#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3giu s HIS 2 N 0.00 -1.16 -0.14 0.00 4.02 -1.26 -4.86 115.29 111.89 3giu s HIS 2 Ca 0.00 1.85 -0.00 0.00 1.02 0.00 0.00 55.06 57.93 3giu s HIS 2 Cb 0.00 0.54 -0.01 0.00 -1.02 0.00 0.00 32.58 32.09 3giu s HIS 2 CO 0.00 -0.64 -0.14 0.42 1.02 0.00 0.00 174.74 175.40 3giu s ILE 3 N 2.77 2.93 -0.27 0.60 1.01 0.10 -0.63 121.20 127.71 3giu s ILE 3 Ca 0.01 -0.70 -0.15 0.00 0.00 0.00 0.00 60.65 59.81 3giu s ILE 3 Cb -0.13 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.08 3giu s ILE 3 CO -0.17 0.52 0.40 -0.22 0.00 0.00 0.00 174.94 175.46 3giu s LEU 4 N 0.54 4.06 -0.16 2.97 2.96 -0.14 -0.91 118.68 128.00 3giu s LEU 4 Ca -0.09 0.29 -0.02 0.00 -0.22 0.00 0.00 54.13 54.10 3giu s LEU 4 Cb -0.16 -2.46 -0.02 0.00 0.50 0.00 0.00 46.19 44.06 3giu s LEU 4 CO 0.04 -0.21 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.08 3giu s VAL 5 N 2.11 3.33 0.12 1.68 1.01 0.33 -0.53 120.40 128.45 3giu s VAL 5 Ca 0.16 -0.55 0.09 0.00 0.00 0.00 0.00 61.98 61.68 3giu s VAL 5 Cb -0.16 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 3giu s VAL 5 CO 0.10 0.49 -0.19 0.42 0.00 0.00 0.00 175.10 175.93 3giu s THR 6 N 0.61 2.78 0.22 3.92 -4.23 -0.76 -1.67 115.64 116.51 3giu s THR 6 Ca -0.05 -1.53 0.02 0.00 -1.18 0.00 0.00 61.69 58.95 3giu s THR 6 Cb -0.15 -2.27 -0.05 0.00 1.34 0.00 0.00 72.50 71.37 3giu s THR 6 CO 0.03 0.10 0.02 -0.83 -0.54 0.00 0.00 174.62 173.40 3giu s GLY 7 N -2.14 1.50 0.20 3.99 0.00 -0.85 -0.70 107.32 109.31 3giu s GLY 7 Ca 0.18 -1.74 0.06 0.00 0.00 0.00 0.00 44.72 43.21 3giu s GLY 7 CO 0.10 -1.60 0.18 -1.36 0.00 0.00 0.00 173.10 170.41 3giu s PHE 8 N -3.58 3.18 0.72 1.90 0.08 -1.25 -0.52 117.98 118.50 3giu s PHE 8 Ca 0.29 -0.04 -0.13 0.00 0.12 0.00 0.00 56.93 57.17 3giu s PHE 8 Cb 0.06 -1.48 0.03 0.00 -0.57 0.00 0.00 43.02 41.06 3giu s PHE 8 CO 0.08 0.52 1.11 0.00 -0.10 0.00 0.00 175.22 176.83 3giu s ALA 9 N -1.91 2.33 0.62 5.36 0.00 -0.62 -4.00 121.76 123.54 3giu s ALA 9 Ca 0.32 0.46 -0.18 0.00 0.00 0.00 0.00 51.96 52.56 3giu s ALA 9 Cb -0.09 -3.31 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 3giu s ALA 9 CO 0.25 -1.56 1.23 -2.14 0.00 0.00 0.00 175.76 173.54 3giu s PRO 10 N -4.42 2.77 0.27 0.00 0.02 -1.26 -4.63 135.00 127.75 3giu s PRO 10 Ca 0.65 1.88 -0.14 0.00 0.02 0.00 0.00 61.00 63.41 3giu s PRO 10 Cb -0.20 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.43 3giu s PRO 10 CO 0.48 -1.38 0.54 -0.59 -0.33 0.00 0.00 177.00 175.72 3giu s PHE 11 N -1.59 0.30 -1.39 6.54 -0.12 -1.26 -4.87 117.98 115.59 3giu s PHE 11 Ca 0.78 -0.69 -0.07 0.00 -0.05 0.00 0.00 56.93 56.90 3giu s PHE 11 Cb -0.32 0.30 0.03 0.00 -0.63 0.00 0.00 43.02 42.41 3giu s PHE 11 CO 0.36 -1.08 0.96 -3.47 -0.05 0.00 0.00 175.22 171.94 3giu n ASP 12 N -0.53 -3.88 -0.37 1.98 2.03 -1.26 -2.02 116.55 112.49 3giu n ASP 12 Ca -0.02 -0.71 -0.05 0.00 0.52 0.00 0.00 54.79 54.53 3giu n ASP 12 Cb 0.61 -4.36 -0.02 0.00 -0.72 0.00 0.00 41.12 36.63 3giu n ASP 12 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3giu n ASN 13 N -2.97 -4.65 -4.85 1.67 4.13 -1.26 -5.01 115.26 102.32 3giu n ASN 13 Ca -0.10 0.12 -0.33 0.00 1.68 0.00 0.00 54.58 55.95 3giu n ASN 13 Cb 0.59 -2.57 -0.06 0.00 -1.54 0.00 0.00 39.78 36.20 3giu n ASN 13 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 3giu s GLN 14 N -1.90 4.00 0.16 3.52 -1.52 -0.86 -5.00 119.66 118.06 3giu s GLN 14 Ca 0.00 0.59 0.23 0.00 -1.95 0.00 0.00 55.36 54.23 3giu s GLN 14 Cb 0.00 -2.61 -0.01 0.00 -0.22 0.00 0.00 33.01 30.17 3giu s GLN 14 CO 0.00 0.27 1.00 0.27 -0.25 0.00 0.00 175.29 176.58 3giu n ASN 15 N -0.00 0.72 -4.23 5.90 6.94 -1.26 -4.20 115.26 119.12 3giu n ASN 15 Ca 0.01 0.22 -0.13 0.00 -0.02 0.00 0.00 54.58 54.66 3giu n ASN 15 Cb 0.52 0.64 -0.10 0.00 -2.36 0.00 0.00 39.78 38.48 3giu n ASN 15 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3giu s ILE 16 N -3.35 0.92 -0.12 1.53 -5.25 -1.26 -4.84 121.20 108.83 3giu s ILE 16 Ca -0.00 -2.01 -0.00 0.00 -0.99 0.00 0.00 60.65 57.65 3giu s ILE 16 Cb 0.11 -1.90 0.02 0.00 2.95 0.00 0.00 42.46 43.64 3giu s ILE 16 CO 0.80 -0.69 -0.09 0.21 -1.79 0.00 0.00 174.94 173.37 3giu s ASN 17 N -3.15 2.34 0.59 4.36 3.84 -1.26 -4.66 114.94 117.00 3giu s ASN 17 Ca 0.18 -0.36 0.37 0.00 0.21 0.00 0.00 52.86 53.25 3giu s ASN 17 Cb 0.04 -0.94 1.76 0.00 -0.55 0.00 0.00 41.25 41.56 3giu s ASN 17 CO 0.00 -0.10 2.13 1.55 -2.79 0.00 0.00 177.10 177.89 3giu h PRO 18 N 8.14 0.00 0.01 0.43 0.13 -1.89 -2.01 132.00 136.81 3giu h PRO 18 Ca -0.32 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3giu h PRO 18 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3giu h PRO 18 CO 0.44 0.01 -0.01 0.66 -0.23 0.00 0.00 178.00 178.88 3giu h SER 19 N 0.00 -0.01 -0.35 1.44 4.64 -1.86 -0.44 113.55 116.97 3giu h SER 19 Ca -0.00 -0.13 -0.12 0.00 -0.47 0.00 0.00 61.79 61.07 3giu h SER 19 Cb 0.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 3giu h SER 19 CO 0.00 0.12 -0.26 -0.25 -0.87 0.00 0.00 176.83 175.57 3giu h TRP 20 N -0.15 0.93 -0.89 4.77 2.91 -1.60 -1.44 115.95 120.49 3giu h TRP 20 Ca -0.00 -0.26 0.07 0.00 1.13 0.00 0.00 58.89 59.83 3giu h TRP 20 Cb 0.14 -0.20 -0.06 0.00 -0.51 0.00 0.00 29.16 28.52 3giu h TRP 20 CO -0.03 1.02 0.55 0.93 -1.03 0.00 0.00 178.44 179.88 3giu h GLU 21 N 0.57 0.96 -0.17 2.65 4.39 -1.31 -0.55 114.58 121.12 3giu h GLU 21 Ca 0.07 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 3giu h GLU 21 Cb 0.83 -0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 29.26 3giu h GLU 21 CO 0.07 0.63 -0.14 0.00 -1.16 0.00 0.00 179.01 178.41 3giu h ALA 22 N 1.43 0.25 -0.94 3.43 0.00 -0.96 -3.16 119.26 119.30 3giu h ALA 22 Ca 0.39 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 55.04 3giu h ALA 22 Cb 0.21 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 3giu h ALA 22 CO -0.19 0.12 0.60 0.28 0.00 0.00 0.00 179.25 180.07 3giu h VAL 23 N 0.05 1.11 0.00 0.00 2.07 -0.69 -1.46 116.25 117.33 3giu h VAL 23 Ca 0.03 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 3giu h VAL 23 Cb 0.66 -0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.31 3giu h VAL 23 CO 0.04 0.21 -0.09 0.00 0.02 0.00 0.00 177.57 177.74 3giu h THR 24 N 1.13 0.34 0.00 2.57 1.03 -1.11 -2.16 112.91 114.70 3giu h THR 24 Ca 0.39 -0.55 0.00 0.00 -0.01 0.00 0.00 66.41 66.24 3giu h THR 24 Cb 0.09 1.41 0.00 0.00 -1.07 0.00 0.00 68.15 68.58 3giu h THR 24 CO -0.15 0.09 -0.36 0.00 -0.01 0.00 0.00 175.52 175.09 3giu n GLN 25 N -3.38 0.10 -1.92 0.00 1.13 -0.58 -4.91 117.38 107.81 3giu n GLN 25 Ca -0.01 0.04 -0.38 0.00 -1.94 0.00 0.00 57.00 54.71 3giu n GLN 25 Cb 0.26 -1.57 0.02 0.00 0.11 0.00 0.00 30.24 29.06 3giu n GLN 25 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3giu s LEU 26 N -3.44 3.95 0.72 1.08 1.43 -0.82 -4.99 118.68 116.62 3giu s LEU 26 Ca 0.11 2.66 -0.14 0.00 -1.03 0.00 0.00 54.13 55.72 3giu s LEU 26 Cb 0.16 -4.20 0.03 0.00 0.03 0.00 0.00 46.19 42.22 3giu s LEU 26 CO 0.65 -1.31 1.16 -1.61 0.23 0.00 0.00 176.35 175.48 3giu s GLU 27 N -2.75 2.28 0.21 1.70 0.41 -1.26 -4.94 118.70 114.36 3giu s GLU 27 Ca 0.67 1.59 0.26 0.00 -0.41 0.00 0.00 54.97 57.08 3giu s GLU 27 Cb -0.38 -1.87 0.85 0.00 -1.78 0.00 0.00 34.13 30.96 3giu