#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fl1 s ALA 5 N 0.00 3.80 -2.14 -0.43 0.00 -1.20 -4.35 121.76 117.44 2fl1 s ALA 5 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.30 2fl1 s ALA 5 Cb 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 23.12 21.14 2fl1 s ALA 5 CO 0.00 0.51 0.00 0.72 0.00 0.00 0.00 175.76 176.99 2fl1 n HIS 6 N 2.34 -0.11 -0.92 0.00 -0.00 -1.26 -1.53 115.22 113.74 2fl1 n HIS 6 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.53 2fl1 n HIS 6 Cb 0.54 -3.50 0.00 0.00 -0.00 0.00 0.00 29.99 27.03 2fl1 n HIS 6 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2fl1 n GLY 7 N -0.51 0.51 3.72 -1.41 0.00 -1.26 -2.46 105.19 103.78 2fl1 n GLY 7 Ca -0.21 -0.31 -0.27 0.00 0.00 0.00 0.00 46.02 45.23 2fl1 n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fl1 s LEU 8 N 0.00 3.53 0.18 0.99 1.43 -0.58 -4.70 118.68 119.53 2fl1 s LEU 8 Ca 0.00 -0.25 0.07 0.00 -1.03 0.00 0.00 54.13 52.92 2fl1 s LEU 8 Cb 0.00 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 2fl1 s LEU 8 CO 0.00 0.10 -0.14 -0.89 0.23 0.00 0.00 176.35 175.65 2fl1 s THR 9 N -1.65 1.61 -2.00 5.49 2.01 -1.26 -1.42 115.64 118.41 2fl1 s THR 9 Ca 0.28 -2.09 0.10 0.00 0.31 0.00 0.00 61.69 60.29 2fl1 s THR 9 Cb -0.10 -1.93 0.28 0.00 0.01 0.00 0.00 72.50 70.77 2fl1 s THR 9 CO 0.20 -0.57 1.35 -0.90 -0.69 0.00 0.00 174.62 174.02 2fl1 n ASP 10 N -0.16 0.00 -3.30 3.53 3.85 -1.26 -4.29 116.55 114.92 2fl1 n ASP 10 Ca -0.10 -1.62 -0.09 0.00 -0.71 0.00 0.00 54.79 52.27 2fl1 n ASP 10 Cb 0.60 0.00 -0.05 0.00 -1.35 0.00 0.00 41.12 40.31 2fl1 n ASP 10 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2fl1 s ASP 11 N -1.35 0.19 0.37 -1.12 -1.08 -1.26 -4.20 116.67 108.22 2fl1 s ASP 11 Ca 0.15 -0.82 0.06 0.00 -0.52 0.00 0.00 52.55 51.41 2fl1 s ASP 11 Cb 0.07 1.13 -0.07 0.00 -1.46 0.00 0.00 42.92 42.59 2fl1 s ASP 11 CO 0.11 -0.29 0.03 -0.04 0.52 0.00 0.00 175.17 175.51 2fl1 s MET 12 N 2.07 1.80 0.18 4.34 -1.94 -0.83 -4.98 119.30 119.93 2fl1 s MET 12 Ca 0.13 -2.01 0.10 0.00 -1.71 0.00 0.00 55.69 52.21 2fl1 s MET 12 Cb -0.12 -1.27 -0.04 0.00 2.01 0.00 0.00 34.83 35.41 2fl1 s MET 12 CO -0.17 -0.11 -0.22 0.95 -0.01 0.00 0.00 175.02 175.46 2fl1 s THR 13 N -2.99 2.16 0.19 2.05 -4.23 -1.20 -1.78 115.64 109.83 2fl1 s THR 13 Ca 0.36 -1.97 0.09 0.00 -1.18 0.00 0.00 61.69 58.98 2fl1 s THR 13 Cb 0.09 -2.01 -0.04 0.00 1.34 0.00 0.00 72.50 71.88 2fl1 s THR 13 CO 0.17 -0.17 -0.17 -0.04 -0.54 0.00 0.00 174.62 173.87 2fl1 s MET 14 N -2.66 1.32 -0.07 3.99 -1.94 0.53 -0.43 119.30 120.05 2fl1 s MET 14 Ca 0.18 -1.50 0.01 0.00 -1.71 0.00 0.00 55.69 52.67 2fl1 s MET 14 Cb -0.07 -1.30 0.02 0.00 2.01 0.00 0.00 34.83 35.49 2fl1 s MET 14 CO 0.08 0.25 -0.06 -1.01 -0.01 0.00 0.00 175.02 174.27 2fl1 s HIS 15 N -2.39 1.07 0.14 -0.03 3.76 0.41 -1.23 115.29 117.02 2fl1 s HIS 15 Ca 0.19 -0.40 0.08 0.00 -0.15 0.00 0.00 55.06 54.79 2fl1 s HIS 15 Cb -0.04 -0.91 -0.04 0.00 1.11 0.00 0.00 32.58 32.70 2fl1 s HIS 15 CO 0.07 -0.30 -0.13 -0.06 -0.85 0.00 0.00 174.74 173.47 2fl1 s PHE 16 N 1.19 2.62 -0.27 1.40 0.08 0.52 0.09 117.98 123.61 2fl1 s PHE 16 Ca -0.06 -0.22 -0.03 0.00 0.12 0.00 0.00 56.93 56.73 2fl1 s PHE 16 Cb -0.14 -1.34 0.15 0.00 -0.57 0.00 0.00 43.02 41.12 2fl1 s PHE 16 CO -0.02 0.45 0.51 0.50 -0.10 0.00 0.00 175.22 176.56 2fl1 s ARG 17 N -2.42 0.46 0.00 0.44 3.52 -0.42 -2.30 118.95 118.23 2fl1 s ARG 17 Ca 0.21 0.90 0.08 0.00 -0.13 0.00 0.00 55.73 56.79 2fl1 s ARG 17 Cb -0.10 0.21 -0.02 0.00 -1.56 0.00 0.00 34.95 33.48 2fl1 s ARG 17 CO 0.13 -0.53 -0.23 1.41 -0.81 0.00 0.00 175.30 175.27 2fl1 s MET 18 N 2.72 1.80 -0.03 5.12 -2.45 0.31 -1.69 119.30 125.08 2fl1 s MET 18 Ca 0.12 -0.90 0.06 0.00 -1.25 0.00 0.00 55.69 53.72 2fl1 s MET 18 Cb -0.14 -1.80 -0.01 0.00 1.25 0.00 0.00 34.83 34.12 2fl1 s MET 18 CO -0.18 0.49 -0.21 -1.21 1.05 0.00 0.00 175.02 174.96 2fl1 s GLU 19 N -0.76 1.86 0.38 4.11 2.02 -0.59 -0.74 118.70 124.97 2fl1 s GLU 19 Ca 0.09 -0.75 -0.15 0.00 0.02 0.00 0.00 54.97 54.19 2fl1 s GLU 19 Cb -0.09 -1.71 0.05 0.00 0.10 0.00 0.00 34.13 32.47 2fl1 s GLU 19 CO 0.00 0.40 0.76 0.20 0.02 0.00 0.00 175.26 176.64 2fl1 s GLY 20 N -0.33 0.43 -0.30 -1.39 0.00 -0.65 -0.83 107.32 104.26 2fl1 s GLY 20 Ca 0.04 -0.79 -0.06 0.00 0.00 0.00 0.00 44.72 43.91 2fl1 s GLY 20 CO 0.01 -0.35 0.65 0.00 0.00 0.00 0.00 173.10 173.40 2fl1 s VAL 22 N 2.86 3.12 -1.43 0.00 1.01 -0.72 -1.65 120.40 123.61 2fl1 s VAL 22 Ca 0.08 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.47 2fl1 s VAL 22 Cb -0.13 -2.40 0.00 0.00 0.00 0.00 0.00 36.38 33.85 2fl1 s VAL 22 CO -0.20 0.45 0.34 0.47 0.00 0.00 0.00 175.10 176.16 2fl1 n ASP 23 N 4.62 -0.23 0.00 3.32 8.00 -0.46 -0.93 116.55 130.87 2fl1 n ASP 23 Ca -0.19 -1.07 0.00 0.00 0.71 0.00 0.00 54.79 54.24 2fl1 n ASP 23 Cb 0.51 -2.71 0.00 0.00 -0.02 0.00 0.00 41.12 38.90 2fl1 n ASP 23 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fl1 n GLY 24 N -2.11 2.99 3.57 0.44 0.00 -1.26 -4.99 105.19 103.82 2fl1 n GLY 24 Ca -0.31 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 2fl1 n GLY 24 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2fl1 s HIS 25 N -1.55 3.02 0.48 1.61 5.04 -0.11 -5.04 115.29 118.74 2fl1 s HIS 25 Ca 0.00 0.45 -0.17 0.00 -1.54 0.00 0.00 55.06 53.79 2fl1 s HIS 25 Cb 0.00 -3.68 -0.09 0.00 0.04 0.00 0.00 32.58 28.85 2fl1 s HIS 25 CO 0.00 -0.92 0.95 0.15 -2.34 0.00 0.00 174.74 172.58 2fl1 s LYS 26 N 3.41 4.01 0.11 2.88 1.02 -1.26 -1.75 119.74 128.15 2fl1 s LYS 26 Ca 0.34 0.95 -0.25 0.00 0.02 0.00 0.00 55.97 57.03 2fl1 s LYS 26 Cb -0.12 -2.18 0.07 0.00 -0.52 0.00 0.00 37.83 35.09 2fl1 s LYS 26 CO 0.21 -0.18 0.62 -0.59 -0.92 0.00 0.00 175.35 174.50 2fl1 s PHE 27 N -2.47 -0.57 -0.04 3.18 -0.12 -0.72 -4.34 117.98 112.91 2fl1 s PHE 27 Ca 0.59 0.52 0.00 0.00 -0.05 0.00 0.00 56.93 57.99 2fl1 s PHE 27 Cb -0.10 0.52 0.03 0.00 -0.63 0.00 0.00 43.02 42.84 2fl1 s PHE 27 CO 0.26 -0.79 -0.01 0.08 -0.05 0.00 0.00 175.22 174.71 2fl1 s VAL 28 N -3.12 0.32 -0.02 -2.49 1.01 -0.67 -1.63 120.40 113.79 2fl1 s VAL 28 Ca -0.02 0.04 0.06 0.00 0.00 0.00 0.00 61.98 62.07 2fl1 s VAL 28 Cb -0.01 -0.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.94 2fl1 s VAL 28 CO -0.07 0.20 -0.21 -0.63 0.00 0.00 0.00 175.10 174.38 2fl1 s ILE 29 N 1.22 2.47 0.16 2.22 1.01 0.08 -1.64 121.20 126.71 2fl1 s ILE 29 Ca -0.07 -1.00 0.06 0.00 0.00 0.00 0.00 60.65 59.64 2fl1 s ILE 29 Cb -0.13 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 2fl1 s ILE 29 CO -0.02 0.55 -0.13 -0.70 0.00 0.00 0.00 174.94 174.64 2fl1 s GLU 30 N -0.76 1.14 0.00 2.79 2.12 -0.26 -0.53 118.70 123.20 2fl1 s GLU 30 Ca 0.11 -1.42 0.00 0.00 0.36 0.00 0.00 54.97 54.02 2fl1 s GLU 30 Cb -0.10 -0.90 0.00 0.00 0.26 0.00 0.00 34.13 33.39 2fl1 s GLU 30 CO 0.00 0.15 0.00 0.41 -0.54 0.00 0.00 175.26 175.28 2fl1 n GLY 31 N 0.03 -0.71 3.42 -1.50 0.00 -0.97 -0.63 105.19 104.82 2fl1 n GLY 31 Ca -0.12 -1.00 -0.11 0.00 0.00 0.00 0.00 46.02 44.80 2fl1 n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fl1 s ASN 32 N 0.00 0.05 0.02 1.61 2.20 -0.67 -0.35 114.94 117.79 2fl1 s ASN 32 Ca 0.00 -1.14 -0.28 0.00 -0.94 0.00 0.00 52.86 50.50 2fl1 s ASN 32 Cb 0.00 0.50 0.10 0.00 -2.00 0.00 0.00 41.25 39.85 2fl1 s ASN 32 CO 0.00 -1.02 1.25 -0.83 -2.94 0.00 0.00 177.10 173.55 2fl1 s GLY 33 N -3.09 -0.16 0.09 0.45 0.00 -0.37 -0.34 107.32 103.90 2fl1 s GLY 33 Ca 0.30 0.14 -0.06 0.00 0.00 0.00 0.00 44.72 45.10 2fl1 s GLY 33 