#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t26 n LYS 20 N 0.00 1.13 -1.97 0.54 5.02 -1.26 -4.96 118.16 116.66 1t26 n LYS 20 Ca 0.00 0.43 -0.35 0.00 -2.02 0.00 0.00 58.31 56.37 1t26 n LYS 20 Cb 0.00 -2.28 0.03 0.00 -0.02 0.00 0.00 35.03 32.76 1t26 n LYS 20 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1t26 s ALA 21 N -1.43 2.52 -0.23 7.82 0.00 -1.26 -4.82 121.76 124.37 1t26 s ALA 21 Ca 0.75 0.83 -0.06 0.00 0.00 0.00 0.00 51.96 53.48 1t26 s ALA 21 Cb -0.43 -3.39 -0.02 0.00 0.00 0.00 0.00 23.12 19.28 1t26 s ALA 21 CO 0.47 -1.15 0.01 0.21 0.00 0.00 0.00 175.76 175.31 1t26 s LYS 22 N -3.56 3.55 -0.24 0.00 2.20 -1.26 -1.10 119.74 119.34 1t26 s LYS 22 Ca 0.73 -0.54 -0.01 0.00 -0.36 0.00 0.00 55.97 55.80 1t26 s LYS 22 Cb -0.26 -3.16 0.03 0.00 -1.51 0.00 0.00 37.83 32.93 1t26 s LYS 22 CO 0.34 -0.14 -0.09 0.42 -0.36 0.00 0.00 175.35 175.53 1t26 s ILE 23 N 1.41 2.70 -0.24 5.43 1.01 0.03 -0.64 121.20 130.89 1t26 s ILE 23 Ca 0.05 -1.04 -0.08 0.00 0.00 0.00 0.00 60.65 59.58 1t26 s ILE 23 Cb -0.15 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1t26 s ILE 23 CO 0.01 0.25 0.10 -0.69 0.00 0.00 0.00 174.94 174.61 1t26 s VAL 24 N 1.31 4.71 -0.51 2.92 1.01 -0.19 -1.36 120.40 128.27 1t26 s VAL 24 Ca 0.00 -0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.77 1t26 s VAL 24 Cb -0.16 -3.20 0.08 0.00 0.00 0.00 0.00 36.38 33.10 1t26 s VAL 24 CO -0.06 0.34 0.54 -0.76 0.00 0.00 0.00 175.10 175.16 1t26 s LEU 25 N 1.39 5.42 -0.79 3.92 1.43 0.35 -1.23 118.68 129.17 1t26 s LEU 25 Ca 0.06 -1.26 -0.23 0.00 -1.03 0.00 0.00 54.13 51.67 1t26 s LEU 25 Cb -0.15 -2.30 0.07 0.00 0.03 0.00 0.00 46.19 43.84 1t26 s LEU 25 CO 0.05 -0.84 1.15 -0.69 0.23 0.00 0.00 176.35 176.24 1t26 s VAL 26 N 2.17 4.20 0.00 -1.59 1.01 0.13 -1.24 120.40 125.08 1t26 s VAL 26 Ca 0.09 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.59 1t26 s VAL 26 Cb -0.23 -4.82 0.00 0.00 0.00 0.00 0.00 36.38 31.33 1t26 s VAL 26 CO 0.08 -1.64 0.00 0.61 0.00 0.00 0.00 175.10 174.15 1t26 n GLY 27 N 5.62 3.16 1.83 4.51 0.00 0.19 -1.47 105.19 119.04 1t26 n GLY 27 Ca 0.09 -1.08 -0.20 0.00 0.00 0.00 0.00 46.02 44.83 1t26 n GLY 27 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1t26 n SER 28 N 0.00 4.59 -0.39 1.61 7.64 -1.13 -4.42 113.62 121.52 1t26 n SER 28 Ca 0.00 -3.77 0.00 0.00 1.01 0.00 0.00 58.87 56.11 1t26 n SER 28 Cb 0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.80 1t26 n SER 28 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t26 n GLY 29 N -0.78 1.23 0.06 0.23 0.00 -1.26 -4.57 105.19 100.11 1t26 n GLY 29 Ca 0.41 -1.51 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 1t26 n GLY 29 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1t26 h MET 30 N 0.00 0.07 -0.48 1.61 2.86 -1.99 -1.37 114.93 115.63 1t26 h MET 30 Ca 0.00 -0.02 -0.10 0.00 -2.06 0.00 0.00 59.70 57.53 1t26 h MET 30 Cb 0.00 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1t26 h MET 30 CO 0.00 0.28 -0.07 0.82 1.06 0.00 0.00 176.91 179.00 1t26 h ILE 31 N -0.16 1.27 -1.00 -1.22 2.04 -1.92 -2.80 117.51 113.71 1t26 h ILE 31 Ca 0.01 -1.18 0.07 0.00 1.00 0.00 0.00 64.86 64.76 1t26 h ILE 31 Cb 0.25 1.05 -0.07 0.00 -0.74 0.00 0.00 36.82 37.31 1t26 h ILE 31 CO 0.00 0.41 0.64 1.23 0.00 0.00 0.00 178.15 180.44 1t26 h GLY 32 N 0.75 1.54 1.00 5.37 0.00 -1.75 -1.36 103.07 108.62 1t26 h GLY 32 Ca 0.13 -0.47 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 1t26 h GLY 32 CO 0.04 0.32 0.11 -1.33 0.00 0.00 0.00 176.54 175.67 1t26 h GLY 33 N 1.15 0.96 1.08 4.60 0.00 -1.01 -1.71 103.07 108.14 1t26 h GLY 33 Ca 0.44 -0.62 -0.11 0.00 0.00 0.00 0.00 47.33 47.04 1t26 h GLY 33 CO -0.18 0.58 -0.09 -2.08 0.00 0.00 0.00 176.54 174.76 1t26 h VAL 35 N 0.78 1.27 -0.40 4.60 2.07 -1.22 -2.33 116.25 121.01 1t26 h VAL 35 Ca 0.17 -1.24 0.03 0.00 0.82 0.00 0.00 66.70 66.47 1t26 h VAL 35 Cb 0.38 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 1t26 h VAL 35 CO 0.01 0.44 0.21 0.24 0.02 0.00 0.00 177.57 178.49 1t26 h MET 36 N 0.89 0.42 -0.62 1.57 2.86 -1.09 -0.39 114.93 118.57 1t26 h MET 36 Ca 0.14 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1t26 h MET 36 Cb 0.66 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.19 1t26 h MET 36 CO 0.05 0.28 0.41 0.00 1.06 0.00 0.00 176.91 178.70 1t26 h ALA 37 N 1.20 0.79 -0.62 6.32 0.00 -1.17 0.20 119.26 125.98 1t26 h ALA 37 Ca 0.17 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1t26 h ALA 37 Cb 0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1t26 h ALA 37 CO -0.10 0.23 0.39 1.15 0.00 0.00 0.00 179.25 180.92 1t26 h THR 38 N 0.85 1.11 -0.07 0.00 2.02 -0.99 -2.40 112.91 113.43 1t26 h THR 38 Ca 0.23 -0.27 -0.16 0.00 0.77 0.00 0.00 66.41 66.98 1t26 h THR 38 Cb -0.08 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.58 1t26 h THR 38 CO -0.05 0.14 -0.65 -0.07 0.37 0.00 0.00 175.52 175.27 1t26 h LEU 39 N 0.78 0.32 -0.64 2.58 3.38 -0.64 -1.83 115.31 119.27 1t26 h LEU 39 Ca 0.24 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1t26 h LEU 39 Cb -0.02 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1t26 h LEU 39 CO -0.08 0.88 0.26 0.40 0.09 0.00 0.00 178.44 179.99 1t26 h ILE 40 N 0.20 1.23 -0.43 1.22 2.04 -0.71 -1.61 117.51 119.46 1t26 h ILE 40 Ca -0.01 -0.72 -0.08 0.00 1.00 0.00 0.00 64.86 65.05 1t26 h ILE 40 Cb 1.18 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1t26 h ILE 40 CO 0.10 0.28 -0.05 0.58 0.00 0.00 0.00 178.15 179.07 1t26 h VAL 41 N 0.89 1.27 -0.88 1.67 2.07 -1.30 0.09 116.25 120.05 1t26 h VAL 41 Ca 0.21 -1.12 0.09 0.00 0.82 0.00 0.00 66.70 66.71 1t26 h VAL 41 Cb 0.19 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.03 1t26 h VAL 41 CO -0.02 0.38 0.57 1.56 0.02 0.00 0.00 177.57 180.08 1t26 h GLN 42 N 0.62 0.86 -0.12 1.57 1.08 -1.03 -2.04 115.11 116.04 1t26 h GLN 42 Ca 0.12 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1t26 h GLN 42 Cb 0.56 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 1t26 h GLN 42 CO 0.03 0.57 0.00 1.63 -0.95 0.00 0.00 178.83 180.11 1t26 n LYS 43 N -4.52 2.13 -3.99 1.46 5.02 -0.63 -4.98 118.16 112.64 1t26 n LYS 43 Ca 0.15 -1.66 -0.30 0.00 -2.02 0.00 0.00 58.31 54.48 1t26 n LYS 43 Cb 0.30 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 1t26 n LYS 43 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1t26 n ASN 44 N 0.96 -3.15 0.12 4.39 5.15 -0.10 -4.90 115.26 117.74 1t26 n ASN 44 Ca 0.17 -0.90 -0.00 0.00 -0.60 0.00 0.00 54.58 53.25 1t26 n ASN 44 Cb 0.51 -3.41 0.06 0.00 -0.53 0.00 0.00 39.78 36.41 1t26 n ASN 44 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1t26 h LEU 45 N -1.84 0.00 0.00 1.20 3.38 -1.54 -3.49 115.31 113.03 1t26 h LEU 45 Ca -0.60 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.37 1t26 h LEU 45 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1t26 h LEU 45 CO 0.69 0.65 0.00 0.61 0.09 0.00 0.00 178.44 180.47 1t26 n GLY 46 N 0.94 0.66 3.76 0.83 0.00 -1.26 -4.53 105.19 105.58 1t26 n GLY 46 Ca 0.01 -1.15 -0.37 0.00 0.00 0.00 0.00 46.02 44.50 1t26 n GLY 46 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1t26 s ASP 47 N 0.00 5.67 -0.06 1.61 1.01 -0.26 -4.65 116.67 120.00 1t26 s ASP 47 Ca 0.00 2.51 0.05 0.00 0.71 0.00 0.00 52.55 55.82 1t26 s ASP 47 Cb 0.00 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 1t26 s ASP 47 CO 0.00 -1.27 -0.21 -0.69 0.21 0.00 0.00 175.17 173.21 1t26 s VAL 49 N -1.45 1.74 -0.20 -1.27 1.01 0.69 -0.79 120.40 120.13 1t26 s VAL 49 Ca 0.69 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.76 1t26 s VAL 49 Cb -0.34 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1t26 s VAL 49 CO 0.40 0.49 -0.10 -0.69 0.00 0.00 0.00 175.10 175.20 1t26 s VAL 50 N 0.01 2.91 -0.55 2.92 1.01 -0.47 -1.23 120.40 125.01 1t26 s VAL 50 Ca -0.06 -0.66 -0.20 0.00 0.00 0.00 0.00 61.98 61.07 1t26 s VAL 50 Cb -0.13 -2.29 0.07 0.00 0.00 0.00 0.00 36.38 34.03 1t26 s VAL 50 CO 0.04 0.47 0.71 -0.76 0.00 0.00 0.00 175.10 175.56 1t26 s LEU 51 N 1.30 4.92 -0.11 3.92 1.43 0.88 -0.49 118.68 130.53 1t26 s LEU 51 Ca 0.04 -0.98 -0.06 0.00 -1.03 0.00 0.00 54.13 52.10 1t26 s LEU 51 Cb -0.14 -2.45 -0.04 0.00 0.03 0.00 0.00 46.19 43.59 1t26 s LEU 51 CO -0.05 -1.04 0.11 0.12 0.23 0.00 0.00 176.35 175.71 1t26 s PHE 52 N 2.93 3.49 0.18 0.29 5.36 -0.37 -0.66 117.98 129.20 1t26 s PHE 52 Ca 0.17 0.44 -0.22 0.00 -0.96 0.00 0.00 56.93 56.36 1t26 s PHE 52 Cb -0.19 -1.91 0.06 0.00 -0.34 0.00 0.00 43.02 40.64 1t26 s PHE 52 CO 0.11 0.67 0.61 0.34 -1.46 0.00 0.00 175.22 175.49 1t26 s ASP 53 N -0.97 -0.49 0.35 6.13 -1.08 -0.82 -0.64 116.67 119.14 1t26 s ASP 53 Ca 0.14 -0.14 0.23 0.00 -0.52 0.00 0.00 52.55 52.26 1t26 s ASP 53 Cb -0.12 0.62 0.20 0.00 -1.46 0.00 0.00 42.92 42.16 1t26 s ASP 53 CO 0.04 -1.03 1.38 0.16 0.52 0.00 0.00 175.17 176.24 1t26 h ILE 54 N 2.03 0.01 -2.93 4.11 3.07 -1.93 -3.39 117.51 118.47 1t26 h ILE 54 Ca -0.31 -1.01 -0.54 0.00 1.55 0.00 0.00 64.86 64.54 1t26 h ILE 54 Cb 1.30 1.81 0.01 0.00 -0.27 0.00 0.00 36.82 39.66 1t26 h ILE 54 CO 0.36 0.01 0.80 -0.69 -1.05 0.00 0.00 178.15 177.57 1t26 s VAL 55 N -3.27 3.57 0.31 0.16 1.01 -1.26 -4.98 120.40 115.95 1t26 s VAL 55 Ca 0.04 1.03 -0.29 0.00 0.00 0.00 0.00 61.98 62.76 1t26 s VAL 55 Cb 0.07 -3.66 -0.10 0.00 0.00 0.00 0.00 36.38 32.69 1t26 s VAL 55 CO 0.72 0.02 1.36 -0.75 0.00 0.00 0.00 175.10 176.46 1t26 s LYS 56 N 1.99 4.31 0.00 2.72 2.47 -1.26 -4.11 119.74 125.86 1t26 s LYS 56 Ca 0.64 2.27 0.00 0.00 -1.56 0.00 0.00 55.97 57.33 1t26 s LYS 56 Cb -0.33 -3.08 0.00 0.00 -1.46 0.00 0.00 37.83 32.96 1t26 s LYS 56 CO 0.28 -0.29 0.00 0.09 0.16 0.00 0.00 175.35 175.59 1t26 n ASN 57 N 1.27 0.00 -0.26 1.43 3.02 -1.26 -4.75 115.26 114.71 1t26 n ASN 57 Ca 0.02 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.59 1t26 n ASN 57 Cb 0.41 0.00 0.10 0.00 -0.61 0.00 0.00 39.78 39.68 1t26 n ASN 57 CO 0.00 0.00 0.00 -0.03 -2.62 0.00 0.00 177.26 174.61 1t26 h MET 58 N 0.00 0.01 -0.70 3.52 4.05 -2.01 -0.10 114.93 119.70 1t26 h MET 58 Ca 0.00 -0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.43 1t26 h MET 58 Cb 0.00 -0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 30.76 1t26 h MET 58 CO 0.00 0.01 0.46 -1.35 0.23 0.00 0.00 176.91 176.26 1t26 h PRO 59 N 0.01 0.90 -0.71 0.39 0.11 -1.85 -1.45 132.00 129.40 1t26 h PRO 59 Ca 0.37 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.38 1t26 h PRO 59 Cb 0.58 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.46 1t26 h PRO 59 CO -0.76 0.59 0.27 0.45 -0.21 0.00 0.00 178.00 178.34 1t26 h HIS 60 N 0.92 1.08 -0.15 0.65 3.86 -1.34 -0.46 115.15 119.72 1t26 h HIS 60 Ca 0.26 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.37 1t26 h HIS 60 Cb -0.06 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.08 1t26 h HIS 60 CO -0.00 0.83 -0.01 0.78 0.86 0.00 0.00 177.93 180.39 1t26 h GLY 61 N 1.09 0.29 1.04 2.45 0.00 -0.68 -1.38 103.07 105.88 1t26 h GLY 