#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ls3 n SER 2 N 0.00 2.57 -0.10 7.83 3.41 -1.26 -4.41 113.62 121.67 3ls3 n SER 2 Ca 0.00 -1.81 -0.22 0.00 -0.26 0.00 0.00 58.87 56.59 3ls3 n SER 2 Cb 0.00 0.11 -0.12 0.00 -0.26 0.00 0.00 64.21 63.94 3ls3 n SER 2 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 3ls3 n VAL 3 N 0.87 1.57 -3.19 -3.33 3.14 -1.26 -4.85 118.33 111.28 3ls3 n VAL 3 Ca 0.13 -0.51 -0.42 0.00 -2.96 0.00 0.00 64.34 60.59 3ls3 n VAL 3 Cb 0.54 -1.64 -0.07 0.00 -1.06 0.00 0.00 33.84 31.60 3ls3 n VAL 3 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 3ls3 s ILE 4 N -2.51 4.95 0.28 1.55 -1.09 -1.26 -4.99 121.20 118.13 3ls3 s ILE 4 Ca -0.32 0.34 0.06 0.00 -2.23 0.00 0.00 60.65 58.49 3ls3 s ILE 4 Cb 0.09 -4.04 -0.02 0.00 -1.58 0.00 0.00 42.46 36.91 3ls3 s ILE 4 CO 0.62 -0.32 0.38 -0.54 -1.23 0.00 0.00 174.94 173.85 3ls3 s LYS 5 N 2.54 3.23 0.48 2.79 -0.14 -1.26 -4.60 119.74 122.78 3ls3 s LYS 5 Ca 0.21 -0.91 0.15 0.00 -1.36 0.00 0.00 55.97 54.06 3ls3 s LYS 5 Cb -0.15 -2.81 1.13 0.00 -1.68 0.00 0.00 37.83 34.32 3ls3 s LYS 5 CO 0.15 0.27 2.06 -1.35 -0.76 0.00 0.00 175.35 175.71 3ls3 h PRO 6 N 1.10 0.00 -4.61 -1.68 0.11 -1.97 -3.41 132.00 121.54 3ls3 h PRO 6 Ca -0.49 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.07 3ls3 h PRO 6 Cb 1.24 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 32.01 3ls3 h PRO 6 CO 0.58 0.11 -0.82 -0.51 -0.21 0.00 0.00 178.00 177.14 3ls3 s ASP 7 N -7.00 2.12 0.12 -2.05 1.01 -1.26 -3.94 116.67 105.66 3ls3 s ASP 7 Ca -0.04 -0.36 0.02 0.00 0.71 0.00 0.00 52.55 52.88 3ls3 s ASP 7 Cb 0.16 -0.95 -0.04 0.00 1.01 0.00 0.00 42.92 43.10 3ls3 s ASP 7 CO 0.68 0.01 -0.04 -0.04 0.21 0.00 0.00 175.17 175.99 3ls3 s MET 8 N 0.89 0.90 0.31 8.23 -1.94 -0.63 -5.00 119.30 122.05 3ls3 s MET 8 Ca -0.10 -1.39 0.07 0.00 -1.71 0.00 0.00 55.69 52.57 3ls3 s MET 8 Cb -0.15 -0.19 -0.03 0.00 2.01 0.00 0.00 34.83 36.46 3ls3 s MET 8 CO 0.01 -0.06 0.26 0.15 -0.01 0.00 0.00 175.02 175.37 3ls3 s LYS 9 N -3.86 2.80 -0.00 2.03 1.02 -0.20 -0.91 119.74 120.62 3ls3 s LYS 9 Ca 0.15 -1.21 0.02 0.00 0.02 0.00 0.00 55.97 54.95 3ls3 s LYS 9 Cb 0.06 -2.51 -0.01 0.00 -0.52 0.00 0.00 37.83 34.85 3ls3 s LYS 9 CO -0.02 0.21 -0.06 0.42 -0.92 0.00 0.00 175.35 174.97 3ls3 s ILE 10 N -2.24 0.44 -0.03 2.17 1.01 -0.33 -0.91 121.20 121.30 3ls3 s ILE 10 Ca 0.38 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.74 3ls3 s ILE 10 Cb -0.07 -0.38 0.01 0.00 0.01 0.00 0.00 42.46 42.04 3ls3 s ILE 10 CO 0.26 0.08 -0.04 -0.54 0.00 0.00 0.00 174.94 174.70 3ls3 s LYS 11 N -0.25 0.60 0.03 2.79 1.02 -0.14 -1.32 119.74 122.47 3ls3 s LYS 11 Ca 0.01 -0.10 -0.08 0.00 0.02 0.00 0.00 55.97 55.82 3ls3 s LYS 11 Cb -0.03 -0.63 -0.00 0.00 -0.52 0.00 0.00 37.83 36.65 3ls3 s LYS 11 CO -0.00 -0.02 0.15 -0.48 -0.92 0.00 0.00 175.35 174.08 3ls3 s LEU 12 N 0.58 1.56 -0.02 3.17 0.05 -0.49 -0.91 118.68 122.62 3ls3 s LEU 12 Ca -0.07 -0.40 0.00 0.00 0.05 0.00 0.00 54.13 53.71 3ls3 s LEU 12 Cb -0.10 0.78 0.03 0.00 -2.05 0.00 0.00 46.19 44.84 3ls3 s LEU 12 CO -0.00 -0.51 0.02 -0.60 -0.55 0.00 0.00 176.35 174.71 3ls3 s ARG 13 N -2.40 0.01 -0.12 1.48 3.52 -0.67 -1.33 118.95 119.43 3ls3 s ARG 13 Ca -0.07 0.16 -0.00 0.00 -0.13 0.00 0.00 55.73 55.69 3ls3 s ARG 13 Cb -0.02 -0.26 -0.02 0.00 -1.56 0.00 0.00 34.95 33.09 3ls3 s ARG 13 CO -0.03 -0.15 -0.12 1.41 -0.81 0.00 0.00 175.30 175.60 3ls3 s MET 14 N 0.98 3.32 -0.03 5.12 -2.45 0.68 -1.09 119.30 125.83 3ls3 s MET 14 Ca -0.08 -0.66 0.07 0.00 -1.25 0.00 0.00 55.69 53.77 3ls3 s MET 14 Cb -0.12 -2.64 -0.02 0.00 1.25 0.00 0.00 34.83 33.29 3ls3 s MET 14 CO -0.03 0.27 -0.23 -1.21 1.05 0.00 0.00 175.02 174.88 3ls3 s GLU 15 N 0.21 2.21 0.00 4.11 2.02 -0.48 -1.08 118.70 125.69 3ls3 s GLU 15 Ca -0.07 -0.87 0.00 0.00 0.02 0.00 0.00 54.97 54.05 3ls3 s GLU 15 Cb -0.15 -2.14 0.00 0.00 0.10 0.00 0.00 34.13 31.94 3ls3 s GLU 15 CO 0.05 0.58 0.00 0.41 0.02 0.00 0.00 175.26 176.31 3ls3 n GLY 16 N 2.37 1.30 3.36 -1.39 0.00 -0.52 -1.47 105.19 108.84 3ls3 n GLY 16 Ca -0.16 -0.90 -0.15 0.00 0.00 0.00 0.00 46.02 44.81 3ls3 n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ls3 s ALA 17 N -1.00 -1.20 -0.09 4.61 0.00 -0.25 -1.02 121.76 122.80 3ls3 s ALA 17 Ca 0.00 0.82 0.01 0.00 0.00 0.00 0.00 51.96 52.80 3ls3 s ALA 17 Cb 0.00 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.08 3ls3 s ALA 17 CO 0.00 -0.30 -0.11 0.08 0.00 0.00 0.00 175.76 175.43 3ls3 s VAL 18 N -1.09 1.18 -1.61 0.00 1.01 -0.98 -0.69 120.40 118.22 3ls3 s VAL 18 Ca -0.11 -0.45 -0.18 0.00 0.00 0.00 0.00 61.98 61.24 3ls3 s VAL 18 Cb -0.03 -1.12 0.16 0.00 0.00 0.00 0.00 36.38 35.39 3ls3 s VAL 18 CO 0.06 0.38 0.68 0.59 0.00 0.00 0.00 175.10 176.81 3ls3 n ASN 19 N 4.30 -3.04 -0.02 3.32 3.02 0.40 -0.37 115.26 122.87 3ls3 n ASN 19 Ca -0.19 -0.90 -0.00 0.00 -0.03 0.00 0.00 54.58 53.46 3ls3 n ASN 19 Cb 0.51 -2.52 -0.00 0.00 -0.61 0.00 0.00 39.78 37.16 3ls3 n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ls3 n GLY 20 N -1.26 0.46 3.43 7.41 0.00 -1.26 -5.01 105.19 108.96 3ls3 n GLY 20 Ca 0.07 -0.11 -0.44 0.00 0.00 0.00 0.00 46.02 45.54 3ls3 n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ls3 s HIS 21 N -1.91 3.19 0.53 1.61 5.04 0.50 -5.05 115.29 119.20 3ls3 s HIS 21 Ca 0.00 -0.67 -0.19 0.00 -1.54 0.00 0.00 55.06 52.66 3ls3 s HIS 21 Cb 0.00 -3.08 -0.06 0.00 0.04 0.00 0.00 32.58 29.47 3ls3 s HIS 21 CO 0.00 -0.79 1.06 -1.25 -2.34 0.00 0.00 174.74 171.43 3ls3 s PRO 22 N 1.95 3.55 0.22 2.88 0.04 -1.26 -2.32 135.00 140.06 3ls3 s PRO 22 Ca 0.08 1.37 -0.20 0.00 0.04 0.00 0.00 61.00 62.30 3ls3 s PRO 22 Cb -0.21 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.31 3ls3 s PRO 22 CO 0.10 -0.65 0.61 -0.59 0.04 0.00 0.00 177.00 176.51 3ls3 s PHE 23 N -2.07 -0.20 -0.08 0.56 -0.12 -0.19 -4.31 117.98 111.56 3ls3 s PHE 23 Ca 0.67 -0.16 -0.13 0.00 -0.05 0.00 0.00 56.93 57.27 3ls3 s PHE 23 Cb -0.18 0.54 0.03 0.00 -0.63 0.00 0.00 43.02 42.78 3ls3 s PHE 23 CO 0.27 -1.03 0.33 0.00 -0.05 0.00 0.00 175.22 174.73 3ls3 s ALA 24 N -3.87 -0.81 -0.01 1.99 0.00 -0.82 -1.44 121.76 116.79 3ls3 s ALA 24 Ca 0.09 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.74 3ls3 s ALA 24 Cb -0.03 -0.28 0.01 0.00 0.00 0.00 0.00 23.12 22.81 3ls3 s ALA 24 CO -0.00 -0.20 -0.03 0.42 0.00 0.00 0.00 175.76 175.94 3ls3 s ILE 25 N -0.47 0.29 0.10 0.00 1.01 -0.24 -0.48 121.20 121.40 3ls3 s ILE 25 Ca -0.06 -0.11 0.08 0.00 0.00 0.00 0.00 60.65 60.56 3ls3 s ILE 25 Cb -0.04 -0.28 -0.04 0.00 0.01 0.00 0.00 42.46 42.11 3ls3 s ILE 25 CO 0.02 0.11 -0.15 -1.61 0.00 0.00 0.00 174.94 173.31 3ls3 s GLU 26 N 0.21 1.96 0.04 2.79 2.02 -0.32 -0.23 118.70 125.17 3ls3 s GLU 26 Ca -0.02 -1.08 0.01 0.00 0.02 0.00 0.00 54.97 53.90 3ls3 s GLU 26 Cb -0.05 -2.20 -0.03 0.00 0.10 0.00 0.00 34.13 31.96 3ls3 s GLU 26 CO -0.00 0.50 -0.06 0.20 0.02 0.00 0.00 175.26 175.92 3ls3 s GLY 27 N -2.02 0.45 0.04 -1.39 0.00 -0.44 -0.48 107.32 103.48 3ls3 s GLY 27 Ca 0.18 -0.80 0.04 0.00 0.00 0.00 0.00 44.72 44.15 3ls3 s GLY 27 CO 0.10 -0.86 -0.12 -1.34 0.00 0.00 0.00 173.10 170.88 3ls3 s VAL 28 N -1.78 0.91 0.31 1.40 -7.23 -0.93 -1.39 120.40 111.69 3ls3 s VAL 28 Ca -0.09 -0.93 -0.13 0.00 -1.81 