#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bm8 h TYR 4 N 0.00 0.32 -0.78 -0.67 -0.00 -2.06 -3.00 116.97 110.78 2bm8 h TYR 4 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 58.73 58.68 2bm8 h TYR 4 Cb 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 36.73 36.59 2bm8 h TYR 4 CO 0.00 0.27 0.30 0.77 -0.00 0.00 0.00 178.16 179.50 2bm8 h SER 5 N 0.33 1.08 -0.22 0.10 0.02 -2.11 -2.79 113.55 109.97 2bm8 h SER 5 Ca 0.08 -0.17 -0.15 0.00 -0.84 0.00 0.00 61.79 60.71 2bm8 h SER 5 Cb 0.09 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 2bm8 h SER 5 CO -0.01 0.97 -0.42 0.03 -1.14 0.00 0.00 176.83 176.25 2bm8 h ARG 6 N 1.14 0.77 -6.96 3.45 3.08 -2.11 -3.47 114.38 110.28 2bm8 h ARG 6 Ca 0.26 -0.42 -0.53 0.00 0.07 0.00 0.00 59.98 59.36 2bm8 h ARG 6 Cb 0.23 0.02 0.09 0.00 0.08 0.00 0.00 29.97 30.39 2bm8 h ARG 6 CO -0.02 1.04 0.63 -1.14 -1.07 0.00 0.00 179.97 179.41 2bm8 s GLN 7 N -4.28 3.90 -0.23 0.04 2.00 -1.06 -5.02 119.66 115.02 2bm8 s GLN 7 Ca -0.09 2.19 -0.08 0.00 -2.00 0.00 0.00 55.36 55.39 2bm8 s GLN 7 Cb 0.11 -2.72 -0.03 0.00 0.80 0.00 0.00 33.01 31.17 2bm8 s GLN 7 CO 0.86 -0.56 0.07 1.21 -0.50 0.00 0.00 175.29 176.37 2bm8 s ASN 8 N -0.71 5.37 -0.34 6.67 3.84 -1.26 -5.02 114.94 123.48 2bm8 s ASN 8 Ca 0.58 -0.09 -0.07 0.00 0.21 0.00 0.00 52.86 53.49 2bm8 s ASN 8 Cb -0.39 -1.95 0.03 0.00 -0.55 0.00 0.00 41.25 38.39 2bm8 s ASN 8 CO 0.50 0.04 0.12 -0.36 -2.79 0.00 0.00 177.10 174.61 2bm8 s PHE 9 N 1.16 3.24 0.93 0.43 0.40 -1.26 -5.08 117.98 117.79 2bm8 s PHE 9 Ca 0.05 -1.27 -0.12 0.00 -0.60 0.00 0.00 56.93 54.99 2bm8 s PHE 9 Cb -0.14 -2.31 0.15 0.00 0.51 0.00 0.00 43.02 41.23 2bm8 s PHE 9 CO 0.03 -0.69 1.09 -0.65 0.70 0.00 0.00 175.22 175.70 2bm8 s GLN 10 N 1.45 0.97 -0.49 0.44 -0.21 -1.26 -4.98 119.66 115.57 2bm8 s GLN 10 Ca -0.00 0.82 -0.20 0.00 0.02 0.00 0.00 55.36 55.99 2bm8 s GLN 10 Cb -0.19 -1.78 0.05 0.00 1.00 0.00 0.00 33.01 32.09 2bm8 s GLN 10 CO 0.04 -2.44 0.65 0.34 -2.12 0.00 0.00 175.29 171.76 2bm8 s ASP 11 N -3.32 6.26 0.42 5.90 2.15 -1.26 -4.92 116.67 121.89 2bm8 s ASP 11 Ca 0.64 -0.72 0.29 0.00 0.43 0.00 0.00 52.55 53.20 2bm8 s ASP 11 Cb -0.19 -2.31 1.37 0.00 -0.30 0.00 0.00 42.92 41.49 2bm8 s ASP 11 CO 0.58 -0.89 1.88 -0.07 -0.17 0.00 0.00 175.17 176.50 2bm8 h LEU 12 N 9.81 0.00 -1.37 -1.34 4.07 -2.03 -2.63 115.31 121.82 2bm8 h LEU 12 Ca -0.27 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.63 2bm8 h LEU 12 Cb 1.09 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.82 2bm8 h LEU 12 CO 0.95 0.00 -0.23 0.78 -1.08 0.00 0.00 178.44 178.86 2bm8 h ASN 13 N 0.00 0.12 -0.17 -0.43 2.35 -2.01 -2.69 115.58 112.76 2bm8 h ASN 13 Ca 0.00 -0.03 0.05 0.00 -0.55 0.00 0.00 56.30 55.77 2bm8 h ASN 13 Cb 0.26 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 2bm8 h ASN 13 CO 0.00 0.36 0.16 -0.07 -1.65 0.00 0.00 177.43 176.23 2bm8 h LEU 14 N 0.12 0.00 -0.33 1.61 4.07 -1.90 -1.21 115.31 117.67 2bm8 h LEU 14 Ca 0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.98 2bm8 h LEU 14 Cb 0.48 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.22 2bm8 h LEU 14 CO 0.03 0.00 -0.07 0.49 -1.08 0.00 0.00 178.44 177.81 2bm8 n PHE 15 N -3.97 0.00 -1.67 1.13 0.99 -1.01 -4.89 117.46 108.03 2bm8 n PHE 15 Ca 0.01 0.00 -0.47 0.00 -0.00 0.00 0.00 57.45 56.99 2bm8 n PHE 15 Cb 0.28 -0.11 -0.05 0.00 -1.00 0.00 0.00 39.48 38.61 2bm8 n PHE 15 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 2bm8 n ARG 16 N -0.75 2.12 -0.85 -1.08 0.63 -0.46 -1.59 116.66 114.67 2bm8 n ARG 16 Ca 0.17 0.77 0.00 0.00 -0.92 0.00 0.00 57.85 57.87 2bm8 n ARG 16 Cb 0.26 -2.57 0.00 0.00 0.45 0.00 0.00 32.46 30.60 2bm8 n ARG 16 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2bm8 n GLY 17 N 3.87 0.96 1.43 5.14 0.00 -1.26 -4.76 105.19 110.57 2bm8 n GLY 17 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2bm8 n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bm8 n LEU 18 N 0.00 0.25 0.00 0.99 4.77 -0.62 -5.12 117.00 117.26 2bm8 n LEU 18 Ca 0.00 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2bm8 n LEU 18 Cb 0.00 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2bm8 n LEU 18 CO 0.00 -0.45 0.00 0.61 -1.33 0.00 0.00 177.39 176.22 2bm8 n GLY 19 N 2.50 0.92 0.09 -0.72 0.00 -0.64 -4.88 105.19 102.46 2bm8 n GLY 19 Ca 0.00 -2.30 -0.12 0.00 0.00 0.00 0.00 46.02 43.60 2bm8 n GLY 19 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bm8 h GLU 20 N 0.00 0.13 -4.67 1.61 5.08 -1.98 -3.42 114.58 111.33 2bm8 h GLU 20 Ca 0.00 -0.22 -0.58 0.00 -1.00 0.00 0.00 59.36 57.56 2bm8 h GLU 20 Cb 0.00 0.08 -0.35 0.00 0.50 0.00 0.00 28.75 28.98 2bm8 h GLU 20 CO 0.00 1.01 -0.83 0.34 -1.00 0.00 0.00 179.01 178.53 2bm8 s ASP 21 N -6.79 2.42 0.44 1.42 -1.08 -1.26 -5.01 116.67 106.81 2bm8 s ASP 21 Ca -0.04 -0.42 0.20 0.00 -0.52 0.00 0.00 52.55 51.78 2bm8 s ASP 21 Cb 0.08 -1.07 1.03 0.00 -1.46 0.00 0.00 42.92 41.50 2bm8 s ASP 21 CO 0.84 -0.01 1.92 1.55 0.52 0.00 0.00 175.17 179.99 2bm8 h PRO 22 N 7.59 0.00 -7.04 4.34 0.13 -1.90 -3.44 132.00 131.67 2bm8 h PRO 22 Ca -0.32 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.31 2bm8 h PRO 22 Cb 1.16 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.35 2bm8 h PRO 22 CO 0.49 0.25 0.43 0.00 -0.23 0.00 0.00 178.00 178.94 2bm8 s ALA 23 N -4.08 2.87 -0.07 -0.56 0.00 -1.26 -4.42 121.76 114.25 2bm8 s ALA 23 Ca -0.02 0.79 -0.21 0.00 0.00 0.00 0.00 51.96 52.53 2bm8 s ALA 23 Cb 0.13 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 2bm8 s ALA 23 CO 0.65 -0.55 0.59 -0.47 0.00 0.00 0.00 175.76 175.98 2bm8 s TYR 24 N -1.73 3.58 -0.07 0.00 5.04 -1.26 -4.86 117.35 118.05 2bm8 s TYR 24 Ca 0.67 1.10 0.03 0.00 -2.44 0.00 0.00 57.07 56.43 2bm8 s TYR 24 Cb -0.23 -2.65 0.00 0.00 0.35 0.00 0.00 41.96 39.43 2bm8 s TYR 24 CO 0.28 0.20 -0.17 -1.01 -1.34 0.00 0.00 175.55 173.50 2bm8 s HIS 25 N 0.44 1.82 0.68 4.97 3.76 -1.26 -4.98 115.29 120.73 2bm8 s HIS 25 Ca 0.31 -0.65 -0.17 0.00 -0.15 0.00 0.00 55.06 54.41 2bm8 s HIS 25 Cb -0.17 -1.26 -0.01 0.00 1.11 0.00 0.00 32.58 32.25 2bm8 s HIS 25 CO 0.15 -0.28 1.00 -2.30 -0.85 0.00 0.00 174.74 172.47 2bm8 n PRO 26 N 3.52 0.68 -1.83 8.40 -0.02 -1.26 -4.93 135.00 139.55 2bm8 n PRO 26 Ca -0.20 0.28 -0.40 0.00 -2.02 0.00 0.00 63.50 61.16 2bm8 n PRO 26 Cb 0.52 -2.24 0.01 0.00 -0.02 0.00 0.00 33.50 31.77 2bm8 n PRO 26 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2bm8 s PRO 27 N -3.18 3.83 -0.01 0.52 0.02 -1.26 -5.03 135.00 129.88 2bm8 s PRO 27 Ca 0.75 2.43 0.06 0.00 0.02 0.00 0.00 61.00 64.26 2bm8 s PRO 27 Cb -0.37 -2.76 -0.03 0.00 0.02 0.00 0.00 34.50 31.37 2bm8 s PRO 27 CO 0.48 -0.70 -0.18 0.08 -0.33 0.00 0.00 177.00 176.35 2bm8 s VAL 28 N -1.18 2.74 0.26 3.83 1.01 -1.26 -5.12 120.40 120.68 2bm8 s VAL 28 Ca 0.58 -0.96 -0.27 0.00 0.00 0.00 0.00 61.98 61.33 2bm8 s VAL 28 Cb -0.44 -2.07 -0.09 0.00 0.00 0.00 0.00 36.38 33.78 2bm8 s VAL 28 CO 0.57 0.51 0.90 -0.76 0.00 0.00 0.00 175.10 176.32 2bm8 s LEU 29 N -0.93 4.48 -0.22 3.92 2.01 -1.26 -4.88 118.68 121.80 2bm8 s LEU 29 Ca 0.12 1.81 -0.16 0.00 0.01 0.00 0.00 54.13 55.91 2bm8 s LEU 29 Cb -0.10 -3.74 -0.09 0.00 0.01 0.00 0.00 46.19 42.26 2bm8 s LEU 29 CO 0.02 0.06 -0.31 0.41 1.01 0.00 0.00 176.35 177.53 2bm8 n THR 30 N 1.02 1.51 -0.69 5.49 -1.04 -1.26 -4.76 114.28 114.54 2bm8 n THR 30 Ca -0.01 -0.10 0.08 0.00 -2.04 0.00 0.00 64.05 61.99 2bm8 n THR 30 Cb 0.49 -2.13 0.31 0.00 -1.82 0.00 0.00 70.33 67.19 2bm8 n THR 30 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 2bm8 n ASP 31 N -4.38 4.46 -3.73 8.00 5.75 -1.26 -4.96 116.55 120.43 2bm8 n ASP 31 Ca -0.33 -2.59 -0.09 0.00 -0.01 0.00 0.00 54.79 51.77 2bm8 n ASP 31 Cb 0.68 -0.54 -0.03 0.00 -1.03 0.00 0.00 41.12 40.20 2bm8 n ASP 31 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bm8 s ARG 32 N -2.10 1.45 0.59 0.11 1.04 -1.26 -5.11 118.95 113.67 2bm8 s ARG 32 Ca 0.46 -0.86 -0.15 0.00 -1.04 0.00 0.00 55.73 54.14 2bm8 s ARG 32 Cb 0.32 0.54 -0.04 0.00 -2.04 0.00 0.00 34.95 