CO 0.11 3.70 0.14 0.54 0.00 0.00 0.00 173.10 177.59 2fl1 s ASN 34 N -3.53 0.21 0.00 1.64 4.22 -0.77 0.20 114.94 116.91 2fl1 s ASN 34 Ca 0.24 -0.79 0.00 0.00 -2.14 0.00 0.00 52.86 50.17 2fl1 s ASN 34 Cb 0.01 0.31 0.00 0.00 1.28 0.00 0.00 41.25 42.85 2fl1 s ASN 34 CO -0.01 -0.72 0.00 0.61 -2.04 0.00 0.00 177.10 174.95 2fl1 n GLY 35 N -0.04 -0.55 3.06 0.45 0.00 -0.73 0.64 105.19 108.03 2fl1 n GLY 35 Ca -0.13 -0.97 -0.34 0.00 0.00 0.00 0.00 46.02 44.58 2fl1 n GLY 35 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2fl1 s ASN 36 N 0.00 4.98 0.49 1.61 3.84 0.29 -1.97 114.94 124.17 2fl1 s ASN 36 Ca 0.00 -2.46 0.25 0.00 0.21 0.00 0.00 52.86 50.86 2fl1 s ASN 36 Cb 0.00 -1.76 1.30 0.00 -0.55 0.00 0.00 41.25 40.24 2fl1 s ASN 36 CO 0.00 -0.41 1.89 1.55 -2.79 0.00 0.00 177.10 177.34 2fl1 h PRO 37 N 7.41 0.17 0.00 0.43 0.13 -1.76 -0.55 132.00 137.82 2fl1 h PRO 37 Ca -0.07 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2fl1 h PRO 37 Cb 0.99 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2fl1 h PRO 37 CO 0.66 0.11 0.00 1.19 -0.23 0.00 0.00 178.00 179.73 2fl1 n PHE 38 N -4.39 0.00 -0.17 1.56 3.01 -1.26 -2.58 117.46 113.63 2fl1 n PHE 38 Ca 0.18 0.00 0.02 0.00 1.01 0.00 0.00 57.45 58.66 2fl1 n PHE 38 Cb 0.81 -0.45 0.04 0.00 -0.01 0.00 0.00 39.48 39.87 2fl1 n PHE 38 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2fl1 n LYS 39 N -1.45 2.78 -4.07 -1.08 5.02 -0.26 -4.60 118.16 114.49 2fl1 n LYS 39 Ca 0.08 -1.73 -0.31 0.00 -2.02 0.00 0.00 58.31 54.33 2fl1 n LYS 39 Cb 0.28 -1.11 -0.02 0.00 -0.02 0.00 0.00 35.03 34.16 2fl1 n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fl1 n GLY 40 N -0.47 -0.34 2.98 0.72 0.00 -0.89 -4.54 105.19 102.65 2fl1 n GLY 40 Ca 0.04 0.15 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 2fl1 n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fl1 s LYS 41 N -6.74 0.56 -0.00 1.61 -2.85 -1.14 -0.35 119.74 110.84 2fl1 s LYS 41 Ca 0.37 -0.24 -0.21 0.00 -1.00 0.00 0.00 55.97 54.90 2fl1 s LYS 41 Cb -0.20 -0.55 0.04 0.00 -2.06 0.00 0.00 37.83 35.06 2fl1 s LYS 41 CO 0.90 0.14 0.45 1.14 0.10 0.00 0.00 175.35 178.08 2fl1 s GLN 42 N -0.12 0.87 -0.12 1.78 -2.07 -1.05 -0.55 119.66 118.41 2fl1 s GLN 42 Ca 0.02 -0.13 -0.00 0.00 -1.82 0.00 0.00 55.36 53.43 2fl1 s GLN 42 Cb -0.03 0.40 -0.02 0.00 -1.09 0.00 0.00 33.01 32.27 2fl1 s GLN 42 CO -0.00 -0.28 -0.12 -0.06 -1.32 0.00 0.00 175.29 173.51 2fl1 s PHE 43 N -1.73 2.82 -0.14 9.60 0.08 0.21 -2.67 117.98 126.15 2fl1 s PHE 43 Ca -0.10 -0.54 0.01 0.00 0.12 0.00 0.00 56.93 56.42 2fl1 s PHE 43 Cb -0.02 -1.83 0.02 0.00 -0.57 0.00 0.00 43.02 40.62 2fl1 s PHE 43 CO 0.03 -0.14 -0.15 0.42 -0.10 0.00 0.00 175.22 175.29 2fl1 s ILE 44 N 0.20 1.58 -0.32 0.64 1.01 0.34 -1.84 121.20 122.81 2fl1 s ILE 44 Ca -0.07 -0.65 -0.07 0.00 0.00 0.00 0.00 60.65 59.85 2fl1 s ILE 44 Cb -0.15 -1.46 0.02 0.00 0.01 0.00 0.00 42.46 40.88 2fl1 s ILE 44 CO 0.05 0.46 0.10 0.20 0.00 0.00 0.00 174.94 175.75 2fl1 s ASN 45 N 1.30 5.26 0.11 3.58 0.01 0.54 -0.24 114.94 125.51 2fl1 s ASN 45 Ca 0.01 -0.89 0.08 0.00 -0.71 0.00 0.00 52.86 51.35 2fl1 s ASN 45 Cb -0.14 -1.89 -0.04 0.00 0.41 0.00 0.00 41.25 39.59 2fl1 s ASN 45 CO -0.08 -0.26 -0.13 -0.76 -1.51 0.00 0.00 177.10 174.36 2fl1 s LEU 46 N 1.47 2.90 -0.03 0.60 1.43 -0.62 -1.67 118.68 122.76 2fl1 s LEU 46 Ca 0.01 -0.46 -0.02 0.00 -1.03 0.00 0.00 54.13 52.64 2fl1 s LEU 46 Cb -0.18 -1.72 0.02 0.00 0.03 0.00 0.00 46.19 44.34 2fl1 s LEU 46 CO 0.03 0.18 0.07 0.00 0.23 0.00 0.00 176.35 176.86 2fl1 s VAL 48 N 0.69 4.57 -0.77 0.00 1.01 -0.82 -1.10 120.40 123.98 2fl1 s VAL 48 Ca -0.05 0.72 0.23 0.00 0.00 0.00 0.00 61.98 62.87 2fl1 s VAL 48 Cb -0.08 -4.36 -0.14 0.00 0.00 0.00 0.00 36.38 31.81 2fl1 s VAL 48 CO -0.03 -0.72 1.03 2.30 0.00 0.00 0.00 175.10 177.69 2fl1 n ILE 49 N 6.21 0.08 -3.75 2.22 -5.35 -0.65 -4.50 119.36 113.61 2fl1 n ILE 49 Ca 0.05 -0.14 -0.12 0.00 -0.27 0.00 0.00 62.75 62.26 2fl1 n ILE 49 Cb 0.48 0.44 -0.12 0.00 -1.74 0.00 0.00 39.64 38.70 2fl1 n ILE 49 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2fl1 s GLU 50 N -3.12 0.32 0.00 6.28 2.02 -1.06 -4.88 118.70 118.26 2fl1 s GLU 50 Ca 0.06 0.48 0.00 0.00 0.02 0.00 0.00 54.97 55.52 2fl1 s GLU 50 Cb 0.15 0.08 0.00 0.00 0.10 0.00 0.00 34.13 34.46 2fl1 s GLU 50 CO 0.81 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 176.42 2fl1 n GLY 51 N 3.37 0.74 3.89 -1.39 0.00 -1.26 -1.68 105.19 108.86 2fl1 n GLY 51 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 2fl1 n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fl1 s GLY 52 N -1.96 1.93 0.58 -0.02 0.00 -1.26 -4.00 107.32 102.59 2fl1 s GLY 52 Ca 0.00 -0.39 -0.18 0.00 0.00 0.00 0.00 44.72 44.15 2fl1 s GLY 52 CO 0.00 -0.25 1.10 2.56 0.00 0.00 0.00 173.10 176.52 2fl1 s PRO 53 N -3.58 3.24 0.14 2.90 0.04 -1.26 -5.04 135.00 131.44 2fl1 s PRO 53 Ca 0.47 1.46 -0.30 0.00 0.04 0.00 0.00 61.00 62.67 2fl1 s PRO 53 Cb -0.11 -2.00 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 2fl1 s PRO 53 CO 0.29 -0.91 1.16 -0.51 0.04 0.00 0.00 177.00 177.07 2fl1 s LEU 54 N -4.17 4.44 0.08 -3.56 1.43 -1.26 -4.92 118.68 110.73 2fl1 s LEU 54 Ca 0.69 2.11 0.25 0.00 -1.03 0.00 0.00 54.13 56.15 2fl1 s LEU 54 Cb -0.21 -3.60 0.99 0.00 0.03 0.00 0.00 46.19 43.40 2fl1 s LEU 54 CO 0.32 -0.34 1.78 -0.81 0.23 0.00 0.00 176.35 177.52 2fl1 n PRO 55 N 2.90 0.09 -4.32 1.29 -0.04 -1.26 -4.79 135.00 128.87 2fl1 n PRO 55 Ca 0.05 0.15 -0.26 0.00 -0.04 0.00 0.00 63.50 63.40 2fl1 n PRO 55 Cb 0.46 -1.62 -0.09 0.00 -0.04 0.00 0.00 33.50 32.20 2fl1 n PRO 55 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2fl1 s PHE 56 N -3.06 2.57 0.20 0.54 -0.12 -1.26 -4.67 117.98 112.18 2fl1 s PHE 56 Ca 0.11 -0.25 -0.32 0.00 -0.05 0.00 0.00 56.93 56.42 2fl1 s PHE 56 Cb 0.14 -1.23 -0.12 0.00 -0.63 0.00 0.00 43.02 41.19 2fl1 s PHE 56 CO 0.49 0.55 1.73 0.45 -0.05 0.00 0.00 175.22 178.38 2fl1 s SER 57 N -3.02 6.38 0.19 1.98 0.15 -0.32 -4.86 113.70 114.20 2fl1 s SER 57 Ca 0.26 2.86 0.21 0.00 0.70 0.00 0.00 55.95 59.99 2fl1 s SER 57 Cb -0.08 -2.60 0.88 0.00 -1.71 0.00 0.00 66.02 62.52 2fl1 s SER 57 CO 0.15 -0.97 1.65 -0.62 1.20 0.00 0.00 173.24 174.65 2fl1 n GLU 58 N 4.07 0.14 0.29 5.44 4.71 -1.26 -2.87 120.64 131.16 2fl1 n GLU 58 Ca 0.16 0.36 0.16 0.00 -0.01 0.00 0.00 57.16 57.83 2fl1 n GLU 58 Cb 0.35 -1.77 0.93 0.00 -1.01 0.00 0.00 31.44 29.95 2fl1 n GLU 58 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 2fl1 h ASP 59 N 0.00 0.00 0.69 1.62 3.32 -1.97 0.10 116.42 120.18 2fl1 h ASP 59 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2fl1 h ASP 59 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 2fl1 h ASP 59 CO 0.00 0.00 0.00 2.30 -1.72 0.00 0.00 179.24 179.82 2fl1 n ILE 60 N -3.77 0.82 -0.05 0.35 -5.35 -1.14 -2.85 119.36 107.37 2fl1 n ILE 60 Ca -0.02 0.18 -0.07 0.00 -0.27 0.00 0.00 62.75 62.57 2fl1 n ILE 60 Cb 0.11 -0.99 -0.14 0.00 -1.74 0.00 0.00 39.64 36.89 2fl1 n ILE 60 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2fl1 n LEU 61 N -1.82 0.49 -0.12 7.28 4.77 0.34 -4.70 117.00 123.24 2fl1 n LEU 61 Ca 0.03 0.23 -0.03 0.00 -0.03 0.00 0.00 56.01 56.21 2fl1 n LEU 61 Cb 0.22 0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 2fl1 n LEU 61 CO 0.18 0.39 0.30 -1.20 -1.33 0.00 0.00 177.39 175.73 2fl1 n SER 62 N -2.88 -0.31 0.00 -1.43 7.64 -1.13 -0.58 113.62 114.93 2fl1 n SER 62 Ca -0.22 0.85 0.00 0.00 1.01 0.00 0.00 58.87 60.51 2fl1 n SER 62 Cb 1.05 