#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 5.60 0.08 0.53 5.68 -1.26 -3.95 116.55 123.23 2bm8 n ASP 3 Ca 0.00 -3.45 -0.07 0.00 -0.50 0.00 0.00 54.79 50.77 2bm8 n ASP 3 Cb 0.00 -0.90 0.07 0.00 -1.14 0.00 0.00 41.12 39.15 2bm8 n ASP 3 CO 0.00 0.00 0.00 0.10 -1.33 0.00 0.00 177.20 175.97 2bm8 h TYR 4 N 1.36 0.34 0.00 2.11 -0.00 -2.07 -3.03 116.97 115.69 2bm8 h TYR 4 Ca 0.52 -0.15 0.00 0.00 0.00 0.00 0.00 58.73 59.10 2bm8 h TYR 4 Cb 1.64 -0.05 0.00 0.00 0.00 0.00 0.00 36.73 38.31 2bm8 h TYR 4 CO 1.27 0.87 -0.14 -1.13 -0.00 0.00 0.00 178.16 179.03 2bm8 n SER 5 N -3.81 0.48 -0.04 0.10 3.41 -1.25 -3.50 113.62 109.01 2bm8 n SER 5 Ca -0.03 0.40 -0.22 0.00 -0.26 0.00 0.00 58.87 58.76 2bm8 n SER 5 Cb 0.68 -0.44 -0.13 0.00 -0.26 0.00 0.00 64.21 64.06 2bm8 n SER 5 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2bm8 n ARG 6 N -1.89 0.69 -1.58 4.33 0.00 -1.25 -5.01 116.66 111.95 2bm8 n ARG 6 Ca 0.06 0.38 -0.39 0.00 -0.00 0.00 0.00 57.85 57.90 2bm8 n ARG 6 Cb 0.39 -1.72 0.03 0.00 0.00 0.00 0.00 32.46 31.16 2bm8 n ARG 6 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2bm8 n GLN 7 N -3.86 0.99 -4.09 -0.14 -0.06 -1.15 -5.01 117.38 104.06 2bm8 n GLN 7 Ca -0.32 0.37 -0.35 0.00 -2.00 0.00 0.00 57.00 54.70 2bm8 n GLN 7 Cb 0.91 -2.01 -0.14 0.00 -4.06 0.00 0.00 30.24 24.95 2bm8 n GLN 7 CO 0.00 0.00 0.00 1.21 -0.20 0.00 0.00 177.06 178.07 2bm8 s ASN 8 N -1.02 4.43 -0.37 1.69 2.47 -1.26 -5.01 114.94 115.86 2bm8 s ASN 8 Ca 0.69 -0.32 -0.15 0.00 0.42 0.00 0.00 52.86 53.51 2bm8 s ASN 8 Cb -0.48 -1.75 -0.00 0.00 -1.45 0.00 0.00 41.25 37.57 2bm8 s ASN 8 CO 0.53 0.04 0.31 -0.36 -3.72 0.00 0.00 177.10 173.89 2bm8 s PHE 9 N 1.15 3.22 0.73 0.43 0.40 -1.26 -5.08 117.98 117.57 2bm8 s PHE 9 Ca 0.02 -0.28 -0.11 0.00 -0.60 0.00 0.00 56.93 55.96 2bm8 s PHE 9 Cb -0.15 -2.61 0.03 0.00 0.51 0.00 0.00 43.02 40.81 2bm8 s PHE 9 CO -0.00 -0.48 1.07 -0.65 0.70 0.00 0.00 175.22 175.86 2bm8 s GLN 10 N 1.84 2.61 -0.42 0.44 -0.21 -1.26 -4.97 119.66 117.68 2bm8 s GLN 10 Ca 0.08 0.99 -0.29 0.00 0.02 0.00 0.00 55.36 56.16 2bm8 s GLN 10 Cb -0.18 -1.95 0.02 0.00 1.00 0.00 0.00 33.01 31.90 2bm8 s GLN 10 CO 0.11 -1.34 1.26 0.34 -2.12 0.00 0.00 175.29 173.54 2bm8 s ASP 11 N -3.67 6.54 0.45 5.90 2.15 -1.26 -4.88 116.67 121.90 2bm8 s ASP 11 Ca 0.59 0.73 0.31 0.00 0.43 0.00 0.00 52.55 54.61 2bm8 s ASP 11 Cb -0.15 -2.54 1.36 0.00 -0.30 0.00 0.00 42.92 41.29 2bm8 s ASP 11 CO 0.55 -1.28 1.92 -0.07 -0.17 0.00 0.00 175.17 176.12 2bm8 h LEU 12 N 11.50 0.00 -1.59 -1.34 4.07 -2.02 -1.98 115.31 123.95 2bm8 h LEU 12 Ca -0.25 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.67 2bm8 h LEU 12 Cb 1.08 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.82 2bm8 h LEU 12 CO 1.09 0.00 -0.14 0.78 -1.08 0.00 0.00 178.44 179.09 2bm8 h ASN 13 N 0.00 0.07 -0.45 -0.43 2.35 -2.00 -2.71 115.58 112.41 2bm8 h ASN 13 Ca 0.00 -0.01 0.13 0.00 -0.55 0.00 0.00 56.30 55.87 2bm8 h ASN 13 Cb 0.35 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.69 2bm8 h ASN 13 CO 0.00 0.23 0.35 -0.07 -1.65 0.00 0.00 177.43 176.29 2bm8 h LEU 14 N 0.08 0.00 -1.31 1.61 4.07 -1.76 -2.33 115.31 115.66 2bm8 h LEU 14 Ca 0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.98 2bm8 h LEU 14 Cb 0.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 2bm8 h LEU 14 CO 0.02 0.00 -0.03 0.49 -1.08 0.00 0.00 178.44 177.84 2bm8 n PHE 15 N -4.23 0.00 -1.67 1.13 0.99 -1.02 -4.88 117.46 107.78 2bm8 n PHE 15 Ca 0.08 0.00 -0.52 0.00 -0.00 0.00 0.00 57.45 57.01 2bm8 n PHE 15 Cb 0.55 -0.01 -0.06 0.00 -1.00 0.00 0.00 39.48 38.96 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 0.57 1.66 -0.83 -1.08 0.63 -0.88 -1.31 116.66 115.43 2bm8 n ARG 16 Ca 0.16 0.60 0.00 0.00 -0.92 0.00 0.00 57.85 57.69 2bm8 n ARG 16 Cb 0.45 -2.43 0.00 0.00 0.45 0.00 0.00 32.46 30.94 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 4.60 0.97 1.09 5.14 0.00 -1.26 -4.77 105.19 110.96 2bm8 n GLY 17 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 0.84 0.00 0.99 4.77 -0.43 -5.09 117.00 118.08 2bm8 n LEU 18 Ca 0.00 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2bm8 n LEU 18 Cb 0.00 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 2bm8 n LEU 18 CO 0.00 -0.61 0.00 0.61 -1.33 0.00 0.00 177.39 176.06 2bm8 n GLY 19 N 3.30 1.59 0.24 -0.72 0.00 -0.59 -4.84 105.19 104.16 2bm8 n GLY 19 Ca 0.00 -2.24 -0.08 0.00 0.00 0.00 0.00 46.02 43.71 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 0.64 -3.70 1.61 5.08 -1.99 -3.43 114.58 112.79 2bm8 h GLU 20 Ca 0.00 -0.30 -0.43 0.00 -1.00 0.00 0.00 59.36 57.63 2bm8 h GLU 20 Cb 0.00 -0.01 -0.38 0.00 0.50 0.00 0.00 28.75 28.87 2bm8 h GLU 20 CO 0.00 0.89 -0.77 0.34 -1.00 0.00 0.00 179.01 178.48 2bm8 s ASP 21 N -6.83 1.51 0.54 1.42 -1.08 -1.26 -5.02 116.67 105.95 2bm8 s ASP 21 Ca -0.08 -0.08 0.26 0.00 -0.52 0.00 0.00 52.55 52.13 2bm8 s ASP 21 Cb 0.12 -0.43 1.53 0.00 -1.46 0.00 0.00 42.92 42.69 2bm8 s ASP 21 CO 0.83 -0.19 2.14 1.55 0.52 0.00 0.00 175.17 180.02 2bm8 h PRO 22 N 8.26 0.00 -6.96 4.34 0.13 -1.90 -3.43 132.00 132.43 2bm8 h PRO 22 Ca -0.21 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.43 2bm8 h PRO 22 Cb 1.13 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.30 2bm8 h PRO 22 CO 0.27 0.07 0.46 0.00 -0.23 0.00 0.00 178.00 178.57 2bm8 s ALA 23 N -4.49 3.08 0.24 -0.56 0.00 -1.26 -4.47 121.76 114.31 2bm8 s ALA 23 Ca -0.04 0.85 -0.28 0.00 0.00 0.00 0.00 51.96 52.49 2bm8 s ALA 23 Cb 0.15 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.84 2bm8 s ALA 23 CO 0.59 -0.43 0.91 -0.47 0.00 0.00 0.00 175.76 176.35 2bm8 s TYR 24 N -1.54 3.92 -0.00 0.00 5.04 -1.26 -4.88 117.35 118.63 2bm8 s TYR 24 Ca 0.59 1.84 0.00 0.00 -2.44 0.00 0.00 57.07 57.06 2bm8 s TYR 24 Cb -0.27 -2.93 -0.00 0.00 0.35 0.00 0.00 41.96 39.12 2bm8 s TYR 24 CO 0.33 0.43 -0.01 -1.01 -1.34 0.00 0.00 175.55 173.95 2bm8 s HIS 25 N -1.25 0.09 0.61 4.97 3.76 -1.26 -5.00 115.29 117.20 2bm8 s HIS 25 Ca 0.42 -0.02 -0.19 0.00 -0.15 0.00 0.00 55.06 55.12 2bm8 s HIS 25 Cb -0.24 -0.06 -0.03 0.00 1.11 0.00 0.00 32.58 33.36 2bm8 s HIS 25 CO 0.29 -0.00 1.29 -2.14 -0.85 0.00 0.00 174.74 173.34 2bm8 s PRO 26 N -0.01 2.80 0.56 8.40 0.02 -1.26 -4.94 135.00 140.57 2bm8 s PRO 26 Ca 0.00 2.06 -0.21 0.00 0.02 0.00 0.00 61.00 62.87 2bm8 s PRO 26 Cb -0.00 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.49 2bm8 s PRO 26 CO -0.00 -1.40 1.36 -2.30 -0.33 0.00 0.00 177.00 174.33 2bm8 n PRO 27 N -1.59 1.65 -4.21 5.54 -0.02 -1.26 -5.00 135.00 130.11 2bm8 n PRO 27 Ca 0.14 0.61 -0.34 0.00 -2.02 0.00 0.00 63.50 61.88 2bm8 n PRO 27 Cb 0.48 -2.58 -0.10 0.00 -0.02 0.00 0.00 33.50 31.27 2bm8 n PRO 27 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2bm8 s VAL 28 N -1.29 4.43 -0.02 -1.45 -7.23 -1.26 -5.10 120.40 108.48 2bm8 s VAL 28 Ca 0.73 -0.17 -0.20 0.00 -1.81 0.00 0.00 61.98 60.53 2bm8 s VAL 28 Cb -0.41 -2.95 -0.05 0.00 0.56 0.00 0.00 36.38 33.53 2bm8 s VAL 28 CO 0.48 0.51 0.57 -0.22 -0.31 0.00 0.00 175.10 176.13 2bm8 s LEU 29 N 0.04 4.40 0.00 1.32 2.96 -1.26 -4.72 118.68 121.42 2bm8 s LEU 29 Ca 0.03 1.11 0.00 0.00 -0.22 0.00 0.00 54.13 55.05 2bm8 s LEU 29 Cb -0.13 -2.88 0.00 0.00 0.50 0.00 0.00 46.19 43.68 2bm8 s LEU 29 CO 0.02 0.09 0.00 0.41 -1.32 0.00 0.00 176.35 175.55 2bm8 n THR 30 N 2.83 0.00 -1.76 3.68 -1.04 -1.26 -4.79 114.28 111.94 2bm8 n THR 30 Ca -0.07 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 61.99 2bm8 n THR 30 Cb 0.51 -0.88 0.08 0.00 -1.82 0.00 0.00 70.33 68.22 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 -2.10 1.16 -3.54 8.00 5.75 -1.26 -5.07 116.55 119.49 2bm8 n ASP 31 Ca 0.00 -2.63 -0.13 0.00 -0.01 0.00 0.00 54.79 52.02 2bm8 n ASP 31 Cb 0.50 -0.34 -0.04 0.00 -1.03 0.00 0.00 41.12 40.20 2bm8 n ASP 31 