s GLU 27 CO 0.46 -1.69 1.77 -0.25 -0.49 0.00 0.00 175.26 175.05 3giu n ASP 28 N -2.77 0.77 -3.86 -0.19 8.00 -1.26 -4.59 116.55 112.65 3giu n ASP 28 Ca 0.12 0.59 -0.19 0.00 0.71 0.00 0.00 54.79 56.02 3giu n ASP 28 Cb 0.51 -0.79 -0.16 0.00 -0.02 0.00 0.00 41.12 40.66 3giu n ASP 28 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3giu s ILE 29 N -3.14 0.41 -0.17 0.53 1.10 -1.26 -1.25 121.20 117.42 3giu s ILE 29 Ca 0.10 -0.03 -0.02 0.00 -0.51 0.00 0.00 60.65 60.19 3giu s ILE 29 Cb 0.12 -0.47 0.05 0.00 0.15 0.00 0.00 42.46 42.31 3giu s ILE 29 CO 0.56 0.21 -0.00 -0.63 -2.11 0.00 0.00 174.94 172.96 3giu s ILE 30 N 1.07 0.77 0.00 2.00 1.01 -0.08 -4.96 121.20 121.00 3giu s ILE 30 Ca -0.09 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.01 3giu s ILE 30 Cb -0.14 -1.11 0.00 0.00 0.01 0.00 0.00 42.46 41.22 3giu s ILE 30 CO -0.01 -0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.50 3giu n GLY 31 N 4.98 3.57 1.96 6.18 0.00 -1.26 -0.78 105.19 119.84 3giu n GLY 31 Ca -0.10 -0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.81 3giu n GLY 31 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3giu n THR 32 N 0.00 2.79 -4.07 2.61 -2.24 -1.26 -4.90 114.28 107.21 3giu n THR 32 Ca 0.00 -1.53 -0.35 0.00 -2.27 0.00 0.00 64.05 59.90 3giu n THR 32 Cb 0.00 -0.41 -0.12 0.00 -2.10 0.00 0.00 70.33 67.69 3giu n THR 32 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3giu s HIS 33 N -2.83 3.05 -0.03 4.78 4.02 0.04 -4.42 115.29 119.90 3giu s HIS 33 Ca 0.51 -0.43 -0.24 0.00 1.02 0.00 0.00 55.06 55.92 3giu s HIS 33 Cb 0.41 -2.08 -0.04 0.00 -1.02 0.00 0.00 32.58 29.85 3giu s HIS 33 CO 0.12 -0.22 0.72 0.99 1.02 0.00 0.00 174.74 177.37 3giu s THR 34 N 0.97 4.94 -0.19 1.30 2.01 -1.26 -0.90 115.64 122.52 3giu s THR 34 Ca 0.02 1.50 -0.02 0.00 0.31 0.00 0.00 61.69 63.49 3giu s THR 34 Cb -0.14 -4.06 -0.01 0.00 0.01 0.00 0.00 72.50 68.30 3giu s THR 34 CO 0.02 0.29 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.53 3giu s ILE 35 N 0.48 3.19 -0.01 1.82 -1.09 -0.38 -0.72 121.20 124.50 3giu s ILE 35 Ca 0.38 -0.57 0.02 0.00 -2.23 0.00 0.00 60.65 58.24 3giu s ILE 35 Cb -0.19 -2.41 -0.03 0.00 -1.58 0.00 0.00 42.46 38.25 3giu s ILE 35 CO 0.20 0.47 -0.02 -1.81 -1.23 0.00 0.00 174.94 172.55 3giu s ASP 36 N 1.07 5.00 -0.04 3.58 1.11 -0.09 -4.79 116.67 122.52 3giu s ASP 36 Ca 0.00 -0.03 0.06 0.00 0.18 0.00 0.00 52.55 52.76 3giu s ASP 36 Cb -0.15 -1.28 -0.02 0.00 1.07 0.00 0.00 42.92 42.54 3giu s ASP 36 CO -0.01 0.29 -0.21 -0.54 1.18 0.00 0.00 175.17 175.88 3giu s LYS 37 N -1.46 2.35 -0.07 8.23 1.02 -1.26 -0.51 119.74 128.04 3giu s LYS 37 Ca 0.18 -0.82 -0.03 0.00 0.02 0.00 0.00 55.97 55.32 3giu s LYS 37 Cb -0.11 -2.21 0.04 0.00 -0.52 0.00 0.00 37.83 35.03 3giu s LYS 37 CO 0.09 0.56 0.15 -1.17 -0.92 0.00 0.00 175.35 174.06 3giu s LEU 38 N -0.59 0.43 -0.16 3.17 2.96 -0.67 -4.96 118.68 118.86 3giu s LEU 38 Ca 0.09 0.31 -0.22 0.00 -0.22 0.00 0.00 54.13 54.09 3giu s LEU 38 Cb -0.11 0.32 -0.03 0.00 0.50 0.00 0.00 46.19 46.88 3giu s LEU 38 CO 0.00 -0.18 0.65 -0.75 -1.32 0.00 0.00 176.35 174.75 3giu s LYS 39 N 1.58 4.28 -0.07 1.98 2.20 -1.26 -2.00 119.74 126.45 3giu s LYS 39 Ca -0.05 0.70 -0.04 0.00 -0.36 0.00 0.00 55.97 56.23 3giu s LYS 39 Cb -0.12 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.62 3giu s LYS 39 CO -0.06 -0.16 0.09 -0.51 -0.36 0.00 0.00 175.35 174.36 3giu s LEU 40 N 1.61 4.06 0.55 5.43 1.43 0.33 -4.95 118.68 127.14 3giu s LEU 40 Ca 0.31 0.29 -0.19 0.00 -1.03 0.00 0.00 54.13 53.51 3giu s LEU 40 Cb -0.16 -2.12 -0.05 0.00 0.03 0.00 0.00 46.19 43.89 3giu s LEU 40 CO 0.12 0.35 1.16 -2.16 0.23 0.00 0.00 176.35 176.05 3giu s PRO 41 N -1.28 3.26 -1.28 1.29 0.04 -1.26 -1.59 135.00 134.19 3giu s PRO 41 Ca 0.18 1.69 -0.15 0.00 0.04 0.00 0.00 61.00 62.76 3giu s PRO 41 Cb -0.12 -2.01 0.12 0.00 0.04 0.00 0.00 34.50 32.54 3giu s PRO 41 CO 0.08 -0.94 1.70 2.41 0.04 0.00 0.00 177.00 180.28 3giu n THR 42 N -1.34 4.07 -3.60 1.26 -1.04 -1.26 -4.75 114.28 107.63 3giu n THR 42 Ca 0.12 -4.28 -0.13 0.00 -2.04 0.00 0.00 64.05 57.72 3giu n THR 42 Cb 0.50 -2.43 -0.12 0.00 -1.82 0.00 0.00 70.33 66.46 3giu n THR 42 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3giu s SER 43 N 3.05 0.48 0.24 8.00 0.15 -1.26 -1.21 113.70 123.15 3giu s SER 43 Ca 0.47 0.44 -0.07 0.00 0.70 0.00 0.00 55.95 57.49 3giu s SER 43 Cb 0.03 0.75 0.25 0.00 -1.71 0.00 0.00 66.02 65.34 3giu s SER 43 CO 0.02 -0.26 1.91 -0.26 1.20 0.00 0.00 173.24 175.85 3giu h PHE 44 N 8.27 1.17 0.00 3.44 0.04 -1.92 -2.69 116.94 125.26 3giu h PHE 44 Ca -0.15 0.03 -0.19 0.00 2.80 0.00 0.00 57.97 60.45 3giu h PHE 44 Cb 1.12 -0.40 -0.03 0.00 2.20 0.00 0.00 35.95 38.85 3giu h PHE 44 CO 0.29 0.72 -0.90 0.87 -0.60 0.00 0.00 178.31 178.69 3giu h LYS 45 N 1.25 0.00 0.02 1.51 1.57 -1.98 -3.35 116.57 115.59 3giu h LYS 45 Ca 0.35 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.87 3giu h LYS 45 Cb -0.10 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 3giu h LYS 45 CO -0.09 0.90 -1.46 0.87 -0.57 0.00 0.00 179.45 179.11 3giu h LYS 46 N 0.00 0.04 -0.67 3.15 1.57 -1.93 -3.39 116.57 115.34 3giu h LYS 46 Ca -0.01 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 3giu h LYS 46 Cb 1.63 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.94 3giu h LYS 46 CO 0.12 0.77 0.31 -0.39 -0.57 0.00 0.00 179.45 179.68 3giu h VAL 47 N 0.01 1.23 -0.59 0.50 -1.51 -1.61 -2.03 116.25 112.25 3giu h VAL 47 Ca -0.19 -0.66 -0.04 0.00 -1.23 0.00 0.00 66.70 64.57 3giu h VAL 47 Cb 1.93 0.43 -0.03 0.00 -2.13 0.00 0.00 31.29 31.50 3giu h VAL 47 CO 0.11 0.27 0.21 0.44 -1.23 0.00 0.00 177.57 177.36 3giu h ASP 48 N 0.93 0.83 -0.69 4.19 3.32 -1.76 -0.72 116.42 122.53 3giu h ASP 48 Ca 0.23 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 3giu h ASP 48 Cb 0.14 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 3giu h ASP 48 CO -0.03 0.80 0.15 -1.13 -1.72 0.00 0.00 179.24 177.32 3giu h ASN 49 N 0.82 1.06 -0.29 6.45 -1.24 -1.73 0.21 115.58 120.86 3giu h ASN 49 Ca 0.19 -0.24 -0.02 0.00 0.71 0.00 0.00 56.30 56.94 3giu h ASN 49 Cb 0.25 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.01 3giu h ASN 49 CO -0.01 1.03 0.11 0.40 -1.29 0.00 0.00 177.43 177.67 3giu h ILE 50 N 1.04 1.18 -0.30 2.57 2.04 -1.07 -1.16 117.51 121.80 3giu h ILE 50 Ca 0.21 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3giu h ILE 50 Cb 0.39 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 3giu h ILE 50 CO 0.01 0.18 0.20 0.40 0.00 0.00 0.00 178.15 178.94 3giu h ILE 51 N 0.31 1.09 -0.26 -0.67 2.04 -0.89 -0.86 117.51 118.27 3giu h ILE 51 Ca 0.10 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.82 3giu h ILE 51 Cb 0.18 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 3giu h ILE 51 CO -0.01 0.08 0.04 0.78 0.00 0.00 0.00 178.15 179.04 3giu h ASN 52 N 0.41 -0.03 -0.57 1.72 2.35 -0.37 -0.65 115.58 118.44 3giu h ASN 52 Ca 0.11 0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.81 3giu h ASN 52 Cb -0.03 0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 3giu h ASN 52 CO -0.02 0.02 -0.01 0.11 -1.65 0.00 0.00 177.43 175.88 3giu h LYS 53 N 0.13 1.01 -0.37 0.81 1.57 -1.07 -1.58 116.57 117.07 3giu h LYS 53 Ca 0.12 -0.33 -0.04 0.00 -1.87 0.00 0.00 60.65 58.53 3giu h LYS 53 Cb 0.14 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3giu h LYS 53 CO -0.18 1.01 0.06 1.15 -0.57 0.00 0.00 179.45 180.92 3giu h THR 54 N 0.89 1.24 0.00 -0.16 2.02 -0.85 -2.36 112.91 113.70 3giu h THR 54 Ca 0.16 -0.84 -0.09 0.00 0.77 0.00 0.00 66.41 66.42 3giu h THR 54 Cb 0.56 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 3giu h THR 54 CO 0.03 0.28 -0.41 -0.07 0.37 0.00 0.00 175.52 175.72 3giu h LEU 55 N 0.45 0.00 -0.62 2.58 3.38 -1.05 -1.50 115.31 118.56 3giu h LEU 55 Ca 0.11 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 3giu h LEU 55 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3giu h LEU 55 CO 0.01 0.41 -0.43 0.00 0.09 0.00 0.00 178.44 178.52 3giu h ALA 56 N 1.59 0.87 -0.00 1.53 0.00 -1.14 -3.32 119.26 118.78 3giu h ALA 56 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3giu h ALA 56 Cb 0.92 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3giu h ALA 56 CO 0.05 0.53 -0.73 -1.13 0.00 0.00 0.00 179.25 177.98 3giu n SER 57 N -3.41 0.79 -4.04 0.00 3.41 -0.90 -4.98 113.62 104.49 3giu n SER 57 Ca 0.01 -0.90 -0.14 0.00 -0.26 0.00 0.00 58.87 57.57 3giu n SER 57 Cb 0.59 0.97 -0.12 0.00 -0.26 0.00 0.00 64.21 65.39 3giu n SER 57 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3giu s ASN 58 N -2.47 0.85 -0.38 4.04 0.01 -0.58 -5.08 114.94 111.33 3giu s ASN 58 Ca 0.06 -0.42 -0.17 0.00 -0.71 0.00 0.00 52.86 51.63 3giu s ASN 58 Cb 0.12 -0.00 0.00 0.00 0.41 0.00 0.00 41.25 41.78 3giu s ASN 58 CO 0.64 -0.11 0.44 -2.28 -1.51 0.00 0.00 177.10 174.27 3giu s HIS 59 N -1.00 3.18 -0.02 2.20 5.65 -1.26 -4.56 115.29 119.48 3giu s HIS 59 Ca -0.06 -0.12 0.07 0.00 0.25 0.00 0.00 55.06 55.20 3giu s HIS 59 Cb -0.08 -2.85 -0.02 0.00 -1.18 0.00 0.00 32.58 28.45 3giu s HIS 59 CO 0.00 -0.58 -0.23 0.71 -0.65 0.00 0.00 174.74 173.99 3giu s TYR 60 N 2.18 2.43 0.11 3.88 2.02 -1.26 -4.90 117.35 121.82 3giu s TYR 60 Ca 0.14 -0.36 0.04 0.00 -0.37 0.00 0.00 57.07 56.52 3giu s TYR 60 Cb -0.16 -1.51 -0.21 0.00 -0.40 0.00 0.00 41.96 39.67 3giu s TYR 60 CO 0.13 0.05 1.26 -0.44 -1.57 0.00 0.00 175.55 174.98 3giu h ASP 61 N 5.31 0.11 -3.74 2.29 3.32 -1.25 -3.46 116.42 118.99 3giu h ASP 61 Ca -0.45 -0.11 -0.22 0.00 0.02 0.00 0.00 57.03 56.27 3giu h ASP 61 Cb 1.13 -0.03 -0.28 0.00 0.22 0.00 0.00 39.33 40.37 3giu h ASP 61 CO 0.47 1.08 -0.68 -0.69 -1.72 0.00 0.00 179.24 177.70 3giu s VAL 62 N -2.73 -0.00 -0.18 -1.35 1.01 -0.99 -1.68 120.40 114.49 3giu s VAL 62 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.98 3giu s VAL 62 Cb 0.09 -0.06 0.01 0.00 0.00 0.00 0.00 36.38 36.42 3giu s VAL 62 CO 0.83 0.00 -0.15 -0.69 0.00 0.00 0.00 175.10 175.09 3giu s VAL 63 N 0.02 2.51 -0.27 2.92 1.01 -0.51 -0.97 120.40 125.11 3giu s VAL 63 Ca -0.00 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.20 3giu s VAL 63 Cb -0.00 -2.08 0.07 0.00 0.00 0.00 0.00 36.38 34.37 3giu s VAL 63 CO 0.00 0.51 -0.04 -0.22 0.00 0.00 0.00 175.10 175.35 3giu s LEU 64 N 1.16 3.35 -0.08 3.92 2.96 0.31 -1.63 118.68 128.67 3giu s LEU 64 Ca 0.01 -1.51 -0.13 0.00 -0.22 0.00 0.00 54.13 52.28 3giu s LEU 64 Cb -0.14 -1.39 -0.05 0.00 0.50 0.00 0.00 46.19 45.11 3giu s LEU 64 CO -0.06 -0.27 0.32 0.00 -1.32 0.00 0.00 176.35 175.02 3giu s ALA 65 N 1.20 3.68 0.00 5.97 0.00 -0.68 -1.84 121.76 130.10 3giu s ALA 65 Ca -0.02 -0.38 0.04 0.00 0.00 0.00 0.00 51.96 51.61 3giu s ALA 65 Cb -0.19 -2.32 -0.03 0.00 0.00 0.00 0.00 23.12 20.57 3giu s ALA 65 CO -0.08 0.35 -0.12 0.42 0.00 0.00 0.00 175.76 176.33 3giu s ILE 66 N -0.45 3.26 0.07 0.00 -1.09 0.12 -0.82 121.20 122.29 3giu s ILE 66 Ca 0.20 -0.89 -0.12 0.00 -2.23 0.00 0.00 60.65 57.62 3giu s ILE 66 Cb -0.14 -2.38 0.01 0.00 -1.58 0.00 0.00 42.46 38.37 3giu s ILE 66 CO 0.08 0.42 0.26 -0.83 -1.23 0.00 0.00 174.94 173.64 3giu s GLY 67 N -1.27 -0.04 0.02 6.18 0.00 -0.76 -3.92 107.32 107.52 3giu s GLY 67 Ca 0.15 -0.29 -0.30 0.00 0.00 0.00 0.00 44.72 44.28 3giu s GLY 67 CO 0.05 -0.49 1.06 1.62 0.00 0.00 0.00 173.10 175.34 3giu s GLN 68 N -3.27 4.51 -0.69 2.90 0.74 -1.26 -0.71 119.66 121.88 3giu s GLN 68 Ca 0.00 1.55 0.05 0.00 0.05 0.00 0.00 55.36 57.01 3giu s GLN 68 Cb 0.02 -3.42 0.17 0.00 1.10 0.00 0.00 33.01 30.88 3giu s GLN 68 CO -0.08 -0.12 0.48 0.00 -0.55 0.00 0.00 175.29 175.02 3giu s ALA 69 N 1.02 3.79 0.13 1.58 0.00 0.54 -4.84 121.76 123.98 3giu s ALA 69 Ca 0.54 -3.80 -0.31 0.00 0.00 0.00 0.00 51.96 48.39 3giu s ALA 69 Cb -0.24 -2.17 -0.10 0.00 0.00 0.00 0.00 23.12 20.60 3giu s ALA 69 CO 0.28 -2.09 1.82 0.20 0.00 0.00 0.00 175.76 175.97 3giu s GLY 70 N -1.37 1.33 0.00 0.00 0.00 -1.26 -1.58 107.32 104.44 3giu s GLY 70 Ca 0.24 1.46 0.00 0.00 0.00 0.00 0.00 44.72 46.42 3giu s GLY 70 CO -0.15 3.12 0.00 0.61 0.00 0.00 0.00 173.10 176.68 3giu n GLY 71 N 4.21 2.71 3.81 0.20 0.00 -1.26 -4.98 105.19 109.89 3giu n GLY 71 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 3giu n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3giu s ARG 72 N -0.68 4.11 -0.12 1.61 0.52 -0.62 -4.54 118.95 119.23 3giu s ARG 72 Ca 0.00 1.19 0.15 0.00 -0.52 0.00 0.00 55.73 56.55 3giu s ARG 72 Cb 0.00 -2.16 0.43 0.00 0.52 0.00 0.00 34.95 33.74 3giu s ARG 72 CO 0.00 -0.14 1.34 0.27 0.02 0.00 0.00 175.30 176.78 3giu n ASN 73 N -0.72 3.42 -3.94 0.23 0.23 -1.26 -4.52 115.26 108.70 3giu n ASN 73 Ca 0.08 -2.72 -0.09 0.00 -0.53 0.00 0.00 54.58 51.31 3giu n ASN 73 Cb 0.54 -0.43 -0.08 0.00 -2.08 0.00 0.00 39.78 37.73 3giu n ASN 73 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3giu s ALA 74 N -2.29 0.01 -0.10 -2.53 0.00 -1.26 -4.82 121.76 110.77 3giu s ALA 74 Ca 0.35 -0.83 -0.26 0.00 0.00 0.00 0.00 51.96 51.22 3giu s ALA 74 Cb 0.27 0.57 -0.02 0.00 0.00 0.00 0.00 23.12 23.93 3giu s ALA 74 CO 0.10 -0.52 0.85 0.42 0.00 0.00 0.00 175.76 176.61 3giu s ILE 75 N -3.91 4.91 -0.28 0.00 1.01 -0.58 -4.11 121.20 118.24 3giu s ILE 75 Ca 0.09 1.72 -0.01 0.00 0.00 0.00 0.00 60.65 62.45 3giu s ILE 75 Cb 0.05 -4.17 0.09 0.00 0.01 0.00 0.00 42.46 38.44 3giu s ILE 75 CO -0.07 0.10 0.08 0.42 0.00 0.00 0.00 174.94 175.47 3giu s THR 76 N 1.58 0.80 0.59 2.92 -4.23 -0.15 -2.17 115.64 114.98 3giu s THR 76 Ca 0.42 -1.19 -0.19 0.00 -1.18 0.00 0.00 61.69 59.55 3giu s THR 76 Cb -0.18 -1.51 -0.05 0.00 1.34 0.00 0.00 72.50 72.10 3giu s THR 76 CO 0.17 -0.55 1.05 -2.65 -0.54 0.00 0.00 174.62 172.11 3giu n PRO 77 N 4.90 1.05 -4.11 3.99 -0.02 -1.22 -1.48 135.00 138.11 3giu n PRO 77 Ca -0.04 0.40 -0.35 0.00 -2.02 0.00 0.00 63.50 61.50 3giu n PRO 77 Cb 0.43 -2.25 -0.11 0.00 -0.02 0.00 0.00 33.50 31.55 3giu n PRO 77 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3giu s GLU 78 N -2.78 3.82 0.13 -0.52 0.41 -0.02 -0.91 118.70 118.83 3giu s GLU 78 Ca 0.75 -0.43 -0.10 0.00 -0.41 0.00 0.00 54.97 54.78 3giu s GLU 78 Cb -0.42 -3.12 -0.07 0.00 -1.78 0.00 0.00 34.13 28.73 3giu s GLU 78 CO 0.47 0.19 1.40 -0.09 -0.49 0.00 0.00 175.26 176.74 3giu h ARG 79 N 6.95 0.81 -2.82 1.61 2.43 -1.24 -3.42 114.38 118.70 3giu h ARG 79 Ca -0.35 -0.55 -0.11 0.00 -0.81 0.00 0.00 59.98 58.17 3giu h ARG 79 Cb 1.18 0.08 -0.20 0.00 -0.42 0.00 0.00 29.97 30.60 3giu h ARG 79 CO 0.66 1.17 -0.19 0.54 -1.51 0.00 0.00 179.97 180.64 3giu s VAL 80 N -4.02 0.04 0.06 0.20 0.11 -1.26 -1.16 120.40 114.36 3giu s VAL 80 Ca -0.10 -0.34 0.08 0.00 -2.93 0.00 0.00 61.98 58.69 3giu s VAL 80 Cb 0.10 -0.68 -0.03 0.00 -1.53 0.00 0.00 36.38 34.24 3giu s VAL 80 CO 0.89 -0.19 -0.19 0.00 -3.33 0.00 0.00 175.10 172.28 3giu s ALA 81 N -1.13 2.57 0.06 1.54 0.00 -0.23 -4.09 121.76 120.48 3giu s ALA 81 Ca -0.12 -1.25 0.05 0.00 0.00 0.00 0.00 51.96 50.65 3giu s ALA 81 Cb -0.04 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 3giu s ALA 81 CO 0.05 0.57 -0.08 0.42 0.00 0.00 0.00 175.76 176.72 3giu s ILE 82 N -0.96 3.50 -1.34 0.00 -1.09 -1.26 -1.04 121.20 119.01 3giu s ILE 82 Ca 0.15 -1.03 -0.09 0.00 -2.23 0.00 0.00 60.65 57.44 3giu s ILE 82 Cb -0.10 -2.58 -0.12 0.00 -1.58 0.00 0.00 42.46 38.08 3giu s ILE 82 CO 0.06 0.24 3.03 -3.20 -1.23 0.00 0.00 174.94 173.84 3giu n ASN 83 N 1.10 8.06 -3.71 3.58 5.15 -0.28 -4.80 115.26 124.36 3giu n ASN 83 Ca -0.14 -2.54 -0.13 0.00 -0.60 0.00 0.00 54.58 51.17 3giu n ASN 83 Cb 0.52 -1.51 -0.09 0.00 -0.53 0.00 0.00 39.78 38.17 3giu n ASN 83 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 3giu s ILE 84 N 2.04 -0.00 -0.19 -1.44 2.07 -1.26 -3.61 121.20 118.80 3giu s ILE 84 Ca 0.68 0.00 -0.08 0.00 -1.41 0.00 0.00 60.65 59.84 3giu s ILE 84 Cb 0.20 -0.68 -0.04 0.00 0.13 0.00 0.00 42.46 42.07 3giu s ILE 84 CO -0.05 0.00 0.08 -1.81 -1.91 0.00 0.00 174.94 171.26 3giu s ASP 85 N 0.33 5.78 -0.42 4.50 1.01 0.61 -4.82 116.67 123.66 3giu s ASP 85 Ca -0.01 0.11 0.04 0.00 0.71 0.00 0.00 52.55 53.41 3giu s ASP 85 Cb -0.04 -2.00 0.17 0.00 1.01 0.00 0.00 42.92 42.06 3giu s ASP 85 CO -0.00 0.16 0.45 -0.62 0.21 0.00 0.00 175.17 175.37 3giu s ASP 86 N 0.46 0.57 -0.20 0.27 2.15 0.09 -1.29 116.67 118.71 3giu s ASP 86 Ca 0.05 -2.03 -0.28 0.00 0.43 0.00 0.00 52.55 50.72 3giu s ASP 86 Cb -0.12 0.62 0.00 0.00 -0.30 0.00 0.00 42.92 43.12 3giu s ASP 86 CO 0.00 -0.18 0.97 0.00 -0.17 0.00 0.00 175.17 175.79 3giu s ALA 87 N 0.92 3.62 0.30 3.66 0.00 0.53 -4.51 121.76 126.27 3giu s ALA 87 Ca 0.24 0.14 0.10 0.00 0.00 0.00 0.00 51.96 52.44 3giu s ALA 87 Cb -0.06 -3.45 0.46 0.00 0.00 0.00 0.00 23.12 20.07 3giu s ALA 87 CO -0.08 -0.91 1.68 -0.09 0.00 0.00 0.00 175.76 176.36 3giu h ARG 88 N 7.42 0.07 -4.85 0.00 2.43 -1.89 -3.45 114.38 114.11 3giu h ARG 88 Ca -0.23 -0.04 -0.30 0.00 -0.81 0.00 0.00 59.98 58.60 3giu h ARG 88 Cb 1.09 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 30.49 3giu h ARG 88 CO 0.92 0.57 -0.67 0.96 -1.51 0.00 0.00 179.97 180.24 3giu s ILE 89 N -3.89 0.77 0.67 1.20 -4.36 -1.26 -5.15 121.20 109.18 3giu s ILE 89 Ca -0.03 -1.99 -0.15 0.00 -0.26 0.00 0.00 60.65 58.23 3giu s ILE 89 Cb 0.13 -2.08 0.01 0.00 1.25 0.00 0.00 42.46 41.77 3giu s ILE 89 CO 0.76 -0.52 1.12 -2.84 0.24 0.00 0.00 174.94 173.70 3giu s PRO 90 N -3.88 2.69 0.44 0.37 0.02 -1.26 -4.78 135.00 128.58 3giu s PRO 90 Ca 0.23 1.42 -0.07 0.00 0.02 0.00 0.00 61.00 62.60 3giu s PRO 90 Cb 0.06 -1.93 0.10 0.00 0.02 0.00 0.00 34.50 32.75 3giu s PRO 90 CO 0.03 -1.35 0.53 -0.40 -0.33 0.00 0.00 177.00 175.49 3giu n ASP 91 N -2.51 -0.38 0.04 2.53 5.68 0.06 -4.84 116.55 117.13 3giu n ASP 91 Ca 0.11 -1.08 0.08 0.00 -0.50 0.00 0.00 54.79 53.40 3giu n ASP 91 Cb 0.52 -0.42 0.36 0.00 -1.14 0.00 0.00 41.12 40.44 3giu n ASP 91 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3giu n ASN 92 N -3.48 0.22 -1.29 -1.12 3.02 -0.35 -1.16 115.26 111.10 3giu n ASN 92 Ca 0.07 0.56 0.11 0.00 -0.03 0.00 0.00 54.58 55.28 3giu n ASN 92 Cb 0.24 -0.60 0.30 0.00 -0.61 0.00 0.00 39.78 39.12 3giu n ASN 92 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3giu n ASP 93 N -1.74 3.75 -2.40 6.41 8.00 -1.26 -4.95 116.55 124.36 3giu n ASP 93 Ca 0.03 -2.06 -0.19 0.00 0.71 0.00 0.00 54.79 53.28 3giu n ASP 93 Cb 0.18 -0.47 0.02 0.00 -0.02 0.00 0.00 41.12 40.83 3giu n ASP 93 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3giu n ASP 94 N 1.43 -5.39 -4.56 -2.24 2.03 -0.31 -5.01 116.55 102.49 3giu n ASP 94 Ca 0.23 -0.16 -0.34 0.00 0.52 0.00 0.00 54.79 55.04 3giu n ASP 94 Cb 0.61 -4.32 -0.11 0.00 -0.72 0.00 0.00 41.12 36.58 3giu n ASP 94 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 3giu s PHE 95 N -3.02 3.10 -0.50 -0.67 5.36 -1.26 -4.83 117.98 116.17 3giu s PHE 95 Ca 0.16 -0.12 0.05 0.00 -0.96 0.00 0.00 56.93 56.06 3giu s PHE 95 Cb -0.07 -1.96 0.18 0.00 -0.34 0.00 0.00 43.02 40.83 3giu s PHE 95 CO 0.20 0.10 0.41 0.94 -1.46 0.00 0.00 175.22 175.41 3giu n GLN 96 N 3.30 0.75 -2.22 10.12 7.27 -1.26 -0.76 117.38 134.58 3giu n GLN 96 Ca -0.17 -3.58 -0.42 0.00 0.07 0.00 0.00 57.00 52.89 3giu n GLN 96 Cb 0.53 -1.82 -0.03 0.00 2.41 0.00 0.00 30.24 31.32 3giu n GLN 96 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 3giu s PRO 97 N -0.54 4.35 -0.16 3.69 0.04 -1.26 -4.82 135.00 136.29 3giu s PRO 97 Ca 0.31 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.38 3giu s PRO 97 Cb 0.03 -3.26 0.03 0.00 0.04 0.00 0.00 34.50 31.34 3giu s PRO 97 CO -0.18 -0.39 -0.13 0.42 0.04 0.00 0.00 177.00 176.76 3giu s ILE 98 N 0.99 1.60 -1.33 0.56 1.01 -1.26 -0.35 121.20 122.42 3giu s ILE 98 Ca 0.63 -0.73 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 3giu s ILE 98 Cb -0.36 -1.54 0.02 0.00 0.01 0.00 0.00 42.46 40.59 3giu s ILE 98 CO 0.31 0.39 1.05 0.47 0.00 0.00 0.00 174.94 177.16 3giu n ASP 99 N 4.75 -4.33 -4.54 3.58 8.00 -0.41 -4.96 116.55 118.64 3giu n ASP 99 Ca -0.16 -0.63 -0.34 0.00 0.71 0.00 0.00 54.79 54.37 3giu n ASP 99 Cb 0.49 -4.81 -0.11 0.00 -0.02 0.00 0.00 41.12 36.67 3giu n ASP 99 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3giu s GLN 100 N -6.03 3.53 0.56 -1.24 -1.52 -0.71 -4.95 119.66 109.30 3giu s GLN 100 Ca 0.36 -0.49 -0.21 0.00 -1.95 0.00 0.00 55.36 53.07 3giu s GLN 100 Cb -0.16 -2.90 -0.04 0.00 -0.22 0.00 0.00 33.01 29.68 3giu s GLN 100 CO 0.75 0.35 1.29 0.00 -0.25 0.00 0.00 175.29 177.43 3giu n ALA 101 N 3.23 1.30 -0.08 6.09 0.00 -1.26 -0.28 120.51 129.50 3giu n ALA 101 Ca -0.17 0.10 -0.12 0.00 0.00 0.00 0.00 53.44 53.24 3giu n ALA 101 Cb 0.53 -2.31 -0.09 0.00 0.00 0.00 0.00 19.45 17.58 3giu n ALA 101 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3giu h ILE 102 N 1.18 0.95 -3.31 0.00 2.04 -1.89 -3.44 117.51 113.03 3giu h ILE 102 Ca -0.50 -1.86 -0.52 0.00 1.00 0.00 0.00 64.86 62.98 3giu h ILE 102 Cb 1.32 1.94 -0.39 0.00 -0.74 0.00 0.00 36.82 38.96 3giu h ILE 102 CO 0.56 0.32 -0.78 -1.00 0.00 0.00 0.00 178.15 177.25 3giu s HIS 103 N -2.14 1.28 0.48 1.37 3.76 -1.26 -5.02 115.29 113.76 3giu s HIS 103 Ca -0.18 -0.86 0.18 0.00 -0.15 0.00 0.00 55.06 54.05 3giu s HIS 103 Cb 0.01 -1.12 1.21 0.00 1.11 0.00 0.00 32.58 33.79 3giu s HIS 103 CO 0.47 -0.57 2.07 -0.07 -0.85 0.00 0.00 174.74 175.79 3giu h LEU 104 N 8.20 0.00 -1.32 0.89 3.38 -1.98 -0.71 115.31 123.77 3giu h LEU 104 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3giu h LEU 104 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3giu h LEU 104 CO 0.35 0.10 0.00 -0.90 0.09 0.00 0.00 178.44 178.08 3giu n ASP 105 N -4.27 1.97 -4.97 -0.43 5.75 -1.26 -4.95 116.55 108.39 3giu n ASP 105 Ca -0.03 -1.82 -0.22 0.00 -0.01 0.00 0.00 54.79 52.72 3giu n ASP 105 Cb 0.18 -0.16 0.04 0.00 -1.03 0.00 0.00 41.12 40.15 3giu n ASP 105 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3giu s GLY 