61 Ca 0.24 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 1t26 h GLY 61 CO -0.02 0.21 0.32 0.50 0.00 0.00 0.00 176.54 177.55 1t26 h LYS 62 N -0.00 1.17 -0.38 4.80 1.57 -1.20 -2.30 116.57 120.23 1t26 h LYS 62 Ca 0.04 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1t26 h LYS 62 Cb 0.41 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1t26 h LYS 62 CO 0.01 0.95 0.22 0.00 -0.57 0.00 0.00 179.45 180.06 1t26 h ALA 63 N 1.17 0.48 0.32 3.86 0.00 -1.03 -0.73 119.26 123.33 1t26 h ALA 63 Ca 0.26 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1t26 h ALA 63 Cb 0.21 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1t26 h ALA 63 CO -0.02 -0.02 -0.23 1.25 0.00 0.00 0.00 179.25 180.23 1t26 h LEU 64 N 0.49 -0.58 -0.40 0.00 5.85 -1.04 0.12 115.31 119.75 1t26 h LEU 64 Ca 0.14 0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.98 1t26 h LEU 64 Cb 0.01 0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.14 1t26 h LEU 64 CO -0.02 -0.35 -0.16 -0.78 -0.34 0.00 0.00 178.44 176.79 1t26 h ASP 65 N -0.54 -0.54 -0.37 1.25 3.58 -1.35 -2.53 116.42 115.92 1t26 h ASP 65 Ca -0.03 0.14 -0.07 0.00 0.42 0.00 0.00 57.03 57.49 1t26 h ASP 65 Cb 0.47 0.32 -0.02 0.00 1.72 0.00 0.00 39.33 41.81 1t26 h ASP 65 CO 0.01 -0.19 -0.01 0.74 -2.88 0.00 0.00 179.24 176.90 1t26 h THR 66 N -0.07 1.24 -0.55 2.25 2.02 -0.85 -3.02 112.91 113.92 1t26 h THR 66 Ca 0.20 -1.00 0.06 0.00 0.77 0.00 0.00 66.41 66.44 1t26 h THR 66 Cb 0.38 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 1t26 h THR 66 CO -0.46 0.35 0.37 0.77 0.37 0.00 0.00 175.52 176.92 1t26 h SER 67 N 0.70 0.45 0.29 4.18 4.64 -0.31 -1.80 113.55 121.71 1t26 h SER 67 Ca 0.14 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.44 1t26 h SER 67 Cb 0.45 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1t26 h SER 67 CO 0.02 0.30 -0.10 0.45 -0.87 0.00 0.00 176.83 176.63 1t26 h HIS 68 N 0.52 0.00 0.00 4.77 3.86 -1.50 -2.46 115.15 120.34 1t26 h HIS 68 Ca 0.24 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.45 1t26 h HIS 68 Cb 0.27 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1t26 h HIS 68 CO -0.00 0.10 0.00 0.25 0.86 0.00 0.00 177.93 179.14 1t26 n THR 69 N -3.69 1.12 -0.21 2.45 -2.24 -0.68 -1.98 114.28 109.05 1t26 n THR 69 Ca -0.02 0.35 0.13 0.00 -2.27 0.00 0.00 64.05 62.24 1t26 n THR 69 Cb 0.21 -1.23 0.44 0.00 -2.10 0.00 0.00 70.33 67.64 1t26 n THR 69 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1t26 h ASN 70 N 0.00 0.53 0.59 3.42 2.35 -1.61 0.38 115.58 121.24 1t26 h ASN 70 Ca 0.00 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.75 1t26 h ASN 70 Cb 0.21 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 38.51 1t26 h ASN 70 CO 0.00 0.28 -0.28 0.58 -1.65 0.00 0.00 177.43 176.36 1t26 h VAL 71 N 0.57 0.36 -0.02 2.81 2.07 -1.64 -1.84 116.25 118.55 1t26 h VAL 71 Ca 0.40 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.67 1t26 h VAL 71 Cb 0.74 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1t26 h VAL 71 CO -0.16 0.03 -0.05 0.24 0.02 0.00 0.00 177.57 177.66 1t26 h MET 72 N -0.95 0.03 -0.00 1.57 2.86 -1.64 -2.96 114.93 113.84 1t26 h MET 72 Ca -0.08 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1t26 h MET 72 Cb 0.65 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.31 1t26 h MET 72 CO 0.13 0.09 -0.41 0.00 1.06 0.00 0.00 176.91 177.78 1t26 n ALA 73 N -2.52 3.38 -3.02 6.32 0.00 0.09 -4.95 120.51 119.80 1t26 n ALA 73 Ca -0.02 -0.38 -0.21 0.00 0.00 0.00 0.00 53.44 52.83 1t26 n ALA 73 Cb 0.14 -1.12 0.04 0.00 0.00 0.00 0.00 19.45 18.52 1t26 n ALA 73 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1t26 n TYR 73 N -1.13 -1.93 -4.11 0.00 4.01 -0.76 -4.99 117.16 108.25 1t26 n TYR 73 Ca 0.08 0.54 -0.27 0.00 -0.16 0.00 0.00 57.90 58.10 1t26 n TYR 73 Cb 0.34 -4.33 -0.04 0.00 -0.31 0.00 0.00 39.34 35.00 1t26 n TYR 73 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1t26 s SER 74 N -2.79 4.49 -0.41 7.72 0.01 -0.79 -5.06 113.70 116.87 1t26 s SER 74 Ca 0.31 -1.23 0.09 0.00 1.31 0.00 0.00 55.95 56.42 1t26 s SER 74 Cb -0.14 0.07 0.28 0.00 0.21 0.00 0.00 66.02 66.45 1t26 s SER 74 CO 0.39 -0.84 0.71 -3.20 0.41 0.00 0.00 173.24 170.70 1t26 n ASN 75 N -1.48 -0.45 -4.28 2.44 4.05 -1.26 -4.69 115.26 109.59 1t26 n ASN 75 Ca -0.04 -2.99 -0.34 0.00 0.45 0.00 0.00 54.58 51.66 1t26 n ASN 75 Cb 0.65 0.07 -0.15 0.00 1.23 0.00 0.00 39.78 41.58 1t26 n ASN 75 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1t26 s LYS 77 N 0.97 4.08 -0.15 0.00 1.02 -1.26 -4.86 119.74 119.53 1t26 s LYS 77 Ca -0.02 2.05 -0.01 0.00 0.02 0.00 0.00 55.97 58.01 1t26 s LYS 77 Cb -0.15 -2.79 0.04 0.00 -0.52 0.00 0.00 37.83 34.41 1t26 s LYS 77 CO -0.02 -0.37 -0.03 0.08 -0.92 0.00 0.00 175.35 174.09 1t26 s VAL 78 N -1.29 0.90 0.08 3.17 1.01 -1.26 -0.22 120.40 122.79 1t26 s VAL 78 Ca 0.55 -0.48 0.06 0.00 0.00 0.00 0.00 61.98 62.11 1t26 s VAL 78 Cb -0.36 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 1t26 s VAL 78 CO 0.46 0.11 -0.16 -0.94 0.00 0.00 0.00 175.10 174.57 1t26 s SER 79 N 1.72 1.92 0.38 3.32 1.04 -0.37 -4.60 113.70 117.12 1t26 s SER 79 Ca 0.01 -0.64 0.01 0.00 0.48 0.00 0.00 55.95 55.81 1t26 s SER 79 Cb -0.15 -0.07 -0.02 0.00 0.10 0.00 0.00 66.02 65.88 1t26 s SER 79 CO -0.07 -0.04 0.58 -0.83 0.98 0.00 0.00 173.24 173.86 1t26 s GLY 80 N -1.80 1.43 -0.18 7.32 0.00 -1.26 -0.08 107.32 112.75 1t26 s GLY 80 Ca 0.00 -1.00 -0.21 0.00 0.00 0.00 0.00 44.72 43.52 1t26 s GLY 80 CO 0.03 -0.90 0.56 -0.45 0.00 0.00 0.00 173.10 172.34 1t26 s SER 81 N -4.11 -0.57 -0.09 1.64 0.15 0.17 -4.82 113.70 106.06 1t26 s SER 81 Ca 0.43 1.04 0.13 0.00 0.70 0.00 0.00 55.95 58.25 1t26 s SER 81 Cb -0.10 1.05 0.22 0.00 -1.71 0.00 0.00 66.02 65.48 1t26 s SER 81 CO 0.36 -0.26 1.13 0.59 1.20 0.00 0.00 173.24 176.26 1t26 n ASN 83 N 2.49 2.35 -4.06 5.45 5.03 -1.26 -1.95 115.26 123.30 1t26 n ASN 83 Ca -0.15 -2.76 -0.32 0.00 0.87 0.00 0.00 54.58 52.23 1t26 n ASN 83 Cb 0.56 -0.31 -0.16 0.00 -1.02 0.00 0.00 39.78 38.85 1t26 n ASN 83 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1t26 s THR 84 N -2.31 1.88 0.41 3.41 2.01 -1.26 -4.97 115.64 114.82 1t26 s THR 84 Ca 0.23 -1.03 0.14 0.00 0.31 0.00 0.00 61.69 61.35 1t26 s THR 84 Cb 0.20 -1.83 0.35 0.00 0.01 0.00 0.00 72.50 71.23 1t26 s THR 84 CO 0.03 0.33 1.90 1.88 -0.69 0.00 0.00 174.62 178.07 1t26 h TYR 85 N 7.94 0.56 0.00 4.92 0.05 -1.97 -1.47 116.97 127.00 1t26 h TYR 85 Ca -0.35 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.44 1t26 h TYR 85 Cb 1.11 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.67 1t26 h TYR 85 CO 0.51 0.21 0.00 -0.25 -1.05 0.00 0.00 178.16 177.57 1t26 n ASP 86 N -4.50 0.00 0.00 3.88 9.92 -1.26 -1.64 116.55 122.95 1t26 n ASP 86 Ca 0.16 0.11 0.08 0.00 -0.53 0.00 0.00 54.79 54.60 1t26 n ASP 86 Cb 0.54 -0.30 0.44 0.00 -0.64 0.00 0.00 41.12 41.16 1t26 n ASP 86 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1t26 n ASP 87 N -1.30 0.00 0.19 -2.24 8.00 -0.55 -1.58 116.55 119.07 1t26 n ASP 87 Ca 0.07 -0.38 0.14 0.00 0.71 0.00 0.00 54.79 55.33 1t26 n ASP 87 Cb 0.12 -0.05 0.50 0.00 -0.02 0.00 0.00 41.12 41.67 1t26 n ASP 87 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1t26 h LEU 88 N 0.00 0.00 -9.49 0.64 3.38 -1.53 -3.45 115.31 104.85 1t26 h LEU 88 Ca 0.00 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.37 1t26 h LEU 88 Cb 0.02 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.84 1t26 h LEU 88 CO 0.00 0.00 0.61 0.00 0.09 0.00 0.00 178.44 179.14 1t26 n ALA 89 N -1.94 0.69 -0.97 1.53 0.00 -0.61 -1.58 120.51 117.62 1t26 n ALA 89 Ca 0.02 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1t26 n ALA 89 Cb 0.33 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.54 1t26 n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t26 n GLY 90 N 2.58 0.83 3.74 0.00 0.00 -1.24 -5.00 105.19 106.09 1t26 n GLY 90 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1t26 n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t26 s ALA 91 N -3.31 3.71 -0.15 4.61 0.00 -0.62 -4.66 121.76 121.36 1t26 s ALA 91 Ca 0.00 1.44 0.03 0.00 0.00 0.00 0.00 51.96 53.43 1t26 s ALA 91 Cb 0.00 -3.61 -0.23 0.00 0.00 0.00 0.00 23.12 19.28 1t26 s ALA 91 CO 0.00 -0.85 0.26 -0.25 0.00 0.00 0.00 175.76 174.92 1t26 n ASP 92 N 2.65 1.50 -3.95 0.00 8.00 0.19 -4.28 116.55 120.67 1t26 n ASP 92 Ca 0.09 0.15 -0.18 0.00 0.71 0.00 0.00 54.79 55.56 1t26 n ASP 92 Cb 0.39 -0.31 -0.15 0.00 -0.02 0.00 0.00 41.12 41.02 1t26 n ASP 92 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1t26 s VAL 93 N -2.55 0.51 -0.12 2.53 1.01 -1.04 -1.19 120.40 119.54 1t26 s VAL 93 Ca -0.19 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.59 1t26 s VAL 93 Cb 0.07 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 36.00 1t26 s VAL 93 CO 0.75 0.17 -0.18 -0.69 0.00 0.00 0.00 175.10 175.15 1t26 s VAL 94 N 0.23 1.76 -0.20 2.92 1.01 -0.19 -1.02 120.40 124.91 1t26 s VAL 94 Ca -0.03 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.14 1t26 s VAL 94 Cb -0.07 -1.58 0.00 0.00 0.00 0.00 0.00 36.38 34.73 1t26 s VAL 94 CO -0.00 0.49 -0.11 -0.63 0.00 0.00 0.00 175.10 174.85 1t26 s ILE 95 N 0.92 2.83 -0.42 2.22 1.01 -0.37 -0.96 121.20 126.43 1t26 s ILE 95 Ca -0.07 -0.68 -0.11 0.00 0.00 0.00 0.00 60.65 59.80 1t26 s ILE 95 Cb -0.15 -2.25 0.06 0.00 0.01 0.00 0.00 42.46 40.13 1t26 s ILE 95 CO -0.02 0.47 0.27 -0.69 0.00 0.00 0.00 174.94 174.97 1t26 s VAL 96 N 1.36 4.47 -1.03 2.92 1.01 0.31 -0.69 120.40 128.74 1t26 s VAL 96 Ca 0.05 -1.21 0.09 0.00 0.00 0.00 0.00 61.98 60.91 1t26 s VAL 96 Cb -0.14 -3.67 0.04 0.00 0.00 0.00 0.00 36.38 32.61 1t26 s VAL 96 CO -0.07 -0.45 0.71 0.35 0.00 0.00 0.00 175.10 175.64 1t26 n THR 97 N 4.98 0.00 -1.62 3.92 -2.24 -0.54 -0.45 114.28 118.33 1t26 n THR 97 Ca -0.11 -0.45 -0.47 0.00 -2.27 0.00 0.00 64.05 60.75 1t26 n THR 97 Cb 0.44 1.16 -0.03 0.00 -2.10 0.00 0.00 70.33 69.79 1t26 n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1t26 n ALA 98 N 0.14 0.10 0.00 6.98 0.00 -0.82 -4.67 120.51 122.25 1t26 n ALA 98 Ca 0.05 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1t26 n ALA 98 Cb 0.22 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1t26 n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t26 n GLY 99 N 2.04 0.84 3.90 0.00 0.00 -1.26 -4.73 105.19 105.98 1t26 n GLY 99 Ca 0.13 -1.84 -0.32 0.00 0.00 0.00 0.00 46.02 43.99 1t26 n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1t26 s PHE 100 N -2.53 3.51 -0.07 1.61 0.40 -1.26 -5.02 117.98 114.62 1t26 s PHE 100 Ca 0.00 0.50 0.18 0.00 -0.60 0.00 0.00 56.93 57.02 1t26 s PHE 100 Cb 0.00 -1.96 -0.28 0.00 0.51 0.00 0.00 43.02 41.30 1t26 s PHE 100 CO 0.00 0.50 0.33 -2.37 0.70 0.00 0.00 175.22 174.38 1t26 n THR 101 N 0.33 0.32 -3.68 0.64 5.66 -1.26 -4.83 114.28 111.47 1t26 n THR 101 Ca -0.05 -0.52 -0.13 0.00 -3.05 0.00 0.00 64.05 60.30 1t26 n THR 101 Cb 0.52 -0.09 -0.09 0.00 -1.55 0.00 0.00 70.33 69.12 1t26 n THR 101 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 1t26 s LYS 102 N -3.09 0.65 -0.36 1.09 -2.85 -1.26 -5.02 119.74 108.90 1t26 s LYS 102 Ca -0.07 0.81 -0.32 0.00 -1.00 0.00 0.00 55.97 55.38 1t26 s LYS 102 Cb 0.10 0.30 -0.10 0.00 -2.06 0.00 0.00 37.83 36.07 1t26 s LYS 102 CO 0.78 -0.09 2.25 0.00 0.10 0.00 0.00 175.35 178.39 1t26 n ALA 103 N 2.92 1.21 -1.54 0.59 0.00 -1.26 -4.90 120.51 117.53 1t26 n ALA 103 Ca -0.14 -0.21 -0.19 0.00 0.00 0.00 0.00 53.44 52.90 1t26 n ALA 103 Cb 0.56 -2.70 -0.11 0.00 0.00 0.00 0.00 19.45 17.21 1t26 n ALA 103 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1t26 n PRO 103 N 8.44 0.46 0.00 0.00 -0.04 -1.26 -0.82 135.00 141.79 1t26 n PRO 103 Ca 0.39 -0.52 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 1t26 n PRO 103 Cb 0.31 -2.95 0.00 0.00 -0.04 0.00 0.00 33.50 30.82 1t26 n PRO 103 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1t26 n GLY 103 N 6.40 1.00 3.82 0.55 0.00 -1.26 -5.12 105.19 110.58 1t26 n GLY 103 Ca 0.52 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.16 1t26 n GLY 103 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t26 s LYS 103 N 0.00 3.91 1.13 1.61 1.02 0.00 -5.08 119.74 122.34 1t26 s LYS 103 Ca 0.00 0.28 -0.12 0.00 0.02 0.00 0.00 55.97 56.15 1t26 s LYS 103 Cb 0.00 -3.26 0.27 0.00 -0.52 0.00 0.00 37.83 34.32 1t26 s LYS 103 CO 0.00 0.61 1.05 0.45 -0.92 0.00 0.00 175.35 176.54 1t26 s SER 103 N -0.76 1.16 0.30 2.83 0.15 -1.26 -4.82 113.70 111.29 1t26 s SER 103 Ca 0.21 1.69 0.15 0.00 0.70 0.00 0.00 55.95 58.71 1t26 s SER 103 Cb -0.15 -2.40 0.31 0.00 -1.71 0.00 0.00 66.02 62.07 1t26 s SER 103 CO 0.10 -4.12 1.55 0.44 1.20 0.00 0.00 173.24 172.42 1t26 h ASP 105 N -2.57 0.00 -0.84 5.45 3.32 -1.98 -3.19 116.42 116.62 1t26 h ASP 105 Ca -0.59 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.47 1t26 h ASP 105 Cb 1.32 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.83 1t26 h ASP 105 CO 0.48 0.52 0.54 0.07 -1.72 0.00 0.00 179.24 179.12 1t26 h LYS 105 N 0.00 1.12 -2.11 3.56 2.10 -1.96 -3.31 116.57 115.97 1t26 h LYS 105 Ca -0.01 -0.08 -0.72 0.00 -2.00 0.00 0.00 60.65 57.84 1t26 h LYS 105 Cb 1.21 -0.25 -0.32 0.00 -0.90 0.00 0.00 32.23 31.97 1t26 h LYS 105 CO 0.07 0.76 0.43 -0.85 -2.00 0.00 0.00 179.45 177.86 1t26 n GLU 106 N -4.47 4.06 -3.06 0.07 0.28 -1.20 -4.94 120.64 111.37 1t26 n GLU 106 Ca 0.09 -4.43 -0.27 0.00 -0.16 0.00 0.00 57.16 52.39 1t26 n GLU 106 Cb 0.03 -2.34 -0.02 0.00 1.43 0.00 0.00 31.44 30.54 1t26 n GLU 106 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 177.13 176.51 1t26 s TRP 107 N -3.98 3.51 -0.29 -1.84 -0.00 -1.25 -4.71 118.94 110.38 1t26 s TRP 107 Ca 0.45 0.67 -0.20 0.00 -0.00 0.00 0.00 56.10 57.02 1t26 s TRP 107 Cb 0.30 -2.15 0.17 0.00 -0.00 0.00 0.00 33.47 31.79 1t26 s TRP 107 CO -0.21 -0.02 1.20 1.21 -0.00 0.00 0.00 176.95 179.13 1t26 s ASN 108 N -3.71 -0.24 0.47 5.86 3.84 -1.26 -4.89 114.94 115.01 1t26 s ASN 108 Ca 0.45 0.42 0.18 0.00 0.21 0.00 0.00 52.86 54.12 1t26 s ASN 108 Cb -0.10 0.78 1.15 0.00 -0.55 0.00 0.00 41.25 42.53 1t26 s ASN 108 CO 0.37 -0.07 2.02 0.03 -2.79 0.00 0.00 177.10 176.66 1t26 h ARG 109 N 4.62 0.00 -0.43 0.43 3.08 -1.96 -2.49 114.38 117.63 1t26 h ARG 109 Ca -0.27 0.00 0.02 0.00 0.07 0.00 0.00 59.98 59.80 1t26 h ARG 109 Cb 1.18 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.21 1t26 h ARG 109 CO 0.19 0.16 0.28 -0.44 -1.07 0.00 0.00 179.97 179.09 1t26 h ASP 110 N 0.00 0.42 0.66 7.04 3.32 -1.96 -1.54 116.42 124.37 1t26 h ASP 110 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1t26 h ASP 110 Cb 0.32 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1t26 h ASP 110 CO 0.02 0.29 0.00 0.47 -1.72 0.00 0.00 179.24 178.30 1t26 n ASP 111 N -4.48 0.05 0.02 6.45 10.43 -0.94 -2.30 116.55 125.80 1t26 n ASP 111 Ca 0.04 0.51 0.13 0.00 2.57 0.00 0.00 54.79 58.04 1t26 n ASP 111 Cb 0.13 -0.52 0.42 0.00 1.84 0.00 0.00 41.12 42.99 1t26 n ASP 111 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1t26 n LEU 112 N -1.56 0.36 0.04 0.64 4.77 -0.58 -4.32 117.00 116.35 1t26 n LEU 112 Ca 0.04 0.34 -0.13 0.00 -0.03 0.00 0.00 56.01 56.23 1t26 n LEU 112 Cb 0.22 -0.36 -0.07 0.00 -2.33 0.00 0.00 43.42 40.88 1t26 n LEU 112 CO 0.18 -0.00 0.58 0.25 -1.33 0.00 0.00 177.39 177.06 1t26 h LEU 113 N 0.00 -1.33 -2.01 2.23 5.85 -1.58 -1.65 115.31 116.83 1t26 h LEU 113 Ca 0.00 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1t26 h LEU 113 Cb 0.57 0.52 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 1t26 h LEU 113 CO 0.00 -0.45 -0.05 1.55 -0.34 0.00 0.00 178.44 179.15 1t26 h PRO 114 N -0.56 0.00 0.00 5.25 0.13 -1.82 -2.81 132.00 132.18 1t26 h PRO 114 Ca 0.05 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.94 1t26 h PRO 114 Cb 0.65 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.74 1t26 h PRO 114 CO -0.35 0.05 -1.33 -0.07 -0.23 0.00 0.00 178.00 176.07 1t26 h LEU 115 N 0.00 0.00 -0.57 1.56 4.07 -1.61 -3.39 115.31 115.36 1t26 h LEU 115 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1t26 h LEU 115 Cb 0.33 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.07 1t26 h LEU 115 CO 0.01 0.98 -0.38 0.59 -1.08 0.00 0.00 178.44 178.56 1t26 n ASN 116 N -3.20 1.19 0.18 -0.43 3.02 -0.69 -4.66 115.26 110.67 1t26 n ASN 116 Ca -0.08 -1.10 -0.14 0.00 -0.03 0.00 0.00 54.58 53.23 1t26 n ASN 116 Cb 0.98 0.63 -0.08 0.00 -0.61 0.00 0.00 39.78 40.70 1t26 n ASN 116 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1t26 h ASN 117 N 1.04 -0.36 0.04 6.41 -0.00 -1.70 -3.12 115.58 117.89 1t26 h ASN 117 Ca 0.00 -0.10 -0.01 0.00 -0.00 0.00 0.00 56.30 56.20 1t26 h ASN 117 Cb 0.41 0.09 -0.00 0.00 -0.00 0.00 0.00 38.32 38.82 1t26 h ASN 117 CO 0.00 -0.11 -0.02 0.50 -0.00 0.00 0.00 177.43 177.79 1t26 h LYS 118 N -0.60 0.00 -0.61 4.14 1.63 -1.87 -2.36 116.57 116.91 1t26 h LYS 118 Ca -0.04 0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 59.67 1t26 h LYS 118 Cb 0.43 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.04 1t26 h LYS 118 CO 0.07 0.02 0.03 0.82 -3.45 0.00 0.00 179.45 176.94 1t26 h ILE 119 N 0.00 1.26 -0.59 2.00 2.04 -1.86 -2.43 117.51 117.94 1t26 h ILE 119 Ca -0.00 -1.11 -0.07 0.00 1.00 0.00 0.00 64.86 64.68 1t26 h ILE 119 Cb 0.05 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1t26 h ILE 119 CO 0.00 0.40 0.07 0.24 0.00 0.00 0.00 178.15 178.87 1t26 h MET 120 N 0.96 0.96 -0.17 2.37 2.86 -1.40 -1.60 114.93 118.91 1t26 h MET 120 Ca 0.18 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1t26 h MET 120 Cb 0.51 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1t26 h MET 120 CO 0.02 0.90 0.07 0.82 1.06 0.00 0.00 176.91 179.78 1t26 h ILE 121 N 0.90 1.16 -0.40 -1.22 2.04 -1.51 0.20 117.51 118.67 1t26 h ILE 121 Ca 0.18 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1t26 h ILE 121 Cb 0.42 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 1t26 h ILE 121 CO 0.01 0.15 0.26 -0.08 0.00 0.00 0.00 178.15 178.49 1t26 h GLU 122 N 0.12 0.54 -0.58 2.37 4.81 -1.35 -2.12 114.58 118.37 1t26 h GLU 122 Ca 0.06 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 1t26 h GLU 122 Cb 0.17 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 1t26 h GLU 122 CO -0.00 0.38 0.12 0.82 -0.73 0.00 0.00 179.01 179.60 1t26 h ILE 123 N 0.54 1.25 -0.80 2.32 2.04 -1.21 -2.97 117.51 118.67 1t26 h ILE 123 Ca 0.15 -0.93 0.07 0.00 1.00 0.00 0.00 64.86 65.15 1t26 h ILE 123 Cb -0.03 0.74 -0.06 0.00 -0.74 0.00 0.00 36.82 36.72 1t26 h ILE 123 CO -0.03 0.34 0.47 1.23 0.00 0.00 0.00 178.15 180.17 1t26 h GLY 124 N 0.85 1.20 1.02 5.37 0.00 -0.62 -0.99 103.07 109.90 1t26 h GLY 124 Ca 0.18 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 1t26 h GLY 124 CO 0.01 0.20 0.50 -1.33 0.00 0.00 0.00 176.54 175.92 1t26 h GLY 125 N 0.85 1.28 1.67 4.60 0.00 -1.24 -1.23 103.07 108.99 1t26 h GLY 125 Ca 0.36 -0.56 -0.12 0.00 0.00 0.00 0.00 47.33 47.01 1t26 h GLY 125 CO -0.19 0.54 -0.44 0.45 0.00 0.00 0.00 176.54 176.89 1t26 h HIS 126 N 1.21 0.44 -0.39 5.60 -0.00 -1.28 -2.43 115.15 118.30 1t26 h HIS 126 Ca 0.31 -0.13 -0.09 0.00 -0.00 0.00 0.00 60.37 60.46 1t26 h HIS 126 Cb -0.01 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 27.29 1t26 h HIS 126 CO 0.00 0.75 -0.10 0.82 -0.00 0.00 0.00 177.93 179.41 1t26 h ILE 127 N 0.30 1.28 -0.90 2.45 2.04 -0.89 0.19 117.51 121.97 1t26 h ILE 127 Ca 0.02 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.70 1t26 h ILE 127 Cb 0.90 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 38.18 1t26 h ILE 127 CO 0.07 0.39 0.57 0.50 0.00 0.00 0.00 178.15 179.69 1t26 h LYS 128 N 0.56 1.20 0.03 2.37 3.64 -1.07 -0.15 116.57 123.14 1t26 h LYS 128 Ca 0.10 -0.09 -0.15 0.00 -1.27 0.00 0.00 60.65 59.24 1t26 h LYS 128 Cb 0.62 -0.26 0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1t26 h LYS 128 CO 0.04 0.81 -0.60 -0.22 -2.27 0.00 0.00 179.45 177.21 1t26 h LYS 129 N 1.22 0.35 0.05 1.90 3.64 -1.36 -3.37 116.57 119.00 1t26 h LYS 129 Ca 0.33 -0.42 -0.35 0.00 -1.27 0.00 0.00 60.65 58.94 1t26 h LYS 129 Cb -0.10 0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 1t26 h LYS 129 CO -0.07 1.11 -2.08 0.09 -2.27 0.00 0.00 179.45 176.23 1t26 n ASN 130 N -4.24 1.43 -3.01 4.20 3.02 0.04 -4.77 115.26 111.94 1t26 n ASN 130 Ca -0.11 0.16 -0.15 0.00 -0.03 0.00 0.00 54.58 54.45 1t26 n ASN 130 Cb 0.68 -0.27 0.01 0.00 -0.61 0.00 0.00 39.78 39.60 1t26 n ASN 130 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1t26 h PRO 132 N 3.06 0.00 -0.52 0.00 0.13 -1.65 -1.67 132.00 131.35 1t26 h PRO 132 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1t26 h PRO 132 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1t26 h PRO 132 CO 0.36 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.22 1t26 n ASN 132 N -2.72 3.61 -4.81 1.44 5.03 -1.26 -4.77 115.26 111.78 1t26 n ASN 132 Ca -0.02 -1.99 -0.32 0.00 0.87 0.00 0.00 54.58 53.12 1t26 n ASN 132 Cb 0.06 -0.34 0.03 0.00 -1.02 0.00 0.00 39.78 38.51 1t26 n ASN 132 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1t26 s ALA 133 N -1.32 2.67 -0.17 5.41 0.00 -0.63 -5.00 121.76 122.72 1t26 s ALA 133 Ca 0.43 0.25 -0.14 0.00 0.00 0.00 0.00 51.96 52.50 1t26 s ALA 133 Cb 0.24 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 1t26 s ALA 133 CO 0.32 -1.07 0.30 0.12 0.00 0.00 0.00 175.76 175.43 1t26 s PHE 134 N -2.74 3.44 -0.11 0.00 5.36 -0.33 -4.91 117.98 118.68 1t26 s PHE 134 Ca 0.61 0.57 -0.01 0.00 -0.96 0.00 0.00 56.93 57.15 1t26 s PHE 134 Cb -0.15 -2.37 -0.02 0.00 -0.34 0.00 0.00 43.02 40.14 1t26 s PHE 134 CO 0.46 0.18 -0.09 0.42 -1.46 0.00 0.00 175.22 174.74 1t26 s ILE 135 N 0.65 3.50 -0.15 3.12 -1.09 0.30 -1.02 121.20 126.51 1t26 s ILE 135 Ca 0.16 -0.52 0.02 0.00 -2.23 0.00 0.00 60.65 58.08 1t26 s ILE 135 Cb -0.13 -2.47 0.02 0.00 -1.58 0.00 0.00 42.46 38.29 1t26 s ILE 135 CO 0.04 0.54 -0.19 -0.63 -1.23 0.00 0.00 174.94 