#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bm8 n ASP 3 N 0.00 3.16 -1.54 1.20 8.00 -1.26 -4.36 116.55 121.74 2bm8 n ASP 3 Ca 0.00 -1.93 -0.03 0.00 0.71 0.00 0.00 54.79 53.55 2bm8 n ASP 3 Cb 0.00 -0.18 0.21 0.00 -0.02 0.00 0.00 41.12 41.14 2bm8 n ASP 3 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2bm8 n TYR 4 N 1.28 1.58 0.00 1.24 0.18 -1.26 -4.88 117.16 115.30 2bm8 n TYR 4 Ca 0.16 -0.79 0.00 0.00 1.88 0.00 0.00 57.90 59.16 2bm8 n TYR 4 Cb 0.55 -0.49 0.00 0.00 -0.38 0.00 0.00 39.34 39.02 2bm8 n TYR 4 CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 2bm8 n SER 5 N 0.06 0.00 -3.66 9.48 7.64 -1.26 -4.19 113.62 121.69 2bm8 n SER 5 Ca 0.25 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.77 2bm8 n SER 5 Cb 1.01 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 64.18 2bm8 n SER 5 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2bm8 n ARG 6 N 0.00 3.83 -4.88 1.43 1.74 -1.26 -5.00 116.66 112.52 2bm8 n ARG 6 Ca 0.00 -4.64 -0.33 0.00 -0.77 0.00 0.00 57.85 52.11 2bm8 n ARG 6 Cb 0.00 -2.40 -0.15 0.00 -1.02 0.00 0.00 32.46 28.89 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 -2.95 3.27 -0.59 5.56 0.74 -1.26 -5.08 119.66 119.36 2bm8 s GLN 7 Ca 0.37 -0.75 -0.21 0.00 0.05 0.00 0.00 55.36 54.82 2bm8 s GLN 7 Cb 0.12 -2.53 0.07 0.00 1.10 0.00 0.00 33.01 31.77 2bm8 s GLN 7 CO 0.02 0.19 0.80 1.21 -0.55 0.00 0.00 175.29 176.95 2bm8 s ASN 8 N 0.39 6.21 0.05 6.67 3.04 -1.26 -5.03 114.94 125.01 2bm8 s ASN 8 Ca -0.13 -1.04 -0.31 0.00 0.04 0.00 0.00 52.86 51.42 2bm8 s ASN 8 Cb -0.16 -2.35 -0.06 0.00 -1.54 0.00 0.00 41.25 37.13 2bm8 s ASN 8 CO 0.06 -1.18 1.36 -0.36 -3.04 0.00 0.00 177.10 173.94 2bm8 s PHE 9 N 3.26 3.10 0.83 0.43 0.40 -1.26 -5.02 117.98 119.72 2bm8 s PHE 9 Ca 0.18 0.96 -0.11 0.00 -0.60 0.00 0.00 56.93 57.36 2bm8 s PHE 9 Cb -0.19 -3.63 0.09 0.00 0.51 0.00 0.00 43.02 39.80 2bm8 s PHE 9 CO 0.10 -2.21 1.12 -0.65 0.70 0.00 0.00 175.22 174.28 2bm8 s GLN 10 N 1.68 1.77 -0.38 0.44 -0.21 -1.26 -4.97 119.66 116.73 2bm8 s GLN 10 Ca 0.63 1.34 -0.23 0.00 0.02 0.00 0.00 55.36 57.12 2bm8 s GLN 10 Cb -0.33 -1.83 0.01 0.00 1.00 0.00 0.00 33.01 31.86 2bm8 s GLN 10 CO 0.28 -2.04 0.79 0.34 -2.12 0.00 0.00 175.29 172.55 2bm8 s ASP 11 N -3.05 6.53 0.11 5.90 -1.08 -1.26 -4.92 116.67 118.89 2bm8 s ASP 11 Ca 0.64 0.28 0.17 0.00 -0.52 0.00 0.00 52.55 53.12 2bm8 s ASP 11 Cb -0.20 -2.40 0.72 0.00 -1.46 0.00 0.00 42.92 39.59 2bm8 s ASP 11 CO 0.56 -0.77 1.52 0.18 0.52 0.00 0.00 175.17 177.18 2bm8 n LEU 12 N 6.49 0.26 0.21 -1.34 4.32 -1.26 -2.72 117.00 122.97 2bm8 n LEU 12 Ca 0.03 0.57 0.05 0.00 -0.02 0.00 0.00 56.01 56.64 2bm8 n LEU 12 Cb 0.48 -0.54 0.48 0.00 -1.62 0.00 0.00 43.42 42.22 2bm8 n LEU 12 CO 0.55 -0.42 0.89 0.78 -1.22 0.00 0.00 177.39 177.97 2bm8 h ASN 13 N 0.00 0.02 -0.48 -1.43 2.35 -2.01 -2.68 115.58 111.35 2bm8 h ASN 13 Ca 0.00 -0.00 0.14 0.00 -0.55 0.00 0.00 56.30 55.88 2bm8 h ASN 13 Cb 0.25 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.60 2bm8 h ASN 13 CO 0.00 0.21 0.35 -0.07 -1.65 0.00 0.00 177.43 176.27 2bm8 h LEU 14 N 0.02 0.02 -2.25 1.61 4.07 -1.94 -2.67 115.31 114.16 2bm8 h LEU 14 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2bm8 h LEU 14 Cb 0.35 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.08 2bm8 h LEU 14 CO 0.02 0.01 0.00 0.49 -1.08 0.00 0.00 178.44 177.88 2bm8 n PHE 15 N -4.40 1.04 -2.21 1.13 0.99 -1.01 -4.89 117.46 108.11 2bm8 n PHE 15 Ca 0.09 -0.40 -0.43 0.00 -0.00 0.00 0.00 57.45 56.71 2bm8 n PHE 15 Cb 0.55 -0.21 -0.02 0.00 -1.00 0.00 0.00 39.48 38.79 2bm8 n PHE 15 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.76 177.26 2bm8 s ARG 16 N -1.81 4.21 0.00 -1.08 3.52 -1.01 -1.84 118.95 120.95 2bm8 s ARG 16 Ca 0.33 1.94 0.00 0.00 -0.13 0.00 0.00 55.73 57.87 2bm8 s ARG 16 Cb 0.22 -3.86 0.00 0.00 -1.56 0.00 0.00 34.95 29.76 2bm8 s ARG 16 CO 0.15 -0.76 0.00 0.41 -0.81 0.00 0.00 175.30 174.28 2bm8 n GLY 17 N 3.86 0.38 1.30 8.12 0.00 -1.26 -4.77 105.19 112.83 2bm8 n GLY 17 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 0.53 0.00 0.99 4.77 -1.12 -5.09 117.00 117.08 2bm8 n LEU 18 Ca 0.00 0.17 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 2bm8 n LEU 18 Cb 0.14 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2bm8 n LEU 18 CO 0.00 -0.58 0.00 0.61 -1.33 0.00 0.00 177.39 176.09 2bm8 n GLY 19 N 2.84 1.00 0.16 -0.72 0.00 -0.76 -4.82 105.19 102.88 2bm8 n GLY 19 Ca 0.00 -2.18 0.04 0.00 0.00 0.00 0.00 46.02 43.88 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 0.00 -3.10 1.61 5.08 -1.98 -3.43 114.58 112.76 2bm8 h GLU 20 Ca 0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.99 2bm8 h GLU 20 Cb 0.00 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 28.87 2bm8 h GLU 20 CO 0.00 0.43 -0.70 0.34 -1.00 0.00 0.00 179.01 178.08 2bm8 s ASP 21 N -6.42 1.35 0.50 1.42 -1.08 -1.26 -5.02 116.67 106.16 2bm8 s ASP 21 Ca 0.04 -0.05 0.27 0.00 -0.52 0.00 0.00 52.55 52.29 2bm8 s ASP 21 Cb 0.08 0.01 1.29 0.00 -1.46 0.00 0.00 42.92 42.83 2bm8 s ASP 21 CO 0.73 -0.28 1.99 1.55 0.52 0.00 0.00 175.17 179.67 2bm8 h PRO 22 N 8.40 0.00 -7.06 4.34 0.13 -1.90 -3.43 132.00 132.47 2bm8 h PRO 22 Ca -0.14 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.50 2bm8 h PRO 22 Cb 1.13 0.00 0.06 0.00 0.13 0.00 0.00 31.00 32.32 2bm8 h PRO 22 CO 0.20 0.14 0.43 0.00 -0.23 0.00 0.00 178.00 178.54 2bm8 s ALA 23 N -3.94 2.80 -0.10 -0.56 0.00 -1.26 -4.42 121.76 114.28 2bm8 s ALA 23 Ca -0.01 0.78 -0.21 0.00 0.00 0.00 0.00 51.96 52.52 2bm8 s ALA 23 Cb 0.12 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 2bm8 s ALA 23 CO 0.59 -0.62 0.60 -0.47 0.00 0.00 0.00 175.76 175.86 2bm8 s TYR 24 N -1.78 3.54 -0.06 0.00 5.04 -1.26 -4.88 117.35 117.95 2bm8 s TYR 24 Ca 0.69 1.07 0.02 0.00 -2.44 0.00 0.00 57.07 56.42 2bm8 s TYR 24 Cb -0.23 -2.69 0.01 0.00 0.35 0.00 0.00 41.96 39.40 2bm8 s TYR 24 CO 0.26 0.11 -0.12 -1.01 -1.34 0.00 0.00 175.55 173.45 2bm8 s HIS 25 N 0.79 1.37 0.66 4.97 3.76 -1.26 -5.01 115.29 120.57 2bm8 s HIS 25 Ca 0.32 -0.48 -0.17 0.00 -0.15 0.00 0.00 55.06 54.57 2bm8 s HIS 25 Cb -0.16 -1.01 -0.04 0.00 1.11 0.00 0.00 32.58 32.47 2bm8 s HIS 25 CO 0.14 -0.25 0.73 -2.30 -0.85 0.00 0.00 174.74 172.21 2bm8 n PRO 26 N 3.77 0.54 -2.08 8.40 -0.02 -1.26 -4.96 135.00 139.39 2bm8 n PRO 26 Ca -0.23 0.23 -0.37 0.00 -2.02 0.00 0.00 63.50 61.11 2bm8 n PRO 26 Cb 0.52 -1.97 0.01 0.00 -0.02 0.00 0.00 33.50 32.04 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 -2.74 3.45 -0.04 0.52 0.04 -1.26 -5.04 135.00 129.93 2bm8 s PRO 27 Ca 0.71 1.91 0.06 0.00 0.04 0.00 0.00 61.00 63.72 2bm8 s PRO 27 Cb -0.39 -2.28 -0.01 0.00 0.04 0.00 0.00 34.50 31.87 2bm8 s PRO 27 CO 0.52 -0.85 -0.22 0.08 0.04 0.00 0.00 177.00 176.58 2bm8 s VAL 28 N -1.49 1.75 0.35 -0.36 1.01 -1.26 -5.13 120.40 115.27 2bm8 s VAL 28 Ca 0.68 -0.92 -0.26 0.00 0.00 0.00 0.00 61.98 61.48 2bm8 s VAL 28 Cb -0.32 -1.47 -0.09 0.00 0.00 0.00 0.00 36.38 34.50 2bm8 s VAL 28 CO 0.38 0.49 1.06 -0.76 0.00 0.00 0.00 175.10 176.28 2bm8 s LEU 29 N -0.27 4.30 0.00 3.92 2.01 -1.26 -4.88 118.68 122.50 2bm8 s LEU 29 Ca 0.02 2.12 -0.00 0.00 0.01 0.00 0.00 54.13 56.27 2bm8 s LEU 29 Cb -0.11 -3.97 -0.00 0.00 0.01 0.00 0.00 46.19 42.12 2bm8 s LEU 29 CO 0.01 -0.35 -0.01 0.41 1.01 0.00 0.00 176.35 177.42 2bm8 n THR 30 N 0.41 0.14 0.95 5.49 -1.04 -1.26 -4.81 114.28 114.16 2bm8 n THR 30 Ca 0.03 0.03 0.11 0.00 -2.04 0.00 0.00 64.05 62.17 2bm8 n THR 30 Cb 0.48 -1.52 0.31 0.00 -1.82 0.00 0.00 70.33 67.78 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 -3.07 2.21 -3.83 8.00 5.75 -1.26 -4.94 116.55 119.40 2bm8 n ASP 31 Ca -0.01 -1.81 -0.09 0.00 -0.01 0.00 0.00 54.79 52.87 2bm8 n ASP 31 Cb 0.47 -0.15 -0.07 0.00 -1.03 0.00 0.00 41.12 40.33 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 -1.70 0.86 0.38 