#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bd8 h ALA 8 N 0.00 0.40 -0.74 5.13 0.00 -1.99 -0.87 119.26 121.19 1bd8 h ALA 8 Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.93 1bd8 h ALA 8 Cb 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1bd8 h ALA 8 CO 0.00 -0.12 0.49 0.78 0.00 0.00 0.00 179.25 180.40 1bd8 h GLY 9 N 0.43 1.02 1.01 0.00 0.00 -1.81 -0.50 103.07 103.22 1bd8 h GLY 9 Ca 0.12 -0.34 -0.11 0.00 0.00 0.00 0.00 47.33 46.99 1bd8 h GLY 9 CO -0.02 0.28 -0.21 -0.55 0.00 0.00 0.00 176.54 176.04 1bd8 h ASP 10 N 0.86 0.82 -0.47 0.19 3.32 -1.62 -1.06 116.42 118.46 1bd8 h ASP 10 Ca 0.31 -0.42 -0.05 0.00 0.02 0.00 0.00 57.03 56.89 1bd8 h ASP 10 Cb 0.13 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1bd8 h ASP 10 CO -0.09 1.06 0.10 0.03 -1.72 0.00 0.00 179.24 178.62 1bd8 h ARG 11 N 0.59 0.77 -0.23 3.56 3.08 -0.60 -0.96 114.38 120.58 1bd8 h ARG 11 Ca 0.08 -0.19 -0.07 0.00 0.07 0.00 0.00 59.98 59.87 1bd8 h ARG 11 Cb 0.76 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 1bd8 h ARG 11 CO 0.06 0.76 -0.11 1.25 -1.07 0.00 0.00 179.97 180.86 1bd8 h LEU 12 N 0.64 0.50 -0.54 3.04 5.85 -1.10 -1.20 115.31 122.50 1bd8 h LEU 12 Ca 0.15 -0.41 0.05 0.00 0.84 0.00 0.00 57.88 58.51 1bd8 h LEU 12 Cb 0.35 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 1bd8 h LEU 12 CO 0.00 0.80 0.26 0.28 -0.34 0.00 0.00 178.44 179.45 1bd8 h SER 13 N 0.19 0.37 -0.43 1.25 0.02 -1.16 -0.81 113.55 112.98 1bd8 h SER 13 Ca 0.05 0.04 0.02 0.00 -0.84 0.00 0.00 61.79 61.06 1bd8 h SER 13 Cb 0.61 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.09 1bd8 h SER 13 CO 0.03 0.25 0.24 1.23 -1.14 0.00 0.00 176.83 177.44 1bd8 h GLY 14 N 0.51 0.59 1.02 -3.77 0.00 -1.11 0.19 103.07 100.50 1bd8 h GLY 14 Ca 0.24 -0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.35 1bd8 h GLY 14 CO -0.18 0.14 0.20 0.00 0.00 0.00 0.00 176.54 176.70 1bd8 h ALA 15 N 1.20 0.84 -0.60 3.60 0.00 -1.01 -1.74 119.26 121.55 1bd8 h ALA 15 Ca 0.18 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1bd8 h ALA 15 Cb 0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1bd8 h ALA 15 CO -0.10 0.51 -0.01 0.00 0.00 0.00 0.00 179.25 179.66 1bd8 h ALA 16 N 1.07 0.84 0.00 0.00 0.00 -0.86 -1.18 119.26 119.13 1bd8 h ALA 16 Ca 0.21 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1bd8 h ALA 16 Cb 0.30 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1bd8 h ALA 16 CO -0.01 0.67 -0.40 0.00 0.00 0.00 0.00 179.25 179.52 1bd8 h ALA 17 N 1.00 1.25 0.00 0.00 0.00 -0.31 -2.03 119.26 119.17 1bd8 h ALA 17 Ca 0.17 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1bd8 h ALA 17 Cb 0.57 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1bd8 h ALA 17 CO 0.03 0.50 -0.05 0.54 0.00 0.00 0.00 179.25 180.27 1bd8 n ARG 18 N -3.93 0.21 -1.19 0.00 1.74 -0.68 -4.17 116.66 108.64 1bd8 n ARG 18 Ca -0.02 0.16 -0.01 0.00 -0.77 0.00 0.00 57.85 57.22 1bd8 n ARG 18 Cb 0.44 -1.74 -0.00 0.00 -1.02 0.00 0.00 32.46 30.15 1bd8 n ARG 18 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bd8 n GLY 19 N 1.35 0.43 3.53 -0.13 0.00 -0.93 -4.97 105.19 104.47 1bd8 n GLY 19 Ca 0.06 -1.02 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 1bd8 n GLY 19 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bd8 s ASP 20 N -2.99 6.53 0.22 1.61 -1.08 -0.49 -4.85 116.67 115.63 1bd8 s ASP 20 Ca 0.00 -1.59 -0.06 0.00 -0.52 0.00 0.00 52.55 50.37 1bd8 s ASP 20 Cb 0.00 -2.52 0.20 0.00 -1.46 0.00 0.00 42.92 39.13 1bd8 s ASP 20 CO 0.00 -1.40 1.75 0.58 0.52 0.00 0.00 175.17 176.63 1bd8 h VAL 21 N 6.53 1.26 -0.64 1.11 2.07 -1.93 -1.86 116.25 122.78 1bd8 h VAL 21 Ca 0.18 -0.92 -0.08 0.00 0.82 0.00 0.00 66.70 66.70 1bd8 h VAL 21 Cb 1.01 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1bd8 h VAL 21 CO 1.34 0.35 0.07 1.56 0.02 0.00 0.00 177.57 180.92 1bd8 h GLN 22 N 1.02 1.07 -0.55 1.57 4.20 -1.98 -0.54 115.11 119.90 1bd8 h GLN 22 Ca 0.22 -0.30 -0.11 0.00 0.06 0.00 0.00 58.65 58.52 1bd8 h GLN 22 Cb 0.33 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1bd8 h GLN 22 CO -0.00 1.00 -0.08 1.49 -0.67 0.00 0.00 178.83 180.56 1bd8 h GLU 23 N 0.99 1.03 -0.42 1.46 4.57 -1.90 -1.06 114.58 119.25 1bd8 h GLU 23 Ca 0.19 -0.37 -0.00 0.00 -1.18 0.00 0.00 59.36 58.00 1bd8 h GLU 23 Cb 0.47 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.97 1bd8 h GLU 23 CO 0.02 1.06 0.26 0.28 -1.18 0.00 0.00 179.01 179.45 1bd8 h VAL 24 N 0.91 1.13 -0.73 0.32 2.07 -1.19 -0.34 116.25 118.42 1bd8 h VAL 24 Ca 0.15 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1bd8 h VAL 24 Cb 0.65 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1bd8 h VAL 24 CO 0.04 0.13 0.38 0.03 0.02 0.00 0.00 177.57 178.18 1bd8 h ARG 25 N 0.56 1.03 -0.47 1.57 3.08 -0.89 -1.43 114.38 117.84 1bd8 h ARG 25 Ca 0.15 -0.13 0.02 0.00 0.07 0.00 0.00 59.98 60.09 1bd8 h ARG 25 Cb -0.02 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 29.81 1bd8 h ARG 25 CO -0.03 0.78 0.28 -0.09 -1.07 0.00 0.00 179.97 179.84 1bd8 h ARG 26 N 1.01 0.54 -0.40 0.04 2.43 -0.77 0.78 114.38 118.01 1bd8 h ARG 26 Ca 0.25 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.29 1bd8 h ARG 26 Cb 0.07 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1bd8 h ARG 26 CO -0.04 0.36 -0.16 -0.07 -1.51 0.00 0.00 179.97 178.55 1bd8 h LEU 27 N 0.56 0.83 -0.19 3.80 4.07 -0.73 -0.06 115.31 123.59 1bd8 h LEU 27 