173.47 1t26 s ILE 136 N -0.10 1.94 -0.15 2.92 1.01 -0.14 -1.55 121.20 125.13 1t26 s ILE 136 Ca 0.00 -0.88 -0.07 0.00 0.00 0.00 0.00 60.65 59.70 1t26 s ILE 136 Cb -0.13 -1.75 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 1t26 s ILE 136 CO 0.03 0.52 0.08 -0.69 0.00 0.00 0.00 174.94 174.88 1t26 s VAL 137 N 1.12 4.96 -0.02 2.92 1.01 -0.20 -0.53 120.40 129.66 1t26 s VAL 137 Ca -0.00 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1t26 s VAL 137 Cb -0.14 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.03 1t26 s VAL 137 CO -0.08 0.52 -0.01 0.52 0.00 0.00 0.00 175.10 176.06 1t26 n VAL 138 N 2.89 0.10 -1.54 2.92 0.31 0.41 -1.31 118.33 122.10 1t26 n VAL 138 Ca -0.18 -0.05 -0.53 0.00 -0.01 0.00 0.00 64.34 63.57 1t26 n VAL 138 Cb 0.53 -0.74 -0.06 0.00 -0.91 0.00 0.00 33.84 32.67 1t26 n VAL 138 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1t26 n THR 139 N -2.33 0.40 -3.28 2.52 -1.04 -1.11 -4.58 114.28 104.86 1t26 n THR 139 Ca -0.03 -0.10 -0.30 0.00 -2.04 0.00 0.00 64.05 61.58 1t26 n THR 139 Cb 0.54 -0.46 -0.04 0.00 -1.82 0.00 0.00 70.33 68.55 1t26 n THR 139 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1t26 s ASN 140 N 0.06 6.54 -0.20 8.00 0.02 -1.26 -2.85 114.94 125.24 1t26 s ASN 140 Ca 0.82 0.88 -0.29 0.00 -1.02 0.00 0.00 52.86 53.25 1t26 s ASN 140 Cb -1.04 -2.21 -0.00 0.00 0.02 0.00 0.00 41.25 38.01 1t26 s ASN 140 CO 0.53 -0.19 1.20 -2.16 0.02 0.00 0.00 177.10 176.50 1t26 s PRO 141 N -3.31 4.20 0.29 -0.60 0.04 -1.26 -4.43 135.00 129.93 1t26 s PRO 141 Ca 0.47 1.51 0.01 0.00 0.04 0.00 0.00 61.00 63.03 1t26 s PRO 141 Cb -0.11 -3.74 0.54 0.00 0.04 0.00 0.00 34.50 31.23 1t26 s PRO 141 CO 0.26 -0.74 1.87 -0.24 0.04 0.00 0.00 177.00 178.19 1t26 h VAL 142 N 5.54 0.98 0.00 -0.36 3.04 -1.77 -1.47 116.25 122.22 1t26 h VAL 142 Ca -0.24 -0.35 -0.06 0.00 -1.01 0.00 0.00 66.70 65.04 1t26 h VAL 142 Cb 1.09 -0.13 -0.01 0.00 -2.01 0.00 0.00 31.29 30.23 1t26 h VAL 142 CO 0.98 0.19 -0.27 0.44 -1.01 0.00 0.00 177.57 177.90 1t26 h ASP 143 N 1.02 0.00 0.03 3.17 3.32 -1.88 -0.46 116.42 121.63 1t26 h ASP 143 Ca 0.46 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.50 1t26 h ASP 143 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1t26 h ASP 143 CO -0.21 0.27 -0.02 0.58 -1.72 0.00 0.00 179.24 178.14 1t26 h VAL 144 N 0.00 1.00 -0.63 -1.35 2.07 -1.69 -3.34 116.25 112.32 1t26 h VAL 144 Ca -0.00 -1.64 0.03 0.00 0.82 0.00 0.00 66.70 65.90 1t26 h VAL 144 Cb 0.64 1.86 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 1t26 h VAL 144 CO 0.04 0.33 0.41 0.24 0.02 0.00 0.00 177.57 178.60 1t26 h MET 145 N -0.97 0.73 -0.59 1.57 2.86 -1.16 -2.26 114.93 115.11 1t26 h MET 145 Ca -0.00 -0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 1t26 h MET 145 Cb 0.57 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 1t26 h MET 145 CO 0.01 0.48 0.10 -0.24 1.06 0.00 0.00 176.91 178.31 1t26 h VAL 146 N 0.75 1.26 -0.37 -2.22 3.04 -1.25 -1.27 116.25 116.19 1t26 h VAL 146 Ca 0.25 -0.99 -0.14 0.00 -1.01 0.00 0.00 66.70 64.81 1t26 h VAL 146 Cb 0.07 0.75 -0.01 0.00 -2.01 0.00 0.00 31.29 30.09 1t26 h VAL 146 CO -0.07 0.36 -0.34 -0.61 -1.01 0.00 0.00 177.57 175.91 1t26 h GLN 147 N 0.88 0.83 -0.53 4.17 4.15 -1.56 -0.19 115.11 122.86 1t26 h GLN 147 Ca 0.18 -0.41 -0.00 0.00 0.77 0.00 0.00 58.65 59.19 1t26 h GLN 147 Cb 0.42 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.08 1t26 h GLN 147 CO 0.01 1.04 0.33 -0.07 -1.93 0.00 0.00 178.83 178.21 1t26 h LEU 148 N 0.69 0.63 -0.83 -2.39 3.38 -1.29 -0.38 115.31 115.13 1t26 h LEU 148 Ca 0.07 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 1t26 h LEU 148 Cb 0.90 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1t26 h LEU 148 CO 0.08 0.49 -0.16 0.25 0.09 0.00 0.00 178.44 179.19 1t26 h LEU 149 N 0.71 0.69 -0.29 1.67 5.85 -1.01 -2.01 115.31 120.93 1t26 h LEU 149 Ca 0.19 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1t26 h LEU 149 Cb -0.03 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 1t26 h LEU 149 CO -0.04 0.87 0.15 -0.74 -0.34 0.00 0.00 178.44 178.34 1t26 h HIS 150 N 0.62 0.28 -0.48 1.25 2.76 -0.53 -0.42 115.15 118.63 1t26 h HIS 150 Ca 0.10 0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.20 1t26 h HIS 150 Cb 0.63 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.48 1t26 h HIS 150 CO 0.03 0.16 -0.02 1.96 -1.30 0.00 0.00 177.93 178.75 1t26 h GLN 151 N 0.31 0.82 0.00 5.26 4.20 -0.80 -2.70 115.11 122.20 1t26 h GLN 151 Ca 0.12 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1t26 h GLN 151 Cb 0.03 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.72 1t26 h GLN 151 CO -0.08 0.84 -0.85 0.45 -0.67 0.00 0.00 178.83 178.52 1t26 h HIS 152 N 0.76 0.00 0.00 2.96 3.86 -1.21 -3.33 115.15 118.20 1t26 h HIS 152 Ca 0.14 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.31 1t26 h HIS 152 Cb 0.49 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 1t26 h HIS 152 CO 0.03 0.00 -1.11 -1.13 0.86 0.00 0.00 177.93 176.58 1t26 n SER 153 N -2.64 0.85 0.00 2.45 3.41 -0.18 -3.92 113.62 113.59 1t26 n SER 153 Ca 0.01 0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.96 1t26 n SER 153 Cb 0.53 0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.86 1t26 n SER 153 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1t26 n GLY 154 N 1.24 0.43 3.79 5.00 0.00 -1.02 -4.01 105.19 110.62 1t26 n GLY 154 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1t26 n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1t26 s VAL 155 N -2.04 3.56 0.72 1.61 -7.23 -1.26 -5.00 120.40 110.75 1t26 s VAL 155 Ca 0.00 0.76 -0.16 0.00 -1.81 0.00 0.00 61.98 60.77 1t26 s VAL 155 Cb 0.00 -3.28 0.03 0.00 0.56 0.00 0.00 36.38 33.69 1t26 s VAL 155 CO 0.00 -0.42 1.22 -2.84 -0.31 0.00 0.00 175.10 172.75 1t26 s PRO 156 N -4.01 2.21 0.53 4.82 0.02 -1.26 -4.90 135.00 132.41 1t26 s PRO 156 Ca 0.65 1.82 0.24 0.00 0.02 0.00 0.00 61.00 63.73 1t26 s PRO 156 Cb -0.18 -1.83 1.47 0.00 0.02 0.00 0.00 34.50 33.98 1t26 s PRO 156 CO 0.37 -1.80 2.14 1.57 -0.33 0.00 0.00 177.00 178.96 1t26 h LYS 157 N -0.14 0.00 -0.00 5.54 2.10 -1.94 -0.45 116.57 121.67 1t26 h LYS 157 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1t26 h LYS 157 Cb 1.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.63 1t26 h LYS 157 CO 0.50 0.06 0.00 0.27 -2.00 0.00 0.00 179.45 178.28 1t26 n ASN 158 N -4.03 0.02 -0.47 7.07 6.94 -1.26 -3.78 115.26 119.76 1t26 n ASN 158 Ca -0.03 -1.03 0.04 0.00 -0.02 0.00 0.00 54.58 53.54 1t26 n ASN 158 Cb 0.15 -0.00 0.11 0.00 -2.36 0.00 0.00 39.78 37.68 1t26 n ASN 158 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1t26 n LYS 159 N -0.97 2.72 -3.79 -3.83 4.76 -0.18 -0.95 118.16 115.93 1t26 n LYS 159 Ca 0.23 -1.85 -0.13 0.00 -2.87 0.00 0.00 58.31 53.69 1t26 n LYS 159 Cb 0.11 -1.20 -0.14 0.00 -1.84 0.00 0.00 35.03 31.96 1t26 n LYS 159 CO 0.00 0.00 0.00 -1.50 -1.37 0.00 0.00 177.40 174.53 1t26 s ILE 160 N -0.98 -0.03 0.16 -0.18 2.07 -1.25 -0.53 121.20 120.46 1t26 s ILE 160 Ca 0.17 0.10 -0.02 0.00 -1.41 0.00 0.00 60.65 59.49 1t26 s ILE 160 Cb 0.09 -0.20 -0.04 0.00 0.13 0.00 0.00 42.46 42.44 1t26 s ILE 160 CO 0.12 0.04 0.10 0.27 -1.91 0.00 0.00 174.94 173.56 1t26 s ILE 161 N 0.68 0.07 0.12 2.00 -4.36 -0.59 -4.78 121.20 114.33 1t26 s ILE 161 Ca -0.05 -1.89 0.10 0.00 -0.26 0.00 0.00 60.65 58.55 1t26 s ILE 161 Cb -0.07 -2.17 -0.04 0.00 1.25 0.00 0.00 42.46 41.43 1t26 s ILE 161 CO -0.03 -0.31 -0.25 -0.83 0.24 0.00 0.00 174.94 173.76 1t26 s GLY 162 N -3.08 1.58 0.20 6.27 0.00 -0.40 -1.03 107.32 110.86 1t26 s GLY 162 Ca 0.28 -1.43 -0.30 0.00 0.00 0.00 0.00 44.72 43.27 1t26 s GLY 162 CO 0.05 -1.40 1.15 -2.27 0.00 0.00 0.00 173.10 170.63 1t26 s LEU 163 N -1.99 4.48 0.00 0.66 2.96 -0.43 -1.37 118.68 122.99 1t26 s LEU 163 Ca 0.14 2.21 0.00 0.00 -0.22 0.00 0.00 54.13 56.26 1t26 s LEU 163 Cb -0.10 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.98 1t26 s LEU 163 CO 0.06 -0.28 0.00 0.61 -1.32 0.00 0.00 176.35 175.42 1t26 n GLY 164 N 1.92 -2.06 0.33 7.98 0.00 -1.26 -4.81 105.19 107.29 1t26 n GLY 164 Ca 0.03 0.67 0.04 0.00 0.00 0.00 0.00 46.02 46.76 1t26 n GLY 164 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1t26 h GLY 165 N 0.00 0.81 1.01 -0.02 0.00 -1.75 -0.46 103.07 102.65 1t26 h GLY 165 Ca 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 1t26 h GLY 165 CO 0.00 0.26 0.37 -2.08 0.00 0.00 0.00 176.54 175.09 1t26 h VAL 166 N 0.73 1.22 0.08 4.60 2.07 -1.81 0.28 116.25 123.42 1t26 h VAL 166 Ca 0.24 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 1t26 h VAL 166 Cb 0.04 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1t26 h VAL 166 CO -0.06 0.25 -0.04 0.25 0.02 0.00 0.00 177.57 177.99 1t26 h LEU 167 N 0.97 -0.09 -0.48 2.57 5.85 -1.70 -2.40 115.31 120.04 1t26 h LEU 167 Ca 0.25 -0.45 0.01 0.00 0.84 0.00 0.00 57.88 58.53 1t26 h LEU 167 Cb 0.06 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1t26 h LEU 167 CO -0.04 0.43 0.30 0.44 -0.34 0.00 0.00 178.44 179.24 1t26 h ASP 168 N -0.65 0.51 0.68 1.25 3.32 -1.06 -2.40 116.42 118.07 1t26 h ASP 168 Ca -0.01 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 1t26 h ASP 168 Cb 0.53 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1t26 h ASP 168 CO 0.02 0.37 -0.23 0.71 -1.72 0.00 0.00 179.24 178.39 1t26 h THR 169 N 0.62 0.67 -0.62 0.35 1.35 -1.01 -2.82 112.91 111.45 1t26 h THR 169 Ca 0.18 -1.01 0.01 0.00 -0.55 0.00 0.00 66.41 65.04 1t26 h THR 169 Cb -0.04 1.65 -0.03 0.00 -1.73 0.00 0.00 68.15 67.99 1t26 h THR 169 CO -0.06 0.22 0.41 0.77 -0.25 0.00 0.00 175.52 176.62 1t26 h SER 170 N 0.00 0.69 -0.01 5.36 4.64 -0.89 0.18 113.55 123.52 1t26 h SER 170 Ca -0.00 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 1t26 h SER 170 Cb 0.63 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1t26 h SER 170 CO 0.03 0.50 -0.02 0.03 -0.87 0.00 0.00 176.83 176.50 1t26 h ARG 171 N 0.82 0.03 -0.23 4.77 3.08 -1.50 0.05 114.38 121.39 1t26 h ARG 171 Ca 0.23 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.27 1t26 h ARG 171 Cb -0.06 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1t26 h ARG 171 CO -0.05 0.54 0.12 1.25 -1.07 0.00 0.00 179.97 180.76 1t26 h LEU 172 N -0.48 0.19 -0.34 3.04 5.85 -1.39 -0.64 115.31 121.55 1t26 h LEU 172 Ca 0.00 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.75 1t26 h LEU 172 Cb 0.54 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1t26 h LEU 172 CO 0.00 0.15 0.18 0.11 -0.34 0.00 0.00 178.44 178.54 1t26 h LYS 173 N 0.26 0.36 0.16 1.25 1.57 -0.69 -2.44 116.57 117.03 1t26 h LYS 173 Ca 0.09 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1t26 h LYS 173 Cb 0.01 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1t26 h LYS 173 CO -0.06 0.23 -0.08 -0.92 -0.57 0.00 0.00 179.45 178.06 1t26 h TYR 174 N 0.37 -0.20 -0.94 -1.35 3.20 -0.58 -1.16 116.97 116.31 1t26 h TYR 174 Ca 0.14 