#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bm8 h ASP 3 N 0.00 0.00 -0.52 0.53 5.19 -2.03 -3.26 116.42 116.32 2bm8 h ASP 3 Ca 0.00 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.34 2bm8 h ASP 3 Cb 0.00 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.49 2bm8 h ASP 3 CO 0.00 0.00 0.06 0.10 -3.12 0.00 0.00 179.24 176.28 2bm8 h TYR 4 N 0.00 0.95 -0.00 4.55 -0.00 -2.06 -3.02 116.97 117.39 2bm8 h TYR 4 Ca 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 58.73 58.56 2bm8 h TYR 4 Cb 0.55 -0.26 -0.00 0.00 0.00 0.00 0.00 36.73 37.02 2bm8 h TYR 4 CO 0.00 0.86 -0.12 0.66 -0.00 0.00 0.00 178.16 179.56 2bm8 h SER 5 N 0.77 0.00 0.00 0.10 4.64 -2.07 -2.92 113.55 114.07 2bm8 h SER 5 Ca 0.16 -0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.15 2bm8 h SER 5 Cb 0.44 -0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.47 2bm8 h SER 5 CO 0.02 0.12 -2.22 -2.11 -0.87 0.00 0.00 176.83 171.77 2bm8 n ARG 6 N -4.40 1.06 -1.62 4.77 -4.01 -1.25 -5.03 116.66 106.18 2bm8 n ARG 6 Ca -0.03 0.00 -0.40 0.00 -1.04 0.00 0.00 57.85 56.39 2bm8 n ARG 6 Cb 0.19 -1.45 0.03 0.00 -3.04 0.00 0.00 32.46 28.18 2bm8 n ARG 6 CO 0.00 0.00 0.00 0.94 -3.04 0.00 0.00 177.63 175.53 2bm8 n GLN 7 N -2.70 1.26 -4.29 2.89 7.27 -1.11 -5.00 117.38 115.70 2bm8 n GLN 7 Ca -0.30 0.46 -0.34 0.00 0.07 0.00 0.00 57.00 56.89 2bm8 n GLN 7 Cb 1.06 -2.12 -0.11 0.00 2.41 0.00 0.00 30.24 31.49 2bm8 n GLN 7 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 2bm8 s ASN 8 N -0.89 5.16 -0.37 1.69 3.04 -1.26 -4.99 114.94 117.31 2bm8 s ASN 8 Ca 0.67 0.01 -0.07 0.00 0.04 0.00 0.00 52.86 53.51 2bm8 s ASN 8 Cb -0.50 -1.74 0.06 0.00 -1.54 0.00 0.00 41.25 37.53 2bm8 s ASN 8 CO 0.54 0.23 0.17 -0.36 -3.04 0.00 0.00 177.10 174.64 2bm8 s PHE 9 N -0.02 3.32 0.58 0.43 0.40 -1.26 -5.08 117.98 116.34 2bm8 s PHE 9 Ca 0.03 -1.54 -0.19 0.00 -0.60 0.00 0.00 56.93 54.63 2bm8 s PHE 9 Cb -0.13 -2.61 -0.06 0.00 0.51 0.00 0.00 43.02 40.73 2bm8 s PHE 9 CO 0.02 -0.79 0.88 1.04 0.70 0.00 0.00 175.22 177.07 2bm8 n GLN 10 N 4.83 0.85 -2.58 0.44 6.02 -1.26 -4.94 117.38 120.74 2bm8 n GLN 10 Ca -0.11 0.33 -0.43 0.00 -0.01 0.00 0.00 57.00 56.78 2bm8 n GLN 10 Cb 0.44 -2.06 -0.02 0.00 1.02 0.00 0.00 30.24 29.61 2bm8 n GLN 10 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2bm8 s ASP 11 N -1.20 6.82 0.15 1.08 -1.08 -1.26 -4.92 116.67 116.26 2bm8 s ASP 11 Ca 0.73 0.98 0.23 0.00 -0.52 0.00 0.00 52.55 53.98 2bm8 s ASP 11 Cb -0.43 -2.54 0.90 0.00 -1.46 0.00 0.00 42.92 39.38 2bm8 s ASP 11 CO 0.49 -1.00 1.71 0.18 0.52 0.00 0.00 175.17 177.07 2bm8 n LEU 12 N 7.23 0.45 0.28 -1.34 4.32 -1.26 -2.45 117.00 124.23 2bm8 n LEU 12 Ca 0.13 0.58 0.15 0.00 -0.02 0.00 0.00 56.01 56.85 2bm8 n LEU 12 Cb 0.47 -0.48 0.84 0.00 -1.62 0.00 0.00 43.42 42.62 2bm8 n LEU 12 CO 0.62 -0.31 1.04 0.78 -1.22 0.00 0.00 177.39 178.30 2bm8 h ASN 13 N 0.00 0.00 0.22 -1.43 2.35 -2.00 -2.66 115.58 112.06 2bm8 h ASN 13 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2bm8 h ASN 13 Cb 0.45 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.82 2bm8 h ASN 13 CO 0.00 0.07 0.00 -0.07 -1.65 0.00 0.00 177.43 175.78 2bm8 h LEU 14 N 0.00 0.00 -2.13 1.61 4.07 -1.90 -2.36 115.31 114.60 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 0.23 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.97 2bm8 h LEU 14 CO 0.01 0.00 0.00 0.49 -1.08 0.00 0.00 178.44 177.86 2bm8 n PHE 15 N -2.54 0.29 -1.65 1.13 0.99 -1.00 -4.92 117.46 109.75 2bm8 n PHE 15 Ca -0.01 -0.17 -0.43 0.00 -0.00 0.00 0.00 57.45 56.85 2bm8 n PHE 15 Cb 0.10 -0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 38.55 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 1.23 2.71 -0.02 -1.08 0.63 -0.89 -2.10 116.66 117.14 2bm8 n ARG 16 Ca 0.15 0.96 0.00 0.00 -0.92 0.00 0.00 57.85 58.05 2bm8 n ARG 16 Cb 0.53 -3.03 0.00 0.00 0.45 0.00 0.00 32.46 30.41 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 4.74 2.09 0.99 5.14 0.00 -1.26 -4.81 105.19 112.08 2bm8 n GLY 17 Ca 0.22 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 0.03 0.00 0.99 4.77 -0.94 -5.11 117.00 116.74 2bm8 n LEU 18 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2bm8 n LEU 18 Cb 0.00 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2bm8 n LEU 18 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 2bm8 n GLY 19 N 2.98 -1.53 0.07 -0.72 0.00 -0.89 -4.89 105.19 100.22 2bm8 n GLY 19 Ca -0.01 -2.23 0.08 0.00 0.00 0.00 0.00 46.02 43.86 2bm8 n GLY 19 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bm8 n GLU 20 N -0.48 0.63 -3.87 1.61 1.02 -1.26 -4.63 120.64 113.67 2bm8 n GLU 20 Ca 0.00 0.02 -0.22 0.00 -0.02 0.00 0.00 57.16 56.94 2bm8 n GLU 20 Cb 0.00 -1.70 -0.17 0.00 -0.02 0.00 0.00 31.44 29.55 2bm8 n GLU 20 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2bm8 s ASP 21 N -5.17 1.38 0.35 1.62 -1.08 -1.26 -5.03 116.67 107.48 2bm8 s ASP 21 Ca -0.04 -0.09 0.07 0.00 -0.52 0.00 0.00 52.55 51.96 2bm8 s ASP 21 Cb 0.11 -0.43 0.64 0.00 -1.46 0.00 0.00 42.92 41.78 2bm8 s ASP 21 CO 0.84 -0.16 1.85 1.55 0.52 0.00 0.00 175.17 179.77 2bm8 h PRO 22 N 8.01 0.34 -7.14 4.34 0.13 -1.89 -3.44 132.00 132.34 2bm8 h PRO 22 Ca -0.25 -0.09 -0.51 0.00 -0.87 0.00 0.00 66.00 64.28 2bm8 h PRO 22 Cb 1.13 -0.04 0.09 0.00 0.13 0.00 0.00 31.00 32.31 2bm8 h PRO 22 CO 0.32 0.49 0.41 0.00 -0.23 0.00 0.00 178.00 178.99 2bm8 s ALA 23 N -4.67 2.57 -0.04 -0.56 0.00 -1.26 -4.46 121.76 113.34 2bm8 s ALA 23 Ca -0.06 0.72 -0.18 0.00 0.00 0.00 0.00 51.96 52.44 2bm8 s ALA 23 Cb 0.15 -3.35 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 2bm8 s ALA 23 CO 0.75 -1.05 0.50 -0.47 0.00 0.00 0.00 175.76 175.50 2bm8 s TYR 24 N -2.01 3.64 -0.08 0.00 5.04 -1.26 -4.89 117.35 117.79 2bm8 s TYR 24 Ca 0.71 1.04 0.02 0.00 -2.44 0.00 0.00 57.07 56.40 2bm8 s TYR 24 Cb -0.23 -2.50 0.02 0.00 0.35 0.00 0.00 41.96 39.60 2bm8 s TYR 24 CO 0.34 0.38 -0.12 -1.01 -1.34 0.00 0.00 175.55 173.80 2bm8 s HIS 25 N -0.20 1.53 0.53 4.97 3.76 -1.26 -5.01 115.29 119.61 2bm8 s HIS 25 Ca 0.27 -0.64 -0.22 0.00 -0.15 0.00 0.00 55.06 54.32 2bm8 s HIS 25 Cb -0.17 -1.15 -0.05 0.00 1.11 0.00 0.00 32.58 32.31 2bm8 s HIS 25 CO 0.14 -0.36 1.36 -0.35 -0.85 0.00 0.00 174.74 174.68 2bm8 n PRO 26 N 4.13 1.74 -1.51 8.40 -0.04 -1.26 -4.93 135.00 141.52 2bm8 n PRO 26 Ca -0.20 0.64 -0.39 0.00 -0.04 0.00 0.00 63.50 63.50 2bm8 n PRO 26 Cb 0.51 -2.57 0.03 0.00 -0.04 0.00 0.00 33.50 31.43 2bm8 n PRO 26 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2bm8 n PRO 27 N -0.89 0.73 -4.71 0.54 -0.02 -1.26 -5.03 135.00 124.36 2bm8 n PRO 27 Ca 0.10 0.28 -0.23 0.00 -2.02 0.00 0.00 63.50 61.62 2bm8 n PRO 27 Cb 0.44 -1.80 -0.15 0.00 -0.02 0.00 0.00 33.50 31.97 2bm8 n PRO 27 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bm8 s VAL 28 N -1.56 1.19 0.24 -1.45 1.01 -1.26 -5.13 120.40 113.44 2bm8 s VAL 28 Ca 0.68 -0.64 -0.25 0.00 0.00 0.00 0.00 61.98 61.77 2bm8 s VAL 28 Cb -0.49 -0.99 -0.09 0.00 0.00 0.00 0.00 36.38 34.81 2bm8 s VAL 28 CO 0.54 0.34 0.84 -0.76 0.00 0.00 0.00 175.10 176.06 2bm8 s LEU 29 N -0.35 4.45 -0.01 3.92 1.02 -1.26 -4.79 118.68 121.66 2bm8 s LEU 29 Ca 0.06 1.69 0.00 0.00 0.02 0.00 0.00 54.13 55.90 2bm8 s LEU 29 Cb -0.06 -3.65 -0.01 0.00 0.02 0.00 0.00 46.19 42.49 2bm8 s LEU 29 CO -0.01 0.06 -0.01 0.41 0.02 0.00 0.00 176.35 176.83 2bm8 n THR 30 N 1.00 0.08 -0.91 5.49 -1.04 -1.26 -4.86 114.28 112.79 2bm8 n THR 30 Ca -0.02 -0.03 0.04 0.00 -2.04 0.00 0.00 64.05 62.00 2bm8 n THR 30 Cb 0.50 -0.62 0.06 0.00 -1.82 0.00 0.00 70.33 68.44 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 -2.46 1.53 -3.73 8.00 5.75 -1.26 -5.03 116.55 119.34 2bm8 n ASP 31 Ca -0.02 -2.30 -0.10 0.00 -0.01 0.00 0.00 54.79 52.36 2bm8 n ASP 31 Cb 0.53 -0.21 -0.04 0.00 -1.03 0.00 0.00 41.12 40.37 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 -1.44 1.35 0.50 0.11 1.04 -1.26 -5.11 118.95 114.13 2bm8 s ARG 32 Ca 0.13 -0.86 -0.20 0.00 -1.04 0.00 0.00 55.73 53.76 2bm8 s ARG 32 Cb 0.11 0.51 -0.08 0.00 -2.04 0.00 0.00 34.95 33.46 2bm8 s ARG 32 CO 0.01 -0.57 1.07 -1.25 -0.04 0.00 0.00 175.30 174.53 2bm8 s PRO 33 N -3.87 3.69 0.30 3.89 0.04 -1.26 -4.91 135.00 132.88 2bm8 s PRO 33 Ca 0.09 1.46 0.06 0.00 0.04 0.00 0.00 61.00 62.65 2bm8 s PRO 33 Cb -0.01 -2.11 0.48 0.00 0.04 0.00 0.00 34.50 32.91 2bm8 s PRO 33 CO -0.04 -0.54 1.72 -0.09 0.04 0.00 0.00 177.00 178.09 2bm8 h ARG 34 N 1.53 0.26 -4.33 4.56 2.43 -2.01 -3.38 114.38 113.44 2bm8 h ARG 34 Ca -0.50 -0.11 -0.73 0.00 -0.81 0.00 0.00 59.98 57.83 2bm8 h ARG 34 Cb 1.23 -0.01 -0.25 0.00 -0.42 0.00 0.00 29.97 30.53 2bm8 h ARG 34 CO 0.59 0.60 -0.37 -0.51 -1.51 0.00 0.00 179.97 178.77 2bm8 s ASP 35 N -6.87 5.95 0.05 -3.80 1.01 -1.26 -5.07 116.67 106.68 2bm8 s ASP 35 Ca -0.05 -1.48 -0.25 0.00 0.71 0.00 0.00 52.55 51.48 2bm8 s ASP 35 Cb 0.14 -2.11 -0.06 0.00 1.01 0.00 0.00 42.92 41.90 2bm8 s ASP 35 CO 0.77 -0.64 0.78 0.86 0.21 0.00 0.00 175.17 177.15 2bm8 s TRP 36 N 1.54 3.75 0.18 4.23 -0.11 -1.26 -5.04 118.94 122.23 2bm8 s TRP 36 Ca 0.04 1.50 -0.30 0.00 1.22 0.00 0.00 56.10 58.55 2bm8 s TRP 36 Cb -0.25 -2.83 -0.08 0.00 -1.50 0.00 0.00 33.47 28.81 2bm8 s TRP 36 CO 0.04 0.28 1.28 -2.14 -4.62 0.00 0.00 176.95 171.79 2bm8 s PRO 37 N -0.09 4.41 0.46 5.86 0.02 -1.26 -4.93 135.00 139.47 2bm8 s PRO 37 Ca 0.39 2.00 0.25 0.00 0.02 0.00 0.00 61.00 63.66 2bm8 s PRO 37 Cb -0.21 -3.22 1.04 0.00 0.02 0.00 0.00 34.50 32.13 2bm8 s PRO 37 CO 0.23 -0.23 1.88 -0.07 -0.33 0.00 0.00 177.00 178.48 2bm8 h LEU 38 N 5.57 0.00 -1.18 -5.54 4.07 -1.98 -2.21 115.31 114.05 2bm8 h LEU 38 Ca -0.44 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.52 2bm8 h LEU 38 Cb 1.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.95 2bm8 h LEU 38 CO 0.78 0.20 0.00 -2.24 -1.08 0.00 0.00 178.44 176.09 2bm8 h ASP 39 N 0.00 0.00 -0.44 -0.43 2.03 -2.05 -2.44 116.42 113.09 2bm8 h ASP 39 Ca -0.00 0.00 -0.26 0.00 -0.73 0.00 0.00 57.03 56.04 2bm8 h ASP 39 Cb 0.66 0.00 -0.16 0.00 -0.83 0.00 0.00 39.33 39.00 2bm8 h ASP 39 CO 0.03 0.00 -0.14 0.54 -1.03 0.00 0.00 179.24 178.63 2bm8 n ARG 40 N -2.73 2.13 -0.17 4.15 1.74 -0.84 -4.85 116.66 116.08 2bm8 n ARG 40 Ca 0.01 -3.35 -0.07 0.00 -0.77 0.00 0.00 57.85 53.67 2bm8 n ARG 40 Cb 0.27 -1.91 0.02 0.00 -1.02 0.00 0.00 32.46 29.82 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 1.24 0.65 -0.00 -1.55 7.01 -1.34 -2.16 115.95 119.79 2bm8 h TRP 41 Ca 0.26 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.27 2bm8 h TRP 41 Cb 1.56 -0.21 -0.00 0.00 -2.10 0.00 0.00 29.16 28.40 2bm8 h TRP 41 CO 1.04 0.44 0.01 0.00 -2.79 0.00 0.00 178.44 177.13 2bm8 h ALA 42 N 1.16 1.59 -0.01 2.65 0.00 -1.89 -2.74 119.26 120.02 2bm8 h ALA 42 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2bm8 h ALA 42 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2bm8 h ALA 42 CO -0.04 -0.01 -0.01 0.39 0.00 0.00 0.00 179.25 179.59 2bm8 n GLU 43 N -3.92 1.36 -2.33 0.00 1.02 -0.81 -4.94 120.64 111.01 2bm8 n GLU 43 Ca -0.03 -0.56 -0.39 0.00 -0.02 0.00 0.00 57.16 56.16 2bm8 n GLU 43 Cb 0.09 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 29.99 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 3.23 0.63 0.62 0.00 -1.04 -4.99 121.76 118.18 2bm8 s ALA 44 Ca 0.41 0.96 -0.18 0.00 0.00 0.00 0.00 51.96 53.15 2bm8 s ALA 44 Cb 0.21 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.94 2bm8 s ALA 44 CO 0.36 -0.44 1.25 -1.25 0.00 0.00 0.00 175.76 175.67 2bm8 s PRO 45 N -2.11 2.73 0.00 0.00 0.04 -1.26 -4.95 135.00 129.44 2bm8 s PRO 45 Ca 0.54 1.93 0.14 0.00 0.04 0.00 0.00 61.00 63.64 2bm8 s PRO 45 Cb -0.31 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.24 2bm8 s PRO 45 CO 0.39 -1.42 0.63 0.54 0.04 0.00 0.00 177.00 177.19 2bm8 n ARG 46 N -1.81 2.34 -2.00 4.56 5.12 -1.26 -4.99 116.66 118.61 2bm8 n ARG 46 Ca 0.15 -0.22 -0.30 0.00 -1.93 0.00 0.00 57.85 55.54 2bm8 n ARG 46 Cb 0.49 -1.16 0.01 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 -2.11 6.17 0.23 0.55 1.47 -1.26 -4.99 116.67 116.72 2bm8 s ASP 47 Ca 0.07 1.31 -0.08 0.00 1.18 0.00 0.00 52.55 55.03 2bm8 s ASP 47 Cb 0.11 -2.38 0.38 0.00 -0.34 0.00 0.00 42.92 40.68 2bm8 s ASP 47 CO 0.50 -0.86 1.69 0.25 0.68 0.00 0.00 175.17 177.43 2bm8 h LEU 48 N -0.25 -0.02 0.00 2.11 5.85 -2.03 -3.46 115.31 117.50 2bm8 h LEU 48 Ca -0.45 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.41 2bm8 h LEU 48 Cb 1.20 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.42 2bm8 h LEU 48 CO 0.62 -0.02 0.00 0.61 -0.34 0.00 0.00 178.44 179.31 2bm8 n GLY 49 N -1.34 0.82 3.83 3.75 0.00 -1.26 -5.05 105.19 105.94 2bm8 n GLY 49 Ca 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.11 0.04 0.15 1.61 -0.85 -1.26 -4.32 117.35 110.61 2bm8 s TYR 50 Ca 0.00 -0.55 -0.30 0.00 -0.52 0.00 0.00 57.07 55.69 2bm8 s TYR 50 Cb 0.00 0.75 -0.08 0.00 0.38 0.00 0.00 41.96 43.02 2bm8 s TYR 50 CO 0.00 -1.21 1.25 0.45 -1.52 0.00 0.00 175.55 174.52 2bm8 s SER 51 N -3.17 7.00 -0.14 -0.18 0.15 -1.26 -4.93 113.70 111.17 2bm8 s SER 51 Ca 0.17 2.24 0.12 0.00 0.70 0.00 0.00 55.95 59.17 2bm8 s SER 51 Cb -0.04 -2.60 0.57 0.00 -1.71 0.00 0.00 66.02 62.25 2bm8 s SER 51 CO 0.08 -0.47 1.41 -0.90 1.20 0.00 0.00 173.24 174.55 2bm8 n ASP 52 N 3.07 4.13 0.02 5.45 5.75 -1.26 -4.65 116.55 129.06 2bm8 n ASP 52 Ca 0.07 -2.53 -0.03 0.00 -0.01 0.00 0.00 54.79 52.28 2bm8 n ASP 52 Cb 0.44 -0.58 -0.02 0.00 -1.03 0.00 0.00 41.12 39.93 2bm8 n ASP 52 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 2bm8 h PHE 53 N 2.97 -0.32 -1.35 2.11 -0.00 -2.05 -3.39 116.94 114.90 2bm8 h PHE 53 Ca 0.00 0.01 -0.28 0.00 -0.00 0.00 0.00 57.97 57.70 2bm8 h PHE 53 Cb 1.40 0.14 -0.22 0.00 -0.00 0.00 0.00 35.95 37.27 2bm8 h PHE 53 CO 0.71 -0.12 -0.64 -1.13 -0.00 0.00 0.00 178.31 177.13 2bm8 n SER 54 N -3.09 -2.56 -1.48 0.41 3.41 -1.26 -5.02 113.62 104.03 2bm8 n SER 54 Ca -0.02 -2.78 0.05 0.00 -0.26 0.00 0.00 58.87 55.86 2bm8 n SER 54 Cb 0.08 1.08 0.29 0.00 -0.26 0.00 0.00 64.21 65.40 2bm8 n SER 54 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2bm8 n PRO 55 N 2.83 3.75 -3.57 4.33 -0.04 -1.26 -4.91 135.00 136.12 2bm8 n PRO 55 Ca 0.21 -2.23 -0.32 0.00 -0.04 0.00 0.00 63.50 61.12 2bm8 n PRO 55 Cb 0.54 -2.03 -0.05 0.00 -0.04 0.00 0.00 33.50 31.92 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 -2.23 3.45 0.25 0.54 4.12 -1.26 -4.93 117.35 117.29 2bm8 s TYR 56 Ca 0.39 0.67 0.01 0.00 0.02 0.00 0.00 57.07 58.16 2bm8 s TYR 56 Cb 0.29 -2.10 -0.03 0.00 -1.52 0.00 0.00 41.96 38.60 2bm8 s TYR 56 CO 0.12 0.37 0.21 1.14 0.02 0.00 0.00 175.55 177.40 2bm8 s GLN 57 N -2.73 1.42 -0.25 -0.62 -2.07 -1.26 -1.34 119.66 112.81 2bm8 s GLN 57 Ca 0.43 -1.74 -0.02 0.00 -1.82 0.00 0.00 55.36 52.21 2bm8 s GLN 57 Cb -0.12 0.30 0.13 0.00 -1.09 0.00 0.00 33.01 32.23 2bm8 s GLN 57 CO 0.23 -0.50 0.33 -0.46 -1.32 0.00 0.00 175.29 173.58 2bm8 s TRP 58 N -3.89 -0.67 -1.43 9.60 -0.11 0.22 -4.74 118.94 117.92 2bm8 s TRP 58 Ca 0.39 0.49 -0.09 0.00 1.22 0.00 0.00 56.10 58.11 2bm8 s TRP 58 Cb 0.05 -0.16 0.05 0.00 -1.50 0.00 0.00 33.47 31.91 2bm8 s TRP 58 CO 0.17 -0.75 0.97 0.54 -4.62 0.00 0.00 176.95 173.26 2bm8 n ARG 59 N 5.35 -5.98 -1.09 5.86 1.74 -1.26 -1.79 116.66 119.48 2bm8 n ARG 59 Ca -0.03 0.67 -0.03 0.00 -0.77 0.00 0.00 57.85 57.68 2bm8 n ARG 59 Cb 0.49 -5.53 -0.01 0.00 -1.02 0.00 0.00 32.46 26.39 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 -1.70 0.63 3.40 -0.13 0.00 -1.26 -5.03 105.19 101.11 2bm8 n GLY 60 Ca -0.06 -0.67 -0.32 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.73 