#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ls3 n VAL 3 N 0.00 0.66 -2.87 2.46 0.24 -1.26 -4.55 118.33 113.00 3ls3 n VAL 3 Ca 0.00 -0.20 -0.43 0.00 -2.04 0.00 0.00 64.34 61.67 3ls3 n VAL 3 Cb 0.00 -0.70 -0.04 0.00 -1.47 0.00 0.00 33.84 31.63 3ls3 n VAL 3 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3ls3 s ILE 4 N -3.15 4.57 0.35 1.34 -1.09 -1.26 -5.01 121.20 116.96 3ls3 s ILE 4 Ca 0.09 0.76 -0.01 0.00 -2.23 0.00 0.00 60.65 59.26 3ls3 s ILE 4 Cb 0.11 -4.35 -0.04 0.00 -1.58 0.00 0.00 42.46 36.60 3ls3 s ILE 4 CO 0.56 -0.69 0.57 -0.54 -1.23 0.00 0.00 174.94 173.61 3ls3 s LYS 5 N 3.49 3.51 0.48 2.79 -0.14 -1.26 -5.01 119.74 123.60 3ls3 s LYS 5 Ca 0.35 -0.22 0.18 0.00 -1.36 0.00 0.00 55.97 54.91 3ls3 s LYS 5 Cb -0.11 -2.63 1.18 0.00 -1.68 0.00 0.00 37.83 34.58 3ls3 s LYS 5 CO 0.23 0.12 2.05 -1.35 -0.76 0.00 0.00 175.35 175.64 3ls3 h PRO 6 N 0.86 0.00 -4.39 -1.68 0.11 -1.96 -3.40 132.00 121.54 3ls3 h PRO 6 Ca -0.49 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.06 3ls3 h PRO 6 Cb 1.21 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 31.96 3ls3 h PRO 6 CO 0.62 0.13 -0.81 -0.51 -0.21 0.00 0.00 178.00 177.22 3ls3 s ASP 7 N -6.82 2.39 0.18 -2.05 1.01 -1.26 -4.02 116.67 106.09 3ls3 s ASP 7 Ca -0.04 -0.38 -0.00 0.00 0.71 0.00 0.00 52.55 52.83 3ls3 s ASP 7 Cb 0.16 -0.97 -0.04 0.00 1.01 0.00 0.00 42.92 43.07 3ls3 s ASP 7 CO 0.66 -0.10 0.08 -0.04 0.21 0.00 0.00 175.17 175.99 3ls3 s MET 8 N 1.62 1.10 0.29 8.23 -1.94 -0.04 -4.99 119.30 123.57 3ls3 s MET 8 Ca 0.05 -1.56 0.08 0.00 -1.71 0.00 0.00 55.69 52.55 3ls3 s MET 8 Cb -0.13 0.14 -0.04 0.00 2.01 0.00 0.00 34.83 36.82 3ls3 s MET 8 CO -0.09 -0.30 0.16 0.15 -0.01 0.00 0.00 175.02 174.93 3ls3 s LYS 9 N -4.07 2.63 -0.02 2.03 1.02 0.29 -0.61 119.74 121.00 3ls3 s LYS 9 Ca 0.31 -1.29 0.01 0.00 0.02 0.00 0.00 55.97 55.03 3ls3 s LYS 9 Cb 0.07 -2.38 0.01 0.00 -0.52 0.00 0.00 37.83 35.02 3ls3 s LYS 9 CO 0.07 0.27 -0.03 0.42 -0.92 0.00 0.00 175.35 175.16 3ls3 s ILE 10 N -2.27 0.35 -0.07 2.17 1.01 -0.41 -0.35 121.20 121.63 3ls3 s ILE 10 Ca 0.35 -0.12 0.02 0.00 0.00 0.00 0.00 60.65 60.91 3ls3 s ILE 10 Cb -0.06 -0.35 0.01 0.00 0.01 0.00 0.00 42.46 42.07 3ls3 s ILE 10 CO 0.24 0.14 -0.14 -0.54 0.00 0.00 0.00 174.94 174.64 3ls3 s LYS 11 N 0.35 1.87 0.04 2.79 1.02 0.48 -1.19 119.74 125.10 3ls3 s LYS 11 Ca -0.04 -0.47 0.00 0.00 0.02 0.00 0.00 55.97 55.49 3ls3 s LYS 11 Cb -0.07 -1.52 -0.03 0.00 -0.52 0.00 0.00 37.83 35.68 3ls3 s LYS 11 CO -0.00 0.04 -0.04 -0.48 -0.92 0.00 0.00 175.35 173.94 3ls3 s LEU 12 N 0.65 2.37 -0.03 3.17 0.05 -0.38 -1.03 118.68 123.49 3ls3 s LEU 12 Ca -0.15 -0.75 -0.01 0.00 0.05 0.00 0.00 54.13 53.27 3ls3 s LEU 12 Cb -0.16 0.08 0.03 0.00 -2.05 0.00 0.00 46.19 44.09 3ls3 s LEU 12 CO 0.04 -0.42 0.03 -0.60 -0.55 0.00 0.00 176.35 174.86 3ls3 s ARG 13 N -2.68 0.02 -0.16 1.48 3.52 -0.90 -1.18 118.95 119.06 3ls3 s ARG 13 Ca -0.03 0.23 -0.06 0.00 -0.13 0.00 0.00 55.73 55.73 3ls3 s ARG 13 Cb -0.01 -0.39 -0.04 0.00 -1.56 0.00 0.00 34.95 32.95 3ls3 s ARG 13 CO -0.05 -0.22 0.05 1.41 -0.81 0.00 0.00 175.30 175.69 3ls3 s MET 14 N 1.42 3.75 0.02 5.12 -2.45 0.25 -1.13 119.30 126.29 3ls3 s MET 14 Ca -0.04 -0.35 0.08 0.00 -1.25 0.00 0.00 55.69 54.13 3ls3 s MET 14 Cb -0.13 -3.11 -0.02 0.00 1.25 0.00 0.00 34.83 32.81 3ls3 s MET 14 CO -0.03 0.38 -0.25 -1.21 1.05 0.00 0.00 175.02 174.97 3ls3 s GLU 15 N 0.04 1.80 0.05 4.11 2.02 -0.60 -1.05 118.70 125.07 3ls3 s GLU 15 Ca 0.05 -0.99 -0.05 0.00 0.02 0.00 0.00 54.97 53.99 3ls3 s GLU 15 Cb -0.12 -1.87 0.02 0.00 0.10 0.00 0.00 34.13 32.25 3ls3 s GLU 15 CO 0.01 0.50 0.24 0.41 0.02 0.00 0.00 175.26 176.44 3ls3 n GLY 16 N 2.05 1.18 3.44 -1.39 0.00 -0.37 -1.47 105.19 108.62 3ls3 n GLY 16 Ca -0.16 -0.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.25 -1.35 -0.10 4.61 0.00 -0.47 -1.00 121.76 122.20 3ls3 s ALA 17 Ca 0.05 1.37 0.01 0.00 0.00 0.00 0.00 51.96 53.39 3ls3 s ALA 17 Cb -0.01 -0.65 0.02 0.00 0.00 0.00 0.00 23.12 22.49 3ls3 s ALA 17 CO 0.01 -0.28 -0.12 0.08 0.00 0.00 0.00 175.76 175.46 3ls3 s VAL 18 N -0.13 1.23 -1.33 0.00 1.01 -0.68 -0.95 120.40 119.54 3ls3 s VAL 18 Ca -0.03 -0.47 -0.09 0.00 0.00 0.00 0.00 61.98 61.39 3ls3 s VAL 18 Cb -0.03 -1.17 0.06 0.00 0.00 0.00 0.00 36.38 35.24 3ls3 s VAL 18 CO 0.03 0.39 0.52 0.59 0.00 0.00 0.00 175.10 176.63 3ls3 n ASN 19 N 4.40 -4.11 0.00 3.32 4.13 0.49 -1.05 115.26 122.45 3ls3 n ASN 19 Ca -0.18 -0.39 0.00 0.00 1.68 0.00 0.00 54.58 55.69 3ls3 n ASN 19 Cb 0.51 -3.38 0.00 0.00 -1.54 0.00 0.00 39.78 35.37 3ls3 n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ls3 n GLY 20 N -1.24 1.57 3.57 7.41 0.00 -1.26 -5.01 105.19 110.23 3ls3 n GLY 20 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.60 2.95 0.56 1.61 5.04 -0.21 -5.02 115.29 116.61 3ls3 s HIS 21 Ca 0.00 0.46 -0.16 0.00 -1.54 0.00 0.00 55.06 53.82 3ls3 s HIS 21 Cb 0.00 -3.92 -0.06 0.00 0.04 0.00 0.00 32.58 28.64 3ls3 s HIS 21 CO 0.00 -1.06 1.02 -1.25 -2.34 0.00 0.00 174.74 171.11 3ls3 s PRO 22 N 3.72 3.67 0.25 2.88 0.04 -1.26 -1.69 135.00 142.60 3ls3 s PRO 22 Ca 0.37 1.02 -0.21 0.00 0.04 0.00 0.00 61.00 62.22 3ls3 s PRO 22 Cb -0.10 -2.09 0.03 0.00 0.04 0.00 0.00 34.50 32.38 3ls3 s PRO 22 CO 0.25 -0.51 0.68 -0.59 0.04 0.00 0.00 177.00 176.87 3ls3 s PHE 23 N -2.64 -0.28 -0.09 0.56 -0.12 -0.17 -4.31 117.98 110.94 3ls3 s PHE 23 Ca 0.60 -0.11 -0.11 0.00 -0.05 0.00 0.00 56.93 57.26 3ls3 s PHE 23 Cb -0.12 0.66 0.03 0.00 -0.63 0.00 0.00 43.02 42.95 3ls3 s PHE 23 CO 0.36 -1.13 0.28 0.00 -0.05 0.00 0.00 175.22 174.69 3ls3 s ALA 24 N -3.87 -0.70 -0.01 1.99 0.00 -0.57 -1.24 121.76 117.35 3ls3 s ALA 24 Ca 0.08 0.68 0.03 0.00 0.00 0.00 0.00 51.96 52.75 3ls3 s ALA 24 Cb -0.05 -0.35 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 3ls3 s ALA 24 CO 0.02 -0.16 -0.09 0.42 0.00 0.00 0.00 175.76 175.95 3ls3 s ILE 25 N -0.18 0.69 0.06 0.00 1.01 -0.22 -0.62 121.20 121.95 3ls3 s ILE 25 Ca -0.03 -0.36 0.08 0.00 0.00 0.00 0.00 60.65 60.34 3ls3 s ILE 25 Cb -0.03 -0.59 -0.03 0.00 0.01 0.00 0.00 42.46 41.82 3ls3 s ILE 25 CO 0.01 0.20 -0.21 -1.61 0.00 0.00 0.00 174.94 173.34 3ls3 s GLU 26 N -0.12 1.90 0.02 2.79 2.02 -0.35 -0.58 118.70 124.38 3ls3 s GLU 26 Ca 0.02 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 53.93 3ls3 s GLU 26 Cb -0.04 -2.11 -0.02 0.00 0.10 0.00 0.00 34.13 32.06 3ls3 s GLU 26 CO -0.00 0.52 -0.03 0.20 0.02 0.00 0.00 175.26 175.96 3ls3 s GLY 27 N -1.59 0.28 -0.01 -1.39 0.00 -0.33 -0.43 107.32 103.86 3ls3 s GLY 27 Ca 0.15 -0.67 0.02 0.00 0.00 0.00 0.00 44.72 44.22 3ls3 s GLY 27 CO 0.06 -0.74 -0.08 -1.34 0.00 0.00 0.00 173.10 171.00 3ls3 s VAL 28 N -1.72 0.64 0.36 1.40 -7.23 -0.74 -1.25 120.40 111.86 3ls3 s VAL 28 Ca -0.13 -0.34 -0.05 0.00 -1.81 0.00 0.00 61.98 59.65 3ls3 s VAL 28 Cb -0.08 -0.55 0.02 0.00 0.56 0.00 0.00 36.38 36.33 3ls3 s VAL 28 CO -0.02 0.19 0.56 0.61 -0.31 0.00 0.00 175.10 176.12 3ls3 n GLY 29 N 2.95 1.85 2.89 2.32 0.00 -0.33 -0.90 105.19 113.97 3ls3 n GLY 29 Ca -0.14 -1.53 -0.12 0.00 0.00 0.00 0.00 46.02 44.23 3ls3 n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ls3 s LEU 30 N 0.00 2.01 0.16 0.99 1.02 -0.05 -1.29 118.68 121.52 3ls3 s LEU 30 Ca 0.26 -0.06 -0.11 0.00 0.02 0.00 0.00 54.13 54.24 3ls3 s LEU 30 Cb -0.02 0.04 0.00 0.00 0.02 0.00 0.00 46.19 46.23 3ls3 s LEU 30 CO 0.19 -0.05 0.33 -0.83 0.02 0.00 0.00 176.35 176.01 3ls3 s GLY 31 N -0.22 0.28 -0.47 -3.19 0.00 0.22 -0.68 107.32 103.26 3ls3 s GLY 31 Ca -0.02 -0.68 0.04 0.00 0.00 0.00 0.00 44.72 44.05 3ls3 s GLY 31 CO -0.00 -0.69 0.21 0.54 0.00 0.00 0.00 173.10 173.16 3ls3 s LYS 32 N -3.93 1.78 0.37 2.90 1.02 0.14 -0.86 119.74 121.16 3ls3 s LYS 32 Ca 0.13 -2.38 0.10 0.00 0.02 0.00 0.00 55.97 53.84 3ls3 s LYS 32 Cb 0.03 -3.16 0.86 0.00 -0.52 0.00 0.00 37.83 35.03 3ls3 s LYS 32 CO -0.02 -1.08 1.90 -1.35 -0.92 0.00 0.00 175.35 173.88 3ls3 h PRO 33 N 6.77 0.62 0.00 -1.68 0.11 -1.77 -1.22 132.00 134.83 3ls3 h PRO 33 Ca -0.07 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.95 3ls3 h PRO 33 Cb 0.92 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.88 3ls3 h PRO 33 CO 0.63 0.41 -0.45 0.74 -0.21 0.00 0.00 178.00 179.12 3ls3 h PHE 34 N 0.64 0.00 -0.01 0.65 -1.00 -1.84 -3.14 116.94 112.24 3ls3 h PHE 34 Ca 0.40 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.18 3ls3 h PHE 34 Cb 0.65 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.21 3ls3 h PHE 34 CO -0.00 0.27 -0.39 0.39 -1.61 0.00 0.00 178.31 176.97 3ls3 n GLU 35 N -3.09 0.86 -3.29 1.51 1.02 -0.81 -4.45 120.64 112.39 3ls3 n GLU 35 Ca 0.01 -0.60 -0.18 0.00 -0.02 0.00 0.00 57.16 56.38 3ls3 n GLU 35 Cb 0.65 -1.49 0.06 0.00 -0.02 0.00 0.00 31.44 30.64 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 1.39 -0.17 3.10 0.62 0.00 -0.53 -4.58 105.19 105.02 3ls3 n GLY 36 Ca 0.10 0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 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 -5.94 1.00 0.05 1.61 1.02 -1.07 -1.11 119.74 115.30 3ls3 s LYS 37 Ca 0.43 -0.55 -0.13 0.00 0.02 0.00 0.00 55.97 55.73 3ls3 s LYS 37 Cb -0.19 -0.98 0.02 0.00 -0.52 0.00 0.00 37.83 36.16 3ls3 s LYS 37 CO 0.53 0.26 0.29 1.14 -0.92 0.00 0.00 175.35 176.65 3ls3 s GLN 38 N -0.58 0.83 -0.00 1.68 -2.07 -0.67 0.27 119.66 119.11 3ls3 s GLN 38 Ca 0.04 -0.57 0.00 0.00 -1.82 0.00 0.00 55.36 53.01 3ls3 s GLN 38 Cb -0.06 0.35 0.01 0.00 -1.09 0.00 0.00 33.01 32.22 3ls3 s GLN 38 CO 0.00 -0.27 0.00 0.45 -1.32 0.00 0.00 175.29 174.15 3ls3 s SER 39 N -2.20 0.05 0.03 12.60 0.15 0.14 -1.51 113.70 122.96 3ls3 s SER 39 Ca -0.03 0.00 -0.05 0.00 0.70 0.00 0.00 55.95 56.57 3ls3 s SER 39 Cb -0.00 -0.02 -0.01 0.00 -1.71 0.00 0.00 66.02 64.28 3ls3 s SER 39 CO -0.05 -0.02 0.09 0.00 1.20 0.00 0.00 173.24 174.46 3ls3 s MET 40 N 0.20 0.56 -0.20 5.44 0.23 -0.16 -0.87 119.30 124.52 3ls3 s MET 40 Ca -0.02 -0.71 -0.05 0.00 -1.03 0.00 0.00 55.69 53.88 3ls3 s MET 40 Cb -0.03 0.22 -0.02 0.00 -1.53 0.00 0.00 34.83 33.47 3ls3 s MET 40 CO -0.01 -0.14 -0.00 -0.51 -2.03 0.00 0.00 175.02 172.34 3ls3 s ASP 41 N -2.01 4.85 -0.08 -1.18 1.01 -0.07 -1.01 116.67 118.17 3ls3 s ASP 41 Ca -0.07 -0.19 0.05 0.00 0.71 0.00 0.00 52.55 53.06 3ls3 s ASP 41 Cb -0.02 -1.83 -0.01 0.00 1.01 0.00 0.00 42.92 42.07 3ls3 s ASP 41 CO -0.04 0.08 -0.23 -0.76 0.21 0.00 0.00 175.17 174.43 3ls3 s LEU 42 N 0.93 2.16 -0.13 1.23 1.43 0.73 -1.80 118.68 123.23 3ls3 s LEU 42 Ca 0.01 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.64 3ls3 s LEU 42 Cb -0.14 -1.41 0.01 0.00 0.03 0.00 0.00 46.19 44.68 3ls3 s LEU 42 CO 0.02 0.22 -0.19 -0.54 0.23 0.00 0.00 176.35 176.08 3ls3 s LYS 43 N -0.00 2.72 0.04 1.70 1.02 0.43 -1.59 119.74 124.06 3ls3 s LYS 43 Ca -0.08 -0.74 -0.30 0.00 0.02 0.00 0.00 55.97 54.86 3ls3 s LYS 43 Cb -0.15 -2.24 -0.07 0.00 -0.52 0.00 0.00 37.83 34.85 3ls3 s LYS 43 CO 0.05 -0.05 1.58 0.08 -0.92 0.00 0.00 175.35 176.09 3ls3 s VAL 44 N 0.92 3.27 -0.21 3.17 1.01 -0.42 -1.21 120.40 126.93 3ls3 s VAL 44 Ca -0.06 0.68 0.12 0.00 0.00 0.00 0.00 61.98 62.72 3ls3 s VAL 44 Cb -0.15 -3.44 -0.22 0.00 0.00 0.00 0.00 36.38 32.57 3ls3 s VAL 44 CO -0.03 -0.01 -0.03 0.29 0.00 0.00 0.00 175.10 175.33 3ls3 n LYS 45 N 5.63 0.74 -3.86 2.72 4.76 0.21 -4.88 118.16 123.47 3ls3 n LYS 45 Ca 0.15 0.04 -0.12 0.00 -2.87 0.00 0.00 58.31 55.51 3ls3 n LYS 45 Cb 0.42 -1.50 -0.12 0.00 -1.84 0.00 0.00 35.03 31.98 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 -2.48 0.21 0.00 1.97 2.02 -0.93 -4.89 118.70 114.59 3ls3 s GLU 46 Ca -0.18 -0.03 0.00 0.00 0.02 0.00 0.00 54.97 54.78 3ls3 s GLU 46 Cb 0.07 0.09 0.00 0.00 0.10 0.00 0.00 34.13 34.39 3ls3 s GLU 46 CO 0.73 -0.04 0.00 0.41 0.02 0.00 0.00 175.26 176.39 3ls3 n GLY 47 N 2.59 0.68 3.94 -1.39 0.00 -1.26 -1.51 105.19 108.23 3ls3 n GLY 47 Ca -0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.97 1.49 0.39 -0.02 0.00 -1.26 -4.06 107.32 101.88 3ls3 s GLY 48 Ca 0.00 -0.88 -0.26 0.00 0.00 0.00 0.00 44.72 43.59 3ls3 s GLY 48 CO 0.00 -0.73 1.19 2.56 0.00 0.00 0.00 173.10 176.12 3ls3 s PRO 49 N -4.56 4.09 0.31 2.90 0.04 -1.26 -5.08 135.00 131.44 3ls3 s PRO 49 Ca 0.46 1.90 -0.29 0.00 0.04 0.00 0.00 61.00 63.12 3ls3 s PRO 49 Cb -0.10 -2.74 -0.10 0.00 0.04 0.00 0.00 34.50 31.60 3ls3 s PRO 49 CO 0.39 -0.31 1.26 -0.51 0.04 0.00 0.00 177.00 177.88 3ls3 s LEU 50 N -2.38 4.46 -0.15 -3.56 1.43 -1.26 -4.88 118.68 112.34 3ls3 s LEU 50 Ca 0.56 2.57 0.03 0.00 -1.03 0.00 0.00 54.13 56.26 3ls3 s LEU 50 Cb -0.32 -3.64 0.30 0.00 0.03 0.00 0.00 46.19 42.55 3ls3 s LEU 50 CO 0.41 -0.44 1.24 -0.81 0.23 0.00 0.00 176.35 176.97 3ls3 n PRO 51 N 1.02 1.94 -3.94 1.29 -0.04 -1.26 -4.87 135.00 129.14 3ls3 n PRO 51 Ca 0.00 -1.26 -0.10 0.00 -0.04 0.00 0.00 63.50 62.11 3ls3 n PRO 51 Cb 0.43 -1.61 -0.06 0.00 -0.04 0.00 0.00 33.50 32.21 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 -1.49 0.33 0.04 0.54 -0.12 -1.26 -4.75 117.98 111.26 3ls3 s PHE 52 Ca 0.23 -0.68 -0.31 0.00 -0.05 0.00 0.00 56.93 56.12 3ls3 s PHE 52 Cb 0.19 0.04 -0.10 0.00 -0.63 0.00 0.00 43.02 42.53 3ls3 s PHE 52 CO 0.05 -0.80 1.95 0.00 -0.05 0.00 0.00 175.22 176.37 3ls3 n ALA 53 N -0.27 1.61 0.13 1.99 0.00 0.39 -4.88 120.51 119.49 3ls3 n ALA 53 Ca -0.07 0.23 0.13 0.00 0.00 0.00 0.00 53.44 53.74 3ls3 n ALA 53 Cb 0.63 -2.65 0.65 0.00 0.00 0.00 0.00 19.45 18.08 3ls3 n ALA 53 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 3ls3 h TYR 54 N 10.14 0.03 -0.03 0.00 3.20 -1.94 -2.46 116.97 125.90 3ls3 h TYR 54 Ca -0.49 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.39 3ls3 h TYR 54 Cb 1.24 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 39.50 3ls3 h TYR 54 CO 0.92 0.01 0.06 -0.44 -1.64 0.00 0.00 178.16 177.07 3ls3 h ASP 55 N 0.03 0.00 0.61 -2.11 3.32 -1.96 -1.19 116.42 115.12 3ls3 h ASP 55 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3ls3 h ASP 55 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 3ls3 h ASP 55 CO -0.00 0.00 0.00 2.30 -1.72 0.00 