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 64.02 2fl1 n SER 62 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fl1 n ALA 63 N -3.06 1.45 0.88 -0.43 0.00 -1.26 -1.87 120.51 116.22 2fl1 n ALA 63 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.56 2fl1 n ALA 63 Cb 0.08 -0.97 0.02 0.00 0.00 0.00 0.00 19.45 18.59 2fl1 n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fl1 n ALA 64 N -0.64 4.04 -2.35 0.00 0.00 0.25 -4.84 120.51 116.97 2fl1 n ALA 64 Ca 0.00 -0.48 -0.39 0.00 0.00 0.00 0.00 53.44 52.57 2fl1 n ALA 64 Cb 0.00 -0.92 0.02 0.00 0.00 0.00 0.00 19.45 18.55 2fl1 n ALA 64 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2fl1 n PHE 65 N -1.62 2.95 0.00 0.00 3.01 -0.78 -4.94 117.46 116.08 2fl1 n PHE 65 Ca 0.04 -2.56 0.00 0.00 1.01 0.00 0.00 57.45 55.94 2fl1 n PHE 65 Cb 0.36 -1.11 0.00 0.00 -0.01 0.00 0.00 39.48 38.72 2fl1 n PHE 65 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2fl1 n ASN 69 N -0.29 0.00 0.00 4.37 2.85 -1.26 -5.10 115.26 115.83 2fl1 n ASN 69 Ca 0.49 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.99 2fl1 n ASN 69 Cb 0.27 0.00 0.17 0.00 1.24 0.00 0.00 39.78 41.46 2fl1 n ASN 69 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2fl1 n ARG 70 N 0.00 0.29 0.02 1.20 5.12 -1.26 -1.28 116.66 120.75 2fl1 n ARG 70 Ca 0.00 0.00 -0.07 0.00 -1.93 0.00 0.00 57.85 55.85 2fl1 n ARG 70 Cb 0.00 -1.30 0.11 0.00 -1.16 0.00 0.00 32.46 30.11 2fl1 n ARG 70 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 2fl1 h LEU 71 N 0.00 0.51 -6.04 0.55 3.38 -1.93 -3.23 115.31 108.56 2fl1 h LEU 71 Ca 0.00 -0.25 -0.73 0.00 0.09 0.00 0.00 57.88 57.00 2fl1 h LEU 71 Cb 0.00 -0.15 -0.09 0.00 0.09 0.00 0.00 40.66 40.52 2fl1 h LEU 71 CO 0.00 0.91 2.68 0.49 0.09 0.00 0.00 178.44 182.61 2fl1 n PHE 72 N -3.99 3.06 -3.79 1.13 3.01 -0.41 -4.64 117.46 111.84 2fl1 n PHE 72 Ca -0.02 -2.89 -0.16 0.00 1.01 0.00 0.00 57.45 55.39 2fl1 n PHE 72 Cb 0.55 -2.22 -0.16 0.00 -0.01 0.00 0.00 39.48 37.63 2fl1 n PHE 72 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2fl1 s THR 73 N 1.46 -0.03 -0.39 4.37 2.01 -1.22 -4.37 115.64 117.47 2fl1 s THR 73 Ca 0.47 0.21 -0.27 0.00 0.31 0.00 0.00 61.69 62.41 2fl1 s THR 73 Cb 0.13 -0.11 0.02 0.00 0.01 0.00 0.00 72.50 72.55 2fl1 s THR 73 CO -0.05 0.10 1.01 -0.70 -0.69 0.00 0.00 174.62 174.29 2fl1 s GLU 74 N 1.13 3.84 -0.23 4.92 2.12 -0.70 -4.32 118.70 125.45 2fl1 s GLU 74 Ca -0.08 0.65 -0.08 0.00 0.36 0.00 0.00 54.97 55.81 2fl1 s GLU 74 Cb -0.13 -3.82 -0.04 0.00 0.26 0.00 0.00 34.13 30.40 2fl1 s GLU 74 CO -0.03 -1.06 0.10 0.71 -0.54 0.00 0.00 175.26 174.44 2fl1 s TYR 75 N 3.77 3.20 0.57 5.30 1.51 -1.26 -1.04 117.35 129.40 2fl1 s TYR 75 Ca 0.42 -0.06 -0.19 0.00 -1.01 0.00 0.00 57.07 56.23 2fl1 s TYR 75 Cb -0.11 -2.21 -0.04 0.00 -0.11 0.00 0.00 41.96 39.48 2fl1 s TYR 75 CO 0.22 -0.08 1.18 -2.14 -1.11 0.00 0.00 175.55 173.62 2fl1 s PRO 76 N 1.13 3.11 0.50 -1.71 0.02 -1.26 -4.86 135.00 131.93 2fl1 s PRO 76 Ca 0.05 1.76 0.26 0.00 0.02 0.00 0.00 61.00 63.10 2fl1 s PRO 76 Cb -0.14 -1.96 1.34 0.00 0.02 0.00 0.00 34.50 33.76 2fl1 s PRO 76 CO 0.04 -1.08 1.88 1.05 -0.33 0.00 0.00 177.00 178.56 2fl1 h GLU 77 N 1.01 0.14 0.00 5.54 9.09 -2.00 -0.72 114.58 127.64 2fl1 h GLU 77 Ca -0.50 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 58.90 2fl1 h GLU 77 Cb 1.29 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 28.36 2fl1 h GLU 77 CO 0.56 0.09 0.00 0.41 0.05 0.00 0.00 179.01 180.12 2fl1 n GLY 78 N -1.64 -0.99 3.24 1.06 0.00 -1.26 -4.68 105.19 100.93 2fl1 n GLY 78 Ca 0.18 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 2fl1 n GLY 78 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fl1 s ILE 79 N -2.78 2.17 0.13 -0.61 1.01 -0.28 -5.06 121.20 115.77 2fl1 s ILE 79 Ca 0.13 -0.99 -0.31 0.00 0.00 0.00 0.00 60.65 59.48 2fl1 s ILE 79 Cb 0.12 -1.83 -0.09 0.00 0.01 0.00 0.00 42.46 40.67 2fl1 s ILE 79 CO 0.30 0.56 1.61 -0.69 0.00 0.00 0.00 174.94 176.71 2fl1 s VAL 80 N 0.26 2.78 -1.10 2.92 1.01 -1.26 -4.64 120.40 120.36 2fl1 s VAL 80 Ca -0.16 0.45 -0.14 0.00 0.00 0.00 0.00 61.98 62.13 2fl1 s VAL 80 Cb -0.17 -3.29 0.18 0.00 0.00 0.00 0.00 36.38 33.10 2fl1 s VAL 80 CO 0.08 0.02 1.27 -0.62 0.00 0.00 0.00 175.10 175.85 2fl1 s ASP 81 N 1.67 6.97 0.43 3.32 -1.08 -1.26 -4.65 116.67 122.08 2fl1 s ASP 81 Ca 0.72 -2.82 0.21 0.00 -0.52 0.00 0.00 52.55 50.14 2fl1 s ASP 81 Cb -0.42 -2.36 1.17 0.00 -1.46 0.00 0.00 42.92 39.84 2fl1 s ASP 81 CO 0.32 -0.75 1.83 0.22 0.52 0.00 0.00 175.17 177.30 2fl1 h TYR 82 N 7.56 0.48 0.06 -5.34 3.20 -1.91 -1.21 116.97 119.81 2fl1 h TYR 82 Ca 0.24 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.13 2fl1 h TYR 82 Cb 0.92 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 39.05 2fl1 h TYR 82 CO 1.07 0.09 -0.03 0.74 -1.64 0.00 0.00 178.16 178.39 2fl1 h PHE 83 N 0.33 -0.08 0.00 -3.82 -1.00 -1.89 -3.12 116.94 107.36 2fl1 h PHE 83 Ca 0.51 -0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.28 2fl1 h PHE 83 Cb 1.42 0.03 -0.00 0.00 3.61 0.00 0.00 35.95 41.01 2fl1 h PHE 83 CO -0.00 0.40 -0.04 0.87 -1.61 0.00 0.00 178.31 177.93 2fl1 h LYS 84 N -0.96 0.00 0.00 1.51 1.57 -1.83 -1.35 116.57 115.51 2fl1 h LYS 84 Ca -0.01 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 2fl1 h LYS 84 Cb 0.51 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 2fl1 h LYS 84 CO 0.01 0.04 -0.28 -0.91 -0.57 0.00 0.00 179.45 177.74 2fl1 h ASN 85 N 0.00 0.00 -0.23 0.86 2.35 -1.26 -2.80 115.58 114.50 2fl1 h ASN 85 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2fl1 h ASN 85 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2fl1 h ASN 85 CO 0.00 0.28 0.00 -1.54 -1.65 0.00 0.00 177.43 174.53 2fl1 n SER 86 N -3.47 1.77 -4.93 5.81 3.41 -0.51 -4.90 113.62 110.81 2fl1 n SER 86 Ca -0.00 -1.80 -0.26 0.00 -0.26 0.00 0.00 58.87 56.55 2fl1 n SER 86 Cb 0.46 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2fl1 n SER 86 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fl1 n PRO 88 N -2.14 0.28 -0.28 0.00 -0.04 -1.03 -4.81 135.00 126.97 2fl1 n PRO 88 Ca -0.00 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2fl1 n PRO 88 Cb 0.56 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.65 2fl1 n PRO 88 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fl1 h ALA 89 N 3.14 1.08 0.00 0.55 0.00 -1.81 -0.76 119.26 121.46 2fl1 h ALA 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2fl1 h ALA 89 Cb 0.30 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2fl1 h ALA 89 CO 0.00 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.84 2fl1 n GLY 90 N -1.31 -3.46 3.24 0.00 0.00 -0.07 -4.21 105.19 99.37 2fl1 n GLY 90 Ca 0.11 -2.10 -0.14 0.00 0.00 0.00 0.00 46.02 43.89 2fl1 n GLY 90 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2fl1 s TYR 91 N -0.67 1.32 0.21 1.61 -0.85 -1.11 -1.88 117.35 115.97 2fl1 s TYR 91 Ca 0.00 -1.37 0.08 0.00 -0.52 0.00 0.00 57.07 55.26 2fl1 s TYR 91 Cb 0.00 -0.66 -0.05 0.00 0.38 0.00 0.00 41.96 41.63 2fl1 s TYR 91 CO 0.00 -0.60 -0.14 0.95 -1.52 0.00 0.00 175.55 174.24 2fl1 s THR 92 N -3.98 1.73 0.05 -3.49 -4.23 0.10 -1.04 115.64 104.79 2fl1 s THR 92 Ca 0.39 -2.21 -0.13 0.00 -1.18 0.00 0.00 61.69 58.55 2fl1 s THR 92 Cb 0.07 -2.05 0.02 0.00 1.34 0.00 0.00 72.50 71.88 2fl1 s THR 92 CO 0.14 -0.59 0.30 -1.66 -0.54 0.00 0.00 174.62 172.26 2fl1 s TRP 93 N -2.98 -0.08 0.00 3.99 1.48 -0.91 -0.48 118.94 119.96 2fl1 s TRP 93 Ca 0.23 -0.09 0.02 0.00 -1.06 0.00 0.00 