2.54 0.34 0.99 1.43 -0.74 -4.52 118.68 117.98 2bm8 s LEU 61 Ca 0.00 -0.30 -0.29 0.00 -1.03 0.00 0.00 54.13 52.51 2bm8 s LEU 61 Cb 0.00 -1.51 -0.11 0.00 0.03 0.00 0.00 46.19 44.60 2bm8 s LEU 61 CO 0.00 0.29 1.50 0.54 0.23 0.00 0.00 176.35 178.91 2bm8 n ARG 62 N 2.65 2.61 -4.07 1.70 1.74 -1.26 -0.61 116.66 119.41 2bm8 n ARG 62 Ca -0.17 0.92 -0.33 0.00 -0.77 0.00 0.00 57.85 57.49 2bm8 n ARG 62 Cb 0.52 -2.65 -0.16 0.00 -1.02 0.00 0.00 32.46 29.15 2bm8 n ARG 62 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2bm8 s MET 63 N -1.52 3.05 0.17 5.56 -1.94 -0.45 -3.87 119.30 120.31 2bm8 s MET 63 Ca 0.57 -0.80 0.16 0.00 -1.71 0.00 0.00 55.69 53.91 2bm8 s MET 63 Cb -0.50 -2.67 -0.03 0.00 2.01 0.00 0.00 34.83 33.64 2bm8 s MET 63 CO 0.58 -0.22 1.13 -0.07 -0.01 0.00 0.00 175.02 176.44 2bm8 h LEU 64 N 7.97 0.00 -9.28 -0.03 3.38 -1.94 -3.38 115.31 112.04 2bm8 h LEU 64 Ca -0.44 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 56.97 2bm8 h LEU 64 Cb 1.14 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 2bm8 h LEU 64 CO 0.63 0.50 0.64 -0.54 0.09 0.00 0.00 178.44 179.76 2bm8 s LYS 65 N -2.97 4.38 0.70 1.13 1.02 -1.26 -5.04 119.74 117.70 2bm8 s LYS 65 Ca 0.01 1.53 -0.06 0.00 0.02 0.00 0.00 55.97 57.46 2bm8 s LYS 65 Cb 0.08 -3.56 0.06 0.00 -0.52 0.00 0.00 37.83 33.90 2bm8 s LYS 65 CO 0.78 -0.40 1.01 0.16 -0.92 0.00 0.00 175.35 175.98 2bm8 s ASP 66 N 1.30 4.82 0.40 2.83 1.47 -1.26 -4.76 116.67 121.47 2bm8 s ASP 66 Ca 0.52 0.44 0.12 0.00 1.18 0.00 0.00 52.55 54.81 2bm8 s ASP 66 Cb -0.21 -1.09 0.94 0.00 -0.34 0.00 0.00 42.92 42.21 2bm8 s ASP 66 CO 0.19 -1.59 1.93 -0.65 0.68 0.00 0.00 175.17 175.73 2bm8 h PRO 67 N -0.58 0.53 -0.76 2.11 0.11 -1.98 -0.53 132.00 130.90 2bm8 h PRO 67 Ca -0.44 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2bm8 h PRO 67 Cb 1.32 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 2bm8 h PRO 67 CO 0.60 0.35 0.42 -0.44 -0.21 0.00 0.00 178.00 178.71 2bm8 h ASP 68 N 0.54 0.94 0.12 -2.05 5.19 -1.93 -1.66 116.42 117.57 2bm8 h ASP 68 Ca 0.36 -0.10 -0.23 0.00 -0.62 0.00 0.00 57.03 56.44 2bm8 h ASP 68 Cb 0.65 -0.24 0.01 0.00 0.18 0.00 0.00 39.33 39.93 2bm8 h ASP 68 CO -0.13 0.77 -0.90 0.74 -3.12 0.00 0.00 179.24 176.60 2bm8 h THR 69 N 1.04 1.33 -0.71 0.35 2.02 -1.54 -2.98 112.91 112.43 2bm8 h THR 69 Ca 0.27 -2.23 0.05 0.00 0.77 0.00 0.00 66.41 65.27 2bm8 h THR 69 Cb 0.03 2.26 -0.05 0.00 -1.74 0.00 0.00 68.15 68.65 2bm8 h THR 69 CO -0.04 0.68 0.42 1.56 0.37 0.00 0.00 175.52 178.51 2bm8 h GLN 70 N 0.36 0.76 -0.36 6.66 4.20 -0.98 -1.61 115.11 124.14 2bm8 h GLN 70 Ca -0.08 -0.05 0.04 0.00 0.06 0.00 0.00 58.65 58.62 2bm8 h GLN 70 Cb 1.53 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 29.10 2bm8 h GLN 70 CO 0.17 0.51 0.14 0.00 -0.67 0.00 0.00 178.83 178.97 2bm8 h ALA 71 N 1.34 0.43 -0.56 3.87 0.00 -1.20 -0.31 119.26 122.83 2bm8 h ALA 71 Ca 0.31 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2bm8 h ALA 71 Cb 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2bm8 h ALA 71 CO -0.16 -0.25 0.35 0.28 0.00 0.00 0.00 179.25 179.48 2bm8 h VAL 72 N 0.30 1.16 -0.02 0.00 2.07 -1.31 -2.15 116.25 116.30 2bm8 h VAL 72 Ca 0.16 -0.33 -0.10 0.00 0.82 0.00 0.00 66.70 67.25 2bm8 h VAL 72 Cb 0.12 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 2bm8 h VAL 72 CO -0.15 0.16 -0.47 1.88 0.02 0.00 0.00 177.57 179.00 2bm8 h TYR 73 N 0.76 0.04 -0.20 1.57 -1.99 -0.90 -1.79 116.97 114.46 2bm8 h TYR 73 Ca 0.20 -0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.92 2bm8 h TYR 73 Cb -0.05 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.66 2bm8 h TYR 73 CO -0.03 0.51 0.11 1.25 -0.00 0.00 0.00 178.16 180.00 2bm8 h HIS 74 N 0.03 0.28 -0.50 4.88 2.76 -0.66 -1.68 115.15 120.26 2bm8 h HIS 74 Ca -0.00 -0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 58.04 2bm8 h HIS 74 Cb 0.85 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.71 2bm8 h HIS 74 CO 0.00 0.26 -0.15 -0.44 -1.30 0.00 0.00 177.93 176.30 2bm8 h ASP 75 N 0.22 0.99 -0.73 3.26 3.32 -0.96 -1.84 116.42 120.69 2bm8 h ASP 75 Ca 0.07 -0.37 -0.07 0.00 0.02 0.00 0.00 57.03 56.68 2bm8 h ASP 75 Cb 0.08 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 2bm8 h ASP 75 CO -0.01 1.14 0.19 -0.03 -1.72 0.00 0.00 179.24 178.81 2bm8 h MET 76 N 0.84 1.15 -0.28 3.56 4.05 -1.34 -1.35 114.93 121.56 2bm8 h MET 76 Ca 0.12 -0.27 -0.07 0.00 -0.28 0.00 0.00 59.70 59.21 2bm8 h MET 76 Cb 0.72 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 2bm8 h MET 76 CO 0.06 1.00 -0.09 -0.07 0.23 0.00 0.00 176.91 178.04 2bm8 h LEU 77 N 1.10 0.57 -1.23 3.39 4.07 -1.16 0.21 115.31 122.25 2bm8 h LEU 77 Ca 0.23 -0.38 0.03 0.00 0.08 0.00 0.00 57.88 57.85 2bm8 h LEU 77 Cb 0.35 -0.16 -0.05 0.00 1.08 0.00 0.00 40.66 41.89 2bm8 h LEU 77 CO -0.00 0.82 0.53 -0.25 -1.08 0.00 0.00 178.44 178.46 2bm8 h TRP 78 N 0.32 0.97 0.00 1.13 2.91 -1.20 0.87 115.95 120.94 2bm8 h TRP 78 Ca 0.07 0.02 -0.05 0.00 1.13 0.00 0.00 58.89 60.06 2bm8 h TRP 78 Cb 0.58 -0.32 -0.01 0.00 -0.51 0.00 0.00 29.16 28.90 2bm8 h TRP 78 CO 0.05 0.56 -0.32 1.49 -1.03 0.00 0.00 178.44 179.20 2bm8 h GLU 79 N 1.00 0.00 -0.10 2.65 4.81 -1.09 -3.39 114.58 118.47 2bm8 h GLU 79 Ca 0.32 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.42 2bm8 h GLU 79 Cb 0.03 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.42 2bm8 h GLU 79 CO -0.09 0.69 -0.43 1.25 -0.73 0.00 0.00 179.01 179.69 2bm8 h LEU 80 N -1.00 0.55 -2.47 1.64 6.46 -1.04 -3.49 115.31 115.96 2bm8 h LEU 80 Ca -0.07 -0.64 -0.21 0.00 -0.12 0.00 0.00 57.88 56.84 2bm8 h LEU 80 Cb 0.80 -0.16 0.17 0.00 -0.73 0.00 0.00 40.66 40.74 2bm8 h LEU 80 CO -0.05 1.10 -0.72 0.54 -0.62 0.00 0.00 178.44 178.69 2bm8 n ARG 81 N -4.30 -2.03 -2.02 1.25 1.74 0.30 -4.87 116.66 106.74 2bm8 n ARG 81 Ca -0.08 0.90 -0.38 0.00 -0.77 0.00 0.00 57.85 57.52 2bm8 n ARG 81 Cb 0.56 -5.61 0.01 0.00 -1.02 0.00 0.00 32.46 26.41 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 -4.16 3.51 0.01 5.56 0.04 -1.26 -4.63 135.00 134.07 2bm8 s PRO 82 Ca 0.38 2.04 0.10 0.00 0.04 0.00 0.00 61.00 63.56 2bm8 s PRO 82 Cb -0.05 -2.39 -0.23 0.00 0.04 0.00 0.00 34.50 31.87 2bm8 s PRO 82 CO 0.70 -0.83 0.85 0.00 0.04 0.00 0.00 177.00 177.77 2bm8 h ARG 83 N 1.87 0.02 -4.02 4.56 2.47 -0.82 -3.41 114.38 115.05 2bm8 h ARG 83 Ca -0.50 -0.03 -0.38 0.00 -1.26 0.00 0.00 59.98 57.81 2bm8 h ARG 83 Cb 1.27 0.01 -0.33 0.00 -1.65 0.00 0.00 29.97 29.27 2bm8 h ARG 83 CO 0.59 0.69 -0.76 0.99 0.56 0.00 0.00 179.97 182.04 2bm8 s THR 84 N -2.63 0.44 -0.17 2.04 2.01 -0.95 -1.18 115.64 115.21 2bm8 s THR 84 Ca -0.04 -0.10 0.01 0.00 0.31 0.00 0.00 61.69 61.87 2bm8 s THR 84 Cb 0.08 -0.47 0.02 0.00 0.01 0.00 0.00 72.50 72.15 2bm8 s THR 84 CO 0.82 0.19 -0.17 -0.63 -0.69 0.00 0.00 174.62 174.14 2bm8 s ILE 85 N 0.74 1.87 -0.15 1.82 1.01 -0.74 -1.01 121.20 124.75 2bm8 s ILE 85 Ca -0.09 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 59.66 2bm8 s ILE 85 Cb -0.12 -1.73 -0.03 0.00 0.01 0.00 0.00 42.46 40.58 2bm8 s ILE 85 CO -0.00 0.47 -0.03 -0.69 0.00 0.00 0.00 174.94 174.69 2bm8 s VAL 86 N 1.36 3.94 -0.29 2.92 1.01 0.20 -1.16 120.40 128.36 2bm8 s VAL 86 Ca 0.04 -0.35 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 2bm8 s VAL 86 Cb -0.13 -2.71 0.05 0.00 0.00 0.00 0.00 36.38 33.58 2bm8 s VAL 86 CO -0.12 0.51 -0.03 -1.61 0.00 0.00 0.00 175.10 173.85 2bm8 s GLU 87 N 0.21 2.42 -0.50 2.72 0.41 0.19 -1.28 118.70 122.87 2bm8 s GLU 87 Ca -0.02 -1.26 -0.26 0.00 -0.41 0.00 0.00 54.97 53.02 2bm8 s GLU 87 Cb -0.14 -3.11 0.03 0.00 -1.78 0.00 0.00 34.13 29.13 2bm8 s GLU 87 CO 0.03 -0.60 0.98 -1.17 -0.49 0.00 0.00 175.26 174.01 2bm8 s LEU 88 N 1.23 3.93 0.00 1.80 0.20 -0.22 -1.08 118.68 124.54 2bm8 s LEU 88 Ca -0.06 0.05 0.00 0.00 0.69 0.00 