0.00 179.24 179.82 3ls3 n ILE 56 N -3.53 0.91 0.22 0.35 -5.35 -0.93 -3.11 119.36 107.92 3ls3 n ILE 56 Ca -0.02 0.23 0.11 0.00 -0.27 0.00 0.00 62.75 62.80 3ls3 n ILE 56 Cb 0.14 -1.05 -0.11 0.00 -1.74 0.00 0.00 39.64 36.88 3ls3 n ILE 56 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3ls3 n LEU 57 N -1.80 0.34 0.07 7.28 4.77 -0.45 -4.73 117.00 122.49 3ls3 n LEU 57 Ca 0.03 -0.01 -0.04 0.00 -0.03 0.00 0.00 56.01 55.95 3ls3 n LEU 57 Cb 0.20 -0.02 0.15 0.00 -2.33 0.00 0.00 43.42 41.42 3ls3 n LEU 57 CO 0.16 0.01 0.55 0.71 -1.33 0.00 0.00 177.39 177.50 3ls3 h THR 58 N 0.00 1.34 0.00 -5.08 1.35 -1.62 -1.55 112.91 107.36 3ls3 h THR 58 Ca 0.00 -1.74 0.00 0.00 -0.55 0.00 0.00 66.41 64.12 3ls3 h THR 58 Cb 0.90 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 3ls3 h THR 58 CO 0.00 0.52 0.00 0.24 -0.25 0.00 0.00 175.52 176.03 3ls3 h MET 59 N 0.24 0.00 -0.14 4.72 2.86 -1.85 -2.78 114.93 117.98 3ls3 h MET 59 Ca 0.01 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.47 3ls3 h MET 59 Cb 0.97 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.63 3ls3 h MET 59 CO 0.08 0.00 -0.64 0.00 1.06 0.00 0.00 176.91 177.41 3ls3 h ALA 60 N 2.04 0.62 0.00 6.32 0.00 -1.59 -3.45 119.26 123.20 3ls3 h ALA 60 Ca 0.00 -0.55 -0.42 0.00 0.00 0.00 0.00 54.91 53.94 3ls3 h ALA 60 Cb 0.60 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.34 3ls3 h ALA 60 CO 0.00 0.71 2.41 1.19 0.00 0.00 0.00 179.25 183.56 3ls3 n PHE 61 N -3.91 1.37 0.00 0.00 0.99 -1.05 -5.04 117.46 109.82 3ls3 n PHE 61 Ca -0.04 -1.80 0.00 0.00 -0.00 0.00 0.00 57.45 55.61 3ls3 n PHE 61 Cb 0.66 -1.59 0.00 0.00 -1.00 0.00 0.00 39.48 37.55 3ls3 n PHE 61 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 3ls3 n ASN 65 N 5.12 0.00 0.00 4.37 2.85 -1.26 -5.14 115.26 121.20 3ls3 n ASN 65 Ca 0.42 0.00 0.07 0.00 -0.11 0.00 0.00 54.58 54.97 3ls3 n ASN 65 Cb 0.19 0.00 0.44 0.00 1.24 0.00 0.00 39.78 41.65 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 0.69 0.26 1.20 3.00 -1.26 -2.28 116.66 118.28 3ls3 n ARG 66 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.85 57.97 3ls3 n ARG 66 Cb 0.00 -1.33 0.71 0.00 0.00 0.00 0.00 32.46 31.84 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 0.66 -1.53 5.15 3.04 -1.95 -3.24 116.25 118.38 3ls3 h VAL 67 Ca 0.00 -0.49 -0.76 0.00 -1.01 0.00 0.00 66.70 64.44 3ls3 h VAL 67 Cb 0.00 1.30 -0.17 0.00 -2.01 0.00 0.00 31.29 30.42 3ls3 h VAL 67 CO 0.00 0.12 1.92 0.49 -1.01 0.00 0.00 177.57 179.09 3ls3 n PHE 68 N -3.78 2.81 -3.71 3.17 3.72 -0.97 -4.64 117.46 114.07 3ls3 n PHE 68 Ca -0.02 -2.76 -0.11 0.00 -0.05 0.00 0.00 57.45 54.51 3ls3 n PHE 68 Cb 0.22 -1.86 -0.11 0.00 -0.94 0.00 0.00 39.48 36.80 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 -0.11 -1.04 -0.50 4.37 0.00 -1.22 -4.43 121.76 118.83 3ls3 s ALA 69 Ca 0.40 1.40 -0.29 0.00 0.00 0.00 0.00 51.96 53.47 3ls3 s ALA 69 Cb 0.10 -0.84 0.03 0.00 0.00 0.00 0.00 23.12 22.40 3ls3 s ALA 69 CO 0.01 -0.24 1.20 0.21 0.00 0.00 0.00 175.76 176.94 3ls3 s LYS 70 N 1.00 3.63 -0.21 0.00 2.20 -0.66 -4.53 119.74 121.16 3ls3 s LYS 70 Ca -0.06 0.53 -0.10 0.00 -0.36 0.00 0.00 55.97 55.97 3ls3 s LYS 70 Cb -0.07 -3.96 -0.05 0.00 -1.51 0.00 0.00 37.83 32.24 3ls3 s LYS 70 CO -0.08 -1.52 0.13 0.71 -0.36 0.00 0.00 175.35 174.23 3ls3 s TYR 71 N 4.81 3.36 0.92 4.03 2.02 -1.26 -0.73 117.35 130.50 3ls3 s TYR 71 Ca 0.49 0.27 -0.12 0.00 -0.37 0.00 0.00 57.07 57.34 3ls3 s TYR 71 Cb -0.08 -2.19 0.14 0.00 -0.40 0.00 0.00 41.96 39.43 3ls3 s TYR 71 CO 0.30 0.20 1.09 -1.25 -1.57 0.00 0.00 175.55 174.33 3ls3 s PRO 72 N 0.58 1.08 0.53 -1.71 0.04 -1.26 -4.94 135.00 129.33 3ls3 s PRO 72 Ca 0.07 0.70 0.31 0.00 0.04 0.00 0.00 61.00 62.12 3ls3 s PRO 72 Cb -0.12 -1.80 1.46 0.00 0.04 0.00 0.00 34.50 34.09 3ls3 s PRO 72 CO 0.00 -2.33 2.04 1.49 0.04 0.00 0.00 177.00 178.25 3ls3 h GLU 73 N -1.61 0.00 -0.53 4.56 4.81 -2.00 -2.88 114.58 116.94 3ls3 h GLU 73 Ca -0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3ls3 h GLU 73 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 3ls3 h GLU 73 CO 0.56 0.09 0.00 0.27 -0.73 0.00 0.00 179.01 179.20 3ls3 n ASN 74 N -3.37 2.87 -4.09 1.04 6.94 -1.26 -4.78 115.26 112.60 3ls3 n ASN 74 Ca -0.01 -2.06 -0.28 0.00 -0.02 0.00 0.00 54.58 52.21 3ls3 n ASN 74 Cb 0.27 -0.37 -0.17 0.00 -2.36 0.00 0.00 39.78 37.15 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 -1.40 1.53 0.18 1.53 1.01 -1.09 -5.06 121.20 117.91 3ls3 s ILE 75 Ca 0.34 -0.70 -0.31 0.00 0.00 0.00 0.00 60.65 59.99 3ls3 s ILE 75 Cb 0.19 -1.37 -0.10 0.00 0.01 0.00 0.00 42.46 41.19 3ls3 s ILE 75 CO 0.22 0.44 1.50 -0.69 0.00 0.00 0.00 174.94 176.41 3ls3 s VAL 76 N 0.68 2.75 -0.70 2.92 1.01 -1.26 -4.72 120.40 121.08 3ls3 s VAL 76 Ca -0.13 0.56 -0.16 0.00 0.00 0.00 0.00 61.98 62.25 3ls3 s VAL 76 Cb -0.16 -3.36 0.17 0.00 0.00 0.00 0.00 36.38 33.03 3ls3 s VAL 76 CO 0.03 0.06 0.68 -0.62 0.00 0.00 0.00 175.10 175.25 3ls3 s ASP 77 N 0.91 6.47 0.38 3.32 -1.08 -1.26 -4.63 116.67 120.77 3ls3 s ASP 77 Ca 0.66 -2.17 0.04 0.00 -0.52 0.00 0.00 52.55 50.57 3ls3 s ASP 77 Cb -0.42 -2.23 0.73 0.00 -1.46 0.00 0.00 42.92 39.54 3ls3 s ASP 77 CO 0.34 -0.77 2.03 0.22 0.52 0.00 0.00 175.17 177.51 3ls3 h TYR 78 N 8.43 0.66 0.04 -5.34 3.20 -1.93 -3.02 116.97 119.01 3ls3 h TYR 78 Ca -0.09 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.71 3ls3 h TYR 78 Cb 1.07 -0.22 0.01 0.00 1.54 0.00 0.00 36.73 39.12 3ls3 h TYR 78 CO 0.91 0.43 -0.33 0.74 -1.64 0.00 0.00 178.16 178.26 3ls3 h PHE 79 N 0.71 0.25 -0.14 -3.82 -1.00 -1.91 -3.13 116.94 107.90 3ls3 h PHE 79 Ca 0.19 -0.17 -0.04 0.00 2.81 0.00 0.00 57.97 60.77 3ls3 h PHE 79 Cb -0.06 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.47 3ls3 h PHE 79 CO 0.00 1.07 -0.08 0.87 -1.61 0.00 0.00 178.31 178.57 3ls3 h LYS 80 N -0.64 0.21 0.00 1.51 1.57 -1.89 -2.27 116.57 115.06 3ls3 h LYS 80 Ca -0.05 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 3ls3 h LYS 80 Cb 1.20 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 3ls3 h LYS 80 CO 0.06 0.30 -0.24 1.96 -0.57 0.00 0.00 179.45 180.97 3ls3 h GLN 81 N 0.20 0.00 0.00 3.15 4.20 -1.56 -3.26 115.11 117.85 3ls3 h GLN 81 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 3ls3 h GLN 81 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3ls3 h GLN 81 CO 0.01 0.24 0.00 -1.13 -0.67 0.00 0.00 178.83 177.28 3ls3 n SER 82 N -3.66 0.74 -4.89 1.46 3.41 -0.85 -4.78 113.62 105.04 3ls3 n SER 82 Ca -0.01 0.61 -0.29 0.00 -0.26 0.00 0.00 58.87 58.92 3ls3 n SER 82 Cb 0.36 -0.79 -0.03 0.00 -0.26 0.00 0.00 64.21 63.49 3ls3 n SER 82 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3ls3 s PHE 83 N -3.19 3.49 -0.10 7.33 0.40 -1.23 -0.45 117.98 124.23 3ls3 s PHE 83 Ca 0.08 0.83 0.28 0.00 -0.60 0.00 0.00 56.93 57.51 3ls3 s PHE 83 Cb 0.11 -2.27 0.88 0.00 0.51 0.00 0.00 43.02 42.25 3ls3 s PHE 83 CO 0.51 -0.01 1.80 -1.00 0.70 0.00 0.00 175.22 177.22 3ls3 h PRO 84 N 1.26 0.00 -0.82 0.24 0.13 -1.91 -3.45 