#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1c s LEU 2 N 0.00 4.18 -0.15 3.17 1.43 -1.26 -5.06 118.68 120.99 3h1c s LEU 2 Ca 0.00 0.70 -0.02 0.00 -1.03 0.00 0.00 54.13 53.78 3h1c s LEU 2 Cb 0.00 -2.68 0.04 0.00 0.03 0.00 0.00 46.19 43.58 3h1c s LEU 2 CO 0.00 -0.12 -0.01 0.20 0.23 0.00 0.00 176.35 176.66 3h1c s ASN 3 N 0.99 2.55 0.30 2.29 0.01 -1.26 -5.12 114.94 114.70 3h1c s ASN 3 Ca 0.24 -0.58 -0.28 0.00 -0.71 0.00 0.00 52.86 51.54 3h1c s ASN 3 Cb -0.15 -0.68 -0.09 0.00 0.41 0.00 0.00 41.25 40.74 3h1c s ASN 3 CO 0.10 -0.23 1.02 -2.16 -1.51 0.00 0.00 177.10 174.32 3h1c s PRO 4 N 1.80 4.58 -0.41 -0.60 0.04 -1.26 -4.62 135.00 134.53 3h1c s PRO 4 Ca 0.01 1.58 -0.08 0.00 0.04 0.00 0.00 61.00 62.55 3h1c s PRO 4 Cb -0.15 -3.00 0.08 0.00 0.04 0.00 0.00 34.50 31.47 3h1c s PRO 4 CO -0.07 0.22 0.23 0.42 0.04 0.00 0.00 177.00 177.84 3h1c s ILE 5 N -1.36 4.05 0.06 0.56 1.01 -0.38 -4.99 121.20 120.15 3h1c s ILE 5 Ca 0.48 -1.45 0.08 0.00 0.00 0.00 0.00 60.65 59.76 3h1c s ILE 5 Cb -0.26 -3.49 -0.03 0.00 0.01 0.00 0.00 42.46 38.69 3h1c s ILE 5 CO 0.33 -0.49 -0.23 0.54 0.00 0.00 0.00 174.94 175.10 3h1c s VAL 6 N 1.39 1.84 -0.05 2.92 0.11 -1.26 -1.79 120.40 123.55 3h1c s VAL 6 Ca 0.03 -1.33 -0.03 0.00 -2.93 0.00 0.00 61.98 57.72 3h1c s VAL 6 Cb -0.23 -1.60 0.03 0.00 -1.53 0.00 0.00 36.38 33.05 3h1c s VAL 6 CO 0.01 0.21 0.12 -0.60 -3.33 0.00 0.00 175.10 171.51 3h1c s ARG 7 N -1.35 0.09 -0.03 1.54 3.52 -0.79 -5.02 118.95 116.91 3h1c s ARG 7 Ca 0.09 0.29 0.05 0.00 -0.13 0.00 0.00 55.73 56.03 3h1c s ARG 7 Cb -0.09 -0.12 -0.03 0.00 -1.56 0.00 0.00 34.95 33.15 3h1c s ARG 7 CO 0.02 -0.12 -0.17 0.15 -0.81 0.00 0.00 175.30 174.37 3h1c s LYS 8 N 0.85 2.36 -0.02 5.12 1.02 -1.26 -2.19 119.74 125.61 3h1c s LYS 8 Ca -0.07 -0.79 -0.15 0.00 0.02 0.00 0.00 55.97 54.99 3h1c s LYS 8 Cb -0.09 -2.29 0.02 0.00 -0.52 0.00 0.00 37.83 34.96 3h1c s LYS 8 CO -0.04 0.60 0.31 -0.59 -0.92 0.00 0.00 175.35 174.71 3h1c s PHE 9 N -0.74 -0.19 0.17 3.18 -0.71 -0.96 -5.01 117.98 113.71 3h1c s PHE 9 Ca 0.12 0.29 -0.30 0.00 -1.04 0.00 0.00 56.93 56.00 3h1c s PHE 9 Cb -0.10 0.10 -0.07 0.00 -1.21 0.00 0.00 43.02 41.73 3h1c s PHE 9 CO 0.01 -0.38 0.95 -1.14 -1.34 0.00 0.00 175.22 173.32 3h1c s GLN 10 N -1.26 4.76 -0.30 1.99 2.00 -1.26 -1.35 119.66 124.24 3h1c s GLN 10 Ca -0.13 1.46 -0.02 0.00 -2.00 0.00 0.00 55.36 54.68 3h1c s GLN 10 Cb -0.05 -3.34 0.12 0.00 0.80 0.00 0.00 33.01 30.54 3h1c s GLN 10 CO 0.04 0.35 0.21 -0.47 -0.50 0.00 0.00 175.29 174.92 3h1c s TYR 11 N -0.51 0.05 0.00 1.67 5.04 -0.73 -4.94 117.35 117.92 3h1c s TYR 11 Ca 0.44 -0.71 0.00 0.00 -2.44 0.00 0.00 57.07 54.37 3h1c s TYR 11 Cb -0.24 -0.72 0.00 0.00 0.35 0.00 0.00 41.96 41.35 3h1c s TYR 11 CO 0.31 -0.87 0.00 0.41 -1.34 0.00 0.00 175.55 174.06 3h1c n GLY 12 N 5.08 1.59 0.00 8.97 0.00 -1.26 -2.47 105.19 117.10 3h1c n GLY 12 Ca -0.02 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.30 3h1c n GLY 12 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h1c n GLN 13 N 0.00 2.51 -4.26 1.61 1.13 -1.26 -5.09 117.38 112.01 3h1c n GLN 13 Ca 0.00 0.00 -0.31 0.00 -1.94 0.00 0.00 57.00 54.75 3h1c n GLN 13 Cb 0.00 -0.76 -0.09 0.00 0.11 0.00 0.00 30.24 29.50 3h1c n GLN 13 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 3h1c s HIS 14 N -1.26 2.88 -0.14 1.08 3.76 -1.03 -5.08 115.29 115.50 3h1c s HIS 14 Ca 0.00 -0.07 -0.22 0.00 -0.15 0.00 0.00 55.06 54.62 3h1c s HIS 14 Cb 0.00 -1.52 -0.03 0.00 1.11 0.00 0.00 32.58 32.13 3h1c s HIS 14 CO 0.00 0.43 0.64 0.95 -0.85 0.00 0.00 174.74 175.91 3h1c s THR 15 N -1.18 5.05 -0.20 1.30 -4.23 -1.26 -1.78 115.64 113.34 3h1c s THR 15 Ca 0.22 1.27 -0.10 0.00 -1.18 0.00 0.00 61.69 61.89 3h1c s THR 15 Cb -0.11 -3.97 -0.05 0.00 1.34 0.00 0.00 72.50 69.71 3h1c s THR 15 CO 0.14 0.19 0.15 -0.69 -0.54 0.00 0.00 174.62 173.86 3h1c s VAL 16 N 1.34 5.39 -0.18 2.29 1.01 -0.46 -2.22 120.40 127.57 3h1c s VAL 16 Ca 0.32 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.53 3h1c s VAL 16 Cb -0.16 -3.49 0.01 0.00 0.00 0.00 0.00 36.38 32.74 3h1c s VAL 16 CO 0.13 0.42 -0.17 -0.89 0.00 0.00 0.00 175.10 174.60 3h1c s THR 17 N 0.44 2.33 -0.19 3.92 2.01 0.42 -2.28 115.64 122.30 3h1c s THR 17 Ca 0.09 -0.85 -0.02 0.00 0.31 0.00 0.00 61.69 61.22 3h1c s THR 17 Cb -0.11 -2.00 -0.00 0.00 0.01 0.00 0.00 72.50 70.40 3h1c s THR 17 CO -0.01 0.52 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.57 3h1c s LEU 18 N 1.27 2.61 -0.04 4.42 1.02 -0.93 -1.21 118.68 125.82 3h1c s LEU 18 Ca 0.04 -0.46 0.05 0.00 0.02 0.00 0.00 54.13 53.77 3h1c s LEU 18 Cb -0.13 -1.63 -0.01 0.00 0.02 0.00 0.00 46.19 44.44 3h1c s LEU 18 CO -0.10 0.02 -0.19 -0.70 0.02 0.00 0.00 176.35 175.40 3h1c s GLU 19 N 1.22 1.88 0.01 1.70 2.12 0.11 -1.89 118.70 123.85 3h1c s GLU 19 Ca 0.02 -0.68 -0.11 0.00 0.36 0.00 0.00 54.97 54.56 3h1c s GLU 19 Cb -0.14 -1.66 0.01 0.00 0.26 0.00 0.00 34.13 32.60 3h1c s GLU 19 CO -0.05 0.30 0.23 -0.08 -0.54 0.00 0.00 175.26 175.13 3h1c s THR 20 N -0.09 0.08 0.00 -1.70 -1.32 -0.74 0.58 115.64 112.46 3h1c s THR 20 Ca -0.02 -0.68 0.00 0.00 -1.21 0.00 0.00 61.69 59.79 3h1c s THR 20 Cb -0.11 -0.70 0.00 0.00 -1.51 0.00 0.00 72.50 70.18 3h1c s THR 20 CO 0.02 -0.37 0.00 0.61 -2.21 0.00 0.00 174.62 172.67 3h1c n GLY 21 N 1.05 1.86 0.07 6.08 0.00 -1.26 -1.25 105.19 111.74 3h1c n GLY 21 Ca -0.21 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.75 3h1c n GLY 21 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3h1c n MET 22 N -0.27 0.46 -2.95 1.61 0.00 -1.26 -4.84 117.12 109.86 3h1c n MET 22 Ca 0.00 0.37 -0.40 0.00 0.00 0.00 0.00 57.70 57.67 3h1c n MET 22 Cb 0.00 -1.52 -0.06 0.00 0.00 0.00 0.00 33.22 31.65 3h1c n MET 22 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 3h1c s MET 23 N -2.45 4.57 -0.76 2.12 -1.94 -1.26 -4.36 119.30 115.22 3h1c s MET 23 Ca -0.20 1.17 -0.01 0.00 -1.71 0.00 0.00 55.69 54.95 3h1c s MET 23 Cb 0.03 -3.30 0.00 0.00 2.01 0.00 0.00 34.83 33.57 3h1c s MET 23 CO 0.30 0.46 0.66 0.00 -0.01 0.00 0.00 175.02 176.43 3h1c n ALA 24 N 2.02 -2.61 0.15 3.03 0.00 -1.26 -4.71 120.51 117.13 3h1c n ALA 24 Ca -0.04 -0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.40 3h1c n ALA 24 Cb 0.49 -1.26 0.06 0.00 0.00 0.00 0.00 19.45 18.74 3h1c n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h1c h ARG 25 N 0.24 0.00 0.00 0.00 3.08 -1.89 -3.27 114.38 112.53 3h1c h ARG 25 Ca -0.23 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.74 3h1c h ARG 25 Cb 1.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 3h1c h ARG 25 CO 0.32 0.19 -0.39 0.37 -1.07 0.00 0.00 179.97 179.39 3h1c h GLN 26 N 0.00 0.00 -7.35 0.04 4.15 -1.96 -3.45 115.11 106.55 3h1c h GLN 26 Ca -0.02 0.00 -0.51 0.00 0.77 0.00 0.00 58.65 58.89 3h1c h GLN 26 Cb 1.19 0.00 0.10 0.00 0.21 0.00 0.00 27.48 28.98 3h1c h GLN 26 CO 0.03 0.39 0.36 0.00 -1.93 0.00 0.00 178.83 177.68 3h1c s ALA 27 N -3.19 2.61 0.16 3.38 0.00 -1.23 -4.99 121.76 118.50 3h1c s ALA 27 Ca 0.03 0.05 -0.12 0.00 0.00 0.00 0.00 51.96 51.93 3h1c s ALA 27 Cb 0.08 -3.17 0.05 0.00 0.00 0.00 0.00 23.12 20.08 3h1c s ALA 27 CO 0.71 -1.31 1.66 1.15 0.00 0.00 0.00 175.76 177.97 3h1c h THR 28 N -0.79 1.25 -2.46 0.00 2.02 -1.87 -3.45 112.91 107.62 3h1c h THR 28 Ca -0.44 -0.91 -0.09 0.00 0.77 0.00 0.00 66.41 65.74 3h1c h THR 28 Cb 1.22 0.78 -0.22 0.00 -1.74 0.00 0.00 68.15 68.19 3h1c h THR 28 CO 0.57 0.33 -0.07 0.00 0.37 0.00 0.00 175.52 176.72 3h1c s ALA 29 N -5.27 -1.32 -0.16 6.16 0.00 -0.99 -4.74 121.76 115.44 3h1c s ALA 29 Ca -0.13 1.30 -0.06 0.00 0.00 0.00 0.00 51.96 53.08 3h1c s ALA 29 Cb 0.12 -0.59 0.08 0.00 0.00 0.00 0.00 23.12 22.72 3h1c s ALA 29 CO 0.81 -0.27 0.34 0.00 0.00 0.00 0.00 175.76 176.63 3h1c s ALA 30 N -0.20 -0.84 -0.18 0.00 0.00 -1.26 -1.61 121.76 117.68 3h1c s ALA 30 Ca -0.04 1.20 0.01 0.00 0.00 0.00 0.00 51.96 53.13 3h1c s ALA 30 Cb -0.03 -1.16 0.03 0.00 0.00 0.00 0.00 23.12 21.95 3h1c s ALA 30 CO 0.03 -0.69 -0.16 0.08 0.00 0.00 0.00 175.76 175.01 3h1c s VAL 31 N 2.50 1.89 -0.67 0.00 1.01 -1.01 -4.36 120.40 119.77 3h1c s VAL 31 Ca -0.00 -0.93 -0.24 0.00 0.00 0.00 0.00 61.98 60.80 3h1c s VAL 31 Cb -0.12 -1.78 0.05 0.00 0.00 0.00 0.00 36.38 34.53 3h1c s VAL 31 CO -0.10 0.42 1.07 -0.32 0.00 0.00 0.00 175.10 176.17 3h1c s MET 32 N 1.34 3.18 -0.03 2.72 1.75 0.20 -3.35 119.30 125.11 3h1c s MET 32 Ca 0.03 -0.52 -0.02 0.00 -1.25 0.00 0.00 55.69 53.93 3h1c s MET 32 Cb -0.14 -4.18 -0.04 0.00 2.84 0.00 0.00 34.83 33.31 3h1c s MET 32 CO -0.11 -1.87 0.11 0.54 -0.65 0.00 0.00 175.02 173.03 3h1c s VAL 33 N 4.63 4.98 -0.21 10.11 0.11 -1.25 -0.71 120.40 138.06 3h1c s VAL 33 Ca 0.28 -0.24 -0.09 0.00 -2.93 0.00 0.00 61.98 59.00 3h1c s VAL 33 Cb -0.13 -3.26 0.08 0.00 -1.53 0.00 0.00 36.38 31.55 3h1c s VAL 33 CO 0.14 0.41 0.47 -0.94 -3.33 0.00 0.00 175.10 171.85 3h1c s SER 34 N -1.60 -0.52 -0.25 3.54 1.04 -0.35 -2.39 113.70 113.16 3h1c s SER 34 Ca 0.22 1.08 0.00 0.00 0.48 0.00 0.00 55.95 57.73 3h1c s SER 34 Cb -0.12 1.26 0.04 0.00 0.10 0.00 0.00 66.02 67.30 3h1c s SER 34 CO 0.13 -0.22 -0.09 -0.32 0.98 0.00 0.00 173.24 173.72 3h1c s MET 35 N 2.12 2.61 -0.96 4.02 1.75 -0.79 -0.44 119.30 127.62 3h1c s MET 35 Ca -0.06 -1.12 -0.13 0.00 -1.25 0.00 0.00 55.69 53.13 3h1c s MET 35 Cb -0.10 -2.93 0.02 0.00 2.84 0.00 0.00 34.83 34.66 3h1c s MET 35 CO -0.14 -0.46 0.62 -3.47 -0.65 0.00 0.00 175.02 170.91 3h1c n ASP 36 N 4.58 -4.42 0.00 1.11 2.03 -0.94 -3.32 116.55 115.58 3h1c n ASP 36 Ca -0.16 -1.09 0.00 0.00 0.52 0.00 0.00 54.79 54.06 3h1c n ASP 36 Cb 0.45 -1.55 0.00 0.00 -0.72 0.00 0.00 41.12 39.30 3h1c n ASP 36 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3h1c n ASP 37 N -2.38 0.00 -1.63 1.67 8.00 -1.26 -4.79 116.55 116.15 3h1c n ASP 37 Ca -0.24 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.10 3h1c n ASP 37 Cb 0.63 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.73 3h1c n ASP 37 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3h1c n THR 38 N 0.00 0.27 -3.70 -3.53 -1.04 -1.21 -4.79 114.28 100.29 3h1c n THR 38 Ca 0.00 -0.19 -0.13 0.00 -2.04 0.00 0.00 64.05 61.69 3h1c n THR 38 Cb 0.00 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.42 3h1c n THR 38 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h1c s ALA 39 N -0.62 -1.29 -0.12 2.41 0.00 0.11 -1.88 121.76 120.37 3h1c s ALA 39 Ca 0.23 1.47 -0.02 0.00 0.00 0.00 0.00 51.96 53.64 3h1c s ALA 39 Cb -0.25 -0.86 0.04 0.00 0.00 0.00 0.00 23.12 22.05 3h1c s ALA 39 CO 0.24 -0.25 0.01 0.08 0.00 0.00 0.00 175.76 175.84 3h1c s VAL 40 N 0.30 0.47 -0.40 0.00 1.01 -1.01 -2.22 120.40 118.56 3h1c s VAL 40 Ca -0.00 -0.15 -0.27 0.00 0.00 0.00 0.00 61.98 61.55 3h1c s VAL 40 Cb -0.04 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.62 3h1c s VAL 40 CO 0.00 0.10 1.02 0.12 0.00 0.00 0.00 175.10 176.34 3h1c s PHE 41 N 1.92 3.00 -0.10 5.22 5.36 0.42 -3.79 117.98 130.01 3h1c s PHE 41 Ca 0.03 0.80 0.01 0.00 -0.96 0.00 0.00 56.93 56.81 3h1c s PHE 41 Cb -0.14 -3.92 -0.02 0.00 -0.34 0.00 0.00 43.02 38.59 3h1c s PHE 41 CO -0.06 -0.98 -0.12 0.08 -1.46 0.00 0.00 175.22 172.68 3h1c s VAL 42 N 3.83 3.20 -0.01 3.12 1.01 -1.21 -1.24 120.40 129.09 3h1c s VAL 42 Ca 0.42 -0.64 0.05 0.00 0.00 0.00 0.00 61.98 61.82 3h1c s VAL 42 Cb -0.10 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 3h1c s VAL 42 CO 0.23 0.56 -0.16 0.42 0.00 0.00 0.00 175.10 176.14 3h1c s THR 43 N -0.18 1.30 -0.17 3.92 -4.23 0.04 -2.39 115.64 113.93 3h1c s THR 43 Ca 0.01 -0.70 0.01 0.00 -1.18 0.00 0.00 61.69 59.82 3h1c s THR 43 Cb -0.13 -1.09 0.02 0.00 1.34 0.00 0.00 72.50 72.65 3h1c s THR 43 CO 0.03 0.37 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.63 3h1c s VAL 44 N -0.36 1.78 -0.16 2.29 1.01 -0.63 -0.82 120.40 123.51 3h1c s VAL 44 Ca 0.06 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.25 3h1c s VAL 44 Cb -0.07 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.68 3h1c s VAL 44 CO -0.01 0.46 -0.16 -0.69 0.00 0.00 0.00 175.10 174.70 3h1c s VAL 45 N 1.40 1.76 -0.06 2.92 1.01 -0.80 -2.35 120.40 124.27 3h1c s VAL 45 Ca 0.04 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.30 3h1c s VAL 45 Cb -0.13 -1.62 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 3h1c s VAL 45 CO -0.11 0.49 -0.14 -0.83 0.00 0.00 0.00 175.10 174.50 3h1c s GLY 46 N 1.40 1.53 0.12 4.51 0.00 -1.26 -1.29 107.32 112.32 3h1c s GLY 46 Ca 0.05 -0.97 -0.31 0.00 0.00 0.00 0.00 44.72 43.50 3h1c s GLY 46 CO -0.11 -0.67 1.25 1.62 0.00 0.00 0.00 173.10 175.19 3h1c s GLN 47 N -0.54 4.42 -0.00 2.90 2.00 0.48 -4.96 119.66 123.95 3h1c s GLN 47 Ca 0.07 1.89 -0.25 0.00 -2.00 0.00 0.00 55.36 55.08 3h1c s GLN 47 Cb -0.12 -3.28 -0.18 0.00 0.80 0.00 0.00 33.01 30.23 3h1c s GLN 47 CO 0.01 -0.26 1.30 0.87 -0.50 0.00 0.00 175.29 176.71 3h1c h LYS 48 N 6.30 -0.11 -5.26 1.67 1.79 -1.99 -3.43 116.57 115.54 3h1c h LYS 48 Ca -0.43 0.01 -0.61 0.00 -2.18 0.00 0.00 60.65 57.44 3h1c h LYS 48 Cb 1.21 0.03 -0.14 0.00 -1.58 0.00 0.00 32.23 31.75 3h1c h LYS 48 CO 0.81 0.26 -0.52 0.15 -1.08 0.00 0.00 179.45 179.07 3h1c s LYS 49 N -4.56 4.10 0.34 3.15 1.02 -1.26 -5.09 119.74 117.44 3h1c s LYS 49 Ca -0.15 -0.27 -0.27 0.00 0.02 0.00 0.00 55.97 55.30 3h1c s LYS 49 Cb 0.02 -3.34 -0.09 0.00 -0.52 0.00 0.00 37.83 33.90 3h1c s LYS 49 CO 0.63 0.27 1.06 0.00 -0.92 0.00 0.00 175.35 176.39 3h1c s ALA 50 N 0.41 3.23 0.05 5.17 0.00 -1.26 -4.91 121.76 124.44 3h1c s ALA 50 Ca 0.06 0.77 -0.31 0.00 0.00 0.00 0.00 51.96 52.48 3h1c s ALA 50 Cb -0.12 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.65 3h1c s ALA 50 CO -0.01 -0.15 1.39 0.21 0.00 0.00 0.00 175.76 177.20 3h1c s LYS 51 N -1.98 4.30 0.42 0.00 2.47 -1.26 -4.93 119.74 118.76 3h1c s LYS 51 Ca 0.51 2.00 0.09 0.00 -1.56 0.00 0.00 55.97 57.01 3h1c s LYS 51 Cb -0.26 -3.45 0.92 0.00 -1.46 0.00 0.00 37.83 33.58 3h1c s LYS 51 CO 0.33 -0.51 2.05 -1.00 0.16 0.00 0.00 175.35 176.38 3h1c h PRO 52 N 7.44 0.47 -2.28 4.03 0.13 -2.01 -3.13 132.00 136.65 3h1c h PRO 52 Ca -0.40 -0.03 -0.77 0.00 -0.87 0.00 0.00 66.00 63.94 3h1c h PRO 52 Cb 1.19 -0.11 -0.23 0.00 0.13 0.00 0.00 31.00 31.99 3h1c h PRO 52 CO 0.88 0.31 1.32 0.41 -0.23 0.00 0.00 178.00 180.70 3h1c n GLY 53 N -1.49 5.72 2.98 1.56 0.00 -1.26 -4.95 105.19 107.75 3h1c n GLY 53 Ca 0.04 -2.39 -0.10 0.00 0.00 0.00 0.00 46.02 43.56 3h1c n GLY 53 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h1c s GLN 54 N -3.38 0.30 0.00 1.61 -1.52 -1.18 -5.05 119.66 110.44 3h1c s GLN 54 Ca 0.46 -0.56 0.00 0.00 -1.95 0.00 0.00 55.36 53.31 3h1c s GLN 54 Cb 0.24 0.05 0.00 0.00 -0.22 0.00 0.00 33.01 33.08 3h1c s GLN 54 CO -0.17 -0.03 0.00 -0.40 -0.25 0.00 0.00 175.29 174.44 3h1c n ASP 55 N 1.75 0.97 -4.92 5.90 5.75 -1.26 -5.06 116.55 119.67 3h1c n ASP 55 Ca -0.23 0.00 -0.28 0.00 -0.01 0.00 0.00 54.79 54.28 3h1c n ASP 55 Cb 0.55 0.08 -0.03 0.00 -1.03 0.00 0.00 41.12 40.69 3h1c n ASP 55 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3h1c s PHE 56 N -1.20 3.48 -0.37 2.11 -0.12 -1.26 -4.97 117.98 115.65 3h1c s PHE 56 Ca 0.00 0.40 -0.24 0.00 -0.05 0.00 0.00 56.93 57.05 3h1c s PHE 56 Cb 0.00 -1.90 0.01 0.00 -0.63 0.00 0.00 43.02 40.50 3h1c s PHE 56 CO 0.00 0.34 0.81 0.12 -0.05 0.00 0.00 175.22 176.44 3h1c s PHE 57 N -1.91 3.10 -0.59 3.49 5.36 -1.26 -4.86 117.98 121.31 3h1c s PHE 57 Ca 0.40 0.58 -0.22 0.00 -0.96 0.00 0.00 56.93 56.73 3h1c s PHE 57 Cb -0.11 -3.46 0.07 0.00 -0.34 0.00 0.00 43.02 39.18 3h1c s PHE 57 CO 0.29 -0.76 0.84 -1.25 -1.46 0.00 0.00 175.22 172.88 3h1c s PRO 58 N 3.17 3.15 -0.21 10.12 0.04 -1.26 -5.01 135.00 144.99 3h1c s PRO 58 Ca 0.32 -0.81 0.00 0.00 0.04 0.00 0.00 61.00 60.56 3h1c s PRO 58 Cb -0.13 -4.17 0.02 0.00 0.04 0.00 0.00 34.50 30.27 3h1c s PRO 58 CO 0.17 -1.57 -0.13 -1.17 0.04 0.00 0.00 177.00 174.34 3h1c s LEU 59 N 3.49 2.69 -0.20 -3.56 2.96 -1.26 -3.29 118.68 119.52 3h1c s LEU 59 Ca 0.21 -0.80 0.01 0.00 -0.22 0.00 0.00 54.13 53.33 3h1c s LEU 59 Cb -0.18 -1.57 0.04 0.00 0.50 0.00 0.00 46.19 44.99 3h1c s LEU 59 CO 0.12 -0.06 -0.13 0.28 -1.32 0.00 0.00 176.35 175.23 3h1c s THR 60 N 1.29 1.81 -0.28 3.68 -1.32 -1.23 -5.09 115.64 114.51 3h1c s THR 60 Ca 0.02 -1.05 -0.09 0.00 -1.21 0.00 0.00 61.69 59.36 3h1c s THR 60 Cb -0.15 -1.81 -0.03 0.00 -1.51 0.00 0.00 72.50 69.00 3h1c s THR 60 CO -0.09 0.26 0.13 -0.69 -2.21 0.00 0.00 174.62 172.03 3h1c s VAL 61 N 1.34 4.72 -0.29 5.08 1.01 -1.26 -2.10 120.40 128.90 3h1c s VAL 61 Ca -0.00 -0.13 -0.08 0.00 0.00 0.00 0.00 61.98 61.77 3h1c s VAL 61 Cb -0.16 -3.28 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 3h1c s VAL 61 CO -0.09 0.23 0.10 0.20 0.00 0.00 0.00 175.10 175.54 3h1c s ASN 62 N 1.66 5.25 -0.35 3.32 0.01 0.63 -4.85 114.94 120.62 3h1c s ASN 62 Ca 0.06 -0.50 -0.01 0.00 -0.71 0.00 0.00 52.86 51.70 3h1c s ASN 62 Cb -0.16 -1.93 0.09 0.00 0.41 0.00 0.00 41.25 39.66 3h1c s ASN 62 CO 0.07 -0.15 0.10 -0.47 -1.51 0.00 0.00 177.10 175.14 3h1c s TYR 63 N 1.57 3.49 -0.19 2.20 5.04 -1.26 -0.61 117.35 127.60 3h1c s TYR 63 Ca 0.04 -2.31 -0.01 0.00 -2.44 0.00 0.00 57.07 52.35 3h1c s TYR 63 Cb -0.16 -2.74 -0.00 0.00 0.35 0.00 0.00 41.96 39.40 3h1c s TYR 63 CO 0.04 -0.91 -0.11 1.14 -1.34 0.00 0.00 175.55 174.37 3h1c s GLN 64 N 1.14 3.26 -0.31 4.97 -2.07 -1.03 -4.72 119.66 120.90 3h1c s GLN 64 Ca 0.03 -0.70 -0.19 0.00 -1.82 0.00 0.00 55.36 52.68 3h1c s GLN 64 Cb -0.21 -2.78 -0.01 0.00 -1.09 0.00 0.00 33.01 28.92 3h1c s GLN 64 CO -0.04 -0.10 0.54 -1.21 -1.32 0.00 0.00 175.29 173.17 3h1c s GLU 65 N 1.15 3.83 -0.12 9.60 2.02 -1.26 -2.18 118.70 131.74 3h1c s GLU 65 Ca 0.01 0.10 -0.15 0.00 0.02 0.00 0.00 54.97 54.96 3h1c s GLU 65 Cb -0.14 -3.74 -0.05 0.00 0.10 0.00 0.00 34.13 30.30 3h1c s GLU 65 CO -0.04 -0.54 0.35 1.03 0.02 0.00 0.00 175.26 176.08 3h1c s ARG 66 N 2.43 4.18 0.35 1.61 0.52 -1.22 -4.97 118.95 121.85 3h1c s ARG 66 Ca 0.21 0.21 0.27 0.00 -0.52 0.00 0.00 55.73 55.90 3h1c s ARG 66 Cb -0.15 -3.39 1.05 0.00 0.52 0.00 0.00 34.95 32.99 3h1c s ARG 66 CO 0.12 0.31 1.80 1.79 0.02 0.00 0.00 175.30 179.34 3h1c h THR 67 N 4.51 0.00 0.00 0.02 1.35 -1.89 -2.86 112.91 114.04 3h1c h THR 67 Ca -0.43 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 3h1c h THR 67 Cb 1.18 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 3h1c h THR 67 CO 0.73 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.00 3h1c n TYR 68 N -2.54 0.00 -0.28 4.73 4.11 -1.25 -2.73 117.16 119.20 3h1c n TYR 68 Ca 0.02 0.00 -0.05 0.00 -0.00 0.00 0.00 57.90 57.87 3h1c n TYR 68 Cb 0.29 -0.46 0.06 0.00 -0.00 0.00 0.00 39.34 39.23 3h1c n TYR 68 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 3h1c h ALA 69 N 2.68 0.99 0.00 -3.48 0.00 -1.64 -2.54 119.26 115.28 3h1c h ALA 69 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3h1c h ALA 69 Cb 0.29 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3h1c h ALA 69 CO 0.00 0.51 -0.66 0.00 0.00 0.00 0.00 179.25 179.11 3h1c n ALA 70 N -2.37 3.34 -1.52 0.00 0.00 -1.21 -2.97 120.51 115.79 3h1c n ALA 70 Ca 0.07 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.18 