0.00 0.00 61.98 59.03 3ls3 s VAL 28 Cb -0.07 -0.84 0.02 0.00 0.56 0.00 0.00 36.38 36.04 3ls3 s VAL 28 CO -0.01 -0.07 0.61 -0.83 -0.31 0.00 0.00 175.10 174.49 3ls3 s GLY 29 N -1.12 0.58 -0.00 2.32 0.00 -0.43 -1.18 107.32 107.48 3ls3 s GLY 29 Ca -0.01 -0.88 0.01 0.00 0.00 0.00 0.00 44.72 43.84 3ls3 s GLY 29 CO 0.01 -0.52 -0.01 1.08 0.00 0.00 0.00 173.10 173.66 3ls3 s LEU 30 N -3.06 1.92 0.16 0.66 1.43 -0.35 -1.19 118.68 118.25 3ls3 s LEU 30 Ca 0.20 -0.03 -0.06 0.00 -1.03 0.00 0.00 54.13 53.22 3ls3 s LEU 30 Cb -0.03 -0.10 -0.02 0.00 0.03 0.00 0.00 46.19 46.07 3ls3 s LEU 30 CO 0.12 0.01 0.20 -0.83 0.23 0.00 0.00 176.35 176.08 3ls3 s GLY 31 N 0.06 0.76 -0.38 -3.19 0.00 -0.09 -1.29 107.32 103.19 3ls3 s GLY 31 Ca -0.00 -1.17 0.02 0.00 0.00 0.00 0.00 44.72 43.57 3ls3 s GLY 31 CO -0.00 -1.06 0.15 0.54 0.00 0.00 0.00 173.10 172.73 3ls3 s LYS 32 N -4.02 1.25 0.40 2.90 1.02 0.71 -1.60 119.74 120.40 3ls3 s LYS 32 Ca 0.22 -1.77 0.08 0.00 0.02 0.00 0.00 55.97 54.53 3ls3 s LYS 32 Cb 0.05 -2.58 0.84 0.00 -0.52 0.00 0.00 37.83 35.62 3ls3 s LYS 32 CO 0.03 -1.04 1.99 -1.35 -0.92 0.00 0.00 175.35 174.06 3ls3 h PRO 33 N 7.35 0.38 0.00 -1.68 0.11 -1.79 -1.60 132.00 134.77 3ls3 h PRO 33 Ca -0.07 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.99 3ls3 h PRO 33 Cb 0.97 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3ls3 h PRO 33 CO 0.52 0.35 -0.37 0.74 -0.21 0.00 0.00 178.00 179.03 3ls3 h PHE 34 N 0.38 0.00 0.00 0.65 -1.00 -1.84 -3.23 116.94 111.90 3ls3 h PHE 34 Ca 0.09 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.87 3ls3 h PHE 34 Cb 0.15 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.71 3ls3 h PHE 34 CO 0.00 0.00 -0.69 0.39 -1.61 0.00 0.00 178.31 176.40 3ls3 n GLU 35 N -2.83 0.24 -3.10 1.51 1.02 -0.81 -4.50 120.64 112.17 3ls3 n GLU 35 Ca 0.03 0.05 -0.13 0.00 -0.02 0.00 0.00 57.16 57.08 3ls3 n GLU 35 Cb 0.52 -1.63 0.05 0.00 -0.02 0.00 0.00 31.44 30.36 3ls3 n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ls3 n GLY 36 N 1.38 0.08 3.10 0.62 0.00 -0.67 -4.52 105.19 105.17 3ls3 n GLY 36 Ca 0.03 -0.14 -0.18 0.00 0.00 0.00 0.00 46.02 45.73 3ls3 n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ls3 s LYS 37 N -5.66 0.77 0.08 1.61 1.02 -1.16 -0.24 119.74 116.17 3ls3 s LYS 37 Ca 0.30 -0.66 -0.16 0.00 0.02 0.00 0.00 55.97 55.48 3ls3 s LYS 37 Cb -0.13 -0.72 0.03 0.00 -0.52 0.00 0.00 37.83 36.48 3ls3 s LYS 37 CO 0.42 0.18 0.37 1.14 -0.92 0.00 0.00 175.35 176.53 3ls3 s GLN 38 N -1.05 0.95 -0.01 1.68 -2.07 -0.58 -0.21 119.66 118.37 3ls3 s GLN 38 Ca -0.01 -0.59 -0.01 0.00 -1.82 0.00 0.00 55.36 52.94 3ls3 s GLN 38 Cb -0.07 0.42 0.01 0.00 -1.09 0.00 0.00 33.01 32.28 3ls3 s GLN 38 CO 0.01 -0.34 0.03 0.45 -1.32 0.00 0.00 175.29 174.12 3ls3 s SER 39 N -2.43 -0.01 -0.00 12.60 0.15 -0.41 -1.35 113.70 122.25 3ls3 s SER 39 Ca -0.01 0.06 0.01 0.00 0.70 0.00 0.00 55.95 56.71 3ls3 s SER 39 Cb 0.01 0.03 -0.00 0.00 -1.71 0.00 0.00 66.02 64.34 3ls3 s SER 39 CO -0.07 -0.04 -0.05 -0.04 1.20 0.00 0.00 173.24 174.24 3ls3 s MET 40 N 0.32 0.37 -0.22 5.44 -1.94 0.30 -1.21 119.30 122.35 3ls3 s MET 40 Ca -0.03 -0.16 -0.07 0.00 -1.71 0.00 0.00 55.69 53.72 3ls3 s MET 40 Cb -0.04 -0.36 -0.03 0.00 2.01 0.00 0.00 34.83 36.41 3ls3 s MET 40 CO -0.01 0.10 0.07 -0.51 -0.01 0.00 0.00 175.02 174.65 3ls3 s ASP 41 N -0.10 5.32 -0.08 3.03 1.01 -0.32 -0.59 116.67 124.94 3ls3 s ASP 41 Ca 0.02 -0.10 0.04 0.00 0.71 0.00 0.00 52.55 53.22 3ls3 s ASP 41 Cb -0.02 -1.94 -0.01 0.00 1.01 0.00 0.00 42.92 41.96 3ls3 s ASP 41 CO -0.00 0.05 -0.22 -0.76 0.21 0.00 0.00 175.17 174.44 3ls3 s LEU 42 N 1.14 2.24 -0.10 1.23 1.43 0.77 -2.18 118.68 123.21 3ls3 s LEU 42 Ca 0.04 -0.47 0.03 0.00 -1.03 0.00 0.00 54.13 52.71 3ls3 s LEU 42 Cb -0.14 -1.44 0.01 0.00 0.03 0.00 0.00 46.19 44.65 3ls3 s LEU 42 CO 0.03 0.22 -0.19 -0.75 0.23 0.00 0.00 176.35 175.90 3ls3 s LYS 43 N -0.01 2.50 -0.06 1.70 2.20 0.37 -1.47 119.74 124.98 3ls3 s LYS 43 Ca -0.07 -0.68 -0.30 0.00 -0.36 0.00 0.00 55.97 54.56 3ls3 s LYS 43 Cb -0.15 -1.98 -0.05 0.00 -1.51 0.00 0.00 37.83 34.14 3ls3 s LYS 43 CO 0.05 0.06 1.47 0.08 -0.36 0.00 0.00 175.35 176.65 3ls3 s VAL 44 N 0.62 3.78 -0.19 4.02 1.01 -0.01 -1.18 120.40 128.46 3ls3 s VAL 44 Ca -0.14 1.04 0.12 0.00 0.00 0.00 0.00 61.98 63.01 3ls3 s VAL 44 Cb -0.16 -3.67 -0.20 0.00 0.00 0.00 0.00 36.38 32.35 3ls3 s VAL 44 CO 0.04 -0.06 -0.00 0.29 0.00 0.00 0.00 175.10 175.37 3ls3 n LYS 45 N 6.33 1.00 -3.92 2.72 4.76 0.37 -4.96 118.16 124.46 3ls3 n LYS 45 Ca 0.15 0.03 -0.10 0.00 -2.87 0.00 0.00 58.31 55.51 3ls3 n LYS 45 Cb 0.43 -1.45 -0.11 0.00 -1.84 0.00 0.00 35.03 32.07 3ls3 n LYS 45 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3ls3 s GLU 46 N -2.43 0.35 0.00 1.97 2.02 -0.93 -4.91 118.70 114.77 3ls3 s GLU 46 Ca -0.14 -0.45 0.00 0.00 0.02 0.00 0.00 54.97 54.40 3ls3 s GLU 46 Cb 0.06 0.14 0.00 0.00 0.10 0.00 0.00 34.13 34.43 3ls3 s GLU 46 CO 0.67 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 176.29 3ls3 n GLY 47 N 1.71 0.53 3.93 -1.39 0.00 -1.26 -1.94 105.19 106.77 3ls3 n GLY 47 Ca -0.22 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 3ls3 n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ls3 s GLY 48 N -2.18 1.53 0.30 -0.02 0.00 -1.26 -4.16 107.32 101.53 3ls3 s GLY 48 Ca 0.00 -0.83 -0.29 0.00 0.00 0.00 0.00 44.72 43.60 3ls3 s GLY 48 CO 0.00 -0.64 1.32 2.56 0.00 0.00 0.00 173.10 176.34 3ls3 s PRO 49 N -4.68 4.36 0.17 2.90 0.04 -1.26 -5.08 135.00 131.45 3ls3 s PRO 49 Ca 0.49 2.20 -0.31 0.00 0.04 0.00 0.00 61.00 63.41 3ls3 s PRO 49 Cb -0.10 -3.10 -0.09 0.00 0.04 0.00 0.00 34.50 31.25 3ls3 s PRO 49 CO 0.41 -0.22 1.48 -0.51 0.04 0.00 0.00 177.00 178.21 3ls3 s LEU 50 N -1.35 4.38 -0.12 -3.56 1.43 -1.26 -4.90 118.68 113.30 3ls3 s LEU 50 Ca 0.51 2.55 0.08 0.00 -1.03 0.00 0.00 54.13 56.24 3ls3 s LEU 50 Cb -0.39 -3.60 0.44 0.00 0.03 0.00 0.00 46.19 42.66 3ls3 s LEU 50 CO 0.49 -0.74 1.19 -0.81 0.23 0.00 0.00 176.35 176.71 3ls3 n PRO 51 N 3.54 3.01 -4.07 1.29 -0.04 -1.26 -4.91 135.00 132.56 3ls3 n PRO 51 Ca 0.11 -1.69 -0.10 0.00 -0.04 0.00 0.00 63.50 61.79 3ls3 n PRO 51 Cb 0.40 -1.86 -0.09 0.00 -0.04 0.00 0.00 33.50 31.92 3ls3 n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3ls3 s PHE 52 N -1.91 0.67 0.09 0.54 -0.12 -1.26 -4.73 117.98 111.26 3ls3 s PHE 52 Ca 0.29 -1.03 -0.31 0.00 -0.05 0.00 0.00 56.93 55.84 3ls3 s PHE 52 Cb 0.22 -0.28 -0.09 0.00 -0.63 0.00 0.00 43.02 42.23 3ls3 s PHE 52 CO 0.10 -0.63 1.79 0.00 -0.05 0.00 0.00 175.22 176.43 3ls3 s ALA 53 N -4.02 3.72 0.49 1.99 0.00 -0.32 -4.88 121.76 118.74 3ls3 s ALA 53 Ca 0.22 1.35 0.22 0.00 0.00 0.00 0.00 51.96 53.75 3ls3 s ALA 53 Cb 0.05 -3.75 1.38 0.00 0.00 0.00 0.00 23.12 20.80 3ls3 s ALA 53 CO 0.02 -1.23 2.11 -0.92 0.00 0.00 0.00 175.76 175.74 3ls3 h TYR 54 N 8.76 0.00 -0.16 0.00 3.20 -1.96 -2.72 116.97 124.09 3ls3 h TYR 54 Ca -0.45 0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.47 3ls3 h TYR 54 Cb 1.21 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 3ls3 h TYR 54 CO 0.81 0.09 0.27 -0.44 -1.64 0.00 0.00 178.16 177.24 3ls3 h ASP 55 N 0.00 0.00 1.03 -2.11 3.32 -1.97 0.27 116.42 116.97 3ls3 h ASP 55 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ls3 