#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bm9 n SER 5 N 0.00 0.11 -2.24 9.48 3.41 -1.26 -1.72 113.62 121.41 2bm9 n SER 5 Ca 0.00 0.53 -0.27 0.00 -0.26 0.00 0.00 58.87 58.87 2bm9 n SER 5 Cb 0.00 -0.55 0.02 0.00 -0.26 0.00 0.00 64.21 63.42 2bm9 n SER 5 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2bm9 n ARG 6 N -1.62 3.40 -4.18 4.33 3.00 -1.26 -5.04 116.66 115.29 2bm9 n ARG 6 Ca 0.03 -4.11 -0.29 0.00 -0.01 0.00 0.00 57.85 53.47 2bm9 n ARG 6 Cb 0.17 -2.27 -0.08 0.00 0.00 0.00 0.00 32.46 30.27 2bm9 n ARG 6 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 2bm9 s GLN 7 N -3.64 2.39 -0.08 5.56 -0.44 -0.70 -5.12 119.66 117.63 2bm9 s GLN 7 Ca 0.52 -0.99 0.02 0.00 -2.50 0.00 0.00 55.36 52.41 2bm9 s GLN 7 Cb 0.42 -2.41 -0.02 0.00 -1.64 0.00 0.00 33.01 29.36 2bm9 s GLN 7 CO -0.06 0.50 -0.13 1.21 0.50 0.00 0.00 175.29 177.31 2bm9 s ASN 8 N -2.56 4.09 -0.15 6.67 2.47 -1.26 -5.13 114.94 119.07 2bm9 s ASN 8 Ca 0.25 -0.22 -0.03 0.00 0.42 0.00 0.00 52.86 53.29 2bm9 s ASN 8 Cb -0.11 -1.12 -0.02 0.00 -1.45 0.00 0.00 41.25 38.55 2bm9 s ASN 8 CO 0.17 0.29 -0.07 -0.36 -3.72 0.00 0.00 177.10 173.42 2bm9 s PHE 9 N -0.40 2.95 0.84 0.43 0.40 -1.26 -5.11 117.98 115.83 2bm9 s PHE 9 Ca 0.05 -0.45 -0.11 0.00 -0.60 0.00 0.00 56.93 55.81 2bm9 s PHE 9 Cb -0.12 -1.93 0.09 0.00 0.51 0.00 0.00 43.02 41.57 2bm9 s PHE 9 CO 0.02 -0.13 1.10 -0.65 0.70 0.00 0.00 175.22 176.26 2bm9 s GLN 10 N 0.44 1.76 -0.53 0.44 -0.21 -1.26 -4.97 119.66 115.33 2bm9 s GLN 10 Ca -0.06 0.70 -0.26 0.00 0.02 0.00 0.00 55.36 55.76 2bm9 s GLN 10 Cb -0.15 -1.88 0.03 0.00 1.00 0.00 0.00 33.01 32.02 2bm9 s GLN 10 CO 0.03 -1.86 1.04 0.34 -2.12 0.00 0.00 175.29 172.73 2bm9 s ASP 11 N -3.73 6.44 0.00 5.90 2.15 -1.26 -4.87 116.67 121.30 2bm9 s ASP 11 Ca 0.62 -0.00 0.08 0.00 0.43 0.00 0.00 52.55 53.68 2bm9 s ASP 11 Cb -0.16 -2.49 0.44 0.00 -0.30 0.00 0.00 42.92 40.41 2bm9 s ASP 11 CO 0.55 -1.28 1.07 0.18 -0.17 0.00 0.00 175.17 175.52 2bm9 n LEU 12 N 7.77 0.00 0.05 -1.34 4.32 -1.26 -1.29 117.00 125.25 2bm9 n LEU 12 Ca 0.06 0.19 0.13 0.00 -0.02 0.00 0.00 56.01 56.37 2bm9 n LEU 12 Cb 0.48 -0.19 0.48 0.00 -1.62 0.00 0.00 43.42 42.58 2bm9 n LEU 12 CO 0.67 -0.14 0.86 0.59 -1.22 0.00 0.00 177.39 178.16 2bm9 n ASN 13 N -1.19 0.40 0.20 -1.43 3.02 -1.26 -3.19 115.26 111.81 2bm9 n ASN 13 Ca 0.05 0.46 0.05 0.00 -0.03 0.00 0.00 54.58 55.11 2bm9 n ASN 13 Cb 0.05 -0.54 0.39 0.00 -0.61 0.00 0.00 39.78 39.08 2bm9 n ASN 13 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2bm9 h LEU 14 N 0.00 0.00 -1.60 3.41 4.07 -1.60 -3.12 115.31 116.46 2bm9 h LEU 14 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2bm9 h LEU 14 Cb 0.61 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.35 2bm9 h LEU 14 CO 0.00 0.35 -0.06 0.49 -1.08 0.00 0.00 178.44 178.15 2bm9 n PHE 15 N -3.75 0.00 -1.67 1.13 3.01 -1.19 -4.93 117.46 110.06 2bm9 n PHE 15 Ca -0.01 0.00 -0.55 0.00 1.01 0.00 0.00 57.45 57.90 2bm9 n PHE 15 Cb 0.44 -0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.84 2bm9 n PHE 15 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 2bm9 n ARG 16 N 0.92 1.20 -2.22 -1.08 0.63 -1.18 -1.76 116.66 113.16 2bm9 n ARG 16 Ca 0.14 0.44 -0.18 0.00 -0.92 0.00 0.00 57.85 57.33 2bm9 n ARG 16 Cb 0.53 -2.11 -0.02 0.00 0.45 0.00 0.00 32.46 31.31 2bm9 n ARG 16 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2bm9 n GLY 17 N 3.65 -0.07 1.81 5.14 0.00 -1.26 -4.75 105.19 109.71 2bm9 n GLY 17 Ca 0.24 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2bm9 n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bm9 n LEU 18 N -2.50 0.00 0.00 0.99 4.77 -0.94 -5.12 117.00 114.21 2bm9 n LEU 18 Ca -0.21 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 2bm9 n LEU 18 Cb 0.65 0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 2bm9 n LEU 18 CO 0.25 -0.45 0.00 0.61 -1.33 0.00 0.00 177.39 176.47 2bm9 n GLY 19 N 0.28 0.90 0.18 -0.72 0.00 -0.72 -4.84 105.19 100.27 2bm9 n GLY 19 Ca 0.00 -1.98 -0.14 0.00 0.00 0.00 0.00 46.02 43.90 2bm9 n GLY 19 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bm9 h GLU 20 N 0.00 0.51 -5.18 1.61 5.08 -1.98 -3.44 114.58 111.18 2bm9 h GLU 20 Ca 0.00 -0.48 -0.67 0.00 -1.00 0.00 0.00 59.36 57.21 2bm9 h GLU 20 Cb 0.00 0.12 -0.31 0.00 0.50 0.00 0.00 28.75 29.06 2bm9 h GLU 20 CO 0.00 1.11 -0.80 0.34 -1.00 0.00 0.00 179.01 178.66 2bm9 s ASP 21 N -7.08 3.65 0.17 1.42 -1.08 -1.26 -4.99 116.67 107.50 2bm9 s ASP 21 Ca -0.07 -0.48 0.20 0.00 -0.52 0.00 0.00 52.55 51.68 2bm9 s ASP 21 Cb 0.09 -1.56 0.85 0.00 -1.46 0.00 0.00 42.92 40.84 2bm9 s ASP 21 CO 0.87 0.08 1.62 -0.81 0.52 0.00 0.00 175.17 177.44 2bm9 n PRO 22 N 4.11 0.13 -2.76 4.34 -0.04 -1.26 -4.79 135.00 134.73 2bm9 n PRO 22 Ca -0.19 0.38 -0.33 0.00 -0.04 0.00 0.00 63.50 63.31 2bm9 n PRO 22 Cb 0.52 -1.75 -0.06 0.00 -0.04 0.00 0.00 33.50 32.16 2bm9 n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bm9 s ALA 23 N -3.22 3.01 -0.23 0.55 0.00 -1.26 -4.51 121.76 116.10 2bm9 s ALA 23 Ca 0.05 0.45 -0.27 0.00 0.00 0.00 0.00 51.96 52.19 2bm9 s ALA 23 Cb 0.09 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 20.04 2bm9 s ALA 23 CO 0.34 0.03 0.96 -0.47 0.00 0.00 0.00 175.76 176.62 2bm9 s TYR 24 N -2.11 3.33 0.13 0.00 5.04 -1.26 -4.85 117.35 117.63 2bm9 s TYR 24 Ca 0.63 1.34 0.08 0.00 -2.44 0.00 0.00 57.07 56.68 2bm9 s TYR 24 Cb -0.11 -3.18 -0.04 0.00 0.35 0.00 0.00 41.96 38.98 2bm9 s TYR 24 CO 0.15 -0.45 -0.13 -1.01 -1.34 0.00 0.00 175.55 172.78 2bm9 s HIS 25 N 3.04 2.64 0.28 4.97 3.76 -1.26 -4.96 115.29 123.77 2bm9 s HIS 25 Ca 0.41 -0.21 -0.18 0.00 -0.15 0.00 0.00 55.06 54.92 2bm9 s HIS 25 Cb -0.15 -1.36 -0.09 0.00 1.11 0.00 0.00 32.58 32.09 2bm9 s HIS 25 CO 0.07 0.44 0.76 -2.14 -0.85 0.00 0.00 174.74 173.02 2bm9 s PRO 26 N -2.36 4.18 0.92 8.40 0.02 -1.26 -5.04 135.00 139.86 2bm9 s PRO 26 Ca 0.21 0.85 -0.10 0.00 0.02 0.00 0.00 61.00 61.98 2bm9 s PRO 26 Cb -0.10 -2.65 0.14 0.00 0.02 0.00 0.00 34.50 31.91 2bm9 s PRO 26 CO 0.13 0.26 1.11 -0.35 -0.33 0.00 0.00 177.00 177.82 2bm9 n PRO 27 N 0.19 -0.43 -4.20 5.54 -0.04 -1.26 -5.03 135.00 129.77 2bm9 n PRO 27 Ca 0.01 -0.06 -0.18 0.00 -0.04 0.00 0.00 63.50 63.23 2bm9 n PRO 27 Cb 0.52 -2.35 -0.16 0.00 -0.04 0.00 0.00 33.50 31.47 2bm9 n PRO 27 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2bm9 s VAL 28 N -2.60 0.52 -0.06 0.52 1.01 -1.26 -5.11 120.40 113.42 2bm9 s VAL 28 Ca 0.67 -0.19 -0.27 0.00 0.00 0.00 0.00 61.98 62.18 2bm9 s VAL 28 Cb -0.23 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 2bm9 s VAL 28 CO 0.58 0.19 0.89 -0.76 0.00 0.00 0.00 175.10 176.00 2bm9 s LEU 29 N 0.43 4.31 0.00 3.92 2.01 -1.26 -4.82 118.68 123.26 2bm9 s LEU 29 Ca -0.05 1.44 0.00 0.00 0.01 0.00 0.00 54.13 55.53 2bm9 s LEU 29 Cb -0.09 -3.39 0.00 0.00 0.01 0.00 0.00 46.19 42.72 2bm9 s LEU 29 CO 0.00 -0.27 0.00 0.41 1.01 0.00 0.00 176.35 177.50 2bm9 n THR 30 N 4.09 0.00 0.34 5.49 -1.04 -1.26 -4.76 114.28 117.14 2bm9 n THR 30 Ca 0.04 0.43 0.12 0.00 -2.04 0.00 0.00 64.05 62.61 2bm9 n THR 30 Cb 0.50 -1.36 0.53 0.00 -1.82 0.00 0.00 70.33 68.18 2bm9 n THR 30 CO 0.00 0.00 0.00 -2.24 -0.64 0.00 0.00 175.07 172.19 2bm9 h ASP 31 N 0.00 0.00 -4.03 8.00 2.03 -1.92 -3.44 116.42 117.05 2bm9 h ASP 31 Ca 0.00 0.00 -0.35 0.00 -0.73 0.00 0.00 57.03 55.95 2bm9 h ASP 31 Cb 0.00 0.00 -0.14 0.00 -0.83 0.00 0.00 39.33 38.36 2bm9 h ASP 31 CO 0.00 0.00 -0.67 0.00 -1.03 0.00 0.00 179.24 177.54 2bm9 s ARG 32 N -3.40 1.23 0.52 4.15 1.04 -1.26 -5.14 118.95 116.10 2bm9 s ARG 32 Ca 0.02 -1.60 -0.20 0.00 -1.04 0.00 0.00 55.73 52.92 2bm9 s ARG 32 Cb 0.09 -0.54 -0.06 0.00 -2.04 0.00 0.00 34.95 32.39 2bm9 s ARG 32 CO 0.36 -0.07 1.13 -1.25 -0.04 0.00 0.00 175.30 175.43 2bm9 s PRO 33 N -3.85 3.45 0.11 3.89 0.04 -1.26 -4.85 135.00 132.53 2bm9 s PRO 33 Ca 0.25 1.63 -0.20 0.00 0.04 0.00 0.00 61.00 62.72 2bm9 s PRO 33 Cb 0.05 -2.08 -0.09 0.00 0.04 0.00 0.00 34.50 32.42 2bm9 s PRO 33 CO 