3h1c n ALA 70 Cb 0.10 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.45 3h1c n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h1c n GLY 71 N 1.42 0.47 2.89 0.00 0.00 -0.96 -5.07 105.19 103.96 3h1c n GLY 71 Ca 0.04 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.58 3h1c n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3h1c s ARG 72 N -2.82 0.05 -0.11 1.61 3.52 -1.10 -5.03 118.95 115.07 3h1c s ARG 72 Ca 0.00 -0.08 -0.23 0.00 -0.13 0.00 0.00 55.73 55.30 3h1c s ARG 72 Cb 0.00 0.02 -0.03 0.00 -1.56 0.00 0.00 34.95 33.38 3h1c s ARG 72 CO 0.00 -0.01 0.68 0.42 -0.81 0.00 0.00 175.30 175.58 3h1c s ILE 73 N -0.21 5.04 0.45 4.11 1.01 -1.26 -3.96 121.20 126.39 3h1c s ILE 73 Ca -0.02 1.37 -0.25 0.00 0.00 0.00 0.00 60.65 61.74 3h1c s ILE 73 Cb -0.01 -4.01 -0.08 0.00 0.01 0.00 0.00 42.46 38.36 3h1c s ILE 73 CO -0.00 0.21 1.43 -2.16 0.00 0.00 0.00 174.94 174.42 3h1c s PRO 74 N 1.12 3.66 -0.90 2.79 0.04 -1.26 -4.92 135.00 135.53 3h1c s PRO 74 Ca 0.35 2.43 -0.04 0.00 0.04 0.00 0.00 61.00 63.77 3h1c s PRO 74 Cb -0.17 -2.64 0.13 0.00 0.04 0.00 0.00 34.50 31.86 3h1c s PRO 74 CO 0.15 -0.84 2.47 0.41 0.04 0.00 0.00 177.00 179.23 3h1c n GLY 75 N 0.58 4.97 3.76 0.56 0.00 -1.26 -4.67 105.19 109.13 3h1c n GLY 75 Ca 0.05 -2.07 -0.25 0.00 0.00 0.00 0.00 46.02 43.75 3h1c n GLY 75 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h1c s SER 76 N 0.09 4.42 0.20 1.61 0.15 -1.26 -5.02 113.70 113.89 3h1c s SER 76 Ca 0.54 -1.14 -0.01 0.00 0.70 0.00 0.00 55.95 56.04 3h1c s SER 76 Cb 0.29 -0.32 0.16 0.00 -1.71 0.00 0.00 66.02 64.44 3h1c s SER 76 CO -0.18 -0.62 1.53 0.15 1.20 0.00 0.00 173.24 175.32 3h1c h PHE 77 N 1.35 0.61 0.00 3.44 3.57 -1.95 -3.07 116.94 120.89 3h1c h PHE 77 Ca -0.42 -0.21 -0.01 0.00 3.53 0.00 0.00 57.97 60.85 3h1c h PHE 77 Cb 1.26 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.88 3h1c h PHE 77 CO 0.73 0.92 -0.49 0.74 -2.23 0.00 0.00 178.31 177.98 3h1c h PHE 78 N 0.38 0.00 -3.46 0.41 -1.00 -1.96 -3.48 116.94 107.83 3h1c h PHE 78 Ca 0.01 0.00 -0.38 0.00 2.81 0.00 0.00 57.97 60.41 3h1c h PHE 78 Cb 1.07 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.65 3h1c h PHE 78 CO 0.04 0.04 -0.53 0.54 -1.61 0.00 0.00 178.31 176.78 3h1c n ARG 79 N -2.92 -3.05 -4.33 1.51 5.12 -1.16 -5.01 116.66 106.82 3h1c n ARG 79 Ca 0.02 0.90 -0.17 0.00 -1.93 0.00 0.00 57.85 56.66 3h1c n ARG 79 Cb 0.56 -5.55 -0.10 0.00 -1.16 0.00 0.00 32.46 26.20 3h1c n ARG 79 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 3h1c s ARG 80 N -5.29 1.29 -0.06 5.56 3.52 -1.26 -4.72 118.95 118.00 3h1c s ARG 80 Ca 0.14 -1.60 -0.29 0.00 -0.13 0.00 0.00 55.73 53.84 3h1c s ARG 80 Cb -0.06 -0.89 -0.07 0.00 -1.56 0.00 0.00 34.95 32.37 3h1c s ARG 80 CO 0.17 0.07 1.97 -1.21 -0.81 0.00 0.00 175.30 175.50 3h1c s GLU 81 N -3.73 3.85 0.00 5.12 0.41 -1.26 -4.90 118.70 118.19 3h1c s GLU 81 Ca 0.23 2.34 0.00 0.00 -0.41 0.00 0.00 54.97 57.13 3h1c s GLU 81 Cb 0.02 -4.19 0.00 0.00 -1.78 0.00 0.00 34.13 28.18 3h1c s GLU 81 CO 0.06 -1.27 0.00 0.41 -0.49 0.00 0.00 175.26 173.97 3h1c n GLY 82 N 4.83 -0.61 3.77 -1.39 0.00 -1.26 -5.04 105.19 105.48 3h1c n GLY 82 Ca 0.22 -1.73 -0.38 0.00 0.00 0.00 0.00 46.02 44.14 3h1c n GLY 82 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h1c s ARG 83 N -2.14 3.98 -0.48 1.61 0.52 -1.26 -4.88 118.95 116.30 3h1c s ARG 83 Ca 0.00 1.80 -0.46 0.00 -0.52 0.00 0.00 55.73 56.55 3h1c s ARG 83 Cb 0.00 -2.60 -0.19 0.00 0.52 0.00 0.00 34.95 32.68 3h1c s ARG 83 CO 0.00 -0.37 1.70 -2.30 0.02 0.00 0.00 175.30 174.35 3h1c n PRO 84 N -0.08 0.09 -1.49 3.54 -0.02 -1.26 -4.93 135.00 130.85 3h1c n PRO 84 Ca 0.05 0.03 -0.30 0.00 -2.02 0.00 0.00 63.50 61.27 3h1c n PRO 84 Cb 0.47 -1.55 0.20 0.00 -0.02 0.00 0.00 33.50 32.60 3h1c n PRO 84 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3h1c s SER 85 N 3.52 2.27 0.30 2.55 0.15 -1.26 -4.77 113.70 116.47 3h1c s SER 85 Ca 1.07 0.58 -0.01 0.00 0.70 0.00 0.00 55.95 58.29 3h1c s SER 85 Cb -1.47 -0.82 0.48 0.00 -1.71 0.00 0.00 66.02 62.50 3h1c s SER 85 CO 0.78 -3.28 1.94 -0.08 1.20 0.00 0.00 173.24 173.80 3h1c h GLU 86 N -2.01 1.05 -0.12 5.44 4.81 -2.00 -1.93 114.58 119.83 3h1c h GLU 86 Ca -0.46 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 58.60 3h1c h GLU 86 Cb 1.28 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3h1c h GLU 86 CO 0.42 0.70 -0.35 0.78 -0.73 0.00 0.00 179.01 179.82 3h1c h GLY 87 N 1.08 0.49 1.78 1.92 0.00 -2.01 -3.24 103.07 103.08 3h1c h GLY 87 Ca 0.35 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 3h1c h GLY 87 CO -0.11 0.56 0.07 0.83 0.00 0.00 0.00 176.54 177.89 3h1c h GLU 88 N 0.03 0.29 0.00 4.80 5.08 -1.81 -2.01 114.58 120.96 3h1c h GLU 88 Ca -0.01 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 3h1c h GLU 88 Cb 0.97 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 3h1c h GLU 88 CO 0.08 0.26 -0.41 1.79 -1.00 0.00 0.00 179.01 179.72 3h1c h THR 89 N 0.30 0.83 -0.15 1.13 1.35 -1.45 -2.84 112.91 112.08 3h1c h THR 89 Ca 0.07 -1.78 -0.21 0.00 -0.55 0.00 0.00 66.41 63.94 3h1c h THR 89 Cb 0.09 2.13 0.01 0.00 -1.73 0.00 0.00 68.15 68.65 3h1c h THR 89 CO -0.01 0.41 -0.76 -0.07 -0.25 0.00 0.00 175.52 174.85 3h1c h LEU 90 N 0.00 0.87 -0.70 3.87 3.38 -1.39 -2.76 115.31 118.57 3h1c h LEU 90 Ca -0.00 -0.56 -0.14 0.00 0.09 0.00 0.00 57.88 57.27 3h1c h LEU 90 Cb 1.10 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 3h1c h LEU 90 CO 0.05 1.35 -0.63 0.40 0.09 0.00 0.00 178.44 179.71 3h1c h ILE 91 N 0.50 1.43 -0.86 1.22 5.03 -1.58 -2.09 117.51 121.16 3h1c h ILE 91 Ca -0.04 -2.10 0.01 0.00 -0.12 0.00 0.00 64.86 62.61 3h1c h ILE 91 Cb 1.37 2.11 -0.04 0.00 -3.03 0.00 0.00 36.82 37.23 3h1c h ILE 91 CO 0.15 0.61 0.57 0.00 -0.68 0.00 0.00 178.15 178.80 3h1c h ALA 92 N 1.29 1.40 0.01 1.87 0.00 -1.43 -1.41 119.26 120.99 3h1c h ALA 92 Ca -0.01 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.65 3h1c h ALA 92 Cb 1.12 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3h1c h ALA 92 CO 0.09 0.55 -0.88 0.00 0.00 0.00 0.00 179.25 179.01 3h1c h ARG 93 N 1.15 0.15 0.00 0.00 3.08 -1.41 -2.54 114.38 114.81 3h1c h ARG 93 Ca 0.32 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 3h1c h ARG 93 Cb -0.11 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 3h1c h ARG 93 CO -0.07 0.93 -0.08 1.25 -1.07 0.00 0.00 179.97 180.93 3h1c h LEU 94 N 0.08 0.00 0.06 3.04 5.85 -0.62 -0.98 115.31 122.75 3h1c h LEU 94 Ca -0.04 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.33 3h1c h LEU 94 Cb 1.51 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.50 3h1c h LEU 94 CO 0.13 0.08 -2.07 -0.38 -0.34 0.00 0.00 178.44 175.87 3h1c n ILE 95 N -3.47 1.65 0.00 4.05 5.41 -0.61 -4.50 119.36 121.90 3h1c n ILE 95 Ca -0.02 -0.69 -0.11 0.00 1.00 0.00 0.00 62.75 62.94 3h1c n ILE 95 Cb 0.22 -1.41 0.03 0.00 -0.71 0.00 0.00 39.64 37.78 3h1c n ILE 95 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 3h1c h ASP 96 N 0.04 0.65 -0.31 4.38 3.58 -1.11 -3.32 116.42 120.33 3h1c h ASP 96 Ca -0.44 -0.37 -0.02 0.00 0.42 0.00 0.00 57.03 56.62 3h1c h ASP 96 Cb 2.02 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 42.87 3h1c h ASP 96 CO 0.05 1.10 0.12 0.03 -2.88 0.00 0.00 179.24 177.66 3h1c h ARG 97 N 0.43 0.47 0.00 0.28 3.08 -1.41 -2.61 114.38 114.62 3h1c h ARG 97 Ca -0.00 -0.09 -0.11 0.00 0.07 0.00 0.00 59.98 59.84 3h1c h ARG 97 Cb 1.17 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 3h1c h ARG 97 CO 0.11 0.49 -0.55 -1.35 -1.07 0.00 0.00 179.97 177.61 3h1c h PRO 98 N 0.36 0.00 0.00 0.04 0.11 -1.80 -3.33 132.00 127.37 3h1c h PRO 98 Ca 0.10 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.11 3h1c h PRO 98 Cb 0.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.30 3h1c h PRO 98 CO -0.01 0.55 -0.77 -0.84 -0.21 0.00 0.00 178.00 176.72 3h1c h ILE 99 N 0.00 0.59 -0.22 4.15 3.07 -1.64 -3.39 117.51 120.07 3h1c h ILE 99 Ca -0.01 -1.92 -0.02 0.00 1.55 0.00 0.00 64.86 64.47 3h1c h ILE 99 Cb 1.26 2.18 -0.01 0.00 -0.27 0.00 0.00 36.82 39.98 3h1c h ILE 99 CO 0.07 0.34 0.07 -0.09 -1.05 0.00 0.00 178.15 177.49 3h1c h ARG 100 N 0.00 0.35 0.00 0.16 2.43 -1.58 -3.09 114.38 112.65 3h1c h ARG 100 Ca -0.05 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 3h1c h ARG 100 Cb 1.37 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 3h1c h ARG 100 CO 0.05 0.44 0.00 -0.35 -1.51 0.00 0.00 179.97 178.59 3h1c n PRO 101 N -4.77 0.20 0.16 0.20 -0.04 -1.26 -2.94 135.00 126.55 3h1c n PRO 101 Ca -0.03 0.34 0.13 0.00 -0.04 0.00 0.00 63.50 63.90 3h1c n PRO 101 Cb 0.15 -1.82 0.37 0.00 -0.04 0.00 0.00 33.50 32.16 3h1c n PRO 101 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3h1c h LEU 102 N 0.00 0.00 -9.61 1.53 3.38 -1.75 -3.44 115.31 105.43 3h1c h LEU 102 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3h1c h LEU 102 Cb 0.47 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.25 3h1c h LEU 102 CO 0.00 0.00 0.66 -0.36 0.09 0.00 0.00 178.44 178.83 3h1c s PHE 103 N -3.22 3.28 0.69 1.13 0.40 -1.15 -2.64 117.98 116.47 3h1c s PHE 103 Ca 0.08 1.14 -0.16 0.00 -0.60 0.00 0.00 56.93 57.38 3h1c s PHE 103 Cb 0.09 -3.60 -0.01 0.00 0.51 0.00 0.00 43.02 40.01 3h1c s PHE 103 CO 0.59 -1.97 0.92 -2.30 0.70 0.00 0.00 175.22 173.15 3h1c n PRO 104 N 3.27 0.57 -1.98 0.24 -0.02 -1.26 -4.87 135.00 130.95 3h1c n PRO 104 Ca 0.08 0.25 -0.42 0.00 -2.02 0.00 0.00 63.50 61.39 3h1c n PRO 104 Cb 0.43 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.72 3h1c n PRO 104 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3h1c s GLU 105 N -3.14 3.24 0.00 -0.52 0.41 -1.26 -2.54 118.70 114.89 3h1c s GLU 105 Ca 0.73 1.38 0.00 0.00 -0.41 0.00 0.00 54.97 56.68 3h1c s GLU 105 Cb -0.36 -4.23 0.00 0.00 -1.78 0.00 0.00 34.13 27.76 3h1c s GLU 105 CO 0.50 -1.97 0.00 0.41 -0.49 0.00 0.00 175.26 173.71 3h1c n GLY 106 N 5.47 1.35 3.66 -1.39 0.00 -1.26 -4.89 105.19 108.12 3h1c n GLY 106 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 3h1c n GLY 106 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3h1c s PHE 107 N -2.00 3.35 -0.21 1.61 5.36 -1.05 -4.91 117.98 120.14 3h1c s PHE 107 Ca 0.00 1.30 0.06 0.00 -0.96 0.00 0.00 56.93 57.33 3h1c s PHE 107 Cb 0.00 -3.13 -0.08 0.00 -0.34 0.00 0.00 43.02 39.47 3h1c s PHE 107 CO 0.00 -0.39 0.23 0.28 -1.46 0.00 0.00 175.22 173.88 3h1c n VAL 108 N 5.15 0.00 -1.98 3.12 0.31 -1.26 -4.46 118.33 119.20 3h1c n VAL 108 Ca 0.08 -0.29 -0.40 0.00 -0.01 0.00 0.00 64.34 63.71 3h1c n VAL 108 Cb 0.47 0.80 -0.01 0.00 -0.91 0.00 0.00 33.84 34.20 3h1c n VAL 108 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3h1c s ASN 109 N -1.95 6.46 0.06 4.52 0.01 -1.26 -4.52 114.94 118.26 3h1c s ASN 109 Ca 0.01 2.80 -0.30 0.00 -0.71 0.00 0.00 52.86 54.66 3h1c s ASN 109 Cb 0.05 -2.65 -0.05 0.00 0.41 0.00 0.00 41.25 39.00 3h1c s ASN 109 CO 0.26 -0.76 1.11 -0.70 -1.51 0.00 0.00 177.10 175.49 3h1c s GLU 110 N -2.05 4.50 -0.02 -0.60 2.12 -1.26 -4.62 118.70 116.77 3h1c s GLU 110 Ca 0.53 1.64 -0.00 0.00 0.36 0.00 0.00 54.97 57.50 3h1c s GLU 110 Cb -0.42 -3.37 0.03 0.00 0.26 0.00 0.00 34.13 30.63 3h1c s GLU 110 CO 0.55 -0.13 0.03 0.54 -0.54 0.00 0.00 175.26 175.71 3h1c s VAL 111 N 0.83 -0.02 -0.10 3.70 0.11 -1.21 -0.39 120.40 123.33 3h1c s VAL 111 Ca 0.55 0.21 0.02 0.00 -2.93 0.00 0.00 61.98 59.84 3h1c s VAL 111 Cb -0.27 -0.13 -0.01 0.00 -1.53 0.00 0.00 36.38 34.45 3h1c s VAL 111 CO 0.30 0.11 -0.18 -1.58 -3.33 0.00 0.00 175.10 170.42 3h1c s GLN 112 N 1.17 3.05 -0.33 1.54 0.74 -0.41 -3.54 119.66 121.88 3h1c s GLN 112 Ca -0.08 -0.77 -0.04 0.00 0.05 0.00 0.00 55.36 54.52 3h1c s GLN 112 Cb -0.13 -2.43 0.05 0.00 1.10 0.00 0.00 33.01 31.60 3h1c s GLN 112 CO -0.03 0.29 0.07 0.08 -0.55 0.00 0.00 175.29 175.15 3h1c s VAL 113 N 0.12 3.43 -0.38 1.34 1.01 -0.89 -1.91 120.40 123.12 3h1c s VAL 113 Ca -0.09 -1.32 -0.09 0.00 0.00 0.00 0.00 61.98 60.48 3h1c s VAL 113 Cb -0.15 -2.99 0.05 0.00 0.00 0.00 0.00 36.38 33.28 3h1c s VAL 113 CO 0.06 -0.20 0.20 -0.63 0.00 0.00 0.00 175.10 174.52 3h1c s ILE 114 N 1.32 4.23 -0.35 2.22 1.09 0.00 -0.26 121.20 129.44 3h1c s ILE 114 Ca -0.02 -1.13 -0.04 0.00 -1.10 0.00 0.00 60.65 58.36 3h1c s ILE 114 Cb -0.20 -3.45 0.07 0.00 -1.06 0.00 0.00 42.46 37.82 3h1c s ILE 114 CO 0.01 -0.32 0.11 0.00 -0.10 0.00 0.00 174.94 174.64 3h1c s ALA 115 N 1.46 3.02 -0.15 9.38 0.00 0.22 -0.78 121.76 134.91 3h1c s ALA 115 Ca 0.01 -2.04 -0.04 0.00 0.00 0.00 0.00 51.96 49.89 3h1c s ALA 115 Cb -0.21 -2.23 -0.03 0.00 0.00 0.00 0.00 23.12 20.66 3h1c s ALA 115 CO 0.04 -1.49 -0.01 -0.08 0.00 0.00 0.00 175.76 174.21 3h1c s THR 116 N 1.26 4.11 -0.06 0.00 -1.32 -0.37 -2.47 115.64 116.79 3h1c s THR 116 Ca 0.01 -0.29 -0.30 0.00 -1.21 0.00 0.00 61.69 59.90 3h1c s THR 116 Cb -0.21 -2.80 -0.02 0.00 -1.51 0.00 0.00 72.50 67.96 3h1c s THR 116 CO -0.01 0.51 1.00 -0.69 -2.21 0.00 0.00 174.62 173.22 3h1c s VAL 117 N 0.15 4.81 -0.05 5.08 1.01 -0.93 -0.44 120.40 130.03 3h1c s VAL 117 Ca 0.00 2.04 0.05 0.00 0.00 0.00 0.00 61.98 64.07 3h1c s VAL 117 Cb -0.13 -4.31 -0.06 0.00 0.00 0.00 0.00 36.38 31.87 3h1c s VAL 117 CO 0.02 0.07 0.02 0.55 0.00 0.00 0.00 175.10 175.76 3h1c n VAL 118 N 4.29 0.35 -3.78 2.92 3.14 -0.94 -3.44 118.33 120.87 3h1c n VAL 118 Ca 0.08 -0.22 -0.13 0.00 -2.96 0.00 0.00 64.34 61.11 3h1c n VAL 118 Cb 0.50 -0.86 -0.10 0.00 -1.06 0.00 0.00 33.84 32.32 3h1c n VAL 118 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 3h1c s SER 119 N -3.63 -0.21 -0.02 6.55 1.04 -1.16 -4.00 113.70 112.27 3h1c s SER 119 Ca -0.03 0.24 -0.01 0.00 0.48 0.00 0.00 55.95 56.64 3h1c s SER 119 Cb 0.02 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.57 3h1c s SER 119 CO 0.21 -0.30 0.05 0.54 0.98 0.00 0.00 173.24 174.72 3h1c s VAL 120 N -0.76 -0.04 -0.20 5.02 0.11 -1.16 0.05 120.40 123.42 3h1c s VAL 120 Ca -0.08 0.15 -0.09 0.00 -2.93 0.00 0.00 61.98 59.02 3h1c s VAL 120 Cb -0.04 -0.10 -0.05 0.00 -1.53 0.00 0.00 36.38 34.66 3h1c s VAL 120 CO 0.02 0.06 0.11 0.21 -3.33 0.00 0.00 175.10 172.17 3h1c s ASN 121 N 0.77 5.97 0.66 3.54 2.47 -1.26 -4.68 114.94 122.40 3h1c s ASN 121 Ca -0.06 0.15 0.31 0.00 0.42 0.00 0.00 52.86 53.67 3h1c s ASN 121 Cb -0.09 -2.05 1.67 0.00 -1.45 0.00 0.00 41.25 39.34 3h1c s ASN 121 CO -0.03 0.15 1.96 -0.65 -3.72 0.00 0.00 177.10 174.81 3h1c h PRO 122 N 6.87 0.00 0.08 0.43 0.11 -1.97 -2.57 132.00 134.95 3h1c h PRO 122 Ca -0.39 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.56 3h1c h PRO 122 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3h1c h PRO 122 CO 0.72 0.00 -0.76 1.96 -0.21 0.00 0.00 178.00 179.71 3h1c h GLN 123 N 0.00 0.17 -5.35 1.05 1.08 -1.95 -3.41 115.11 106.70 3h1c h GLN 123 Ca 0.02 -0.28 -0.62 0.00 -1.45 0.00 0.00 58.65 56.32 3h1c h GLN 123 Cb 0.66 0.11 -0.12 0.00 -0.05 0.00 0.00 27.48 28.08 3h1c h GLN 123 CO -0.00 1.14 -0.50 0.14 -0.95 0.00 0.00 178.83 178.66 3h1c s VAL 124 N -2.37 5.34 -0.07 -0.54 -7.23 -0.97 -2.61 120.40 111.95 3h1c s VAL 124 Ca -0.18 0.16 -0.27 0.00 -1.81 0.00 0.00 61.98 59.88 3h1c s VAL 124 Cb 0.01 -3.41 -0.02 0.00 0.56 0.00 0.00 36.38 33.51 3h1c s VAL 124 CO 0.75 0.48 0.88 0.21 -0.31 0.00 0.00 175.10 177.11 3h1c s ASN 125 N 0.10 7.16 0.21 4.85 3.84 -1.26 -4.44 114.94 125.40 3h1c s ASN 125 Ca 0.09 1.41 0.17 0.00 0.21 0.00 0.00 52.86 54.74 3h1c s ASN 125 Cb -0.11 -2.50 0.85 0.00 -0.55 0.00 0.00 41.25 38.93 3h1c s ASN 125 CO -0.01 -0.29 1.53 -2.65 -2.79 0.00 0.00 177.10 172.90 3h1c n PRO 126 N 4.37 0.11 -0.21 0.43 -0.02 -1.26 -3.47 135.00 134.94 3h1c n PRO 126 Ca 0.04 0.52 -0.07 0.00 -2.02 0.00 0.00 63.50 61.97 3h1c n PRO 126 Cb 0.50 -1.81 0.03 0.00 -0.02 0.00 0.00 33.50 32.21 3h1c n PRO 126 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 3h1c h ASP 127 N 0.00 0.75 1.69 2.55 2.03 -2.00 -0.03 116.42 121.42 3h1c h ASP 127 Ca 0.00 -0.09 -0.06 0.00 -0.73 0.00 0.00 57.03 56.14 3h1c h ASP 127 Cb 0.12 -0.19 -0.01 0.00 -0.83 0.00 0.00 39.33 38.42 3h1c h ASP 127 CO 0.00 0.63 -0.30 0.16 -1.03 0.00 0.00 179.24 178.70 3h1c h ILE 128 N 0.82 0.52 -0.23 4.15 -0.00 -1.97 -3.11 117.51 117.69 3h1c h ILE 128 Ca 0.21 -1.74 -0.17 0.00 -0.00 0.00 0.00 64.86 63.17 3h1c h ILE 128 Cb 0.05 2.26 0.00 0.00 -0.00 0.00 0.00 36.82 39.12 3h1c h ILE 128 CO -0.03 0.30 -0.51 0.58 -0.00 0.00 0.00 178.15 178.48 3h1c h VAL 129 N 0.00 1.30 -0.02 0.16 2.07 -1.60 -3.08 116.25 115.08 3h1c h VAL 129 Ca -0.00 -1.72 -0.08 0.00 0.82 0.00 0.00 66.70 65.72 3h1c h VAL 129 Cb 1.23 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 3h1c h VAL 129 CO 0.04 0.55 -0.37 0.00 0.02 0.00 0.00 177.57 177.81 3h1c h ALA 130 N 0.63 1.36 -0.20 1.67 0.00 -1.04 -2.09 119.26 119.59 3h1c h ALA 130 Ca 0.00 -0.34 -0.18 0.00 0.00 0.00 0.00 54.91 54.39 3h1c h ALA 130 Cb 1.12 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 3h1c h ALA 130 CO 0.11 0.48 -0.59 0.52 0.00 0.00 0.00 179.25 179.77 3h1c h MET 131 N 0.03 0.64 -0.32 0.00 2.86 -1.55 -1.60 114.93 114.99 3h1c h MET 131 Ca 0.00 -0.43 -0.16 0.00 -2.06 0.00 0.00 59.70 57.06 3h1c h MET 131 Cb 0.67 0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.39 3h1c h MET 131 CO 0.05 1.05 -0.41 0.82 1.06 0.00 0.00 176.91 179.47 3h1c h ILE 132 N 0.48 1.28 -0.60 -1.22 2.04 -1.44 -2.23 117.51 115.82 3h1c h ILE 132 Ca -0.00 -1.60 -0.04 0.00 1.00 0.00 0.00 64.86 64.22 3h1c h ILE 132 Cb 1.16 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.76 3h1c h ILE 132 CO 0.12 0.52 0.20 1.23 0.00 0.00 0.00 178.15 180.22 3h1c h GLY 133 N 0.62 0.96 1.73 5.37 0.00 -1.33 0.10 103.07 110.53 3h1c h GLY 133 Ca 0.04 -0.52 -0.16 0.00 0.00 0.00 0.00 47.33 46.68 3h1c h GLY 133 CO 0.10 0.49 -0.69 0.00 0.00 0.00 0.00 176.54 176.44 3h1c h ALA 134 N 1.35 0.73 -0.33 3.60 0.00 -1.31 -1.76 119.26 121.53 3h1c h ALA 134 Ca 0.20 -0.59 -0.15 0.00 0.00 0.00 0.00 54.91 54.36 3h1c h ALA 134 Cb 0.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3h1c h ALA 134 CO -0.01 0.78 -0.40 1.03 0.00 0.00 0.00 179.25 180.64 3h1c h SER 135 N 0.18 0.86 0.58 0.00 0.87 -0.92 -1.84 113.55 113.28 3h1c h SER 135 Ca -0.02 -0.40 -0.17 0.00 -1.23 0.00 0.00 61.79 59.98 3h1c h SER 135 Cb 1.23 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.93 3h1c h SER 135 CO 0.11 1.15 -0.74 0.00 -0.53 0.00 0.00 176.83 176.82 3h1c h ALA 136 N 0.88 0.72 -0.08 6.23 0.00 -0.79 -2.67 119.26 123.55 3h1c h ALA 136 Ca 0.05 -0.65 -0.24 0.00 0.00 0.00 0.00 54.91 54.08 3h1c h ALA 136 Cb 0.96 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.68 3h1c h ALA 136 CO 0.09 0.86 -0.89 0.00 0.00 0.00 0.00 179.25 179.31 3h1c h ALA 137 N 1.15 0.26 0.00 0.00 0.00 -1.28 -2.87 119.26 116.52 3h1c h ALA 137 Ca -0.02 -0.65 -0.07 0.00 0.00 0.00 0.00 54.91 54.17 3h1c h ALA 137 Cb 1.31 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 3h1c h ALA 137 CO 0.11 0.70 -0.35 -0.07 0.00 0.00 0.00 179.25 179.64 3h1c h LEU 138 N 0.45 0.00 -0.16 0.00 3.38 -1.38 -2.04 115.31 115.56 3h1c h LEU 138 Ca -0.08 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.66 3h1c h LEU 138 Cb 1.