h ASP 55 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3ls3 h ASP 55 CO 0.01 0.00 0.00 0.16 -1.72 0.00 0.00 179.24 177.69 3ls3 h ILE 56 N 0.00 0.00 0.00 0.35 3.07 -1.89 -3.21 117.51 115.84 3ls3 h ILE 56 Ca 0.08 -0.37 0.00 0.00 1.55 0.00 0.00 64.86 66.11 3ls3 h ILE 56 Cb 0.61 1.23 0.00 0.00 -0.27 0.00 0.00 36.82 38.39 3ls3 h ILE 56 CO -0.00 0.00 -1.41 0.18 -1.05 0.00 0.00 178.15 175.87 3ls3 n LEU 57 N -2.40 0.47 -0.03 0.16 4.77 0.08 -4.72 117.00 115.33 3ls3 n LEU 57 Ca 0.03 -0.09 -0.08 0.00 -0.03 0.00 0.00 56.01 55.84 3ls3 n LEU 57 Cb 0.31 -0.03 0.09 0.00 -2.33 0.00 0.00 43.42 41.46 3ls3 n LEU 57 CO 0.24 0.05 0.60 0.71 -1.33 0.00 0.00 177.39 177.67 3ls3 h THR 58 N 0.00 1.29 0.00 -5.08 1.35 -1.58 -2.35 112.91 106.54 3ls3 h THR 58 Ca 0.00 -1.54 -0.03 0.00 -0.55 0.00 0.00 66.41 64.28 3ls3 h THR 58 Cb 0.81 1.50 -0.00 0.00 -1.73 0.00 0.00 68.15 68.73 3ls3 h THR 58 CO 0.00 0.49 -0.16 0.24 -0.25 0.00 0.00 175.52 175.84 3ls3 h MET 59 N 0.52 0.00 -0.08 4.72 2.86 -1.84 -2.44 114.93 118.66 3ls3 h MET 59 Ca 0.05 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.53 3ls3 h MET 59 Cb 0.90 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.55 3ls3 h MET 59 CO 0.08 0.16 -0.63 0.00 1.06 0.00 0.00 176.91 177.57 3ls3 h ALA 60 N 1.84 0.78 0.00 6.32 0.00 -1.73 -3.44 119.26 123.03 3ls3 h ALA 60 Ca -0.00 -0.56 -0.32 0.00 0.00 0.00 0.00 54.91 54.02 3ls3 h ALA 60 Cb 0.29 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3ls3 h ALA 60 CO 0.02 0.74 2.06 1.19 0.00 0.00 0.00 179.25 183.26 3ls3 n PHE 61 N -3.86 1.08 0.00 0.00 3.72 -0.92 -5.03 117.46 112.45 3ls3 n PHE 61 Ca -0.03 -1.75 0.00 0.00 -0.05 0.00 0.00 57.45 55.63 3ls3 n PHE 61 Cb 0.64 -1.56 0.00 0.00 -0.94 0.00 0.00 39.48 37.62 3ls3 n PHE 61 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3ls3 n ASN 65 N 3.85 0.00 0.00 4.37 2.85 -1.26 -5.14 115.26 119.93 3ls3 n ASN 65 Ca 0.41 0.00 0.07 0.00 -0.11 0.00 0.00 54.58 54.95 3ls3 n ASN 65 Cb 0.22 0.00 0.44 0.00 1.24 0.00 0.00 39.78 41.68 3ls3 n ASN 65 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 3ls3 n ARG 66 N 0.00 0.67 0.28 1.20 3.00 -1.26 -1.67 116.66 118.89 3ls3 n ARG 66 Ca 0.00 0.00 0.14 0.00 -0.00 0.00 0.00 57.85 57.99 3ls3 n ARG 66 Cb 0.00 -1.35 0.82 0.00 0.00 0.00 0.00 32.46 31.93 3ls3 n ARG 66 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.63 177.39 3ls3 h VAL 67 N 0.00 0.54 -1.79 5.15 3.04 -1.96 -3.23 116.25 118.00 3ls3 h VAL 67 Ca 0.00 -0.30 -0.77 0.00 -1.01 0.00 0.00 66.70 64.62 3ls3 h VAL 67 Cb 0.00 1.20 -0.19 0.00 -2.01 0.00 0.00 31.29 30.29 3ls3 h VAL 67 CO 0.00 0.07 1.70 0.49 -1.01 0.00 0.00 177.57 178.81 3ls3 n PHE 68 N -3.71 2.77 -3.73 3.17 3.72 -0.67 -4.67 117.46 114.33 3ls3 n PHE 68 Ca -0.02 -2.74 -0.12 0.00 -0.05 0.00 0.00 57.45 54.52 3ls3 n PHE 68 Cb 0.17 -1.77 -0.11 0.00 -0.94 0.00 0.00 39.48 36.83 3ls3 n PHE 68 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ls3 s ALA 69 N -0.45 -0.83 -0.53 4.37 0.00 -1.22 -4.41 121.76 118.69 3ls3 s ALA 69 Ca 0.37 1.13 -0.28 0.00 0.00 0.00 0.00 51.96 53.19 3ls3 s ALA 69 Cb 0.08 -0.68 0.01 0.00 0.00 0.00 0.00 23.12 22.53 3ls3 s ALA 69 CO 0.03 -0.20 1.46 0.21 0.00 0.00 0.00 175.76 177.26 3ls3 s LYS 70 N 0.81 3.30 -0.17 0.00 2.20 -0.21 -4.53 119.74 121.13 3ls3 s LYS 70 Ca -0.05 0.58 -0.15 0.00 -0.36 0.00 0.00 55.97 55.99 3ls3 s LYS 70 Cb -0.06 -4.13 -0.04 0.00 -1.51 0.00 0.00 37.83 32.08 3ls3 s LYS 70 CO -0.06 -1.93 0.35 0.71 -0.36 0.00 0.00 175.35 174.06 3ls3 s TYR 71 N 6.21 3.43 0.89 4.03 2.02 -1.26 -0.92 117.35 131.76 3ls3 s TYR 71 Ca 0.56 0.62 -0.12 0.00 -0.37 0.00 0.00 57.07 57.77 3ls3 s TYR 71 Cb -0.12 -2.43 0.13 0.00 -0.40 0.00 0.00 41.96 39.14 3ls3 s TYR 71 CO 0.26 0.14 1.09 -1.25 -1.57 0.00 0.00 175.55 174.22 3ls3 s PRO 72 N 0.79 1.29 0.53 -1.71 0.04 -1.26 -4.94 135.00 129.73 3ls3 s PRO 72 Ca 0.18 0.79 0.20 0.00 0.04 0.00 0.00 61.00 62.21 3ls3 s PRO 72 Cb -0.14 -1.81 1.33 0.00 0.04 0.00 0.00 34.50 33.92 3ls3 s PRO 72 CO 0.06 -2.21 2.09 1.05 0.04 0.00 0.00 177.00 178.03 3ls3 h GLU 73 N -1.53 0.00 -0.21 4.56 9.09 -2.00 -2.93 114.58 121.57 3ls3 h GLU 73 Ca -0.49 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.92 3ls3 h GLU 73 Cb 1.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.38 3ls3 h GLU 73 CO 0.55 0.00 0.00 0.27 0.05 0.00 0.00 179.01 179.88 3ls3 n ASN 74 N -4.46 2.12 -4.25 3.06 6.94 -1.26 -4.78 115.26 112.64 3ls3 n ASN 74 Ca 0.02 -1.78 -0.32 0.00 -0.02 0.00 0.00 54.58 52.47 3ls3 n ASN 74 Cb 0.29 -0.13 -0.16 0.00 -2.36 0.00 0.00 39.78 37.41 3ls3 n ASN 74 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3ls3 s ILE 75 N -1.74 2.31 0.19 1.53 1.01 -1.11 -5.05 121.20 118.34 3ls3 s ILE 75 Ca 0.34 -0.92 -0.32 0.00 0.00 0.00 0.00 60.65 59.75 3ls3 s ILE 75 Cb 0.19 -1.91 -0.11 0.00 0.01 0.00 0.00 42.46 40.64 3ls3 s ILE 75 CO 0.28 0.55 1.62 -0.69 0.00 0.00 0.00 174.94 176.70 3ls3 s VAL 76 N 0.44 2.39 -0.68 2.92 1.01 -1.26 -4.74 120.40 120.48 3ls3 s VAL 76 Ca -0.15 0.28 -0.15 0.00 0.00 0.00 0.00 61.98 61.96 3ls3 s VAL 76 Cb -0.17 -3.18 0.17 0.00 0.00 0.00 0.00 36.38 33.20 3ls3 s VAL 76 CO 0.06 0.02 0.65 -0.62 0.00 0.00 0.00 175.10 175.22 3ls3 s ASP 77 N 1.12 6.46 0.35 3.32 -1.08 -1.26 -4.65 116.67 120.93 3ls3 s ASP 77 Ca 0.71 -2.18 0.03 0.00 -0.52 0.00 0.00 52.55 50.59 3ls3 s ASP 77 Cb -0.46 -2.22 0.66 0.00 -1.46 0.00 0.00 42.92 39.44 3ls3 s ASP 77 CO 0.32 -0.75 1.97 0.22 0.52 0.00 0.00 175.17 177.45 3ls3 h TYR 78 N 8.40 0.83 0.02 -5.34 3.20 -1.93 -2.91 116.97 119.25 3ls3 h TYR 78 Ca -0.10 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.74 3ls3 h TYR 78 Cb 1.07 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.07 3ls3 h TYR 78 CO 0.89 0.47 -0.19 0.74 -1.64 0.00 0.00 178.16 178.44 3ls3 h PHE 79 N 0.85 0.14 -0.43 -3.82 -1.00 -1.91 -2.92 116.94 107.85 3ls3 h PHE 79 Ca 0.30 -0.09 -0.05 0.00 2.81 0.00 0.00 57.97 60.94 3ls3 h PHE 79 Cb 0.11 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 39.64 3ls3 h PHE 79 CO -0.00 1.01 0.07 0.87 -1.61 0.00 0.00 178.31 178.65 3ls3 h LYS 80 N -0.77 0.66 0.00 1.51 1.57 -1.88 -2.47 116.57 115.18 3ls3 h LYS 80 Ca -0.03 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 3ls3 h LYS 80 Cb 1.08 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 33.28 3ls3 h LYS 80 CO 0.04 0.62 -0.09 1.96 -0.57 0.00 0.00 179.45 181.41 3ls3 h GLN 81 N 0.64 0.00 0.00 3.15 4.20 -1.53 -3.08 115.11 118.49 3ls3 h GLN 81 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 3ls3 h GLN 81 Cb 0.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.07 3ls3 h GLN 81 CO 0.00 0.09 0.00 0.66 -0.67 0.00 0.00 178.83 178.91 3ls3 h SER 82 N 0.00 0.00 -3.70 1.46 4.64 -1.24 -3.46 113.55 111.25 3ls3 h SER 82 Ca -0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 3ls3 h SER 82 Cb 0.