#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h56 s HIS 3 N 0.00 0.95 0.27 1.43 4.02 -1.26 -5.08 115.29 115.62 1h56 s HIS 3 Ca 0.00 -1.24 -0.08 0.00 1.02 0.00 0.00 55.06 54.75 1h56 s HIS 3 Cb 0.00 -0.45 0.44 0.00 -1.02 0.00 0.00 32.58 31.55 1h56 s HIS 3 CO 0.00 -0.63 1.57 -1.35 1.02 0.00 0.00 174.74 175.35 1h56 h PRO 4 N 2.67 0.00 -0.01 8.40 0.11 -2.06 -2.36 132.00 138.76 1h56 h PRO 4 Ca -0.35 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.76 1h56 h PRO 4 Cb 1.23 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1h56 h PRO 4 CO 0.53 0.00 -0.01 -0.44 -0.21 0.00 0.00 178.00 177.87 1h56 h ASP 5 N 0.00 0.02 -0.09 -2.05 3.32 -1.98 -2.76 116.42 112.88 1h56 h ASP 5 Ca 0.46 -0.61 0.03 0.00 0.02 0.00 0.00 57.03 56.93 1h56 h ASP 5 Cb 0.72 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.26 1h56 h ASP 5 CO -0.96 0.62 0.16 0.25 -1.72 0.00 0.00 179.24 177.59 1h56 h LEU 6 N -0.58 0.00 0.00 1.55 5.85 -1.93 0.78 115.31 120.97 1h56 h LEU 6 Ca -0.00 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.52 1h56 h LEU 6 Cb 0.62 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 1h56 h LEU 6 CO 0.00 0.00 -0.95 0.78 -0.34 0.00 0.00 178.44 177.93 1h56 h ASN 7 N 0.00 0.00 0.56 1.25 4.21 -1.39 -2.28 115.58 117.93 1h56 h ASN 7 Ca 0.04 0.00 -0.17 0.00 1.21 0.00 0.00 56.30 57.39 1h56 h ASN 7 Cb 0.37 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.55 1h56 h ASN 7 CO -0.00 0.95 -0.74 0.11 -1.29 0.00 0.00 177.43 176.46 1h56 h LYS 8 N 0.00 0.14 -0.02 0.81 1.79 0.74 -0.77 116.57 119.26 1h56 h LYS 8 Ca -0.01 -0.13 -0.22 0.00 -2.18 0.00 0.00 60.65 58.11 1h56 h LYS 8 Cb 1.73 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 32.42 1h56 h LYS 8 CO 0.12 0.82 -0.91 1.25 -1.08 0.00 0.00 179.45 179.65 1h56 h LEU 9 N 0.09 0.55 -0.29 2.94 5.85 -0.80 -0.68 115.31 122.98 1h56 h LEU 9 Ca -0.02 -0.43 -0.09 0.00 0.84 0.00 0.00 57.88 58.18 1h56 h LEU 9 Cb 1.31 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 1h56 h LEU 9 CO 0.11 1.22 -0.16 0.25 -0.34 0.00 0.00 178.44 179.51 1h56 h LEU 10 N 0.25 0.64 0.17 2.25 5.85 -1.33 -1.09 115.31 122.06 1h56 h LEU 10 Ca -0.07 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.22 1h56 h LEU 10 Cb 1.54 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.39 1h56 h LEU 10 CO 0.16 0.92 -0.08 -0.08 -0.34 0.00 0.00 178.44 179.02 1h56 h GLU 11 N 0.37 -0.22 -0.07 1.25 4.81 -1.13 -3.34 114.58 116.25 1h56 h GLU 11 Ca 0.06 0.01 -0.22 0.00 -0.13 0.00 0.00 59.36 59.09 1h56 h GLU 11 Cb 0.69 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1h56 h GLU 11 CO 0.05 0.04 -0.84 -0.07 -0.73 0.00 0.00 179.01 177.46 1h56 h LEU 12 N -0.46 0.67 -1.40 1.64 3.38 -1.19 -3.37 115.31 114.57 1h56 h LEU 12 Ca -0.02 -0.47 0.23 0.00 0.09 0.00 0.00 57.88 57.71 1h56 h LEU 12 Cb 0.36 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 1h56 h LEU 12 CO 0.04 1.25 0.64 -0.25 0.09 0.00 0.00 178.44 180.21 1h56 h TRP 13 N 0.35 0.64 -0.58 1.13 2.91 -1.31 -1.94 115.95 117.14 1h56 h TRP 13 Ca -0.06 0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.05 1h56 h TRP 13 Cb 1.45 -0.19 -0.06 0.00 -0.51 0.00 0.00 29.16 29.85 1h56 h TRP 13 CO 0.07 0.11 0.26 -1.35 -1.03 0.00 0.00 178.44 176.50 1h56 h PRO 14 N 0.43 0.48 -0.17 2.65 0.11 -1.74 -1.62 132.00 132.14 1h56 h PRO 14 Ca 0.54 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.50 1h56 h PRO 14 Cb 1.32 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1h56 h PRO 14 CO -0.25 0.31 -0.43 0.45 -0.21 0.00 0.00 178.00 177.88 1h56 h HIS 15 N 0.49 0.47 -0.64 0.65 3.86 -1.63 -2.67 115.15 115.68 1h56 h HIS 15 Ca 0.27 -0.14 -0.06 0.00 -1.16 0.00 0.00 60.37 59.29 1h56 h HIS 15 Cb 0.26 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.60 1h56 h HIS 15 CO -0.13 0.76 0.17 0.82 0.86 0.00 0.00 177.93 180.41 1h56 h ILE 16 N 0.33 1.25 -0.17 2.45 1.08 -1.15 0.13 117.51 121.43 1h56 h ILE 16 Ca 0.03 -0.90 -0.06 0.00 -0.39 0.00 0.00 64.86 63.54 1h56 h ILE 16 Cb 0.89 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 35.25 1h56 h ILE 16 CO 0.07 0.34 -0.16 -0.61 -0.69 0.00 0.00 178.15 177.11 1h56 h GLN 17 N 0.93 0.28 -0.23 2.37 5.75 -1.21 -1.46 115.11 121.55 1h56 h GLN 17 Ca 0.20 -0.07 -0.10 0.00 -0.15 0.00 0.00 58.65 58.53 1h56 h GLN 17 Cb 0.33 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.85 1h56 h GLN 17 CO -0.00 0.44 -0.25 1.49 -2.65 0.00 0.00 178.83 177.86 1h56 h GLU 18 N 0.26 0.57 -0.47 1.69 4.81 -1.03 -1.22 114.58 119.21 1h56 h GLU 18 Ca 0.05 -0.31 -0.02 0.00 -0.13 0.00 0.00 59.36 58.95 1h56 h GLU 18 Cb 0.44 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1h56 h GLU 18 CO 0.03 0.91 0.20 -0.92 -0.73 0.00 0.00 179.01 178.49 1h56 h TYR 19 N 0.27 0.65 -0.19 0.92 3.20 -0.37 -1.38 116.97 120.07 1h56 h TYR 19 Ca 0.03 -0.02 -0.21 0.00 3.14 0.00 0.00 58.73 61.67 1h56 h TYR 19 Cb 0.81 -0.21 0.01 0.00 1.54 0.00 0.00 36.73 38.88 1h56 h TYR 19 CO 0.08 0.50 -0.70 0.37 -1.64 0.00 0.00 178.16 176.77 1h56 h GLN 20 N 0.66 0.78 -0.27 1.82 5.75 -1.13 -2.19 115.11 120.54 1h56 h GLN 20 Ca 0.16 -0.59 0.00 0.00 -0.15 0.00 0.00 58.65 58.07 1h56 h GLN 20 Cb 0.11 0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 1h56 h GLN 20 CO -0.02 1.20 0.17 -0.44 -2.65 0.00 0.00 178.83 177.10 1h56 h ASP 21 N 0.56 0.32 -0.20 -0.69 3.32 -0.72 -1.16 116.42 117.84 1h56 h ASP 21 Ca -0.03 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 