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 3h1c h LEU 138 CO 0.18 0.35 -0.97 0.28 0.09 0.00 0.00 178.44 178.37 3h1c h SER 139 N 0.00 0.42 -0.39 -0.43 0.02 -1.48 -3.24 113.55 108.45 3h1c h SER 139 Ca -0.00 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 3h1c h SER 139 Cb 0.84 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.25 3h1c h SER 139 CO 0.05 1.18 0.00 0.18 -1.14 0.00 0.00 176.83 177.09 3h1c n LEU 140 N -3.68 2.94 0.01 5.07 4.32 -1.08 -4.41 117.00 120.16 3h1c n LEU 140 Ca -0.06 -1.32 -0.18 0.00 -0.02 0.00 0.00 56.01 54.43 3h1c n LEU 140 Cb 0.86 -0.25 -0.10 0.00 -1.62 0.00 0.00 43.42 42.30 3h1c n LEU 140 CO 0.50 0.66 0.21 0.77 -1.22 0.00 0.00 177.39 178.32 3h1c h SER 141 N 3.64 0.69 0.00 -1.43 4.64 -1.39 -3.27 113.55 116.42 3h1c h SER 141 Ca 0.00 -0.73 0.00 0.00 -0.47 0.00 0.00 61.79 60.59 3h1c h SER 141 Cb 0.81 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3h1c h SER 141 CO 0.00 1.32 0.00 0.61 -0.87 0.00 0.00 176.83 177.89 3h1c n GLY 142 N 1.00 2.48 3.69 -0.77 0.00 -1.26 -4.78 105.19 105.56 3h1c n GLY 142 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 3h1c n GLY 142 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h1c s ILE 143 N -2.55 2.70 -0.38 -0.61 1.09 -1.26 -0.20 121.20 119.99 3h1c s ILE 143 Ca 0.00 0.24 -0.39 0.00 -1.10 0.00 0.00 60.65 59.40 3h1c s ILE 143 Cb 0.00 -3.15 -0.14 0.00 -1.06 0.00 0.00 42.46 38.11 3h1c s ILE 143 CO 0.00 0.00 2.10 -0.81 -0.10 0.00 0.00 174.94 176.13 3h1c n PRO 144 N 5.44 0.78 -3.37 2.79 -0.04 -1.26 -4.91 135.00 134.43 3h1c n PRO 144 Ca 0.17 0.23 -0.12 0.00 -0.04 0.00 0.00 63.50 63.74 3h1c n PRO 144 Cb 0.39 -2.13 -0.09 0.00 -0.04 0.00 0.00 33.50 31.63 3h1c n PRO 144 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3h1c s PHE 145 N 6.31 -0.71 -1.53 0.54 5.36 -1.26 -4.44 117.98 122.26 3h1c s PHE 145 Ca 1.11 0.47 -0.10 0.00 -0.96 0.00 0.00 56.93 57.45 3h1c s PHE 145 Cb -1.07 -0.15 -0.09 0.00 -0.34 0.00 0.00 43.02 41.36 3h1c s PHE 145 CO 0.57 -0.78 2.91 0.09 -1.46 0.00 0.00 175.22 176.55 3h1c n ASN 146 N 5.35 8.37 0.00 6.13 3.02 -1.08 -4.82 115.26 132.22 3h1c n ASN 146 Ca -0.03 -2.55 0.00 0.00 -0.03 0.00 0.00 54.58 51.98 3h1c n ASN 146 Cb 0.49 -1.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.15 3h1c n ASN 146 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h1c n GLY 147 N 3.57 2.60 3.97 7.41 0.00 -1.26 -4.95 105.19 116.53 3h1c n GLY 147 Ca 0.75 -1.83 -0.24 0.00 0.00 0.00 0.00 46.02 44.70 3h1c n GLY 147 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h1c s PRO 148 N 3.99 1.88 0.13 1.61 0.04 -1.26 -4.91 135.00 136.47 3h1c s PRO 148 Ca 0.00 -0.85 0.10 0.00 0.04 0.00 0.00 61.00 60.28 3h1c s PRO 148 Cb 0.00 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 3h1c s PRO 148 CO 0.00 -1.32 -0.19 0.96 0.04 0.00 0.00 177.00 176.48 3h1c s ILE 149 N -3.13 2.73 0.08 0.56 -4.36 -1.26 -4.18 121.20 111.63 3h1c s ILE 149 Ca 0.64 -1.62 0.05 0.00 -0.26 0.00 0.00 60.65 59.46 3h1c s ILE 149 Cb -0.07 -2.26 -0.04 0.00 1.25 0.00 0.00 42.46 41.34 3h1c s ILE 149 CO 0.44 0.06 -0.03 -0.83 0.24 0.00 0.00 174.94 174.81 3h1c s GLY 150 N -2.25 1.87 -0.18 6.27 0.00 -1.08 -4.80 107.32 107.17 3h1c s GLY 150 Ca 0.18 -1.12 -0.02 0.00 0.00 0.00 0.00 44.72 43.76 3h1c s GLY 150 CO 0.10 -1.08 -0.09 0.00 0.00 0.00 0.00 173.10 172.02 3h1c s ALA 151 N -1.24 2.71 0.01 3.20 0.00 -1.26 -3.75 121.76 121.43 3h1c s ALA 151 Ca 0.23 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 51.18 3h1c s ALA 151 Cb -0.11 -1.45 -0.01 0.00 0.00 0.00 0.00 23.12 21.54 3h1c s ALA 151 CO 0.16 -0.10 -0.06 0.00 0.00 0.00 0.00 175.76 175.76 3h1c s ALA 152 N 0.93 0.44 -0.16 0.00 0.00 -1.09 -4.91 121.76 116.97 3h1c s ALA 152 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.55 3h1c s ALA 152 Cb -0.15 -0.05 -0.00 0.00 0.00 0.00 0.00 23.12 22.92 3h1c s ALA 152 CO -0.00 0.05 -0.15 0.50 0.00 0.00 0.00 175.76 176.16 3h1c s ARG 153 N -0.62 3.21 -0.22 0.00 3.52 -1.26 -1.85 118.95 121.74 3h1c s ARG 153 Ca -0.03 -0.75 -0.04 0.00 -0.13 0.00 0.00 55.73 54.79 3h1c s ARG 153 Cb -0.05 -2.63 -0.01 0.00 -1.56 0.00 0.00 34.95 30.70 3h1c s ARG 153 CO -0.00 0.00 -0.04 0.08 -0.81 0.00 0.00 175.30 174.53 3h1c s VAL 154 N 0.85 3.43 0.14 7.11 1.01 -1.14 0.81 120.40 132.61 3h1c s VAL 154 Ca -0.05 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.51 3h1c s VAL 154 Cb -0.15 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 3h1c s VAL 154 CO -0.01 0.42 0.07 -0.83 0.00 0.00 0.00 175.10 174.75 3h1c s GLY 155 N 1.44 1.81 -0.42 4.51 0.00 0.50 -3.21 107.32 111.95 3h1c s GLY 155 Ca 0.05 -1.20 0.03 0.00 0.00 0.00 0.00 44.72 43.61 3h1c s GLY 155 CO -0.03 -1.20 0.16 -0.47 0.00 0.00 0.00 173.10 171.57 3h1c s TYR 156 N -1.60 3.21 -0.15 1.90 5.04 -1.22 -0.18 117.35 124.34 3h1c s TYR 156 Ca 0.29 -2.94 -0.02 0.00 -2.44 0.00 0.00 57.07 51.96 3h1c s TYR 156 Cb -0.11 -2.70 -0.02 0.00 0.35 0.00 0.00 41.96 39.49 3h1c s TYR 156 CO 0.21 -0.84 -0.08 0.42 -1.34 0.00 0.00 175.55 173.91 3h1c s ILE 157 N 0.40 3.38 -0.88 3.14 1.01 -0.68 -1.19 121.20 126.37 3h1c s ILE 157 Ca 0.14 -0.53 -0.19 0.00 0.00 0.00 0.00 60.65 60.07 3h1c s ILE 157 Cb -0.22 -2.46 0.03 0.00 0.01 0.00 0.00 42.46 39.81 3h1c s ILE 157 CO -0.05 0.50 0.53 -0.46 0.00 0.00 0.00 174.94 175.46 3h1c n ASN 158 N 3.77 -3.55 -3.67 3.58 0.23 -1.26 -1.97 115.26 112.38 3h1c n ASN 158 Ca -0.18 -0.98 -0.27 0.00 -0.53 0.00 0.00 54.58 52.62 3h1c n ASN 158 Cb 0.52 -1.30 0.04 0.00 -2.08 0.00 0.00 39.78 36.97 3h1c n ASN 158 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 3h1c n ASP 159 N -1.75 -5.43 -3.75 0.53 8.00 -1.26 -4.99 116.55 107.91 3h1c n ASP 159 Ca -0.15 -0.62 -0.13 0.00 0.71 0.00 0.00 54.79 54.60 3h1c n ASP 159 Cb 0.50 -4.32 -0.10 0.00 -0.02 0.00 0.00 41.12 37.18 3h1c n ASP 159 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 3h1c s GLN 160 N -6.38 0.52 -0.03 -1.24 2.00 -0.83 -5.15 119.66 108.54 3h1c s GLN 160 Ca 0.59 0.30 -0.24 0.00 -2.00 0.00 0.00 55.36 54.00 3h1c s GLN 160 Cb -0.28 0.24 -0.04 0.00 0.80 0.00 0.00 33.01 33.73 3h1c s GLN 160 CO 0.72 -0.10 0.72 0.71 -0.50 0.00 0.00 175.29 176.84 3h1c s TYR 161 N -0.30 3.62 -0.11 1.67 1.51 -1.26 -1.69 117.35 120.79 3h1c s TYR 161 Ca -0.04 1.31 0.02 0.00 -1.01 0.00 0.00 57.07 57.35 3h1c s TYR 161 Cb -0.03 -2.80 0.01 0.00 -0.11 0.00 0.00 41.96 39.03 3h1c s TYR 161 CO 0.02 0.15 -0.17 0.08 -1.11 0.00 0.00 175.55 174.51 3h1c s VAL 162 N 0.53 1.66 0.03 0.71 1.01 0.74 -4.98 120.40 120.11 3h1c s VAL 162 Ca 0.38 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 61.32 3h1c s VAL 162 Cb -0.18 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 3h1c s VAL 162 CO 0.19 0.47 0.96 -0.22 0.00 0.00 0.00 175.10 176.51 3h1c s LEU 163 N 0.88 4.41 -0.67 3.92 2.96 -1.26 -0.37 118.68 128.54 3h1c s LEU 163 Ca -0.08 1.68 -0.11 0.00 -0.22 0.00 0.00 54.13 55.41 3h1c s LEU 163 Cb -0.15 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.00 3h1c s LEU 163 CO -0.01 -0.19 0.64 0.59 -1.32 0.00 0.00 176.35 176.06 3h1c n ASN 164 N 3.55 -6.16 -4.75 3.68 3.02 0.24 -4.89 115.26 109.95 3h1c n ASN 164 Ca 0.05 -0.36 -0.40 0.00 -0.03 0.00 0.00 54.58 53.83 3h1c n ASN 164 Cb 0.50 -3.10 -0.05 0.00 -0.61 0.00 0.00 39.78 36.53 3h1c n ASN 164 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3h1c s PRO 165 N -3.60 4.74 0.92 3.52 0.04 -1.26 -5.01 135.00 134.36 3h1c s PRO 165 Ca 0.12 1.65 -0.12 0.00 0.04 0.00 0.00 61.00 62.68 3h1c s PRO 165 Cb -0.02 -3.24 0.15 0.00 0.04 0.00 0.00 34.50 31.43 3h1c s PRO 165 CO 0.84 0.35 1.12 0.95 0.04 0.00 0.00 177.00 180.30 3h1c s THR 166 N -1.13 2.13 0.52 1.26 -4.23 -1.26 -4.77 115.64 108.16 3h1c s THR 166 Ca 0.43 0.04 0.17 0.00 -1.18 0.00 0.00 61.69 61.15 3h1c s THR 166 Cb -0.29 -2.72 0.28 0.00 1.34 0.00 0.00 72.50 71.12 3h1c s THR 166 CO 0.36 -0.05 2.14 -0.61 -0.54 0.00 0.00 174.62 175.92 3h1c h GLN 167 N -1.57 0.00 0.03 3.99 5.75 -1.74 -0.33 115.11 121.25 3h1c h GLN 167 Ca -0.51 0.00 -0.22 0.00 -0.15 0.00 0.00 58.65 57.77 3h1c h GLN 167 Cb 1.33 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.87 3h1c h GLN 167 CO 0.60 0.00 -0.99 0.22 -2.65 0.00 0.00 178.83 176.01 3h1c h ASP 168 N 0.00 0.30 1.41 -0.69 3.58 -1.90 -3.28 116.42 115.84 3h1c h ASP 168 Ca 0.02 -0.27 -0.03 0.00 0.42 0.00 0.00 57.03 57.17 3h1c h ASP 168 Cb 0.10 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 3h1c h ASP 168 CO -0.00 1.12 -0.14 -0.33 -2.88 0.00 0.00 179.24 177.01 3h1c h GLU 169 N 0.10 0.00 0.00 0.28 5.08 -1.46 -3.21 114.58 115.37 3h1c h GLU 169 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3h1c h GLU 169 Cb 1.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.91 3h1c h GLU 169 CO 0.15 0.14 0.00 -0.07 -1.00 0.00 0.00 179.01 178.24 3h1c h LEU 170 N 0.00 0.00 -0.71 1.33 3.38 -1.23 -3.14 115.31 114.95 3h1c h LEU 170 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 3h1c h LEU 170 Cb 0.89 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 3h1c h LEU 170 CO 0.02 0.00 -0.30 0.11 0.09 0.00 0.00 178.44 178.36 3h1c h LYS 171 N 0.00 0.66 -0.65 1.13 1.57 -1.72 -2.98 116.57 114.58 3h1c h LYS 171 Ca 0.00 -0.29 -0.17 0.00 -1.87 0.00 0.00 60.65 58.32 3h1c h LYS 171 Cb 0.48 -0.02 -0.10 0.00 0.08 0.00 0.00 32.23 32.67 3h1c h LYS 171 CO 0.00 0.88 0.20 0.39 -0.57 0.00 0.00 179.45 180.35 3h1c n GLU 172 N -4.08 3.66 -4.18 3.15 1.02 -1.19 -4.95 120.64 114.08 3h1c n GLU 172 Ca -0.01 -3.09 -0.35 0.00 -0.02 0.00 0.00 57.16 53.70 3h1c n GLU 172 Cb 0.46 -2.16 -0.09 0.00 -0.02 0.00 0.00 31.44 29.63 3h1c n GLU 172 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3h1c s SER 173 N -1.20 5.52 0.00 1.62 0.15 -1.13 -4.54 113.70 114.13 3h1c s SER 173 Ca 0.53 0.16 0.25 0.00 0.70 0.00 0.00 55.95 57.60 3h1c s SER 173 Cb 0.43 -1.76 0.53 0.00 -1.71 0.00 0.00 66.02 63.51 3h1c s SER 173 CO 0.12 0.30 1.43 0.29 1.20 0.00 0.00 173.24 176.59 3h1c n LYS 174 N 2.66 1.43 -3.75 5.44 4.01 -0.33 -4.92 118.16 122.70 3h1c n LYS 174 Ca -0.18 -1.02 -0.13 0.00 -0.51 0.00 0.00 58.31 56.47 3h1c n LYS 174 Cb 0.53 -1.48 -0.11 0.00 -0.51 0.00 0.00 35.03 33.47 3h1c n LYS 174 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 3h1c s LEU 175 N -2.27 0.58 -0.16 -0.35 2.96 -1.26 -0.86 118.68 117.32 3h1c s LEU 175 Ca 0.27 0.73 -0.04 0.00 -0.22 0.00 0.00 54.13 54.87 3h1c s LEU 175 Cb 0.20 1.24 0.07 0.00 0.50 0.00 0.00 46.19 48.19 3h1c s LEU 175 CO 0.44 -0.13 0.14 -0.62 -1.32 0.00 0.00 176.35 174.86 3h1c s ASP 176 N 0.26 1.77 0.08 3.68 2.15 -0.16 -3.43 116.67 121.01 3h1c s ASP 176 Ca -0.01 -0.33 0.03 0.00 0.43 0.00 0.00 52.55 52.67 3h1c s ASP 176 Cb -0.03 0.02 -0.04 0.00 -0.30 0.00 0.00 42.92 42.57 3h1c s ASP 176 CO -0.00 -0.32 -0.08 -1.48 -0.17 0.00 0.00 175.17 173.11 3h1c s LEU 177 N 2.22 2.41 -0.24 -1.34 0.05 -1.20 -1.33 118.68 119.25 3h1c s LEU 177 Ca 0.04 -0.83 0.02 0.00 0.05 0.00 0.00 54.13 53.42 3h1c s LEU 177 Cb -0.15 -0.18 0.05 0.00 -2.05 0.00 0.00 46.19 43.85 3h1c s LEU 177 CO -0.09 -0.33 -0.13 -0.69 -0.55 0.00 0.00 176.35 174.56 3h1c s VAL 178 N -2.65 2.17 -0.16 1.48 1.01 0.40 -2.89 120.40 119.77 3h1c s VAL 178 Ca 0.04 -1.42 -0.04 0.00 0.00 0.00 0.00 61.98 60.56 3h1c s VAL 178 Cb -0.01 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 3h1c s VAL 178 CO -0.02 0.13 -0.03 0.54 0.00 0.00 0.00 175.10 175.73 3h1c s VAL 179 N 1.16 3.98 -0.01 2.92 0.11 -0.77 -1.80 120.40 125.99 3h1c s VAL 179 Ca -0.05 -0.33 0.03 0.00 -2.93 0.00 0.00 61.98 58.71 3h1c s VAL 179 Cb -0.18 -2.75 -0.00 0.00 -1.53 0.00 0.00 36.38 31.92 3h1c s VAL 179 CO -0.07 0.49 -0.10 0.00 -3.33 0.00 0.00 175.10 172.09 3h1c s ALA 180 N 0.36 0.85 -0.16 1.54 0.00 0.58 -2.66 121.76 122.27 3h1c s ALA 180 Ca -0.03 -0.40 -0.35 0.00 0.00 0.00 0.00 51.96 51.18 3h1c s ALA 180 Cb -0.14 -0.25 0.14 0.00 0.00 0.00 0.00 23.12 22.88 3h1c s ALA 180 CO 0.03 0.19 1.32 0.20 0.00 0.00 0.00 175.76 177.50 3h1c s GLY 181 N -0.11 -0.34 0.33 0.00 0.00 -1.25 -0.54 107.32 105.41 3h1c s GLY 181 Ca 0.02 1.34 -0.06 0.00 0.00 0.00 0.00 44.72 46.02 3h1c s GLY 181 CO -0.00 0.39 0.43 -1.30 0.00 0.00 0.00 173.10 172.62 3h1c n THR 182 N -0.25 0.00 -0.03 0.90 -2.24 0.50 -2.62 114.28 110.55 3h1c n THR 182 Ca -0.02 -0.31 -0.02 0.00 -2.27 0.00 0.00 64.05 61.43 3h1c n THR 182 Cb 0.60 -1.76 0.24 0.00 -2.10 0.00 0.00 70.33 67.30 3h1c n THR 182 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3h1c h GLU 183 N 0.00 0.58 0.12 -0.78 4.81 -1.91 -3.29 114.58 114.10 3h1c h GLU 183 Ca -0.14 -0.15 -0.27 0.00 -0.13 0.00 0.00 59.36 58.67 3h1c h GLU 183 Cb 0.39 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 3h1c h GLU 183 CO 0.10 0.65 -1.36 0.00 -0.73 0.00 0.00 179.01 177.66 3h1c h ALA 184 N 1.40 0.16 -2.64 2.92 0.00 -1.95 -3.50 119.26 115.65 3h1c h ALA 184 Ca 0.11 -1.06 -0.09 0.00 0.00 0.00 0.00 54.91 53.87 3h1c h ALA 184 Cb 0.44 0.45 -0.13 0.00 0.00 0.00 0.00 17.79 18.55 3h1c h ALA 184 CO 0.02 0.79 -0.30 0.00 0.00 0.00 0.00 179.25 179.76 3h1c s ALA 185 N -2.47 -0.12 0.52 0.00 0.00 -1.24 -4.89 121.76 113.56 3h1c s ALA 185 Ca -0.20 -0.78 -0.17 0.00 0.00 0.00 0.00 51.96 50.81 3h1c s ALA 185 Cb 0.04 0.79 -0.08 0.00 0.00 0.00 0.00 23.12 23.88 3h1c s ALA 185 CO 0.77 -0.63 0.99 0.08 0.00 0.00 0.00 175.76 176.97 3h1c s VAL 186 N -3.94 4.39 0.00 0.00 1.01 -1.26 -0.37 120.40 120.23 3h1c s VAL 186 Ca 0.14 1.19 0.00 0.00 0.00 0.00 0.00 61.98 63.31 3h1c s VAL 186 Cb 0.03 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 32.76 3h1c s VAL 186 CO -0.02 -0.61 0.00 0.18 0.00 0.00 0.00 175.10 174.64 3h1c n LEU 187 N -1.53 0.01 -3.84 3.92 4.77 0.29 -4.71 117.00 115.92 3h1c n LEU 187 Ca 0.07 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.90 3h1c n LEU 187 Cb 0.54 -0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.47 3h1c n LEU 187 CO 0.45 -0.12 -0.37 -0.04 -1.33 0.00 0.00 177.39 175.98 3h1c s MET 188 N -2.00 0.22 -0.07 3.23 1.00 -0.09 -2.25 119.30 119.34 3h1c s MET 188 Ca 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 55.69 55.73 3h1c s MET 188 Cb 0.00 -0.36 0.03 0.00 0.00 0.00 0.00 34.83 34.50 3h1c s MET 188 CO 0.00 -0.08 -0.03 0.08 0.00 0.00 0.00 175.02 174.99 3h1c s VAL 189 N 0.69 0.53 -0.20 -6.03 1.01 -0.84 -0.31 120.40 115.26 3h1c s VAL 189 Ca -0.07 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 61.91 3h1c s VAL 189 Cb -0.10 -0.63 0.03 0.00 0.00 0.00 0.00 36.38 35.69 3h1c s VAL 189 CO -0.01 0.27 -0.18 -0.70 0.00 0.00 0.00 175.10 174.47 3h1c s GLU 190 N 1.60 2.83 0.01 2.72 2.56 -0.75 -0.68 118.70 127.00 3h1c s GLU 190 Ca -0.00 -0.94 -0.00 0.00 0.00 0.00 0.00 54.97 54.03 3h1c s GLU 190 Cb -0.13 -2.64 -0.01 0.00 2.00 0.00 0.00 34.13 33.35 3h1c s GLU 190 CO -0.04 -0.29 -0.00 -1.54 -0.56 0.00 0.00 175.26 172.83 3h1c s SER 191 N 1.25 0.12 -0.02 -1.70 1.04 -0.79 -0.45 113.70 113.15 3h1c s SER 191 Ca 0.02 -0.26 0.03 0.00 0.48 0.00 0.00 55.95 56.22 3h1c s SER 191 Cb -0.15 0.07 -0.00 0.00 0.10 0.00 0.00 66.02 66.04 3h1c s SER 191 CO -0.11 -0.17 -0.09 -1.83 0.98 0.00 0.00 173.24 172.02 3h1c s GLU 192 N -0.81 0.82 0.17 4.02 -1.05 -0.44 -2.47 118.70 118.94 3h1c s GLU 192 Ca -0.09 -0.31 -0.13 0.00 -0.15 0.00 0.00 54.97 54.29 3h1c s GLU 192 Cb -0.06 -0.79 0.01 0.00 -0.44 0.00 0.00 34.13 32.86 3h1c s GLU 192 CO -0.00 0.16 0.40 0.00 0.95 0.00 0.00 175.26 176.76 3h1c s ALA 193 N -0.03 -0.51 1.11 -0.84 0.00 -0.08 -0.99 121.76 120.42 3h1c s ALA 193 Ca 0.01 -0.51 -0.18 0.00 0.00 0.00 0.00 51.96 51.28 3h1c s ALA 193 Cb -0.06 0.83 0.25 0.00 0.00 0.00 0.00 23.12 24.14 3h1c s ALA 193 CO -0.00 -0.71 1.19 -0.65 0.00 0.00 0.00 175.76 175.59 3h1c s GLN 194 N -3.91 -0.47 -0.55 0.00 -1.52 -0.03 -4.30 119.66 108.88 3h1c s GLN 194 Ca 0.12 -0.19 -0.26 0.00 -1.95 0.00 0.00 55.36 53.08 3h1c s GLN 194 Cb 0.01 -1.70 -0.07 0.00 -0.22 0.00 0.00 33.01 31.03 3h1c s GLN 194 CO -0.03 -3.19 2.36 -0.51 -0.25 0.00 0.00 175.29 173.67 3h1c s LEU 195 N -6.52 3.32 0.09 2.90 1.43 -1.26 -4.37 118.68 114.27 3h1c s LEU 195 Ca 0.72 0.86 0.05 0.00 -1.03 0.00 0.00 54.13 54.72 3h1c s LEU 195 Cb -0.08 -2.51 -0.03 0.00 0.03 0.00 0.00 46.19 43.60 3h1c s LEU 195 CO 0.55 -2.98 -0.12 -0.76 0.23 0.00 0.00 176.35 173.27 3h1c s LEU 196 N 12.29 2.34 0.99 1.79 1.43 -1.25 -4.70 118.68 131.57 3h1c s LEU 196 Ca 0.94 -0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 53.21 3h1c s LEU 196 Cb -0.16 -0.43 0.19 0.00 0.03 0.00 0.00 46.19 45.82 3h1c s LEU 196 CO 0.23 -0.16 1.09 -0.94 0.23 0.00 0.00 176.35 176.81 3h1c s SER 197 N -2.08 2.67 0.12 2.29 1.04 -1.26 -1.16 113.70 115.33 3h1c s SER 197 Ca 0.02 1.19 -0.14 0.00 0.48 0.00 0.00 55.95 57.50 3h1c s SER 197 Cb -0.07 -1.86 -0.04 0.00 0.10 0.00 0.00 66.02 64.16 3h1c s SER 197 CO 0.02 -3.10 1.50 -0.33 0.98 0.00 0.00 173.24 172.30 3h1c h GLU 198 N -1.87 0.78 -0.07 4.02 3.07 -1.97 -2.93 114.58 115.61 3h1c h GLU 198 Ca -0.54 -0.33 -0.07 0.00 -0.50 0.00 0.00 59.36 57.92 3h1c h GLU 198 Cb 1.33 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 29.20 3h1c h GLU 198 CO 0.58 0.95 -0.26 -0.44 -1.40 0.00 0.00 179.01 178.44 3h1c h ASP 199 N 0.58 0.12 0.26 1.42 3.32 -1.99 -0.85 116.42 119.28 3h1c h ASP 199 Ca 0.09 -0.03 -0.21 0.00 0.02 0.00 0.00 57.03 56.90 3h1c h ASP 199 Cb 0.71 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 3h1c h ASP 199 CO 0.05 0.39 -0.83 1.56 -1.72 0.00 0.00 179.24 178.69 3h1c h GLN 200 N 0.12 0.44 -0.03 3.56 4.20 -1.94 -1.40 115.11 120.06 3h1c h GLN 200 Ca 0.02 -0.41 -0.17 0.00 0.06 0.00 0.00 58.65 58.15 3h1c h GLN 200 Cb 0.52 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 3h1c h GLN 200 CO 0.04 1.06 -0.73 0.52 -0.67 0.00 0.00 178.83 179.05 3h1c h MET 201 N 0.28 0.18 -0.07 1.46 2.86 -1.30 -2.91 114.93 115.42 3h1c h MET 201 Ca -0.06 -0.15 -0.14 0.00 -2.06 0.00 0.00 59.70 57.30 3h1c h MET 201 Cb 1.44 0.03 0.01 0.00 0.06 0.00 0.00 31.60 33.14 3h1c h MET 201 CO 0.15 0.83 -0.49 1.25 1.06 0.00 0.00 176.91 179.70 3h1c h LEU 202 N 0.12 0.55 -2.02 1.22 6.46 -1.17 -3.23 115.31 117.24 3h1c h LEU 202 Ca -0.02 -0.67 -0.01 0.00 -0.12 0.00 0.00 57.88 57.06 3h1c h LEU 202 Cb 1.28 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 41.05 3h1c h LEU 202 CO 0.11 1.14 -0.05 1.23 -0.62 0.00 0.00 178.44 180.25 3h1c h GLY 203 N 0.01 0.00 1.66 3.75 0.00 -1.30 -2.52 103.07 104.67 3h1c h GLY 203 Ca -0.04 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.06 3h1c h GLY 203 CO 0.10 0.00 -0.98 0.00 0.00 0.00 0.00 176.54 175.66 3h1c h ALA 204 N 1.95 0.36 -0.40 3.60 0.00 -1.55 -1.88 119.26 121.35 3h1c h ALA 204 Ca -0.00 -0.76 -0.14 0.00 0.00 0.00 0.00 54.91 54.02 3h1c h ALA 204 Cb 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3h1c h ALA 204 CO 0.01 0.90 -0.29 0.28 0.00 0.00 0.00 179.25 180.14 3h1c h VAL 205 N 0.15 1.28 -0.43 0.00 2.07 -1.48 -2.16 116.25 115.68 3h1c h VAL 205 Ca -0.08 -1.45 -0.13 0.00 0.82 0.00 0.00 66.70 65.86 3h1c h VAL 205 Cb 1.64 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 32.73 3h1c h VAL 205 CO 0.16 0.49 -0.22 0.58 0.02 0.00 0.00 177.57 178.60 3h1c h VAL 206 N 0.71 