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 3ls3 h SER 82 CO 0.01 0.00 0.10 -0.36 -0.87 0.00 0.00 176.83 175.71 3ls3 s PHE 83 N -3.27 3.42 -0.91 4.77 0.40 -1.17 -0.29 117.98 120.93 3ls3 s PHE 83 Ca 0.07 1.12 0.28 0.00 -0.60 0.00 0.00 56.93 57.79 3ls3 s PHE 83 Cb 0.10 -2.48 1.09 0.00 0.51 0.00 0.00 43.02 42.24 3ls3 s PHE 83 CO 0.54 -0.01 1.87 -0.35 0.70 0.00 0.00 175.22 177.97 3ls3 n PRO 84 N -0.85 0.08 -0.08 0.24 -0.04 -1.26 -4.85 135.00 128.24 3ls3 n PRO 84 Ca 0.03 0.08 -0.10 0.00 -0.04 0.00 0.00 63.50 63.47 3ls3 n PRO 84 Cb 0.54 -1.60 -0.03 0.00 -0.04 0.00 0.00 33.50 32.37 3ls3 n PRO 84 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3ls3 h GLU 85 N 0.00 0.39 0.00 0.54 3.07 -1.90 -3.34 114.58 113.34 3ls3 h GLU 85 Ca 0.00 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 3ls3 h GLU 85 Cb 0.57 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 3ls3 h GLU 85 CO 0.00 0.36 0.00 0.41 -1.40 0.00 0.00 179.01 178.38 3ls3 n GLY 86 N -0.91 -1.91 3.82 -3.84 0.00 0.60 -4.63 105.19 98.32 3ls3 n GLY 86 Ca -0.02 -2.01 -0.07 0.00 0.00 0.00 0.00 46.02 43.92 3ls3 n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ls3 s TYR 87 N 0.00 -0.13 0.21 1.61 1.13 -1.03 -1.08 117.35 118.06 3ls3 s TYR 87 Ca 0.00 -0.32 0.05 0.00 -1.41 0.00 0.00 57.07 55.39 3ls3 s TYR 87 Cb 0.00 0.65 -0.05 0.00 -1.10 0.00 0.00 41.96 41.46 3ls3 s TYR 87 CO 0.00 -1.21 -0.07 -1.54 -2.51 0.00 0.00 175.55 170.23 3ls3 s SER 88 N -2.93 2.09 0.10 -0.18 1.04 -0.59 -0.99 113.70 112.24 3ls3 s SER 88 Ca 0.12 -1.12 0.02 0.00 0.48 0.00 0.00 55.95 55.46 3ls3 s SER 88 Cb -0.05 -0.05 -0.04 0.00 0.10 0.00 0.00 66.02 65.98 3ls3 s SER 88 CO 0.07 -0.37 -0.07 -1.66 0.98 0.00 0.00 173.24 172.19 3ls3 s TRP 89 N -3.25 0.93 -0.01 5.02 1.48 -0.10 -0.61 118.94 122.40 3ls3 s TRP 89 Ca 0.24 -0.84 0.02 0.00 -1.06 0.00 0.00 56.10 54.46 3ls3 s TRP 89 Cb 0.03 -0.52 -0.00 0.00 -1.16 0.00 0.00 33.47 31.81 3ls3 s TRP 89 CO 0.06 -0.11 -0.06 -1.21 -4.06 0.00 0.00 176.95 171.58 3ls3 s GLU 90 N -3.53 0.48 -0.11 3.25 2.02 -0.52 -1.60 118.70 118.69 3ls3 s GLU 90 Ca 0.10 -0.21 -0.11 0.00 0.02 0.00 0.00 54.97 54.77 3ls3 s GLU 90 Cb 0.03 -0.47 0.03 0.00 0.10 0.00 0.00 34.13 33.82 3ls3 s GLU 90 CO -0.03 0.12 0.32 0.50 0.02 0.00 0.00 175.26 176.19 3ls3 s ARG 91 N -0.12 0.40 -0.01 1.61 3.52 -0.01 -0.97 118.95 123.36 3ls3 s ARG 91 Ca 0.02 0.40 0.08 0.00 -0.13 0.00 0.00 55.73 56.10 3ls3 s ARG 91 Cb -0.03 0.19 -0.02 0.00 -1.56 0.00 0.00 34.95 33.53 3ls3 s ARG 91 CO -0.00 -0.05 -0.26 -1.54 -0.81 0.00 0.00 175.30 172.64 3ls3 s SER 92 N 0.07 3.08 -0.21 -2.12 1.04 -0.04 -1.03 113.70 114.48 3ls3 s SER 92 Ca -0.01 -0.48 -0.00 0.00 0.48 0.00 0.00 55.95 55.94 3ls3 s SER 92 Cb -0.02 -0.34 0.05 0.00 0.10 0.00 0.00 66.02 65.81 3ls3 s SER 92 CO 0.01 0.31 -0.04 -0.04 0.98 0.00 0.00 173.24 174.46 3ls3 s MET 93 N -0.67 1.39 -0.31 4.02 -1.94 0.40 -0.71 119.30 121.48 3ls3 s MET 93 Ca 0.10 -0.75 -0.04 0.00 -1.71 0.00 0.00 55.69 53.29 3ls3 s MET 93 Cb -0.10 -2.34 0.04 0.00 2.01 0.00 0.00 34.83 34.44 3ls3 s MET 93 CO -0.01 -0.56 0.05 0.42 -0.01 0.00 0.00 175.02 174.91 3ls3 s ILE 94 N 1.55 3.42 0.41 2.53 1.01 0.08 -0.96 121.20 129.23 3ls3 s ILE 94 Ca -0.03 -1.18 -0.11 0.00 0.00 0.00 0.00 60.65 59.33 3ls3 s ILE 94 Cb -0.17 -2.91 -0.06 0.00 0.01 0.00 0.00 42.46 39.32 3ls3 s ILE 94 CO -0.07 -0.10 0.77 -0.31 0.00 0.00 0.00 174.94 175.24 3ls3 s TYR 95 N 1.35 3.47 -0.02 3.97 1.51 0.16 -1.00 117.35 126.78 3ls3 s TYR 95 Ca -0.03 1.05 0.32 0.00 -1.01 0.00 0.00 57.07 57.40 3ls3 s TYR 95 Cb -0.19 -2.45 1.32 0.00 -0.11 0.00 0.00 41.96 40.53 3ls3 s TYR 95 CO 0.01 -0.11 1.93 1.05 -1.11 0.00 0.00 175.55 177.32 3ls3 h GLU 96 N 1.24 0.00 -0.66 -0.62 4.11 -1.50 -1.39 114.58 115.76 3ls3 h GLU 96 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 3ls3 h GLU 96 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3ls3 h GLU 96 CO 0.64 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.32 3ls3 n ASP 97 N -2.87 4.83 0.00 3.06 5.75 -1.26 -4.95 116.55 121.12 3ls3 n ASP 97 Ca 0.01 -2.47 0.00 0.00 -0.01 0.00 0.00 54.79 52.32 3ls3 n ASP 97 Cb 0.27 -0.59 0.00 0.00 -1.03 0.00 0.00 41.12 39.77 3ls3 n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ls3 n GLY 98 N 1.13 0.63 3.76 6.12 0.00 -0.52 -4.72 105.19 111.59 3ls3 n GLY 98 Ca 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 3ls3 n GLY 98 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ls3 s GLY 99 N -2.12 2.34 -0.04 -0.02 0.00 -1.19 -4.77 107.32 101.52 3ls3 s GLY 99 Ca 0.00 1.60 0.01 0.00 0.00 0.00 0.00 44.72 46.33 3ls3 s GLY 99 CO 0.00 2.49 -0.06 -0.42 0.00 0.00 0.00 173.10 175.11 3ls3 s ILE 100 N -0.33 0.67 -0.01 0.90 1.01 -0.72 -0.67 121.20 122.04 3ls3 s ILE 100 Ca 0.61 -0.21 0.06 0.00 0.00 0.00 0.00 60.65 61.10 3ls3 s ILE 100 Cb -0.48 -0.66 -0.03 0.00 0.01 0.00 0.00 42.46 41.31 3ls3 s ILE 100 CO 0.53 0.25 -0.19 0.00 0.00 0.00 0.00 174.94 175.52 3ls3 s ASN 102 N -0.93 1.71 0.03 0.00 2.20 0.15 -0.45 114.94 117.65 3ls3 s ASN 102 Ca 0.12 -0.42 -0.04 0.00 -0.94 0.00 0.00 52.86 51.58 3ls3 s ASN 102 Cb -0.10 -0.13 -0.02 0.00 -2.00 0.00 0.00 41.25 39.00 3ls3 s ASN 102 CO 0.02 0.07 0.05 0.00 -2.94 0.00 0.00 177.10 174.30 3ls3 s ALA 103 N -0.74 0.03 0.09 3.54 0.00 -0.19 -0.52 121.76 123.97 3ls3 s ALA 103 Ca 0.03 -0.61 0.04 0.00 0.00 0.00 0.00 51.96 51.41 3ls3 s ALA 103 Cb -0.07 0.22 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 3ls3 s ALA 103 CO 0.01 -0.28 -0.10 0.95 0.00 0.00 0.00 175.76 176.34 3ls3 s THR 104 N -2.42 0.90 -0.03 0.00 -4.23 -0.24 -0.83 115.64 108.80 3ls3 s THR 104 Ca -0.07 -1.52 -0.02 0.00 -1.18 0.00 0.00 61.69 58.91 3ls3 s THR 104 Cb -0.03 -1.22 0.01 0.00 1.34 0.00 0.00 72.50 72.61 3ls3 s THR 104 CO -0.04 -0.49 0.07 0.21 -0.54 0.00 0.00 174.62 173.82 3ls3 s ASN 105 N -2.23 -0.05 -0.19 3.99 3.84 -0.63 -1.23 114.94 118.45 3ls3 s ASN 105 Ca 0.02 0.13 0.00 0.00 0.21 0.00 0.00 52.86 53.22 3ls3 s ASN 105 Cb -0.05 0.10 0.01 0.00 -0.55 0.00 0.00 41.25 40.77 3ls3 s ASN 105 CO 0.00 -0.05 -0.17 -0.62 -2.79 0.00 0.00 177.10 173.47 3ls3 s ASP 106 N 0.34 3.40 -0.19 -4.21 2.15 -0.71 -0.92 116.67 116.52 3ls3 s ASP 106 Ca -0.03 -0.59 -0.01 0.00 0.43 0.00 0.00 52.55 52.36 3ls3 s ASP 106 Cb -0.04 -1.54 0.01 0.00 -0.30 0.00 0.00 42.92 41.05 3ls3 s ASP 106 CO -0.01 0.00 -0.15 -0.63 -0.17 0.00 0.00 175.17 174.22 3ls3 s ILE 107 N 1.29 2.56 0.41 4.11 1.01 -0.16 -1.99 121.20 128.43 3ls3 s ILE 107 Ca 0.04 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 59.95 3ls3 s ILE 107 Cb -0.13 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 3ls3 s ILE 107 CO -0.10 0.50 0.06 0.42 0.00 0.00 0.00 174.94 175.82 3ls3 s THR 108 N 1.23 1.15 -0.08 2.92 -4.23 -0.56 -2.46 115.64 113.61 3ls3 s THR 108 Ca 0.03 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.56 3ls3 s THR 108 Cb -0.14 -2.54 0.01 0.00 1.34 0.00 0.00 72.50 71.17 3ls3 s THR 108 CO -0.07 0.00 -0.14 -0.22 -0.54 0.00 0.00 174.62 173.65 3ls3 s LEU 109 N -3.66 1.69 -0.26 4.79 2.96 -1.26 -0.61 118.68 122.34 3ls3 s LEU 109 Ca 0.25 -0.36 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 3ls3 s LEU 109 Cb 0.05 -0.95 0.07 0.00 0.50 0.00 0.00 46.19 45.87 3ls3 s LEU 109 CO 0.13 0.04 -0.00 -0.62 -1.32 0.00 0.00 176.35 174.57 3ls3 s ASP 110 N 0.73 3.95 1.90 3.68 -1.08 -0.41 -4.98 116.67 120.46 3ls3 s ASP 110 Ca -0.13 -1.38 0.00 0.00 -0.52 0.00 0.00 52.55 50.52 3ls3 s ASP 110 Cb -0.16 -1.14 0.00 0.00 -1.46 0.00 0.00 42.92 40.16 3ls3 s ASP 110 CO 0.03 -0.30 0.00 0.61 0.52 0.00 0.00 175.17 176.03 3ls3 n GLY 111 N 4.67 2.84 1.05 2.66 0.00 -1.26 -1.08 105.19 114.07 3ls3 