33.73 2bm8 s ARG 32 CO 0.18 -0.63 1.04 -1.25 -0.04 0.00 0.00 175.30 174.61 2bm8 s PRO 33 N -3.87 3.43 0.17 3.89 0.04 -1.26 -4.83 135.00 132.57 2bm8 s PRO 33 Ca 0.09 1.11 -0.10 0.00 0.04 0.00 0.00 61.00 62.14 2bm8 s PRO 33 Cb -0.02 -2.05 0.05 0.00 0.04 0.00 0.00 34.50 32.52 2bm8 s PRO 33 CO -0.02 -0.71 1.63 -0.09 0.04 0.00 0.00 177.00 177.85 2bm8 h ARG 34 N 0.40 1.02 -4.39 4.56 2.43 -2.01 -3.40 114.38 112.99 2bm8 h ARG 34 Ca -0.46 -0.32 -0.73 0.00 -0.81 0.00 0.00 59.98 57.65 2bm8 h ARG 34 Cb 1.21 -0.09 -0.22 0.00 -0.42 0.00 0.00 29.97 30.45 2bm8 h ARG 34 CO 0.58 1.01 -0.38 -0.51 -1.51 0.00 0.00 179.97 179.17 2bm8 s ASP 35 N -6.51 6.10 -0.11 -3.80 1.01 -1.26 -5.06 116.67 107.04 2bm8 s ASP 35 Ca -0.12 -1.17 -0.17 0.00 0.71 0.00 0.00 52.55 51.80 2bm8 s ASP 35 Cb 0.13 -2.16 -0.04 0.00 1.01 0.00 0.00 42.92 41.85 2bm8 s ASP 35 CO 0.85 -0.56 0.45 0.86 0.21 0.00 0.00 175.17 176.98 2bm8 s TRP 36 N 1.64 3.53 0.28 4.23 -0.11 -1.26 -5.03 118.94 122.22 2bm8 s TRP 36 Ca 0.04 0.87 -0.29 0.00 1.22 0.00 0.00 56.10 57.94 2bm8 s TRP 36 Cb -0.22 -2.51 -0.10 0.00 -1.50 0.00 0.00 33.47 29.14 2bm8 s TRP 36 CO 0.08 0.21 1.27 -1.25 -4.62 0.00 0.00 176.95 172.64 2bm8 s PRO 37 N 0.47 4.42 0.34 5.86 0.04 -1.26 -4.93 135.00 139.94 2bm8 s PRO 37 Ca 0.25 2.09 0.18 0.00 0.04 0.00 0.00 61.00 63.56 2bm8 s PRO 37 Cb -0.15 -3.13 0.36 0.00 0.04 0.00 0.00 34.50 31.62 2bm8 s PRO 37 CO 0.10 -0.13 1.58 -0.07 0.04 0.00 0.00 177.00 178.52 2bm8 h LEU 38 N 4.11 0.00 -1.30 -3.56 4.07 -1.99 -2.14 115.31 114.50 2bm8 h LEU 38 Ca -0.47 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.49 2bm8 h LEU 38 Cb 1.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.96 2bm8 h LEU 38 CO 0.70 0.38 0.00 -2.24 -1.08 0.00 0.00 178.44 176.20 2bm8 h ASP 39 N 0.00 0.00 -0.34 -0.43 2.03 -2.05 -2.73 116.42 112.89 2bm8 h ASP 39 Ca -0.00 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.16 2bm8 h ASP 39 Cb 1.15 0.00 -0.08 0.00 -0.83 0.00 0.00 39.33 39.56 2bm8 h ASP 39 CO 0.05 0.00 -0.03 0.54 -1.03 0.00 0.00 179.24 178.77 2bm8 n ARG 40 N -2.74 2.13 -0.27 4.15 5.12 -0.81 -4.81 116.66 119.43 2bm8 n ARG 40 Ca 0.01 -3.07 0.04 0.00 -1.93 0.00 0.00 57.85 52.90 2bm8 n ARG 40 Cb 0.25 -1.83 0.17 0.00 -1.16 0.00 0.00 32.46 29.89 2bm8 n ARG 40 CO 0.00 0.00 0.00 2.35 -1.93 0.00 0.00 177.63 178.05 2bm8 h TRP 41 N 1.19 0.69 0.00 -1.55 7.01 -1.41 -1.85 115.95 120.03 2bm8 h TRP 41 Ca 0.17 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.20 2bm8 h TRP 41 Cb 1.63 -0.19 -0.00 0.00 -2.10 0.00 0.00 29.16 28.50 2bm8 h TRP 41 CO 0.88 0.21 -0.01 0.00 -2.79 0.00 0.00 178.44 176.73 2bm8 h ALA 42 N 1.49 1.01 -0.20 2.65 0.00 -1.87 -2.81 119.26 119.53 2bm8 h ALA 42 Ca 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2bm8 h ALA 42 Cb 0.49 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2bm8 h ALA 42 CO -0.31 0.01 0.00 0.39 0.00 0.00 0.00 179.25 179.34 2bm8 n GLU 43 N -3.12 2.24 -2.47 0.00 1.02 -0.70 -4.96 120.64 112.66 2bm8 n GLU 43 Ca -0.01 -1.85 -0.37 0.00 -0.02 0.00 0.00 57.16 54.91 2bm8 n GLU 43 Cb 0.22 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.13 2bm8 n GLU 43 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bm8 s ALA 44 N -1.75 3.08 0.62 0.62 0.00 -1.06 -5.00 121.76 118.27 2bm8 s ALA 44 Ca 0.34 0.77 -0.17 0.00 0.00 0.00 0.00 51.96 52.90 2bm8 s ALA 44 Cb 0.21 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 2bm8 s ALA 44 CO 0.30 -0.32 1.14 -1.25 0.00 0.00 0.00 175.76 175.64 2bm8 s PRO 45 N -2.50 2.90 0.00 0.00 0.04 -1.26 -4.97 135.00 129.22 2bm8 s PRO 45 Ca 0.58 1.57 0.17 0.00 0.04 0.00 0.00 61.00 63.37 2bm8 s PRO 45 Cb -0.24 -1.95 -0.13 0.00 0.04 0.00 0.00 34.50 32.22 2bm8 s PRO 45 CO 0.30 -1.20 0.79 0.54 0.04 0.00 0.00 177.00 177.47 2bm8 n ARG 46 N -2.00 1.40 -2.40 4.56 5.12 -1.26 -4.98 116.66 117.09 2bm8 n ARG 46 Ca 0.12 -0.26 -0.26 0.00 -1.93 0.00 0.00 57.85 55.52 2bm8 n ARG 46 Cb 0.51 -1.32 0.04 0.00 -1.16 0.00 0.00 32.46 30.53 2bm8 n ARG 46 CO 0.00 0.00 0.00 0.16 -1.93 0.00 0.00 177.63 175.86 2bm8 s ASP 47 N -2.46 5.34 0.22 0.55 1.47 -1.26 -4.98 116.67 115.56 2bm8 s ASP 47 Ca 0.09 0.53 -0.08 0.00 1.18 0.00 0.00 52.55 54.28 2bm8 s ASP 47 Cb 0.13 -1.43 0.35 0.00 -0.34 0.00 0.00 42.92 41.64 2bm8 s ASP 47 CO 0.63 -1.21 1.72 0.25 0.68 0.00 0.00 175.17 177.25 2bm8 h LEU 48 N -0.24 0.17 0.00 2.11 5.85 -2.02 -3.46 115.31 117.72 2bm8 h LEU 48 Ca -0.45 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.37 2bm8 h LEU 48 Cb 1.28 0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.41 2bm8 h LEU 48 CO 0.59 0.08 0.00 0.61 -0.34 0.00 0.00 178.44 179.38 2bm8 n GLY 49 N -1.31 0.58 3.50 3.75 0.00 -1.26 -5.04 105.19 105.40 2bm8 n GLY 49 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 2bm8 n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2bm8 s TYR 50 N -2.28 0.85 0.18 1.61 -0.85 -1.26 -4.42 117.35 111.18 2bm8 s TYR 50 Ca 0.00 -1.13 -0.30 0.00 -0.52 0.00 0.00 57.07 55.12 2bm8 s TYR 50 Cb 0.00 -0.03 -0.08 0.00 0.38 0.00 0.00 41.96 42.23 2bm8 s TYR 50 CO 0.00 -1.07 1.24 0.45 -1.52 0.00 0.00 175.55 174.66 2bm8 s SER 51 N -3.17 7.01 -0.10 -0.18 0.15 -1.26 -4.91 113.70 111.24 2bm8 s SER 51 Ca 0.29 2.28 0.06 0.00 0.70 0.00 0.00 55.95 59.27 2bm8 s SER 51 Cb 0.00 -2.61 0.34 0.00 -1.71 0.00 0.00 66.02 62.04 2bm8 s SER 51 CO 0.16 -0.44 1.01 -0.90 1.20 0.00 0.00 173.24 174.27 2bm8 n ASP 52 N 2.70 2.93 0.00 5.45 5.75 -1.26 -4.63 116.55 127.50 2bm8 n ASP 52 Ca 0.06 -2.38 0.00 0.00 -0.01 0.00 0.00 54.79 52.46 2bm8 n ASP 52 Cb 0.44 -0.57 0.00 0.00 -1.03 0.00 0.00 41.12 39.96 2bm8 n ASP 52 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2bm8 n PHE 53 N 0.26 0.00 -3.07 2.11 -0.00 -1.26 -4.52 117.46 110.97 2bm8 n PHE 53 Ca 0.11 0.00 -0.18 0.00 -0.00 0.00 0.00 57.45 57.38 2bm8 n PHE 53 Cb 0.64 -0.40 -0.04 0.00 -0.00 0.00 0.00 39.48 39.68 2bm8 n PHE 53 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2bm8 n SER 54 N -1.86 -1.17 -1.93 -2.13 2.88 -1.26 -5.01 113.62 103.14 2bm8 n SER 54 Ca 0.00 -2.80 -0.03 0.00 -1.33 0.00 0.00 58.87 54.71 2bm8 n SER 54 Cb 0.00 0.27 0.31 0.00 -0.75 0.00 0.00 64.21 64.05 2bm8 n SER 54 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2bm8 n PRO 55 N 1.97 3.86 -4.00 -1.46 -0.04 -1.26 -4.91 135.00 129.16 2bm8 n PRO 55 Ca 0.20 -2.93 -0.31 0.00 -0.04 0.00 0.00 63.50 60.42 2bm8 n PRO 55 Cb 0.55 -2.19 -0.06 0.00 -0.04 0.00 0.00 33.50 31.76 2bm8 n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2bm8 s TYR 56 N -2.81 3.34 0.22 0.54 1.51 -1.26 -5.02 117.35 113.87 2bm8 s TYR 56 Ca 0.52 0.17 0.03 0.00 -1.01 0.00 0.00 57.07 56.78 2bm8 s TYR 56 Cb 0.41 -1.70 -0.05 0.00 -0.11 0.00 0.00 41.96 40.52 2bm8 s TYR 56 CO 0.13 0.56 0.01 1.14 -1.11 0.00 0.00 175.55 176.28 2bm8 s GLN 57 N -2.34 1.27 -0.09 -0.62 -2.07 -1.26 -0.69 119.66 113.86 2bm8 s GLN 57 Ca 0.31 -1.64 -0.03 0.00 -1.82 0.00 0.00 55.36 52.17 2bm8 s GLN 57 Cb -0.12 -0.46 0.05 0.00 -1.09 0.00 0.00 33.01 31.39 2bm8 s GLN 57 CO 0.23 -0.13 0.11 -0.46 -1.32 0.00 0.00 175.29 173.72 2bm8 s TRP 58 N -3.54 -0.02 -1.51 9.60 -0.11 0.10 -4.71 118.94 118.75 2bm8 s TRP 58 Ca 0.28 0.26 -0.04 0.00 1.22 0.00 0.00 56.10 57.83 2bm8 s TRP 58 Cb 0.06 -0.44 0.00 0.00 -1.50 0.00 0.00 33.47 31.60 2bm8 s TRP 58 CO 0.08 -0.31 0.09 0.54 -4.62 0.00 0.00 176.95 172.72 2bm8 n ARG 59 N 5.31 -0.96 -0.98 5.86 1.74 -1.26 -0.77 116.66 125.59 2bm8 n ARG 59 Ca -0.04 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2bm8 n ARG 59 Cb 0.50 -3.51 0.00 0.00 -1.02 0.00 0.00 32.46 28.43 2bm8 n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bm8 n GLY 60 N -2.52 0.50 3.61 -0.13 0.00 -1.26 -5.02 105.19 100.38 2bm8 n GLY 60 Ca -0.31 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 2bm8 n GLY 60 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bm8 s LEU 61 N 0.00 3.28 0.35 0.99 1.43 0.05 -4.36 118.68 120.42 2bm8 s LEU 61 Ca 0.00 0.01 -0.29 0.00 -1.03 0.00 0.00 54.13 52.82 2bm8 s LEU 61 Cb 0.00 -1.75 -0.11 0.00 0.03 0.00 0.00 