0.00 54.13 54.81 2bm8 s LEU 88 Cb -0.20 -3.15 0.00 0.00 -0.43 0.00 0.00 46.19 42.42 2bm8 s LEU 88 CO -0.02 -1.16 0.00 0.61 -0.29 0.00 0.00 176.35 175.49 2bm8 n GLY 89 N 4.98 0.72 0.59 7.98 0.00 0.25 -1.46 105.19 118.25 2bm8 n GLY 89 Ca 0.06 -1.15 -0.11 0.00 0.00 0.00 0.00 46.02 44.82 2bm8 n GLY 89 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2bm8 n VAL 90 N 2.62 0.94 0.00 1.61 0.31 -1.26 -4.79 118.33 117.77 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 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.16 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 -3.72 0.00 0.29 3.52 9.36 -1.26 -3.38 117.16 121.97 2bm8 n TYR 91 Ca -0.20 0.00 0.11 0.00 3.32 0.00 0.00 57.90 61.13 2bm8 n TYR 91 Cb 0.54 0.00 -0.09 0.00 -0.63 0.00 0.00 39.34 39.16 2bm8 n TYR 91 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 2bm8 n ASN 92 N 11.55 0.41 0.00 2.98 6.94 -1.26 -1.87 115.26 134.02 2bm8 n ASN 92 Ca 0.00 -0.14 0.00 0.00 -0.02 0.00 0.00 54.58 54.42 2bm8 n ASN 92 Cb 0.00 1.33 0.00 0.00 -2.36 0.00 0.00 39.78 38.75 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 1.31 0.77 0.26 4.83 0.00 -1.22 -0.03 105.19 111.11 2bm8 n GLY 93 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 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 0.99 1.43 -0.02 0.00 -1.86 -1.99 103.07 101.61 2bm8 h GLY 94 Ca 0.00 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 46.95 2bm8 h GLY 94 CO 0.00 0.21 -0.11 1.48 0.00 0.00 0.00 176.54 178.13 2bm8 h SER 95 N 0.76 0.67 0.02 0.19 4.64 -1.92 -2.30 113.55 115.61 2bm8 h SER 95 Ca 0.29 -0.19 -0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2bm8 h SER 95 Cb 0.11 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 2bm8 h SER 95 CO -0.14 0.81 -0.01 -0.07 -0.87 0.00 0.00 176.83 176.55 2bm8 h LEU 96 N 0.63 -0.02 -1.32 5.97 4.07 -1.81 -0.84 115.31 121.99 2bm8 h LEU 96 Ca 0.11 -0.09 0.04 0.00 0.08 0.00 0.00 57.88 58.02 2bm8 h LEU 96 Cb 0.55 0.01 -0.04 0.00 1.08 0.00 0.00 40.66 42.25 2bm8 h LEU 96 CO 0.03 0.08 0.49 0.00 -1.08 0.00 0.00 178.44 177.96 2bm8 h ALA 97 N 0.86 1.59 -0.08 1.53 0.00 -1.29 -1.75 119.26 120.13 2bm8 h ALA 97 Ca -0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2bm8 h ALA 97 Cb 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2bm8 h ALA 97 CO 0.00 0.32 -0.14 2.35 0.00 0.00 0.00 179.25 181.78 2bm8 h TRP 98 N 0.87 0.29 -0.76 0.00 7.01 -1.14 -0.36 115.95 121.87 2bm8 h TRP 98 Ca 0.30 -0.10 0.06 0.00 2.11 0.00 0.00 58.89 61.26 2bm8 h TRP 98 Cb 0.10 -0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 27.05 2bm8 h TRP 98 CO -0.00 0.74 0.45 0.74 -2.79 0.00 0.00 178.44 177.58 2bm8 h PHE 99 N -0.24 0.83 -0.35 2.65 0.05 -1.01 -0.43 116.94 118.44 2bm8 h PHE 99 Ca 0.00 0.03 -0.09 0.00 3.82 0.00 0.00 57.97 61.73 2bm8 h PHE 99 Cb 0.72 -0.26 -0.01 0.00 2.00 0.00 0.00 35.95 38.39 2bm8 h PHE 99 CO 0.11 0.42 -0.12 -0.09 -0.18 0.00 0.00 178.31 178.45 2bm8 h ARG 100 N 0.83 0.70 -0.32 1.51 1.12 -1.19 -2.18 114.38 114.84 2bm8 h ARG 100 Ca 0.33 -0.28 -0.09 0.00 -1.11 0.00 0.00 59.98 58.83 2bm8 h ARG 100 Cb 0.17 -0.03 -0.02 0.00 -0.01 0.00 0.00 29.97 30.08 2bm8 h ARG 100 CO -0.17 0.88 -0.19 -0.44 -3.11 0.00 0.00 179.97 176.94 2bm8 h ASP 101 N 0.49 0.59 -0.17 -3.80 3.32 -0.60 -2.07 116.42 114.18 2bm8 h ASP 101 Ca 0.08 -0.19 -0.10 0.00 0.02 0.00 0.00 57.03 56.85 2bm8 h ASP 101 Cb 0.64 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.03 2bm8 h ASP 101 CO 0.04 0.79 -0.28 0.25 -1.72 0.00 0.00 179.24 178.32 2bm8 h LEU 102 N 0.54 0.54 -0.98 1.55 5.85 -1.05 -2.25 115.31 119.51 2bm8 h LEU 102 Ca 0.09 -0.53 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 2bm8 h LEU 102 Cb 0.62 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 2bm8 h LEU 102 CO 0.04 0.97 0.52 0.71 -0.34 0.00 0.00 178.44 180.35 2bm8 h THR 103 N 0.13 1.25 0.13 1.05 1.35 -1.30 -0.68 112.91 114.84 2bm8 h THR 103 Ca 0.01 -0.58 -0.01 0.00 -0.55 0.00 0.00 66.41 65.29 2bm8 h THR 103 Cb 0.87 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.30 2bm8 h THR 103 CO 0.06 0.27 -0.06 0.50 -0.25 0.00 0.00 175.52 176.04 2bm8 h LYS 104 N 1.24 -0.17 -0.38 4.72 3.64 -1.37 -0.04 116.57 124.22 2bm8 h LYS 104 Ca 0.32 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.69 2bm8 h LYS 104 Cb -0.02 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2bm8 h LYS 104 CO -0.06 -0.00 0.14 0.82 -2.27 0.00 0.00 179.45 178.08 2bm8 h ILE 105 N -0.31 1.15 0.00 2.00 1.08 -1.24 -2.20 117.51 118.00 2bm8 h ILE 105 Ca -0.02 -0.48 0.00 0.00 -0.39 0.00 0.00 64.86 63.97 2bm8 h ILE 105 Cb 0.25 0.71 0.00 0.00 -3.07 0.00 0.00 36.82 34.71 2bm8 h ILE 105 CO 0.03 0.18 0.00 0.23 -0.69 0.00 0.00 178.15 177.90 2bm8 n MET 106 N -4.38 0.10 -0.80 2.37 2.81 -0.28 -4.90 117.12 112.04 2bm8 n MET 106 Ca 0.02 0.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.04 2bm8 n MET 106 Cb 0.15 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.03 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 0.56 3.79 3.03 0.00 -0.83 -5.04 105.19 107.86 2bm8 n GLY 107 Ca 0.06 -0.33 -0.38 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 -2.00 4.93 -0.75 -0.61 1.01 -0.07 -5.02 121.20 118.68 2bm8 s ILE 108 Ca 0.00 1.10 -0.20 0.00 0.00 0.00 0.00 60.65 61.55 2bm8 s ILE 108 Cb 0.00 -3.85 0.11 0.00 0.01 0.00 0.00 42.46 38.73 2bm8 s ILE 108 CO 0.00 0.48 0.95 -0.62 0.00 0.00 0.00 174.94 175.75 2bm8 s ASP 109 N -0.55 6.38 -0.07 3.58 3.68 -1.26 -4.18 116.67 124.25 2bm8 s ASP 109 Ca 0.28 -1.59 0.00 0.00 2.13 0.00 0.00 52.55 53.37 2bm8 s ASP 109 Cb -0.18 -2.37 0.02 0.00 -1.45 0.00 0.00 42.92 38.95 2bm8 s ASP 109 CO 0.16 -1.17 -0.04 0.00 0.13 0.00 0.00 175.17 174.24 2bm8 s GLN 111 N 1.35 4.39 -0.16 0.00 -1.52 -0.32 -4.93 119.66 118.47 2bm8 s GLN 111 Ca -0.04 0.74 -0.05 0.00 -1.95 0.00 0.00 55.36 54.07 2bm8 s GLN 111 Cb -0.13 -3.42 -0.03 0.00 -0.22 0.00 0.00 33.01 29.21 2bm8 s GLN 111 CO -0.03 0.17 0.01 0.08 -0.25 0.00 0.00 175.29 175.27 2bm8 s VAL 112 N 0.49 4.30 -0.05 1.09 1.01 -0.29 -1.79 120.40 125.15 2bm8 s VAL 112 Ca 0.33 -0.22 0.05 0.00 0.00 0.00 0.00 61.98 62.14 2bm8 s VAL 112 Cb -0.17 -2.90 -0.00 0.00 0.00 0.00 0.00 36.38 33.31 2bm8 s VAL 112 CO 0.16 0.50 -0.20 -0.63 0.00 0.00 0.00 175.10 174.93 2bm8 s ILE 113 N 0.19 1.68 -0.11 2.22 1.01 -0.31 -1.92 121.20 123.97 2bm8 s ILE 113 Ca 0.01 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 59.85 2bm8 s ILE 113 Cb -0.13 -1.44 0.00 0.00 0.01 0.00 0.00 42.46 40.90 2bm8 s ILE 113 CO 0.02 0.48 -0.23 -0.83 0.00 0.00 0.00 174.94 174.37 2bm8 s GLY 114 N 0.04 1.34 -0.14 6.18 0.00 -0.96 0.54 107.32 114.32 2bm8 s GLY 114 Ca -0.06 -0.98 0.01 0.00 0.00 0.00 0.00 44.72 43.70 2bm8 s GLY 114 CO 0.03 -0.29 -0.18 -0.42 0.00 0.00 0.00 173.10 172.24 2bm8 s ILE 115 N 0.39 2.41 -0.16 0.90 1.01 -0.24 -1.48 121.20 124.03 2bm8 s ILE 115 Ca -0.17 -0.86 -0.20 0.00 0.00 0.00 0.00 60.65 59.42 2bm8 s ILE 115 Cb -0.18 -1.99 0.05 0.00 0.01 0.00 0.00 42.46 40.35 2bm8 s ILE 115 CO 0.08 0.53 0.52 -0.62 0.00 0.00 0.00 174.94 175.45 2bm8 s ASP 116 N 0.75 -0.52 0.30 3.58 2.15 -1.10 0.88 116.67 122.70 2bm8 s ASP 116 Ca -0.07 0.90 0.03 0.00 0.43 0.00 0.00 52.55 53.84 2bm8 s ASP 116 Cb -0.16 0.92 0.77 0.00 -0.30 0.00 0.00 42.92 44.15 2bm8 s ASP 116 CO 0.00 -0.27 1.62 -0.09 -0.17 0.00 0.00 175.17 176.26 2bm8 h ARG 117 N 4.82 0.14 -3.67 4.34 9.65 -1.84 -2.69 114.38 125.12 2bm8 h ARG 117 Ca -0.28 -0.01 -0.46 0.00 -1.10 0.00 0.00 59.98 58.14 2bm8 h ARG 117 Cb 1.17 -0.03 -0.38 0.00 -1.39 0.00 0.00 29.97 29.33 2bm8 h ARG 117 CO 0.23 0.09 -0.77 0.34 2.80 0.00 0.00 179.97 182.66 2bm8 s ASP 118 N -5.03 1.90 -0.02 -3.80 2.15 -1.26 -4.69 116.67 105.92 2bm8 s ASP 118 Ca -0.12 -0.26 0.14 0.00 0.43 0.00 0.00 52.55 52.75 2bm8 s ASP 118 Cb 0.27 -0.48 