n GLY 111 Ca -0.08 0.22 0.12 0.00 0.00 0.00 0.00 46.02 46.28 3ls3 n GLY 111 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ls3 n ASP 112 N 10.34 3.16 -4.24 1.61 9.92 -1.26 -4.95 116.55 131.13 3ls3 n ASP 112 Ca 0.00 -1.96 -0.35 0.00 -0.53 0.00 0.00 54.79 51.95 3ls3 n ASP 112 Cb 0.00 -0.17 -0.14 0.00 -0.64 0.00 0.00 41.12 40.16 3ls3 n ASP 112 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3ls3 s TYR 114 N 1.39 3.40 -0.19 0.00 1.51 -0.09 -1.29 117.35 122.08 3ls3 s TYR 114 Ca 0.03 1.46 -0.02 0.00 -1.01 0.00 0.00 57.07 57.53 3ls3 s TYR 114 Cb -0.15 -3.45 -0.01 0.00 -0.11 0.00 0.00 41.96 38.24 3ls3 s TYR 114 CO -0.05 -1.21 -0.08 0.42 -1.11 0.00 0.00 175.55 173.52 3ls3 s ILE 115 N -0.43 3.21 -0.10 2.71 1.01 0.22 -0.97 121.20 126.86 3ls3 s ILE 115 Ca 0.51 -0.56 0.03 0.00 0.00 0.00 0.00 60.65 60.63 3ls3 s ILE 115 Cb -0.34 -2.42 0.01 0.00 0.01 0.00 0.00 42.46 39.71 3ls3 s ILE 115 CO 0.40 0.46 -0.21 0.00 0.00 0.00 0.00 174.94 175.59 3ls3 s GLU 117 N 0.54 2.61 -0.08 0.00 2.12 -0.84 -1.67 118.70 121.37 3ls3 s GLU 117 Ca -0.15 -1.12 0.02 0.00 0.36 0.00 0.00 54.97 54.09 3ls3 s GLU 117 Cb -0.17 -2.94 -0.02 0.00 0.26 0.00 0.00 34.13 31.27 3ls3 s GLU 117 CO 0.05 -0.46 -0.15 0.42 -0.54 0.00 0.00 175.26 174.58 3ls3 s ILE 118 N 1.24 2.94 -0.07 -3.70 1.01 -0.25 -1.74 121.20 120.62 3ls3 s ILE 118 Ca -0.03 -0.74 0.03 0.00 0.00 0.00 0.00 60.65 59.91 3ls3 s ILE 118 Cb -0.18 -2.18 -0.02 0.00 0.01 0.00 0.00 42.46 40.09 3ls3 s ILE 118 CO -0.05 0.56 -0.15 -0.60 0.00 0.00 0.00 174.94 174.70 3ls3 s ARG 119 N -0.20 2.72 -0.05 2.79 6.06 -0.37 -1.38 118.95 128.53 3ls3 s ARG 119 Ca -0.00 -0.71 0.00 0.00 -2.50 0.00 0.00 55.73 52.52 3ls3 s ARG 119 Cb -0.13 -2.43 0.02 0.00 0.06 0.00 0.00 34.95 32.48 3ls3 s ARG 119 CO 0.03 0.51 -0.02 0.12 -2.50 0.00 0.00 175.30 173.43 3ls3 s PHE 120 N -0.42 0.66 -0.13 5.12 5.36 -0.54 -1.08 117.98 126.95 3ls3 s PHE 120 Ca 0.05 -0.17 -0.03 0.00 -0.96 0.00 0.00 56.93 55.82 3ls3 s PHE 120 Cb -0.12 -0.67 0.05 0.00 -0.34 0.00 0.00 43.02 41.94 3ls3 s PHE 120 CO 0.02 -0.23 0.05 -0.51 -1.46 0.00 0.00 175.22 173.09 3ls3 s ASP 121 N 1.25 2.15 -0.08 6.13 1.01 0.33 -1.09 116.67 126.37 3ls3 s ASP 121 Ca -0.06 -0.45 0.01 0.00 0.71 0.00 0.00 52.55 52.76 3ls3 s ASP 121 Cb -0.14 -0.37 -0.02 0.00 1.01 0.00 0.00 42.92 43.40 3ls3 s ASP 121 CO -0.02 -0.29 -0.10 -0.83 0.21 0.00 0.00 175.17 174.14 3ls3 s GLY 122 N 2.02 1.61 0.09 0.21 0.00 0.13 -0.67 107.32 110.71 3ls3 s GLY 122 Ca 0.02 -0.91 0.01 0.00 0.00 0.00 0.00 44.72 43.84 3ls3 s GLY 122 CO -0.07 -0.53 -0.05 -1.34 0.00 0.00 0.00 173.10 171.11 3ls3 s VAL 123 N -0.41 0.52 -1.32 1.40 -7.23 -0.42 -0.45 120.40 112.48 3ls3 s VAL 123 Ca 0.05 -1.90 0.00 0.00 -1.81 0.00 0.00 61.98 58.33 3ls3 s VAL 123 Cb -0.12 -1.66 0.00 0.00 0.56 0.00 0.00 36.38 35.16 3ls3 s VAL 123 CO 0.02 -0.89 0.00 0.59 -0.31 0.00 0.00 175.10 174.52 3ls3 n ASN 124 N -0.00 -4.48 -4.69 4.85 3.02 -1.26 -1.76 115.26 110.93 3ls3 n ASN 124 Ca -0.12 0.13 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 3ls3 n ASN 124 Cb 0.61 -3.48 -0.03 0.00 -0.61 0.00 0.00 39.78 36.27 3ls3 n ASN 124 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3ls3 s PHE 125 N -2.64 3.20 0.37 3.10 0.08 -1.26 -3.17 117.98 117.66 3ls3 s PHE 125 Ca 0.00 1.23 -0.28 0.00 0.12 0.00 0.00 56.93 58.00 3ls3 s PHE 125 Cb 0.00 -3.41 -0.11 0.00 -0.57 0.00 0.00 43.02 38.93 3ls3 s PHE 125 CO 0.00 -1.26 1.49 -2.14 -0.10 0.00 0.00 175.22 173.21 3ls3 s PRO 126 N 2.23 4.12 0.53 0.24 0.02 -1.26 -4.89 135.00 135.99 3ls3 s PRO 126 Ca 0.55 2.55 0.18 0.00 0.02 0.00 0.00 61.00 64.31 3ls3 s PRO 126 Cb -0.24 -2.98 1.33 0.00 0.02 0.00 0.00 34.50 32.63 3ls3 s PRO 126 CO 0.21 -0.52 2.15 0.00 -0.33 0.00 0.00 177.00 178.52 3ls3 h ALA 127 N 3.18 1.92 -0.61 -1.55 0.00 -1.98 -1.48 119.26 118.75 3ls3 h ALA 127 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3ls3 h ALA 127 Cb 1.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3ls3 h ALA 127 CO 0.66 0.01 0.00 -1.71 0.00 0.00 0.00 179.25 178.21 3ls3 n ASN 128 N -4.43 3.91 -4.70 0.00 5.15 -1.26 -4.42 115.26 109.52 3ls3 n ASN 128 Ca -0.03 -2.15 -0.29 0.00 -0.60 0.00 0.00 54.58 51.51 3ls3 n ASN 128 Cb 0.10 -0.45 0.12 0.00 -0.53 0.00 0.00 39.78 39.02 3ls3 n ASN 128 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3ls3 s GLY 129 N -1.02 1.62 0.54 8.20 0.00 -0.56 -4.86 107.32 111.25 3ls3 s GLY 129 Ca 0.43 -0.74 0.33 0.00 0.00 0.00 0.00 44.72 44.74 3ls3 s GLY 129 CO 0.26 -0.17 2.01 -0.56 0.00 0.00 0.00 173.10 174.64 3ls3 h PRO 130 N -1.30 0.00 0.06 2.90 0.13 -1.94 -1.69 132.00 130.16 3ls3 h PRO 130 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3ls3 h PRO 130 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 3ls3 h PRO 130 CO 0.59 0.05 -0.03 0.28 -0.23 0.00 0.00 178.00 178.66 3ls3 h VAL 131 N 0.00 1.09 0.00 1.56 2.07 -1.93 0.03 116.25 119.07 3ls3 h VAL 131 Ca -0.00 -1.54 -0.04 0.00 0.82 0.00 0.00 66.70 65.95 3ls3 h VAL 131 Cb 0.48 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 3ls3 h VAL 131 CO 0.01 0.33 -0.17 0.24 0.02 0.00 0.00 177.57 178.00 3ls3 h MET 132 N -0.90 0.00 -0.07 1.57 2.86 -1.75 -0.75 114.93 115.90 3ls3 h MET 132 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3ls3 h MET 132 Cb 0.60 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.26 3ls3 h MET 132 CO 0.01 0.17 0.00 1.04 1.06 0.00 0.00 176.91 179.19 3ls3 n GLN 133 N -3.37 2.17 -3.65 1.72 1.13 -0.64 -4.74 117.38 110.00 3ls3 n GLN 133 Ca -0.00 -1.71 -0.22 0.00 -1.94 0.00 0.00 57.00 53.13 3ls3 n GLN 133 Cb 0.38 -1.47 0.04 0.00 0.11 0.00 0.00 30.24 29.30 3ls3 n GLN 133 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3ls3 n LYS 134 N 1.05 -4.41 -0.34 -1.09 5.02 -0.63 -4.92 118.16 112.83 3ls3 n LYS 134 Ca 0.16 0.64 0.11 0.00 -2.02 0.00 0.00 58.31 57.20 3ls3 n LYS 134 Cb 0.53 -5.16 0.30 0.00 -0.02 0.00 0.00 35.03 30.68 3ls3 n LYS 134 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3ls3 n ARG 135 N -4.17 2.72 -3.22 1.97 3.00 -0.10 -5.00 116.66 111.87 3ls3 n ARG 135 Ca -0.26 -2.59 -0.33 0.00 -0.01 0.00 0.00 57.85 54.66 3ls3 n ARG 135 Cb 0.66 -1.54 -0.06 0.00 0.00 0.00 0.00 32.46 31.53 3ls3 n ARG 135 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 3ls3 s THR 136 N -1.04 4.74 -0.07 0.55 -4.23 -1.26 -0.23 115.64 114.11 3ls3 s THR 136 Ca 0.46 0.87 -0.09 0.00 -1.18 0.00 0.00 61.69 61.75 3ls3 s THR 136 Cb 0.24 -3.