#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 2.27 -0.08 -0.89 1.02 -1.26 -5.12 118.68 114.62 3h1c s LEU 2 Ca 0.00 -0.54 0.02 0.00 0.02 0.00 0.00 54.13 53.63 3h1c s LEU 2 Cb 0.00 -1.49 -0.02 0.00 0.02 0.00 0.00 46.19 44.70 3h1c s LEU 2 CO 0.00 0.10 -0.12 0.20 0.02 0.00 0.00 176.35 176.54 3h1c s ASN 3 N 0.72 4.15 0.58 2.29 0.01 -1.26 -5.02 114.94 116.42 3h1c s ASN 3 Ca -0.08 -0.20 -0.13 0.00 -0.71 0.00 0.00 52.86 51.74 3h1c s ASN 3 Cb -0.16 -1.13 -0.05 0.00 0.41 0.00 0.00 41.25 40.32 3h1c s ASN 3 CO 0.01 0.30 1.00 -2.16 -1.51 0.00 0.00 177.10 174.74 3h1c s PRO 4 N -0.43 3.72 -0.26 -0.60 0.04 -1.26 -4.85 135.00 131.36 3h1c s PRO 4 Ca 0.05 0.80 -0.07 0.00 0.04 0.00 0.00 61.00 61.82 3h1c s PRO 4 Cb -0.12 -2.11 -0.02 0.00 0.04 0.00 0.00 34.50 32.29 3h1c s PRO 4 CO 0.02 -0.45 0.06 0.42 0.04 0.00 0.00 177.00 177.09 3h1c s ILE 5 N -2.97 4.15 0.21 0.56 1.01 -1.02 -4.99 121.20 118.15 3h1c s ILE 5 Ca 0.56 -0.31 0.11 0.00 0.00 0.00 0.00 60.65 61.00 3h1c s ILE 5 Cb -0.11 -2.98 -0.04 0.00 0.01 0.00 0.00 42.46 39.34 3h1c s ILE 5 CO 0.46 0.29 -0.18 0.68 0.00 0.00 0.00 174.94 176.19 3h1c s VAL 6 N 1.58 2.69 -0.15 2.92 -7.23 -1.26 -2.96 120.40 115.98 3h1c s VAL 6 Ca 0.06 -1.98 -0.05 0.00 -1.81 0.00 0.00 61.98 58.20 3h1c s VAL 6 Cb -0.15 -2.33 0.07 0.00 0.56 0.00 0.00 36.38 34.52 3h1c s VAL 6 CO 0.03 -0.18 0.30 -0.60 -0.31 0.00 0.00 175.10 174.33 3h1c s ARG 7 N -2.92 0.19 -0.09 4.82 3.52 -1.03 -5.03 118.95 118.41 3h1c s ARG 7 Ca 0.24 0.78 -0.03 0.00 -0.13 0.00 0.00 55.73 56.59 3h1c s ARG 7 Cb -0.08 -0.02 -0.04 0.00 -1.56 0.00 0.00 34.95 33.26 3h1c s ARG 7 CO 0.13 -0.30 0.06 0.15 -0.81 0.00 0.00 175.30 174.52 3h1c s LYS 8 N 2.46 3.15 -0.02 5.12 1.02 -1.26 -2.87 119.74 127.34 3h1c s LYS 8 Ca 0.01 -0.32 -0.14 0.00 0.02 0.00 0.00 55.97 55.55 3h1c s LYS 8 Cb -0.12 -2.94 0.02 0.00 -0.52 0.00 0.00 37.83 34.27 3h1c s LYS 8 CO -0.10 0.72 0.29 -0.59 -0.92 0.00 0.00 175.35 174.76 3h1c s PHE 9 N -0.97 -0.16 0.05 3.18 -0.71 -1.02 -5.04 117.98 113.31 3h1c s PHE 9 Ca 0.15 0.24 -0.28 0.00 -1.04 0.00 0.00 56.93 56.00 3h1c s PHE 9 Cb -0.12 0.08 -0.05 0.00 -1.21 0.00 0.00 43.02 41.73 3h1c s PHE 9 CO 0.04 -0.37 0.89 -0.65 -1.34 0.00 0.00 175.22 173.80 3h1c s GLN 10 N -1.27 4.59 -0.27 1.99 -1.52 -1.26 -1.63 119.66 120.29 3h1c s GLN 10 Ca -0.13 1.29 -0.04 0.00 -1.95 0.00 0.00 55.36 54.54 3h1c s GLN 10 Cb -0.05 -3.40 0.10 0.00 -0.22 0.00 0.00 33.01 29.43 3h1c s GLN 10 CO 0.04 0.15 0.15 -0.47 -0.25 0.00 0.00 175.29 174.91 3h1c s TYR 11 N 0.32 0.16 0.00 0.91 5.04 -0.08 -4.94 117.35 118.76 3h1c s TYR 11 Ca 0.45 -0.65 0.00 0.00 -2.44 0.00 0.00 57.07 54.44 3h1c s TYR 11 Cb -0.21 -0.78 0.00 0.00 0.35 0.00 0.00 41.96 41.31 3h1c s TYR 11 CO 0.27 -0.79 0.00 0.41 -1.34 0.00 0.00 175.55 174.10 3h1c n GLY 12 N 5.27 1.58 0.00 8.97 0.00 -1.26 -2.19 105.19 117.56 3h1c n GLY 12 Ca -0.06 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.10 -4.38 1.61 1.13 -1.26 -5.06 117.38 109.31 3h1c n GLN 13 Ca 0.00 -0.37 -0.28 0.00 -1.94 0.00 0.00 57.00 54.41 3h1c n GLN 13 Cb 0.00 -0.86 -0.13 0.00 0.11 0.00 0.00 30.24 29.36 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 -0.09 2.25 -0.49 1.08 3.76 -0.93 -5.11 115.29 115.77 3h1c s HIS 14 Ca 0.00 -0.38 -0.14 0.00 -0.15 0.00 0.00 55.06 54.38 3h1c s HIS 14 Cb 0.00 -1.21 0.09 0.00 1.11 0.00 0.00 32.58 32.57 3h1c s HIS 14 CO 0.00 0.35 0.41 0.99 -0.85 0.00 0.00 174.74 175.63 3h1c s THR 15 N -1.15 5.04 0.01 1.30 2.01 -1.20 -0.91 115.64 120.75 3h1c s THR 15 Ca 0.14 -1.27 -0.29 0.00 0.31 0.00 0.00 61.69 60.58 3h1c s THR 15 Cb -0.10 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 3h1c s THR 15 CO 0.06 -0.66 0.92 -0.69 -0.69 0.00 0.00 174.62 173.56 3h1c s VAL 16 N 1.59 4.81 -0.10 3.82 1.01 -0.64 -4.30 120.40 126.59 3h1c s VAL 16 Ca 0.04 1.94 0.03 0.00 0.00 0.00 0.00 61.98 63.98 3h1c s VAL 16 Cb -0.26 -4.27 -0.01 0.00 0.00 0.00 0.00 36.38 31.84 3h1c s VAL 16 CO 0.05 0.22 -0.18 -0.89 0.00 0.00 0.00 175.10 174.29 3h1c s THR 17 N 0.71 2.62 -0.11 3.92 2.01 0.26 -2.42 115.64 122.63 3h1c s THR 17 Ca 0.48 -0.83 0.03 0.00 0.31 0.00 0.00 61.69 61.68 3h1c s THR 17 Cb -0.21 -2.04 -0.00 0.00 0.01 0.00 0.00 72.50 70.25 3h1c s THR 17 CO 0.27 0.55 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.77 3h1c s LEU 18 N 0.12 2.20 -0.01 4.42 1.43 -1.14 -1.75 118.68 123.95 3h1c s LEU 18 Ca -0.09 -0.52 0.04 0.00 -1.03 0.00 0.00 54.13 52.53 3h1c s LEU 18 Cb -0.15 -1.45 -0.01 0.00 0.03 0.00 0.00 46.19 44.61 3h1c s LEU 18 CO 0.06 0.16 -0.13 -0.70 0.23 0.00 0.00 176.35 175.96 3h1c s GLU 19 N 0.35 1.08 0.09 1.70 2.12 -1.06 -2.48 118.70 120.50 3h1c s GLU 19 Ca -0.17 -0.49 -0.12 0.00 0.36 0.00 0.00 54.97 54.55 3h1c s GLU 19 Cb -0.18 -1.04 0.01 0.00 0.26 0.00 0.00 34.13 33.19 3h1c s GLU 19 CO 0.08 0.28 0.27 -0.08 -0.54 0.00 0.00 175.26 175.28 3h1c s THR 20 N -0.33 0.11 -0.27 -1.70 -1.32 -1.16 -1.19 115.64 109.78 3h1c s THR 20 Ca 0.05 -0.91 -0.01 0.00 -1.21 0.00 0.00 61.69 59.61 3h1c s THR 20 Cb -0.05 -1.21 0.00 0.00 -1.51 0.00 0.00 72.50 69.73 3h1c s THR 20 CO -0.00 -0.50 0.09 0.61 -2.21 0.00 0.00 174.62 172.60 3h1c n GLY 21 N 0.01 0.44 0.00 6.08 0.00 -1.26 -2.44 105.19 108.03 3h1c n GLY 21 Ca -0.16 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.30 2.00 0.00 1.61 0.00 -1.26 -4.58 117.12 113.58 3h1c n MET 22 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.68 3h1c n MET 22 Cb 0.52 -0.41 0.00 0.00 0.00 0.00 0.00 33.22 33.34 3h1c n MET 22 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 175.97 174.64 3h1c n MET 23 N -0.30 0.00 -3.34 2.12 2.81 -1.26 -4.88 117.12 112.27 3h1c n MET 23 Ca 0.00 0.00 -0.44 0.00 -1.81 0.00 0.00 57.70 55.45 3h1c n MET 23 Cb 0.00 -0.12 -0.08 0.00 -0.71 0.00 0.00 33.22 32.31 3h1c n MET 23 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h1c s ALA 24 N -4.77 3.49 -0.13 3.04 0.00 -1.26 -4.89 121.76 117.24 3h1c s ALA 24 Ca 0.00 -1.88 0.07 0.00 0.00 0.00 0.00 51.96 50.15 3h1c s ALA 24 Cb 0.00 -3.10 -0.23 0.00 0.00 0.00 0.00 23.12 19.78 3h1c s ALA 24 CO 0.00 -1.73 0.32 0.54 0.00 0.00 0.00 175.76 174.89 3h1c n ARG 25 N 5.47 0.68 0.20 0.00 1.74 -1.26 -4.31 116.66 119.18 3h1c n ARG 25 Ca -0.10 0.20 0.06 0.00 -0.77 0.00 0.00 57.85 57.24 3h1c n ARG 25 Cb 0.45 -1.67 0.40 0.00 -1.02 0.00 0.00 32.46 30.62 3h1c n ARG 25 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 3h1c h GLN 26 N 0.02 0.00 -6.89 5.56 1.08 -2.00 -3.42 115.11 109.46 3h1c h GLN 26 Ca -0.43 0.00 -0.49 0.00 -1.45 0.00 0.00 58.65 56.28 3h1c h GLN 26 Cb 2.05 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 29.50 3h1c h GLN 26 CO 0.04 0.34 0.43 0.00 -0.95 0.00 0.00 178.83 178.70 3h1c s ALA 27 N -3.81 3.22 0.42 3.87 0.00 -1.26 -4.95 121.76 119.25 3h1c s ALA 27 Ca -0.01 0.76 0.25 0.00 0.00 0.00 0.00 51.96 52.97 3h1c s ALA 27 Cb 0.12 -3.29 1.39 0.00 0.00 0.00 0.00 23.12 21.34 3h1c s ALA 27 CO 0.68 -0.16 2.06 1.79 0.00 0.00 0.00 175.76 180.14 3h1c h THR 