0.43 0.00 -0.30 0.00 0.00 42.92 42.84 2bm8 s ASP 118 CO 0.77 -0.22 1.36 0.18 -0.17 0.00 0.00 175.17 177.09 2bm8 n LEU 119 N 5.12 3.36 0.22 -1.34 4.77 -1.26 -4.59 117.00 123.29 2bm8 n LEU 119 Ca -0.08 -2.11 0.07 0.00 -0.03 0.00 0.00 56.01 53.86 2bm8 n LEU 119 Cb 0.49 -0.34 0.51 0.00 -2.33 0.00 0.00 43.42 41.76 2bm8 n LEU 119 CO 0.11 0.79 0.85 0.77 -1.33 0.00 0.00 177.39 178.58 2bm8 h SER 120 N 2.65 0.00 0.41 -1.43 4.64 -1.95 -2.93 113.55 114.94 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 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2bm8 h SER 120 CO 0.03 0.24 -0.10 0.54 -0.87 0.00 0.00 176.83 176.67 2bm8 n ARG 121 N -3.93 0.62 -1.69 4.77 3.00 -1.26 -4.90 116.66 113.28 2bm8 n ARG 121 Ca -0.02 -0.19 -0.44 0.00 -0.01 0.00 0.00 57.85 57.19 2bm8 n ARG 121 Cb 0.32 -1.50 -0.02 0.00 0.00 0.00 0.00 32.46 31.27 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 1.83 2.38 -2.03 0.00 1.13 0.95 -4.99 117.38 116.65 2bm8 n GLN 123 Ca 0.10 -0.45 -0.42 0.00 -1.94 0.00 0.00 57.00 54.29 2bm8 n GLN 123 Cb 0.33 -0.94 -0.03 0.00 0.11 0.00 0.00 30.24 29.72 2bm8 n GLN 123 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2bm8 s ILE 124 N -0.94 3.61 0.40 5.09 1.01 -1.25 -4.96 121.20 124.16 2bm8 s ILE 124 Ca 0.04 0.73 -0.27 0.00 0.00 0.00 0.00 60.65 61.16 2bm8 s ILE 124 Cb 0.04 -3.49 -0.11 0.00 0.01 0.00 0.00 42.46 38.92 2bm8 s ILE 124 CO 0.13 -0.09 1.35 -2.65 0.00 0.00 0.00 174.94 173.68 2bm8 n PRO 125 N 7.19 2.19 0.20 2.79 -0.02 -1.26 -4.89 135.00 141.19 2bm8 n PRO 125 Ca 0.17 0.77 0.15 0.00 -2.02 0.00 0.00 63.50 62.57 2bm8 n PRO 125 Cb 0.43 -2.46 0.76 0.00 -0.02 0.00 0.00 33.50 32.20 2bm8 n PRO 125 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bm8 h ALA 126 N 2.42 1.96 0.00 3.55 0.00 -2.01 -0.55 119.26 124.63 2bm8 h ALA 126 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2bm8 h ALA 126 Cb 1.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2bm8 h ALA 126 CO 0.62 -0.23 -0.03 -1.13 0.00 0.00 0.00 179.25 178.48 2bm8 n SER 127 N -4.15 0.26 -2.03 0.00 3.41 -1.26 -3.51 113.62 106.33 2bm8 n SER 127 Ca 0.01 0.49 -0.25 0.00 -0.26 0.00 0.00 58.87 58.86 2bm8 n SER 127 Cb 0.27 -0.54 0.10 0.00 -0.26 0.00 0.00 64.21 63.78 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 -1.72 5.51 -0.62 4.04 2.03 -0.22 -4.71 116.55 120.87 2bm8 n ASP 128 Ca 0.06 -3.76 0.07 0.00 0.52 0.00 0.00 54.79 51.69 2bm8 n ASP 128 Cb 0.37 -0.74 0.19 0.00 -0.72 0.00 0.00 41.12 40.22 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 -0.94 2.68 -2.03 -0.67 1.56 -1.23 -4.83 117.12 111.66 2bm8 n MET 129 Ca 0.52 -2.45 -0.42 0.00 -0.27 0.00 0.00 57.70 55.08 2bm8 n MET 129 Cb 0.95 -1.55 -0.03 0.00 2.15 0.00 0.00 33.22 34.74 2bm8 n MET 129 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 2bm8 s GLU 130 N -2.14 4.23 -1.19 2.12 2.12 -1.26 -2.30 118.70 120.27 2bm8 s GLU 130 Ca 0.31 2.20 -0.02 0.00 0.36 0.00 0.00 54.97 57.83 2bm8 s GLU 130 Cb 0.24 -3.60 0.00 0.00 0.26 0.00 0.00 34.13 31.03 2bm8 s GLU 130 CO 0.09 -0.68 0.22 0.09 -0.54 0.00 0.00 175.26 174.44 2bm8 n ASN 131 N 5.55 -4.68 -3.84 -1.70 3.02 -1.26 -5.00 115.26 107.35 2bm8 n ASN 131 Ca 0.15 -0.11 -0.23 0.00 -0.03 0.00 0.00 54.58 54.35 2bm8 n ASN 131 Cb 0.42 -3.68 -0.17 0.00 -0.61 0.00 0.00 39.78 35.74 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 -2.87 0.61 -0.18 2.41 1.01 -0.97 -1.14 121.20 120.06 2bm8 s ILE 132 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.70 2bm8 s ILE 132 Cb -0.05 -0.69 0.02 0.00 0.01 0.00 0.00 42.46 41.74 2bm8 s ILE 132 CO 0.14 0.28 -0.18 -0.89 0.00 0.00 0.00 174.94 174.29 2bm8 s THR 133 N 1.62 2.23 0.04 2.92 2.01 -0.81 -4.98 115.64 118.68 2bm8 s THR 133 Ca 0.01 -0.88 -0.26 0.00 0.31 0.00 0.00 61.69 60.86 2bm8 s THR 133 Cb -0.13 -1.95 -0.05 0.00 0.01 0.00 0.00 72.50 70.38 2bm8 s THR 133 CO -0.04 0.53 0.83 -0.76 -0.69 0.00 0.00 174.62 174.48 2bm8 s LEU 134 N 1.29 4.44 -0.08 4.42 2.01 -1.26 -2.26 118.68 127.24 2bm8 s LEU 134 Ca 0.05 1.52 0.05 0.00 0.01 0.00 0.00 54.13 55.75 2bm8 s LEU 134 Cb -0.13 -3.33 -0.00 0.00 0.01 0.00 0.00 46.19 42.73 2bm8 s LEU 134 CO -0.11 -0.05 -0.23 -1.00 1.01 0.00 0.00 176.35 175.97 2bm8 s HIS 135 N 0.16 2.35 0.24 0.29 3.76 -0.55 -4.98 115.29 116.56 2bm8 s HIS 135 Ca 0.42 -0.83 -0.30 0.00 -0.15 0.00 0.00 55.06 54.20 2bm8 s HIS 135 Cb -0.21 -1.56 -0.09 0.00 1.11 0.00 0.00 32.58 31.83 2bm8 s HIS 135 CO 0.24 -0.31 1.09 -1.14 -0.85 0.00 0.00 174.74 173.78 2bm8 s GLN 136 N 0.14 4.63 0.06 1.40 2.00 -1.26 -2.72 119.66 123.91 2bm8 s GLN 136 Ca -0.11 1.76 -0.06 0.00 -2.00 0.00 0.00 55.36 54.95 2bm8 s GLN 136 Cb -0.16 -3.22 0.02 0.00 0.80 0.00 0.00 33.01 30.45 2bm8 s GLN 136 CO 0.06 0.18 0.28 0.41 -0.50 0.00 0.00 175.29 175.71 2bm8 n GLY 137 N 1.50 1.21 3.61 2.59 0.00 -1.01 -4.88 105.19 108.20 2bm8 n GLY 137 Ca 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.66 -0.43 0.16 1.61 2.15 -1.26 -2.72 116.67 114.51 2bm8 s ASP 138 Ca 0.06 0.68 0.18 0.00 0.43 0.00 0.00 52.55 53.90 2bm8 s ASP 138 Cb -0.01 0.63 -0.04 0.00 -0.30 0.00 0.00 42.92 43.20 2bm8 s ASP 138 CO 0.02 -0.26 1.04 0.00 -0.17 0.00 0.00 175.17 175.80 2bm8 h SER 140 N 0.00 0.00 -3.79 0.00 4.64 -1.93 -3.41 113.55 109.06 2bm8 h SER 140 Ca -0.08 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.58 2bm8 h SER 140 Cb 1.36 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.27 2bm8 h SER 140 CO 0.03 0.00 -0.51 -1.81 -0.87 0.00 0.00 176.83 173.67 2bm8 s ASP 141 N -5.70 5.93 0.00 4.97 1.01 -1.20 -4.95 116.67 116.72 2bm8 s ASP 141 Ca 0.03 -0.23 0.27 0.00 0.71 0.00 0.00 52.55 53.32 2bm8 s ASP 141 Cb 0.08 -2.10 1.39 0.00 1.01 0.00 0.00 42.92 43.30 2bm8 s ASP 141 CO 0.56 -0.13 1.92 0.18 0.21 0.00 0.00 175.17 177.91 2bm8 n LEU 142 N 5.06 0.00 0.15 1.23 4.77 -1.26 -3.20 117.00 123.75 2bm8 n LEU 142 Ca -0.14 0.25 0.13 0.00 -0.03 0.00 0.00 56.01 56.23 2bm8 n LEU 142 Cb 0.51 -0.25 0.38 0.00 -2.33 0.00 0.00 43.42 41.73 2bm8 n LEU 142 CO 0.34 -0.03 0.87 0.71 -1.33 0.00 0.00 177.39 177.96 2bm8 h THR 143 N 0.00 0.00 -0.84 -5.08 1.35 -1.92 -2.80 112.91 103.62 2bm8 h THR 143 Ca 0.00 -0.57 0.03 0.00 -0.55 0.00 0.00 66.41 65.32 2bm8 h THR 143 Cb 0.22 1.53 -0.05 0.00 -1.73 0.00 0.00 68.15 68.13 2bm8 h THR 143 CO 0.00 0.00 0.54 0.74 -0.25 0.00 0.00 175.52 176.55 2bm8 h THR 144 N 0.00 1.14 0.03 6.82 2.02 -1.81 -3.10 112.91 118.01 2bm8 h THR 144 Ca 0.00 -0.36 -0.27 0.00 0.77 0.00 0.00 66.41 66.54 2bm8 h THR 144 Cb 0.73 -0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 2bm8 h THR 144 CO 0.00 0.19 -1.49 -0.26 0.37 0.00 0.00 175.52 174.33 2bm8 h PHE 145 N 1.06 0.10 0.00 3.16 -1.00 -1.76 -3.23 116.94 115.27 2bm8 h PHE 145 Ca 0.33 -0.07 0.00 0.00 2.81 0.00 0.00 57.97 61.04 2bm8 h PHE 145 Cb -0.01 -0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.55 2bm8 h PHE 145 CO -0.02 1.10 0.00 0.39 -1.61 0.00 0.00 178.31 178.17 2bm8 n GLU 146 N -3.22 0.49 -0.47 1.51 1.02 -1.07 -1.87 120.64 117.02 2bm8 n GLU 146 Ca -0.13 0.04 0.08 0.00 -0.02 0.00 0.00 57.16 57.13 2bm8 n GLU 146 Cb 1.02 -1.50 0.27 0.00 -0.02 0.00 0.00 31.44 31.21 2bm8 n GLU 146 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2bm8 n HIS 147 N -1.11 1.06 -3.30 -0.32 8.25 -1.17 -4.95 115.22 113.68 2bm8 n HIS 147 Ca 0.13 -0.77 -0.36 0.00 -0.26 0.00 0.00 57.72 56.46 2bm8 n HIS 147 Cb 0.10 -0.28 -0.06 0.00 1.12 0.00 0.00 29.99 30.87 2bm8 n HIS 147 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2bm8 s LEU 148 N -2.41 4.35 0.21 2.41 1.02 -0.78 -5.02 118.68 118.46 2bm8 s LEU 148 Ca 0.41 1.16 0.25 0.00 0.02 0.00 0.00 54.13 55.97 2bm8 s LEU 148 Cb 0.31 -3.31 0.51 0.00 0.02 0.00 0.00 46.19 43.72 2bm8 s LEU 148 CO 0.12 0.10 1.53 0.03 0.02 0.00 0.00 176.35 178.15 2bm8 h ARG 149 N 3.60 0.00 0.00 1.70 2.47 -1.92 -3.45 114.38 116.78 2bm8 h ARG 149 Ca -0.49 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 2bm8 h ARG 149 Cb 1.19 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 2bm8 h ARG 149 CO 0.65 0.00 0.00 -1.91 0.56 0.00 0.00 179.97 179.27 2bm8 n GLU 150 N -2.37 3.05 -4.14 0.04 2.13 -1.26 -5.20 120.64 112.90 2bm8 n GLU 150 Ca 0.04 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 57.74 2bm8 n GLU 150 Cb 0.46 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 32.09 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 2.83 1.37 0.78 5.31 -1.94 -1.26 -5.17 119.30 121.21 2bm8 s MET 151 Ca 0.00 -1.54 -0.12 0.00 -1.71 0.00 0.00 55.69 52.33 2bm8 s MET 151 Cb 0.00 0.34 0.06 0.00 2.01 0.00 0.00 34.83 37.24 2bm8 s MET 151 CO 0.00 -0.50 1.13 0.00 -0.01 0.00 0.00 175.02 175.64 2bm8 s ALA 152 N -4.03 2.60 0.23 3.03 0.00 -1.26 -5.03 121.76 117.30 2bm8 s ALA 152 Ca 0.34 -0.46 0.10 0.00 0.00 0.00 0.00 51.96 51.94 2bm8 s ALA 152 Cb 0.04 -3.01 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 2bm8 s ALA 152 CO 0.12 -1.54 -0.19 -1.01 0.00 0.00 0.00 175.76 173.14 2bm8 s HIS 153 N -3.41 2.06 0.84 0.00 3.76 -1.26 -3.72 115.29 113.57 2bm8 s HIS 153 Ca 0.61 -0.42 -0.10 0.00 -0.15 0.00 0.00 55.06 54.99 2bm8 s HIS 153 Cb -0.12 -0.94 0.10 0.00 1.11 0.00 0.00 32.58 32.73 2bm8 s HIS 153 CO 0.51 0.54 1.12 -2.14 -0.85 0.00 0.00 174.74 173.92 2bm8 s PRO 154 N -3.35 1.64 -0.00 8.40 0.02 -1.26 -4.56 135.00 135.88 2bm8 s PRO 154 Ca 0.25 1.35 0.04 0.00 0.02 0.00 0.00 61.00 62.66 2bm8 s PRO 154 Cb -0.04 -1.81 -0.01 0.00 0.02 0.00 0.00 34.50 32.66 2bm8 s PRO 154 CO 0.11 -2.14 -0.12 -1.17 -0.33 0.00 0.00 177.00 173.35 2bm8 s LEU 155 N -6.26 2.04 -0.19 -5.54 0.20 -1.26 -0.21 118.68 107.46 2bm8 s LEU 155 Ca 0.64 -0.23 0.01 0.00 0.69 0.00 0.00 54.13 55.24 2bm8 s LEU 155 Cb -0.20 -0.60 0.03 0.00 -0.43 0.00 0.00 46.19 44.99 2bm8 s LEU 155 CO 0.57 0.13 -0.18 -0.63 -0.29 0.00 0.00 176.35 175.95 2bm8 s ILE 156 N -0.33 2.02 -0.23 6.68 1.01 -0.18 -1.89 121.20 128.28 2bm8 s ILE 156 Ca 0.04 -1.01 -0.06 0.00 0.00 0.00 0.00 60.65 59.62 2bm8 s ILE 156 Cb -0.05 -1.88 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 2bm8 s ILE 156 CO -0.00 0.44 0.01 0.12 0.00 0.00 0.00 174.94 175.52 2bm8 s PHE 157 N 1.28 3.03 -0.17 3.97 5.36 -0.34 -0.63 117.98 130.47 2bm8 s PHE 157 Ca 0.03 -0.64 0.01 0.00 -0.96 0.00 0.00 56.93 55.36 2bm8 s PHE 157 Cb -0.14 -2.16 0.01 0.00 -0.34 0.00 0.00 43.02 40.39 2bm8 s PHE 157 CO -0.12 -0.42 -0.18 0.42 -1.46 0.00 0.00 175.22 173.46 2bm8 s ILE 158 N 1.48 2.29 -0.43 3.12 1.01 -0.41 -0.71 121.20 127.55 2bm8 s ILE 158 Ca 0.06 -0.88 -0.24 0.00 0.00 0.00 0.00 60.65 59.59 2bm8 s ILE 158 Cb -0.15 -1.96 0.02 0.00 0.01 0.00 0.00 42.46 40.38 2bm8 s ILE 158 CO 0.01 0.53 0.85 -0.62 0.00 0.00 0.00 174.94 175.70 2bm8 s ASP 159 N 1.11 6.49 -0.02 3.58 3.68 0.17 -1.05 116.67 130.62 2bm8 s ASP 159 Ca 0.00 0.10 0.11 0.00 2.13 0.00 0.00 52.55 54.89 2bm8 s ASP 159 Cb -0.14 -2.42 0.31 0.00 -1.45 0.00 0.00 42.92 39.23 2bm8 s ASP 159 CO -0.07 -0.93 1.26 0.59 0.13 0.00 0.00 175.17 176.15 2bm8 n ASN 160 N 6.84 2.98 -0.13 -0.34 3.02 -0.54 -2.21 115.26 124.89 2bm8 n ASN 160 Ca 0.04 -2.12 -0.28 0.00 -0.03 0.00 0.00 54.58 52.19 2bm8 n ASN 160 Cb 0.48 -0.26 -0.10 0.00 -0.61 0.00 0.00 39.78 39.29 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 0.34 1.15 -2.23 5.41 0.00 -1.12 -4.83 120.51 119.22 2bm8 n ALA 161 Ca 0.12 -1.02 -0.11 0.00 0.00 0.00 0.00 53.44 52.43 2bm8 n ALA 161 Cb 0.47 0.03 -0.00 0.00 0.00 0.00 0.00 19.45 19.95 2bm8 n ALA 161 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2bm8 n HIS 162 N -4.24 -0.55 -4.76 0.00 8.25 -1.26 -5.02 115.22 107.64 2bm8 n HIS 162 Ca -0.52 0.02 -0.33 0.00 -0.26 0.00 0.00 57.72 56.63 2bm8 n HIS 162 Cb 0.87 -2.58 -0.15 0.00 1.12 0.00 0.00 29.99 29.25 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 -2.56 2.45 -1.51 -1.41 0.00 -1.26 -4.74 121.76 112.73 2bm8 s ALA 163 Ca 0.01 -0.98 -0.12 0.00 0.00 0.00 0.00 51.96 50.87 2bm8 s ALA 163 Cb -0.00 -1.12 0.07 0.00 0.00 0.00 0.00 23.12 22.07 2bm8 s ALA 163 CO 0.01 0.12 0.94 -1.71 0.00 0.00 0.00 175.76 175.13 2bm8 n ASN 164 N 3.78 -4.29 -0.04 0.00 5.15 -1.26 -4.75 115.26 113.85 2bm8 n ASN 164 Ca -0.19 -0.79 -0.12 0.00 -0.60 0.00 0.00 54.58 52.89 2bm8 n ASN 164 Cb 0.52 -3.88 0.02 0.00 -0.53 0.00 0.00 39.78 35.90 2bm8 n ASN 164 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 2bm8 h THR 165 N -2.06 1.30 -0.09 -0.44 2.02 -1.93 -2.62 112.91 109.09 2bm8 h THR 165 Ca -0.59 -1.75 -0.12 0.00 0.77 0.00 0.00 66.41 64.73 2bm8 h THR 165 Cb 1.37 1.68 -0.01 0.00 -1.74 0.00 0.00 68.15 69.46 2bm8 h THR 165 CO 0.66 0.56 -0.48 -0.26 0.37 0.00 0.00 175.52 176.37 2bm8 h PHE 166 N 0.54 0.27 0.00 3.16 -1.00 -1.98 0.04 116.94 117.97 2bm8 h PHE 166 Ca 0.01 -0.08 -0.15 0.00 2.81 0.00 0.00 57.97 60.55 2bm8 h PHE 166 Cb 1.10 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.59 2bm8 h PHE 166 CO 0.06 0.67 -0.74 -0.91 -1.61 0.00 0.00 178.31 175.78 2bm8 h ASN 167 N 0.18 0.00 -0.17 2.17 2.35 -1.94 -1.08 115.58 117.08 2bm8 h ASN 167 Ca 0.01 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.58 2bm8 h ASN 167 Cb 0.92 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.29 2bm8 h ASN 167 CO 0.07 0.74 -0.54 0.40 -1.65 0.00 0.00 177.43 176.45 2bm8 h ILE 168 N 0.00 1.29 -0.81 2.81 2.04 -1.25 -1.81 117.51 119.78 2bm8 h ILE 168 Ca -0.01 -1.74 0.01 0.00 1.00 0.00 0.00 64.86 64.12 2bm8 h ILE 168 Cb 1.31 1.66 -0.04 0.00 -0.74 0.00 0.00 36.82 39.01 2bm8 h ILE 168 CO 0.10 0.56 0.53 -0.03 0.00 0.00 0.00 178.15 179.31 2bm8 h MET 169 N 0.59 1.07 0.37 2.37 4.05 -0.92 -0.27 114.93 122.20 2bm8 h MET 169 Ca 0.01 -0.07 -0.02 0.00 -0.28 0.00 0.00 59.70 59.35 2bm8 h MET 169 Cb 1.12 -0.24 0.00 0.00 -0.80 0.00 0.00 31.60 31.69 2bm8 h MET 169 CO 0.11 0.71 -0.18 -0.22 0.23 0.00 0.00 176.91 177.57 2bm8 h LYS 170 N 1.10 -0.48 -0.99 0.39 3.64 -0.99 -1.00 116.57 118.23 2bm8 h LYS 170 Ca 0.30 0.03 0.13 0.00 -1.27 0.00 0.00 60.65 59.84 2bm8 h LYS 170 Cb -0.12 0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 31.72 2bm8 h LYS 170 CO -0.06 -0.23 0.62 2.35 -2.27 0.00 0.00 179.45 179.86 2bm8 h TRP 171 N -0.67 1.09 -0.33 1.91 7.01 -1.30 -2.38 115.95 121.27 2bm8 h TRP 171 Ca -0.05 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 60.89 2bm8 h TRP 171 Cb 0.48 -0.34 -0.01 0.00 -2.10 0.00 0.00 29.16 27.19 2bm8 h TRP 171 CO -0.01 0.40 -0.13 0.00 -2.79 0.00 0.00 178.44 175.92 2bm8 h ALA 172 N 1.56 0.47 -0.20 2.65 0.00 -0.57 0.24 119.26 123.41 2bm8 h ALA 172 Ca 0.50 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 2bm8 h ALA 172 Cb 0.58 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2bm8 h ALA 172 CO -0.27 0.35 -0.25 0.28 0.00 0.00 0.00 179.25 179.36 2bm8 h VAL 173 N 0.45 1.26 0.02 0.00 2.07 -1.04 -0.79 116.25 118.23 2bm8 h VAL 173 Ca 0.08 -1.20 -0.25 0.00 0.82 0.00 0.00 66.70 66.15 2bm8 h VAL 173 Cb 0.64 1.37 0.02 0.00 -1.52 0.00 0.00 31.29 31.81 2bm8 h VAL 173 CO 0.04 0.38 -0.98 0.44 0.02 0.00 0.00 177.57 177.47 2bm8 h ASP 174 N 0.34 0.82 -0.00 0.57 3.32 -1.16 -3.42 116.42 116.89 2bm8 h ASP 174 Ca 0.05 -0.76 0.00 0.00 0.02 0.00 0.00 57.03 56.34 2bm8 h ASP 174 Cb 0.62 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.92 2bm8 h ASP 174 CO 0.04 1.48 -0.05 1.41 -1.72 0.00 0.00 179.24 180.41 2bm8 n HIS 175 N -3.93 0.00 0.07 4.55 8.25 0.05 -4.93 115.22 119.28 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 0.85 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.96 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 -0.85 0.25 -4.76 2.41 7.94 -0.53 -5.03 117.00 116.43 2bm8 n LEU 176 Ca 0.00 0.21 -0.39 0.00 -1.11 0.00 0.00 56.01 54.72 2bm8 n LEU 176 Cb 0.02 0.05 -0.05 0.00 0.53 