Ca 0.19 -0.39 -0.22 0.00 0.08 0.00 0.00 57.88 57.54 1bd8 h LEU 27 Cb 0.01 -0.23 0.01 0.00 1.08 0.00 0.00 40.66 41.53 1bd8 h LEU 27 CO -0.08 1.04 -0.75 -0.07 -1.08 0.00 0.00 178.44 177.49 1bd8 h LEU 28 N 0.63 0.92 0.00 1.67 3.38 -1.14 -0.61 115.31 120.16 1bd8 h LEU 28 Ca 0.09 -0.59 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 1bd8 h LEU 28 Cb 0.70 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1bd8 h LEU 28 CO 0.05 1.39 -1.82 1.41 0.09 0.00 0.00 178.44 179.56 1bd8 n HIS 29 N -3.94 0.00 -0.11 1.13 8.25 0.26 -3.51 115.22 117.30 1bd8 n HIS 29 Ca -0.07 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.16 1bd8 n HIS 29 Cb 0.73 -0.47 -0.08 0.00 1.12 0.00 0.00 29.99 31.29 1bd8 n HIS 29 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1bd8 n ARG 30 N -2.20 0.46 0.20 -0.41 0.63 -0.10 -4.64 116.66 110.59 1bd8 n ARG 30 Ca -0.09 0.20 0.09 0.00 -0.92 0.00 0.00 57.85 57.13 1bd8 n ARG 30 Cb 0.58 -1.27 0.18 0.00 0.45 0.00 0.00 32.46 32.40 1bd8 n ARG 30 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1bd8 h GLU 31 N -0.77 0.00 -3.13 -0.14 4.81 -1.36 -3.47 114.58 110.51 1bd8 h GLU 31 Ca -0.54 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 58.48 1bd8 h GLU 31 Cb 1.47 0.00 0.06 0.00 0.63 0.00 0.00 28.75 30.90 1bd8 h GLU 31 CO -0.33 0.19 -0.34 1.28 -0.73 0.00 0.00 179.01 179.08 1bd8 n LEU 32 N -3.17 -2.48 -4.76 1.64 4.77 -0.51 -5.00 117.00 107.49 1bd8 n LEU 32 Ca 0.03 -0.23 -0.41 0.00 -0.03 0.00 0.00 56.01 55.37 1bd8 n LEU 32 Cb 0.58 -1.81 -0.03 0.00 -2.33 0.00 0.00 43.42 39.83 1bd8 n LEU 32 CO 0.36 0.25 0.96 -0.69 -1.33 0.00 0.00 177.39 176.93 1bd8 s VAL 33 N -3.04 2.94 0.26 4.08 1.01 -0.35 -4.99 120.40 120.31 1bd8 s VAL 33 Ca 0.24 0.89 -0.30 0.00 0.00 0.00 0.00 61.98 62.82 1bd8 s VAL 33 Cb -0.11 -3.57 -0.09 0.00 0.00 0.00 0.00 36.38 32.61 1bd8 s VAL 33 CO 0.30 0.19 1.01 -2.28 0.00 0.00 0.00 175.10 174.33 1bd8 s HIS 34 N -0.81 3.80 0.47 5.22 2.46 -1.26 -4.55 115.29 120.62 1bd8 s HIS 34 Ca 0.50 1.82 0.38 0.00 0.47 0.00 0.00 55.06 58.23 1bd8 s HIS 34 Cb -0.38 -3.12 1.96 0.00 -0.13 0.00 0.00 32.58 30.91 1bd8 s HIS 34 CO 0.47 -0.01 2.22 -1.00 -2.47 0.00 0.00 174.74 173.95 1bd8 h PRO 35 N 3.98 0.00 -0.40 2.88 0.13 -1.88 -1.60 132.00 135.11 1bd8 h PRO 35 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1bd8 h PRO 35 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1bd8 h PRO 35 CO 0.67 0.02 0.00 -0.25 -0.23 0.00 0.00 178.00 178.21 1bd8 n ASP 36 N -3.22 1.95 -4.67 1.44 8.00 -1.26 -4.32 116.55 114.46 1bd8 n ASP 36 Ca -0.02 -2.06 -0.47 0.00 0.71 0.00 0.00 54.79 52.95 1bd8 n ASP 36 Cb 0.16 -0.27 -0.04 0.00 -0.02 0.00 0.00 41.12 40.95 1bd8 n ASP 36 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bd8 n ALA 37 N 0.43 1.16 -1.98 2.24 0.00 -0.60 -4.84 120.51 116.91 1bd8 n ALA 37 Ca 0.11 0.40 -0.40 0.00 0.00 0.00 0.00 53.44 53.55 1bd8 n ALA 37 Cb 0.33 -2.39 -0.06 0.00 0.00 0.00 0.00 19.45 17.34 1bd8 n ALA 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1bd8 s LEU 38 N 1.81 4.59 0.99 0.00 1.43 -1.26 -4.51 118.68 121.72 1bd8 s LEU 38 Ca 0.83 1.80 -0.16 0.00 -1.03 0.00 0.00 54.13 55.56 1bd8 s LEU 38 Cb -0.69 -3.49 0.21 0.00 0.03 0.00 0.00 46.19 42.24 1bd8 s LEU 38 CO 0.42 0.11 1.29 0.54 0.23 0.00 0.00 176.35 178.94 1bd8 s ASN 39 N -0.81 2.88 0.62 2.29 2.20 -0.12 -4.20 114.94 117.80 1bd8 s ASN 39 Ca 0.41 0.33 0.39 0.00 -0.94 0.00 0.00 52.86 53.05 1bd8 s ASN 39 Cb -0.24 -0.41 1.98 0.00 -2.00 0.00 0.00 41.25 40.58 1bd8 s ASN 39 CO 0.29 -2.88 2.22 0.08 -2.94 0.00 0.00 177.10 173.87 1bd8 h ARG 40 N -1.74 0.00 -0.64 3.55 0.11 -1.89 -1.79 114.38 111.97 1bd8 h ARG 40 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 1bd8 h ARG 40 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 1bd8 h ARG 40 CO 0.38 0.01 0.00 1.19 0.10 0.00 0.00 179.97 181.65 1bd8 n PHE 41 N -3.15 1.56 -1.43 4.08 3.72 -1.26 -4.93 117.46 116.05 1bd8 n PHE 41 Ca -0.02 -0.58 -0.06 0.00 -0.05 0.00 0.00 57.45 56.74 1bd8 n PHE 41 Cb 0.16 -0.32 -0.02 0.00 -0.94 0.00 0.00 39.48 38.36 1bd8 n PHE 41 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bd8 n GLY 42 N 0.87 0.65 3.71 1.37 0.00 -0.67 -5.04 105.19 106.08 1bd8 n GLY 42 Ca 0.24 -0.74 -0.23 0.00 0.00 0.00 0.00 46.02 45.29 1bd8 n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bd8 s LYS 43 N -3.01 2.54 0.32 1.61 1.02 -1.26 -4.85 119.74 116.12 1bd8 s LYS 43 Ca 0.00 -1.24 0.04 0.00 0.02 0.00 0.00 55.97 54.79 1bd8 s LYS 43 Cb 0.00 -2.34 -0.02 0.00 -0.52 0.00 0.00 37.83 34.95 1bd8 s LYS 43 CO 0.00 0.39 0.48 0.95 -0.92 0.00 0.00 175.35 176.25 1bd8 s THR 44 N -2.16 4.63 0.37 2.17 -4.23 -1.26 -0.94 115.64 114.21 1bd8 s THR 44 Ca 0.31 -0.82 0.04 0.00 -1.18 0.00 0.00 61.69 60.04 1bd8 s THR 44 Cb -0.07 -3.65 0.27 0.00 1.34 0.00 0.00 72.50 70.39 1bd8 s THR 44 CO 0.21 -0.31 2.01 0.00 -0.54 0.00 0.00 174.62 175.99 1bd8 h ALA 45 N 0.88 1.62 -0.07 3.99 0.00 -1.79 -0.56 119.26 123.32 1bd8 h ALA 45 Ca -0.49 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 1bd8 h ALA 45 Cb 1.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1bd8 h ALA 45 CO 0.58 0.34 -0.12 1.25 0.00 0.00 0.00 179.25 181.29 1bd8 h LEU 46 N 0.78 0.10 -0.88 0.00 5.85 -1.94 -1.64 115.31 117.57 1bd8 h LEU 46 Ca 0.23 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.82 1bd8 h LEU 46 Cb -0.01 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1bd8 h LEU 46 CO -0.06 0.23 -0.54 1.56 -0.34 0.00 0.00 178.44 179.30 1bd8 h GLN 47 N 0.10 0.06 -0.17 1.25 4.20 -1.49 -3.35 115.11 115.72 1bd8 h GLN 47 Ca 0.02 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1bd8 h GLN 47 Cb 0.