28 N 2.60 0.65 -3.10 0.00 1.35 -1.82 -3.43 112.91 109.17 3h1c h THR 28 Ca -0.47 -0.54 -0.17 0.00 -0.55 0.00 0.00 66.41 64.68 3h1c h THR 28 Cb 1.21 1.34 -0.26 0.00 -1.73 0.00 0.00 68.15 68.71 3h1c h THR 28 CO 0.64 0.13 -0.43 0.00 -0.25 0.00 0.00 175.52 175.61 3h1c s ALA 29 N -4.27 -0.62 -0.25 6.62 0.00 -0.64 -4.40 121.76 118.20 3h1c s ALA 29 Ca -0.03 0.78 -0.04 0.00 0.00 0.00 0.00 51.96 52.66 3h1c s ALA 29 Cb 0.14 -0.46 0.14 0.00 0.00 0.00 0.00 23.12 22.93 3h1c s ALA 29 CO 0.60 -0.14 0.47 0.00 0.00 0.00 0.00 175.76 176.70 3h1c s ALA 30 N 0.36 -1.49 0.03 0.00 0.00 -1.26 -1.80 121.76 117.60 3h1c s ALA 30 Ca -0.02 1.45 0.05 0.00 0.00 0.00 0.00 51.96 53.44 3h1c s ALA 30 Cb -0.03 -1.71 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 3h1c s ALA 30 CO -0.01 -1.11 -0.14 0.14 0.00 0.00 0.00 175.76 174.64 3h1c s VAL 31 N 2.68 1.07 -0.27 0.00 -7.23 -0.82 -4.06 120.40 111.77 3h1c s VAL 31 Ca 0.09 -0.95 -0.02 0.00 -1.81 0.00 0.00 61.98 59.29 3h1c s VAL 31 Cb -0.14 -0.97 0.03 0.00 0.56 0.00 0.00 36.38 35.86 3h1c s VAL 31 CO -0.17 0.02 -0.03 -0.32 -0.31 0.00 0.00 175.10 174.30 3h1c s MET 32 N -1.06 2.77 -0.05 4.82 1.75 -0.33 -1.76 119.30 125.44 3h1c s MET 32 Ca 0.01 -1.03 -0.12 0.00 -1.25 0.00 0.00 55.69 53.31 3h1c s MET 32 Cb -0.08 -3.09 -0.05 0.00 2.84 0.00 0.00 34.83 34.46 3h1c s MET 32 CO 0.01 -0.46 0.31 0.08 -0.65 0.00 0.00 175.02 174.31 3h1c s VAL 33 N 1.33 5.22 -0.24 10.11 1.01 -1.00 -2.56 120.40 134.26 3h1c s VAL 33 Ca -0.01 0.60 -0.04 0.00 0.00 0.00 0.00 61.98 62.53 3h1c s VAL 33 Cb -0.17 -3.60 0.09 0.00 0.00 0.00 0.00 36.38 32.70 3h1c s VAL 33 CO -0.03 0.58 0.14 -0.55 0.00 0.00 0.00 175.10 175.24 3h1c s SER 34 N -0.94 2.69 0.02 3.32 0.15 -0.72 -1.79 113.70 116.43 3h1c s SER 34 Ca 0.20 -0.87 -0.17 0.00 0.70 0.00 0.00 55.95 55.81 3h1c s SER 34 Cb -0.15 -0.15 -0.09 0.00 -1.71 0.00 0.00 66.02 63.92 3h1c s SER 34 CO 0.09 -0.39 1.08 -0.03 1.20 0.00 0.00 173.24 175.20 3h1c h MET 35 N 8.39 -0.58 0.00 5.44 4.05 -1.75 0.77 114.93 131.25 3h1c h MET 35 Ca -0.17 0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.29 3h1c h MET 35 Cb 1.08 0.13 0.00 0.00 -0.80 0.00 0.00 31.60 32.01 3h1c h MET 35 CO 0.36 -0.39 -0.06 -3.47 0.23 0.00 0.00 176.91 173.58 3h1c n ASP 36 N -3.86 0.10 0.00 1.39 2.03 -1.26 -2.52 116.55 112.44 3h1c n ASP 36 Ca -0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.24 3h1c n ASP 36 Cb 0.24 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.64 3h1c n ASP 36 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 3h1c n ASP 37 N -2.15 0.00 -4.69 1.67 2.03 -1.26 -4.97 116.55 107.19 3h1c n ASP 37 Ca 0.00 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.90 3h1c n ASP 37 Cb 0.03 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.39 3h1c n ASP 37 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3h1c s THR 38 N 0.00 4.95 -0.05 5.18 2.01 -1.26 -4.30 115.64 122.17 3h1c s THR 38 Ca 0.00 1.55 0.05 0.00 0.31 0.00 0.00 61.69 63.60 3h1c s THR 38 Cb 0.00 -4.10 -0.01 0.00 0.01 0.00 0.00 72.50 68.41 3h1c s THR 38 CO 0.00 0.12 -0.21 0.00 -0.69 0.00 0.00 174.62 173.84 3h1c s ALA 39 N 1.61 1.86 -0.12 7.40 0.00 0.68 -2.42 121.76 130.77 3h1c s ALA 39 Ca 0.38 -0.88 -0.00 0.00 0.00 0.00 0.00 51.96 51.46 3h1c s ALA 39 Cb -0.17 -0.59 0.02 0.00 0.00 0.00 0.00 23.12 22.38 3h1c s ALA 39 CO 0.15 0.35 -0.09 0.08 0.00 0.00 0.00 175.76 176.25 3h1c s VAL 40 N -0.06 1.10 -0.31 0.00 1.01 -0.74 -0.31 120.40 121.09 3h1c s