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.39 3ls3 s THR 136 CO 0.32 -0.06 -0.18 0.52 -0.54 0.00 0.00 174.62 174.67 3ls3 n VAL 137 N -0.05 1.25 -3.51 2.29 0.31 0.13 -4.76 118.33 113.99 3ls3 n VAL 137 Ca 0.01 0.17 -0.10 0.00 -0.01 0.00 0.00 64.34 64.41 3ls3 n VAL 137 Cb 0.53 -1.92 -0.03 0.00 -0.91 0.00 0.00 33.84 31.50 3ls3 n VAL 137 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3ls3 s LYS 138 N -2.43 0.85 0.29 5.55 -2.85 -1.24 -4.99 119.74 114.91 3ls3 s LYS 138 Ca -0.16 -0.18 -0.28 0.00 -1.00 0.00 0.00 55.97 54.35 3ls3 s LYS 138 Cb 0.03 0.39 -0.09 0.00 -2.06 0.00 0.00 37.83 36.10 3ls3 s LYS 138 CO 0.23 -0.34 0.98 -1.58 0.10 0.00 0.00 175.35 174.73 3ls3 s TRP 139 N -2.63 3.76 0.71 1.78 0.52 -1.26 -0.89 118.94 120.94 3ls3 s TRP 139 Ca 0.02 1.82 -0.11 0.00 0.02 0.00 0.00 56.10 57.85 3ls3 s TRP 139 Cb -0.01 -3.02 0.02 0.00 -1.15 0.00 0.00 33.47 29.31 3ls3 s TRP 139 CO -0.06 0.12 1.07 -1.21 0.02 0.00 0.00 176.95 176.89 3ls3 s GLU 140 N -1.64 2.78 0.20 4.98 0.41 -0.46 -4.83 118.70 120.14 3ls3 s GLU 140 Ca 0.46 0.96 -0.32 0.00 -0.41 0.00 0.00 54.97 55.66 3ls3 s GLU 140 Cb -0.24 -1.97 -0.15 0.00 -1.78 0.00 0.00 34.13 29.99 3ls3 s GLU 140 CO 0.30 -1.21 1.23 1.28 -0.49 0.00 0.00 175.26 176.36 3ls3 n LEU 141 N -3.21 2.00 -4.44 1.80 4.77 -1.26 -4.80 117.00 111.86 3ls3 n LEU 141 Ca 0.08 1.14 -0.28 0.00 -0.03 0.00 0.00 56.01 56.92 3ls3 n LEU 141 Cb 0.54 -1.28 -0.12 0.00 -2.33 0.00 0.00 43.42 40.23 3ls3 n LEU 141 CO 0.56 -1.07 -0.52 -0.94 -1.33 0.00 0.00 177.39 174.08 3ls3 s SER 142 N 0.06 3.58 -0.18 -1.43 1.04 -0.63 -4.95 113.70 111.19 3ls3 s SER 142 Ca 0.71 -0.72 0.01 0.00 0.48 0.00 0.00 55.95 56.43 3ls3 s SER 142 Cb -0.78 -0.36 0.03 0.00 0.10 0.00 0.00 66.02 65.01 3ls3 s SER 142 CO 0.52 0.16 -0.14 -0.89 0.98 0.00 0.00 173.24 173.86 3ls3 s THR 143 N -1.32 1.76 -0.08 2.02 2.01 -1.26 -0.64 115.64 118.13 3ls3 s THR 143 Ca 0.18 -0.92 -0.15 0.00 0.31 0.00 0.00 61.69 61.10 3ls3 s THR 143 Cb -0.09 -1.72 -0.05 0.00 0.01 0.00 0.00 72.50 70.65 3ls3 s THR 143 CO 0.09 0.34 0.40 -0.70 -0.69 0.00 0.00 174.62 174.05 3ls3 s GLU 144 N 1.38 4.14 -0.20 4.92 2.12 0.62 -4.47 118.70 127.21 3ls3 s GLU 144 Ca 0.02 0.33 -0.05 0.00 0.36 0.00 0.00 54.97 55.63 3ls3 s GLU 144 Cb -0.15 -3.35 -0.02 0.00 0.26 0.00 0.00 34.13 30.87 3ls3 s GLU 144 CO -0.10 0.39 -0.01 0.15 -0.54 0.00 0.00 175.26 175.15 3ls3 s LYS 145 N -0.09 3.60 -0.05 4.30 -0.14 -0.59 -0.84 119.74 125.93 3ls3 s LYS 145 Ca 0.22 -0.53 0.05 0.00 -1.36 0.00 0.00 55.97 54.36 3ls3 s LYS 145 Cb -0.15 -3.05 -0.02 0.00 -1.68 0.00 0.00 37.83 32.93 3ls3 s LYS 145 CO 0.10 0.03 -0.20 -0.51 -0.76 0.00 0.00 175.35 174.00 3ls3 s LEU 146 N 0.95 2.39 -0.01 3.17 1.02 0.23 -1.87 118.68 124.56 3ls3 s LEU 146 Ca 0.01 -0.35 -0.14 0.00 0.02 0.00 0.00 54.13 53.67 3ls3 s LEU 146 Cb -0.14 -1.45 0.02 0.00 0.02 0.00 0.00 46.19 44.63 3ls3 s LEU 146 CO 0.02 0.31 0.30 -0.72 0.02 0.00 0.00 176.35 176.27 3ls3 s TYR 147 N -0.52 -0.16 0.12 0.29 1.13 -0.26 -2.03 117.35 115.92 3ls3 s TYR 147 Ca 0.07 0.21 -0.21 0.00 -1.41 0.00 0.00 57.07 55.73 3ls3 s TYR 147 Cb -0.11 0.09 -0.07 0.00 -1.10 0.00 0.00 41.96 40.76 3ls3 s TYR 147 CO 0.01 -0.39 0.65 0.08 -2.51 0.00 0.00 175.55 173.38 3ls3 s VAL 148 N -1.43 4.61 -0.12 -3.49 1.01 -1.26 -0.17 120.40 119.54 3ls3 s VAL 148 Ca -0.13 1.36 -0.10 0.00 0.00 0.00 0.00 61.98 63.12 3ls3 s VAL 148 Cb -0.05 -3.97 0.04 0.00 0.00 0.00 0.00 36.38 32.40 3ls3 s VAL 148 CO 0.03 0.51 0.32 -0.60 0.00 0.00 0.00 175.10 175.36 3ls3 s ARG 149 N -1.22 0.34 -1.44 2.72 3.52 -0.48 -4.91 118.95 117.49 3ls3 s ARG 149 Ca 0.32 0.52 -0.05 0.00 -0.13 0.00 0.00 55.73 56.39 3ls3 s ARG 149 Cb -0.20 0.09 0.02 0.00 -1.56 0.00 0.00 34.95 33.30 3ls3 s ARG 149 CO 0.21 -0.09 0.44 -0.25 -0.81 0.00 0.00 175.30 174.81 3ls3 n ASP 150 N 3.39 -5.12 0.00 -2.12 8.00 -1.26 -1.64 116.55 117.79 3ls3 n ASP 150 Ca -0.17 -0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.10 3ls3 n ASP 150 Cb 0.56 -4.19 0.00 0.00 -0.02 0.00 0.00 41.12 37.47 3ls3 n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ls3 n GLY 151 N -1.28 0.57 3.52 0.44 0.00 -1.26 -4.99 105.19 102.19 3ls3 n GLY 151 Ca -0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 3ls3 n GLY 151 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ls3 s VAL 152 N -2.37 0.61 -0.18 1.61 -7.23 -0.65 -5.00 120.40 107.19 3ls3 s VAL 152 Ca 0.00 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.13 3ls3 s VAL 152 Cb 0.00 -2.34 -0.02 0.00 0.56 0.00 0.00 36.38 34.58 3ls3 s VAL 152 CO 0.00 0.00 -0.03 -0.22 -0.31 0.00 0.00 175.10 174.54 3ls3 s LEU 153 N -3.62 3.17 0.19 1.32 2.96 -0.98 -1.38 118.68 120.35 3ls3 s LEU 153 Ca 0.23 -0.20 0.09 0.00 -0.22 0.00 0.00 54.13 54.03 3ls3 s LEU 153 Cb 0.02 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.89 3ls3 s LEU 153 CO 0.14 0.11 -0.08 -0.54 -1.32 0.00 0.00 176.35 174.66 3ls3 s LYS 154 N 0.73 2.09 0.09 1.98 1.02 0.76 -0.00 119.74 126.41 3ls3 s LYS 154 Ca -0.01 -1.28 -0.09 0.00 0.02 0.00 0.00 55.97 54.60 3ls3 s LYS 154 Cb -0.14 -2.16 0.00 0.00 -0.52 0.00 0.00 37.83 35.00 3ls3 s LYS 154 CO 0.02 0.43 0.21 -1.54 -0.92 0.00 0.00 175.35 173.55 3ls3 s SER 155 N -2.92 0.08 0.10 2.83 1.04 0.22 -1.10 113.70 113.96 3ls3 s SER 155 Ca 0.26 -0.60 -0.13 0.00 0.48 0.00 0.00 55.95 55.95 3ls3 s SER 155 Cb -0.09 0.35 0.02 0.00 0.10 0.00 0.00 66.02 66.40 3ls3 s SER 155 CO 0.16 -0.73 0.32 1.51 0.98 0.00 0.00 173.24 175.48 3ls3 s ASP 156 N -2.81 -0.11 -0.02 7.02 3.84 -0.78 -1.13 116.67 122.69 3ls3 s ASP 156 Ca 0.04 -0.40 -0.10 0.00 -0.00 0.00 0.00 52.55 52.09 3ls3 s ASP 156 Cb 0.04 0.41 0.01 0.00 -1.38 0.00 0.00 42.92 42.01 3ls3 s ASP 156 CO -0.11 -0.78 0.23 -0.83 -0.00 0.00 0.00 175.17 173.68 3ls3 s GLY 157 N -2.71 -0.08 -0.73 2.12 0.00 -0.55 -1.55 107.32 103.83 3ls3 s GLY 157 Ca 0.02 0.22 -0.08 0.00 0.00 0.00 0.00 44.72 44.88 3ls3 s GLY 157 CO -0.10 0.06 0.60 0.54 0.00 0.00 0.00 173.10 174.20 3ls3 s ASN 158 N -1.04 5.98 0.36 1.64 4.22 -1.26 -1.34 114.94 123.50 3ls3 s ASN 158 Ca -0.11 -2.79 0.05 0.00 -2.14 0.00 0.00 52.86 47.88 3ls3 s ASN 158 Cb -0.05 -2.03 -0.01 0.00 1.28 0.00 0.00 41.25 40.44 3ls3 s ASN 158 CO 0.02 -0.47 0.51 -0.31 -2.04 0.00 0.00 177.10 174.82 3ls3 s TYR 159 N 0.03 3.13 -0.11 1.54 2.02 0.04 -4.88 117.35 119.12 3ls3 s TYR 159 Ca 0.17 -0.13 -0.07 0.00 -0.37 0.00 0.00 57.07 56.67 3ls3 s TYR 159 Cb -0.15 -2.07 0.04 0.00 -0.40 0.00 0.00 41.96 39.38 3ls3 s TYR 159 CO -0.06 -0.09 0.28 0.00 -1.57 0.00 0.00 175.55 174.11 3ls3 s ALA 160 N -2.26 -0.67 -0.12 3.71 0.00 -1.26 -1.23 121.76 119.93 3ls3 s ALA 160 Ca 0.46 1.02 -0.12 0.00 0.00 0.00 0.00 51.96 53.31 3ls3 s ALA 160 Cb -0.10 -0.62 -0.05 0.00 0.00 0.00 0.00 23.12 22.35 3ls3 s ALA 160 CO 0.32 -0.19 0.26 -0.51 0.00 0.00 0.00 175.76 175.65 3ls3 s LEU 161 N 0.94 4.32 0.37 0.00 1.43 0.16 -1.36 118.68 124.53 3ls3 s LEU 161 Ca -0.06 0.56 -0.23 0.00 -1.03 0.00 0.00 54.13 53.37 3ls3 s LEU 161 Cb -0.07 -2.32 -0.10 0.00 0.03 0.00 0.00 46.19 43.72 3ls3 s LEU 161 CO -0.06 0.22 0.93 -0.94 0.23 0.00 0.00 176.35 176.72 3ls3 s SER 162 N -0.19 7.11 0.19 2.29 1.04 -0.07 -0.61 113.70 123.47 3ls3 s SER 162 Ca 0.17 1.72 0.07 0.00 0.48 0.00 0.00 55.95 58.39 3ls3 s SER 162 Cb -0.13 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.40 3ls3 s SER 162 CO 0.05 -0.21 0.04 -0.76 0.98 0.00 0.00 173.24 173.34 3ls3 s LEU 163 N -2.63 3.43 0.16 2.42 1.43 -0.44 -0.69 118.68 122.35 3ls3 s LEU 163 Ca 0.56 -0.37 -0.31 0.00 -1.03 0.00 0.00 54.13 52.97 3ls3 s LEU 163 Cb -0.13 -2.04 -0.10 0.00 0.03 0.00 0.00 46.19 43.94 3ls3 s LEU 163 CO 0.18 0.06 1.65 -1.61 0.23 0.00 0.00 176.35 176.87 3ls3 s GLU 164 N -3.16 4.18 0.00 1.70 2.02 0.68 -1.29 118.70 122.83 3ls3 s GLU 164 Ca 0.29 2.45 0.00 0.00 0.02 0.00 0.00 54.97 57.73 3ls3 s GLU 164 Cb -0.09 -3.25 0.00 0.00 0.10 0.00 0.00 34.13 30.90 3ls3 s GLU 164 CO 0.20 -0.69 0.00 0.41 0.02 0.00 0.00 175.26 175.20 3ls3 n GLY 165 N 3.91 0.86 0.00 -1.39 0.00 -1.26 -4.93 105.19 102.38 3ls3 n GLY 165 