1.27 -0.65 2.57 2.07 -1.54 -1.85 116.25 118.84 3h1c h VAL 206 Ca 0.08 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.21 3h1c h VAL 206 Cb 0.87 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.85 3h1c h VAL 206 CO 0.08 0.47 0.36 0.15 0.02 0.00 0.00 177.57 178.65 3h1c h PHE 207 N 0.74 0.89 -0.19 1.57 3.57 -1.32 -1.51 116.94 120.69 3h1c h PHE 207 Ca 0.09 -0.02 -0.15 0.00 3.53 0.00 0.00 57.97 61.43 3h1c h PHE 207 Cb 0.79 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 3h1c h PHE 207 CO 0.06 0.63 -0.50 0.78 -2.23 0.00 0.00 178.31 177.05 3h1c h GLY 208 N 0.89 0.58 1.89 2.40 0.00 -1.35 -2.38 103.07 105.10 3h1c h GLY 208 Ca 0.23 -0.64 -0.12 0.00 0.00 0.00 0.00 47.33 46.79 3h1c h GLY 208 CO -0.04 0.58 -0.54 0.84 0.00 0.00 0.00 176.54 177.38 3h1c h HIS 209 N 0.42 0.15 0.01 5.60 -0.00 -1.16 -2.13 115.15 118.03 3h1c h HIS 209 Ca 0.02 -0.05 -0.23 0.00 -0.00 0.00 0.00 60.37 60.11 3h1c h HIS 209 Cb 1.03 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.41 3h1c h HIS 209 CO 0.04 0.63 -0.96 0.93 -0.00 0.00 0.00 177.93 178.58 3h1c h GLU 210 N 0.09 0.41 0.00 5.26 5.08 -1.23 -3.31 114.58 120.89 3h1c h GLU 210 Ca -0.00 -0.45 -0.14 0.00 -1.00 0.00 0.00 59.36 57.77 3h1c h GLU 210 Cb 0.98 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 3h1c h GLU 210 CO 0.08 1.12 -0.66 1.96 -1.00 0.00 0.00 179.01 180.51 3h1c h GLN 211 N 0.23 0.00 -0.00 2.33 1.08 -1.36 -3.18 115.11 114.21 3h1c h GLN 211 Ca -0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 3h1c h GLN 211 Cb 1.60 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.03 3h1c h GLN 211 CO 0.17 0.66 -0.01 0.00 -0.95 0.00 0.00 178.83 178.69 3h1c n GLN 212 N -3.40 0.64 0.09 1.46 10.64 -0.81 -3.80 117.38 122.20 3h1c n GLN 212 Ca 0.00 -0.04 0.01 0.00 -1.83 0.00 0.00 57.00 55.15 3h1c n GLN 212 Cb 0.74 -1.50 0.35 0.00 -0.86 0.00 0.00 30.24 28.97 3h1c n GLN 212 CO 0.00 0.00 0.00 1.96 -1.83 0.00 0.00 177.06 177.19 3h1c h GLN 213 N 0.09 0.31 0.00 2.61 1.08 -1.63 -2.45 115.11 115.12 3h1c h GLN 213 Ca 0.00 -0.08 -0.07 0.00 -1.45 0.00 0.00 58.65 57.05 3h1c h GLN 213 Cb 0.21 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 3h1c h GLN 213 CO 0.00 0.45 -0.35 -0.24 -0.95 0.00 0.00 178.83 177.74 3h1c h VAL 214 N 0.29 0.96 -0.13 -0.54 3.04 -1.81 -1.77 116.25 116.29 3h1c h VAL 214 Ca 0.06 -1.33 -0.13 0.00 -1.01 0.00 0.00 66.70 64.28 3h1c h VAL 214 Cb 0.41 1.78 0.00 0.00 -2.01 0.00 0.00 31.29 31.48 3h1c h VAL 214 CO 0.02 0.34 -0.44 0.58 -1.01 0.00 0.00 177.57 177.06 3h1c h VAL 215 N 0.00 1.36 -0.73 1.51 2.07 -1.69 -3.00 116.25 115.77 3h1c h VAL 215 Ca -0.00 -1.73 -0.03 0.00 0.82 0.00 0.00 66.70 65.75 3h1c h VAL 215 Cb 0.76 2.08 -0.03 0.00 -1.52 0.00 0.00 31.29 32.57 3h1c h VAL 215 CO 0.05 0.52 0.33 0.40 0.02 0.00 0.00 177.57 178.88 3h1c h ILE 216 N 0.15 1.24 -0.43 4.57 2.04 -1.27 -2.51 117.51 121.30 3h1c h ILE 216 Ca -0.02 -0.69 -0.09 0.00 1.00 0.00 0.00 64.86 65.06 3h1c h ILE 216 Cb 1.06 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 3h1c h ILE 216 CO 0.09 0.29 -0.09 1.56 0.00 0.00 0.00 178.15 180.00 3h1c h GLN 217 N 1.04 0.76 0.00 2.37 4.20 -1.37 -2.30 115.11 119.80 3h1c h GLN 217 Ca 0.25 -0.24 -0.16 0.00 0.06 0.00 0.00 58.65 58.56 3h1c h GLN 217 Cb 0.14 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 3h1c h GLN 217 CO -0.03 0.83 -0.77 -0.91 -0.67 0.00 0.00 178.83 177.28 3h1c h ASN 218 N 0.69 0.00 -0.19 1.46 2.35 -1.35 -2.65 115.58 115.89 3h1c h ASN 218 Ca 0.12 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.75 3h1c h ASN 218 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.93 3h1c h ASN 218 CO 0.03 0.77 -0.34 0.40 -1.65 0.00 0.00 177.43 176.65 3h1c h ILE 219 N 0.00 1.33 -0.72 2.81 2.04 -1.40 -2.78 117.51 118.80 3h1c h ILE 219 Ca -0.01 -1.56 0.02 0.00 1.00 0.00 0.00 64.86 64.31 3h1c h ILE 219 Cb 1.39 1.86 -0.04 0.00 -0.74 0.00 0.00 36.82 39.30 3h1c h ILE 219 CO 0.10 0.48 0.48 0.78 0.00 0.00 0.00 178.15 179.99 3h1c h ASN 220 N 0.24 0.80 1.04 1.72 2.35 -1.41 -1.35 115.58 118.98 3h1c h ASN 220 Ca 0.01 -0.02 -0.12 0.00 -0.55 0.00 0.00 56.30 55.63 3h1c h ASN 220 Cb 0.93 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.09 3h1c h ASN 220 CO 0.08 0.57 -0.56 -0.33 -1.65 0.00 0.00 177.43 175.53 3h1c h GLU 221 N 0.94 0.00 0.00 0.81 4.39 -1.51 -2.85 114.58 116.36 3h1c h GLU 221 Ca 0.27 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.82 3h1c h GLU 221 Cb -0.05 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 3h1c h GLU 221 CO -0.07 0.56 -0.70 1.25 -1.16 0.00 0.00 179.01 178.89 3h1c h LEU 222 N 0.00 0.00 -0.81 1.33 6.46 -1.11 -2.64 115.31 118.54 3h1c h LEU 222 Ca -0.01 0.00 -0.09 0.00 -0.12 0.00 0.00 57.88 57.66 3h1c h LEU 222 Cb 1.24 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 41.15 3h1c h LEU 222 CO 0.07 0.70 -0.13 0.58 -0.62 0.00 0.00 178.44 179.05 3h1c h VAL 223 N 0.00 1.26 -0.14 1.05 2.07 -1.14 -0.30 116.25 119.05 3h1c h VAL 223 Ca -0.01 -1.18 -0.11 0.00 0.82 0.00 0.00 66.70 66.22 3h1c h VAL 223 Cb 1.31 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 3h1c h VAL 223 CO 0.09 0.40 -0.39 0.11 0.02 0.00 0.00 177.57 177.80 3h1c h LYS 224 N 0.69 0.30 0.09 1.57 1.57 -1.36 -1.13 116.57 118.30 3h1c h LYS 224 Ca 0.11 -0.14 -0.25 0.00 -1.87 0.00 0.00 60.65 58.50 3h1c h LYS 224 Cb 0.60 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 3h1c h LYS 224 CO 0.04 0.65 -1.30 0.93 -0.57 0.00 0.00 179.45 179.21 3h1c h GLU 225 N 0.26 0.19 0.00 3.15 5.08 -1.30 -3.42 114.58 118.53 3h1c h GLU 225 Ca 0.03 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 3h1c h GLU 225 Cb 0.81 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.18 3h1c h GLU 225 CO 0.06 1.15 -0.31 0.00 -1.00 0.00 0.00 179.01 178.91 3h1c n ALA 226 N -3.01 1.93 -2.14 3.43 0.00 -0.14 -5.09 120.51 115.50 3h1c n ALA 226 Ca -0.25 -1.28 -0.41 0.00 0.00 0.00 0.00 53.44 51.50 3h1c n ALA 226 Cb 0.84 -0.39 -0.04 0.00 0.00 0.00 0.00 19.45 19.85 3h1c n ALA 226 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h1c s GLY 227 N -1.27 2.88 0.13 0.00 0.00 -0.43 -4.94 107.32 103.69 3h1c s GLY 227 Ca 0.07 0.73 -0.30 0.00 0.00 0.00 0.00 44.72 45.22 3h1c s GLY 227 CO 0.01 1.60 1.11 1.25 0.00 0.00 0.00 173.10 177.07 3h1c s LYS 228 N -0.19 4.55 0.22 2.90 2.20 -1.24 -4.96 119.74 123.23 3h1c s LYS 228 Ca 0.49 1.71 -0.30 0.00 -0.36 0.00 0.00 55.97 57.51 3h1c s LYS 228 Cb -0.27 -3.31 -0.15 0.00 -1.51 0.00 0.00 37.83 32.58 3h1c s LYS 228 CO 0.33 -0.02 0.95 -2.30 -0.36 0.00 0.00 175.35 173.95 3h1c n PRO 229 N 2.88 0.93 -2.11 4.03 -0.02 -1.26 -4.17 135.00 135.28 3h1c n PRO 229 Ca 0.04 0.33 -0.39 0.00 -2.02 0.00 0.00 63.50 61.47 3h1c n PRO 229 Cb 0.47 -1.66 -0.01 0.00 -0.02 0.00 0.00 33.50 32.28 3h1c n PRO 229 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3h1c s ARG 230 N -1.02 3.91 0.31 -0.52 0.52 -1.26 -4.53 118.95 116.36 3h1c s ARG 230 Ca 0.65 2.05 -0.29 0.00 -0.52 0.00 0.00 55.73 57.62 3h1c s ARG 230 Cb -0.82 -2.67 -0.11 0.00 0.52 0.00 0.00 34.95 31.87 3h1c s ARG 230 CO 0.57 -0.51 1.47 -1.58 0.02 0.00 0.00 175.30 175.27 3h1c s TRP 231 N -1.33 2.82 -1.18 -0.53 0.52 0.72 -4.91 118.94 115.05 3h1c s TRP 231 Ca 0.59 1.07 -0.21 0.00 0.02 0.00 0.00 56.10 57.57 3h1c s TRP 231 Cb -0.35 -3.93 0.02 0.00 -1.15 0.00 0.00 33.47 28.05 3h1c s TRP 231 CO 0.45 -2.89 1.75 0.34 0.02 0.00 0.00 176.95 176.62 3h1c s ASP 232 N 0.10 6.16 -0.10 2.95 2.15 -1.26 -4.85 116.67 121.81 3h1c s ASP 232 Ca 0.57 -1.90 0.02 0.00 0.43 0.00 0.00 52.55 51.67 3h1c s ASP 232 Cb -0.45 -2.58 0.01 0.00 -0.30 0.00 0.00 42.92 39.61 3h1c s ASP 232 CO 0.52 -1.87 -0.17 0.86 -0.17 0.00 0.00 175.17 174.35 3h1c s TRP 233 N 6.65 2.03 -0.03 -5.34 -0.00 -1.26 -5.12 118.94 115.86 3h1c s TRP 233 Ca 0.58 -0.90 0.04 0.00 -0.00 0.00 0.00 56.10 55.81 3h1c s TRP 233 Cb 0.01 -1.43 -0.00 0.00 -0.00 0.00 0.00 33.47 32.04 3h1c s TRP 233 CO 0.05 -0.43 -0.14 -0.65 -0.00 0.00 0.00 176.95 175.77 3h1c s GLN 234 N 0.78 1.45 0.89 5.86 1.11 -1.26 -5.12 119.66 123.37 3h1c s GLN 234 Ca -0.11 -0.51 -0.11 0.00 0.01 0.00 0.00 55.36 54.65 3h1c s GLN 234 Cb -0.16 -1.30 0.12 0.00 -1.01 0.00 0.00 33.01 30.66 3h1c s GLN 234 CO 0.02 0.22 1.10 -1.25 0.01 0.00 0.00 175.29 175.38 3h1c s PRO 235 N 0.03 1.31 0.14 2.91 0.04 -1.26 -4.93 135.00 133.24 3h1c s PRO 235 Ca -0.02 1.14 -0.34 0.00 0.04 0.00 0.00 61.00 61.81 3h1c s PRO 235 Cb -0.10 -1.79 -0.15 0.00 0.04 0.00 0.00 34.50 32.50 3h1c s PRO 235 CO 0.01 -2.30 1.40 0.39 0.04 0.00 0.00 177.00 176.55 3h1c n GLU 236 N -3.96 1.61 -1.70 4.56 1.02 -1.26 -4.89 120.64 116.02 3h1c n GLU 236 Ca 0.09 0.58 -0.43 0.00 -0.02 0.00 0.00 57.16 57.38 3h1c n GLU 236 Cb 0.54 -2.25 -0.01 0.00 -0.02 0.00 0.00 31.44 29.69 3h1c n GLU 236 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 3h1c n PRO 237 N 2.65 2.25 -2.10 3.49 -0.02 -1.26 -4.88 135.00 135.13 3h1c n PRO 237 Ca 0.16 0.80 -0.42 0.00 -2.02 0.00 0.00 63.50 62.02 3h1c n PRO 237 Cb 0.25 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.25 3h1c n PRO 237 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3h1c s VAL 238 N -0.56 3.57 -0.88 -1.45 1.01 -1.26 -4.94 120.40 115.89 3h1c s VAL 238 Ca 0.61 0.57 -0.19 0.00 0.00 0.00 0.00 61.98 62.97 3h1c s VAL 238 Cb -0.57 -3.82 0.13 0.00 0.00 0.00 0.00 36.38 32.12 3h1c s VAL 238 CO 0.56 -0.56 1.06 0.21 0.00 0.00 0.00 175.10 176.37 3h1c s ASN 239 N 5.72 6.59 0.37 3.32 2.47 -1.26 -4.87 114.94 127.28 3h1c s ASN 239 Ca 0.74 -2.00 0.17 0.00 0.42 0.00 0.00 52.86 52.18 3h1c s ASN 239 Cb -0.19 -2.38 0.72 0.00 -1.45 0.00 0.00 41.25 37.95 3h1c s ASN 239 CO 0.32 -1.05 1.77 -0.33 -3.72 0.00 0.00 177.10 174.09 3h1c h GLU 240 N 8.80 0.00 -0.00 0.43 5.08 -1.99 -1.66 114.58 125.24 3h1c h GLU 240 Ca 0.10 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.31 3h1c h GLU 240 Cb 1.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 3h1c h GLU 240 CO 1.08 0.39 -0.72 0.00 -1.00 0.00 0.00 179.01 178.76 3h1c h ALA 241 N 1.61 0.81 0.13 3.43 0.00 -2.01 -2.98 119.26 120.25 3h1c h ALA 241 Ca -0.00 -0.65 -0.32 0.00 0.00 0.00 0.00 54.91 53.93 3h1c h ALA 241 Cb 0.82 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3h1c h ALA 241 CO 0.05 0.89 -1.65 1.25 0.00 0.00 0.00 179.25 179.79 3h1c h LEU 242 N 0.01 0.42 -1.21 0.00 6.46 -1.93 -3.34 115.31 115.72 3h1c h LEU 242 Ca -0.01 -0.65 -0.06 0.00 -0.12 0.00 0.00 57.88 57.04 3h1c h LEU 242 Cb 1.27 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 41.05 3h1c h LEU 242 CO 0.09 1.55 -0.31 0.78 -0.62 0.00 0.00 178.44 179.94 3h1c h ASN 243 N 0.07 0.00 0.03 1.25 4.21 -1.38 -3.13 115.58 116.63 3h1c h ASN 243 Ca -0.29 0.00 -0.25 0.00 1.21 0.00 0.00 56.30 56.97 3h1c h ASN 243 Cb 2.04 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 39.25 3h1c h ASN 243 CO 0.15 0.31 -0.97 0.00 -1.29 0.00 0.00 177.43 175.63 3h1c h ALA 244 N 1.69 0.22 0.00 -0.83 0.00 -1.66 -2.94 119.26 115.74 3h1c h ALA 244 Ca -0.00 -0.68 -0.14 0.00 0.00 0.00 0.00 54.91 54.09 3h1c h ALA 244 Cb 0.73 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3h1c h ALA 244 CO 0.04 0.71 -0.64 0.07 0.00 0.00 0.00 179.25 179.43 3h1c h ARG 245 N 0.40 0.00 -0.09 0.00 0.11 -1.67 -2.18 114.38 110.95 3h1c h ARG 245 Ca -0.10 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.78 3h1c h ARG 245 Cb 1.61 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.70 3h1c h ARG 245 CO 0.19 0.64 -0.70 0.28 0.10 0.00 0.00 179.97 180.48 3h1c h VAL 246 N 0.00 1.33 0.00 0.08 2.07 -1.64 -3.20 116.25 114.89 3h1c h VAL 246 Ca -0.01 -1.98 -0.03 0.00 0.82 0.00 0.00 66.70 65.50 3h1c h VAL 246 Cb 1.29 2.22 -0.00 0.00 -1.52 0.00 0.00 31.29 33.27 3h1c h VAL 246 CO 0.08 0.61 -0.15 0.00 0.02 0.00 0.00 177.57 178.13 3h1c h ALA 247 N 0.46 1.09 0.00 1.67 0.00 -1.51 -0.17 119.26 120.80 3h1c h ALA 247 Ca -0.06 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3h1c h ALA 247 Cb 1.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3h1c h ALA 247 CO 0.14 0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.58 3h1c h ALA 248 N 1.85 1.00 0.00 0.00 0.00 -1.38 -2.68 119.26 118.05 3h1c h ALA 248 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 3h1c h ALA 248 Cb 0.56 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3h1c h ALA 248 CO 0.02 0.00 -1.36 -0.11 0.00 0.00 0.00 179.25 177.79 3h1c n LEU 249 N -2.41 0.71 -0.13 0.00 0.00 -0.96 -4.87 117.00 109.34 3h1c n LEU 249 Ca 0.02 -0.01 -0.27 0.00 0.00 0.00 0.00 56.01 55.75 3h1c n LEU 249 Cb 0.28 0.04 -0.11 0.00 0.00 0.00 0.00 43.42 43.64 3h1c n LEU 249 CO 0.23 0.24 -1.27 0.00 0.00 0.00 0.00 177.39 176.59 3h1c n ALA 250 N -2.31 1.14 -0.30 1.96 0.00 -0.12 -4.47 120.51 116.41 3h1c n ALA 250 Ca -0.09 -0.99 0.19 0.00 0.00 0.00 0.00 53.44 52.55 3h1c n ALA 250 Cb 0.66 -0.02 0.47 0.00 0.00 0.00 0.00 19.45 20.56 3h1c n ALA 250 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3h1c h GLU 251 N -0.89 0.46 -0.38 0.00 4.81 -1.66 0.29 114.58 117.21 3h1c h GLU 251 Ca -0.63 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 58.53 3h1c h GLU 251 Cb 1.60 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.86 3h1c h GLU 251 CO -0.35 0.31 0.05 0.00 -0.73 0.00 0.00 179.01 178.28 3h1c h ALA 252 N 1.62 0.51 0.05 2.92 0.00 -1.81 -2.53 119.26 120.02 3h1c h ALA 252 Ca 0.54 -0.22 -0.24 0.00 0.00 0.00 0.00 54.91 55.00 3h1c h ALA 252 Cb 1.26 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3h1c h ALA 252 CO -0.27 0.23 -1.10 0.00 0.00 0.00 0.00 179.25 178.11 3h1c h ARG 253 N 0.48 0.11 0.00 0.00 3.08 -1.22 -3.31 114.38 113.53 3h1c h ARG 253 Ca 0.11 -0.19 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 3h1c h ARG 253 Cb 0.39 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 3h1c h ARG 253 CO 0.01 1.09 -0.38 -0.07 -1.07 0.00 0.00 179.97 179.54 3h1c h LEU 254 N 0.03 0.00 -0.72 3.04 3.38 -0.56 -1.48 115.31 119.01 3h1c h LEU 254 Ca -0.06 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 3h1c h LEU 254 Cb 1.85 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.59 3h1c h LEU 254 CO 0.16 0.38 -0.52 -1.28 0.09 0.00 0.00 178.44 177.27 3h1c h SER 255 N 0.00 0.34 1.47 -0.43 0.87 -1.53 -2.91 113.55 111.35 3h1c h SER 255 Ca -0.00 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.38 3h1c h SER 255 Cb 0.92 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 3h1c h SER 255 CO 0.05 0.80 -0.38 0.44 -0.53 0.00 0.00 176.83 177.21 3h1c h ASP 256 N 0.24 0.00 -0.18 6.23 3.32 -1.60 -3.33 116.42 121.10 3h1c h ASP 256 Ca 0.01 -0.03 -0.19 0.00 0.02 0.00 0.00 57.03 56.83 3h1c h ASP 256 Cb 1.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.56 3h1c h ASP 256 CO 0.08 0.02 -0.62 0.00 -1.72 0.00 0.00 179.24 177.00 3h1c h ALA 257 N 2.15 0.46 -0.63 3.45 0.00 -1.09 -3.19 119.26 120.41 3h1c h ALA 257 Ca 0.00 -0.54 -0.44 0.00 0.00 0.00 0.00 54.91 53.93 3h1c h ALA 257 Cb 0.93 -0.06 -0.18 0.00 0.00 0.00 0.00 17.79 18.47 3h1c h ALA 257 CO 0.00 0.69 0.55 0.66 0.00 0.00 0.00 179.25 181.15 3h1c n TYR 258 N -3.97 2.03 0.00 0.00 4.01 -1.12 -3.98 117.16 114.13 3h1c n TYR 258 Ca -0.05 -2.27 0.00 0.00 -0.16 0.00 0.00 57.90 55.42 3h1c n TYR 258 Cb 0.66 -1.12 0.00 0.00 -0.31 0.00 0.00 39.34 38.58 3h1c n TYR 258 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 3h1c n ARG 259 N 0.01 2.56 -2.69 -0.72 0.63 -1.20 -4.67 116.66 110.58 3h1c n ARG 259 Ca 0.40 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 57.01 3h1c n ARG 259 Cb 0.59 -0.97 -0.06 0.00 0.45 0.00 0.00 32.46 32.48 3h1c n ARG 259 CO 0.00 0.00 0.00 0.96 -2.51 0.00 0.00 177.63 176.08 3h1c s ILE 260 N -1.92 4.46 -0.10 5.15 -4.36 -1.26 -4.79 121.20 118.38 3h1c s ILE 260 Ca 0.00 1.36 -0.25 0.00 -0.26 0.00 0.00 60.65 61.50 3h1c s ILE 260 Cb 0.00 -3.64 -0.22 0.00 1.25 0.00 0.00 42.46 39.85 3h1c s ILE 260 CO 0.00 -0.44 0.81 0.71 0.24 0.00 0.00 174.94 176.26 3h1c h THR 261 N 1.56 1.46 -3.88 8.37 1.35 -1.89 -3.41 112.91 116.46 3h1c h THR 261 Ca -0.48 -1.87 -0.53 0.00 -0.55 0.00 0.00 66.41 62.98 3h1c h THR 261 Cb 1.18 2.66 0.07 0.00 -1.73 0.00 0.00 68.15 70.34 3h1c h THR 261 CO 0.61 0.46 0.66 -0.62 -0.25 0.00 0.00 175.52 176.38 3h1c s ASP 262 N -5.98 6.70 0.07 5.36 2.15 -1.26 -4.66 116.67 119.06 3h1c s ASP 262 Ca -0.16 2.75 -0.16 0.00 0.43 0.00 0.00 52.55 55.41 3h1c s ASP 262 Cb -0.01 -2.65 -0.14 0.00 -0.30 0.00 0.00 42.92 39.82 3h1c s ASP 262 CO 0.61 -0.60 1.32 0.50 -0.17 0.00 0.00 175.17 176.83 3h1c h LYS 263 N 3.34 0.63 -0.25 4.34 3.64 -1.99 -2.07 116.57 124.21 3h1c h LYS 263 Ca -0.49 -0.43 -0.08 0.00 -1.27 0.00 0.00 60.65 58.38 3h1c h LYS 263 Cb 1.23 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.09 3h1c h LYS 263 CO 0.65 1.05 -0.18 1.96 -2.27 0.00 0.00 179.45 180.66 3h1c h GLN 264 N 0.31 0.43 -0.00 1.90 4.20 -1.99 -0.44 115.11 119.53 3h1c h GLN 264 Ca -0.00 -0.14 -0.19 0.00 0.06 0.00 0.00 58.65 58.39 3h1c h GLN 264 Cb 1.05 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.78 3h1c h GLN 264 CO 0.10 0.60 -0.83 0.93 -0.67 0.00 0.00 178.83 178.96 3h1c h GLU 265 N 0.40 0.15 0.02 1.46 5.08 -1.96 -3.13 114.58 116.61 3h1c h GLU 265 Ca 0.07 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3h1c h GLU 265 Cb 0.54 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3h1c h GLU 265 CO 0.04 0.90 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.84 3h1c h ARG 266 N 0.09 -0.03 0.00 2.33 2.43 -1.09 -2.89 114.38 115.22 3h1c h ARG 266 Ca -0.03 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 3h1c h ARG 266 Cb 1.45 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 31.00 3h1c h ARG 266 CO 0.12 0.69 -0.15 1.88 -1.51 0.00 0.00 179.97 181.01 3h1c h TYR 267 N -0.88 0.00 0.16 2.20 0.05 -1.22 0.28 116.97 117.55 3h1c h TYR 267 Ca -0.00 0.00 -0.24 0.00 0.05 0.00 0.00 58.73 58.54 3h1c h TYR 267 Cb 0.74 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.51 3h1c h TYR 267 CO 0.19 0.15 -1.04 0.00 -1.05 0.00 0.00 178.16 176.41 3h1c h ALA 268 N 1.85 -0.09 -0.36 3.88 0.00 -1.67 -3.11 119.26 119.77 3h1c h ALA 268 Ca -0.00 -0.74 -0.16 0.00 0.00 0.00 0.00 54.91 54.01 3h1c h ALA 268 Cb 0.31 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3h1c h ALA 268 CO 0.02 0.50 -0.41 0.37 0.00 0.00 0.00 179.25 179.73 3h1c h GLN 269 N -0.11 0.89 0.00 0.00 5.75 -1.26 -2.62 115.11 117.77 3h1c h GLN 269 Ca -0.17 -0.48 -0.04 0.00 -0.15 0.00 0.00 58.65 57.80 3h1c h GLN 269 Cb 1.80 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 30.36 3h1c h GLN 269 CO 0.20 1.13 -0.19 -0.24 -2.65 0.00 0.00 178.83 177.08 3h1c h VAL 270 N 0.72 0.52 0.01 2.39 3.04 -1.09 -2.63 116.25 119.22 3h1c h VAL 270 Ca 0.05 -0.93 -0.21 0.00 -1.01 0.00 0.00 66.70 64.60 3h1c h VAL 270 Cb 1.00 1.64 -0.01 0.00 -2.01 0.00 0.00 31.29 31.91 3h1c h VAL 270 CO 0.10 0.18 -0.92 -0.78 -1.01 0.00 0.00 177.57 175.14 3h1c h ASP 271 N 0.00 0.33 -0.39 3.17 3.58 -1.45 -2.38 116.42 119.29 3h1c h ASP 271 Ca -0.00 -0.27 -0.04 0.00 0.42 0.00 0.00 57.03 57.13 3h1c h ASP 271 Cb 0.62 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.55 3h1c h ASP 271 CO 0.02 1.08 0.08 0.58 -2.88 0.00 0.00 179.24 178.12 3h1c h VAL 272 N 0.13 1.24 -0.59 2.25 2.07 -1.11 -0.26 116.25 119.98 3h1c h VAL 272 Ca -0.06 -0.83 -0.08 0.00 0.82 0.00 0.00 66.70 66.55 3h1c h VAL 272 Cb 1.56 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.33 3h1c h VAL 272 CO 0.15 0.28 0.05 0.40 0.02 0.00 0.00 177.57 178.47 3h1c h ILE 273 N 0.49 1.26 -0.54 4.57 2.04 -1.55 -1.52 117.51 122.26 3h1c h ILE 273 Ca 0.12 -1.07 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 3h1c h ILE 273 Cb 0.34 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 3h1c h ILE 273 CO 0.01 0.39 0.26 0.11 0.00 0.00 0.00 178.15 178.92 3h1c h LYS 274 N 0.91 0.78 -0.25 2.37 1.57 -1.30 -2.32 116.57 118.32 3h1c h LYS 274 Ca 0.17 -0.11 -0.17 0.00 -1.87 0.00 0.00 60.65 58.67 3h1c h LYS 274 Cb 0.49 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 3h1c h LYS 274 CO 0.02 0.64 -0.54 1.03 -0.57 0.00 0.00 179.45 180.03 3h1c h SER 275 N 0.73 0.83 0.75 0.86 0.87 -0.92 -3.04 113.55 113.62 3h1c h SER 275 Ca 0.19 -0.44 -0.16 0.00 -1.23 0.00 0.00 61.79 60.15 3h1c h SER 275 Cb 0.11 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.81 3h1c h SER 275 CO -0.02 1.20 -0.76 -0.33 -0.53 0.00 0.00 176.83 176.39 3h1c h GLU 276 N 0.58 0.01 -0.18 2.24 5.08 -1.27 -2.48 114.58 118.56 3h1c h GLU 276 Ca 0.02 -0.01 -0.21 0.00 -1.00 0.00 0.00 59.36 58.15 3h1c h GLU 276 Cb 1.