VAL 40 Ca -0.04 -0.34 -0.20 0.00 0.00 0.00 0.00 61.98 61.40 3h1c s VAL 40 Cb -0.13 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.14 3h1c s VAL 40 CO 0.03 0.38 0.63 0.12 0.00 0.00 0.00 175.10 176.26 3h1c s PHE 41 N 1.64 3.21 -0.12 5.22 5.36 0.10 -2.39 117.98 131.01 3h1c s PHE 41 Ca 0.04 0.57 0.01 0.00 -0.96 0.00 0.00 56.93 56.60 3h1c s PHE 41 Cb -0.13 -3.00 -0.01 0.00 -0.34 0.00 0.00 43.02 39.55 3h1c s PHE 41 CO -0.08 -0.48 -0.17 0.08 -1.46 0.00 0.00 175.22 173.11 3h1c s VAL 42 N 2.61 2.71 -0.02 3.12 1.01 -0.72 -0.87 120.40 128.24 3h1c s VAL 42 Ca 0.25 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.50 3h1c s VAL 42 Cb -0.15 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 3h1c s VAL 42 CO 0.12 0.54 -0.18 0.42 0.00 0.00 0.00 175.10 176.00 3h1c s THR 43 N 0.34 1.43 -0.16 3.92 -4.23 0.39 -1.94 115.64 115.40 3h1c s THR 43 Ca -0.14 -0.76 0.02 0.00 -1.18 0.00 0.00 61.69 59.63 3h1c s THR 43 Cb -0.17 -1.20 0.02 0.00 1.34 0.00 0.00 72.50 72.49 3h1c s THR 43 CO 0.07 0.41 -0.20 -0.69 -0.54 0.00 0.00 174.62 173.67 3h1c s VAL 44 N -0.31 1.96 -0.18 2.29 1.01 -0.75 -0.22 120.40 124.20 3h1c s VAL 44 Ca 0.04 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.13 3h1c s VAL 44 Cb -0.08 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.55 3h1c s VAL 44 CO 0.00 0.53 -0.16 -0.69 0.00 0.00 0.00 175.10 174.77 3h1c s VAL 45 N 1.11 2.42 -0.03 2.92 1.01 -0.51 -1.63 120.40 125.69 3h1c s VAL 45 Ca -0.00 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.17 3h1c s VAL 45 Cb -0.14 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.21 3h1c s VAL 45 CO -0.08 0.51 -0.10 -0.83 0.00 0.00 0.00 175.10 174.61 3h1c s GLY 46 N 1.19 0.57 0.32 4.51 0.00 -1.26 -1.25 107.32 111.41 3h1c s GLY 46 Ca 0.02 -0.36 -0.21 0.00 0.00 0.00 0.00 44.72 44.17 3h1c s GLY 46 CO -0.08 -0.10 0.85 1.20 0.00 0.00 0.00 173.10 174.97 3h1c s GLN 47 N 0.20 4.30 -0.01 2.90 -0.21 -1.14 -4.95 119.66 120.75 3h1c s GLN 47 Ca -0.04 1.03 -0.21 0.00 0.02 0.00 0.00 55.36 56.17 3h1c s GLN 47 Cb -0.09 -2.61 -0.25 0.00 1.00 0.00 0.00 33.01 31.06 3h1c s GLN 47 CO 0.01 0.21 1.05 0.87 -2.12 0.00 0.00 175.29 175.32 3h1c h LYS 48 N 2.77 0.37 -4.47 2.91 1.57 -2.01 -3.43 116.57 114.29 3h1c h LYS 48 Ca -0.48 -0.44 -0.64 0.00 -1.87 0.00 0.00 60.65 57.23 3h1c h LYS 48 Cb 1.19 0.13 -0.39 0.00 0.08 0.00 0.00 32.23 33.24 3h1c h LYS 48 CO 0.64 1.12 -0.75 0.21 -0.57 0.00 0.00 179.45 180.10 3h1c s LYS 49 N -3.05 1.48 0.51 3.15 2.20 -1.26 -5.04 119.74 117.73 3h1c s LYS 49 Ca -0.13 -1.54 -0.07 0.00 -0.36 0.00 0.00 55.97 53.87 3h1c s LYS 49 Cb 0.03 -2.86 0.11 0.00 -1.51 0.00 0.00 37.83 33.60 3h1c s LYS 49 CO 0.82 -0.85 0.69 0.00 -0.36 0.00 0.00 175.35 175.66 3h1c n ALA 50 N 4.44 -0.59 -1.38 3.13 0.00 -1.26 -5.05 120.51 119.80 3h1c n ALA 50 Ca -0.02 -1.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.09 3h1c n ALA 50 Cb 0.42 0.01 0.07 0.00 0.00 0.00 0.00 19.45 19.96 3h1c n ALA 50 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3h1c s LYS 51 N -4.43 2.46 0.16 0.00 -0.14 -1.26 -4.97 119.74 111.56 3h1c s LYS 51 Ca 0.41 1.41 0.19 0.00 -1.36 0.00 0.00 55.97 56.62 3h1c s LYS 51 Cb -0.01 -1.91 -0.03 0.00 -1.68 0.00 0.00 37.83 34.20 3h1c s LYS 51 CO 0.28 -1.52 1.03 -1.00 -0.76 0.00 0.00 175.35 173.38 3h1c h PRO 52 N -0.41 0.00 -1.30 -1.68 0.13 -1.99 -3.35 132.00 123.40 3h1c h PRO 52 Ca -0.46 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.32 3h1c h PRO 52 Cb 1.25 