0.11 1.04 -1.26 -5.14 118.95 113.24 2bm8 s ARG 32 Ca 0.34 -0.93 -0.26 0.00 -1.04 0.00 0.00 55.73 53.84 2bm8 s ARG 32 Cb 0.19 0.35 -0.09 0.00 -2.04 0.00 0.00 34.95 33.36 2bm8 s ARG 32 CO 0.27 -0.28 1.14 -1.25 -0.04 0.00 0.00 175.30 175.15 2bm8 s PRO 33 N -3.82 4.19 0.30 3.89 0.04 -1.26 -4.88 135.00 133.45 2bm8 s PRO 33 Ca 0.04 1.79 0.03 0.00 0.04 0.00 0.00 61.00 62.90 2bm8 s PRO 33 Cb 0.04 -2.76 0.48 0.00 0.04 0.00 0.00 34.50 32.31 2bm8 s PRO 33 CO -0.11 -0.19 1.79 -0.09 0.04 0.00 0.00 177.00 178.44 2bm8 h ARG 34 N 2.85 0.52 -3.61 4.56 2.43 -2.01 -3.37 114.38 115.75 2bm8 h ARG 34 Ca -0.48 -0.15 -0.77 0.00 -0.81 0.00 0.00 59.98 57.76 2bm8 h ARG 34 Cb 1.23 -0.05 -0.29 0.00 -0.42 0.00 0.00 29.97 30.43 2bm8 h ARG 34 CO 0.63 0.64 0.16 -0.51 -1.51 0.00 0.00 179.97 179.39 2bm8 s ASP 35 N -6.77 6.71 0.13 -3.80 1.01 -1.26 -5.04 116.67 107.64 2bm8 s ASP 35 Ca -0.07 -3.25 -0.30 0.00 0.71 0.00 0.00 52.55 49.64 2bm8 s ASP 35 Cb 0.14 -2.12 -0.07 0.00 1.01 0.00 0.00 42.92 41.88 2bm8 s ASP 35 CO 0.78 -0.37 1.23 0.86 0.21 0.00 0.00 175.17 177.88 2bm8 s TRP 36 N -0.69 3.40 0.26 4.23 -0.11 -1.26 -5.00 118.94 119.78 2bm8 s TRP 36 Ca 0.25 1.30 -0.29 0.00 1.22 0.00 0.00 56.10 58.57 2bm8 s TRP 36 Cb -0.11 -3.47 -0.09 0.00 -1.50 0.00 0.00 33.47 28.30 2bm8 s TRP 36 CO -0.09 -1.43 1.20 -1.25 -4.62 0.00 0.00 176.95 170.77 2bm8 s PRO 37 N 0.44 4.50 0.48 5.86 0.04 -1.26 -4.95 135.00 140.11 2bm8 s PRO 37 Ca 0.57 1.96 0.27 0.00 0.04 0.00 0.00 61.00 63.84 2bm8 s PRO 37 Cb -0.32 -3.17 0.74 0.00 0.04 0.00 0.00 34.50 31.79 2bm8 s PRO 37 CO 0.33 -0.02 1.75 -0.07 0.04 0.00 0.00 177.00 179.03 2bm8 h LEU 38 N 4.19 0.00 -1.27 -3.56 4.07 -1.98 -2.40 115.31 114.36 2bm8 h LEU 38 Ca -0.47 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.45 2bm8 h LEU 38 Cb 1.22 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.95 2bm8 h LEU 38 CO 0.69 0.02 -0.21 -2.24 -1.08 0.00 0.00 178.44 175.63 2bm8 h ASP 39 N 0.00 0.00 -0.40 -0.43 2.03 -2.04 -2.86 116.42 112.72 2bm8 h ASP 39 Ca -0.00 0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 56.25 2bm8 h ASP 39 Cb 0.82 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.29 2bm8 h ASP 39 CO 0.00 0.21 0.04 0.54 -1.03 0.00 0.00 179.24 179.00 2bm8 n ARG 40 N -3.44 3.33 -0.30 4.15 1.74 -0.92 -4.82 116.66 116.41 2bm8 n ARG 40 Ca -0.00 -2.98 0.15 0.00 -0.77 0.00 0.00 57.85 54.25 2bm8 n ARG 40 Cb 0.39 -1.99 0.40 0.00 -1.02 0.00 0.00 32.46 30.25 2bm8 n ARG 40 CO 0.00 0.00 0.00 2.35 -1.52 0.00 0.00 177.63 178.46 2bm8 h TRP 41 N 2.29 0.82 0.00 -1.55 7.01 -1.31 0.21 115.95 123.42 2bm8 h TRP 41 Ca 0.06 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.09 2bm8 h TRP 41 Cb 1.71 -0.25 0.00 0.00 -2.10 0.00 0.00 29.16 28.52 2bm8 h TRP 41 CO 0.79 0.22 0.00 0.00 -2.79 0.00 0.00 178.44 176.66 2bm8 h ALA 42 N 1.61 1.00 -0.00 2.65 0.00 -1.87 -3.04 119.26 119.60 2bm8 h ALA 42 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.42 2bm8 h ALA 42 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2bm8 h ALA 42 CO -0.26 0.00 -0.18 0.39 0.00 0.00 0.00 179.25 179.19 2bm8 n GLU 43 N -3.03 0.68 -2.30 0.00 1.02 0.06 -4.92 120.64 112.14 2bm8 n GLU 43 Ca 0.02 -0.31 -0.40 0.00 -0.02 0.00 0.00 57.16 56.45 2bm8 n GLU 43 Cb 0.37 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.26 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 -2.53 3.42 0.74 0.62 0.00 -1.15 -4.99 121.76 117.86 2bm8 s ALA 44 Ca 0.26 1.06 -0.14 0.00 0.00 0.00 0.00 51.96 53.14 2bm8 s ALA 44 Cb 0.20 -3.40 0.04 0.00 0.00 0.00 0.00 23.12 19.96 2bm8 s ALA 44 CO 0.51 -0.40 1.15 -1.25 0.00 0.00 0.00 175.76 175.77 2bm8 s PRO 45 N -1.68 2.21 -0.01 0.00 0.04 -1.26 -4.98 135.00 129.32 2bm8 s PRO 45 Ca 0.48 1.54 0.14 0.00 0.04 0.00 0.00 61.00 63.19 2bm8 s PRO 45 Cb -0.35 -1.86 -0.19 0.00 0.04 0.00 0.00 34.50 32.13 2bm8 s PRO 45 CO 0.46 -1.73 0.36 0.54 0.04 0.00 0.00 177.00 176.67 2bm8 n ARG 46 N -2.93 0.96 -1.56 4.56 5.12 -1.26 -4.99 116.66 116.56 2bm8 n ARG 46 Ca 0.12 -0.09 -0.30 0.00 -1.93 0.00 0.00 57.85 55.65 2bm8 n ARG 46 Cb 0.51 -1.27 0.10 0.00 -1.16 0.00 0.00 32.46 30.64 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 -3.24 4.35 0.19 0.55 1.47 -1.26 -4.97 116.67 113.75 2bm8 s ASP 47 Ca -0.03 1.24 -0.13 0.00 1.18 0.00 0.00 52.55 54.81 2bm8 s ASP 47 Cb 0.09 -1.94 0.19 0.00 -0.34 0.00 0.00 42.92 40.91 2bm8 s ASP 47 CO 0.56 -2.05 1.73 0.25 0.68 0.00 0.00 175.17 176.34 2bm8 h LEU 48 N -1.15 0.08 0.00 2.11 5.85 -2.03 -3.46 115.31 116.71 2bm8 h LEU 48 Ca -0.48 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.32 2bm8 h LEU 48 Cb 1.28 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.40 2bm8 h LEU 48 CO 0.60 0.07 0.00 0.61 -0.34 0.00 0.00 178.44 179.38 2bm8 n GLY 49 N -1.27 0.67 3.82 3.75 0.00 -1.26 -5.06 105.19 105.84 2bm8 n GLY 49 Ca 0.05 0.00 -0.08 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 -2.00 -0.04 0.19 1.61 -0.85 -1.26 -4.53 117.35 110.47 2bm8 s TYR 50 Ca 0.00 -0.49 -0.31 0.00 -0.52 0.00 0.00 57.07 55.75 2bm8 s TYR 50 Cb 0.00 0.72 -0.10 0.00 0.38 0.00 0.00 41.96 42.96 2bm8 s TYR 50 CO 0.00 -1.34 1.56 0.45 -1.52 0.00 0.00 175.55 174.70 2bm8 s SER 51 N -2.98 6.57 -0.33 -0.18 0.15 -1.26 -4.92 113.70 110.76 2bm8 s SER 51 Ca 0.13 2.66 0.05 0.00 0.70 0.00 0.00 55.95 59.49 2bm8 s SER 51 Cb -0.05 -2.60 0.55 0.00 -1.71 0.00 0.00 66.02 62.20 2bm8 s SER 51 CO 0.09 -0.82 1.68 -0.90 1.20 0.00 0.00 173.24 174.49 2bm8 n ASP 52 N 3.59 3.79 0.04 5.45 5.68 -1.26 -4.69 116.55 129.15 2bm8 n ASP 52 Ca 0.12 -3.18 -0.01 0.00 -0.50 0.00 0.00 54.79 51.22 2bm8 n ASP 52 Cb 0.38 -0.75 -0.01 0.00 -1.14 0.00 0.00 41.12 39.61 2bm8 n ASP 52 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 2bm8 h PHE 53 N 1.20 -0.09 -1.84 2.11 -0.00 -2.05 -3.41 116.94 112.86 2bm8 h PHE 53 Ca 0.42 -0.00 -0.53 0.00 -0.00 0.00 0.00 57.97 57.86 2bm8 h PHE 53 Cb 2.34 0.03 -0.36 0.00 -0.00 0.00 0.00 35.95 37.96 2bm8 h PHE 53 CO 1.19 -0.06 -1.03 0.45 -0.00 0.00 0.00 178.31 178.86 2bm8 n SER 54 N -2.30 -0.22 -0.42 0.41 2.88 -1.26 -4.99 113.62 107.72 2bm8 n SER 54 Ca -0.01 -2.72 0.13 0.00 -1.33 0.00 0.00 58.87 54.94 2bm8 n SER 54 Cb 0.04 -0.37 0.43 0.00 -0.75 0.00 0.00 64.21 63.56 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 1.59 1.39 -3.00 -1.46 -0.04 -1.26 -4.91 135.00 127.32 2bm8 n PRO 55 Ca 0.21 -0.85 -0.30 0.00 -0.04 0.00 0.00 63.50 62.51 2bm8 n PRO 55 Cb 0.53 -1.48 -0.04 0.00 -0.04 0.00 0.00 33.50 32.48 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 -2.19 3.45 0.19 0.54 1.51 -1.26 -4.98 117.35 114.61 2bm8 s TYR 56 Ca 0.32 1.00 -0.00 0.00 -1.01 0.00 0.00 57.07 57.38 2bm8 s TYR 56 Cb 0.20 -2.40 -0.04 0.00 -0.11 0.00 0.00 41.96 39.61 2bm8 s TYR 56 CO 0.41 -0.02 0.09 1.14 -1.11 0.00 0.00 175.55 176.06 2bm8 s GLN 57 N -3.62 1.16 -0.12 -0.62 -2.07 -1.26 -1.34 119.66 111.79 2bm8 s GLN 57 Ca 0.50 -1.60 -0.04 0.00 -1.82 0.00 0.00 55.36 52.41 2bm8 s GLN 57 Cb -0.10 0.11 0.06 0.00 -1.09 0.00 0.00 33.01 31.98 2bm8 s GLN 57 CO 0.28 -0.31 0.13 -0.46 -1.32 0.00 0.00 175.29 173.61 2bm8 s TRP 58 N -4.01 -0.05 -1.50 9.60 -0.11 0.59 -4.71 118.94 118.75 2bm8 s TRP 58 Ca 0.34 0.21 -0.01 0.00 1.22 0.00 0.00 56.10 57.86 2bm8 s TRP 58 Cb 0.07 -0.44 0.00 0.00 -1.50 0.00 0.00 33.47 31.60 2bm8 s TRP 58 CO 0.09 -0.38 0.13 0.54 -4.62 0.00 0.00 176.95 172.71 2bm8 n ARG 59 N 5.31 -1.51 -0.98 5.86 1.74 -1.26 -1.66 116.66 124.16 2bm8 n ARG 59 Ca -0.05 0.17 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 2bm8 n ARG 59 Cb 0.50 -3.79 0.00 0.00 -1.02 0.00 0.00 32.46 28.14 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 -2.42 0.76 3.64 -0.13 0.00 -1.26 -5.02 105.19 100.76 2bm8 n GLY 60 Ca -0.32 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 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 3.35 0.34 0.99 1.43 -0.66 -4.31 118.68 119.82 