132.00 127.44 3ls3 h PRO 84 Ca -0.47 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.62 3ls3 h PRO 84 Cb 1.19 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 3ls3 h PRO 84 CO 0.64 0.05 0.38 0.93 -0.23 0.00 0.00 178.00 179.78 3ls3 h GLU 85 N 0.00 1.19 0.00 0.86 3.07 -1.93 -3.30 114.58 114.48 3ls3 h GLU 85 Ca -0.00 -0.18 0.00 0.00 -0.50 0.00 0.00 59.36 58.68 3ls3 h GLU 85 Cb 0.76 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 3ls3 h GLU 85 CO 0.01 0.93 0.00 0.41 -1.40 0.00 0.00 179.01 178.95 3ls3 n GLY 86 N -1.00 -1.45 3.74 -3.84 0.00 0.41 -4.63 105.19 98.43 3ls3 n GLY 86 Ca 0.08 -1.97 -0.08 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.01 0.20 1.61 1.13 -0.95 -1.90 117.35 117.43 3ls3 s TYR 87 Ca 0.00 -0.41 0.08 0.00 -1.41 0.00 0.00 57.07 55.33 3ls3 s TYR 87 Cb 0.00 0.51 -0.05 0.00 -1.10 0.00 0.00 41.96 41.32 3ls3 s TYR 87 CO 0.00 -1.13 -0.15 -1.54 -2.51 0.00 0.00 175.55 170.22 3ls3 s SER 88 N -2.95 2.60 0.08 -0.18 1.04 -0.48 -0.86 113.70 112.95 3ls3 s SER 88 Ca 0.15 -0.99 0.03 0.00 0.48 0.00 0.00 55.95 55.61 3ls3 s SER 88 Cb -0.04 -0.14 -0.04 0.00 0.10 0.00 0.00 66.02 65.90 3ls3 s SER 88 CO 0.07 -0.14 -0.08 -1.66 0.98 0.00 0.00 173.24 172.40 3ls3 s TRP 89 N -2.78 0.90 -0.01 5.02 1.48 -0.29 -0.43 118.94 122.83 3ls3 s TRP 89 Ca 0.21 -0.71 0.04 0.00 -1.06 0.00 0.00 56.10 54.58 3ls3 s TRP 89 Cb -0.02 -0.51 -0.01 0.00 -1.16 0.00 0.00 33.47 31.77 3ls3 s TRP 89 CO 0.07 -0.08 -0.12 -1.21 -4.06 0.00 0.00 176.95 171.56 3ls3 s GLU 90 N -2.87 0.96 -0.11 3.25 2.02 -0.40 -1.28 118.70 120.27 3ls3 s GLU 90 Ca 0.04 -0.41 -0.09 0.00 0.02 0.00 0.00 54.97 54.52 3ls3 s GLU 90 Cb -0.02 -0.92 0.03 0.00 0.10 0.00 0.00 34.13 33.32 3ls3 s GLU 90 CO -0.02 0.24 0.28 0.50 0.02 0.00 0.00 175.26 176.29 3ls3 s ARG 91 N -0.24 0.32 -0.02 1.61 3.52 0.37 -0.74 118.95 123.77 3ls3 s ARG 91 Ca 0.04 0.42 0.05 0.00 -0.13 0.00 0.00 55.73 56.10 3ls3 s ARG 91 Cb -0.05 0.13 -0.03 0.00 -1.56 0.00 0.00 34.95 33.44 3ls3 s ARG 91 CO -0.00 -0.05 -0.15 -1.54 -0.81 0.00 0.00 175.30 172.74 3ls3 s SER 92 N 0.30 3.97 -0.17 -2.12 1.04 -0.15 -0.80 113.70 115.77 3ls3 s SER 92 Ca -0.01 -0.27 -0.00 0.00 0.48 0.00 0.00 55.95 56.14 3ls3 s SER 92 Cb -0.03 -0.78 0.04 0.00 0.10 0.00 0.00 66.02 65.36 3ls3 s SER 92 CO -0.01 0.31 -0.06 -0.04 0.98 0.00 0.00 173.24 174.43 3ls3 s MET 93 N -1.00 1.51 -0.29 4.02 -1.94 0.97 -0.84 119.30 121.73 3ls3 s MET 93 Ca 0.13 -0.57 -0.03 0.00 -1.71 0.00 0.00 55.69 53.51 3ls3 s MET 93 Cb -0.11 -2.08 0.04 0.00 2.01 0.00 0.00 34.83 34.69 3ls3 s MET 93 CO 0.03 -0.44 -0.01 0.42 -0.01 0.00 0.00 175.02 175.01 3ls3 s ILE 94 N 1.60 3.10 0.35 2.53 1.01 0.14 -0.94 121.20 128.99 3ls3 s ILE 94 Ca 0.00 -1.18 -0.12 0.00 0.00 0.00 0.00 60.65 59.36 3ls3 s ILE 94 Cb -0.16 -2.70 -0.07 0.00 0.01 0.00 0.00 42.46 39.55 3ls3 s ILE 94 CO -0.08 0.01 0.72 -0.31 0.00 0.00 0.00 174.94 175.28 3ls3 s TYR 95 N 1.31 3.43 -0.11 3.97 1.51 0.28 -1.11 117.35 126.64 3ls3 s TYR 95 Ca -0.02 1.06 0.28 0.00 -1.01 0.00 0.00 57.07 57.38 3ls3 s TYR 95 Cb -0.18 -2.43 1.34 0.00 -0.11 0.00 0.00 41.96 40.57 3ls3 s TYR 95 CO -0.02 0.02 1.85 1.05 -1.11 0.00 0.00 175.55 177.34 3ls3 h GLU 96 N 1.75 0.00 -0.50 -0.62 4.11 -1.54 -1.95 114.58 115.84 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 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3ls3 h GLU 96 CO 0.65 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.33 3ls3 n ASP 97 N -2.53 3.57 0.00 3.06 5.75 -1.26 -4.94 116.55 120.20 3ls3 n ASP 97 Ca -0.00 -1.98 0.00 0.00 -0.01 0.00 0.00 54.79 52.80 3ls3 n ASP 97 Cb 0.16 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 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 1.47 1.14 3.75 6.12 0.00 -0.73 -4.76 105.19 112.17 3ls3 n GLY 98 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.17 2.06 -0.04 -0.02 0.00 -1.22 -4.77 107.32 101.15 3ls3 s GLY 99 Ca 0.00 1.57 0.01 0.00 0.00 0.00 0.00 44.72 46.31 3ls3 s GLY 99 CO 0.00 2.57 -0.06 -0.42 0.00 0.00 0.00 173.10 175.19 3ls3 s ILE 100 N 0.08 0.64 -0.00 0.90 1.01 -0.64 -0.55 121.20 122.63 3ls3 s ILE 100 Ca 0.64 -0.21 0.08 0.00 0.00 0.00 0.00 60.65 61.16 3ls3 s ILE 100 Cb -0.48 -0.63 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 3ls3 s ILE 100 CO 0.47 0.24 -0.24 0.00 0.00 0.00 0.00 174.94 175.41 3ls3 s ASN 102 N -0.85 3.42 0.07 0.00 0.01 0.13 -0.02 114.94 117.69 3ls3 s ASN 102 Ca 0.11 -0.55 -0.10 0.00 -0.71 0.00 0.00 52.86 51.60 3ls3 s ASN 102 Cb -0.10 -0.40 0.01 0.00 0.41 0.00 0.00 41.25 41.17 3ls3 s ASN 102 CO 0.00 0.25 0.23 0.00 -1.51 0.00 0.00 177.10 176.07 3ls3 s ALA 103 N -0.88 -0.41 0.05 0.60 0.00 0.02 -0.53 121.76 120.61 3ls3 s ALA 103 Ca 0.13 -0.37 0.01 0.00 0.00 0.00 0.00 51.96 51.73 3ls3 s ALA 103 Cb -0.10 0.43 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 3ls3 s ALA 103 CO 0.04 -0.47 -0.05 0.95 0.00 0.00 0.00 175.76 176.22 3ls3 s THR 104 N -3.31 0.39 -0.03 0.00 -4.23 -0.20 -0.47 115.64 107.79 3ls3 s THR 104 Ca 0.01 -1.28 -0.02 0.00 -1.18 0.00 0.00 61.69 59.22 3ls3 s THR 104 Cb 0.02 -0.81 0.01 0.00 1.34 0.00 0.00 72.50 73.06 3ls3 s THR 104 CO -0.08 -0.59 0.07 0.21 -0.54 0.00 0.00 174.62 173.69 3ls3 s ASN 105 N -1.98 -0.05 -0.21 3.99 3.84 -0.40 -1.16 114.94 118.96 3ls3 s ASN 105 Ca -0.06 0.14 -0.00 0.00 0.21 0.00 0.00 52.86 53.15 3ls3 s ASN 105 Cb -0.05 0.11 0.02 0.00 -0.55 0.00 0.00 41.25 40.78 3ls3 s ASN 105 CO -0.02 -0.05 -0.14 -0.62 -2.79 0.00 0.00 177.10 173.47 3ls3 s ASP 106 N 0.32 3.67 -0.17 -4.21 2.15 -0.71 -1.14 116.67 116.59 3ls3 s ASP 106 Ca -0.02 -0.70 -0.01 0.00 0.43 0.00 0.00 52.55 52.24 3ls3 s ASP 106 Cb -0.04 -1.57 -0.00 0.00 -0.30 0.00 0.00 42.92 41.01 3ls3 s ASP 106 CO -0.01 -0.04 -0.12 -0.63 -0.17 0.00 0.00 175.17 174.20 3ls3 s ILE 107 N 1.32 2.90 0.36 4.11 1.01 -0.04 -2.01 121.20 128.85 3ls3 s ILE 107 Ca 0.03 -0.68 0.05 0.00 0.00 0.00 0.00 60.65 60.05 3ls3 s ILE 107 Cb -0.14 -2.25 -0.06 0.00 0.01 0.00 0.00 42.46 40.01 3ls3 s ILE 107 CO -0.09 0.49 0.05 0.42 0.00 0.00 0.00 174.94 175.81 3ls3 s THR 108 N 0.93 1.37 -0.11 2.92 -4.23 -0.36 -2.24 115.64 113.92 3ls3 s THR 108 Ca -0.02 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.51 3ls3 s THR 108 Cb -0.15 -2.79 0.01 0.00 1.34 0.00 0.00 72.50 70.91 3ls3 s THR 108 CO -0.01 0.00 -0.18 -0.22 -0.54 0.00 0.00 174.62 173.67 3ls3 s LEU 109 N -3.58 1.86 -0.34 4.79 2.96 -1.24 -0.52 118.68 122.60 3ls3 s LEU 109 Ca 0.34 -0.47 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 3ls3 s LEU 109 Cb 0.08 -1.19 0.09 0.00 0.50 0.00 0.00 46.19 45.68 3ls3 s LEU 109 CO 0.15 0.06 0.06 -0.62 -1.32 0.00 0.00 176.35 174.68 3ls3 s ASP 110 N 0.79 4.85 1.84 3.68 2.15 0.44 -4.97 116.67 125.45 3ls3 s ASP 110 Ca -0.10 -1.91 0.00 0.00 0.43 0.00 0.00 52.55 50.97 3ls3 s ASP 110 Cb -0.16 -1.67 0.00 0.00 -0.30 0.00 0.00 42.92 40.79 3ls3 s ASP 110 CO 0.01 -0.38 0.00 0.61 -0.17 0.00 0.00 175.17 175.24 3ls3 n GLY 111 N 4.40 1.77 1.07 2.66 0.00 -1.26 -1.23 105.19 112.59 3ls3 