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1bd8 h GLN 47 CO 0.02 0.58 0.00 1.33 -0.67 0.00 0.00 178.83 180.09 1bd8 n VAL 48 N -3.91 0.87 -1.13 -0.54 0.24 -1.01 -4.93 118.33 107.93 1bd8 n VAL 48 Ca -0.02 -0.94 -0.31 0.00 -2.04 0.00 0.00 64.34 61.04 1bd8 n VAL 48 Cb 0.55 0.58 0.11 0.00 -1.47 0.00 0.00 33.84 33.62 1bd8 n VAL 48 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bd8 s MET 49 N -0.94 1.91 -0.46 7.34 0.23 -0.65 -4.15 119.30 122.59 1bd8 s MET 49 Ca 0.12 1.32 -0.28 0.00 -1.03 0.00 0.00 55.69 55.82 1bd8 s MET 49 Cb 0.07 -1.85 -0.02 0.00 -1.53 0.00 0.00 34.83 31.50 1bd8 s MET 49 CO 0.09 -1.92 1.77 1.41 -2.03 0.00 0.00 175.02 174.33 1bd8 s MET 50 N -4.75 3.07 0.07 3.16 1.75 -0.81 -4.85 119.30 116.95 1bd8 s MET 50 Ca 0.64 1.01 0.14 0.00 -1.25 0.00 0.00 55.69 56.23 1bd8 s MET 50 Cb -0.19 -4.25 0.62 0.00 2.84 0.00 0.00 34.83 33.84 1bd8 s MET 50 CO 0.55 -2.18 1.44 1.19 -0.65 0.00 0.00 175.02 175.37 1bd8 n PHE 51 N 11.10 0.21 0.23 4.11 3.01 -1.26 -1.43 117.46 133.44 1bd8 n PHE 51 Ca 0.21 0.09 0.10 0.00 1.01 0.00 0.00 57.45 58.86 1bd8 n PHE 51 Cb 0.49 -0.65 0.55 0.00 -0.01 0.00 0.00 39.48 39.87 1bd8 n PHE 51 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1bd8 h GLY 52 N 1.82 0.00 -7.51 1.37 0.00 -1.96 -3.40 103.07 93.39 1bd8 h GLY 52 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 1bd8 h GLY 52 CO 0.00 0.00 1.57 -0.56 0.00 0.00 0.00 176.54 177.55 1bd8 s SER 53 N -6.30 6.73 0.29 0.19 0.01 -0.51 -4.83 113.70 109.28 1bd8 s SER 53 Ca -0.01 -2.14 -0.03 0.00 1.31 0.00 0.00 55.95 55.08 1bd8 s SER 53 Cb 0.12 -2.51 0.41 0.00 0.21 0.00 0.00 66.02 64.25 1bd8 s SER 53 CO 0.63 -1.19 1.95 0.74 0.41 0.00 0.00 173.24 175.78 1bd8 h THR 54 N 5.86 1.22 -0.94 1.44 2.02 -1.86 -2.00 112.91 118.65 1bd8 h THR 54 Ca 0.29 -0.43 0.04 0.00 0.77 0.00 0.00 66.41 67.07 1bd8 h THR 54 Cb 0.95 0.02 -0.06 0.00 -1.74 0.00 0.00 68.15 67.32 1bd8 h THR 54 CO 1.35 0.22 0.61 0.00 0.37 0.00 0.00 175.52 178.06 1bd8 h ALA 55 N 1.45 1.24 -0.51 6.16 0.00 -1.97 -0.93 119.26 124.71 1bd8 h ALA 55 Ca 0.30 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 1bd8 h ALA 55 Cb -0.10 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.34 1bd8 h ALA 55 CO -0.06 0.48 0.12 0.82 0.00 0.00 0.00 179.25 180.61 1bd8 h ILE 56 N 1.18 1.24 -0.39 0.00 2.04 -1.76 0.06 117.51 119.87 1bd8 h ILE 56 Ca 0.37 -0.85 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 1bd8 h ILE 56 Cb 0.00 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1bd8 h ILE 56 CO -0.12 0.31 0.22 0.00 0.00 0.00 0.00 178.15 178.55 1bd8 h ALA 57 N 1.00 0.50 -0.22 1.87 0.00 -1.16 -2.08 119.26 119.16 1bd8 h ALA 57 Ca 0.16 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1bd8 h ALA 57 Cb 0.33 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1bd8 h ALA 57 CO 0.00 0.03 -0.46 1.25 0.00 0.00 0.00 179.25 180.07 1bd8 h LEU 58 N 0.51 0.60 -0.33 0.00 6.46 -0.97 -1.44 115.31 120.14 1bd8 h LEU 58 Ca 0.14 -0.29 0.00 0.00 -0.12 0.00 0.00 57.88 57.61 1bd8 h LEU 58 Cb 0.06 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 39.80 1bd8 h LEU 58 CO -0.02 0.97 0.22 -0.33 -0.62 0.00 0.00 178.44 178.66 1bd8 h GLU 59 N 0.45 0.44 -0.56 1.25 4.39 -0.81 0.19 114.58 119.93 1bd8 h GLU 59 Ca 0.03 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1bd8 h GLU 59 Cb 0.98 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.50 1bd8 h GLU 59 CO 0.09 0.29 0.32 -0.07 -1.16 0.00 0.00 179.01 178.48 1bd8 h LEU 60 N 0.45 0.68 -0.72 1.33 3.38 -1.24 -2.81 115.31 116.38 1bd8 h LEU 60 Ca 0.12 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 1bd8 h LEU 60 Cb -0.05 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1bd8 h LEU 60 CO -0.03 0.56 -0.16 -0.07 0.09 0.00 0.00 178.44 178.83 1bd8 h LEU 61 N 0.75 0.81 -1.44 1.67 3.38 -0.99 -1.26 115.31 118.23 1bd8 h LEU 61 Ca 0.20 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1bd8 h LEU 61 Cb 0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1bd8 h LEU 61 CO -0.03 0.97 -0.28 0.11 0.09 0.00 0.00 178.44 179.30 1bd8 h LYS 62 N 0.72 0.00 -0.02 1.13 1.57 -0.90 -2.08 116.57 116.99 1bd8 h LYS 62 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1bd8 h LYS 62 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1bd8 h LYS 62 CO 0.05 0.28 0.00 1.04 -0.57 0.00 0.00 179.45 180.25 1bd8 n GLN 63 N -4.12 1.48 0.00 3.15 1.13 -0.97 -4.92 117.38 113.13 1bd8 n GLN 63 Ca -0.02 -0.70 0.00 0.00 -1.94 0.00 0.00 57.00 54.34 1bd8 n GLN 63 Cb 0.34 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.21 1bd8 n GLN 63 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1bd8 n GLY 64 N 1.11 1.41 3.73 1.08 0.00 -0.78 -4.65 105.19 107.09 1bd8 n GLY 64 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 1bd8 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bd8 n ALA 65 N -0.67 1.52 -2.66 4.61 0.00 -0.52 -4.82 120.51 117.98 1bd8 n ALA 65 Ca 0.00 0.14 -0.40 0.00 0.00 0.00 0.00 53.44 53.18 1bd8 n ALA 65 Cb 0.00 -2.34 -0.06 0.00 0.00 0.00 0.00 19.45 17.06 1bd8 n ALA 65 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1bd8 s SER 66 N -0.86 6.72 0.36 0.00 0.15 -1.26 -4.76 