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.38 3h1c h GLU 276 CO 0.11 0.76 -0.71 1.15 -1.00 0.00 0.00 179.01 179.33 3h1c h THR 277 N 0.01 1.28 -0.37 1.13 2.02 -1.45 -2.56 112.91 112.97 3h1c h THR 277 Ca -0.01 -1.90 -0.16 0.00 0.77 0.00 0.00 66.41 65.11 3h1c h THR 277 Cb 1.34 1.91 -0.01 0.00 -1.74 0.00 0.00 68.15 69.66 3h1c h THR 277 CO 0.10 0.61 -0.39 0.40 0.37 0.00 0.00 175.52 176.60 3h1c h ILE 278 N 0.54 1.27 -0.48 3.11 2.04 -1.58 -2.99 117.51 119.43 3h1c h ILE 278 Ca -0.04 -1.57 -0.08 0.00 1.00 0.00 0.00 64.86 64.17 3h1c h ILE 278 Cb 1.34 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 38.80 3h1c h ILE 278 CO 0.15 0.52 -0.04 0.00 0.00 0.00 0.00 178.15 178.79 3h1c h ALA 279 N 0.81 1.04 0.00 1.87 0.00 -1.46 -1.84 119.26 119.68 3h1c h ALA 279 Ca 0.06 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 3h1c h ALA 279 Cb 0.98 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 3h1c h ALA 279 CO 0.09 0.59 -0.14 0.00 0.00 0.00 0.00 179.25 179.80 3h1c h THR 280 N 0.75 0.26 0.02 0.00 1.03 -1.49 -2.68 112.91 110.80 3h1c h THR 280 Ca 0.14 -1.25 -0.26 0.00 -0.01 0.00 0.00 66.41 65.03 3h1c h THR 280 Cb 0.51 2.03 -0.03 0.00 -1.07 0.00 0.00 68.15 69.58 3h1c h THR 280 CO 0.03 0.14 -1.38 -0.07 -0.01 0.00 0.00 175.52 174.22 3h1c h LEU 281 N 0.00 0.08 -0.72 0.00 3.38 -1.36 -3.11 115.31 113.57 3h1c h LEU 281 Ca -0.00 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 3h1c h LEU 281 Cb 1.01 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 3h1c h LEU 281 CO 0.02 1.10 -0.51 -0.07 0.09 0.00 0.00 178.44 179.06 3h1c h LEU 282 N 0.01 0.00 -0.42 1.67 3.38 -1.34 0.27 115.31 118.88 3h1c h LEU 282 Ca -0.16 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 3h1c h LEU 282 Cb 1.91 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.65 3h1c h LEU 282 CO 0.12 0.51 -0.46 0.00 0.09 0.00 0.00 178.44 178.70 3h1c h ALA 283 N 1.49 0.80 0.08 1.53 0.00 -1.56 -2.99 119.26 118.59 3h1c h ALA 283 Ca -0.01 -0.42 -0.36 0.00 0.00 0.00 0.00 54.91 54.13 3h1c h ALA 283 Cb 1.07 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 3h1c h ALA 283 CO 0.07 0.58 -2.01 -1.91 0.00 0.00 0.00 179.25 175.97 3h1c n GLU 284 N -3.35 0.71 -3.49 0.00 2.13 -1.15 -4.83 120.64 110.66 3h1c n GLU 284 Ca 0.01 0.28 -0.26 0.00 0.66 0.00 0.00 57.16 57.85 3h1c n GLU 284 Cb 0.64 -1.67 -0.13 0.00 0.27 0.00 0.00 31.44 30.55 3h1c n GLU 284 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3h1c s ASP 285 N -6.94 2.95 0.41 4.31 2.15 0.93 -5.01 116.67 115.47 3h1c s ASP 285 Ca -0.26 -1.37 0.23 0.00 0.43 0.00 0.00 52.55 51.58 3h1c s ASP 285 Cb 0.07 -0.14 0.58 0.00 -0.30 0.00 0.00 42.92 43.13 3h1c s ASP 285 CO 0.70 -0.40 1.68 1.05 -0.17 0.00 0.00 175.17 178.04 3h1c h GLU 286 N 8.06 0.00 -3.33 4.34 4.11 -1.71 -3.37 114.58 122.68 3h1c h GLU 286 Ca -0.13 0.00 -0.72 0.00 0.07 0.00 0.00 59.36 58.58 3h1c h GLU 286 Cb 1.02 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.19 3h1c h GLU 286 CO 0.37 0.19 2.79 0.25 0.07 0.00 0.00 179.01 182.69 3h1c n THR 287 N -3.21 4.31 -3.80 -1.06 -2.24 -1.26 -4.88 114.28 102.14 3h1c n THR 287 Ca 0.02 -3.64 -0.12 0.00 -2.27 0.00 0.00 64.05 58.03 3h1c n THR 287 Cb 0.52 -2.42 -0.10 0.00 -2.10 0.00 0.00 70.33 66.23 3h1c n THR 287 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3h1c s LEU 288 N 0.09 1.12 0.13 3.22 1.98 -1.26 -5.14 118.68 118.83 3h1c s LEU 288 Ca 0.51 0.21 -0.31 0.00 -2.89 0.00 0.00 54.13 51.66 3h1c s LEU 288 Cb 0.14 0.92 -0.08 0.00 0.66 0.00 0.00 46.19 47.84 3h1c s LEU 288 CO -0.06 -0.26 1.30 -0.62 -1.89 0.00 0.00 176.35 174.83 3h1c s ASP 289 N -0.65 6.94 0.07 3.68 2.15 -1.26 -4.95 116.67 122.66 3h1c s ASP 289 Ca -0.07 2.26 -0.06 0.00 0.43 0.00 0.00 52.55 55.10 3h1c s ASP 289 Cb -0.04 -2.59 -0.29 0.00 -0.30 0.00 0.00 42.92 39.69 3h1c s ASP 289 CO 0.02 -0.54 1.12 -0.08 -0.17 0.00 0.00 175.17 175.52 3h1c h GLU 290 N 6.21 0.32 0.00 4.34 4.81 -2.00 -3.23 114.58 125.02 3h1c h GLU 290 Ca -0.43 -0.55 -0.10 0.00 -0.13 0.00 0.00 59.36 58.16 3h1c h GLU 290 Cb 1.21 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.78 3h1c h GLU 290 CO 0.81 1.26 -0.45 -0.91 -0.73 0.00 0.00 179.01 178.99 3h1c h ASN 291 N 0.09 0.00 0.05 1.04 2.35 -1.97 -3.06 115.58 114.08 3h1c h ASN 291 Ca -0.15 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.40 3h1c h ASN 291 Cb 2.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.37 3h1c h ASN 291 CO 0.22 0.45 -0.71 -0.08 -1.65 0.00 0.00 177.43 175.66 3h1c h GLU 292 N 0.00 0.59 -0.21 0.81 4.81 -1.98 -3.21 114.58 115.40 3h1c h GLU 292 Ca -0.00 -0.46 -0.09 0.00 -0.13 0.00 0.00 59.36 58.67 3h1c h GLU 292 Cb 0.85 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 3h1c h GLU 292 CO 0.06 1.08 -0.28 -0.07 -0.73 0.00 0.00 179.01 179.08 3h1c h LEU 293 N 0.41 0.40 -1.15 1.64 3.38 -1.56 -2.91 115.31 115.53 3h1c h LEU 293 Ca -0.03 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 3h1c h LEU 293 Cb 1.30 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 3h1c h LEU 293 CO 0.13 0.67 -0.43 1.23 0.09 0.00 0.00 178.44 180.14 3h1c h GLY 294 N 1.03 0.00 1.72 0.83 0.00 -1.56 -2.32 103.07 102.77 3h1c h GLY 294 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.19 3h1c h GLY 294 CO 0.05 0.00 -0.82 0.83 0.00 0.00 0.00 176.54 176.60 3h1c h GLU 295 N 0.00 0.26 -0.21 4.80 5.08 -1.52 -2.28 114.58 120.71 3h1c h GLU 295 Ca -0.00 -0.25 -0.20 0.00 -1.00 0.00 0.00 59.36 57.90 3h1c h GLU 295 Cb 0.76 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.08 3h1c h GLU 295 CO 0.06 0.94 -0.65 0.82 -1.00 0.00 0.00 179.01 179.18 3h1c h ILE 296 N 0.16 1.29 -0.20 3.13 1.08 -1.40 -1.73 117.51 119.84 3h1c h ILE 296 Ca -0.04 -1.86 -0.07 0.00 -0.39 0.00 0.00 64.86 62.50 3h1c h ILE 296 Cb 1.42 1.81 -0.01 0.00 -3.07 0.00 0.00 36.82 36.97 3h1c h ILE 296 CO 0.13 0.59 -0.20 -0.07 -0.69 0.00 0.00 178.15 177.92 3h1c h LEU 297 N 0.57 0.34 -0.72 1.44 3.38 -1.45 -2.44 115.31 116.45 3h1c h LEU 297 Ca -0.02 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.72 3h1c h LEU 297 Cb 1.26 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 3h1c h LEU 297 CO 0.14 0.56 -0.64 -0.74 0.09 0.00 0.00 178.44 177.85 3h1c h HIS 298 N 0.32 0.03 -0.13 1.13 2.76 -1.32 -2.80 115.15 115.13 3h1c h HIS 298 Ca 0.06 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.10 3h1c h HIS 298 Cb 0.54 -0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.48 3h1c h HIS 298 CO 0.01 0.65 -0.42 0.00 -1.30 0.00 0.00 177.93 176.87 3h1c h ALA 299 N 1.35 1.04 -0.23 5.26 0.00 -0.85 -1.44 119.26 124.38 3h1c h ALA 299 Ca -0.01 -0.43 -0.17 0.00 0.00 0.00 0.00 54.91 54.31 3h1c h ALA 299 Cb 1.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3h1c h ALA 299 CO 0.08 0.61 -0.51 0.82 0.00 0.00 0.00 179.25 180.26 3h1c h ILE 300 N 0.25 1.30 -0.97 0.00 1.08 -1.43 -1.90 117.51 115.84 3h1c h ILE 300 Ca 0.02 -1.72 0.03 0.00 -0.39 0.00 0.00 64.86 62.80 3h1c h ILE 300 Cb 0.86 1.78 -0.05 0.00 -3.07 0.00 0.00 36.82 36.33 3h1c h ILE 300 CO 0.07 0.55 0.64 -0.33 -0.69 0.00 0.00 178.15 178.38 3h1c h GLU 301 N 0.49 1.22 -0.22 2.37 5.08 -1.33 -0.34 114.58 121.84 3h1c h GLU 301 Ca 0.00 -0.07 -0.16 0.00 -1.00 0.00 0.00 59.36 58.13 3h1c h GLU 301 Cb 1.12 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 3h1c h GLU 301 CO 0.11 0.81 -0.52 0.87 -1.00 0.00 0.00 179.01 179.28 3h1c h LYS 302 N 1.25 0.63 -0.07 2.33 1.57 -1.24 -3.10 116.57 117.95 3h1c h LYS 302 Ca 0.37 -0.38 -0.17 0.00 -1.87 0.00 0.00 60.65 58.60 3h1c h LYS 302 Cb -0.05 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 3h1c h LYS 302 CO -0.10 1.00 -0.70 -0.97 -0.57 0.00 0.00 179.45 178.11 3h1c h ASN 303 N 0.49 0.39 -0.16 0.86 -1.24 -0.84 -2.79 115.58 112.30 3h1c h ASN 303 Ca 0.02 -0.25 -0.06 0.00 0.71 0.00 0.00 56.30 56.71 3h1c h ASN 303 Cb 1.07 -0.11 -0.00 0.00 0.73 0.00 0.00 38.32 40.00 3h1c h ASN 303 CO 0.10 0.97 -0.15 0.58 -1.29 0.00 0.00 177.43 177.64 3h1c h VAL 304 N 0.23 1.34 -0.09 2.57 2.07 -1.12 -3.04 116.25 118.22 3h1c h VAL 304 Ca -0.02 -1.31 -0.06 0.00 0.82 0.00 0.00 66.70 66.14 3h1c h VAL 304 Cb 1.25 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.87 3h1c h VAL 304 CO 0.11 0.39 -0.16 0.58 0.02 0.00 0.00 177.57 178.51 3h1c h VAL 305 N 0.01 1.40 -0.19 2.57 2.07 -1.62 -3.11 116.25 117.39 3h1c h VAL 305 Ca 0.03 -1.44 -0.02 0.00 0.82 0.00 0.00 66.70 66.08 3h1c h VAL 305 Cb 0.68 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 3h1c h VAL 305 CO 0.04 0.41 0.04 0.03 0.02 0.00 0.00 177.57 178.11 3h1c h ARG 306 N -0.20 0.30 0.00 1.57 3.08 -1.62 -2.95 114.38 114.56 3h1c h ARG 306 Ca 0.00 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3h1c h ARG 306 Cb 0.74 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.75 3h1c h ARG 306 CO 0.04 0.44 -0.06 0.66 -1.07 0.00 0.00 179.97 179.98 3h1c h SER 307 N 0.11 0.00 -0.02 7.04 4.64 -1.67 -2.29 113.55 121.35 3h1c h SER 307 Ca 0.06 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.30 3h1c h SER 307 Cb 0.28 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.37 3h1c h SER 307 CO 0.00 0.06 -0.30 -0.09 -0.87 0.00 0.00 176.83 175.63 3h1c h ARG 308 N 0.00 0.25 -0.01 4.77 2.43 -1.45 -2.81 114.38 117.56 3h1c h ARG 308 Ca -0.00 -0.24 -0.16 0.00 -0.81 0.00 0.00 59.98 58.77 3h1c h ARG 308 Cb 0.61 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 3h1c h ARG 308 CO 0.01 0.92 -0.74 0.28 -1.51 0.00 0.00 179.97 178.93 3h1c h VAL 309 N -0.34 1.49 -0.28 0.20 2.07 -1.50 -1.86 116.25 116.02 3h1c h VAL 309 Ca -0.03 -2.43 -0.11 0.00 0.82 0.00 0.00 66.70 64.95 3h1c h VAL 309 Cb 1.01 2.31 -0.01 0.00 -1.52 0.00 0.00 31.29 33.08 3h1c h VAL 309 CO 0.06 0.70 -0.27 0.25 0.02 0.00 0.00 177.57 178.33 3h1c h LEU 310 N 0.06 0.57 -0.24 2.57 5.85 -1.49 -3.17 115.31 119.45 3h1c h LEU 310 Ca -0.02 -0.21 -0.21 0.00 0.84 0.00 0.00 57.88 58.28 3h1c h LEU 310 Cb 1.30 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.18 3h1c h LEU 310 CO 0.10 0.82 -0.81 0.00 -0.34 0.00 0.00 178.44 178.21 3h1c h ALA 311 N 1.22 0.41 0.00 1.25 0.00 -1.49 -3.48 119.26 117.17 3h1c h ALA 311 Ca 0.07 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3h1c h ALA 311 Cb 0.73 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3h1c h ALA 311 CO 0.06 0.74 0.00 0.41 0.00 0.00 0.00 179.25 180.45 3h1c n GLY 312 N 0.73 0.30 3.80 0.00 0.00 -1.16 -5.12 105.19 103.73 3h1c n GLY 312 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 3h1c n GLY 312 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h1c s GLU 313 N 0.00 3.63 0.91 1.61 2.02 -0.71 -5.02 118.70 121.14 3h1c s GLU 313 Ca 0.00 1.36 -0.11 0.00 0.02 0.00 0.00 54.97 56.24 3h1c s GLU 313 Cb 0.00 -2.07 0.12 0.00 0.10 0.00 0.00 34.13 32.28 3h1c s GLU 313 CO 0.00 -0.57 1.01 -0.35 0.02 0.00 0.00 175.26 175.37 3h1c n PRO 314 N -1.25 -0.34 -0.37 0.39 -0.04 -1.26 -4.35 135.00 127.77 3h1c n PRO 314 Ca 0.09 -0.04 -0.09 0.00 -0.04 0.00 0.00 63.50 63.43 3h1c n PRO 314 Cb 0.52 -2.28 0.07 0.00 -0.04 0.00 0.00 33.50 31.77 3h1c n PRO 314 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3h1c n ARG 315 N -3.62 -1.41 -0.09 0.54 1.74 -1.03 -4.82 116.66 107.97 3h1c n ARG 315 Ca 0.11 -0.55 -0.10 0.00 -0.77 0.00 0.00 57.85 56.54 3h1c n ARG 315 Cb 0.52 -0.48 -0.03 0.00 -1.02 0.00 0.00 32.46 31.45 3h1c n ARG 315 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3h1c h ILE 316 N -1.75 1.18 -0.42 0.55 2.04 -1.91 -2.89 117.51 114.31 3h1c h ILE 316 Ca -0.13 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.16 3h1c h ILE 316 Cb 0.38 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 3h1c h ILE 316 CO 0.08 0.19 0.00 -0.90 0.00 0.00 0.00 178.15 177.53 3h1c n ASP 317 N -4.74 2.39 -1.35 1.72 5.75 -1.26 -4.12 116.55 114.93 3h1c n ASP 317 Ca -0.02 -1.97 -0.03 0.00 -0.01 0.00 0.00 54.79 52.76 3h1c n ASP 317 Cb 0.14 -0.28 0.01 0.00 -1.03 0.00 0.00 41.12 39.97 3h1c n ASP 317 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h1c n GLY 318 N 1.22 0.34 3.62 6.12 0.00 -1.09 -4.85 105.19 110.55 3h1c n GLY 318 Ca 0.15 -0.40 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 3h1c n GLY 318 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h1c s ARG 319 N -4.26 2.07 0.62 1.61 0.52 -1.26 -4.86 118.95 113.39 3h1c s ARG 319 Ca 0.00 -1.72 -0.06 0.00 -0.52 0.00 0.00 55.73 53.44 3h1c s ARG 319 Cb -0.00 -1.94 0.02 0.00 0.52 0.00 0.00 34.95 33.55 3h1c s ARG 319 CO 0.11 0.17 0.92 -1.21 0.02 0.00 0.00 175.30 175.32 3h1c s GLU 320 N -3.70 2.70 0.54 3.54 0.41 -1.26 -2.48 118.70 118.45 3h1c s GLU 320 Ca 0.34 -0.12 0.26 0.00 -0.41 0.00 0.00 54.97 55.04 3h1c s GLU 320 Cb -0.01 -2.26 1.54 0.00 -1.78 0.00 0.00 34.13 31.62 3h1c s GLU 320 CO 0.19 -0.85 2.14 1.57 -0.49 0.00 0.00 175.26 177.83 3h1c h LYS 321 N -0.27 0.00 -0.00 1.61 2.10 -1.96 -2.90 116.57 115.14 3h1c h LYS 321 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 3h1c h LYS 321 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 3h1c h LYS 321 CO 0.60 0.07 -0.30 -0.40 -2.00 0.00 0.00 179.45 177.42 3h1c n ASP 322 N -3.85 0.42 -4.73 7.07 5.75 -1.26 -1.68 116.55 118.26 3h1c n ASP 322 Ca -0.02 -0.71 -0.41 0.00 -0.01 0.00 0.00 54.79 53.63 3h1c n ASP 322 Cb 0.17 0.93 -0.04 0.00 -1.03 0.00 0.00 41.12 41.14 3h1c n ASP 322 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 3h1c s MET 323 N -1.57 4.63 0.33 0.11 1.75 -1.10 -4.76 119.30 118.68 3h1c s MET 323 Ca 0.03 1.62 0.07 0.00 -1.25 0.00 0.00 55.69 56.16 3h1c s MET 323 Cb 0.05 -3.32 -0.03 0.00 2.84 0.00 0.00 34.83 34.38 3h1c s MET 323 CO 0.27 0.11 0.31 0.96 -0.65 0.00 0.00 175.02 176.02 3h1c s ILE 324 N -0.09 3.65 1.11 10.11 -5.25 -1.26 -4.61 121.20 124.86 3h1c s ILE 324 Ca 0.49 -1.33 -0.16 0.00 -0.99 0.00 0.00 60.65 58.66 3h1c s ILE 324 Cb -0.27 -3.23 0.24 0.00 2.95 0.00 0.00 42.46 42.16 3h1c s ILE 324 CO 0.33 -0.18 1.11 -0.13 -1.79 0.00 0.00 174.94 174.27 3h1c s ARG 325 N -4.00 -0.49 0.43 0.37 0.52 -1.26 -5.01 118.95 109.51 3h1c s ARG 325 Ca 0.41 0.17 -0.24 0.00 -0.52 0.00 0.00 55.73 55.55 3h1c s ARG 325 Cb -0.06 -1.66 -0.08 0.00 0.52 0.00 0.00 34.95 33.67 3h1c s ARG 325 CO 0.27 -3.27 1.16 0.20 0.02 0.00 0.00 175.30 173.68 3h1c s GLY 326 N -3.72 2.80 0.02 -3.53 0.00 -1.26 -4.80 107.32 96.83 3h1c s GLY 326 Ca 0.68 0.93 0.06 0.00 0.00 0.00 0.00 44.72 46.40 3h1c s GLY 326 CO 0.57 1.40 -0.17 1.08 0.00 0.00 0.00 173.10 175.98 3h1c s LEU 327 N -2.81 2.62 -0.16 0.66 1.43 -1.26 -0.96 118.68 118.20 3h1c s LEU 327 Ca 0.61 -0.38 -0.04 0.00 -1.03 0.00 0.00 54.13 53.29 3h1c s LEU 327 Cb -0.29 -1.53 0.05 0.00 0.03 0.00 0.00 46.19 44.46 3h1c s LEU 327 CO 0.36 0.27 0.06 -0.62 0.23 0.00 0.00 176.35 176.65 3h1c s ASP 328 N -1.28 2.35 -0.25 2.29 2.15 0.24 -4.98 116.67 117.20 3h1c s ASP 328 Ca 0.14 -0.57 -0.06 0.00 0.43 0.00 0.00 52.55 52.50 3h1c s ASP 328 Cb -0.10 -0.38 -0.01 0.00 -0.30 0.00 0.00 42.92 42.12 3h1c s ASP 328 CO 0.04 -0.31 0.03 -0.69 -0.17 0.00 0.00 175.17 174.07 3h1c s VAL 329 N 2.02 3.86 -0.10 1.11 1.01 -1.26 -0.83 120.40 126.21 3h1c s VAL 329 Ca 0.02 -0.43 -0.00 0.00 0.00 0.00 0.00 61.98 61.57 3h1c s VAL 329 Cb -0.16 -2.84 0.02 0.00 0.00 0.00 0.00 36.38 33.41 3h1c s VAL 329 CO -0.08 0.31 -0.08 -0.13 0.00 0.00 0.00 175.10 175.12 3h1c s ARG 330 N 1.53 1.52 -0.09 2.72 0.52 -1.05 -5.02 118.95 119.08 3h1c s ARG 330 Ca 0.05 -0.26 0.01 0.00 -0.52 0.00 0.00 55.73 55.01 3h1c s ARG 330 Cb -0.15 -1.53 -0.02 0.00 0.52 0.00 0.00 34.95 33.76 3h1c s ARG 330 CO 0.01 -0.22 -0.11 0.99 0.02 0.00 0.00 175.30 175.98 3h1c s THR 331 N 1.55 3.28 -0.00 0.02 2.01 -1.26 -0.33 115.64 120.91 3h1c s THR 331 Ca 0.02 -0.62 -0.00 0.00 0.31 0.00 0.00 61.69 61.40 3h1c s THR 331 Cb -0.13 -2.34 0.00 0.00 0.01 0.00 0.00 72.50 70.04 3h1c s THR 331 CO -0.06 0.57 0.00 0.61 -0.69 0.00 0.00 174.62 175.05 3h1c n GLY 332 N 2.73 0.68 0.16 4.40 0.00 0.25 -4.99 105.19 108.43 3h1c n GLY 332 Ca -0.18 -0.57 -0.01 0.00 0.00 0.00 0.00 46.02 45.26 3h1c n GLY 332 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3h1c h VAL 333 N -0.01 1.37 -3.53 1.61 3.04 -1.83 -3.44 116.25 113.47 3h1c h VAL 333 Ca -0.00 -1.81 -0.68 0.00 -1.01 0.00 0.00 66.70 63.20 3h1c h VAL 333 Cb 1.00 1.94 -0.17 0.00 -2.01 0.00 0.00 31.29 32.06 3h1c h VAL 333 CO 0.00 0.52 -0.68 -0.76 -1.01 0.00 0.00 177.57 175.65 3h1c s LEU 334 N -7.90 3.31 -0.08 3.16 1.43 -1.26 -5.05 118.68 112.29 3h1c s LEU 334 Ca -0.03 -0.04 -0.10 0.00 -1.03 0.00 0.00 54.13 52.94 3h1c s LEU 334 Cb 0.13 -1.83 -0.29 0.00 0.03 0.00 0.00 46.19 44.23 3h1c s LEU 334 CO 0.76 0.32 0.55 1.55 0.23 0.00 0.00 176.35 179.76 3h1c h PRO 335 N 4.78 0.35 -1.38 1.29 0.13 -2.02 -3.40 132.00 131.75 3h1c h PRO 335 Ca -0.49 -0.60 -0.71 0.00 -0.87 0.00 0.00 66.00 63.34 3h1c h PRO 335 Cb 1.17 0.22 -0.28 0.00 0.13 0.00 0.00 31.00 32.25 3h1c h PRO 335 CO 0.54 1.29 0.94 -2.13 -0.23 0.00 0.00 178.00 178.41 3h1c n ARG 336 N -3.56 2.70 -4.18 0.86 3.00 -1.26 -4.92 116.66 109.30 3h1c n ARG 336 Ca -0.28 -3.35 -0.11 0.00 -0.00 0.00 0.00 57.85 54.12 3h1c n ARG 336 Cb 1.07 -2.27 -0.10 0.00 0.00 0.00 0.00 32.46 31.15 3h1c n ARG 336 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 3h1c s THR 337 N -4.87 0.03 -0.03 5.15 -1.32 -1.26 -5.09 115.64 108.25 3h1c s THR 337 Ca 0.60 -1.97 -0.18 0.00 -1.21 0.00 0.00 61.69 58.93 3h1c s THR 337 Cb 0.48 -2.34 -0.11 0.00 -1.51 0.00 0.00 72.50 69.01 3h1c s THR 337 CO -0.16 -0.16 0.76 0.45 -2.21 0.00 0.00 174.62 173.30 3h1c h HIS 338 N 2.70 -0.45 -3.93 9.09 3.86 -1.92 -3.47 115.15 121.04 3h1c h HIS 338 Ca -0.36 -0.01 -0.34 0.00 -1.16 0.00 0.00 60.37 58.51 3h1c h HIS 338 Cb 1.23 0.15 -0.28 0.00 1.06 0.00 0.00 27.41 29.57 3h1c h HIS 338 CO 0.38 -0.18 -0.76 0.20 0.86 0.00 0.00 177.93 