0.06 -0.77 1.74 -0.09 0.04 0.00 0.00 177.00 177.98 2bm9 h ARG 34 N 1.38 0.22 -4.55 4.56 2.43 -1.98 -3.38 114.38 113.07 2bm9 h ARG 34 Ca -0.50 -0.02 -0.72 0.00 -0.81 0.00 0.00 59.98 57.93 2bm9 h ARG 34 Cb 1.26 -0.05 -0.21 0.00 -0.42 0.00 0.00 29.97 30.55 2bm9 h ARG 34 CO 0.58 0.18 0.31 -0.51 -1.51 0.00 0.00 179.97 179.02 2bm9 s ASP 35 N -5.38 6.47 0.28 -3.80 1.01 -1.26 -5.03 116.67 108.95 2bm9 s ASP 35 Ca -0.13 -1.95 -0.29 0.00 0.71 0.00 0.00 52.55 50.89 2bm9 s ASP 35 Cb 0.08 -2.30 -0.09 0.00 1.01 0.00 0.00 42.92 41.61 2bm9 s ASP 35 CO 0.69 -0.95 1.05 0.86 0.21 0.00 0.00 175.17 177.03 2bm9 s TRP 36 N 2.00 3.66 0.35 4.23 -0.11 -1.26 -5.01 118.94 122.80 2bm9 s TRP 36 Ca 0.19 1.75 -0.24 0.00 1.22 0.00 0.00 56.10 59.02 2bm9 s TRP 36 Cb -0.15 -3.19 -0.10 0.00 -1.50 0.00 0.00 33.47 28.53 2bm9 s TRP 36 CO -0.02 -0.29 0.94 -1.25 -4.62 0.00 0.00 176.95 171.71 2bm9 s PRO 37 N -1.47 4.47 0.40 5.86 0.04 -1.26 -4.97 135.00 138.07 2bm9 s PRO 37 Ca 0.45 1.25 0.25 0.00 0.04 0.00 0.00 61.00 62.99 2bm9 s PRO 37 Cb -0.29 -2.61 0.56 0.00 0.04 0.00 0.00 34.50 32.20 2bm9 s PRO 37 CO 0.37 0.19 1.69 -0.07 0.04 0.00 0.00 177.00 179.22 2bm9 h LEU 38 N 2.79 0.00 -0.89 -3.56 4.07 -1.99 -2.65 115.31 113.09 2bm9 h LEU 38 Ca -0.47 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.37 2bm9 h LEU 38 Cb 1.19 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.91 2bm9 h LEU 38 CO 0.64 0.00 -0.52 -2.24 -1.08 0.00 0.00 178.44 175.24 2bm9 h ASP 39 N 0.00 0.09 -0.90 -0.43 2.03 -2.04 -3.09 116.42 112.07 2bm9 h ASP 39 Ca 0.00 -0.05 -0.49 0.00 -0.73 0.00 0.00 57.03 55.77 2bm9 h ASP 39 Cb 0.88 -0.03 -0.28 0.00 -0.83 0.00 0.00 39.33 39.07 2bm9 h ASP 39 CO 0.00 0.60 0.56 0.54 -1.03 0.00 0.00 179.24 179.90 2bm9 n ARG 40 N -3.92 2.25 -0.32 4.15 1.74 -1.00 -4.75 116.66 114.80 2bm9 n ARG 40 Ca -0.02 -3.08 0.04 0.00 -0.77 0.00 0.00 57.85 54.02 2bm9 n ARG 40 Cb 0.54 -2.14 0.23 0.00 -1.02 0.00 0.00 32.46 30.07 2bm9 n ARG 40 CO 0.00 0.00 0.00 2.35 -1.52 0.00 0.00 177.63 178.46 2bm9 h TRP 41 N 1.11 1.08 0.00 -1.55 7.01 -1.48 -2.31 115.95 119.81 2bm9 h TRP 41 Ca 0.57 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 61.51 2bm9 h TRP 41 Cb 2.48 -0.36 -0.01 0.00 -2.10 0.00 0.00 29.16 29.17 2bm9 h TRP 41 CO 1.50 0.56 -0.44 0.00 -2.79 0.00 0.00 178.44 177.27 2bm9 h ALA 42 N 1.50 0.92 0.00 2.65 0.00 -1.88 -2.97 119.26 119.47 2bm9 h ALA 42 Ca 0.40 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bm9 h ALA 42 Cb 0.20 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2bm9 h ALA 42 CO -0.15 0.55 0.00 0.39 0.00 0.00 0.00 179.25 180.03 2bm9 n GLU 43 N -3.50 0.07 -2.35 0.00 1.02 -0.87 -4.92 120.64 110.09 2bm9 n GLU 43 Ca 0.00 0.06 -0.41 0.00 -0.02 0.00 0.00 57.16 56.80 2bm9 n GLU 43 Cb 0.57 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.45 2bm9 n GLU 43 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bm9 s ALA 44 N -2.91 3.44 0.30 0.62 0.00 -1.12 -4.96 121.76 117.12 2bm9 s ALA 44 Ca 0.15 1.00 -0.27 0.00 0.00 0.00 0.00 51.96 52.84 2bm9 s ALA 44 Cb 0.17 -3.40 -0.14 0.00 0.00 0.00 0.00 23.12 19.75 2bm9 s ALA 44 CO 0.44 -0.35 0.77 -2.30 0.00 0.00 0.00 175.76 174.33 2bm9 n PRO 45 N 1.70 0.82 0.00 0.00 -0.02 -1.26 -4.91 135.00 131.34 2bm9 n PRO 45 Ca 0.02 0.29 0.11 0.00 -2.02 0.00 0.00 63.50 61.89 2bm9 n PRO 45 Cb 0.44 -1.55 -0.06 0.00 -0.02 0.00 0.00 33.50 32.31 2bm9 n PRO 45 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2bm9 n ARG 46 N 0.75 0.17 -2.53 -0.52 5.12 -1.26 -5.00 116.66 113.39 2bm9 n ARG 46 Ca 0.12 -0.03 -0.28 0.00 -1.93 0.00 0.00 57.85 55.73 2bm9 n ARG 46 Cb 0.32 -1.52 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 2bm9 n ARG 46 CO 0.00 0.00 0.00 0.16 -1.93 0.00 0.00 177.63 175.86 2bm9 s ASP 47 N -3.45 6.25 0.21 0.55 1.47 -1.26 -4.98 116.67 115.45 2bm9 s ASP 47 Ca 0.05 0.99 -0.10 0.00 1.18 0.00 0.00 52.55 54.66 2bm9 s ASP 47 Cb 0.15 -2.27 0.27 0.00 -0.34 0.00 0.00 42.92 40.74 2bm9 s ASP 47 CO 0.85 -0.62 1.73 0.25 0.68 0.00 0.00 175.17 178.05 2bm9 h LEU 48 N 0.15 0.14 0.00 2.11 5.85 -2.05 -3.46 115.31 118.05 2bm9 h LEU 48 Ca -0.47 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.34 2bm9 h LEU 48 Cb 1.20 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.32 2bm9 h LEU 48 CO 0.62 0.09 0.00 0.61 -0.34 0.00 0.00 178.44 179.41 2bm9 n GLY 49 N -1.30 1.18 0.00 3.75 0.00 -1.26 -5.07 105.19 102.49 2bm9 n GLY 49 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2bm9 n GLY 49 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2bm9 n TYR 50 N -1.59 0.00 -2.14 1.61 0.18 -1.26 -4.44 117.16 109.52 2bm9 n TYR 50 Ca 0.00 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.36 2bm9 n TYR 50 Cb 0.00 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 38.93 2bm9 n TYR 50 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2bm9 s SER 51 N 0.00 6.77 -0.05 9.48 0.15 -1.26 -4.90 113.70 123.89 2bm9 s SER 51 Ca 0.00 2.18 0.10 0.00 0.70 0.00 0.00 55.95 58.92 2bm9 s SER 51 Cb 0.00 -2.55 0.37 0.00 -1.71 0.00 0.00 66.02 62.13 2bm9 s SER 51 CO 0.00 -0.80 1.22 -0.90 1.20 0.00 0.00 173.24 173.96 2bm9 n ASP 52 N 5.90 2.65 -4.64 5.45 5.75 -1.26 -4.66 116.55 125.73 2bm9 n ASP 52 Ca 0.15 -2.21 -0.43 0.00 -0.01 0.00 0.00 54.79 52.29 2bm9 n ASP 52 Cb 0.43 -0.40 -0.02 0.00 -1.03 0.00 0.00 41.12 40.09 2bm9 n ASP 52 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 2bm9 s PHE 53 N -1.67 2.92 -0.68 2.11 2.19 -1.26 -4.39 117.98 117.20 2bm9 s PHE 53 Ca 0.27 1.05 -0.08 0.00 0.33 0.00 0.00 56.93 58.50 2bm9 s PHE 53 Cb 0.17 -3.70 0.01 0.00 -1.31 0.00 0.00 43.02 38.19 2bm9 s PHE 53 CO 0.13 -1.31 0.56 0.45 1.83 0.00 0.00 175.22 176.89 2bm9 n SER 54 N 7.07 -4.48 -1.36 6.13 2.88 -1.26 -4.88 113.62 117.72 2bm9 n SER 54 Ca 0.13 -0.74 0.11 0.00 -1.33 0.00 0.00 58.87 57.04 2bm9 n SER 54 Cb 0.46 -1.45 0.32 0.00 -0.75 0.00 0.00 64.21 62.79 2bm9 n SER 54 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2bm9 n PRO 55 N -1.97 2.88 -3.99 -1.46 -0.04 -1.26 -5.03 135.00 124.13 2bm9 n PRO 55 Ca -0.25 -2.58 -0.28 0.00 -0.04 0.00 0.00 63.50 60.35 2bm9 n PRO 55 Cb 0.64 -1.63 -0.04 0.00 -0.04 0.00 0.00 33.50 32.42 2bm9 n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2bm9 s TYR 56 N -1.26 3.36 0.05 0.54 1.51 -1.26 -5.00 117.35 115.29 2bm9 s TYR 56 Ca 0.47 0.11 -0.21 0.00 -1.01 0.00 0.00 57.07 56.43 2bm9 s TYR 56 Cb 0.26 -1.64 0.05 0.00 -0.11 0.00 0.00 41.96 40.52 2bm9 s TYR 56 CO 0.30 0.53 0.49 1.14 -1.11 0.00 0.00 175.55 176.91 2bm9 s GLN 57 N -2.89 1.01 -0.16 -0.62 1.03 -1.26 -1.22 119.66 115.54 2bm9 s GLN 57 Ca 0.33 -0.27 -0.01 0.00 0.04 0.00 0.00 55.36 55.45 2bm9 s GLN 57 Cb -0.11 0.46 0.04 0.00 0.03 0.00 0.00 33.01 33.43 2bm9 s GLN 57 CO 0.26 -0.36 -0.03 -0.46 -2.54 0.00 0.00 175.29 172.16 2bm9 s TRP 58 N -2.46 1.49 -1.63 9.60 -0.11 0.93 -4.79 118.94 121.97 2bm9 s TRP 58 Ca -0.05 -0.97 -0.14 0.00 1.22 0.00 0.00 56.10 56.16 2bm9 s TRP 58 Cb -0.01 -1.21 0.12 0.00 -1.50 0.00 0.00 33.47 30.87 2bm9 s TRP 58 CO -0.02 -0.59 0.70 0.54 -4.62 0.00 0.00 176.95 172.96 2bm9 n ARG 59 N 4.93 -3.29 -0.76 5.86 1.74 -1.26 -1.37 116.66 122.50 2bm9 n ARG 59 Ca -0.11 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 2bm9 n ARG 59 Cb 0.48 -4.97 0.00 0.00 -1.02 0.00 0.00 32.46 26.95 2bm9 n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bm9 n GLY 60 N -1.57 0.59 3.32 -0.13 0.00 -1.26 -5.04 105.19 101.10 2bm9 n GLY 60 Ca -0.02 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 2bm9 n GLY 60 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bm9 s LEU 61 N 0.00 2.16 0.24 0.99 1.43 -0.47 -4.22 118.68 118.80 2bm9 s LEU 61 Ca 0.00 -0.56 -0.30 0.00 -1.03 0.00 0.00 54.13 52.24 2bm9 s LEU 61 Cb 0.00 -1.21 -0.09 0.00 0.03 0.00 0.00 46.19 44.92 2bm9 s LEU 61 CO 0.00 0.24 1.21 -0.13 0.23 0.00 0.00 176.35 177.90 2bm9 s ARG 62 N -1.17 4.49 -0.24 1.70 0.52 -1.26 -0.05 118.95 122.95 2bm9 s ARG 62 Ca 0.11 1.95 -0.03 0.00 -0.52 0.00 0.00 