113.70 114.05 1bd8 s SER 66 Ca 0.70 0.88 0.19 0.00 0.70 0.00 0.00 55.95 58.41 1bd8 s SER 66 Cb -0.43 -2.36 0.51 0.00 -1.71 0.00 0.00 66.02 62.03 1bd8 s SER 66 CO 0.51 -0.29 1.65 1.55 1.20 0.00 0.00 173.24 177.85 1bd8 h PRO 67 N 7.47 0.00 -0.56 5.44 0.13 -1.92 -3.24 132.00 139.31 1bd8 h PRO 67 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1bd8 h PRO 67 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1bd8 h PRO 67 CO 0.78 0.39 0.00 0.09 -0.23 0.00 0.00 178.00 179.03 1bd8 n ASN 68 N -3.39 3.01 -4.65 1.44 3.02 -1.26 -4.58 115.26 108.85 1bd8 n ASN 68 Ca 0.01 -2.21 -0.42 0.00 -0.03 0.00 0.00 54.58 51.93 1bd8 n ASN 68 Cb 0.57 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 1bd8 n ASN 68 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1bd8 n VAL 69 N 0.69 2.32 -3.86 2.41 3.14 -1.23 -4.99 118.33 116.82 1bd8 n VAL 69 Ca 0.16 -0.50 -0.12 0.00 -2.96 0.00 0.00 64.34 60.92 1bd8 n VAL 69 Cb 0.55 -1.35 -0.13 0.00 -1.06 0.00 0.00 33.84 31.86 1bd8 n VAL 69 CO 0.00 0.00 0.00 -1.58 -6.46 0.00 0.00 176.83 168.79 1bd8 s GLN 70 N -1.98 0.14 0.17 1.45 0.74 -1.26 -4.29 119.66 114.62 1bd8 s GLN 70 Ca 0.60 0.02 -0.01 0.00 0.05 0.00 0.00 55.36 56.03 1bd8 s GLN 70 Cb -0.56 0.06 0.04 0.00 1.10 0.00 0.00 33.01 33.64 1bd8 s GLN 70 CO 0.59 -0.02 0.23 -0.40 -0.55 0.00 0.00 175.29 175.14 1bd8 n ASP 71 N 2.82 0.22 -0.04 6.67 5.75 -0.65 -4.91 116.55 126.41 1bd8 n ASP 71 Ca -0.14 -1.21 0.15 0.00 -0.01 0.00 0.00 54.79 53.59 1bd8 n ASP 71 Cb 0.59 -0.16 0.78 0.00 -1.03 0.00 0.00 41.12 41.30 1bd8 n ASP 71 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1bd8 n THR 72 N -1.87 0.00 1.48 2.12 -2.24 -1.26 -1.80 114.28 110.71 1bd8 n THR 72 Ca 0.04 -0.02 0.14 0.00 -2.27 0.00 0.00 64.05 61.94 1bd8 n THR 72 Cb 0.12 -0.39 0.51 0.00 -2.10 0.00 0.00 70.33 68.47 1bd8 n THR 72 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1bd8 n SER 73 N -1.11 1.54 -0.00 3.42 3.41 -1.26 -4.92 113.62 114.71 1bd8 n SER 73 Ca 0.17 -1.51 -0.00 0.00 -0.26 0.00 0.00 58.87 57.27 1bd8 n SER 73 Cb 0.22 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.17 1bd8 n SER 73 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bd8 n GLY 74 N 1.18 0.44 3.70 5.00 0.00 -0.74 -0.31 105.19 114.46 1bd8 n GLY 74 Ca 0.19 -0.54 -0.39 0.00 0.00 0.00 0.00 46.02 45.28 1bd8 n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bd8 s THR 75 N -2.00 5.12 0.47 2.61 2.01 -1.26 -4.11 115.64 118.48 1bd8 s THR 75 Ca 0.00 1.11 0.04 0.00 0.31 0.00 0.00 61.69 63.15 1bd8 s THR 75 Cb 0.00 -3.89 -0.03 0.00 0.01 0.00 0.00 72.50 68.59 1bd8 s THR 75 CO 0.00 0.25 0.08 -0.44 -0.69 0.00 0.00 174.62 173.82 1bd8 s SER 76 N 0.83 4.17 0.36 3.53 0.01 -1.26 -1.64 113.70 119.71 1bd8 s SER 76 Ca 0.29 -1.44 0.06 0.00 1.31 0.00 0.00 55.95 56.16 1bd8 s SER 76 Cb -0.16 0.12 0.75 0.00 0.21 0.00 0.00 66.02 66.94 1bd8 s SER 76 CO 0.12 -0.73 1.96 -0.65 0.41 0.00 0.00 173.24 174.35 1bd8 h PRO 77 N 1.39 0.73 -0.39 12.44 0.11 -1.81 -0.97 132.00 143.50 1bd8 h PRO 77 Ca -0.43 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 1bd8 h PRO 77 Cb 1.28 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1bd8 h PRO 77 CO 0.73 0.48 0.07 -0.24 -0.21 0.00 0.00 178.00 178.83 1bd8 h VAL 78 N 0.75 1.19 0.00 3.15 3.04 -1.93 -0.21 116.25 122.25 1bd8 h VAL 78 Ca 0.31 -0.71 -0.00 0.00 -1.01 0.00 0.00 66.70 65.29 1bd8 h VAL 78 Cb 0.25 0.82 0.00 0.00 -2.01 0.00 0.00 31.29 30.36 1bd8 h VAL 78 CO -0.10 0.25 -0.00 0.45 -1.01 0.00 0.00 177.57 177.16 1bd8 h HIS 79 N 0.57 -0.01 -0.55 3.17 3.86 -1.58 -1.78 115.15 118.85 1bd8 h HIS 79 Ca 0.13 -0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.26 1bd8 h HIS 79 Cb 0.27 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.72 1bd8 h HIS 79 CO 0.01 0.18 0.04 -0.44 0.86 0.00 0.00 177.93 178.58 1bd8 h ASP 80 N -0.19 0.87 -0.32 2.45 3.32 -1.26 -0.77 116.42 120.52 1bd8 h ASP 80 Ca -0.00 -0.21 -0.10 0.00 0.02 0.00 0.00 57.03 56.74 1bd8 h ASP 80 Cb 0.19 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1bd8 h ASP 80 CO 0.00 0.91 -0.15 0.00 -1.72 0.00 0.00 179.24 178.28 1bd8 h ALA 81 N 1.19 0.95 -0.25 3.45 0.00 -0.95 -2.12 119.26 121.53 1bd8 h ALA 81 Ca 0.17 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 1bd8 h ALA 81 Cb 0.45 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1bd8 h ALA 81 CO 0.02 0.61 -0.28 0.00 0.00 0.00 0.00 179.25 179.59 1bd8 h ALA 82 N 1.14 0.38 -0.39 0.00 0.00 -1.16 -1.65 119.26 117.59 1bd8 h ALA 82 Ca 0.11 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 1bd8 h ALA 82 Cb 0.64 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1bd8 h ALA 82 CO 0.04 0.39 0.03 -0.09 0.00 0.00 0.00 179.25 179.62 1bd8 h ARG 83 N 0.36 0.60 -0.02 0.00 2.43 -1.02 -2.75 114.38 113.98 1bd8 h ARG 83 Ca 0.04 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1bd8 h ARG 83 Cb 0.85 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1bd8 h ARG 83 CO 0.07 0.61 -0.04 0.25 -1.51 0.00 0.00 179.97 179.35 1bd8 n THR 84 N -4.27 0.00 -0.86 0.20 -2.24 -0.81 -4.84 114.28 101.45 1bd8 n THR 84 Ca 0.02 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1bd8 n THR 84 Cb 0.24 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 1bd8 n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bd8 n GLY 85 N 1.28 0.49 3.47 3.38 0.00 -0.86 -4.98 105.19 107.96 1bd8 n GLY 85 Ca 0.16 -0.75 -0.44 0.00 0.00 0.00 0.00 