0.00 0.00 43.42 43.97 2bm8 n LEU 176 CO 0.02 -0.59 0.71 -0.76 -1.11 0.00 0.00 177.39 175.66 2bm8 s LEU 177 N -6.42 4.51 0.46 -1.96 1.43 -0.42 -5.04 118.68 111.24 2bm8 s LEU 177 Ca 0.00 2.05 0.06 0.00 -1.03 0.00 0.00 54.13 55.20 2bm8 s LEU 177 Cb 0.00 -3.75 -0.03 0.00 0.03 0.00 0.00 46.19 42.45 2bm8 s LEU 177 CO 0.00 -0.05 0.18 -1.61 0.23 0.00 0.00 176.35 175.10 2bm8 s GLU 178 N -1.56 2.21 0.03 1.70 2.02 -1.26 -4.94 118.70 116.90 2bm8 s GLU 178 Ca 0.46 -2.02 -0.35 0.00 0.02 0.00 0.00 54.97 53.08 2bm8 s GLU 178 Cb -0.26 -1.89 -0.14 0.00 0.10 0.00 0.00 34.13 31.94 2bm8 s GLU 178 CO 0.33 -0.27 1.66 -1.91 0.02 0.00 0.00 175.26 175.09 2bm8 n GLU 179 N -1.34 1.93 -0.08 1.61 2.13 -1.26 -1.81 120.64 121.82 2bm8 n GLU 179 Ca -0.05 0.70 0.00 0.00 0.66 0.00 0.00 57.16 58.47 2bm8 n GLU 179 Cb 0.65 -2.47 0.00 0.00 0.27 0.00 0.00 31.44 29.89 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 3.67 1.18 3.79 8.31 0.00 -0.50 -5.02 105.19 116.63 2bm8 n GLY 180 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2bm8 n GLY 180 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bm8 s ASP 181 N -2.89 6.89 -0.02 1.61 1.01 -0.75 -4.82 116.67 117.71 2bm8 s ASP 181 Ca 0.00 1.93 -0.01 0.00 0.71 0.00 0.00 52.55 55.18 2bm8 s ASP 181 Cb 0.00 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 2bm8 s ASP 181 CO 0.00 -0.40 0.08 -0.31 0.21 0.00 0.00 175.17 174.75 2bm8 s TYR 182 N -1.76 3.30 -0.21 4.23 1.51 -0.79 -1.06 117.35 122.57 2bm8 s TYR 182 Ca 0.57 0.23 0.01 0.00 -1.01 0.00 0.00 57.07 56.87 2bm8 s TYR 182 Cb -0.19 -1.76 0.05 0.00 -0.11 0.00 0.00 41.96 39.96 2bm8 s TYR 182 CO 0.24 0.56 -0.08 0.12 -1.11 0.00 0.00 175.55 175.28 2bm8 s PHE 183 N -1.16 2.32 -0.25 2.71 5.36 -0.43 -1.20 117.98 125.33 2bm8 s PHE 183 Ca 0.21 -1.60 0.01 0.00 -0.96 0.00 0.00 56.93 54.60 2bm8 s PHE 183 Cb -0.12 -1.57 0.05 0.00 -0.34 0.00 0.00 43.02 41.04 2bm8 s PHE 183 CO 0.12 -0.74 -0.10 0.42 -1.46 0.00 0.00 175.22 173.46 2bm8 s ILE 184 N 1.42 2.38 -0.35 3.12 1.01 0.11 -1.75 121.20 127.14 2bm8 s ILE 184 Ca -0.03 -1.43 -0.23 0.00 0.00 0.00 0.00 60.65 58.96 2bm8 s ILE 184 Cb -0.17 -2.32 0.01 0.00 0.01 0.00 0.00 42.46 39.99 2bm8 s ILE 184 CO -0.07 0.06 0.79 -0.63 0.00 0.00 0.00 174.94 175.09 2bm8 s ILE 185 N 1.18 4.74 0.09 2.92 1.01 -0.78 0.42 121.20 130.78 2bm8 s ILE 185 Ca -0.05 0.96 -0.20 0.00 0.00 0.00 0.00 60.65 61.36 2bm8 s ILE 185 Cb -0.19 -4.20 -0.07 0.00 0.01 0.00 0.00 42.46 38.02 2bm8 s ILE 185 CO -0.05 -0.40 0.60 -1.61 0.00 0.00 0.00 174.94 173.48 2bm8 s GLU 186 N 3.08 4.24 0.00 2.79 2.02 -0.94 -4.43 118.70 125.47 2bm8 s GLU 186 Ca 0.32 0.79 0.00 0.00 0.02 0.00 0.00 54.97 56.10 2bm8 s GLU 186 Cb -0.13 -3.22 0.00 0.00 0.10 0.00 0.00 34.13 30.88 2bm8 s GLU 186 CO 0.16 0.62 0.00 -0.25 0.02 0.00 0.00 175.26 175.81 2bm8 n ASP 187 N 1.63 0.00 0.14 -0.19 8.00 0.10 -4.63 116.55 121.61 2bm8 n ASP 187 Ca -0.09 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.52 2bm8 n ASP 187 Cb 0.50 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.68 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 -0.05 -1.24 4.05 -1.87 -3.36 114.93 112.46 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 0.00 -0.10 0.82 0.23 0.00 0.00 176.91 177.86 2bm8 h ILE 189 N 0.00 0.73 -0.49 1.77 2.04 -1.85 -1.72 117.51 118.00 2bm8 h ILE 189 Ca 0.00 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.00 2bm8 h ILE 189 Cb 0.99 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 2bm8 h ILE 189 CO 0.00 0.00 0.38 1.55 0.00 0.00 0.00 178.15 180.08 2bm8 h PRO 190 N -0.15 0.00 -0.01 2.37 0.13 -1.83 -1.52 132.00 130.99 2bm8 h PRO 190 Ca 0.06 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.09 2bm8 h PRO 190 Cb 0.23 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.36 2bm8 h PRO 190 CO -0.14 0.00 -0.38 1.88 -0.23 0.00 0.00 178.00 179.13 2bm8 h TYR 191 N 0.00 0.40 -0.42 1.56 -1.99 -1.55 -2.47 116.97 112.49 2bm8 h TYR 191 Ca 0.23 -0.21 -0.03 0.00 2.00 0.00 0.00 58.73 60.73 2bm8 h TYR 191 Cb 0.99 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 39.65 2bm8 h TYR 191 CO 0.00 1.01 0.16 -1.49 -0.00 0.00 0.00 178.16 177.84 2bm8 h TRP 192 N -0.33 0.60 -0.31 4.88 6.55 -1.11 -1.55 115.95 124.69 2bm8 h TRP 192 Ca -0.05 -0.03 -0.15 0.00 0.95 0.00 0.00 58.89 59.62 2bm8 h TRP 192 Cb 1.11 -0.19 -0.00 0.00 -0.86 0.00 0.00 29.16 29.22 2bm8 h TRP 192 CO 0.16 0.49 -0.38 -0.92 -1.05 0.00 0.00 178.44 176.73 2bm8 h TYR 193 N 0.60 0.98 -0.76 0.49 3.20 -1.37 -1.39 116.97 118.72 2bm8 h TYR 193 Ca 0.15 -0.31 0.03 0.00 3.14 0.00 0.00 58.73 61.73 2bm8 h TYR 193 Cb 0.14 -0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.17 2bm8 h TYR 193 CO 0.01 1.11 0.48 -0.09 -1.64 0.00 0.00 178.16 178.02 2bm8 h ARG 194 N 0.57 0.91 0.00 1.82 9.65 -0.91 -2.98 114.38 123.44 2bm8 h ARG 194 Ca 0.04 -0.05 -0.26 0.00 -1.10 0.00 0.00 59.98 58.60 2bm8 h ARG 194 Cb 0.98 -0.21 -0.05 0.00 -1.39 0.00 0.00 29.97 29.30 2bm8 h ARG 194 CO 0.09 0.60 -1.92 0.66 2.80 0.00 0.00 179.97 182.20 2bm8 n TYR 195 N -4.62 0.51 -3.08 2.20 0.53 -0.64 -4.65 117.16 107.42 2bm8 n TYR 195 Ca 0.09 0.18 -0.19 0.00 -1.02 0.00 0.00 57.90 56.96 2bm8 n TYR 195 Cb 0.09 -1.02 -0.03 0.00 -1.03 0.00 0.00 39.34 37.35 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 -2.56 1.40 0.08 -0.72 0.00 -0.53 -5.00 120.51 113.19 2bm8 n ALA 196 Ca -0.20 -2.90 -0.02 0.00 0.00 0.00 0.00 53.44 50.33 2bm8 n ALA 196 Cb 0.99 -0.96 0.24 0.00 0.00 0.00 0.00 19.45 19.72 2bm8 n ALA 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2bm8 h PRO 197 N 3.67 0.28 0.50 0.00 0.11 -1.67 -1.82 132.00 133.07 2bm8 h PRO 197 Ca 0.03 -0.12 -0.02 0.00 0.11 0.00 0.00 66.00 65.99 2bm8 h PRO 197 Cb 0.95 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.05 2bm8 h PRO 197 CO 0.42 0.60 -0.24 0.37 -0.21 0.00 0.00 178.00 178.94 2bm8 h GLN 198 N 0.24 -0.65 -0.01 1.05 5.75 -1.93 -2.43 115.11 117.13 2bm8 h GLN 198 Ca 0.03 0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 58.46 2bm8 h GLN 198 Cb 0.73 0.15 -0.02 0.00 1.07 0.00 0.00 27.48 29.41 2bm8 h GLN 198 CO 0.06 -0.40 -0.53 -0.07 -2.65 0.00 0.00 178.83 175.24 2bm8 h LEU 199 N -0.74 0.02 0.14 -2.39 3.38 -1.93 -2.64 115.31 111.14 2bm8 h LEU 199 Ca -0.07 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2bm8 h LEU 199 Cb 0.55 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2bm8 h LEU 199 CO 0.11 0.54 -0.07 0.15 0.09 0.00 0.00 178.44 179.27 2bm8 h PHE 200 N 0.01 -0.18 -0.84 1.13 3.57 -1.33 -1.28 116.94 118.03 2bm8 h PHE 200 Ca -0.00 -0.00 0.18 0.00 3.53 0.00 0.00 57.97 61.67 2bm8 h PHE 200 Cb 0.94 0.06 -0.11 0.00 2.79 0.00 0.00 35.95 39.63 2bm8 h PHE 200 CO 0.00 0.28 0.35 0.77 -2.23 0.00 0.00 178.31 177.49 2bm8 h SER 201 N -0.84 0.31 -0.24 0.41 0.02 -1.46 0.07 113.55 111.82 2bm8 h SER 201 Ca -0.02 0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 2bm8 h SER 201 Cb 0.54 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 2bm8 h SER 201 CO 0.03 0.06 0.08 -0.33 -1.14 0.00 0.00 176.83 175.53 2bm8 h GLU 202 N 0.43 0.36 -0.23 3.45 5.08 -1.42 -0.43 114.58 121.83 2bm8 h GLU 202 Ca 0.49 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.72 2bm8 h GLU 202 Cb 0.84 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2bm8 h GLU 202 CO -0.47 0.43 -0.06 1.88 -1.00 0.00 0.00 179.01 179.79 2bm8 h TYR 203 N 0.22 0.50 -0.96 4.33 0.99 -0.62 -2.17 116.97 119.27 2bm8 h TYR 203 Ca 0.08 -0.11 0.00 0.00 2.00 0.00 0.00 58.73 60.70 2bm8 h TYR 203 Cb 0.22 -0.12 -0.05 0.00 1.00 0.00 0.00 36.73 37.78 2bm8 h TYR 203 CO -0.00 0.69 0.60 -0.07 -0.00 0.00 0.00 178.16 179.38 2bm8 h LEU 204 N 0.17 1.13 -1.41 3.88 3.38 -1.00 -2.50 115.31 118.96 2bm8 h LEU 204 Ca 0.06 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bm8 h LEU 204 Cb 0.53 