55.73 57.23 2bm9 s ARG 62 Cb -0.10 -3.18 0.00 0.00 0.52 0.00 0.00 34.95 32.19 2bm9 s ARG 62 CO 0.02 -0.04 -0.04 -1.64 0.02 0.00 0.00 175.30 173.62 2bm9 s MET 63 N -0.89 3.18 0.19 3.54 -1.94 -0.36 -3.98 119.30 119.04 2bm9 s MET 63 Ca 0.50 -0.76 0.18 0.00 -1.71 0.00 0.00 55.69 53.90 2bm9 s MET 63 Cb -0.34 -3.03 0.00 0.00 2.01 0.00 0.00 34.83 33.46 2bm9 s MET 63 CO 0.41 -0.28 1.13 -0.07 -0.01 0.00 0.00 175.02 176.20 2bm9 h LEU 64 N 8.09 0.00 -9.59 -0.03 3.38 -1.96 -3.38 115.31 111.83 2bm9 h LEU 64 Ca -0.38 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.06 2bm9 h LEU 64 Cb 1.14 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.92 2bm9 h LEU 64 CO 0.60 0.37 0.71 -0.54 0.09 0.00 0.00 178.44 179.66 2bm9 s LYS 65 N -3.06 4.34 0.46 1.13 -0.14 -1.26 -5.01 119.74 116.20 2bm9 s LYS 65 Ca 0.01 2.08 0.00 0.00 -1.36 0.00 0.00 55.97 56.70 2bm9 s LYS 65 Cb 0.08 -3.23 -0.00 0.00 -1.68 0.00 0.00 37.83 33.00 2bm9 s LYS 65 CO 0.77 -0.39 0.69 0.16 -0.76 0.00 0.00 175.35 175.82 2bm9 s ASP 66 N 0.87 5.80 0.26 2.83 1.47 -1.26 -4.86 116.67 121.77 2bm9 s ASP 66 Ca 0.62 0.29 -0.08 0.00 1.18 0.00 0.00 52.55 54.57 2bm9 s ASP 66 Cb -0.37 -1.51 0.44 0.00 -0.34 0.00 0.00 42.92 41.15 2bm9 s ASP 66 CO 0.33 -0.74 1.60 -0.65 0.68 0.00 0.00 175.17 176.39 2bm9 h PRO 67 N 0.36 0.03 -0.61 2.11 0.11 -1.96 -0.35 132.00 131.69 2bm9 h PRO 67 Ca -0.46 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.66 2bm9 h PRO 67 Cb 1.25 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 2bm9 h PRO 67 CO 0.57 0.02 0.41 -0.44 -0.21 0.00 0.00 178.00 178.35 2bm9 h ASP 68 N 0.03 0.69 -0.36 -2.05 5.19 -1.94 -1.31 116.42 116.67 2bm9 h ASP 68 Ca 0.43 -0.02 -0.16 0.00 -0.62 0.00 0.00 57.03 56.67 2bm9 h ASP 68 Cb 0.74 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 40.08 2bm9 h ASP 68 CO -0.80 0.49 -0.40 0.74 -3.12 0.00 0.00 179.24 176.15 2bm9 h THR 69 N 0.81 1.27 -0.81 0.35 2.02 -1.39 -3.01 112.91 112.16 2bm9 h THR 69 Ca 0.23 -1.57 -0.00 0.00 0.77 0.00 0.00 66.41 65.83 2bm9 h THR 69 Cb -0.06 1.43 -0.04 0.00 -1.74 0.00 0.00 68.15 67.74 2bm9 h THR 69 CO -0.05 0.52 0.50 1.56 0.37 0.00 0.00 175.52 178.42 2bm9 h GLN 70 N 0.72 1.08 -0.66 6.66 4.20 -0.58 -1.40 115.11 125.14 2bm9 h GLN 70 Ca 0.05 -0.09 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 2bm9 h GLN 70 Cb 1.00 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.51 2bm9 h GLN 70 CO 0.10 0.75 0.23 0.00 -0.67 0.00 0.00 178.83 179.23 2bm9 h ALA 71 N 1.44 1.17 -0.26 3.87 0.00 -1.34 -0.03 119.26 124.12 2bm9 h ALA 71 Ca 0.29 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2bm9 h ALA 71 Cb -0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 2bm9 h ALA 71 CO -0.06 0.59 -0.17 0.28 0.00 0.00 0.00 179.25 179.89 2bm9 h VAL 72 N 0.96 1.31 -0.48 0.00 2.07 -1.22 -2.16 116.25 116.71 2bm9 h VAL 72 Ca 0.22 -1.29 -0.11 0.00 0.82 0.00 0.00 66.70 66.35 2bm9 h VAL 72 Cb 0.24 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 2bm9 h VAL 72 CO -0.01 0.40 -0.11 1.88 0.02 0.00 0.00 177.57 179.75 2bm9 h TYR 73 N 0.29 1.04 -0.30 1.57 0.99 -0.96 -0.33 116.97 119.28 2bm9 h TYR 73 Ca 0.05 -0.22 0.07 0.00 2.00 0.00 0.00 58.73 60.63 2bm9 h TYR 73 Cb 0.70 -0.26 -0.08 0.00 1.00 0.00 0.00 36.73 38.10 2bm9 h TYR 73 CO 0.07 1.00 -0.24 1.25 -0.00 0.00 0.00 178.16 180.24 2bm9 h HIS 74 N 0.78 -0.64 -0.92 4.88 2.76 -1.00 0.32 115.15 121.33 2bm9 h HIS 74 Ca 0.12 0.04 0.05 0.00 -2.20 0.00 0.00 60.37 58.39 2bm9 h HIS 74 Cb 0.66 0.32 -0.06 0.00 1.55 0.00 0.00 27.41 29.88 2bm9 h HIS 74 CO 0.05 -0.32 0.59 -0.44 -1.30 0.00 0.00 177.93 176.51 2bm9 h ASP 75 N -0.22 0.95 -0.09 3.26 3.32 -0.78 -0.12 116.42 122.74 2bm9 h ASP 75 Ca 0.15 0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.10 2bm9 h ASP 75 Cb 0.46 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2bm9 h ASP 75 CO -0.42 0.62 -0.31 -0.03 -1.72 0.00 0.00 179.24 177.37 2bm9 h MET 76 N 1.09 0.56 0.13 3.56 1.85 -0.34 -1.27 114.93 120.52 2bm9 h MET 76 Ca 0.39 -0.25 -0.01 0.00 -0.61 0.00 0.00 59.70 59.23 2bm9 h MET 76 Cb 0.12 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 32.13 2bm9 h MET 76 CO -0.16 0.81 -0.06 -0.07 -0.40 0.00 0.00 176.91 177.03 2bm9 h LEU 77 N 0.48 -0.15 -0.97 3.39 4.07 0.41 -1.94 115.31 120.61 2bm9 h LEU 77 Ca 0.06 -0.40 0.23 0.00 0.08 0.00 0.00 57.88 57.85 2bm9 h LEU 77 Cb 0.78 0.04 -0.12 0.00 1.08 0.00 0.00 40.66 42.44 2bm9 h LEU 77 CO 0.06 0.41 0.53 -0.25 -1.08 0.00 0.00 178.44 178.11 2bm9 h TRP 78 N -0.81 0.90 0.04 1.13 2.91 -1.05 -2.21 115.95 116.86 2bm9 h TRP 78 Ca -0.02 0.04 -0.13 0.00 1.13 0.00 0.00 58.89 59.91 2bm9 h TRP 78 Cb 0.54 -0.25 0.01 0.00 -0.51 0.00 0.00 29.16 28.96 2bm9 h TRP 78 CO 0.09 0.05 -0.54 1.49 -1.03 0.00 0.00 178.44 178.50 2bm9 h GLU 79 N 0.54 0.30 -2.64 2.65 4.81 -1.21 -3.39 114.58 115.64 2bm9 h GLU 79 Ca 0.61 -0.37 -0.61 0.00 -0.13 0.00 0.00 59.36 58.86 2bm9 h GLU 79 Cb 1.14 0.12 -0.42 0.00 0.63 0.00 0.00 28.75 30.22 2bm9 h GLU 79 CO -0.48 1.09 -0.57 -0.11 -0.73 0.00 0.00 179.01 178.21 2bm9 n LEU 80 N -4.28 3.43 -4.47 1.64 -0.00 -0.73 -5.04 117.00 107.55 2bm9 n LEU 80 Ca -0.11 -5.33 -0.52 0.00 -0.00 0.00 0.00 56.01 50.04 2bm9 n LEU 80 Cb 0.66 -0.72 -0.07 0.00 -0.00 0.00 0.00 43.42 43.29 2bm9 n LEU 80 CO 0.45 1.91 1.73 0.54 -0.00 0.00 0.00 177.39 182.01 2bm9 n ARG 81 N 1.39 1.04 -3.40 1.96 1.74 -0.86 -4.66 116.66 113.87 2bm9 n ARG 81 Ca 0.25 0.30 -0.38 0.00 -0.77 0.00 0.00 57.85 57.25 2bm9 n ARG 81 Cb 0.38 -2.35 -0.06 0.00 -1.02 0.00 0.00 32.46 29.41 2bm9 n ARG 81 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2bm9 s PRO 82 N 5.81 4.16 0.02 5.56 0.04 -1.26 -4.39 135.00 144.94 2bm9 s PRO 82 Ca 1.08 0.44 0.25 0.00 0.04 0.00 0.00 61.00 62.82 2bm9 s PRO 82 Cb -0.93 -3.33 1.05 0.00 0.04 0.00 0.00 34.50 31.33 2bm9 s PRO 82 CO 0.52 0.42 1.79 0.54 0.04 0.00 0.00 177.00 180.32 2bm9 n ARG 83 N 2.74 0.02 -3.65 4.56 1.74 -0.41 -4.30 116.66 117.36 2bm9 n ARG 83 Ca -0.10 0.09 -0.04 0.00 -0.77 0.00 0.00 57.85 57.02 2bm9 n ARG 83 Cb 0.52 -1.53 -0.06 0.00 -1.02 0.00 0.00 32.46 30.37 2bm9 n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2bm9 s THR 84 N -3.01 -0.65 -0.04 0.55 2.01 -1.16 0.37 115.64 113.70 2bm9 s THR 84 Ca 0.12 0.04 0.03 0.00 0.31 0.00 0.00 61.69 62.18 2bm9 s THR 84 Cb 0.16 -0.92 -0.03 0.00 0.01 0.00 0.00 72.50 71.72 2bm9 s THR 84 CO 0.46 0.01 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.67 2bm9 s ILE 85 N 2.47 3.34 -0.27 1.82 1.01 -0.21 -1.86 121.20 127.50 2bm9 s ILE 85 Ca -0.06 -0.69 -0.01 0.00 0.00 0.00 0.00 60.65 59.89 2bm9 s ILE 85 Cb -0.10 -2.36 0.08 0.00 0.01 0.00 0.00 42.46 40.09 2bm9 s ILE 85 CO -0.18 0.54 0.05 -0.69 0.00 0.00 0.00 174.94 174.67 2bm9 s VAL 86 N -0.81 0.95 0.03 2.92 1.01 -0.34 -1.14 120.40 123.02 2bm9 s VAL 86 Ca 0.13 -1.19 -0.23 0.00 0.00 0.00 0.00 61.98 60.69 2bm9 s VAL 86 Cb -0.11 -1.56 -0.06 0.00 0.00 0.00 0.00 36.38 34.65 2bm9 s VAL 86 CO 0.02 -0.45 0.69 -1.61 0.00 0.00 0.00 175.10 173.74 2bm9 s GLU 87 N 1.61 4.41 -0.34 2.72 0.41 -0.58 0.12 118.70 127.05 2bm9 s GLU 87 Ca 0.04 0.92 0.03 0.00 -0.41 0.00 0.00 54.97 55.55 2bm9 s GLU 87 Cb -0.18 -3.34 0.09 0.00 -1.78 0.00 0.00 34.13 28.93 2bm9 s GLU 87 CO -0.17 0.35 0.05 -1.17 -0.49 0.00 0.00 175.26 173.83 2bm9 s LEU 88 N -0.23 4.60 0.00 1.80 0.20 -0.56 -1.82 118.68 122.67 2bm9 s LEU 88 Ca 0.35 -1.98 0.00 0.00 0.69 0.00 0.00 54.13 53.19 2bm9 s LEU 88 Cb -0.20 -1.65 0.00 0.00 -0.43 0.00 0.00 46.19 43.91 2bm9 s LEU 88 CO 0.21 -0.37 0.00 0.61 -0.29 0.00 0.00 176.35 176.51 2bm9 n GLY 89 N 4.35 3.66 0.35 7.98 0.00 -0.18 0.13 105.19 121.47 2bm9 n GLY 89 Ca -0.01 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.80 2bm9 n GLY 89 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2bm9 n VAL 90 N 0.10 0.00 0.00 1.61 0.31 -1.26 -4.67 118.33 114.43 2bm9 n VAL 90 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2bm9 n VAL 90 Cb 0.00 -0.56 0.00 0.00 -0.91 0.00 0.00 33.84 32.37 