2bm8 s LEU 61 Ca 0.00 -0.05 -0.29 0.00 -1.03 0.00 0.00 54.13 52.76 2bm8 s LEU 61 Cb 0.00 -1.89 -0.11 0.00 0.03 0.00 0.00 46.19 44.22 2bm8 s LEU 61 CO 0.00 0.30 1.44 -0.13 0.23 0.00 0.00 176.35 178.19 2bm8 s ARG 62 N -1.39 4.20 -0.29 1.70 0.52 -1.26 -0.30 118.95 122.13 2bm8 s ARG 62 Ca 0.17 2.44 -0.00 0.00 -0.52 0.00 0.00 55.73 57.82 2bm8 s ARG 62 Cb -0.11 -3.02 0.06 0.00 0.52 0.00 0.00 34.95 32.39 2bm8 s ARG 62 CO 0.08 -0.43 -0.02 -1.64 0.02 0.00 0.00 175.30 173.30 2bm8 s MET 63 N -1.65 2.34 0.17 3.54 -1.94 -0.45 -4.09 119.30 117.23 2bm8 s MET 63 Ca 0.53 -1.32 0.25 0.00 -1.71 0.00 0.00 55.69 53.44 2bm8 s MET 63 Cb -0.44 -3.12 0.91 0.00 2.01 0.00 0.00 34.83 34.19 2bm8 s MET 63 CO 0.56 -0.63 1.76 1.28 -0.01 0.00 0.00 175.02 177.98 2bm8 n LEU 64 N 4.56 0.58 -4.66 -0.03 4.77 -1.26 -4.28 117.00 116.68 2bm8 n LEU 64 Ca -0.13 0.58 -0.40 0.00 -0.03 0.00 0.00 56.01 56.04 2bm8 n LEU 64 Cb 0.43 -0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 2bm8 n LEU 64 CO 0.25 -0.27 0.29 -0.54 -1.33 0.00 0.00 177.39 175.80 2bm8 s LYS 65 N -3.14 4.18 0.74 3.23 1.02 -1.26 -5.07 119.74 119.45 2bm8 s LYS 65 Ca 0.09 0.48 -0.10 0.00 0.02 0.00 0.00 55.97 56.46 2bm8 s LYS 65 Cb 0.12 -3.58 0.05 0.00 -0.52 0.00 0.00 37.83 33.90 2bm8 s LYS 65 CO 0.50 -0.21 1.10 0.16 -0.92 0.00 0.00 175.35 175.98 2bm8 s ASP 66 N 1.21 4.94 0.38 2.83 1.47 -1.26 -4.70 116.67 121.54 2bm8 s ASP 66 Ca 0.26 0.82 0.14 0.00 1.18 0.00 0.00 52.55 54.95 2bm8 s ASP 66 Cb -0.16 -1.48 0.99 0.00 -0.34 0.00 0.00 42.92 41.93 2bm8 s ASP 66 CO 0.10 -1.61 1.82 -0.65 0.68 0.00 0.00 175.17 175.51 2bm8 h PRO 67 N -0.78 0.50 -0.20 2.11 0.11 -1.97 -0.36 132.00 131.40 2bm8 h PRO 67 Ca -0.45 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 65.49 2bm8 h PRO 67 Cb 1.30 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2bm8 h PRO 67 CO 0.64 0.33 -0.46 -0.44 -0.21 0.00 0.00 178.00 177.86 2bm8 h ASP 68 N 0.51 0.55 -0.20 -2.05 3.32 -1.93 -1.67 116.42 114.94 2bm8 h ASP 68 Ca 0.51 -0.26 -0.08 0.00 0.02 0.00 0.00 57.03 57.22 2bm8 h ASP 68 Cb 1.13 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.52 2bm8 h ASP 68 CO -0.24 0.93 -0.20 0.74 -1.72 0.00 0.00 179.24 178.75 2bm8 h THR 69 N 0.41 1.33 -0.75 0.35 2.02 -1.57 -2.64 112.91 112.05 2bm8 h THR 69 Ca 0.03 -1.35 0.12 0.00 0.77 0.00 0.00 66.41 65.97 2bm8 h THR 69 Cb 0.97 1.75 -0.08 0.00 -1.74 0.00 0.00 68.15 69.04 2bm8 h THR 69 CO 0.09 0.41 0.35 1.56 0.37 0.00 0.00 175.52 178.30 2bm8 h GLN 70 N 0.17 0.53 -0.56 6.66 4.20 -1.07 -1.05 115.11 123.99 2bm8 h GLN 70 Ca 0.03 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2bm8 h GLN 70 Cb 0.74 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.37 2bm8 h GLN 70 CO 0.05 0.35 0.36 0.00 -0.67 0.00 0.00 178.83 178.92 2bm8 h ALA 71 N 1.50 0.72 0.19 3.87 0.00 -1.21 -0.13 119.26 124.19 2bm8 h ALA 71 Ca 0.39 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 2bm8 h ALA 71 Cb 0.52 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2bm8 h ALA 71 CO -0.34 0.17 -0.09 0.28 0.00 0.00 0.00 179.25 179.27 2bm8 h VAL 72 N 0.76 0.87 0.00 0.00 2.07 -1.07 -2.52 116.25 116.35 2bm8 h VAL 72 Ca 0.21 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 2bm8 h VAL 72 Cb -0.07 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.71 2bm8 h VAL 72 CO -0.04 0.06 -0.00 1.88 0.02 0.00 0.00 177.57 179.48 2bm8 h TYR 73 N -0.36 0.00 -0.09 1.57 -1.99 -1.06 -0.84 116.97 114.20 2bm8 h TYR 73 Ca -0.03 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.69 2bm8 h TYR 73 Cb 0.28 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.01 2bm8 h TYR 73 CO -0.03 0.00 -0.02 1.25 -0.00 0.00 0.00 178.16 179.36 2bm8 h HIS 74 N 0.00 0.19 -0.77 4.88 2.76 -0.80 -0.43 115.15 120.97 2bm8 h HIS 74 Ca -0.00 -0.04 0.01 0.00 -2.20 0.00 0.00 60.37 58.14 2bm8 h HIS 74 Cb 0.00 -0.05 -0.04 0.00 1.55 0.00 0.00 27.41 28.88 2bm8 h HIS 74 CO 0.00 0.48 0.51 -0.44 -1.30 0.00 0.00 177.93 177.18 2bm8 h ASP 75 N -0.16 0.88 -0.22 3.26 3.32 -0.97 -1.06 116.42 121.47 2bm8 h ASP 75 Ca 0.02 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 2bm8 h ASP 75 Cb 0.42 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2bm8 h ASP 75 CO 0.01 0.63 0.07 -0.03 -1.72 0.00 0.00 179.24 178.20 2bm8 h MET 76 N 1.03 0.34 -0.54 3.56 4.05 -1.09 -1.24 114.93 121.03 2bm8 h MET 76 Ca 0.29 -0.07 0.05 0.00 -0.28 0.00 0.00 59.70 59.69 2bm8 h MET 76 Cb -0.10 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 30.60 2bm8 h MET 76 CO -0.07 0.43 0.27 -0.07 0.23 0.00 0.00 176.91 177.70 2bm8 h LEU 77 N 0.18 0.39 -0.94 3.39 4.07 -0.88 -0.20 115.31 121.31 2bm8 h LEU 77 Ca 0.07 0.03 -0.06 0.00 0.08 0.00 0.00 57.88 58.00 2bm8 h LEU 77 Cb 0.23 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 41.91 2bm8 h LEU 77 CO -0.00 0.26 0.09 -0.25 -1.08 0.00 0.00 178.44 177.46 2bm8 h TRP 78 N 0.53 0.90 0.02 1.13 2.91 -0.87 0.11 115.95 120.69 2bm8 h TRP 78 Ca 0.24 -0.10 -0.03 0.00 1.13 0.00 0.00 58.89 60.13 2bm8 h TRP 78 Cb 0.16 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 28.56 2bm8 h TRP 78 CO -0.10 0.78 -0.15 1.49 -1.03 0.00 0.00 178.44 179.42 2bm8 h GLU 79 N 0.82 0.05 0.17 2.65 4.81 -1.02 -3.39 114.58 118.67 2bm8 h GLU 79 Ca 0.17 -0.08 -0.29 0.00 -0.13 0.00 0.00 59.36 59.02 2bm8 h GLU 79 Cb 0.37 0.03 0.02 0.00 0.63 0.00 0.00 28.75 29.79 2bm8 h GLU 79 CO 0.01 1.04 -1.32 1.25 -0.73 0.00 0.00 179.01 179.25 2bm8 h LEU 80 N -0.90 0.56 -2.94 1.64 6.46 -1.03 -3.49 115.31 115.61 2bm8 h LEU 80 Ca -0.03 -0.60 -0.29 0.00 -0.12 0.00 0.00 57.88 56.84 2bm8 h LEU 80 Cb 1.11 -0.18 0.07 0.00 -0.73 0.00 0.00 40.66 40.93 2bm8 h LEU 80 CO 0.02 1.47 -0.70 0.54 -0.62 0.00 0.00 178.44 179.15 2bm8 n ARG 81 N -3.59 -1.47 -2.12 1.25 1.74 0.39 -4.81 116.66 108.04 2bm8 n ARG 81 Ca -0.11 0.85 -0.41 0.00 -0.77 0.00 0.00 57.85 57.41 2bm8 n ARG 81 Cb 1.05 -4.60 -0.03 0.00 -1.02 0.00 0.00 32.46 27.87 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 -4.75 4.33 0.43 5.56 0.04 -1.26 -4.54 135.00 134.82 2bm8 s PRO 82 Ca 0.28 2.17 0.26 0.00 0.04 0.00 0.00 61.00 63.75 2bm8 s PRO 82 Cb -0.08 -3.15 0.70 0.00 0.04 0.00 0.00 34.50 32.01 2bm8 s PRO 82 CO 0.82 -0.33 1.74 0.00 0.04 0.00 0.00 177.00 179.27 2bm8 h ARG 83 N 5.15 0.00 -3.15 4.56 2.47 -1.40 -3.40 114.38 118.60 2bm8 h ARG 83 Ca -0.45 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.02 2bm8 h ARG 83 Cb 1.22 0.00 -0.32 0.00 -1.65 0.00 0.00 29.97 29.21 2bm8 h ARG 83 CO 0.77 0.00 -0.59 0.99 0.56 0.00 0.00 179.97 181.70 2bm8 s THR 84 N -3.32 -0.13 -0.16 2.04 2.01 -1.02 -1.07 115.64 114.00 2bm8 s THR 84 Ca 0.06 0.23 0.01 0.00 0.31 0.00 0.00 61.69 62.30 2bm8 s THR 84 Cb 0.07 -0.29 0.01 0.00 0.01 0.00 0.00 72.50 72.30 2bm8 s THR 84 CO 0.61 0.09 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.82 2bm8 s ILE 85 N 1.56 2.31 -0.17 1.82 1.01 -0.71 -1.56 121.20 125.46 2bm8 s ILE 85 Ca -0.05 -0.88 -0.04 0.00 0.00 0.00 0.00 60.65 59.67 2bm8 s ILE 85 Cb -0.12 -1.96 -0.02 0.00 0.01 0.00 0.00 42.46 40.37 2bm8 s ILE 85 CO -0.06 0.53 -0.03 -0.69 0.00 0.00 0.00 174.94 174.69 2bm8 s VAL 86 N 0.94 3.86 -0.28 2.92 1.01 0.04 -0.38 120.40 128.51 2bm8 s VAL 86 Ca -0.03 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.53 2bm8 s VAL 86 Cb -0.15 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.53 2bm8 s VAL 86 CO -0.04 0.47 0.04 -1.61 0.00 0.00 0.00 175.10 173.96 2bm8 s GLU 87 N 0.64 3.06 -0.32 2.72 0.41 0.13 -0.58 118.70 124.76 2bm8 s GLU 87 Ca -0.02 -0.86 -0.20 0.00 -0.41 0.00 0.00 54.97 53.48 2bm8 s GLU 87 Cb -0.14 -3.27 -0.01 0.00 -1.78 0.00 0.00 34.13 28.93 2bm8 s GLU 87 CO 0.02 -0.41 0.63 -1.17 -0.49 0.00 0.00 175.26 173.84 2bm8 s LEU 88 N 1.46 4.17 0.00 1.80 0.20 0.06 -0.65 118.68 125.72 2bm8 s LEU 88 Ca 0.02 0.36 0.00 0.00 0.69 0.00 0.00 54.13 55.21 2bm8 s LEU 88 Cb -0.17 -2.81 0.00 0.00 -0.43 0.00 0.00 