201 CO 0.01 0.77 0.20 -0.08 -1.14 0.00 0.00 176.83 176.60 2br5 h GLU 202 N 1.27 0.86 0.15 3.45 4.81 -1.52 -0.65 114.58 122.95 2br5 h GLU 202 Ca 0.36 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2br5 h GLU 202 Cb -0.11 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.14 2br5 h GLU 202 CO -0.09 0.76 -0.07 1.88 -0.73 0.00 0.00 179.01 180.76 2br5 h TYR 203 N 0.79 -0.19 -0.70 0.92 0.99 -0.72 -1.61 116.97 116.45 2br5 h TYR 203 Ca 0.19 -0.00 0.12 0.00 2.00 0.00 0.00 58.73 61.04 2br5 h TYR 203 Cb 0.24 0.06 -0.09 0.00 1.00 0.00 0.00 36.73 37.94 2br5 h TYR 203 CO 0.01 0.16 0.27 -0.07 -0.00 0.00 0.00 178.16 178.53 2br5 h LEU 204 N -0.56 0.25 -1.47 3.88 3.38 -1.11 -2.28 115.31 117.40 2br5 h LEU 204 Ca -0.02 0.10 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2br5 h LEU 204 Cb 0.43 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2br5 h LEU 204 CO 0.03 0.11 -0.20 1.23 0.09 0.00 0.00 178.44 179.71 2br5 h GLY 205 N 0.43 0.10 1.54 0.83 0.00 -0.93 -0.90 103.07 104.14 2br5 h GLY 205 Ca 0.38 -0.06 0.05 0.00 0.00 0.00 0.00 47.33 47.69 2br5 h GLY 205 CO -0.37 0.06 0.18 0.00 0.00 0.00 0.00 176.54 176.41 2br5 h ALA 206 N 1.71 1.81 -0.53 3.60 0.00 -0.67 0.15 119.26 125.33 2br5 h ALA 206 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2br5 h ALA 206 Cb 0.40 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2br5 h ALA 206 CO 0.03 -0.27 0.00 1.19 0.00 0.00 0.00 179.25 180.20 2br5 n PHE 207 N -3.85 1.48 -0.14 0.00 3.01 -0.34 -4.60 117.46 113.02 2br5 n PHE 207 Ca 0.01 -0.55 0.11 0.00 1.01 0.00 0.00 57.45 58.03 2br5 n PHE 207 Cb 0.30 -0.31 0.46 0.00 -0.01 0.00 0.00 39.48 39.92 2br5 n PHE 207 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 2br5 h ARG 208 N 3.46 0.50 -0.00 -1.08 0.11 -1.03 -1.95 114.38 114.39 2br5 h ARG 208 Ca 0.00 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.05 2br5 h ARG 208 Cb 1.47 -0.11 0.00 0.00 1.11 0.00 0.00 29.97 32.44 2br5 h ARG 208 CO 0.29 0.33 -0.32 -0.25 0.10 0.00 0.00 179.97 180.11 2br5 n ASP 209 N -4.48 0.46 -0.00 0.08 8.00 -1.26 -4.53 116.55 114.82 2br5 n ASP 209 Ca 0.11 -0.22 -0.00 0.00 0.71 0.00 0.00 54.79 55.39 2br5 n ASP 209 Cb 0.38 0.05 -0.00 0.00 -0.02 0.00 0.00 41.12 41.52 2br5 n ASP 209 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2br5 n VAL 210 N -1.33 0.02 -4.57 2.53 0.24 -0.84 -4.63 118.33 109.75 2br5 n VAL 210 Ca 0.08 -0.01 -0.31 0.00 -2.04 0.00 0.00 64.34 62.06 2br5 n VAL 210 Cb 0.33 -0.70 -0.12 0.00 -1.47 0.00 0.00 33.84 31.88 2br5 n VAL 210 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2br5 s LEU 211 N -4.62 2.81 0.12 1.34 1.43 -0.79 -0.08 118.68 118.88 2br5 s LEU 211 Ca -0.00 -0.34 0.07 0.00 -1.03 0.00 0.00 54.13 52.83 2br5 s LEU 211 Cb 0.00 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 2br5 s LEU 211 CO 0.01 0.26 -0.17 -0.94 0.23 0.00 0.00 176.35 175.73 2br5 s SER 212 N -1.49 2.32 0.07 2.29 1.04 -0.67 -4.55 113.70 112.72 2br5 s SER 212 Ca 0.16 -0.77 -0.24 0.00 0.48 0.00 0.00 55.95 55.59 2br5 s SER 212 Cb -0.11 -0.11 -0.06 0.00 0.10 0.00 0.00 66.02 65.84 2br5 s SER 212 CO 0.07 -0.04 0.71 -0.32 0.98 0.00 0.00 173.24 174.64 2br5 s MET 213 N -2.37 4.45 -0.62 4.02 1.75 -1.26 -1.24 119.30 124.02 2br5 s MET 213 Ca 0.09 0.99 -0.18 0.00 -1.25 0.00 0.00 55.69 55.34 2br5 s MET 213 Cb -0.07 -3.32 0.12 0.00 2.84 0.00 0.00 34.83 34.41 2br5 s MET 213 CO 0.04 0.42 0.68 0.34 -0.65 0.00 0.00 175.02 175.86 2br5 s ASP 214 N -0.52 6.27 0.00 1.11 -1.08 -0.06 -4.92 116.67 117.47 2br5 s ASP 214 Ca 0.35 -1.69 0.19 0.00 -0.52 0.00 0.00 52.55 50.88 2br5 s ASP 214 Cb -0.21 -2.27 1.08 0.00 -1.46 0.00 0.00 42.92 40.06 2br5 s ASP 214 CO 0.22 -0.99 1.53 0.23 0.52 0.00 0.00 175.17 176.68 2br5 n MET 215 N 5.82 0.52 -0.01 4.34 2.81 -1.26 -1.09 117.12 128.25 2br5 n MET 215 Ca -0.07 0.02 -0.10 0.00 -1.81 0.00 0.00 57.70 55.74 2br5 n MET 215 Cb 0.43 -1.50 -0.14 0.00 -0.71 0.00 0.00 33.22 31.30 2br5 n MET 215 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2br5 h LEU 216 N 0.00 0.07 0.00 4.03 5.85 -1.98 -3.39 115.31 119.89 2br5 h LEU 216 Ca 0.00 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2br5 h LEU 216 Cb 0.03 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.04 2br5 h LEU 216 CO 0.00 1.12 -1.09 -1.22 -0.34 0.00 0.00 178.44 176.91 2br5 n TYR 217 N -3.14 0.00 0.19 1.25 0.53 -0.94 -4.77 117.16 110.28 2br5 n TYR 217 Ca -0.17 0.00 0.07 0.00 -1.02 0.00 0.00 57.90 56.78 2br5 n TYR 217 Cb 1.04 -0.15 0.33 0.00 -1.03 0.00 0.00 39.34 39.53 2br5 n TYR 217 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2br5 h ALA 218 N 1.46 0.95 -0.37 -0.72 0.00 -1.30 -2.86 119.26 116.43 2br5 h ALA 218 Ca 0.00 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 2br5 h ALA 218 Cb 0.44 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2br5 h ALA 218 CO 0.00 0.41 0.03 0.09 0.00 0.00 0.00 179.25 179.78 2br5 n ASN 219 N -3.40 3.79 -0.48 0.00 3.02 -1.26 -0.75 115.26 116.17 2br5 n ASN 219 Ca 0.00 -3.22 0.08 0.00 -0.03 0.00 0.00 54.58 51.41 2br5 n ASN 219 Cb 0.52 -0.60 0.03 0.00 -0.61 0.00 0.00 39.78 39.11 2br5 n ASN 219 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2br5 n ALA 220 N -0.57 2.84 -3.43 5.41 0.00 -1.08 -4.93 120.51 118.76 2br5 n ALA 220 Ca 0.28 -0.57 -0.14 0.00 0.00 0.00 0.00 53.44 53.00 2br5 n ALA 220 Cb 1.02 -0.54 -0.08 0.00 0.00 0.00 0.00 19.45 19.84 2br5 n ALA 220 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2br5 s SER 221 N -1.62 -0.53 0.39 0.00 1.04 -1.26 -4.75 113.70 106.97 2br5 s SER 221 Ca 0.15 0.88 0.16 0.00 0.48 0.00 0.00 55.95 57.63 2br5 s SER 221 Cb 0.13 0.89 1.04 0.00 0.10 0.00 0.00 66.02 68.18 2br5 s SER 221 CO 0.31 -0.31 1.82 -1.28 0.98 0.00 0.00 173.24 174.75 2br5 h SER 222 N 4.64 0.48 0.17 7.02 0.87 -1.96 -0.78 113.55 123.99 2br5 h SER 222 Ca -0.28 0.06 -0.27 0.00 -1.23 