2bm9 n VAL 90 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2bm9 n TYR 91 N -2.35 0.00 1.13 3.52 9.36 -1.26 -1.01 117.16 126.54 2bm9 n TYR 91 Ca 0.00 0.00 0.13 0.00 3.32 0.00 0.00 57.90 61.35 2bm9 n TYR 91 Cb 0.34 0.00 0.37 0.00 -0.63 0.00 0.00 39.34 39.42 2bm9 n TYR 91 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 2bm9 n ASN 92 N 4.47 0.63 0.00 2.98 6.94 -1.17 -3.45 115.26 125.66 2bm9 n ASN 92 Ca 0.00 -0.44 0.00 0.00 -0.02 0.00 0.00 54.58 54.12 2bm9 n ASN 92 Cb 0.00 0.11 0.00 0.00 -2.36 0.00 0.00 39.78 37.53 2bm9 n ASN 92 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2bm9 n GLY 93 N 1.42 0.59 0.24 4.83 0.00 -0.18 -1.13 105.19 110.95 2bm9 n GLY 93 Ca 0.09 -0.09 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 2bm9 n GLY 93 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bm9 h GLY 94 N 0.00 0.86 0.41 -0.02 0.00 -1.80 0.24 103.07 102.76 2bm9 h GLY 94 Ca 0.00 -0.50 0.14 0.00 0.00 0.00 0.00 47.33 46.96 2bm9 h GLY 94 CO 0.00 0.47 0.62 1.76 0.00 0.00 0.00 176.54 179.39 2bm9 h SER 95 N 0.71 0.87 0.96 0.19 0.02 -1.89 -0.09 113.55 114.31 2bm9 h SER 95 Ca 0.17 0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 61.13 2bm9 h SER 95 Cb 0.26 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 62.70 2bm9 h SER 95 CO -0.01 0.43 -0.47 -0.07 -1.14 0.00 0.00 176.83 175.58 2bm9 h LEU 96 N 0.91 -1.11 -1.54 5.07 4.07 -1.37 -1.21 115.31 120.14 2bm9 h LEU 96 Ca 0.51 0.04 -0.00 0.00 0.08 0.00 0.00 57.88 58.51 2bm9 h LEU 96 Cb 0.60 0.29 -0.00 0.00 1.08 0.00 0.00 40.66 42.63 2bm9 h LEU 96 CO -0.28 -0.79 -0.00 0.00 -1.08 0.00 0.00 178.44 176.29 2bm9 h ALA 97 N -1.24 1.00 -0.05 1.53 0.00 -1.07 -2.24 119.26 117.20 2bm9 h ALA 97 Ca -0.13 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2bm9 h ALA 97 Cb 0.99 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 2bm9 h ALA 97 CO 0.21 0.00 -0.07 2.35 0.00 0.00 0.00 179.25 181.75 2bm9 h TRP 98 N 0.00 0.16 -0.30 0.00 7.01 -0.95 -2.37 115.95 119.50 2bm9 h TRP 98 Ca -0.00 -0.05 -0.05 0.00 2.11 0.00 0.00 58.89 60.90 2bm9 h TRP 98 Cb 0.49 -0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.50 2bm9 h TRP 98 CO 0.00 0.63 -0.03 0.74 -2.79 0.00 0.00 178.44 176.98 2bm9 h PHE 99 N -0.35 0.49 -0.18 2.65 0.05 -0.65 -0.94 116.94 118.02 2bm9 h PHE 99 Ca 0.01 -0.05 -0.12 0.00 3.82 0.00 0.00 57.97 61.63 2bm9 h PHE 99 Cb 0.61 -0.14 0.00 0.00 2.00 0.00 0.00 35.95 38.42 2bm9 h PHE 99 CO 0.10 0.51 -0.35 -0.09 -0.18 0.00 0.00 178.31 178.31 2bm9 h ARG 100 N 0.45 0.54 -0.23 1.51 1.12 -1.53 -2.99 114.38 113.25 2bm9 h ARG 100 Ca 0.10 -0.35 -0.04 0.00 -1.11 0.00 0.00 59.98 58.58 2bm9 h ARG 100 Cb 0.35 0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 30.34 2bm9 h ARG 100 CO 0.01 0.96 -0.00 -0.44 -3.11 0.00 0.00 179.97 177.39 2bm9 h ASP 101 N 0.20 0.40 -0.06 -3.80 3.32 -0.66 -0.77 116.42 115.05 2bm9 h ASP 101 Ca 0.01 -0.31 0.03 0.00 0.02 0.00 0.00 57.03 56.77 2bm9 h ASP 101 Cb 0.94 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.35 2bm9 h ASP 101 CO 0.08 0.62 -0.13 -0.07 -1.72 0.00 0.00 179.24 178.01 2bm9 h LEU 102 N 0.17 -0.40 -1.43 1.55 4.07 -1.37 -1.32 115.31 116.58 2bm9 h LEU 102 Ca 0.06 0.07 0.15 0.00 0.08 0.00 0.00 57.88 58.24 2bm9 h LEU 102 Cb 0.41 0.18 -0.06 0.00 1.08 0.00 0.00 40.66 42.27 2bm9 h LEU 102 CO 0.01 -0.18 0.55 0.71 -1.08 0.00 0.00 178.44 178.45 2bm9 h THR 103 N -0.19 0.80 -0.34 0.22 1.35 -1.36 -1.58 112.91 111.82 2bm9 h THR 103 Ca 0.07 -0.19 -0.02 0.00 -0.55 0.00 0.00 66.41 65.72 2bm9 h THR 103 Cb 0.29 0.21 -0.02 0.00 -1.73 0.00 0.00 68.15 66.90 2bm9 h THR 103 CO -0.18 0.10 0.15 0.50 -0.25 0.00 0.00 175.52 175.84 2bm9 h LYS 104 N 0.55 0.50 0.00 4.72 3.64 0.01 -2.08 116.57 123.91 2bm9 h LYS 104 Ca 0.42 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.70 2bm9 h LYS 104 Cb 0.81 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.54 2bm9 h LYS 104 CO -0.17 0.48 -0.08 0.82 -2.27 0.00 0.00 179.45 178.23 2bm9 h ILE 105 N 0.40 0.18 -0.01 2.00 2.04 -0.95 -2.94 117.51 118.24 2bm9 h ILE 105 Ca 0.11 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.13 2bm9 h ILE 105 Cb 0.15 1.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 2bm9 h ILE 105 CO -0.01 0.08 -0.15 0.23 0.00 0.00 0.00 178.15 178.30 2bm9 n MET 106 N -3.18 0.87 -1.73 2.37 2.81 -0.66 -4.92 117.12 112.69 2bm9 n MET 106 Ca 0.01 -0.41 -0.08 0.00 -1.81 0.00 0.00 57.70 55.41 2bm9 n MET 106 Cb 0.40 -1.49 -0.02 0.00 -0.71 0.00 0.00 33.22 31.40 2bm9 n MET 106 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2bm9 n GLY 107 N 1.28 0.49 3.67 3.03 0.00 -1.06 -5.01 105.19 107.60 2bm9 n GLY 107 Ca 0.14 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 2bm9 n GLY 107 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bm9 s ILE 108 N -2.37 5.15 -0.85 -0.61 -1.09 -0.82 -5.02 121.20 115.59 2bm9 s ILE 108 Ca 0.00 0.85 -0.22 0.00 -2.23 0.00 0.00 60.65 59.05 2bm9 s ILE 108 Cb 0.00 -3.79 0.08 0.00 -1.58 0.00 0.00 42.46 37.17 2bm9 s ILE 108 CO 0.00 0.22 1.17 -0.62 -1.23 0.00 0.00 174.94 174.48 2bm9 s ASP 109 N 1.06 6.42 -0.07 3.58 -1.08 -1.26 -4.52 116.67 120.80 2bm9 s ASP 109 Ca 0.22 -1.44 0.01 0.00 -0.52 0.00 0.00 52.55 50.83 2bm9 s ASP 109 Cb -0.15 -2.46 0.02 0.00 -1.46 0.00 0.00 42.92 38.87 2bm9 s ASP 109 CO 0.09 -1.36 -0.09 0.00 0.52 0.00 0.00 175.17 174.33 2bm9 s GLN 111 N 0.96 3.97 0.11 0.00 -1.52 0.16 -4.87 119.66 118.47 2bm9 s GLN 111 Ca -0.09 0.11 -0.18 0.00 -1.95 0.00 0.00 55.36 53.25 2bm9 s GLN 111 Cb -0.15 -3.68 -0.07 0.00 -0.22 0.00 0.00 33.01 28.90 2bm9 s GLN 111 CO 0.00 -0.36 0.57 0.08 -0.25 0.00 0.00 175.29 175.34 2bm9 s VAL 112 N 2.20 4.77 -0.01 1.09 1.01 -0.71 -1.04 120.40 127.71 2bm9 s VAL 112 Ca 0.18 1.09 -0.00 0.00 0.00 0.00 0.00 61.98 63.25 2bm9 s VAL 112 Cb -0.16 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.40 2bm9 s VAL 112 CO 0.10 0.43 0.02 -0.63 0.00 0.00 0.00 175.10 175.01 2bm9 s ILE 113 N -1.26 -0.03 -0.02 2.22 1.01 -0.29 -2.03 121.20 120.80 2bm9 s ILE 113 Ca 0.33 0.10 0.06 0.00 0.00 0.00 0.00 60.65 61.14 2bm9 s ILE 113 Cb -0.18 -0.05 -0.01 0.00 0.01 0.00 0.00 42.46 42.23 2bm9 s ILE 113 CO 0.19 0.04 -0.20 -0.83 0.00 0.00 0.00 174.94 174.14 2bm9 s GLY 114 N 0.49 0.99 -0.02 6.18 0.00 -0.70 -1.53 107.32 112.73 2bm9 s GLY 114 Ca -0.04 -0.86 0.05 0.00 0.00 0.00 0.00 44.72 43.87 2bm9 s GLY 114 CO -0.01 -0.68 -0.16 -0.42 0.00 0.00 0.00 173.10 171.83 2bm9 s ILE 115 N -0.41 1.27 -0.25 0.90 1.01 -0.75 -1.80 121.20 121.17 2bm9 s ILE 115 Ca 0.06 -0.68 -0.27 0.00 0.00 0.00 0.00 60.65 59.76 2bm9 s ILE 115 Cb -0.08 -1.06 0.15 0.00 0.01 0.00 0.00 42.46 41.47 2bm9 s ILE 115 CO -0.00 0.36 1.15 -0.62 0.00 0.00 0.00 174.94 175.83 2bm9 s ASP 116 N -0.30 -0.28 0.45 3.58 -1.08 -0.75 -1.02 116.67 117.26 2bm9 s ASP 116 Ca 0.05 0.44 0.22 0.00 -0.52 0.00 0.00 52.55 52.73 2bm9 s ASP 116 Cb -0.07 0.41 1.04 0.00 -1.46 0.00 0.00 42.92 42.84 2bm9 s ASP 116 CO -0.00 -0.17 1.91 0.08 0.52 0.00 0.00 175.17 177.51 2bm9 h ARG 117 N 3.13 0.00 -4.31 4.34 0.11 -1.77 -2.64 114.38 113.24 2bm9 h ARG 117 Ca -0.22 0.00 -0.57 0.00 0.10 0.00 0.00 59.98 59.29 2bm9 h ARG 117 Cb 1.18 0.00 -0.37 0.00 1.11 0.00 0.00 29.97 31.88 2bm9 h ARG 117 CO 0.20 0.24 -0.80 0.34 0.10 0.00 0.00 179.97 180.06 2bm9 s ASP 118 N -6.40 2.89 -0.18 0.08 -1.08 -1.26 -4.79 116.67 105.94 2bm9 s ASP 118 Ca -0.02 -0.67 0.11 0.00 -0.52 0.00 0.00 52.55 51.46 2bm9 s ASP 118 Cb 0.12 -1.01 -0.19 0.00 -1.46 0.00 0.00 42.92 40.39 2bm9 s ASP 118 CO 0.65 -0.16 -0.01 0.18 0.52 0.00 0.00 175.17 176.34 2bm9 n LEU 119 N 4.83 0.87 -0.23 -1.34 4.77 -1.26 -4.66 117.00 119.96 2bm9 n LEU 119 Ca -0.13 -0.03 0.18 0.00 -0.03 0.00 0.00 56.01 56.00 2bm9 n LEU 119 Cb 0.48 0.08 0.28 0.00 -2.33 0.00 0.00 43.42 41.93 2bm9 n LEU 119 CO 0.18 0.54 0.51 -1.54 -1.33 0.00 0.00 177.39 175.75 2bm9 n SER 120 N -2.77 0.02 -1.10 -1.43 3.41 -1.26 0.31 113.62 110.80 2bm9 n SER 120 Ca -0.30 0.39 -0.02 0.00 -0.26 0.00 0.00 