46.19 42.78 2bm8 s LEU 88 CO 0.01 -0.50 0.00 0.61 -0.29 0.00 0.00 176.35 176.17 2bm8 n GLY 89 N 4.48 -0.33 0.37 7.98 0.00 0.12 0.23 105.19 118.05 2bm8 n GLY 89 Ca -0.01 -0.84 -0.17 0.00 0.00 0.00 0.00 46.02 45.00 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 1.73 0.97 0.00 1.61 0.31 -1.26 -4.74 118.33 116.96 2bm8 n VAL 90 Ca 0.00 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2bm8 n VAL 90 Cb 0.00 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.33 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 -3.62 0.00 0.44 3.52 9.36 -1.26 -2.52 117.16 123.08 2bm8 n TYR 91 Ca -0.34 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.00 2bm8 n TYR 91 Cb 0.76 0.00 0.14 0.00 -0.63 0.00 0.00 39.34 39.62 2bm8 n TYR 91 CO 0.00 0.00 0.00 -2.95 0.22 0.00 0.00 176.86 174.13 2bm8 h ASN 92 N 0.00 0.00 0.00 2.98 -1.07 -1.90 -2.92 115.58 112.67 2bm8 h ASN 92 Ca 0.00 -0.14 0.00 0.00 0.07 0.00 0.00 56.30 56.23 2bm8 h ASN 92 Cb 0.00 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.25 2bm8 h ASN 92 CO 0.00 0.07 0.00 0.61 0.07 0.00 0.00 177.43 178.18 2bm8 n GLY 93 N 1.28 0.75 0.09 9.14 0.00 -1.05 0.18 105.19 115.58 2bm8 n GLY 93 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 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 0.10 2.00 -0.02 0.00 -1.83 -2.06 103.07 101.27 2bm8 h GLY 94 Ca 0.00 0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 2bm8 h GLY 94 CO 0.00 -0.06 -0.23 1.48 0.00 0.00 0.00 176.54 177.73 2bm8 h SER 95 N -0.01 0.00 0.26 0.19 4.64 -1.90 -1.34 113.55 115.40 2bm8 h SER 95 Ca 0.07 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 2bm8 h SER 95 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2bm8 h SER 95 CO -0.16 0.23 -0.12 -0.07 -0.87 0.00 0.00 176.83 175.84 2bm8 h LEU 96 N 0.00 -0.29 -1.34 5.97 4.07 -1.76 -1.31 115.31 120.65 2bm8 h LEU 96 Ca -0.00 -0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 2bm8 h LEU 96 Cb 0.42 0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.21 2bm8 h LEU 96 CO 0.03 -0.19 0.25 0.00 -1.08 0.00 0.00 178.44 177.45 2bm8 h ALA 97 N 0.37 1.49 0.03 1.53 0.00 -1.05 -1.37 119.26 120.27 2bm8 h ALA 97 Ca -0.04 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2bm8 h ALA 97 Cb 0.28 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2bm8 h ALA 97 CO 0.06 0.41 -0.02 2.35 0.00 0.00 0.00 179.25 182.05 2bm8 h TRP 98 N 0.70 -0.04 -0.75 0.00 7.01 -1.15 0.17 115.95 121.88 2bm8 h TRP 98 Ca 0.18 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.22 2bm8 h TRP 98 Cb 0.06 0.01 -0.05 0.00 -2.10 0.00 0.00 29.16 27.09 2bm8 h TRP 98 CO 0.01 0.20 0.47 0.74 -2.79 0.00 0.00 178.44 177.06 2bm8 h PHE 99 N -0.28 0.87 0.33 2.65 0.05 -0.99 0.34 116.94 119.91 2bm8 h PHE 99 Ca -0.00 0.02 -0.02 0.00 3.82 0.00 0.00 57.97 61.79 2bm8 h PHE 99 Cb 0.26 -0.28 0.00 0.00 2.00 0.00 0.00 35.95 37.93 2bm8 h PHE 99 CO 0.01 0.48 -0.16 -0.09 -0.18 0.00 0.00 178.31 178.37 2bm8 h ARG 100 N 0.90 -0.42 -0.47 1.51 1.12 -1.13 -1.57 114.38 114.32 2bm8 h ARG 100 Ca 0.31 0.03 0.08 0.00 -1.11 0.00 0.00 59.98 59.29 2bm8 h ARG 100 Cb 0.07 0.10 -0.06 0.00 -0.01 0.00 0.00 29.97 30.06 2bm8 h ARG 100 CO -0.13 -0.22 0.09 -0.44 -3.11 0.00 0.00 179.97 176.16 2bm8 h ASP 101 N -0.54 0.01 -0.19 -3.80 3.32 -0.35 -1.63 116.42 113.24 2bm8 h ASP 101 Ca -0.05 0.08 -0.13 0.00 0.02 0.00 0.00 57.03 56.96 2bm8 h ASP 101 Cb 0.40 0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 2bm8 h ASP 101 CO 0.07 0.03 -0.32 0.25 -1.72 0.00 0.00 179.24 177.56 2bm8 h LEU 102 N 0.23 0.71 -0.84 1.55 5.85 -0.86 -1.55 115.31 120.39 2bm8 h LEU 102 Ca 0.23 -0.29 -0.11 0.00 0.84 0.00 0.00 57.88 58.55 2bm8 h LEU 102 Cb 0.30 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2bm8 h LEU 102 CO -0.30 0.98 -0.38 0.71 -0.34 0.00 0.00 178.44 179.11 2bm8 h THR 103 N 0.58 1.30 -0.33 1.05 1.35 -1.09 -2.65 112.91 113.12 2bm8 h THR 103 Ca 0.07 -1.50 -0.06 0.00 -0.55 0.00 0.00 66.41 64.37 2bm8 h THR 103 Cb 0.83 1.58 -0.01 0.00 -1.73 0.00 0.00 68.15 68.81 2bm8 h THR 103 CO 0.07 0.46 -0.02 0.11 -0.25 0.00 0.00 175.52 175.89 2bm8 h LYS 104 N 0.34 0.60 -0.33 4.72 1.79 -0.56 -1.48 116.57 121.65 2bm8 h LYS 104 Ca 0.03 -0.20 -0.05 0.00 -2.18 0.00 0.00 60.65 58.26 2bm8 h LYS 104 Cb 0.82 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.41 2bm8 h LYS 104 CO 0.07 0.74 0.01 0.82 -1.08 0.00 0.00 179.45 180.00 2bm8 h ILE 105 N 0.40 1.19 0.00 1.86 2.04 -1.31 -2.12 117.51 119.57 2bm8 h ILE 105 Ca 0.09 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.21 2bm8 h ILE 105 Cb 0.48 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 2bm8 h ILE 105 CO 0.02 0.25 0.00 0.24 0.00 0.00 0.00 178.15 178.67 2bm8 h MET 106 N 0.48 0.00 0.00 2.37 2.86 -1.33 -3.47 114.93 115.84 2bm8 h MET 106 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2bm8 h MET 106 Cb 0.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2bm8 h MET 106 CO 0.01 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.39 2bm8 n GLY 107 N 0.70 0.39 3.67 8.32 0.00 -0.80 -5.04 105.19 112.44 2bm8 n GLY 107 Ca 0.03 -1.01 -0.38 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.00 5.21 -0.94 -0.61 1.01 -0.61 -5.02 121.20 118.24 2bm8 s ILE 108 Ca 0.00 0.67 -0.24 0.00 0.00 0.00 0.00 60.65 61.08 2bm8 s ILE 108 Cb 0.00 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.72 2bm8 s ILE 108 CO 0.00 0.25 1.86 -0.62 0.00 0.00 0.00 174.94 176.43 2bm8 s ASP 109 N 1.06 5.38 -0.09 3.58 2.15 -1.26 -4.43 116.67 123.07 2bm8 s ASP 109 Ca 0.18 -0.88 0.03 0.00 0.43 0.00 0.00 52.55 52.32 2bm8 s ASP 109 Cb -0.15 -2.56 0.01 0.00 -0.30 0.00 0.00 42.92 39.92 2bm8 s ASP 109 CO 0.08 -2.54 -0.17 0.00 -0.17 0.00 0.00 175.17 172.37 2bm8 s GLN 111 N 0.61 4.12 -0.16 0.00 -1.52 -0.23 -4.91 119.66 117.57 2bm8 s GLN 111 Ca -0.15 0.13 -0.08 0.00 -1.95 0.00 0.00 55.36 53.32 2bm8 s GLN 111 Cb -0.16 -3.57 -0.04 0.00 -0.22 0.00 0.00 33.01 29.01 2bm8 s GLN 111 CO 0.05 -0.11 0.11 0.08 -0.25 0.00 0.00 175.29 175.17 2bm8 s VAL 112 N 1.54 5.28 -0.07 1.09 1.01 0.25 -1.73 120.40 127.77 2bm8 s VAL 112 Ca 0.17 0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.31 2bm8 s VAL 112 Cb -0.15 -3.35 0.01 0.00 0.00 0.00 0.00 36.38 32.89 2bm8 s VAL 112 CO 0.08 0.52 -0.14 -0.63 0.00 0.00 0.00 175.10 174.94 2bm8 s ILE 113 N -0.26 1.27 -0.15 2.22 1.01 0.48 -1.19 121.20 124.60 2bm8 s ILE 113 Ca 0.10 -0.56 0.01 0.00 0.00 0.00 0.00 60.65 60.20 2bm8 s ILE 113 Cb -0.12 -1.15 0.00 0.00 0.01 0.00 0.00 42.46 41.21 2bm8 s ILE 113 CO 0.01 0.39 -0.18 -0.83 0.00 0.00 0.00 174.94 174.33 2bm8 s GLY 114 N 0.59 1.43 -0.14 6.18 0.00 -0.35 0.17 107.32 115.20 2bm8 s GLY 114 Ca -0.15 -1.05 -0.00 0.00 0.00 0.00 0.00 44.72 43.52 2bm8 s GLY 114 CO 0.04 -0.02 -0.13 -0.42 0.00 0.00 0.00 173.10 172.58 2bm8 s ILE 115 N 0.78 2.97 0.03 0.90 1.01 0.18 -1.08 121.20 125.98 2bm8 s ILE 115 Ca -0.07 -0.68 -0.15 0.00 0.00 0.00 0.00 60.65 59.75 2bm8 s ILE 115 Cb -0.16 -2.26 0.02 0.00 0.01 0.00 0.00 42.46 40.08 2bm8 s ILE 115 CO 0.00 0.51 0.33 -0.62 0.00 0.00 0.00 174.94 175.16 2bm8 s ASP 116 N 0.55 -0.18 0.26 3.58 -1.08 -0.99 -0.70 116.67 118.11 2bm8 s ASP 116 Ca -0.08 -0.07 -0.04 0.00 -0.52 0.00 0.00 52.55 51.83 2bm8 s ASP 116 Cb -0.16 0.36 0.33 0.00 -1.46 0.00 0.00 42.92 41.99 2bm8 s ASP 116 CO 0.04 -0.58 1.91 -0.09 0.52 0.00 0.00 175.17 176.97 2bm8 h ARG 117 N 3.35 1.24 -3.92 4.34 2.43 -1.89 -2.10 114.38 117.83 2bm8 h ARG 117 Ca -0.31 -0.07 -0.56 0.00 -0.81 0.00 0.00 59.98 58.22 2bm8 h ARG 117 Cb 1.19 -0.28 -0.39 0.00 -0.42 0.00 0.00 29.97 30.07 2bm8 h ARG 117 CO 0.44 0.82 -0.77 0.34 -1.51 0.00 0.00 179.97 179.29 2bm8 s ASP 118 N -6.03 3.40 0.00 -3.80 2.15 -1.26 -4.75 116.67 106.38 2bm8 s ASP 118 Ca -0.13 -1.03 0.24 0.00 0.43 0.00 0.00 52.55 52.06 2bm8 s ASP 118 Cb 0.19 -0.88 0.39 0.00 -0.30 0.00 0.00 42.92 42.32 2bm8 s