n GLY 111 Ca -0.02 0.26 0.08 0.00 0.00 0.00 0.00 46.02 46.34 3ls3 n GLY 111 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ls3 n ASP 112 N 11.27 3.87 -4.20 1.61 5.75 -1.26 -4.95 116.55 128.65 3ls3 n ASP 112 Ca 0.00 -2.43 -0.34 0.00 -0.01 0.00 0.00 54.79 52.01 3ls3 n ASP 112 Cb 0.00 -0.45 -0.15 0.00 -1.03 0.00 0.00 41.12 39.49 3ls3 n ASP 112 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ls3 s TYR 114 N 1.36 3.45 -0.18 0.00 1.51 0.53 -0.42 117.35 123.59 3ls3 s TYR 114 Ca 0.04 1.40 -0.01 0.00 -1.01 0.00 0.00 57.07 57.49 3ls3 s TYR 114 Cb -0.14 -3.41 -0.00 0.00 -0.11 0.00 0.00 41.96 38.29 3ls3 s TYR 114 CO -0.08 -1.17 -0.11 0.42 -1.11 0.00 0.00 175.55 173.51 3ls3 s ILE 115 N 0.27 2.93 -0.08 2.71 -1.09 0.32 -0.39 121.20 125.87 3ls3 s ILE 115 Ca 0.54 -0.66 0.04 0.00 -2.23 0.00 0.00 60.65 58.34 3ls3 s ILE 115 Cb -0.31 -2.28 0.00 0.00 -1.58 0.00 0.00 42.46 38.29 3ls3 s ILE 115 CO 0.34 0.48 -0.19 0.00 -1.23 0.00 0.00 174.94 174.34 3ls3 s GLU 117 N 0.35 2.35 -0.08 0.00 2.12 -0.85 -2.11 118.70 120.48 3ls3 s GLU 117 Ca -0.14 -1.20 0.02 0.00 0.36 0.00 0.00 54.97 54.00 3ls3 s GLU 117 Cb -0.16 -2.79 -0.02 0.00 0.26 0.00 0.00 34.13 31.42 3ls3 s GLU 117 CO 0.06 -0.49 -0.12 0.42 -0.54 0.00 0.00 175.26 174.59 3ls3 s ILE 118 N 1.17 3.24 -0.06 -3.70 1.01 -0.28 -1.73 121.20 120.84 3ls3 s ILE 118 Ca -0.06 -0.64 0.05 0.00 0.00 0.00 0.00 60.65 60.01 3ls3 s ILE 118 Cb -0.18 -2.31 -0.01 0.00 0.01 0.00 0.00 42.46 39.96 3ls3 s ILE 118 CO -0.07 0.57 -0.22 -0.60 0.00 0.00 0.00 174.94 174.62 3ls3 s ARG 119 N -0.43 2.63 -0.05 2.79 6.06 -0.31 -1.56 118.95 128.08 3ls3 s ARG 119 Ca 0.06 -0.85 0.01 0.00 -2.50 0.00 0.00 55.73 52.44 3ls3 s ARG 119 Cb -0.12 -2.25 0.02 0.00 0.06 0.00 0.00 34.95 32.67 3ls3 s ARG 119 CO 0.02 0.40 -0.03 0.12 -2.50 0.00 0.00 175.30 173.31 3ls3 s PHE 120 N -0.20 0.68 -0.10 5.12 5.36 -0.54 -1.03 117.98 127.27 3ls3 s PHE 120 Ca -0.02 -0.18 -0.03 0.00 -0.96 0.00 0.00 56.93 55.74 3ls3 s PHE 120 Cb -0.13 -0.66 0.04 0.00 -0.34 0.00 0.00 43.02 41.93 3ls3 s PHE 120 CO 0.03 -0.21 0.07 -0.51 -1.46 0.00 0.00 175.22 173.14 3ls3 s ASP 121 N 1.13 1.72 0.00 6.13 1.01 0.31 -1.36 116.67 125.61 3ls3 s ASP 121 Ca -0.08 -0.24 0.07 0.00 0.71 0.00 0.00 52.55 53.01 3ls3 s ASP 121 Cb -0.14 -0.22 -0.03 0.00 1.01 0.00 0.00 42.92 43.55 3ls3 s ASP 121 CO -0.01 -0.29 -0.21 -0.83 0.21 0.00 0.00 175.17 174.04 3ls3 s GLY 122 N 2.13 1.44 0.11 0.21 0.00 -0.13 -0.70 107.32 110.39 3ls3 s GLY 122 Ca 0.04 -1.14 -0.03 0.00 0.00 0.00 0.00 44.72 43.59 3ls3 s GLY 122 CO -0.06 -0.98 0.09 -1.34 0.00 0.00 0.00 173.10 170.82 3ls3 s VAL 123 N -0.76 0.13 -1.70 1.40 -7.23 -0.15 -0.38 120.40 111.70 3ls3 s VAL 123 Ca 0.12 -1.71 0.00 0.00 -1.81 0.00 0.00 61.98 58.58 3ls3 s VAL 123 Cb -0.10 -1.80 0.00 0.00 0.56 0.00 0.00 36.38 35.04 3ls3 s VAL 123 CO 0.02 -0.59 0.00 0.59 -0.31 0.00 0.00 175.10 174.81 3ls3 n ASN 124 N -0.06 -5.08 -4.68 4.85 3.02 -1.26 -1.62 115.26 110.43 3ls3 n ASN 124 Ca -0.09 0.26 -0.42 0.00 -0.03 0.00 0.00 54.58 54.30 3ls3 n ASN 124 Cb 0.63 -4.13 -0.03 0.00 -0.61 0.00 0.00 39.78 35.64 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 -2.72 2.87 0.47 3.10 0.08 -1.26 -3.39 117.98 117.13 3ls3 s PHE 125 Ca 0.00 0.94 -0.24 0.00 0.12 0.00 0.00 56.93 57.75 3ls3 s PHE 125 Cb 0.00 -3.56 -0.07 0.00 -0.57 0.00 0.00 43.02 38.82 3ls3 s PHE 125 CO 0.00 -1.99 1.37 -2.14 -0.10 0.00 0.00 175.22 172.36 3ls3 s PRO 126 N 2.87 3.57 0.40 0.24 0.02 -1.26 -4.90 135.00 135.94 3ls3 s PRO 126 Ca 0.59 2.28 0.10 0.00 0.02 0.00 0.00 61.00 63.99 3ls3 s PRO 126 Cb -0.26 -2.53 0.89 0.00 0.02 0.00 0.00 34.50 32.62 3ls3 s PRO 126 CO 0.21 -0.86 1.97 0.00 -0.33 0.00 0.00 177.00 177.99 3ls3 h ALA 127 N 2.10 1.86 -0.68 -1.55 0.00 -1.98 -1.71 119.26 117.29 3ls3 h ALA 127 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3ls3 h ALA 127 Cb 1.27 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3ls3 h ALA 127 CO 0.60 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.95 3ls3 n ASN 128 N -4.48 3.96 -4.71 0.00 3.02 -1.26 -4.38 115.26 107.41 3ls3 n ASN 128 Ca 0.10 -2.07 -0.29 0.00 -0.03 0.00 0.00 54.58 52.30 3ls3 n ASN 128 Cb 0.30 -0.47 0.11 0.00 -0.61 0.00 0.00 39.78 39.11 3ls3 n ASN 128 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3ls3 s GLY 129 N -1.00 1.65 0.51 7.41 0.00 -0.64 -4.86 107.32 110.39 3ls3 s GLY 129 Ca 0.47 -0.85 0.30 0.00 0.00 0.00 0.00 44.72 44.64 3ls3 s GLY 129 CO 0.30 -0.30 1.92 -0.56 0.00 0.00 0.00 173.10 174.46 3ls3 h PRO 130 N -1.13 0.00 0.04 2.90 0.13 -1.93 -1.27 132.00 130.74 3ls3 h PRO 130 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3ls3 h PRO 130 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 3ls3 h PRO 130 CO 0.58 0.06 -0.02 0.28 -0.23 0.00 0.00 178.00 178.67 3ls3 h VAL 131 N 0.00 1.34 0.00 1.56 2.07 -1.94 0.31 116.25 119.60 3ls3 h VAL 131 Ca -0.00 -1.69 -0.05 0.00 0.82 0.00 0.00 66.70 65.78 3ls3 h VAL 131 Cb 0.61 2.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 3ls3 h VAL 131 CO 0.01 0.40 -0.24 0.24 0.02 0.00 0.00 177.57 178.00 3ls3 h MET 132 N -0.85 0.00 -0.34 1.57 2.86 -1.76 0.12 114.93 116.53 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 0.69 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.35 3ls3 h MET 132 CO 0.01 0.24 0.00 1.04 1.06 0.00 0.00 176.91 179.26 3ls3 n GLN 133 N -3.40 2.21 -3.82 1.72 1.13 -0.49 -4.74 117.38 109.99 3ls3 n GLN 133 Ca 0.00 -1.83 -0.25 0.00 -1.94 0.00 0.00 57.00 52.98 3ls3 n GLN 133 Cb 0.44 -1.46 0.01 0.00 0.11 0.00 0.00 30.24 29.34 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 1.04 -3.42 -0.55 -1.09 5.02 -0.87 -4.91 118.16 113.38 3ls3 n LYS 134 Ca 0.18 0.49 0.05 0.00 -2.02 0.00 0.00 58.31 57.01 3ls3 n LYS 134 Cb 0.49 -4.67 0.25 0.00 -0.02 0.00 0.00 35.03 31.08 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 -4.31 2.79 -3.58 1.97 1.74 0.05 -4.97 116.66 110.35 3ls3 n ARG 135 Ca -0.27 -2.92 -0.29 0.00 -0.77 0.00 0.00 57.85 53.61 3ls3 n ARG 135 Cb 0.67 -1.87 -0.04 0.00 -1.02 0.00 0.00 32.46 30.20 3ls3 n ARG 135 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3ls3 s THR 136 N -2.92 5.13 -0.05 0.55 -4.23 -1.26 -0.68 115.64 112.19 3ls3 s THR 136 Ca 0.44 -0.13 -0.07 0.00 -1.18 0.00 0.00 61.69 60.74 3ls3 s THR 136 Cb 0.36 -3.71 -0.03 0.00 1.34 0.00 0.00 72.50 70.46 3ls3 s THR 136 CO 0.08 -0.17 -0.16 0.52 -0.54 0.00 0.00 174.62 174.35 3ls3 n VAL 137 N -0.56 1.17 -3.60 2.29 0.31 0.29 -4.75 118.33 113.48 3ls3 n VAL 137 Ca -0.03 0.17 -0.06 0.00 -0.01 0.00 0.00 64.34 64.40 3ls3 n VAL 137 Cb 0.53 -1.86 -0.02 0.00 -0.91 0.00 0.00 33.84 31.59 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 -2.35 0.98 0.11 5.55 -2.85 -1.23 -5.00 119.74 114.95 3ls3 s LYS 138 Ca -0.14 -0.45 -0.24 0.00 -1.00 0.00 0.00 55.97 54.14 3ls3 s LYS 138 Cb 0.03 0.39 -0.07 0.00 -2.06 0.00 0.00 37.83 36.12 3ls3 s LYS 138 CO 0.20 -0.44 0.72 -1.58 0.10 0.00 0.00 175.35 174.35 3ls3 s TRP 139 N -3.20 3.84 0.81 1.78 0.52 -1.26 -0.80 118.94 120.63 3ls3 s TRP 139 Ca 0.08 1.50 -0.11 0.00 0.02 0.00 0.00 56.10 57.59 3ls3 s TRP 139 Cb -0.01 -2.71 0.08 0.00 -1.15 0.00 0.00 33.47 29.68 3ls3 s TRP 139 CO -0.05 0.48 1.09 -1.21 0.02 0.00 0.00 176.95 177.28 3ls3 s GLU 140 N -0.88 1.93 0.24 4.98 0.41 -0.20 -4.80 118.70 120.39 3ls3 s GLU 140 Ca 0.34 1.06 -0.31 0.00 -0.41 0.00 0.00 54.97 55.65 3ls3 s GLU 140 Cb -0.22 -1.87 -0.14 0.00 -1.78 0.00 0.00 34.13 30.13 3ls3 s GLU 140 CO 0.24 -1.84 1.30 1.28 -0.49 0.00 0.00 175.26 175.74 3ls3 n LEU 141 N -3.64 2.66 -4.35 1.80 4.77 -1.26 -4.82 117.00 112.16 3ls3 n LEU 141 Ca 0.08 1.15 -0.23 0.00 -0.03 0.00 0.00 56.01 56.99 3ls3 n LEU 141 Cb 0.54 -1.37 -0.11 0.00 -2.33 0.00 0.00 43.42 40.14 3ls3 n LEU 141 CO 0.54 -0.77 -0.50 -0.94 -1.33 0.00 0.00 177.39 174.40 3ls3 s SER 142 N 0.07 2.82 -0.17 -1.43 1.04 -0.64 -4.96 113.70 110.44 3ls3 s SER 142 Ca 0.67 -0.84 -0.00 0.00 0.48 0.00 0.00 55.95 56.26 3ls3 s SER 142 Cb -0.69 -0.18 0.04 0.00 0.10 0.00 0.00 66.02 65.29 3ls3 s SER 142 CO 0.53 0.01 -0.08 -0.89 0.98 0.00 0.00 173.24 173.79 3ls3 s THR 143 N -1.86 1.27 -0.09 2.02 2.01 -1.26 -0.68 115.64 117.04 3ls3 s THR 143 Ca 0.16 -0.68 -0.13 0.00 0.31 0.00 0.00 61.69 61.35 3ls3 s THR 143 Cb -0.07 -1.38 -0.05 0.00 0.01 0.00 0.00 72.50 71.02 3ls3 s THR 143 CO 0.07 0.20 0.32 -0.70 -0.69 0.00 0.00 174.62 173.83 3ls3 s GLU 144 N 1.57 4.01 -0.18 4.92 2.12 0.11 -4.46 118.70 126.79 3ls3 s GLU 144 Ca 0.01 0.20 -0.03 0.00 0.36 0.00 0.00 54.97 55.51 3ls3 s GLU 144 Cb -0.15 -3.32 -0.01 0.00 0.26 0.00 0.00 34.13 30.91 3ls3 s GLU 144 CO -0.08 0.48 -0.07 0.15 -0.54 0.00 0.00 175.26 175.19 3ls3 s LYS 145 N -0.30 3.41 -0.08 4.30 -0.14 -0.31 -1.03 119.74 125.59 3ls3 s LYS 145 Ca 0.20 -0.63 0.02 0.00 -1.36 0.00 0.00 55.97 54.19 3ls3 s LYS 145 Cb -0.14 -2.88 -0.02 0.00 -1.68 0.00 0.00 37.83 33.11 3ls3 s LYS 145 CO 0.08 -0.02 -0.14 -0.51 -0.76 0.00 0.00 175.35 174.00 3ls3 s LEU 146 N 1.00 2.74 0.03 3.17 1.02 0.07 -1.75 118.68 124.96 3ls3 s LEU 146 Ca -0.00 -0.24 -0.10 0.00 0.02 0.00 0.00 54.13 53.80 3ls3 s LEU 146 Cb -0.15 -1.58 0.01 0.00 0.02 0.00 0.00 46.19 44.49 3ls3 s LEU 146 CO -0.00 0.27 0.21 -0.72 0.02 0.00 0.00 176.35 176.14 3ls3 s TYR 147 N -0.30 0.00 0.10 0.29 1.13 -0.34 -2.22 117.35 116.00 3ls3 s TYR 147 Ca 0.03 -0.15 -0.19 0.00 -1.41 0.00 0.00 57.07 55.35 3ls3 s TYR 147 Cb -0.13 0.00 -0.07 0.00 -1.10 0.00 0.00 41.96 40.66 3ls3 s TYR 147 CO 0.03 -0.41 0.59 0.08 -2.51 0.00 0.00 175.55 173.32 3ls3 s VAL 148 N -2.20 4.72 -0.14 -3.49 1.01 -1.26 -0.54 120.40 118.50 3ls3 s VAL 148 Ca -0.08 1.20 -0.13 0.00 0.00 0.00 0.00 61.98 62.97 3ls3 s VAL 148 Cb -0.03 -3.89 0.04 0.00 0.00 0.00 0.00 36.38 32.50 3ls3 s VAL 148 CO -0.02 0.49 0.38 -0.60 0.00 0.00 0.00 175.10 175.35 3ls3 s ARG 149 N -1.28 0.44 -1.46 2.72 3.52 -0.52 -4.91 118.95 117.46 3ls3 s ARG 149 Ca 0.31 0.54 -0.10 0.00 -0.13 0.00 0.00 55.73 56.35 3ls3 s ARG 149 Cb -0.19 0.20 0.06 0.00 -1.56 0.00 0.00 34.95 33.46 3ls3 s ARG 149 CO 0.20 -0.06 0.77 -0.25 -0.81 0.00 0.00 175.30 175.15 3ls3 n ASP 150 N 2.96 -4.93 0.00 -2.12 8.00 -1.26 -1.61 116.55 117.59 3ls3 n ASP 150 Ca -0.14 -0.54 0.00 0.00 0.71 0.00 0.00 54.79 54.82 3ls3 n ASP 150 Cb 0.57 -3.97 0.00 0.00 -0.02 0.00 0.00 41.12 37.70 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 -1.53 0.54 3.51 0.44 0.00 -1.26 -4.99 105.19 101.90 3ls3 n GLY 151 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.39 0.70 -0.16 1.61 -7.23 -0.63 -5.01 120.40 107.28 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 -2.41 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 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 -3.59 3.28 0.24 1.32 2.96 -0.89 -1.44 118.68 120.56 3ls3 s LEU 153 Ca 0.25 -0.13 0.10 0.00 -0.22 0.00 0.00 54.13 54.13 3ls3 s LEU 153 Cb 0.03 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 3ls3 s LEU 153 CO 0.14 0.15 -0.08 -0.54 -1.32 0.00 0.00 176.35 174.70 3ls3 s LYS 154 N 0.47 2.07 0.09 1.98 1.02 0.30 0.17 119.74 125.83 3ls3 s LYS 154 Ca -0.03 -1.45 -0.12 0.00 0.02 0.00 0.00 55.97 54.40 3ls3 s LYS 154 Cb -0.14 -2.07 0.01 0.00 -0.52 0.00 0.00 37.83 35.11 3ls3 s LYS 154 CO 0.03 0.38 0.28 -1.54 -0.92 0.00 0.00 175.35 173.57 3ls3 s SER 155 N -3.34 -0.04 0.07 2.83 1.04 0.13 -1.20 113.70 113.20 3ls3 s SER 155 Ca 0.29 -0.47 -0.06 0.00 0.48 0.00 0.00 55.95 56.19 3ls3 s SER 155 Cb -0.07 0.39 -0.02 0.00 0.10 0.00 0.00 66.02 66.42 3ls3 s SER 155 CO 0.17 -0.75 0.11 1.51 0.98 0.00 0.00 173.24 175.25 3ls3 s ASP 156 N -2.71 0.25 -0.12 7.02 -4.77 -0.72 -1.21 116.67 114.40 3ls3 s ASP 156 Ca 0.03 -0.74 -0.12 0.00 -3.30 0.00 0.00 52.55 48.41 3ls3 s ASP 156 Cb 0.03 0.28 0.03 0.00 -1.09 0.00 0.00 42.92 42.17 3ls3 s ASP 156 CO -0.10 -0.65 0.34 -0.83 0.70 0.00 0.00 175.17 174.63 3ls3 s GLY 157 N -2.77 -0.25 -0.70 2.12 0.00 -0.71 -1.17 107.32 103.84 3ls3 s GLY 157 Ca 0.04 0.94 -0.08 0.00 0.00 0.00 0.00 44.72 45.62 3ls3 s GLY 157 CO -0.10 0.81 0.57 -1.31 0.00 0.00 0.00 173.10 173.07 3ls3 s ASN 158 N 0.12 5.94 0.38 1.64 0.02 -1.26 -1.00 114.94 120.77 3ls3 s ASN 158 Ca -0.01 -2.70 0.05 0.00 -1.02 0.00 0.00 52.86 49.18 3ls3 s ASN 158 Cb -0.03 -2.02 -0.00 0.00 0.02 0.00 0.00 41.25 39.22 3ls3 s ASN 158 CO 0.01 -0.49 0.55 -0.31 0.02 0.00 0.00 177.10 176.88 3ls3 s TYR 159 N 0.16 3.08 -0.12 2.20 2.02 0.30 -4.89 117.35 120.10 3ls3 s TYR 159 Ca 0.16 -0.14 -0.06 0.00 -0.37 0.00 0.00 57.07 56.66 3ls3 s TYR 159 Cb -0.17 -2.16 0.05 0.00 -0.40 0.00 0.00 41.96 39.28 3ls3 s TYR 159 CO -0.05 -0.20 0.28 0.00 -1.57 0.00 0.00 175.55 174.01 3ls3 s ALA 160 N -2.32 -0.67 -0.20 3.71 0.00 -1.26 -1.54 121.76 119.49 3ls3 s ALA 160 Ca 0.48 1.11 -0.15 0.00 0.00 0.00 0.00 51.96 53.40 3ls3 s ALA 160 Cb -0.10 -0.69 -0.04 0.00 0.00 0.00 0.00 23.12 22.29 3ls3 s ALA 160 CO 0.33 -0.21 0.34 -0.51 0.00 0.00 0.00 175.76 175.72 3ls3 s LEU 161 N 1.26 4.17 0.32 0.00 1.43 -0.15 -1.03 118.68 124.67 3ls3 s LEU 161 Ca -0.09 0.46 -0.27 0.00 -1.03 0.00 0.00 54.13 53.20 3ls3 s LEU 161 Cb -0.10 -2.43 -0.09 0.00 0.03 0.00 0.00 46.19 43.60 3ls3 s LEU 161 CO -0.09 -0.02 1.00 -0.94 0.23 0.00 0.00 176.35 176.53 3ls3 s SER 162 N 0.92 7.23 0.17 2.29 1.04 0.02 -0.52 113.70 124.85 3ls3 s SER 162 Ca 0.17 2.00 0.05 0.00 0.48 0.00 0.00 55.95 58.65 3ls3 s SER 162 Cb -0.14 -2.60 -0.04 0.00 0.10 0.00 0.00 66.02 63.34 3ls3 s SER 162 CO 0.07 -0.15 0.14 -0.76 0.98 0.00 0.00 173.24 173.52 3ls3 s LEU 163 N -1.92 3.82 0.20 2.42 1.43 -0.40 -0.55 118.68 123.69 3ls3 s LEU 163 Ca 0.49 -0.13 -0.32 0.00 -1.03 0.00 0.00 54.13 53.15 3ls3 s LEU 163 Cb -0.24 -2.42 -0.12 0.00 0.03 0.00 0.00 46.19 43.44 3ls3 s LEU 163 CO 0.30 0.06 1.71 -1.61 0.23 0.00 0.00 176.35 177.04 3ls3 s GLU 164 N -3.14 4.13 0.00 1.70 2.02 0.14 -1.49 118.70 122.07 3ls3 s GLU 164 Ca 0.31 2.58 0.00 0.00 0.02 0.00 0.00 54.97 57.88 3ls3 s GLU 164 Cb -0.10 -3.09 0.00 0.00 0.10 0.00 0.00 34.13 31.04 3ls3 s GLU 164 CO 0.24 -0.74 0.00 0.41 0.02 0.00 0.00 175.26 175.19 3ls3 