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bm8 s ARG 32 N -1.37 1.10 0.52 0.11 1.70 -1.26 -5.12 118.95 114.63 2bm8 s ARG 32 Ca 0.22 -0.31 -0.19 0.00 -0.47 0.00 0.00 55.73 54.98 2bm8 s ARG 32 Cb 0.22 0.50 -0.07 0.00 -0.57 0.00 0.00 34.95 35.03 2bm8 s ARG 32 CO -0.04 -0.42 1.08 -1.25 -1.08 0.00 0.00 175.30 173.59 2bm8 s PRO 33 N -2.82 3.56 0.35 3.89 0.04 -1.26 -4.93 135.00 133.83 2bm8 s PRO 33 Ca -0.03 1.45 0.07 0.00 0.04 0.00 0.00 61.00 62.53 2bm8 s PRO 33 Cb -0.00 -2.05 0.66 0.00 0.04 0.00 0.00 34.50 33.14 2bm8 s PRO 33 CO -0.05 -0.64 1.86 -0.09 0.04 0.00 0.00 177.00 178.12 2bm8 h ARG 34 N 1.30 0.36 -4.24 4.56 2.43 -2.01 -3.38 114.38 113.39 2bm8 h ARG 34 Ca -0.49 -0.09 -0.74 0.00 -0.81 0.00 0.00 59.98 57.85 2bm8 h ARG 34 Cb 1.24 -0.04 -0.27 0.00 -0.42 0.00 0.00 29.97 30.47 2bm8 h ARG 34 CO 0.58 0.49 -0.34 -0.51 -1.51 0.00 0.00 179.97 178.68 2bm8 s ASP 35 N -6.82 5.87 -0.14 -3.80 1.01 -1.26 -5.06 116.67 106.46 2bm8 s ASP 35 Ca -0.06 -1.82 -0.22 0.00 0.71 0.00 0.00 52.55 51.16 2bm8 s ASP 35 Cb 0.15 -2.08 -0.03 0.00 1.01 0.00 0.00 42.92 41.97 2bm8 s ASP 35 CO 0.75 -0.73 0.67 0.86 0.21 0.00 0.00 175.17 176.93 2bm8 s TRP 36 N 1.45 3.47 0.24 4.23 -0.11 -1.26 -5.04 118.94 121.91 2bm8 s TRP 36 Ca 0.05 1.09 -0.30 0.00 1.22 0.00 0.00 56.10 58.16 2bm8 s TRP 36 Cb -0.27 -2.81 -0.09 0.00 -1.50 0.00 0.00 33.47 28.80 2bm8 s TRP 36 CO 0.01 -0.06 1.23 -1.25 -4.62 0.00 0.00 176.95 172.26 2bm8 s PRO 37 N 1.43 4.46 0.51 5.86 0.04 -1.26 -4.94 135.00 141.10 2bm8 s PRO 37 Ca 0.33 1.98 0.29 0.00 0.04 0.00 0.00 61.00 63.64 2bm8 s PRO 37 Cb -0.16 -3.18 1.26 0.00 0.04 0.00 0.00 34.50 32.46 2bm8 s PRO 37 CO 0.13 -0.09 1.96 -0.07 0.04 0.00 0.00 177.00 178.97 2bm8 h LEU 38 N 4.61 0.00 -0.57 -3.56 4.07 -1.99 -2.28 115.31 115.59 2bm8 h LEU 38 Ca -0.46 0.00 0.00 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 0.72 0.12 0.00 -0.90 -1.08 0.00 0.00 178.44 177.30 2bm8 n ASP 39 N -3.34 0.63 -0.86 -0.43 5.75 -1.26 -2.46 116.55 114.59 2bm8 n ASP 39 Ca -0.00 0.64 0.01 0.00 -0.01 0.00 0.00 54.79 55.43 2bm8 n ASP 39 Cb 0.33 -0.78 0.20 0.00 -1.03 0.00 0.00 41.12 39.84 2bm8 n ASP 39 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2bm8 n ARG 40 N -2.19 1.75 -0.30 0.11 1.74 -0.86 -4.86 116.66 112.05 2bm8 n ARG 40 Ca 0.03 -3.19 -0.00 0.00 -0.77 0.00 0.00 57.85 53.92 2bm8 n ARG 40 Cb 0.25 -1.72 0.13 0.00 -1.02 0.00 0.00 32.46 30.10 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 0.98 0.95 0.00 -1.55 7.01 -1.46 -1.64 115.95 120.24 2bm8 h TRP 41 Ca 0.11 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.14 2bm8 h TRP 41 Cb 1.35 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 28.10 2bm8 h TRP 41 CO 0.84 0.50 0.00 0.00 -2.79 0.00 0.00 178.44 176.99 2bm8 h ALA 42 N 1.38 1.00 -0.02 2.65 0.00 -1.89 -2.77 119.26 119.60 2bm8 h ALA 42 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2bm8 h ALA 42 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2bm8 h ALA 42 CO -0.16 0.00 -0.02 0.39 0.00 0.00 0.00 179.25 179.46 2bm8 n GLU 43 N -3.07 1.99 -2.32 0.00 1.02 -0.62 -4.94 120.64 112.70 2bm8 n GLU 43 Ca -0.01 -1.47 -0.41 0.00 -0.02 0.00 0.00 57.16 55.25 2bm8 n GLU 43 Cb 0.17 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.09 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 -2.03 3.45 0.67 0.62 0.00 -1.05 -4.99 121.76 118.43 2bm8 s ALA 44 Ca 0.32 1.04 -0.16 0.00 0.00 0.00 0.00 51.96 53.16 2bm8 s ALA 44 Cb 0.20 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.93 2bm8 s ALA 44 CO 0.33 -0.37 1.17 -1.25 0.00 0.00 0.00 175.76 175.63 2bm8 s PRO 45 N -1.37 2.60 -0.01 0.00 0.04 -1.26 -4.97 135.00 130.03 2bm8 s PRO 45 Ca 0.48 1.63 0.15 0.00 0.04 0.00 0.00 61.00 63.30 2bm8 s PRO 45 Cb -0.35 -1.90 -0.19 0.00 0.04 0.00 0.00 34.50 32.09 2bm8 s PRO 45 CO 0.45 -1.45 0.55 0.54 0.04 0.00 0.00 177.00 177.12 2bm8 n ARG 46 N -2.31 1.43 -1.71 4.56 1.74 -1.26 -4.98 116.66 114.12 2bm8 n ARG 46 Ca 0.12 -0.05 -0.29 0.00 -0.77 0.00 0.00 57.85 56.86 2bm8 n ARG 46 Cb 0.51 -1.28 0.14 0.00 -1.02 0.00 0.00 32.46 30.81 2bm8 n ARG 46 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2bm8 s ASP 47 N -2.92 3.51 0.22 0.55 3.84 -1.26 -4.98 116.67 115.63 2bm8 s ASP 47 Ca 0.02 0.71 -0.08 0.00 -0.00 0.00 0.00 52.55 53.20 2bm8 s ASP 47 Cb 0.11 -1.10 0.17 0.00 -1.38 0.00 0.00 42.92 40.72 2bm8 s ASP 47 CO 0.64 -2.53 1.79 0.25 -0.00 0.00 0.00 175.17 175.33 2bm8 h LEU 48 N -1.49 1.11 0.00 2.11 5.85 -2.02 -3.46 115.31 117.41 2bm8 h LEU 48 Ca -0.47 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.09 2bm8 h LEU 48 Cb 1.30 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 42.05 2bm8 h LEU 48 CO 0.55 0.97 0.00 0.61 -0.34 0.00 0.00 178.44 180.23 2bm8 n GLY 49 N -0.92 0.47 3.78 3.75 0.00 -1.26 -5.04 105.19 105.97 2bm8 n GLY 49 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 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 0.14 0.14 1.61 -0.85 -1.26 -4.21 117.35 110.91 2bm8 s TYR 50 Ca 0.00 -0.70 -0.30 0.00 -0.52 0.00 0.00 57.07 55.55 2bm8 s TYR 50 Cb 0.00 0.68 -0.07 0.00 0.38 0.00 0.00 41.96 42.95 2bm8 s TYR 50 CO 0.00 -1.41 1.15 0.45 -1.52 0.00 0.00 175.55 174.23 2bm8 s SER 51 N -3.04 7.16 -0.14 -0.18 0.15 -1.26 -4.91 113.70 111.48 2bm8 s SER 51 Ca 0.16 2.09 0.04 0.00 0.70 0.00 0.00 55.95 58.94 2bm8 s SER 51 Cb -0.05 -2.60 0.32 0.00 -1.71 0.00 0.00 66.02 61.99 2bm8 s SER 51 CO 0.11 -0.34 1.18 -0.90 1.20 0.00 0.00 173.24 174.48 2bm8 n ASP 52 N 2.97 3.14 0.00 5.45 5.75 -1.26 -4.70 116.55 127.89 2bm8 n ASP 52 Ca 0.05 -2.51 0.00 0.00 -0.01 0.00 0.00 54.79 52.32 2bm8 n ASP 52 Cb 0.46 -0.61 0.00 0.00 -1.03 0.00 0.00 41.12 39.94 2bm8 n ASP 52 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2bm8 n PHE 53 N 0.08 0.00 -3.31 2.11 -0.00 -1.26 -4.47 117.46 110.61 2bm8 n PHE 53 Ca 0.17 0.00 -0.26 0.00 -0.00 0.00 0.00 57.45 57.37 2bm8 n PHE 53 Cb 0.79 -0.10 -0.09 0.00 -0.00 0.00 0.00 39.48 40.09 2bm8 n PHE 53 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2bm8 n SER 54 N -0.92 -0.32 -0.44 -2.13 2.88 -1.26 -4.98 113.62 106.45 2bm8 n SER 54 Ca 0.00 -2.49 0.14 0.00 -1.33 0.00 0.00 58.87 55.18 2bm8 n SER 54 Cb 0.00 -0.54 0.47 0.00 -0.75 0.00 0.00 64.21 63.39 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 2.34 1.47 -2.94 -1.46 -0.04 -1.26 -4.95 135.00 128.17 2bm8 n PRO 55 Ca 0.27 -0.88 -0.27 0.00 -0.04 0.00 0.00 63.50 62.57 2bm8 n PRO 55 Cb 0.50 -1.48 -0.01 0.00 -0.04 0.00 0.00 33.50 32.46 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 -2.13 3.52 0.16 0.54 1.51 -1.26 -4.95 117.35 114.73 2bm8 s TYR 56 Ca 0.34 0.74 -0.13 0.00 -1.01 0.00 0.00 57.07 57.01 2bm8 s TYR 56 Cb 0.20 -2.22 0.01 0.00 -0.11 0.00 0.00 41.96 39.85 2bm8 s TYR 56 CO 0.38 -0.09 0.37 1.14 -1.11 0.00 0.00 175.55 176.24 2bm8 s GLN 57 N -4.29 1.16 -0.18 -0.62 -2.07 -1.26 -1.21 119.66 111.19 2bm8 s GLN 57 Ca 0.46 -0.96 -0.03 0.00 -1.82 0.00 0.00 55.36 53.01 2bm8 s GLN 57 Cb -0.10 0.43 0.06 0.00 -1.09 0.00 0.00 33.01 32.31 2bm8 s GLN 57 CO 0.38 -0.45 0.05 -0.46 -1.32 0.00 0.00 175.29 173.49 2bm8 s TRP 58 N -3.89 0.72 -1.47 9.60 -0.11 0.18 -4.77 118.94 119.20 2bm8 s TRP 58 Ca 0.10 -0.63 -0.11 0.00 1.22 0.00 0.00 56.10 56.68 2bm8 s TRP 58 Cb 0.02 -0.90 0.06 0.00 -1.50 0.00 0.00 33.47 31.15 2bm8 s TRP 58 CO -0.05 -0.56 0.89 0.54 -4.62 0.00 0.00 176.95 173.16 2bm8 n ARG 59 N 5.13 -5.62 -0.54 5.86 1.74 -1.26 -1.82 116.66 120.14 2bm8 n ARG 59 Ca -0.08 0.68 0.00 0.00 -0.77 0.00 0.00 57.85 57.68 2bm8 n ARG 59 Cb 0.48 -5.58 0.00 0.00 -1.02 0.00 0.00 32.46 26.34 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 -1.66 0.73 3.33 -0.13 0.00 -1.26 -5.06 105.19 101.15 2bm8 n GLY 60 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 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 2.14 0.40 0.99 1.43 -0.76 -4.42 118.68 118.47 2bm8 s LEU 61 Ca 0.00 -0.51 -0.27 0.00 -1.03 0.00 0.00 54.13 52.33 2bm8 s LEU 61 Cb 0.00 -1.33 -0.09 0.00 0.03 0.00 0.00 46.19 44.80 2bm8 s LEU 61 CO 0.00 0.29 1.39 -0.13 0.23 0.00 0.00 176.35 178.13 2bm8 s ARG 62 N -0.90 3.96 -0.28 1.70 0.52 -1.26 -0.65 118.95 122.04 2bm8 s ARG 62 Ca 0.11 2.36 0.01 0.00 -0.52 0.00 0.00 55.73 57.69 2bm8 s ARG 62 Cb -0.10 -2.81 0.06 0.00 0.52 0.00 0.00 34.95 32.61 2bm8 s ARG 62 CO 0.00 -0.57 -0.06 -1.64 0.02 0.00 0.00 175.30 173.05 2bm8 s MET 63 N -2.22 2.28 0.35 3.54 -1.94 -0.35 -4.11 119.30 116.85 2bm8 s MET 63 Ca 0.56 -1.34 0.19 0.00 -1.71 0.00 0.00 55.69 53.39 2bm8 s MET 63 Cb -0.42 -3.03 0.34 0.00 2.01 0.00 0.00 34.83 33.73 2bm8 s MET 63 CO 0.55 -0.61 1.57 -0.07 -0.01 0.00 0.00 175.02 176.46 2bm8 h LEU 64 N 7.86 0.00 -9.25 -0.03 3.38 -1.94 -3.38 115.31 111.94 2bm8 h LEU 64 Ca -0.19 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.22 2bm8 h LEU 64 Cb 1.05 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 2bm8 h LEU 64 CO 0.49 0.33 0.68 -0.54 0.09 0.00 0.00 178.44 179.50 2bm8 s LYS 65 N -3.18 4.36 0.62 1.13 1.02 -1.26 -5.03 119.74 117.39 2bm8 s LYS 65 Ca 0.04 1.53 -0.05 0.00 0.02 0.00 0.00 55.97 57.51 2bm8 s LYS 65 Cb 0.08 -3.58 0.03 0.00 -0.52 0.00 0.00 37.83 33.83 2bm8 s LYS 65 CO 0.70 -0.44 0.91 0.16 -0.92 0.00 0.00 175.35 175.76 2bm8 s ASP 66 N 1.35 5.29 0.37 2.83 1.47 -1.26 -4.74 116.67 121.98 2bm8 s ASP 66 Ca 0.52 0.50 0.12 0.00 1.18 0.00 0.00 52.55 54.87 2bm8 s ASP 66 Cb -0.21 -1.38 0.93 0.00 -0.34 0.00 0.00 42.92 41.92 2bm8 s ASP 66 CO 0.18 -1.24 1.83 -0.65 0.68 0.00 0.00 175.17 175.97 2bm8 h PRO 67 N -0.26 0.56 -0.31 2.11 0.11 -1.95 -0.43 132.00 131.83 2bm8 h PRO 67 Ca -0.45 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 2bm8 h PRO 67 Cb 1.28 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2bm8 h PRO 67 CO 0.59 0.37 0.12 -0.44 -0.21 0.00 0.00 178.00 178.43 2bm8 h ASP 68 N 0.57 0.44 -0.59 -2.05 3.32 -1.94 -1.05 116.42 115.13 2bm8 h ASP 68 Ca 0.50 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.37 2bm8 h ASP 68 Cb 1.01 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.42 2bm8 h ASP 68 CO -0.25 0.49 0.34 0.74 -1.72 0.00 0.00 179.24 178.84 2bm8 h THR 69 N 0.36 1.18 -0.24 0.35 2.02 -1.48 -2.42 112.91 112.69 2bm8 h THR 69 Ca 0.10 -0.46 -0.10 0.00 0.77 0.00 0.00 66.41 66.72 2bm8 h THR 69 Cb 0.19 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 2bm8 h THR 69 CO -0.01 0.20 -0.30 1.56 0.37 0.00 0.00 175.52 177.35 2bm8 h GLN 70 N 0.85 0.48 -0.37 6.66 4.20 -0.73 -2.05 115.11 124.15 2bm8 h GLN 70 Ca 0.22 -0.20 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 2bm8 h GLN 70 Cb 0.02 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 2bm8 h GLN 70 CO -0.04 0.73 -0.18 0.00 -0.67 0.00 0.00 178.83 178.67 2bm8 h ALA 71 N 1.27 0.98 -0.07 3.87 0.00 -0.91 -1.73 119.26 122.66 2bm8 h ALA 71 Ca 0.05 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 2bm8 h ALA 71 Cb 0.73 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2bm8 h ALA 71 CO 0.06 0.60 -0.03 0.28 0.00 0.00 0.00 179.25 180.16 2bm8 h VAL 72 N 0.62 1.32 0.00 0.00 2.07 -1.08 -2.66 116.25 116.52 2bm8 h VAL 72 Ca 0.10 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.57 2bm8 h VAL 72 Cb 0.66 1.84 -0.00 0.00 -1.52 0.00 0.00 31.29 32.26 2bm8 h VAL 72 CO 0.05 0.28 -0.15 1.88 0.02 0.00 0.00 177.57 179.65 2bm8 h TYR 73 N -0.21 0.00 0.24 1.57 -1.99 -1.38 -1.68 116.97 113.52 2bm8 h TYR 73 Ca 0.02 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.74 2bm8 h TYR 73 Cb 0.46 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.19 2bm8 h TYR 73 CO 0.06 0.15 -0.12 1.25 -0.00 0.00 0.00 178.16 179.51 2bm8 h HIS 74 N 0.00 -0.30 -0.47 4.88 2.76 -1.14 -0.80 115.15 120.08 2bm8 h HIS 74 Ca -0.00 -0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.24 2bm8 h HIS 74 Cb 0.41 0.10 -0.07 0.00 1.55 0.00 0.00 27.41 29.40 2bm8 h HIS 74 CO 0.00 0.06 0.08 -0.44 -1.30 0.00 0.00 177.93 176.33 2bm8 h ASP 75 N -0.72 -0.03 -0.24 3.26 3.32 -1.22 -1.95 116.42 118.83 2bm8 h ASP 75 Ca -0.03 0.09 0.03 0.00 0.02 0.00 0.00 57.03 57.13 2bm8 h ASP 75 Cb 0.49 0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.14 2bm8 h ASP 75 CO 0.05 0.02 0.08 -0.03 -1.72 0.00 0.00 179.24 177.64 2bm8 h MET 76 N 0.21 0.18 -0.84 3.56 4.05 -1.28 -1.22 114.93 119.59 2bm8 h MET 76 Ca 0.24 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.64 2bm8 h MET 76 Cb 0.31 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.03 2bm8 h MET 76 CO -0.32 0.12 0.49 -0.07 0.23 0.00 0.00 176.91 177.36 2bm8 h LEU 77 N 0.19 1.02 -0.63 3.39 4.07 -0.68 0.51 115.31 123.19 2bm8 h LEU 77 Ca 0.11 -0.07 -0.12 0.00 0.08 0.00 0.00 57.88 57.88 2bm8 h LEU 77 Cb 0.08 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.55 2bm8 h LEU 77 CO -0.12 0.80 -0.21 -0.25 -1.08 0.00 0.00 178.44 177.58 2bm8 h TRP 78 N 1.17 0.97 0.02 1.13 2.91 -0.91 0.60 115.95 121.84 2bm8 h TRP 78 Ca 0.30 -0.22 -0.00 0.00 1.13 0.00 0.00 58.89 60.10 2bm8 h TRP 78 Cb -0.02 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 28.40 2bm8 h TRP 78 CO 0.01 0.99 -0.01 1.49 -1.03 0.00 0.00 178.44 179.88 2bm8 h GLU 79 N 0.74 -0.03 -0.04 2.65 4.81 -0.94 -3.38 114.58 118.40 2bm8 h GLU 79 Ca 0.10 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.11 2bm8 h GLU 79 Cb 0.75 0.01 0.02 0.00 0.63 0.00 0.00 28.75 30.15 2bm8 h GLU 79 CO 0.06 0.67 -0.84 1.25 -0.73 0.00 0.00 179.01 179.41 2bm8 h LEU 80 N -0.94 0.81 -2.42 1.64 5.85 -0.99 -3.49 115.31 115.77 2bm8 h LEU 80 Ca -0.00 -0.71 -0.28 0.00 0.84 0.00 0.00 57.88 57.73 2bm8 h LEU 80 Cb 0.71 -0.24 0.19 0.00 0.37 0.00 0.00 40.66 41.68 2bm8 h LEU 80 CO 0.01 1.41 -0.86 0.54 -0.34 0.00 0.00 178.44 179.20 2bm8 n ARG 81 N -3.99 -2.64 -2.09 1.25 1.74 0.20 -4.84 116.66 106.28 2bm8 n ARG 81 Ca -0.10 0.83 -0.38 0.00 -0.77 0.00 0.00 57.85 57.43 2bm8 n ARG 81 Cb 0.78 -5.70 0.00 0.00 -1.02 0.00 0.00 32.46 26.53 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 -4.64 3.76 0.08 5.56 0.04 -1.26 -4.57 135.00 133.97 2bm8 s PRO 82 Ca 0.41 2.02 0.24 0.00 0.04 0.00 0.00 61.00 63.70 2bm8 s PRO 82 Cb -0.06 -2.55 0.24 0.00 0.04 0.00 0.00 34.50 32.17 2bm8 s PRO 82 CO 0.75 -0.62 1.21 0.54 0.04 0.00 0.00 177.00 178.92 2bm8 n ARG 83 N -0.28 0.26 -3.77 4.56 5.12 -0.06 -4.44 116.66 118.05 2bm8 n ARG 83 Ca 0.06 0.04 -0.13 0.00 -1.93 0.00 0.00 57.85 55.89 2bm8 n ARG 83 Cb 0.46 -1.63 -0.13 0.00 -1.16 0.00 0.00 32.46 30.00 2bm8 n ARG 83 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2bm8 s THR 84 N -3.16 -0.03 -0.07 0.55 2.01 -0.94 -1.24 115.64 112.76 2bm8 s THR 84 Ca 0.06 0.09 0.02 0.00 0.31 0.00 0.00 61.69 62.17 2bm8 s THR 84 Cb 0.14 -0.30 0.02 0.00 0.01 0.00 0.00 72.50 72.37 2bm8 s THR 84 CO 0.75 0.04 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.98 2bm8 s ILE 85 N 0.74 1.06 -0.12 1.82 1.01 -0.69 -1.55 121.20 123.49 2bm8 s ILE 85 Ca -0.05 -0.41 0.03 0.00 0.00 0.00 0.00 60.65 60.22 2bm8 s ILE 85 Cb -0.07 -1.00 0.00 0.00 0.01 0.00 0.00 42.46 41.40 2bm8 s ILE 85 CO -0.04 0.35 -0.21 -0.69 0.00 0.00 0.00 174.94 174.34 2bm8 s VAL 86 N 0.90 2.24 -0.31 2.92 1.01 -0.16 -0.98 120.40 126.01 2bm8 s VAL 86 Ca -0.10 -0.94 -0.03 0.00 0.00 0.00 0.00 61.98 60.91 2bm8 s VAL 86 Cb -0.15 -1.88 0.05 0.00 0.00 0.00 0.00 36.38 34.40 2bm8 s VAL 86 CO 0.01 0.55 0.03 -1.61 0.00 0.00 0.00 175.10 174.07 2bm8 s GLU 87 N 0.49 2.45 -0.78 2.72 0.41 0.31 -0.41 118.70 123.90 2bm8 s GLU 87 Ca -0.14 -1.27 -0.25 0.00 -0.41 0.00 0.00 54.97 52.91 2bm8 s GLU 87 Cb -0.17 -3.25 0.05 0.00 -1.78 0.00 0.00 34.13 28.98 2bm8 s GLU 87 CO 0.05 -0.64 1.22 -1.17 -0.49 0.00 0.00 175.26 174.23 2bm8 s LEU 88 N 1.28 3.65 0.00 1.80 0.20 0.79 -1.28 118.68 125.13 2bm8 s LEU 88 Ca -0.04 -0.86 0.00 0.00 0.69 0.00 