ASP 118 CO 0.82 -0.28 1.38 0.18 -0.17 0.00 0.00 175.17 177.10 2bm8 n LEU 119 N 4.86 3.35 0.00 -1.34 4.77 -1.26 -4.58 117.00 122.80 2bm8 n LEU 119 Ca -0.10 -1.38 0.08 0.00 -0.03 0.00 0.00 56.01 54.58 2bm8 n LEU 119 Cb 0.45 -0.20 0.36 0.00 -2.33 0.00 0.00 43.42 41.70 2bm8 n LEU 119 CO 0.15 0.69 0.75 -1.54 -1.33 0.00 0.00 177.39 176.12 2bm8 n SER 120 N 1.45 0.00 -0.50 -1.43 3.41 -1.26 -2.09 113.62 113.21 2bm8 n SER 120 Ca 0.18 0.44 0.13 0.00 -0.26 0.00 0.00 58.87 59.36 2bm8 n SER 120 Cb 0.60 -0.47 0.38 0.00 -0.26 0.00 0.00 64.21 64.46 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 -1.47 1.52 -1.86 4.33 3.00 -1.26 -4.96 116.66 115.96 2bm8 n ARG 121 Ca 0.04 -1.00 -0.42 0.00 -0.01 0.00 0.00 57.85 56.46 2bm8 n ARG 121 Cb 0.18 -1.48 -0.03 0.00 0.00 0.00 0.00 32.46 31.13 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 6.39 2.66 -2.61 0.00 1.13 0.13 -4.93 117.38 120.15 2bm8 n GLN 123 Ca 0.17 -2.55 -0.43 0.00 -1.94 0.00 0.00 57.00 52.26 2bm8 n GLN 123 Cb 0.41 -1.55 -0.02 0.00 0.11 0.00 0.00 30.24 29.18 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 -1.16 4.60 0.63 5.09 1.01 -1.25 -5.00 121.20 125.12 2bm8 s ILE 124 Ca 0.46 1.91 -0.18 0.00 0.00 0.00 0.00 60.65 62.84 2bm8 s ILE 124 Cb 0.25 -4.23 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 2bm8 s ILE 124 CO 0.33 -0.09 1.19 -2.16 0.00 0.00 0.00 174.94 174.21 2bm8 s PRO 125 N 2.71 2.81 0.53 2.79 0.04 -1.26 -4.91 135.00 137.71 2bm8 s PRO 125 Ca 0.48 1.74 0.22 0.00 0.04 0.00 0.00 61.00 63.48 2bm8 s PRO 125 Cb -0.18 -1.92 1.41 0.00 0.04 0.00 0.00 34.50 33.85 2bm8 s PRO 125 CO 0.13 -1.31 2.13 0.00 0.04 0.00 0.00 177.00 177.99 2bm8 h ALA 126 N 0.56 1.64 0.00 8.56 0.00 -2.00 -1.83 119.26 126.19 2bm8 h ALA 126 Ca -0.49 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2bm8 h ALA 126 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2bm8 h ALA 126 CO 0.54 0.08 0.00 -1.13 0.00 0.00 0.00 179.25 178.74 2bm8 n SER 127 N -4.10 0.68 -2.56 0.00 3.41 -1.26 -3.76 113.62 106.03 2bm8 n SER 127 Ca -0.03 0.65 -0.29 0.00 -0.26 0.00 0.00 58.87 58.94 2bm8 n SER 127 Cb 0.15 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.31 2bm8 n SER 127 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2bm8 n ASP 128 N -2.22 5.09 0.00 4.04 2.03 -0.69 -4.75 116.55 120.05 2bm8 n ASP 128 Ca 0.03 -3.73 0.00 0.00 0.52 0.00 0.00 54.79 51.60 2bm8 n ASP 128 Cb 0.26 -0.55 0.00 0.00 -0.72 0.00 0.00 41.12 40.12 2bm8 n ASP 128 CO 0.00 0.00 0.00 0.80 -1.92 0.00 0.00 177.20 176.08 2bm8 n MET 129 N -0.48 1.54 -1.69 -0.67 1.56 -1.25 -4.81 117.12 111.32 2bm8 n MET 129 Ca 0.41 -1.02 -0.45 0.00 -0.27 0.00 0.00 57.70 56.37 2bm8 n MET 129 Cb 0.59 -0.82 -0.04 0.00 2.15 0.00 0.00 33.22 35.11 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 -0.27 2.44 -1.86 2.12 2.13 -1.26 -2.07 120.64 121.87 2bm8 n GLU 130 Ca 0.00 0.88 -0.18 0.00 0.66 0.00 0.00 57.16 58.52 2bm8 n GLU 130 Cb 0.30 -2.71 -0.05 0.00 0.27 0.00 0.00 31.44 29.26 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 4.41 -5.16 -4.03 4.31 3.02 -1.26 -4.99 115.26 111.55 2bm8 n ASN 131 Ca 0.18 0.25 -0.29 0.00 -0.03 0.00 0.00 54.58 54.69 2bm8 n ASN 131 Cb 0.32 -4.23 -0.17 0.00 -0.61 0.00 0.00 39.78 35.09 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 -2.75 1.50 -0.09 2.41 1.01 -0.88 -0.58 121.20 121.81 2bm8 s ILE 132 Ca 0.00 -0.61 0.04 0.00 0.00 0.00 0.00 60.65 60.08 2bm8 s ILE 132 Cb 0.00 -1.39 -0.00 0.00 0.01 0.00 0.00 42.46 41.08 2bm8 s ILE 132 CO 0.00 0.44 -0.23 -0.89 0.00 0.00 0.00 174.94 174.26 2bm8 s THR 133 N 1.25 2.00 -0.30 2.92 2.01 -0.33 -4.95 115.64 118.25 2bm8 s THR 133 Ca -0.01 -1.00 -0.07 0.00 0.31 0.00 0.00 61.69 60.92 2bm8 s THR 133 Cb -0.14 -1.73 0.01 0.00 0.01 0.00 0.00 72.50 70.65 2bm8 s THR 133 CO -0.06 0.55 0.10 -0.76 -0.69 0.00 0.00 174.62 173.76 2bm8 s LEU 134 N 0.26 3.91 -0.15 4.42 1.02 -1.26 -1.21 118.68 125.67 2bm8 s LEU 134 Ca -0.16 -0.66 -0.04 0.00 0.02 0.00 0.00 54.13 53.29 2bm8 s LEU 134 Cb -0.17 -1.91 -0.03 0.00 0.02 0.00 0.00 46.19 44.10 2bm8 s LEU 134 CO 0.08 -0.19 -0.00 -1.00 0.02 0.00 0.00 176.35 175.25 2bm8 s HIS 135 N 1.53 3.11 -0.46 0.29 3.76 -0.24 -4.99 115.29 118.28 2bm8 s HIS 135 Ca 0.03 -0.10 -0.25 0.00 -0.15 0.00 0.00 55.06 54.59 2bm8 s HIS 135 Cb -0.17 -1.96 0.03 0.00 1.11 0.00 0.00 32.58 31.59 2bm8 s HIS 135 CO 0.03 0.11 0.87 -1.14 -0.85 0.00 0.00 174.74 173.77 2bm8 s GLN 136 N 0.12 3.48 0.00 1.40 0.74 -1.26 -2.36 119.66 121.78 2bm8 s GLN 136 Ca 0.01 0.05 0.00 0.00 0.05 0.00 0.00 55.36 55.47 2bm8 s GLN 136 Cb -0.13 -3.94 0.00 0.00 1.10 0.00 0.00 33.01 30.04 2bm8 s GLN 136 CO 0.02 -1.19 0.00 0.41 -0.55 0.00 0.00 175.29 173.98 2bm8 n GLY 137 N 4.96 7.23 3.15 2.59 0.00 -0.79 -4.94 105.19 117.39 2bm8 n GLY 137 Ca 0.05 -1.92 0.05 0.00 0.00 0.00 0.00 46.02 44.19 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 1.00 -0.66 0.34 1.61 3.68 -1.26 -3.70 116.67 117.68 2bm8 s ASP 138 Ca 0.00 0.39 0.02 0.00 2.13 0.00 0.00 52.55 55.09 2bm8 s ASP 138 Cb 0.00 1.55 0.59 0.00 -1.45 0.00 0.00 42.92 43.61 2bm8 s ASP 138 CO 0.00 -0.12 1.97 0.00 0.13 0.00 0.00 175.17 177.15 2bm8 n SER 140 N -4.40 0.42 -4.34 0.00 3.41 -1.26 -4.49 113.62 102.96 2bm8 n SER 140 Ca 0.06 0.55 -0.38 0.00 -0.26 0.00 0.00 58.87 58.84 2bm8 n SER 140 Cb 0.08 -0.66 -0.12 0.00 -0.26 0.00 0.00 64.21 63.25 2bm8 n SER 140 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2bm8 s ASP 141 N -3.78 5.29 0.30 4.04 3.68 -1.04 -5.00 116.67 120.16 2bm8 s ASP 141 Ca 0.11 -0.84 0.15 0.00 2.13 0.00 0.00 52.55 54.10 2bm8 s ASP 141 Cb 0.14 -1.91 0.39 0.00 -1.45 0.00 0.00 42.92 40.10 2bm8 s ASP 141 CO 0.51 -0.25 1.60 -0.07 0.13 0.00 0.00 175.17 177.09 2bm8 h LEU 142 N 8.27 0.00 -1.08 -1.34 3.38 -1.81 -3.09 115.31 119.63 2bm8 h LEU 142 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2bm8 h LEU 142 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2bm8 h LEU 142 CO 0.61 0.53 0.00 0.71 0.09 0.00 0.00 178.44 180.38 2bm8 h THR 143 N 0.00 0.00 -0.77 0.22 1.35 -1.94 -1.65 112.91 110.11 2bm8 h THR 143 Ca -0.01 -0.18 0.17 0.00 -0.55 0.00 0.00 66.41 65.85 2bm8 h THR 143 Cb 1.13 0.88 -0.11 0.00 -1.73 0.00 0.00 68.15 68.31 2bm8 h THR 143 CO 0.07 0.00 0.22 0.74 -0.25 0.00 0.00 175.52 176.29 2bm8 h THR 144 N 0.00 0.49 0.00 6.82 2.02 -1.85 -2.93 112.91 117.47 2bm8 h THR 144 Ca 0.00 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.08 2bm8 h THR 144 Cb 0.26 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 2bm8 h THR 144 CO 0.00 0.05 0.00 0.49 0.37 0.00 0.00 175.52 176.43 2bm8 n PHE 145 N -5.14 0.80 -0.24 3.16 3.01 -0.62 -4.13 117.46 114.30 2bm8 n PHE 145 Ca 0.16 0.23 0.03 0.00 1.01 0.00 0.00 57.45 58.88 2bm8 n PHE 145 Cb 0.50 -0.88 0.13 0.00 -0.01 0.00 0.00 39.48 39.22 2bm8 n PHE 145 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 2bm8 h GLU 146 N 0.00 0.10 -6.35 -1.08 4.57 -1.62 -3.40 114.58 106.79 2bm8 h GLU 146 Ca 0.00 -0.01 -0.62 0.00 -1.18 0.00 0.00 59.36 57.55 2bm8 h GLU 146 Cb 0.70 -0.02 0.11 0.00 -0.16 0.00 0.00 28.75 29.39 2bm8 h GLU 146 CO 0.00 0.06 -0.09 -2.39 -1.18 0.00 0.00 179.01 175.41 2bm8 n HIS 147 N -5.33 0.64 -2.16 0.92 1.44 -1.26 -2.49 115.22 106.97 2bm8 n HIS 147 Ca 0.11 0.75 -0.15 0.00 -2.01 0.00 0.00 57.72 56.43 2bm8 n HIS 147 Cb 0.42 -2.15 -0.01 0.00 0.12 0.00 0.00 29.99 28.36 2bm8 n HIS 147 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2bm8 n LEU 148 N 1.39 -1.59 0.26 2.39 4.77 -1.26 -4.70 117.00 118.26 2bm8 n LEU 148 Ca 0.12 0.04 0.14 0.00 -0.03 0.00 0.00 56.01 56.27 2bm8 n LEU 148 Cb 0.31 -2.21 0.65 0.00 -2.33 0.00 0.00 43.42 39.84 2bm8 n LEU 148 CO 0.58 -0.24 0.93 0.03 -1.33 0.00 0.00 177.39 177.37 2bm8 h ARG 149 N 0.00 0.00 0.00 3.23 3.08 -1.70 -3.19 114.38 115.80 2bm8 h ARG 149 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.71 2bm8 h ARG 149 