56.10 55.19 2fl1 s TRP 93 Cb -0.01 0.09 -0.01 0.00 -1.16 0.00 0.00 33.47 32.39 2fl1 s TRP 93 CO 0.07 -0.52 -0.06 -1.01 -4.06 0.00 0.00 176.95 171.37 2fl1 s HIS 94 N -2.75 0.51 0.01 1.66 3.76 -0.95 -2.24 115.29 115.29 2fl1 s HIS 94 Ca -0.04 -0.13 -0.09 0.00 -0.15 0.00 0.00 55.06 54.66 2fl1 s HIS 94 Cb -0.00 -0.32 0.00 0.00 1.11 0.00 0.00 32.58 33.37 2fl1 s HIS 94 CO -0.05 -0.02 0.17 0.50 -0.85 0.00 0.00 174.74 174.50 2fl1 s ARG 95 N -0.27 0.55 -0.06 1.40 3.52 -0.35 -1.68 118.95 122.05 2fl1 s ARG 95 Ca 0.01 -0.42 0.04 0.00 -0.13 0.00 0.00 55.73 55.23 2fl1 s ARG 95 Cb -0.03 0.23 0.00 0.00 -1.56 0.00 0.00 34.95 33.59 2fl1 s ARG 95 CO -0.00 -0.14 -0.19 -1.54 -0.81 0.00 0.00 175.30 172.62 2fl1 s SER 96 N -1.52 2.43 -0.17 -2.12 1.04 -0.85 -1.68 113.70 110.83 2fl1 s SER 96 Ca -0.13 -0.41 -0.04 0.00 0.48 0.00 0.00 55.95 55.84 2fl1 s SER 96 Cb -0.06 -0.88 -0.03 0.00 0.10 0.00 0.00 66.02 65.15 2fl1 s SER 96 CO 0.01 0.14 -0.02 -0.36 0.98 0.00 0.00 173.24 173.99 2fl1 s PHE 97 N 0.22 3.05 -0.31 5.02 0.40 0.16 -2.56 117.98 123.96 2fl1 s PHE 97 Ca -0.10 -0.29 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 2fl1 s PHE 97 Cb -0.14 -2.00 0.08 0.00 0.51 0.00 0.00 43.02 41.47 2fl1 s PHE 97 CO 0.04 -0.06 -0.01 0.50 0.70 0.00 0.00 175.22 176.40 2fl1 s ARG 98 N 0.49 1.94 0.14 0.44 3.52 -1.07 -1.65 118.95 122.75 2fl1 s ARG 98 Ca -0.02 -1.59 -0.20 0.00 -0.13 0.00 0.00 55.73 53.78 2fl1 s ARG 98 Cb -0.14 -3.11 -0.07 0.00 -1.56 0.00 0.00 34.95 30.06 2fl1 s ARG 98 CO 0.02 -0.77 0.65 -0.06 -0.81 0.00 0.00 175.30 174.34 2fl1 s PHE 99 N 1.04 3.76 0.58 5.12 0.40 -0.16 -1.95 117.98 126.77 2fl1 s PHE 99 Ca 0.01 1.36 0.29 0.00 -0.60 0.00 0.00 56.93 57.99 2fl1 s PHE 99 Cb -0.20 -2.57 1.43 0.00 0.51 0.00 0.00 43.02 42.19 2fl1 s PHE 99 CO -0.06 0.49 1.83 1.05 0.70 0.00 0.00 175.22 179.23 2fl1 h GLU 100 N 4.07 0.00 -0.66 0.44 4.11 -1.74 0.25 114.58 121.05 2fl1 h GLU 100 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2fl1 h GLU 100 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2fl1 h GLU 100 CO 0.65 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.33 2fl1 n ASP 101 N -3.74 4.33 0.00 3.06 3.85 -1.26 -4.93 116.55 117.86 2fl1 n ASP 101 Ca 0.12 -2.57 0.00 0.00 -0.71 0.00 0.00 54.79 51.63 2fl1 n ASP 101 Cb 0.82 -0.59 0.00 0.00 -1.35 0.00 0.00 41.12 40.00 2fl1 n ASP 101 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2fl1 n GLY 102 N 0.67 1.45 3.76 6.12 0.00 0.07 -4.78 105.19 112.49 2fl1 n GLY 102 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 2fl1 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fl1 s ALA 103 N -2.33 3.40 -0.01 4.61 0.00 -1.24 -4.86 121.76 121.34 2fl1 s ALA 103 Ca 0.00 0.98 0.02 0.00 0.00 0.00 0.00 51.96 52.97 2fl1 s ALA 103 Cb 0.00 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 19.75 2fl1 s ALA 103 CO 0.00 -0.30 -0.08 0.14 0.00 0.00 0.00 175.76 175.52 2fl1 s VAL 104 N -1.19 0.64 0.22 0.00 -7.23 -0.88 -0.99 120.40 110.97 2fl1 s VAL 104 Ca 0.47 -0.33 0.05 0.00 -1.81 0.00 0.00 61.98 60.36 2fl1 s VAL 104 Cb -0.33 -0.55 -0.05 0.00 0.56 0.00 0.00 36.38 36.01 2fl1 s VAL 104 CO 0.43 0.19 -0.07 0.00 -0.31 0.00 0.00 175.10 175.34 2fl1 s ILE 106 N -3.20 0.03 0.03 0.00 -4.36 -0.54 0.40 121.20 113.55 2fl1 s ILE 106 Ca 0.25 -0.28 -0.11 0.00 -0.26 0.00 0.00 60.65 60.25 2fl1 s ILE 106 Cb 0.03 -0.56 0.01 0.00 1.25 0.00 0.00 42.46 43.19 2fl1 s ILE 106 CO 0.07 -0.16 0.22 0.00 0.24 0.00 0.00 174.94 175.31 2fl1 s SER 108 N -1.85 0.75 0.04 0.00 0.01 -0.89 -1.21 113.70 110.56 2fl1 s SER 108 Ca -0.08 -0.39 -0.02 0.00 1.31 0.00 0.00 55.95 56.77 2fl1 s SER 108 Cb -0.03 0.00 -0.03 0.00 0.21 0.00 0.00 66.02 66.18 2fl1 s SER 108 CO -0.02 -0.11 0.00 0.00 0.41 0.00 0.00 173.24 173.52 2fl1 s ALA 109 N -0.94 0.28 -0.17 1.44 0.00 -0.95 -1.34 121.76 120.07 2fl1 s ALA 109 Ca -0.06 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 50.96 2fl1 s ALA 109 Cb -0.07 0.25 0.05 0.00 0.00 0.00 0.00 23.12 23.35 2fl1 s ALA 109 CO 0.00 -0.32 0.01 0.34 0.00 0.00 0.00 175.76 175.79 2fl1 s ASP 110 N -2.45 2.77 -0.17 0.00 -1.08 0.20 -2.15 116.67 113.79 2fl1 s ASP 110 Ca -0.00 -0.71 -0.11 0.00 -0.52 0.00 0.00 52.55 51.21 2fl1 s ASP 110 Cb 0.02 -0.67 -0.05 0.00 -1.46 0.00 0.00 42.92 40.76 2fl1 s ASP 110 CO -0.07 -0.26 0.19 -0.63 0.52 0.00 0.00 175.17 174.92 2fl1 s ILE 111 N 1.80 5.38 -0.04 4.11 1.09 -0.20 -2.57 121.20 130.76 2fl1 s ILE 111 Ca -0.00 0.33 0.03 0.00 -1.10 0.00 0.00 60.65 59.90 2fl1 s ILE 111 Cb -0.16 -3.52 0.01 0.00 -1.06 0.00 0.00 42.46 37.73 2fl1 s ILE 111 CO -0.07 0.45 -0.11 -0.89 -0.10 0.00 0.00 174.94 174.22 2fl1 s THR 112 N 0.15 0.95 -0.28 2.92 2.01 -0.67 -2.75 115.64 117.96 2fl1 s THR 112 Ca 0.12 -0.42 -0.13 0.00 0.31 0.00 0.00 61.69 61.57 2fl1 s THR 112 Cb -0.12 -0.85 -0.04 0.00 0.01 0.00 0.00 72.50 71.50 2fl1 s THR 112 CO 0.01 0.30 0.29 -0.69 -0.69 0.00 0.00 174.62 173.84 2fl1 s VAL 113 N 0.38 5.23 -0.83 3.82 1.01 -0.29 -0.65 120.40 129.08 2fl1 s VAL 113 Ca -0.07 0.35 -0.15 0.00 0.00 0.00 0.00 61.98 62.11 2fl1 s VAL 113 Cb -0.12 -3.63 0.20 0.00 0.00 0.00 0.00 36.38 32.83 2fl1 s VAL 113 CO 0.02 0.18 0.81 0.21 0.00 0.00 0.00 175.10 176.31 2fl1 s ASN 114 N 1.70 6.71 0.26 3.32 2.47 0.16 -4.68 114.94 124.89 2fl1 s ASN 114 Ca 0.11 -2.54 -0.03 0.00 0.42 0.00 0.00 52.86 50.83 2fl1 s ASN 114 Cb -0.16 -2.24 0.40 0.00 -1.45 0.00 0.00 41.25 37.80 2fl1 s ASN 114 CO 0.11 -0.67 1.88 0.58 -3.72 0.00 0.00 177.10 175.28 2fl1 h VAL 115 N 5.00 1.08 -0.86 -5.21 2.07 -1.84 -0.46 116.25 116.03 2fl1 h VAL 115 Ca 0.09 -0.40 0.22 0.00 0.82 0.00 0.00 66.70 67.44 2fl1 h VAL 115 Cb 1.04 -0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.59 2fl1 h VAL 115 CO 0.82 0.21 0.60 -0.09 0.02 0.00 0.00 177.57 179.13 2fl1 h ARG 116 N 1.16 0.19 -0.03 1.57 2.43 -1.94 -1.50 114.38 116.26 2fl1 h ARG 116 Ca 0.43 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.59 2fl1 h ARG 116 Cb 0.17 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2fl1 h ARG 116 CO -0.17 0.12 0.00 0.39 -1.51 0.00 0.00 179.97 178.80 2fl1 n GLU 117 N -4.40 0.30 -3.83 0.20 4.71 -0.89 -5.00 120.64 111.74 2fl1 n GLU 117 Ca 0.18 -1.04 -0.27 0.00 -0.01 0.00 0.00 57.16 56.02 2fl1 n GLU 117 Cb 0.80 -1.16 0.03 0.00 -1.01 0.00 0.00 31.44 30.11 2fl1 n GLU 117 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 2fl1 n ASN 118 N 0.44 -3.51 -4.21 1.62 5.15 -0.23 -4.91 115.26 109.61 2fl1 n ASN 118 Ca 0.05 -0.79 -0.12 0.00 -0.60 0.00 0.00 54.58 53.12 2fl1 n ASN 118 Cb 0.21 -3.98 -0.10 0.00 -0.53 0.00 0.00 39.78 35.39 2fl1 n ASN 118 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2fl1 s ILE 120 N -3.93 2.25 -0.19 0.00 1.01 0.43 -0.66 121.20 120.12 2fl1 s ILE 120 Ca 0.30 -1.10 -0.05 0.00 0.00 0.00 0.00 60.65 59.80 2fl1 s ILE 120 Cb 0.07 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.70 2fl1 s ILE 120 CO 0.07 0.54 0.01 -0.47 0.00 0.00 0.00 174.94 175.08 2fl1 s TYR 121 N -0.67 3.08 -0.22 3.97 5.04 0.18 -0.44 117.35 128.28 2fl1 s TYR 121 Ca 0.11 -0.30 0.01 0.00 -2.44 0.00 0.00 57.07 54.45 2fl1 s TYR 121 Cb -0.10 -2.06 0.03 0.00 0.35 0.00 0.00 41.96 40.19 2fl1 s TYR 121 CO -0.00 -0.11 -0.15 -1.58 -1.34 0.00 0.00 175.55 172.37 2fl1 s HIS 122 N 0.72 2.99 -0.15 4.97 5.65 0.11 -1.68 115.29 127.91 2fl1 s HIS 122 Ca 0.00 -1.88 0.01 0.00 0.25 0.00 0.00 55.06 53.44 2fl1 s HIS 122 Cb -0.14 -1.94 0.00 0.00 -1.18 0.00 0.00 32.58 29.32 2fl1 s HIS 122 CO 0.02 -0.82 -0.17 -2.00 -0.65 0.00 0.00 