0.00 54.13 53.92 2bm8 s LEU 88 Cb -0.20 -2.52 0.00 0.00 -0.43 0.00 0.00 46.19 43.05 2bm8 s LEU 88 CO -0.00 -1.63 0.00 0.61 -0.29 0.00 0.00 176.35 175.03 2bm8 n GLY 89 N 5.63 2.93 0.51 7.98 0.00 0.93 -0.73 105.19 122.44 2bm8 n GLY 89 Ca 0.08 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 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 0.53 1.08 0.00 1.61 0.31 -1.26 -4.82 118.33 115.78 2bm8 n VAL 90 Ca 0.00 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 2bm8 n VAL 90 Cb 0.00 -1.84 0.00 0.00 -0.91 0.00 0.00 33.84 31.09 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 -3.85 0.00 1.00 3.52 9.36 -1.26 -3.02 117.16 122.91 2bm8 n TYR 91 Ca -0.22 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.12 2bm8 n TYR 91 Cb 0.55 0.00 0.32 0.00 -0.63 0.00 0.00 39.34 39.58 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 10.22 0.41 0.00 2.98 6.94 -1.26 -2.43 115.26 132.12 2bm8 n ASN 92 Ca 0.00 -0.11 0.00 0.00 -0.02 0.00 0.00 54.58 54.45 2bm8 n ASN 92 Cb 0.00 0.11 0.00 0.00 -2.36 0.00 0.00 39.78 37.53 2bm8 n ASN 92 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2bm8 n GLY 93 N 1.50 0.71 0.33 4.83 0.00 -1.17 -0.44 105.19 110.96 2bm8 n GLY 93 Ca 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.03 2bm8 n GLY 93 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bm8 h GLY 94 N 0.00 1.23 1.58 -0.02 0.00 -1.83 -1.85 103.07 102.19 2bm8 h GLY 94 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.75 2bm8 h GLY 94 CO 0.00 0.55 -0.41 1.48 0.00 0.00 0.00 176.54 178.16 2bm8 h SER 95 N 1.14 0.00 -0.51 0.19 4.64 -1.90 -2.48 113.55 114.63 2bm8 h SER 95 Ca 0.29 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.58 2bm8 h SER 95 Cb 0.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 2bm8 h SER 95 CO -0.04 0.00 0.27 -0.07 -0.87 0.00 0.00 176.83 176.12 2bm8 h LEU 96 N 0.00 0.65 -0.34 5.97 4.07 -1.82 -1.36 115.31 122.48 2bm8 h LEU 96 Ca 0.00 -0.11 -0.13 0.00 0.08 0.00 0.00 57.88 57.72 2bm8 h LEU 96 Cb 0.98 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.55 2bm8 h LEU 96 CO 0.00 0.57 -0.30 0.00 -1.08 0.00 0.00 178.44 177.63 2bm8 h ALA 97 N 1.11 0.50 -0.15 1.53 0.00 -1.26 -2.42 119.26 118.55 2bm8 h ALA 97 Ca 0.18 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2bm8 h ALA 97 Cb 0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2bm8 h ALA 97 CO -0.03 0.53 0.08 2.35 0.00 0.00 0.00 179.25 182.18 2bm8 h TRP 98 N 0.59 0.22 -0.61 0.00 7.01 -1.41 0.11 115.95 121.86 2bm8 h TRP 98 Ca 0.06 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.08 2bm8 h TRP 98 Cb 0.88 -0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 27.83 2bm8 h TRP 98 CO 0.07 0.24 0.37 0.74 -2.79 0.00 0.00 178.44 177.07 2bm8 h PHE 99 N 0.13 0.70 0.29 2.65 0.05 -1.21 0.24 116.94 119.80 2bm8 h PHE 99 Ca 0.05 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 61.85 2bm8 h PHE 99 Cb 0.10 -0.23 0.00 0.00 2.00 0.00 0.00 35.95 37.83 2bm8 h PHE 99 CO -0.03 0.40 -0.14 -0.09 -0.18 0.00 0.00 178.31 178.27 2bm8 h ARG 100 N 0.74 -0.38 -0.74 1.51 1.12 -1.28 -1.96 114.38 113.39 2bm8 h ARG 100 Ca 0.24 0.03 0.09 0.00 -1.11 0.00 0.00 59.98 59.23 2bm8 h ARG 100 Cb 0.02 0.09 -0.07 0.00 -0.01 0.00 0.00 29.97 30.00 2bm8 h ARG 100 CO -0.10 -0.15 0.39 -0.44 -3.11 0.00 0.00 179.97 176.56 2bm8 h ASP 101 N -0.55 0.55 0.56 -3.80 3.32 -0.51 -1.97 116.42 114.02 2bm8 h ASP 101 Ca -0.04 0.05 -0.12 0.00 0.02 0.00 0.00 57.03 56.94 2bm8 h ASP 101 Cb 0.40 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2bm8 h ASP 101 CO 0.07 0.32 -0.58 0.25 -1.72 0.00 0.00 179.24 177.58 2bm8 h LEU 102 N 0.68 0.02 -0.35 1.55 5.85 -0.43 -1.84 115.31 120.80 2bm8 h LEU 102 Ca 0.35 -0.01 -0.18 0.00 0.84 0.00 0.00 57.88 58.88 2bm8 h LEU 102 Cb 0.33 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 2bm8 h LEU 102 CO -0.24 0.60 -0.83 0.71 -0.34 0.00 0.00 178.44 178.33 2bm8 h THR 103 N 0.01 1.54 0.33 1.05 1.35 -1.16 -2.59 112.91 113.44 2bm8 h THR 103 Ca -0.01 -2.67 -0.02 0.00 -0.55 0.00 0.00 66.41 63.17 2bm8 h THR 103 Cb 1.03 2.46 0.00 0.00 -1.73 0.00 0.00 68.15 69.92 2bm8 h THR 103 CO 0.08 0.77 -0.16 0.11 -0.25 0.00 0.00 175.52 176.07 2bm8 h LYS 104 N 0.05 -0.43 -1.02 4.72 1.79 -0.96 -0.71 116.57 120.02 2bm8 h LYS 104 Ca -0.02 0.03 0.33 0.00 -2.18 0.00 0.00 60.65 58.80 2bm8 h LYS 104 Cb 1.45 0.10 -0.15 0.00 -1.58 0.00 0.00 32.23 32.05 2bm8 h LYS 104 CO 0.12 -0.12 0.59 0.82 -1.08 0.00 0.00 179.45 179.77 2bm8 h ILE 105 N -0.75 0.29 -0.00 1.86 2.04 -1.44 0.05 117.51 119.57 2bm8 h ILE 105 Ca -0.05 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2bm8 h ILE 105 Cb 0.50 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 2bm8 h ILE 105 CO 0.07 0.06 -0.03 0.23 0.00 0.00 0.00 178.15 178.48 2bm8 n MET 106 N -5.02 0.85 -1.65 2.37 2.81 -0.98 -4.91 117.12 110.59 2bm8 n MET 106 Ca 0.32 -0.16 -0.11 0.00 -1.81 0.00 0.00 57.70 55.94 2bm8 n MET 106 Cb 1.01 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.99 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 1.16 0.75 3.79 3.03 0.00 0.00 -5.02 105.19 108.91 2bm8 n GLY 107 Ca 0.19 -0.47 -0.37 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.47 5.26 -0.97 -0.61 1.01 -0.29 -5.04 121.20 118.09 2bm8 s ILE 108 Ca 0.00 0.58 -0.21 0.00 0.00 0.00 0.00 60.65 61.01 2bm8 s ILE 108 Cb 0.00 -3.61 0.09 0.00 0.01 0.00 0.00 42.46 38.94 2bm8 s ILE 108 CO 0.00 0.49 1.29 -0.62 0.00 0.00 0.00 174.94 176.10 2bm8 s ASP 109 N -0.30 6.55 -0.13 3.58 3.68 -1.26 -4.36 116.67 124.44 2bm8 s ASP 109 Ca 0.19 -1.70 0.01 0.00 2.13 0.00 0.00 52.55 53.17 2bm8 s ASP 109 Cb -0.14 -2.49 0.02 0.00 -1.45 0.00 0.00 42.92 38.86 2bm8 s ASP 109 CO 0.07 -1.31 -0.15 0.00 0.13 0.00 0.00 175.17 173.91 2bm8 s GLN 111 N 1.21 4.52 -0.08 0.00 -1.52 -0.38 -4.90 119.66 118.52 2bm8 s GLN 111 Ca -0.01 1.21 -0.01 0.00 -1.95 0.00 0.00 55.36 54.60 2bm8 s GLN 111 Cb -0.14 -3.45 -0.03 0.00 -0.22 0.00 0.00 33.01 29.17 2bm8 s GLN 111 CO -0.06 0.02 -0.03 0.08 -0.25 0.00 0.00 175.29 175.05 2bm8 s VAL 112 N 0.83 4.01 -0.04 1.09 1.01 -0.33 -1.70 120.40 125.27 2bm8 s VAL 112 Ca 0.46 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.09 2bm8 s VAL 112 Cb -0.20 -2.67 0.02 0.00 0.00 0.00 0.00 36.38 33.53 2bm8 s VAL 112 CO 0.24 0.59 -0.06 -0.63 0.00 0.00 0.00 175.10 175.25 2bm8 s ILE 113 N -0.75 0.59 -0.07 2.22 1.01 -0.16 -1.72 121.20 122.32 2bm8 s ILE 113 Ca 0.12 -0.19 0.04 0.00 0.00 0.00 0.00 60.65 60.61 2bm8 s ILE 113 Cb -0.11 -0.58 -0.02 0.00 0.01 0.00 0.00 42.46 41.76 2bm8 s ILE 113 CO 0.02 0.22 -0.19 -0.83 0.00 0.00 0.00 174.94 174.16 2bm8 s GLY 114 N 0.65 1.42 -0.12 6.18 0.00 -0.57 -0.53 107.32 114.35 2bm8 s GLY 114 Ca -0.09 -1.00 0.01 0.00 0.00 0.00 0.00 44.72 43.65 2bm8 s GLY 114 CO 0.00 -0.62 -0.16 -0.42 0.00 0.00 0.00 173.10 171.91 2bm8 s ILE 115 N -0.28 1.59 -0.02 0.90 1.01 -0.40 -1.17 121.20 122.82 2bm8 s ILE 115 Ca 0.01 -0.68 -0.20 0.00 0.00 0.00 0.00 60.65 59.77 2bm8 s ILE 115 Cb -0.13 -1.45 0.04 0.00 0.01 0.00 0.00 42.46 40.93 2bm8 s ILE 115 CO 0.03 0.46 0.44 -0.62 0.00 0.00 0.00 174.94 175.24 2bm8 s ASP 116 N 1.07 -0.35 0.50 3.58 -1.08 -1.16 -0.05 116.67 119.19 2bm8 s ASP 116 Ca -0.04 0.27 0.23 0.00 -0.52 0.00 0.00 52.55 52.49 2bm8 s ASP 116 Cb -0.14 0.40 1.30 0.00 -1.46 0.00 0.00 42.92 43.01 2bm8 s ASP 116 CO -0.04 -0.53 2.05 0.08 0.52 0.00 0.00 175.17 177.26 2bm8 h ARG 117 N 3.49 0.00 -4.34 4.34 0.11 -1.77 -2.80 114.38 113.41 2bm8 h ARG 117 Ca -0.29 0.00 -0.61 0.00 0.10 0.00 0.00 59.98 59.18 2bm8 h ARG 117 Cb 1.17 0.00 -0.38 0.00 1.11 0.00 0.00 29.97 31.87 2bm8 h ARG 117 CO 0.40 0.14 -0.79 0.34 0.10 0.00 0.00 179.97 180.17 2bm8 s ASP 118 N -6.47 3.79 -0.02 0.08 2.15 -1.26 -4.78 116.67 110.17 2bm8 s ASP 118 Ca -0.03 -1.15 0.12 0.00 0.43 0.00 0.00 52.55 51.92 2bm8 s ASP 118 