178.43 3h1c s GLY 339 N -2.97 0.30 -0.12 2.45 0.00 -0.98 -3.61 107.32 102.40 3h1c s GLY 339 Ca -0.10 -0.28 -0.12 0.00 0.00 0.00 0.00 44.72 44.22 3h1c s GLY 339 CO 0.33 -0.24 0.34 -1.35 0.00 0.00 0.00 173.10 172.18 3h1c s SER 340 N -0.21 -0.34 -0.06 1.64 1.04 -1.26 -1.15 113.70 113.36 3h1c s SER 340 Ca 0.02 0.62 -0.06 0.00 0.48 0.00 0.00 55.95 57.01 3h1c s SER 340 Cb -0.03 0.66 0.02 0.00 0.10 0.00 0.00 66.02 66.77 3h1c s SER 340 CO -0.00 -0.15 0.18 0.00 0.98 0.00 0.00 173.24 174.24 3h1c s ALA 341 N 0.02 -0.43 -0.56 5.32 0.00 0.39 -0.58 121.76 125.91 3h1c s ALA 341 Ca -0.01 0.44 0.04 0.00 0.00 0.00 0.00 51.96 52.43 3h1c s ALA 341 Cb -0.03 -0.25 0.14 0.00 0.00 0.00 0.00 23.12 22.99 3h1c s ALA 341 CO 0.01 -0.10 0.33 -1.17 0.00 0.00 0.00 175.76 174.84 3h1c s LEU 342 N -0.06 4.12 -0.00 0.00 2.96 0.55 -1.60 118.68 124.65 3h1c s LEU 342 Ca -0.01 -3.23 -0.20 0.00 -0.22 0.00 0.00 54.13 50.46 3h1c s LEU 342 Cb -0.02 -1.50 -0.05 0.00 0.50 0.00 0.00 46.19 45.12 3h1c s LEU 342 CO 0.00 -0.19 0.58 0.12 -1.32 0.00 0.00 176.35 175.55 3h1c s PHE 343 N -0.56 3.69 -0.04 5.38 5.36 -1.23 -2.53 117.98 128.05 3h1c s PHE 343 Ca 0.20 1.19 -0.02 0.00 -0.96 0.00 0.00 56.93 57.34 3h1c s PHE 343 Cb -0.18 -2.59 0.02 0.00 -0.34 0.00 0.00 43.02 39.93 3h1c s PHE 343 CO -0.06 0.37 0.09 0.99 -1.46 0.00 0.00 175.22 175.15 3h1c s THR 344 N -0.26 -0.02 -0.22 0.12 2.01 -0.01 -2.16 115.64 115.10 3h1c s THR 344 Ca 0.31 0.09 -0.04 0.00 0.31 0.00 0.00 61.69 62.35 3h1c s THR 344 Cb -0.18 -0.15 0.09 0.00 0.01 0.00 0.00 72.50 72.27 3h1c s THR 344 CO 0.17 0.04 0.18 -0.60 -0.69 0.00 0.00 174.62 173.71 3h1c s ARG 345 N 0.53 0.17 6.23 4.92 3.52 -1.04 0.82 118.95 134.10 3h1c s ARG 345 Ca -0.04 -0.06 0.00 0.00 -0.13 0.00 0.00 55.73 55.50 3h1c s ARG 345 Cb -0.06 -1.31 0.00 0.00 -1.56 0.00 0.00 34.95 32.02 3h1c s ARG 345 CO -0.02 -0.78 0.00 0.41 -0.81 0.00 0.00 175.30 174.10 3h1c n GLY 346 N 5.29 1.74 2.51 8.12 0.00 -0.13 -3.33 105.19 119.38 3h1c n GLY 346 Ca -0.06 -0.23 -0.22 0.00 0.00 0.00 0.00 46.02 45.52 3h1c n GLY 346 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h1c n GLU 347 N 1.43 1.93 -3.58 1.61 -0.58 -1.26 -4.97 120.64 115.21 3h1c n GLU 347 Ca 0.00 -4.01 -0.12 0.00 -0.42 0.00 0.00 57.16 52.61 3h1c n GLU 347 Cb 0.00 -1.93 -0.06 0.00 -0.57 0.00 0.00 31.44 28.88 3h1c n GLU 347 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 3h1c s THR 348 N -3.29 0.00 -0.30 2.62 2.01 -1.21 -2.65 115.64 112.82 3h1c s THR 348 Ca 0.44 0.00 -0.24 0.00 0.31 0.00 0.00 61.69 62.20 3h1c s THR 348 Cb 0.32 -1.00 0.19 0.00 0.01 0.00 0.00 72.50 72.02 3h1c s THR 348 CO -0.11 0.00 1.41 0.00 -0.69 0.00 0.00 174.62 175.23 3h1c s GLN 349 N -0.71 0.07 -0.10 4.92 -2.07 -1.04 -2.51 119.66 118.22 3h1c s GLN 349 Ca -0.02 0.09 -0.01 0.00 -1.82 0.00 0.00 55.36 53.59 3h1c s GLN 349 Cb -0.02 0.03 0.03 0.00 -1.09 0.00 0.00 33.01 31.96 3h1c s GLN 349 CO 0.02 -0.01 -0.03 0.00 -1.32 0.00 0.00 175.29 173.95 3h1c s ALA 350 N 0.20 0.99 -0.98 2.60 0.00 -0.92 -1.31 121.76 122.34 3h1c s ALA 350 Ca 0.05 -0.34 -0.24 0.00 0.00 0.00 0.00 51.96 51.43 3h1c s ALA 350 Cb -0.05 -0.84 0.05 0.00 0.00 0.00 0.00 23.12 22.28 3h1c s ALA 350 CO -0.15 -0.48 1.42 -1.17 0.00 0.00 0.00 175.76 175.39 3h1c s LEU 351 N 1.85 3.45 -0.19 0.00 2.96 0.25 -3.50 118.68 123.50 3h1c s LEU 351 Ca 0.05 -1.29 -0.09 0.00 -0.22 0.00 0.00 54.13 52.57 3h1c s LEU 351 Cb -0.13 -2.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.95 3h1c s LEU 351 CO -0.07 -1.56 0.11 -0.69 -1.32 0.00 0.00 176.35 172.83 3h1c s VAL 352 N 5.10 5.25 0.01 1.68 1.01 -0.63 -0.47 120.40 132.34 3h1c s VAL 352 Ca 0.44 0.13 0.06 0.00 0.00 0.00 0.00 61.98 62.61 3h1c s VAL 352 Cb -0.01 -3.39 -0.02 0.00 0.00 0.00 0.00 36.38 32.96 3h1c s VAL 352 CO -0.06 0.45 -0.18 0.42 0.00 0.00 0.00 175.10 175.73 3h1c s THR 353 N 0.34 1.42 -0.11 3.92 -4.23 0.23 -0.46 115.64 116.74 3h1c s THR 353 Ca 0.07 -0.90 -0.01 0.00 -1.18 0.00 0.00 61.69 59.67 3h1c s THR 353 Cb -0.11 -1.20 -0.03 0.00 1.34 0.00 0.00 72.50 72.50 3h1c s THR 353 CO -0.01 0.29 -0.07 0.00 -0.54 0.00 0.00 174.62 174.28 3h1c s ALA 354 N -0.57 2.90 -0.09 3.99 0.00 -0.30 -1.15 121.76 126.53 3h1c s ALA 354 Ca 0.06 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.18 3h1c s ALA 354 Cb -0.07 -1.32 0.01 0.00 0.00 0.00 0.00 23.12 21.73 3h1c s ALA 354 CO 0.00 0.39 -0.20 0.99 0.00 0.00 0.00 175.76 176.95 3h1c s THR 355 N -0.20 1.74 0.03 0.00 2.01 0.01 -2.31 115.64 116.93 3h1c s THR 355 Ca 0.02 -0.83 -0.13 0.00 0.31 0.00 0.00 61.69 61.06 3h1c s THR 355 Cb -0.13 -1.53 -0.06 0.00 0.01 0.00 0.00 72.50 70.79 3h1c s THR 355 CO 0.03 0.49 0.41 -0.76 -0.69 0.00 0.00 174.62 174.10 3h1c s LEU 356 N 0.54 4.44 0.18 4.42 1.43 -1.26 -1.56 118.68 126.86 3h1c s LEU 356 Ca -0.16 0.93 -0.17 0.00 -1.03 0.00 0.00 54.13 53.70 3h1c s LEU 356 Cb -0.17 -2.72 0.03 0.00 0.03 0.00 0.00 46.19 43.36 3h1c s LEU 356 CO 0.06 0.28 0.50 -0.83 0.23 0.00 0.00 176.35 176.58 3h1c s GLY 357 N -1.28 -0.11 0.73 -3.19 0.00 -0.34 -4.99 107.32 98.14 3h1c s GLY 357 Ca 0.27 -0.20 -0.11 0.00 0.00 0.00 0.00 44.72 44.67 3h1c s GLY 357 CO 0.15 -0.28 1.11 -1.59 0.00 0.00 0.00 173.10 172.49 3h1c s THR 358 N -3.86 3.12 -0.58 0.90 2.01 -1.26 -0.89 115.64 115.08 3h1c s THR 358 Ca 0.08 0.35 0.16 0.00 0.31 0.00 0.00 61.69 62.60 3h1c s THR 358 Cb -0.00 -3.36 0.16 0.00 0.01 0.00 0.00 72.50 69.31 3h1c s THR 358 CO -0.04 -0.47 1.49 0.00 -0.69 0.00 0.00 174.62 174.90 3h1c n ALA 359 N -3.07 1.29 0.15 7.40 0.00 -1.26 -1.97 120.51 123.05 3h1c n ALA 359 Ca 0.07 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.60 3h1c n ALA 359 Cb 0.58 -1.25 0.23 0.00 0.00 0.00 0.00 19.45 19.01 3h1c n ALA 359 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3h1c h ARG 360 N 0.00 0.00 -0.69 0.00 2.43 -2.00 -3.16 114.38 110.96 3h1c h ARG 360 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3h1c h ARG 360 Cb 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3h1c h ARG 360 CO 0.00 0.54 0.00 -0.25 -1.51 0.00 0.00 179.97 178.75 3h1c n ASP 361 N -3.81 3.39 -4.76 -3.80 8.00 -0.83 -4.93 116.55 109.80 3h1c n ASP 361 Ca -0.01 -2.41 -0.40 0.00 0.71 0.00 0.00 54.79 52.67 3h1c n ASP 361 Cb 0.57 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 41.08 3h1c n ASP 361 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h1c s ALA 362 N -1.88 3.39 -0.11 2.24 0.00 -1.20 -5.00 121.76 119.21 3h1c s ALA 362 Ca 0.30 0.83 -0.30 0.00 0.00 0.00 0.00 51.96 52.80 3h1c s ALA 362 Cb 0.22 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 3h1c s ALA 362 CO 0.11 -0.08 1.23 -1.14 0.00 0.00 0.00 175.76 175.88 3h1c s GLN 363 N -1.31 4.29 -0.59 0.00 0.74 -1.20 -4.87 119.66 116.72 3h1c s GLN 363 Ca 0.44 1.67 -0.23 0.00 0.05 0.00 0.00 55.36 57.29 3h1c s GLN 363 Cb -0.30 -3.65 0.05 0.00 1.10 0.00 0.00 33.01 30.20 3h1c s GLN 363 CO 0.39 -0.57 0.94 0.08 -0.55 0.00 0.00 175.29 175.57 3h1c s VAL 364 N 2.82 4.38 -0.44 1.34 1.01 -1.26 -1.41 120.40 126.83 3h1c s VAL 364 Ca 0.55 -0.00 -0.24 0.00 0.00 0.00 0.00 61.98 62.30 3h1c s VAL 364 Cb -0.23 -4.58 0.02 0.00 0.00 0.00 0.00 36.38 31.59 3h1c s VAL 364 CO 0.18 -1.24 0.81 -0.76 0.00 0.00 0.00 175.10 174.10 3h1c s LEU 365 N 3.95 4.19 -1.24 3.92 1.43 0.30 -4.97 118.68 126.25 3h1c s LEU 365 Ca 0.26 -0.02 -0.12 0.00 -1.03 0.00 0.00 54.13 53.23 3h1c s LEU 365 Cb -0.14 -3.01 0.17 0.00 0.03 0.00 0.00 46.19 43.23 3h1c s LEU 365 CO 0.15 -0.92 1.62 -0.67 0.23 0.00 0.00 176.35 176.76 3h1c n ASP 366 N 6.77 5.15 -4.83 2.29 2.03 -1.26 -1.18 116.55 125.52 3h1c n ASP 366 Ca 0.03 -3.02 -0.31 0.00 0.52 0.00 0.00 54.79 52.01 3h1c n ASP 366 Cb 0.48 -1.54 0.06 0.00 -0.72 0.00 0.00 41.12 39.40 3h1c n ASP 366 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 3h1c s GLU 367 N 1.22 2.72 0.21 -0.67 2.12 -1.23 -4.98 118.70 118.09 3h1c s GLU 367 Ca 0.42 0.75 -0.07 0.00 0.36 0.00 0.00 54.97 56.43 3h1c s GLU 367 Cb 0.02 -1.98 0.15 0.00 0.26 0.00 0.00 34.13 32.58 3h1c s GLU 367 CO 0.00 -1.20 1.73 1.25 -0.54 0.00 0.00 175.26 176.50 3h1c h LEU 368 N -0.78 1.04 -6.13 2.70 5.85 -1.98 -3.24 115.31 112.76 3h1c h LEU 368 Ca -0.45 -0.22 -0.79 0.00 0.84 0.00 0.00 57.88 57.26 3h1c h LEU 368 Cb 1.23 -0.28 -0.28 0.00 0.37 0.00 0.00 40.66 41.70 3h1c h LEU 368 CO 0.59 1.01 0.89 1.15 -0.34 0.00 0.00 178.44 181.74 3h1c n MET 369 N -4.23 5.20 0.00 1.25 0.00 -1.26 -4.72 117.12 113.36 3h1c n MET 369 Ca 0.05 -4.66 0.00 0.00 0.00 0.00 0.00 57.70 53.09 3h1c n MET 369 Cb 0.26 -2.44 0.00 0.00 0.00 0.00 0.00 33.22 31.04 3h1c n MET 369 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3h1c n GLY 370 N -0.09 0.65 3.85 3.17 0.00 -1.22 -5.03 105.19 106.51 3h1c n GLY 370 Ca 0.46 -1.63 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 3h1c n GLY 370 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3h1c s GLU 371 N -3.82 4.02 0.06 1.61 -1.05 -1.26 -3.57 118.70 114.69 3h1c s GLU 371 Ca 0.00 0.64 0.02 0.00 -0.15 0.00 0.00 54.97 55.48 3h1c s GLU 371 Cb 0.00 -2.58 -0.03 0.00 -0.44 0.00 0.00 34.13 31.08 3h1c s GLU 371 CO 0.00 0.25 -0.08 1.03 0.95 0.00 0.00 175.26 177.41 3h1c s ARG 372 N -2.69 0.62 -0.21 -4.83 0.52 -0.32 -4.96 118.95 107.08 3h1c s ARG 372 Ca 0.50 -0.92 -0.06 0.00 -0.52 0.00 0.00 55.73 54.74 3h1c s ARG 372 Cb -0.12 -0.29 -0.03 0.00 0.52 0.00 0.00 34.95 35.04 3h1c s ARG 372 CO 0.19 0.04 0.02 0.95 0.02 0.00 0.00 175.30 176.51 3h1c s THR 373 N -1.97 4.06 -0.18 0.02 -4.23 -1.26 -0.54 115.64 111.55 3h1c s THR 373 Ca -0.04 -0.27 -0.14 0.00 -1.18 0.00 0.00 61.69 60.06 3h1c s THR 373 Cb -0.06 -2.85 -0.04 0.00 1.34 0.00 0.00 72.50 70.89 3h1c s THR 373 CO -0.01 0.41 0.32 -0.62 -0.54 0.00 0.00 174.62 174.18 3h1c s ASP 374 N 1.09 6.42 -0.17 3.99 2.15 -0.50 -4.99 116.67 124.65 3h1c s ASP 374 Ca 0.03 0.49 -0.14 0.00 0.43 0.00 0.00 52.55 53.35 3h1c s ASP 374 Cb -0.14 -2.19 -0.10 0.00 -0.30 0.00 0.00 42.92 40.18 3h1c s ASP 374 CO 0.02 0.04 -0.04 0.41 -0.17 0.00 0.00 175.17 175.43 3h1c n THR 375 N 3.88 1.47 -3.00 1.71 -1.04 -1.26 -3.26 114.28 112.77 3h1c n THR 375 Ca -0.11 0.10 -0.40 0.00 -2.04 0.00 0.00 64.05 61.60 3h1c n THR 375 Cb 0.52 -2.24 -0.04 0.00 -1.82 0.00 0.00 70.33 66.74 3h1c n THR 375 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 3h1c s PHE 376 N -2.32 3.56 -0.02 -1.42 5.36 -1.26 -2.61 117.98 119.27 3h1c s PHE 376 Ca -0.22 1.28 0.06 0.00 -0.96 0.00 0.00 56.93 57.09 3h1c s PHE 376 Cb 0.04 -2.85 -0.01 0.00 -0.34 0.00 0.00 43.02 39.86 3h1c s PHE 376 CO 0.38 0.04 -0.20 -0.51 -1.46 0.00 0.00 175.22 173.47 3h1c s LEU 377 N 0.98 2.02 -0.02 6.12 1.43 0.44 -5.00 118.68 124.66 3h1c s LEU 377 Ca 0.39 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 3h1c s LEU 377 Cb -0.18 -1.04 0.01 0.00 0.03 0.00 0.00 46.19 45.01 3h1c s LEU 377 CO 0.18 0.23 -0.04 0.12 0.23 0.00 0.00 176.35 177.07 3h1c s PHE 378 N -0.36 0.50 -0.02 0.29 5.36 -1.26 -0.21 117.98 122.27 3h1c s PHE 378 Ca 0.05 -0.10 0.03 0.00 -0.96 0.00 0.00 56.93 55.96 3h1c s PHE 378 Cb -0.09 -0.39 -0.00 0.00 -0.34 0.00 0.00 43.02 42.20 3h1c s PHE 378 CO -0.00 -0.06 -0.11 -1.01 -1.46 0.00 0.00 175.22 172.58 3h1c s HIS 379 N 0.26 1.11 -0.23 10.12 3.76 0.19 -4.82 115.29 125.67 3h1c s HIS 379 Ca -0.03 -0.27 0.01 0.00 -0.15 0.00 0.00 55.06 54.63 3h1c s HIS 379 Cb -0.06 -0.76 0.04 0.00 1.11 0.00 0.00 32.58 32.90 3h1c s HIS 379 CO -0.00 -0.09 -0.12 -0.47 -0.85 0.00 0.00 174.74 173.21 3h1c s TYR 380 N 0.03 3.07 -0.19 1.40 5.04 -1.26 -1.33 117.35 124.10 3h1c s TYR 380 Ca -0.01 -1.89 -0.03 0.00 -2.44 0.00 0.00 57.07 52.70 3h1c s TYR 380 Cb -0.08 -1.97 -0.02 0.00 0.35 0.00 0.00 41.96 40.25 3h1c s TYR 380 CO 0.00 -0.81 -0.05 -0.80 -1.34 0.00 0.00 175.55 172.55 3h1c s ASN 381 N 1.23 4.41 -0.57 4.32 0.01 -0.99 -4.74 114.94 118.61 3h1c s ASN 381 Ca -0.02 -0.31 0.03 0.00 -0.71 0.00 0.00 52.86 51.85 3h1c s ASN 381 Cb -0.17 -1.74 0.14 0.00 0.41 0.00 0.00 41.25 39.90 3h1c s ASN 381 CO -0.07 0.06 0.33 0.12 -1.51 0.00 0.00 177.10 176.03 3h1c s PHE 382 N 1.02 3.28 0.58 2.20 5.36 -1.26 -3.00 117.98 126.16 3h1c s PHE 382 Ca 0.00 -3.12 -0.13 0.00 -0.96 0.00 0.00 56.93 52.72 3h1c s PHE 382 Cb -0.15 -2.88 -0.05 0.00 -0.34 0.00 0.00 43.02 39.60 3h1c s PHE 382 CO 0.00 -0.73 1.01 -2.14 -1.46 0.00 0.00 175.22 171.90 3h1c s PRO 383 N -0.44 3.72 0.58 10.12 0.02 -1.26 -4.98 135.00 142.76 3h1c s PRO 383 Ca 0.18 0.82 0.36 0.00 0.02 0.00 0.00 61.00 62.38 3h1c s PRO 383 Cb -0.22 -2.10 1.60 0.00 0.02 0.00 0.00 34.50 33.80 3h1c s PRO 383 CO -0.03 -0.47 2.07 -1.00 -0.33 0.00 0.00 177.00 177.25 3h1c h PRO 384 N 0.10 0.00 0.00 5.54 0.13 -1.89 -3.00 132.00 132.88 3h1c h PRO 384 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3h1c h PRO 384 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3h1c h PRO 384 CO 0.62 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.87 3h1c n TYR 385 N -3.09 0.00 -0.09 1.56 4.11 -1.26 -1.43 117.16 116.96 3h1c n TYR 385 Ca -0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.76 3h1c n TYR 385 Cb 0.25 -0.48 -0.02 0.00 -0.00 0.00 0.00 39.34 39.09 3h1c n TYR 385 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.86 177.52 3h1c h SER 386 N 0.00 0.95 0.28 9.48 4.64 -1.67 -3.26 113.55 123.97 3h1c h SER 386 Ca 0.00 -0.47 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3h1c h SER 386 Cb 0.38 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3h1c h SER 386 CO 0.00 1.26 -1.26 1.33 -0.87 0.00 0.00 176.83 177.29 3h1c n VAL 387 N -4.03 0.12 -0.93 0.95 0.24 -1.22 -2.11 118.33 111.36 3h1c n VAL 387 Ca -0.03 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 3h1c n VAL 387 Cb 0.58 0.27 0.00 0.00 -1.47 0.00 0.00 33.84 33.22 3h1c n VAL 387 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h1c n GLY 388 N 1.35 1.09 3.61 7.63 0.00 -1.15 -5.02 105.19 112.71 3h1c n GLY 388 Ca 0.01 -0.29 -0.28 0.00 0.00 0.00 0.00 46.02 45.46 3h1c n GLY 388 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h1c s GLU 389 N -2.03 1.99 -0.08 1.61 2.02 -0.51 -5.03 118.70 116.68 3h1c s GLU 389 Ca 0.00 -2.21 0.04 0.00 0.02 0.00 0.00 54.97 52.82 3h1c s GLU 389 Cb 0.00 -1.17 -0.01 0.00 0.10 0.00 0.00 34.13 33.04 3h1c s GLU 389 CO 0.00 -0.31 -0.20 0.95 0.02 0.00 0.00 175.26 175.72 3h1c s THR 390 N -3.01 2.50 0.15 3.63 -4.23 -1.26 -4.05 115.64 109.36 3h1c s THR 390 Ca 0.21 -0.90 -0.24 0.00 -1.18 0.00 0.00 61.69 59.58 3h1c s THR 390 Cb 0.04 -1.96 0.06 0.00 1.34 0.00 0.00 72.50 71.99 3h1c s THR 390 CO 0.11 0.56 0.78 -0.83 -0.54 0.00 0.00 174.62 174.70 3h1c s GLY 391 N -0.13 -0.37 0.62 3.99 0.00 -1.26 -5.05 107.32 105.11 3h1c s GLY 391 Ca -0.03 0.35 -0.15 0.00 0.00 0.00 0.00 44.72 44.89 3h1c s GLY 391 CO 0.04 0.11 1.08 1.06 0.00 0.00 0.00 173.10 175.39 3h1c s MET 392 N -3.53 3.10 -0.34 2.90 -1.94 -1.26 -4.87 119.30 113.35 3h1c s MET 392 Ca 0.07 1.26 -0.00 0.00 -1.71 0.00 0.00 55.69 55.31 3h1c s MET 392 Cb -0.02 -2.00 0.11 0.00 2.01 0.00 0.00 34.83 34.93 3h1c s MET 392 CO -0.04 -1.00 0.13 0.08 -0.01 0.00 0.00 175.02 174.18 3h1c s VAL 393 N -2.44 0.96 0.00 -6.03 1.01 -1.26 -4.92 120.40 107.72 3h1c s VAL 393 Ca 0.65 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.97 3h1c s VAL 393 Cb -0.18 -1.72 0.00 0.00 0.00 0.00 0.00 36.38 34.49 3h1c s VAL 393 CO 0.40 -0.73 0.00 0.61 0.00 0.00 0.00 175.10 175.37 3h1c n GLY 394 N 4.55 4.16 3.71 4.51 0.00 -1.26 -5.13 105.19 115.73 3h1c n GLY 394 Ca 0.01 -0.52 -0.38 0.00 0.00 0.00 0.00 46.02 45.13 3h1c n GLY 394 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h1c n SER 395 N 0.00 2.00 -4.65 1.61 7.64 -1.26 -4.91 113.62 114.05 3h1c n SER 395 Ca 0.00 0.87 -0.43 0.00 1.01 0.00 0.00 58.87 60.33 3h1c n SER 395 Cb 0.00 -1.53 -0.02 0.00 -1.01 0.00 0.00 64.21 61.65 3h1c n SER 395 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3h1c s PRO 396 N -3.08 4.10 1.24 1.43 0.04 -1.26 -5.01 135.00 132.47 3h1c s PRO 396 Ca 0.78 1.71 -0.14 0.00 0.04 0.00 0.00 61.00 63.39 3h1c s PRO 396 Cb -0.40 -3.87 0.32 0.00 0.04 0.00 0.00 34.50 30.58 3h1c s PRO 396 CO 0.45 -0.89 1.00 1.63 0.04 0.00 0.00 177.00 179.22 3h1c n LYS 397 N 7.00 -2.96 0.13 4.56 5.02 -1.26 -4.79 118.16 125.86 3h1c n LYS 397 Ca 0.16 -0.84 0.04 0.00 -2.02 0.00 0.00 58.31 55.64 3h1c n LYS 397 Cb 0.45 -2.13 0.45 0.00 -0.02 0.00 0.00 35.03 33.77 3h1c n LYS 397 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h1c h ARG 398 N -2.89 0.24 -0.20 1.97 3.08 -1.97 -2.61 114.38 111.99 3h1c h ARG 398 Ca -0.62 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 59.26 3h1c h ARG 398 Cb 1.34 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.34 3h1c h ARG 398 CO 0.47 0.30 -0.44 -0.09 -1.07 0.00 0.00 179.97 179.14 3h1c h ARG 399 N 0.23 0.50 -0.10 0.04 2.43 -1.98 -2.47 114.38 113.04 3h1c h ARG 399 Ca 0.05 -0.27 -0.12 0.00 -0.81 0.00 0.00 59.98 58.84 3h1c h ARG 399 Cb 0.23 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3h1c h ARG 399 CO 0.01 0.85 -0.48 0.93 -1.51 0.00 0.00 179.97 179.76 3h1c h GLU 400 N 0.40 0.24 -0.13 0.20 5.08 -1.79 -2.28 114.58 116.31 3h1c h GLU 400 Ca 0.03 -0.13 -0.23 0.00 -1.00 0.00 0.00 59.36 58.03 3h1c h GLU 400 Cb 0.94 0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.21 3h1c h GLU 400 CO 0.08 0.68 -0.82 0.82 -1.00 0.00 0.00 179.01 178.77 3h1c h ILE 401 N 0.20 1.28 -0.68 3.13 2.04 -1.46 -1.91 117.51 120.09 3h1c h ILE 401 Ca 0.01 -2.01 -0.05 0.00 1.00 0.00 0.00 64.86 63.81 3h1c h ILE 401 Cb 0.92 2.03 -0.03 0.00 -0.74 0.00 0.00 36.82 39.00 3h1c h ILE 401 CO 0.07 0.64 0.24 1.23 0.00 0.00 0.00 178.15 180.33 3h1c h GLY 402 N 0.55 1.12 1.79 5.37 0.00 -1.35 -2.36 103.07 108.18 3h1c h GLY 402 Ca -0.06 -0.64 0.00 0.00 0.00 0.00 0.00 47.33 46.63 3h1c h GLY 402 CO 0.17 0.60 -0.14 1.42 0.00 0.00 0.00 176.54 178.59 3h1c n HIS 403 N -4.35 0.61 -0.03 5.60 8.25 -0.87 -2.92 115.22 121.52 3h1c n HIS 403 Ca 0.05 0.18 -0.14 0.00 -0.26 0.00 0.00 57.72 57.54 3h1c n HIS 403 Cb 0.20 -0.76 -0.10 0.00 1.12 0.00 0.00 29.99 30.46 3h1c n HIS 403 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 3h1c h GLY 404 N 4.65 0.27 2.00 -1.41 0.00 -0.84 -3.12 103.07 104.61 3h1c h GLY 404 Ca 0.00 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 46.86 3h1c h GLY 404 CO 0.00 0.32 -0.51 -0.09 0.00 0.00 0.00 176.54 176.27 3h1c h ARG 405 N -0.30 0.00 0.00 4.80 9.65 -1.56 -2.88 114.38 124.10 3h1c h ARG 405 Ca -0.01 0.00 0.03 0.00 -1.10 0.00 0.00 59.98 58.90 3h1c h ARG 405 Cb 0.87 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.41 3h1c h ARG 405 CO 0.05 0.51 -0.21 1.25 2.80 0.00 0.00 179.97 184.37 3h1c h LEU 406 N 0.00 -0.61 -0.74 3.80 6.46 -1.56 0.20 115.31 122.87 3h1c h LEU 406 Ca -0.01 0.09 -0.06 0.00 -0.12 0.00 0.00 57.88 57.78 3h1c h LEU 406 Cb 1.07 0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 41.24 3h1c h LEU 406 CO 0.07 -0.28 -0.28 0.00 -0.62 0.00 0.00 178.44 177.33 3h1c h ALA 407 N 0.55 0.93 -0.50 1.25 0.00 -1.59 -2.95 119.26 116.95 3h1c h ALA 407 Ca 0.06 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 3h1c h ALA 407 Cb 0.41 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3h1c