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3ls3 n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ls3 n GLY 166 N -2.02 1.87 0.00 -0.02 0.00 -0.41 -5.14 105.19 99.47 3ls3 n GLY 166 Ca 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.03 3ls3 n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ls3 n GLY 167 N 1.39 -0.54 3.24 -0.02 0.00 -1.26 -4.43 105.19 103.57 3ls3 n GLY 167 Ca 0.00 -1.75 -0.16 0.00 0.00 0.00 0.00 46.02 44.11 3ls3 n GLY 167 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3ls3 s HIS 168 N -1.55 1.32 -0.17 1.61 0.09 -1.26 -1.32 115.29 114.00 3ls3 s HIS 168 Ca 0.00 -0.63 0.01 0.00 -0.00 0.00 0.00 55.06 54.44 3ls3 s HIS 168 Cb 0.00 -0.68 0.03 0.00 -0.00 0.00 0.00 32.58 31.93 3ls3 s HIS 168 CO 0.00 0.12 -0.13 -0.47 -0.00 0.00 0.00 174.74 174.26 3ls3 s TYR 169 N -2.58 2.31 0.03 1.40 5.04 0.22 -4.94 117.35 118.83 3ls3 s TYR 169 Ca 0.11 -1.41 -0.04 0.00 -2.44 0.00 0.00 57.07 53.29 3ls3 s TYR 169 Cb -0.02 -1.63 -0.04 0.00 0.35 0.00 0.00 41.96 40.61 3ls3 s TYR 169 CO 0.02 -0.71 0.24 1.03 -1.34 0.00 0.00 175.55 174.79 3ls3 s ARG 170 N 1.44 3.51 -0.06 4.97 1.81 -1.26 -0.67 118.95 128.68 3ls3 s ARG 170 Ca 0.02 -0.22 -0.03 0.00 -1.72 0.00 0.00 55.73 53.78 3ls3 s ARG 170 Cb -0.14 -3.05 0.03 0.00 -0.45 0.00 0.00 34.95 31.34 3ls3 s ARG 170 CO -0.10 0.63 0.15 0.00 -0.68 0.00 0.00 175.30 175.30 3ls3 s ASP 172 N 0.89 6.23 -0.15 0.00 1.01 -0.17 -0.78 116.67 123.69 3ls3 s ASP 172 Ca -0.07 0.26 -0.06 0.00 0.71 0.00 0.00 52.55 53.39 3ls3 s ASP 172 Cb -0.09 -2.13 -0.04 0.00 1.01 0.00 0.00 42.92 41.67 3ls3 s ASP 172 CO -0.04 0.07 0.05 -0.36 0.21 0.00 0.00 175.17 175.09 3ls3 s PHE 173 N 0.89 3.26 -0.09 4.23 2.99 -0.45 -0.74 117.98 128.06 3ls3 s PHE 173 Ca 0.11 0.13 -0.00 0.00 0.00 0.00 0.00 56.93 57.17 3ls3 s PHE 173 Cb -0.13 -1.99 0.02 0.00 0.00 0.00 0.00 43.02 40.92 3ls3 s PHE 173 CO 0.04 0.28 -0.06 0.15 -0.00 0.00 0.00 175.22 175.63 3ls3 s LYS 174 N -0.08 1.25 0.05 0.44 1.02 0.11 -1.48 119.74 121.05 3ls3 s LYS 174 Ca 0.06 -0.16 0.06 0.00 0.02 0.00 0.00 55.97 55.95 3ls3 s LYS 174 Cb -0.12 -1.37 -0.02 0.00 -0.52 0.00 0.00 37.83 35.79 3ls3 s LYS 174 CO 0.01 -0.25 -0.16 0.99 -0.92 0.00 0.00 175.35 175.02 3ls3 s THR 175 N 1.66 1.29 -0.13 2.17 2.01 -0.28 -0.86 115.64 121.50 3ls3 s THR 175 Ca 0.03 -1.13 0.02 0.00 0.31 0.00 0.00 61.69 60.92 3ls3 s THR 175 Cb -0.13 -1.16 0.01 0.00 0.01 0.00 0.00 72.50 71.23 3ls3 s THR 175 CO -0.06 0.01 -0.21 -0.89 -0.69 0.00 0.00 174.62 172.78 3ls3 s THR 176 N -0.92 1.95 -0.13 -0.82 2.01 -0.14 -0.61 115.64 116.97 3ls3 s THR 176 Ca 0.03 -0.92 -0.05 0.00 0.31 0.00 0.00 61.69 61.06 3ls3 s THR 176 Cb -0.09 -1.73 -0.04 0.00 0.01 0.00 0.00 72.50 70.66 3ls3 s THR 176 CO 0.02 0.53 0.05 -0.31 -0.69 0.00 0.00 174.62 174.22 3ls3 s TYR 177 N 0.82 3.29 -0.26 4.92 2.02 1.00 -1.43 117.35 127.70 3ls3 s TYR 177 Ca -0.08 0.20 -0.01 0.00 -0.37 0.00 0.00 57.07 56.81 3ls3 s TYR 177 Cb -0.16 -1.94 0.08 0.00 -0.40 0.00 0.00 41.96 39.54 3ls3 s TYR 177 CO -0.01 0.38 0.05 0.15 -1.57 0.00 0.00 175.55 174.55 3ls3 s LYS 178 N -0.37 0.85 0.42 -0.62 1.02 0.22 -2.31 119.74 118.95 3ls3 s LYS 178 Ca 0.09 -0.84 -0.25 0.00 0.02 0.00 0.00 55.97 54.98 3ls3 s LYS 178 Cb -0.12 -2.14 -0.08 0.00 -0.52 0.00 0.00 37.83 34.96 3ls3 s LYS 178 CO 0.02 -0.80 1.31 0.00 -0.92 0.00 0.00 175.35 174.95 3ls3 s ALA 179 N 1.66 3.21 -2.03 5.17 0.00 -1.26 -1.54 121.76 126.96 3ls3 s ALA 179 Ca 0.03 1.24 0.15 0.00 0.00 0.00 0.00 51.96 53.38 3ls3 s ALA 179 Cb -0.17 -3.49 0.83 0.00 0.00 0.00 0.00 23.12 20.29 3ls3 s ALA 179 CO -0.16 -0.87 1.55 1.63 0.00 0.00 0.00 175.76 177.90 3ls3 n LYS 180 N -0.01 1.11 -4.00 0.00 5.02 -0.24 -4.84 118.16 115.20 3ls3 n LYS 180 Ca 0.04 -0.17 -0.09 0.00 -2.02 0.00 0.00 58.31 56.07 3ls3 n LYS 180 Cb 0.44 -1.25 -0.05 0.00 -0.02 0.00 0.00 35.03 34.15 3ls3 n LYS 180 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 3ls3 s LYS 181 N -1.96 1.54 0.09 1.97 -2.85 -1.26 -4.97 119.74 112.30 3ls3 s LYS 181 Ca 0.23 -1.27 -0.31 0.00 -1.00 0.00 0.00 55.97 53.62 3ls3 s LYS 181 Cb 0.11 0.47 -0.08 0.00 -2.06 0.00 0.00 37.83 36.26 3ls3 s LYS 181 CO 0.18 -0.64 1.60 0.08 0.10 0.00 0.00 175.35 176.66 3ls3 s VAL 182 N -4.01 3.02 0.20 1.79 1.01 -1.26 -5.00 120.40 116.14 3ls3 s VAL 182 Ca 0.23 0.56 0.02 0.00 0.00 0.00 0.00 61.98 62.78 3ls3 s VAL 182 Cb -0.00 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 3ls3 s VAL 182 CO 0.09 0.01 0.02 0.68 0.00 0.00 0.00 175.10 175.91 3ls3 s VAL 183 N 2.18 0.68 0.20 2.92 -7.23 -1.26 -5.03 120.40 112.86 3ls3 s VAL 183 Ca 0.72 -1.99 -0.30 0.00 -1.81 0.00 0.00 61.98 58.60 3ls3 s VAL 183 Cb -0.40 -2.26 -0.08 0.00 0.56 0.00 0.00 36.38 34.20 3ls3 s VAL 183 CO 0.31 -0.35 1.26 -1.58 -0.31 0.00 0.00 175.10 174.43 3ls3 s GLN 184 N -3.94 4.44 0.07 4.82 0.74 -1.26 -5.01 119.66 119.51 3ls3 s GLN 184 Ca 0.28 1.98 -0.19 0.00 0.05 0.00 0.00 55.36 57.47 3ls3 s GLN 184 Cb 0.06 -3.21 -0.07 0.00 1.10 0.00 0.00 33.01 30.90 3ls3 s GLN 184 CO 0.07 -0.17 0.56 -0.51 -0.55 0.00 0.00 175.29 174.69 3ls3 s LEU 185 N -0.23 4.52 0.52 3.68 1.43 -1.26 -4.66 118.68 122.67 3ls3 s LEU 185 Ca 0.55 1.25 -0.10 0.00 -1.03 0.00 0.00 54.13 54.79 3ls3 s LEU 185 Cb -0.35 -2.88 -0.05 0.00 0.03 0.00 0.00 46.19 42.94 3ls3 s LEU 185 CO 0.38 0.27 0.89 -2.16 0.23 0.00 0.00 176.35 175.96 3ls3 s PRO 186 N -1.07 3.67 0.85 1.29 0.04 -1.26 -4.94 135.00 133.58 3ls3 s PRO 186 Ca 0.29 0.55 -0.12 0.00 0.04 0.00 0.00 61.00 61.77 3ls3 s PRO 186 Cb -0.19 -2.25 0.10 0.00 0.04 0.00 0.00 34.50 32.20 3ls3 s PRO 186 CO 0.19 -0.30 1.10 -0.51 0.04 0.00 0.00 177.00 177.52 3ls3 s ASP 187 N -3.77 3.96 0.15 6.66 1.01 -1.26 -4.58 116.67 118.84 3ls3 s ASP 187 Ca 0.52 1.31 -0.34 0.00 0.71 0.00 0.00 52.55 54.76 3ls3 s ASP 187 Cb -0.10 -2.01 -0.15 0.00 1.01 0.00 0.00 42.92 41.67 3ls3 s ASP 187 CO 0.43 -2.31 1.42 0.00 0.21 0.00 0.00 175.17 174.92 3ls3 n TYR 188 N -3.65 1.89 -3.88 4.23 9.36 -1.26 -4.86 117.16 118.98 3ls3 n TYR 188 Ca 0.07 0.46 -0.10 0.00 3.32 0.00 0.00 57.90 61.65 3ls3 n TYR 188 Cb 0.56 -2.43 0.00 0.00 -0.63 0.00 0.00 39.34 36.85 3ls3 n TYR 188 CO 0.00 0.00 0.00 -3.38 0.22 0.00 0.00 176.86 173.70 3ls3 s HIS 189 N 0.47 0.32 0.16 2.98 -3.43 -0.86 -4.92 115.29 110.01 3ls3 s HIS 189 Ca 0.78 -0.86 0.11 0.00 -0.80 0.00 0.00 55.06 54.29 3ls3 s HIS 189 Cb -0.78 0.60 -0.04 0.00 -1.43 0.00 0.00 32.58 30.92 3ls3 s HIS 189 CO 0.44 -1.42 -0.25 -1.12 -2.00 0.00 0.00 174.74 170.39 3ls3 s SER 190 N -3.09 3.42 -0.10 7.38 0.01 -0.07 -0.60 113.70 120.65 3ls3 s SER 190 Ca 0.19 -0.80 0.01 0.00 1.31 0.00 0.00 55.95 56.65 3ls3 s SER 190 Cb -0.04 -0.26 0.02 0.00 0.21 0.00 0.00 66.02 65.95 3ls3 s SER 190 CO 0.13 0.15 -0.11 -0.69 0.41 0.00 0.00 173.24 173.13 3ls3 s VAL 191 N -1.40 1.16 -0.01 3.43 1.01 -0.02 -0.84 120.40 123.74 3ls3 s VAL 191 Ca 0.18 -0.42 -0.16 0.00 0.00 0.00 0.00 61.98 61.58 3ls3 s VAL 191 Cb -0.09 -1.12 -0.06 0.00 0.00 0.00 0.00 36.38 35.12 3ls3 s VAL 191 CO 0.08 0.38 0.45 -1.81 0.00 0.00 0.00 175.10 174.20 3ls3 s ASP 192 N 1.27 6.83 0.06 3.32 1.01 -0.18 -0.28 116.67 128.71 3ls3 s ASP 192 Ca -0.03 0.99 0.05 0.00 0.71 0.00 0.00 52.55 54.28 3ls3 s ASP 192 Cb -0.14 -2.28 -0.03 0.00 1.01 0.00 0.00 42.92 41.49 3ls3 s ASP 192 