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2bm8 h ARG 149 CO 0.42 0.12 0.00 -1.91 -1.07 0.00 0.00 179.97 177.52 2bm8 n GLU 150 N -3.35 0.00 -2.48 0.04 2.13 -1.26 -4.88 120.64 110.84 2bm8 n GLU 150 Ca -0.00 0.46 -0.25 0.00 0.66 0.00 0.00 57.16 58.02 2bm8 n GLU 150 Cb 0.32 -1.50 0.04 0.00 0.27 0.00 0.00 31.44 30.56 2bm8 n GLU 150 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 2bm8 s MET 151 N -2.93 2.77 0.52 5.31 -1.94 -1.21 -5.08 119.30 116.74 2bm8 s MET 151 Ca 0.00 -0.21 -0.04 0.00 -1.71 0.00 0.00 55.69 53.73 2bm8 s MET 151 Cb 0.00 -2.32 -0.01 0.00 2.01 0.00 0.00 34.83 34.51 2bm8 s MET 151 CO 0.01 -0.73 0.81 0.00 -0.01 0.00 0.00 175.02 175.10 2bm8 s ALA 152 N -2.94 3.43 0.16 3.03 0.00 -1.26 -5.08 121.76 119.10 2bm8 s ALA 152 Ca 0.54 -0.71 0.07 0.00 0.00 0.00 0.00 51.96 51.86 2bm8 s ALA 152 Cb -0.10 -2.49 -0.04 0.00 0.00 0.00 0.00 23.12 20.48 2bm8 s ALA 152 CO 0.43 -0.55 -0.14 -1.01 0.00 0.00 0.00 175.76 174.48 2bm8 s HIS 153 N -2.81 1.56 1.17 0.00 3.76 -1.26 -3.86 115.29 113.86 2bm8 s HIS 153 Ca 0.50 -0.57 -0.15 0.00 -0.15 0.00 0.00 55.06 54.69 2bm8 s HIS 153 Cb -0.10 -0.77 0.28 0.00 1.11 0.00 0.00 32.58 33.09 2bm8 s HIS 153 CO 0.43 0.24 1.04 -2.14 -0.85 0.00 0.00 174.74 173.47 2bm8 s PRO 154 N -3.17 -0.95 -0.09 8.40 0.02 -1.26 -4.41 135.00 133.55 2bm8 s PRO 154 Ca 0.16 0.50 -0.05 0.00 0.02 0.00 0.00 61.00 61.63 2bm8 s PRO 154 Cb -0.03 -1.58 0.04 0.00 0.02 0.00 0.00 34.50 32.95 2bm8 s PRO 154 CO 0.05 -3.66 0.22 -1.17 -0.33 0.00 0.00 177.00 172.10 2bm8 s LEU 155 N -7.08 0.73 -0.21 -5.54 0.20 -1.26 -1.30 118.68 104.22 2bm8 s LEU 155 Ca 0.68 0.45 -0.03 0.00 0.69 0.00 0.00 54.13 55.92 2bm8 s LEU 155 Cb -0.20 0.66 -0.01 0.00 -0.43 0.00 0.00 46.19 46.22 2bm8 s LEU 155 CO 0.61 -0.13 -0.07 -0.63 -0.29 0.00 0.00 176.35 175.84 2bm8 s ILE 156 N 0.86 3.22 -0.23 6.68 1.01 -0.60 -1.24 121.20 130.90 2bm8 s ILE 156 Ca -0.06 -0.55 -0.07 0.00 0.00 0.00 0.00 60.65 59.97 2bm8 s ILE 156 Cb -0.08 -2.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 2bm8 s ILE 156 CO -0.05 0.44 0.07 0.12 0.00 0.00 0.00 174.94 175.52 2bm8 s PHE 157 N 1.36 3.11 -0.20 3.97 5.36 -0.32 -0.78 117.98 130.48 2bm8 s PHE 157 Ca 0.04 -0.31 0.02 0.00 -0.96 0.00 0.00 56.93 55.72 2bm8 s PHE 157 Cb -0.14 -2.20 0.03 0.00 -0.34 0.00 0.00 43.02 40.37 2bm8 s PHE 157 CO -0.04 -0.25 -0.17 0.42 -1.46 0.00 0.00 175.22 173.73 2bm8 s ILE 158 N 1.34 2.06 -0.34 3.12 1.01 0.25 -0.63 121.20 128.00 2bm8 s ILE 158 Ca 0.05 -1.14 -0.24 0.00 0.00 0.00 0.00 60.65 59.32 2bm8 s ILE 158 Cb -0.15 -1.97 0.01 0.00 0.01 0.00 0.00 42.46 40.36 2bm8 s ILE 158 CO 0.03 0.35 0.84 -0.62 0.00 0.00 0.00 174.94 175.55 2bm8 s ASP 159 N 1.24 6.64 0.00 3.58 3.68 0.75 -0.76 116.67 131.81 2bm8 s ASP 159 Ca 0.01 0.55 0.05 0.00 2.13 0.00 0.00 52.55 55.28 2bm8 s ASP 159 Cb -0.15 -2.43 0.10 0.00 -1.45 0.00 0.00 42.92 38.99 2bm8 s ASP 159 CO -0.10 -0.74 0.95 0.59 0.13 0.00 0.00 175.17 176.00 2bm8 n ASN 160 N 6.47 2.04 -0.12 -0.34 3.02 0.13 -2.60 115.26 123.87 2bm8 n ASN 160 Ca 0.05 -1.72 -0.23 0.00 -0.03 0.00 0.00 54.58 52.65 2bm8 n ASN 160 Cb 0.48 -0.06 -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 0.04 1.42 -2.69 5.41 0.00 -1.12 -4.77 120.51 118.80 2bm8 n ALA 161 Ca 0.04 -1.00 -0.12 0.00 0.00 0.00 0.00 53.44 52.36 2bm8 n ALA 161 Cb 0.25 0.09 0.02 0.00 0.00 0.00 0.00 19.45 19.81 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 -3.76 -1.08 -0.08 0.00 8.25 -1.26 -4.97 115.22 112.32 2bm8 n HIS 162 Ca -0.47 0.30 -0.07 0.00 -0.26 0.00 0.00 57.72 57.22 2bm8 n HIS 162 Cb 0.89 -2.89 -0.02 0.00 1.12 0.00 0.00 29.99 29.08 2bm8 n HIS 162 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2bm8 n ALA 163 N -2.81 0.72 -1.87 -1.41 0.00 -1.26 -4.67 120.51 109.21 2bm8 n ALA 163 Ca -0.06 -0.67 -0.22 0.00 0.00 0.00 0.00 53.44 52.49 2bm8 n ALA 163 Cb 0.56 0.02 0.05 0.00 0.00 0.00 0.00 19.45 20.09 2bm8 n ALA 163 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2bm8 n ASN 164 N -4.42 4.90 0.04 0.00 5.15 -1.26 -4.92 115.26 114.74 2bm8 n ASN 164 Ca -0.11 -3.77 -0.11 0.00 -0.60 0.00 0.00 54.58 49.99 2bm8 n ASN 164 Cb 0.42 -0.45 -0.04 0.00 -0.53 0.00 0.00 39.78 39.18 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 1.87 0.43 -0.89 -0.44 2.02 -1.94 -1.01 112.91 112.95 2bm8 h THR 165 Ca 0.36 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.55 2bm8 h THR 165 Cb 1.41 0.43 -0.04 0.00 -1.74 0.00 0.00 68.15 68.20 2bm8 h THR 165 CO 0.79 0.00 0.58 -0.26 0.37 0.00 0.00 175.52 177.00 2bm8 h PHE 166 N -0.36 1.12 -0.60 3.16 -1.00 -1.98 0.24 116.94 117.51 2bm8 h PHE 166 Ca 0.07 0.02 -0.05 0.00 2.81 0.00 0.00 57.97 60.83 2bm8 h PHE 166 Cb 0.47 -0.38 -0.03 0.00 3.61 0.00 0.00 35.95 39.62 2bm8 h PHE 166 CO -0.30 0.71 0.17 -0.91 -1.61 0.00 0.00 178.31 176.37 2bm8 h ASN 167 N 1.20 0.89 -0.17 2.17 2.35 -1.75 -1.24 115.58 119.03 2bm8 h ASN 167 Ca 0.32 -0.22 -0.06 0.00 -0.55 0.00 0.00 56.30 55.80 2bm8 h ASN 167 Cb -0.13 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 37.99 2bm8 h ASN 167 CO -0.07 0.87 -0.07 0.40 -1.65 0.00 0.00 177.43 176.91 2bm8 h ILE 168 N 0.86 1.22 -0.53 2.81 2.04 -0.29 -1.64 117.51 121.97 2bm8 h ILE 168 Ca 0.19 -0.92 -0.05 0.00 1.00 0.00 0.00 64.86 65.08 2bm8 h ILE 168 Cb 0.31 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 2bm8 h ILE 168 CO -0.00 0.30 0.13 -0.03 0.00 0.00 0.00 178.15 178.55 2bm8 h MET 169 N 0.47 0.84 -0.61 2.37 4.05 -0.21 -0.24 114.93 121.60 2bm8 h MET 169 Ca 0.09 -0.20 -0.05 0.00 -0.28 0.00 0.00 59.70 59.26 2bm8 h MET 169 Cb 0.42 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.09 2bm8 h MET 169 CO 0.02 0.80 0.20 -0.22 0.23 0.00 0.00 176.91 177.94 2bm8 h LYS 170 N 0.74 0.95 -0.31 0.39 3.64 -0.89 -0.92 116.57 120.17 2bm8 h LYS 170 Ca 0.16 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2bm8 h LYS 170 Cb 0.34 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2bm8 h LYS 170 CO 0.00 0.84 0.17 2.35 -2.27 0.00 0.00 179.45 180.54 2bm8 h TRP 171 N 0.88 0.42 -0.40 1.91 7.01 -1.15 -2.42 115.95 122.20 2bm8 h TRP 171 Ca 0.20 -0.01 -0.11 0.00 2.11 0.00 0.00 58.89 61.08 2bm8 h TRP 171 Cb 0.28 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.19 2bm8 h TRP 171 CO 0.02 0.35 -0.20 0.00 -2.79 0.00 0.00 178.44 175.82 2bm8 h ALA 172 N 1.04 0.89 -0.61 2.65 0.00 -0.80 0.10 119.26 122.54 2bm8 h ALA 172 Ca 0.11 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 2bm8 h ALA 172 Cb 0.07 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2bm8 h ALA 172 CO -0.02 0.63 0.01 0.28 0.00 0.00 0.00 179.25 180.15 2bm8 h VAL 173 N 0.69 1.27 0.07 0.00 2.07 -1.12 0.23 116.25 119.46 2bm8 h VAL 173 Ca 0.10 -1.14 -0.27 0.00 0.82 0.00 0.00 66.70 66.21 2bm8 h VAL 173 Cb 0.71 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 2bm8 h VAL 173 CO 0.05 0.42 -1.36 0.44 0.02 0.00 0.00 177.57 177.14 2bm8 h ASP 174 N 0.97 0.24 -0.00 0.57 3.32 -1.19 -3.41 116.42 116.93 2bm8 h ASP 174 Ca 0.17 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.91 2bm8 h ASP 174 Cb 0.55 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.02 2bm8 h ASP 174 CO 0.03 1.26 -0.03 1.41 -1.72 0.00 0.00 179.24 180.19 2bm8 n HIS 175 N -3.39 0.00 0.06 4.55 8.25 0.34 -4.93 115.22 120.10 2bm8 n HIS 175 Ca -0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 2bm8 n HIS 175 Cb 1.01 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.12 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 -1.00 0.30 -4.76 2.41 7.94 -0.20 -4.87 117.00 116.82 2bm8 n LEU 176 Ca 0.00 0.19 -0.40 0.00 -1.11 0.00 0.00 56.01 54.70 2bm8 n LEU 176 Cb 0.01 0.02 -0.04 0.00 0.53 0.00 0.00 43.42 43.94 2bm8 n LEU 176 CO 0.01 -0.57 0.79 -0.76 -1.11 0.00 0.00 177.39 175.75 2bm8 s LEU 177 N -6.42 4.48 0.47 -1.96 1.43 0.65 -5.03 118.68 112.29 2bm8 s LEU 177 Ca 0.00 2.25 0.07 0.00 -1.03 0.00 