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.04 1t26 h TYR 174 Cb 0.04 0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.32 1t26 h TYR 174 CO -0.09 -0.10 0.61 1.88 -1.64 0.00 0.00 178.16 178.82 1t26 h TYR 175 N -0.24 1.14 -0.42 -3.82 0.05 -1.10 -1.39 116.97 111.19 1t26 h TYR 175 Ca -0.02 0.03 -0.14 0.00 0.05 0.00 0.00 58.73 58.64 1t26 h TYR 175 Cb 0.19 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 37.54 1t26 h TYR 175 CO -0.06 0.65 -0.31 0.82 -1.05 0.00 0.00 178.16 178.21 1t26 h ILE 176 N 1.17 1.27 -0.12 -2.88 2.04 -1.35 -2.99 117.51 114.65 1t26 h ILE 176 Ca 0.38 -1.47 -0.04 0.00 1.00 0.00 0.00 64.86 64.73 1t26 h ILE 176 Cb 0.02 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1t26 h ILE 176 CO -0.13 0.50 -0.09 0.77 0.00 0.00 0.00 178.15 179.20 1t26 h SER 177 N 0.78 0.16 -0.37 1.72 4.64 -0.37 -1.46 113.55 118.65 1t26 h SER 177 Ca 0.08 -0.03 -0.07 0.00 -0.47 0.00 0.00 61.79 61.30 1t26 h SER 177 Cb 0.89 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 1t26 h SER 177 CO 0.08 0.28 -0.06 1.56 -0.87 0.00 0.00 176.83 177.82 1t26 h GLN 178 N 0.17 0.70 -0.48 4.77 4.20 -1.19 0.21 115.11 123.48 1t26 h GLN 178 Ca 0.04 -0.25 -0.11 0.00 0.06 0.00 0.00 58.65 58.39 1t26 h GLN 178 Cb 0.27 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1t26 h GLN 178 CO 0.01 0.83 -0.12 -0.22 -0.67 0.00 0.00 178.83 178.66 1t26 h LYS 179 N 0.51 0.94 -0.00 1.46 1.63 -1.31 -3.20 116.57 116.59 1t26 h LYS 179 Ca 0.10 -0.36 0.00 0.00 -0.85 0.00 0.00 60.65 59.54 1t26 h LYS 179 Cb 0.55 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 1t26 h LYS 179 CO 0.03 1.02 -0.30 1.28 -3.45 0.00 0.00 179.45 178.03 1t26 n LEU 180 N -4.21 0.58 -3.47 5.20 4.77 -0.59 -4.97 117.00 114.31 1t26 n LEU 180 Ca 0.00 -0.01 -0.18 0.00 -0.03 0.00 0.00 56.01 55.79 1t26 n LEU 180 Cb 0.40 -0.23 0.08 0.00 -2.33 0.00 0.00 43.42 41.34 1t26 n LEU 180 CO 0.45 0.12 0.10 0.59 -1.33 0.00 0.00 177.39 177.32 1t26 n ASN 181 N -1.17 -2.29 -4.39 -1.43 3.02 0.03 -5.03 115.26 104.00 1t26 n ASN 181 Ca 0.09 -0.63 -0.20 0.00 -0.03 0.00 0.00 54.58 53.81 1t26 n ASN 181 Cb 0.33 -5.03 -0.10 0.00 -0.61 0.00 0.00 39.78 34.37 1t26 n ASN 181 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1t26 s VAL 182 N -3.38 1.30 0.14 2.41 -7.23 -1.01 -5.07 120.40 107.56 1t26 s VAL 182 Ca 0.05 -2.06 -0.32 0.00 -1.81 0.00 0.00 61.98 57.83 1t26 s VAL 182 Cb -0.02 -2.47 -0.12 0.00 0.56 0.00 0.00 36.38 34.33 1t26 s VAL 182 CO 0.74 -0.26 1.75 0.00 -0.31 0.00 0.00 175.10 177.02 1t26 h PRO 184 N 7.49 0.23 0.00 0.00 0.11 -1.91 0.58 132.00 138.49 1t26 h PRO 184 Ca -0.45 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1t26 h PRO 184 Cb 1.23 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1t26 h PRO 184 CO 0.94 0.15 -0.01 -0.09 -0.21 0.00 0.00 178.00 178.78 1t26 h ARG 185 N 0.23 0.00 0.00 1.05 9.65 -1.93 -2.12 114.38 121.26 1t26 h ARG 185 Ca 0.47 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.35 1t26 h ARG 185 Cb 0.86 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.44 1t26 h ARG 185 CO -0.58 0.01 0.00 -0.25 2.80 0.00 0.00 179.97 181.94 1t26 n ASP 186 N -3.17 0.26 -4.71 -3.80 8.00 0.19 -4.61 116.55 108.71 1t26 n ASP 186 Ca -0.02 0.54 -0.38 0.00 0.71 0.00 0.00 54.79 55.64 1t26 n ASP 186 Cb 0.12 -0.60 -0.07 0.00 -0.02 0.00 0.00 41.12 40.56 1t26 n ASP 186 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1t26 s VAL 187 N -3.07 5.21 0.06 2.53 1.01 -0.80 -4.26 120.40 121.08 1t26 s VAL 187 Ca 0.10 0.82 0.09 0.00 0.00 0.00 0.00 61.98 63.00 1t26 s VAL 187 Cb 0.13 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 1t26 s VAL 187 CO 0.44 0.31 -0.26 0.21 0.00 0.00 0.00 175.10 175.80 1t26 s ASN 188 N 0.71 3.14 0.16 3.32 3.04 -0.57 -4.87 114.94 119.86 1t26 s ASN 188 Ca 0.23 -0.61 -0.23 0.00 0.04 0.00 0.00 52.86 52.28 1t26 s ASN 188 Cb -0.15 -0.27 0.07 0.00 -1.54 0.00 0.00 41.25 39.36 1t26 s ASN 188 CO 0.08 0.24 0.63 0.00 -3.04 0.00 0.00 177.10 175.01 1t26 s ALA 189 N -0.85 -1.59 -0.07 1.71 0.00 -1.26 -1.65 121.76 118.05 1t26 s ALA 189 Ca 0.12 0.46 0.02 0.00 0.00 0.00 0.00 51.96 52.56 1t26 s ALA 189 Cb -0.10 0.85 0.01 0.00 0.00 0.00 0.00 23.12 23.88 1t26 s ALA 189 CO 0.03 -0.79 -0.14 -1.01 0.00 0.00 0.00 175.76 173.85 1t26 s HIS 190 N -3.71 1.61 -0.08 0.00 3.76 -1.26 -4.93 115.29 110.67 1t26 s HIS 190 Ca 0.02 -0.62 0.01 0.00 -0.15 0.00 0.00 55.06 54.33 1t26 s HIS 190 Cb -0.01 -1.16 0.02 0.00 1.11 0.00 0.00 32.58 32.53 1t26 s HIS 190 CO -0.11 -0.31 -0.10 0.42 -0.85 0.00 0.00 174.74 173.79 1t26 s ILE 191 N 0.68 1.05 0.33 0.60 1.01 -1.26 -2.13 121.20 121.47 1t26 s ILE 191 Ca -0.14 -0.39 0.05 0.00 0.00 0.00 0.00 60.65 60.17 1t26 s ILE 191 Cb -0.16 -1.00 -0.02 0.00 0.01 0.00 0.00 42.46 41.30 1t26 s ILE 191 CO 0.04 0.35 0.17 1.33 0.00 0.00 0.00 174.94 176.83 1t26 n VAL 192 N 4.17 0.00 0.00 2.92 0.24 -0.66 -4.63 118.33 120.37 1t26 n VAL 192 Ca -0.20 -2.07 0.00 0.00 -2.04 0.00 0.00 64.34 60.03 1t26 n VAL 192 Cb 0.51 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.74 1t26 n VAL 192 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1t26 n GLY 193 N -0.45 2.05 3.36 7.63 0.00 -0.40 -1.54 105.19 115.83 1t26 n GLY 193 Ca -0.00 -0.34 -0.12 0.00 0.00 0.00 0.00 46.02 45.56 1t26 n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t26 s ALA 194 N -0.22 -1.18 -0.47 4.61 0.00 -1.26 -1.74 121.76 121.50 1t26 s ALA 194 Ca 0.00 0.28 -0.19 0.00 0.00 0.00 0.00 51.96 52.05 1t26 s ALA 194 Cb 0.00 0.60 0.04 0.00 0.00 0.00 0.00 23.12 23.76 1t26 s ALA 194 CO 0.00 -0.60 0.58 -1.58 0.00 0.00 0.00 175.76 174.16 1t26 s HIS 195 N -3.25 3.08 -5.00 0.00 2.46 -1.26 -3.78 115.29 107.55 1t26 s HIS 195 Ca -0.01 -0.40 0.00 0.00 0.47 0.00 0.00 55.06 55.12 1t26 s HIS 195 Cb 0.00 -3.34 0.00 0.00 -0.13 0.00 0.00 32.58 29.11 1t26 s HIS 195 CO -0.08 -0.92 0.00 0.41 -2.47 0.00 0.00 174.74 171.68 1t26 n GLY 196 N 5.13 -0.90 0.12 1.59 0.00 -1.26 -4.70 105.19 105.17 1t26 n GLY 196 Ca -0.06 -1.29 0.10 0.00 0.00 0.00 0.00 46.02 44.78 1t26 n GLY 196 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1t26 n ASN 197 N 2.22 0.50 -1.32 1.61 3.02 -1.26 -1.52 115.26 118.50 1t26 n ASN 197 Ca 0.00 0.68 0.11 0.00 -0.03 0.00 0.00 54.58 55.33 1t26 n ASN 197 Cb 0.00 -0.76 0.31 0.00 -0.61 0.00 0.00 39.78 38.72 1t26 n ASN 197 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1t26 n LYS 198 N -2.11 2.80 -1.61 3.52 4.76 -1.26 -4.99 118.16 119.27 1t26 n LYS 198 Ca 0.00 -2.52 -0.43 0.00 -2.87 0.00 0.00 58.31 52.49 1t26 n LYS 198 Cb 0.12 -1.60 -0.00 0.00 -1.84 0.00 0.00 35.03 31.70 1t26 n LYS 198 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1t26 n MET 199 N 1.42 1.45 -3.54 1.97 0.00 -0.58 -4.49 117.12 113.35 1t26 n MET 199 Ca 0.23 0.51 -0.42 0.00 0.00 0.00 0.00 57.70 58.03 1t26 n MET 199 Cb 0.64 -2.00 -0.11 0.00 0.00 0.00 0.00 33.22 31.75 1t26 n MET 199 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1t26 s VAL 200 N -1.18 4.84 -0.24 3.17 1.01 -0.59 -4.95 120.40 122.46 1t26 s VAL 200 Ca 0.60 -0.80 -0.21 0.00 0.00 0.00 0.00 61.98 61.57 1t26 s VAL 200 Cb -0.61 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.04 1t26 s VAL 200 CO 0.59 -0.28 0.65 -0.76 0.00 0.00 0.00 175.10 175.30 1t26 s LEU 201 N 1.60 4.08 -0.82 3.92 1.02 -1.26 -1.65 118.68 125.57 1t26 s LEU 201 Ca 0.03 0.76 -0.14 0.00 0.02 0.00 0.00 54.13 54.80 1t26 s LEU 201 Cb -0.19 -2.89 0.21 0.00 0.02 0.00 0.00 46.19 43.34 1t26 s LEU 201 CO 0.08 -0.36 0.78 -0.76 0.02 0.00 0.00 176.35 176.11 1t26 s LEU 202 N 2.40 6.62 0.32 1.79 1.43 -0.91 -4.91 118.68 125.42 1t26 s LEU 202 Ca 0.27 -2.61 0.06 0.00 -1.03 0.00 0.00 54.13 50.82 1t26 s LEU 202 Cb -0.16 -2.22 0.71 0.00 0.03 0.00 0.00 46.19 44.55 1t26 s LEU 202 CO 0.09 -0.62 1.84 0.50 0.23 0.00 0.00 176.35 178.39 1t26 h LYS 203 N 7.90 0.80 0.00 1.70 3.64 -1.95 -2.09 116.57 126.57 1t26 h LYS 203 Ca 0.09 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1t26 h LYS 203 Cb 1.04 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.68 1t26 h LYS 203 CO 0.79 0.53 -0.06 -0.09 -2.27 0.00 0.00 179.45 178.35 1t26 h ARG 204 N 0.82 0.00 -0.75 1.90 2.43 -1.98 -2.88 114.38 113.92 1t26 h ARG 204 Ca 0.49 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 59.35 1t26 h ARG 204 Cb 0.66 0.00 -0.18 0.00 -0.42 0.00 0.00 29.97 30.03 1t26 h ARG 204 CO -0.25 0.06 0.34 0.66 -1.51 0.00 0.00 179.97 179.27 1t26 n TYR 205 N -3.86 2.40 -3.79 2.20 4.01 -0.78 -4.94 117.16 112.40 1t26 n TYR 205 Ca -0.03 -1.47 -0.37 0.00 -0.16 0.00 0.00 57.90 55.88 1t26 n TYR 205 Cb 0.15 -0.73 -0.07 0.00 -0.31 0.00 0.00 39.34 38.38 1t26 n TYR 205 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1t26 s ILE 206 N -3.13 5.43 0.11 -0.72 1.01 -1.09 -4.11 121.20 118.70 1t26 s ILE 206 Ca 0.54 0.28 0.03 0.00 0.00 0.00 0.00 60.65 61.50 1t26 s ILE 206 Cb 0.45 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 1t26 s ILE 206 CO 0.10 0.55 -0.09 0.42 0.00 0.00 0.00 174.94 175.93 1t26 s THR 207 N -0.58 0.96 -0.28 2.92 -4.23 -0.66 -1.54 115.64 112.23 1t26 s THR 207 Ca 0.14 -1.83 0.16 0.00 -1.18 0.00 0.00 61.69 58.97 1t26 s THR 207 Cb -0.12 -1.58 0.49 0.00 1.34 0.00 0.00 72.50 72.62 1t26 s THR 207 CO 0.03 -0.69 1.14 0.52 -0.54 0.00 0.00 174.62 175.09 1t26 n VAL 208 N 0.19 1.82 0.00 2.29 0.31 -1.26 -1.52 118.33 120.17 1t26 n VAL 208 Ca -0.13 -3.52 0.00 0.00 -0.01 0.00 0.00 64.34 60.67 1t26 n VAL 208 Cb 0.59 0.19 0.00 0.00 -0.91 0.00 0.00 33.84 33.71 1t26 n VAL 208 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1t26 n GLY 209 N -0.63 0.00 3.83 2.92 0.00 -1.26 -4.76 105.19 105.29 1t26 n GLY 209 Ca 0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 1t26 n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1t26 s ILE 209 N 0.00 5.42 0.21 -0.61 1.01 -1.26 -5.05 121.20 120.92 1t26 s ILE 209 Ca 0.00 0.18 -0.32 0.00 0.00 0.00 0.00 60.65 60.51 1t26 s ILE 209 Cb 0.00 -3.39 -0.13 0.00 0.01 0.00 0.00 42.46 38.94 1t26 s ILE 209 CO 0.00 0.57 1.48 -2.65 0.00 0.00 0.00 174.94 174.34 1t26 n PRO 209 N 2.43 2.11 0.12 2.79 -0.02 -1.26 -4.22 135.00 136.94 1t26 n PRO 209 Ca -0.19 0.75 0.15 0.00 -2.02 0.00 0.00 63.50 62.19 1t26 n PRO 209 Cb 0.54 -2.46 0.67 0.00 -0.02 0.00 0.00 33.50 32.23 1t26 n PRO 209 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1t26 h LEU 210 N 4.87 0.00 -1.93 2.45 5.85 -1.61 -2.01 115.31 122.94 1t26 h LEU 210 Ca -0.45 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.38 1t26 h LEU 210 Cb 1.26 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 1t26 h LEU 210 CO 0.81 0.00 0.29 -0.61 -0.34 0.00 0.00 178.44 178.59 1t26 h GLN 210 N 0.00 0.08 -0.37 1.25 5.75 -1.89 0.28 115.11 120.21 1t26 h GLN 210 Ca 0.14 -0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.56 1t26 h GLN 210 Cb 0.54 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.06 1t26 h GLN 210 CO -0.00 0.05 -0.08 0.93 -2.65 0.00 0.00 178.83 177.08 1t26 h GLU 211 N 0.08 0.62 0.00 1.69 