n GLY 165 N 3.96 1.12 0.00 -1.39 0.00 -1.26 -4.92 105.19 102.69 3ls3 n GLY 165 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.00 2.21 0.00 -0.02 0.00 -0.55 -5.15 105.19 99.67 3ls3 n GLY 166 Ca 0.00 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.93 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 0.01 -1.31 3.27 -0.02 0.00 -1.26 -4.27 105.19 101.60 3ls3 n GLY 167 Ca 0.00 -1.60 -0.18 0.00 0.00 0.00 0.00 46.02 44.24 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 -1.87 1.48 -0.15 1.61 0.09 -1.26 -1.27 115.29 113.91 3ls3 s HIS 168 Ca 0.00 -0.56 0.00 0.00 -0.00 0.00 0.00 55.06 54.50 3ls3 s HIS 168 Cb 0.00 -0.75 0.03 0.00 -0.00 0.00 0.00 32.58 31.85 3ls3 s HIS 168 CO 0.00 0.19 -0.12 -0.47 -0.00 0.00 0.00 174.74 174.34 3ls3 s TYR 169 N -2.32 2.07 0.04 1.40 5.04 0.32 -4.93 117.35 118.97 3ls3 s TYR 169 Ca 0.12 -1.21 -0.11 0.00 -2.44 0.00 0.00 57.07 53.43 3ls3 s TYR 169 Cb -0.04 -1.52 -0.06 0.00 0.35 0.00 0.00 41.96 40.69 3ls3 s TYR 169 CO 0.04 -0.66 0.38 1.03 -1.34 0.00 0.00 175.55 175.00 3ls3 s ARG 170 N 1.52 3.77 -0.02 4.97 0.52 -1.26 -0.98 118.95 127.47 3ls3 s ARG 170 Ca 0.03 0.21 0.00 0.00 -0.52 0.00 0.00 55.73 55.46 3ls3 s ARG 170 Cb -0.14 -3.09 0.02 0.00 0.52 0.00 0.00 34.95 32.26 3ls3 s ARG 170 CO -0.10 0.62 0.00 0.00 0.02 0.00 0.00 175.30 175.85 3ls3 s ASP 172 N 0.60 6.15 -0.16 0.00 1.01 -0.27 -0.54 116.67 123.47 3ls3 s ASP 172 Ca -0.05 0.15 -0.06 0.00 0.71 0.00 0.00 52.55 53.30 3ls3 s ASP 172 Cb -0.08 -2.12 -0.04 0.00 1.01 0.00 0.00 42.92 41.69 3ls3 s ASP 172 CO -0.01 0.05 0.04 -0.36 0.21 0.00 0.00 175.17 175.10 3ls3 s PHE 173 N 1.08 3.22 -0.10 4.23 0.40 -0.17 -0.69 117.98 125.94 3ls3 s PHE 173 Ca 0.09 0.05 -0.01 0.00 -0.60 0.00 0.00 56.93 56.46 3ls3 s PHE 173 Cb -0.14 -2.01 0.03 0.00 0.51 0.00 0.00 43.02 41.41 3ls3 s PHE 173 CO 0.05 0.20 -0.05 0.15 0.70 0.00 0.00 175.22 176.27 3ls3 s LYS 174 N 0.11 1.18 0.04 0.44 -0.14 -0.02 -1.74 119.74 119.61 3ls3 s LYS 174 Ca 0.04 -0.12 0.07 0.00 -1.36 0.00 0.00 55.97 54.59 3ls3 s LYS 174 Cb -0.12 -1.37 -0.02 0.00 -1.68 0.00 0.00 37.83 34.63 3ls3 s LYS 174 CO 0.01 -0.29 -0.20 0.99 -0.76 0.00 0.00 175.35 175.10 3ls3 s THR 175 N 1.81 1.65 -0.12 2.17 2.01 -0.35 -0.97 115.64 121.83 3ls3 s THR 175 Ca 0.05 -1.19 0.03 0.00 0.31 0.00 0.00 61.69 60.89 3ls3 s THR 175 Cb -0.12 -1.43 0.00 0.00 0.01 0.00 0.00 72.50 70.95 3ls3 s THR 175 CO -0.07 0.20 -0.21 -0.89 -0.69 0.00 0.00 174.62 172.95 3ls3 s THR 176 N -0.80 2.21 -0.15 -0.82 2.01 0.08 -0.69 115.64 117.49 3ls3 s THR 176 Ca 0.07 -0.95 -0.05 0.00 0.31 0.00 0.00 61.69 61.07 3ls3 s THR 176 Cb -0.09 -1.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.51 3ls3 s THR 176 CO 0.02 0.55 0.02 -0.31 -0.69 0.00 0.00 174.62 174.21 3ls3 s TYR 177 N 0.54 3.19 -0.28 4.92 2.02 0.13 -1.28 117.35 126.59 3ls3 s TYR 177 Ca -0.13 0.03 0.00 0.00 -0.37 0.00 0.00 57.07 56.60 3ls3 s TYR 177 Cb -0.17 -1.96 0.08 0.00 -0.40 0.00 0.00 41.96 39.51 3ls3 s TYR 177 CO 0.04 0.22 0.04 0.15 -1.57 0.00 0.00 175.55 174.44 3ls3 s LYS 178 N -0.04 1.05 0.46 -0.62 1.02 0.43 -2.09 119.74 119.95 3ls3 s LYS 178 Ca 0.04 -1.07 -0.25 0.00 0.02 0.00 0.00 55.97 54.71 3ls3 s LYS 178 Cb -0.13 -2.34 -0.08 0.00 -0.52 0.00 0.00 37.83 34.76 3ls3 s LYS 178 CO 0.02 -0.83 1.43 0.00 -0.92 0.00 0.00 175.35 175.05 3ls3 s ALA 179 N 1.49 3.20 -2.01 5.17 0.00 -1.26 -1.38 121.76 126.97 3ls3 s ALA 179 Ca 0.04 1.47 0.07 0.00 0.00 0.00 0.00 51.96 53.54 3ls3 s ALA 179 Cb -0.18 -3.59 0.22 0.00 0.00 0.00 0.00 23.12 19.56 3ls3 s ALA 179 CO -0.15 -1.23 1.17 1.63 0.00 0.00 0.00 175.76 177.18 3ls3 n LYS 180 N -0.28 1.43 -3.95 0.00 5.02 -0.80 -4.84 118.16 114.74 3ls3 n LYS 180 Ca 0.06 -0.67 -0.10 0.00 -2.02 0.00 0.00 58.31 55.58 3ls3 n LYS 180 Cb 0.42 -1.16 -0.03 0.00 -0.02 0.00 0.00 35.03 34.24 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 -1.76 1.81 -0.02 1.97 -2.85 -1.26 -4.99 119.74 112.64 3ls3 s LYS 181 Ca 0.14 -1.33 -0.30 0.00 -1.00 0.00 0.00 55.97 53.48 3ls3 s LYS 181 Cb 0.07 0.53 -0.05 0.00 -2.06 0.00 0.00 37.83 36.32 3ls3 s LYS 181 CO 0.10 -0.79 1.41 0.08 0.10 0.00 0.00 175.35 176.24 3ls3 s VAL 182 N -3.46 3.75 0.26 1.79 1.01 -1.26 -5.03 120.40 117.46 3ls3 s VAL 182 Ca 0.20 1.10 0.05 0.00 0.00 0.00 0.00 61.98 63.33 3ls3 s VAL 182 Cb -0.03 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.59 3ls3 s VAL 182 CO 0.11 -0.02 -0.02 0.68 0.00 0.00 0.00 175.10 175.86 3ls3 s VAL 183 N 2.61 1.29 0.28 2.92 -7.23 -1.26 -5.03 120.40 113.98 3ls3 s VAL 183 Ca 0.64 -2.06 -0.29 0.00 -1.81 0.00 0.00 61.98 58.45 3ls3 s VAL 183 Cb -0.31 -2.44 -0.10 0.00 0.56 0.00 0.00 36.38 34.10 3ls3 s VAL 183 CO 0.26 -0.28 1.29 -1.58 -0.31 0.00 0.00 175.10 174.48 3ls3 s GLN 184 N -3.81 4.39 -0.04 4.82 0.74 -1.26 -5.01 119.66 119.49 3ls3 s GLN 184 Ca 0.30 2.13 -0.14 0.00 0.05 0.00 0.00 55.36 57.70 3ls3 s GLN 184 Cb 0.05 -3.12 -0.05 0.00 1.10 0.00 0.00 33.01 30.99 3ls3 s GLN 184 CO 0.11 -0.18 0.37 -0.51 -0.55 0.00 0.00 175.29 174.54 3ls3 s LEU 185 N -1.17 4.42 0.59 3.68 1.43 -1.26 -4.68 118.68 121.69 3ls3 s LEU 185 Ca 0.51 0.85 -0.09 0.00 -1.03 0.00 0.00 54.13 54.37 3ls3 s LEU 185 Cb -0.38 -2.52 -0.04 0.00 0.03 0.00 0.00 46.19 43.28 3ls3 s LEU 185 CO 0.47 0.28 0.97 -2.16 0.23 0.00 0.00 176.35 176.13 3ls3 s PRO 186 N -0.73 3.53 0.91 1.29 0.04 -1.26 -4.94 135.00 133.83 3ls3 s PRO 186 Ca 0.22 0.58 -0.12 0.00 0.04 0.00 0.00 61.00 61.72 3ls3 s PRO 186 Cb -0.16 -2.16 0.14 0.00 0.04 0.00 0.00 34.50 32.36 3ls3 s PRO 186 CO 0.11 -0.50 1.13 -0.51 0.04 0.00 0.00 177.00 177.27 3ls3 s ASP 187 N -4.17 3.52 0.24 6.66 1.01 -1.26 -4.58 116.67 118.09 3ls3 s ASP 187 Ca 0.53 1.00 -0.31 0.00 0.71 0.00 0.00 52.55 54.48 3ls3 s ASP 187 Cb -0.11 -1.60 -0.13 0.00 1.01 0.00 0.00 42.92 42.10 3ls3 s ASP 187 CO 0.51 -2.55 1.52 0.00 0.21 0.00 0.00 175.17 174.87 3ls3 n TYR 188 N -3.77 2.47 -3.89 4.23 9.36 -1.26 -4.86 117.16 119.44 3ls3 n TYR 188 Ca 0.06 0.31 -0.10 0.00 3.32 0.00 0.00 57.90 61.50 3ls3 n TYR 188 Cb 0.59 -2.54 0.00 0.00 -0.63 0.00 0.00 39.34 36.76 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 0.20 0.37 0.22 2.98 -3.43 -0.94 -4.96 115.29 109.72 3ls3 s HIS 189 Ca 0.69 -0.91 0.10 0.00 -0.80 0.00 0.00 55.06 54.14 3ls3 s HIS 189 Cb -0.59 0.57 -0.05 0.00 -1.43 0.00 0.00 32.58 31.09 3ls3 s HIS 189 CO 0.46 -1.43 -0.18 -1.54 -2.00 0.00 0.00 174.74 170.05 3ls3 s SER 190 N -3.11 3.01 -0.09 7.38 1.04 -0.53 -0.75 113.70 120.65 3ls3 s SER 190 Ca 0.19 -0.96 0.02 0.00 0.48 0.00 0.00 55.95 55.68 3ls3 s SER 190 Cb -0.04 -0.20 0.01 0.00 0.10 0.00 0.00 66.02 65.89 3ls3 s SER 190 CO 0.14 -0.04 -0.15 -0.69 0.98 0.00 0.00 173.24 173.48 3ls3 s VAL 191 N -2.43 1.43 -0.06 5.02 1.01 -0.20 -0.51 120.40 124.67 3ls3 s VAL 191 Ca 0.23 -0.63 -0.15 0.00 0.00 0.00 0.00 61.98 61.43 3ls3 s VAL 191 Cb -0.04 -1.30 -0.05 0.00 0.00 0.00 0.00 36.38 34.99 3ls3 s VAL 191 CO 0.10 0.43 0.38 -1.81 0.00 0.00 0.00 175.10 174.19 3ls3 s ASP 192 N 0.81 6.69 0.09 3.32 1.01 0.14 -0.72 