46.02 44.99 1bd8 n GLY 85 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bd8 s PHE 86 N -2.00 3.34 0.23 1.61 0.08 -0.68 -4.83 117.98 115.74 1bd8 s PHE 86 Ca 0.00 -1.91 -0.05 0.00 0.12 0.00 0.00 56.93 55.09 1bd8 s PHE 86 Cb 0.00 -4.36 0.24 0.00 -0.57 0.00 0.00 43.02 38.33 1bd8 s PHE 86 CO 0.00 -1.47 1.74 1.25 -0.10 0.00 0.00 175.22 176.64 1bd8 h LEU 87 N 10.19 0.90 -0.91 -0.37 5.85 -1.94 -1.37 115.31 127.66 1bd8 h LEU 87 Ca 0.29 -0.21 -0.09 0.00 0.84 0.00 0.00 57.88 58.72 1bd8 h LEU 87 Cb 0.91 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 1bd8 h LEU 87 CO 1.24 0.92 -0.12 0.44 -0.34 0.00 0.00 178.44 180.58 1bd8 h ASP 88 N 0.88 0.65 -0.21 1.25 3.32 -1.95 0.16 116.42 120.52 1bd8 h ASP 88 Ca 0.17 -0.19 -0.20 0.00 0.02 0.00 0.00 57.03 56.83 1bd8 h ASP 88 Cb 0.43 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1bd8 h ASP 88 CO 0.01 0.80 -0.65 0.74 -1.72 0.00 0.00 179.24 178.42 1bd8 h THR 89 N 0.60 1.28 -0.59 0.35 2.02 -1.77 -2.74 112.91 112.05 1bd8 h THR 89 Ca 0.11 -1.84 0.00 0.00 0.77 0.00 0.00 66.41 65.45 1bd8 h THR 89 Cb 0.56 1.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.73 1bd8 h THR 89 CO 0.04 0.59 0.39 0.25 0.37 0.00 0.00 175.52 177.16 1bd8 h LEU 90 N 0.61 0.69 -0.89 2.58 5.85 -0.78 -1.23 115.31 122.13 1bd8 h LEU 90 Ca -0.02 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.72 1bd8 h LEU 90 Cb 1.27 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.07 1bd8 h LEU 90 CO 0.14 0.51 0.57 0.11 -0.34 0.00 0.00 178.44 179.43 1bd8 h LYS 91 N 0.81 1.06 -0.38 1.25 1.57 -0.92 -0.93 116.57 119.03 1bd8 h LYS 91 Ca 0.22 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.83 1bd8 h LYS 91 Cb -0.08 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 31.97 1bd8 h LYS 91 CO -0.05 0.70 -0.20 -0.39 -0.57 0.00 0.00 179.45 178.95 1bd8 h VAL 92 N 1.10 1.27 -0.16 0.50 -1.51 -1.15 -0.49 116.25 115.81 1bd8 h VAL 92 Ca 0.36 -1.28 -0.01 0.00 -1.23 0.00 0.00 66.70 64.54 1bd8 h VAL 92 Cb 0.04 1.18 -0.01 0.00 -2.13 0.00 0.00 31.29 30.38 1bd8 h VAL 92 CO -0.13 0.43 0.08 -0.07 -1.23 0.00 0.00 177.57 176.65 1bd8 h LEU 93 N 0.65 0.21 -0.57 4.19 3.38 -0.82 -1.79 115.31 120.57 1bd8 h LEU 93 Ca 0.10 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1bd8 h LEU 93 Cb 0.69 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 1bd8 h LEU 93 CO 0.05 0.28 -0.07 0.58 0.09 0.00 0.00 178.44 179.37 1bd8 h VAL 94 N 0.13 1.27 -0.64 1.22 2.07 -1.04 -2.10 116.25 117.16 1bd8 h VAL 94 Ca 0.06 -1.22 0.06 0.00 0.82 0.00 0.00 66.70 66.41 1bd8 h VAL 94 Cb 0.12 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 1bd8 h VAL 94 CO -0.01 0.44 0.42 -0.08 0.02 0.00 0.00 177.57 178.36 1bd8 h GLU 95 N 0.93 0.64 -0.83 1.57 4.81 -0.94 -1.97 114.58 118.79 1bd8 h GLU 95 Ca 0.15 -0.04 -0.17 0.00 -0.13 0.00 0.00 59.36 59.18 1bd8 h GLU 95 Cb 0.63 -0.14 -0.10 0.00 0.63 0.00 0.00 28.75 29.77 1bd8 h GLU 95 CO 0.04 0.42 0.21 0.72 -0.73 0.00 0.00 179.01 179.68 1bd8 n HIS 96 N -4.47 1.83 -0.22 0.92 8.25 -0.68 -4.91 115.22 115.92 1bd8 n HIS 96 Ca 0.09 -0.95 0.00 0.00 -0.26 0.00 0.00 57.72 56.60 1bd8 n HIS 96 Cb 0.22 -0.56 0.00 0.00 1.12 0.00 0.00 29.99 30.77 1bd8 n HIS 96 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bd8 n GLY 97 N -0.06 0.88 3.73 -1.41 0.00 -0.74 -4.85 105.19 102.73 1bd8 n GLY 97 Ca 0.30 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 1bd8 n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bd8 s ALA 98 N -2.00 3.39 -0.05 4.61 0.00 -0.82 -4.83 121.76 122.06 1bd8 s ALA 98 Ca 0.00 0.85 -0.30 0.00 0.00 0.00 0.00 51.96 52.51 1bd8 s ALA 98 Cb 0.00 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 1bd8 s ALA 98 CO 0.00 -0.35 1.03 0.34 0.00 0.00 0.00 175.76 176.78 1bd8 s ASP 99 N 0.53 7.26 -0.04 0.00 -1.08 -1.26 -4.60 116.67 117.47 1bd8 s ASP 99 Ca 0.55 1.65 0.21 0.00 -0.52 0.00 0.00 52.55 54.44 1bd8 s ASP 99 Cb -0.30 -2.56 0.67 0.00 -1.46 0.00 0.00 42.92 39.27 1bd8 s ASP 99 CO 0.32 -0.39 1.57 1.33 0.52 0.00 0.00 175.17 178.52 1bd8 n VAL 100 N 4.26 1.31 -0.48 1.11 0.24 -1.26 -4.31 118.33 119.19 1bd8 n VAL 100 Ca 0.08 -1.08 0.07 0.00 -2.04 0.00 0.00 64.34 61.38 1bd8 n VAL 100 Cb 0.49 0.36 0.23 0.00 -1.47 0.00 0.00 33.84 33.45 1bd8 n VAL 100 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1bd8 n ASN 101 N 1.45 3.56 -4.67 -1.34 3.02 -1.26 -4.32 115.26 111.69 1bd8 n ASN 101 Ca 0.25 -2.35 -0.38 0.00 -0.03 0.00 0.00 54.58 52.07 1bd8 n ASN 101 Cb 0.72 -0.39 -0.08 0.00 -0.61 0.00 0.00 39.78 39.42 1bd8 n ASN 101 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1bd8 s VAL 102 N -1.64 5.23 0.43 2.41 1.01 -1.26 -4.99 120.40 121.59 1bd8 s VAL 102 Ca 0.34 0.59 -0.19 0.00 0.00 0.00 0.00 61.98 62.72 1bd8 s VAL 102 Cb 0.22 -3.68 -0.10 0.00 0.00 0.00 0.00 36.38 32.82 1bd8 s VAL 102 CO 0.16 0.27 0.92 -2.16 0.00 0.00 0.00 175.10 174.29 1bd8 s PRO 103 N 1.27 4.14 0.30 2.72 0.04 -1.26 -4.64 135.00 137.57 1bd8 s PRO 103 Ca 0.16 1.01 -0.04 0.00 0.04 0.00 0.00 61.00 62.18 1bd8 s PRO 103 Cb -0.14 -2.21 0.07 0.00 0.04 0.00 0.00 34.50 32.25 1bd8 s PRO 103 CO 0.07 -0.05 0.41 -0.40 0.04 0.00 0.00 177.00 177.08 1bd8 n ASP 104 N -0.79 0.17 0.03 6.66 5.68 -0.33 -4.87 116.55 123.10 1bd8 n ASP 104 Ca 0.06 -1.23 0.08 0.00 -0.50 0.00 0.00 54.79 53.20 1bd8 n ASP 104 Cb 0.54 -0.30 0.35 0.00 -1.14 0.00 0.00 41.12 40.56 1bd8 n ASP 104 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bd8 