174.74 171.12 2fl1 s GLU 123 N 1.23 3.17 0.06 2.88 2.12 -1.06 -1.30 118.70 125.79 2fl1 s GLU 123 Ca -0.01 -0.78 -0.03 0.00 0.36 0.00 0.00 54.97 54.52 2fl1 s GLU 123 Cb -0.16 -2.58 -0.03 0.00 0.26 0.00 0.00 34.13 31.62 2fl1 s GLU 123 CO -0.09 0.01 0.02 -1.54 -0.54 0.00 0.00 175.26 173.13 2fl1 s SER 124 N 0.80 0.40 0.03 -1.70 1.04 -0.68 -0.63 113.70 112.95 2fl1 s SER 124 Ca -0.06 -0.92 0.05 0.00 0.48 0.00 0.00 55.95 55.50 2fl1 s SER 124 Cb -0.15 0.23 -0.02 0.00 0.10 0.00 0.00 66.02 66.18 2fl1 s SER 124 CO -0.00 -0.63 -0.16 0.42 0.98 0.00 0.00 173.24 173.84 2fl1 s THR 125 N -3.91 1.28 -0.04 2.02 -4.23 -0.45 -1.54 115.64 108.77 2fl1 s THR 125 Ca 0.07 -0.96 -0.02 0.00 -1.18 0.00 0.00 61.69 59.60 2fl1 s THR 125 Cb 0.07 -1.12 0.03 0.00 1.34 0.00 0.00 72.50 72.82 2fl1 s THR 125 CO -0.10 0.15 0.08 0.12 -0.54 0.00 0.00 174.62 174.32 2fl1 s PHE 126 N -0.70 -0.00 -0.07 3.99 5.36 -0.01 -2.09 117.98 124.45 2fl1 s PHE 126 Ca 0.04 0.31 0.02 0.00 -0.96 0.00 0.00 56.93 56.34 2fl1 s PHE 126 Cb -0.08 -0.36 0.01 0.00 -0.34 0.00 0.00 43.02 42.26 2fl1 s PHE 126 CO 0.01 -0.18 -0.11 0.71 -1.46 0.00 0.00 175.22 174.19 2fl1 s TYR 127 N 1.86 1.37 0.18 10.12 1.51 -0.67 -0.81 117.35 130.92 2fl1 s TYR 127 Ca 0.00 -0.51 0.10 0.00 -1.01 0.00 0.00 57.07 55.65 2fl1 s TYR 127 Cb -0.12 -1.03 -0.04 0.00 -0.11 0.00 0.00 41.96 40.66 2fl1 s TYR 127 CO -0.04 -0.28 -0.20 0.20 -1.11 0.00 0.00 175.55 174.13 2fl1 s GLY 128 N 0.74 1.53 -0.07 0.71 0.00 -0.66 -1.47 107.32 108.10 2fl1 s GLY 128 Ca -0.13 -1.57 -0.10 0.00 0.00 0.00 0.00 44.72 42.91 2fl1 s GLY 128 CO 0.03 -1.62 0.26 0.54 0.00 0.00 0.00 173.10 172.30 2fl1 s VAL 129 N -2.02 0.02 -1.18 1.40 0.11 -0.19 -1.35 120.40 117.20 2fl1 s VAL 129 Ca 0.19 -0.20 -0.03 0.00 -2.93 0.00 0.00 61.98 59.01 2fl1 s VAL 129 Cb -0.06 -0.43 -0.02 0.00 -1.53 0.00 0.00 36.38 34.34 2fl1 s VAL 129 CO 0.08 -0.11 0.90 0.59 -3.33 0.00 0.00 175.10 173.24 2fl1 n ASN 130 N 2.39 -3.31 -4.67 3.54 3.02 -1.26 -2.07 115.26 112.90 2fl1 n ASN 130 Ca -0.16 -0.71 -0.41 0.00 -0.03 0.00 0.00 54.58 53.27 2fl1 n ASN 130 Cb 0.57 -4.83 -0.04 0.00 -0.61 0.00 0.00 39.78 34.87 2fl1 n ASN 130 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2fl1 s PHE 131 N -3.44 3.43 0.24 3.10 0.40 -1.26 -3.62 117.98 116.84 2fl1 s PHE 131 Ca 0.15 1.23 -0.31 0.00 -0.60 0.00 0.00 56.93 57.40 2fl1 s PHE 131 Cb -0.03 -2.97 -0.13 0.00 0.51 0.00 0.00 43.02 40.40 2fl1 s PHE 131 CO 0.76 -0.20 1.48 -2.30 0.70 0.00 0.00 175.22 175.66 2fl1 n PRO 132 N 5.05 2.21 -0.16 0.24 -0.02 -1.26 -4.83 135.00 136.23 2fl1 n PRO 132 Ca 0.03 0.79 0.26 0.00 -2.02 0.00 0.00 63.50 62.56 2fl1 n PRO 132 Cb 0.49 -2.50 0.69 0.00 -0.02 0.00 0.00 33.50 32.17 2fl1 n PRO 132 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fl1 h ALA 133 N 4.71 2.71 -0.51 3.55 0.00 -1.98 0.29 119.26 128.02 2fl1 h ALA 133 Ca -0.45 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 2fl1 h ALA 133 Cb 1.26 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2fl1 h ALA 133 CO 0.79 -0.96 0.04 -0.40 0.00 0.00 0.00 179.25 178.72 2fl1 n ASP 134 N -4.32 5.08 -4.93 0.00 3.85 -1.26 -4.55 116.55 110.42 2fl1 n ASP 134 Ca 0.17 -3.02 -0.26 0.00 -0.71 0.00 0.00 54.79 50.98 2fl1 n ASP 134 Cb 0.87 -0.66 0.05 0.00 -1.35 0.00 0.00 41.12 40.04 2fl1 n ASP 134 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 2fl1 s GLY 135 N -1.17 1.67 0.23 6.12 0.00 0.10 -4.89 107.32 109.39 2fl1 s GLY 135 Ca 0.51 -0.89 -0.06 0.00 0.00 0.00 0.00 44.72 44.28 2fl1 s GLY 135 CO 0.13 -0.55 1.84 -2.55 0.00 0.00 0.00 173.10 171.98 2fl1 h PRO 136 N -0.37 0.86 -0.64 2.90 0.11 -1.94 -0.45 132.00 132.47 2fl1 h PRO 136 Ca -0.44 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.59 2fl1 h PRO 136 Cb 1.29 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 2fl1 h PRO 136 CO 0.60 0.57 0.29 0.28 -0.21 0.00 0.00 178.00 179.52 2fl1 h VAL 137 N 0.89 1.22 0.00 3.15 2.07 -1.94 -0.45 116.25 121.19 2fl1 h VAL 137 Ca 0.36 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 67.22 2fl1 h VAL 137 Cb 0.19 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2fl1 h VAL 137 CO -0.18 0.26 -0.33 0.24 0.02 0.00 0.00 177.57 177.58 2fl1 h MET 138 N 0.88 0.00 -0.00 1.57 2.86 -1.74 -0.84 114.93 117.66 2fl1 h MET 138 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 2fl1 h MET 138 Cb 0.14 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.80 2fl1 h MET 138 CO -0.02 0.00 -0.42 1.63 1.06 0.00 0.00 176.91 179.16 2fl1 n LYS 139 N -2.95 0.30 -3.07 1.72 4.76 -0.20 -4.92 118.16 113.80 2fl1 n LYS 139 Ca 0.03 -0.18 -0.13 0.00 -2.87 0.00 0.00 58.31 55.16 2fl1 n LYS 139 Cb 0.54 -1.50 0.07 0.00 -1.84 0.00 0.00 35.03 32.30 2fl1 n LYS 139 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2fl1 n LYS 140 N -1.19 -4.36 -0.07 1.97 4.76 -0.27 -4.96 118.16 114.03 2fl1 n LYS 140 Ca 0.08 0.68 0.05 0.00 -2.87 0.00 0.00 58.31 56.25 2fl1 n LYS 140 Cb 0.34 -5.12 0.08 0.00 -1.84 0.00 0.00 35.03 28.50 2fl1 n LYS 140 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2fl1 n MET 141 N -3.33 1.50 -3.10 1.97 2.81 -0.63 -4.97 117.12 111.38 2fl1 n MET 141 Ca -0.18 -1.50 -0.27 0.00 -1.81 0.00 0.00 57.70 53.93 2fl1 n MET 141 Cb 0.62 -1.22 -0.02 0.00 -0.71 0.00 0.00 33.22 31.90 2fl1 n MET 141 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2fl1 s THR 142 N -0.91 4.98 0.00 2.03 -4.23 -1.26 0.14 115.64 116.38 2fl1 s THR 142 Ca 0.16 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.73 2fl1 s THR 142 Cb 0.10 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 70.14 2fl1 s THR 142 CO 0.13 -0.54 0.00 0.35 -0.54 0.00 0.00 174.62 174.02 2fl1 n THR 143 N -1.52 0.00 -3.55 3.99 -2.24 0.50 -4.67 114.28 106.80 2fl1 n THR 143 Ca -0.01 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.69 2fl1 n THR 143 Cb 0.55 -0.63 -0.03 0.00 -2.10 0.00 0.00 70.33 68.12 2fl1 n THR 143 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2fl1 s ASN 144 N -4.16 -0.31 0.26 3.42 0.01 -1.24 -4.69 114.94 108.23 2fl1 s ASN 144 Ca 0.00 0.13 -0.29 0.00 -0.71 0.00 0.00 52.86 51.99 2fl1 s ASN 144 Cb 0.00 0.30 -0.09 0.00 0.41 0.00 0.00 41.25 41.87 2fl1 s ASN 144 CO 0.00 -0.44 0.95 0.26 -1.51 0.00 0.00 177.10 176.37 2fl1 s TRP 145 N -2.28 3.89 0.36 2.20 0.52 -1.26 -0.36 118.94 122.01 2fl1 s TRP 145 Ca 0.04 1.87 -0.24 0.00 0.02 0.00 0.00 56.10 57.79 2fl1 s TRP 145 Cb -0.01 -2.99 -0.10 0.00 -1.15 0.00 0.00 33.47 29.22 2fl1 s TRP 145 CO -0.05 0.33 0.96 -2.00 0.02 0.00 0.00 176.95 176.20 2fl1 s GLU 146 N -1.41 4.43 0.32 4.98 2.12 0.24 -4.66 118.70 124.72 2fl1 s GLU 146 Ca 0.43 1.28 -0.28 0.00 0.36 0.00 0.00 54.97 56.77 2fl1 s GLU 146 Cb -0.25 -2.58 -0.13 0.00 0.26 0.00 0.00 34.13 31.43 2fl1 s GLU 146 CO 0.31 0.14 1.14 -2.30 -0.54 0.00 0.00 175.26 174.01 2fl1 n PRO 147 N 0.12 1.72 -4.46 4.30 -0.02 -1.26 -4.70 135.00 130.71 2fl1 n PRO 147 Ca 0.04 0.61 -0.23 0.00 -2.02 0.00 0.00 63.50 61.89 2fl1 n PRO 147 Cb 0.51 -2.09 -0.09 0.00 -0.02 0.00 0.00 33.50 31.82 2fl1 n PRO 147 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2fl1 s SER 148 N -0.45 2.42 -0.24 2.55 1.04 -1.03 -5.00 113.70 112.98 2fl1 s SER 148 Ca 0.57 -1.63 -0.03 0.00 0.48 0.00 0.00 55.95 55.34 2fl1 s SER 148 Cb -0.63 0.44 0.08 0.00 0.10 0.00 0.00 66.02 66.00 2fl1 s SER 148 CO 0.61 -0.91 0.08 0.00 0.98 0.00 0.00 173.24 174.00 2fl1 s GLU 150 N 1.86 4.10 -0.18 0.00 2.12 -0.11 -4.70 118.70 121.79 2fl1 s GLU 150 Ca 0.04 0.62 -0.11 0.00 0.36 0.00 0.00 54.97 55.88 2fl1 s GLU 