#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bm8 h ASP 3 N 0.00 0.27 -0.13 6.41 3.58 -2.05 -3.06 116.42 121.44 2bm8 h ASP 3 Ca 0.00 -0.17 0.04 0.00 0.42 0.00 0.00 57.03 57.32 2bm8 h ASP 3 Cb 0.00 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 2bm8 h ASP 3 CO 0.00 0.86 0.19 0.10 -2.88 0.00 0.00 179.24 177.51 2bm8 h TYR 4 N 0.16 0.00 -0.80 0.28 -0.00 -2.06 -3.25 116.97 111.31 2bm8 h TYR 4 Ca -0.01 0.00 0.03 0.00 0.00 0.00 0.00 58.73 58.75 2bm8 h TYR 4 Cb 1.20 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.88 2bm8 h TYR 4 CO 0.02 0.00 0.51 0.77 -0.00 0.00 0.00 178.16 179.46 2bm8 h SER 5 N 0.00 0.85 -0.59 0.10 0.02 -2.05 -3.10 113.55 108.78 2bm8 h SER 5 Ca 0.06 -0.00 -0.42 0.00 -0.84 0.00 0.00 61.79 60.59 2bm8 h SER 5 Cb 0.45 -0.19 -0.38 0.00 0.14 0.00 0.00 62.40 62.42 2bm8 h SER 5 CO -0.00 0.58 -0.86 0.54 -1.14 0.00 0.00 176.83 175.95 2bm8 n ARG 6 N -4.59 2.92 -3.58 3.45 1.74 -1.23 -5.03 116.66 110.33 2bm8 n ARG 6 Ca 0.09 -3.88 -0.37 0.00 -0.77 0.00 0.00 57.85 52.92 2bm8 n ARG 6 Cb 0.08 -2.01 -0.07 0.00 -1.02 0.00 0.00 32.46 29.45 2bm8 n ARG 6 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2bm8 s GLN 7 N -3.50 4.05 -0.39 5.56 2.00 -1.17 -5.06 119.66 121.15 2bm8 s GLN 7 Ca 0.44 0.13 -0.22 0.00 -2.00 0.00 0.00 55.36 53.71 2bm8 s GLN 7 Cb 0.39 -3.34 0.01 0.00 0.80 0.00 0.00 33.01 30.86 2bm8 s GLN 7 CO 0.01 0.42 0.74 1.21 -0.50 0.00 0.00 175.29 177.16 2bm8 s ASN 8 N -0.10 6.47 -0.55 6.67 3.84 -1.26 -5.03 114.94 124.99 2bm8 s ASN 8 Ca 0.18 0.15 -0.18 0.00 0.21 0.00 0.00 52.86 53.22 2bm8 s ASN 8 Cb -0.14 -2.37 0.09 0.00 -0.55 0.00 0.00 41.25 38.29 2bm8 s ASN 8 CO 0.06 -0.74 0.61 -0.36 -2.79 0.00 0.00 177.10 173.88 2bm8 s PHE 9 N 3.02 3.09 0.73 0.43 0.40 -1.26 -5.05 117.98 119.35 2bm8 s PHE 9 Ca 0.29 -0.93 -0.15 0.00 -0.60 0.00 0.00 56.93 55.54 2bm8 s PHE 9 Cb -0.13 -3.76 0.04 0.00 0.51 0.00 0.00 43.02 39.68 2bm8 s PHE 9 CO 0.18 -1.12 1.21 -0.65 0.70 0.00 0.00 175.22 175.53 2bm8 s GLN 10 N 2.32 2.14 -0.18 0.44 -0.21 -1.26 -4.97 119.66 117.94 2bm8 s GLN 10 Ca 0.10 1.76 -0.26 0.00 0.02 0.00 0.00 55.36 56.97 2bm8 s GLN 10 Cb -0.24 -1.83 -0.01 0.00 1.00 0.00 0.00 33.01 31.93 2bm8 s GLN 10 CO 0.07 -1.84 0.88 0.34 -2.12 0.00 0.00 175.29 172.62 2bm8 s ASP 11 N -2.04 6.98 0.04 5.90 2.15 -1.26 -4.93 116.67 123.51 2bm8 s ASP 11 Ca 0.74 1.22 0.27 0.00 0.43 0.00 0.00 52.55 55.21 2bm8 s ASP 11 Cb -0.29 -2.47 0.91 0.00 -0.30 0.00 0.00 42.92 40.77 2bm8 s ASP 11 CO 0.45 -0.46 1.72 0.18 -0.17 0.00 0.00 175.17 176.89 2bm8 n LEU 12 N 5.50 0.30 0.22 -1.34 4.32 -1.26 -3.36 117.00 121.39 2bm8 n LEU 12 Ca 0.06 0.36 0.10 0.00 -0.02 0.00 0.00 56.01 56.51 2bm8 n LEU 12 Cb 0.48 -0.38 0.45 0.00 -1.62 0.00 0.00 43.42 42.35 2bm8 n LEU 12 CO 0.49 0.00 0.80 0.78 -1.22 0.00 0.00 177.39 178.24 2bm8 h ASN 13 N 0.00 0.00 -0.28 -1.43 2.35 -2.01 -2.71 115.58 111.51 2bm8 h ASN 13 Ca 0.00 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 2bm8 h ASN 13 Cb 0.55 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 2bm8 h ASN 13 CO 0.00 0.22 0.19 -0.07 -1.65 0.00 0.00 177.43 176.12 2bm8 h LEU 14 N 0.00 0.22 -0.69 1.61 4.07 -1.99 -2.80 115.31 115.74 2bm8 h LEU 14 Ca -0.00 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 2bm8 h LEU 14 Cb 0.76 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.45 2bm8 h LEU 14 CO 0.03 0.15 0.00 0.49 -1.08 0.00 0.00 178.44 178.03 2bm8 n PHE 15 N -4.49 0.02 -1.66 1.13 0.99 -1.02 -4.85 117.46 107.59 2bm8 n PHE 15 Ca 0.02 -0.01 -0.45 0.00 -0.00 0.00 0.00 57.45 57.01 2bm8 n PHE 15 Cb 0.17 0.00 -0.04 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 -0.16 2.44 -1.31 -1.08 0.63 -1.06 -1.31 116.66 114.82 2bm8 n ARG 16 Ca 0.20 0.88 -0.11 0.00 -0.92 0.00 0.00 57.85 57.90 2bm8 n ARG 16 Cb 0.28 -2.87 -0.05 0.00 0.45 0.00 0.00 32.46 30.27 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 4.68 1.13 0.00 5.14 0.00 -1.26 -4.80 105.19 110.08 2bm8 n GLY 17 Ca 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.21 0.96 0.00 0.99 4.77 -0.42 -5.11 117.00 116.97 2bm8 n LEU 18 Ca -0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 2bm8 n LEU 18 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 2bm8 n LEU 18 CO 0.16 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2bm8 n GLY 19 N 2.14 -3.10 0.15 -0.72 0.00 -0.49 -4.79 105.19 98.38 2bm8 n GLY 19 Ca 0.00 -1.87 -0.24 0.00 0.00 0.00 0.00 46.02 43.91 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 0.49 -5.10 1.61 5.08 -1.97 -3.41 114.58 111.28 2bm8 h GLU 20 Ca 0.00 -0.84 -0.67 0.00 -1.00 0.00 0.00 59.36 56.85 2bm8 h GLU 20 Cb 0.00 0.31 -0.33 0.00 0.50 0.00 0.00 28.75 29.24 2bm8 h GLU 20 CO 0.00 1.40 -0.83 0.34 -1.00 0.00 0.00 179.01 178.93 2bm8 s ASP 21 N -7.49 3.44 0.58 1.42 -1.08 -1.26 -4.99 116.67 107.28 2bm8 s ASP 21 Ca -0.12 -0.56 0.36 0.00 -0.52 0.00 0.00 52.55 51.71 2bm8 s ASP 21 Cb 0.05 -1.54 1.66 0.00 -1.46 0.00 0.00 42.92 41.62 2bm8 s ASP 21 CO 0.91 0.03 2.10 1.55 0.52 0.00 0.00 175.17 180.28 2bm8 h PRO 22 N 7.75 0.00 -7.05 4.34 0.13 -1.90 -3.44 132.00 131.83 2bm8 h PRO 22 Ca -0.40 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.28 2bm8 h PRO 22 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2bm8 h PRO 22 CO 0.61 0.03 0.35 0.00 -0.23 0.00 0.00 178.00 178.75 2bm8 s ALA 23 N -3.86 3.01 0.16 -0.56 0.00 -1.26 -4.48 121.76 114.78 2bm8 s ALA 23 Ca -0.01 0.46 -0.25 0.00 0.00 0.00 0.00 51.96 52.15 2bm8 s ALA 23 Cb 0.11 -3.18 -0.08 0.00 0.00 0.00 0.00 23.12 19.97 2bm8 s ALA 23 CO 0.52 0.03 0.78 -0.47 0.00 0.00 0.00 175.76 176.62 2bm8 s TYR 24 N -2.10 3.90 -0.02 0.00 5.04 -1.26 -4.89 117.35 118.03 2bm8 s TYR 24 Ca 0.62 1.63 0.01 0.00 -2.44 0.00 0.00 57.07 56.89 2bm8 s TYR 24 Cb -0.11 -2.77 0.01 0.00 0.35 0.00 0.00 41.96 39.44 2bm8 s TYR 24 CO 0.15 0.51 -0.01 -1.01 -1.34 0.00 0.00 175.55 173.85 2bm8 s HIS 25 N -1.10 0.25 0.72 4.97 3.76 -1.26 -5.01 115.29 117.62 2bm8 s HIS 25 Ca 0.36 -0.01 -0.16 0.00 -0.15 0.00 0.00 55.06 55.10 2bm8 s HIS 25 Cb -0.23 -0.28 0.03 0.00 1.11 0.00 0.00 32.58 33.21 2bm8 s HIS 25 CO 0.26 -0.07 1.20 -2.30 -0.85 0.00 0.00 174.74 172.99 2bm8 n PRO 26 N 3.65 0.65 -1.75 8.40 -0.02 -1.26 -4.94 135.00 139.74 2bm8 n PRO 26 Ca -0.21 0.29 -0.35 0.00 -2.02 0.00 0.00 63.50 61.21 2bm8 n PRO 26 Cb 0.54 -2.44 0.06 0.00 -0.02 0.00 0.00 33.50 31.64 2bm8 n PRO 26 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2bm8 s PRO 27 N -3.65 2.61 -0.21 0.52 0.04 -1.26 -5.00 135.00 128.04 2bm8 s PRO 27 Ca 0.78 1.81 -0.03 0.00 0.04 0.00 0.00 61.00 63.60 2bm8 s PRO 27 Cb -0.34 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.32 2bm8 s PRO 27 CO 0.46 -1.49 -0.08 0.08 0.04 0.00 0.00 177.00 176.01 2bm8 s VAL 28 N -1.75 3.02 0.63 -0.36 1.01 -1.26 -5.10 120.40 116.59 2bm8 s VAL 28 Ca 0.76 -0.65 -0.16 0.00 0.00 0.00 0.00 61.98 61.93 2bm8 s VAL 28 Cb -0.30 -2.37 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 2bm8 s VAL 28 CO 0.39 0.43 1.12 -0.76 0.00 0.00 0.00 175.10 176.27 2bm8 s LEU 29 N 1.42 3.49 0.03 3.92 1.02 -1.26 -4.77 118.68 122.52 2bm8 s LEU 29 Ca 0.05 2.05 0.00 0.00 0.02 0.00 0.00 54.13 56.25 2bm8 s LEU 29 Cb -0.14 -4.56 0.00 0.00 0.02 0.00 0.00 46.19 41.51 2bm8 s LEU 29 CO -0.06 -1.51 0.00 0.41 0.02 0.00 0.00 176.35 175.21 2bm8 n THR 30 N -2.10 0.03 -0.02 5.49 -1.04 -1.26 -4.91 114.28 110.46 2bm8 n THR 30 Ca 0.11 0.01 0.05 0.00 -2.04 0.00 0.00 64.05 62.18 2bm8 n THR 30 Cb 0.52 -0.72 0.12 0.00 -1.82 0.00 0.00 70.33 68.42 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 -2.70 2.61 -3.92 8.00 5.75 -1.26 -4.99 116.55 120.04 2bm8 n ASP 31 Ca 0.00 -1.86 -0.09 0.00 -0.01 0.00 0.00 54.79 52.83 2bm8 n ASP 31 Cb 0.10 -0.16 -0.07 0.00 -1.03 0.00 0.00 41.12 39.96 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 -0.96 1.13 0.66 0.11 1.04 -1.26 -5.12 118.95 114.54 2bm8 s ARG 32 Ca 0.19 -1.11 -0.13 0.00 -1.04 0.00 0.00 55.73 53.65 2bm8 s ARG 32 Cb 0.10 0.39 -0.01 0.00 -2.04 0.00 0.00 34.95 33.39 2bm8 s ARG 32 CO 0.14 -0.41 1.06 -1.25 -0.04 0.00 0.00 175.30 174.80 2bm8 s PRO 33 N -3.94 3.09 0.16 3.89 0.04 -1.26 -4.93 135.00 132.04 2bm8 s PRO 33 Ca 0.14 1.04 -0.02 0.00 0.04 0.00 0.00 61.00 62.21 2bm8 s PRO 33 Cb 0.03 -2.01 -0.01 0.00 0.04 0.00 0.00 34.50 32.55 2bm8 s PRO 33 CO -0.02 -0.98 1.38 -0.09 0.04 0.00 0.00 177.00 177.32 2bm8 h ARG 34 N -0.28 0.38 -4.16 4.56 2.43 -2.01 -3.40 114.38 111.90 2bm8 h ARG 34 Ca -0.45 -0.36 -0.75 0.00 -0.81 0.00 0.00 59.98 57.61 2bm8 h ARG 34 Cb 1.21 0.09 -0.27 0.00 -0.42 0.00 0.00 29.97 30.59 2bm8 h ARG 34 CO 0.57 1.02 -0.29 -0.51 -1.51 0.00 0.00 179.97 179.26 2bm8 s ASP 35 N -7.01 5.98 -0.03 -3.80 1.01 -1.26 -5.06 116.67 106.49 2bm8 s ASP 35 Ca -0.05 -1.90 -0.26 0.00 0.71 0.00 0.00 52.55 51.05 2bm8 s ASP 35 Cb 0.10 -2.12 -0.03 0.00 1.01 0.00 0.00 42.92 41.88 2bm8 s ASP 35 CO 0.85 -0.77 0.82 0.86 0.21 0.00 0.00 175.17 177.14 2bm8 s TRP 36 N 1.41 3.62 0.24 4.23 -0.11 -1.26 -5.03 118.94 122.04 2bm8 s TRP 36 Ca 0.05 1.44 -0.30 0.00 1.22 0.00 0.00 56.10 58.51 2bm8 s TRP 36 Cb -0.27 -2.93 -0.09 0.00 -1.50 0.00 0.00 33.47 28.67 2bm8 s TRP 36 CO 0.01 0.06 1.35 -1.25 -4.62 0.00 0.00 176.95 172.49 2bm8 s PRO 37 N 0.84 4.35 0.37 5.86 0.04 -1.26 -4.93 135.00 140.26 2bm8 s PRO 37 Ca 0.43 2.16 0.16 0.00 0.04 0.00 0.00 61.00 63.80 2bm8 s PRO 37 Cb -0.19 -3.15 0.70 0.00 0.04 0.00 0.00 34.50 31.90 2bm8 s PRO 37 CO 0.22 -0.29 1.76 -0.07 0.04 0.00 0.00 177.00 178.67 2bm8 h LEU 38 N 4.94 0.00 -2.31 -3.56 4.07 -1.98 -2.20 115.31 114.27 2bm8 h LEU 38 Ca -0.46 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.50 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 0.76 0.40 -0.03 -2.24 -1.08 0.00 0.00 178.44 176.24 2bm8 h ASP 39 N 0.00 0.00 -0.24 -0.43 2.03 -2.05 -2.34 116.42 113.39 2bm8 h ASP 39 Ca -0.00 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.18 2bm8 h ASP 39 Cb 0.82 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 39.26 2bm8 h ASP 39 CO 0.05 0.03 -0.18 0.54 -1.03 0.00 0.00 179.24 178.65 2bm8 n ARG 40 N -3.33 1.81 -0.31 4.15 5.12 -0.84 -4.84 116.66 118.41 2bm8 n ARG 40 Ca -0.02 -3.18 -0.04 0.00 -1.93 0.00 0.00 57.85 52.69 2bm8 n ARG 40 Cb 0.17 -1.75 0.08 0.00 -1.16 0.00 0.00 32.46 29.80 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 1.00 1.10 0.00 -1.55 7.01 -1.31 -1.98 115.95 120.22 2bm8 h TRP 41 Ca 0.14 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.13 2bm8 h TRP 41 Cb 1.45 -0.37 -0.00 0.00 -2.10 0.00 0.00 29.16 28.14 2bm8 h TRP 41 CO 0.89 0.72 -0.11 0.00 -2.79 0.00 0.00 178.44 177.15 2bm8 h ALA 42 N 1.29 1.42 -0.00 2.65 0.00 -1.88 -2.49 119.26 120.25 2bm8 h ALA 42 Ca 0.31 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2bm8 h ALA 42 Cb -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2bm8 h ALA 42 CO -0.06 0.13 -0.09 0.39 0.00 0.00 0.00 179.25 179.62 2bm8 n GLU 43 N -3.82 0.78 -2.17 0.00 1.02 -0.75 -4.93 120.64 110.77 2bm8 n GLU 43 Ca -0.02 -0.27 -0.40 0.00 -0.02 0.00 0.00 57.16 56.45 2bm8 n GLU 43 Cb 0.21 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.11 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 -2.40 3.41 0.74 0.62 0.00 -0.94 -4.98 121.76 118.21 2bm8 s ALA 44 Ca 0.31 1.17 -0.14 0.00 0.00 0.00 0.00 51.96 53.31 2bm8 s ALA 44 Cb 0.20 -3.45 0.04 0.00 0.00 0.00 0.00 23.12 19.92 2bm8 s ALA 44 CO 0.46 -0.59 1.15 -1.25 0.00 0.00 0.00 175.76 175.53 2bm8 s PRO 45 N -1.87 2.19 -0.05 0.00 0.04 -1.26 -4.98 135.00 129.07 2bm8 s PRO 45 Ca 0.50 1.54 0.12 0.00 0.04 0.00 0.00 61.00 63.21 2bm8 s PRO 45 Cb -0.37 -1.86 -0.19 0.00 0.04 0.00 0.00 34.50 32.12 2bm8 s PRO 45 CO 0.49 -1.75 0.21 -2.13 0.04 0.00 0.00 177.00 173.87 2bm8 n ARG 46 N -2.94 0.89 -1.30 4.56 3.00 -1.26 -5.00 116.66 114.61 2bm8 n ARG 46 Ca 0.12 -0.09 -0.29 0.00 -0.00 0.00 0.00 57.85 57.59 2bm8 n ARG 46 Cb 0.51 -1.31 0.14 0.00 0.00 0.00 0.00 32.46 31.80 2bm8 n ARG 46 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.63 177.79 2bm8 s ASP 47 N -3.82 3.41 0.20 6.15 3.84 -1.26 -4.96 116.67 120.23 2bm8 s ASP 47 Ca -0.05 1.30 -0.11 0.00 -0.00 0.00 0.00 52.55 53.69 2bm8 s ASP 47 Cb 0.07 -1.97 0.22 0.00 -1.38 0.00 0.00 42.92 39.85 2bm8 s ASP 47 CO 0.53 -2.65 1.75 0.25 -0.00 0.00 0.00 175.17 175.05 2bm8 h LEU 48 N -1.56 0.23 0.00 2.11 5.85 -2.02 -3.46 115.31 116.46 2bm8 h LEU 48 Ca -0.51 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2bm8 h LEU 48 Cb 1.30 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.37 2bm8 h LEU 48 CO 0.57 0.15 0.00 0.61 -0.34 0.00 0.00 178.44 179.43 2bm8 n GLY 49 N -1.28 0.46 3.58 3.75 0.00 -1.26 -5.05 105.19 105.39 2bm8 n GLY 49 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.00 0.81 0.35 1.61 -0.85 -1.26 -4.36 117.35 111.65 2bm8 s TYR 50 Ca 0.00 -1.17 -0.27 0.00 -0.52 0.00 0.00 57.07 55.11 2bm8 s TYR 50 Cb 0.00 0.18 -0.09 0.00 0.38 0.00 0.00 41.96 42.43 2bm8 s TYR 50 CO 0.00 -1.27 1.16 0.45 -1.52 0.00 0.00 175.55 174.37 2bm8 s SER 51 N -3.20 6.81 -0.34 -0.18 0.15 -1.26 -4.95 113.70 110.74 2bm8 s SER 51 Ca 0.26 2.35 0.09 0.00 0.70 0.00 0.00 55.95 59.36 2bm8 s SER 51 Cb -0.02 -2.62 0.72 0.00 -1.71 0.00 0.00 66.02 62.39 2bm8 s SER 51 CO 0.18 -0.47 1.80 -0.90 1.20 0.00 0.00 173.24 175.05 2bm8 n ASP 52 N 0.52 4.54 0.24 5.45 5.75 -1.26 -4.74 116.55 127.05 2bm8 n ASP 52 Ca 0.02 -3.31 -0.11 0.00 -0.01 0.00 0.00 54.79 51.38 2bm8 n ASP 52 Cb 0.45 -0.75 -0.06 0.00 -1.03 0.00 0.00 41.12 39.74 2bm8 n ASP 52 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 2bm8 h PHE 53 N 2.31 -0.76 -0.99 2.11 -0.00 -2.05 -3.40 116.94 114.15 2bm8 h PHE 53 Ca 0.32 -0.01 -0.20 0.00 -0.00 0.00 0.00 57.97 58.08 2bm8 h PHE 53 Cb 2.37 0.27 -0.18 0.00 -0.00 0.00 0.00 35.95 38.42 2bm8 h PHE 53 CO 1.31 -0.41 -0.54 0.45 -0.00 0.00 0.00 178.31 179.11 2bm8 n SER 54 N -4.09 -3.09 -1.23 0.41 2.88 -1.26 -5.02 113.62 102.21 2bm8 n SER 54 Ca -0.08 -2.92 0.11 0.00 -1.33 0.00 0.00 58.87 54.64 2bm8 n SER 54 Cb 0.28 1.54 0.28 0.00 -0.75 0.00 0.00 64.21 65.57 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 2.73 2.66 -3.20 -1.46 -0.04 -1.26 -4.96 135.00 129.47 2bm8 n PRO 55 Ca 0.18 -2.50 -0.31 0.00 -0.04 0.00 0.00 63.50 60.82 2bm8 n PRO 55 Cb 0.56 -1.52 -0.05 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.11 3.42 0.10 0.54 1.51 -1.26 -4.95 117.35 115.59 2bm8 s TYR 56 Ca 0.44 1.01 0.01 0.00 -1.01 0.00 0.00 57.07 57.51 2bm8 s TYR 56 Cb 0.23 -2.38 -0.04 0.00 -0.11 0.00 0.00 41.96 39.66 2bm8 s TYR 56 CO 0.31 0.13 -0.04 1.14 -1.11 0.00 0.00 175.55 175.98 2bm8 s GLN 57 N -3.14 0.83 -0.18 -0.62 -2.07 -1.26 -1.97 119.66 111.25 2bm8 s GLN 57 Ca 0.50 -1.34 -0.03 0.00 -1.82 0.00 0.00 55.36 52.67 2bm8 s GLN 57 Cb -0.11 -0.07 0.06 0.00 -1.09 0.00 0.00 33.01 31.80 2bm8 s GLN 57 CO 0.22 -0.08 0.05 -0.46 -1.32 0.00 0.00 175.29 173.70 2bm8 s TRP 58 N -3.74 0.78 -1.33 9.60 -0.11 0.76 -4.81 118.94 120.09 2bm8 s TRP 58 Ca 0.13 -0.65 -0.01 0.00 1.22 0.00 0.00 56.10 56.79 2bm8 s TRP 58 Cb 0.06 -0.92 0.00 0.00 -1.50 0.00 0.00 33.47 31.12 2bm8 s TRP 58 CO -0.04 -0.56 0.68 0.54 -4.62 0.00 0.00 176.95 172.95 2bm8 n ARG 59 N 5.12 -4.78 -1.00 5.86 1.74 -1.26 -1.49 116.66 120.84 2bm8 n ARG 59 Ca -0.08 0.60 -0.00 0.00 -0.77 0.00 0.00 57.85 57.59 2bm8 n ARG 59 Cb 0.48 -5.13 -0.00 0.00 -1.02 0.00 0.00 32.46 26.79 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 -1.62 0.33 3.57 -0.13 0.00 -1.26 -5.01 105.19 101.06 2bm8 n GLY 60 Ca -0.29 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 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 3.05 0.59 0.99 1.43 -0.56 -4.42 118.68 119.76 2bm8 s LEU 61 Ca 0.00 -0.23 -0.19 0.00 -1.03 0.00 0.00 54.13 52.68 2bm8 s LEU 61 Cb 0.00 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 2bm8 s LEU 61 CO 0.00 0.26 1.21 -0.13 0.23 0.00 0.00 176.35 177.92 2bm8 s ARG 62 N -1.55 3.00 -0.19 1.70 0.52 -1.26 -0.17 118.95 121.00 2bm8 s ARG 62 Ca 0.17 1.85 -0.02 0.00 -0.52 0.00 0.00 55.73 57.21 2bm8 s ARG 62 Cb -0.11 -1.96 0.06 0.00 0.52 0.00 0.00 34.95 33.46 2bm8 s ARG 62 CO 0.08 -1.19 0.02 -1.64 0.02 0.00 0.00 175.30 172.60 2bm8 s MET 63 N -3.29 0.78 0.09 3.54 -1.94 -0.83 -3.90 119.30 113.74 2bm8 s MET 63 Ca 0.77 -0.45 0.28 0.00 -1.71 0.00 0.00 55.69 54.58 2bm8 s MET 63 Cb -0.31 -2.08 1.05 0.00 2.01 0.00 0.00 34.83 35.50 2bm8 s MET 63 CO 0.34 -0.61 1.86 1.28 -0.01 0.00 0.00 175.02 177.88 2bm8 n LEU 64 N 5.01 0.34 -4.64 -0.03 4.77 -1.26 -4.33 117.00 116.86 2bm8 n LEU 64 Ca -0.09 0.52 -0.40 0.00 -0.03 0.00 0.00 56.01 56.01 2bm8 n LEU 64 Cb 0.47 -0.42 -0.06 0.00 -2.33 0.00 0.00 43.42 41.08 2bm8 n LEU 64 CO 0.13 -0.07 0.36 -0.54 -1.33 0.00 0.00 177.39 175.94 2bm8 s LYS 65 N -3.04 4.15 0.75 3.23 1.02 -1.26 -5.06 119.74 119.52 2bm8 s LYS 65 Ca 0.13 0.54 -0.11 0.00 0.02 0.00 0.00 55.97 56.54 2bm8 s LYS 65 Cb 0.16 -3.62 0.04 0.00 -0.52 0.00 0.00 37.83 33.90 2bm8 s LYS 65 CO 0.56 -0.32 1.10 0.16 -0.92 0.00 0.00 175.35 175.93 2bm8 s ASP 66 N 1.35 5.03 0.25 2.83 1.47 -1.26 -4.72 116.67 121.63 2bm8 s ASP 66 Ca 0.26 1.19 -0.03 0.00 1.18 0.00 0.00 52.55 55.15 2bm8 s ASP 66 Cb -0.16 -1.95 0.51 0.00 -0.34 0.00 0.00 42.92 40.98 2bm8 s ASP 66 CO 0.09 -1.61 1.69 -0.65 0.68 0.00 0.00 175.17 175.37 2bm8 h PRO 67 N -0.84 0.29 -0.84 2.11 0.11 -1.97 -0.26 132.00 130.61 2bm8 h PRO 67 Ca -0.46 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.70 2bm8 h PRO 67 Cb 1.26 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 2bm8 h PRO 67 CO 0.62 0.19 0.51 -0.44 -0.21 0.00 0.00 178.00 178.67 2bm8 h ASP 68 N 0.30 0.79 -0.37 -2.05 3.32 -1.93 -0.54 116.42 115.95 2bm8 h ASP 68 Ca 0.44 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.39 2bm8 h ASP 68 Cb 0.76 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 2bm8 h ASP 68 CO -0.51 0.50 -0.21 0.74 -1.72 0.00 0.00 179.24 178.04 2bm8 h THR 69 N 0.93 1.27 -0.28 0.35 2.02 -1.54 -2.71 112.91 112.95 2bm8 h THR 69 Ca 0.37 -1.35 0.01 0.00 0.77 0.00 0.00 66.41 66.21 2bm8 h THR 69 Cb 0.19 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 2bm8 h THR 69 CO -0.18 0.46 0.19 1.56 0.37 0.00 0.00 175.52 177.91 2bm8 h GLN 70 N 0.75 0.36 0.00 6.66 4.20 0.08 -1.94 115.11 125.22 2bm8 h GLN 70 Ca 0.10 -0.02 -0.19 0.00 0.06 0.00 0.00 58.65 58.60 2bm8 h GLN 70 Cb 0.75 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 2bm8 h GLN 70 CO 0.06 0.24 -0.85 0.00 -0.67 0.00 0.00 178.83 177.61 2bm8 h ALA 71 N 1.83 0.57 -0.05 3.87 0.00 -0.84 -1.94 119.26 122.71 2bm8 h ALA 71 Ca 0.11 -0.72 -0.13 0.00 0.00 0.00 0.00 54.91 54.17 2bm8 h ALA 71 Cb -0.02 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.69 2bm8 h ALA 71 CO -0.02 0.93 -0.48 0.28 0.00 0.00 0.00 179.25 179.96 2bm8 h VAL 72 N 0.08 1.42 -0.37 0.00 2.07 -1.19 -2.55 116.25 115.71 2bm8 h VAL 72 Ca -0.03 -1.91 -0.03 0.00 0.82 0.00 0.00 66.70 65.55 2bm8 h VAL 72 Cb 1.47 2.42 -0.02 0.00 -1.52 0.00 0.00 31.29 33.64 2bm8 h VAL 72 CO 0.12 0.56 0.09 1.88 0.02 0.00 0.00 177.57 180.24 2bm8 h TYR 73 N -0.08 0.54 -0.26 1.57 0.99 -1.43 -1.21 116.97 117.09 2bm8 h TYR 73 Ca -0.05 -0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.64 2bm8 h TYR 73 Cb 1.16 -0.17 -0.01 0.00 1.00 0.00 0.00 36.73 38.71 2bm8 h TYR 73 CO 0.13 0.47 0.13 1.25 -0.00 0.00 0.00 178.16 180.14 2bm8 h HIS 74 N 0.53 0.37 -0.69 4.88 2.76 -1.27 -0.04 115.15 121.69 2bm8 h HIS 74 Ca 0.13 -0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.21 2bm8 h HIS 74 Cb 0.20 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 29.01 2bm8 h HIS 74 CO 0.01 0.35 0.15 -0.44 -1.30 0.00 0.00 177.93 176.70 2bm8 h ASP 75 N 0.29 1.06 -0.10 3.26 3.32 -1.20 -1.87 116.42 121.19 2bm8 h ASP 75 Ca 0.09 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 56.88 2bm8 h ASP 75 Cb 0.11 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 2bm8 h ASP 75 CO -0.01 1.02 -0.06 -0.03 -1.72 0.00 0.00 179.24 178.45 2bm8 h MET 76 N 1.05 0.21 -0.68 3.56 4.05 -0.95 -0.94 114.93 121.24 2bm8 h MET 76 Ca 0.22 -0.10 0.06 0.00 -0.28 0.00 0.00 59.70 59.60 2bm8 h MET 76 Cb 0.39 -0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.13 2bm8 h MET 76 CO 0.01 0.58 0.38 -0.07 0.23 0.00 0.00 176.91 178.04 2bm8 h LEU 77 N -0.17 0.56 -0.80 3.39 4.07 -1.00 -0.33 115.31 121.03 2bm8 h LEU 77 Ca 0.02 0.03 -0.08 0.00 0.08 0.00 0.00 57.88 57.93 2bm8 h LEU 77 Cb 0.53 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.16 2bm8 h LEU 77 CO 0.02 0.36 0.02 -0.25 -1.08 0.00 0.00 178.44 177.51 2bm8 h TRP 78 N 0.70 0.98 0.01 1.13 2.91 -1.06 0.78 115.95 121.40 2bm8 h TRP 78 Ca 0.30 -0.15 -0.09 0.00 1.13 0.00 0.00 58.89 60.09 2bm8 h TRP 78 Cb 0.19 -0.27 0.01 0.00 -0.51 0.00 0.00 29.16 28.58 2bm8 h TRP 78 CO -0.08 0.88 -0.36 1.49 -1.03 0.00 0.00 178.44 179.34 2bm8 h GLU 79 N 0.85 0.23 0.03 2.65 4.81 -1.00 -3.38 114.58 118.77 2bm8 h GLU 79 Ca 0.16 -0.26 -0.27 0.00 -0.13 0.00 0.00 59.36 58.86 2bm8 h GLU 79 Cb 0.48 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 2bm8 h GLU 79 CO 0.02 0.99 -1.46 1.25 -0.73 0.00 0.00 179.01 179.08 2bm8 h LEU 80 N -0.42 0.10 -3.27 1.64 7.12 -1.04 -3.49 115.31 115.94 2bm8 h LEU 80 Ca -0.05 -0.15 -0.37 0.00 0.13 0.00 0.00 57.88 57.44 2bm8 h LEU 80 Cb 1.12 -0.03 0.03 0.00 -0.53 0.00 0.00 40.66 41.25 2bm8 h LEU 80 CO 0.07 1.13 -0.79 0.54 -0.13 0.00 0.00 178.44 179.26 2bm8 n ARG 81 N -3.24 -1.27 -2.44 1.25 1.74 0.26 -4.81 116.66 108.15 2bm8 n ARG 81 Ca -0.12 0.76 -0.41 0.00 -0.77 0.00 0.00 57.85 57.31 2bm8 n ARG 81 Cb 1.02 -3.73 -0.04 0.00 -1.02 0.00 0.00 32.46 28.68 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 -5.08 4.59 0.37 5.56 0.04 -1.26 -4.55 135.00 134.67 2bm8 s PRO 82 Ca 0.21 1.83 0.24 0.00 0.04 0.00 0.00 61.00 63.32 2bm8 s PRO 82 Cb -0.08 -3.20 0.41 0.00 0.04 0.00 0.00 34.50 31.66 2bm8 s PRO 82 CO 0.86 0.12 1.59 0.00 0.04 0.00 0.00 177.00 179.61 2bm8 h ARG 83 N 4.19 0.00 -3.33 4.56 2.47 -1.04 -3.40 114.38 117.83 2bm8 h ARG 83 Ca -0.46 0.00 -0.24 0.00 -1.26 0.00 0.00 59.98 58.02 2bm8 h ARG 83 Cb 1.21 0.00 -0.31 0.00 -1.65 0.00 0.00 29.97 29.22 2bm8 h ARG 83 CO 0.69 0.00 -0.61 0.99 0.56 0.00 0.00 179.97 181.60 2bm8 s THR 84 N -3.20 -0.04 -0.11 2.04 2.01 -1.02 -0.95 115.64 114.37 2bm8 s THR 84 Ca 0.07 0.14 0.00 0.00 0.31 0.00 0.00 61.69 62.22 2bm8 s THR 84 Cb 0.07 -0.21 0.02 0.00 0.01 0.00 0.00 72.50 72.39 2bm8 s THR 84 CO 0.67 0.06 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.92 2bm8 s ILE 85 N 0.91 1.22 -0.11 1.82 1.01 -0.69 -1.33 121.20 124.04 2bm8 s ILE 85 Ca -0.07 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.16 2bm8 s ILE 85 Cb -0.09 -1.18 -0.02 0.00 0.01 0.00 0.00 42.46 41.18 2bm8 s ILE 85 CO -0.04 0.40 -0.15 -0.69 0.00 0.00 0.00 174.94 174.46 2bm8 s VAL 86 N 1.42 2.95 -0.25 2.92 1.01 -0.34 -0.90 120.40 127.22 2bm8 s VAL 86 Ca 0.01 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.30 2bm8 s VAL 86 Cb -0.13 -2.21 0.05 0.00 0.00 0.00 0.00 36.38 34.09 2bm8 s VAL 86 CO -0.06 0.54 -0.12 -1.61 0.00 0.00 0.00 175.10 173.85 2bm8 s GLU 87 N 0.07 2.39 -0.65 2.72 0.41 0.34 -0.85 118.70 123.13 2bm8 s GLU 87 Ca -0.06 -1.25 -0.23 0.00 -0.41 0.00 0.00 54.97 53.02 2bm8 s GLU 87 Cb -0.15 -2.84 0.06 0.00 -1.78 0.00 0.00 34.13 29.42 2bm8 s GLU 87 CO 0.05 -0.50 1.01 -1.17 -0.49 0.00 0.00 175.26 174.15 2bm8 s LEU 88 N 1.14 4.17 0.00 1.80 0.20 0.43 -0.86 118.68 125.56 2bm8 s LEU 88 Ca -0.06 -0.82 0.00 0.00 0.69 0.00 0.00 54.13 53.94 2bm8 s LEU 88 Cb -0.19 -2.50 0.00 0.00 -0.43 