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.22 3h1c h PRO 52 CO 0.52 0.19 0.46 0.41 -0.23 0.00 0.00 178.00 179.35 3h1c n GLY 53 N 1.28 4.09 3.44 1.56 0.00 -1.26 -4.89 105.19 109.41 3h1c n GLY 53 Ca -0.04 -1.09 -0.33 0.00 0.00 0.00 0.00 46.02 44.56 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 -2.07 3.37 -0.02 1.61 -1.52 -1.26 -4.99 119.66 114.79 3h1c s GLN 54 Ca 0.35 -0.62 0.06 0.00 -1.95 0.00 0.00 55.36 53.21 3h1c s GLN 54 Cb 0.28 -2.70 -0.10 0.00 -0.22 0.00 0.00 33.01 30.27 3h1c s GLN 54 CO 0.02 0.29 0.13 -0.40 -0.25 0.00 0.00 175.29 175.07 3h1c n ASP 55 N 3.33 3.49 -4.61 5.90 5.75 -1.26 -5.01 116.55 124.14 3h1c n ASP 55 Ca -0.18 0.00 -0.31 0.00 -0.01 0.00 0.00 54.79 54.29 3h1c n ASP 55 Cb 0.53 1.22 -0.10 0.00 -1.03 0.00 0.00 41.12 41.74 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 -2.42 2.87 -0.44 2.11 -0.71 -1.26 -5.05 117.98 113.08 3h1c s PHE 56 Ca -0.02 -0.06 -0.29 0.00 -1.04 0.00 0.00 56.93 55.51 3h1c s PHE 56 Cb 0.04 -1.55 0.01 0.00 -1.21 0.00 0.00 43.02 40.31 3h1c s PHE 56 CO 0.27 0.40 1.35 0.12 -1.34 0.00 0.00 175.22 176.03 3h1c s PHE 57 N -1.10 2.48 -1.20 3.49 5.36 -1.26 -4.88 117.98 120.86 3h1c s PHE 57 Ca 0.20 0.67 -0.12 0.00 -0.96 0.00 0.00 56.93 56.72 3h1c s PHE 57 Cb -0.11 -4.35 0.20 0.00 -0.34 0.00 0.00 43.02 38.41 3h1c s PHE 57 CO 0.11 -1.83 1.47 -0.35 -1.46 0.00 0.00 175.22 173.16 3h1c n PRO 58 N 8.07 3.51 -3.71 10.12 -0.04 -1.26 -4.98 135.00 146.72 3h1c n PRO 58 Ca 0.15 -3.93 -0.36 0.00 -0.04 0.00 0.00 63.50 59.32 3h1c n PRO 58 Cb 0.48 -2.91 -0.09 0.00 -0.04 0.00 0.00 33.50 30.95 3h1c n PRO 58 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3h1c s LEU 59 N 0.51 4.14 -0.07 1.53 0.20 -1.26 -3.09 118.68 120.64 3h1c s LEU 59 Ca 0.40 0.16 0.02 0.00 0.69 0.00 0.00 54.13 55.39 3h1c s LEU 59 Cb -0.01 -2.09 0.02 0.00 -0.43 0.00 0.00 46.19 43.67 3h1c s LEU 59 CO -0.00 0.12 -0.10 0.28 -0.29 0.00 0.00 176.35 176.36 3h1c s THR 60 N 0.72 0.98 -0.19 3.68 -1.32 -1.07 -5.04 115.64 113.40 3h1c s THR 60 Ca 0.08 -0.36 -0.02 0.00 -1.21 0.00 0.00 61.69 60.17 3h1c s THR 60 Cb -0.12 -0.93 -0.00 0.00 -1.51 0.00 0.00 72.50 69.93 3h1c s THR 60 CO 0.01 0.33 -0.10 -0.69 -2.21 0.00 0.00 174.62 171.96 3h1c s VAL 61 N 0.91 2.98 -0.35 5.08 1.01 -1.26 -1.91 120.40 126.85 3h1c s VAL 61 Ca -0.10 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.20 3h1c s VAL 61 Cb -0.15 -2.32 0.07 0.00 0.00 0.00 0.00 36.38 33.98 3h1c s VAL 61 CO 0.01 0.47 0.10 0.20 0.00 0.00 0.00 175.10 175.88 3h1c s ASN 62 N 1.24 5.14 -0.16 3.32 0.01 -0.74 -4.90 114.94 118.85 3h1c s ASN 62 Ca 0.03 -1.48 -0.12 0.00 -0.71 0.00 0.00 52.86 50.58 3h1c s ASN 62 Cb -0.14 -1.80 -0.05 0.00 0.41 0.00 0.00 41.25 39.67 3h1c s ASN 62 CO -0.04 -0.37 0.24 -0.47 -1.51 0.00 0.00 177.10 174.95 3h1c s TYR 63 N 1.26 3.47 -0.10 2.20 5.04 -1.26 -2.25 117.35 125.71 3h1c s TYR 63 Ca 0.00 0.54 -0.04 0.00 -2.44 0.00 0.00 57.07 55.13 3h1c s TYR 63 Cb -0.21 -2.26 0.05 0.00 0.35 0.00 0.00 41.96 39.89 3h1c s TYR 63 CO -0.01 0.31 0.22 1.14 -1.34 0.00 0.00 175.55 175.87 3h1c s GLN 64 N 0.23 0.15 -0.29 4.97 -2.07 -0.80 -4.81 119.66 117.04 3h1c s GLN 64 Ca 0.14 0.55 -0.15 0.00 -1.82 0.00 0.00 55.36 54.08 3h1c s GLN 64 Cb -0.13 -0.14 -0.03 0.00 -1.09 0.00 0.00 33.01 31.63 3h1c s GLN 64 CO 0.03 -0.21 0.36 -1.21 -1.32 0.00 0.00 175.29 172.94 3h1c s GLU 65 N 1.61 3.90 0.23 9.60 2.02 -1.26 -2.35 118.70 132.45 3h1c s GLU 65 Ca -0.06 -0.10 -0.29 0.00 0.02 0.00 0.00 