Cb 0.14 -1.16 0.35 0.00 -0.30 0.00 0.00 42.92 41.95 2bm8 s ASP 118 CO 0.62 -0.23 1.29 0.18 -0.17 0.00 0.00 175.17 176.86 2bm8 n LEU 119 N 4.69 3.10 0.13 -1.34 4.77 -1.26 -4.62 117.00 122.47 2bm8 n LEU 119 Ca -0.12 -2.09 0.13 0.00 -0.03 0.00 0.00 56.01 53.90 2bm8 n LEU 119 Cb 0.44 -0.28 0.36 0.00 -2.33 0.00 0.00 43.42 41.61 2bm8 n LEU 119 CO 0.18 0.75 0.87 0.77 -1.33 0.00 0.00 177.39 178.63 2bm8 h SER 120 N 2.20 0.00 0.45 -1.43 4.64 -1.93 -2.90 113.55 114.57 2bm8 h SER 120 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bm8 h SER 120 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 2bm8 h SER 120 CO 0.02 0.00 -0.07 0.54 -0.87 0.00 0.00 176.83 176.45 2bm8 n ARG 121 N -2.46 0.57 -1.92 4.77 3.00 -1.26 -4.92 116.66 114.43 2bm8 n ARG 121 Ca 0.05 -0.12 -0.41 0.00 -0.01 0.00 0.00 57.85 57.36 2bm8 n ARG 121 Cb 0.44 -1.50 -0.02 0.00 0.00 0.00 0.00 32.46 31.39 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 2.10 2.62 -2.19 0.00 1.13 0.41 -4.98 117.38 116.47 2bm8 n GLN 123 Ca 0.07 -0.43 -0.42 0.00 -1.94 0.00 0.00 57.00 54.27 2bm8 n GLN 123 Cb 0.39 -0.96 -0.03 0.00 0.11 0.00 0.00 30.24 29.75 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 3.68 0.50 5.09 1.01 -1.25 -4.98 121.20 124.09 2bm8 s ILE 124 Ca 0.05 1.04 -0.23 0.00 0.00 0.00 0.00 60.65 61.51 2bm8 s ILE 124 Cb 0.06 -3.67 -0.06 0.00 0.01 0.00 0.00 42.46 38.79 2bm8 s ILE 124 CO 0.19 -0.02 1.40 -2.84 0.00 0.00 0.00 174.94 173.68 2bm8 s PRO 125 N 2.65 3.38 0.53 2.79 0.02 -1.26 -4.90 135.00 138.22 2bm8 s PRO 125 Ca 0.65 2.35 0.19 0.00 0.02 0.00 0.00 61.00 64.22 2bm8 s PRO 125 Cb -0.32 -2.45 1.39 0.00 0.02 0.00 0.00 34.50 33.15 2bm8 s PRO 125 CO 0.26 -1.04 2.16 0.00 -0.33 0.00 0.00 177.00 178.06 2bm8 h ALA 126 N 1.85 1.84 -0.89 -1.55 0.00 -2.01 -2.57 119.26 115.94 2bm8 h ALA 126 Ca -0.51 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 54.56 2bm8 h ALA 126 Cb 1.29 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.91 2bm8 h ALA 126 CO 0.59 0.02 -0.24 0.43 0.00 0.00 0.00 179.25 180.05 2bm8 n SER 127 N -4.34 -0.35 -3.35 0.00 7.64 -1.26 -3.51 113.62 108.46 2bm8 n SER 127 Ca -0.03 1.53 -0.26 0.00 1.01 0.00 0.00 58.87 61.12 2bm8 n SER 127 Cb 0.10 -0.45 -0.08 0.00 -1.01 0.00 0.00 64.21 62.78 2bm8 n SER 127 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2bm8 n ASP 128 N -5.43 2.71 -0.93 6.43 3.85 -0.97 -4.80 116.55 117.42 2bm8 n ASP 128 Ca 0.14 -3.23 0.08 0.00 -0.71 0.00 0.00 54.79 51.07 2bm8 n ASP 128 Cb 0.43 -0.66 0.25 0.00 -1.35 0.00 0.00 41.12 39.79 2bm8 n ASP 128 CO 0.00 0.00 0.00 0.80 -1.01 0.00 0.00 177.20 176.99 2bm8 n MET 129 N 0.99 3.08 -1.66 0.11 1.56 -1.23 -4.86 117.12 115.12 2bm8 n MET 129 Ca 0.27 -2.69 -0.49 0.00 -0.27 0.00 0.00 57.70 54.53 2bm8 n MET 129 Cb 0.45 -1.74 -0.05 0.00 2.15 0.00 0.00 33.22 34.02 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 -0.12 1.86 -2.55 2.12 0.00 -1.26 -1.23 120.64 119.46 2bm8 n GLU 130 Ca 0.20 0.67 -0.19 0.00 0.00 0.00 0.00 57.16 57.84 2bm8 n GLU 130 Cb 0.81 -2.43 -0.00 0.00 0.00 0.00 0.00 31.44 29.81 2bm8 n GLU 130 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2bm8 n ASN 131 N 4.47 -5.45 -3.88 4.31 3.02 -1.26 -4.99 115.26 111.47 2bm8 n ASN 131 Ca 0.20 -0.03 -0.22 0.00 -0.03 0.00 0.00 54.58 54.51 2bm8 n ASN 131 Cb 0.25 -4.53 -0.17 0.00 -0.61 0.00 0.00 39.78 34.73 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 -2.97 0.60 -0.06 2.41 1.01 -0.37 -1.19 121.20 120.64 2bm8 s ILE 132 Ca 0.06 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.64 2bm8 s ILE 132 Cb -0.03 -0.64 -0.00 0.00 0.01 0.00 0.00 42.46 41.80 2bm8 s ILE 132 CO 0.08 0.26 -0.19 -0.89 0.00 0.00 0.00 174.94 174.19 2bm8 s THR 133 N 1.16 1.62 -0.17 2.92 2.01 -0.70 -4.92 115.64 117.56 2bm8 s THR 133 Ca -0.07 -0.81 -0.05 0.00 0.31 0.00 0.00 61.69 61.08 2bm8 s THR 133 Cb -0.14 -1.39 -0.03 0.00 0.01 0.00 0.00 72.50 70.95 2bm8 s THR 133 CO -0.01 0.46 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.61 2bm8 s LEU 134 N 0.09 3.39 -0.11 4.42 1.02 -1.26 -1.51 118.68 124.72 2bm8 s LEU 134 Ca -0.07 -0.08 0.03 0.00 0.02 0.00 0.00 54.13 54.03 2bm8 s LEU 134 Cb -0.13 -1.83 0.00 0.00 0.02 0.00 0.00 46.19 44.25 2bm8 s LEU 134 CO 0.03 0.16 -0.22 -1.00 0.02 0.00 0.00 176.35 175.34 2bm8 s HIS 135 N 0.42 2.51 -0.11 0.29 3.76 -0.32 -4.99 115.29 116.86 2bm8 s HIS 135 Ca -0.02 -1.10 -0.30 0.00 -0.15 0.00 0.00 55.06 53.49 2bm8 s HIS 135 Cb -0.14 -1.70 -0.03 0.00 1.11 0.00 0.00 32.58 31.83 2bm8 s HIS 135 CO 0.02 -0.47 1.37 -1.14 -0.85 0.00 0.00 174.74 173.67 2bm8 s GLN 136 N 0.52 4.24 0.04 1.40 2.00 -1.26 -2.96 119.66 123.64 2bm8 s GLN 136 Ca -0.15 1.82 0.00 0.00 -2.00 0.00 0.00 55.36 55.04 2bm8 s GLN 136 Cb -0.17 -3.77 -0.03 0.00 0.80 0.00 0.00 33.01 29.84 2bm8 s GLN 136 CO 0.05 -0.70 -0.05 0.20 -0.50 0.00 0.00 175.29 174.30 2bm8 s GLY 137 N 2.23 0.44 -0.08 2.59 0.00 -1.06 -4.94 107.32 106.50 2bm8 s GLY 137 Ca 0.60 -0.90 0.03 0.00 0.00 0.00 0.00 44.72 44.46 2bm8 s GLY 137 CO 0.20 -0.98 -0.18 -0.35 0.00 0.00 0.00 173.10 171.79 2bm8 s ASP 138 N -2.09 2.39 0.38 1.64 3.68 -1.26 -2.33 116.67 119.08 2bm8 s ASP 138 Ca -0.05 -0.42 0.21 0.00 2.13 0.00 0.00 52.55 54.42 2bm8 s ASP 138 Cb -0.03 -1.02 0.57 0.00 -1.45 0.00 0.00 42.92 40.98 2bm8 s ASP 138 CO -0.04 0.11 1.67 0.00 0.13 0.00 0.00 175.17 177.04 2bm8 h SER 140 N 0.00 0.70 -3.93 0.00 4.64 -1.95 -3.45 113.55 109.56 2bm8 h SER 140 Ca -0.00 -0.89 -0.51 0.00 -0.47 0.00 0.00 61.79 59.92 2bm8 h SER 140 Cb 0.99 -0.23 0.05 0.00 -0.31 0.00 0.00 62.40 62.91 2bm8 h SER 140 CO 0.04 1.53 0.51 -0.62 -0.87 0.00 0.00 176.83 177.42 2bm8 s ASP 141 N -7.25 6.59 -0.00 4.97 -1.08 -1.23 -4.97 116.67 113.69 2bm8 s ASP 141 Ca -0.11 2.36 0.07 0.00 -0.52 0.00 0.00 52.55 54.34 2bm8 s ASP 141 Cb 0.03 -2.62 -0.08 0.00 -1.46 0.00 0.00 42.92 38.79 2bm8 s ASP 141 CO 0.89 -0.63 0.24 0.18 0.52 0.00 0.00 175.17 176.38 2bm8 n LEU 142 N 0.19 0.22 0.25 -1.34 4.77 -1.26 -4.37 117.00 115.46 2bm8 n LEU 142 Ca 0.04 -0.34 0.09 0.00 -0.03 0.00 0.00 56.01 55.76 2bm8 n LEU 142 Cb 0.46 0.00 0.64 0.00 -2.33 0.00 0.00 43.42 42.19 2bm8 n LEU 142 CO 0.51 0.05 1.01 0.74 -1.33 0.00 0.00 177.39 178.38 2bm8 h THR 143 N 0.00 0.94 -0.94 -5.08 2.02 -1.93 -3.00 112.91 104.91 2bm8 h THR 143 Ca 0.00 -0.25 0.29 0.00 0.77 0.00 0.00 66.41 67.21 2bm8 h THR 143 Cb 0.21 1.14 -0.15 0.00 -1.74 0.00 0.00 68.15 67.60 2bm8 h THR 143 CO 0.00 0.07 0.33 0.74 0.37 0.00 0.00 175.52 177.03 2bm8 h THR 144 N 0.00 0.23 -0.01 3.16 2.02 -1.87 -2.17 112.91 114.26 2bm8 h THR 144 Ca -0.00 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.12 2bm8 h THR 144 Cb 0.14 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 2bm8 h THR 144 CO 0.01 0.03 0.00 0.49 0.37 0.00 0.00 175.52 176.42 2bm8 n PHE 145 N -5.22 0.00 0.16 3.16 3.01 -1.13 -4.42 117.46 113.02 2bm8 n PHE 145 Ca 0.27 -0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.74 2bm8 n PHE 145 Cb 0.85 0.00 0.32 0.00 -0.01 0.00 0.00 39.48 40.64 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 1.58 0.05 -0.02 -1.08 4.57 -1.55 -2.62 114.58 115.51 2bm8 h GLU 146 Ca 0.00 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2bm8 h GLU 146 Cb 0.34 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.92 2bm8 h GLU 146 CO 0.00 0.44 0.03 1.12 -1.18 0.00 0.00 179.01 179.41 2bm8 h HIS 147 N 0.04 0.00 0.00 0.92 2.07 -1.81 -2.92 115.15 113.45 2bm8 h HIS 147 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2bm8 h HIS 147 Cb 0.72 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.70 2bm8 h HIS 147 CO 0.00 0.00 0.00 -0.07 -3.07 0.00 0.00 177.93 174.79 2bm8 h LEU 148 N 0.00 0.00 -0.86 6.12 3.38 -1.80 -3.29 115.31 118.85 2bm8 h LEU 148 Ca 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2bm8 h LEU 148 Cb 0.06 