0.00 0.00 61.79 60.08 2br5 h SER 222 Cb 1.17 -0.02 0.02 0.00 -0.44 0.00 0.00 62.40 63.12 2br5 h SER 222 CO 0.24 0.16 -1.09 1.56 -0.53 0.00 0.00 176.83 177.17 2br5 h GLN 223 N 0.46 0.57 0.00 2.24 4.20 -1.95 -3.24 115.11 117.39 2br5 h GLN 223 Ca 0.53 -0.68 0.00 0.00 0.06 0.00 0.00 58.65 58.56 2br5 h GLN 223 Cb 1.24 0.21 0.00 0.00 0.30 0.00 0.00 27.48 29.23 2br5 h GLN 223 CO -0.24 1.28 -0.37 1.28 -0.67 0.00 0.00 178.83 180.10 2br5 n LEU 224 N -3.78 0.40 -1.54 1.46 4.77 -1.13 0.35 117.00 117.54 2br5 n LEU 224 Ca -0.10 0.17 -0.21 0.00 -0.03 0.00 0.00 56.01 55.83 2br5 n LEU 224 Cb 0.91 -0.31 -0.04 0.00 -2.33 0.00 0.00 43.42 41.65 2br5 n LEU 224 CO 0.55 0.06 0.63 -0.67 -1.33 0.00 0.00 177.39 176.64 2br5 n ASP 225 N -1.59 0.27 -2.32 -1.43 2.03 -0.31 -0.11 116.55 113.08 2br5 n ASP 225 Ca 0.06 0.24 -0.14 0.00 0.52 0.00 0.00 54.79 55.47 2br5 n ASP 225 Cb 0.35 -0.33 -0.01 0.00 -0.72 0.00 0.00 41.12 40.41 2br5 n ASP 225 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2br5 n ARG 226 N 2.72 -2.05 0.00 -0.67 1.74 0.07 -4.54 116.66 113.94 2br5 n ARG 226 Ca 0.20 0.68 0.00 0.00 -0.77 0.00 0.00 57.85 57.96 2br5 n ARG 226 Cb -0.01 -5.26 0.00 0.00 -1.02 0.00 0.00 32.46 26.17 2br5 n ARG 226 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2br5 n GLY 227 N -0.78 1.59 3.38 -0.13 0.00 0.84 -4.92 105.19 105.16 2br5 n GLY 227 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 2br5 n GLY 227 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2br5 s VAL 228 N -0.70 4.99 0.18 1.61 1.01 -1.25 -1.79 120.40 124.46 2br5 s VAL 228 Ca 0.00 -1.03 0.11 0.00 0.00 0.00 0.00 61.98 61.07 2br5 s VAL 228 Cb 0.00 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 2br5 s VAL 228 CO 0.00 -0.48 -0.23 -0.76 0.00 0.00 0.00 175.10 173.63 2br5 s LEU 229 N 1.60 2.47 0.03 3.92 1.43 -0.73 -0.88 118.68 126.53 2br5 s LEU 229 Ca 0.04 -0.83 -0.09 0.00 -1.03 0.00 0.00 54.13 52.22 2br5 s LEU 229 Cb -0.23 -1.22 0.00 0.00 0.03 0.00 0.00 46.19 44.78 2br5 s LEU 229 CO 0.06 0.13 0.18 0.00 0.23 0.00 0.00 176.35 176.95 2br5 s ARG 230 N -2.62 0.66 0.33 1.70 1.70 -0.38 -0.01 118.95 120.34 2br5 s ARG 230 Ca 0.20 -0.61 -0.27 0.00 -0.47 0.00 0.00 55.73 54.59 2br5 s ARG 230 Cb -0.08 0.27 -0.09 0.00 -0.57 0.00 0.00 34.95 34.48 2br5 s ARG 230 CO 0.10 -0.19 1.04 0.50 -1.08 0.00 0.00 175.30 175.67 2br5 s ARG 231 N -2.44 4.45 0.00 3.89 3.00 -0.54 -1.67 118.95 125.63 2br5 s ARG 231 Ca -0.06 1.58 0.00 0.00 -1.00 0.00 0.00 55.73 56.25 2br5 s ARG 231 Cb -0.02 -2.86 0.00 0.00 0.00 0.00 0.00 34.95 32.07 2br5 s ARG 231 CO -0.03 0.10 0.00 0.28 0.00 0.00 0.00 175.30 175.64 2br5 n VAL 232 N 0.58 0.00 -0.27 7.11 0.31 0.89 -1.78 118.33 125.17 2br5 n VAL 232 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2br5 n VAL 232 Cb 0.48 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.41 2br5 n VAL 232 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51