0.00 54.13 55.42 2bm8 s LEU 177 Cb 0.00 -3.72 -0.00 0.00 0.03 0.00 0.00 46.19 42.49 2bm8 s LEU 177 CO 0.00 -0.23 0.34 -1.61 0.23 0.00 0.00 176.35 175.08 2bm8 s GLU 178 N -1.64 2.33 0.21 1.70 2.02 -1.26 -4.91 118.70 117.15 2bm8 s GLU 178 Ca 0.47 -1.83 -0.32 0.00 0.02 0.00 0.00 54.97 53.31 2bm8 s GLU 178 Cb -0.31 -2.15 -0.13 0.00 0.10 0.00 0.00 34.13 31.64 2bm8 s GLU 178 CO 0.39 -0.36 1.58 -1.91 0.02 0.00 0.00 175.26 174.98 2bm8 n GLU 179 N -1.56 2.37 0.00 1.61 2.13 -1.26 -1.80 120.64 122.12 2bm8 n GLU 179 Ca 0.00 0.85 0.00 0.00 0.66 0.00 0.00 57.16 58.67 2bm8 n GLU 179 Cb 0.64 -2.62 0.00 0.00 0.27 0.00 0.00 31.44 29.73 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 3.06 3.10 3.76 8.31 0.00 -0.52 -4.97 105.19 117.93 2bm8 n GLY 180 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 0.42 5.79 -0.10 1.61 1.01 -0.75 -4.63 116.67 120.01 2bm8 s ASP 181 Ca 0.00 2.53 -0.06 0.00 0.71 0.00 0.00 52.55 55.73 2bm8 s ASP 181 Cb 0.00 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 2bm8 s ASP 181 CO 0.00 -1.20 0.13 -0.31 0.21 0.00 0.00 175.17 174.00 2bm8 s TYR 182 N -1.42 3.54 -0.18 4.23 1.51 -0.37 -1.33 117.35 123.33 2bm8 s TYR 182 Ca 0.67 0.47 0.01 0.00 -1.01 0.00 0.00 57.07 57.21 2bm8 s TYR 182 Cb -0.34 -1.91 0.03 0.00 -0.11 0.00 0.00 41.96 39.63 2bm8 s TYR 182 CO 0.41 0.70 -0.15 0.12 -1.11 0.00 0.00 175.55 175.53 2bm8 s PHE 183 N -1.05 2.55 -0.09 2.71 5.36 0.26 -1.17 117.98 126.56 2bm8 s PHE 183 Ca 0.16 -1.58 0.04 0.00 -0.96 0.00 0.00 56.93 54.58 2bm8 s PHE 183 Cb -0.12 -1.75 0.00 0.00 -0.34 0.00 0.00 43.02 40.82 2bm8 s PHE 183 CO 0.05 -0.76 -0.21 0.42 -1.46 0.00 0.00 175.22 173.26 2bm8 s ILE 184 N 1.36 1.84 -0.30 3.12 1.01 0.20 -1.62 121.20 126.80 2bm8 s ILE 184 Ca 0.02 -0.89 -0.03 0.00 0.00 0.00 0.00 60.65 59.75 2bm8 s ILE 184 Cb -0.15 -1.60 0.04 0.00 0.01 0.00 0.00 42.46 40.76 2bm8 s ILE 184 CO -0.10 0.51 0.01 -0.63 0.00 0.00 0.00 174.94 174.73 2bm8 s ILE 185 N 0.43 3.16 0.29 2.92 1.01 -0.56 -0.18 121.20 128.27 2bm8 s ILE 185 Ca -0.18 -1.23 -0.21 0.00 0.00 0.00 0.00 60.65 59.03 2bm8 s ILE 185 Cb -0.17 -2.76 -0.09 0.00 0.01 0.00 0.00 42.46 39.45 2bm8 s ILE 185 CO 0.07 -0.05 0.81 -1.61 0.00 0.00 0.00 174.94 174.17 2bm8 s GLU 186 N 1.31 4.32 0.00 2.79 2.02 -1.07 -4.54 118.70 123.52 2bm8 s GLU 186 Ca -0.03 1.01 0.00 0.00 0.02 0.00 0.00 54.97 55.96 2bm8 s GLU 186 Cb -0.19 -2.73 0.00 0.00 0.10 0.00 0.00 34.13 31.32 2bm8 s GLU 186 CO -0.01 0.29 0.00 -0.25 0.02 0.00 0.00 175.26 175.31 2bm8 n ASP 187 N 0.39 0.00 0.10 -0.19 8.00 0.80 -4.55 116.55 121.09 2bm8 n ASP 187 Ca 0.01 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.48 2bm8 n ASP 187 Cb 0.51 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.56 2bm8 n ASP 187 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 2bm8 h MET 188 N 0.00 0.00 -0.48 -1.24 4.05 -1.87 -3.37 114.93 112.03 2bm8 h MET 188 Ca 0.00 0.00 0.02 0.00 -0.28 0.00 0.00 59.70 59.44 2bm8 h MET 188 Cb 0.00 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 30.77 2bm8 h MET 188 CO 0.00 0.77 0.29 0.82 0.23 0.00 0.00 176.91 179.02 2bm8 h ILE 189 N 0.00 1.06 -0.65 1.77 2.04 -1.83 -1.50 117.51 118.41 2bm8 h ILE 189 Ca -0.01 -0.20 0.08 0.00 1.00 0.00 0.00 64.86 65.73 2bm8 h ILE 189 Cb 1.59 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 2bm8 h ILE 189 CO 0.10 0.11 0.43 -0.65 0.00 0.00 0.00 178.15 178.14 2bm8 h PRO 190 N 0.59 0.56 -0.21 2.37 0.11 -1.84 -1.93 132.00 131.65 2bm8 h PRO 190 Ca 0.19 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 66.09 2bm8 h PRO 190 Cb -0.00 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 30.99 2bm8 h PRO 190 CO -0.08 0.37 -0.55 1.88 -0.21 0.00 0.00 178.00 179.41 2bm8 h TYR 191 N 0.58 0.97 -0.52 0.65 -1.99 -1.51 -2.37 116.97 112.77 2bm8 h TYR 191 Ca 0.29 -0.37 -0.01 0.00 2.00 0.00 0.00 58.73 60.63 2bm8 h TYR 191 Cb 0.39 -0.17 -0.03 0.00 2.00 0.00 0.00 36.73 38.92 2bm8 h TYR 191 CO -0.00 1.18 0.28 -1.49 -0.00 0.00 0.00 178.16 178.13 2bm8 h TRP 192 N 0.48 0.70 -0.01 4.88 6.55 -1.12 -1.46 115.95 125.97 2bm8 h TRP 192 Ca -0.01 -0.01 -0.14 0.00 0.95 0.00 0.00 58.89 59.68 2bm8 h TRP 192 Cb 1.17 -0.23 -0.02 0.00 -0.86 0.00 0.00 29.16 29.22 2bm8 h TRP 192 CO 0.09 0.50 -0.65 -0.92 -1.05 0.00 0.00 178.44 176.40 2bm8 h TYR 193 N 0.73 0.08 -0.14 0.49 3.20 -1.33 -0.11 116.97 119.89 2bm8 h TYR 193 Ca 0.19 -0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.83 2bm8 h TYR 193 Cb 0.04 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.29 2bm8 h TYR 193 CO 0.00 0.70 -0.70 -0.09 -1.64 0.00 0.00 178.16 176.43 2bm8 h ARG 194 N 0.04 0.60 0.03 1.82 2.43 -0.95 -3.02 114.38 115.33 2bm8 h ARG 194 Ca -0.01 -0.46 -0.33 0.00 -0.81 0.00 0.00 59.98 58.37 2bm8 h ARG 194 Cb 1.16 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.75 2bm8 h ARG 194 CO 0.09 1.08 -1.97 0.66 -1.51 0.00 0.00 179.97 178.32 2bm8 n TYR 195 N -3.90 0.78 -3.17 2.20 0.53 -0.59 -4.61 117.16 108.40 2bm8 n TYR 195 Ca -0.05 0.24 -0.20 0.00 -1.02 0.00 0.00 57.90 56.87 2bm8 n TYR 195 Cb 0.70 -1.13 -0.04 0.00 -1.03 0.00 0.00 39.34 37.84 2bm8 n TYR 195 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2bm8 n ALA 196 N -2.75 2.43 -0.23 -0.72 0.00 -0.06 -4.98 120.51 114.21 2bm8 n ALA 196 Ca -0.26 -3.59 -0.00 0.00 0.00 0.00 0.00 53.44 49.59 2bm8 n ALA 196 Cb 1.07 -0.89 0.12 0.00 0.00 0.00 0.00 19.45 19.75 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 3.20 0.55 -0.12 0.00 0.13 -1.64 -0.84 132.00 133.29 2bm8 h PRO 197 Ca 0.10 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 65.14 2bm8 h PRO 197 Cb 0.89 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 2bm8 h PRO 197 CO 0.54 0.37 -0.14 1.96 -0.23 0.00 0.00 178.00 180.49 2bm8 h GLN 198 N 0.57 0.30 -0.31 0.86 4.20 -1.93 -2.49 115.11 116.31 2bm8 h GLN 198 Ca 0.32 -0.17 -0.15 0.00 0.06 0.00 0.00 58.65 58.70 2bm8 h GLN 198 Cb 0.31 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 2bm8 h GLN 198 CO -0.25 0.73 -0.43 -0.07 -0.67 0.00 0.00 178.83 178.14 2bm8 h LEU 199 N -0.11 0.83 -0.15 1.46 3.38 -1.94 -2.62 115.31 116.16 2bm8 h LEU 199 Ca 0.01 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 2bm8 h LEU 199 Cb 0.69 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2bm8 h LEU 199 CO 0.03 1.14 0.07 0.15 0.09 0.00 0.00 178.44 179.92 2bm8 h PHE 200 N 0.62 0.22 -0.64 1.13 3.57 -1.20 -0.78 116.94 119.86 2bm8 h PHE 200 Ca 0.04 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 2bm8 h PHE 200 Cb 0.99 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.63 2bm8 h PHE 200 CO 0.05 0.27 0.34 0.77 -2.23 0.00 0.00 178.31 177.51 2bm8 h SER 201 N 0.11 0.79 -0.11 0.41 0.02 -1.40 -1.03 113.55 112.34 2bm8 h SER 201 Ca 0.05 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 2bm8 h SER 201 Cb 0.13 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 2bm8 h SER 201 CO -0.01 0.64 -0.01 -0.08 -1.14 0.00 0.00 176.83 176.23 2bm8 h GLU 202 N 0.89 0.20 -0.11 3.45 4.81 -1.29 -1.73 114.58 120.81 2bm8 h GLU 202 Ca 0.23 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 2bm8 h GLU 202 Cb 0.03 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 2bm8 h GLU 202 CO -0.04 0.48 0.01 1.88 -0.73 0.00 0.00 179.01 180.62 2bm8 h TYR 203 N -0.10 0.19 -0.39 0.92 0.99 -0.57 -0.74 116.97 117.27 2bm8 h TYR 203 Ca 0.03 -0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.73 2bm8 h TYR 203 Cb 0.40 -0.05 -0.02 0.00 1.00 0.00 0.00 36.73 38.06 2bm8 h TYR 203 CO 0.04 0.38 0.22 1.25 -0.00 0.00 0.00 178.16 180.06 2bm8 h LEU 204 N -0.06 0.48 -2.51 3.88 6.46 -1.33 -2.83 115.31 119.40 2bm8 h LEU 204 Ca 0.03 -0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2bm8 h LEU 204 Cb 0.30 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.11 2bm8 h LEU 204 CO 0.00 0.42 0.02 1.23 -0.62 0.00 0.00 178.44 179.49 2bm8 h GLY 205 N 0.50 