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2bm8 h LEU 148 CO -0.00 0.00 0.39 0.03 0.09 0.00 0.00 178.44 178.95 2bm8 h ARG 149 N 0.00 1.22 -3.15 1.13 3.08 -1.70 -3.28 114.38 111.68 2bm8 h ARG 149 Ca 0.00 -0.18 -0.76 0.00 0.07 0.00 0.00 59.98 59.10 2bm8 h ARG 149 Cb 0.64 -0.22 -0.17 0.00 0.08 0.00 0.00 29.97 30.31 2bm8 h ARG 149 CO 0.00 0.94 1.93 -0.85 -1.07 0.00 0.00 179.97 180.92 2bm8 n GLU 150 N -4.30 4.05 -3.51 0.04 0.28 -1.24 -4.91 120.64 111.05 2bm8 n GLU 150 Ca 0.08 -3.69 -0.08 0.00 -0.16 0.00 0.00 57.16 53.31 2bm8 n GLU 150 Cb 0.15 -2.78 -0.02 0.00 1.43 0.00 0.00 31.44 30.22 2bm8 n GLU 150 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2bm8 s MET 151 N -0.61 0.85 0.68 3.44 0.23 -1.24 -5.12 119.30 117.53 2bm8 s MET 151 Ca 0.42 -0.32 -0.15 0.00 -1.03 0.00 0.00 55.69 54.61 2bm8 s MET 151 Cb 0.12 0.38 0.01 0.00 -1.53 0.00 0.00 34.83 33.81 2bm8 s MET 151 CO -0.01 -0.37 1.12 0.00 -2.03 0.00 0.00 175.02 173.73 2bm8 s ALA 152 N -3.14 2.40 0.34 3.16 0.00 -1.26 -5.03 121.76 118.21 2bm8 s ALA 152 Ca 0.05 0.57 0.10 0.00 0.00 0.00 0.00 51.96 52.68 2bm8 s ALA 152 Cb -0.01 -3.34 -0.06 0.00 0.00 0.00 0.00 23.12 19.71 2bm8 s ALA 152 CO -0.09 -1.40 -0.08 -1.01 0.00 0.00 0.00 175.76 173.18 2bm8 s HIS 153 N -2.34 2.43 1.05 0.00 3.76 -1.26 -3.94 115.29 114.98 2bm8 s HIS 153 Ca 0.67 -0.46 -0.12 0.00 -0.15 0.00 0.00 55.06 55.00 2bm8 s HIS 153 Cb -0.21 -1.36 0.22 0.00 1.11 0.00 0.00 32.58 32.33 2bm8 s HIS 153 CO 0.43 0.58 1.07 -2.14 -0.85 0.00 0.00 174.74 173.83 2bm8 s PRO 154 N -3.62 -0.00 -0.03 8.40 0.02 -1.26 -4.45 135.00 134.05 2bm8 s PRO 154 Ca 0.33 0.99 -0.02 0.00 0.02 0.00 0.00 61.00 62.32 2bm8 s PRO 154 Cb 0.01 -1.65 0.02 0.00 0.02 0.00 0.00 34.50 32.90 2bm8 s PRO 154 CO 0.17 -3.15 0.08 -1.17 -0.33 0.00 0.00 177.00 172.60 2bm8 s LEU 155 N -6.85 1.21 -0.18 -5.54 0.20 -1.26 -0.88 118.68 105.37 2bm8 s LEU 155 Ca 0.67 0.15 -0.02 0.00 0.69 0.00 0.00 54.13 55.61 2bm8 s LEU 155 Cb -0.23 0.16 -0.01 0.00 -0.43 0.00 0.00 46.19 45.68 2bm8 s LEU 155 CO 0.61 -0.10 -0.09 -0.63 -0.29 0.00 0.00 176.35 175.86 2bm8 s ILE 156 N 0.75 3.16 -0.19 6.68 1.01 -0.59 -1.31 121.20 130.70 2bm8 s ILE 156 Ca -0.06 -0.59 -0.04 0.00 0.00 0.00 0.00 60.65 59.97 2bm8 s ILE 156 Cb -0.08 -2.39 -0.02 0.00 0.01 0.00 0.00 42.46 39.98 2bm8 s ILE 156 CO -0.03 0.47 -0.04 0.12 0.00 0.00 0.00 174.94 175.46 2bm8 s PHE 157 N 1.04 2.96 -0.16 3.97 5.36 0.25 -0.99 117.98 130.41 2bm8 s PHE 157 Ca -0.00 -0.67 0.01 0.00 -0.96 0.00 0.00 56.93 55.31 2bm8 s PHE 157 Cb -0.15 -2.04 0.02 0.00 -0.34 0.00 0.00 43.02 40.52 2bm8 s PHE 157 CO -0.01 -0.33 -0.16 0.42 -1.46 0.00 0.00 175.22 173.67 2bm8 s ILE 158 N 1.00 1.75 -0.42 3.12 1.01 0.46 -0.62 121.20 127.51 2bm8 s ILE 158 Ca 0.00 -0.76 -0.19 0.00 0.00 0.00 0.00 60.65 59.71 2bm8 s ILE 158 Cb -0.15 -1.62 0.02 0.00 0.01 0.00 0.00 42.46 40.72 2bm8 s ILE 158 CO 0.01 0.47 0.53 -0.62 0.00 0.00 0.00 174.94 175.33 2bm8 s ASP 159 N 1.41 6.27 -0.00 3.58 3.68 0.12 -0.14 116.67 131.58 2bm8 s ASP 159 Ca 0.05 -0.43 0.11 0.00 2.13 0.00 0.00 52.55 54.41 2bm8 s ASP 159 Cb -0.13 -2.27 0.31 0.00 -1.45 0.00 0.00 42.92 39.38 2bm8 s ASP 159 CO -0.11 -0.64 1.25 0.59 0.13 0.00 0.00 175.17 176.39 2bm8 n ASN 160 N 5.90 2.93 -0.06 -0.34 3.02 0.10 -2.40 115.26 124.40 2bm8 n ASN 160 Ca -0.05 -2.01 -0.10 0.00 -0.03 0.00 0.00 54.58 52.40 2bm8 n ASN 160 Cb 0.48 -0.23 -0.05 0.00 -0.61 0.00 0.00 39.78 39.37 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 0.51 1.95 -2.80 5.41 0.00 -0.94 -4.82 120.51 119.82 2bm8 n ALA 161 Ca 0.12 -0.48 -0.12 0.00 0.00 0.00 0.00 53.44 52.96 2bm8 n ALA 161 Cb 0.43 0.29 0.03 0.00 0.00 0.00 0.00 19.45 20.19 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 -3.12 -1.19 -4.82 0.00 8.25 -1.26 -5.03 115.22 108.05 2bm8 n HIS 162 Ca -0.21 0.36 -0.33 0.00 -0.26 0.00 0.00 57.72 57.28 2bm8 n HIS 162 Cb 0.69 -2.93 -0.16 0.00 1.12 0.00 0.00 29.99 28.71 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 -2.97 2.39 -1.50 -1.41 0.00 -1.26 -4.66 121.76 112.35 2bm8 s ALA 163 Ca 0.21 -0.99 -0.11 0.00 0.00 0.00 0.00 51.96 51.07 2bm8 s ALA 163 Cb -0.09 -1.06 0.07 0.00 0.00 0.00 0.00 23.12 22.04 2bm8 s ALA 163 CO 0.26 0.14 0.89 -1.71 0.00 0.00 0.00 175.76 175.33 2bm8 n ASN 164 N 3.77 -3.76 -0.17 0.00 5.15 -1.26 -4.85 115.26 114.13 2bm8 n ASN 164 Ca -0.19 -0.82 -0.09 0.00 -0.60 0.00 0.00 54.58 52.88 2bm8 n ASN 164 Cb 0.52 -3.79 0.01 0.00 -0.53 0.00 0.00 39.78 35.99 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 -1.99 1.26 -0.01 -0.44 2.02 -1.94 -2.82 112.91 108.99 2bm8 h THR 165 Ca -0.59 -0.99 -0.09 0.00 0.77 0.00 0.00 66.41 65.51 2bm8 h THR 165 Cb 1.37 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 68.69 2bm8 h THR 165 CO 0.66 0.35 -0.40 -0.26 0.37 0.00 0.00 175.52 176.23 2bm8 h PHE 166 N 0.72 0.02 -0.11 3.16 -1.00 -1.98 -0.99 116.94 116.76 2bm8 h PHE 166 Ca 0.15 -0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.73 2bm8 h PHE 166 Cb 0.44 -0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.00 2bm8 h PHE 166 CO 0.03 0.42 -0.73 -0.91 -1.61 0.00 0.00 178.31 175.51 2bm8 h ASN 167 N 0.01 0.62 -0.04 2.17 2.35 -1.94 -2.80 115.58 115.95 2bm8 h ASN 167 Ca -0.00 -0.40 -0.08 0.00 -0.55 0.00 0.00 56.30 55.27 2bm8 h ASN 167 Cb 0.72 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.90 2bm8 h ASN 167 CO 0.05 1.15 -0.21 0.40 -1.65 0.00 0.00 177.43 177.18 2bm8 h ILE 168 N 0.36 1.25 -0.13 2.81 2.04 -1.15 -0.65 117.51 122.03 2bm8 h ILE 168 Ca -0.03 -1.14 -0.15 0.00 1.00 0.00 0.00 64.86 64.53 2bm8 h ILE 168 Cb 1.32 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.68 2bm8 h ILE 168 CO 0.13 0.36 -0.56 -0.03 0.00 0.00 0.00 178.15 178.06 2bm8 h MET 169 N 0.39 0.40 -0.15 2.37 4.05 -1.22 -0.56 114.93 120.21 2bm8 h MET 169 Ca 0.06 -0.26 -0.02 0.00 -0.28 0.00 0.00 59.70 59.21 2bm8 h MET 169 Cb 0.58 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.41 2bm8 h MET 169 CO 0.04 0.85 0.00 -0.22 0.23 0.00 0.00 176.91 177.81 2bm8 h LYS 170 N 0.31 0.26 -0.85 0.39 3.64 -1.20 -1.37 116.57 117.75 2bm8 h LYS 170 Ca 0.00 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2bm8 h LYS 170 Cb 1.07 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.83 2bm8 h LYS 170 CO 0.10 0.49 0.50 2.35 -2.27 0.00 0.00 179.45 180.62 2bm8 h TRP 171 N 0.00 1.13 -0.40 1.91 7.01 -1.00 -1.51 115.95 123.08 2bm8 h TRP 171 Ca 0.04 -0.01 -0.12 0.00 2.11 0.00 0.00 58.89 60.91 2bm8 h TRP 171 Cb 0.37 -0.37 -0.01 0.00 -2.10 0.00 0.00 29.16 27.05 2bm8 h TRP 171 CO 0.03 0.76 -0.22 0.00 -2.79 0.00 0.00 178.44 176.22 2bm8 h ALA 172 N 1.27 0.56 -0.36 2.65 0.00 -1.04 -0.95 119.26 121.40 2bm8 h ALA 172 Ca 0.30 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2bm8 h ALA 172 Cb -0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2bm8 h ALA 172 CO -0.06 0.54 0.06 0.28 0.00 0.00 0.00 179.25 180.08 2bm8 h VAL 173 N 0.67 1.24 0.00 0.00 2.07 -1.13 0.18 116.25 119.28 2bm8 h VAL 173 Ca 0.09 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 2bm8 h VAL 173 Cb 0.78 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2bm8 h VAL 173 CO 0.06 0.28 -0.05 0.44 0.02 0.00 0.00 177.57 178.32 2bm8 h ASP 174 N 0.43 0.00 0.00 0.57 3.32 -1.09 -3.39 116.42 116.26 2bm8 h ASP 174 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2bm8 h ASP 174 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 2bm8 h ASP 174 CO 0.01 0.05 0.00 1.41 -1.72 0.00 0.00 179.24 178.99 2bm8 n HIS 175 N -3.13 0.00 0.10 4.55 8.25 -0.38 -5.02 115.22 119.59 2bm8 n HIS 175 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2bm8 n HIS 175 Cb 0.46 0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.58 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 0.00 -0.59 -4.67 2.41 7.94 -0.25 -4.79 117.00 117.06 2bm8 n LEU 176 Ca 0.00 0.34 -0.42 0.00 -1.11 0.00 0.00 56.01 54.82 2bm8 n LEU 176 Cb 0.36 0.70 -0.03 0.00 0.53 0.00 0.00 43.42 44.98 2bm8 n LEU 176 CO 0.00 -0.54 1.45 -0.76 -1.11 0.00 0.00 177.39 176.43 2bm8 s LEU 177 N -6.14 4.38 0.58 -1.96 1.43 0.47 -5.02 118.68 112.42 2bm8 s LEU 177 Ca 0.00 2.47 -0.02 0.00 -1.03 0.00 0.00 54.13 55.55 2bm8 s LEU 177 Cb 0.00 -3.54 0.03 0.00 0.03 0.00 0.00 46.19 42.71 2bm8 s LEU 177 CO 0.00 -0.97 0.84 -1.61 0.23 0.00 0.00 176.35 174.84 2bm8 s GLU 178 N 3.88 2.56 0.31 1.70 2.02 -1.26 -4.88 118.70 123.03 2bm8 s GLU 178 Ca 0.79 -0.53 -0.30 0.00 0.02 0.00 0.00 54.97 54.96 2bm8 s GLU 178 Cb -0.39 -2.39 -0.12 0.00 0.10 0.00 0.00 34.13 31.33 2bm8 s GLU 178 CO 0.35 -0.79 1.52 -1.91 0.02 0.00 0.00 175.26 174.45 2bm8 n GLU 179 N -2.48 2.56 0.00 1.61 2.13 -1.26 -2.06 120.64 121.14 2bm8 n GLU 179 Ca 0.07 0.91 0.00 0.00 0.66 0.00 0.00 57.16 58.79 2bm8 n GLU 179 Cb 0.59 -2.64 0.00 0.00 0.27 0.00 0.00 31.44 29.66 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 1.63 3.04 3.77 8.31 0.00 -0.34 -5.02 105.19 116.59 2bm8 n GLY 180 Ca 0.07 -0.48 -0.35 0.00 0.00 0.00 0.00 46.02 45.25 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 0.44 5.80 -0.05 1.61 1.01 -0.87 -4.71 116.67 119.90 2bm8 s ASP 181 Ca 0.00 2.21 -0.01 0.00 0.71 0.00 0.00 52.55 55.46 2bm8 s ASP 181 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 2bm8 s ASP 181 CO 0.00 -1.17 0.04 -0.31 0.21 0.00 0.00 175.17 173.95 2bm8 s TYR 182 N -1.72 3.23 -0.25 4.23 1.51 -0.43 -0.80 117.35 123.13 2bm8 s TYR 182 Ca 0.71 0.21 0.03 0.00 -1.01 0.00 0.00 57.07 57.01 2bm8 s TYR 182 Cb -0.25 -1.76 0.05 0.00 -0.11 0.00 0.00 41.96 39.89 2bm8 s TYR 182 CO 0.29 0.52 -0.12 0.12 -1.11 0.00 0.00 175.55 175.25 2bm8 s PHE 183 N -1.04 3.15 -0.20 2.71 5.36 0.31 -0.58 117.98 127.67 2bm8 s PHE 183 Ca 0.18 -2.19 -0.02 0.00 -0.96 0.00 0.00 56.93 53.94 2bm8 s PHE 183 Cb -0.12 -1.91 0.01 0.00 -0.34 0.00 0.00 43.02 40.66 2bm8 s PHE 183 CO 0.08 -0.86 -0.11 0.42 -1.46 0.00 0.00 175.22 173.28 2bm8 s ILE 184 N 1.15 2.76 -0.29 3.12 1.01 0.21 -2.06 121.20 127.10 2bm8 s ILE 184 Ca -0.07 -0.71 -0.10 0.00 0.00 0.00 0.00 60.65 59.77 2bm8 s ILE 184 Cb -0.19 -2.23 -0.02 0.00 0.01 0.00 0.00 42.46 40.03 2bm8 s ILE 184 CO -0.06 0.47 0.15 -0.63 0.00 0.00 0.00 174.94 174.87 2bm8 s ILE 185 N 1.39 4.76 -0.03 2.92 1.01 -0.68 -0.70 121.20 129.86 2bm8 s ILE 185 Ca 0.05 -0.22 -0.17 0.00 0.00 0.00 0.00 60.65 60.32 2bm8 s ILE 185 Cb -0.14 -3.35 -0.05 0.00 0.01 0.00 0.00 42.46 38.93 2bm8 s ILE 185 CO -0.08 0.16 0.46 -1.61 0.00 0.00 0.00 174.94 173.87 2bm8 s GLU 186 N 1.66 4.12 0.00 2.79 2.02 -1.01 -4.44 118.70 123.84 2bm8 s GLU 186 Ca 0.06 0.47 0.00 0.00 0.02 0.00 0.00 54.97 55.52 2bm8 s GLU 186 Cb -0.16 -3.31 0.00 0.00 0.10 0.00 0.00 34.13 30.76 2bm8 s GLU 186 CO 0.07 0.48 0.00 -0.25 0.02 0.00 0.00 175.26 175.58 2bm8 n ASP 187 N 2.51 0.00 0.12 -0.19 8.00 -0.02 -4.69 116.55 122.27 2bm8 n ASP 187 Ca -0.11 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.41 2bm8 n ASP 187 Cb 0.52 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.62 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 -0.55 -1.24 4.05 -1.88 -3.35 114.93 111.96 2bm8 h MET 188 Ca 0.00 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.45 2bm8 h MET 188 Cb 0.00 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 30.76 2bm8 h MET 188 CO 0.00 0.48 0.33 0.82 0.23 0.00 0.00 176.91 178.77 2bm8 h ILE 189 N 0.00 1.05 -0.36 1.77 2.04 -1.84 -0.47 117.51 119.70 2bm8 h ILE 189 Ca -0.03 -0.22 0.08 0.00 1.00 0.00 0.00 64.86 65.68 2bm8 h ILE 189 Cb 1.43 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 2bm8 h ILE 189 CO 0.06 0.12 0.25 -0.65 0.00 0.00 0.00 178.15 177.93 2bm8 h PRO 190 N 0.64 0.13 0.25 2.37 0.11 -1.81 -2.06 132.00 131.62 2bm8 h PRO 190 Ca 0.22 -0.01 -0.33 0.00 0.11 0.00 0.00 66.00 66.00 2bm8 h PRO 190 Cb 0.04 -0.03 0.04 0.00 0.11 0.00 0.00 31.00 31.16 2bm8 h PRO 190 CO -0.10 0.09 -1.43 1.88 -0.21 0.00 0.00 178.00 178.22 2bm8 h TYR 191 N 0.13 0.97 -0.67 0.65 -1.99 -1.35 -2.80 116.97 111.91 2bm8 h TYR 191 Ca 0.17 -0.70 -0.04 0.00 2.00 0.00 0.00 58.73 60.15 2bm8 h TYR 191 Cb 0.49 -0.04 -0.03 0.00 2.00 0.00 0.00 36.73 39.15 2bm8 h TYR 191 CO -0.00 1.55 0.26 -1.49 -0.00 0.00 0.00 178.16 178.48 2bm8 h TRP 192 N 0.11 1.00 -0.07 4.88 6.55 -0.93 -1.77 115.95 125.72 2bm8 h TRP 192 Ca -0.25 -0.07 -0.18 0.00 0.95 0.00 0.00 58.89 59.35 2bm8 h TRP 192 Cb 2.13 -0.30 -0.01 0.00 -0.86 0.00 0.00 29.16 30.12 2bm8 h TRP 192 CO 0.13 0.77 -0.72 -0.92 -1.05 0.00 0.00 178.44 176.65 2bm8 h TYR 193 N 0.97 0.46 -0.32 0.49 3.20 -1.47 0.70 116.97 121.00 2bm8 h TYR 193 Ca 0.23 -0.20 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 2bm8 h TYR 193 Cb 0.19 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 2bm8 h TYR 193 CO 0.02 0.94 0.08 -0.09 -1.64 0.00 0.00 178.16 177.47 2bm8 h ARG 194 N 0.23 0.51 0.00 1.82 2.43 -1.21 -2.69 114.38 115.48 2bm8 h ARG 194 Ca -0.03 -0.12 -0.14 0.00 -0.81 0.00 0.00 59.98 58.88 2bm8 h ARG 194 Cb 1.28 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 2bm8 h ARG 194 CO 0.12 0.58 -1.12 1.88 -1.51 0.00 0.00 179.97 179.91 2bm8 h TYR 195 N 0.36 0.00 -1.22 2.20 0.99 -1.33 -3.41 116.97 114.55 2bm8 h TYR 195 Ca 0.10 0.00 -0.38 0.00 2.00 0.00 0.00 58.73 60.45 2bm8 h TYR 195 Cb 0.29 0.00 -0.34 0.00 1.00 0.00 0.00 36.73 37.68 2bm8 h TYR 195 CO 0.01 0.53 -1.02 0.00 -0.00 0.00 0.00 178.16 177.69 2bm8 n ALA 196 N -2.33 2.01 -0.14 3.88 0.00 0.24 -5.00 120.51 119.17 2bm8 n ALA 196 Ca -0.06 -2.86 -0.04 0.00 0.00 0.00 0.00 53.44 50.49 2bm8 n ALA 196 Cb 0.80 -0.97 0.04 0.00 0.00 0.00 0.00 19.45 19.32 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 2.91 0.15 0.01 0.00 0.13 -1.62 -0.52 132.00 133.05 2bm8 h PRO 197 Ca -0.03 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2bm8 h PRO 197 Cb 1.09 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2bm8 h PRO 197 CO 0.40 0.10 -0.00 1.96 -0.23 0.00 0.00 178.00 180.23 2bm8 h GLN 198 N 0.16 -0.01 -0.58 0.86 4.20 -1.94 -1.35 115.11 116.46 2bm8 h GLN 198 Ca 0.22 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.90 2bm8 h GLN 198 Cb 0.30 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.05 2bm8 h GLN 198 CO -0.33 0.48 0.24 -0.07 -0.67 0.00 0.00 178.83 178.48 2bm8 h LEU 199 N -0.50 0.76 -0.24 1.46 3.38 -1.95 -0.90 115.31 117.32 2bm8 h LEU 199 Ca -0.00 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 2bm8 h LEU 199 Cb 0.49 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2bm8 h LEU 199 CO 0.00 0.67 -0.28 0.15 0.09 0.00 0.00 178.44 179.07 2bm8 h PHE 200 N 0.82 0.74 -0.70 1.13 3.57 -1.05 -0.90 116.94 120.56 2bm8 h PHE 200 Ca 0.20 -0.23 -0.05 0.00 3.53 0.00 0.00 57.97 61.42 2bm8 h PHE 200 Cb 0.15 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 2bm8 h PHE 200 CO 0.01 0.95 0.25 0.77 -2.23 0.00 0.00 178.31 178.07 2bm8 h SER 201 N 0.31 0.97 -0.06 0.41 0.02 -1.06 -0.39 113.55 113.75 2bm8 h SER 201 Ca 0.03 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 60.82 2bm8 h SER 201 Cb 0.85 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 63.14 2bm8 h SER 201 CO 0.07 0.88 0.02 -0.08 -1.14 0.00 0.00 176.83 176.58 2bm8 h GLU 202 N 1.02 0.09 -0.22 3.45 4.81 -1.10 -0.48 114.58 122.15 2bm8 h GLU 202 Ca 0.23 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.41 2bm8 h GLU 202 Cb 0.23 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 2bm8 h GLU 202 CO -0.02 0.23 0.01 1.88 -0.73 0.00 0.00 179.01 180.39 2bm8 h TYR 203 N -0.07 0.41 -0.50 0.92 0.99 -0.92 -1.62 116.97 116.18 2bm8 h TYR 203 Ca 0.02 -0.07 -0.09 0.00 2.00 0.00 0.00 58.73 60.59 2bm8 h TYR 203 Cb 0.17 -0.11 -0.02 0.00 1.00 0.00 0.00 36.73 37.77 2bm8 h TYR 203 CO -0.02 0.55 -0.07 -0.07 -0.00 0.00 0.00 178.16 178.56 2bm8 h LEU 204 