0.00 0.00 46.19 43.07 2bm8 s LEU 88 CO -0.06 -1.47 0.00 0.61 -0.29 0.00 0.00 176.35 175.14 2bm8 n GLY 89 N 5.30 2.46 0.63 7.98 0.00 0.88 -0.49 105.19 121.94 2bm8 n GLY 89 Ca -0.02 -1.12 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 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 1.31 0.91 0.00 1.61 0.31 -1.26 -4.78 118.33 116.44 2bm8 n VAL 90 Ca 0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2bm8 n VAL 90 Cb 0.00 -1.76 0.00 0.00 -0.91 0.00 0.00 33.84 31.17 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 -3.68 0.00 1.08 3.52 9.36 -1.26 -2.80 117.16 123.39 2bm8 n TYR 91 Ca -0.17 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.16 2bm8 n TYR 91 Cb 0.51 0.00 0.19 0.00 -0.63 0.00 0.00 39.34 39.41 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 11.16 1.00 0.00 2.98 2.04 -1.26 -2.62 115.26 128.56 2bm8 n ASN 92 Ca 0.00 -0.79 0.00 0.00 -0.44 0.00 0.00 54.58 53.35 2bm8 n ASN 92 Cb 0.00 0.37 0.00 0.00 -2.53 0.00 0.00 39.78 37.62 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 1.43 0.54 0.13 4.83 0.00 -1.12 -0.90 105.19 110.10 2bm8 n GLY 93 Ca 0.08 -0.10 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 0.36 1.67 -0.02 0.00 -1.83 -2.30 103.07 100.95 2bm8 h GLY 94 Ca 0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.12 2bm8 h GLY 94 CO 0.00 0.16 -0.02 1.48 0.00 0.00 0.00 176.54 178.16 2bm8 h SER 95 N 0.26 0.38 0.23 0.19 4.64 -1.91 -1.56 113.55 115.78 2bm8 h SER 95 Ca 0.08 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2bm8 h SER 95 Cb 0.09 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 2bm8 h SER 95 CO -0.01 0.47 -0.23 -0.07 -0.87 0.00 0.00 176.83 176.12 2bm8 h LEU 96 N 0.40 -0.61 -1.38 5.97 4.07 -1.82 -1.15 115.31 120.80 2bm8 h LEU 96 Ca 0.09 0.06 0.08 0.00 0.08 0.00 0.00 57.88 58.18 2bm8 h LEU 96 Cb 0.30 0.21 -0.05 0.00 1.08 0.00 0.00 40.66 42.20 2bm8 h LEU 96 CO 0.01 -0.33 0.49 0.00 -1.08 0.00 0.00 178.44 177.53 2bm8 h ALA 97 N 0.21 1.75 -0.10 1.53 0.00 -1.19 -2.25 119.26 119.21 2bm8 h ALA 97 Ca -0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2bm8 h ALA 97 Cb 0.45 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2bm8 h ALA 97 CO -0.05 0.12 -0.20 2.35 0.00 0.00 0.00 179.25 181.46 2bm8 h TRP 98 N 0.72 0.40 -0.78 0.00 7.01 -0.95 -0.53 115.95 121.81 2bm8 h TRP 98 Ca 0.33 -0.14 0.01 0.00 2.11 0.00 0.00 58.89 61.20 2bm8 h TRP 98 Cb 0.36 -0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 27.31 2bm8 h TRP 98 CO -0.00 0.81 0.52 0.74 -2.79 0.00 0.00 178.44 177.72 2bm8 h PHE 99 N -0.13 0.98 -0.25 2.65 0.05 -1.06 0.47 116.94 119.66 2bm8 h PHE 99 Ca 0.00 0.02 -0.06 0.00 3.82 0.00 0.00 57.97 61.75 2bm8 h PHE 99 Cb 0.79 -0.33 -0.01 0.00 2.00 0.00 0.00 35.95 38.40 2bm8 h PHE 99 CO 0.11 0.62 -0.09 -0.09 -0.18 0.00 0.00 178.31 178.67 2bm8 h ARG 100 N 1.06 0.51 -0.56 1.51 1.12 -1.37 -1.10 114.38 115.55 2bm8 h ARG 100 Ca 0.29 -0.21 -0.00 0.00 -1.11 0.00 0.00 59.98 58.94 2bm8 h ARG 100 Cb -0.12 -0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 29.79 2bm8 h ARG 100 CO -0.06 0.75 0.34 -0.44 -3.11 0.00 0.00 179.97 177.45 2bm8 h ASP 101 N 0.24 0.67 -0.21 -3.80 3.32 -0.83 -0.84 116.42 114.96 2bm8 h ASP 101 Ca 0.06 -0.06 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 2bm8 h ASP 101 Cb 0.58 -0.17 0.01 0.00 0.22 0.00 0.00 39.33 39.97 2bm8 h ASP 101 CO 0.03 0.53 -0.68 0.25 -1.72 0.00 0.00 179.24 177.65 2bm8 h LEU 102 N 0.75 0.97 -1.03 1.55 5.85 -0.81 -0.48 115.31 122.11 2bm8 h LEU 102 Ca 0.20 -0.58 -0.05 0.00 0.84 0.00 0.00 57.88 58.29 2bm8 h LEU 102 Cb -0.02 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 2bm8 h LEU 102 CO -0.04 1.39 0.15 0.71 -0.34 0.00 0.00 178.44 180.31 2bm8 h THR 103 N 0.60 1.23 -0.26 1.05 1.35 -1.18 -1.93 112.91 113.77 2bm8 h THR 103 Ca -0.02 -0.80 -0.02 0.00 -0.55 0.00 0.00 66.41 65.01 2bm8 h THR 103 Cb 1.30 0.64 -0.01 0.00 -1.73 0.00 0.00 68.15 68.35 2bm8 h THR 103 CO 0.15 0.30 0.07 0.50 -0.25 0.00 0.00 175.52 176.29 2bm8 h LYS 104 N 0.82 0.41 0.00 4.72 3.64 -0.57 -0.42 116.57 125.18 2bm8 h LYS 104 Ca 0.18 -0.09 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 2bm8 h LYS 104 Cb 0.28 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2bm8 h LYS 104 CO -0.00 0.49 -0.26 0.82 -2.27 0.00 0.00 179.45 178.23 2bm8 h ILE 105 N 0.25 0.79 -0.00 2.00 2.04 -1.07 -2.18 117.51 119.34 2bm8 h ILE 105 Ca 0.08 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.88 2bm8 h ILE 105 Cb 0.26 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2bm8 h ILE 105 CO -0.00 0.25 -0.12 0.23 0.00 0.00 0.00 178.15 178.51 2bm8 n MET 106 N -3.66 0.17 -1.94 2.37 2.81 -0.73 -4.94 117.12 111.20 2bm8 n MET 106 Ca -0.01 -0.04 -0.09 0.00 -1.81 0.00 0.00 57.70 55.75 2bm8 n MET 106 Cb 0.38 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.38 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 1.43 0.26 3.77 3.03 0.00 -0.82 -5.03 105.19 107.83 2bm8 n GLY 107 Ca 0.09 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.40 5.29 -1.09 -0.61 1.01 -0.23 -5.03 121.20 118.14 2bm8 s ILE 108 Ca 0.00 0.55 -0.22 0.00 0.00 0.00 0.00 60.65 60.98 2bm8 s ILE 108 Cb 0.00 -3.61 0.04 0.00 0.01 0.00 0.00 42.46 38.89 2bm8 s ILE 108 CO 0.00 0.45 1.60 -0.62 0.00 0.00 0.00 174.94 176.37 2bm8 s ASP 109 N 0.01 6.39 -0.17 3.58 2.15 -1.26 -4.35 116.67 123.02 2bm8 s ASP 109 Ca 0.17 -1.65 0.01 0.00 0.43 0.00 0.00 52.55 51.51 2bm8 s ASP 109 Cb -0.13 -2.57 0.02 0.00 -0.30 0.00 0.00 42.92 39.93 2bm8 s ASP 109 CO 0.05 -1.61 -0.19 0.00 -0.17 0.00 0.00 175.17 173.25 2bm8 s GLN 111 N 1.30 4.63 -0.13 0.00 -1.52 -0.12 -4.93 119.66 118.89 2bm8 s GLN 111 Ca 0.04 1.31 -0.01 0.00 -1.95 0.00 0.00 55.36 54.76 2bm8 s GLN 111 Cb -0.13 -3.36 -0.02 0.00 -0.22 0.00 0.00 33.01 29.28 2bm8 s GLN 111 CO -0.12 0.26 -0.11 0.08 -0.25 0.00 0.00 175.29 175.16 2bm8 s VAL 112 N -0.11 3.28 -0.11 1.09 1.01 -0.27 -1.70 120.40 123.59 2bm8 s VAL 112 Ca 0.43 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.83 2bm8 s VAL 112 Cb -0.22 -2.39 0.02 0.00 0.00 0.00 0.00 36.38 33.79 2bm8 s VAL 112 CO 0.27 0.52 -0.10 -0.63 0.00 0.00 0.00 175.10 175.17 2bm8 s ILE 113 N 0.24 1.14 -0.06 2.22 1.01 -0.08 -0.86 121.20 124.81 2bm8 s ILE 113 Ca -0.07 -0.38 -0.03 0.00 0.00 0.00 0.00 60.65 60.17 2bm8 s ILE 113 Cb -0.15 -1.12 -0.04 0.00 0.01 0.00 0.00 42.46 41.16 2bm8 s ILE 113 CO 0.05 0.38 0.08 -0.83 0.00 0.00 0.00 174.94 174.62 2bm8 s GLY 114 N 1.49 2.02 -0.07 6.18 0.00 -0.36 -0.50 107.32 116.07 2bm8 s GLY 114 Ca 0.02 -0.78 0.01 0.00 0.00 0.00 0.00 44.72 43.96 2bm8 s GLY 114 CO -0.07 -0.59 -0.08 -0.42 0.00 0.00 0.00 173.10 171.94 2bm8 s ILE 115 N -1.07 0.92 -0.07 0.90 1.01 -0.04 -1.58 121.20 121.28 2bm8 s ILE 115 Ca 0.18 -0.31 -0.30 0.00 0.00 0.00 0.00 60.65 60.22 2bm8 s ILE 115 Cb -0.12 -0.90 0.07 0.00 0.01 0.00 0.00 42.46 41.52 2bm8 s ILE 115 CO 0.08 0.32 0.68 -0.62 0.00 0.00 0.00 174.94 175.41 2bm8 s ASP 116 N 1.08 -0.67 0.59 3.58 -1.08 -0.90 -0.09 116.67 119.19 2bm8 s ASP 116 Ca -0.07 0.78 0.37 0.00 -0.52 0.00 0.00 52.55 53.11 2bm8 s ASP 116 Cb -0.14 0.62 1.77 0.00 -1.46 0.00 0.00 42.92 43.71 2bm8 s ASP 116 CO -0.01 -0.58 2.13 0.08 0.52 0.00 0.00 175.17 177.32 2bm8 h ARG 117 N 3.19 0.00 -3.39 4.34 0.11 -1.82 -2.95 114.38 113.86 2bm8 h ARG 117 Ca -0.27 0.00 -0.58 0.00 0.10 0.00 0.00 59.98 59.23 2bm8 h ARG 117 Cb 1.14 0.00 -0.40 0.00 1.11 0.00 0.00 29.97 31.82 2bm8 h ARG 117 CO 0.36 0.01 -0.76 0.34 0.10 0.00 0.00 179.97 180.02 2bm8 s ASP 118 N -5.52 3.91 0.00 0.08 2.15 -1.26 -4.82 116.67 111.21 2bm8 s ASP 118 Ca -0.01 -1.70 0.22 0.00 0.43 0.00 0.00 52.55 51.48 2bm8 s ASP 118 Cb 0.11 -0.80 0.55 0.00 -0.30 0.00 0.00 42.92 42.47 2bm8 s ASP 118 CO 0.50 -0.40 1.47 0.18 -0.17 0.00 0.00 175.17 176.75 2bm8 n LEU 119 N 4.76 3.48 