n GLY 105 N 2.18 -1.05 0.49 6.12 0.00 0.57 -1.69 105.19 111.80 1bd8 n GLY 105 Ca 0.06 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.19 1bd8 n GLY 105 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bd8 n THR 106 N -1.67 0.00 -0.67 2.61 -2.24 -1.26 -4.92 114.28 106.12 1bd8 n THR 106 Ca 0.03 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1bd8 n THR 106 Cb 0.18 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 1bd8 n THR 106 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bd8 n GLY 107 N 1.27 0.71 3.74 3.38 0.00 -0.68 -1.11 105.19 112.49 1bd8 n GLY 107 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1bd8 n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bd8 s ALA 108 N -2.36 3.39 0.70 4.61 0.00 -1.26 -4.06 121.76 122.78 1bd8 s ALA 108 Ca 0.00 0.13 -0.09 0.00 0.00 0.00 0.00 51.96 52.00 1bd8 s ALA 108 Cb 0.00 -2.90 0.04 0.00 0.00 0.00 0.00 23.12 20.27 1bd8 s ALA 108 CO 0.00 0.02 1.05 -0.51 0.00 0.00 0.00 175.76 176.32 1bd8 s LEU 109 N 0.30 2.85 0.34 0.00 1.43 -1.26 -1.19 118.68 121.15 1bd8 s LEU 109 Ca 0.36 0.75 0.09 0.00 -1.03 0.00 0.00 54.13 54.29 1bd8 s LEU 109 Cb -0.18 -3.43 0.83 0.00 0.03 0.00 0.00 46.19 43.43 1bd8 s LEU 109 CO 0.19 -1.50 1.82 -0.65 0.23 0.00 0.00 176.35 176.44 1bd8 h PRO 110 N -0.63 0.66 -0.37 1.29 0.11 -1.82 -0.76 132.00 130.48 1bd8 h PRO 110 Ca -0.45 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 1bd8 h PRO 110 Cb 1.29 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 1bd8 h PRO 110 CO 0.63 0.44 -0.09 0.97 -0.21 0.00 0.00 178.00 179.73 1bd8 h ILE 111 N 0.68 1.24 -0.61 4.15 2.10 -1.93 -1.81 117.51 121.33 1bd8 h ILE 111 Ca 0.52 -1.05 -0.01 0.00 1.08 0.00 0.00 64.86 65.40 1bd8 h ILE 111 Cb 0.90 1.06 -0.03 0.00 -1.09 0.00 0.00 36.82 37.66 1bd8 h ILE 111 CO -0.28 0.35 0.33 0.45 -1.08 0.00 0.00 178.15 177.93 1bd8 h HIS 112 N 0.58 0.83 -0.79 2.19 3.86 -1.51 -1.20 115.15 119.12 1bd8 h HIS 112 Ca 0.11 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1bd8 h HIS 112 Cb 0.50 -0.27 -0.04 0.00 1.06 0.00 0.00 27.41 28.67 1bd8 h HIS 112 CO 0.02 0.60 0.44 -0.07 0.86 0.00 0.00 177.93 179.78 1bd8 h LEU 113 N 0.82 0.98 -0.95 2.43 3.38 -1.00 -1.38 115.31 119.60 1bd8 h LEU 113 Ca 0.21 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 1bd8 h LEU 113 Cb 0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1bd8 h LEU 113 CO -0.03 0.78 -0.30 0.00 0.09 0.00 0.00 178.44 178.98 1bd8 h ALA 114 N 1.23 1.11 -0.44 1.53 0.00 -1.15 -2.27 119.26 119.28 1bd8 h ALA 114 Ca 0.28 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1bd8 h ALA 114 Cb 0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1bd8 h ALA 114 CO -0.05 0.56 -0.02 0.28 0.00 0.00 0.00 179.25 180.03 1bd8 h VAL 115 N 0.35 1.26 -0.84 0.00 2.07 -0.86 -0.56 116.25 117.67 1bd8 h VAL 115 Ca 0.05 -1.07 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 1bd8 h VAL 115 Cb 0.71 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.52 1bd8 h VAL 115 CO 0.05 0.37 0.46 -0.61 0.02 0.00 0.00 177.57 177.86 1bd8 h GLN 116 N 0.62 1.18 -0.00 1.57 5.75 -1.11 -2.64 115.11 120.47 1bd8 h GLN 116 Ca 0.12 -0.14 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1bd8 h GLN 116 Cb 0.52 -0.23 0.00 0.00 1.07 0.00 0.00 27.48 28.84 1bd8 h GLN 116 CO 0.03 0.87 -0.30 0.39 -2.65 0.00 0.00 178.83 177.16 1bd8 n GLU 117 N -4.37 0.26 -1.09 1.69 -0.58 -0.87 -4.96 120.64 110.72 1bd8 n GLU 117 Ca 0.08 -0.13 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 1bd8 n GLU 117 Cb 0.10 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.47 1bd8 n GLU 117 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1bd8 n GLY 118 N 1.43 0.60 3.50 0.62 0.00 -0.49 -4.99 105.19 105.86 1bd8 n GLY 118 Ca 0.08 -0.80 -0.43 0.00 0.00 0.00 0.00 46.02 44.88 1bd8 n GLY 118 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1bd8 s HIS 119 N -2.00 2.96 0.19 1.61 3.76 -0.34 -4.86 115.29 116.61 1bd8 s HIS 119 Ca 0.00 -1.37 -0.12 0.00 -0.15 0.00 0.00 55.06 53.42 1bd8 s HIS 119 Cb 0.00 -4.47 0.18 0.00 1.11 0.00 0.00 32.58 29.40 1bd8 s HIS 119 CO 0.00 -1.65 1.78 0.00 -0.85 0.00 0.00 174.74 174.02 1bd8 h THR 120 N 5.91 0.91 -0.50 1.30 1.03 -1.94 -0.72 112.91 118.90 1bd8 h THR 120 Ca 0.23 -0.17 -0.07 0.00 -0.01 0.00 0.00 66.41 66.39 1bd8 h THR 120 Cb 0.98 0.37 -0.02 0.00 -1.07 0.00 0.00 68.15 68.41 1bd8 h THR 120 CO 1.27 0.09 0.03 0.00 -0.01 0.00 0.00 175.52 176.89 1bd8 h ALA 121 N 1.32 1.11 -0.33 0.00 0.00 -1.98 -1.41 119.26 117.96 1bd8 h ALA 121 Ca 0.25 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1bd8 h ALA 121 Cb 0.