58.87 58.67 2bm9 n SER 120 Cb 1.00 -0.19 0.08 0.00 -0.26 0.00 0.00 64.21 64.84 2bm9 n SER 120 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2bm9 n ARG 121 N -2.84 1.67 -3.53 4.33 3.00 -1.26 -4.91 116.66 113.11 2bm9 n ARG 121 Ca 0.16 -0.81 -0.37 0.00 -0.01 0.00 0.00 57.85 56.82 2bm9 n ARG 121 Cb 0.68 -1.50 -0.07 0.00 0.00 0.00 0.00 32.46 31.57 2bm9 n ARG 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2bm9 n GLN 123 N 3.83 3.13 -2.83 0.00 1.13 -0.28 -4.94 117.38 117.42 2bm9 n GLN 123 Ca -0.12 -2.60 -0.42 0.00 -1.94 0.00 0.00 57.00 51.92 2bm9 n GLN 123 Cb 0.52 -1.63 -0.04 0.00 0.11 0.00 0.00 30.24 29.20 2bm9 n GLN 123 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2bm9 s ILE 124 N -1.44 4.75 0.71 5.09 1.01 -1.25 -5.02 121.20 125.05 2bm9 s ILE 124 Ca 0.43 1.56 -0.15 0.00 0.00 0.00 0.00 60.65 62.49 2bm9 s ILE 124 Cb 0.25 -4.20 0.03 0.00 0.01 0.00 0.00 42.46 38.55 2bm9 s ILE 124 CO 0.24 -0.20 1.20 -2.16 0.00 0.00 0.00 174.94 174.01 2bm9 s PRO 125 N 3.06 2.26 0.33 2.79 0.04 -1.26 -4.93 135.00 137.29 2bm9 s PRO 125 Ca 0.37 1.73 0.02 0.00 0.04 0.00 0.00 61.00 63.16 2bm9 s PRO 125 Cb -0.14 -1.85 0.58 0.00 0.04 0.00 0.00 34.50 33.13 2bm9 s PRO 125 CO 0.10 -1.73 1.92 0.00 0.04 0.00 0.00 177.00 177.33 2bm9 h ALA 126 N -0.18 1.42 0.00 8.56 0.00 -2.01 -0.88 119.26 126.17 2bm9 h ALA 126 Ca -0.48 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2bm9 h ALA 126 Cb 1.29 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2bm9 h ALA 126 CO 0.50 0.44 0.03 0.66 0.00 0.00 0.00 179.25 180.89 2bm9 h SER 127 N 0.71 0.00 -0.10 0.00 4.64 -2.04 -3.17 113.55 113.58 2bm9 h SER 127 Ca 0.17 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.44 2bm9 h SER 127 Cb 0.14 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.20 2bm9 h SER 127 CO -0.02 0.00 -0.29 -0.67 -0.87 0.00 0.00 176.83 174.98 2bm9 n ASP 128 N -2.42 2.11 -1.59 4.97 -0.08 -0.33 -4.77 116.55 114.43 2bm9 n ASP 128 Ca -0.02 -3.71 0.08 0.00 -1.51 0.00 0.00 54.79 49.63 2bm9 n ASP 128 Cb 0.07 -0.54 0.36 0.00 2.34 0.00 0.00 41.12 43.35 2bm9 n ASP 128 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12 2bm9 n MET 129 N -1.14 4.26 -2.06 -0.67 1.56 -1.20 -4.90 117.12 112.97 2bm9 n MET 129 Ca 0.22 -3.04 -0.43 0.00 -0.27 0.00 0.00 57.70 54.18 2bm9 n MET 129 Cb 0.78 -2.11 -0.03 0.00 2.15 0.00 0.00 33.22 34.02 2bm9 n MET 129 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 2bm9 s GLU 130 N -2.67 3.87 0.00 2.12 2.12 -1.26 -1.95 118.70 120.93 2bm9 s GLU 130 Ca 0.51 1.82 0.00 0.00 0.36 0.00 0.00 54.97 57.66 2bm9 s GLU 130 Cb 0.39 -4.04 0.00 0.00 0.26 0.00 0.00 34.13 30.74 2bm9 s GLU 130 CO 0.15 -1.21 0.00 0.09 -0.54 0.00 0.00 175.26 173.75 2bm9 n ASN 131 N 8.24 -1.78 -4.89 -1.70 3.02 -1.26 -4.99 115.26 111.89 2bm9 n ASN 131 Ca 0.19 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.39 2bm9 n ASN 131 Cb 0.45 -1.33 -0.05 0.00 -0.61 0.00 0.00 39.78 38.23 2bm9 n ASN 131 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2bm9 s ILE 132 N -2.27 5.45 -0.03 2.41 1.01 -0.82 -1.73 121.20 125.22 2bm9 s ILE 132 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 60.65 60.63 2bm9 s ILE 132 Cb 0.00 -3.48 0.03 0.00 0.01 0.00 0.00 42.46 39.02 2bm9 s ILE 132 CO 0.00 0.44 0.02 -0.89 0.00 0.00 0.00 174.94 174.52 2bm9 s THR 133 N -1.21 0.01 0.22 2.92 2.01 -0.86 -4.95 115.64 113.78 2bm9 s THR 133 Ca 0.22 0.20 0.01 0.00 0.31 0.00 0.00 61.69 62.44 2bm9 s THR 133 Cb -0.12 -0.16 -0.04 0.00 0.01 0.00 0.00 72.50 72.19 2bm9 s THR 133 CO 0.13 0.12 0.40 -0.76 -0.69 0.00 0.00 174.62 173.82 2bm9 s LEU 134 N 1.22 4.22 -0.10 4.42 1.02 -1.26 -1.72 118.68 126.48 2bm9 s LEU 134 Ca -0.07 0.32 -0.07 0.00 0.02 0.00 0.00 54.13 54.33 2bm9 s LEU 134 Cb -0.13 -3.11 0.04 0.00 0.02 0.00 0.00 46.19 43.01 2bm9 s LEU 134 CO -0.03 -0.07 0.26 -1.00 0.02 0.00 0.00 176.35 175.53 2bm9 s HIS 135 N -1.94 -0.32 -0.29 0.29 3.76 -0.75 -4.94 115.29 111.11 2bm9 s HIS 135 Ca 0.37 0.76 -0.11 0.00 -0.15 0.00 0.00 55.06 55.94 2bm9 s HIS 135 Cb -0.10 0.08 -0.03 0.00 1.11 0.00 0.00 32.58 33.63 2bm9 s HIS 135 CO 0.30 -0.19 0.18 -1.14 -0.85 0.00 0.00 174.74 173.04 2bm9 s GLN 136 N 0.71 3.72 0.02 1.40 0.74 -1.25 -1.81 119.66 123.18 2bm9 s GLN 136 Ca -0.05 -0.47 -0.28 0.00 0.05 0.00 0.00 55.36 54.62 2bm9 s GLN 136 Cb -0.06 -3.62 0.09 0.00 1.10 0.00 0.00 33.01 30.52 2bm9 s GLN 136 CO -0.04 -0.27 0.79 0.20 -0.55 0.00 0.00 175.29 175.42 2bm9 s GLY 137 N 1.71 -0.50 0.16 2.59 0.00 -0.99 -4.94 107.32 105.34 2bm9 s GLY 137 Ca 0.06 1.03 -0.01 0.00 0.00 0.00 0.00 44.72 45.81 2bm9 s GLY 137 CO 0.09 0.46 0.34 -0.35 0.00 0.00 0.00 173.10 173.64 2bm9 s ASP 138 N -2.21 6.39 -0.04 1.64 -1.08 -1.26 -2.57 116.67 117.53 2bm9 s ASP 138 Ca 0.01 0.36 -0.25 0.00 -0.52 0.00 0.00 52.55 52.15 2bm9 s ASP 138 Cb -0.01 -1.99 -0.20 0.00 -1.46 0.00 0.00 42.92 39.26 2bm9 s ASP 138 CO -0.06 0.02 1.10 0.00 0.52 0.00 0.00 175.17 176.75 2bm9 h SER 140 N -0.66 0.25 -3.57 0.00 4.64 -1.94 -3.31 113.55 108.95 2bm9 h SER 140 Ca -0.01 0.13 -0.62 0.00 -0.47 0.00 0.00 61.79 60.82 2bm9 h SER 140 Cb 0.56 0.11 -0.13 0.00 -0.31 0.00 0.00 62.40 62.63 2bm9 h SER 140 CO 0.01 -0.15 0.02 -0.62 -0.87 0.00 0.00 176.83 175.23 2bm9 s ASP 141 N -4.55 6.44 0.33 4.97 2.15 -1.20 -4.95 116.67 119.86 2bm9 s ASP 141 Ca -0.08 0.43 0.26 0.00 0.43 0.00 0.00 52.55 53.59 2bm9 s ASP 141 Cb 0.29 -2.29 0.79 0.00 -0.30 0.00 0.00 42.92 41.41 2bm9 s ASP 141 CO 0.82 -0.36 1.75 -0.07 -0.17 0.00 0.00 175.17 177.14 2bm9 h LEU 142 N 8.92 0.00 0.00 -1.34 3.38 -1.81 -3.25 115.31 121.20 2bm9 h LEU 142 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2bm9 h LEU 142 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2bm9 h LEU 142 CO 0.74 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.62 2bm9 n THR 143 N -2.62 0.09 0.90 0.22 -2.24 -1.26 -2.41 114.28 106.97 2bm9 n THR 143 Ca 0.04 0.02 0.09 0.00 -2.27 0.00 0.00 64.05 61.93 2bm9 n THR 143 Cb 0.40 -0.60 0.46 0.00 -2.10 0.00 0.00 70.33 68.49 2bm9 n THR 143 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2bm9 n THR 144 N -1.15 0.37 0.00 4.28 -1.04 -1.23 -4.08 114.28 111.44 2bm9 n THR 144 Ca 0.16 0.09 0.00 0.00 -2.04 0.00 0.00 64.05 62.26 2bm9 n THR 144 Cb 0.15 -0.81 0.00 0.00 -1.82 0.00 0.00 70.33 67.85 2bm9 n THR 144 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2bm9 n PHE 145 N -1.22 0.00 0.30 -1.42 3.01 -1.01 -4.64 117.46 112.48 2bm9 n PHE 145 Ca 0.09 0.00 0.19 0.00 1.01 0.00 0.00 57.45 58.74 2bm9 n PHE 145 Cb 0.12 0.00 0.89 0.00 -0.01 0.00 0.00 39.48 40.48 2bm9 n PHE 145 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2bm9 h GLU 146 N 0.00 0.00 0.00 -1.08 5.08 -1.71 -2.53 114.58 114.34 2bm9 h GLU 146 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2bm9 h GLU 146 Cb 0.