h ALA 407 CO -0.19 0.36 -0.18 -0.22 0.00 0.00 0.00 179.25 179.02 3h1c h LYS 408 N 0.00 0.99 0.00 0.00 3.64 -1.20 -2.98 116.57 117.02 3h1c h LYS 408 Ca -0.00 -0.40 -0.08 0.00 -1.27 0.00 0.00 60.65 58.90 3h1c h LYS 408 Cb 0.94 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.70 3h1c h LYS 408 CO 0.04 1.07 -0.39 0.00 -2.27 0.00 0.00 179.45 177.90 3h1c h ARG 409 N 0.86 0.00 0.00 1.90 3.08 -0.85 -1.08 114.38 118.29 3h1c h ARG 409 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 3h1c h ARG 409 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.80 3h1c h ARG 409 CO 0.06 0.39 0.00 0.41 -1.07 0.00 0.00 179.97 179.76 3h1c n GLY 410 N -0.07 -1.47 0.01 0.04 0.00 -1.13 -3.83 105.19 98.75 3h1c n GLY 410 Ca -0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 3h1c n GLY 410 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3h1c n VAL 411 N -1.60 0.17 -0.19 1.61 0.31 -1.13 -4.73 118.33 112.77 3h1c n VAL 411 Ca 0.06 -0.14 0.09 0.00 -0.01 0.00 0.00 64.34 64.35 3h1c n VAL 411 Cb 0.33 -0.49 0.39 0.00 -0.91 0.00 0.00 33.84 33.16 3h1c n VAL 411 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3h1c h LEU 412 N 0.00 0.61 -1.13 7.52 5.85 -1.30 0.31 115.31 127.17 3h1c h LEU 412 Ca -0.07 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 3h1c h LEU 412 Cb 0.90 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 3h1c h LEU 412 CO 0.00 0.37 -0.18 0.00 -0.34 0.00 0.00 178.44 178.29 3h1c h ALA 413 N 1.62 1.01 0.00 1.25 0.00 -1.85 -3.21 119.26 118.08 3h1c h ALA 413 Ca 0.34 -0.16 -0.33 0.00 0.00 0.00 0.00 54.91 54.75 3h1c h ALA 413 Cb 0.43 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 3h1c h ALA 413 CO -0.12 0.22 -2.07 0.28 0.00 0.00 0.00 179.25 177.57 3h1c n VAL 414 N -3.33 1.51 -1.68 0.00 0.31 -0.29 -4.84 118.33 110.01 3h1c n VAL 414 Ca 0.00 -0.81 -0.44 0.00 -0.01 0.00 0.00 64.34 63.08 3h1c n VAL 414 Cb 0.41 -0.81 -0.02 0.00 -0.91 0.00 0.00 33.84 32.51 3h1c n VAL 414 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 3h1c n MET 415 N -2.93 2.07 -2.17 5.55 2.00 -0.06 -3.05 117.12 118.53 3h1c n MET 415 Ca -0.26 0.73 -0.37 0.00 0.00 0.00 0.00 57.70 57.80 3h1c n MET 415 Cb 1.10 -2.36 0.00 0.00 0.00 0.00 0.00 33.22 31.96 3h1c n MET 415 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 3h1c s PRO 416 N -0.87 3.62 0.85 0.03 0.04 -1.26 -4.95 135.00 132.46 3h1c s PRO 416 Ca 0.64 1.85 -0.12 0.00 0.04 0.00 0.00 61.00 63.41 3h1c s PRO 416 Cb -0.62 -2.36 0.10 0.00 0.04 0.00 0.00 34.50 31.66 3h1c s PRO 416 CO 0.54 -0.69 1.11 0.16 0.04 0.00 0.00 177.00 178.16 3h1c s ASP 417 N -1.31 4.02 0.53 6.66 -4.77 -1.26 -4.83 116.67 115.71 3h1c s ASP 417 Ca 0.65 1.20 0.22 0.00 -3.30 0.00 0.00 52.55 51.32 3h1c s ASP 417 Cb -0.31 -1.87 1.43 0.00 -1.09 0.00 0.00 42.92 41.09 3h1c s ASP 417 CO 0.37 -2.25 2.14 0.24 0.70 0.00 0.00 175.17 176.37 3h1c h MET 418 N -1.29 0.00 -0.70 2.11 2.86 -1.97 -2.18 114.93 113.76 3h1c h MET 418 Ca -0.49 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.08 3h1c h MET 418 Cb 1.29 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.92 3h1c h MET 418 CO 0.60 0.05 0.17 -0.44 1.06 0.00 0.00 176.91 178.35 3h1c h ASP 419 N 0.00 1.07 0.14 1.22 3.32 -2.01 -3.19 116.42 116.98 3h1c h ASP 419 Ca -0.00 -0.24 -0.36 0.00 0.02 0.00 0.00 57.03 56.45 3h1c h ASP 419 Cb 0.11 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 3h1c h ASP 419 CO 0.01 1.03 -2.07 1.17 -1.72 0.00 0.00 179.24 177.65 3h1c n LYS 420 N -4.24 0.72 -3.84 3.56 4.81 -1.16 -4.79 118.16 113.23 3h1c n LYS 420 Ca 0.05 0.23 -0.30 0.00 -0.87 0.00 0.00 58.31 57.42 3h1c n LYS 420 Cb 0.26 -1.68 -0.14 0.00 0.02 0.00 0.00 35.03 33.49 3h1c n LYS 420 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 3h1c s PHE 421 N -2.55 2.54 -1.04 5.64 5.36 -0.83 -5.03 117.98 122.07 3h1c s PHE 421 Ca -0.22 -2.43 -0.04 0.00 -0.96 0.00 0.00 56.93 53.27 3h1c s PHE 421 Cb 0.07 -2.24 0.14 0.00 -0.34 0.00 0.00 43.02 40.66 3h1c s PHE 421 CO 0.75 -0.86 2.39 -0.35 -1.46 0.00 0.00 175.22 175.68 3h1c n PRO 422 N 4.17 4.08 -4.03 10.12 -0.04 -1.20 -4.18 135.00 143.92 3h1c n PRO 422 Ca 0.03 -3.35 -0.15 0.00 -0.04 0.00 0.00 63.50 59.99 3h1c n PRO 422 Cb 0.39 -2.47 -0.15 0.00 -0.04 0.00 0.00 33.50 31.23 3h1c n PRO 422 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3h1c s TYR 423 N -1.87 0.31 -0.08 0.54 1.51 -1.26 -4.71 117.35 111.79 3h1c s TYR 423 Ca 0.53 -0.05 -0.30 0.00 -1.01 0.00 0.00 57.07 56.25 3h1c s TYR 423 Cb 0.25 -0.25 -0.02 0.00 -0.11 0.00 0.00 41.96 41.83 3h1c s TYR 423 CO -0.15 -0.03 1.02 0.95 -1.11 0.00 0.00 175.55 176.23 3h1c s THR 424 N 0.16 4.73 -0.16 -0.71 -4.23 -0.07 -4.88 115.64 110.49 3h1c s THR 424 Ca -0.01 1.99 -0.02 0.00 -1.18 0.00 0.00 61.69 62.47 3h1c s THR 424 Cb -0.04 -4.28 -0.02 0.00 1.34 0.00 0.00 72.50 69.50 3h1c s THR 424 CO -0.00 0.03 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.34 3h1c s VAL 425 N 1.86 3.40 -0.21 2.29 1.01 -1.07 -1.20 120.40 126.47 3h1c s VAL 425 Ca 0.50 -0.52 -0.03 0.00 0.00 0.00 0.00 61.98 61.93 3h1c s VAL 425 Cb -0.19 -2.48 -0.00 0.00 0.00 0.00 0.00 36.38 33.70 3h1c s VAL 425 CO 0.20 0.49 -0.07 -0.60 0.00 0.00 0.00 175.10 175.11 3h1c s ARG 426 N 0.66 3.29 -0.21 2.72 3.52 -0.60 -0.42 118.95 127.92 3h1c s ARG 426 Ca -0.04 -0.67 -0.04 0.00 -0.13 0.00 0.00 55.73 54.85 3h1c s ARG 426 Cb -0.15 -2.93 -0.01 0.00 -1.56 0.00 0.00 34.95 30.30 3h1c s ARG 426 CO 0.02 -0.20 -0.04 0.08 -0.81 0.00 0.00 175.30 174.35 3h1c s VAL 427 N 1.44 3.44 -0.16 7.11 1.01 0.70 -0.81 120.40 133.14 3h1c s VAL 427 Ca 0.06 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.56 3h1c s VAL 427 Cb -0.14 -2.56 -0.00 0.00 0.00 0.00 0.00 36.38 33.68 3h1c s VAL 427 CO -0.05 0.43 -0.15 -0.69 0.00 0.00 0.00 175.10 174.64 3h1c s VAL 428 N 1.32 2.74 -0.17 2.92 1.01 -0.30 -0.64 120.40 127.27 3h1c s VAL 428 Ca 0.04 -0.75 -0.05 0.00 0.00 0.00 0.00 61.98 61.22 3h1c s VAL 428 Cb -0.14 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 3h1c s VAL 428 CO -0.02 0.51 0.00 -0.55 0.00 0.00 0.00 175.10 175.05 3h1c s SER 429 N 0.80 5.05 -0.36 3.32 0.15 -0.44 -0.60 113.70 121.61 3h1c s SER 429 Ca -0.05 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.51 3h1c s SER 429 Cb -0.15 -1.85 0.10 0.00 -1.71 0.00 0.00 66.02 62.41 3h1c s SER 429 CO 0.00 0.14 0.10 -1.61 1.20 0.00 0.00 173.24 173.08 3h1c s GLU 430 N 0.53 1.88 -0.16 5.44 0.41 0.38 -2.35 118.70 124.83 3h1c s GLU 430 Ca -0.01 -1.74 -0.29 0.00 -0.41 0.00 0.00 54.97 52.52 3h1c s GLU 430 Cb -0.14 -3.35 -0.02 0.00 -1.78 0.00 0.00 34.13 28.84 3h1c s GLU 430 CO 0.02 -0.93 1.40 0.42 -0.49 0.00 0.00 175.26 175.67 3h1c s ILE 431 N 1.06 4.04 -0.20 -1.63 1.09 -1.16 0.86 121.20 125.26 3h1c s ILE 431 Ca 0.06 1.24 0.15 0.00 -1.10 0.00 0.00 60.65 61.00 3h1c s ILE 431 Cb -0.21 -3.85 -0.23 0.00 -1.06 0.00 0.00 42.46 37.11 3h1c s ILE 431 CO -0.05 -0.16 0.02 0.35 -0.10 0.00 0.00 174.94 174.99 3h1c n THR 432 N 5.57 1.35 -4.11 2.92 -2.24 -0.43 -4.51 114.28 112.84 3h1c n THR 432 Ca 0.15 -0.78 -0.15 0.00 -2.27 0.00 0.00 64.05 61.01 3h1c n THR 432 Cb 0.44 -0.64 -0.13 0.00 -2.10 0.00 0.00 70.33 67.90 3h1c n THR 432 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3h1c s GLU 433 N -2.47 0.43 -0.05 -0.78 2.02 -1.19 -4.06 118.70 112.60 3h1c s GLU 433 Ca -0.14 -0.35 -0.02 0.00 0.02 0.00 0.00 54.97 54.49 3h1c s GLU 433 Cb 0.06 -0.34 0.03 0.00 0.10 0.00 0.00 34.13 33.98 3h1c s GLU 433 CO 0.76 0.08 0.08 0.45 0.02 0.00 0.00 175.26 176.65 3h1c s SER 434 N -0.56 0.93 0.23 -0.19 0.15 -0.90 -2.51 113.70 110.87 3h1c s SER 434 Ca -0.02 0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.76 3h1c s SER 434 Cb -0.04 -0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.22 3h1c s SER 434 CO -0.00 -0.24 0.00 -3.20 1.20 0.00 0.00 173.24 171.00 3h1c n ASN 435 N 5.17 -0.55 0.00 5.45 5.15 -1.08 -4.65 115.26 124.75 3h1c n ASN 435 Ca -0.06 0.41 0.00 0.00 -0.60 0.00 0.00 54.58 54.32 3h1c n ASN 435 Cb 0.50 0.68 0.00 0.00 -0.53 0.00 0.00 39.78 40.43 3h1c n ASN 435 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h1c n GLY 436 N 1.10 -0.11 2.96 8.20 0.00 -1.26 0.34 105.19 116.41 3h1c n GLY 436 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 3h1c n GLY 436 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h1c s SER 437 N -1.06 1.77 -0.03 1.61 0.15 -1.26 -4.66 113.70 110.21 3h1c s SER 437 Ca 0.00 -0.27 0.09 0.00 0.70 0.00 0.00 55.95 56.48 3h1c s SER 437 Cb 0.00 -0.76 -0.14 0.00 -1.71 0.00 0.00 66.02 63.41 3h1c s SER 437 CO 0.00 -0.04 0.17 -1.54 1.20 0.00 0.00 173.24 173.04 3h1c n SER 438 N 4.25 2.82 -0.01 5.45 3.41 -1.26 -4.12 113.62 124.16 3h1c n SER 438 Ca -0.19 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.24 3h1c n SER 438 Cb 0.51 1.29 -0.09 0.00 -0.26 0.00 0.00 64.21 65.66 3h1c n SER 438 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3h1c h SER 439 N 0.00 0.77 1.36 4.04 0.02 -1.94 -2.52 113.55 115.27 3h1c h SER 439 Ca -0.05 -0.67 -0.03 0.00 -0.84 0.00 0.00 61.79 60.20 3h1c h SER 439 Cb 0.66 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.97 3h1c h SER 439 CO 0.00 1.32 -0.13 0.24 -1.14 0.00 0.00 176.83 177.12 3h1c h MET 440 N 0.27 0.00 0.00 3.45 2.86 -1.90 -2.66 114.93 116.96 3h1c h MET 440 Ca -0.06 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.47 3h1c h MET 440 Cb 1.35 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.99 3h1c h MET 440 CO 0.14 0.13 -0.50 0.00 1.06 0.00 0.00 176.91 177.74 3h1c h ALA 441 N 1.87 1.09 0.00 6.32 0.00 -1.69 -2.52 119.26 124.33 3h1c h ALA 441 Ca -0.00 -0.46 -0.16 0.00 0.00 0.00 0.00 54.91 54.29 3h1c h ALA 441 Cb 0.84 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3h1c h ALA 441 CO 0.02 0.63 -0.75 0.77 0.00 0.00 0.00 179.25 179.91 3h1c h SER 442 N 0.00 0.00 -0.27 0.00 0.02 -1.11 -1.88 113.55 110.31 3h1c h SER 442 Ca -0.01 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 3h1c h SER 442 Cb 0.93 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 3h1c h SER 442 CO 0.07 0.75 -0.13 0.58 -1.14 0.00 0.00 176.83 176.96 3h1c h VAL 443 N 0.00 1.30 -0.54 2.27 2.07 -1.30 -0.67 116.25 119.37 3h1c h VAL 443 Ca -0.01 -1.21 -0.11 0.00 0.82 0.00 0.00 66.70 66.19 3h1c h VAL 443 Cb 1.34 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 32.61 3h1c h VAL 443 CO 0.10 0.38 -0.09 0.00 0.02 0.00 0.00 177.57 177.98 3h1c h GLY 445 N 0.96 0.00 0.81 0.00 0.00 -1.29 -3.19 103.07 100.35 3h1c h GLY 445 Ca 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.41 3h1c h GLY 445 CO 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 176.54 176.46 3h1c h ALA 446 N 1.55 0.29 -0.28 3.60 0.00 -1.06 -2.05 119.26 121.31 3h1c h ALA 446 Ca -0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 3h1c h ALA 446 Cb 0.93 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3h1c h ALA 446 CO 0.06 0.14 0.01 1.03 0.00 0.00 0.00 179.25 180.49 3h1c h SER 447 N 0.13 0.39 0.91 0.00 0.87 -1.58 0.13 113.55 114.39 3h1c h SER 447 Ca 0.04 -0.06 -0.18 0.00 -1.23 0.00 0.00 61.79 60.36 3h1c h SER 447 Cb 0.62 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.46 3h1c h SER 447 CO 0.03 0.45 -0.84 -0.07 -0.53 0.00 0.00 176.83 175.87 3h1c h LEU 448 N 0.41 0.00 0.16 2.23 3.38 -1.54 -3.14 115.31 116.81 3h1c h LEU 448 Ca 0.09 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.77 3h1c h LEU 448 Cb 0.26 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.03 3h1c h LEU 448 CO 0.01 0.84 -1.32 0.00 0.09 0.00 0.00 178.44 178.06 3h1c h ALA 449 N 1.16 0.04 -0.39 1.53 0.00 -0.83 -3.06 119.26 117.71 3h1c h ALA 449 Ca -0.01 -0.89 -0.08 0.00 0.00 0.00 0.00 54.91 53.93 3h1c h ALA 449 Cb 1.53 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 3h1c h ALA 449 CO 0.11 0.91 -0.08 -0.07 0.00 0.00 0.00 179.25 180.13 3h1c h LEU 450 N 0.09 0.74 -0.93 0.00 3.38 -1.08 -1.82 115.31 115.69 3h1c h LEU 450 Ca -0.17 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.40 3h1c h LEU 450 Cb 2.03 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.57 3h1c h LEU 450 CO 0.22 0.92 -0.22 0.24 0.09 0.00 0.00 178.44 179.69 3h1c h MET 451 N 0.54 0.00 -0.01 1.13 2.86 -1.68 -0.37 114.93 117.41 3h1c h MET 451 Ca 0.10 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.56 3h1c h MET 451 Cb 0.59 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 3h1c h MET 451 CO 0.03 0.22 -0.80 0.22 1.06 0.00 0.00 176.91 177.64 3h1c h ASP 452 N 0.00 0.24 0.38 1.22 3.58 -1.41 -3.28 116.42 117.14 3h1c h ASP 452 Ca -0.00 -0.18 -0.20 0.00 0.42 0.00 0.00 57.03 57.08 3h1c h ASP 452 Cb 0.82 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 41.79 3h1c h ASP 452 CO 0.03 0.94 -0.82 0.00 -2.88 0.00 0.00 179.24 176.50 3h1c h ALA 453 N 1.05 0.53 0.00 -0.78 0.00 -0.91 -3.41 119.26 115.74 3h1c h ALA 453 Ca -0.03 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.21 3h1c h ALA 453 Cb 1.39 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3h1c h ALA 453 CO 0.12 0.82 0.00 0.41 0.00 0.00 0.00 179.25 180.60 3h1c n GLY 454 N 0.74 1.35 3.66 0.00 0.00 -0.74 -4.79 105.19 105.41 3h1c n GLY 454 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 3h1c n GLY 454 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h1c s VAL 455 N -2.00 4.23 -1.24 1.61 1.01 -0.22 -4.95 120.40 118.84 3h1c s VAL 455 Ca 0.00 1.49 -0.16 0.00 0.00 0.00 0.00 61.98 63.31 3h1c s VAL 455 Cb 0.00 -3.97 0.13 0.00 0.00 0.00 0.00 36.38 32.54 3h1c s VAL 455 CO 0.00 -0.14 1.54 -2.16 0.00 0.00 0.00 175.10 174.34 3h1c s PRO 456 N 3.56 4.04 0.65 2.72 0.04 -1.26 -4.20 135.00 140.55 3h1c s PRO 456 Ca 0.56 -2.34 -0.12 0.00 0.04 0.00 0.00 61.00 59.14 3h1c s PRO 456 Cb -0.22 -5.24 -0.02 0.00 0.04 0.00 0.00 34.50 29.06 3h1c s PRO 456 CO 0.16 -1.96 1.05 0.96 0.04 0.00 0.00 177.00 177.25 3h1c s ILE 457 N 2.62 4.21 0.06 0.56 -4.36 -1.26 -4.48 121.20 118.54 3h1c s ILE 457 Ca 0.47 0.78 -0.27 0.00 -0.26 0.00 0.00 60.65 61.37 3h1c s ILE 457 Cb -0.00 -3.54 -0.17 0.00 1.25 0.00 0.00 42.46 40.00 3h1c s ILE 457 CO 0.03 -0.87 1.57 0.11 0.24 0.00 0.00 174.94 176.01 3h1c h LYS 458 N -0.34 -0.37 -3.61 0.37 1.57 -1.91 -3.47 116.57 108.80 3h1c h LYS 458 Ca -0.44 0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.30 3h1c h LYS 458 Cb 1.20 0.08 -0.08 0.00 0.08 0.00 0.00 32.23 33.51 3h1c h LYS 458 CO 0.58 -0.18 -0.09 0.00 -0.57 0.00 0.00 179.45 179.20 3h1c s ALA 459 N -5.73 -0.27 0.43 3.86 0.00 -1.26 -5.16 121.76 113.64 3h1c s ALA 459 Ca -0.15 -0.87 -0.24 0.00 0.00 0.00 0.00 51.96 50.70 3h1c s ALA 459 Cb 0.04 1.05 -0.08 0.00 0.00 0.00 0.00 23.12 24.13 3h1c s ALA 459 CO 0.62 -0.87 1.18 0.00 0.00 0.00 0.00 175.76 176.70 3h1c s ALA 460 N -3.92 3.06 -0.06 0.00 0.00 -1.26 -5.03 121.76 114.56 3h1c s ALA 460 Ca 0.22 0.98 0.01 0.00 0.00 0.00 0.00 51.96 53.18 3h1c s ALA 460 Cb -0.01 -3.40 0.02 0.00 0.00 0.00 0.00 23.12 19.73 3h1c s ALA 460 CO 0.10 -0.64 -0.09 0.54 0.00 0.00 0.00 175.76 175.67 3h1c s VAL 461 N -1.46 0.88 0.20 0.00 0.11 -1.26 -4.40 120.40 114.47 3h1c s VAL 461 Ca 0.61 -0.31 0.05 0.00 -2.93 0.00 0.00 61.98 59.39 3h1c s VAL 461 Cb -0.31 -0.85 -0.05 0.00 -1.53 0.00 0.00 36.38 33.64 3h1c s VAL 461 CO 0.38 0.31 -0.06 0.00 -3.33 0.00 0.00 175.10 172.39 3h1c s ALA 462 N 0.92 1.76 0.03 1.54 0.00 -0.81 -4.12 121.76 121.08 3h1c s ALA 462 Ca -0.10 -1.66 -0.03 0.00 0.00 0.00 0.00 51.96 50.16 3h1c s ALA 462 Cb -0.15 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.18 3h1c s ALA 462 CO 0.01 -0.13 0.03 0.20 0.00 0.00 0.00 175.76 175.86 3h1c s GLY 463 N -3.27 0.23 0.25 0.00 0.00 -1.26 -1.49 107.32 101.78 3h1c s GLY 463 Ca 0.23 -0.62 0.01 0.00 0.00 0.00 0.00 44.72 44.35 3h1c s GLY 463 CO 0.06 -0.72 0.09 -1.50 0.00 0.00 0.00 173.10 171.02 3h1c s ILE 464 N -2.17 0.59 0.03 0.90 2.07 -0.61 -4.75 121.20 117.26 3h1c s ILE 464 Ca -0.09 -2.00 0.08 0.00 -1.41 0.00 0.00 60.65 57.23 3h1c s ILE 464 Cb -0.04 -2.59 -0.03 0.00 0.13 0.00 0.00 42.46 39.93 3h1c s ILE 464 CO -0.03 -0.05 -0.22 0.00 -1.91 0.00 0.00 174.94 172.73 3h1c s ALA 465 N -3.73 2.41 -0.01 1.50 0.00 -1.26 -2.74 121.76 117.93 3h1c s ALA 465 Ca 0.37 -1.21 0.03 0.00 0.00 0.00 0.00 51.96 51.15 3h1c s ALA 465 Cb 0.08 -0.62 -0.01 0.00 0.00 0.00 0.00 23.12 22.57 3h1c s ALA 465 CO 0.13 0.55 -0.10 -1.64 0.00 0.00 0.00 175.76 174.69 3h1c s MET 466 N -1.25 0.91 0.24 0.00 -1.94 0.21 -1.03 119.30 116.45 3h1c s MET 466 Ca 0.13 -0.37 0.05 0.00 -1.71 0.00 0.00 55.69 53.79 3h1c s MET 466 Cb -0.10 -0.87 -0.05 0.00 2.01 0.00 0.00 34.83 35.82 3h1c s MET 466 CO 0.03 0.20 -0.05 0.20 -0.01 0.00 0.00 175.02 175.39 3h1c s GLY 467 N -0.13 1.61 0.01 -0.03 0.00 -0.74 -0.92 107.32 107.13 3h1c s GLY 467 Ca 0.02 -1.79 0.02 0.00 0.00 0.00 0.00 44.72 42.97 3h1c s GLY 467 CO -0.00 -1.74 -0.06 -2.27 0.00 0.00 0.00 173.10 169.03 3h1c s LEU 468 N -3.35 2.09 -0.23 0.66 2.96 -1.26 -0.60 118.68 118.94 3h1c s LEU 468 Ca 0.27 -0.24 0.02 0.00 -0.22 0.00 0.00 54.13 53.97 3h1c s LEU 468 Cb 0.04 -0.21 0.04 0.00 0.50 0.00 0.00 46.19 46.56 3h1c s LEU 468 CO 0.09 -0.03 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.27 3h1c s VAL 469 N -0.53 2.21 -0.06 1.68 1.01 -0.71 -2.67 120.40 121.34 3h1c s VAL 469 Ca -0.02 -1.36 0.02 0.00 0.00 0.00 0.00 61.98 60.62 3h1c s VAL 469 Cb -0.04 -2.17 0.01 0.00 0.00 0.00 0.00 36.38 34.17 3h1c s VAL 469 CO -0.00 0.17 -0.12 -0.75 0.00 0.00 0.00 175.10 174.40 3h1c s LYS 470 N 1.18 1.54 0.04 2.72 2.20 -1.26 -2.28 119.74 123.88 3h1c s LYS 470 Ca -0.04 -0.39 -0.04 0.00 -0.36 0.00 0.00 55.97 55.15 3h1c s LYS 470 Cb -0.17 -1.30 -0.01 0.00 -1.51 0.00 0.00 37.83 34.83 3h1c s LYS 470 CO -0.07 0.05 -0.07 -1.91 -0.36 0.00 0.00 175.35 172.98 3h1c n GLU 471 N 3.71 0.10 0.00 4.03 4.07 -1.26 -5.07 120.64 126.23 3h1c n GLU 471 Ca -0.22 0.04 0.00 0.00 -0.06 0.00 0.00 57.16 56.92 3h1c n GLU 471 Cb 0.52 -0.68 0.00 0.00 -0.06 0.00 0.00 31.44 31.22 3h1c n GLU 471 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3h1c n GLY 472 N 3.09 0.45 0.03 8.31 0.00 -1.26 -5.02 105.19 110.79 3h1c n GLY 472 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 3h1c n GLY 472 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3h1c n ASP 473 N 0.00 3.27 -4.82 1.61 5.75 -1.26 -5.04 116.55 116.06 3h1c n ASP 473 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 54.79 54.47 3h1c n ASP 473 Cb 0.00 0.68 0.03 0.00 -1.03 0.00 0.00 41.12 40.80 3h1c n ASP 473 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3h1c s ASN 474 N -3.86 5.60 0.07 -1.12 2.20 -1.26 -5.08 114.94 111.49 3h1c s ASN 474 Ca -0.03 1.64 -0.11 0.00 -0.94 0.00 0.00 52.86 53.42 3h1c s ASN 474 Cb 0.02 -2.50 0.01 0.00 -2.00 0.00 0.00 41.25 36.78 3h1c s ASN 474 CO 0.29 -1.30 0.25 -0.72 -2.94 0.00 0.00 177.10 172.68 3h1c s TYR 475 N -2.91 0.03 -0.08 1.54 1.13 -1.26 -4.04 117.35 111.76 3h1c s TYR 475 Ca 0.59 -0.34 0.00 0.00 -1.41 0.00 0.00 57.07 55.92 3h1c s TYR 475 Cb -0.14 0.02 0.02 0.00 -1.10 0.00 0.00 41.96 40.77 3h1c s TYR 475 CO 0.50 -0.53 -0.06 0.08 -2.51 0.00 0.00 175.55 173.02 3h1c s VAL 476 N -3.31 0.81 -0.12 -3.49 1.01 -0.97 -5.01 120.40 109.33 