106 N -1.41 1.78 0.70 6.12 0.00 -0.27 -5.09 107.32 109.16 3giu s GLY 106 Ca 0.31 -1.26 -0.14 0.00 0.00 0.00 0.00 44.72 43.64 3giu s GLY 106 CO 0.25 -0.98 1.13 0.00 0.00 0.00 0.00 173.10 173.50 3giu s ALA 107 N -2.78 2.30 0.27 3.20 0.00 -1.26 -4.93 121.76 118.57 3giu s ALA 107 Ca 0.56 0.59 0.37 0.00 0.00 0.00 0.00 51.96 53.49 3giu s ALA 107 Cb -0.10 -3.36 1.71 0.00 0.00 0.00 0.00 23.12 21.37 3giu s ALA 107 CO 0.39 -1.57 2.11 -1.00 0.00 0.00 0.00 175.76 175.69 3giu h PRO 108 N -0.30 0.00 -2.82 0.00 0.13 -1.96 -3.41 132.00 123.63 3giu h PRO 108 Ca -0.46 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 3giu h PRO 108 Cb 1.26 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.23 3giu h PRO 108 CO 0.52 0.00 0.01 0.00 -0.23 0.00 0.00 178.00 178.30 3giu s ALA 109 N -3.82 -1.26 -0.08 -0.56 0.00 -1.26 -1.12 121.76 113.66 3giu s ALA 109 Ca -0.01 0.54 0.03 0.00 0.00 0.00 0.00 51.96 52.52 3giu s ALA 109 Cb 0.10 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.61 3giu s ALA 109 CO 0.50 -0.50 -0.16 0.71 0.00 0.00 0.00 175.76 176.31 3giu s TYR 110 N -2.46 1.85 0.02 0.00 2.02 -0.21 -4.99 117.35 113.58 3giu s TYR 110 Ca -0.05 -0.73 -0.24 0.00 -0.37 0.00 0.00 57.07 55.68 3giu s TYR 110 Cb -0.01 -1.30 -0.05 0.00 -0.40 0.00 0.00 41.96 40.20 3giu s TYR 110 CO -0.02 -0.34 0.72 -0.06 -1.57 0.00 0.00 175.55 174.28 3giu s PHE 111 N 0.59 3.70 0.28 2.71 0.08 -1.26 -1.07 117.98 123.01 3giu s PHE 111 Ca -0.15 1.38 -0.30 0.00 0.12 0.00 0.00 56.93 57.98 3giu s PHE 111 Cb -0.16 -2.78 -0.13 0.00 -0.57 0.00 0.00 43.02 39.38 3giu s PHE 111 CO 0.05 0.26 1.39 0.45 -0.10 0.00 0.00 175.22 177.26 3giu n SER 112 N 2.96 2.89 -1.57 1.36 2.88 -0.31 -4.90 113.62 116.94 3giu n SER 112 Ca -0.03 1.17 0.08 0.00 -1.33 0.00 0.00 58.87 58.75 3giu n SER 112 Cb 0.51 -1.47 0.36 0.00 -0.75 0.00 0.00 64.21 62.86 3giu n SER 112 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3giu n ASN 113 N 1.64 5.14 -4.93 -3.46 6.94 -1.20 -4.93 115.26 114.46 3giu n ASN 113 Ca 0.09 -2.94 -0.25 0.00 -0.02 0.00 0.00 54.58 51.45 3giu n ASN 113 Cb 0.34 -0.64 0.01 0.00 -2.36 0.00 0.00 39.78 37.13 3giu n ASN 113 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3giu s LEU 114 N -2.75 3.59 -1.32 -4.53 1.43 -1.24 -4.75 118.68 109.11 3giu s LEU 114 Ca 0.51 0.62 -0.18 0.00 -1.03 0.00 0.00 54.13 54.06 3giu s LEU 114 Cb 0.39 -3.51 0.06 0.00 0.03 0.00 0.00 46.19 43.16 3giu s LEU 114 CO 0.14 -0.69 1.82 -0.81 0.23 0.00 0.00 176.35 177.04 3giu n PRO 115 N -2.22 3.09 0.00 1.29 -0.04 -1.26 -4.79 135.00 131.08 3giu n PRO 115 Ca 0.01 -3.14 0.02 0.00 -0.04 0.00 0.00 63.50 60.34 3giu n PRO 115 Cb 0.57 -3.47 0.36 0.00 -0.04 0.00 0.00 33.50 30.91 3giu n PRO 115 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3giu h VAL 116 N 5.34 1.15 -0.16 0.52 -1.51 -1.94 -2.33 116.25 117.32 3giu h VAL 116 Ca 0.46 -0.51 -0.21 0.00 -1.23 0.00 0.00 66.70 65.22 3giu h VAL 116 Cb 0.84 0.74 0.01 0.00 -2.13 0.00 0.00 31.29 30.74 3giu h VAL 116 CO 1.52 0.19 -0.73 0.11 -1.23 0.00 0.00 177.57 177.43 3giu h LYS 117 N 0.52 0.74 -0.47 5.19 1.57 -1.86 -0.94 116.57 121.32 3giu h LYS 117 Ca 0.13 -0.58 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 3giu h LYS 117 Cb 0.14 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3giu h LYS 117 CO -0.01 1.19 0.00 0.00 -0.57 0.00 0.00 179.45 180.06 3giu n ALA 118 N -2.58 1.10 0.00 3.86 0.00 -0.88 -0.46 120.51 121.54 3giu n ALA 118 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3giu n ALA 118 Cb 0.72 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.19 3giu n ALA 118 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3giu n THR 120 N 0.61 0.00 0.05 0.00 -1.04 -0.36 -1.01 114.28 112.54 3giu n THR 120 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 3giu n THR 120 Cb 0.00 0.00 0.27 0.00 -1.82 0.00 0.00 70.33 68.78 3giu n THR 120 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 3giu h GLN 121 N 0.00 0.38 -0.97 -2.82 5.75 -1.03 -2.16 115.11 114.26 3giu h GLN 121 Ca 0.00 -0.13 0.01 0.00 -0.15 0.00 0.00 58.65 58.38 3giu h GLN 121 Cb 0.00 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.47 3giu h GLN 121 CO 0.00 0.58 0.64 0.66 -2.65 0.00 0.00 178.83 178.06 3giu h SER 122 N 0.35 1.12 -0.06 -0.69 4.64 -1.30 0.12 113.55 117.73 3giu h SER 122 Ca 0.06 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3giu h SER 122 Cb 0.57 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3giu h SER 122 CO 0.04 0.82 0.02 0.40 -0.87 0.00 0.00 176.83 177.24 3giu h ILE 123 N 1.32 1.16 -0.99 0.95 2.04 -1.69 -2.95 117.51 117.35 3giu h ILE 123 Ca 0.36 -0.49 0.05 0.00 1.00 0.00 0.00 64.86 65.78 3giu h ILE 123 Cb -0.14 1.38 -0.06 0.00 -0.74 0.00 0.00 36.82 37.26 3giu h ILE 123 CO -0.08 0.14 0.65 0.40 0.00 0.00 0.00 178.15 179.26 3giu h ILE 124 N -0.09 1.13 0.00 -0.67 2.04 -1.01 -1.86 117.51 117.04 3giu h ILE 124 Ca 0.02 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 3giu h ILE 124 Cb 0.20 -0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.09 3giu h ILE 124 CO -0.00 0.22 -0.06 0.78 0.00 0.00 0.00 178.15 179.09 3giu h ASN 125 N 1.21 0.00 0.31 1.72 2.35 -0.62 0.79 115.58 121.34 3giu h ASN 125 Ca 0.41 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.16 3giu h ASN 125 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 3giu h ASN 125 CO -0.15 0.06 0.00 0.00 -1.65 0.00 0.00 177.43 175.69 3giu n GLN 126 N -3.94 0.67 -0.59 0.81 1.13 -0.71 -4.90 117.38 109.84 3giu n GLN 126 Ca -0.03 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 3giu n GLN 126 Cb 0.15 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.00 3giu n GLN 126 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3giu n GLY 127 N 1.11 0.66 3.85 1.08 0.00 0.27 -5.07 105.19 107.09 3giu n GLY 127 Ca 0.18 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 3giu n GLY 127 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3giu s LEU 128 N 0.00 4.12 0.04 0.99 1.43 -1.13 -5.04 118.68 119.09 3giu s LEU 128 Ca 0.00 0.17 -0.30 0.00 -1.03 0.00 0.00 54.13 52.97 3giu s LEU 128 Cb 0.00 -2.68 -0.08 0.00 0.03 0.00 0.00 46.19 43.47 3giu s LEU 128 CO 0.00 0.19 1.66 -2.84 0.23 0.00 0.00 176.35 175.59 3giu s PRO 129 N -2.31 4.20 -0.02 1.29 0.02 -1.26 -3.81 135.00 133.10 3giu s PRO 129 Ca 0.31 2.30 -0.04 0.00 0.02 0.00 0.00 61.00 63.59 3giu s PRO 129 Cb -0.13 -3.70 0.00 0.00 0.02 0.00 0.00 34.50 30.70 3giu s PRO 129 CO 0.23 -0.76 0.09 0.20 -0.33 0.00 0.00 177.00 176.44 3giu s GLY 130 N 2.67 0.01 0.01 0.52 0.00 -1.26 -1.52 107.32 107.75 3giu s GLY 130 Ca 0.74 0.02 -0.22 0.00 0.00 0.00 0.00 44.72 45.27 3giu s GLY 130 CO 0.32 -0.05 0.49 0.00 0.00 0.00 0.00 173.10 173.86 3giu s ALA 131 N -0.63 -1.24 -0.35 3.20 0.00 -0.92 -4.88 121.76 116.94 3giu s ALA 131 Ca -0.07 0.63 -0.22 0.00 0.00 0.00 0.00 51.96 52.30 3giu s ALA 131 Cb -0.04 0.24 0.01 0.00 0.00 0.00 0.00 23.12 23.32 3giu s ALA 131 CO 0.00 -0.42 0.72 -1.17 0.00 0.00 0.00 175.76 174.89 3giu s LEU 132 N -1.69 4.18 0.15 0.00 2.96 -1.26 -3.44 118.68 119.58 3giu s LEU 132 Ca -0.08 0.30 -0.17 0.00 -0.22 0.00 0.00 54.13 53.95 3giu s LEU 132 Cb -0.01 -2.93 -0.07 0.00 0.50 0.00 0.00 46.19 43.68 3giu s LEU 132 CO 0.02 -0.66 0.62 -0.55 -1.32 0.00 0.00 176.35 174.45 