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2bm9 h GLU 146 CO 0.00 0.01 0.55 0.72 -1.00 0.00 0.00 179.01 179.29 2bm9 n HIS 147 N -3.14 0.12 -0.46 4.33 8.25 -1.26 -2.97 115.22 120.09 2bm9 n HIS 147 Ca -0.01 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 2bm9 n HIS 147 Cb 0.21 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.13 2bm9 n HIS 147 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 2bm9 n LEU 148 N -1.67 0.75 0.00 2.41 -0.00 -0.95 -4.68 117.00 112.86 2bm9 n LEU 148 Ca -0.00 -0.75 0.07 0.00 -0.00 0.00 0.00 56.01 55.32 2bm9 n LEU 148 Cb 0.56 0.00 0.40 0.00 -0.00 0.00 0.00 43.42 44.38 2bm9 n LEU 148 CO 0.02 0.19 0.66 -2.11 -0.00 0.00 0.00 177.39 176.14 2bm9 n ARG 149 N -0.11 0.72 -2.87 1.47 1.85 -1.16 -2.67 116.66 113.90 2bm9 n ARG 149 Ca 0.00 0.00 -0.39 0.00 -1.00 0.00 0.00 57.85 56.46 2bm9 n ARG 149 Cb 0.22 -1.29 0.00 0.00 -1.05 0.00 0.00 32.46 30.33 2bm9 n ARG 149 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 2bm9 n GLU 150 N -0.79 4.61 -4.36 2.89 -0.00 -1.26 -4.99 120.64 116.74 2bm9 n GLU 150 Ca 0.10 -4.66 -0.18 0.00 -0.00 0.00 0.00 57.16 52.42 2bm9 n GLU 150 Cb 0.05 -2.44 -0.15 0.00 -0.00 0.00 0.00 31.44 28.90 2bm9 n GLU 150 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.13 178.54 2bm9 s MET 151 N -3.56 0.72 0.56 3.44 1.75 -1.09 -5.15 119.30 115.98 2bm9 s MET 151 Ca 0.38 -0.32 -0.17 0.00 -1.25 0.00 0.00 55.69 54.33 2bm9 s MET 151 Cb 0.15 -0.70 -0.05 0.00 2.84 0.00 0.00 34.83 37.07 2bm9 s MET 151 CO -0.04 0.19 1.04 0.00 -0.65 0.00 0.00 175.02 175.57 2bm9 s ALA 152 N -0.21 2.81 0.24 4.11 0.00 -1.26 -5.07 121.76 122.39 2bm9 s ALA 152 Ca 0.03 0.40 0.09 0.00 0.00 0.00 0.00 51.96 52.48 2bm9 s ALA 152 Cb -0.03 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 2bm9 s ALA 152 CO -0.00 -0.63 -0.03 -1.01 0.00 0.00 0.00 175.76 174.08 2bm9 s HIS 153 N -2.40 2.67 0.88 0.00 3.76 -1.26 -4.09 115.29 114.85 2bm9 s HIS 153 Ca 0.63 -0.22 -0.11 0.00 -0.15 0.00 0.00 55.06 55.22 2bm9 s HIS 153 Cb -0.15 -1.22 0.12 0.00 1.11 0.00 0.00 32.58 32.44 2bm9 s HIS 153 CO 0.33 0.60 1.10 -2.14 -0.85 0.00 0.00 174.74 173.78 2bm9 s PRO 154 N -3.44 1.38 -0.05 8.40 0.02 -1.26 -4.42 135.00 135.63 2bm9 s PRO 154 Ca 0.30 1.18 0.01 0.00 0.02 0.00 0.00 61.00 62.51 2bm9 s PRO 154 Cb -0.07 -1.80 0.02 0.00 0.02 0.00 0.00 34.50 32.68 2bm9 s PRO 154 CO 0.19 -2.26 -0.03 -1.17 -0.33 0.00 0.00 177.00 173.39 2bm9 s LEU 155 N -6.31 1.20 -0.07 -5.54 0.20 -1.26 -1.29 118.68 105.61 2bm9 s LEU 155 Ca 0.64 -0.12 -0.03 0.00 0.69 0.00 0.00 54.13 55.31 2bm9 s LEU 155 Cb -0.20 -0.44 -0.04 0.00 -0.43 0.00 0.00 46.19 45.09 2bm9 s LEU 155 CO 0.58 -0.08 0.06 -0.63 -0.29 0.00 0.00 176.35 175.98 2bm9 s ILE 156 N 1.11 4.73 -0.29 6.68 1.01 -0.78 -0.93 121.20 132.72 2bm9 s ILE 156 Ca -0.08 -0.18 -0.03 0.00 0.00 0.00 0.00 60.65 60.36 2bm9 s ILE 156 Cb -0.14 -3.06 0.11 0.00 0.01 0.00 0.00 42.46 39.38 2bm9 s ILE 156 CO -0.01 0.53 0.17 0.12 0.00 0.00 0.00 174.94 175.75 2bm9 s PHE 157 N -1.01 0.18 0.07 3.97 5.36 -0.02 -1.20 117.98 125.34 2bm9 s PHE 157 Ca 0.16 -0.79 -0.19 0.00 -0.96 0.00 0.00 56.93 55.16 2bm9 s PHE 157 Cb -0.12 -0.81 -0.07 0.00 -0.34 0.00 0.00 43.02 41.69 2bm9 s PHE 157 CO 0.06 -0.85 0.56 0.42 -1.46 0.00 0.00 175.22 173.95 2bm9 s ILE 158 N 2.08 4.75 -0.27 3.12 1.01 0.31 -2.03 121.20 130.18 2bm9 s ILE 158 Ca 0.10 1.19 -0.07 0.00 0.00 0.00 0.00 60.65 61.86 2bm9 s ILE 158 Cb -0.16 -3.88 -0.02 0.00 0.01 0.00 0.00 42.46 38.41 2bm9 s ILE 158 CO -0.33 0.54 0.08 -0.62 0.00 0.00 0.00 174.94 174.61 2bm9 s ASP 159 N -1.14 5.17 -0.08 3.58 3.68 0.31 -1.49 116.67 126.71 2bm9 s ASP 159 Ca 0.29 -0.37 0.11 0.00 2.13 0.00 0.00 52.55 54.72 2bm9 s ASP 159 Cb -0.19 -1.92 0.17 0.00 -1.45 0.00 0.00 42.92 39.52 2bm9 s ASP 159 CO 0.19 -0.09 1.06 0.59 0.13 0.00 0.00 175.17 177.05 2bm9 n ASN 160 N 4.92 1.62 -0.04 -0.34 3.02 0.12 -2.38 115.26 122.18 2bm9 n ASN 160 Ca -0.15 -2.58 -0.08 0.00 -0.03 0.00 0.00 54.58 51.73 2bm9 n ASN 160 Cb 0.50 -0.30 -0.03 0.00 -0.61 0.00 0.00 39.78 39.35 2bm9 n ASN 160 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bm9 n ALA 161 N -0.90 2.50 -0.62 5.41 0.00 -0.90 -4.67 120.51 121.33 2bm9 n ALA 161 Ca 0.09 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2bm9 n ALA 161 Cb 0.60 0.40 0.00 0.00 0.00 0.00 0.00 19.45 20.45 2bm9 n ALA 161 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2bm9 n HIS 162 N -3.32 0.00 -2.70 0.00 8.25 -1.26 -5.02 115.22 111.17 2bm9 n HIS 162 Ca -0.15 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.90 2bm9 n HIS 162 Cb 0.61 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.68 2bm9 n HIS 162 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2bm9 s ALA 163 N -3.58 3.21 -2.09 -1.41 0.00 -1.26 -4.19 121.76 112.44 2bm9 s ALA 163 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.54 2bm9 s ALA 163 Cb 0.00 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.80 2bm9 s ALA 163 CO 0.00 -0.15 0.00 -1.71 0.00 0.00 0.00 175.76 173.90 2bm9 n ASN 164 N 3.37 -5.36 -0.17 0.00 4.05 -1.26 -4.80 115.26 111.08 2bm9 n ASN 164 Ca 0.04 0.44 -0.01 0.00 0.45 0.00 0.00 54.58 55.50 2bm9 n ASN 164 Cb 0.50 -4.72 0.08 0.00 1.23 0.00 0.00 39.78 36.87 2bm9 n ASN 164 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 2bm9 h THR 165 N 0.00 0.69 -0.17 -0.44 2.02 -1.98 -1.59 112.91 111.44 2bm9 h THR 165 Ca -0.42 -0.08 -0.06 0.00 0.77 0.00 0.00 66.41 66.62 2bm9 h THR 165 Cb 1.32 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 2bm9 h THR 165 CO 0.60 0.04 -0.15 -0.26 0.37 0.00 0.00 175.52 176.12 2bm9 h PHE 166 N 0.24 0.29 -0.40 3.16 -1.00 -1.94 0.14 116.94 117.43 2bm9 h PHE 166 Ca 0.27 -0.04 -0.13 0.00 2.81 0.00 0.00 57.97 60.88 2bm9 h PHE 166 Cb 0.38 -0.08 -0.01 0.00 3.61 0.00 0.00 35.95 39.85 2bm9 h PHE 166 CO -0.24 0.42 -0.28 -0.91 -1.61 0.00 0.00 178.31 175.69 2bm9 h ASN 167 N 0.26 0.90 -0.37 2.17 2.35 -1.70 -2.66 115.58 116.53 2bm9 h ASN 167 Ca 0.05 -0.36 -0.10 0.00 -0.55 0.00 0.00 56.30 55.34 2bm9 h ASN 167 Cb 0.43 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 2bm9 h ASN 167 CO 0.03 1.12 -0.11 0.40 -1.65 0.00 0.00 177.43 177.21 2bm9 h ILE 168 N 0.73 1.26 -0.25 2.81 2.04 -0.61 -1.86 117.51 121.63 2bm9 h ILE 168 Ca 0.08 -1.19 0.01 0.00 1.00 0.00 0.00 64.86 64.77 2bm9 h ILE 168 Cb 0.84 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 2bm9 h ILE 168 CO 0.07 0.41 0.13 0.24 0.00 0.00 0.00 178.15 179.00 2bm9 h MET 169 N 0.74 0.26 0.00 2.37 2.86 -0.74 -1.92 114.93 118.50 2bm9 h MET 169 Ca 0.12 -0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.67 2bm9 h MET 169 Cb 0.60 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 2bm9 h MET 169 CO 0.04 0.17 -0.36 -0.22 1.06 0.00 0.00 176.91 177.60 2bm9 h LYS 170 N 0.27 0.00 -0.32 1.72 3.64 -1.14 0.29 116.57 121.03 2bm9 h LYS 170 Ca 0.10 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.32 2bm9 h LYS 170 Cb 0.02 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2bm9 h LYS 170 CO -0.07 0.36 -0.45 2.35 -2.27 0.00 0.00 179.45 179.37 2bm9 h TRP 171 N 0.00 1.03 0.03 1.91 7.01 -1.12 -2.50 115.95 122.31 2bm9 h TRP 171 Ca -0.00 -0.33 -0.00 0.00 2.11 0.00 0.00 58.89 60.66 2bm9 h TRP 171 Cb 0.76 -0.21 0.00 0.00 -2.10 0.00 0.00 29.16 27.61 2bm9 h TRP 171 CO 0.00 1.14 -0.01 0.00 -2.79 0.00 0.00 178.44 176.77 2bm9 h ALA 172 N 0.81 -0.03 -0.46 2.65 0.00 -0.37 0.57 119.26 122.42 2bm9 h ALA 172 Ca 0.04 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.87 2bm9 h ALA 172 Cb 1.04 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2bm9 h ALA 172 CO 0.10 -0.40 0.31 0.28 0.00 0.00 0.00 179.25 179.54 2bm9 h VAL 173 N -0.27 1.00 0.00 0.00 2.07 -1.04 0.10 116.25 118.11 2bm9 h VAL 173 Ca -0.00 -0.15 -0.25 0.00 0.82 0.00 0.00 66.70 67.12 2bm9 h VAL 173 Cb 0.26 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 2bm9 h VAL 173 CO 0.01 0.08 -1.48 0.44 0.02 0.00 0.00 177.57 176.64 2bm9 h ASP 174 N 0.44 0.00 0.00 0.57 5.19 -1.34 -3.42 116.42 117.86 2bm9 h ASP 174 Ca 0.20 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.61 2bm9 h ASP 174 Cb 0.22 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.73 2bm9 h ASP 174 CO -0.05 0.91 0.00 1.41 -3.12 0.00 0.00 179.24 178.39 2bm9 n HIS 175 N -3.08 0.00 0.04 4.55 8.25 0.18 -4.99 115.22 120.17 2bm9 n HIS 175 Ca -0.12 -0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.16 2bm9 n HIS 175 Cb 0.98 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 32.07 2bm9 n HIS 175 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2bm9 n LEU 176 N -0.18 -0.47 -4.69 2.41 7.94 0.26 -4.80 117.00 117.46 2bm9 n LEU 176 Ca 0.00 0.16 -0.42 0.00 -1.11 0.00 0.00 56.01 54.64 2bm9 n LEU 176 Cb 0.39 0.64 -0.03 0.00 0.53 0.00 0.00 43.42 44.96 2bm9 n LEU 176 CO 0.00 -0.45 1.44 -0.76 -1.11 0.00 0.00 177.39 176.50 2bm9 s LEU 177 N -5.45 4.39 0.10 -1.96 1.43 -0.66 -5.00 118.68 111.53 2bm9 s LEU 177 Ca 0.00 2.68 -0.02 0.00 -1.03 0.00 0.00 54.13 55.76 2bm9 s LEU 177 Cb 0.00 -3.56 -0.05 0.00 0.03 0.00 0.00 46.19 42.61 2bm9 s LEU 177 CO 0.00 -0.97 0.29 -1.61 0.23 0.00 0.00 176.35 174.29 