46.19 44.36 2bm8 s LEU 61 CO 0.00 0.36 1.53 -0.13 0.23 0.00 0.00 176.35 178.33 2bm8 s ARG 62 N -0.92 4.10 -0.26 1.70 0.52 -1.26 -0.72 118.95 122.12 2bm8 s ARG 62 Ca 0.13 2.59 -0.01 0.00 -0.52 0.00 0.00 55.73 57.92 2bm8 s ARG 62 Cb -0.11 -2.98 0.04 0.00 0.52 0.00 0.00 34.95 32.42 2bm8 s ARG 62 CO 0.03 -0.58 -0.06 -1.64 0.02 0.00 0.00 175.30 173.07 2bm8 s MET 63 N -1.65 2.68 0.09 3.54 -1.94 0.13 -3.94 119.30 118.20 2bm8 s MET 63 Ca 0.56 -1.08 0.26 0.00 -1.71 0.00 0.00 55.69 53.71 2bm8 s MET 63 Cb -0.47 -3.00 0.63 0.00 2.01 0.00 0.00 34.83 34.00 2bm8 s MET 63 CO 0.59 -0.46 1.54 1.28 -0.01 0.00 0.00 175.02 177.96 2bm8 n LEU 64 N 4.63 0.55 -4.68 -0.03 4.77 -1.26 -4.19 117.00 116.80 2bm8 n LEU 64 Ca -0.16 0.29 -0.40 0.00 -0.03 0.00 0.00 56.01 55.71 2bm8 n LEU 64 Cb 0.46 -0.28 -0.05 0.00 -2.33 0.00 0.00 43.42 41.22 2bm8 n LEU 64 CO 0.26 -0.03 0.43 -0.54 -1.33 0.00 0.00 177.39 176.18 2bm8 s LYS 65 N -3.09 4.28 0.70 3.23 1.02 -1.26 -5.05 119.74 119.57 2bm8 s LYS 65 Ca 0.10 0.75 -0.11 0.00 0.02 0.00 0.00 55.97 56.73 2bm8 s LYS 65 Cb 0.15 -3.55 0.01 0.00 -0.52 0.00 0.00 37.83 33.93 2bm8 s LYS 65 CO 0.66 -0.19 1.08 0.16 -0.92 0.00 0.00 175.35 176.14 2bm8 s ASP 66 N 1.09 5.46 0.34 2.83 1.47 -1.26 -4.72 116.67 121.87 2bm8 s ASP 66 Ca 0.32 1.10 0.09 0.00 1.18 0.00 0.00 52.55 55.25 2bm8 s ASP 66 Cb -0.16 -1.92 0.84 0.00 -0.34 0.00 0.00 42.92 41.34 2bm8 s ASP 66 CO 0.12 -1.32 1.80 -0.65 0.68 0.00 0.00 175.17 175.80 2bm8 h PRO 67 N -0.62 0.65 -0.49 2.11 0.11 -1.97 -0.15 132.00 131.64 2bm8 h PRO 67 Ca -0.45 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 2bm8 h PRO 67 Cb 1.25 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2bm8 h PRO 67 CO 0.64 0.43 -0.08 -0.44 -0.21 0.00 0.00 178.00 178.34 2bm8 h ASP 68 N 0.67 0.86 -0.48 -2.05 3.45 -1.94 -1.96 116.42 114.96 2bm8 h ASP 68 Ca 0.55 -0.25 -0.13 0.00 0.43 0.00 0.00 57.03 57.63 2bm8 h ASP 68 Cb 0.99 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 39.51 2bm8 h ASP 68 CO -0.32 0.96 -0.22 0.74 -1.57 0.00 0.00 179.24 178.83 2bm8 h THR 69 N 0.79 1.27 -0.94 0.35 2.02 -1.42 -2.39 112.91 112.59 2bm8 h THR 69 Ca 0.14 -1.39 0.10 0.00 0.77 0.00 0.00 66.41 66.02 2bm8 h THR 69 Cb 0.58 1.12 -0.07 0.00 -1.74 0.00 0.00 68.15 68.05 2bm8 h THR 69 CO 0.04 0.48 0.60 1.56 0.37 0.00 0.00 175.52 178.57 2bm8 h GLN 70 N 0.86 0.93 -0.51 6.66 4.20 -0.99 -1.45 115.11 124.83 2bm8 h GLN 70 Ca 0.11 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.64 2bm8 h GLN 70 Cb 0.80 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.36 2bm8 h GLN 70 CO 0.07 0.62 -0.16 0.00 -0.67 0.00 0.00 178.83 178.69 2bm8 h ALA 71 N 1.53 0.76 -0.30 3.87 0.00 -1.05 0.03 119.26 124.10 2bm8 h ALA 71 Ca 0.44 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2bm8 h ALA 71 Cb 0.39 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2bm8 h ALA 71 CO -0.20 0.67 -0.13 0.28 0.00 0.00 0.00 179.25 179.87 2bm8 h VAL 72 N 0.87 1.29 -0.40 0.00 2.07 -0.97 -2.30 116.25 116.80 2bm8 h VAL 72 Ca 0.13 -1.22 -0.06 0.00 0.82 0.00 0.00 66.70 66.36 2bm8 h VAL 72 Cb 0.73 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 2bm8 h VAL 72 CO 0.06 0.39 -0.02 1.88 0.02 0.00 0.00 177.57 179.90 2bm8 h TYR 73 N 0.37 0.69 -0.07 1.57 -1.99 -1.20 -1.36 116.97 114.99 2bm8 h TYR 73 Ca 0.07 -0.09 0.02 0.00 2.00 0.00 0.00 58.73 60.73 2bm8 h TYR 73 Cb 0.65 -0.19 -0.02 0.00 2.00 0.00 0.00 36.73 39.16 2bm8 h TYR 73 CO 0.06 0.67 -0.07 1.25 -0.00 0.00 0.00 178.16 180.07 2bm8 h HIS 74 N 0.61 -0.17 -0.70 4.88 2.76 -0.77 -0.66 115.15 121.10 2bm8 h HIS 74 Ca 0.12 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.24 2bm8 h HIS 74 Cb 0.42 0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.44 2bm8 h HIS 74 CO 0.02 -0.11 0.18 -0.44 -1.30 0.00 0.00 177.93 176.28 2bm8 h ASP 75 N -0.09 1.04 -0.52 3.26 3.32 -1.11 -2.15 116.42 120.18 2bm8 h ASP 75 Ca 0.05 -0.21 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 2bm8 h ASP 75 Cb 0.17 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2bm8 h ASP 75 CO -0.12 0.99 0.11 -0.03 -1.72 0.00 0.00 179.24 178.47 2bm8 h MET 76 N 1.05 0.84 -0.44 3.56 4.05 -1.05 -1.87 114.93 121.07 2bm8 h MET 76 Ca 0.22 -0.21 -0.09 0.00 -0.28 0.00 0.00 59.70 59.34 2bm8 h MET 76 Cb 0.35 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 31.03 2bm8 h MET 76 CO 0.00 0.81 -0.09 -0.07 0.23 0.00 0.00 176.91 177.79 2bm8 h LEU 77 N 0.72 0.84 -1.07 3.39 4.07 -0.95 -1.00 115.31 121.32 2bm8 h LEU 77 Ca 0.16 -0.35 -0.08 0.00 0.08 0.00 0.00 57.88 57.69 2bm8 h LEU 77 Cb 0.36 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.86 2bm8 h LEU 77 CO 0.00 1.00 -0.16 -0.25 -1.08 0.00 0.00 178.44 177.95 2bm8 h TRP 78 N 0.67 0.51 0.00 1.13 2.91 -1.24 0.40 115.95 120.33 2bm8 h TRP 78 Ca 0.11 -0.09 -0.00 0.00 1.13 0.00 0.00 58.89 60.05 2bm8 h TRP 78 Cb 0.62 -0.13 0.00 0.00 -0.51 0.00 0.00 29.16 29.13 2bm8 h TRP 78 CO 0.05 0.61 -0.00 1.49 -1.03 0.00 0.00 178.44 179.56 2bm8 h GLU 79 N 0.43 -0.00 0.16 2.65 4.81 -1.29 -3.38 114.58 117.95 2bm8 h GLU 79 Ca 0.08 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 59.01 2bm8 h GLU 79 Cb 0.54 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.94 2bm8 h GLU 79 CO 0.03 0.88 -1.30 1.25 -0.73 0.00 0.00 179.01 179.14 2bm8 h LEU 80 N -0.91 0.72 -2.78 1.64 6.46 -1.16 -3.49 115.31 115.79 2bm8 h LEU 80 Ca -0.00 -0.72 -0.25 0.00 -0.12 0.00 0.00 57.88 56.79 2bm8 h LEU 80 Cb 0.88 -0.23 0.09 0.00 -0.73 0.00 0.00 40.66 40.67 2bm8 h LEU 80 CO 0.00 1.54 -0.65 0.54 -0.62 0.00 0.00 178.44 179.25 2bm8 n ARG 81 N -3.69 -1.60 -2.51 1.25 1.74 0.14 -4.85 116.66 107.14 2bm8 n ARG 81 Ca -0.13 0.93 -0.35 0.00 -0.77 0.00 0.00 57.85 57.53 2bm8 n ARG 81 Cb 1.02 -4.98 -0.03 0.00 -1.02 0.00 0.00 32.46 27.45 2bm8 n ARG 81 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2bm8 s PRO 82 N -4.49 3.89 -0.02 5.56 0.04 -1.26 -4.58 135.00 134.15 2bm8 s PRO 82 Ca 0.28 1.45 0.21 0.00 0.04 0.00 0.00 61.00 62.98 2bm8 s PRO 82 Cb -0.07 -2.25 -0.28 0.00 0.04 0.00 0.00 34.50 31.94 2bm8 s PRO 82 CO 0.79 -0.37 0.66 0.54 0.04 0.00 0.00 177.00 178.67 2bm8 n ARG 83 N -0.67 0.43 -4.18 4.56 1.74 0.86 -4.48 116.66 114.92 2bm8 n ARG 83 Ca 0.08 -0.10 -0.18 0.00 -0.77 0.00 0.00 57.85 56.88 2bm8 n ARG 83 Cb 0.51 -1.49 -0.15 0.00 -1.02 0.00 0.00 32.46 30.31 2bm8 n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2bm8 s THR 84 N -3.22 0.48 -0.14 0.55 2.01 -1.01 -1.75 115.64 112.56 2bm8 s THR 84 Ca -0.00 -0.20 0.02 0.00 0.31 0.00 0.00 61.69 61.82 2bm8 s THR 84 Cb 0.15 -0.45 0.01 0.00 0.01 0.00 0.00 72.50 72.22 2bm8 s THR 84 CO 0.86 0.16 -0.22 -0.63 -0.69 0.00 0.00 174.62 174.11 2bm8 s ILE 85 N 0.23 2.05 -0.20 1.82 1.01 -0.67 -1.94 121.20 123.50 2bm8 s ILE 85 Ca -0.03 -0.97 -0.06 0.00 0.00 0.00 0.00 60.65 59.60 2bm8 s ILE 85 Cb -0.07 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 2bm8 s ILE 85 CO -0.00 0.55 0.01 -0.69 0.00 0.00 0.00 174.94 174.81 2bm8 s VAL 86 N 0.84 4.14 -0.26 2.92 1.01 -0.03 -0.70 120.40 128.32 2bm8 s VAL 86 Ca -0.07 -0.25 -0.07 0.00 0.00 0.00 0.00 61.98 61.60 2bm8 s VAL 86 Cb -0.15 -2.87 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 2bm8 s VAL 86 CO -0.02 0.43 0.05 -1.61 0.00 0.00 0.00 175.10 173.95 2bm8 s GLU 87 N 0.86 3.46 -0.43 2.72 0.41 0.85 -0.62 118.70 125.94 2bm8 s GLU 87 Ca 0.01 -0.60 -0.19 0.00 -0.41 0.00 0.00 54.97 53.78 2bm8 s GLU 87 Cb -0.14 -3.29 0.02 0.00 -1.78 0.00 0.00 34.13 28.94 2bm8 s GLU 87 CO 0.02 -0.26 0.56 -1.17 -0.49 0.00 0.00 175.26 173.92 2bm8 s LEU 88 N 1.56 4.64 0.00 1.80 0.20 -0.42 -0.66 118.68 125.80 2bm8 s LEU 88 Ca 0.05 -0.46 0.00 0.00 0.69 0.00 0.00 54.13 54.41 2bm8 s LEU 88 Cb -0.15 -2.60 0.00 0.00 -0.43 0.00 0.00 46.19 43.01 2bm8 s LEU 88 CO 0.02 -0.70 0.00 0.61 -0.29 0.00 0.00 176.35 175.99 2bm8 n GLY 89 N 5.06 0.54 0.35 7.98 0.00 0.12 -0.74 105.19 118.51 2bm8 n GLY 89 Ca -0.04 -0.95 -0.15 0.00 0.00 0.00 0.00 46.02 44.88 2bm8 n GLY 89 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2bm8 n VAL 90 