1h56 h ASP 21 Cb 1.31 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 1h56 h ASP 21 CO 0.14 0.25 0.13 0.25 -1.72 0.00 0.00 179.24 178.29 1h56 h LEU 22 N 0.35 0.24 -0.68 1.55 5.85 -1.23 -1.51 115.31 119.87 1h56 h LEU 22 Ca 0.10 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.67 1h56 h LEU 22 Cb -0.01 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 1h56 h LEU 22 CO -0.02 0.18 -0.65 0.00 -0.34 0.00 0.00 178.44 177.62 1h56 h ALA 23 N 1.86 0.89 -0.22 1.25 0.00 -0.63 -3.11 119.26 119.30 1h56 h ALA 23 Ca 0.07 -0.58 -0.10 0.00 0.00 0.00 0.00 54.91 54.31 1h56 h ALA 23 Cb -0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1h56 h ALA 23 CO -0.01 0.79 -0.23 -0.07 0.00 0.00 0.00 179.25 179.72 1h56 h LEU 24 N 0.05 0.59 -1.75 0.00 3.38 -0.20 0.45 115.31 117.84 1h56 h LEU 24 Ca -0.01 -0.48 0.14 0.00 0.09 0.00 0.00 57.88 57.62 1h56 h LEU 24 Cb 1.15 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.69 1h56 h LEU 24 CO 0.09 0.95 0.44 0.11 0.09 0.00 0.00 178.44 180.12 1h56 h LYS 25 N 0.25 0.25 -0.64 1.13 1.57 -1.47 0.91 116.57 118.58 1h56 h LYS 25 Ca 0.03 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1h56 h LYS 25 Cb 0.79 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1h56 h LYS 25 CO 0.06 0.17 0.00 0.72 -0.57 0.00 0.00 179.45 179.83 1h56 n HIS 26 N -4.44 1.70 -1.53 -1.35 8.25 -1.14 -4.93 115.22 111.78 1h56 n HIS 26 Ca 0.12 -0.61 0.00 0.00 -0.26 0.00 0.00 57.72 56.97 1h56 n HIS 26 Cb 0.53 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 31.24 1h56 n HIS 26 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h56 n GLY 27 N 0.70 0.50 2.88 -1.41 0.00 0.31 -4.69 105.19 103.48 1h56 n GLY 27 Ca 0.24 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 1h56 n GLY 27 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h56 s ILE 28 N -2.00 1.46 0.11 -0.61 1.01 0.16 -4.98 121.20 116.34 1h56 s ILE 28 Ca 0.00 -1.56 -0.30 0.00 0.00 0.00 0.00 60.65 58.79 1h56 s ILE 28 Cb 0.00 -1.96 -0.10 0.00 0.01 0.00 0.00 42.46 40.42 1h56 s ILE 28 CO 0.00 -0.44 1.60 0.78 0.00 0.00 0.00 174.94 176.88 1h56 h ASN 29 N 7.92 -1.06 -3.70 3.58 2.35 -1.89 -3.21 115.58 119.57 1h56 h ASN 29 Ca -0.13 0.12 -0.63 0.00 -0.55 0.00 0.00 56.30 55.11 1h56 h ASN 29 Cb 1.04 0.39 -0.38 0.00 0.05 0.00 0.00 38.32 39.42 1h56 h ASN 29 CO 0.46 -0.46 -0.78 -0.62 -1.65 0.00 0.00 177.43 174.38 1h56 s ASP 30 N -4.71 4.14 0.58 5.81 -1.08 -1.26 -4.86 116.67 115.30 1h56 s ASP 30 Ca -0.16 -1.37 0.36 0.00 -0.52 0.00 0.00 52.55 50.86 1h56 s ASP 30 Cb 0.07 -1.33 1.64 0.00 -1.46 0.00 0.00 42.92 41.84 1h56 s ASP 30 CO 0.64 -0.24 2.08 0.16 0.52 0.00 0.00 175.17 178.33 1h56 h ILE 31 N 6.69 0.02 -0.28 4.11 3.07 -1.89 -2.71 117.51 126.52 1h56 h ILE 31 Ca -0.17 -0.39 0.00 0.00 1.55 0.00 0.00 64.86 65.85 1h56 h ILE 31 Cb 1.05 1.38 0.00 0.00 -0.27 0.00 0.00 36.82 38.99 1h56 h ILE 31 CO 0.44 0.01 0.00 0.49 -1.05 0.00 0.00 178.15 178.04 1h56 n PHE 32 N -3.11 0.37 0.00 0.16 3.72 -1.26 -0.73 117.46 116.62 1h56 n PHE 32 Ca -0.00 -0.19 0.00 0.00 -0.05 0.00 0.00 57.45 57.21 1h56 n PHE 32 Cb 0.25 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 1h56 n PHE 32 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1h56 n GLN 33 N 0.61 0.00 -1.39 -1.08 1.13 -1.02 -4.83 117.38 110.79 1h56 n GLN 33 Ca 0.16 0.00 -0.29 0.00 -1.94 0.00 0.00 57.00 54.92 1h56 n GLN 33 Cb 0.37 0.00 -0.07 0.00 0.11 0.00 0.00 30.24 30.65 1h56 n GLN 33 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1h56 n ASP 34 N 0.00 7.23 -1.96 1.08 8.00 -1.26 -4.55 116.55 125.09 1h56 n ASP 34 Ca 0.00 -2.77 -0.20 0.00 0.71 0.00 0.00 54.79 52.53 1h56 n ASP 34 Cb 0.00 -1.42 -0.04 0.00 -0.02 0.00 0.00 41.12 39.63 1h56 n ASP 34 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1h56 n ASN 35 N 2.43 -5.59 -0.29 -2.24 5.03 -1.26 -4.85 115.26 108.49 1h56 n ASN 35 Ca 0.60 0.21 0.05 0.00 0.87 0.00 0.00 54.58 56.31 1h56 n ASN 35 Cb 0.49 -4.72 0.19 0.00 -1.02 0.00 0.00 39.78 34.72 1h56 n ASN 35 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1h56 h GLY 36 N 0.00 1.31 2.00 7.41 0.00 -1.73 0.74 103.07 112.80 1h56 h GLY 36 Ca -0.45 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.60 1h56 h GLY 36 CO 0.58 0.05 0.00 -1.33 0.00 0.00 0.00 176.54 175.84 1h56 h GLY 37 N 0.71 0.00 0.00 4.60 0.00 -1.18 -2.48 103.07 104.72 1h56 h GLY 37 Ca 0.42 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.53 1h56 h GLY 37 CO -0.30 0.00 -1.55 0.28 0.00 0.00 0.00 176.54 174.97 1h56 n LYS 38 N -2.60 0.55 -0.29 4.80 5.02 0.24 -4.35 118.16 121.52 1h56 n LYS 38 Ca -0.02 0.35 0.29 0.00 -2.02 0.00 0.00 58.31 56.91 1h56 n LYS 38 Cb 0.05 -1.56 0.65 0.00 -0.02 0.00 0.00 35.03 34.15 1h56 n LYS 38 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1h56 h LEU 39 N -1.00 0.18 -0.83 -0.35 5.85 -0.75 -0.77 115.31 117.64 1h56 h LEU 39 Ca -0.33 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.35 1h56 h LEU 39 Cb 1.22 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 1h56 h LEU 39 CO -0.20 0.04 0.08 0.25 -0.34 0.00 0.00 178.44 178.26 1h56 h LEU 40 N 0.16 0.91 -0.19 2.25 5.85 -1.65 -2.51 115.31 120.12 1h56 h LEU 40 Ca 0.54 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 59.09 1h56 h LEU 40 Cb 1.83 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.59 1h56 h LEU 40 CO -0.12 0.93 -0.01 1.56 -0.34 0.00 0.00 178.44 180.46 1h56 h GLN 41 N 0.90 0.05 -0.58 1.25 4.20 -1.33 0.21 115.11 119.81 1h56 h GLN 41 Ca 0.18 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 1h56 h GLN 41 Cb 0.42 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.16 1h56 h GLN 41 CO 0.01 0.03 0.26 0.28 -0.67 0.00 0.00 178.83 178.74 1h56 h VAL 42 N 0.05 1.22 0.74 -0.54 2.07 -1.61 1.02 116.25 119.20 1h56 h VAL 42 Ca 0.09 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 1h56 h VAL 42 Cb 0.12 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1h56 h VAL 42 CO -0.16 0.25 -0.46 -0.07 0.02 0.00 0.00 177.57 177.15 1h56 h LEU 43 N 0.79 -1.18 -0.56 2.57 3.38 -0.98 0.70 115.31 120.03 1h56 h LEU 43 Ca 0.20 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.26 1h56 h LEU 43 Cb 0.16 0.35 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 1h56 h LEU 43 CO -0.02 -0.71 0.34 -0.07 0.09 0.00 0.00 178.44 178.06 1h56 h LEU 44 N -1.13 0.54 -1.60 1.67 3.38 -0.44 0.39 115.31 118.12 1h56 h LEU 44 Ca -0.10 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1h56 h LEU 44 Cb 0.91 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1h56 h LEU 44 CO 0.09 0.38 -0.21 0.40 0.09 0.00 0.00 178.44 179.19 1h56 h ILE 45 N 0.66 1.08 -0.14 1.22 2.04 0.14 -3.24 117.51 119.26 1h56 h ILE 45 Ca 0.23 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.34 1h56 h ILE 45 Cb 0.03 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1h56 h ILE 45 CO -0.10 0.21 0.00 1.07 0.00 0.00 0.00 178.15 179.33 1h56 n THR 46 N -4.18 0.47 -1.21 -0.27 5.66 0.24 -4.99 114.28 110.00 1h56 n THR 46 Ca -0.02 -0.73 -0.07 0.00 -3.05 0.00 0.00 64.05 60.17 1h56 n THR 46 Cb 0.28 0.87 -0.03 0.00 -1.55 0.00 0.00 70.33 69.90 1h56 n THR 46 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1h56 n GLY 47 N 0.44 0.79 3.93 1.09 0.00 0.13 -4.99 105.19 106.58 1h56 n GLY 47 Ca 0.07 -0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.69 1h56 n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h56 s LEU 48 N -1.62 2.72 -0.05 0.99 1.43 -1.12 -4.78 118.68 116.26 1h56 s LEU 48 Ca 0.00 0.35 0.01 0.00 -1.03 0.00 0.00 54.13 53.45 1h56 s LEU 48 Cb 0.00 -2.68 0.02 0.00 0.03 0.00 0.00 46.19 43.57 1h56 s LEU 48 CO 0.00 -2.16 -0.03 -0.89 0.23 0.00 0.00 176.35 173.50 1h56 s THR 49 N -3.57 0.48 0.21 5.49 2.01 -1.07 -4.80 115.64 114.39 1h56 s THR 49 Ca 0.67 -0.06 -0.30 0.00 0.31 0.00 0.00 61.69 62.31 1h56 s THR 49 Cb -0.07 -0.53 -0.08 0.00 0.01 0.00 0.00 72.50 71.82 1h56 s THR 49 CO 0.49 0.22 1.10 0.68 -0.69 0.00 0.00 174.62 176.43 1h56 s VAL 50 N 1.12 3.74 -0.10 3.82 -7.23 -1.26 -1.89 120.40 118.60 1h56 s VAL 50 Ca -0.08 1.57 -0.12 0.00 -1.81 0.00 0.00 61.98 61.53 1h56 s VAL 50 Cb -0.14 -4.00 -0.05 0.00 0.56 0.00 0.00 36.38 32.75 1h56 s VAL 50 CO -0.01 0.30 0.29 -0.76 -0.31 0.00 0.00 175.10 174.61 1h56 s LEU 51 N -0.67 4.35 0.00 1.32 1.43 -0.77 -4.97 118.68 119.37 1h56 s LEU 51 Ca 0.48 0.64 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 1h56 s LEU 51 Cb -0.30 -2.37 0.00 0.00 0.03 0.00 0.00 46.19 43.55 1h56 s LEU 51 CO 0.37 0.25 0.00 -0.81 0.23 0.00 0.00 176.35 176.38 1h56 n PRO 52 N 2.64 0.00 0.00 1.29 -0.04 -1.26 -4.91 135.00 132.71 1h56 n PRO 52 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 1h56 n PRO 52 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 1h56 n PRO 52 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1h56 n GLY 53 N 0.59 0.55 0.00 0.55 0.00 -1.26 -4.77 105.19 100.85 1h56 n GLY 53 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.18 1h56 n GLY 53 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1h56 n ARG 54 N -0.03 0.00 -3.11 1.61 0.00 -1.26 -4.98 116.66 108.89 1h56 n ARG 54 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 57.85 57.63 1h56 n ARG 54 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 32.46 32.42 1h56 n ARG 54 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1h56 n GLU 55 N 0.00 1.78 0.00 -0.14 4.07 -1.26 -4.99 120.64 120.10 1h56 n GLU 55 Ca 0.00 -3.92 0.00 0.00 -0.06 0.00 0.00 57.16 53.18 1h56 n GLU 55 Cb 0.00 -1.89 0.00 0.00 -0.06 0.00 0.00 31.44 29.49 1h56 n GLU 55 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1h56 n GLY 56 N 0.16 0.49 3.80 8.31 0.00 -1.26 -5.04 105.19 111.64 1h56 n GLY 56 Ca 0.27 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.90 1h56 n GLY 56 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1h56 s ASN 57 N -0.05 7.04 0.00 1.61 3.84 -1.26 -5.02 114.94 121.10 1h56 s ASN 57 Ca 0.00 1.23 0.00 0.00 0.21 0.00 0.00 52.86 54.30 1h56 s ASN 57 Cb 0.00 -2.36 0.00 0.00 -0.55 0.00 0.00 41.25 38.34 1h56 s ASN 57 CO 0.00 0.22 0.00 0.47 -2.79 0.00 0.00 177.10 175.00 1h56 n ASP 58 N 2.03 0.00 -4.73 -4.21 8.00 -0.73 -4.76 116.55 112.15 1h56 n ASP 58 Ca -0.09 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.18 1h56 n ASP 58 Cb 0.51 0.00 0.10 0.00 -0.02 0.00 0.00 41.12 41.71 1h56 n ASP 58 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h56 s ALA 59 N -4.00 3.93 -0.15 2.24 0.00 -0.94 -1.85 121.76 120.99 1h56 s ALA 59 Ca 0.00 -1.88 -0.20 0.00 0.00 0.00 0.00 51.96 49.88 1h56 s ALA 59 Cb 0.00 -1.86 0.05 0.00 0.00 0.00 0.00 23.12 21.31 1h56 s ALA 59 CO 0.00 -1.39 0.53 0.14 0.00 0.00 0.00 175.76 175.04 1h56 s VAL 60 N -3.07 0.01 0.12 0.00 -7.23 -0.79 0.70 120.40 110.14 1h56 s VAL 60 Ca 0.66 -0.07 -0.01 0.00 -1.81 0.00 0.00 61.98 60.76 1h56 s VAL 60 Cb -0.05 -0.77 0.03 0.00 0.56 0.00 0.00 36.38 36.15 1h56 s VAL 60 