3h1c s VAL 476 Ca 0.01 -0.21 -0.15 0.00 0.00 0.00 0.00 61.98 61.63 3h1c s VAL 476 Cb 0.02 -0.84 -0.05 0.00 0.00 0.00 0.00 36.38 35.51 3h1c s VAL 476 CO -0.08 0.31 0.35 -0.69 0.00 0.00 0.00 175.10 174.99 3h1c s VAL 477 N 1.41 5.23 -0.07 2.92 1.01 -1.26 -1.74 120.40 127.90 3h1c s VAL 477 Ca -0.02 0.68 0.03 0.00 0.00 0.00 0.00 61.98 62.67 3h1c s VAL 477 Cb -0.13 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 3h1c s VAL 477 CO -0.04 0.43 -0.16 -0.76 0.00 0.00 0.00 175.10 174.57 3h1c s LEU 478 N 0.09 2.60 -0.15 3.92 1.02 0.23 -4.63 118.68 121.77 3h1c s LEU 478 Ca 0.20 -0.29 -0.09 0.00 0.02 0.00 0.00 54.13 53.96 3h1c s LEU 478 Cb -0.14 -1.54 -0.05 0.00 0.02 0.00 0.00 46.19 44.49 3h1c s LEU 478 CO 0.07 0.27 0.16 -0.44 0.02 0.00 0.00 176.35 176.44 3h1c s SER 479 N -0.30 6.34 -0.75 2.29 0.01 -0.68 -1.79 113.70 118.82 3h1c s SER 479 Ca 0.02 0.39 -0.03 0.00 1.31 0.00 0.00 55.95 57.65 3h1c s SER 479 Cb -0.13 -2.10 0.00 0.00 0.21 0.00 0.00 66.02 64.01 3h1c s SER 479 CO 0.03 0.29 0.65 -0.67 0.41 0.00 0.00 173.24 173.94 3h1c n ASP 480 N 2.75 -6.34 -4.79 2.44 2.03 -0.20 -4.68 116.55 107.76 3h1c n ASP 480 Ca -0.17 -0.46 -0.34 0.00 0.52 0.00 0.00 54.79 54.33 3h1c n ASP 480 Cb 0.53 -3.46 -0.01 0.00 -0.72 0.00 0.00 41.12 37.46 3h1c n ASP 480 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 3h1c s ILE 481 N -2.90 3.52 0.45 5.18 -4.36 -1.25 -4.82 121.20 117.01 3h1c s ILE 481 Ca 0.03 0.91 -0.05 0.00 -0.26 0.00 0.00 60.65 61.28 3h1c s ILE 481 Cb -0.01 -3.36 0.10 0.00 1.25 0.00 0.00 42.46 40.44 3h1c s ILE 481 CO 0.82 -0.24 0.61 0.18 0.24 0.00 0.00 174.94 176.56 3h1c n LEU 482 N -1.28 0.00 0.12 0.37 7.99 -1.26 -4.27 117.00 118.66 3h1c n LEU 482 Ca 0.10 -0.91 -0.02 0.00 -0.01 0.00 0.00 56.01 55.17 3h1c n LEU 482 Cb 0.52 -0.44 0.20 0.00 -0.11 0.00 0.00 43.42 43.59 3h1c n LEU 482 CO 0.42 -0.88 0.56 1.23 -1.51 0.00 0.00 177.39 177.21 3h1c h GLY 483 N -0.64 0.12 2.00 -0.72 0.00 -0.39 -2.80 103.07 100.65 3h1c h GLY 483 Ca -0.20 -0.13 -0.17 0.00 0.00 0.00 0.00 47.33 46.83 3h1c h GLY 483 CO 0.17 0.12 -0.80 -0.55 0.00 0.00 0.00 176.54 175.48 3h1c h ASP 484 N 0.09 0.00 0.94 0.19 3.32 -1.95 -2.99 116.42 116.02 3h1c h ASP 484 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h1c h ASP 484 Cb 0.96 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.51 3h1c h ASP 484 CO 0.07 0.80 -0.18 -0.62 -1.72 0.00 0.00 179.24 177.60 3h1c n GLU 485 N -3.55 0.07 -0.06 3.56 1.02 -1.17 -2.53 120.64 117.98 3h1c n GLU 485 Ca -0.00 0.04 -0.22 0.00 -0.02 0.00 0.00 57.16 56.96 3h1c n GLU 485 Cb 0.78 -1.56 -0.13 0.00 -0.02 0.00 0.00 31.44 30.51 3h1c n GLU 485 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3h1c n ASP 486 N -1.67 2.03 0.05 1.62 2.03 -1.07 -2.90 116.55 116.64 3h1c n ASP 486 Ca 0.06 0.19 -0.13 0.00 0.52 0.00 0.00 54.79 55.43 3h1c n ASP 486 Cb 0.36 -0.78 -0.03 0.00 -0.72 0.00 0.00 41.12 39.95 3h1c n ASP 486 CO 0.00 0.00 0.00 0.45 -1.92 0.00 0.00 177.20 175.73 3h1c h HIS 487 N -0.25 0.65 -0.03 -0.67 3.86 -1.64 -3.26 115.15 113.82 3h1c h HIS 487 Ca -0.47 -0.32 0.00 0.00 -1.16 0.00 0.00 60.37 58.42 3h1c h HIS 487 Cb 1.83 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 30.21 3h1c h HIS 487 CO 0.06 1.13 -0.02 1.28 0.86 0.00 0.00 177.93 181.23 3h1c n LEU 488 N -3.79 2.68 0.00 2.43 4.77 -1.05 -4.91 117.00 117.12 3h1c n LEU 488 Ca -0.06 -0.89 0.00 0.00 -0.03 0.00 0.00 56.01 55.02 3h1c n LEU 488 Cb 0.79 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.88 3h1c n LEU 488 CO 0.50 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 3h1c n GLY 489 N 1.32 1.05 0.07 -0.72 0.00 -1.14 -4.83 105.19 100.94 3h1c n GLY 489 Ca 0.15 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.07 3h1c n GLY 489 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h1c n ASP 490 N 0.00 0.82 -4.19 1.61 8.00 -1.09 -5.01 116.55 116.70 3h1c n ASP 490 Ca 0.00 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.39 3h1c n ASP 490 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 3h1c n ASP 490 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h1c s MET 491 N -1.24 0.92 -0.59 -1.24 0.23 -1.26 -0.28 119.30 115.82 3h1c s MET 491 Ca 0.00 -1.40 0.06 0.00 -1.03 0.00 0.00 55.69 53.32 3h1c s MET 491 Cb 0.00 -0.17 0.25 0.00 -1.53 0.00 0.00 34.83 33.38 3h1c s MET 491 CO 0.00 -0.07 0.72 -3.47 -2.03 0.00 0.00 175.02 170.16 3h1c n ASP 492 N -0.10 3.17 -4.64 -1.18 2.03 0.40 -4.42 116.55 111.80 3h1c n ASP 492 Ca -0.10 -3.33 -0.43 0.00 0.52 0.00 0.00 54.79 51.46 3h1c n ASP 492 Cb 0.62 -0.66 -0.02 0.00 -0.72 0.00 0.00 41.12 40.33 3h1c n ASP 492 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 3h1c s PHE 493 N -2.29 2.86 -0.11 -0.67 5.36 -0.09 -3.49 117.98 119.54 3h1c s PHE 493 Ca 0.39 1.01 0.02 0.00 -0.96 0.00 0.00 56.93 57.39 3h1c s PHE 493 Cb 0.16 -3.68 0.01 0.00 -0.34 0.00 0.00 43.02 39.17 3h1c s PHE 493 CO -0.03 -1.48 -0.16 0.15 -1.46 0.00 0.00 175.22 172.24 3h1c s LYS 494 N 3.78 2.28 -0.06 10.12 1.02 0.94 0.68 119.74 138.51 3h1c s LYS 494 Ca 0.53 -0.58 0.02 0.00 0.02 0.00 0.00 55.97 55.96 3h1c s LYS 494 Cb -0.18 -1.95 0.01 0.00 -0.52 0.00 0.00 37.83 35.20 3h1c s LYS 494 CO 0.18 -0.08 -0.11 0.08 -0.92 0.00 0.00 175.35 174.50 3h1c s VAL 495 N 1.02 1.04 -0.03 3.17 1.01 -1.11 -0.29 120.40 125.22 3h1c s VAL 495 Ca -0.05 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.51 3h1c s VAL 495 Cb -0.15 -0.95 0.01 0.00 0.00 0.00 0.00 36.38 35.29 3h1c s VAL 495 CO -0.02 0.33 -0.06 0.00 0.00 0.00 0.00 175.10 175.34 3h1c s ALA 496 N 0.62 0.71 0.01 5.51 0.00 0.11 -1.57 121.76 127.14 3h1c s ALA 496 Ca -0.13 -0.19 -0.13 0.00 0.00 0.00 0.00 51.96 51.52 3h1c s ALA 496 Cb -0.15 -0.33 0.04 0.00 0.00 0.00 0.00 23.12 22.69 3h1c s ALA 496 CO 0.03 0.07 0.58 0.41 0.00 0.00 0.00 175.76 176.85 3h1c n GLY 497 N 3.56 0.53 0.00 0.00 0.00 -0.56 -0.36 105.19 108.37 3h1c n GLY 497 Ca -0.21 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 44.86 3h1c n GLY 497 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3h1c n SER 498 N -0.64 0.00 0.17 1.61 2.88 0.10 -1.92 113.62 115.81 3h1c n SER 498 Ca 0.02 -0.60 0.01 0.00 -1.33 0.00 0.00 58.87 56.96 3h1c n SER 498 Cb 0.27 0.00 0.30 0.00 -0.75 0.00 0.00 64.21 64.03 3h1c n SER 498 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3h1c h ARG 499 N 0.00 0.01 0.03 -1.46 3.08 -1.97 -3.34 114.38 110.73 3h1c h ARG 499 Ca 0.00 -0.00 -0.39 0.00 0.07 0.00 0.00 59.98 59.66 3h1c h ARG 499 Cb 0.00 -0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 3h1c h ARG 499 CO 0.00 0.45 -2.38 -0.25 -1.07 0.00 0.00 179.97 176.72 3h1c n ASP 500 N -4.02 2.01 -3.48 7.04 8.00 -1.26 -5.07 116.55 119.78 3h1c n ASP 500 Ca -0.02 -0.06 -0.22 0.00 0.71 0.00 0.00 54.79 55.21 3h1c n ASP 500 Cb 0.46 -0.51 -0.08 0.00 -0.02 0.00 0.00 41.12 40.97 3h1c n ASP 500 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h1c n GLY 501 N 2.19 2.96 3.41 0.44 0.00 -1.25 -4.54 105.19 108.39 3h1c n GLY 501 Ca -0.43 -1.96 -0.34 0.00 0.00 0.00 0.00 46.02 43.29 3h1c n GLY 501 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h1c s ILE 502 N -3.33 3.55 -0.15 -0.61 1.01 -0.31 -0.73 121.20 120.64 3h1c s ILE 502 Ca 0.36 -0.46 -0.18 0.00 0.00 0.00 0.00 60.65 60.36 3h1c s ILE 502 Cb 0.02 -2.56 -0.24 0.00 0.01 0.00 0.00 42.46 39.68 3h1c s ILE 502 CO 0.25 0.47 0.44 0.77 0.00 0.00 0.00 174.94 176.87 3h1c h SER 503 N 7.21 0.21 -4.38 3.58 4.64 -0.89 -3.35 113.55 120.57 3h1c h SER 503 Ca -0.33 -0.76 -0.20 0.00 -0.47 0.00 0.00 61.79 60.03 3h1c h SER 503 Cb 1.19 -0.07 -0.24 0.00 -0.31 0.00 0.00 62.40 62.97 3h1c h SER 503 CO 0.60 1.53 -0.69 0.00 -0.87 0.00 0.00 176.83 177.40 3h1c s ALA 504 N -2.42 0.02 -0.04 5.18 0.00 0.10 -0.90 121.76 123.71 3h1c s ALA 504 Ca -0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 51.96 51.45 3h1c s ALA 504 Cb 0.04 0.06 0.03 0.00 0.00 0.00 0.00 23.12 23.26 3h1c s ALA 504 CO 0.70 -0.09 0.07 -1.17 0.00 0.00 0.00 175.76 175.27 3h1c s LEU 505 N -0.75 0.40 -0.07 0.00 0.20 -1.03 -0.71 118.68 116.71 3h1c s LEU 505 Ca -0.08 0.11 0.05 0.00 0.69 0.00 0.00 54.13 54.90 3h1c s LEU 505 Cb -0.05 -0.04 -0.01 0.00 -0.43 0.00 0.00 46.19 45.66 3h1c s LEU 505 CO -0.00 -0.21 -0.22 -1.58 -0.29 0.00 0.00 176.35 174.04 3h1c s GLN 506 N 1.84 2.48 -0.09 1.98 0.74 0.61 -1.88 119.66 125.34 3h1c s GLN 506 Ca 0.00 -0.81 0.02 0.00 0.05 0.00 0.00 55.36 54.62 3h1c s GLN 506 Cb -0.12 -2.03 0.02 0.00 1.10 0.00 0.00 33.01 31.97 3h1c s GLN 506 CO -0.03 0.28 -0.12 1.41 -0.55 0.00 0.00 175.29 176.27 3h1c s MET 507 N 0.06 1.83 -0.30 1.67 -2.45 0.15 -0.04 119.30 120.21 3h1c s MET 507 Ca -0.08 -0.43 -0.02 0.00 -1.25 0.00 0.00 55.69 53.90 3h1c s MET 507 Cb -0.15 -1.58 0.10 0.00 1.25 0.00 0.00 34.83 34.46 3h1c s MET 507 CO 0.05 -0.05 0.11 -0.51 1.05 0.00 0.00 175.02 175.67 3h1c s ASP 508 N 0.93 3.77 -0.09 1.11 1.01 -1.23 -1.98 116.67 120.19 3h1c s ASP 508 Ca -0.09 -1.45 -0.03 0.00 0.71 0.00 0.00 52.55 51.69 3h1c s ASP 508 Cb -0.15 -0.62 -0.03 0.00 1.01 0.00 0.00 42.92 43.13 3h1c s ASP 508 CO 0.00 -0.42 0.03 -0.63 0.21 0.00 0.00 175.17 174.36 3h1c s ILE 509 N 1.85 4.56 -0.12 0.77 1.01 -0.95 -0.46 121.20 127.86 3h1c s ILE 509 Ca 0.09 -0.17 0.21 0.00 0.00 0.00 0.00 60.65 60.79 3h1c s ILE 509 Cb -0.17 -2.94 -0.21 0.00 0.01 0.00 0.00 42.46 39.16 3h1c s ILE 509 CO -0.30 0.60 0.63 2.29 0.00 0.00 0.00 174.94 178.15 3h1c n LYS 510 N 2.07 0.64 -4.22 2.79 -0.00 0.61 -4.86 118.16 115.20 3h1c n LYS 510 Ca -0.19 -0.03 -0.31 0.00 -0.00 0.00 0.00 58.31 57.78 3h1c n LYS 510 Cb 0.54 -1.64 -0.09 0.00 -0.00 0.00 0.00 35.03 33.84 3h1c n LYS 510 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 3h1c s ILE 511 N -3.27 3.96 -0.22 0.58 -4.36 -1.25 -4.81 121.20 111.83 3h1c s ILE 511 Ca -0.06 -0.88 -0.10 0.00 -0.26 0.00 0.00 60.65 59.35 3h1c s ILE 511 Cb 0.11 -2.83 -0.05 0.00 1.25 0.00 0.00 42.46 40.94 3h1c s ILE 511 CO 0.86 0.22 0.14 -1.83 0.24 0.00 0.00 174.94 174.57 3h1c s GLU 512 N -1.99 4.11 0.00 0.37 -1.05 -1.26 -4.66 118.70 114.22 3h1c s GLU 512 Ca 0.23 -0.25 0.00 0.00 -0.15 0.00 0.00 54.97 54.79 3h1c s GLU 512 Cb -0.12 -3.47 0.00 0.00 -0.44 0.00 0.00 34.13 30.11 3h1c s GLU 512 CO 0.15 0.17 0.00 0.41 0.95 0.00 0.00 175.26 176.94 3h1c n GLY 513 N 3.92 0.52 3.70 -3.83 0.00 -1.26 -5.04 105.19 103.20 3h1c n GLY 513 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 3h1c n GLY 513 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3h1c s ILE 514 N -0.63 4.31 0.48 -0.61 2.07 -1.26 -5.05 121.20 120.51 3h1c s ILE 514 Ca 0.00 1.65 0.01 0.00 -1.41 0.00 0.00 60.65 60.90 3h1c s ILE 514 Cb 0.00 -4.06 0.01 0.00 0.13 0.00 0.00 42.46 38.54 3h1c s ILE 514 CO 0.00 0.07 0.70 -0.89 -1.91 0.00 0.00 174.94 172.91 3h1c s THR 515 N 1.53 3.50 0.03 4.00 2.01 -1.26 -4.64 115.64 120.81 3h1c s THR 515 Ca 0.56 -0.59 0.32 0.00 0.31 0.00 0.00 61.69 62.28 3h1c s THR 515 Cb -0.25 -3.29 0.38 0.00 0.01 0.00 0.00 72.50 69.35 3h1c s THR 515 CO 0.26 -0.20 1.93 0.50 -0.69 0.00 0.00 174.62 176.42 3h1c h LYS 516 N 0.31 0.00 0.11 4.92 3.64 -1.99 -3.02 116.57 120.55 3h1c h LYS 516 Ca -0.44 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.93 3h1c h LYS 516 Cb 1.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 3h1c h LYS 516 CO 0.55 0.01 -0.06 0.93 -2.27 0.00 0.00 179.45 178.61 3h1c h GLU 517 N 0.00 -0.15 0.00 1.90 4.39 -2.00 -2.97 114.58 115.75 3h1c h GLU 517 Ca -0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3h1c h GLU 517 Cb 0.58 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 3h1c h GLU 517 CO 0.00 0.18 0.00 -0.84 -1.16 0.00 0.00 179.01 177.19 3h1c h ILE 518 N -0.49 0.00 0.00 3.13 3.07 -1.97 -2.12 117.51 119.13 3h1c h ILE 518 Ca -0.02 -0.33 -0.07 0.00 1.55 0.00 0.00 64.86 66.00 3h1c h ILE 518 Cb 0.40 1.14 -0.01 0.00 -0.27 0.00 0.00 36.82 38.08 3h1c h ILE 518 CO 0.03 0.00 -0.32 -0.03 -1.05 0.00 0.00 178.15 176.77 3h1c h MET 519 N 0.00 0.00 0.05 0.16 4.05 -1.44 -3.14 114.93 114.61 3h1c h MET 519 Ca 0.00 0.00 -0.37 0.00 -0.28 0.00 0.00 59.70 59.05 3h1c h MET 519 Cb 0.47 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.23 3h1c h MET 519 CO 0.00 0.32 -2.15 0.94 0.23 0.00 0.00 176.91 176.25 3h1c n GLN 520 N -3.41 0.68 -0.23 0.39 7.27 -0.85 -3.79 117.38 117.43 3h1c n GLN 520 Ca 0.00 0.26 -0.07 0.00 0.07 0.00 0.00 57.00 57.26 3h1c n GLN 520 Cb 0.51 -1.62 0.06 0.00 2.41 0.00 0.00 30.24 31.60 3h1c n GLN 520 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 3h1c h VAL 521 N -0.20 1.26 0.00 1.69 2.07 -1.56 0.12 116.25 119.64 3h1c h VAL 521 Ca -0.50 -1.01 -0.07 0.00 0.82 0.00 0.00 66.70 65.93 3h1c h VAL 521 Cb 1.86 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 32.23 3h1c h VAL 521 CO -0.07 0.38 -0.34 0.00 0.02 0.00 0.00 177.57 177.56 3h1c h ALA 522 N 1.10 1.01 0.12 1.67 0.00 -1.76 -2.42 119.26 118.97 3h1c h ALA 522 Ca 0.21 -0.31 -0.33 0.00 0.00 0.00 0.00 54.91 54.48 3h1c h ALA 522 Cb 0.42 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3h1c h ALA 522 CO 0.01 0.43 -1.73 1.25 0.00 0.00 0.00 179.25 179.20 3h1c h LEU 523 N 0.00 0.38 -0.52 0.00 5.85 -1.55 -3.09 115.31 116.38 3h1c h LEU 523 Ca -0.00 -0.65 -0.16 0.00 0.84 0.00 0.00 57.88 57.90 3h1c h LEU 523 Cb 0.85 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 3h1c h LEU 523 CO 0.04 1.56 -0.73 -1.13 -0.34 0.00 0.00 178.44 177.85 3h1c h ASN 524 N 0.07 0.13 1.22 1.25 -1.24 -0.81 -2.97 115.58 113.23 3h1c h ASN 524 Ca -0.32 -0.09 -0.06 0.00 0.71 0.00 0.00 56.30 56.53 3h1c h ASN 524 Cb 2.04 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 41.04 3h1c h ASN 524 CO 0.13 0.81 -0.31 -0.61 -1.29 0.00 0.00 177.43 176.17 3h1c h GLN 525 N 0.07 0.00 -0.26 6.67 4.15 -1.58 -3.14 115.11 121.03 3h1c h GLN 525 Ca -0.02 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.29 3h1c h GLN 525 Cb 1.29 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.96 3h1c h GLN 525 CO 0.10 0.31 -0.31 0.00 -1.93 0.00 0.00 178.83 177.00 3h1c h ALA 526 N 1.69 0.99 -0.60 3.38 0.00 -1.43 -2.90 119.26 120.39 3h1c h ALA 526 Ca -0.00 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 3h1c h ALA 526 Cb 1.00 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 3h1c h ALA 526 CO 0.04 0.60 0.32 -0.22 0.00 0.00 0.00 179.25 179.99 3h1c h LYS 527 N 0.46 0.85 -0.31 0.00 3.64 -1.49 0.95 116.57 120.66 3h1c h LYS 527 Ca 0.06 -0.11 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 3h1c h LYS 527 Cb 0.77 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 3h1c h LYS 527 CO 0.06 0.66 -0.24 0.78 -2.27 0.00 0.00 179.45 178.44 3h1c h GLY 528 N 0.82 0.66 2.00 5.01 0.00 -1.64 -1.04 103.07 108.87 3h1c h GLY 528 Ca 0.21 -0.55 -0.15 0.00 0.00 0.00 0.00 47.33 46.84 3h1c h GLY 528 CO -0.03 0.50 -0.71 0.00 0.00 0.00 0.00 176.54 176.30 3h1c h ALA 529 N 1.21 0.70 -0.01 3.60 0.00 -1.29 -2.97 119.26 120.49 3h1c h ALA 529 Ca 0.08 -0.64 -0.20 0.00 0.00 0.00 0.00 54.91 54.14 3h1c h ALA 529 Cb 0.70 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.39 3h1c h ALA 529 CO 0.05 0.88 -0.77 -0.09 0.00 0.00 0.00 179.25 179.32 3h1c h ARG 530 N 0.00 0.54 0.00 0.00 2.43 -0.64 -3.24 114.38 113.46 3h1c h ARG 530 Ca -0.01 -0.57 -0.04 0.00 -0.81 0.00 0.00 59.98 58.56 3h1c h ARG 530 Cb 1.36 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 31.06 3h1c h ARG 530 CO 0.09 1.19 -0.18 -0.07 -1.51 0.00 0.00 179.97 179.50 3h1c h LEU 531 N 0.11 0.00 -0.17 3.80 3.38 -1.25 -2.37 115.31 118.81 3h1c h LEU 531 Ca -0.09 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 3h1c h LEU 531 Cb 1.46 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.21 3h1c h LEU 531 CO 0.15 0.18 -0.15 -0.74 0.09 0.00 0.00 178.44 177.97 3h1c h HIS 532 N 0.00 0.48 -0.40 1.13 2.76 -1.57 -2.11 115.15 115.44 3h1c h HIS 532 Ca -0.00 -0.14 -0.12 0.00 -2.20 0.00 0.00 60.37 57.91 3h1c h HIS 532 Cb 0.45 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 3h1c h HIS 532 CO 0.00 0.77 -0.25 0.82 -1.30 0.00 0.00 177.93 177.97 3h1c h ILE 533 N 0.05 1.27 -0.26 6.26 2.04 -1.56 -2.87 117.51 122.45 3h1c h ILE 533 Ca 0.03 -1.38 -0.02 0.00 1.00 0.00 0.00 64.86 64.49 3h1c h ILE 533 Cb 0.68 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 3h1c h ILE 533 CO 0.04 0.46 0.06 -0.07 0.00 0.00 0.00 178.15 178.64 3h1c h LEU 534 N 0.70 0.34 -0.84 1.44 3.38 -1.43 0.55 115.31 119.45 3h1c h LEU 534 Ca 0.09 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 3h1c h LEU 534 Cb 0.78 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 3h1c h LEU 534 CO 0.06 0.35 -0.36 1.23 0.09 0.00 0.00 178.44 179.81 3h1c h GLY 535 N 0.59 0.47 1.64 0.83 0.00 -1.16 -1.29 103.07 104.15 3h1c h GLY 535 Ca 0.09 -0.43 -0.27 0.00 0.00 0.00 0.00 47.33 46.72 3h1c h GLY 535 CO -0.00 0.39 -1.22 -2.08 0.00 0.00 0.00 176.54 173.63 3h1c h VAL 536 N 0.36 1.50 -0.45 4.60 2.07 -1.27 -2.91 116.25 120.16 3h1c h VAL 536 Ca 0.04 -3.04 -0.12 0.00 0.82 0.00 0.00 66.70 64.39 3h1c h VAL 536 Cb 0.81 2.92 -0.01 0.00 -1.52 0.00 0.00 31.29 33.48 3h1c h VAL 536 CO 0.07 0.89 -0.20 0.24 0.02 0.00 0.00 177.57 178.59 3h1c h MET 537 N 0.08 0.89 0.00 1.57 2.07 -0.84 -2.87 114.93 115.83 3h1c h MET 537 Ca -0.13 -0.36 0.00 0.00 -2.07 0.00 0.00 59.70 57.14 3h1c h MET 537 Cb 1.94 -0.04 0.00 0.00 -1.87 0.00 0.00 31.60 31.63 3h1c h MET 537 CO 0.20 1.01 0.00 0.93 1.07 0.00 0.00 176.91 180.12 3h1c h GLU 538 N 0.78 0.00 -0.08 1.72 5.08 -1.32 -2.88 114.58 117.87 3h1c h GLU 538 Ca 0.11 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.36 3h1c h GLU 538 Cb 0.74 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 3h1c h GLU 538 CO 0.06 0.00 -0.44 0.37 -1.00 0.00 0.00 179.01 178.00 3h1c h GLN 539 N 0.00 0.19 0.00 2.33 4.15 -1.29 -3.33 115.11 117.16 3h1c h GLN 539 Ca 0.00 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.32 3h1c h GLN 539 Cb 0.76 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.45 3h1c h GLN 539 CO 0.00 0.60 -0.04 0.00 -1.93 0.00 0.00 178.83 177.47 3h1c h ALA 540 N 1.39 0.00 -3.70 3.38 0.00 -1.53 -3.49 119.26 115.32 3h1c h ALA 540 Ca 0.01 -0.05 -0.26 0.00 0.00 0.00 0.00 54.91 54.61 3h1c h ALA 540 Cb 0.85 0.04 -0.27 0.00 0.00 0.00 0.00 17.79 18.40 3h1c h ALA 540 CO 0.07 0.04 -0.73 0.96 0.00 0.00 0.00 179.25 179.58 3h1c s ILE 541 N -1.33 0.18 0.00 0.00 -5.25 -1.09 -5.02 121.20 108.68 3h1c s ILE 541 Ca -0.01 -0.21 0.00 0.00 -0.99 0.00 0.00 60.65 59.44 3h1c s ILE 541 Cb 0.00 -0.18 0.00 0.00 2.95 0.00 0.00 42.46 45.23 3h1c s ILE 541 CO 0.02 -0.02 0.15 -0.46 -1.79 0.00 0.00 174.94 172.83 3h1c n ASN 542 N 2.82 0.29 -3.86 4.36 6.94 -1.26 -4.02 115.26 120.54 3h1c n ASN 542 Ca -0.14 -1.00 -0.15 0.00 -0.02 0.00 0.00 54.58 53.26 3h1c n ASN 542 Cb 0.59 0.00 -0.15 0.00 -2.36 0.00 0.00 39.78 37.85 3h1c n ASN 542 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3h1c s ALA 543 N -0.00 0.25 -2.00 -2.53 0.00 -1.26 -5.01 121.76 111.21 3h1c s ALA 543 Ca 0.00 0.04 0.19 0.00 0.00 0.00 0.00 51.96 52.19 3h1c s ALA 543 Cb 0.00 -0.19 1.11 0.00 0.00 0.00 0.00 23.12 24.04 3h1c s ALA 543 CO 0.00 -0.01 1.50 -0.35 0.00 0.00 0.00 175.76 176.90