N 2.45 0.88 0.00 1.61 0.31 -1.25 -4.76 118.33 117.58 2bm8 n VAL 90 Ca 0.00 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2bm8 n VAL 90 Cb 0.00 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 31.44 2bm8 n VAL 90 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2bm8 n TYR 91 N -3.46 0.00 1.09 3.52 9.36 -1.26 -1.58 117.16 124.83 2bm8 n TYR 91 Ca -0.30 0.00 0.13 0.00 3.32 0.00 0.00 57.90 61.05 2bm8 n TYR 91 Cb 0.75 0.00 0.39 0.00 -0.63 0.00 0.00 39.34 39.84 2bm8 n TYR 91 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 2bm8 n ASN 92 N 11.14 0.48 0.00 2.98 2.04 -1.26 -2.87 115.26 127.76 2bm8 n ASN 92 Ca 0.00 -0.26 0.00 0.00 -0.44 0.00 0.00 54.58 53.88 2bm8 n ASN 92 Cb 0.00 0.05 0.00 0.00 -2.53 0.00 0.00 39.78 37.30 2bm8 n ASN 92 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2bm8 n GLY 93 N 1.45 0.68 0.13 4.83 0.00 -0.61 -0.96 105.19 110.70 2bm8 n GLY 93 Ca 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.03 2bm8 n GLY 93 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bm8 h GLY 94 N 0.00 0.24 1.77 -0.02 0.00 -1.80 -1.87 103.07 101.39 2bm8 h GLY 94 Ca 0.00 0.07 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 2bm8 h GLY 94 CO 0.00 -0.10 -0.03 1.48 0.00 0.00 0.00 176.54 177.89 2bm8 h SER 95 N 0.03 0.27 -0.21 0.19 4.64 -1.89 -1.20 113.55 115.38 2bm8 h SER 95 Ca 0.14 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2bm8 h SER 95 Cb 0.21 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2bm8 h SER 95 CO -0.28 0.36 0.14 -0.07 -0.87 0.00 0.00 176.83 176.10 2bm8 h LEU 96 N 0.29 0.24 -0.35 5.97 4.07 -1.74 0.38 115.31 124.17 2bm8 h LEU 96 Ca 0.07 -0.01 -0.04 0.00 0.08 0.00 0.00 57.88 57.98 2bm8 h LEU 96 Cb 0.25 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.92 2bm8 h LEU 96 CO 0.01 0.18 0.08 0.00 -1.08 0.00 0.00 178.44 177.63 2bm8 h ALA 97 N 1.07 0.47 -0.23 1.53 0.00 -0.93 -1.23 119.26 119.94 2bm8 h ALA 97 Ca 0.08 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.84 2bm8 h ALA 97 Cb -0.03 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 2bm8 h ALA 97 CO -0.02 0.14 -0.03 2.35 0.00 0.00 0.00 179.25 181.69 2bm8 h TRP 98 N 0.42 -0.07 -0.63 0.00 7.01 -1.10 0.04 115.95 121.62 2bm8 h TRP 98 Ca 0.11 0.02 -0.07 0.00 2.11 0.00 0.00 58.89 61.06 2bm8 h TRP 98 Cb 0.31 0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.41 2bm8 h TRP 98 CO 0.02 -0.07 0.12 0.74 -2.79 0.00 0.00 178.44 176.45 2bm8 h PHE 99 N 0.03 1.10 -0.40 2.65 0.05 -0.74 -1.33 116.94 118.31 2bm8 h PHE 99 Ca 0.11 -0.15 -0.01 0.00 3.82 0.00 0.00 57.97 61.74 2bm8 h PHE 99 Cb 0.16 -0.30 -0.02 0.00 2.00 0.00 0.00 35.95 37.78 2bm8 h PHE 99 CO -0.22 0.93 0.22 -0.09 -0.18 0.00 0.00 178.31 178.97 2bm8 h ARG 100 N 0.96 0.55 -0.52 1.51 1.12 -0.94 -2.27 114.38 114.79 2bm8 h ARG 100 Ca 0.19 -0.07 -0.03 0.00 -1.11 0.00 0.00 59.98 58.97 2bm8 h ARG 100 Cb 0.41 -0.11 -0.02 0.00 -0.01 0.00 0.00 29.97 30.24 2bm8 h ARG 100 CO 0.01 0.45 0.20 -0.44 -3.11 0.00 0.00 179.97 177.09 2bm8 h ASP 101 N 0.51 0.71 -0.30 -3.80 3.32 -0.53 -2.33 116.42 114.01 2bm8 h ASP 101 Ca 0.14 -0.17 -0.17 0.00 0.02 0.00 0.00 57.03 56.85 2bm8 h ASP 101 Cb 0.06 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.42 2bm8 h ASP 101 CO -0.02 0.69 -0.46 0.25 -1.72 0.00 0.00 179.24 177.98 2bm8 h LEU 102 N 0.69 0.94 -1.06 1.55 5.85 -1.23 -1.63 115.31 120.42 2bm8 h LEU 102 Ca 0.17 -0.46 -0.03 0.00 0.84 0.00 0.00 57.88 58.40 2bm8 h LEU 102 Cb 0.20 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2bm8 h LEU 102 CO -0.01 1.25 0.29 0.71 -0.34 0.00 0.00 178.44 180.33 2bm8 h THR 103 N 0.69 1.22 0.18 1.05 1.35 -1.38 -2.39 112.91 113.64 2bm8 h THR 103 Ca 0.04 -0.66 -0.01 0.00 -0.55 0.00 0.00 66.41 65.23 2bm8 h THR 103 Cb 1.05 0.41 0.00 0.00 -1.73 0.00 0.00 68.15 67.88 2bm8 h THR 103 CO 0.10 0.27 -0.09 0.50 -0.25 0.00 0.00 175.52 176.06 2bm8 h LYS 104 N 0.94 -0.23 0.00 4.72 3.64 -0.84 -0.91 116.57 123.89 2bm8 h LYS 104 Ca 0.23 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.60 2bm8 h LYS 104 Cb 0.14 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 2bm8 h LYS 104 CO -0.02 0.00 -0.10 -0.84 -2.27 0.00 0.00 179.45 176.22 2bm8 h ILE 105 N -0.44 0.42 0.00 2.00 -0.00 -1.33 -1.33 117.51 116.83 2bm8 h ILE 105 Ca -0.02 -0.50 0.00 0.00 -0.00 0.00 0.00 64.86 64.33 2bm8 h ILE 105 Cb 0.34 1.35 0.00 0.00 -0.00 0.00 0.00 36.82 38.52 2bm8 h ILE 105 CO 0.04 0.09 0.00 0.23 -0.00 0.00 0.00 178.15 178.51 2bm8 n MET 106 N -3.49 0.18 -1.95 0.16 2.81 -0.90 -4.90 117.12 109.04 2bm8 n MET 106 Ca -0.01 0.06 -0.06 0.00 -1.81 0.00 0.00 57.70 55.88 2bm8 n MET 106 Cb 0.24 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.24 2bm8 n MET 106 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2bm8 n GLY 107 N 0.95 0.25 3.54 3.03 0.00 -0.50 -5.04 105.19 107.43 2bm8 n GLY 107 Ca 0.09 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.08 2bm8 n GLY 107 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bm8 s ILE 108 N -2.27 4.50 -0.59 -0.61 1.01 -0.38 -5.04 121.20 117.82 2bm8 s ILE 108 Ca 0.00 -0.12 -0.28 0.00 0.00 0.00 0.00 60.65 60.25 2bm8 s ILE 108 Cb 0.00 -3.06 0.01 0.00 0.01 0.00 0.00 42.46 39.43 2bm8 s ILE 108 CO 0.00 0.41 1.41 -0.62 0.00 0.00 0.00 174.94 176.14 2bm8 s ASP 109 N 0.93 6.10 -0.07 3.58 3.68 -1.26 -4.26 116.67 125.36 2bm8 s ASP 109 Ca 0.03 0.19 -0.01 0.00 2.13 0.00 0.00 52.55 54.89 2bm8 s ASP 109 Cb -0.14 -2.55 0.03 0.00 -1.45 0.00 0.00 42.92 38.81 2bm8 s ASP 109 CO 0.03 -1.75 -0.01 0.00 0.13 0.00 0.00 175.17 173.56 2bm8 s GLN 111 N 1.78 4.43 -0.11 0.00 -1.52 -0.72 -4.95 119.66 118.58 2bm8 s GLN 111 Ca 0.02 0.86 -0.08 0.00 -1.95 0.00 0.00 55.36 54.21 2bm8 s GLN 111 Cb -0.13 -3.43 -0.04 0.00 -0.22 0.00 0.00 33.01 29.19 2bm8 s GLN 111 CO -0.05 0.11 0.17 0.08 -0.25 0.00 0.00 175.29 175.36 2bm8 s VAL 112 N 0.63 5.45 -0.08 1.09 1.01 -0.52 -1.68 120.40 126.30 2bm8 s VAL 112 Ca 0.36 0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.65 2bm8 s VAL 112 Cb -0.18 -3.44 0.02 0.00 0.00 0.00 0.00 36.38 32.77 2bm8 s VAL 112 CO 0.18 0.61 -0.11 -0.63 0.00 0.00 0.00 175.10 175.14 2bm8 s ILE 113 N -0.98 1.13 -0.07 2.22 1.01 0.13 -1.01 121.20 123.63 2bm8 s ILE 113 Ca 0.16 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.39 2bm8 s ILE 113 Cb -0.13 -1.06 -0.02 0.00 0.01 0.00 0.00 42.46 41.26 2bm8 s ILE 113 CO 0.05 0.36 -0.13 -0.83 0.00 0.00 0.00 174.94 174.39 2bm8 s GLY 114 N 0.92 1.55 -0.07 6.18 0.00 0.35 -0.11 107.32 116.14 2bm8 s GLY 114 Ca -0.10 -0.95 0.03 0.00 0.00 0.00 0.00 44.72 43.71 2bm8 s GLY 114 CO 0.01 -0.65 -0.18 -0.42 0.00 0.00 0.00 173.10 171.86 2bm8 s ILE 115 N -0.54 1.55 -0.01 0.90 1.01 0.17 -0.80 121.20 123.48 2bm8 s ILE 115 Ca 0.07 -0.74 -0.19 0.00 0.00 0.00 0.00 60.65 59.80 2bm8 s ILE 115 Cb -0.12 -1.36 0.04 0.00 0.01 0.00 0.00 42.46 41.03 2bm8 s ILE 115 CO 0.01 0.45 0.41 -0.62 0.00 0.00 0.00 174.94 175.19 2bm8 s ASP 116 N 0.39 -0.31 0.23 3.58 2.15 -0.64 0.10 116.67 122.18 2bm8 s ASP 116 Ca -0.14 0.21 -0.08 0.00 0.43 0.00 0.00 52.55 52.98 2bm8 s ASP 116 Cb -0.16 0.38 0.25 0.00 -0.30 0.00 0.00 42.92 43.10 2bm8 s ASP 116 CO 0.05 -0.52 1.87 -0.09 -0.17 0.00 0.00 175.17 176.31 2bm8 h ARG 117 N 3.52 1.00 -2.82 4.34 2.43 -1.84 -0.87 114.38 120.15 2bm8 h ARG 117 Ca -0.29 -0.06 -0.53 0.00 -0.81 0.00 0.00 59.98 58.28 2bm8 h ARG 117 Cb 1.17 -0.23 -0.40 0.00 -0.42 0.00 0.00 29.97 30.10 2bm8 h ARG 117 CO 0.40 0.66 -0.78 0.34 -1.51 0.00 0.00 179.97 179.09 2bm8 s ASP 118 N -5.85 3.55 0.00 -3.80 2.15 -1.26 -4.42 116.67 107.03 2bm8 s ASP 118 Ca -0.13 -1.31 0.31 0.00 0.43 0.00 0.00 52.55 51.85 2bm8 s ASP 118 Cb 0.17 -0.37 1.65 0.00 -0.30 0.00 0.00 42.92 44.06 2bm8 s ASP 118 CO 0.79 -0.44 2.08 0.18 -0.17 0.00 0.00 175.17 177.61 2bm8 n LEU 119 N 5.22 0.44 0.15 -1.34 4.77 -1.26 -3.83 117.00 121.15 2bm8 n LEU 119 Ca -0.06 -0.14 0.13 0.00 -0.03 0.00 0.00 56.01 55.91 2bm8 n LEU 119 Cb 0.42 -0.01 0.47 0.00 -2.33 0.00 0.00 43.42 41.98 2bm8 n LEU 119 CO 0.04 0.07 0.88 0.77 -1.33 