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1bd8 h ALA 121 CO -0.20 0.57 -0.02 0.28 0.00 0.00 0.00 179.25 179.88 1bd8 h VAL 122 N 0.77 1.26 -0.28 0.00 2.07 -1.78 -1.64 116.25 116.65 1bd8 h VAL 122 Ca 0.15 -1.01 0.03 0.00 0.82 0.00 0.00 66.70 66.69 1bd8 h VAL 122 Cb 0.43 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 1bd8 h VAL 122 CO 0.02 0.33 0.09 0.58 0.02 0.00 0.00 177.57 178.61 1bd8 h VAL 123 N 0.40 0.92 -0.26 2.57 2.07 -0.90 -0.39 116.25 120.66 1bd8 h VAL 123 Ca 0.09 -0.07 0.06 0.00 0.82 0.00 0.00 66.70 67.59 1bd8 h VAL 123 Cb 0.48 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 1bd8 h VAL 123 CO 0.02 0.04 -0.09 -1.28 0.02 0.00 0.00 177.57 176.28 1bd8 h SER 124 N 0.21 -0.32 -0.30 0.57 0.87 -1.13 -0.58 113.55 112.88 1bd8 h SER 124 Ca 0.12 0.09 0.04 0.00 -1.23 0.00 0.00 61.79 60.81 1bd8 h SER 124 Cb 0.09 0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.21 1bd8 h SER 124 CO -0.13 -0.12 0.07 0.15 -0.53 0.00 0.00 176.83 176.28 1bd8 h PHE 125 N -0.04 0.13 0.00 2.24 3.57 -0.91 -3.02 116.94 118.91 1bd8 h PHE 125 Ca 0.13 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.65 1bd8 h PHE 125 Cb 0.24 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.97 1bd8 h PHE 125 CO -0.28 0.04 0.00 -0.07 -2.23 0.00 0.00 178.31 175.77 1bd8 h LEU 126 N 0.19 0.00 -1.23 0.59 3.38 -0.75 -3.36 115.31 114.13 1bd8 h LEU 126 Ca 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1bd8 h LEU 126 Cb 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1bd8 h LEU 126 CO -0.16 0.00 0.23 0.00 0.09 0.00 0.00 178.44 178.60 1bd8 h ALA 127 N 2.26 1.40 -2.66 1.53 0.00 -0.97 -2.00 119.26 118.82 1bd8 h ALA 127 Ca 0.00 -0.13 -0.77 0.00 0.00 0.00 0.00 54.91 54.01 1bd8 h ALA 127 Cb 0.75 -0.22 -0.30 0.00 0.00 0.00 0.00 17.79 18.02 1bd8 h ALA 127 CO 0.00 0.46 0.28 0.00 0.00 0.00 0.00 179.25 179.99 1bd8 s ALA 128 N -5.39 4.56 0.00 0.00 0.00 -1.26 -3.84 121.76 115.83 1bd8 s ALA 128 Ca -0.09 -3.81 0.00 0.00 0.00 0.00 0.00 51.96 48.05 1bd8 s ALA 128 Cb 0.16 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.93 1bd8 s ALA 128 CO 0.78 -2.19 0.00 0.39 0.00 0.00 0.00 175.76 174.74 1bd8 n GLU 129 N 2.67 0.00 -3.98 0.00 1.02 -1.13 -5.05 120.64 114.15 1bd8 n GLU 129 Ca 0.22 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 57.08 1bd8 n GLU 129 Cb 0.39 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.77 1bd8 n GLU 129 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1bd8 s SER 130 N 0.00 6.05 -0.79 1.62 0.01 -0.76 -4.83 113.70 115.00 1bd8 s SER 130 Ca 0.00 0.11 -0.26 0.00 1.31 0.00 0.00 55.95 57.11 1bd8 s SER 130 Cb 0.00 -1.76 0.04 0.00 0.21 0.00 0.00 66.02 64.51 1bd8 s SER 130 CO 0.00 0.11 1.28 -1.81 0.41 0.00 0.00 173.24 173.22 1bd8 s ASP 131 N -2.86 6.23 0.00 2.44 1.01 -1.26 -4.88 116.67 117.35 1bd8 s ASP 131 Ca 0.33 -0.72 0.24 0.00 0.71 0.00 0.00 52.55 53.10 1bd8 s ASP 131 Cb -0.12 -2.54 1.41 0.00 1.01 0.00 0.00 42.92 42.68 1bd8 s ASP 131 CO 0.26 -1.72 1.78 0.18 0.21 0.00 0.00 175.17 175.88 1bd8 n LEU 132 N 9.06 0.00 -0.51 1.23 4.77 -1.26 -2.46 117.00 127.82 1bd8 n LEU 132 Ca 0.08 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.19 1bd8 n LEU 132 Cb 0.49 -0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.81 1bd8 n LEU 132 CO 0.69 -0.00 0.59 1.41 -1.33 0.00 0.00 177.39 178.74 1bd8 n HIS 133 N -1.00 0.00 -2.35 -1.77 8.25 -1.26 -4.40 115.22 112.68 1bd8 n HIS 133 Ca 0.18 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.22 1bd8 n HIS 133 Cb 0.08 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.13 1bd8 n HIS 133 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1bd8 s ARG 134 N -2.29 4.43 -0.05 -0.41 1.81 -1.03 -4.90 118.95 116.50 1bd8 s ARG 134 Ca 0.26 1.87 0.01 0.00 -1.72 0.00 0.00 55.73 56.15 1bd8 s ARG 134 Cb 0.19 -3.29 -0.03 0.00 -0.45 0.00 0.00 34.95 31.37 1bd8 s ARG 134 CO 0.45 -0.24 -0.04 1.03 -0.68 0.00 0.00 175.30 175.82 1bd8 s ARG 135 N 0.64 2.78 0.00 3.54 3.00 -1.26 -4.20 118.95 123.44 1bd8 s ARG 135 Ca 0.58 -0.55 0.00 0.00 0.00 0.00 0.00 55.73 55.76 1bd8 s ARG 135 Cb -0.32 -2.64 0.00 0.00 0.00 0.00 0.00 34.95 31.99 1bd8 s ARG 135 CO 0.32 0.66 0.00 -0.40 0.00 0.00 0.00 175.30 175.88 1bd8 n ASP 136 N 1.97 0.00 0.18 0.23 5.68 -0.58 -4.81 116.55 119.21 1bd8 n ASP 136 Ca -0.17 -0.62 0.06 0.00 -0.50 0.00 0.00 54.79 53.56 1bd8 n ASP 136 Cb 0.53 0.00 0.56 0.00 -1.14 0.00 0.00 41.12 41.07 1bd8 n ASP 136 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1bd8 h ALA 137 N -1.63 1.88 -0.03 2.12 0.00 -1.38 -0.36 119.26 119.85 1bd8 h ALA 137 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1bd8 h ALA 137 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1bd8 h ALA 137 CO 0.00 0.11 0.00 0.54 0.00 0.00 0.00 179.25 179.90 1bd8 n ARG 138 N -4.50 1.23 -1.03 0.00 1.74 -1.26 -4.91 116.66 107.93 1bd8 n ARG 138 Ca -0.01 -0.34 -0.00 0.00 -0.77 0.00 0.00 57.85 56.73 1bd8 n ARG 138 Cb 0.10 -1.39 -0.00 0.00 -1.02 0.00 0.00 32.46 30.14 1bd8 n ARG 138 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bd8 n GLY 139 N 0.96 0.39 3.69 -0.13 0.00 -0.15 -5.04 105.19 104.91 1bd8 n GLY 139 Ca 0.18 -1.08 -0.35 0.00 0.00 0.00 0.00 46.02 44.76 1bd8 n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bd8 s LEU 140 N -0.04 3.59 0.69 0.99 1.43 -1.26 -4.75 118.68 119.33 1bd8 s LEU 140 Ca 0.00 0.14 -0.08 0.00 -1.03 0.00 0.00 54.13 53.16 1bd8 s LEU 140 Cb 0.00 -1.84 0.04 0.00 0.03 0.00 0.00 46.19 44.42 1bd8 s LEU 140 CO 0.00 0.37 1.02 0.42 0.23 0.00 0.00 176.35 178.39 1bd8 s THR 141 N -0.91 2.80 0.27 5.49 -4.23 -1.26 -1.53 115.64 116.27 1bd8 s THR 141 Ca 0.14 -0.04 -0.03 0.00 -1.18 0.00 0.00 61.69 60.58 1bd8 s THR 141 Cb -0.11 -3.20 0.27 0.00 1.34 0.00 0.00 72.50 70.80 1bd8 s THR 141 CO 0.03 -0.22 1.92 -0.65 -0.54 0.00 0.00 174.62 175.15 1bd8 h PRO 142 N -0.56 1.18 -0.57 3.99 0.11 -1.77 0.20 132.00 134.58 1bd8 h PRO 142 Ca -0.45 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 65.53 1bd8 h PRO 142 Cb 1.29 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1bd8 h PRO 142 CO 0.62 0.78 0.11 1.25 -0.21 0.00 0.00 178.00 180.55 1bd8 h LEU 143 N 1.22 0.89 -0.57 2.35 5.85 -1.86 -1.38 