3giu s SER 133 N 1.80 6.97 0.00 3.68 0.15 -0.08 -4.86 113.70 121.36 3giu s SER 133 Ca 0.28 1.25 0.13 0.00 0.70 0.00 0.00 55.95 58.30 3giu s SER 133 Cb -0.14 -2.35 0.23 0.00 -1.71 0.00 0.00 66.02 62.05 3giu s SER 133 CO 0.16 0.13 1.10 0.59 1.20 0.00 0.00 173.24 176.41 3giu n ASN 134 N 1.02 2.57 -3.72 5.45 3.02 -1.26 -0.68 115.26 121.66 3giu n ASN 134 Ca -0.06 -1.77 -0.14 0.00 -0.03 0.00 0.00 54.58 52.58 3giu n ASN 134 Cb 0.51 -0.13 -0.15 0.00 -0.61 0.00 0.00 39.78 39.40 3giu n ASN 134 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3giu s SER 135 N -1.03 0.13 -0.05 6.41 0.15 -1.26 -4.71 113.70 113.33 3giu s SER 135 Ca 0.21 0.33 0.11 0.00 0.70 0.00 0.00 55.95 57.30 3giu s SER 135 Cb 0.12 0.24 0.40 0.00 -1.71 0.00 0.00 66.02 65.07 3giu s SER 135 CO 0.17 -0.18 1.26 0.00 1.20 0.00 0.00 173.24 175.70 3giu n ALA 136 N 4.54 2.76 0.00 5.45 0.00 -1.26 -5.04 120.51 126.97 3giu n ALA 136 Ca -0.20 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 52.38 3giu n ALA 136 Cb 0.51 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3giu n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3giu n GLY 137 N 0.85 -1.73 1.00 0.00 0.00 -1.26 -3.43 105.19 100.62 3giu n GLY 137 Ca 0.14 -1.39 0.04 0.00 0.00 0.00 0.00 46.02 44.82 3giu n GLY 137 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3giu n THR 138 N 0.00 0.57 -1.92 2.61 -2.24 -1.26 -4.62 114.28 107.42 3giu n THR 138 Ca 0.00 -1.31 0.00 0.00 -2.27 0.00 0.00 64.05 60.47 3giu n THR 138 Cb 0.00 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 3giu n THR 138 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3giu n PHE 139 N -0.07 0.00 0.18 4.78 7.35 -1.26 -0.73 117.46 127.71 3giu n PHE 139 Ca 0.08 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.79 3giu n PHE 139 Cb 0.93 0.00 0.36 0.00 0.35 0.00 0.00 39.48 41.12 3giu n PHE 139 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3giu h VAL 140 N 0.00 1.26 -0.26 -2.13 2.07 -1.97 -2.23 116.25 112.99 3giu h VAL 140 Ca 0.00 -1.24 -0.06 0.00 0.82 0.00 0.00 66.70 66.23 3giu h VAL 140 Cb 0.00 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 3giu h VAL 140 CO 0.00 0.35 -0.06 0.00 0.02 0.00 0.00 177.57 177.88 3giu h ASN 142 N 0.25 1.02 -0.64 0.00 -1.24 -1.55 -2.12 115.58 111.30 3giu h ASN 142 Ca 0.07 -0.13 0.08 0.00 0.71 0.00 0.00 56.30 57.02 3giu h ASN 142 Cb 0.54 -0.26 -0.06 0.00 0.73 0.00 0.00 38.32 39.26 3giu h ASN 142 CO 0.03 0.87 0.31 -0.74 -1.29 0.00 0.00 177.43 176.60 3giu h HIS 143 N 1.10 0.55 -0.15 0.67 2.76 -1.17 0.11 115.15 119.02 3giu h HIS 143 Ca 0.27 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.43 3giu h HIS 143 Cb 0.12 -0.15 -0.00 0.00 1.55 0.00 0.00 27.41 28.92 3giu h HIS 143 CO 0.01 0.21 -0.05 1.15 -1.30 0.00 0.00 177.93 177.96 3giu h THR 144 N 0.55 1.30 -0.53 6.26 2.02 -0.98 0.04 112.91 121.57 3giu h THR 144 Ca 0.31 -1.02 0.02 0.00 0.77 0.00 0.00 66.41 66.49 3giu h THR 144 Cb 0.29 1.66 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 3giu h THR 144 CO -0.24 0.30 0.32 0.25 0.37 0.00 0.00 175.52 176.52 3giu h LEU 145 N -0.01 0.52 -0.47 2.58 5.85 -1.14 -1.17 115.31 121.47 3giu h LEU 145 Ca 0.04 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 3giu h LEU 145 Cb 0.49 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 3giu h LEU 145 CO 0.02 0.36 0.29 0.22 -0.34 0.00 0.00 178.44 178.99 3giu h TYR 146 N 0.63 0.61 -0.81 1.25 3.20 -0.65 -1.34 116.97 119.85 3giu h TYR 146 Ca 0.21 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.04 3giu h TYR 146 Cb 0.02 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.06 3giu h TYR 146 CO -0.06 0.41 0.34 1.25 -1.64 0.00 0.00 178.16 178.46 3giu h HIS 147 N 0.62 1.22 -0.67 -3.82 2.76 -0.66 0.13 115.15 114.73 3giu h HIS 147 Ca 0.17 -0.08 0.01 0.00 -2.20 0.00 0.00 60.37 58.27 3giu h HIS 147 Cb -0.02 -0.37 -0.04 0.00 1.55 0.00 0.00 27.41 28.53 3giu h HIS 147 CO -0.03 0.91 0.44 -0.07 -1.30 0.00 0.00 177.93 177.88 3giu h LEU 148 N 1.18 0.76 -0.87 0.26 3.38 -0.97 0.58 115.31 119.62 3giu h LEU 148 Ca 0.27 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 3giu h LEU 148 Cb 0.19 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 3giu h LEU 148 CO -0.03 0.54 0.29 1.23 0.09 0.00 0.00 178.44 180.56 3giu h GLY 149 N 0.89 1.20 0.94 0.83 0.00 -0.43 -0.76 103.07 105.74 3giu h GLY 149 Ca 0.25 -0.65 -0.02 0.00 0.00 0.00 0.00 47.33 46.91 3giu h GLY 149 CO -0.07 0.62 0.15 -1.82 0.00 0.00 0.00 176.54 175.43 3giu h TYR 150 N 1.09 0.50 -0.76 5.60 3.20 -0.34 -1.18 116.97 125.08 3giu h TYR 150 Ca 0.25 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 3giu h TYR 150 Cb 0.22 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.30 3giu h TYR 150 CO 0.02 0.45 0.44 -0.07 -1.64 0.00 0.00 178.16 177.36 3giu h LEU 151 N 0.41 0.93 -0.86 2.82 3.38 -0.63 0.51 115.31 121.87 3giu h LEU 151 Ca 0.12 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3giu h LEU 151 Cb 0.14 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 3giu h LEU 151 CO -0.01 0.74 0.42 -0.61 0.09 0.00 0.00 178.44 179.07 3giu h GLN 152 N 1.05 1.23 -0.04 1.13 -0.00 -0.96 0.18 115.11 117.71 3giu h GLN 152 Ca 0.27 -0.18 -0.01 0.00 -0.00 0.00 0.00 58.65 58.74 3giu h GLN 152 Cb -0.01 -0.23 -0.00 0.00 0.00 0.00 0.00 27.48 27.25 3giu h GLN 152 CO -0.05 0.94 -0.00 0.22 0.00 0.00 0.00 178.83 179.94 3giu h ASP 153 N 1.22 0.06 0.48 -0.69 3.58 -0.80 -3.19 116.42 117.09 3giu h ASP 153 Ca 0.30 -0.32 -0.11 0.00 0.42 0.00 0.00 57.03 57.32 3giu h ASP 153 Cb 0.10 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.12 3giu h ASP 153 CO -0.04 0.37 -1.61 0.29 -2.88 0.00 0.00 179.24 175.37 3giu n LYS 154 N -4.89 0.64 0.00 0.28 4.76 0.13 -4.78 118.16 114.30 3giu n LYS 154 Ca -0.07 0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 3giu n LYS 154 Cb 0.19 -1.69 0.00 0.00 -1.84 0.00 0.00 35.03 31.68 3giu n LYS 154 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 3giu n HIS 155 N -2.64 0.00 -3.51 2.13 8.25 0.42 -5.00 115.22 114.87 3giu n HIS 155 Ca -0.09 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.10 3giu n HIS 155 Cb 0.74 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.75 3giu n HIS 155 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3giu n TYR 156 N -1.33 1.78 0.30 4.41 4.01 0.00 -4.95 117.16 121.37 3giu n TYR 156 Ca 0.00 -3.91 0.16 0.00 -0.16 0.00 0.00 57.90 53.99 3giu n TYR 156 Cb 0.14 -0.36 0.92 0.00 -0.31 0.00 0.00 39.34 39.72 3giu n TYR 156 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3giu h PRO 157 N 4.81 0.00 -0.01 -0.72 0.13 -1.82 -1.97 132.00 132.41 3giu h PRO 157 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3giu h PRO 157 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3giu h PRO 157 CO 0.63 0.03 -0.19 0.72 -0.23 0.00 0.00 178.00 178.96 3giu n HIS 158 N -3.63 0.00 -2.43 1.56 8.25 -1.26 -4.90 115.22 112.81 3giu n HIS 158 Ca -0.03 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.03 3giu n HIS 158 Cb 0.13 -0.16 -0.04 0.00 1.12 0.00 0.00 29.99 31.04 3giu n HIS 158 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3giu s LEU 159 N -2.50 4.53 -0.00 2.41 2.96 -0.74 -4.96 118.68 120.37 3giu s LEU 159 Ca 0.26 2.31 0.01 0.00 -0.22 0.00 0.00 54.13 56.49 3giu