0.06 -1.34 4.77 -1.26 -4.51 117.00 122.95 2bm8 n LEU 119 Ca -0.01 -1.65 0.13 0.00 -0.03 0.00 0.00 56.01 54.45 2bm8 n LEU 119 Cb 0.41 -0.37 0.50 0.00 -2.33 0.00 0.00 43.42 41.63 2bm8 n LEU 119 CO 0.12 0.82 0.91 -1.54 -1.33 0.00 0.00 177.39 176.37 2bm8 n SER 120 N 1.43 0.41 -0.10 -1.43 3.41 -1.26 -2.69 113.62 113.39 2bm8 n SER 120 Ca 0.21 0.54 0.13 0.00 -0.26 0.00 0.00 58.87 59.50 2bm8 n SER 120 Cb 0.57 -0.65 0.39 0.00 -0.26 0.00 0.00 64.21 64.26 2bm8 n SER 120 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2bm8 n ARG 121 N -1.89 0.41 -1.70 4.33 3.00 -1.26 -4.95 116.66 114.59 2bm8 n ARG 121 Ca 0.06 -0.21 -0.43 0.00 -0.01 0.00 0.00 57.85 57.26 2bm8 n ARG 121 Cb 0.37 -1.50 -0.03 0.00 0.00 0.00 0.00 32.46 31.30 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 2.97 0.39 -2.12 0.00 1.13 -0.08 -4.98 117.38 114.71 2bm8 n GLN 123 Ca 0.13 -1.10 -0.42 0.00 -1.94 0.00 0.00 57.00 53.67 2bm8 n GLN 123 Cb 0.33 -1.19 -0.03 0.00 0.11 0.00 0.00 30.24 29.47 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 -0.82 3.76 0.48 5.09 1.01 -1.25 -4.98 121.20 124.49 2bm8 s ILE 124 Ca 0.12 0.92 -0.23 0.00 0.00 0.00 0.00 60.65 61.46 2bm8 s ILE 124 Cb 0.08 -3.60 -0.07 0.00 0.01 0.00 0.00 42.46 38.89 2bm8 s ILE 124 CO 0.12 -0.08 1.31 -2.84 0.00 0.00 0.00 174.94 173.45 2bm8 s PRO 125 N 3.87 3.55 0.38 2.79 0.02 -1.26 -4.90 135.00 139.45 2bm8 s PRO 125 Ca 0.68 2.13 0.13 0.00 0.02 0.00 0.00 61.00 63.96 2bm8 s PRO 125 Cb -0.30 -2.46 0.94 0.00 0.02 0.00 0.00 34.50 32.70 2bm8 s PRO 125 CO 0.26 -0.83 1.86 0.00 -0.33 0.00 0.00 177.00 177.95 2bm8 h ALA 126 N 1.99 2.00 -0.51 -1.55 0.00 -2.01 -2.75 119.26 116.43 2bm8 h ALA 126 Ca -0.50 0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.49 2bm8 h ALA 126 Cb 1.27 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 2bm8 h ALA 126 CO 0.60 -0.27 0.34 0.66 0.00 0.00 0.00 179.25 180.57 2bm8 h SER 127 N 0.55 0.41 -2.27 0.00 4.64 -2.03 -2.92 113.55 111.94 2bm8 h SER 127 Ca 0.47 -0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 61.18 2bm8 h SER 127 Cb 0.95 -0.09 -0.41 0.00 -0.31 0.00 0.00 62.40 62.54 2bm8 h SER 127 CO -0.21 0.27 -0.55 -0.90 -0.87 0.00 0.00 176.83 174.57 2bm8 n ASP 128 N -4.47 4.45 -1.35 4.97 3.85 -1.04 -4.73 116.55 118.22 2bm8 n ASP 128 Ca 0.07 -3.63 0.08 0.00 -0.71 0.00 0.00 54.79 50.60 2bm8 n ASP 128 Cb 0.23 -0.62 0.32 0.00 -1.35 0.00 0.00 41.12 39.70 2bm8 n ASP 128 CO 0.00 0.00 0.00 0.23 -1.01 0.00 0.00 177.20 176.42 2bm8 n MET 129 N 0.04 3.65 -1.89 0.11 2.81 -1.10 -4.83 117.12 115.90 2bm8 n MET 129 Ca 0.31 -2.82 -0.42 0.00 -1.81 0.00 0.00 57.70 52.96 2bm8 n MET 129 Cb 0.39 -1.87 -0.03 0.00 -0.71 0.00 0.00 33.22 31.00 2bm8 n MET 129 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2bm8 s GLU 130 N -2.14 4.20 -1.86 0.03 2.12 -1.26 -2.17 118.70 117.62 2bm8 s GLU 130 Ca 0.46 2.42 0.00 0.00 0.36 0.00 0.00 54.97 58.21 2bm8 s GLU 130 Cb 0.32 -3.12 0.00 0.00 0.26 0.00 0.00 34.13 31.59 2bm8 s GLU 130 CO 0.18 -0.60 0.00 0.09 -0.54 0.00 0.00 175.26 174.39 2bm8 n ASN 131 N 3.49 -5.46 -4.00 -1.70 4.13 -1.26 -5.00 115.26 105.46 2bm8 n ASN 131 Ca 0.12 0.22 -0.28 0.00 1.68 0.00 0.00 54.58 56.33 2bm8 n ASN 131 Cb 0.38 -4.58 -0.17 0.00 -1.54 0.00 0.00 39.78 33.87 2bm8 n ASN 131 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2bm8 s ILE 132 N -2.85 1.33 -0.15 2.41 1.01 -0.92 -1.11 121.20 120.92 2bm8 s ILE 132 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 60.14 2bm8 s ILE 132 Cb 0.00 -1.26 -0.01 0.00 0.01 0.00 0.00 42.46 41.21 2bm8 s ILE 132 CO 0.00 0.41 -0.14 -0.89 0.00 0.00 0.00 174.94 174.32 2bm8 s THR 133 N 1.31 2.79 -0.07 2.92 2.01 -0.04 -4.97 115.64 119.58 2bm8 s THR 133 Ca -0.01 -0.74 -0.03 0.00 0.31 0.00 0.00 61.69 61.22 2bm8 s THR 133 Cb -0.14 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 2bm8 s THR 133 CO -0.05 0.51 0.09 -0.76 -0.69 0.00 0.00 174.62 173.72 2bm8 s LEU 134 N 0.69 4.03 -0.02 4.42 1.02 -1.26 -1.22 118.68 126.34 2bm8 s LEU 134 Ca -0.07 0.28 -0.01 0.00 0.02 0.00 0.00 54.13 54.35 2bm8 s LEU 134 Cb -0.16 -2.11 0.02 0.00 0.02 0.00 0.00 46.19 43.97 2bm8 s LEU 134 CO 0.02 0.35 0.05 -1.00 0.02 0.00 0.00 176.35 175.79 2bm8 s HIS 135 N -1.06 -0.04 0.83 0.29 3.76 -0.61 -4.97 115.29 113.48 2bm8 s HIS 135 Ca 0.18 0.17 -0.11 0.00 -0.15 0.00 0.00 55.06 55.16 2bm8 s HIS 135 Cb -0.12 -0.07 0.09 0.00 1.11 0.00 0.00 32.58 33.59 2bm8 s HIS 135 CO 0.08 -0.06 1.12 -1.14 -0.85 0.00 0.00 174.74 173.88 2bm8 s GLN 136 N 0.49 1.72 -0.16 1.40 2.00 -1.26 -2.12 119.66 121.74 2bm8 s GLN 136 Ca -0.04 1.36 -0.34 0.00 -2.00 0.00 0.00 55.36 54.35 2bm8 s GLN 136 Cb -0.06 -1.82 0.13 0.00 0.80 0.00 0.00 33.01 32.07 2bm8 s GLN 136 CO -0.02 -2.08 1.15 0.20 -0.50 0.00 0.00 175.29 174.04 2bm8 s GLY 137 N -3.01 -0.32 -0.06 2.59 0.00 -1.11 -4.67 107.32 100.74 2bm8 s GLY 137 Ca 0.64 1.51 0.02 0.00 0.00 0.00 0.00 44.72 46.90 2bm8 s GLY 137 CO 0.56 0.51 -0.12 -0.35 0.00 0.00 0.00 173.10 173.70 2bm8 s ASP 138 N -2.20 1.75 0.15 1.64 2.15 -1.26 -2.87 116.67 116.03 2bm8 s ASP 138 Ca 0.08 -0.29 -0.06 0.00 0.43 0.00 0.00 52.55 52.71 2bm8 s ASP 138 Cb -0.01 -0.75 -0.01 0.00 -0.30 0.00 0.00 42.92 41.85 2bm8 s ASP 138 CO -0.05 0.05 1.41 0.00 -0.17 0.00 0.00 175.17 176.40 2bm8 n SER 140 N -3.91 0.00 -3.82 0.00 7.64 -1.26 -4.54 113.62 107.73 2bm8 n SER 140 Ca -0.05 -1.61 -0.29 0.00 1.01 0.00 0.00 58.87 57.93 2bm8 n SER 140 Cb 0.69 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.73 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 -1.25 3.50 0.14 6.43 3.68 -1.15 -5.00 116.67 123.03 2bm8 s ASP 141 Ca 0.05 -1.12 0.22 0.00 2.13 0.00 0.00 52.55 53.82 2bm8 s ASP 141 Cb 0.02 -0.89 0.88 0.00 -1.45 0.00 0.00 42.92 41.48 2bm8 s ASP 141 CO 0.04 -0.30 1.68 0.18 0.13 0.00 0.00 175.17 176.89 2bm8 n LEU 142 N 4.85 0.40 -0.17 -1.34 4.77 -1.26 -2.85 117.00 121.40 2bm8 n LEU 142 Ca -0.09 0.58 -0.05 0.00 -0.03 0.00 0.00 56.01 56.42 2bm8 n LEU 142 Cb 0.45 -0.50 0.04 0.00 -2.33 0.00 0.00 43.42 41.08 2bm8 n LEU 142 CO 0.15 -0.33 1.05 0.74 -1.33 0.00 0.00 177.39 177.67 2bm8 h THR 143 N 0.00 1.03 -0.97 -5.08 2.02 -1.94 -2.68 112.91 105.29 2bm8 h THR 143 Ca 0.00 -0.20 0.30 0.00 0.77 0.00 0.00 66.41 67.28 2bm8 h THR 143 Cb 0.41 0.40 -0.18 0.00 -1.74 0.00 0.00 68.15 67.04 2bm8 h THR 143 CO 0.00 0.11 0.14 0.41 0.37 0.00 0.00 175.52 176.54 2bm8 n THR 144 N -4.82 -0.41 0.46 3.16 -1.04 -1.13 -2.10 114.28 108.41 2bm8 n THR 144 Ca 0.04 2.10 0.13 0.00 -2.04 0.00 0.00 64.05 64.28 2bm8 n THR 144 Cb 0.09 -3.14 0.31 0.00 -1.82 0.00 0.00 70.33 65.77 2bm8 n THR 144 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 2bm8 h PHE 145 N 0.00 0.00 -0.99 -1.42 -1.00 -1.67 -3.38 116.94 108.49 2bm8 h PHE 145 Ca 0.64 0.00 0.19 0.00 2.81 0.00 0.00 57.97 61.62 2bm8 h PHE 145 Cb 1.44 0.00 -0.11 0.00 3.61 0.00 0.00 35.95 40.89 2bm8 h PHE 145 CO -0.38 0.00 0.59 0.93 -1.61 0.00 0.00 178.31 177.84 2bm8 h GLU 146 N 0.00 0.71 -0.82 1.51 3.07 -1.50 -2.97 114.58 114.58 2bm8 h GLU 146 Ca 0.00 -0.04 0.18 0.00 -0.50 0.00 0.00 59.36 59.00 2bm8 h GLU 146 Cb 0.84 -0.16 -0.06 0.00 -0.84 0.00 0.00 28.75 28.53 2bm8 h GLU 146 CO 0.00 0.47 0.55 1.12 -1.40 0.00 0.00 179.01 179.75 2bm8 h HIS 147 N 0.73 0.48 -0.20 4.33 2.07 -1.80 -1.82 115.15 118.94 2bm8 h HIS 147 Ca 0.58 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 58.11 2bm8 h HIS 147 Cb 0.91 -0.15 0.00 0.00 2.57 0.00 0.00 27.41 30.75 2bm8 h HIS 147 CO -0.01 0.15 0.00 1.47 -3.07 0.00 0.00 177.93 176.47 2bm8 n LEU 148 N -4.48 2.27 0.05 6.12 -0.00 -1.12 -3.63 117.00 116.21 2bm8 n LEU 148 Ca 0.17 -1.15 -0.18 0.00 -0.00 0.00 0.00 56.01 54.85 2bm8 n LEU 148 Cb 0.63 -0.47 -0.09 0.00 -0.00 0.00 0.00 43.42 43.49 2bm8 n LEU 148 CO 0.32 0.36 0.10 -0.09 -0.00 0.00 0.00 177.39 178.08 2bm8 h ARG 149 N 