2bm9 s GLU 178 N 2.74 3.53 -0.04 1.70 2.02 -1.26 -4.92 118.70 122.47 2bm9 s GLU 178 Ca 0.79 -0.27 -0.38 0.00 0.02 0.00 0.00 54.97 55.12 2bm9 s GLU 178 Cb -0.44 -2.94 -0.19 0.00 0.10 0.00 0.00 34.13 30.66 2bm9 s GLU 178 CO 0.35 0.53 1.05 -1.91 0.02 0.00 0.00 175.26 175.31 2bm9 n GLU 179 N 0.15 0.00 -0.10 1.61 2.13 -1.26 -1.75 120.64 121.42 2bm9 n GLU 179 Ca -0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.78 2bm9 n GLU 179 Cb 0.51 -1.42 0.00 0.00 0.27 0.00 0.00 31.44 30.81 2bm9 n GLU 179 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2bm9 n GLY 180 N 1.61 0.69 3.85 8.31 0.00 -0.55 -4.98 105.19 114.12 2bm9 n GLY 180 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 2bm9 n GLY 180 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bm9 s ASP 181 N -2.71 6.69 -0.14 1.61 1.11 -0.72 -4.78 116.67 117.73 2bm9 s ASP 181 Ca 0.00 1.41 -0.05 0.00 0.18 0.00 0.00 52.55 54.09 2bm9 s ASP 181 Cb 0.00 -2.44 -0.04 0.00 1.07 0.00 0.00 42.92 41.52 2bm9 s ASP 181 CO 0.00 -0.41 0.04 -0.31 1.18 0.00 0.00 175.17 175.66 2bm9 s TYR 182 N -2.33 3.22 -0.14 4.23 1.51 -0.11 -0.96 117.35 122.77 2bm9 s TYR 182 Ca 0.56 0.10 0.01 0.00 -1.01 0.00 0.00 57.07 56.74 2bm9 s TYR 182 Cb -0.10 -1.95 0.02 0.00 -0.11 0.00 0.00 41.96 39.82 2bm9 s TYR 182 CO 0.25 0.29 -0.16 0.12 -1.11 0.00 0.00 175.55 174.93 2bm9 s PHE 183 N -0.18 2.29 0.02 2.71 5.36 -0.45 -0.84 117.98 126.88 2bm9 s PHE 183 Ca 0.06 -1.24 0.06 0.00 -0.96 0.00 0.00 56.93 54.85 2bm9 s PHE 183 Cb -0.12 -1.64 -0.02 0.00 -0.34 0.00 0.00 43.02 40.90 2bm9 s PHE 183 CO 0.02 -0.64 -0.18 0.42 -1.46 0.00 0.00 175.22 173.37 2bm9 s ILE 184 N 1.26 1.44 -0.23 3.12 1.01 -0.86 -2.03 121.20 124.92 2bm9 s ILE 184 Ca 0.01 -0.97 -0.00 0.00 0.00 0.00 0.00 60.65 59.68 2bm9 s ILE 184 Cb -0.14 -1.24 0.03 0.00 0.01 0.00 0.00 42.46 41.12 2bm9 s ILE 184 CO -0.08 0.25 -0.10 -0.63 0.00 0.00 0.00 174.94 174.37 2bm9 s ILE 185 N -0.65 2.60 -0.13 2.92 1.01 -0.73 -0.53 121.20 125.70 2bm9 s ILE 185 Ca 0.06 -1.06 -0.20 0.00 0.00 0.00 0.00 60.65 59.45 2bm9 s ILE 185 Cb -0.08 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 2bm9 s ILE 185 CO 0.01 0.26 0.56 -1.61 0.00 0.00 0.00 174.94 174.16 2bm9 s GLU 186 N 1.29 4.33 0.00 2.79 2.02 -1.00 -4.28 118.70 123.85 2bm9 s GLU 186 Ca 0.00 0.57 0.00 0.00 0.02 0.00 0.00 54.97 55.57 2bm9 s GLU 186 Cb -0.16 -3.47 0.00 0.00 0.10 0.00 0.00 34.13 30.60 2bm9 s GLU 186 CO -0.07 0.04 0.00 -0.25 0.02 0.00 0.00 175.26 175.01 2bm9 n ASP 187 N 4.02 0.00 -0.01 -0.19 8.00 -0.07 -4.74 116.55 123.56 2bm9 n ASP 187 Ca -0.05 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.56 2bm9 n ASP 187 Cb 0.51 0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 41.44 2bm9 n ASP 187 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 2bm9 n MET 188 N 0.00 0.65 -0.22 -1.24 1.56 -1.26 -4.33 117.12 112.29 2bm9 n MET 188 Ca 0.00 -0.20 -0.03 0.00 -0.27 0.00 0.00 57.70 57.20 2bm9 n MET 188 Cb 0.00 -1.52 0.08 0.00 2.15 0.00 0.00 33.22 33.93 2bm9 n MET 188 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 2bm9 h ILE 189 N 0.00 1.00 -0.02 1.12 2.04 -1.85 -1.46 117.51 118.34 2bm9 h ILE 189 Ca 0.00 -0.23 -0.03 0.00 1.00 0.00 0.00 64.86 65.60 2bm9 h ILE 189 Cb 1.00 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 2bm9 h ILE 189 CO 0.00 0.12 -0.13 -0.65 0.00 0.00 0.00 178.15 177.50 2bm9 h PRO 190 N 0.68 0.02 -0.02 2.37 0.11 -1.95 -0.25 132.00 132.96 2bm9 h PRO 190 Ca 0.27 -0.00 -0.25 0.00 0.11 0.00 0.00 66.00 66.13 2bm9 h PRO 190 Cb 0.13 -0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.25 2bm9 h PRO 190 CO -0.15 0.15 -0.98 1.88 -0.21 0.00 0.00 178.00 178.69 2bm9 h TYR 191 N 0.02 0.95 0.00 0.65 -1.99 -1.68 -2.37 116.97 112.55 2bm9 h TYR 191 Ca 0.00 -0.50 -0.02 0.00 2.00 0.00 0.00 58.73 60.21 2bm9 h TYR 191 Cb 0.24 -0.11 -0.00 0.00 2.00 0.00 0.00 36.73 38.85 2bm9 h TYR 191 CO 0.00 1.34 -0.08 -1.49 -0.00 0.00 0.00 178.16 177.92 2bm9 h TRP 192 N 0.38 0.00 0.08 4.88 6.55 -0.56 -1.10 115.95 126.18 2bm9 h TRP 192 Ca -0.11 0.00 -0.25 0.00 0.95 0.00 0.00 58.89 59.48 2bm9 h TRP 192 Cb 1.63 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.92 2bm9 h TRP 192 CO 0.09 0.08 -1.14 -0.92 -1.05 0.00 0.00 178.44 175.50 2bm9 h TYR 193 N 0.00 0.32 -0.36 0.49 3.20 -1.04 -1.64 116.97 117.95 2bm9 h TYR 193 Ca -0.00 -0.23 -0.11 0.00 3.14 0.00 0.00 58.73 61.53 2bm9 h TYR 193 Cb 0.17 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 2bm9 h TYR 193 CO 0.00 1.17 -0.24 -0.09 -1.64 0.00 0.00 178.16 177.36 2bm9 h ARG 194 N 0.05 0.71 0.05 1.82 9.65 -0.92 -2.67 114.38 123.06 2bm9 h ARG 194 Ca -0.09 -0.29 -0.38 0.00 -1.10 0.00 0.00 59.98 58.13 2bm9 h ARG 194 Cb 1.88 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 30.37 2bm9 h ARG 194 CO 0.18 0.88 -2.27 0.66 2.80 0.00 0.00 179.97 182.21 2bm9 n TYR 195 N -4.11 0.49 -3.22 2.20 0.53 -0.46 -4.58 117.16 108.01 2bm9 n TYR 195 Ca -0.00 0.11 -0.25 0.00 -1.02 0.00 0.00 57.90 56.74 2bm9 n TYR 195 Cb 0.43 -1.07 -0.06 0.00 -1.03 0.00 0.00 39.34 37.61 2bm9 n TYR 195 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2bm9 n ALA 196 N -3.11 3.40 -0.37 -0.72 0.00 -0.62 -4.97 120.51 114.12 2bm9 n ALA 196 Ca -0.39 -4.15 -0.00 0.00 0.00 0.00 0.00 53.44 48.90 2bm9 n ALA 196 Cb 1.02 -0.85 0.05 0.00 0.00 0.00 0.00 19.45 19.68 2bm9 n ALA 196 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2bm9 h PRO 197 N 3.70 -0.01 0.04 0.00 0.13 -1.64 -0.97 132.00 133.25 2bm9 h PRO 197 Ca 0.13 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 65.04 2bm9 h PRO 197 Cb 0.74 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 2bm9 h PRO 197 CO 0.67 -0.00 -1.02 1.96 -0.23 0.00 0.00 178.00 179.38 2bm9 h GLN 198 N -0.01 0.21 0.16 0.86 4.20 -1.93 -2.84 115.11 115.76 2bm9 h GLN 198 Ca 0.36 -0.28 -0.35 0.00 0.06 0.00 0.00 58.65 58.44 2bm9 h GLN 198 Cb 0.61 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.48 2bm9 h GLN 198 CO -0.98 1.06 -1.77 -0.07 -0.67 0.00 0.00 178.83 176.40 2bm9 h LEU 199 N 0.09 0.52 -0.28 1.46 3.38 -1.86 -3.09 115.31 115.53 2bm9 h LEU 199 Ca -0.07 -0.84 -0.03 0.00 0.09 0.00 0.00 57.88 57.03 2bm9 h LEU 199 Cb 1.70 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 2bm9 h LEU 199 CO 0.16 1.72 0.06 0.15 0.09 0.00 0.00 178.44 180.62 2bm9 h PHE 200 N 0.09 0.49 -0.43 1.13 3.57 -1.31 -0.77 116.94 119.72 2bm9 h PHE 200 Ca -0.34 -0.06 0.11 0.00 3.53 0.00 0.00 57.97 61.21 2bm9 h PHE 200 Cb 2.07 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 40.66 2bm9 h PHE 200 CO 0.09 0.54 0.30 0.77 -2.23 0.00 0.00 178.31 177.78 2bm9 h SER 201 N 0.29 0.05 0.16 0.41 0.02 -1.61 -0.85 113.55 112.03 2bm9 h SER 201 Ca 0.09 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2bm9 h SER 201 Cb 0.31 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2bm9 h SER 201 CO 0.00 0.03 -0.08 -0.08 -1.14 0.00 0.00 176.83 175.57 2bm9 h GLU 202 N 0.06 -0.21 -0.40 3.45 4.81 -1.40 -1.87 114.58 119.02 2bm9 h GLU 202 Ca 0.20 0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.56 2bm9 h GLU 202 Cb 0.73 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 2bm9 h GLU 202 CO -0.01 -0.01 0.44 1.88 -0.73 0.00 0.00 179.01 180.57 2bm9 h TYR 203 N -1.03 0.00 0.04 0.92 0.99 -0.87 -1.20 116.97 115.82 2bm9 h TYR 203 Ca -0.02 0.00 -0.34 0.00 2.00 0.00 0.00 58.73 60.37 2bm9 h TYR 203 Cb 0.29 0.00 -0.04 0.00 1.00 0.00 0.00 36.73 37.98 2bm9 h TYR 203 CO 0.03 0.00 -1.97 -0.11 -0.00 0.00 0.00 178.16 176.11 2bm9 n LEU 204 N -3.71 1.60 -0.27 3.88 -0.00 -0.35 -4.13 117.00 114.02 2bm9 n LEU 204 Ca 0.07 0.24 0.15 0.00 -0.00 0.00 0.00 56.01 56.46 2bm9 n LEU 204 Cb 0.61 -0.35 0.70 0.00 -0.00 0.00 0.00 43.42 44.38 2bm9 n LEU 204 CO 0.27 0.62 0.97 0.61 -0.00 0.00 0.00 177.39 179.86 2bm9 n GLY 205 N 1.81 -0.43 0.25 -3.96 0.00 -0.51 -2.73 105.19 99.61 2bm9 n GLY 205 Ca -0.27 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.55 2bm9 n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm9 