54.97 54.55 3h1c s GLU 65 Cb -0.11 -3.69 -0.09 0.00 0.10 0.00 0.00 34.13 30.34 3h1c s GLU 65 CO -0.08 -0.33 0.91 1.03 0.02 0.00 0.00 175.26 176.81 3h1c s ARG 66 N 2.04 4.77 0.41 1.61 1.81 -1.24 -4.95 118.95 123.39 3h1c s ARG 66 Ca 0.14 1.40 0.22 0.00 -1.72 0.00 0.00 55.73 55.77 3h1c s ARG 66 Cb -0.16 -3.22 0.72 0.00 -0.45 0.00 0.00 34.95 31.84 3h1c s ARG 66 CO 0.11 0.50 1.74 1.79 -0.68 0.00 0.00 175.30 178.76 3h1c h THR 67 N 3.12 0.61 0.00 0.02 1.35 -1.90 -2.98 112.91 113.13 3h1c h THR 67 Ca -0.46 -1.34 0.00 0.00 -0.55 0.00 0.00 66.41 64.06 3h1c h THR 67 Cb 1.20 1.90 0.00 0.00 -1.73 0.00 0.00 68.15 69.52 3h1c h THR 67 CO 0.67 0.27 0.00 0.00 -0.25 0.00 0.00 175.52 176.21 3h1c n TYR 68 N -3.36 0.00 -0.08 4.73 4.11 -1.26 -2.97 117.16 118.33 3h1c n TYR 68 Ca 0.01 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.79 3h1c n TYR 68 Cb 0.49 -0.07 -0.05 0.00 -0.00 0.00 0.00 39.34 39.72 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 3.59 0.30 0.00 -3.48 0.00 -1.62 -3.21 119.26 114.85 3h1c h ALA 69 Ca 0.00 -0.27 -0.24 0.00 0.00 0.00 0.00 54.91 54.40 3h1c h ALA 69 Cb 0.06 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3h1c h ALA 69 CO 0.00 0.11 -1.24 0.00 0.00 0.00 0.00 179.25 178.12 3h1c h ALA 70 N 0.73 0.50 0.00 0.00 0.00 -1.80 -2.87 119.26 115.83 3h1c h ALA 70 Ca 0.05 -1.09 0.00 0.00 0.00 0.00 0.00 54.91 53.87 3h1c h ALA 70 Cb 0.54 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3h1c h ALA 70 CO 0.03 1.35 0.00 0.41 0.00 0.00 0.00 179.25 181.04 3h1c n GLY 71 N 1.42 0.89 2.98 0.00 0.00 -1.21 -5.02 105.19 104.25 3h1c n GLY 71 Ca -0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.81 3h1c n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h1c s ARG 72 N 0.22 0.47 -0.09 1.61 0.52 -1.16 -5.04 118.95 115.48 3h1c s ARG 72 Ca 0.00 -0.31 -0.29 0.00 -0.52 0.00 0.00 55.73 54.61 3h1c s ARG 72 Cb 0.00 -0.41 -0.01 0.00 0.52 0.00 0.00 34.95 35.04 3h1c s ARG 72 CO 0.00 0.11 1.00 0.42 0.02 0.00 0.00 175.30 176.84 3h1c s ILE 73 N -0.37 4.80 0.49 1.52 1.01 -1.26 -4.29 121.20 123.10 3h1c s ILE 73 Ca -0.00 2.03 -0.22 0.00 0.00 0.00 0.00 60.65 62.47 3h1c s ILE 73 Cb -0.04 -4.31 -0.09 0.00 0.01 0.00 0.00 42.46 38.04 3h1c s ILE 73 CO -0.00 0.03 0.94 -0.81 0.00 0.00 0.00 174.94 175.10 3h1c n PRO 74 N 4.82 1.11 -0.23 2.79 -0.04 -1.26 -4.91 135.00 137.29 3h1c n PRO 74 Ca 0.08 0.41 0.04 0.00 -0.04 0.00 0.00 63.50 63.99 3h1c n PRO 74 Cb 0.49 -2.04 0.14 0.00 -0.04 0.00 0.00 33.50 32.05 3h1c n PRO 74 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h1c n GLY 75 N 1.29 1.05 3.83 0.55 0.00 -1.26 -4.68 105.19 105.97 3h1c n GLY 75 Ca 0.11 -0.34 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 3h1c n GLY 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h1c s SER 76 N -0.73 5.36 0.31 1.61 1.04 -1.26 -4.98 113.70 115.06 3h1c s SER 76 Ca 0.20 1.44 0.05 0.00 0.48 0.00 0.00 55.95 58.13 3h1c s SER 76 Cb 0.13 -2.32 0.53 0.00 0.10 0.00 0.00 66.02 64.46 3h1c s SER 76 CO 0.11 -1.43 1.77 0.15 0.98 0.00 0.00 173.24 174.82 3h1c h PHE 77 N -0.71 0.39 -0.01 5.02 3.57 -1.93 -2.59 116.94 120.68 3h1c h PHE 77 Ca -0.45 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 60.98 3h1c h PHE 77 Cb 1.22 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.87 3h1c h PHE 77 CO 0.58 0.58 -0.19 1.19 -2.23 0.00 0.00 178.31 178.24 3h1c n PHE 78 N -4.14 0.00 -2.42 0.41 3.01 -1.26 -4.94 117.46 108.11 3h1c n PHE 78 Ca -0.01 