116.67 128.02 3ls3 s ASP 192 Ca -0.11 0.82 0.04 0.00 0.71 0.00 0.00 52.55 54.02 3ls3 s ASP 192 Cb -0.16 -2.23 -0.03 0.00 1.01 0.00 0.00 42.92 41.51 3ls3 s ASP 192 CO 0.01 0.23 -0.12 -1.00 0.21 0.00 0.00 175.17 174.51 3ls3 s HIS 193 N -0.50 1.14 -0.05 4.23 3.76 0.15 -1.29 115.29 122.72 3ls3 s HIS 193 Ca 0.22 -0.56 0.00 0.00 -0.15 0.00 0.00 55.06 54.57 3ls3 s HIS 193 Cb -0.15 -0.62 0.02 0.00 1.11 0.00 0.00 32.58 32.94 3ls3 s HIS 193 CO 0.10 0.04 -0.02 -1.58 -0.85 0.00 0.00 174.74 172.43 3ls3 s HIS 194 N -1.94 0.61 -0.02 1.40 2.46 0.03 -1.63 115.29 116.20 3ls3 s HIS 194 Ca 0.02 -0.14 0.05 0.00 0.47 0.00 0.00 55.06 55.46 3ls3 s HIS 194 Cb -0.06 -0.63 -0.01 0.00 -0.13 0.00 0.00 32.58 31.75 3ls3 s HIS 194 CO 0.01 -0.21 -0.16 -1.50 -2.47 0.00 0.00 174.74 170.41 3ls3 s ILE 195 N 1.21 1.33 -0.11 0.89 2.07 -1.26 -0.96 121.20 124.37 3ls3 s ILE 195 Ca -0.07 -0.70 -0.07 0.00 -1.41 0.00 0.00 60.65 58.41 3ls3 s ILE 195 Cb -0.14 -1.13 0.04 0.00 0.13 0.00 0.00 42.46 41.37 3ls3 s ILE 195 CO -0.02 0.38 0.26 -0.70 -1.91 0.00 0.00 174.94 172.96 3ls3 s GLU 196 N -0.20 0.26 -0.37 3.50 2.12 -0.31 -4.59 118.70 119.11 3ls3 s GLU 196 Ca 0.02 0.48 -0.29 0.00 0.36 0.00 0.00 54.97 55.55 3ls3 s GLU 196 Cb -0.08 -0.01 0.02 0.00 0.26 0.00 0.00 34.13 34.31 3ls3 s GLU 196 CO 0.00 -0.11 1.07 0.42 -0.54 0.00 0.00 175.26 176.10 3ls3 s ILE 197 N 0.85 4.44 0.05 -3.70 1.01 -1.26 -1.08 121.20 121.51 3ls3 s ILE 197 Ca -0.06 1.53 -0.13 0.00 0.00 0.00 0.00 60.65 61.99 3ls3 s ILE 197 Cb -0.07 -4.45 -0.33 0.00 0.01 0.00 0.00 42.46 37.62 3ls3 s ILE 197 CO -0.06 -0.62 1.06 0.40 0.00 0.00 0.00 174.94 175.72 3ls3 h ILE 198 N 5.87 1.34 -2.86 2.92 1.08 -1.17 -3.48 117.51 121.21 3ls3 h ILE 198 Ca -0.21 -2.75 -0.06 0.00 -0.39 0.00 0.00 64.86 61.44 3ls3 h ILE 198 Cb 1.06 2.96 -0.15 0.00 -3.07 0.00 0.00 36.82 37.61 3ls3 h ILE 198 CO 1.05 0.82 0.03 -0.94 -0.69 0.00 0.00 178.15 178.43 3ls3 s SER 199 N -7.45 -0.42 0.06 1.72 1.04 -1.18 -5.01 113.70 102.45 3ls3 s SER 199 Ca -0.08 0.10 -0.27 0.00 0.48 0.00 0.00 55.95 56.19 3ls3 s SER 199 Cb 0.05 0.50 0.07 0.00 0.10 0.00 0.00 66.02 66.74 3ls3 s SER 199 CO 0.93 -0.75 0.65 -1.38 0.98 0.00 0.00 173.24 173.67 3ls3 s HIS 200 N -2.69 -0.59 0.82 5.02 -3.43 -1.26 -1.25 115.29 111.91 3ls3 s HIS 200 Ca -0.04 0.69 -0.09 0.00 -0.80 0.00 0.00 55.06 54.82 3ls3 s HIS 200 Cb -0.00 0.49 0.14 0.00 -1.43 0.00 0.00 32.58 31.77 3ls3 s HIS 200 CO -0.04 -0.73 1.14 0.16 -2.00 0.00 0.00 174.74 173.28 3ls3 s ASP 201 N -2.03 3.97 0.31 7.38 1.47 -0.80 -4.93 116.67 122.06 3ls3 s ASP 201 Ca -0.04 0.16 0.08 0.00 1.18 0.00 0.00 52.55 53.92 3ls3 s ASP 201 Cb -0.01 -0.47 0.83 0.00 -0.34 0.00 0.00 42.92 42.94 3ls3 s ASP 201 CO -0.02 -2.15 1.74 0.07 0.68 0.00 0.00 175.17 175.49 3ls3 h LYS 202 N -1.02 0.61 -0.24 2.11 2.10 -2.02 -2.04 116.57 116.07 3ls3 h LYS 202 Ca -0.42 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 3ls3 h LYS 202 Cb 1.27 -0.14 0.00 0.00 -0.90 0.00 0.00 32.23 32.46 3ls3 h LYS 202 CO 0.46 0.40 0.00 -0.40 -2.00 0.00 0.00 179.45 177.91 3ls3 n ASP 203 N -4.86 3.46 -1.41 7.07 5.68 -1.26 -4.97 116.55 120.26 3ls3 n ASP 203 Ca 0.26 -2.79 -0.18 0.00 -0.50 0.00 0.00 54.79 51.57 3ls3 n ASP 203 Cb 0.69 -0.45 -0.08 0.00 -1.14 0.00 0.00 41.12 40.14 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 -0.41 -0.01 0.25 2.11 4.02 -0.77 -4.39 117.16 117.96 3ls3 n TYR 204 Ca 0.18 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 58.15 3ls3 n TYR 204 Cb 0.75 -3.11 0.62 0.00 -0.02 0.00 0.00 39.34 37.57 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 -1.93 -3.41 113.55 112.61 3ls3 h SER 205 Ca -0.37 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.12 3ls3 h SER 205 Cb 1.19 0.00 -0.35 0.00 0.14 0.00 0.00 62.40 63.38 3ls3 h SER 205 CO 0.55 0.10 -0.78 0.20 -1.14 0.00 0.00 176.83 175.75 3ls3 s ASN 206 N -6.83 1.49 -0.02 3.07 0.01 -1.26 -1.30 114.94 110.11 3ls3 s ASN 206 Ca -0.04 -0.18 0.01 0.00 -0.71 0.00 0.00 52.86 51.94 3ls3 s ASN 206 Cb 0.16 -0.59 0.01 0.00 0.41 0.00 0.00 41.25 41.24 3ls3 s ASN 206 CO 0.66 -0.09 -0.03 -0.69 -1.51 0.00 0.00 177.10 175.44 3ls3 s VAL 207 N 1.29 0.32 -0.21 1.60 1.01 -0.62 -1.89 120.40 121.89 3ls3 s VAL 207 Ca -0.05 -0.10 -0.06 0.00 0.00 0.00 0.00 61.98 61.77 3ls3 s VAL 207 Cb -0.14 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 35.89 3ls3 s VAL 207 CO -0.02 0.13 0.03 0.21 0.00 0.00 0.00 175.10 175.44 3ls3 s ASN 208 N 0.34 5.01 -0.04 3.32 3.84 -0.38 -0.19 114.94 126.84 3ls3 s ASN 208 Ca -0.04 -0.17 0.07 0.00 0.21 0.00 0.00 52.86 52.93 3ls3 s ASN 208 Cb -0.07 -1.87 -0.01 0.00 -0.55 0.00 0.00 41.25 38.75 3ls3 s ASN 208 CO -0.01 0.04 -0.25 -0.22 -2.79 0.00 0.00 177.10 173.88 3ls3 s LEU 209 N 1.13 2.05 -0.01 3.21 2.96 -0.18 -0.53 118.68 127.30 3ls3 s LEU 209 Ca 0.03 -0.48 0.08 0.00 -0.22 0.00 0.00 54.13 53.54 3ls3 s LEU 209 Cb -0.14 -1.33 -0.02 0.00 0.50 0.00 0.00 46.19 45.20 3ls3 s LEU 209 CO 0.02 0.27 -0.25 -1.00 -1.32 0.00 0.00 176.35 174.07 3ls3 s HIS 210 N -0.35 2.26 0.01 5.38 3.76 -0.24 -0.98 115.29 125.13 3ls3 s HIS 210 Ca 0.02 -0.43 0.03 0.00 -0.15 0.00 0.00 55.06 54.54 3ls3 s HIS 210 Cb -0.12 -1.45 -0.01 0.00 1.11 0.00 0.00 32.58 32.11 3ls3 s HIS 210 CO 0.02 -0.03 -0.10 -2.00 -0.85 0.00 0.00 174.74 171.78 3ls3 s GLU 211 N -0.65 0.77 -0.06 1.40 2.12 -0.57 -1.16 118.70 120.56 3ls3 s GLU 211 Ca 0.10 -0.44 0.02 0.00 0.36 0.00 0.00 54.97 55.01 3ls3 s GLU 211 Cb -0.10 -0.73 0.01 0.00 0.26 0.00 0.00 34.13 33.57 3ls3 s GLU 211 CO -0.01 0.19 -0.11 -1.58 -0.54 0.00 0.00 175.26 173.22 3ls3 s HIS 212 N -0.43 1.32 -0.02 5.30 5.65 -0.13 -1.67 115.29 125.30 3ls3 s HIS 212 Ca 0.02 -0.45 -0.02 0.00 0.25 0.00 0.00 55.06 54.86 3ls3 s HIS 212 Cb -0.05 -0.97 0.01 0.00 -1.18 0.00 0.00 32.58 30.38 3ls3 s HIS 212 CO -0.00 -0.24 0.06 0.00 -0.65 0.00 0.00 174.74 173.91 3ls3 s ALA 213 N 0.62 -0.13 -0.08 1.58 0.00 -0.27 -0.79 121.76 122.69 3ls3 s ALA 213 Ca -0.13 0.19 -0.04 0.00 0.00 0.00 0.00 51.96 51.98 3ls3 s ALA 213 Cb -0.15 -0.12 0.04 0.00 0.00 0.00 0.00 23.12 22.89 3ls3 s ALA 213 CO 0.03 -0.04 0.18 -1.83 0.00 0.00 0.00 175.76 174.10 3ls3 s GLU 214 N 0.14 0.15 0.20 0.00 -1.05 -0.41 -1.65 118.70 116.07 3ls3 s GLU 214 Ca -0.01 0.39 -0.16 0.00 -0.15 0.00 0.00 54.97 55.04 3ls3 s GLU 214 Cb -0.02 -0.10 -0.08 0.00 -0.44 0.00 0.00 34.13 33.50 3ls3 s GLU 214 CO -0.00 -0.13 0.63 0.00 0.95 0.00 0.00 175.26 176.70 3ls3 s ALA 215 N 0.95 3.49 0.03 -0.84 0.00 0.09 -0.68 121.76 124.81 3ls3 s ALA 215 Ca -0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.85 3ls3 s ALA 215 Cb -0.09 -2.64 -0.03 0.00 0.00 0.00 0.00 23.12 20.37 3ls3 s ALA 215 CO -0.05 0.40 -0.02 -1.01 0.00 0.00 0.00 175.76 175.08 3ls3 s HIS 216 N -1.59 0.34 0.00 0.00 3.76 0.33 -4.51 115.29 113.62 3ls3 s HIS 216 Ca 0.43 -0.70 0.00 0.00 -0.15 0.00 0.00 55.06 54.63 3ls3 s HIS 216 Cb -0.14 -0.25 0.00 0.00 1.11 0.00 0.00 32.58 33.29 3ls3 s HIS 216 CO 0.20 -0.26 0.14 -1.13 -0.85 0.00 0.00 174.74 172.84