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 2bm8 h LEU 204 CO 0.02 0.85 -0.01 1.23 0.09 0.00 0.00 178.44 180.62 2bm8 h GLY 205 N 1.31 0.00 2.00 0.83 0.00 -0.88 -2.31 103.07 104.03 2bm8 h GLY 205 Ca 0.35 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.65 2bm8 h GLY 205 CO -0.07 0.00 -0.15 0.00 0.00 0.00 0.00 176.54 176.32 2bm8 h ALA 206 N 1.99 1.27 -0.48 3.60 0.00 -0.92 -2.73 119.26 121.99 2bm8 h ALA 206 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2bm8 h ALA 206 Cb 0.53 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2bm8 h ALA 206 CO 0.00 0.18 0.00 1.19 0.00 0.00 0.00 179.25 180.63 2bm8 n PHE 207 N -3.65 1.53 0.16 0.00 3.01 -0.87 -4.64 117.46 113.01 2bm8 n PHE 207 Ca -0.02 -0.55 0.05 0.00 1.01 0.00 0.00 57.45 57.94 2bm8 n PHE 207 Cb 0.27 -0.36 0.48 0.00 -0.01 0.00 0.00 39.48 39.86 2bm8 n PHE 207 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 2bm8 h ARG 208 N 3.24 0.16 -0.01 -1.08 0.11 -1.59 -1.12 114.38 114.09 2bm8 h ARG 208 Ca 0.00 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.05 2bm8 h ARG 208 Cb 1.55 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.60 2bm8 h ARG 208 CO 0.33 0.24 -0.08 -0.25 0.10 0.00 0.00 179.97 180.31 2bm8 n ASP 209 N -4.37 1.35 0.00 0.08 8.00 -1.26 -4.48 116.55 115.87 2bm8 n ASP 209 Ca -0.01 -1.30 0.00 0.00 0.71 0.00 0.00 54.79 54.19 2bm8 n ASP 209 Cb 0.20 0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.34 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 -0.09 0.00 -4.56 2.53 0.24 -0.92 -4.88 118.33 110.65 2bm8 n VAL 210 Ca 0.17 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.22 2bm8 n VAL 210 Cb 0.35 -0.46 -0.14 0.00 -1.47 0.00 0.00 33.84 32.13 2bm8 n VAL 210 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2bm8 s LEU 211 N -3.52 2.20 0.34 1.34 1.43 -0.47 -2.49 118.68 117.51 2bm8 s LEU 211 Ca 0.00 -0.56 0.10 0.00 -1.03 0.00 0.00 54.13 52.64 2bm8 s LEU 211 Cb 0.00 -0.94 -0.06 0.00 0.03 0.00 0.00 46.19 45.21 2bm8 s LEU 211 CO 0.00 0.13 -0.10 -0.94 0.23 0.00 0.00 176.35 175.68 2bm8 s SER 212 N -1.33 3.73 -0.18 2.29 1.04 -0.69 -4.52 113.70 114.04 2bm8 s SER 212 Ca 0.07 -1.19 -0.18 0.00 0.48 0.00 0.00 55.95 55.13 2bm8 s SER 212 Cb -0.09 -0.35 -0.04 0.00 0.10 0.00 0.00 66.02 65.64 2bm8 s SER 212 CO 0.02 -0.20 0.49 -0.32 0.98 0.00 0.00 173.24 174.22 2bm8 s MET 213 N -3.61 4.23 -0.58 4.02 1.75 -1.26 -1.19 119.30 122.66 2bm8 s MET 213 Ca 0.32 0.40 -0.26 0.00 -1.25 0.00 0.00 55.69 54.90 2bm8 s MET 213 Cb 0.02 -3.52 0.04 0.00 2.84 0.00 0.00 34.83 34.21 2bm8 s MET 213 CO 0.16 -0.05 1.06 0.34 -0.65 0.00 0.00 175.02 175.89 2bm8 s ASP 214 N 0.98 6.35 0.00 1.11 -1.08 0.13 -4.90 116.67 119.26 2bm8 s ASP 214 Ca 0.24 -0.23 0.27 0.00 -0.52 0.00 0.00 52.55 52.31 2bm8 s ASP 214 Cb -0.15 -2.49 1.24 0.00 -1.46 0.00 0.00 42.92 40.06 2bm8 s ASP 214 CO 0.10 -1.39 1.89 0.23 0.52 0.00 0.00 175.17 176.52 2bm8 n MET 215 N 8.00 0.17 0.10 4.34 2.81 -1.26 -1.34 117.12 129.94 2bm8 n MET 215 Ca 0.04 0.04 -0.03 0.00 -1.81 0.00 0.00 57.70 55.94 2bm8 n MET 215 Cb 0.48 -1.50 0.18 0.00 -0.71 0.00 0.00 33.22 31.67 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 0.20 0.00 4.03 5.85 -1.98 -3.38 115.31 120.02 2bm8 h LEU 216 Ca 0.00 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.62 2bm8 h LEU 216 Cb 0.37 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.35 2bm8 h LEU 216 CO 0.00 0.68 -1.11 -1.22 -0.34 0.00 0.00 178.44 176.46 2bm8 n TYR 217 N -3.93 0.00 0.28 1.25 0.53 -1.10 -4.77 117.16 109.42 2bm8 n TYR 217 Ca -0.02 0.00 0.17 0.00 -1.02 0.00 0.00 57.90 57.03 2bm8 n TYR 217 Cb 0.55 -0.09 0.66 0.00 -1.03 0.00 0.00 39.34 39.43 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 0.42 1.00 -0.20 -0.72 0.00 -1.39 -2.65 119.26 115.71 2bm8 h ALA 218 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bm8 h ALA 218 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2bm8 h ALA 218 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 2bm8 n ASN 219 N -3.06 3.18 -0.71 0.00 3.02 -1.26 -1.23 115.26 115.20 2bm8 n ASN 219 Ca 0.01 -2.73 0.12 0.00 -0.03 0.00 0.00 54.58 51.95 2bm8 n ASN 219 Cb 0.31 -0.40 0.16 0.00 -0.61 0.00 0.00 39.78 39.24 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 -0.51 2.81 -3.23 5.41 0.00 -1.00 -4.92 120.51 119.07 2bm8 n ALA 220 Ca 0.16 -0.62 -0.13 0.00 0.00 0.00 0.00 53.44 52.86 2bm8 n ALA 220 Cb 0.68 -0.89 -0.05 0.00 0.00 0.00 0.00 19.45 19.20 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 -2.16 -0.40 0.27 0.00 1.04 -1.26 -4.80 113.70 106.39 2bm8 s SER 221 Ca 0.27 0.00 0.14 0.00 0.48 0.00 0.00 55.95 56.84 2bm8 s SER 221 Cb 0.20 0.50 0.15 0.00 0.10 0.00 0.00 66.02 66.97 2bm8 s SER 221 CO 0.39 -0.79 1.48 0.77 0.98 0.00 0.00 173.24 176.07 2bm8 h SER 222 N 2.56 0.00 0.57 7.02 4.64 -1.95 -1.83 113.55 124.57 2bm8 h SER 222 Ca -0.32 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.81 2bm8 h SER 222 Cb 1.24 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 2bm8 h SER 222 CO 0.42 0.57 -0.85 1.56 -0.87 0.00 0.00 176.83 177.67 2bm8 h GLN 223 N 0.00 0.19 -0.10 4.77 4.20 -1.97 -3.17 115.11 119.04 2bm8 h GLN 223 Ca -0.01 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.50 2bm8 h GLN 223 Cb 1.35 0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.18 2bm8 h GLN 223 CO 0.07 0.93 0.00 1.28 -0.67 0.00 0.00 178.83 180.44 2bm8 n LEU 224 N -3.68 2.55 -3.49 1.46 4.77 -1.20 -0.72 117.00 116.70 2bm8 n LEU 224 Ca -0.03 -0.92 -0.48 0.00 -0.03 0.00 0.00 56.01 54.55 2bm8 n LEU 224 Cb 0.79 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.72 2bm8 n LEU 224 CO 0.47 0.46 1.45 -0.67 -1.33 0.00 0.00 177.39 177.77 2bm8 n ASP 225 N 0.96 0.58 -2.27 -1.43 2.03 -0.69 -1.82 116.55 113.91 2bm8 n ASP 225 Ca 0.16 0.52 -0.18 0.00 0.52 0.00 0.00 54.79 55.82 2bm8 n ASP 225 Cb 0.51 -0.74 -0.02 0.00 -0.72 0.00 0.00 41.12 40.15 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 6.20 -1.80 -0.10 -0.67 1.74 -0.37 -4.64 116.66 117.02 2bm8 n ARG 226 Ca 0.46 0.89 0.02 0.00 -0.77 0.00 0.00 57.85 58.45 2bm8 n ARG 226 Cb -0.03 -5.49 0.03 0.00 -1.02 0.00 0.00 32.46 25.96 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 -0.84 1.59 3.38 -0.13 0.00 -0.75 -4.95 105.19 103.48 2bm8 n GLY 227 Ca -0.21 -0.27 -0.45 0.00 0.00 0.00 0.00 46.02 45.09 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 -1.04 4.95 0.27 1.61 1.01 -1.25 -1.86 120.40 124.08 2bm8 s VAL 228 Ca 0.08 -1.40 0.07 0.00 0.00 0.00 0.00 61.98 60.73 2bm8 s VAL 228 Cb 0.07 -4.55 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 2bm8 s VAL 228 CO 0.01 -1.20 0.19 -0.76 0.00 0.00 0.00 175.10 173.34 2bm8 s LEU 229 N 2.22 3.72 -0.08 3.92 1.43 -0.72 -0.70 118.68 128.47 2bm8 s LEU 229 Ca 0.17 -0.33 -0.26 0.00 -1.03 0.00 0.00 54.13 52.68 2bm8 s LEU 229 Cb -0.17 -2.26 0.06 0.00 0.03 0.00 0.00 46.19 43.85 2bm8 s LEU 229 CO -0.00 -0.09 0.59 0.00 0.23 0.00 0.00 176.35 177.08 2bm8 s ARG 230 N -3.85 0.91 -0.48 1.70 1.70 -0.34 -1.31 118.95 117.29 2bm8 s ARG 230 Ca 0.34 0.28 -0.26 0.00 -0.47 0.00 0.00 55.73 55.62 2bm8 s ARG 230 Cb -0.07 0.43 -0.06 0.00 -0.57 0.00 0.00 34.95 34.67 2bm8 s ARG 230 CO 0.25 -0.25 2.31 0.50 -1.08 0.00 0.00 175.30 177.03 2bm8 s ARG 231 N -0.93 2.27 -0.91 3.89 6.06 -0.22 -1.70 118.95 127.41 2bm8 s ARG 231 Ca -0.09 1.36 -0.15 0.00 -2.50 0.00 0.00 55.73 54.35 2bm8 s ARG 231 Cb -0.02 -4.54 0.20 0.00 0.06 0.00 0.00 34.95 30.65 2bm8 s ARG 231 CO 0.07 -3.09 0.96 0.08 -2.50 0.00 0.00 175.30 170.82 2bm8 s VAL 232 N 11.39 5.36 -2.96 7.11 1.01 -1.04 -1.41 120.40 139.86 2bm8 s VAL 232 Ca 0.94 -2.32 0.24 0.00 0.00 0.00 0.00 61.98 60.84 2bm8 s VAL 232 Cb -0.18 -4.61 0.22 0.00 0.00 0.00 0.00 36.38 31.81 2bm8 s VAL 232 CO 0.26 -1.23 1.30 0.00 0.00 0.00 0.00 175.10 175.44