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.26 3h1c n PHE 78 Cb 0.38 -0.14 -0.01 0.00 -0.01 0.00 0.00 39.48 39.70 3h1c n PHE 78 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3h1c n ARG 79 N -0.75 -1.86 -3.68 -1.08 5.12 -0.98 -4.97 116.66 108.46 3h1c n ARG 79 Ca 0.13 0.93 -0.11 0.00 -1.93 0.00 0.00 57.85 56.88 3h1c n ARG 79 Cb 0.32 -5.59 -0.11 0.00 -1.16 0.00 0.00 32.46 25.91 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 -5.06 0.29 1.07 5.56 3.52 -1.26 -4.69 118.95 118.38 3h1c s ARG 80 Ca 0.01 0.80 -0.16 0.00 -0.13 0.00 0.00 55.73 56.25 3h1c s ARG 80 Cb -0.00 0.05 0.10 0.00 -1.56 0.00 0.00 34.95 33.54 3h1c s ARG 80 CO 0.01 -0.21 0.22 -0.85 -0.81 0.00 0.00 175.30 173.66 3h1c n GLU 81 N 4.78 -1.27 0.00 5.12 0.00 -1.26 -4.95 120.64 123.06 3h1c n GLU 81 Ca -0.16 -0.35 0.00 0.00 0.00 0.00 0.00 57.16 56.65 3h1c n GLU 81 Cb 0.52 -1.80 0.00 0.00 0.00 0.00 0.00 31.44 30.17 3h1c n GLU 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3h1c n GLY 82 N 1.76 -0.28 3.75 -1.84 0.00 -1.26 -5.13 105.19 102.19 3h1c n GLY 82 Ca 0.03 0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.92 3h1c n GLY 82 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3h1c s ARG 83 N 0.10 4.59 0.30 1.61 1.70 -1.26 -5.03 118.95 120.96 3h1c s ARG 83 Ca 0.00 1.21 -0.29 0.00 -0.47 0.00 0.00 55.73 56.18 3h1c s ARG 83 Cb 0.00 -3.33 -0.10 0.00 -0.57 0.00 0.00 34.95 30.95 3h1c s ARG 83 CO 0.00 0.38 1.43 -2.14 -1.08 0.00 0.00 175.30 173.89 3h1c s PRO 84 N -0.50 4.24 0.53 3.89 0.02 -1.26 -5.03 135.00 136.89 3h1c s PRO 84 Ca 0.39 2.36 -0.07 0.00 0.02 0.00 0.00 61.00 63.70 3h1c s PRO 84 Cb -0.22 -3.06 0.12 0.00 0.02 0.00 0.00 34.50 31.35 3h1c s PRO 84 CO 0.26 -0.40 0.72 0.45 -0.33 0.00 0.00 177.00 177.70 3h1c n SER 85 N 1.51 0.22 0.21 2.53 2.88 -1.26 -4.84 113.62 114.87 3h1c n SER 85 Ca 0.04 -1.36 0.05 0.00 -1.33 0.00 0.00 58.87 56.27 3h1c n SER 85 Cb 0.40 -0.54 0.49 0.00 -0.75 0.00 0.00 64.21 63.82 3h1c n SER 85 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 3h1c h GLU 86 N 0.00 0.04 -0.13 -1.46 9.09 -2.00 -2.37 114.58 117.76 3h1c h GLU 86 Ca -0.23 -0.01 -0.09 0.00 0.05 0.00 0.00 59.36 59.07 3h1c h GLU 86 Cb 0.68 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.78 3h1c h GLU 86 CO 0.18 0.20 -0.29 0.78 0.05 0.00 0.00 179.01 179.93 3h1c h GLY 87 N 0.54 0.46 2.00 1.06 0.00 -2.00 -3.08 103.07 102.05 3h1c h GLY 87 Ca 0.01 -0.56 -0.08 0.00 0.00 0.00 0.00 47.33 46.69 3h1c h GLY 87 CO 0.02 0.51 -0.40 0.83 0.00 0.00 0.00 176.54 177.50 3h1c h GLU 88 N 0.01 0.00 -0.05 4.80 5.08 -1.87 -2.98 114.58 119.57 3h1c h GLU 88 Ca -0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 3h1c h GLU 88 Cb 0.89 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.15 3h1c h GLU 88 CO 0.06 0.40 -0.87 1.15 -1.00 0.00 0.00 179.01 178.75 3h1c h THR 89 N 0.00 1.35 -0.22 1.13 2.02 -1.51 -2.80 112.91 112.89 3h1c h THR 89 Ca -0.00 -2.24 -0.11 0.00 0.77 0.00 0.00 66.41 64.82 3h1c h THR 89 Cb 0.77 2.25 -0.01 0.00 -1.74 0.00 0.00 68.15 69.41 3h1c h THR 89 CO 0.05 0.68 -0.34 -0.07 0.37 0.00 0.00 175.52 176.21 3h1c h LEU 90 N 0.33 0.49 -0.49 2.58 -0.00 -1.44 -2.43 115.31 114.35 3h1c h LEU 90 Ca -0.07 -0.20 -0.17 0.00 -0.00 0.00 0.00 57.88 57.45 3h1c h LEU 90 Cb 1.49 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 42.00 3h1c h LEU 90 CO 0.16 0.80 -0.71 0.40 -0.00 0.00 0.00 178.44 179.09 3h1c h ILE 91 N 0.40 1.42 -0.68 1.22 1.08 -1.58 -1.60 117.51 117.78 3h1c h ILE 91 