N 0.16 0.88 -2.05 3.88 3.38 -1.16 -2.74 115.31 117.66 2bm8 h LEU 204 Ca 0.06 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.84 2bm8 h LEU 204 Cb 0.37 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2bm8 h LEU 204 CO 0.01 0.98 0.16 1.23 0.09 0.00 0.00 178.44 180.91 2bm8 h GLY 205 N 0.98 0.00 2.00 0.83 0.00 -0.63 -1.37 103.07 104.88 2bm8 h GLY 205 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 2bm8 h GLY 205 CO 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 176.54 176.49 2bm8 h ALA 206 N 1.87 1.15 -0.46 3.60 0.00 -0.98 -2.58 119.26 121.86 2bm8 h ALA 206 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2bm8 h ALA 206 Cb 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2bm8 h ALA 206 CO -0.00 0.11 0.00 1.19 0.00 0.00 0.00 179.25 180.55 2bm8 n PHE 207 N -3.41 1.09 0.29 0.00 3.01 -0.52 -4.60 117.46 113.32 2bm8 n PHE 207 Ca -0.01 -0.43 0.13 0.00 1.01 0.00 0.00 57.45 58.15 2bm8 n PHE 207 Cb 0.25 -0.21 0.84 0.00 -0.01 0.00 0.00 39.48 40.35 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 2.90 0.00 0.00 -1.08 0.11 -1.58 -0.94 114.38 113.78 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 1.14 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.22 2bm8 h ARG 208 CO 0.18 0.01 -0.42 -0.25 0.10 0.00 0.00 179.97 179.59 2bm8 n ASP 209 N -4.00 0.54 0.00 0.08 8.00 -1.26 -4.55 116.55 115.35 2bm8 n ASP 209 Ca -0.03 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.58 2bm8 n ASP 209 Cb 0.09 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 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 -1.83 0.00 -4.29 2.53 0.24 -0.84 -4.79 118.33 109.35 2bm8 n VAL 210 Ca 0.05 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.06 2bm8 n VAL 210 Cb 0.39 -0.45 -0.11 0.00 -1.47 0.00 0.00 33.84 32.20 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 -4.54 2.77 0.04 1.34 1.43 -0.42 -2.61 118.68 116.69 2bm8 s LEU 211 Ca 0.00 -0.54 0.03 0.00 -1.03 0.00 0.00 54.13 52.59 2bm8 s LEU 211 Cb 0.00 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.60 2bm8 s LEU 211 CO 0.00 0.17 -0.09 -0.94 0.23 0.00 0.00 176.35 175.72 2bm8 s SER 212 N -2.20 1.07 0.05 2.29 1.04 -0.89 -4.50 113.70 110.57 2bm8 s SER 212 Ca 0.19 -0.45 -0.31 0.00 0.48 0.00 0.00 55.95 55.87 2bm8 s SER 212 Cb -0.11 -0.03 -0.05 0.00 0.10 0.00 0.00 66.02 65.94 2bm8 s SER 212 CO 0.11 -0.08 1.18 -0.32 0.98 0.00 0.00 173.24 175.11 2bm8 s MET 213 N -1.21 4.44 -0.58 4.02 1.75 -1.26 -1.31 119.30 125.16 2bm8 s MET 213 Ca -0.04 1.74 -0.20 0.00 -1.25 0.00 0.00 55.69 55.94 2bm8 s MET 213 Cb -0.08 -3.36 0.08 0.00 2.84 0.00 0.00 34.83 34.31 2bm8 s MET 213 CO 0.01 -0.24 0.74 0.34 -0.65 0.00 0.00 175.02 175.21 2bm8 s ASP 214 N 1.06 6.20 0.00 1.11 -1.08 -0.19 -4.94 116.67 118.84 2bm8 s ASP 214 Ca 0.58 -1.17 0.15 0.00 -0.52 0.00 0.00 52.55 51.59 2bm8 s ASP 214 Cb -0.29 -2.32 0.68 0.00 -1.46 0.00 0.00 42.92 39.53 2bm8 s ASP 214 CO 0.29 -1.11 1.43 0.23 0.52 0.00 0.00 175.17 176.53 2bm8 n MET 215 N 6.56 0.11 0.08 4.34 2.81 -1.26 -1.70 117.12 128.06 2bm8 n MET 215 Ca -0.07 0.20 -0.06 0.00 -1.81 0.00 0.00 57.70 55.96 2bm8 n MET 215 Cb 0.44 -1.50 0.08 0.00 -0.71 0.00 0.00 33.22 31.53 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 0.27 0.00 4.03 5.85 -1.98 -3.38 115.31 120.11 2bm8 h LEU 216 Ca 0.00 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.55 2bm8 h LEU 216 Cb 0.19 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.14 2bm8 h LEU 216 CO 0.00 0.87 -0.48 -1.22 -0.34 0.00 0.00 178.44 177.27 2bm8 n TYR 217 N -3.82 0.00 0.18 1.25 0.53 -0.97 -4.73 117.16 109.61 2bm8 n TYR 217 Ca -0.03 0.00 0.06 0.00 -1.02 0.00 0.00 57.90 56.91 2bm8 n TYR 217 Cb 0.67 -0.02 0.25 0.00 -1.03 0.00 0.00 39.34 39.21 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 0.37 0.88 -0.26 -0.72 0.00 -1.50 -3.07 119.26 114.96 2bm8 h ALA 218 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2bm8 h ALA 218 Cb 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2bm8 h ALA 218 CO 0.00 0.46 0.00 0.09 0.00 0.00 0.00 179.25 179.80 2bm8 n ASN 219 N -3.36 3.15 -0.49 0.00 3.02 -1.26 -0.32 115.26 115.99 2bm8 n ASN 219 Ca 0.01 -2.43 0.12 0.00 -0.03 0.00 0.00 54.58 52.26 2bm8 n ASN 219 Cb 0.57 -0.33 0.22 0.00 -0.61 0.00 0.00 39.78 39.62 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 -0.06 3.08 -3.45 5.41 0.00 -1.16 -4.91 120.51 119.41 2bm8 n ALA 220 Ca 0.14 -0.54 -0.16 0.00 0.00 0.00 0.00 53.44 52.88 2bm8 n ALA 220 Cb 0.59 -0.96 -0.05 0.00 0.00 0.00 0.00 19.45 19.03 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 -2.33 -0.59 0.31 0.00 1.04 -1.26 -4.79 113.70 106.07 2bm8 s SER 221 Ca 0.25 0.43 0.16 0.00 0.48 0.00 0.00 55.95 57.27 2bm8 s SER 221 Cb 0.19 0.55 0.35 0.00 0.10 0.00 0.00 66.02 67.21 2bm8 s SER 221 CO 0.47 -0.72 1.58 0.77 0.98 0.00 0.00 173.24 176.32 2bm8 h SER 222 N 2.70 0.00 1.01 7.02 4.64 -1.95 -0.78 113.55 126.19 2bm8 h SER 222 Ca -0.30 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.84 2bm8 h SER 222 Cb 1.20 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.26 2bm8 h SER 222 CO 0.39 0.48 -0.87 1.56 -0.87 0.00 0.00 176.83 177.52 2bm8 h GLN 223 N 0.00 0.00 -0.02 4.77 4.20 -1.97 -3.25 115.11 118.84 2bm8 h GLN 223 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2bm8 h GLN 223 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.95 2bm8 h GLN 223 CO 0.06 0.87 -0.01 1.28 -0.67 0.00 0.00 178.83 180.37 2bm8 n LEU 224 N -3.40 2.40 -4.57 1.46 4.77 -1.14 -0.84 117.00 115.68 2bm8 n LEU 224 Ca 0.00 -0.80 -0.61 0.00 -0.03 0.00 0.00 56.01 54.57 2bm8 n LEU 224 Cb 0.86 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.86 2bm8 n LEU 224 CO 0.45 0.40 1.43 -0.67 -1.33 0.00 0.00 177.39 177.67 2bm8 n ASP 225 N 0.87 1.46 -2.16 -1.43 2.03 -0.31 -0.71 116.55 116.29 2bm8 n ASP 225 Ca 0.16 0.93 -0.13 0.00 0.52 0.00 0.00 54.79 56.27 2bm8 n ASP 225 Cb 0.50 -0.99 -0.02 0.00 -0.72 0.00 0.00 41.12 39.89 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 5.79 -1.93 0.00 -0.67 1.74 0.57 -4.60 116.66 117.56 2bm8 n ARG 226 Ca 0.38 0.69 0.00 0.00 -0.77 0.00 0.00 57.85 58.15 2bm8 n ARG 226 Cb 0.02 -5.21 0.00 0.00 -1.02 0.00 0.00 32.46 26.26 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 -0.68 0.06 3.46 -0.13 0.00 0.12 -4.93 105.19 103.08 2bm8 n GLY 227 Ca -0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.31 4.74 0.20 1.61 1.01 -1.25 -1.69 120.40 124.71 2bm8 s VAL 228 Ca 0.00 -0.33 0.10 0.00 0.00 0.00 0.00 61.98 61.76 2bm8 s VAL 228 Cb 0.00 -4.37 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 2bm8 s VAL 228 CO 0.00 -0.91 -0.17 -0.76 0.00 0.00 0.00 175.10 173.26 2bm8 s LEU 229 N 2.98 2.69 -0.03 3.92 1.43 -0.87 -1.02 118.68 127.78 2bm8 s LEU 229 Ca 0.19 -0.76 -0.21 0.00 -1.03 0.00 0.00 54.13 52.32 2bm8 s LEU 229 Cb -0.18 -1.38 0.04 0.00 0.03 0.00 0.00 46.19 44.71 2bm8 s LEU 229 CO 0.13 0.10 0.45 0.00 0.23 0.00 0.00 176.35 177.26 2bm8 s ARG 230 N -2.85 0.82 -0.63 1.70 1.70 -0.43 -0.53 118.95 118.73 2bm8 s ARG 230 Ca 0.24 -0.02 -0.26 0.00 -0.47 0.00 0.00 55.73 55.22 2bm8 s ARG 230 Cb -0.08 0.37 -0.06 0.00 -0.57 0.00 0.00 34.95 34.62 2bm8 s ARG 230 CO 0.13 -0.24 2.15 0.50 -1.08 0.00 0.00 175.30 176.76 2bm8 s ARG 231 N -1.27 2.28 -0.23 3.89 6.06 0.02 -2.09 118.95 127.62 2bm8 s ARG 231 Ca -0.13 0.77 -0.26 0.00 -2.50 0.00 0.00 55.73 53.61 2bm8 s ARG 231 Cb -0.03 -4.60 0.09 0.00 0.06 0.00 0.00 34.95 30.46 2bm8 s ARG 231 CO 0.06 -3.25 0.81 0.08 -2.50 0.00 0.00 175.30 170.50 2bm8 s VAL 232 N 11.14 0.00 0.00 7.11 1.01 -1.07 -1.19 120.40 137.39 2bm8 s VAL 232 Ca 0.82 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.80 2bm8 s VAL 232 Cb -0.13 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.25 2bm8 s VAL 232 CO 0.18 0.00 0.00 0.00 0.00 0.00 0.00 175.10 175.28