1.32 0.60 -4.73 1.47 2.43 -1.54 -3.37 114.38 110.56 2bm8 h ARG 149 Ca 0.00 -0.66 -0.74 0.00 -0.81 0.00 0.00 59.98 57.78 2bm8 h ARG 149 Cb 0.84 0.19 -0.18 0.00 -0.42 0.00 0.00 29.97 30.40 2bm8 h ARG 149 CO 0.13 1.26 1.30 -1.21 -1.51 0.00 0.00 179.97 179.93 2bm8 s GLU 150 N -3.27 4.07 -0.18 0.20 2.02 -1.24 -4.92 118.70 115.38 2bm8 s GLU 150 Ca -0.08 -2.57 -0.35 0.00 0.02 0.00 0.00 54.97 51.99 2bm8 s GLU 150 Cb 0.07 -5.04 0.14 0.00 0.10 0.00 0.00 34.13 29.41 2bm8 s GLU 150 CO 0.90 -1.75 1.29 0.00 0.02 0.00 0.00 175.26 175.73 2bm8 s MET 151 N 1.53 0.22 0.62 1.61 0.23 -1.26 -5.14 119.30 117.11 2bm8 s MET 151 Ca 0.42 -0.09 -0.14 0.00 -1.03 0.00 0.00 55.69 54.84 2bm8 s MET 151 Cb -0.03 0.09 -0.03 0.00 -1.53 0.00 0.00 34.83 33.33 2bm8 s MET 151 CO -0.01 -0.10 1.05 0.00 -2.03 0.00 0.00 175.02 173.93 2bm8 s ALA 152 N -2.28 2.78 0.23 3.16 0.00 -1.26 -5.05 121.76 119.34 2bm8 s ALA 152 Ca 0.11 0.25 0.11 0.00 0.00 0.00 0.00 51.96 52.44 2bm8 s ALA 152 Cb 0.01 -3.19 -0.05 0.00 0.00 0.00 0.00 23.12 19.89 2bm8 s ALA 152 CO -0.04 -0.86 -0.21 -1.01 0.00 0.00 0.00 175.76 173.65 2bm8 s HIS 153 N -2.69 2.17 0.83 0.00 3.76 -1.26 -3.95 115.29 114.15 2bm8 s HIS 153 Ca 0.61 -0.38 -0.11 0.00 -0.15 0.00 0.00 55.06 55.03 2bm8 s HIS 153 Cb -0.14 -1.01 0.09 0.00 1.11 0.00 0.00 32.58 32.63 2bm8 s HIS 153 CO 0.42 0.55 1.12 -2.14 -0.85 0.00 0.00 174.74 173.85 2bm8 s PRO 154 N -3.13 1.72 0.02 8.40 0.02 -1.26 -4.49 135.00 136.27 2bm8 s PRO 154 Ca 0.24 1.37 0.02 0.00 0.02 0.00 0.00 61.00 62.65 2bm8 s PRO 154 Cb -0.06 -1.82 -0.01 0.00 0.02 0.00 0.00 34.50 32.63 2bm8 s PRO 154 CO 0.11 -2.08 -0.08 -1.17 -0.33 0.00 0.00 177.00 173.46 2bm8 s LEU 155 N -6.17 2.13 -0.20 -5.54 0.20 -1.26 -0.54 118.68 107.29 2bm8 s LEU 155 Ca 0.64 -0.32 0.01 0.00 0.69 0.00 0.00 54.13 55.15 2bm8 s LEU 155 Cb -0.20 -0.28 0.04 0.00 -0.43 0.00 0.00 46.19 45.31 2bm8 s LEU 155 CO 0.56 -0.04 -0.15 -0.63 -0.29 0.00 0.00 176.35 175.80 2bm8 s ILE 156 N -0.71 1.92 -0.24 6.68 1.01 -0.44 -1.90 121.20 127.52 2bm8 s ILE 156 Ca -0.03 -1.09 -0.10 0.00 0.00 0.00 0.00 60.65 59.43 2bm8 s ILE 156 Cb -0.06 -1.88 -0.05 0.00 0.01 0.00 0.00 42.46 40.48 2bm8 s ILE 156 CO 0.00 0.29 0.15 0.12 0.00 0.00 0.00 174.94 175.51 2bm8 s PHE 157 N 1.29 3.31 -0.17 3.97 5.36 0.41 -1.20 117.98 130.95 2bm8 s PHE 157 Ca -0.00 0.20 0.01 0.00 -0.96 0.00 0.00 56.93 56.18 2bm8 s PHE 157 Cb -0.16 -2.25 0.02 0.00 -0.34 0.00 0.00 43.02 40.29 2bm8 s PHE 157 CO -0.10 0.07 -0.19 0.42 -1.46 0.00 0.00 175.22 173.96 2bm8 s ILE 158 N 1.01 2.00 -0.42 3.12 1.01 -0.03 -0.78 121.20 127.10 2bm8 s ILE 158 Ca 0.07 -0.91 -0.21 0.00 0.00 0.00 0.00 60.65 59.60 2bm8 s ILE 158 Cb -0.13 -1.81 0.02 0.00 0.01 0.00 0.00 42.46 40.55 2bm8 s ILE 158 CO 0.04 0.53 0.68 -0.62 0.00 0.00 0.00 174.94 175.57 2bm8 s ASP 159 N 1.27 6.37 0.00 3.58 3.68 0.55 -0.43 116.67 131.70 2bm8 s ASP 159 Ca 0.04 -0.17 0.07 0.00 2.13 0.00 0.00 52.55 54.62 2bm8 s ASP 159 Cb -0.13 -2.34 0.20 0.00 -1.45 0.00 0.00 42.92 39.20 2bm8 s ASP 159 CO -0.12 -0.78 1.16 0.59 0.13 0.00 0.00 175.17 176.15 2bm8 n ASN 160 N 6.35 2.59 -0.11 -0.34 3.02 0.35 -2.49 115.26 124.63 2bm8 n ASN 160 Ca -0.00 -1.97 -0.24 0.00 -0.03 0.00 0.00 54.58 52.33 2bm8 n ASN 160 Cb 0.48 -0.15 -0.08 0.00 -0.61 0.00 0.00 39.78 39.42 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 0.20 1.53 -1.33 5.41 0.00 -0.86 -4.79 120.51 120.67 2bm8 n ALA 161 Ca 0.08 -0.91 -0.05 0.00 0.00 0.00 0.00 53.44 52.56 2bm8 n ALA 161 Cb 0.36 0.20 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 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 -4.01 -0.05 -3.97 0.00 8.25 -1.26 -5.03 115.22 109.15 2bm8 n HIS 162 Ca -0.45 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 56.66 2bm8 n HIS 162 Cb 0.82 -1.35 -0.09 0.00 1.12 0.00 0.00 29.99 30.49 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 -2.21 3.48 -1.44 -1.41 0.00 -1.26 -4.56 121.76 114.36 2bm8 s ALA 163 Ca 0.00 -0.73 -0.06 0.00 0.00 0.00 0.00 51.96 51.17 2bm8 s ALA 163 Cb 0.00 -1.94 0.03 0.00 0.00 0.00 0.00 23.12 21.21 2bm8 s ALA 163 CO 0.00 0.23 0.48 -1.71 0.00 0.00 0.00 175.76 174.76 2bm8 n ASN 164 N 3.34 -5.11 -0.10 0.00 5.15 -1.26 -4.74 115.26 112.53 2bm8 n ASN 164 Ca -0.17 -0.27 -0.04 0.00 -0.60 0.00 0.00 54.58 53.51 2bm8 n ASN 164 Cb 0.52 -4.18 0.18 0.00 -0.53 0.00 0.00 39.78 35.77 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 -1.06 1.24 -0.09 -0.44 2.02 -1.93 -2.65 112.91 110.01 2bm8 h THR 165 Ca -0.48 -0.95 -0.12 0.00 0.77 0.00 0.00 66.41 65.64 2bm8 h THR 165 Cb 1.33 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 68.56 2bm8 h THR 165 CO 0.54 0.34 -0.47 -0.26 0.37 0.00 0.00 175.52 176.03 2bm8 h PHE 166 N 0.73 0.25 -0.38 3.16 -1.00 -1.97 -1.32 116.94 116.41 2bm8 h PHE 166 Ca 0.15 -0.08 -0.15 0.00 2.81 0.00 0.00 57.97 60.70 2bm8 h PHE 166 Cb 0.41 -0.05 -0.01 0.00 3.61 0.00 0.00 35.95 39.91 2bm8 h PHE 166 CO 0.02 0.65 -0.34 -0.91 -1.61 0.00 0.00 178.31 176.12 2bm8 h ASN 167 N 0.17 0.92 -0.78 2.17 2.35 -1.92 -2.65 115.58 115.83 2bm8 h ASN 167 Ca 0.01 -0.40 -0.02 0.00 -0.55 0.00 0.00 56.30 55.34 2bm8 h ASN 167 Cb 0.90 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.98 2bm8 h ASN 167 CO 0.07 1.17 0.40 0.40 -1.65 0.00 0.00 177.43 177.83 2bm8 h ILE 168 N 0.73 1.24 -0.64 2.81 2.04 -1.11 -0.38 117.51 122.20 2bm8 h ILE 168 Ca 0.07 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.29 2bm8 h ILE 168 Cb 0.91 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 2bm8 h ILE 168 CO 0.08 0.28 0.40 0.24 0.00 0.00 0.00 178.15 179.16 2bm8 h MET 169 N 1.12 0.85 0.05 2.37 2.86 -1.18 0.18 114.93 121.17 2bm8 h MET 169 Ca 0.28 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.85 2bm8 h MET 169 Cb 0.07 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.55 2bm8 h MET 169 CO -0.04 0.59 -0.02 -0.22 1.06 0.00 0.00 176.91 178.27 2bm8 h LYS 170 N 0.86 -0.07 -0.92 1.72 3.64 -1.04 0.22 116.57 120.98 2bm8 h LYS 170 Ca 0.23 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.67 2bm8 h LYS 170 Cb -0.06 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 31.72 2bm8 h LYS 170 CO -0.05 -0.03 0.60 2.35 -2.27 0.00 0.00 179.45 180.06 2bm8 h TRP 171 N -0.09 1.08 -0.10 1.91 7.01 -0.82 -1.90 115.95 123.04 2bm8 h TRP 171 Ca -0.01 0.03 -0.22 0.00 2.11 0.00 0.00 58.89 60.80 2bm8 h TRP 171 Cb 0.07 -0.36 0.01 0.00 -2.10 0.00 0.00 29.16 26.78 2bm8 h TRP 171 CO -0.07 0.58 -0.81 0.00 -2.79 0.00 0.00 178.44 175.35 2bm8 h ALA 172 N 1.49 0.39 0.12 2.65 0.00 -0.15 -1.29 119.26 122.48 2bm8 h ALA 172 Ca 0.39 -0.63 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2bm8 h ALA 172 Cb 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2bm8 h ALA 172 CO -0.14 0.72 -0.06 0.28 0.00 0.00 0.00 179.25 180.06 2bm8 h VAL 173 N 0.41 1.05 -0.05 0.00 2.07 -0.29 0.50 116.25 119.93 2bm8 h VAL 173 Ca -0.06 -0.80 -0.21 0.00 0.82 0.00 0.00 66.70 66.46 2bm8 h VAL 173 Cb 1.43 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.74 2bm8 h VAL 173 CO 0.15 0.19 -0.82 0.44 0.02 0.00 0.00 177.57 177.55 2bm8 h ASP 174 N -0.55 0.55 -0.04 0.57 3.32 -1.42 -3.38 116.42 115.48 2bm8 h ASP 174 Ca -0.02 -0.40 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2bm8 h ASP 174 Cb 0.43 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2bm8 h ASP 174 CO 0.03 1.17 0.00 1.41 -1.72 0.00 0.00 179.24 180.12 2bm8 n HIS 175 N -3.81 0.05 0.00 4.55 8.25 -0.49 -4.92 115.22 118.86 2bm8 n HIS 175 Ca -0.06 -0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.26 2bm8 n HIS 175 Cb 0.76 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.86 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 0.12 0.00 -4.68 2.41 7.94 -0.64 -4.86 117.00 117.30 2bm8 n LEU 176 Ca 0.03 0.00 -0.43 0.00 -1.11 0.00 0.00 56.01 