0.00 2.00 3.75 0.00 -1.02 -1.86 103.07 106.45 2bm8 h GLY 205 Ca 0.14 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 2bm8 h GLY 205 CO -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 176.54 176.28 2bm8 h ALA 206 N 1.97 1.41 -0.27 3.60 0.00 -0.87 -2.92 119.26 122.19 2bm8 h ALA 206 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2bm8 h ALA 206 Cb 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2bm8 h ALA 206 CO -0.00 0.30 0.00 1.19 0.00 0.00 0.00 179.25 180.74 2bm8 n PHE 207 N -3.98 0.86 0.48 0.00 3.01 -0.70 -4.58 117.46 112.56 2bm8 n PHE 207 Ca -0.02 -0.31 0.12 0.00 1.01 0.00 0.00 57.45 58.25 2bm8 n PHE 207 Cb 0.32 -0.24 0.46 0.00 -0.01 0.00 0.00 39.48 40.01 2bm8 n PHE 207 CO 0.00 0.00 0.00 2.89 1.01 0.00 0.00 176.76 180.66 2bm8 n ARG 208 N 0.31 0.19 0.00 -1.08 -4.01 -1.10 -1.19 116.66 109.79 2bm8 n ARG 208 Ca 0.12 0.35 0.13 0.00 -1.04 0.00 0.00 57.85 57.41 2bm8 n ARG 208 Cb 0.61 -1.82 0.34 0.00 -3.04 0.00 0.00 32.46 28.55 2bm8 n ARG 208 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 2bm8 n ASP 209 N -2.18 0.73 0.00 2.89 8.00 -1.26 -4.47 116.55 120.26 2bm8 n ASP 209 Ca 0.03 -0.55 0.00 0.00 0.71 0.00 0.00 54.79 54.98 2bm8 n ASP 209 Cb 0.28 0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 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 -1.08 0.00 -4.19 2.53 0.24 -1.01 -4.92 118.33 109.90 2bm8 n VAL 210 Ca 0.09 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.23 2bm8 n VAL 210 Cb 0.34 0.08 -0.14 0.00 -1.47 0.00 0.00 33.84 32.65 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 -1.82 2.06 0.20 1.34 1.43 -0.33 -2.66 118.68 118.89 2bm8 s LEU 211 Ca 0.00 -0.19 0.11 0.00 -1.03 0.00 0.00 54.13 53.02 2bm8 s LEU 211 Cb 0.00 -0.31 -0.04 0.00 0.03 0.00 0.00 46.19 45.87 2bm8 s LEU 211 CO 0.00 0.03 -0.21 -0.94 0.23 0.00 0.00 176.35 175.46 2bm8 s SER 212 N -0.40 3.60 -0.22 2.29 1.04 -0.51 -4.51 113.70 114.98 2bm8 s SER 212 Ca 0.00 -0.82 -0.23 0.00 0.48 0.00 0.00 55.95 55.38 2bm8 s SER 212 Cb -0.04 -0.34 -0.01 0.00 0.10 0.00 0.00 66.02 65.72 2bm8 s SER 212 CO -0.00 0.11 0.75 -0.32 0.98 0.00 0.00 173.24 174.76 2bm8 s MET 213 N -2.76 4.20 -0.55 4.02 1.75 -1.26 -1.47 119.30 123.23 2bm8 s MET 213 Ca 0.22 0.81 -0.28 0.00 -1.25 0.00 0.00 55.69 55.19 2bm8 s MET 213 Cb -0.08 -3.62 0.03 0.00 2.84 0.00 0.00 34.83 34.00 2bm8 s MET 213 CO 0.11 -0.40 1.14 0.34 -0.65 0.00 0.00 175.02 175.55 2bm8 s ASP 214 N 1.30 6.48 0.09 1.11 -1.08 -0.47 -4.90 116.67 119.20 2bm8 s ASP 214 Ca 0.32 0.14 0.26 0.00 -0.52 0.00 0.00 52.55 52.75 2bm8 s ASP 214 Cb -0.16 -2.53 1.01 0.00 -1.46 0.00 0.00 42.92 39.78 2bm8 s ASP 214 CO 0.09 -1.38 1.81 0.23 0.52 0.00 0.00 175.17 176.44 2bm8 n MET 215 N 8.12 0.10 -0.02 4.34 2.81 -1.26 -1.04 117.12 130.17 2bm8 n MET 215 Ca 0.08 0.13 -0.06 0.00 -1.81 0.00 0.00 57.70 56.04 2bm8 n MET 215 Cb 0.49 -1.63 0.12 0.00 -0.71 0.00 0.00 33.22 31.49 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 0.61 0.00 4.03 5.85 -1.99 -3.37 115.31 120.44 2bm8 h LEU 216 Ca 0.00 -0.24 -0.22 0.00 0.84 0.00 0.00 57.88 58.25 2bm8 h LEU 216 Cb 0.54 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 2bm8 h LEU 216 CO 0.00 0.90 -1.94 -1.22 -0.34 0.00 0.00 178.44 175.84 2bm8 n TYR 217 N -4.07 0.00 0.12 1.25 0.53 -1.07 -4.69 117.16 109.24 2bm8 n TYR 217 Ca -0.01 0.00 0.08 0.00 -1.02 0.00 0.00 57.90 56.95 2bm8 n TYR 217 Cb 0.47 -0.65 0.56 0.00 -1.03 0.00 0.00 39.34 38.69 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 0.79 1.95 -0.62 -0.72 0.00 -1.25 -1.69 119.26 117.73 2bm8 h ALA 218 Ca -0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2bm8 h ALA 218 Cb 1.72 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2bm8 h ALA 218 CO 0.02 0.02 0.00 0.09 0.00 0.00 0.00 179.25 179.38 2bm8 n ASN 219 N -4.50 4.53 0.02 0.00 3.02 -1.26 -0.99 115.26 116.07 2bm8 n ASN 219 Ca 0.01 -2.41 0.11 0.00 -0.03 0.00 0.00 54.58 52.27 2bm8 n ASN 219 Cb 0.15 -0.55 0.09 0.00 -0.61 0.00 0.00 39.78 38.87 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 1.05 3.63 -3.26 5.41 0.00 -0.63 -4.89 120.51 121.80 2bm8 n ALA 220 Ca 0.25 -0.40 -0.14 0.00 0.00 0.00 0.00 53.44 53.15 2bm8 n ALA 220 Cb 0.84 -1.01 -0.09 0.00 0.00 0.00 0.00 19.45 19.19 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 -3.48 -0.25 0.53 0.00 1.04 -1.26 -4.84 113.70 105.44 2bm8 s SER 221 Ca 0.07 0.23 0.20 0.00 0.48 0.00 0.00 55.95 56.92 2bm8 s SER 221 Cb 0.16 0.39 1.39 0.00 0.10 0.00 0.00 66.02 68.06 2bm8 s SER 221 CO 0.77 -0.42 2.16 0.77 0.98 0.00 0.00 173.24 177.50 2bm8 h SER 222 N 4.03 0.00 0.60 7.02 4.64 -1.95 0.34 113.55 128.22 2bm8 h SER 222 Ca -0.29 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.81 2bm8 h SER 222 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2bm8 h SER 222 CO 0.38 0.02 -0.99 1.56 -0.87 0.00 0.00 176.83 176.93 2bm8 h GLN 223 N 0.00 0.23 -0.01 4.77 4.20 -1.97 -3.29 115.11 119.04 2bm8 h GLN 223 Ca -0.00 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 58.42 2bm8 h GLN 223 Cb 0.04 0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.91 2bm8 h GLN 223 CO 0.00 1.05 -0.32 1.28 -0.67 0.00 0.00 178.83 180.17 2bm8 n LEU 224 N -3.61 1.72 -2.86 1.46 4.77 -0.97 -0.14 117.00 117.37 2bm8 n LEU 224 Ca -0.05 -0.59 -0.41 0.00 -0.03 0.00 0.00 56.01 54.94 2bm8 n LEU 224 Cb 0.88 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.86 2bm8 n LEU 224 CO 0.50 0.31 0.81 -0.67 -1.33 0.00 0.00 177.39 177.01 2bm8 n ASP 225 N -0.11 0.67 -2.22 -1.43 -0.08 0.07 -1.16 116.55 112.30 2bm8 n ASP 225 Ca 0.11 0.65 -0.14 0.00 -1.51 0.00 0.00 54.79 53.91 2bm8 n ASP 225 Cb 0.43 -0.55 -0.02 0.00 2.34 0.00 0.00 41.12 43.32 2bm8 n ASP 225 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2bm8 n ARG 226 N 3.06 -1.94 0.00 -0.67 1.74 -0.16 -4.68 116.66 114.01 2bm8 n ARG 226 Ca 0.23 0.72 0.00 0.00 -0.77 0.00 0.00 57.85 58.03 2bm8 n ARG 226 Cb -0.03 -5.26 0.00 0.00 -1.02 0.00 0.00 32.46 26.15 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 -0.73 0.10 3.42 -0.13 0.00 -0.31 -4.93 105.19 102.61 2bm8 n GLY 227 Ca -0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.41 5.10 0.14 1.61 1.01 -1.25 -1.49 120.40 125.10 2bm8 s VAL 228 Ca 0.00 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.28 2bm8 s VAL 228 Cb 0.00 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 2bm8 s VAL 228 CO 0.00 -0.63 -0.11 -0.76 0.00 0.00 0.00 175.10 173.61 2bm8 s LEU 229 N 2.02 2.97 0.14 3.92 1.43 -0.64 -1.37 118.68 127.16 2bm8 s LEU 229 Ca 0.09 -0.49 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 2bm8 s LEU 229 Cb -0.22 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 2bm8 s LEU 229 CO 0.09 0.14 0.11 0.00 0.23 0.00 0.00 176.35 176.93 2bm8 s ARG 230 N -2.48 1.00 -0.31 1.70 1.70 -0.54 -0.57 118.95 119.45 2bm8 s ARG 230 Ca 0.22 -1.39 -0.29 0.00 -0.47 0.00 0.00 55.73 53.80 2bm8 s ARG 230 Cb -0.10 0.27 0.01 0.00 -0.57 0.00 0.00 34.95 34.57 2bm8 s ARG 230 CO 0.14 -0.31 1.13 0.50 -1.08 0.00 0.00 175.30 175.68 2bm8 s ARG 231 N -4.04 4.05 0.59 3.89 3.00 -0.44 -1.43 118.95 124.58 2bm8 s ARG 231 Ca 0.23 1.14 -0.13 0.00 -1.00 0.00 0.00 55.73 55.97 2bm8 s ARG 231 Cb 0.06 -3.76 -0.05 0.00 0.00 0.00 0.00 34.95 31.21 2bm8 s ARG 231 CO 0.02 -0.93 1.02 0.08 0.00 0.00 0.00 175.30 175.49 2bm8 s VAL 232 N 3.77 4.43 0.20 7.11 1.01 -1.09 -1.44 120.40 134.39 2bm8 s VAL 232 Ca 0.48 0.96 -0.31 0.00 0.00 0.00 0.00 61.98 63.10 2bm8 s VAL 232 Cb -0.13 -3.68 -0.15 0.00 0.00 0.00 0.00 36.38 32.41 2bm8 s VAL 232 CO 0.17 -0.86 1.09 0.00 0.00 0.00 0.00 175.10 175.50 2bm8 n ALA 233 N -2.31 -0.77 1.23 5.51 0.00 -1.26 -4.76 120.51 118.15 2bm8 n ALA 233 Ca 0.07 0.45 0.13 0.00 0.00 0.00 0.00 53.44 54.08 2bm8 n ALA 233 Cb 0.54 -2.00 0.30 0.00 0.00 0.00 0.00 19.45 18.28 2bm8 n ALA 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50