h ALA 206 N 4.18 1.02 -0.80 4.61 0.00 -1.56 -3.23 119.26 123.48 2bm9 h ALA 206 Ca 0.00 -0.09 -0.46 0.00 0.00 0.00 0.00 54.91 54.36 2bm9 h ALA 206 Cb 0.28 -0.02 -0.26 0.00 0.00 0.00 0.00 17.79 17.80 2bm9 h ALA 206 CO 0.00 0.13 0.41 1.19 0.00 0.00 0.00 179.25 180.98 2bm9 n PHE 207 N -3.25 2.53 0.08 0.00 3.01 -1.10 -4.51 117.46 114.22 2bm9 n PHE 207 Ca 0.00 -2.02 -0.19 0.00 1.01 0.00 0.00 57.45 56.25 2bm9 n PHE 207 Cb 0.36 -0.88 -0.11 0.00 -0.01 0.00 0.00 39.48 38.84 2bm9 n PHE 207 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 2bm9 h ARG 208 N 1.24 0.56 0.00 -1.08 0.11 -1.77 -0.42 114.38 113.02 2bm9 h ARG 208 Ca 0.50 -0.70 0.00 0.00 0.10 0.00 0.00 59.98 59.89 2bm9 h ARG 208 Cb 2.10 0.22 0.00 0.00 1.11 0.00 0.00 29.97 33.40 2bm9 h ARG 208 CO 0.98 1.30 0.00 -0.25 0.10 0.00 0.00 179.97 182.09 2bm9 n ASP 209 N -3.76 0.00 0.00 0.08 8.00 -1.26 -3.80 116.55 115.81 2bm9 n ASP 209 Ca -0.11 -0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.22 2bm9 n ASP 209 Cb 0.94 -0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.84 2bm9 n ASP 209 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2bm9 n VAL 210 N -1.20 0.00 -4.18 2.53 0.24 -1.18 -4.94 118.33 109.60 2bm9 n VAL 210 Ca 0.11 -0.05 -0.11 0.00 -2.04 0.00 0.00 64.34 62.25 2bm9 n VAL 210 Cb 0.13 0.68 -0.10 0.00 -1.47 0.00 0.00 33.84 33.08 2bm9 n VAL 210 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2bm9 s LEU 211 N -0.38 1.39 -0.07 1.34 1.43 -0.17 -2.75 118.68 119.47 2bm9 s LEU 211 Ca 0.00 -1.31 -0.15 0.00 -1.03 0.00 0.00 54.13 51.64 2bm9 s LEU 211 Cb 0.00 0.36 0.03 0.00 0.03 0.00 0.00 46.19 46.61 2bm9 s LEU 211 CO 0.00 -0.80 0.36 -0.94 0.23 0.00 0.00 176.35 175.20 2bm9 s SER 212 N -3.11 -0.30 -0.23 2.29 1.04 -0.72 -4.52 113.70 108.14 2bm9 s SER 212 Ca 0.33 0.39 -0.29 0.00 0.48 0.00 0.00 55.95 56.86 2bm9 s SER 212 Cb 0.07 0.51 -0.00 0.00 0.10 0.00 0.00 66.02 66.70 2bm9 s SER 212 CO 0.08 -0.33 1.20 -0.32 0.98 0.00 0.00 173.24 174.85 2bm9 s MET 213 N -0.69 4.15 -0.52 4.02 1.75 -1.26 -1.38 119.30 125.36 2bm9 s MET 213 Ca -0.08 1.43 -0.28 0.00 -1.25 0.00 0.00 55.69 55.51 2bm9 s MET 213 Cb -0.04 -3.76 0.01 0.00 2.84 0.00 0.00 34.83 33.88 2bm9 s MET 213 CO 0.03 -0.81 1.42 0.34 -0.65 0.00 0.00 175.02 175.35 2bm9 s ASP 214 N 1.95 6.18 0.21 1.11 -1.08 -0.54 -4.88 116.67 119.61 2bm9 s ASP 214 Ca 0.52 0.44 0.25 0.00 -0.52 0.00 0.00 52.55 53.24 2bm9 s ASP 214 Cb -0.18 -2.54 0.87 0.00 -1.46 0.00 0.00 42.92 39.61 2bm9 s ASP 214 CO 0.15 -1.64 1.76 0.80 0.52 0.00 0.00 175.17 176.76 2bm9 n MET 215 N 8.49 0.23 0.09 4.34 1.56 -1.26 -1.08 117.12 129.49 2bm9 n MET 215 Ca 0.14 0.26 -0.15 0.00 -0.27 0.00 0.00 57.70 57.67 2bm9 n MET 215 Cb 0.49 -1.80 -0.14 0.00 2.15 0.00 0.00 33.22 33.92 2bm9 n MET 215 CO 0.00 0.00 0.00 1.25 -0.73 0.00 0.00 175.97 176.49 2bm9 h LEU 216 N 0.00 0.38 -0.02 -0.89 5.85 -1.99 -3.35 115.31 115.29 2bm9 h LEU 216 Ca 0.00 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2bm9 h LEU 216 Cb 0.63 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2bm9 h LEU 216 CO 0.00 1.35 -0.82 -1.22 -0.34 0.00 0.00 178.44 177.42 2bm9 n TYR 217 N -3.49 0.00 -0.05 1.25 0.53 -1.14 -4.69 117.16 109.57 2bm9 n TYR 217 Ca -0.10 0.00 -0.09 0.00 -1.02 0.00 0.00 57.90 56.69 2bm9 n TYR 217 Cb 1.03 0.00 -0.08 0.00 -1.03 0.00 0.00 39.34 39.26 2bm9 n TYR 217 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2bm9 h ALA 218 N 2.50 -0.02 -0.08 -0.72 0.00 -1.24 -3.31 119.26 116.39 2bm9 h ALA 218 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2bm9 h ALA 218 Cb 0.42 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2bm9 h ALA 218 CO 0.00 -0.03 0.00 0.09 0.00 0.00 0.00 179.25 179.31 2bm9 n ASN 219 N -4.71 1.67 -0.80 0.00 3.02 -1.25 -3.97 115.26 109.22 2bm9 n ASN 219 Ca -0.06 -2.13 0.08 0.00 -0.03 0.00 0.00 54.58 52.44 2bm9 n ASN 219 Cb 0.28 -0.52 0.16 0.00 -0.61 0.00 0.00 39.78 39.08 2bm9 n ASN 219 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bm9 n ALA 220 N 0.09 2.34 -3.61 5.41 0.00 -1.25 -4.97 120.51 118.53 2bm9 n ALA 220 Ca 0.04 -0.96 -0.08 0.00 0.00 0.00 0.00 53.44 52.43 2bm9 n ALA 220 Cb 0.38 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.22 2bm9 n ALA 220 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2bm9 s SER 221 N -1.14 -0.25 -0.02 0.00 1.04 -1.26 -4.77 113.70 107.31 2bm9 s SER 221 Ca 0.27 -0.62 -0.22 0.00 0.48 0.00 0.00 55.95 55.86 2bm9 s SER 221 Cb 0.16 0.67 -0.14 0.00 0.10 0.00 0.00 66.02 66.80 2bm9 s SER 221 CO 0.21 -1.24 0.98 0.77 0.98 0.00 0.00 173.24 174.94 2bm9 h SER 222 N 2.08 -0.37 -1.00 7.02 4.64 -1.93 -2.93 113.55 121.06 2bm9 h SER 222 Ca -0.23 -0.17 0.05 0.00 -0.47 0.00 0.00 61.79 60.96 2bm9 h SER 222 Cb 1.26 0.09 -0.06 0.00 -0.31 0.00 0.00 62.40 63.38 2bm9 h SER 222 CO 0.29 0.08 0.65 1.56 -0.87 0.00 0.00 176.83 178.53 2bm9 h GLN 223 N -0.92 1.20 -0.39 4.77 4.20 -1.97 -2.36 115.11 119.64 2bm9 h GLN 223 Ca -0.04 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2bm9 h GLN 223 Cb 0.52 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2bm9 h GLN 223 CO 0.07 0.79 0.00 1.28 -0.67 0.00 0.00 178.83 180.31 2bm9 n LEU 224 N -4.46 2.59 0.00 1.46 4.77 -1.25 -0.89 117.00 119.21 2bm9 n LEU 224 Ca 0.14 -1.21 0.00 0.00 -0.03 0.00 0.00 56.01 54.91 2bm9 n LEU 224 Cb 0.12 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 2bm9 n LEU 224 CO 0.34 0.60 0.00 -0.67 -1.33 0.00 0.00 177.39 176.33 2bm9 n ASP 225 N 0.91 0.00 -1.51 -1.43 -0.08 -0.89 -1.73 116.55 111.82 2bm9 n ASP 225 Ca 0.17 0.00 -0.06 0.00 -1.51 0.00 0.00 54.79 53.39 2bm9 n ASP 225 Cb 0.44 0.00 0.10 0.00 2.34 0.00 0.00 41.12 43.99 2bm9 n ASP 225 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2bm9 n ARG 226 N -0.23 2.18 0.00 -0.67 1.74 -1.26 -3.93 116.66 114.49 2bm9 n ARG 226 Ca 0.00 -3.50 0.08 0.00 -0.77 0.00 0.00 57.85 53.66 2bm9 n ARG 226 Cb 0.00 -1.67 0.06 0.00 -1.02 0.00 0.00 32.46 29.83 2bm9 n ARG 226 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bm9 n GLY 227 N -0.71 0.13 3.61 -0.13 0.00 -0.71 -4.92 105.19 102.46 2bm9 n GLY 227 Ca 0.25 -0.45 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 2bm9 n GLY 227 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bm9 s VAL 228 N -1.35 4.22 0.14 1.61 1.01 -1.25 -1.77 120.40 123.01 2bm9 s VAL 228 Ca 0.18 1.31 0.09 0.00 0.00 0.00 0.00 61.98 63.56 2bm9 s VAL 228 Cb 0.13 -4.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 2bm9 s VAL 228 CO 0.21 -0.77 -0.20 -0.76 0.00 0.00 0.00 175.10 173.58 2bm9 s LEU 229 N 4.40 2.38 0.08 3.92 1.43 -0.86 -1.47 118.68 128.55 2bm9 s LEU 229 Ca 0.50 -0.78 -0.09 0.00 -1.03 0.00 0.00 54.13 52.74 2bm9 s LEU 229 Cb -0.11 -0.88 -0.00 0.00 0.03 0.00 0.00 46.19 45.23 2bm9 s LEU 229 CO 0.27 0.02 0.18 0.00 0.23 0.00 0.00 176.35 177.05 2bm9 s ARG 230 N -2.39 0.81 0.09 1.70 1.04 -0.48 -1.34 118.95 118.38 2bm9 s ARG 230 Ca 0.12 -0.91 -0.31 0.00 -1.04 0.00 0.00 55.73 53.59 2bm9 s ARG 230 Cb -0.08 0.33 -0.07 0.00 -2.04 0.00 0.00 34.95 33.09 2bm9 s ARG 230 CO 0.06 -0.25 1.40 0.50 -0.04 0.00 0.00 175.30 176.97 2bm9 s ARG 231 N -3.65 4.31 -0.04 3.89 6.06 -0.14 -1.76 118.95 127.62 2bm9 s ARG 231 Ca 0.03 2.06 -0.03 0.00 -2.50 0.00 0.00 55.73 55.29 2bm9 s ARG 231 Cb 0.04 -3.33 -0.04 0.00 0.06 0.00 0.00 34.95 31.68 2bm9 s ARG 231 CO -0.10 -0.48 0.15 0.08 -2.50 0.00 0.00 175.30 172.46 2bm9 s VAL 232 N 1.43 5.33 -0.04 7.11 1.01 -1.11 -1.49 120.40 132.63 2bm9 s VAL 232 Ca 0.65 -0.11 -0.13 0.00 0.00 0.00 0.00 61.98 62.40 2bm9 s VAL 232 Cb -0.36 -3.44 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 2bm9 s VAL 232 CO 0.30 0.41 0.37 0.00 0.00 0.00 0.00 175.10 176.17 2bm9 n ALA 233 N 1.26 -1.15 1.50 5.51 0.00 -1.26 -4.86 120.51 121.50 2bm9 n ALA 233 Ca -0.14 0.17 0.14 0.00 0.00 0.00 0.00 53.44 53.62 2bm9 n ALA 233 Cb 0.53 -0.54 0.52 0.00 0.00 0.00 0.00 19.45 19.96 2bm9 n ALA 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50