CO 0.44 -0.04 0.17 -0.90 -0.31 0.00 0.00 175.10 174.46 1h56 n ASP 61 N 2.28 0.16 -0.05 4.85 5.68 -0.13 -2.61 116.55 126.73 1h56 n ASP 61 Ca -0.16 -1.15 -0.06 0.00 -0.50 0.00 0.00 54.79 52.92 1h56 n ASP 61 Cb 0.56 -0.11 0.13 0.00 -1.14 0.00 0.00 41.12 40.56 1h56 n ASP 61 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 1h56 h ASN 62 N -0.14 0.68 0.49 -1.12 2.35 -1.89 -2.14 115.58 113.80 1h56 h ASN 62 Ca -0.06 -0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 1h56 h ASN 62 Cb 0.19 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1h56 h ASN 62 CO 0.05 0.89 0.00 0.00 -1.65 0.00 0.00 177.43 176.72 1h56 h ALA 63 N 1.17 1.00 0.00 -0.83 0.00 -2.01 -3.45 119.26 115.14 1h56 h ALA 63 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1h56 h ALA 63 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1h56 h ALA 63 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 1h56 n GLY 64 N -0.49 0.32 3.67 0.00 0.00 -0.81 -5.03 105.19 102.86 1h56 n GLY 64 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1h56 n GLY 64 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1h56 s GLN 65 N -0.93 4.18 0.40 1.61 2.00 -1.26 -4.69 119.66 120.96 1h56 s GLN 65 Ca 0.00 2.34 -0.11 0.00 -2.00 0.00 0.00 55.36 55.60 1h56 s GLN 65 Cb 0.00 -3.88 -0.07 0.00 0.80 0.00 0.00 33.01 29.87 1h56 s GLN 65 CO 0.00 -0.83 0.77 -1.21 -0.50 0.00 0.00 175.29 173.52 1h56 s GLU 66 N 3.60 3.79 0.10 1.67 2.02 -1.26 -0.96 118.70 127.67 1h56 s GLU 66 Ca 0.77 0.48 0.05 0.00 0.02 0.00 0.00 54.97 56.29 1h56 s GLU 66 Cb -0.38 -2.39 -0.04 0.00 0.10 0.00 0.00 34.13 31.42 1h56 s GLU 66 CO 0.33 -0.03 -0.12 0.71 0.02 0.00 0.00 175.26 176.17 1h56 s TYR 67 N -2.35 1.21 -0.02 1.61 1.51 0.22 -4.31 117.35 115.22 1h56 s TYR 67 Ca 0.51 -0.58 -0.02 0.00 -1.01 0.00 0.00 57.07 55.97 1h56 s TYR 67 Cb -0.10 -0.65 -0.04 0.00 -0.11 0.00 0.00 41.96 41.06 1h56 s TYR 67 CO 0.31 0.06 0.11 -1.21 -1.11 0.00 0.00 175.55 173.71 1h56 s GLU 68 N -2.57 3.20 -0.11 -0.62 0.41 -0.86 -1.77 118.70 116.38 1h56 s GLU 68 Ca 0.05 -0.40 -0.03 0.00 -0.41 0.00 0.00 54.97 54.18 1h56 s GLU 68 Cb -0.05 -2.95 0.04 0.00 -1.78 0.00 0.00 34.13 29.40 1h56 s GLU 68 CO 0.02 0.67 0.06 -1.17 -0.49 0.00 0.00 175.26 174.35 1h56 s LEU 69 N -1.68 0.38 0.00 1.80 2.96 -1.26 0.56 118.68 121.44 1h56 s LEU 69 Ca 0.23 -0.30 0.02 0.00 -0.22 0.00 0.00 54.13 53.86 1h56 s LEU 69 Cb -0.12 -0.26 -0.04 0.00 0.50 0.00 0.00 46.19 46.27 1h56 s LEU 69 CO 0.14 -0.29 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.31 1h56 s LYS 70 N 2.10 2.68 0.08 1.98 3.01 0.05 -4.96 119.74 124.68 1h56 s LYS 70 Ca 0.03 -0.66 0.06 0.00 -1.01 0.00 0.00 55.97 54.39 1h56 s LYS 70 Cb -0.14 -2.60 -0.03 0.00 -1.01 0.00 0.00 37.83 34.05 1h56 s LYS 70 CO -0.06 0.61 -0.16 -1.12 0.51 0.00 0.00 175.35 175.13 1h56 s SER 71 N -1.51 1.94 -0.01 2.83 0.01 -1.26 0.11 113.70 115.81 1h56 s SER 71 Ca 0.19 -0.63 -0.12 0.00 1.31 0.00 0.00 55.95 56.69 1h56 s SER 71 Cb -0.11 -0.08 0.01 0.00 0.21 0.00 0.00 66.02 66.05 1h56 s SER 71 CO 0.09 -0.03 0.24 -0.51 0.41 0.00 0.00 173.24 173.44 1h56 s ILE 72 N -1.23 0.07 -0.39 1.44 1.10 -0.18 -4.74 121.20 117.27 1h56 s ILE 72 Ca 0.01 -0.54 -0.07 0.00 -0.51 0.00 0.00 60.65 59.53 1h56 s ILE 72 Cb -0.10 -0.54 0.07 0.00 0.15 0.00 0.00 42.46 42.05 1h56 s ILE 72 CO 0.03 -0.30 0.20 0.21 -2.11 0.00 0.00 174.94 172.97 1h56 s ASN 73 N -1.31 5.46 0.21 4.50 3.84 -1.26 -0.35 114.94 126.04 1h56 s ASN 73 Ca -0.14 -1.51 0.13 0.00 0.21 0.00 0.00 52.86 51.55 1h56 s ASN 73 Cb -0.06 -1.92 0.70 0.00 -0.55 0.00 0.00 41.25 39.42 1h56 s ASN 73 CO 0.03 -0.48 1.36 0.00 -2.79 0.00 0.00 177.10 175.22 1h56 n ILE 74 N 4.82 1.26 0.08 -5.21 0.13 0.21 -0.66 119.36 120.00 1h56 n ILE 74 Ca -0.09 0.66 -0.12 0.00 -1.10 0.00 0.00 62.75 62.09 1h56 n ILE 74 Cb 0.43 -1.66 -0.13 0.00 -0.84 0.00 0.00 39.64 37.44 1h56 n ILE 74 CO 0.00 0.00 0.00 0.44 2.80 0.00 0.00 176.55 179.79 1h56 h ASP 75 N 0.00 0.24 0.00 9.51 3.32 -1.93 -3.41 116.42 124.15 1h56 h ASP 75 Ca 0.00 -0.27 -0.29 0.00 0.02 0.00 0.00 57.03 56.50 1h56 h ASP 75 Cb 0.11 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.54 1h56 h ASP 75 CO 0.00 1.21 -1.92 0.18 -1.72 0.00 0.00 179.24 176.99 1h56 n LEU 76 N -3.45 1.70 -4.76 1.55 4.77 0.17 -5.07 117.00 111.91 1h56 n LEU 76 Ca -0.06 0.29 -0.24 0.00 -0.03 0.00 0.00 56.01 55.98 1h56 n LEU 76 Cb 0.99 -0.69 -0.07 0.00 -2.33 0.00 0.00 43.42 41.33 1h56 n LEU 76 CO 0.51 0.26 -0.14 0.28 -1.33 0.00 0.00 177.39 176.97 1h56 s THR 77 N -2.52 2.43 0.00 -5.08 -1.32 -0.20 -5.06 115.64 103.88 1h56 s THR 77 Ca -0.31 -1.64 0.00 0.00 -1.21 0.00 0.00 61.69 58.53 1h56 s THR 77 Cb 0.10 -2.99 0.00 0.00 -1.51 0.00 0.00 72.50 68.10 1h56 s THR 77 CO 0.40 -0.02 0.49 1.17 -2.21 0.00 0.00 174.62 174.46 1h56 n LYS 78 N -1.28 0.55 -3.92 7.08 4.81 -1.26 -4.21 118.16 119.93 1h56 n LYS 78 Ca -0.01 -0.61 -0.10 0.00 -0.87 0.00 0.00 58.31 56.72 1h56 n LYS 78 Cb 0.64 -0.70 -0.10 0.00 0.02 0.00 0.00 35.03 34.89 1h56 n LYS 78 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 1h56 s GLY 79 N -0.23 0.13 0.05 3.14 0.00 -1.26 -1.92 107.32 107.23 1h56 s GLY 79 Ca 0.00 -0.37 -0.12 0.00 0.00 0.00 0.00 44.72 44.22 1h56 s GLY 79 CO 0.00 -0.49 0.42 -1.36 0.00 0.00 0.00 173.10 171.67 1h56 s PHE 80 N -1.79 3.65 0.72 1.90 0.40 -0.57 -4.87 117.98 117.42 1h56 s PHE 80 Ca -0.12 0.91 -0.12 0.00 -0.60 0.00 0.00 56.93 57.00 1h56 s PHE 80 Cb -0.06 -2.24 0.03 0.00 0.51 0.00 0.00 43.02 41.26 1h56 s PHE 80 CO -0.01 0.56 1.09 -1.12 0.70 0.00 0.00 175.22 176.44 1h56 s SER 81 N -1.46 4.92 0.00 1.36 0.01 -1.26 -3.17 113.70 114.10 1h56 s SER 81 Ca 0.29 1.82 0.00 0.00 1.31 0.00 0.00 55.95 59.38 1h56 s SER 81 Cb -0.15 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.55 1h56 s SER 81 CO 0.16 -1.76 0.00 0.35 0.41 0.00 0.00 173.24 172.40 1h56 n THR 82 N -3.07 0.00 0.00 1.44 -2.24 -1.25 -4.93 114.28 104.23 1h56 n THR 82 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1h56 n THR 82 Cb 0.53 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 1h56 n THR 82 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1h56 n HIS 83 N -2.56 0.00 0.26 4.78 -0.00 -1.26 -5.04 115.22 111.40 1h56 n HIS 83 Ca 0.00 0.00 0.10 0.00 0.46 0.00 0.00 57.72 58.28 1h56 n HIS 83 Cb 0.19 0.00 0.70 0.00 -0.12 0.00 0.00 29.99 30.76 1h56 n HIS 83 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1h56 h HIS 84 N 0.00 0.00 -3.18 1.57 3.86 -1.89 -0.84 115.15 114.67 1h56 h HIS 84 Ca 0.00 0.00 -0.64 0.00 -1.16 0.00 0.00 60.37 58.57 1h56 h HIS 84 Cb 0.00 0.00 -0.40 0.00 1.06 0.00 0.00 27.41 28.07 1h56 h HIS 84 CO 0.00 0.06 -0.47 -1.01 0.86 0.00 0.00 177.93 177.37 1h56 s HIS 85 N -4.74 3.61 -0.25 2.45 3.76 -1.26 -3.08 115.29 115.78 1h56 s HIS 85 Ca -0.04 -3.24 -0.11 0.00 -0.15 0.00 0.00 55.06 51.51 1h56 s HIS 85 Cb 0.16 -2.85 -0.05 0.00 1.11 0.00 0.00 32.58 30.95 1h56 s HIS 85 CO 0.63 -0.61 0.19 1.41 -0.85 0.00 0.00 174.74 175.50 1h56 s MET 86 N -1.29 4.03 0.06 1.40 0.00 -0.81 -4.93 119.30 117.77 1h56 s MET 86 Ca 0.24 -0.26 0.01 0.00 0.00 0.00 0.00 55.69 55.68 1h56 s MET 86 Cb -0.08 -3.58 -0.00 0.00 0.00 0.00 0.00 34.83 31.17 1h56 s MET 86 CO -0.14 -0.03 0.02 0.27 0.00 0.00 0.00 175.02 175.14 1h56 n ASN 87 N 4.57 1.13 0.13 1.11 0.23 -1.26 -1.60 115.26 119.57 1h56 n ASN 87 Ca -0.14 -1.33 0.13 0.00 -0.53 0.00 0.00 54.58 52.71 1h56 n ASN 87 Cb 0.52 0.14 0.47 0.00 -2.08 0.00 0.00 39.78 38.83 1h56 n ASN 87 CO 0.00 0.00 0.00 1.55 -0.93 0.00 0.00 177.26 177.88 1h56 h PRO 88 N 0.00 0.00 0.05 -0.53 0.13 -1.95 -2.44 132.00 127.25 1h56 h PRO 88 Ca -0.05 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.99 1h56 h PRO 88 Cb 0.18 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.32 1h56 h PRO 88 CO 0.08 0.00 -0.40 0.28 -0.23 0.00 0.00 178.00 177.73 1h56 h VAL 89 N 0.00 1.60 0.83 1.56 2.07 -1.97 -1.44 116.25 118.89 1h56 h VAL 89 Ca 0.00 -2.28 -0.04 0.00 0.82 0.00 0.00 66.70 65.20 1h56 h VAL 89 Cb 0.51 3.09 0.00 0.00 -1.52 0.00 0.00 31.29 33.37 1h56 h VAL 89 CO 0.00 0.62 -0.48 0.40 0.02 0.00 0.00 177.57 178.14 1h56 h ILE 90 N -0.57 0.00 -0.92 4.57 1.08 -1.92 -2.07 117.51 117.68 1h56 h ILE 90 Ca -0.06 0.00 0.24 0.00 -0.39 0.00 0.00 64.86 64.64 1h56 h ILE 90 Cb 1.25 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.94 1h56 h ILE 90 CO 0.08 0.00 0.63 0.40 -0.69 0.00 0.00 178.15 178.56 1h56 h ILE 91 N -1.22 0.60 0.00 -0.67 2.04 -1.55 0.62 117.51 117.34 1h56 h ILE 91 Ca -0.11 -0.07 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 1h56 h ILE 91 Cb 0.96 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 1h56 h ILE 91 CO 0.14 0.04 -0.34 0.00 0.00 0.00 0.00 178.15 177.98 1h56 h ALA 92 N 1.58 1.40 0.10 1.87 0.00 -0.67 -2.91 119.26 120.63 1h56 h ALA 92 Ca 0.46 -0.31 -0.18 0.00 0.00 0.00 0.00 54.91 54.88 1h56 h ALA 92 Cb 1.46 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 19.20 1h56 h ALA 92 CO -0.11 0.43 -0.86 -0.22 0.00 0.00 0.00 179.25 178.49 1h56 h LYS 93 N 0.00 0.21 0.00 0.00 3.64 0.86 -3.35 116.57 117.93 1h56 h LYS 93 Ca -0.00 -0.35 -0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1h56 h LYS 93 Cb 0.62 0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1h56 h LYS 93 CO 0.04 1.17 -0.00 1.88 -2.27 0.00 0.00 179.45 180.27 1h56 h TYR 94 N -0.52 0.00 -0.47 1.91 0.05 -1.23 -2.74 116.97 113.97 1h56 h TYR 94 Ca -0.17 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.42 1h56 h TYR 94 Cb 1.53 0.00 -0.11 0.00 1.01 0.00 0.00 36.73 39.16 1h56 h TYR 94 CO 0.19 0.00 0.23 2.89 -1.05 0.00 0.00 178.16 180.42 1h56 n ARG 95 N -3.09 2.25 0.00 4.88 1.85 -1.10 -3.99 116.66 117.45 1h56 n ARG 95 Ca -0.03 -1.71 0.00 0.00 -1.00 0.00 0.00 57.85 55.11 1h56 n ARG 95 Cb 0.07 -1.76 0.00 0.00 -1.05 0.00 0.00 32.46 29.72 1h56 n ARG 95 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1h56 n GLN 96 N -0.14 1.16 -4.61 2.89 6.02 -1.03 -4.93 117.38 116.75 1h56 n GLN 96 Ca 0.27 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 57.02 1h56 n GLN 96 Cb 1.02 -0.91 -0.14 0.00 1.02 0.00 0.00 30.24 31.23 1h56 n GLN 96 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1h56 s VAL 97 N -1.65 1.38 0.73 5.09 -7.23 -1.26 -4.96 120.40 112.50 1h56 s VAL 97 Ca 0.00 -0.97 -0.11 0.00 -1.81 0.00 0.00 61.98 59.09 1h56 s VAL 97 Cb 0.00 -1.20 0.03 0.00 0.56 0.00 0.00 36.38 35.78 1h56 s VAL 97 CO 0.00 0.20 1.08 -2.16 -0.31 0.00 0.00 175.10 173.92 1h56 s PRO 98 N -0.89 2.53 -0.03 4.82 0.04 -1.26 -4.53 135.00 135.68 1h56 s PRO 98 Ca 0.05 1.14 0.01 0.00 0.04 0.00 0.00 61.00 62.24 1h56 s PRO 98 Cb -0.08 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 1h56 s PRO 98 CO 0.01 -1.43 -0.01 -1.58 0.04 0.00 0.00 177.00 174.03 1h56 s TRP 99 N -2.86 3.08 -0.24 0.56 0.52 -0.74 -2.03 118.94 117.24 1h56 s TRP 99 Ca 0.61 0.10 -0.07 0.00 0.02 0.00 0.00 56.10 56.76 1h56 s TRP 99 Cb -0.17 -1.70 -0.03 0.00 -1.15 0.00 0.00 33.47 30.42 1h56 s TRP 99 CO 0.53 0.45 0.05 0.42 0.02 0.00 0.00 176.95 178.43 1h56 s ILE 100 N -1.00 4.25 -0.24 2.03 -1.09 0.19 -2.08 121.20 123.26 1h56 s ILE 100 Ca 0.17 -0.20 -0.07 0.00 -2.23 0.00 0.00 60.65 58.32 1h56 s ILE 100 Cb -0.11 -2.97 -0.03 0.00 -1.58 0.00 0.00 42.46 37.76 1h56 s ILE 100 CO 0.07 0.37 0.07 -0.36 -1.23 0.00 0.00 174.94 173.86 1h56 s PHE 101 N 1.42 3.10 -0.18 3.97 0.40 0.20 -0.77 117.98 126.11 1h56 s PHE 101 Ca 0.05 -0.37 -0.06 0.00 -0.60 0.00 0.00 56.93 55.96 1h56 s PHE 101 Cb -0.15 -2.23 -0.03 0.00 0.51 0.00 0.00 43.02 41.12 1h56 s PHE 101 CO 0.03 -0.32 0.02 0.00 0.70 0.00 0.00 175.22 175.65 1h56 s ALA 102 N 1.53 3.18 -0.34 5.36 0.00 0.12 -1.38 121.76 130.22 1h56 s ALA 102 Ca 0.06 -0.83 -0.05 0.00 0.00 0.00 0.00 51.96 51.14 1h56 s ALA 102 Cb -0.15 -1.77 0.05 0.00 0.00 0.00 0.00 23.12 21.25 1h56 s ALA 102 CO 0.04 0.11 0.10 0.42 0.00 0.00 0.00 175.76 176.42 1h56 s ILE 103 N 0.53 3.52 0.07 0.00 1.01 -0.71 -1.01 121.20 124.60 1h56 s ILE 103 Ca 0.00 -1.33 0.03 0.00 0.00 0.00 0.00 60.65 59.35 1h56 s ILE 103 Cb -0.14 -3.06 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 1h56 s ILE 103 CO 0.02 -0.24 0.05 -0.31 0.00 0.00 0.00 174.94 174.46 1h56 s TYR 104 N 1.33 3.13 -0.44 3.97 1.51 0.53 -0.54 117.35 126.84 1h56 s TYR 104 Ca -0.01 0.06 0.03 0.00 -1.01 0.00 0.00 57.07 56.14 1h56 s TYR 104 Cb -0.20 -1.61 0.12 0.00 -0.11 0.00 0.00 41.96 40.16 1h56 s TYR 104 CO 0.01 0.51 0.20 0.50 -1.11 0.00 0.00 175.55 175.66 1h56 s ARG 105 N -2.24 1.53 2.26 -0.62 3.52 -0.37 -0.62 118.95 122.42 1h56 s ARG 105 Ca 0.27 -2.13 0.00 0.00 -0.13 0.00 0.00 55.73 53.74 1h56 s ARG 105 Cb -0.12 -2.83 0.00 0.00 -1.56 0.00 0.00 34.95 30.44 1h56 s ARG 105 CO 0.19 -1.09 0.00 0.41 -0.81 0.00 0.00 175.30 174.01 1h56 n GLY 106 N 3.62 0.72 0.44 8.12 0.00 -1.26 -3.54 105.19 113.29 1h56 n GLY 106 Ca 0.05 -1.19 0.11 0.00 0.00 0.00 0.00 46.02 44.99 1h56 n GLY 106 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1h56 n ILE 107 N 0.00 0.00 -3.35 -0.61 -5.35 -1.26 -4.91 119.36 103.87 1h56 n ILE 107 Ca 0.00 -0.23 -0.38 0.00 -0.27 0.00 0.00 62.75 61.87 1h56 n ILE 107 Cb 0.00 1.18 -0.06 0.00 -1.74 0.00 0.00 39.64 39.02 1h56 n ILE 107 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1h56 s ALA 108 N -2.52 3.60 0.25 -1.28 0.00 -1.23 -4.80 121.76 115.77 1h56 s ALA 108 Ca 0.18 -0.09 -0.26 0.00 0.00 0.00 0.00 51.96 51.79 1h56 s ALA 108 Cb 0.18 -2.56 -0.09 0.00 0.00 0.00 0.00 23.12 20.65 1h56 s ALA 108 CO 0.59 0.34 0.86 -1.50 0.00 0.00 0.00 175.76 176.06 1h56 s ILE 109 N -0.71 4.28 -0.02 0.00 2.07 -1.26 -1.23 121.20 124.32 1h56 s ILE 109 Ca 0.27 1.77 0.02 0.00 -1.41 0.00 0.00 60.65 61.29 1h56 s ILE 109 Cb -0.18 -4.09 -0.02 0.00 0.13 0.00 0.00 42.46 38.30 1h56 s ILE 109 CO 0.15 0.33 0.00 -0.62 -1.91 0.00 0.00 174.94 172.90 1h56 n GLU 110 N 1.06 3.13 -3.69 3.50 -0.58 0.30 -4.87 120.64 119.49 1h56 n GLU 110 Ca -0.02 0.00 -0.08 0.00 -0.42 0.00 0.00 57.16 56.64 1h56 n GLU 110 Cb 0.49 -1.05 -0.02 0.00 -0.57 0.00 0.00 31.44 30.29 1h56 n GLU 110 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1h56 s ALA 111 N -2.05 -1.42 -0.18 0.62 0.00 -1.13 -5.03 121.76 112.57 1h56 s ALA 111 Ca -0.01 0.07 -0.07 0.00 0.00 0.00 0.00 51.96 51.94 1h56 s ALA 111 Cb 0.01 0.81 0.08 0.00 0.00 0.00 0.00 23.12 24.02 1h56 s ALA 111 CO 0.08 -0.94 0.38 0.42 0.00 0.00 0.00 175.76 175.71 1h56 s ILE 112 N -3.75 -0.48 0.34 0.00 1.01 -0.00 -1.74 121.20 116.57 1h56 s ILE 112 Ca 0.08 0.18 0.09 0.00 0.00 0.00 0.00 60.65 61.00 1h56 s ILE 112 Cb -0.04 -0.61 -0.06 0.00 0.01 0.00 0.00 42.46 41.77 1h56 s ILE 112 CO -0.01 0.07 -0.04 -0.31 0.00 0.00 0.00 174.94 174.66 1h56 s TYR 113 N 2.33 2.48 -0.08 3.97 1.51 -0.48 0.21 117.35 127.29 1h56 s TYR 113 Ca -0.03 -0.45 -0.02 0.00 -1.01 0.00 0.00 57.07 55.57 1h56 s TYR 113 Cb -0.11 -1.41 0.03 0.00 -0.11 0.00 0.00 41.96 40.36 1h56 s TYR 113 CO -0.12 0.54 0.01 0.50 -1.11 0.00 0.00 175.55 175.37 1h56 s ARG 114 N -3.66 0.51 -0.16 -0.62 3.52 0.05 -0.63 118.95 117.95 1h56 s ARG 114 Ca 0.34 0.10 -0.07 0.00 -0.13 0.00 0.00 55.73 55.96 1h56 s ARG 114 Cb 0.00 -1.01 -0.04 0.00 -1.56 0.00 0.00 34.95 32.34 1h56 s ARG 114 CO 0.18 -0.34 0.09 -0.51 -0.81 0.00 0.00 175.30 173.91 1h56 s LEU 115 N 1.99 4.01 0.56 -0.88 2.01 -0.88 -1.31 118.68 124.18 1h56 s LEU 115 Ca 0.05 0.21 -0.08 0.00 0.01 0.00 0.00 54.13 54.31 1h56 s LEU 115 Cb -0.13 -2.00 -0.04 0.00 0.01 0.00 0.00 46.19 44.03 1h56 s LEU 115 CO -0.05 0.25 0.92 -1.61 1.01 0.00 0.00 176.35 176.87 1h56 s GLU 116 N -0.05 3.54 0.48 1.70 0.41 -1.26 -1.79 118.70 121.73 1h56 s GLU 116 Ca 0.08 0.49 0.32 0.00 -0.41 0.00 0.00 54.97 55.44 1h56 s GLU 116 Cb -0.12 -2.21 1.42 0.00 -1.78 0.00 0.00 34.13 31.45 1h56 s GLU 116 CO 0.01 -0.43 1.73 -1.35 -0.49 0.00 0.00 175.26 174.72 1h56 h PRO 117 N -0.09 0.12 -0.03 0.39 0.11 -1.92 0.58 132.00 131.16 1h56 h PRO 117 Ca -0.45 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 65.48 1h56 h PRO 117 Cb 1.20 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1h56 h PRO 117 CO 0.62 0.08 -0.73 1.57 -0.21 0.00 0.00 178.00 179.33 1h56 h LYS 118 N 0.13 0.21 0.00 1.05 2.10 -1.93 -3.06 116.57 115.07 1h56 h LYS 118 Ca 0.68 -0.18 0.00 0.00 -2.00 0.00 0.00 60.65 59.15 1h56 h LYS 118 Cb 2.32 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 33.69 1h56 h LYS 118 CO -0.18 0.85 0.00 -0.25 -2.00 0.00 0.00 179.45 177.87 1h56 n ASP 119 N -3.77 0.06 -0.14 7.07 8.00 0.20 -1.64 116.55 126.34 1h56 n ASP 119 Ca -0.03 0.52 0.02 0.00 0.71 0.00 0.00 54.79 56.01 1h56 n ASP 119 Cb 0.71 -0.53 0.01 0.00 -0.02 0.00 0.00 41.12 41.29 1h56 n ASP 119 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1h56 n LEU 120 N -1.57 1.16 -0.29 0.64 4.77 -1.19 -4.68 117.00 115.85 1h56 n LEU 120 Ca 0.02 -0.93 0.08 0.00 -0.03 0.00 0.00 56.01 55.16 1h56 n LEU 120 Cb 0.11 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.44 1h56 n LEU 120 CO 0.09 0.26 1.07 -0.08 -1.33 0.00 0.00 177.39 177.40 1h56 h GLU 121 N 0.66 0.51 -0.76 3.23 4.57 -1.21 0.33 114.58 121.91 1h56 h GLU 121 Ca 0.00 -0.03 0.21 0.00 -1.18 0.00 0.00 59.36 58.36 1h56 h GLU 121 Cb 0.15 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 28.59 1h56 h GLU 121 CO 0.00 0.34 0.54 0.35 -1.18 0.00 0.00 179.01 179.06 1h56 h PHE 122 N 0.52 0.09 0.00 0.92 3.04 -1.84 0.28 116.94 119.96 1h56 h PHE 122 Ca 0.48 0.00 -0.23 0.00 3.98 0.00 0.00 57.97 62.20 1h56 h PHE 122 Cb 0.76 -0.03 -0.04 0.00 2.56 0.00 0.00 35.95 39.20 1h56 h PHE 122 CO -0.12 0.03 -1.56 0.66 -2.02 0.00 0.00 178.31 175.29 1h56 n TYR 123 N -4.35 1.00 0.07 0.41 4.01 0.10 -3.65 117.16 114.75 1h56 n TYR 123 Ca 0.15 0.35 -0.11 0.00 -0.16 0.00 0.00 57.90 58.13 1h56 n TYR 123 Cb 0.79 -1.14 -0.08 0.00 -0.31 0.00 0.00 39.34 38.60 1h56 n TYR 123 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 1h56 h TYR 124 N 0.00 -0.23 -0.10 -0.72 0.05 0.09 -1.49 116.97 114.57 1h56 h TYR 124 Ca -0.23 -0.01 0.03 0.00 0.05 0.00 0.00 58.73 58.58 1h56 h TYR 124 Cb 1.81 0.08 -0.00 0.00 1.01 0.00 0.00 36.73 39.62 1h56 h TYR 124 CO 0.00 0.19 0.09 -0.44 -1.05 0.00 0.00 178.16 176.95 1h56 h ASP 125 N -0.85 0.00 0.03 3.88 3.32 -1.38 -1.01 116.42 120.40 1h56 h ASP 125 Ca -0.03 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1h56 h ASP 125 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1h56 h ASP 125 CO 0.04 0.00 -0.01 0.50 -1.72 0.00 0.00 179.24 178.05 1h56 h LYS 126 N 0.00 -0.04 -0.01 3.56 3.64 -1.62 -2.17 116.57 119.93 1h56 h LYS 126 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1h56 h LYS 126 Cb 0.24 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1h56 h LYS 126 CO -0.00 0.42 0.08 -1.49 -2.27 0.00 0.00 179.45 176.19 1h56 h TRP 127 N -0.98 0.00 0.10 1.91 6.55 -0.99 -1.59 115.95 120.94 1h56 h TRP 127 Ca -0.00 0.00 -0.25 0.00 0.95 0.00 0.00 58.89 59.58 1h56 h TRP 127 Cb 0.48 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.77 1h56 h TRP 127 CO 0.12 0.00 -1.31 1.49 -1.05 0.00 0.00 178.44 177.69 1h56 h GLU 128 N 0.00 0.20 0.00 0.49 4.81 -1.25 -2.76 114.58 116.08 1h56 h GLU 128 Ca 0.01 -0.35 -0.00 0.00 -0.13 0.00 0.00 59.36 58.89 1h56 h GLU 128 Cb 0.17 0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 1h56 h GLU 128 CO -0.00 1.17 -0.01 0.00 -0.73 0.00 0.00 179.01 179.43 1h56 h ARG 129 N -0.41 0.00 0.25 1.92 3.08 -0.75 -2.49 114.38 115.98 1h56 h ARG 129 Ca -0.29 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.75 1h56 h ARG 129 Cb 1.67 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.72 1h56 h ARG 129 CO 0.03 0.01 -0.12 0.87 -1.07 0.00 0.00 179.97 179.69 1h56 h LYS 130 N 0.00 -0.32 -1.71 0.04 1.79 -1.40 -2.46 116.57 112.51 1h56 h LYS 130 Ca -0.00 0.02 0.50 0.00 -2.18 0.00 0.00 60.65 58.99 1h56 h LYS 130 Cb 0.03 0.07 -0.07 0.00 -1.58 0.00 0.00 32.23 30.69 1h56 h LYS 130 CO 0.00 -0.10 1.33 1.87 -1.08 0.00 0.00 179.45 181.47 1h56 n TRP 131 N -5.00 0.00 -0.09 -1.35 -0.00 -0.95 -0.07 117.44 109.99 1h56 n TRP 131 Ca -0.06 0.00 -0.16 0.00 -0.00 0.00 0.00 57.50 57.28 1h56 n TRP 131 Cb 0.19 -0.43 -0.09 0.00 -0.00 0.00 0.00 31.31 30.98 1h56 n TRP 131 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 177.69 179.57 1h56 h TYR 132 N 0.00 0.00 -0.21 5.87 0.05 -1.55 0.27 116.97 121.39 1h56 h TYR 132 Ca 0.81 0.00 0.06 0.00 0.05 0.00 0.00 58.73 59.65 1h56 h TYR 132 Cb 3.46 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 41.14 1h56 h TYR 132 CO 0.00 1.07 -0.21 0.77 -1.05 0.00 0.00 178.16 178.74 1h56 h SER 133 N -1.00 -0.66 0.05 3.88 0.02 0.02 0.25 113.55 116.11 1h56 h SER 133 Ca -0.21 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1h56 h SER 133 Cb 1.04 0.32 0.00 0.00 0.14 0.00 0.00 62.40 63.90 1h56 h SER 133 CO -0.13 -0.25 0.00 0.47 -1.14 0.00 0.00 176.83 175.78 1h56 n ASP 134 N -5.35 0.00 -0.52 3.07 8.00 -0.47 -4.80 116.55 116.47 1h56 n ASP 134 Ca -0.01 0.41 0.00 0.00 0.71 0.00 0.00 54.79 55.89 1h56 n ASP 134 Cb 0.27 -0.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.95 1h56 n ASP 134 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1h56 n GLY 135 N -1.24 0.87 2.54 0.44 0.00 0.86 -4.36 105.19 104.31 1h56 n GLY 135 Ca 0.01 -0.58 -0.20 0.00 0.00 0.00 0.00 46.02 45.24 1h56 n GLY 135 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1h56 n HIS 136 N -0.52 -0.22 -3.24 1.61 8.25 0.89 -4.96 115.22 117.03 1h56 n HIS 136 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.07 1h56 n HIS 136 Cb 0.18 -3.52 -0.06 0.00 1.12 0.00 0.00 29.99 27.71 1h56 n HIS 136 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1h56 s LYS 137 N -4.02 4.27 0.70 -0.41 1.02 -0.84 -4.98 119.74 115.48 1h56 s LYS 137 Ca 0.00 0.71 -0.12 0.00 0.02 0.00 0.00 55.97 56.58 1h56 s LYS 137 Cb 0.00 -3.31 0.02 0.00 -0.52 0.00 0.00 37.83 34.01 1h56 s LYS 137 CO 