0.00 0.00 177.39 177.83 2bm8 h SER 120 N 0.69 0.00 0.52 -1.43 4.64 -1.95 -2.75 113.55 113.28 2bm8 h SER 120 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bm8 h SER 120 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2bm8 h SER 120 CO 0.00 0.00 -0.22 0.54 -0.87 0.00 0.00 176.83 176.28 2bm8 n ARG 121 N -2.42 0.36 -1.78 4.77 3.00 -1.25 -4.92 116.66 114.42 2bm8 n ARG 121 Ca 0.03 -0.15 -0.41 0.00 -0.01 0.00 0.00 57.85 57.31 2bm8 n ARG 121 Cb 0.32 -1.50 -0.00 0.00 0.00 0.00 0.00 32.46 31.28 2bm8 n ARG 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2bm8 n GLN 123 N 0.56 0.00 -2.33 0.00 1.13 -0.13 -4.99 117.38 111.63 2bm8 n GLN 123 Ca 0.02 -0.76 -0.43 0.00 -1.94 0.00 0.00 57.00 53.89 2bm8 n GLN 123 Cb 0.39 -1.00 -0.02 0.00 0.11 0.00 0.00 30.24 29.71 2bm8 n GLN 123 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2bm8 s ILE 124 N -0.26 4.10 0.43 5.09 1.01 -1.25 -4.99 121.20 125.33 2bm8 s ILE 124 Ca 0.00 1.32 -0.25 0.00 0.00 0.00 0.00 60.65 61.73 2bm8 s ILE 124 Cb 0.00 -3.89 -0.09 0.00 0.01 0.00 0.00 42.46 38.49 2bm8 s ILE 124 CO 0.00 -0.16 1.24 -2.65 0.00 0.00 0.00 174.94 173.38 2bm8 n PRO 125 N 6.82 1.82 -0.05 2.79 -0.02 -1.26 -4.87 135.00 140.24 2bm8 n PRO 125 Ca 0.15 0.65 0.13 0.00 -2.02 0.00 0.00 63.50 62.41 2bm8 n PRO 125 Cb 0.45 -2.35 0.54 0.00 -0.02 0.00 0.00 33.50 32.11 2bm8 n PRO 125 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bm8 h ALA 126 N 1.94 2.09 -0.67 3.55 0.00 -1.99 -2.18 119.26 122.01 2bm8 h ALA 126 Ca -0.48 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 54.59 2bm8 h ALA 126 Cb 1.30 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 2bm8 h ALA 126 CO 0.59 -0.22 0.46 0.66 0.00 0.00 0.00 179.25 180.75 2bm8 h SER 127 N 0.32 0.14 -2.21 0.00 4.64 -2.03 -1.36 113.55 113.05 2bm8 h SER 127 Ca 0.25 0.01 -0.56 0.00 -0.47 0.00 0.00 61.79 61.02 2bm8 h SER 127 Cb 0.58 -0.02 -0.41 0.00 -0.31 0.00 0.00 62.40 62.23 2bm8 h SER 127 CO -0.06 0.07 -0.78 -0.90 -0.87 0.00 0.00 176.83 174.30 2bm8 n ASP 128 N -4.40 3.56 -0.83 4.97 3.85 -0.82 -4.71 116.55 118.16 2bm8 n ASP 128 Ca 0.13 -3.51 0.07 0.00 -0.71 0.00 0.00 54.79 50.77 2bm8 n ASP 128 Cb 0.63 -0.58 0.21 0.00 -1.35 0.00 0.00 41.12 40.03 2bm8 n ASP 128 CO 0.00 0.00 0.00 0.80 -1.01 0.00 0.00 177.20 176.99 2bm8 n MET 129 N -0.07 2.96 -1.64 0.11 1.56 -0.51 -4.83 117.12 114.70 2bm8 n MET 129 Ca 0.29 -2.34 -0.48 0.00 -0.27 0.00 0.00 57.70 54.90 2bm8 n MET 129 Cb 0.46 -1.47 -0.05 0.00 2.15 0.00 0.00 33.22 34.31 2bm8 n MET 129 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 2bm8 n GLU 130 N 0.45 1.75 -1.55 2.12 2.13 -1.26 -1.67 120.64 122.61 2bm8 n GLU 130 Ca 0.16 0.63 -0.19 0.00 0.66 0.00 0.00 57.16 58.42 2bm8 n GLU 130 Cb 0.58 -2.35 -0.08 0.00 0.27 0.00 0.00 31.44 29.86 2bm8 n GLU 130 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2bm8 n ASN 131 N 3.03 -5.28 -4.35 4.31 3.02 -1.26 -4.98 115.26 109.75 2bm8 n ASN 131 Ca 0.17 0.47 -0.33 0.00 -0.03 0.00 0.00 54.58 54.86 2bm8 n ASN 131 Cb 0.25 -4.45 -0.14 0.00 -0.61 0.00 0.00 39.78 34.83 2bm8 n ASN 131 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2bm8 s ILE 132 N -2.70 3.09 -0.10 2.41 1.01 -0.67 -1.44 121.20 122.80 2bm8 s ILE 132 Ca 0.00 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 60.04 2bm8 s ILE 132 Cb 0.00 -2.32 -0.01 0.00 0.01 0.00 0.00 42.46 40.14 2bm8 s ILE 132 CO 0.00 0.51 -0.18 -0.89 0.00 0.00 0.00 174.94 174.38 2bm8 s THR 133 N 0.59 2.64 0.01 2.92 2.01 -0.18 -5.01 115.64 118.62 2bm8 s THR 133 Ca -0.07 -0.83 0.03 0.00 0.31 0.00 0.00 61.69 61.13 2bm8 s THR 133 Cb -0.15 -2.05 -0.03 0.00 0.01 0.00 0.00 72.50 70.27 2bm8 s THR 133 CO 0.03 0.55 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.71 2bm8 s LEU 134 N 0.07 3.30 -0.01 4.42 1.02 -1.26 -0.50 118.68 125.72 2bm8 s LEU 134 Ca -0.08 -0.10 0.01 0.00 0.02 0.00 0.00 54.13 53.98 2bm8 s LEU 134 Cb -0.15 -1.90 0.01 0.00 0.02 0.00 0.00 46.19 44.16 2bm8 s LEU 134 CO 0.05 0.27 -0.03 -1.00 0.02 0.00 0.00 176.35 175.67 2bm8 s HIS 135 N -1.05 0.35 -0.08 0.29 3.76 0.02 -4.94 115.29 113.64 2bm8 s HIS 135 Ca 0.18 -0.05 -0.12 0.00 -0.15 0.00 0.00 55.06 54.92 2bm8 s HIS 135 Cb -0.11 -0.28 -0.05 0.00 1.11 0.00 0.00 32.58 33.25 2bm8 s HIS 135 CO 0.09 -0.04 0.29 -1.14 -0.85 0.00 0.00 174.74 173.08 2bm8 s GLN 136 N 0.23 3.83 0.00 1.40 0.74 -1.26 -1.62 119.66 122.98 2bm8 s GLN 136 Ca -0.02 0.15 0.00 0.00 0.05 0.00 0.00 55.36 55.54 2bm8 s GLN 136 Cb -0.05 -3.26 0.00 0.00 1.10 0.00 0.00 33.01 30.80 2bm8 s GLN 136 CO -0.00 0.62 0.00 0.41 -0.55 0.00 0.00 175.29 175.76 2bm8 n GLY 137 N 2.24 1.03 3.87 2.59 0.00 -0.33 -4.92 105.19 109.67 2bm8 n GLY 137 Ca -0.16 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.65 2bm8 n GLY 137 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bm8 s ASP 138 N 0.00 6.61 -0.05 1.61 3.68 -1.26 -2.88 116.67 124.38 2bm8 s ASP 138 Ca 0.00 0.75 -0.25 0.00 2.13 0.00 0.00 52.55 55.17 2bm8 s ASP 138 Cb 0.00 -2.16 -0.20 0.00 -1.45 0.00 0.00 42.92 39.11 2bm8 s ASP 138 CO 0.00 0.17 1.09 0.00 0.13 0.00 0.00 175.17 176.56 2bm8 n SER 140 N -4.83 0.24 -4.37 0.00 7.64 -1.26 -4.07 113.62 106.97 2bm8 n SER 140 Ca -0.09 0.52 -0.38 0.00 1.01 0.00 0.00 58.87 59.93 2bm8 n SER 140 Cb 0.29 -0.51 -0.12 0.00 -1.01 0.00 0.00 64.21 62.87 2bm8 n SER 140 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2bm8 s ASP 141 N -3.25 5.43 0.54 6.43 2.15 -1.22 -4.98 116.67 121.76 2bm8 s ASP 141 Ca -0.01 -0.77 0.31 0.00 0.43 0.00 0.00 52.55 52.50 2bm8 s ASP 141 Cb 0.03 -1.95 1.48 0.00 -0.30 0.00 0.00 42.92 42.18 2bm8 s ASP 141 CO 0.09 -0.26 2.05 -0.07 -0.17 0.00 0.00 175.17 176.81 2bm8 h LEU 142 N 8.32 0.00 -2.17 -1.34 3.38 -1.84 -2.98 115.31 118.68 2bm8 h LEU 142 Ca -0.29 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 2bm8 h LEU 142 Cb 1.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 2bm8 h LEU 142 CO 0.62 0.09 -0.05 0.71 0.09 0.00 0.00 178.44 179.90 2bm8 h THR 143 N 0.00 0.68 -0.70 0.22 1.35 -1.92 -1.32 112.91 111.22 2bm8 h THR 143 Ca -0.00 -0.21 0.15 0.00 -0.55 0.00 0.00 66.41 65.80 2bm8 h THR 143 Cb 0.40 1.13 -0.12 0.00 -1.73 0.00 0.00 68.15 67.82 2bm8 h THR 143 CO 0.01 0.05 -0.01 0.74 -0.25 0.00 0.00 175.52 176.07 2bm8 h THR 144 N 0.00 0.40 0.05 6.82 2.02 -1.77 -2.59 112.91 117.84 2bm8 h THR 144 Ca -0.00 -0.04 -0.27 0.00 0.77 0.00 0.00 66.41 66.87 2bm8 h THR 144 Cb 0.12 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 2bm8 h THR 144 CO 0.01 0.02 -1.41 -0.26 0.37 0.00 0.00 175.52 174.24 2bm8 h PHE 145 N 0.10 0.20 0.00 3.16 -1.00 -1.49 -3.34 116.94 114.58 2bm8 h PHE 145 Ca 0.37 -0.14 -0.06 0.00 2.81 0.00 0.00 57.97 60.95 2bm8 h PHE 145 Cb 0.63 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 40.17 2bm8 h PHE 145 CO -0.41 1.17 -0.28 0.93 -1.61 0.00 0.00 178.31 178.11 2bm8 h GLU 146 N 0.03 0.00 -0.01 1.51 5.08 -1.22 -2.26 114.58 117.71 2bm8 h GLU 146 Ca -0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2bm8 h GLU 146 Cb 1.