5.08 -1.73 0.80 114.58 121.12 1t26 h GLU 211 Ca 0.20 -0.17 -0.13 0.00 -1.00 0.00 0.00 59.36 58.26 1t26 h GLU 211 Cb 0.68 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1t26 h GLU 211 CO -0.02 0.69 -0.60 0.74 -1.00 0.00 0.00 179.01 178.82 1t26 h PHE 212 N 0.58 0.00 -0.16 4.33 -1.00 -1.11 -2.06 116.94 117.51 1t26 h PHE 212 Ca 0.11 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.75 1t26 h PHE 212 Cb 0.48 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.04 1t26 h PHE 212 CO 0.02 0.60 -0.44 0.82 -1.61 0.00 0.00 178.31 177.70 1t26 h ILE 213 N 0.00 1.34 -0.66 -0.55 2.04 -0.82 -0.80 117.51 118.07 1t26 h ILE 213 Ca -0.01 -1.70 0.03 0.00 1.00 0.00 0.00 64.86 64.19 1t26 h ILE 213 Cb 1.14 1.98 -0.04 0.00 -0.74 0.00 0.00 36.82 39.16 1t26 h ILE 213 CO 0.08 0.52 0.44 0.78 0.00 0.00 0.00 178.15 179.97 1t26 h ASN 214 N 0.24 0.68 -0.09 1.72 2.35 -0.74 -1.61 115.58 118.12 1t26 h ASN 214 Ca -0.01 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1t26 h ASN 214 Cb 1.06 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.27 1t26 h ASN 214 CO 0.09 0.47 0.00 0.59 -1.65 0.00 0.00 177.43 176.93 1t26 n ASN 215 N -4.46 0.71 -2.03 5.81 3.02 -0.79 -4.91 115.26 112.61 1t26 n ASN 215 Ca 0.08 -1.70 -0.19 0.00 -0.03 0.00 0.00 54.58 52.74 1t26 n ASN 215 Cb 0.13 -0.06 -0.04 0.00 -0.61 0.00 0.00 39.78 39.20 1t26 n ASN 215 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1t26 n LYS 216 N -0.24 -1.64 0.15 3.52 5.02 -0.61 -4.85 118.16 119.50 1t26 n LYS 216 Ca 0.11 0.99 0.03 0.00 -2.02 0.00 0.00 58.31 57.43 1t26 n LYS 216 Cb 0.15 -5.51 0.04 0.00 -0.02 0.00 0.00 35.03 29.69 1t26 n LYS 216 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1t26 h LEU 218 N 0.00 0.00 -7.20 -0.35 3.38 -1.37 -3.45 115.31 106.32 1t26 h LEU 218 Ca -0.42 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.46 1t26 h LEU 218 Cb 1.28 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.80 1t26 h LEU 218 CO 0.54 0.45 -0.13 -0.51 0.09 0.00 0.00 178.44 178.89 1t26 s ILE 219 N -2.99 -0.00 0.30 1.22 2.07 -1.18 -4.86 121.20 115.76 1t26 s ILE 219 Ca 0.04 0.01 0.05 0.00 -1.41 0.00 0.00 60.65 59.34 1t26 s ILE 219 Cb 0.07 -0.72 -0.02 0.00 0.13 0.00 0.00 42.46 41.93 1t26 s ILE 219 CO 0.74 0.00 0.44 -0.94 -1.91 0.00 0.00 174.94 173.27 1t26 s SER 220 N 0.45 6.15 0.25 4.50 1.04 -1.26 -3.97 113.70 120.86 1t26 s SER 220 Ca -0.01 0.01 -0.06 0.00 0.48 0.00 0.00 55.95 56.36 1t26 s SER 220 Cb -0.04 -1.61 0.27 0.00 0.10 0.00 0.00 66.02 64.75 1t26 s SER 220 CO -0.02 -0.27 1.91 0.44 0.98 0.00 0.00 173.24 176.29 1t26 h ASP 221 N 0.98 1.07 -0.76 7.02 3.32 -1.99 -1.52 116.42 124.54 1t26 h ASP 221 Ca -0.49 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.49 1t26 h ASP 221 Cb 1.24 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.50 1t26 h ASP 221 CO 0.58 0.76 0.27 0.00 -1.72 0.00 0.00 179.24 179.12 1t26 h ALA 222 N 1.37 1.00 -0.57 3.45 0.00 -2.00 -0.53 119.26 121.99 1t26 h ALA 222 Ca 0.37 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1t26 h ALA 222 Cb -0.08 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.39 1t26 h ALA 222 CO -0.10 0.65 0.15 0.93 0.00 0.00 0.00 179.25 180.89 1t26 h GLU 223 N 1.12 0.86 -0.33 0.00 5.08 -1.84 -2.53 114.58 116.94 1t26 h GLU 223 Ca 0.25 -0.17 -0.14 0.00 -1.00 0.00 0.00 59.36 58.30 1t26 h GLU 223 Cb 0.26 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1t26 h GLU 223 CO -0.01 0.76 -0.37 1.25 -1.00 0.00 0.00 179.01 179.64 1t26 h LEU 225 N 0.83 0.83 -1.09 1.33 5.85 -0.74 -1.72 115.31 120.61 1t26 h LEU 225 Ca 0.19 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.54 1t26 h LEU 225 Cb 0.28 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 1t26 h LEU 225 CO -0.00 1.11 0.57 -0.33 -0.34 0.00 0.00 178.44 179.45 1t26 h GLU 226 N 0.65 1.19 -0.44 1.25 4.39 -0.80 0.10 114.58 120.91 1t26 h GLU 226 Ca 0.06 -0.08 -0.13 0.00 0.34 0.00 0.00 59.36 59.54 1t26 h GLU 226 Cb 0.92 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1t26 h GLU 226 CO 0.08 0.80 -0.24 0.00 -1.16 0.00 0.00 179.01 178.50 1t26 h ALA 227 N 1.41 0.63 -0.77 3.43 0.00 -1.23 -1.63 119.26 121.10 1t26 h ALA 227 Ca 0.33 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1t26 h ALA 227 Cb -0.11 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1t26 h ALA 227 CO -0.07 0.63 0.28 0.82 0.00 0.00 0.00 179.25 180.91 1t26 h ILE 228 N 0.78 1.26 -0.18 0.00 2.04 -0.80 -0.62 117.51 120.00 1t26 h ILE 228 Ca 0.10 -0.86 0.01 0.00 1.00 0.00 0.00 64.86 65.10 1t26 h ILE 228 Cb 0.82 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1t26 h ILE 228 CO 0.07 0.35 0.09 -0.26 0.00 0.00 0.00 178.15 178.40 1t26 h PHE 229 N 1.13 0.17 -0.86 1.37 -1.00 -0.57 0.20 116.94 117.39 1t26 h PHE 229 Ca 0.25 0.01 -0.03 0.00 2.81 0.00 0.00 57.97 61.01 1t26 h PHE 229 Cb 0.26 -0.05 -0.04 0.00 3.61 0.00 0.00 35.95 39.73 1t26 h PHE 229 CO 0.02 0.10 0.42 0.22 -1.61 0.00 0.00 178.31 177.46 1t26 h ASP 230 N 0.20 1.11 -0.44 2.17 3.58 -1.06 -2.22 116.42 119.76 1t26 h ASP 230 Ca 0.07 -0.13 -0.06 0.00 0.42 0.00 0.00 57.03 57.34 1t26 h ASP 230 Cb 0.01 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.75 1t26 h ASP 230 CO -0.05 0.93 0.08 -0.09 -2.88 0.00 0.00 179.24 177.22 1t26 h ARG 231 N 1.22 0.80 -0.03 0.28 2.43 -0.61 -2.13 114.38 116.33 1t26 h ARG 231 Ca 0.30 -0.18 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1t26 h ARG 231 Cb 0.10 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1t26 h ARG 231 CO -0.04 0.75 0.01 1.15 -1.51 0.00 0.00 179.97 180.34 1t26 h THR 232 N 0.76 1.13 -0.96 0.20 2.02 -0.43 -0.83 112.91 114.80 1t26 h THR 232 Ca 0.16 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.96 1t26 h THR 232 Cb 0.35 1.34 -0.05 0.00 -1.74 0.00 0.00 68.15 68.05 1t26 h THR 232 CO 0.01 0.10 0.60 0.58 0.37 0.00 0.00 175.52 177.18 1t26 h VAL 233 N -0.11 1.26 -0.46 3.16 2.07 -1.25 -2.91 116.25 118.00 1t26 h VAL 233 Ca 0.01 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1t26 h VAL 233 Cb 0.16 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 29.80 1t26 h VAL 233 CO -0.00 0.26 0.00 0.59 0.02 0.00 0.00 177.57 178.44 1t26 n ASN 234 N -4.37 3.21 -0.08 0.57 3.02 -0.82 -4.57 115.26 112.22 1t26 n ASN 234 Ca 0.11 -2.22 -0.09 0.00 -0.03 0.00 0.00 54.58 52.35 1t26 n ASN 234 Cb 0.04 -0.44 -0.02 0.00 -0.61 0.00 0.00 39.78 38.76 1t26 n ASN 234 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1t26 h THR 235 N 2.85 1.05 -0.69 3.41 2.02 -0.94 0.34 112.91 120.94 1t26 h THR 235 Ca 0.00 -0.12 0.08 0.00 0.77 0.00 0.00 66.41 67.14 1t26 h THR 235 Cb 0.96 0.66 -0.07 0.00 -1.74 0.00 0.00 68.15 67.96 1t26 h THR 235 CO 0.12 0.07 0.35 0.00 0.37 0.00 0.00 175.52 176.42 1t26 h ALA 236 N 1.12 0.94 -0.66 6.16 0.00 -1.84 -0.75 119.26 124.23 1t26 h ALA 236 Ca 0.11 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1t26 h ALA 236 Cb -0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1t26 h ALA 236 CO -0.04 -0.02 0.18 1.25 0.00 0.00 0.00 179.25 180.62 1t26 h LEU 237 N 0.62 0.98 -0.88 0.00 5.85 -1.75 -1.89 115.31 118.24 1t26 h LEU 237 Ca 0.33 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.84 1t26 h LEU 237 Cb 0.30 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 1t26 h LEU 237 CO -0.24 0.94 0.58 -0.08 -0.34 0.00 0.00 178.44 179.30 1t26 h GLU 238 N 0.96 1.14 -0.34 1.25 4.81 0.20 -0.59 114.58 122.02 1t26 h GLU 238 Ca 0.21 -0.07 -0.14 0.00 -0.13 0.00 0.00 59.36 59.23 1t26 h GLU 238 Cb 0.33 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1t26 h GLU 238 CO -0.00 0.75 -0.34 0.82 -0.73 0.00 0.00 179.01 179.51 1t26 h ILE 239 N 1.18 1.29 -0.78 2.32 2.04 -0.97 -2.75 117.51 119.84 1t26 h ILE 239 Ca 0.33 -1.51 -0.04 0.00 1.00 0.00 0.00 64.86 64.63 1t26 h ILE 239 Cb -0.12 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 1t26 h ILE 239 CO -0.08 0.50 0.32 0.58 0.00 0.00 0.00 178.15 179.46 1t26 h VAL 240 N 0.61 1.26 0.00 1.67 2.07 -1.08 1.10 116.25 121.88 1t26 h VAL 240 Ca 0.05 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1t26 h VAL 240 Cb 0.93 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1t26 h VAL 240 CO 0.08 0.33 0.00 0.59 0.02 0.00 0.00 177.57 178.59 1t26 n ASN 241 N -4.28 0.00 -0.02 0.57 3.02 -0.25 -2.82 115.26 111.47 1t26 n ASN 241 Ca 0.07 0.17 -0.01 0.00 -0.03 0.00 0.00 54.58 54.78 1t26 n ASN 241 Cb 0.18 -0.33 -0.04 0.00 -0.61 0.00 0.00 39.78 38.98 1t26 n ASN 241 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1t26 n LEU 242 N -1.33 0.00 0.00 3.41 4.77 -0.46 -5.07 117.00 118.31 1t26 n LEU 242 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 1t26 n LEU 242 Cb 0.13 0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1t26 n LEU 242 CO 0.12 0.08 0.00 1.57 -1.33 0.00 0.00 177.39 177.83 1t26 n HIS 243 N -2.01 0.00 -3.86 -1.77 -0.00 0.37 -5.08 115.22 102.86 1t26 n HIS 243 Ca -0.06 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 57.63 1t26 n HIS 243 Cb 0.48 0.00 0.02 0.00 -0.00 0.00 0.00 29.99 30.48 1t26 n HIS 243 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1t26 s ALA 244 N -1.20 -1.53 0.23 1.57 0.00 -1.15 -4.87 121.76 114.82 1t26 s ALA 244 Ca 0.00 -0.33 -0.31 0.00 0.00 0.00 0.00 51.96 51.32 1t26 s ALA 244 Cb 0.00 0.74 -0.14 0.00 0.00 0.00 0.00 23.12 23.73 1t26 s ALA 244 CO 0.00 -1.06 1.38 0.45 0.00 0.00 0.00 175.76 176.53 1t26 n SER 245 N -1.17 2.61 -4.74 0.00 2.88 -1.26 -3.72 113.62 108.22 1t26 n SER 245 Ca -0.04 1.14 -0.42 0.00 -1.33 0.00 0.00 58.87 58.23 1t26 n SER 245 Cb 0.60 -1.41 -0.01 0.00 -0.75 0.00 0.00 64.21 62.64 1t26 n SER 245 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1t26 n PRO 246 N 1.98 2.56 0.00 -1.46 -0.02 -1.26 -4.91 135.00 131.89 1t26 n PRO 246 Ca 0.12 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 1t26 n PRO 246 Cb 0.31 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 1t26 n PRO 246 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 1t26 n TYR 247 N 1.19 0.00 0.01 6.00 0.18 -1.26 -4.81 117.16 118.48 1t26 n TYR 247 Ca 0.05 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.71 1t26 n TYR 247 Cb 0.37 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.24 1t26 n TYR 247 CO 0.00 0.00 0.00 0.28 -2.08 0.00 0.00 176.86 175.06 1t26 h VAL 248 N 0.00 1.24 -0.37 -3.48 2.07 -1.91 -2.40 116.25 111.40 1t26 h VAL 248 Ca 0.00 -1.16 -0.12 0.00 0.82 0.00 0.00 66.70 66.25 1t26 h VAL 248 Cb 0.01 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1t26 h VAL 248 CO 0.00 0.28 -0.22 0.00 0.02 0.00 0.00 177.57 177.65 1t26 h ALA 249 N 0.25 0.52 -0.62 1.67 0.00 -1.99 -2.02 119.26 117.07 1t26 h ALA 249 Ca -0.01 -0.38 0.12 0.00 0.00 0.00 0.00 54.91 54.65 1t26 h ALA 249 Cb 0.53 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.10 1t26 h ALA 249 CO 0.01 0.49 0.13 -1.35 0.00 0.00 0.00 179.25 178.54 1t26 h PRO 250 N 0.59 0.25 -0.35 0.00 0.11 -1.88 0.20 132.00 130.92 1t26 h PRO 250 Ca 0.08 