54.50 2bm8 n LEU 176 Cb 0.17 0.16 -0.02 0.00 0.53 0.00 0.00 43.42 44.25 2bm8 n LEU 176 CO 0.03 -0.47 0.85 -0.76 -1.11 0.00 0.00 177.39 175.92 2bm8 s LEU 177 N -4.89 4.19 0.43 -1.96 1.43 0.17 -5.02 118.68 113.03 2bm8 s LEU 177 Ca 0.00 1.47 0.03 0.00 -1.03 0.00 0.00 54.13 54.61 2bm8 s LEU 177 Cb 0.00 -3.55 0.01 0.00 0.03 0.00 0.00 46.19 42.68 2bm8 s LEU 177 CO 0.00 -0.54 0.62 -1.61 0.23 0.00 0.00 176.35 175.05 2bm8 s GLU 178 N 2.51 2.93 0.21 1.70 2.02 -1.26 -4.89 118.70 121.92 2bm8 s GLU 178 Ca 0.47 -0.81 -0.32 0.00 0.02 0.00 0.00 54.97 54.32 2bm8 s GLU 178 Cb -0.17 -2.65 -0.14 0.00 0.10 0.00 0.00 34.13 31.27 2bm8 s GLU 178 CO 0.13 -0.27 1.38 -1.91 0.02 0.00 0.00 175.26 174.61 2bm8 n GLU 179 N -1.98 1.85 0.00 1.61 2.13 -1.26 -1.65 120.64 121.34 2bm8 n GLU 179 Ca 0.03 0.66 0.00 0.00 0.66 0.00 0.00 57.16 58.51 2bm8 n GLU 179 Cb 0.58 -2.30 0.00 0.00 0.27 0.00 0.00 31.44 29.99 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 2.33 2.70 3.78 8.31 0.00 -0.87 -4.99 105.19 116.45 2bm8 n GLY 180 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.49 5.66 -0.04 1.61 1.01 -0.66 -4.68 116.67 118.09 2bm8 s ASP 181 Ca 0.00 2.02 0.02 0.00 0.71 0.00 0.00 52.55 55.30 2bm8 s ASP 181 Cb 0.00 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.34 2bm8 s ASP 181 CO 0.00 -1.25 -0.07 -0.31 0.21 0.00 0.00 175.17 173.75 2bm8 s TYR 182 N -2.09 2.92 -0.18 4.23 1.51 -0.80 -0.19 117.35 122.75 2bm8 s TYR 182 Ca 0.68 -0.00 0.00 0.00 -1.01 0.00 0.00 57.07 56.75 2bm8 s TYR 182 Cb -0.20 -1.67 0.04 0.00 -0.11 0.00 0.00 41.96 40.02 2bm8 s TYR 182 CO 0.32 0.35 -0.09 0.12 -1.11 0.00 0.00 175.55 175.14 2bm8 s PHE 183 N -0.90 2.13 -0.12 2.71 5.36 0.50 -0.45 117.98 127.22 2bm8 s PHE 183 Ca 0.15 -1.35 0.02 0.00 -0.96 0.00 0.00 56.93 54.78 2bm8 s PHE 183 Cb -0.11 -1.52 0.01 0.00 -0.34 0.00 0.00 43.02 41.06 2bm8 s PHE 183 CO 0.04 -0.69 -0.18 0.42 -1.46 0.00 0.00 175.22 173.36 2bm8 s ILE 184 N 1.49 1.71 -0.33 3.12 1.01 0.04 -1.38 121.20 126.86 2bm8 s ILE 184 Ca 0.01 -0.77 -0.10 0.00 0.00 0.00 0.00 60.65 59.78 2bm8 s ILE 184 Cb -0.15 -1.54 0.00 0.00 0.01 0.00 0.00 42.46 40.77 2bm8 s ILE 184 CO -0.08 0.48 0.17 -0.63 0.00 0.00 0.00 174.94 174.88 2bm8 s ILE 185 N 0.95 4.66 0.10 2.92 1.01 -0.95 -0.33 121.20 129.56 2bm8 s ILE 185 Ca -0.06 -0.52 -0.24 0.00 0.00 0.00 0.00 60.65 59.83 2bm8 s ILE 185 Cb -0.15 -3.43 -0.07 0.00 0.01 0.00 0.00 42.46 38.82 2bm8 s ILE 185 CO -0.02 -0.02 0.73 -1.61 0.00 0.00 0.00 174.94 174.02 2bm8 s GLU 186 N 1.61 4.48 0.00 2.79 2.02 -1.04 -4.52 118.70 124.04 2bm8 s GLU 186 Ca 0.04 1.04 0.00 0.00 0.02 0.00 0.00 54.97 56.07 2bm8 s GLU 186 Cb -0.18 -3.30 0.00 0.00 0.10 0.00 0.00 34.13 30.76 2bm8 s GLU 186 CO 0.07 0.47 0.00 -0.25 0.02 0.00 0.00 175.26 175.57 2bm8 n ASP 187 N 2.09 0.00 0.03 -0.19 8.00 0.27 -4.64 116.55 122.12 2bm8 n ASP 187 Ca -0.05 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.56 2bm8 n ASP 187 Cb 0.50 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.62 2bm8 n ASP 187 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 2bm8 n MET 188 N 0.00 0.34 0.01 -1.24 1.56 -1.26 -4.27 117.12 112.26 2bm8 n MET 188 Ca 0.00 0.00 -0.12 0.00 -0.27 0.00 0.00 57.70 57.31 2bm8 n MET 188 Cb 0.00 -1.62 -0.08 0.00 2.15 0.00 0.00 33.22 33.67 2bm8 n MET 188 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 2bm8 h ILE 189 N 0.00 1.17 -0.74 1.12 2.04 -1.84 -1.82 117.51 117.44 2bm8 h ILE 189 Ca 0.00 -0.49 0.17 0.00 1.00 0.00 0.00 64.86 65.54 2bm8 h ILE 189 Cb 0.77 1.44 -0.04 0.00 -0.74 0.00 0.00 36.82 38.26 2bm8 h ILE 189 CO 0.00 0.13 0.51 -0.65 0.00 0.00 0.00 178.15 178.14 2bm8 h PRO 190 N -0.15 0.24 -0.06 2.37 0.11 -1.83 -1.88 132.00 130.80 2bm8 h PRO 190 Ca 0.01 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.94 2bm8 h PRO 190 Cb 0.21 -0.05 0.01 0.00 0.11 0.00 0.00 31.00 31.27 2bm8 h PRO 190 CO -0.00 0.16 -0.60 1.88 -0.21 0.00 0.00 178.00 179.23 2bm8 h TYR 191 N 0.25 0.72 -0.94 0.65 -1.99 -1.66 -2.13 116.97 111.87 2bm8 h TYR 191 Ca 0.36 -0.35 0.01 0.00 2.00 0.00 0.00 58.73 60.75 2bm8 h TYR 191 Cb 1.06 -0.10 -0.05 0.00 2.00 0.00 0.00 36.73 39.65 2bm8 h TYR 191 CO -0.00 1.15 0.62 -1.49 -0.00 0.00 0.00 178.16 178.44 2bm8 h TRP 192 N 0.09 1.19 -0.06 4.88 6.55 -0.83 -1.32 115.95 126.44 2bm8 h TRP 192 Ca -0.06 0.02 -0.12 0.00 0.95 0.00 0.00 58.89 59.68 2bm8 h TRP 192 Cb 1.27 -0.40 -0.01 0.00 -0.86 0.00 0.00 29.16 29.15 2bm8 h TRP 192 CO 0.12 0.75 -0.53 -0.92 -1.05 0.00 0.00 178.44 176.82 2bm8 h TYR 193 N 1.28 0.19 -0.21 0.49 3.20 -1.39 0.67 116.97 121.20 2bm8 h TYR 193 Ca 0.34 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 2bm8 h TYR 193 Cb -0.14 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 2bm8 h TYR 193 CO 0.00 0.65 0.00 -0.09 -1.64 0.00 0.00 178.16 177.09 2bm8 h ARG 194 N 0.12 0.37 0.14 1.82 9.65 -0.64 -3.16 114.38 122.68 2bm8 h ARG 194 Ca 0.00 -0.12 -0.34 0.00 -1.10 0.00 0.00 59.98 58.42 2bm8 h ARG 194 Cb 0.98 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.52 2bm8 h ARG 194 CO 0.08 0.56 -1.78 1.88 2.80 0.00 0.00 179.97 183.51 2bm8 h TYR 195 N 0.13 0.55 -2.13 2.20 0.99 -1.22 -3.41 116.97 114.09 2bm8 h TYR 195 Ca 0.06 -0.40 -0.57 0.00 2.00 0.00 0.00 58.73 59.82 2bm8 h TYR 195 Cb 0.39 -0.02 -0.41 0.00 1.00 0.00 0.00 36.73 37.69 2bm8 h TYR 195 CO 0.03 1.70 -0.84 0.00 -0.00 0.00 0.00 178.16 179.05 2bm8 n ALA 196 N -2.96 3.44 -0.16 3.88 0.00 0.22 -4.98 120.51 119.95 2bm8 n ALA 196 Ca -0.28 -4.17 -0.09 0.00 0.00 0.00 0.00 53.44 48.90 2bm8 n ALA 196 Cb 1.02 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.63 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 3.65 0.72 -0.27 0.00 0.13 -1.66 -1.52 132.00 133.05 2bm8 h PRO 197 Ca 0.13 -0.15 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 2bm8 h PRO 197 Cb 0.73 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 2bm8 h PRO 197 CO 0.68 0.67 0.07 1.96 -0.23 0.00 0.00 178.00 181.15 2bm8 h GLN 198 N 0.62 0.43 -0.03 0.86 4.20 -1.93 -1.79 115.11 117.45 2bm8 h GLN 198 Ca 0.15 -0.10 -0.15 0.00 0.06 0.00 0.00 58.65 58.61 2bm8 h GLN 198 Cb 0.24 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2bm8 h GLN 198 CO -0.01 0.52 -0.66 -0.07 -0.67 0.00 0.00 178.83 177.94 2bm8 h LEU 199 N 0.26 0.18 -0.06 1.46 3.38 -1.95 -1.94 115.31 116.63 2bm8 h LEU 199 Ca 0.08 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2bm8 h LEU 199 Cb 0.28 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2bm8 h LEU 199 CO 0.00 0.79 -0.26 0.15 0.09 0.00 0.00 178.44 179.20 2bm8 h PHE 200 N 0.11 0.38 -0.88 1.13 3.57 -1.25 -1.44 116.94 118.55 2bm8 h PHE 200 Ca -0.01 -0.16 0.06 0.00 3.53 0.00 0.00 57.97 61.39 2bm8 h PHE 200 Cb 1.18 -0.06 -0.06 0.00 2.79 0.00 0.00 35.95 39.80 2bm8 h PHE 200 CO 0.02 0.89 0.55 0.77 -2.23 0.00 0.00 178.31 178.30 2bm8 h SER 201 N -0.24 0.87 -0.47 0.41 0.02 -1.31 -0.69 113.55 112.15 2bm8 h SER 201 Ca -0.02 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.87 2bm8 h SER 201 Cb 0.91 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 2bm8 h SER 201 CO 0.05 0.56 0.00 -0.08 -1.14 0.00 0.00 176.83 176.23 2bm8 h GLU 202 N 1.01 0.82 -0.07 3.45 4.81 -1.29 -1.78 114.58 121.54 2bm8 h GLU 202 Ca 0.38 -0.26 -0.04 0.00 -0.13 0.00 0.00 59.36 59.31 2bm8 h GLU 202 Cb 0.16 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.46 2bm8 h GLU 202 CO -0.17 0.87 -0.11 1.88 -0.73 0.00 0.00 179.01 180.76 2bm8 h TYR 203 N 0.68 0.23 -0.34 0.92 0.99 -0.93 -2.81 116.97 115.71 2bm8 h TYR 203 Ca 0.13 -0.08 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 2bm8 h TYR 203 Cb 0.50 -0.05 -0.02 0.00 1.00 0.00 0.00 36.73 38.17 2bm8 h TYR 203 CO 0.04 0.69 0.17 1.25 -0.00 0.00 0.00 178.16 180.31 2bm8 h LEU 204 N -0.29 0.43 -2.72 3.88 6.46 -1.16 -2.47 115.31 119.44 2bm8 h