0.00 0.44 1.08 -0.51 -0.92 0.00 0.00 175.35 175.45 1h56 s ASP 138 N -0.43 5.06 -0.15 2.83 1.11 -1.26 -4.29 116.67 119.53 1h56 s ASP 138 Ca 0.30 1.80 -0.08 0.00 0.18 0.00 0.00 52.55 54.75 1h56 s ASP 138 Cb -0.18 -2.52 -0.04 0.00 1.07 0.00 0.00 42.92 41.24 1h56 s ASP 138 CO 0.17 -1.66 0.12 -0.63 1.18 0.00 0.00 175.17 174.35 1h56 s ILE 139 N -2.76 5.35 -0.80 0.77 1.09 -0.63 -4.89 121.20 119.33 1h56 s ILE 139 Ca 0.62 0.16 -0.20 0.00 -1.10 0.00 0.00 60.65 60.12 1h56 s ILE 139 Cb -0.17 -3.36 0.11 0.00 -1.06 0.00 0.00 42.46 37.97 1h56 s ILE 139 CO 0.50 0.55 1.03 0.21 -0.10 0.00 0.00 174.94 177.13 1h56 s ASN 140 N -0.49 6.42 -0.89 3.58 3.84 -1.25 -1.92 114.94 124.24 1h56 s ASN 140 Ca 0.12 -1.61 -0.06 0.00 0.21 0.00 0.00 52.86 51.52 1h56 s ASN 140 Cb -0.12 -2.40 0.00 0.00 -0.55 0.00 0.00 41.25 38.19 1h56 s ASN 140 CO 0.02 -1.21 0.68 -3.20 -2.79 0.00 0.00 177.10 170.60 1h56 n ASN 141 N 6.96 -5.78 -4.75 -4.21 5.15 -0.32 -4.87 115.26 107.43 1h56 n ASN 141 Ca 0.11 -0.74 -0.38 0.00 -0.60 0.00 0.00 54.58 52.98 1h56 n ASN 141 Cb 0.47 -3.08 0.03 0.00 -0.53 0.00 0.00 39.78 36.67 1h56 n ASN 141 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1h56 s PRO 142 N -4.72 3.23 -0.03 1.20 0.02 -1.26 -4.71 135.00 128.72 1h56 s PRO 142 Ca 0.12 2.11 0.06 0.00 0.02 0.00 0.00 61.00 63.32 1h56 s PRO 142 Cb -0.05 -2.25 -0.02 0.00 0.02 0.00 0.00 34.50 32.20 1h56 s PRO 142 CO 0.85 -1.08 -0.21 0.15 -0.33 0.00 0.00 177.00 176.38 1h56 s LYS 143 N -2.91 2.28 -0.19 5.54 1.02 -1.26 -3.83 119.74 120.39 1h56 s LYS 143 Ca 0.71 -0.83 -0.15 0.00 0.02 0.00 0.00 55.97 55.72 1h56 s LYS 143 Cb -0.37 -2.19 -0.04 0.00 -0.52 0.00 0.00 37.83 34.70 1h56 s LYS 143 CO 0.44 0.59 0.37 0.42 -0.92 0.00 0.00 175.35 176.25 1h56 s ILE 144 N -0.67 5.23 0.24 2.17 1.01 -1.19 -4.85 121.20 123.13 1h56 s ILE 144 Ca 0.11 0.66 -0.30 0.00 0.00 0.00 0.00 60.65 61.12 1h56 s ILE 144 Cb -0.10 -3.70 -0.09 0.00 0.01 0.00 0.00 42.46 38.57 1h56 s ILE 144 CO -0.00 0.28 1.17 -2.84 0.00 0.00 0.00 174.94 173.55 1h56 s PRO 145 N 1.12 4.54 0.37 2.79 0.02 -1.26 -1.51 135.00 141.07 1h56 s PRO 145 Ca 0.18 1.89 0.11 0.00 0.02 0.00 0.00 61.00 63.20 1h56 s PRO 145 Cb -0.14 -3.20 0.88 0.00 0.02 0.00 0.00 34.50 32.06 1h56 s PRO 145 CO 0.07 0.03 1.89 0.28 -0.33 0.00 0.00 177.00 178.94 1h56 h VAL 146 N 3.38 0.83 -0.84 3.83 2.07 -1.76 0.28 116.25 124.04 1h56 h VAL 146 Ca -0.46 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 66.90 1h56 h VAL 146 Cb 1.21 0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 1h56 h VAL 146 CO 0.70 0.11 0.53 0.50 0.02 0.00 0.00 177.57 179.43 1h56 h LYS 147 N 0.62 0.96 -0.50 1.57 3.64 -1.91 -0.33 116.57 120.61 1h56 h LYS 147 Ca 0.42 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.73 1h56 h LYS 147 Cb 0.74 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.32 1h56 h LYS 147 CO -0.18 0.63 0.28 -0.92 -2.27 0.00 0.00 179.45 176.99 1h56 h TYR 148 N 0.98 0.69 0.00 1.91 5.03 -0.84 -2.52 116.97 122.23 1h56 h TYR 148 Ca 0.36 -0.02 -0.11 0.00 2.58 0.00 0.00 58.73 61.54 1h56 h TYR 148 Cb 0.12 -0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.16 1h56 h TYR 148 CO -0.03 0.51 -0.53 -0.39 -1.32 0.00 0.00 178.16 176.39 1h56 h VAL 149 N 0.67 1.28 0.00 1.81 -1.51 -0.83 -1.90 116.25 115.77 1h56 h VAL 149 Ca 0.18 -1.89 -0.07 0.00 -1.23 0.00 0.00 66.70 63.69 1h56 h VAL 149 Cb 0.05 2.05 -0.01 0.00 -2.13 0.00 0.00 31.29 31.24 1h56 h VAL 149 CO -0.03 0.52 -0.35 0.24 -1.23 0.00 0.00 177.57 176.72 1h56 h MET 150 N 0.00 0.00 0.00 5.19 2.86 -0.83 -2.02 114.93 120.13 1h56 h MET 150 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1h56 h MET 150 Cb 1.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.66 1h56 h MET 150 CO 0.07 0.35 -1.37 0.39 1.06 0.00 0.00 176.91 177.42 1h56 n GLU 151 N -3.46 0.53 -0.06 1.72 1.02 -0.97 -4.58 120.64 114.85 1h56 n GLU 151 Ca 0.00 -0.03 -0.07 0.00 -0.02 0.00 0.00 57.16 57.05 1h56 n GLU 151 Cb 0.52 -1.65 -0.07 0.00 -0.02 0.00 0.00 31.44 30.22 1h56 n GLU 151 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1h56 n HIS 152 N -2.33 0.00 -2.38 -0.32 8.25 -0.73 -5.07 115.22 112.64 1h56 n HIS 152 Ca -0.01 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.21 1h56 n HIS 152 Cb 0.52 -0.49 0.05 0.00 1.12 0.00 0.00 29.99 31.20 1h56 n HIS 152 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1h56 s GLY 153 N -4.78 1.70 -0.07 -1.41 0.00 -0.76 -4.92 107.32 97.08 1h56 s GLY 153 Ca -0.12 -1.00 -0.21 0.00 0.00 0.00 0.00 44.72 43.40 1h56 s GLY 153 CO 0.35 -0.65 0.61 -1.59 0.00 0.00 0.00 173.10 171.81 1h56 s THR 154 N -3.05 5.07 -0.44 0.90 2.01 -0.43 -4.78 115.64 114.93 1h56 s THR 154 Ca 0.58 1.25 -0.26 0.00 0.31 0.00 0.00 61.69 63.57 1h56 s THR 154 Cb -0.11 -3.95 0.02 0.00 0.01 0.00 0.00 72.50 68.48 1h56 s THR 154 CO 0.43 0.31 0.95 -0.75 -0.69 0.00 0.00 174.62 174.86 1h56 s LYS 155 N 0.57 3.64 0.09 4.92 2.20 -1.26 -0.77 119.74 129.12 1h56 s LYS 155 Ca 0.33 0.32 0.14 0.00 -0.36 0.00 0.00 55.97 56.40 1h56 s LYS 155 Cb -0.17 -3.89 -0.13 0.00 -1.51 0.00 0.00 37.83 32.13 1h56 s LYS 155 CO 0.15 -1.16 0.98 0.82 -0.36 0.00 0.00 175.35 175.77 1h56 h ILE 156 N 6.03 0.82 0.00 5.43 2.04 -0.58 -3.49 117.51 127.76 1h56 h ILE 156 Ca -0.24 -2.40 0.00 0.00 1.00 0.00 0.00 64.86 63.23 1h56 h ILE 156 Cb 1.07 2.31 0.00 0.00 -0.74 0.00 0.00 36.82 39.46 1h56 h ILE 156 CO 1.03 0.47 0.00 0.00 0.00 0.00 0.00 178.15 179.64