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.19 2bm8 h GLU 146 CO 0.13 0.28 -0.18 -2.39 -1.00 0.00 0.00 179.01 175.86 2bm8 n HIS 147 N -3.93 0.00 -1.75 4.33 1.44 -0.99 -4.84 115.22 109.48 2bm8 n HIS 147 Ca -0.02 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.27 2bm8 n HIS 147 Cb 0.36 -0.09 -0.03 0.00 0.12 0.00 0.00 29.99 30.35 2bm8 n HIS 147 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2bm8 s LEU 148 N -2.36 4.37 0.89 2.39 1.43 -0.85 -5.00 118.68 119.54 2bm8 s LEU 148 Ca 0.28 2.87 -0.13 0.00 -1.03 0.00 0.00 54.13 56.12 2bm8 s LEU 148 Cb 0.20 -3.61 0.13 0.00 0.03 0.00 0.00 46.19 42.94 2bm8 s LEU 148 CO 0.47 -0.96 1.21 -0.13 0.23 0.00 0.00 176.35 177.17 2bm8 s ARG 149 N 0.90 1.32 0.27 1.70 3.00 -1.26 -4.97 118.95 119.92 2bm8 s ARG 149 Ca 0.73 0.00 -0.30 0.00 0.00 0.00 0.00 55.73 56.15 2bm8 s ARG 149 Cb -0.49 -1.89 -0.12 0.00 0.00 0.00 0.00 34.95 32.45 2bm8 s ARG 149 CO 0.35 -2.02 1.52 0.39 0.00 0.00 0.00 175.30 175.54 2bm8 n GLU 150 N -3.58 2.44 -4.29 3.54 -0.58 -1.26 -5.01 120.64 111.90 2bm8 n GLU 150 Ca 0.10 0.87 -0.27 0.00 -0.42 0.00 0.00 57.16 57.43 2bm8 n GLU 150 Cb 0.60 -2.60 -0.10 0.00 -0.57 0.00 0.00 31.44 28.77 2bm8 n GLU 150 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2bm8 s MET 151 N -0.46 1.99 0.40 3.49 -1.94 -1.26 -5.14 119.30 116.39 2bm8 s MET 151 Ca 0.66 -1.24 -0.09 0.00 -1.71 0.00 0.00 55.69 53.30 2bm8 s MET 151 Cb -0.56 -2.15 -0.06 0.00 2.01 0.00 0.00 34.83 34.08 2bm8 s MET 151 CO 0.49 0.45 0.75 0.00 -0.01 0.00 0.00 175.02 176.69 2bm8 s ALA 152 N -1.57 3.39 0.26 3.03 0.00 -1.26 -5.07 121.76 120.54 2bm8 s ALA 152 Ca 0.23 -0.29 0.10 0.00 0.00 0.00 0.00 51.96 52.01 2bm8 s ALA 152 Cb -0.09 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.34 2bm8 s ALA 152 CO 0.14 -0.03 -0.07 -1.01 0.00 0.00 0.00 175.76 174.78 2bm8 s HIS 153 N -2.39 2.57 0.91 0.00 3.76 -1.26 -3.53 115.29 115.34 2bm8 s HIS 153 Ca 0.50 -0.25 -0.11 0.00 -0.15 0.00 0.00 55.06 55.05 2bm8 s HIS 153 Cb -0.10 -1.15 0.14 0.00 1.11 0.00 0.00 32.58 32.57 2bm8 s HIS 153 CO 0.33 0.63 1.10 -2.14 -0.85 0.00 0.00 174.74 173.81 2bm8 s PRO 154 N -3.49 1.14 -0.01 8.40 0.02 -1.26 -4.46 135.00 135.35 2bm8 s PRO 154 Ca 0.30 1.19 0.01 0.00 0.02 0.00 0.00 61.00 62.51 2bm8 s PRO 154 Cb -0.06 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.69 2bm8 s PRO 154 CO 0.18 -2.43 -0.02 -1.17 -0.33 0.00 0.00 177.00 173.23 2bm8 s LEU 155 N -6.42 1.88 -0.20 -5.54 0.20 -1.26 -0.10 118.68 107.24 2bm8 s LEU 155 Ca 0.65 -0.03 -0.00 0.00 0.69 0.00 0.00 54.13 55.43 2bm8 s LEU 155 Cb -0.20 -0.12 0.01 0.00 -0.43 0.00 0.00 46.19 45.45 2bm8 s LEU 155 CO 0.58 0.01 -0.15 -0.63 -0.29 0.00 0.00 176.35 175.87 2bm8 s ILE 156 N 0.11 2.44 -0.24 6.68 1.01 -0.82 -1.88 121.20 128.51 2bm8 s ILE 156 Ca -0.01 -0.85 -0.07 0.00 0.00 0.00 0.00 60.65 59.72 2bm8 s ILE 156 Cb -0.03 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.34 2bm8 s ILE 156 CO -0.00 0.48 0.07 0.12 0.00 0.00 0.00 174.94 175.60 2bm8 s PHE 157 N 1.34 3.10 -0.16 3.97 5.36 -0.34 -0.85 117.98 130.40 2bm8 s PHE 157 Ca 0.05 -0.36 -0.01 0.00 -0.96 0.00 0.00 56.93 55.65 2bm8 s PHE 157 Cb -0.14 -2.21 -0.01 0.00 -0.34 0.00 0.00 43.02 40.32 2bm8 s PHE 157 CO -0.10 -0.29 -0.12 0.42 -1.46 0.00 0.00 175.22 173.67 2bm8 s ILE 158 N 1.44 2.92 -0.37 3.12 1.01 0.21 -0.96 121.20 128.56 2bm8 s ILE 158 Ca 0.05 -0.68 -0.18 0.00 0.00 0.00 0.00 60.65 59.84 2bm8 s ILE 158 Cb -0.15 -2.25 0.00 0.00 0.01 0.00 0.00 42.46 40.08 2bm8 s ILE 158 CO 0.04 0.50 0.51 -0.62 0.00 0.00 0.00 174.94 175.37 2bm8 s ASP 159 N 0.80 6.29 0.00 3.58 3.68 0.10 -1.30 116.67 129.83 2bm8 s ASP 159 Ca -0.04 -0.16 0.03 0.00 2.13 0.00 0.00 52.55 54.51 2bm8 s ASP 159 Cb -0.15 -2.26 0.09 0.00 -1.45 0.00 0.00 42.92 39.14 2bm8 s ASP 159 CO 0.01 -0.52 1.05 0.59 0.13 0.00 0.00 175.17 176.42 2bm8 n ASN 160 N 5.77 2.22 -0.09 -0.34 3.02 0.08 -2.24 115.26 123.69 2bm8 n ASN 160 Ca -0.05 -1.95 -0.11 0.00 -0.03 0.00 0.00 54.58 52.44 2bm8 n ASN 160 Cb 0.49 -0.07 -0.10 0.00 -0.61 0.00 0.00 39.78 39.49 2bm8 n ASN 160 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bm8 n ALA 161 N -0.18 1.61 -1.73 5.41 0.00 -1.07 -4.79 120.51 119.77 2bm8 n ALA 161 Ca 0.03 -0.86 -0.15 0.00 0.00 0.00 0.00 53.44 52.46 2bm8 n ALA 161 Cb 0.29 0.02 -0.05 0.00 0.00 0.00 0.00 19.45 19.72 2bm8 n ALA 161 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2bm8 n HIS 162 N -2.89 -0.24 -4.46 0.00 8.25 -1.26 -5.00 115.22 109.62 2bm8 n HIS 162 Ca -0.30 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 56.82 2bm8 n HIS 162 Cb 0.90 -2.86 -0.13 0.00 1.12 0.00 0.00 29.99 29.02 2bm8 n HIS 162 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2bm8 s ALA 163 N -2.64 2.90 -1.42 -1.41 0.00 -1.26 -4.65 121.76 113.28 2bm8 s ALA 163 Ca 0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 51.96 51.01 2bm8 s ALA 163 Cb 0.00 -1.49 0.03 0.00 0.00 0.00 0.00 23.12 21.66 2bm8 s ALA 163 CO 0.00 0.18 1.07 -1.71 0.00 0.00 0.00 175.76 175.30 2bm8 n ASN 164 N 3.61 -5.98 -0.11 0.00 5.15 -1.26 -4.56 115.26 112.12 2bm8 n ASN 164 Ca -0.18 -0.56 -0.11 0.00 -0.60 0.00 0.00 54.58 53.14 2bm8 n ASN 164 Cb 0.52 -4.73 -0.03 0.00 -0.53 0.00 0.00 39.78 35.01 2bm8 n ASN 164 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 2bm8 h THR 165 N -2.40 1.25 -0.04 -0.44 2.02 -1.97 -2.35 112.91 108.99 2bm8 h THR 165 Ca -0.57 -0.88 -0.08 0.00 0.77 0.00 0.00 66.41 65.66 2bm8 h THR 165 Cb 1.37 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 68.98 2bm8 h THR 165 CO 0.59 0.29 -0.34 -0.26 0.37 0.00 0.00 175.52 176.17 2bm8 h PHE 166 N 0.34 0.07 -0.06 3.16 -1.00 -1.98 0.20 116.94 117.67 2bm8 h PHE 166 Ca 0.09 -0.02 -0.17 0.00 2.81 0.00 0.00 57.97 60.69 2bm8 h PHE 166 Cb 0.39 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.92 2bm8 h PHE 166 CO 0.03 0.40 -0.70 -0.91 -1.61 0.00 0.00 178.31 175.52 2bm8 h ASN 167 N 0.06 0.35 -0.44 2.17 2.35 -1.93 -1.74 115.58 116.41 2bm8 h ASN 167 Ca 0.01 -0.23 -0.09 0.00 -0.55 0.00 0.00 56.30 55.44 2bm8 h ASN 167 Cb 0.63 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 2bm8 h ASN 167 CO 0.05 0.94 -0.07 0.40 -1.65 0.00 0.00 177.43 177.10 2bm8 h ILE 168 N 0.21 1.27 -0.79 2.81 2.04 -0.83 -0.97 117.51 121.25 2bm8 h ILE 168 Ca -0.02 -1.16 0.06 0.00 1.00 0.00 0.00 64.86 64.74 2bm8 h ILE 168 Cb 1.25 1.13 -0.06 0.00 -0.74 0.00 0.00 36.82 38.41 2bm8 h ILE 168 CO 0.11 0.40 0.47 -0.03 0.00 0.00 0.00 178.15 179.10 2bm8 h MET 169 N 0.65 0.84 -0.17 2.37 4.05 -0.63 0.54 114.93 122.59 2bm8 h MET 169 Ca 0.11 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.48 2bm8 h MET 169 Cb 0.60 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 31.20 2bm8 h MET 169 CO 0.04 0.56 0.10 -0.22 0.23 0.00 0.00 176.91 177.62 2bm8 h LYS 170 N 0.87 0.23 -1.00 0.39 3.64 -1.09 -1.85 116.57 117.75 2bm8 h LYS 170 Ca 0.35 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.73 2bm8 h LYS 170 Cb 0.18 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.90 2bm8 h LYS 170 CO -0.18 0.18 0.66 2.35 -2.27 0.00 0.00 179.45 180.19 2bm8 h TRP 171 N 0.21 1.24 -0.32 1.91 7.01 -0.74 -2.46 115.95 122.80 2bm8 h TRP 171 Ca 0.06 0.03 -0.13 0.00 2.11 0.00 0.00 58.89 60.96 2bm8 h TRP 171 Cb 0.01 -0.42 -0.01 0.00 -2.10 0.00 0.00 29.16 26.64 2bm8 h TRP 171 CO -0.06 0.76 -0.32 0.00 -2.79 0.00 0.00 178.44 176.03 2bm8 h ALA 172 N 1.38 0.84 -0.29 2.65 0.00 -0.54 -1.21 119.26 122.10 2bm8 h ALA 172 Ca 0.38 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 2bm8 h ALA 172 Cb -0.10 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2bm8 h ALA 172 CO -0.10 0.64 -0.47 0.28 0.00 0.00 0.00 179.25 179.60 2bm8 h VAL 173 N 0.59 1.29 0.00 0.00 2.07 -1.17 0.32 116.25 119.34 2bm8 h VAL 173 Ca 0.07 -1.67 -0.16 0.00 0.82 0.00 0.00 66.70 65.76 2bm8 h VAL 173 Cb 0.83 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 2bm8 h VAL 173 CO 0.07 0.54 -0.80 0.44 0.02 0.00 0.00 177.57 177.84 2bm8 h ASP 174 N 0.61 0.00 0.00 0.57 3.32 -1.23 -3.40 116.42 116.30 2bm8 h ASP 174 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2bm8 h ASP 174 Cb 1.