s LEU 159 Cb 0.20 -3.63 -0.04 0.00 0.50 0.00 0.00 46.19 43.22 3giu s LEU 159 CO 0.50 -0.20 -0.00 -0.13 -1.32 0.00 0.00 176.35 175.20 3giu s ARG 160 N -1.36 2.78 0.02 1.98 0.52 -0.67 -4.97 118.95 117.25 3giu s ARG 160 Ca 0.46 -0.61 -0.12 0.00 -0.52 0.00 0.00 55.73 54.94 3giu s ARG 160 Cb -0.33 -2.67 0.01 0.00 0.52 0.00 0.00 34.95 32.49 3giu s ARG 160 CO 0.42 0.63 0.24 -0.59 0.02 0.00 0.00 175.30 176.02 3giu s PHE 161 N -1.08 -0.06 0.15 -0.53 -0.12 -1.26 -1.43 117.98 113.66 3giu s PHE 161 Ca 0.19 -0.03 -0.18 0.00 -0.05 0.00 0.00 56.93 56.86 3giu s PHE 161 Cb -0.11 0.03 0.06 0.00 -0.63 0.00 0.00 43.02 42.37 3giu s PHE 161 CO 0.10 -0.41 0.88 0.41 -0.05 0.00 0.00 175.22 176.16 3giu n GLY 162 N 1.00 0.68 3.02 1.99 0.00 -0.64 -3.26 105.19 107.98 3giu n GLY 162 Ca -0.20 -1.11 -0.13 0.00 0.00 0.00 0.00 46.02 44.58 3giu n GLY 162 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3giu s PHE 163 N -2.68 -0.18 -0.12 1.61 5.36 -1.26 -1.68 117.98 119.02 3giu s PHE 163 Ca 0.20 0.45 0.01 0.00 -0.96 0.00 0.00 56.93 56.63 3giu s PHE 163 Cb -0.02 0.04 0.02 0.00 -0.34 0.00 0.00 43.02 42.71 3giu s PHE 163 CO 0.04 -0.11 -0.14 0.42 -1.46 0.00 0.00 175.22 173.98 3giu s ILE 164 N 0.33 1.44 0.22 3.12 1.01 -0.00 -0.84 121.20 126.47 3giu s ILE 164 Ca -0.02 -0.58 -0.14 0.00 0.00 0.00 0.00 60.65 59.92 3giu s ILE 164 Cb -0.03 -1.34 -0.08 0.00 0.01 0.00 0.00 42.46 41.02 3giu s ILE 164 CO -0.01 0.43 0.61 -1.00 0.00 0.00 0.00 174.94 174.97 3giu s HIS 165 N 1.26 3.51 0.13 3.97 3.76 -0.55 -1.83 115.29 125.54 3giu s HIS 165 Ca -0.01 1.08 0.07 0.00 -0.15 0.00 0.00 55.06 56.05 3giu s HIS 165 Cb -0.14 -2.40 -0.04 0.00 1.11 0.00 0.00 32.58 31.11 3giu s HIS 165 CO -0.06 0.30 -0.17 0.14 -0.85 0.00 0.00 174.74 174.11 3giu s VAL 166 N -1.68 1.55 0.96 -0.90 -7.23 0.12 -0.98 120.40 112.24 3giu s VAL 166 Ca 0.44 -1.71 -0.12 0.00 -1.81 0.00 0.00 61.98 58.78 3giu s VAL 166 Cb -0.13 -1.60 0.16 0.00 0.56 0.00 0.00 36.38 35.37 3giu s VAL 166 CO 0.20 -0.29 1.09 -2.84 -0.31 0.00 0.00 175.10 172.94 3giu s PRO 167 N -2.47 0.76 0.60 4.82 0.02 -1.26 -0.34 135.00 137.13 3giu s PRO 167 Ca 0.10 0.72 -0.18 0.00 0.02 0.00 0.00 61.00 61.66 3giu s PRO 167 Cb -0.07 -1.76 -0.06 0.00 0.02 0.00 0.00 34.50 32.64 3giu s PRO 167 CO 0.04 -2.56 0.78 0.66 -0.33 0.00 0.00 177.00 175.59 3giu n TYR 168 N -4.09 0.18 -2.87 6.54 4.01 -1.26 -4.74 117.16 114.93 3giu n TYR 168 Ca 0.06 0.43 -0.25 0.00 -0.16 0.00 0.00 57.90 57.98 3giu n TYR 168 Cb 0.56 -2.06 0.01 0.00 -0.31 0.00 0.00 39.34 37.54 3giu n TYR 168 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 3giu s ILE 169 N -1.62 4.48 0.53 -0.72 -4.36 -1.26 -4.34 121.20 113.90 3giu s ILE 169 Ca 0.73 -0.19 0.18 0.00 -0.26 0.00 0.00 60.65 61.12 3giu s ILE 169 Cb -0.42 -3.68 0.28 0.00 1.25 0.00 0.00 42.46 39.89 3giu s ILE 169 CO 0.50 -0.57 2.16 -0.65 0.24 0.00 0.00 174.94 176.61 3giu h PRO 170 N 0.33 0.00 0.00 0.37 0.11 -1.95 -0.66 132.00 130.20 3giu h PRO 170 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3giu h PRO 170 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3giu h PRO 170 CO 0.60 0.02 0.00 -0.85 -0.21 0.00 0.00 178.00 177.56 3giu n GLU 171 N -4.40 0.15 0.00 1.05 0.28 -1.26 -1.79 120.64 114.67 3giu n GLU 171 Ca -0.03 0.47 0.12 0.00 -0.16 0.00 0.00 57.16 57.56 3giu n GLU 171 Cb 0.10 -1.84 0.27 0.00 1.43 0.00 0.00 31.44 31.40 3giu n GLU 171 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 3giu n GLN 172 N -2.14 0.68 -0.22 3.44 6.02 -0.25 -4.35 117.38 120.56 3giu n GLN 172 Ca 0.01 -0.44 0.08 0.00 -0.01 0.00 0.00 57.00 56.65 3giu n GLN 172 Cb 0.16 -1.49 0.14 0.00 1.02 0.00 0.00 30.24 30.06 3giu n GLN 172 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 3giu n VAL 173 N -0.78 1.74 -1.89 5.09 0.24 -0.74 -4.99 118.33 116.99 3giu n VAL 173 Ca 0.10 -2.21 -0.42 0.00 -2.04 0.00 0.00 64.34 59.77 3giu n VAL 173 Cb 0.36 -0.15 -0.03 0.00 -1.47 0.00 0.00 33.84 32.55 3giu n VAL 173 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3giu s ILE 174 N -2.63 2.96 0.00 1.34 1.01 -1.24 -0.87 121.20 121.78 3giu s ILE 174 Ca 0.30 0.42 0.00 0.00 0.00 0.00 0.00 60.65 61.37 3giu s ILE 174 Cb 0.27 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.47 3giu s ILE 174 CO 0.01 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.56 3giu n GLY 175 N 4.04 0.82 2.48 6.18 0.00 -1.26 -4.94 105.19 112.51 3giu n GLY 175 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 3giu n GLY 175 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3giu n LYS 176 N -2.28 2.67 0.19 1.61 5.02 -0.05 -4.96 118.16 120.36 3giu n LYS 176 Ca 0.00 -4.69 0.14 0.00 -2.02 0.00 0.00 58.31 51.74 3giu n LYS 176 Cb 0.00 -2.27 0.65 0.00 -0.02 0.00 0.00 35.03 33.39 3giu n LYS 176 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3giu h PRO 177 N 4.11 0.00 -0.35 1.97 0.13 -1.93 -1.99 132.00 133.95 3giu h PRO 177 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 3giu h PRO 177 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 3giu h PRO 177 CO 0.86 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.38 3giu n ASP 178 N -2.51 2.32 -4.47 1.44 8.00 -1.26 -4.84 116.55 115.23 3giu n ASP 178 Ca 0.00 -1.90 -0.36 0.00 0.71 0.00 0.00 54.79 53.23 3giu n ASP 178 Cb 0.17 -0.23 -0.12 0.00 -0.02 0.00 0.00 41.12 40.92 3giu n ASP 178 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3giu s THR 179 N -1.54 4.44 0.68 -3.53 2.01 -0.75 -5.09 115.64 111.87 3giu s THR 179 Ca 0.32 -0.13 -0.17 0.00 0.31 0.00 0.00 61.69 62.02 3giu s THR 179 Cb 0.17 -3.07 0.00 0.00 0.01 0.00 0.00 72.50 69.61 3giu s THR 179 CO 0.24 0.34 1.23 -2.65 -0.69 0.00 0.00 174.62 173.09 3giu n PRO 180 N 4.81 0.90 0.00 4.92 -0.02 -1.26 -4.98 135.00 139.36 3giu n PRO 180 Ca -0.16 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 3giu n PRO 180 Cb 0.52 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 3giu n PRO 180 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3giu n SER 181 N -2.02 0.00 -4.88 2.55 3.41 -1.26 -4.47 113.62 106.96 3giu n SER 181 Ca 0.15 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.40 3giu n SER 181 Cb 0.48 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.38 3giu n SER 181 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 3giu s PRO 183 N 1.68 3.55 0.26 4.33 0.02 -1.26 -4.94 135.00 138.64 3giu s PRO 183 Ca 0.00 -0.05 -0.02 0.00 0.02 0.00 0.00 61.00 60.95 3giu s PRO 183 Cb 0.00 -3.16 0.49 0.00 0.02 0.00 0.00 34.50 31.85 3giu s PRO 183 CO 0.00 0.72 1.77 1.25 -0.33 0.00 0.00 177.00 180.42 3giu h LEU 184 N 4.58 0.55 -1.60 -5.54 5.85 -1.98 -1.10 115.31 116.07 3giu h LEU 184 Ca -0.53 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.30 3giu h LEU 184 Cb 1.22 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 3giu h LEU 184 CO 0.62 0.26 0.30 1.05 -0.34 0.00 0.00 178.44 180.33 3giu h GLU 185 N 0.66 0.51 -0.13 1.25 4.11 -2.01 -0.40 114.58 118.57 3giu h GLU 185 Ca 0.44 -0.03 -0.21 0.00 0.07 0.00 0.00 59.36 59.63 3giu h GLU 185 Cb 0.57 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.71 3giu h GLU 185 CO -0.33 0.34 -0.77 0.87 0.07 0.00 0.00 179.01 179.19 3giu h LYS 186 N 0.53 0.68 -0.36 1.06 1.57 -1.66 -1.90 116.57 116.49 3giu h LYS 186 Ca 0.18 -0.56 0.02 0.00 -1.87 0.00 0.00 60.65 58.42 3giu h LYS 186 Cb 0.07 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 3giu h LYS 186 CO -0.04 1.17 0.20 0.82 -0.57 0.00 0.00 179.45 181.03 3giu h ILE 187 N 0.46 1.02 -0.63 1.86 2.04 -0.67 -0.57 117.51 121.04 3giu h ILE 187 Ca -0.05 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.69 3giu h ILE 187 Cb 1.38 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 38.00 3giu h ILE 187 CO 0.15 0.07 0.41 0.58 0.00 0.00 0.00 178.15 179.36 3giu h VAL 188 N 0.41 1.13 -0.83 1.67 2.07 -1.03 0.14 116.25 119.81 3giu h VAL 188 Ca 0.14 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 3giu h VAL 188 Cb 0.02 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 29.99 3giu h VAL 188 CO -0.07 0.15 0.49 0.00 0.02 0.00 0.00 177.57 178.16 3giu h ALA 189 N 1.24 1.06 -0.31 1.67 0.00 -1.00 -1.16 119.26 120.76 3giu h ALA 189 Ca 0.24 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 3giu h ALA 189 Cb -0.06 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 3giu h ALA 189 CO -0.07 0.53 -0.17 0.78 0.00 0.00 0.00 179.25 180.32 3giu h GLY 190 N 1.15 0.72 1.02 0.00 0.00 -0.51 -1.54 103.07 103.90 3giu h GLY 190 Ca 0.30 -0.66 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 3giu h GLY 190 CO -0.05 0.60 0.55 1.41 0.00 0.00 0.00 176.54 179.05 3giu h LEU 191 N 0.42 1.11 -0.36 3.11 3.38 -0.85 -0.79 115.31 121.33 3giu h LEU 191 Ca 0.07 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3giu h LEU 191 Cb 0.71 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3giu h LEU 191 CO 0.05 0.86 0.24 0.74 0.09 0.00 0.00 178.44 180.41 3giu h THR 192 N 1.27 1.09 -0.73 0.22 2.02 -1.04 -0.92 112.91 114.83 3giu h THR 192 Ca 0.33 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.32 3giu h THR 192 Cb -0.04 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 66.90 3giu h THR 192 CO -0.06 0.09 0.37 0.00 0.37 0.00 0.00 175.52 176.28 3giu h ALA 193 N 1.13 0.93 -0.52 6.16 0.00 -0.94 -1.06 119.26 124.95 3giu h ALA 193 Ca 0.13 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3giu h ALA 193 Cb -0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3giu h ALA 193 CO -0.03 0.48 0.29 0.00 0.00 0.00 0.00 179.25 179.99 3giu h ALA 194 N 1.18 0.67 -0.47 0.00 0.00 -0.83 -2.64 119.26 117.17 3giu h ALA 194 Ca 0.25 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 3giu h ALA 194 Cb 0.09 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3giu h ALA 194 CO -0.03 0.18 -0.09 0.82 0.00 0.00 0.00 179.25 180.13 3giu h ILE 195 N 0.70 1.26 -0.17 0.00 2.04 -0.80 -2.38 117.51 118.15 3giu h ILE 195 Ca 0.18 -1.16 0.04 0.00 1.00 0.00 0.00 64.86 64.92 3giu h ILE 195 Cb 0.04 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 3giu h ILE 195 CO -0.03 0.40 0.12 -0.33 0.00 0.00 0.00 178.15 178.31 3giu h GLU 196 N 0.77 0.06 -0.00 2.37 5.08 -0.87 -1.53 114.58 120.46 3giu h GLU 196 Ca 0.13 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3giu h GLU 196 Cb 0.58 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.82 3giu h GLU 196 CO 0.04 0.04 -0.09 0.00 -1.00 0.00 0.00 179.01 178.00 3giu n ALA 197 N -2.56 2.65 -2.18 3.43 0.00 -0.90 -4.85 120.51 116.10 3giu n ALA 197 Ca 0.01 -0.20 -0.41 0.00 0.00 0.00 0.00 53.44 52.84 3giu n ALA 197 Cb 0.21 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 3giu n ALA 197 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3giu s ILE 198 N -2.69 3.72 0.35 0.00 1.01 -0.58 -4.92 121.20 118.10 3giu s ILE 198 Ca 0.23 1.36 -0.12 0.00 0.00 0.00 0.00 60.65 62.12 3giu s ILE 198 Cb 0.20 -3.87 0.05 0.00 0.01 0.00 0.00 42.46 38.85 3giu s ILE 198 CO 0.51 0.17 0.67 -1.54 0.00 0.00 0.00 174.94 174.75 3giu n SER 199 N 3.06 -1.95 -0.73 3.58 3.41 -1.26 -5.03 113.62 114.70 3giu n SER 199 Ca 0.06 -2.44 0.09 0.00 -0.26 0.00 0.00 58.87 56.32 3giu n SER 199 Cb 0.45 3.28 0.27 0.00 -0.26 0.00 0.00 64.21 67.95 3giu n SER 199 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3giu n ASN 200 N -1.49 2.14 -4.90 4.04 3.02 -1.26 -4.71 115.26 112.10 3giu n ASN 200 Ca -0.07 -1.88 -0.28 0.00 -0.03 0.00 0.00 54.58 52.32 3giu n ASN 200 Cb 0.53 -0.21 0.03 0.00 -0.61 0.00 0.00 39.78 39.52 3giu n ASN 200 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3giu s ASP 201 N -1.28 5.74 0.42 6.41 1.01 -1.26 -5.01 116.67 122.70 3giu s ASP 201 Ca 0.31 0.97 -0.25 0.00 0.71 0.00 0.00 52.55 54.29 3giu s ASP 201 Cb 0.17 -1.96 -0.10 0.00 1.01 0.00 0.00 42.92 42.04 3giu s ASP 201 CO 0.23 -1.05 1.26 1.21 0.21 0.00 0.00 175.17 177.03 3giu n GLU 202 N -2.69 1.89 -1.18 8.23 2.13 -1.26 -4.83 120.64 122.94 3giu n GLU 202 Ca 0.05 0.67 -0.32 0.00 0.66 0.00 0.00 57.16 58.22 3giu n GLU 202 Cb 0.57 -2.37 0.11 0.00 0.27 0.00 0.00 31.44 30.02 3giu n GLU 202 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3giu s ASP 203 N -0.55 4.06 0.70 4.31 2.15 -1.26 -5.01 116.67 121.07 3giu s ASP 203 Ca 0.61 2.03 -0.14 0.00 0.43 0.00 0.00 52.55 55.48 3giu s ASP 203 Cb -0.51 -2.55 0.02 0.00 -0.30 0.00 0.00 42.92 39.58 3giu s ASP 203 CO 0.58 -2.34 1.13 -0.76 -0.17 0.00 0.00 175.17 173.61 3giu s LEU 204 N -5.87 3.32 -0.40 -1.34 1.43 -1.26 -4.98 118.68 109.57 3giu s LEU 204 Ca 0.65 2.06 0.07 0.00 -1.03 0.00 0.00 54.13 55.89 3giu s LEU 204 Cb -0.21 -4.56 0.43 0.00 0.03 0.00 0.00 46.19 41.89 3giu s LEU 204 CO 0.53 -1.86 1.11 1.41 0.23 0.00 0.00 176.35 177.76 3giu n HIS 205 N -2.66 3.06 -1.46 0.29 8.25 -1.26 -4.68 115.22 116.76 3giu n HIS 205 Ca 0.11 -2.94 -0.29 0.00 -0.26 0.00 0.00 57.72 54.34 3giu n HIS 205 Cb 0.52 -0.15 0.12 0.00 1.12 0.00 0.00 29.99 31.59 3giu n HIS 205 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3giu s LEU 206 N -3.51 2.30 -1.34 2.41 1.43 -1.26 -4.92 118.68 113.79 3giu s LEU 206 Ca 0.46 1.24 -0.13 0.00 -1.03 0.00 0.00 54.13 54.67 3giu s LEU 206 Cb 0.41 -3.70 0.11 0.00 0.03 0.00 0.00 46.19 43.03 3giu s LEU 206 CO -0.13 -2.33 1.91 0.00 0.23 0.00 0.00 176.35 176.03 3giu n ALA 207 N -3.66 4.93 -0.58 4.21 0.00 -1.26 -4.54 120.51 119.61 3giu n ALA 207 Ca 0.07 -4.08 0.07 0.00 0.00 0.00 0.00 53.44 49.49 3giu n ALA 207 Cb 0.57 -3.28 0.18 0.00 0.00 0.00 0.00 19.45 16.92 3giu n ALA 207 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3giu n LEU 208 N 5.60 3.20 -4.65 0.00 4.77 -1.26 -5.02 117.00 119.63 3giu n LEU 208 Ca 0.45 -2.53 -0.29 0.00 -0.03 0.00 0.00 56.01 53.62 3giu n LEU 208 Cb 0.40 -0.36 0.19 0.00 -2.33 0.00 0.00 43.42 41.32 3giu n LEU 208 CO 0.81 0.68 0.62 -0.83 -1.33 0.00 0.00 177.39 177.35 3giu s GLY 209 N -1.56 1.56 0.48 -0.72 0.00 -1.26 -4.48 107.32 101.34 3giu s GLY 209 Ca 0.30 -0.34 -0.07 0.00 0.00 0.00 0.00 44.72 44.60 3giu s GLY 209 CO 0.10 0.29 0.81 -0.51 0.00 0.00 0.00 173.10 173.80 3giu s THR 210 N -2.90 4.85 0.00 0.90 -4.23 -1.26 -5.04 115.64 107.97 3giu s THR 210 Ca 0.66 0.39 0.00 0.00 -1.18 0.00 0.00 61.69 61.56 3giu s THR 210 Cb -0.19 -3.83 0.00 0.00 1.34 0.00 0.00 72.50 69.81 3giu s THR 210 CO 0.59 -0.80 0.90 0.35 -0.54 0.00 0.00 174.62 175.11 3giu n THR 211 N -2.08 0.00 0.00 3.99 -2.24 -1.26 -5.26 114.28 107.43 3giu n THR 211 Ca 0.02 1.40 0.00 0.00 -2.27 0.00 0.00 64.05 63.19 3giu n THR 211 Cb 0.55 -2.31 0.00 0.00 -2.10 0.00 0.00 70.33 66.47 3giu n THR 211 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66