LEU 204 Ca 0.01 -0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 57.65 2bm8 h LEU 204 Cb 0.67 -0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 40.48 2bm8 h LEU 204 CO 0.02 0.42 -0.00 1.23 -0.62 0.00 0.00 178.44 179.49 2bm8 h GLY 205 N 0.41 0.00 2.00 3.75 0.00 -1.35 -1.57 103.07 106.31 2bm8 h GLY 205 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.45 2bm8 h GLY 205 CO -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 176.54 176.52 2bm8 h ALA 206 N 2.00 1.02 -0.53 3.60 0.00 -1.16 -2.40 119.26 121.79 2bm8 h ALA 206 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bm8 h ALA 206 Cb 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2bm8 h ALA 206 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.45 2bm8 n PHE 207 N -3.11 1.87 0.30 0.00 3.01 -0.59 -4.68 117.46 114.26 2bm8 n PHE 207 Ca -0.02 -0.75 0.18 0.00 1.01 0.00 0.00 57.45 57.88 2bm8 n PHE 207 Cb 0.15 -0.47 1.00 0.00 -0.01 0.00 0.00 39.48 40.15 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 3.65 0.00 -0.00 -1.08 0.11 -1.57 -1.15 114.38 114.34 2bm8 h ARG 208 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2bm8 h ARG 208 Cb 1.87 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.95 2bm8 h ARG 208 CO 0.44 0.00 -0.87 -0.25 0.10 0.00 0.00 179.97 179.39 2bm8 n ASP 209 N -3.49 0.93 0.00 0.08 8.00 -1.26 -4.53 116.55 116.28 2bm8 n ASP 209 Ca -0.02 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.63 2bm8 n ASP 209 Cb 0.16 0.81 0.00 0.00 -0.02 0.00 0.00 41.12 42.07 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 -1.44 0.00 -4.08 2.53 0.24 -1.00 -4.80 118.33 109.78 2bm8 n VAL 210 Ca 0.05 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.21 2bm8 n VAL 210 Cb 0.34 0.23 -0.12 0.00 -1.47 0.00 0.00 33.84 32.82 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 -2.84 2.20 0.05 1.34 1.43 -0.47 -2.30 118.68 118.09 2bm8 s LEU 211 Ca 0.00 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.67 2bm8 s LEU 211 Cb 0.00 -0.18 -0.03 0.00 0.03 0.00 0.00 46.19 46.01 2bm8 s LEU 211 CO 0.00 -0.15 -0.08 -0.94 0.23 0.00 0.00 176.35 175.42 2bm8 s SER 212 N -1.27 0.87 -0.20 2.29 1.04 -0.65 -4.45 113.70 111.33 2bm8 s SER 212 Ca -0.07 -0.58 -0.27 0.00 0.48 0.00 0.00 55.95 55.51 2bm8 s SER 212 Cb -0.08 0.04 -0.00 0.00 0.10 0.00 0.00 66.02 66.07 2bm8 s SER 212 CO 0.00 -0.22 0.93 -0.32 0.98 0.00 0.00 173.24 174.61 2bm8 s MET 213 N -1.73 4.28 -0.85 4.02 1.75 -1.26 -1.16 119.30 124.35 2bm8 s MET 213 Ca -0.09 1.18 -0.25 0.00 -1.25 0.00 0.00 55.69 55.28 2bm8 s MET 213 Cb -0.09 -3.61 0.02 0.00 2.84 0.00 0.00 34.83 33.99 2bm8 s MET 213 CO 0.00 -0.47 1.53 0.34 -0.65 0.00 0.00 175.02 175.76 2bm8 s ASP 214 N 1.20 6.01 0.17 1.11 -1.08 -0.22 -4.89 116.67 118.98 2bm8 s ASP 214 Ca 0.41 -0.75 0.15 0.00 -0.52 0.00 0.00 52.55 51.84 2bm8 s ASP 214 Cb -0.16 -2.56 0.74 0.00 -1.46 0.00 0.00 42.92 39.48 2bm8 s ASP 214 CO 0.10 -1.93 1.47 0.23 0.52 0.00 0.00 175.17 175.56 2bm8 n MET 215 N 9.09 0.09 -0.03 4.34 2.81 -1.26 -1.52 117.12 130.64 2bm8 n MET 215 Ca 0.22 0.49 -0.06 0.00 -1.81 0.00 0.00 57.70 56.55 2bm8 n MET 215 Cb 0.50 -1.75 0.14 0.00 -0.71 0.00 0.00 33.22 31.39 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 0.62 0.00 4.03 5.85 -1.98 -3.37 115.31 120.46 2bm8 h LEU 216 Ca 0.00 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.45 2bm8 h LEU 216 Cb 0.12 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 2bm8 h LEU 216 CO 0.00 0.88 -1.53 -1.22 -0.34 0.00 0.00 178.44 176.22 2bm8 n TYR 217 N -4.10 0.00 0.25 1.25 0.53 -0.73 -4.73 117.16 109.63 2bm8 n TYR 217 Ca -0.00 0.00 0.12 0.00 -1.02 0.00 0.00 57.90 56.99 2bm8 n TYR 217 Cb 0.44 -0.30 0.61 0.00 -1.03 0.00 0.00 39.34 39.06 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 0.88 1.14 -0.52 -0.72 0.00 -1.44 -1.55 119.26 117.05 2bm8 h ALA 218 Ca -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2bm8 h ALA 218 Cb 0.73 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2bm8 h ALA 218 CO 0.00 0.21 0.00 0.09 0.00 0.00 0.00 179.25 179.55 2bm8 n ASN 219 N -3.49 3.86 -0.66 0.00 3.02 -1.26 -0.72 115.26 116.01 2bm8 n ASN 219 Ca -0.01 -2.27 0.13 0.00 -0.03 0.00 0.00 54.58 52.39 2bm8 n ASN 219 Cb 0.33 -0.44 0.23 0.00 -0.61 0.00 0.00 39.78 39.30 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 0.82 2.76 -3.33 5.41 0.00 -0.58 -4.93 120.51 120.66 2bm8 n ALA 220 Ca 0.20 -0.58 -0.14 0.00 0.00 0.00 0.00 53.44 52.92 2bm8 n ALA 220 Cb 0.68 -0.95 -0.05 0.00 0.00 0.00 0.00 19.45 19.13 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 -2.14 -0.47 0.29 0.00 1.04 -1.26 -4.78 113.70 106.37 2bm8 s SER 221 Ca 0.29 0.18 0.14 0.00 0.48 0.00 0.00 55.95 57.04 2bm8 s SER 221 Cb 0.20 0.51 0.37 0.00 0.10 0.00 0.00 66.02 67.20 2bm8 s SER 221 CO 0.38 -0.75 1.59 0.77 0.98 0.00 0.00 173.24 176.21 2bm8 h SER 222 N 2.66 0.00 0.46 7.02 4.64 -1.95 -1.51 113.55 124.87 2bm8 h SER 222 Ca -0.31 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.80 2bm8 h SER 222 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 2bm8 h SER 222 CO 0.41 0.56 -0.89 1.56 -0.87 0.00 0.00 176.83 177.60 2bm8 h GLN 223 N 0.00 0.29 -0.01 4.77 4.20 -1.96 -3.23 115.11 119.17 2bm8 h GLN 223 Ca -0.01 -0.31 0.00 0.00 0.06 0.00 0.00 58.65 58.39 2bm8 h GLN 223 Cb 1.15 0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.02 2bm8 h GLN 223 CO 0.07 1.01 -0.29 1.28 -0.67 0.00 0.00 178.83 180.23 2bm8 n LEU 224 N -3.71 1.73 -4.64 1.46 4.77 -1.19 -0.56 117.00 114.86 2bm8 n LEU 224 Ca -0.05 -0.58 -0.64 0.00 -0.03 0.00 0.00 56.01 54.71 2bm8 n LEU 224 Cb 0.81 -0.04 -0.09 0.00 -2.33 0.00 0.00 43.42 41.76 2bm8 n LEU 224 CO 0.49 0.31 0.89 -0.67 -1.33 0.00 0.00 177.39 177.09 2bm8 n ASP 225 N -0.07 0.69 -1.83 -1.43 2.03 -0.57 -1.22 116.55 114.16 2bm8 n ASP 225 Ca 0.12 1.17 -0.07 0.00 0.52 0.00 0.00 54.79 56.53 2bm8 n ASP 225 Cb 0.43 -0.90 -0.02 0.00 -0.72 0.00 0.00 41.12 39.91 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 2.90 -1.83 0.00 -0.67 1.74 0.10 -4.66 116.66 114.23 2bm8 n ARG 226 Ca 0.26 0.40 0.00 0.00 -0.77 0.00 0.00 57.85 57.74 2bm8 n ARG 226 Cb 0.01 -4.75 0.00 0.00 -1.02 0.00 0.00 32.46 26.70 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 -0.40 -0.82 3.48 -0.13 0.00 -0.36 -4.94 105.19 102.02 2bm8 n GLY 227 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.11 4.16 0.14 1.61 1.01 -1.24 -2.23 120.40 123.73 2bm8 s VAL 228 Ca 0.00 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 61.80 2bm8 s VAL 228 Cb 0.00 -4.77 -0.04 0.00 0.00 0.00 0.00 36.38 31.57 2bm8 s VAL 228 CO 0.00 -1.59 0.08 -0.76 0.00 0.00 0.00 175.10 172.83 2bm8 s LEU 229 N 4.49 3.67 0.14 3.92 1.43 -0.48 -1.06 118.68 130.81 2bm8 s LEU 229 Ca 0.27 -0.15 -0.13 0.00 -1.03 0.00 0.00 54.13 53.09 2bm8 s LEU 229 Cb -0.13 -2.32 0.01 0.00 0.03 0.00 0.00 46.19 43.78 2bm8 s LEU 229 CO 0.10 0.11 0.36 0.00 0.23 0.00 0.00 176.35 177.14 2bm8 s ARG 230 N -2.80 1.12 -0.41 1.70 1.70 -0.31 -0.37 118.95 119.57 2bm8 s ARG 230 Ca 0.29 -0.91 -0.28 0.00 -0.47 0.00 0.00 55.73 54.35 2bm8 s ARG 230 Cb -0.11 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.71 2bm8 s ARG 230 CO 0.22 -0.43 1.55 1.03 -1.08 0.00 0.00 175.30 176.59 2bm8 s ARG 231 N -3.87 3.43 0.10 3.89 1.81 0.73 -1.64 118.95 123.40 2bm8 s ARG 231 Ca 0.08 1.02 -0.08 0.00 -1.72 0.00 0.00 55.73 55.03 2bm8 s ARG 231 Cb 0.02 -4.11 -0.06 0.00 -0.45 0.00 0.00 34.95 30.36 2bm8 s ARG 231 CO -0.07 -1.75 0.40 0.08 -0.68 0.00 0.00 175.30 173.28 2bm8 s VAL 232 N 6.12 5.11 0.00 3.52 1.01 -0.97 -2.06 120.40 133.13 2bm8 s VAL 232 Ca 0.66 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.97 2bm8 s VAL 232 Cb -0.16 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.59 2bm8 s VAL 232 CO 0.32 0.20 0.00 0.00 0.00 0.00 0.00 175.10 175.62