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.16 1t26 h PRO 250 Cb 0.78 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.82 1t26 h PRO 250 CO 0.06 0.16 0.19 0.00 -0.21 0.00 0.00 178.00 178.21 1t26 h ALA 251 N 1.50 0.45 -0.88 -0.75 0.00 -1.26 -0.71 119.26 117.63 1t26 h ALA 251 Ca 0.33 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1t26 h ALA 251 Cb 0.51 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1t26 h ALA 251 CO -0.43 -0.02 0.49 0.00 0.00 0.00 0.00 179.25 179.30 1t26 h ALA 252 N 1.05 1.21 -0.43 0.00 0.00 -0.91 -0.86 119.26 119.34 1t26 h ALA 252 Ca 0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1t26 h ALA 252 Cb 0.06 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1t26 h ALA 252 CO -0.02 0.64 0.22 0.00 0.00 0.00 0.00 179.25 180.09 1t26 h ALA 253 N 1.31 0.55 -0.59 0.00 0.00 -0.49 -1.26 119.26 118.79 1t26 h ALA 253 Ca 0.31 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1t26 h ALA 253 Cb 0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1t26 h ALA 253 CO -0.05 0.09 0.29 0.82 0.00 0.00 0.00 179.25 180.40 1t26 h ILE 254 N 0.55 1.21 -0.38 0.00 2.04 -0.72 -2.54 117.51 117.65 1t26 h ILE 254 Ca 0.15 -0.57 -0.07 0.00 1.00 0.00 0.00 64.86 65.37 1t26 h ILE 254 Cb 0.09 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1t26 h ILE 254 CO -0.02 0.23 -0.04 0.40 0.00 0.00 0.00 178.15 178.73 1t26 h ILE 255 N 0.80 1.23 -0.86 -0.67 1.08 -0.98 0.45 117.51 118.56 1t26 h ILE 255 Ca 0.20 -0.95 -0.01 0.00 -0.39 0.00 0.00 64.86 63.72 1t26 h ILE 255 Cb 0.10 0.98 -0.04 0.00 -3.07 0.00 0.00 36.82 34.79 1t26 h ILE 255 CO -0.03 0.32 0.50 -0.08 -0.69 0.00 0.00 178.15 178.17 1t26 h GLU 256 N 0.59 1.17 -0.03 2.37 4.81 -0.94 0.17 114.58 122.73 1t26 h GLU 256 Ca 0.12 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1t26 h GLU 256 Cb 0.43 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1t26 h GLU 256 CO 0.02 0.84 -0.00 0.52 -0.73 0.00 0.00 179.01 179.65 1t26 h MET 257 N 1.19 0.05 -0.87 1.92 2.86 -0.96 -2.38 114.93 116.73 1t26 h MET 257 Ca 0.31 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.91 1t26 h MET 257 Cb -0.02 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.60 1t26 h MET 257 CO -0.05 0.36 0.48 0.00 1.06 0.00 0.00 176.91 178.75 1t26 h ALA 258 N 0.69 1.12 -0.80 6.32 0.00 -0.63 -2.50 119.26 123.45 1t26 h ALA 258 Ca 0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1t26 h ALA 258 Cb 0.34 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1t26 h ALA 258 CO 0.00 0.62 0.33 1.49 0.00 0.00 0.00 179.25 181.70 1t26 h GLU 259 N 1.22 1.19 -0.84 0.00 4.81 -0.66 -0.74 114.58 119.55 1t26 h GLU 259 Ca 0.31 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1t26 h GLU 259 Cb 0.03 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.17 1t26 h GLU 259 CO -0.05 0.95 0.50 1.03 -0.73 0.00 0.00 179.01 180.71 1t26 h SER 260 N 1.16 1.02 0.31 1.04 0.87 -0.99 -1.10 113.55 115.87 1t26 h SER 260 Ca 0.27 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.75 1t26 h SER 260 Cb 0.20 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1t26 h SER 260 CO -0.02 0.79 -0.15 0.22 -0.53 0.00 0.00 176.83 177.13 1t26 h TYR 261 N 1.16 -0.39 -0.88 2.24 3.20 -1.21 -0.90 116.97 120.20 1t26 h TYR 261 Ca 0.30 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.18 1t26 h TYR 261 Cb -0.03 0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.32 1t26 h TYR 261 CO 0.01 -0.05 0.58 -0.07 -1.64 0.00 0.00 178.16 176.99 1t26 h LEU 262 N -0.81 1.00 -2.72 2.82 3.38 -0.97 -2.80 115.31 115.21 1t26 h LEU 262 Ca -0.04 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1t26 h LEU 262 Cb 0.52 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1t26 h LEU 262 CO 0.07 0.71 0.00 0.29 0.09 0.00 0.00 178.44 179.60 1t26 n LYS 263 N -4.41 2.71 -3.81 1.13 5.02 -0.43 -4.98 118.16 113.39 1t26 n LYS 263 Ca 0.10 -2.54 -0.23 0.00 -2.02 0.00 0.00 58.31 53.62 1t26 n LYS 263 Cb 0.04 -1.52 0.01 0.00 -0.02 0.00 0.00 35.03 33.54 1t26 n LYS 263 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1t26 n ASP 264 N 1.48 -0.99 0.14 4.39 2.03 -0.86 -4.89 116.55 117.85 1t26 n ASP 264 Ca 0.22 -0.89 0.01 0.00 0.52 0.00 0.00 54.79 54.65 1t26 n ASP 264 Cb 0.59 -3.66 0.14 0.00 -0.72 0.00 0.00 41.12 37.48 1t26 n ASP 264 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1t26 h LEU 265 N -1.86 0.00 0.13 -2.67 3.38 -1.37 -3.45 115.31 109.47 1t26 h LEU 265 Ca -0.62 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 56.95 1t26 h LEU 265 Cb 1.37 0.00 0.10 0.00 0.09 0.00 0.00 40.66 42.21 1t26 h LEU 265 CO 0.59 0.59 -0.64 0.29 0.09 0.00 0.00 178.44 179.36 1t26 n LYS 266 N -3.51 -6.36 -2.30 1.13 5.02 -0.68 -4.98 118.16 106.48 1t26 n LYS 266 Ca -0.00 0.88 -0.37 0.00 -2.02 0.00 0.00 58.31 56.79 1t26 n LYS 266 Cb 0.67 -5.83 -0.02 0.00 -0.02 0.00 0.00 35.03 29.84 1t26 n LYS 266 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1t26 s LYS 267 N -5.99 3.88 -0.32 1.97 1.02 -1.21 -4.64 119.74 114.45 1t26 s LYS 267 Ca 0.44 1.75 -0.23 0.00 0.02 0.00 0.00 55.97 57.95 1t26 s LYS 267 Cb -0.19 -2.48 0.00 0.00 -0.52 0.00 0.00 37.83 34.64 1t26 s LYS 267 CO 0.54 -0.45 0.77 0.08 -0.92 0.00 0.00 175.35 175.38 1t26 s VAL 268 N -1.53 4.79 -0.01 3.17 1.01 -1.26 -1.88 120.40 124.69 1t26 s VAL 268 Ca 0.61 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.70 1t26 s VAL 268 Cb -0.28 -4.14 0.01 0.00 0.00 0.00 0.00 36.38 31.96 1t26 s VAL 268 CO 0.35 -0.27 -0.01 -0.76 0.00 0.00 0.00 175.10 174.40 1t26 s LEU 269 N 2.95 1.76 -0.23 3.92 1.43 -0.05 -4.93 118.68 123.54 1t26 s LEU 269 Ca 0.32 -0.03 -0.25 0.00 -1.03 0.00 0.00 54.13 53.14 1t26 s LEU 269 Cb -0.14 -0.12 -0.01 0.00 0.03 0.00 0.00 46.19 45.96 1t26 s LEU 269 CO 0.13 -0.01 0.85 -0.63 0.23 0.00 0.00 176.35 176.92 1t26 s ILE 270 N 0.26 4.83 0.12 -0.59 1.01 -1.26 -1.21 121.20 124.36 1t26 s ILE 270 Ca -0.02 1.63 -0.03 0.00 0.00 0.00 0.00 60.65 62.23 1t26 s ILE 270 Cb -0.04 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.25 1t26 s ILE 270 CO -0.01 -0.07 0.09 0.00 0.00 0.00 0.00 174.94 174.96 1t26 s SER 272 N -3.00 7.21 0.08 0.00 0.15 -0.47 -1.94 113.70 115.72 1t26 s SER 272 Ca 0.19 1.49 -0.06 0.00 0.70 0.00 0.00 55.95 58.27 1t26 s SER 272 Cb 0.07 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.82 1t26 s SER 272 CO -0.01 -0.44 0.12 0.28 1.20 0.00 0.00 173.24 174.40 1t26 s THR 273 N 2.00 0.17 0.03 6.45 -1.32 -0.75 -1.28 115.64 120.93 1t26 s THR 273 Ca 0.47 -1.37 -0.30 0.00 -1.21 0.00 0.00 61.69 59.28 1t26 s THR 273 Cb -0.18 -1.39 -0.07 0.00 -1.51 0.00 0.00 72.50 69.34 1t26 s THR 273 CO 0.17 -0.76 1.66 -0.22 -2.21 0.00 0.00 174.62 173.27 1t26 s LEU 274 N -2.88 4.35 0.02 9.08 2.96 -1.26 -1.75 118.68 129.20 1t26 s LEU 274 Ca 0.06 2.40 -0.20 0.00 -0.22 0.00 0.00 54.13 56.16 1t26 s LEU 274 Cb 0.06 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 43.14 1t26 s LEU 274 CO -0.11 -0.90 0.59 -0.76 -1.32 0.00 0.00 176.35 173.85 1t26 s LEU 275 N 3.18 4.45 -0.31 -0.68 1.43 -0.24 -4.96 118.68 121.55 1t26 s LEU 275 Ca 0.74 1.19 0.13 0.00 -1.03 0.00 0.00 54.13 55.16 1t26 s LEU 275 Cb -0.37 -2.91 0.47 0.00 0.03 0.00 0.00 46.19 43.40 1t26 s LEU 275 CO 0.32 0.15 1.13 -0.62 0.23 0.00 0.00 176.35 177.55 1t26 n GLU 276 N 2.46 2.75 0.00 1.70 1.02 -1.23 -2.70 120.64 124.64 1t26 n GLU 276 Ca -0.08 -3.92 0.00 0.00 -0.02 0.00 0.00 57.16 53.14 1t26 n GLU 276 Cb 0.51 -1.96 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 1t26 n GLU 276 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1t26 n GLY 277 N -0.57 1.95 3.76 0.62 0.00 0.31 -4.91 105.19 106.35 1t26 n GLY 277 Ca 0.28 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.89 1t26 n GLY 277 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1t26 s GLN 278 N 0.00 4.14 -0.85 1.61 1.11 -1.21 -1.08 119.66 123.38 1t26 s GLN 278 Ca 0.00 2.53 0.00 0.00 0.01 0.00 0.00 55.36 57.90 1t26 s GLN 278 Cb 0.00 -3.01 0.00 0.00 -1.01 0.00 0.00 33.01 28.99 1t26 s GLN 278 CO 0.00 -0.54 0.00 0.66 0.01 0.00 0.00 175.29 175.42 1t26 n TYR 279 N 1.31 0.00 -0.72 0.91 4.01 -1.26 -1.31 117.16 120.10 1t26 n TYR 279 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 1t26 n TYR 279 Cb 0.39 -2.35 0.00 0.00 -0.31 0.00 0.00 39.34 37.07 1t26 n TYR 279 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1t26 n GLY 280 N -0.03 0.78 3.66 2.72 0.00 -0.24 -5.01 105.19 107.07 1t26 n GLY 280 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 1t26 n GLY 280 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1t26 s HIS 281 N -2.91 3.06 0.14 1.61 3.76 -0.43 -4.87 115.29 115.65 1t26 s HIS 281 Ca 0.00 0.10 0.00 0.00 -0.15 0.00 0.00 55.06 55.01 1t26 s HIS 281 Cb 0.00 -1.71 -0.04 0.00 1.11 0.00 0.00 32.58 31.94 1t26 s HIS 281 CO 0.00 0.43 0.02 -1.12 -0.85 0.00 0.00 174.74 173.22 1t26 s SER 282 N -1.19 0.76 -1.57 1.40 0.01 -1.26 0.11 113.70 111.96 1t26 s SER 282 Ca 0.16 -1.16 -0.02 0.00 1.31 0.00 0.00 55.95 56.23 1t26 s SER 282 Cb -0.11 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.32 1t26 s SER 282 CO 0.06 -0.63 0.32 0.47 0.41 0.00 0.00 173.24 173.87 1t26 n ASP 283 N -0.13 -5.81 -3.56 2.44 8.00 -1.10 -4.97 116.55 111.42 1t26 n ASP 283 Ca -0.07 -0.16 -0.14 0.00 0.71 0.00 0.00 54.79 55.13 1t26 n ASP 283 Cb 0.63 -4.72 -0.05 0.00 -0.02 0.00 0.00 41.12 36.96 1t26 n ASP 283 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1t26 s ILE 285 N -3.08 0.03 0.00 0.53 1.10 -1.26 -5.04 121.20 113.48 1t26 s ILE 285 Ca 0.16 -0.22 -0.06 0.00 -0.51 0.00 0.00 60.65 60.02 1t26 s ILE 285 Cb -0.07 -0.98 -0.05 0.00 0.15 0.00 0.00 42.46 41.51 1t26 s ILE 285 CO 0.20 -0.12 0.25 -0.36 -2.11 0.00 0.00 174.94 172.80 1t26 s PHE 286 N -2.51 3.57 0.15 3.50 0.40 -1.26 -1.07 117.98 120.76 1t26 s PHE 286 Ca -0.05 0.54 -0.17 0.00 -0.60 0.00 0.00 56.93 56.65 1t26 s PHE 286 Cb -0.01 -1.96 0.04 0.00 0.51 0.00 0.00 43.02 41.60 1t26 s PHE 286 CO -0.02 0.62 0.45 0.20 0.70 0.00 0.00 175.22 177.17 1t26 s GLY 287 N -1.72 -0.25 -0.05 4.36 0.00 -0.72 -4.86 107.32 104.08 1t26 s GLY 287 Ca 0.27 -0.05 -0.30 0.00 0.00 0.00 0.00 44.72 44.64 1t26 s GLY 287 CO 0.16 -0.26 1.01 -0.32 0.00 0.00 0.00 173.10 173.69 1t26 s GLY 288 N -2.82 2.60 -0.01 0.20 0.00 -0.71 -1.81 107.32 104.77 1t26 s GLY 288 Ca 0.05 0.47 -0.29 0.00 0.00 0.00 0.00 44.72 44.95 1t26 s GLY 288 CO -0.10 1.83 0.67 -1.08 0.00 0.00 0.00 173.10 174.43 1t26 s THR 289 N 1.54 0.00 0.23 0.90 -1.32 -0.82 -1.27 115.64 114.90 1t26 s THR 289 Ca 0.51 0.00 -0.32 0.00 -1.21 0.00 0.00 61.69 60.67 1t26 s THR 289 Cb -0.20 -1.00 -0.12 0.00 -1.51 0.00 0.00 72.50 69.66 1t26 s THR 289 CO 0.23 0.00 1.60 -0.81 -2.21 0.00 0.00 174.62 173.43 1t26 n PRO 290 N 0.60 2.51 -4.30 7.08 -0.04 -1.26 -2.15 135.00 137.45 1t26 n PRO 290 Ca -0.18 0.90 -0.16 0.00 -0.04 0.00 0.00 63.50 64.02 1t26 n PRO 290 Cb 0.59 -2.68 -0.10 0.00 -0.04 0.00 0.00 33.50 31.27 1t26 n PRO 290 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1t26 s