CO -0.04 0.26 -0.14 -1.00 0.21 0.00 0.00 175.17 174.46 3ls3 s HIS 193 N -0.78 1.19 -0.08 4.23 3.76 0.19 -1.70 115.29 122.10 3ls3 s HIS 193 Ca 0.25 -0.43 0.00 0.00 -0.15 0.00 0.00 55.06 54.74 3ls3 s HIS 193 Cb -0.17 -0.68 0.02 0.00 1.11 0.00 0.00 32.58 32.86 3ls3 s HIS 193 CO 0.14 0.05 -0.06 -1.58 -0.85 0.00 0.00 174.74 172.43 3ls3 s HIS 194 N -1.14 1.15 -0.02 1.40 2.46 -0.13 -1.61 115.29 117.40 3ls3 s HIS 194 Ca -0.01 -0.46 0.07 0.00 0.47 0.00 0.00 55.06 55.12 3ls3 s HIS 194 Cb -0.09 -0.99 -0.02 0.00 -0.13 0.00 0.00 32.58 31.35 3ls3 s HIS 194 CO 0.02 -0.36 -0.22 -1.50 -2.47 0.00 0.00 174.74 170.21 3ls3 s ILE 195 N 1.39 1.76 -0.14 0.89 2.07 -1.26 -1.25 121.20 124.66 3ls3 s ILE 195 Ca -0.02 -0.94 -0.09 0.00 -1.41 0.00 0.00 60.65 58.18 3ls3 s ILE 195 Cb -0.13 -1.47 0.05 0.00 0.13 0.00 0.00 42.46 41.03 3ls3 s ILE 195 CO -0.03 0.50 0.35 -0.70 -1.91 0.00 0.00 174.94 173.14 3ls3 s GLU 196 N -0.44 0.35 -0.45 3.50 2.12 -0.04 -4.59 118.70 119.15 3ls3 s GLU 196 Ca 0.06 0.64 -0.29 0.00 0.36 0.00 0.00 54.97 55.74 3ls3 s GLU 196 Cb -0.09 0.01 0.03 0.00 0.26 0.00 0.00 34.13 34.33 3ls3 s GLU 196 CO -0.00 -0.13 1.13 0.42 -0.54 0.00 0.00 175.26 176.14 3ls3 s ILE 197 N 1.04 4.26 0.08 -3.70 1.01 -1.26 -0.97 121.20 121.65 3ls3 s ILE 197 Ca -0.07 1.32 -0.09 0.00 0.00 0.00 0.00 60.65 61.80 3ls3 s ILE 197 Cb -0.07 -4.57 -0.27 0.00 0.01 0.00 0.00 42.46 37.56 3ls3 s ILE 197 CO -0.08 -0.91 1.15 0.40 0.00 0.00 0.00 174.94 175.50 3ls3 h ILE 198 N 6.14 1.37 -3.13 2.92 1.08 -0.88 -3.48 117.51 121.54 3ls3 h ILE 198 Ca -0.23 -2.66 -0.03 0.00 -0.39 0.00 0.00 64.86 61.55 3ls3 h ILE 198 Cb 1.06 2.75 -0.12 0.00 -3.07 0.00 0.00 36.82 37.44 3ls3 h ILE 198 CO 1.11 0.80 0.12 -0.94 -0.69 0.00 0.00 178.15 178.54 3ls3 s SER 199 N -7.29 -0.45 -0.03 1.72 1.04 -1.18 -5.01 113.70 102.51 3ls3 s SER 199 Ca -0.07 -0.13 -0.29 0.00 0.48 0.00 0.00 55.95 55.94 3ls3 s SER 199 Cb 0.07 0.57 0.10 0.00 0.10 0.00 0.00 66.02 66.85 3ls3 s SER 199 CO 0.91 -0.95 0.88 -1.38 0.98 0.00 0.00 173.24 173.67 3ls3 s HIS 200 N -3.78 -0.39 0.72 5.02 -3.43 -1.26 -0.84 115.29 111.34 3ls3 s HIS 200 Ca 0.02 0.37 -0.03 0.00 -0.80 0.00 0.00 55.06 54.62 3ls3 s HIS 200 Cb -0.00 0.51 0.11 0.00 -1.43 0.00 0.00 32.58 31.77 3ls3 s HIS 200 CO -0.12 -0.53 1.01 0.16 -2.00 0.00 0.00 174.74 173.26 3ls3 s ASP 201 N -2.13 4.39 0.23 7.38 -4.77 -0.63 -4.94 116.67 116.21 3ls3 s ASP 201 Ca 0.02 -0.12 -0.11 0.00 -3.30 0.00 0.00 52.55 49.04 3ls3 s ASP 201 Cb -0.01 -0.33 0.31 0.00 -1.09 0.00 0.00 42.92 41.81 3ls3 s ASP 201 CO -0.06 -1.83 1.61 0.07 0.70 0.00 0.00 175.17 175.66 3ls3 h LYS 202 N -0.59 0.01 -0.49 2.11 2.10 -2.03 -1.32 116.57 116.35 3ls3 h LYS 202 Ca -0.39 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 3ls3 h LYS 202 Cb 1.27 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 3ls3 h LYS 202 CO 0.44 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.50 3ls3 n ASP 203 N -5.48 3.97 -0.93 7.07 5.68 -1.26 -4.96 116.55 120.64 3ls3 n ASP 203 Ca 0.10 -2.38 -0.12 0.00 -0.50 0.00 0.00 54.79 51.90 3ls3 n ASP 203 Cb 0.39 -0.46 -0.05 0.00 -1.14 0.00 0.00 41.12 39.86 3ls3 n ASP 203 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 3ls3 n TYR 204 N 0.68 -0.02 0.26 2.11 4.02 -0.50 -4.31 117.16 119.41 3ls3 n TYR 204 Ca 0.21 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.22 3ls3 n TYR 204 Cb 0.73 -2.22 0.70 0.00 -0.02 0.00 0.00 39.34 38.53 3ls3 n TYR 204 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 3ls3 h SER 205 N 0.00 0.00 -3.35 7.72 0.02 -1.91 -3.40 113.55 112.63 3ls3 h SER 205 Ca -0.24 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.23 3ls3 h SER 205 Cb 0.79 0.00 -0.35 0.00 0.14 0.00 0.00 62.40 62.98 3ls3 h SER 205 CO 0.36 0.13 -0.79 0.20 -1.14 0.00 0.00 176.83 175.58 3ls3 s ASN 206 N -6.21 1.61 -0.01 3.07 0.01 -1.26 -0.83 114.94 111.32 3ls3 s ASN 206 Ca -0.03 -0.22 0.01 0.00 -0.71 0.00 0.00 52.86 51.91 3ls3 s ASN 206 Cb 0.13 -0.67 0.01 0.00 0.41 0.00 0.00 41.25 41.13 3ls3 s ASN 206 CO 0.59 -0.06 -0.03 -0.69 -1.51 0.00 0.00 177.10 175.41 3ls3 s VAL 207 N 1.18 0.28 -0.21 1.60 1.01 -0.54 -1.61 120.40 122.12 3ls3 s VAL 207 Ca -0.06 -0.08 -0.07 0.00 0.00 0.00 0.00 61.98 61.77 3ls3 s VAL 207 Cb -0.14 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 3ls3 s VAL 207 CO -0.02 0.12 0.07 0.21 0.00 0.00 0.00 175.10 175.48 3ls3 s ASN 208 N 0.34 5.42 -0.05 3.32 3.84 -0.02 -0.16 114.94 127.63 3ls3 s ASN 208 Ca -0.03 -0.04 0.06 0.00 0.21 0.00 0.00 52.86 53.05 3ls3 s ASN 208 Cb -0.06 -1.95 -0.02 0.00 -0.55 0.00 0.00 41.25 38.67 3ls3 s ASN 208 CO -0.01 0.08 -0.21 -0.22 -2.79 0.00 0.00 177.10 173.96 3ls3 s LEU 209 N 0.91 2.34 -0.05 3.21 2.96 0.24 -0.12 118.68 128.18 3ls3 s LEU 209 Ca 0.04 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 53.60 3ls3 s LEU 209 Cb -0.14 -1.44 0.01 0.00 0.50 0.00 0.00 46.19 45.12 3ls3 s LEU 209 CO 0.03 0.30 -0.11 -1.00 -1.32 0.00 0.00 176.35 174.25 3ls3 s HIS 210 N -0.50 1.28 0.02 5.38 3.76 -0.14 -0.54 115.29 124.54 3ls3 s HIS 210 Ca 0.06 -0.40 0.04 0.00 -0.15 0.00 0.00 55.06 54.62 3ls3 s HIS 210 Cb -0.11 -0.93 -0.02 0.00 1.11 0.00 0.00 32.58 32.64 3ls3 s HIS 210 CO 0.01 -0.19 -0.13 -2.00 -0.85 0.00 0.00 174.74 171.58 3ls3 s GLU 211 N 0.42 0.97 -0.03 1.40 2.12 -0.46 -0.86 118.70 122.26 3ls3 s GLU 211 Ca -0.09 -0.61 0.01 0.00 0.36 0.00 0.00 54.97 54.64 3ls3 s GLU 211 Cb -0.13 -0.95 0.01 0.00 0.26 0.00 0.00 34.13 33.33 3ls3 s GLU 211 CO 0.02 0.25 -0.05 -1.58 -0.54 0.00 0.00 175.26 173.35 3ls3 s HIS 212 N -0.60 0.74 -0.03 5.30 5.65 -0.38 -1.52 115.29 124.45 3ls3 s HIS 212 Ca 0.03 -0.19 -0.01 0.00 0.25 0.00 0.00 55.06 55.14 3ls3 s HIS 212 Cb -0.06 -0.60 0.02 0.00 -1.18 0.00 0.00 32.58 30.75 3ls3 s HIS 212 CO 0.00 -0.14 0.06 0.00 -0.65 0.00 0.00 174.74 174.01 3ls3 s ALA 213 N 0.60 -0.09 -0.03 1.58 0.00 0.67 -0.95 121.76 123.55 3ls3 s ALA 213 Ca -0.08 0.25 0.01 0.00 0.00 0.00 0.00 51.96 52.14 3ls3 s ALA 213 Cb -0.11 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 22.85 3ls3 s ALA 213 CO 0.00 -0.06 -0.04 -1.83 0.00 0.00 0.00 175.76 173.83 3ls3 s GLU 214 N 0.45 0.54 0.29 0.00 -1.05 -0.69 -1.04 118.70 117.20 3ls3 s GLU 214 Ca -0.04 -0.09 -0.08 0.00 -0.15 0.00 0.00 54.97 54.61 3ls3 s GLU 214 Cb -0.05 -0.59 -0.06 0.00 -0.44 0.00 0.00 34.13 32.99 3ls3 s GLU 214 CO -0.02 -0.02 0.60 0.00 0.95 0.00 0.00 175.26 176.78 3ls3 s ALA 215 N 0.55 3.53 0.01 -0.84 0.00 -0.09 -1.01 121.76 123.92 3ls3 s ALA 215 Ca -0.06 -0.34 -0.15 0.00 0.00 0.00 0.00 51.96 51.41 3ls3 s ALA 215 Cb -0.10 -2.46 0.02 0.00 0.00 0.00 0.00 23.12 20.59 3ls3 s ALA 215 CO -0.00 0.31 0.32 -1.01 0.00 0.00 0.00 175.76 175.38 3ls3 s HIS 216 N -2.02 -0.16 0.00 0.00 3.76 -0.02 -4.53 115.29 112.32 3ls3 s HIS 216 Ca 0.47 0.15 0.00 0.00 -0.15 0.00 0.00 55.06 55.53 3ls3 s HIS 216 Cb -0.11 0.11 0.00 0.00 1.11 0.00 0.00 32.58 33.69 3ls3 s HIS 216 CO 0.26 -0.46 0.30 -1.13 -0.85 0.00 0.00 174.74 172.86 3ls3 n SER 217 N 0.91 0.00 -0.23 1.40 3.41 -1.26 -0.89 113.62 116.96 3ls3 n SER 217 Ca -0.20 -1.00 0.15 0.00 -0.26 0.00 0.00 58.87 57.56 3ls3 n SER 217 Cb 0.58 0.00 0.75 0.00 -0.26 0.00 0.00 64.21 65.27 3ls3 n SER 217 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26