115.31 121.82 1bd8 h LEU 143 Ca 0.39 -0.25 -0.09 0.00 0.84 0.00 0.00 57.88 58.77 1bd8 h LEU 143 Cb 0.02 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 1bd8 h LEU 143 CO -0.12 0.92 0.01 -0.33 -0.34 0.00 0.00 178.44 178.58 1bd8 h GLU 144 N 0.84 1.00 -0.34 1.25 5.08 -1.70 -2.73 114.58 117.97 1bd8 h GLU 144 Ca 0.18 -0.31 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1bd8 h GLU 144 Cb 0.39 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 1bd8 h GLU 144 CO 0.01 0.99 0.20 -0.07 -1.00 0.00 0.00 179.01 179.14 1bd8 h LEU 145 N 0.89 0.33-10.20 1.33 3.38 -0.52 -1.45 115.31 109.07 1bd8 h LEU 145 Ca 0.16 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.62 1bd8 h LEU 145 Cb 0.53 -0.07 0.13 0.00 0.09 0.00 0.00 40.66 41.34 1bd8 h LEU 145 CO 0.03 0.24 0.37 0.00 0.09 0.00 0.00 178.44 179.17 1bd8 s ALA 146 N -6.16 2.29 0.00 1.53 0.00 -0.53 -1.75 121.76 117.14 1bd8 s ALA 146 Ca -0.13 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1bd8 s ALA 146 Cb 0.10 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.85 1bd8 s ALA 146 CO 0.71 -1.58 0.00 1.28 0.00 0.00 0.00 175.76 176.18 1bd8 n LEU 147 N -2.66 0.00 -0.19 0.00 4.77 -1.26 -4.51 117.00 113.16 1bd8 n LEU 147 Ca 0.11 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.04 1bd8 n LEU 147 Cb 0.51 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.65 1bd8 n LEU 147 CO 0.48 0.00 1.09 1.56 -1.33 0.00 0.00 177.39 179.19 1bd8 h GLN 148 N 0.00 0.67 0.00 3.23 4.20 -1.04 -2.02 115.11 120.14 1bd8 h GLN 148 Ca 0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1bd8 h GLN 148 Cb 0.00 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.63 1bd8 h GLN 148 CO 0.00 0.44 0.00 0.54 -0.67 0.00 0.00 178.83 179.14 1bd8 n ARG 149 N -4.75 0.24 -1.21 1.46 1.74 -0.72 -4.90 116.66 108.52 1bd8 n ARG 149 Ca 0.04 0.25 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 1bd8 n ARG 149 Cb 0.06 -1.81 0.00 0.00 -1.02 0.00 0.00 32.46 29.69 1bd8 n ARG 149 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bd8 n GLY 150 N 1.04 0.39 3.35 -0.13 0.00 -0.76 -4.96 105.19 104.12 1bd8 n GLY 150 Ca 0.05 -1.03 -0.43 0.00 0.00 0.00 0.00 46.02 44.60 1bd8 n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bd8 n ALA 151 N 0.50 4.14 0.11 4.61 0.00 -1.26 -4.82 120.51 123.79 1bd8 n ALA 151 Ca 0.00 -4.13 0.05 0.00 0.00 0.00 0.00 53.44 49.36 1bd8 n ALA 151 Cb 0.11 -3.22 0.50 0.00 0.00 0.00 0.00 19.45 16.85 1bd8 n ALA 151 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1bd8 h GLN 152 N 6.94 0.30 -0.36 0.00 1.08 -1.97 -0.80 115.11 120.31 1bd8 h GLN 152 Ca 0.38 -0.02 -0.06 0.00 -1.45 0.00 0.00 58.65 57.50 1bd8 h GLN 152 Cb 0.82 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 28.16 1bd8 h GLN 152 CO 1.40 0.23 -0.02 -0.44 -0.95 0.00 0.00 178.83 179.06 1bd8 h ASP 153 N 0.31 0.54 0.37 1.46 3.32 -2.00 -1.00 116.42 119.41 1bd8 h ASP 153 Ca 0.08 -0.11 -0.20 0.00 0.02 0.00 0.00 57.03 56.82 1bd8 h ASP 153 Cb 0.02 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 1bd8 h ASP 153 CO -0.01 0.62 -0.85 -0.07 -1.72 0.00 0.00 179.24 177.21 1bd8 h LEU 154 N 0.54 0.44 -0.05 1.55 3.38 -1.59 -2.71 115.31 116.87 1bd8 h LEU 154 Ca 0.11 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1bd8 h LEU 154 Cb 0.37 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1bd8 h LEU 154 CO 0.01 1.10 0.03 0.58 0.09 0.00 0.00 178.44 180.26 1bd8 h VAL 155 N 0.21 1.06 -0.54 1.22 2.07 -0.86 -0.51 116.25 118.90 1bd8 h VAL 155 Ca -0.05 -0.16 0.10 0.00 0.82 0.00 0.00 66.70 67.41 1bd8 h VAL 155 Cb 1.46 1.07 -0.09 0.00 -1.52 0.00 0.00 31.29 32.21 1bd8 h VAL 155 CO 0.14 0.05 0.03 0.44 0.02 0.00 0.00 177.57 178.25 1bd8 h ASP 156 N 0.02 -0.16 0.22 0.57 3.32 -1.18 0.05 116.42 119.26 1bd8 h ASP 156 Ca 0.02 0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1bd8 h ASP 156 Cb 0.05 0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1bd8 h ASP 156 CO -0.00 -0.06 -0.11 0.40 -1.72 0.00 0.00 179.24 177.75 1bd8 h ILE 157 N 0.15 0.80 -0.22 0.35 2.04 -1.21 -3.19 117.51 116.24 1bd8 h ILE 157 Ca 0.28 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.98 1bd8 h ILE 157 Cb 0.42 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1bd8 h ILE 157 CO -0.43 0.03 -0.06 -0.07 0.00 0.00 0.00 178.15 177.62 1bd8 h LEU 158 N -0.36 0.31 -1.84 1.44 3.38 -0.63 -2.42 115.31 115.19 1bd8 h LEU 158 Ca -0.03 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1bd8 h LEU 158 Cb 0.27 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1bd8 h LEU 158 CO 0.05 0.42 -0.11 1.56 0.09 0.00 0.00 178.44 180.45 1bd8 h GLN 159 N 0.32 0.00 0.00 1.13 4.20 -0.99 -1.67 115.11 118.10 1bd8 h GLN 159 Ca 0.07 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 1bd8 h GLN 159 Cb 0.32 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 1bd8 h GLN 159 CO 0.01 0.11 -0.06 0.78 -0.67 0.00 0.00 178.83 179.00 1bd8 h GLY 160 N 0.38 0.00 -0.68 3.46 0.00 -1.44 -2.88 103.07 101.92 1bd8 h GLY 160 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1bd8 h GLY 160 CO 0.01 0.00 -0.43 1.42 0.00 0.00 0.00 176.54 177.54 1bd8 n HIS 161 N -3.35 0.00 0.00 5.60 8.25 -0.65 -5.16 115.22 119.91 1bd8 n HIS 161 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1bd8 n HIS 161 Cb 0.23 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.34 1bd8 n HIS 161 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65