150 Cb -0.17 -3.20 -0.05 0.00 0.26 0.00 0.00 34.13 30.98 2fl1 s GLU 150 CO -0.19 0.64 0.18 0.21 -0.54 0.00 0.00 175.26 175.56 2fl1 s LYS 151 N -1.20 4.18 -0.24 4.30 2.47 0.45 -0.76 119.74 128.95 2fl1 s LYS 151 Ca 0.29 -0.11 -0.06 0.00 -1.56 0.00 0.00 55.97 54.52 2fl1 s LYS 151 Cb -0.18 -3.41 -0.02 0.00 -1.46 0.00 0.00 37.83 32.76 2fl1 s LYS 151 CO 0.18 0.30 0.02 0.42 0.16 0.00 0.00 175.35 176.43 2fl1 s ILE 152 N 0.34 3.93 -0.14 5.43 -1.09 0.52 -1.20 121.20 129.00 2fl1 s ILE 152 Ca 0.11 -0.30 -0.02 0.00 -2.23 0.00 0.00 60.65 58.21 2fl1 s ILE 152 Cb -0.12 -2.82 -0.02 0.00 -1.58 0.00 0.00 42.46 37.92 2fl1 s ILE 152 CO 0.00 0.38 -0.09 -0.63 -1.23 0.00 0.00 174.94 173.37 2fl1 s ILE 153 N 1.52 3.42 0.04 2.92 -1.09 0.56 -1.81 121.20 126.76 2fl1 s ILE 153 Ca 0.06 -0.53 -0.19 0.00 -2.23 0.00 0.00 60.65 57.76 2fl1 s ILE 153 Cb -0.15 -2.46 -0.06 0.00 -1.58 0.00 0.00 42.46 38.21 2fl1 s ILE 153 CO 0.01 0.51 0.56 -2.16 -1.23 0.00 0.00 174.94 172.63 2fl1 s PRO 154 N 0.30 4.22 -0.63 2.79 0.04 -1.26 0.31 135.00 140.78 2fl1 s PRO 154 Ca -0.07 0.70 -0.00 0.00 0.04 0.00 0.00 61.00 61.67 2fl1 s PRO 154 Cb -0.15 -3.28 0.16 0.00 0.04 0.00 0.00 34.50 31.27 2fl1 s PRO 154 CO 0.04 0.54 0.43 0.42 0.04 0.00 0.00 177.00 178.47 2fl1 s ILE 155 N -0.76 3.38 0.16 0.56 1.01 0.48 -4.94 121.20 121.09 2fl1 s ILE 155 Ca 0.29 -3.28 -0.16 0.00 0.00 0.00 0.00 60.65 57.50 2fl1 s ILE 155 Cb -0.19 -3.23 0.04 0.00 0.01 0.00 0.00 42.46 39.10 2fl1 s ILE 155 CO 0.18 -0.89 1.72 0.78 0.00 0.00 0.00 174.94 176.73 2fl1 h ASN 156 N 6.62 -0.04 -0.93 3.58 2.35 -1.95 0.19 115.58 125.39 2fl1 h ASN 156 Ca -0.00 0.07 0.25 0.00 -0.55 0.00 0.00 56.30 56.06 2fl1 h ASN 156 Cb 0.90 0.10 -0.13 0.00 0.05 0.00 0.00 38.32 39.24 2fl1 h ASN 156 CO 0.72 0.01 0.43 0.77 -1.65 0.00 0.00 177.43 177.72 2fl1 h SER 157 N 0.16 0.36 -0.02 5.81 4.64 -1.95 0.29 113.55 122.84 2fl1 h SER 157 Ca 0.18 0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 2fl1 h SER 157 Cb 0.22 0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2fl1 h SER 157 CO -0.25 -0.04 -0.41 0.00 -0.87 0.00 0.00 176.83 175.25 2fl1 n GLN 158 N -5.06 1.37 -3.77 4.77 1.13 -1.01 -4.98 117.38 109.84 2fl1 n GLN 158 Ca 0.25 -1.06 -0.27 0.00 -1.94 0.00 0.00 57.00 53.98 2fl1 n GLN 158 Cb 0.75 -1.45 0.05 0.00 0.11 0.00 0.00 30.24 29.70 2fl1 n GLN 158 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2fl1 n LYS 159 N 0.09 -6.53 -4.41 -1.09 5.02 0.62 -4.99 118.16 106.86 2fl1 n LYS 159 Ca 0.09 0.70 -0.20 0.00 -2.02 0.00 0.00 58.31 56.88 2fl1 n LYS 159 Cb 0.46 -5.65 -0.10 0.00 -0.02 0.00 0.00 35.03 29.72 2fl1 n LYS 159 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2fl1 s ILE 160 N -3.33 1.24 0.11 -0.18 -4.36 -0.96 -4.72 121.20 109.00 2fl1 s ILE 160 Ca 0.59 -2.03 0.08 0.00 -0.26 0.00 0.00 60.65 59.02 2fl1 s ILE 160 Cb -0.28 -2.61 -0.04 0.00 1.25 0.00 0.00 42.46 40.78 2fl1 s ILE 160 CO 0.79 -0.14 -0.14 -0.76 0.24 0.00 0.00 174.94 174.93 2fl1 s LEU 161 N -3.43 2.89 -0.06 0.37 1.43 -0.63 -0.38 118.68 118.86 2fl1 s LEU 161 Ca 0.33 -0.46 0.06 0.00 -1.03 0.00 0.00 54.13 53.03 2fl1 s LEU 161 Cb 0.07 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.57 2fl1 s LEU 161 CO 0.13 0.18 -0.24 -0.75 0.23 0.00 0.00 176.35 175.90 2fl1 s LYS 162 N -2.17 2.64 -0.10 1.70 2.20 0.15 0.32 119.74 124.48 2fl1 s LYS 162 Ca 0.20 -0.89 -0.01 0.00 -0.36 0.00 0.00 55.97 54.91 2fl1 s LYS 162 Cb -0.11 -2.20 -0.03 0.00 -1.51 0.00 0.00 37.83 33.99 2fl1 s LYS 162 CO 0.12 0.36 -0.07 0.20 -0.36 0.00 0.00 175.35 175.60 2fl1 s GLY 163 N -0.10 1.68 -0.11 5.54 0.00 0.27 -0.32 107.32 114.28 2fl1 s GLY 163 Ca -0.05 -0.87 -0.01 0.00 0.00 0.00 0.00 44.72 43.78 2fl1 s GLY 163 CO 0.04 -0.43 -0.01 -0.35 0.00 0.00 0.00 173.10 172.35 2fl1 s ASP 164 N -0.32 2.05 -0.20 1.64 3.68 -0.34 -1.04 116.67 122.14 2fl1 s ASP 164 Ca 0.04 -0.31 -0.11 0.00 2.13 0.00 0.00 52.55 54.30 2fl1 s ASP 164 Cb -0.13 -0.59 0.06 0.00 -1.45 0.00 0.00 42.92 40.82 2fl1 s ASP 164 CO 0.02 -0.20 0.49 0.54 0.13 0.00 0.00 175.17 176.16 2fl1 s VAL 165 N 1.87 -0.02 -0.29 1.11 0.11 -0.98 -0.41 120.40 121.78 2fl1 s VAL 165 Ca 0.04 0.07 -0.23 0.00 -2.93 0.00 0.00 61.98 58.92 2fl1 s VAL 165 Cb -0.13 -0.72 -0.00 0.00 -1.53 0.00 0.00 36.38 33.99 2fl1 s VAL 165 CO -0.07 0.03 0.76 -0.55 -3.33 0.00 0.00 175.10 171.94 2fl1 s SER 166 N 1.47 6.65 0.13 3.54 0.15 -1.26 -1.53 113.70 122.84 2fl1 s SER 166 Ca -0.10 0.68 0.04 0.00 0.70 0.00 0.00 55.95 57.27 2fl1 s SER 166 Cb -0.07 -2.39 -0.04 0.00 -1.71 0.00 0.00 66.02 61.80 2fl1 s SER 166 CO -0.15 -0.56 0.09 -0.04 1.20 0.00 0.00 173.24 173.78 2fl1 s MET 167 N 2.85 2.82 -0.05 5.44 -1.94 0.14 -4.82 119.30 123.75 2fl1 s MET 167 Ca 0.31 -0.82 -0.01 0.00 -1.71 0.00 0.00 55.69 53.47 2fl1 s MET 167 Cb -0.14 -2.65 0.03 0.00 2.01 0.00 0.00 34.83 34.08 2fl1 s MET 167 CO 0.11 0.52 0.00 0.71 -0.01 0.00 0.00 175.02 176.35 2fl1 s TYR 168 N -1.57 0.51 -0.25 -0.03 1.51 -1.26 -0.67 117.35 115.59 2fl1 s TYR 168 Ca 0.30 -0.07 -0.12 0.00 -1.01 0.00 0.00 57.07 56.16 2fl1 s TYR 168 Cb -0.11 -0.63 -0.05 0.00 -0.11 0.00 0.00 41.96 41.06 2fl1 s TYR 168 CO 0.22 -0.24 0.23 -1.17 -1.11 0.00 0.00 175.55 173.49 2fl1 s LEU 169 N 1.58 4.08 0.34 -1.29 2.96 -0.48 -0.60 118.68 125.27 2fl1 s LEU 169 Ca -0.02 0.16 -0.26 0.00 -0.22 0.00 0.00 54.13 53.80 2fl1 s LEU 169 Cb -0.13 -2.21 -0.10 0.00 0.50 0.00 0.00 46.19 44.25 2fl1 s LEU 169 CO -0.03 -0.02 0.96 -0.76 -1.32 0.00 0.00 176.35 175.18 2fl1 s LEU 170 N 1.43 4.30 0.05 -0.68 1.43 0.52 -0.79 118.68 124.93 2fl1 s LEU 170 Ca 0.10 1.86 0.03 0.00 -1.03 0.00 0.00 54.13 55.09 2fl1 s LEU 170 Cb -0.15 -4.06 -0.04 0.00 0.03 0.00 0.00 46.19 41.98 2fl1 s LEU 170 CO 0.08 -0.13 0.01 -0.76 0.23 0.00 0.00 176.35 175.77 2fl1 s LEU 171 N -2.17 3.51 0.34 1.79 1.43 -0.19 -0.37 118.68 123.02 2fl1 s LEU 171 Ca 0.52 -0.10 0.14 0.00 -1.03 0.00 0.00 54.13 53.66 2fl1 s LEU 171 Cb -0.19 -2.15 1.06 0.00 0.03 0.00 0.00 46.19 44.94 2fl1 s LEU 171 CO 0.24 0.22 1.68 0.11 0.23 0.00 0.00 176.35 178.82 2fl1 h LYS 172 N 3.79 0.36 -1.05 1.70 1.57 0.90 0.52 116.57 124.35 2fl1 h LYS 172 Ca -0.48 -0.02 -0.37 0.00 -1.87 0.00 0.00 60.65 57.91 2fl1 h LYS 172 Cb 1.17 -0.08 -0.21 0.00 0.08 0.00 0.00 32.23 33.19 2fl1 h LYS 172 CO 0.59 0.24 0.47 -0.40 -0.57 0.00 0.00 179.45 179.78 2fl1 n ASP 173 N -5.00 4.08 -0.59 0.86 5.75 -1.26 -5.01 116.55 115.38 2fl1 n ASP 173 Ca 0.31 -3.12 0.08 0.00 -0.01 0.00 0.00 54.79 52.04 2fl1 n ASP 173 Cb 0.94 -0.78 -0.03 0.00 -1.03 0.00 0.00 41.12 40.23 2fl1 n ASP 173 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2fl1 n GLY 174 N -0.53 -2.14 0.00 6.12 0.00 0.17 -5.06 105.19 103.76 2fl1 n GLY 174 Ca 0.41 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 45.08 2fl1 n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fl1 n GLY 175 N -3.11 0.28 3.44 -0.02 0.00 -1.26 -4.40 105.19 100.11 2fl1 n GLY 175 Ca -0.01 -1.61 -0.22 0.00 0.00 0.00 0.00 46.02 44.18 2fl1 n GLY 175 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2fl1 s ARG 176 N -3.75 1.57 -0.25 1.61 1.70 -1.26 -1.02 118.95 117.55 2fl1 s ARG 176 Ca 0.00 -1.77 -0.00 0.00 -0.47 0.00 0.00 55.73 53.49 2fl1 s ARG 176 Cb 0.00 -1.31 0.07 0.00 -0.57 0.00 0.00 34.95 33.14 2fl1 s ARG 176 CO 0.00 0.12 0.00 -0.47 -1.08 0.00 0.00 175.30 173.87 2fl1 s TYR 177 N -2.88 2.08 0.36 5.89 5.04 0.03 -4.94 117.35 122.93 2fl1 s TYR 177 Ca 0.29 -1.67 -0.26 0.00 -2.44 0.00 0.00 57.07 53.00 2fl1 s TYR 177 Cb 0.02 -1.60 -0.09 0.00 