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2bm8 h ASP 174 CO 0.10 0.72 0.00 1.41 -1.72 0.00 0.00 179.24 179.76 2bm8 n HIS 175 N -3.25 0.00 0.07 4.55 8.25 -0.47 -4.97 115.22 119.40 2bm8 n HIS 175 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2bm8 n HIS 175 Cb 0.83 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.94 2bm8 n HIS 175 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2bm8 n LEU 176 N -0.32 0.23 -4.75 2.41 7.94 -0.66 -5.02 117.00 116.83 2bm8 n LEU 176 Ca 0.00 0.22 -0.40 0.00 -1.11 0.00 0.00 56.01 54.73 2bm8 n LEU 176 Cb 0.05 0.06 -0.06 0.00 0.53 0.00 0.00 43.42 44.00 2bm8 n LEU 176 CO 0.00 -0.60 0.68 -0.76 -1.11 0.00 0.00 177.39 175.60 2bm8 s LEU 177 N -6.43 4.60 0.50 -1.96 1.43 0.10 -5.03 118.68 111.89 2bm8 s LEU 177 Ca 0.00 2.00 0.06 0.00 -1.03 0.00 0.00 54.13 55.16 2bm8 s LEU 177 Cb 0.00 -3.66 0.01 0.00 0.03 0.00 0.00 46.19 42.57 2bm8 s LEU 177 CO 0.00 0.07 0.32 -1.61 0.23 0.00 0.00 176.35 175.36 2bm8 s GLU 178 N -1.33 2.28 0.18 1.70 2.02 -1.26 -4.90 118.70 117.39 2bm8 s GLU 178 Ca 0.43 -1.96 -0.33 0.00 0.02 0.00 0.00 54.97 53.13 2bm8 s GLU 178 Cb -0.26 -2.06 -0.14 0.00 0.10 0.00 0.00 34.13 31.77 2bm8 s GLU 178 CO 0.33 -0.44 1.55 -1.91 0.02 0.00 0.00 175.26 174.82 2bm8 n GLU 179 N -1.58 2.17 0.00 1.61 2.13 -1.26 -1.83 120.64 121.88 2bm8 n GLU 179 Ca -0.03 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.57 2bm8 n GLU 179 Cb 0.64 -2.53 0.00 0.00 0.27 0.00 0.00 31.44 29.82 2bm8 n GLU 179 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2bm8 n GLY 180 N 3.16 1.91 3.79 8.31 0.00 -0.72 -4.98 105.19 116.64 2bm8 n GLY 180 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 2bm8 n GLY 180 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bm8 s ASP 181 N -2.99 6.22 -0.04 1.61 1.01 -0.76 -4.74 116.67 116.97 2bm8 s ASP 181 Ca 0.00 2.04 -0.04 0.00 0.71 0.00 0.00 52.55 55.26 2bm8 s ASP 181 Cb 0.00 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 2bm8 s ASP 181 CO 0.00 -0.87 0.18 -0.31 0.21 0.00 0.00 175.17 174.38 2bm8 s TYR 182 N -1.84 3.57 -0.21 4.23 1.51 -0.79 -0.74 117.35 123.08 2bm8 s TYR 182 Ca 0.67 0.43 0.00 0.00 -1.01 0.00 0.00 57.07 57.17 2bm8 s TYR 182 Cb -0.20 -1.88 0.05 0.00 -0.11 0.00 0.00 41.96 39.82 2bm8 s TYR 182 CO 0.24 0.67 -0.06 0.12 -1.11 0.00 0.00 175.55 175.41 2bm8 s PHE 183 N -1.24 2.17 -0.08 2.71 5.36 -0.53 -1.20 117.98 125.16 2bm8 s PHE 183 Ca 0.24 -1.53 0.03 0.00 -0.96 0.00 0.00 56.93 54.71 2bm8 s PHE 183 Cb -0.13 -1.50 -0.02 0.00 -0.34 0.00 0.00 43.02 41.04 2bm8 s PHE 183 CO 0.14 -0.73 -0.18 0.42 -1.46 0.00 0.00 175.22 173.42 2bm8 s ILE 184 N 1.47 2.67 -0.33 3.12 1.01 -0.13 -2.27 121.20 126.74 2bm8 s ILE 184 Ca -0.03 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.80 2bm8 s ILE 184 Cb -0.18 -2.05 0.08 0.00 0.01 0.00 0.00 42.46 40.33 2bm8 s ILE 184 CO -0.07 0.56 0.03 -0.63 0.00 0.00 0.00 174.94 174.83 2bm8 s ILE 185 N -0.09 2.58 0.32 2.92 1.01 -0.66 0.01 121.20 127.29 2bm8 s ILE 185 Ca -0.04 -1.94 -0.28 0.00 0.00 0.00 0.00 60.65 58.40 2bm8 s ILE 185 Cb -0.14 -2.71 -0.09 0.00 0.01 0.00 0.00 42.46 39.53 2bm8 s ILE 185 CO 0.04 -0.39 1.07 -1.61 0.00 0.00 0.00 174.94 174.05 2bm8 s GLU 186 N 1.06 4.49 0.00 2.79 2.02 -0.95 -4.52 118.70 123.59 2bm8 s GLU 186 Ca 0.03 1.69 0.00 0.00 0.02 0.00 0.00 54.97 56.70 2bm8 s GLU 186 Cb -0.20 -2.98 0.00 0.00 0.10 0.00 0.00 34.13 31.05 2bm8 s GLU 186 CO -0.05 0.11 0.00 -0.25 0.02 0.00 0.00 175.26 175.09 2bm8 n ASP 187 N 0.78 0.00 0.19 -0.19 8.00 -0.05 -4.58 116.55 120.71 2bm8 n ASP 187 Ca 0.01 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.62 2bm8 n ASP 187 Cb 0.47 0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.69 2bm8 n ASP 187 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 2bm8 h MET 188 N 0.00 0.00 0.27 -1.24 2.86 -1.87 -3.37 114.93 111.57 2bm8 h MET 188 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2bm8 h MET 188 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 2bm8 h MET 188 CO 0.00 0.03 -0.13 0.82 1.06 0.00 0.00 176.91 178.69 2bm8 h ILE 189 N 0.00 0.75 -1.00 -1.22 2.04 -1.82 -1.49 117.51 114.78 2bm8 h ILE 189 Ca -0.00 -0.10 0.27 0.00 1.00 0.00 0.00 64.86 66.02 2bm8 h ILE 189 Cb 1.03 0.81 -0.13 0.00 -0.74 0.00 0.00 36.82 37.79 2bm8 h ILE 189 CO 0.00 0.02 0.57 -0.65 0.00 0.00 0.00 178.15 178.10 2bm8 h PRO 190 N -0.41 0.48 -0.26 2.37 0.11 -1.82 -1.45 132.00 131.03 2bm8 h PRO 190 Ca -0.04 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.96 2bm8 h PRO 190 Cb 0.31 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 2bm8 h PRO 190 CO 0.06 0.32 -0.15 1.88 -0.21 0.00 0.00 178.00 179.90 2bm8 h TYR 191 N 0.50 0.65 -0.39 0.65 -1.99 -1.60 -2.15 116.97 112.63 2bm8 h TYR 191 Ca 0.66 -0.17 0.01 0.00 2.00 0.00 0.00 58.73 61.24 2bm8 h TYR 191 Cb 1.34 -0.15 -0.02 0.00 2.00 0.00 0.00 36.73 39.90 2bm8 h TYR 191 CO -0.02 0.83 0.26 -1.49 -0.00 0.00 0.00 178.16 177.74 2bm8 h TRP 192 N 0.28 0.46 -0.16 4.88 6.55 -0.48 -0.59 115.95 126.89 2bm8 h TRP 192 Ca 0.05 0.01 -0.19 0.00 0.95 0.00 0.00 58.89 59.72 2bm8 h TRP 192 Cb 0.67 -0.16 0.00 0.00 -0.86 0.00 0.00 29.16 28.82 2bm8 h TRP 192 CO 0.07 0.28 -0.67 -0.92 -1.05 0.00 0.00 178.44 176.15 2bm8 h TYR 193 N 0.49 0.83 -0.11 0.49 3.20 -1.23 -1.15 116.97 119.50 2bm8 h TYR 193 Ca 0.15 -0.34 -0.01 0.00 3.14 0.00 0.00 58.73 61.68 2bm8 h TYR 193 Cb 0.00 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.13 2bm8 h TYR 193 CO -0.00 1.12 0.04 -0.09 -1.64 0.00 0.00 178.16 177.59 2bm8 h ARG 194 N 0.46 0.16 0.00 1.82 2.43 -0.70 -2.78 114.38 115.78 2bm8 h ARG 194 Ca -0.02 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.99 2bm8 h ARG 194 Cb 1.26 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.76 2bm8 h ARG 194 CO 0.13 0.28 -0.88 1.88 -1.51 0.00 0.00 179.97 179.87 2bm8 h TYR 195 N 0.01 0.00 -0.91 2.20 0.99 -1.19 -3.40 116.97 114.66 2bm8 h TYR 195 Ca 0.04 0.00 -0.36 0.00 2.00 0.00 0.00 58.73 60.41 2bm8 h TYR 195 Cb 0.18 0.00 -0.26 0.00 1.00 0.00 0.00 36.73 37.65 2bm8 h TYR 195 CO -0.01 0.54 -0.78 0.00 -0.00 0.00 0.00 178.16 177.91 2bm8 n ALA 196 N -2.29 0.45 -0.11 3.88 0.00 -0.43 -5.02 120.51 116.98 2bm8 n ALA 196 Ca -0.02 -2.34 -0.05 0.00 0.00 0.00 0.00 53.44 51.03 2bm8 n ALA 196 Cb 0.78 -1.07 0.02 0.00 0.00 0.00 0.00 19.45 19.19 2bm8 n ALA 196 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2bm8 h PRO 197 N 3.26 0.11 0.11 0.00 0.13 -1.62 -1.51 132.00 132.49 2bm8 h PRO 197 Ca -0.02 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2bm8 h PRO 197 Cb 1.02 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.13 2bm8 h PRO 197 CO 0.32 0.07 -0.06 0.37 -0.23 0.00 0.00 178.00 178.47 2bm8 h GLN 198 N 0.11 -0.15 -0.34 0.86 4.15 -1.93 -1.92 115.11 115.88 2bm8 h GLN 198 Ca 0.18 0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.53 2bm8 h GLN 198 Cb 0.25 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 2bm8 h GLN 198 CO -0.30 -0.10 -0.12 -0.07 -1.93 0.00 0.00 178.83 176.31 2bm8 h LEU 199 N -0.16 0.69 -0.65 -2.39 3.38 -1.92 -2.39 115.31 111.86 2bm8 h LEU 199 Ca -0.01 -0.38 0.06 0.00 0.09 0.00 0.00 57.88 57.64 2bm8 h LEU 199 Cb 0.13 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.63 2bm8 h LEU 199 CO 0.02 0.92 0.35 0.15 0.09 0.00 0.00 178.44 179.96 2bm8 h PHE 200 N 0.46 0.64 -0.64 1.13 3.57 -1.21 -0.62 116.94 120.26 2bm8 h PHE 200 Ca 0.08 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 2bm8 h PHE 200 Cb 0.63 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 2bm8 h PHE 200 CO 0.05 0.29 0.15 0.77 -2.23 0.00 0.00 178.31 177.35 2bm8 h SER 201 N 0.64 0.98 0.01 0.41 0.02 -1.22 -1.80 113.55 112.59 2bm8 h SER 201 Ca 0.30 -0.24 0.02 0.00 -0.84 0.00 0.00 61.79 61.03 2bm8 h SER 201 Cb 0.21 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 2bm8 h SER 201 CO -0.19 0.96 -0.16 -0.33 -1.14 0.00 0.00 176.83 175.97 2bm8 h GLU 202 N 0.95 -0.26 0.17 3.45 5.08 -1.00 -1.40 114.58 121.58 2bm8 h GLU 202 Ca 0.20 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 2bm8 h GLU 202 Cb 0.37 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2bm8 h GLU 202 CO 0.00 -0.18 -0.08 1.88 -1.00 0.00 0.00 179.01 179.63 2bm8 h TYR 203 N -0.27 -0.22 -0.74 4.33 0.99 -0.87 -1.60 116.97 118.58 2bm8 h TYR 203 Ca 0.05 -0.01 0.11 0.00 2.00 0.00 0.00 58.73 60.88 2bm8 h TYR 203 Cb 0.33 0.07 -0.08 0.00 1.00 0.00 0.00 36.73 38.06 2bm8 h TYR 203 CO -0.21 0.20 0.36 -0.07 -0.00 0.00 0.00 178.16 178.44 2bm8 h LEU 204 N -0.76 0.44 -1.57 3.88 3.38 -1.44 -2.33 115.31 116.92 2bm8 h LEU 204 Ca -0.02 0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2bm8 h LEU 204 Cb 0.51 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2bm8 h LEU 204 CO 0.04 0.23 0.30 1.23 0.09 0.00 0.00 178.44 180.33 2bm8 h GLY 205 N 0.58 0.62 2.00 0.83 0.00 -0.99 -1.17 103.07 104.94 2bm8 h GLY 205 Ca 0.38 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2bm8 h GLY 205 CO -0.31 0.22 