VAL 291 N 0.54 0.98 -0.23 0.52 -7.23 -0.35 -1.32 120.40 113.32 1t26 s VAL 291 Ca 0.71 -2.03 -0.07 0.00 -1.81 0.00 0.00 61.98 58.79 1t26 s VAL 291 Cb -0.56 -2.22 -0.03 0.00 0.56 0.00 0.00 36.38 34.14 1t26 s VAL 291 CO 0.41 -0.42 0.05 -0.69 -0.31 0.00 0.00 175.10 174.14 1t26 s VAL 292 N -3.45 4.22 -0.24 1.32 1.01 -0.51 -0.87 120.40 121.88 1t26 s VAL 292 Ca 0.26 -0.21 -0.07 0.00 0.00 0.00 0.00 61.98 61.96 1t26 s VAL 292 Cb 0.05 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1t26 s VAL 292 CO 0.06 0.38 0.05 -0.76 0.00 0.00 0.00 175.10 174.83 1t26 s LEU 293 N 1.31 3.37 0.00 3.92 1.43 -0.79 -1.02 118.68 126.91 1t26 s LEU 293 Ca 0.05 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 1t26 s LEU 293 Cb -0.15 -1.89 0.00 0.00 0.03 0.00 0.00 46.19 44.18 1t26 s LEU 293 CO 0.03 -0.02 0.00 0.61 0.23 0.00 0.00 176.35 177.20 1t26 n GLY 294 N 4.81 4.36 0.42 -3.19 0.00 -0.69 -1.68 105.19 109.22 1t26 n GLY 294 Ca -0.16 -1.32 0.22 0.00 0.00 0.00 0.00 46.02 44.75 1t26 n GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t26 h ALA 295 N 1.24 2.45 -0.44 4.61 0.00 -1.80 -0.00 119.26 125.32 1t26 h ALA 295 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1t26 h ALA 295 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1t26 h ALA 295 CO 0.00 -0.70 0.00 0.09 0.00 0.00 0.00 179.25 178.64 1t26 n ASN 296 N -4.42 4.13 0.00 0.00 3.02 -1.26 -5.03 115.26 111.70 1t26 n ASN 296 Ca 0.18 -2.54 0.00 0.00 -0.03 0.00 0.00 54.58 52.19 1t26 n ASN 296 Cb 0.77 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1t26 n ASN 296 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1t26 n GLY 297 N 0.64 0.48 3.55 7.41 0.00 -0.02 -4.57 105.19 112.69 1t26 n GLY 297 Ca 0.20 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.98 1t26 n GLY 297 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t26 s VAL 298 N 0.00 3.65 0.06 1.61 1.01 -0.12 -1.70 120.40 124.92 1t26 s VAL 298 Ca 0.00 0.37 0.07 0.00 0.00 0.00 0.00 61.98 62.42 1t26 s VAL 298 Cb 0.00 -4.74 -0.23 0.00 0.00 0.00 0.00 36.38 31.41 1t26 s VAL 298 CO 0.00 -1.69 1.06 -0.33 0.00 0.00 0.00 175.10 174.14 1t26 h GLU 299 N 10.93 0.03 -3.27 2.72 5.08 -1.32 -3.45 114.58 125.29 1t26 h GLU 299 Ca -0.27 -0.06 -0.17 0.00 -1.00 0.00 0.00 59.36 57.85 1t26 h GLU 299 Cb 1.07 0.02 -0.26 0.00 0.50 0.00 0.00 28.75 30.09 1t26 h GLU 299 CO 1.27 0.87 -0.48 -0.65 -1.00 0.00 0.00 179.01 179.02 1t26 s GLN 301 N -2.67 0.25 -0.26 2.33 -0.21 -1.24 -4.98 119.66 112.89 1t26 s GLN 301 Ca -0.02 0.22 -0.04 0.00 0.02 0.00 0.00 55.36 55.54 1t26 s GLN 301 Cb 0.09 0.12 0.01 0.00 1.00 0.00 0.00 33.01 34.23 1t26 s GLN 301 CO 0.83 -0.04 0.00 0.08 -2.12 0.00 0.00 175.29 174.04 1t26 s VAL 302 N -0.02 3.48 -0.20 1.09 1.01 -1.26 -1.42 120.40 123.07 1t26 s VAL 302 Ca -0.01 -0.72 -0.16 0.00 0.00 0.00 0.00 61.98 61.09 1t26 s VAL 302 Cb -0.02 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 1t26 s VAL 302 CO 0.00 0.22 0.40 -0.63 0.00 0.00 0.00 175.10 175.09 1t26 s ILE 303 N 1.44 5.20 -0.34 2.22 1.01 -0.43 -5.02 121.20 125.27 1t26 s ILE 303 Ca 0.03 0.71 -0.14 0.00 0.00 0.00 0.00 60.65 61.26 1t26 s ILE 303 Cb -0.16 -3.73 -0.01 0.00 0.01 0.00 0.00 42.46 38.56 1t26 s ILE 303 CO -0.01 0.26 0.27 -0.70 0.00 0.00 0.00 174.94 174.76 1t26 s GLU 304 N 1.28 3.49 0.35 2.79 2.12 -1.26 -4.16 118.70 123.30 1t26 s GLU 304 Ca 0.19 -0.61 -0.27 0.00 0.36 0.00 0.00 54.97 54.64 1t26 s GLU 304 Cb -0.15 -3.82 -0.09 0.00 0.26 0.00 0.00 34.13 30.33 1t26 s GLU 304 CO 0.08 -0.48 1.20 -0.51 -0.54 0.00 0.00 175.26 175.01 1t26 s LEU 305 N 1.80 4.34 -1.34 2.70 1.43 -1.26 -4.91 118.68 121.44 1t26 s LEU 305 Ca 0.07 2.44 -0.11 0.00 -1.03 0.00 0.00 54.13 55.51 1t26 s LEU 305 Cb -0.17 -3.82 0.12 0.00 0.03 0.00 0.00 46.19 42.35 1t26 s LEU 305 CO 0.11 -0.52 2.00 0.00 0.23 0.00 0.00 176.35 178.17 1t26 n GLN 306 N 0.54 3.36 -2.04 1.70 6.02 -1.26 -4.93 117.38 120.76 1t26 n GLN 306 Ca 0.02 -3.20 -0.37 0.00 -0.01 0.00 0.00 57.00 53.43 1t26 n GLN 306 Cb 0.45 -3.05 0.02 0.00 1.02 0.00 0.00 30.24 28.68 1t26 n GLN 306 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1t26 s LEU 307 N 0.64 3.85 0.92 1.08 1.43 -1.26 -5.06 118.68 120.29 1t26 s LEU 307 Ca 0.42 2.46 -0.13 0.00 -1.03 0.00 0.00 54.13 55.86 1t26 s LEU 307 Cb 0.11 -4.37 0.19 0.00 0.03 0.00 0.00 46.19 42.16 1t26 s LEU 307 CO -0.03 -1.32 1.26 0.54 0.23 0.00 0.00 176.35 177.03 1t26 s ASN 308 N -1.32 3.29 0.29 2.29 2.20 -1.26 -4.81 114.94 115.62 1t26 s ASN 308 Ca 0.70 0.09 0.04 0.00 -0.94 0.00 0.00 52.86 52.76 1t26 s ASN 308 Cb -0.32 -0.18 0.45 0.00 -2.00 0.00 0.00 41.25 39.20 1t26 s ASN 308 CO 0.38 -2.60 1.73 0.77 -2.94 0.00 0.00 177.10 174.43 1t26 h SER 309 N -1.44 0.40 -0.49 3.54 4.64 -1.98 0.17 113.55 118.39 1t26 h SER 309 Ca -0.42 -0.14 -0.11 0.00 -0.47 0.00 0.00 61.79 60.65 1t26 h SER 309 Cb 1.24 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 1t26 h SER 309 CO 0.37 0.68 -0.12 -0.33 -0.87 0.00 0.00 176.83 176.56 1t26 h GLU 310 N 0.34 0.94 -0.40 4.77 3.07 -2.00 -0.78 114.58 120.53 1t26 h GLU 310 Ca 0.05 -0.36 -0.14 0.00 -0.50 0.00 0.00 59.36 58.41 1t26 h GLU 310 Cb 0.69 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.54 1t26 h GLU 310 CO 0.05 1.02 -0.28 0.93 -1.40 0.00 0.00 179.01 179.34 1t26 h GLU 311 N 0.80 0.90 -0.79 2.33 5.08 -1.86 -3.00 114.58 118.03 1t26 h GLU 311 Ca 0.12 -0.43 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 1t26 h GLU 311 Cb 0.68 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.88 1t26 h GLU 311 CO 0.05 1.08 0.50 0.87 -1.00 0.00 0.00 179.01 180.51 1t26 h LYS 312 N 0.72 1.06 -0.88 2.33 1.57 -0.78 -1.41 116.57 119.17 1t26 h LYS 312 Ca 0.08 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1t26 h LYS 312 Cb 0.86 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.89 1t26 h LYS 312 CO 0.08 0.72 0.55 0.00 -0.57 0.00 0.00 179.45 180.22 1t26 h ALA 313 N 1.47 1.12 -0.29 3.86 0.00 -1.01 0.37 119.26 124.78 1t26 h ALA 313 Ca 0.29 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.97 1t26 h ALA 313 Cb -0.09 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.34 1t26 h ALA 313 CO -0.06 0.56 -0.39 0.87 0.00 0.00 0.00 179.25 180.23 1t26 h LYS 314 N 1.20 0.68 -0.64 0.00 1.79 -1.29 -2.40 116.57 115.91 1t26 h LYS 314 Ca 0.32 -0.35 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 1t26 h LYS 314 Cb -0.08 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.55 1t26 h LYS 314 CO -0.06 0.96 0.37 0.35 -1.08 0.00 0.00 179.45 179.99 1t26 h PHE 315 N 0.56 0.85 -0.96 -1.35 3.04 -0.75 -2.21 116.94 116.12 1t26 h PHE 315 Ca 0.05 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.00 1t26 h PHE 315 Cb 0.92 -0.28 -0.05 0.00 2.56 0.00 0.00 35.95 39.11 1t26 h PHE 315 CO 0.04 0.59 0.62 -0.44 -2.02 0.00 0.00 178.31 177.11 1t26 h ASP 316 N 0.87 1.12 -0.67 0.41 3.32 -0.73 -1.70 116.42 119.04 1t26 h ASP 316 Ca 0.23 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 1t26 h ASP 316 Cb -0.00 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.23 1t26 h ASP 316 CO -0.04 0.82 0.35 -0.33 -1.72 0.00 0.00 179.24 178.32 1t26 h GLU 317 N 1.31 0.95 -0.24 3.56 5.08 -0.98 -0.95 114.58 123.32 1t26 h GLU 317 Ca 0.35 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1t26 h GLU 317 Cb -0.13 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 28.93 1t26 h GLU 317 CO -0.07 0.73 0.13 0.00 -1.00 0.00 0.00 179.01 178.80 1t26 h ALA 318 N 1.17 0.30 -0.87 3.43 0.00 -0.83 -2.55 119.26 119.91 1t26 h ALA 318 Ca 0.23 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1t26 h ALA 318 Cb 0.07 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1t26 h ALA 318 CO -0.03 -0.17 0.43 0.82 0.00 0.00 0.00 179.25 180.30 1t26 h ILE 319 N 0.27 1.26 -0.64 0.00 1.08 -1.15 -2.36 117.51 115.97 1t26 h ILE 319 Ca 0.08 -0.71 0.00 0.00 -0.39 0.00 0.00 64.86 63.85 1t26 h ILE 319 Cb 0.06 0.13 -0.03 0.00 -3.07 0.00 0.00 36.82 33.91 1t26 h ILE 319 CO -0.01 0.31 0.42 0.00 -0.69 0.00 0.00 178.15 178.18 1t26 h ALA 320 N 1.24 1.53 -0.27 1.87 0.00 -0.98 -0.66 119.26 121.98 1t26 h ALA 320 Ca 0.30 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 1t26 h ALA 320 Cb 0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1t26 h ALA 320 CO -0.04 0.43 -0.48 1.49 0.00 0.00 0.00 179.25 180.66 1t26 h GLU 321 N 0.88 0.72 -0.51 0.00 4.57 -1.04 -0.64 114.58 118.55 1t26 h GLU 321 Ca 0.24 -0.41 -0.02 0.00 -1.18 0.00 0.00 59.36 57.99 1t26 h GLU 321 Cb -0.09 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 1t26 h GLU 321 CO -0.05 1.03 0.26 1.15 -1.18 0.00 0.00 179.01 180.22 1t26 h THR 322 N 0.57 1.19 -0.77 0.32 2.02 -0.87 -2.25 112.91 113.12 1t26 h THR 322 Ca 0.03 -0.53 -0.05 0.00 0.77 0.00 0.00 66.41 66.64 1t26 h THR 322 Cb 1.03 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 1t26 h THR 322 CO 0.10 0.21 0.30 0.11 0.37 0.00 0.00 175.52 176.61 1t26 h LYS 323 N 0.68 1.15 -0.16 6.66 1.57 -0.99 -0.41 116.57 125.07 1t26 h LYS 323 Ca 0.18 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1t26 h LYS 323 Cb 0.10 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1t26 h LYS 323 CO -0.02 0.94 0.11 -0.09 -0.57 0.00 0.00 179.45 179.81 1t26 h ARG 324 N 1.12 0.21 -0.00 3.15 2.43 -0.87 -2.39 114.38 118.02 1t26 h ARG 324 Ca 0.26 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.30 1t26 h ARG 324 Cb 0.23 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1t26 h ARG 324 CO -0.02 0.14 -0.55 0.52 -1.51 0.00 0.00 179.97 178.56 1t26 h MET 325 N 0.22 0.01 -0.75 0.20 2.86 -1.27 -2.92 114.93 113.28 1t26 h MET 325 Ca 0.06 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.68 1t26 h MET 325 Cb -0.02 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.60 1t26 h MET 325 CO -0.01 0.56 0.41 -0.22 1.06 0.00 0.00 176.91 178.70 1t26 h LYS 326 N 0.01 1.05 -0.44 1.72 3.64 -0.85 -2.05 116.57 119.65 1t26 h LYS 326 Ca -0.01 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.19 1t26 h LYS 326 Cb 0.97 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1t26 h LYS 326 CO 0.07 0.78 0.02 0.00 -2.27 0.00 0.00 179.45 178.05 1t26 h ALA 327 N 1.21 1.20 0.00 5.00 0.00 -1.25 -2.59 119.26 122.84 1t26 h ALA 327 Ca 0.26 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1t26 h ALA 327 Cb 0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1t26 h ALA 327 CO -0.04 0.53 -0.21 -0.07 0.00 0.00 0.00 179.25 179.46 1t26 h LEU 328 N 0.67 0.00 -0.39 0.00 3.38 -1.36 -3.00 115.31 114.60 1t26 h LEU 328 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1t26 h LEU 328 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1t26 h LEU 328 CO 0.01 0.21 0.00 0.00 0.09 0.00 0.00 178.44 178.75 1t26 h ALA 329 N 1.79 1.00 -0.02 1.53 0.00 -0.97 -3.48 119.26 119.11 1t26 h ALA 329 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1t26 h ALA 329 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1t26 h ALA 329 CO 0.03 0.00 0.00 0.72 0.00 0.00 0.00 179.25 180.00