0.35 0.00 0.00 41.96 40.64 2fl1 s TYR 177 CO 0.12 -0.77 1.06 0.50 -1.34 0.00 0.00 175.55 175.12 2fl1 s ARG 178 N 1.50 4.30 -0.13 4.97 3.52 -1.26 -1.38 118.95 130.46 2fl1 s ARG 178 Ca -0.00 1.60 -0.09 0.00 -0.13 0.00 0.00 55.73 57.10 2fl1 s ARG 178 Cb -0.18 -2.73 0.04 0.00 -1.56 0.00 0.00 34.95 30.52 2fl1 s ARG 178 CO -0.10 -0.04 0.32 0.00 -0.81 0.00 0.00 175.30 174.67 2fl1 s GLN 180 N 0.74 3.52 -0.28 0.00 2.00 -0.82 0.29 119.66 125.11 2fl1 s GLN 180 Ca -0.05 -0.60 -0.16 0.00 -2.00 0.00 0.00 55.36 52.55 2fl1 s GLN 180 Cb -0.06 -3.58 -0.03 0.00 0.80 0.00 0.00 33.01 30.14 2fl1 s GLN 180 CO -0.05 -0.34 0.43 -0.06 -0.50 0.00 0.00 175.29 174.77 2fl1 s PHE 181 N 1.66 3.24 -0.22 1.67 0.40 -0.58 -2.61 117.98 121.53 2fl1 s PHE 181 Ca 0.06 0.44 0.02 0.00 -0.60 0.00 0.00 56.93 56.84 2fl1 s PHE 181 Cb -0.17 -2.66 0.04 0.00 0.51 0.00 0.00 43.02 40.75 2fl1 s PHE 181 CO 0.07 -0.29 -0.14 -0.51 0.70 0.00 0.00 175.22 175.06 2fl1 s ASP 182 N 1.63 3.79 0.10 1.36 -0.00 -1.06 -2.32 116.67 120.16 2fl1 s ASP 182 Ca 0.17 -1.04 0.07 0.00 -0.00 0.00 0.00 52.55 51.75 2fl1 s ASP 182 Cb -0.16 -1.45 -0.03 0.00 -0.00 0.00 0.00 42.92 41.28 2fl1 s ASP 182 CO 0.10 -0.12 -0.19 -0.89 -0.00 0.00 0.00 175.17 174.07 2fl1 s THR 183 N 1.23 1.55 -0.17 -1.27 2.01 -0.21 -2.00 115.64 116.79 2fl1 s THR 183 Ca -0.03 -1.52 0.01 0.00 0.31 0.00 0.00 61.69 60.46 2fl1 s THR 183 Cb -0.17 -1.46 0.02 0.00 0.01 0.00 0.00 72.50 70.90 2fl1 s THR 183 CO -0.08 -0.14 -0.20 -0.63 -0.69 0.00 0.00 174.62 172.88 2fl1 s ILE 184 N -1.30 2.03 -0.23 1.82 -1.09 -0.68 0.94 121.20 122.69 2fl1 s ILE 184 Ca 0.05 -0.93 -0.08 0.00 -2.23 0.00 0.00 60.65 57.46 2fl1 s ILE 184 Cb -0.09 -1.83 -0.03 0.00 -1.58 0.00 0.00 42.46 38.92 2fl1 s ILE 184 CO 0.04 0.54 0.08 -0.31 -1.23 0.00 0.00 174.94 174.05 2fl1 s TYR 185 N 1.19 3.14 -0.15 3.97 1.51 0.15 -2.23 117.35 124.92 2fl1 s TYR 185 Ca 0.02 -0.22 0.01 0.00 -1.01 0.00 0.00 57.07 55.87 2fl1 s TYR 185 Cb -0.14 -2.20 0.02 0.00 -0.11 0.00 0.00 41.96 39.53 2fl1 s TYR 185 CO -0.10 -0.19 -0.18 0.15 -1.11 0.00 0.00 175.55 174.12 2fl1 s LYS 186 N 1.25 2.63 0.37 -0.62 1.02 0.37 -1.60 119.74 123.16 2fl1 s LYS 186 Ca 0.05 -0.70 -0.24 0.00 0.02 0.00 0.00 55.97 55.10 2fl1 s LYS 186 Cb -0.14 -2.26 -0.10 0.00 -0.52 0.00 0.00 37.83 34.81 2fl1 s LYS 186 CO 0.04 -0.15 0.98 0.00 -0.92 0.00 0.00 175.35 175.30 2fl1 s ALA 187 N 1.20 3.14 -0.05 5.17 0.00 -1.26 0.01 121.76 129.96 2fl1 s ALA 187 Ca 0.00 0.56 -0.26 0.00 0.00 0.00 0.00 51.96 52.27 2fl1 s ALA 187 Cb -0.14 -3.21 -0.21 0.00 0.00 0.00 0.00 23.12 19.57 2fl1 s ALA 187 CO -0.08 0.03 1.13 0.87 0.00 0.00 0.00 175.76 177.71 2fl1 h LYS 188 N 2.70 -0.03 -6.15 0.00 1.57 -1.66 -3.44 116.57 109.56 2fl1 h LYS 188 Ca -0.48 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 57.72 2fl1 h LYS 188 Cb 1.20 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.47 2fl1 h LYS 188 CO 0.63 0.54 -0.24 0.95 -0.57 0.00 0.00 179.45 180.76 2fl1 s THR 189 N -3.80 5.09 0.14 -0.16 -4.23 -1.26 -5.02 115.64 106.39 2fl1 s THR 189 Ca -0.16 0.39 -0.33 0.00 -1.18 0.00 0.00 61.69 60.42 2fl1 s THR 189 Cb 0.01 -3.64 -0.12 0.00 1.34 0.00 0.00 72.50 70.08 2fl1 s THR 189 CO 0.65 0.22 1.71 1.21 -0.54 0.00 0.00 174.62 177.87 2fl1 n GLU 190 N 0.68 2.48 -2.42 3.99 2.13 -1.26 -4.92 120.64 121.33 2fl1 n GLU 190 Ca -0.06 0.90 -0.41 0.00 0.66 0.00 0.00 57.16 58.25 2fl1 n GLU 190 Cb 0.52 -2.73 -0.04 0.00 0.27 0.00 0.00 31.44 29.47 2fl1 n GLU 190 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2fl1 s PRO 191 N 1.77 4.57 0.15 5.31 0.04 -1.26 -4.94 135.00 140.63 2fl1 s PRO 191 Ca 0.80 1.86 0.07 0.00 0.04 0.00 0.00 61.00 63.77 2fl1 s PRO 191 Cb -0.59 -3.20 -0.10 0.00 0.04 0.00 0.00 34.50 30.65 2fl1 s PRO 191 CO 0.38 0.08 1.34 0.87 0.04 0.00 0.00 177.00 179.70 2fl1 h LYS 192 N 4.31 0.01 -3.86 4.56 1.57 -1.95 -3.46 116.57 117.75 2fl1 h LYS 192 Ca -0.46 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.15 2fl1 h LYS 192 Cb 1.21 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.33 2fl1 h LYS 192 CO 0.69 0.93 -0.62 -1.83 -0.57 0.00 0.00 179.45 178.06 2fl1 s GLU 193 N -2.88 0.42 -0.05 3.15 -1.05 -1.26 -5.16 118.70 111.87 2fl1 s GLU 193 Ca 0.00 -0.64 0.04 0.00 -0.15 0.00 0.00 54.97 54.22 2fl1 s GLU 193 Cb 0.10 0.16 -0.03 0.00 -0.44 0.00 0.00 34.13 33.93 2fl1 s GLU 193 CO 0.81 -0.09 -0.15 -1.64 0.95 0.00 0.00 175.26 175.15 2fl1 s MET 194 N -1.85 2.51 0.85 -4.83 -1.94 -1.26 -4.93 119.30 107.85 2fl1 s MET 194 Ca -0.12 -0.71 -0.13 0.00 -1.71 0.00 0.00 55.69 53.03 2fl1 s MET 194 Cb -0.06 -2.37 0.11 0.00 2.01 0.00 0.00 34.83 34.52 2fl1 s MET 194 CO -0.02 0.61 1.20 -1.25 -0.01 0.00 0.00 175.02 175.54 2fl1 s PRO 195 N -0.69 1.60 0.47 2.03 0.04 -1.26 -4.95 135.00 132.24 2fl1 s PRO 195 Ca 0.11 0.05 0.04 0.00 0.04 0.00 0.00 61.00 61.24 2fl1 s PRO 195 Cb -0.11 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.54 2fl1 s PRO 195 CO 0.01 -1.84 0.66 -0.51 0.04 0.00 0.00 177.00 175.36 2fl1 s ASP 196 N -4.54 5.54 0.64 6.66 -0.00 -1.26 -4.69 116.67 119.00 2fl1 s ASP 196 Ca 0.64 -0.16 -0.18 0.00 -0.00 0.00 0.00 52.55 52.85 2fl1 s ASP 196 Cb -0.10 -0.88 -0.04 0.00 -0.00 0.00 0.00 42.92 41.90 2fl1 s ASP 196 CO 0.50 -0.89 0.95 -2.67 -0.00 0.00 0.00 175.17 173.06 2fl1 n TRP 197 N -2.06 0.73 -3.83 4.23 4.27 -1.26 -4.81 117.44 114.71 2fl1 n TRP 197 Ca 0.07 0.42 -0.06 0.00 -3.89 0.00 0.00 57.50 54.04 2fl1 n TRP 197 Cb 0.59 -2.12 -0.01 0.00 -1.36 0.00 0.00 31.31 28.41 2fl1 n TRP 197 CO 0.00 0.00 0.00 -3.38 -2.29 0.00 0.00 177.69 172.02 2fl1 s HIS 198 N -1.58 -0.10 0.16 -2.67 -3.43 -0.75 -4.96 115.29 101.95 2fl1 s HIS 198 Ca 0.76 -0.36 0.04 0.00 -0.80 0.00 0.00 55.06 54.70 2fl1 s HIS 198 Cb -0.40 0.72 -0.04 0.00 -1.43 0.00 0.00 32.58 31.43 2fl1 s HIS 198 CO 0.47 -1.19 0.19 -0.06 -2.00 0.00 0.00 174.74 172.15 2fl1 s PHE 199 N -3.38 3.27 -0.19 0.38 2.99 0.15 -0.35 117.98 120.85 2fl1 s PHE 199 Ca 0.13 0.03 -0.04 0.00 0.00 0.00 0.00 56.93 57.05 2fl1 s PHE 199 Cb -0.05 -1.57 0.06 0.00 0.00 0.00 0.00 43.02 41.47 2fl1 s PHE 199 CO 0.07 0.52 0.07 0.42 -0.00 0.00 0.00 175.22 176.29 2fl1 s ILE 200 N -1.74 0.24 -0.00 0.64 1.01 0.06 -0.73 121.20 120.69 2fl1 s ILE 200 Ca 0.32 -0.43 -0.20 0.00 0.00 0.00 0.00 60.65 60.35 2fl1 s ILE 200 Cb -0.10 -0.85 -0.05 0.00 0.01 0.00 0.00 42.46 41.46 2fl1 s ILE 200 CO 0.25 -0.29 0.57 -1.10 0.00 0.00 0.00 174.94 174.37 2fl1 s GLN 201 N 1.98 4.27 0.23 2.79 -0.21 -0.71 -0.93 119.66 127.08 2fl1 s GLN 201 Ca 0.01 0.69 0.10 0.00 0.02 0.00 0.00 55.36 56.18 2fl1 s GLN 201 Cb -0.17 -3.33 -0.05 0.00 1.00 0.00 0.00 33.01 30.47 2fl1 s GLN 201 CO -0.11 0.41 -0.17 -1.01 -2.12 0.00 0.00 175.29 172.29 2fl1 s HIS 202 N -0.32 1.97 -0.15 0.91 3.76 -0.76 -2.16 115.29 118.53 2fl1 s HIS 202 Ca 0.30 -0.46 -0.04 0.00 -0.15 0.00 0.00 55.06 54.71 2fl1 s HIS 202 Cb -0.18 -0.90 0.07 0.00 1.11 0.00 0.00 32.58 32.68 2fl1 s HIS 202 CO 0.17 0.50 0.15 0.15 -0.85 0.00 0.00 174.74 174.86 2fl1 s LYS 203 N -3.47 0.09 -0.08 1.40 1.02 -0.34 -2.47 119.74 115.90 2fl1 s LYS 203 Ca 0.25 0.20 0.03 0.00 0.02 0.00 0.00 55.97 56.47 2fl1 s LYS 203 Cb -0.03 -1.17 0.00 0.00 -0.52 0.00 0.00 37.83 36.11 2fl1 s LYS 203 CO 0.10 -0.56 -0.19 -1.17 -0.92 0.00 0.00 175.35 172.62 2fl1 s LEU 204 N 2.24 1.89 0.01 3.17 2.96 -1.26 -1.06 118.68 126.64 2fl1 s LEU 204 Ca 0.04 -0.43 0.01 0.00 -0.22 0.00 0.00 54.13 53.53 2fl1 s LEU 204 Cb -0.15 -1.13 -0.01 0.00 0.50 0.00 0.00 46.19 45.40 2fl1 s LEU 204 CO -0.09 0.11 -0.05 