0.00 0.00 0.00 0.00 0.00 176.54 176.45 2bm8 h ALA 206 N 1.72 1.00 -0.51 3.60 0.00 -0.71 -2.06 119.26 122.30 2bm8 h ALA 206 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2bm8 h ALA 206 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2bm8 h ALA 206 CO -0.04 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.40 2bm8 n PHE 207 N -2.85 0.99 0.18 0.00 3.01 -0.44 -4.63 117.46 113.73 2bm8 n PHE 207 Ca -0.02 -0.42 0.06 0.00 1.01 0.00 0.00 57.45 58.08 2bm8 n PHE 207 Cb 0.10 -0.13 0.56 0.00 -0.01 0.00 0.00 39.48 39.99 2bm8 n PHE 207 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 2bm8 h ARG 208 N 3.12 0.14 0.00 -1.08 0.11 -1.47 -0.66 114.38 114.54 2bm8 h ARG 208 Ca 0.00 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2bm8 h ARG 208 Cb 1.01 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.06 2bm8 h ARG 208 CO 0.12 0.13 -0.04 -0.25 0.10 0.00 0.00 179.97 180.03 2bm8 n ASP 209 N -4.48 0.33 0.00 0.08 8.00 -1.26 -4.33 116.55 114.88 2bm8 n ASP 209 Ca -0.01 0.49 0.00 0.00 0.71 0.00 0.00 54.79 55.97 2bm8 n ASP 209 Cb 0.11 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 2bm8 n ASP 209 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2bm8 n VAL 210 N -1.79 0.00 -4.35 2.53 0.24 -0.87 -4.74 118.33 109.35 2bm8 n VAL 210 Ca 0.06 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.15 2bm8 n VAL 210 Cb 0.37 -0.33 -0.13 0.00 -1.47 0.00 0.00 33.84 32.28 2bm8 n VAL 210 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2bm8 s LEU 211 N -3.10 2.21 0.12 1.34 1.43 -0.31 -2.08 118.68 118.29 2bm8 s LEU 211 Ca 0.00 -0.52 0.06 0.00 -1.03 0.00 0.00 54.13 52.64 2bm8 s LEU 211 Cb 0.00 -0.67 -0.04 0.00 0.03 0.00 0.00 46.19 45.51 2bm8 s LEU 211 CO 0.00 0.03 -0.15 -0.94 0.23 0.00 0.00 176.35 175.52 2bm8 s SER 212 N -1.35 2.09 -0.27 2.29 1.04 -0.62 -4.50 113.70 112.38 2bm8 s SER 212 Ca 0.02 -0.79 -0.25 0.00 0.48 0.00 0.00 55.95 55.41 2bm8 s SER 212 Cb -0.09 -0.08 -0.00 0.00 0.10 0.00 0.00 66.02 65.95 2bm8 s SER 212 CO 0.02 -0.11 0.84 -0.32 0.98 0.00 0.00 173.24 174.65 2bm8 s MET 213 N -2.56 4.09 -0.47 4.02 1.75 -1.26 -1.17 119.30 123.70 2bm8 s MET 213 Ca 0.09 0.83 -0.29 0.00 -1.25 0.00 0.00 55.69 55.07 2bm8 s MET 213 Cb -0.06 -3.69 0.02 0.00 2.84 0.00 0.00 34.83 33.94 2bm8 s MET 213 CO 0.03 -0.62 1.34 0.34 -0.65 0.00 0.00 175.02 175.47 2bm8 s ASP 214 N 1.47 6.36 0.00 1.11 -1.08 -0.39 -4.90 116.67 119.24 2bm8 s ASP 214 Ca 0.35 0.58 0.26 0.00 -0.52 0.00 0.00 52.55 53.23 2bm8 s ASP 214 Cb -0.15 -2.54 1.23 0.00 -1.46 0.00 0.00 42.92 40.00 2bm8 s ASP 214 CO 0.10 -1.46 1.87 0.23 0.52 0.00 0.00 175.17 176.43 2bm8 n MET 215 N 8.18 0.19 0.10 4.34 2.81 -1.26 -1.44 117.12 130.05 2bm8 n MET 215 Ca 0.14 0.04 -0.04 0.00 -1.81 0.00 0.00 57.70 56.04 2bm8 n MET 215 Cb 0.49 -1.50 0.15 0.00 -0.71 0.00 0.00 33.22 31.64 2bm8 n MET 215 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2bm8 h LEU 216 N 0.00 0.19 0.00 4.03 5.85 -1.98 -3.38 115.31 120.01 2bm8 h LEU 216 Ca 0.00 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.57 2bm8 h LEU 216 Cb 0.35 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2bm8 h LEU 216 CO 0.00 0.74 -1.30 -1.22 -0.34 0.00 0.00 178.44 176.31 2bm8 n TYR 217 N -3.87 0.00 0.31 1.25 0.53 -1.09 -4.75 117.16 109.54 2bm8 n TYR 217 Ca -0.02 0.00 0.17 0.00 -1.02 0.00 0.00 57.90 57.03 2bm8 n TYR 217 Cb 0.61 -0.19 0.75 0.00 -1.03 0.00 0.00 39.34 39.48 2bm8 n TYR 217 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2bm8 h ALA 218 N 0.38 1.00 -0.33 -0.72 0.00 -1.43 -2.10 119.26 116.05 2bm8 h ALA 218 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2bm8 h ALA 218 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2bm8 h ALA 218 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 2bm8 n ASN 219 N -2.88 3.36 -0.09 0.00 3.02 -1.26 -0.72 115.26 116.69 2bm8 n ASN 219 Ca 0.00 -2.37 0.11 0.00 -0.03 0.00 0.00 54.58 52.29 2bm8 n ASN 219 Cb 0.23 -0.36 0.07 0.00 -0.61 0.00 0.00 39.78 39.11 2bm8 n ASN 219 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bm8 n ALA 220 N 0.20 4.03 -3.21 5.41 0.00 -0.79 -4.92 120.51 121.23 2bm8 n ALA 220 Ca 0.16 -0.50 -0.13 0.00 0.00 0.00 0.00 53.44 52.96 2bm8 n ALA 220 Cb 0.61 -0.93 -0.06 0.00 0.00 0.00 0.00 19.45 19.07 2bm8 n ALA 220 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2bm8 s SER 221 N -2.88 -0.34 0.23 0.00 1.04 -1.26 -4.84 113.70 105.65 2bm8 s SER 221 Ca 0.12 0.06 0.08 0.00 0.48 0.00 0.00 55.95 56.69 2bm8 s SER 221 Cb 0.17 0.45 0.21 0.00 0.10 0.00 0.00 66.02 66.95 2bm8 s SER 221 CO 0.74 -0.68 1.53 0.77 0.98 0.00 0.00 173.24 176.57 2bm8 h SER 222 N 2.93 0.10 0.26 7.02 4.64 -1.95 -1.10 113.55 125.45 2bm8 h SER 222 Ca -0.31 -0.07 -0.17 0.00 -0.47 0.00 0.00 61.79 60.77 2bm8 h SER 222 Cb 1.21 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2bm8 h SER 222 CO 0.43 0.76 -0.69 1.56 -0.87 0.00 0.00 176.83 178.02 2bm8 h GLN 223 N 0.05 0.38 -0.00 4.77 4.20 -1.97 -3.17 115.11 119.37 2bm8 h GLN 223 Ca -0.01 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.40 2bm8 h GLN 223 Cb 1.23 0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.07 2bm8 h GLN 223 CO 0.10 0.93 -0.51 1.28 -0.67 0.00 0.00 178.83 179.96 2bm8 n LEU 224 N -3.85 0.69 -2.80 1.46 4.77 -1.18 -0.87 117.00 115.22 2bm8 n LEU 224 Ca -0.04 -0.12 -0.40 0.00 -0.03 0.00 0.00 56.01 55.42 2bm8 n LEU 224 Cb 0.68 -0.19 -0.07 0.00 -2.33 0.00 0.00 43.42 41.51 2bm8 n LEU 224 CO 0.47 0.16 0.90 -0.67 -1.33 0.00 0.00 177.39 176.92 2bm8 n ASP 225 N -1.30 0.61 -2.19 -1.43 2.03 -0.42 -1.02 116.55 112.82 2bm8 n ASP 225 Ca 0.07 0.58 -0.18 0.00 0.52 0.00 0.00 54.79 55.77 2bm8 n ASP 225 Cb 0.34 -0.55 -0.03 0.00 -0.72 0.00 0.00 41.12 40.16 2bm8 n ASP 225 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2bm8 n ARG 226 N 3.61 -1.74 0.00 -0.67 1.74 0.10 -4.61 116.66 115.10 2bm8 n ARG 226 Ca 0.27 0.93 0.00 0.00 -0.77 0.00 0.00 57.85 58.28 2bm8 n ARG 226 Cb -0.03 -5.50 0.00 0.00 -1.02 0.00 0.00 32.46 25.91 2bm8 n ARG 226 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bm8 n GLY 227 N -0.80 -0.57 3.44 -0.13 0.00 -0.19 -4.93 105.19 102.03 2bm8 n GLY 227 Ca -0.21 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.38 2bm8 n GLY 227 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bm8 s VAL 228 N -0.29 4.74 0.20 1.61 1.01 -1.25 -1.66 120.40 124.76 2bm8 s VAL 228 Ca 0.00 -0.46 0.08 0.00 0.00 0.00 0.00 61.98 61.60 2bm8 s VAL 228 Cb 0.00 -4.41 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 2bm8 s VAL 228 CO 0.00 -0.97 0.02 -0.76 0.00 0.00 0.00 175.10 173.39 2bm8 s LEU 229 N 2.97 3.35 0.05 3.92 1.43 -0.96 -1.26 118.68 128.19 2bm8 s LEU 229 Ca 0.17 -0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 52.76 2bm8 s LEU 229 Cb -0.19 -1.97 0.00 0.00 0.03 0.00 0.00 46.19 44.06 2bm8 s LEU 229 CO 0.12 0.06 0.19 0.00 0.23 0.00 0.00 176.35 176.95 2bm8 s ARG 230 N -3.16 0.73 0.09 1.70 1.70 -0.31 -1.45 118.95 118.24 2bm8 s ARG 230 Ca 0.29 -0.72 -0.30 0.00 -0.47 0.00 0.00 55.73 54.53 2bm8 s ARG 230 Cb -0.09 0.30 -0.06 0.00 -0.57 0.00 0.00 34.95 34.53 2bm8 s ARG 230 CO 0.20 -0.22 1.18 0.50 -1.08 0.00 0.00 175.30 175.88 2bm8 s ARG 231 N -2.90 4.47 0.47 3.89 6.06 0.08 -1.58 118.95 129.43 2bm8 s ARG 231 Ca -0.02 1.77 0.08 0.00 -2.50 0.00 0.00 55.73 55.05 2bm8 s ARG 231 Cb 0.00 -3.32 0.01 0.00 0.06 0.00 0.00 34.95 31.70 2bm8 s ARG 231 CO -0.06 -0.18 0.49 0.08 -2.50 0.00 0.00 175.30 173.13 2bm8 s VAL 232 N 0.71 2.46 0.00 7.11 1.01 -0.88 -1.76 120.40 129.05 2bm8 s VAL 232 Ca 0.56 -1.25 0.00 0.00 0.00 0.00 0.00 61.98 61.30 2bm8 s VAL 232 Cb -0.30 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.37 2bm8 s VAL 232 CO 0.31 0.00 0.00 0.00 0.00 0.00 0.00 175.10 175.41 2bm8 n ALA 233 N -1.76 0.00 0.00 5.51 0.00 -1.26 -4.76 120.51 118.24 2bm8 n ALA 233 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2bm8 n ALA 233 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 2bm8 n ALA 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50