0.20 -1.32 0.00 0.00 176.35 175.20 2fl1 s ASN 205 N 0.41 0.56 -0.06 3.68 0.01 -0.48 -4.30 114.94 114.77 2fl1 s ASN 205 Ca -0.15 -0.28 0.05 0.00 -0.71 0.00 0.00 52.86 51.77 2fl1 s ASN 205 Cb -0.16 -0.00 -0.02 0.00 0.41 0.00 0.00 41.25 41.47 2fl1 s ASN 205 CO 0.06 -0.08 -0.19 -0.60 -1.51 0.00 0.00 177.10 174.78 2fl1 s ARG 206 N -0.75 2.54 -0.11 -0.60 3.52 -1.26 -1.37 118.95 120.92 2fl1 s ARG 206 Ca -0.04 -0.79 0.01 0.00 -0.13 0.00 0.00 55.73 54.77 2fl1 s ARG 206 Cb -0.05 -2.29 0.02 0.00 -1.56 0.00 0.00 34.95 31.07 2fl1 s ARG 206 CO -0.00 0.50 -0.11 -2.00 -0.81 0.00 0.00 175.30 172.89 2fl1 s GLU 207 N -0.44 1.77 0.32 5.12 2.12 -0.34 -4.98 118.70 122.26 2fl1 s GLU 207 Ca 0.05 -0.38 -0.28 0.00 0.36 0.00 0.00 54.97 54.72 2fl1 s GLU 207 Cb -0.12 -1.66 -0.09 0.00 0.26 0.00 0.00 34.13 32.52 2fl1 s GLU 207 CO 0.02 -0.17 1.10 0.34 -0.54 0.00 0.00 175.26 176.01 2fl1 s ASP 208 N 1.33 7.07 -0.21 -1.70 -1.08 -1.26 -0.49 116.67 120.32 2fl1 s ASP 208 Ca -0.01 2.25 0.23 0.00 -0.52 0.00 0.00 52.55 54.50 2fl1 s ASP 208 Cb -0.14 -2.62 0.49 0.00 -1.46 0.00 0.00 42.92 39.20 2fl1 s ASP 208 CO -0.05 -0.28 1.13 0.54 0.52 0.00 0.00 175.17 177.03 2fl1 n ARG 209 N 0.80 1.40 -2.23 4.34 1.74 0.91 -4.87 116.66 118.76 2fl1 n ARG 209 Ca 0.01 -3.17 -0.36 0.00 -0.77 0.00 0.00 57.85 53.56 2fl1 n ARG 209 Cb 0.46 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.64 2fl1 n ARG 209 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2fl1 s SER 210 N -3.40 5.81 0.10 0.55 0.01 -0.70 -4.30 113.70 111.78 2fl1 s SER 210 Ca 0.28 2.25 0.01 0.00 1.31 0.00 0.00 55.95 59.80 2fl1 s SER 210 Cb 0.33 -2.59 -0.00 0.00 0.21 0.00 0.00 66.02 63.97 2fl1 s SER 210 CO -0.07 -1.16 0.03 -0.90 0.41 0.00 0.00 173.24 171.55 2fl1 n ASP 211 N -1.06 1.18 0.11 2.44 5.68 -0.66 -4.87 116.55 119.37 2fl1 n ASP 211 Ca 0.10 -1.54 0.05 0.00 -0.50 0.00 0.00 54.79 52.91 2fl1 n ASP 211 Cb 0.50 0.23 0.51 0.00 -1.14 0.00 0.00 41.12 41.22 2fl1 n ASP 211 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2fl1 h ALA 212 N 1.15 1.81 0.00 2.12 0.00 -2.04 -3.23 119.26 119.07 2fl1 h ALA 212 Ca -0.08 -0.03 -0.33 0.00 0.00 0.00 0.00 54.91 54.48 2fl1 h ALA 212 Cb 0.30 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 2fl1 h ALA 212 CO 0.13 0.17 -2.07 1.17 0.00 0.00 0.00 179.25 178.65 2fl1 n LYS 213 N -4.49 0.66 -3.91 0.00 3.00 -1.26 -5.01 118.16 107.15 2fl1 n LYS 213 Ca 0.01 0.13 -0.10 0.00 -0.00 0.00 0.00 58.31 58.34 2fl1 n LYS 213 Cb 0.08 -1.64 -0.10 0.00 0.00 0.00 0.00 35.03 33.37 2fl1 n LYS 213 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 2fl1 s ASN 214 N -5.74 0.12 -0.18 3.14 0.01 -1.22 -5.09 114.94 105.97 2fl1 s ASN 214 Ca -0.07 -0.37 -0.27 0.00 -0.71 0.00 0.00 52.86 51.44 2fl1 s ASN 214 Cb 0.07 0.19 -0.01 0.00 0.41 0.00 0.00 41.25 41.91 2fl1 s ASN 214 CO 0.83 -0.40 0.93 -1.58 -1.51 0.00 0.00 177.10 175.37 2fl1 s GLN 215 N -1.77 4.31 0.06 -0.60 0.74 -1.26 -1.66 119.66 119.48 2fl1 s GLN 215 Ca -0.12 1.20 0.02 0.00 0.05 0.00 0.00 55.36 56.51 2fl1 s GLN 215 Cb -0.06 -3.59 -0.03 0.00 1.10 0.00 0.00 33.01 30.43 2fl1 s GLN 215 CO -0.01 -0.42 -0.07 0.15 -0.55 0.00 0.00 175.29 174.39 2fl1 s LYS 216 N 2.46 0.64 0.10 1.67 1.02 -1.26 -1.94 119.74 122.43 2fl1 s LYS 216 Ca 0.42 -0.99 -0.25 0.00 0.02 0.00 0.00 55.97 55.17 2fl1 s LYS 216 Cb -0.16 -0.22 0.08 0.00 -0.52 0.00 0.00 37.83 37.00 2fl1 s LYS 216 CO 0.12 0.01 0.66 1.67 -0.92 0.00 0.00 175.35 176.89 2fl1 s TRP 217 N -2.33 -0.53 -0.10 3.18 -2.14 -0.93 -0.06 118.94 116.03 2fl1 s TRP 217 Ca -0.01 0.44 0.02 0.00 2.66 0.00 0.00 56.10 59.21 2fl1 s TRP 217 Cb -0.04 0.53 -0.02 0.00 -3.10 0.00 0.00 33.47 30.85 2fl1 s TRP 217 CO -0.02 -0.76 -0.15 -1.14 -2.66 0.00 0.00 176.95 172.21 2fl1 s GLN 218 N -3.23 3.02 -0.08 3.25 0.74 0.36 -1.59 119.66 122.12 2fl1 s GLN 218 Ca -0.00 -0.72 0.00 0.00 0.05 0.00 0.00 55.36 54.69 2fl1 s GLN 218 Cb -0.01 -2.49 -0.03 0.00 1.10 0.00 0.00 33.01 31.58 2fl1 s GLN 218 CO -0.09 0.35 -0.06 -0.51 -0.55 0.00 0.00 175.29 174.44 2fl1 s LEU 219 N -0.03 3.21 -0.09 3.68 1.43 0.67 -1.20 118.68 126.34 2fl1 s LEU 219 Ca -0.04 -0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.06 2fl1 s LEU 219 Cb -0.14 -1.71 0.02 0.00 0.03 0.00 0.00 46.19 44.39 2fl1 s LEU 219 CO 0.04 0.35 -0.10 -0.63 0.23 0.00 0.00 176.35 176.24 2fl1 s ILE 220 N -0.72 1.09 0.07 -0.59 1.01 -0.47 -0.50 121.20 121.08 2fl1 s ILE 220 Ca 0.11 -0.39 0.08 0.00 0.00 0.00 0.00 60.65 60.45 2fl1 s ILE 220 Cb -0.11 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.28 2fl1 s ILE 220 CO 0.02 0.36 -0.21 -0.70 0.00 0.00 0.00 174.94 174.41 2fl1 s GLU 221 N 1.17 1.31 -0.04 2.79 2.12 -1.09 -1.38 118.70 123.57 2fl1 s GLU 221 Ca -0.05 -1.05 -0.01 0.00 0.36 0.00 0.00 54.97 54.22 2fl1 s GLU 221 Cb -0.14 -1.50 0.03 0.00 0.26 0.00 0.00 34.13 32.78 2fl1 s GLU 221 CO -0.02 0.37 0.03 -1.58 -0.54 0.00 0.00 175.26 173.52 2fl1 s HIS 222 N -0.95 0.23 0.02 5.30 2.46 -0.23 -2.52 115.29 119.61 2fl1 s HIS 222 Ca 0.08 0.10 0.01 0.00 0.47 0.00 0.00 55.06 55.72 2fl1 s HIS 222 Cb -0.09 -0.50 -0.02 0.00 -0.13 0.00 0.00 32.58 31.84 2fl1 s HIS 222 CO 0.03 -0.19 -0.04 0.00 -2.47 0.00 0.00 174.74 172.07 2fl1 s ALA 223 N 1.74 0.26 -0.19 1.58 0.00 0.53 -1.19 121.76 124.48 2fl1 s ALA 223 Ca -0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 51.96 51.27 2fl1 s ALA 223 Cb -0.13 0.09 0.06 0.00 0.00 0.00 0.00 23.12 23.15 2fl1 s ALA 223 CO -0.03 -0.09 0.48 -1.50 0.00 0.00 0.00 175.76 174.62 2fl1 s ILE 224 N -1.25 -0.02 0.62 0.00 2.07 -0.92 -1.73 121.20 119.99 2fl1 s ILE 224 Ca -0.12 0.06 -0.07 0.00 -1.41 0.00 0.00 60.65 59.11 2fl1 s ILE 224 Cb -0.09 -0.70 0.01 0.00 0.13 0.00 0.00 42.46 41.81 2fl1 s ILE 224 CO -0.00 0.02 0.96 0.00 -1.91 0.00 0.00 174.94 174.00 2fl1 s ALA 225 N 1.28 3.19 -0.10 1.50 0.00 -0.21 -1.74 121.76 125.69 2fl1 s ALA 225 Ca -0.08 -0.61 -0.33 0.00 0.00 0.00 0.00 51.96 50.94 2fl1 s ALA 225 Cb -0.07 -2.71 0.14 0.00 0.00 0.00 0.00 23.12 20.48 2fl1 s ALA 225 CO -0.12 -0.90 1.39 -1.54 0.00 0.00 0.00 175.76 174.59 2fl1 s SER 226 N -4.32 -0.02 0.00 0.00 1.04 0.10 -4.55 113.70 105.94 2fl1 s SER 226 Ca 0.55 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.94 2fl1 s SER 226 Cb -0.11 0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.06 2fl1 s SER 226 CO 0.47 -0.09 0.00 0.54 0.98 0.00 0.00 173.24 175.14 2fl1 n ARG 227 N -0.44 1.40 -1.84 4.02 5.12 -1.26 0.35 116.66 124.00 2fl1 n ARG 227 Ca -0.08 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.43 2fl1 n ARG 227 Cb 0.63 0.00 -0.00 0.00 -1.16 0.00 0.00 32.46 31.92 2fl1 n ARG 227 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2fl1 s SER 228 N -1.00 6.39 0.00 0.55 0.15 -1.26 -4.79 113.70 113.75 2fl1 s SER 228 Ca 0.00 3.00 0.24 0.00 0.70 0.00 0.00 55.95 59.89 2fl1 s SER 228 Cb 0.00 -2.67 1.28 0.00 -1.71 0.00 0.00 66.02 62.92 2fl1 s SER 228 CO 0.00 -0.84 1.79 0.00 1.20 0.00 0.00 173.24 175.40 2fl1 n ALA 229 N 0.49 2.27 -2.80 5.45 0.00 -1.26 -4.69 120.51 119.97 2fl1 n ALA 229 Ca 0.01 -0.12 -0.35 0.00 0.00 0.00 0.00 53.44 52.98 2fl1 n ALA 229 Cb 0.40 -1.39 -0.09 0.00 0.00 0.00 0.00 19.45 18.37 2fl1 n ALA 229 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fl1 s LEU 230 N -2.39 3.91 0.00 0.00 1.43 -1.26 -5.33 118.68 115.04 2fl1 s LEU 230 Ca 0.27 0.13 0.08 0.00 -1.03 0.00 0.00 54.13 53.58 2fl1 s LEU 230 Cb 0.16 -1.99 0.45 0.00 0.03 0.00 0.00 46.19 44.84 2fl1 s LEU 230 CO 0.33 0.19 0.91 -0.81 0.23 0.00 0.00 176.35 177.20