Ca 0.05 -2.21 -0.03 0.00 -0.39 0.00 0.00 64.86 62.27 3h1c h ILE 91 Cb 0.80 2.17 -0.03 0.00 -3.07 0.00 0.00 36.82 36.69 3h1c h ILE 91 CO 0.06 0.65 0.29 0.00 -0.69 0.00 0.00 178.15 178.47 3h1c h ALA 92 N 1.08 1.25 0.00 1.87 0.00 -1.29 -1.69 119.26 120.47 3h1c h ALA 92 Ca -0.02 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 3h1c h ALA 92 Cb 1.27 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 3h1c h ALA 92 CO 0.11 0.56 -0.62 0.00 0.00 0.00 0.00 179.25 179.30 3h1c h ARG 93 N 0.97 0.00 0.00 0.00 3.08 -1.36 -2.24 114.38 114.83 3h1c h ARG 93 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3h1c h ARG 93 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 3h1c h ARG 93 CO -0.02 0.62 0.00 1.25 -1.07 0.00 0.00 179.97 180.75 3h1c h LEU 94 N 0.00 0.00 0.01 3.04 5.85 -0.55 -2.59 115.31 121.08 3h1c h LEU 94 Ca -0.01 0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.34 3h1c h LEU 94 Cb 1.23 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.19 3h1c h LEU 94 CO 0.08 0.00 -2.32 -0.38 -0.34 0.00 0.00 178.44 175.48 3h1c n ILE 95 N -3.03 1.48 0.03 4.05 5.41 -0.71 -4.52 119.36 122.07 3h1c n ILE 95 Ca 0.01 -0.73 -0.13 0.00 1.00 0.00 0.00 62.75 62.91 3h1c n ILE 95 Cb 0.34 -0.98 -0.09 0.00 -0.71 0.00 0.00 39.64 38.20 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 0.01 -0.10 -0.68 4.38 1.82 -1.36 -3.33 116.42 117.14 3h1c h ASP 96 Ca -0.52 -0.40 0.13 0.00 -0.39 0.00 0.00 57.03 55.85 3h1c h ASP 96 Cb 2.08 0.03 -0.09 0.00 0.68 0.00 0.00 39.33 42.02 3h1c h ASP 96 CO -0.00 0.37 0.21 0.03 -1.61 0.00 0.00 179.24 178.23 3h1c h ARG 97 N -0.61 0.33 0.00 0.28 2.47 -1.70 -1.92 114.38 113.23 3h1c h ARG 97 Ca -0.01 -0.02 -0.12 0.00 -1.26 0.00 0.00 59.98 58.57 3h1c h ARG 97 Cb 0.50 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.73 3h1c h ARG 97 CO 0.02 0.22 -0.58 -1.35 0.56 0.00 0.00 179.97 178.84 3h1c h PRO 98 N 0.34 0.00 0.00 0.04 0.11 -1.80 -3.29 132.00 127.40 3h1c h PRO 98 Ca 0.37 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.39 3h1c h PRO 98 Cb 0.57 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 3h1c h PRO 98 CO -0.42 0.58 -0.61 -0.84 -0.21 0.00 0.00 178.00 176.50 3h1c h ILE 99 N 0.00 0.56 0.02 4.15 3.07 -1.47 -3.39 117.51 120.46 3h1c h ILE 99 Ca -0.01 -1.85 -0.00 0.00 1.55 0.00 0.00 64.86 64.56 3h1c h ILE 99 Cb 1.10 2.20 0.00 0.00 -0.27 0.00 0.00 36.82 39.85 3h1c h ILE 99 CO 0.08 0.32 -0.01 -0.09 -1.05 0.00 0.00 178.15 177.40 3h1c h ARG 100 N 0.00 -0.02 0.00 0.16 2.43 -1.55 -3.13 114.38 112.26 3h1c h ARG 100 Ca -0.03 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3h1c h ARG 100 Cb 1.31 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 3h1c h ARG 100 CO 0.04 0.04 0.00 -1.35 -1.51 0.00 0.00 179.97 177.19 3h1c h PRO 101 N -0.08 0.00 0.00 0.20 0.11 -1.76 -2.99 132.00 127.47 3h1c h PRO 101 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3h1c h PRO 101 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 3h1c h PRO 101 CO 0.00 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 177.72 3h1c h LEU 102 N 0.00 0.00 -9.71 2.35 3.38 -1.77 -3.44 115.31 106.12 3h1c h LEU 102 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 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 0.59 -0.36 0.09 0.00 0.00 178.44 178.76 3h1c s PHE 103 N -3.45 3.33 0.66 1.13 0.40 -1.13 -2.98 117.98 115.93 3h1c s PHE 103 Ca 0.04 1.38 -0.17 0.00 -0.60 0.00 0.00 56.93 57.57 3h1c s PHE 103 Cb 0.08 -3.51 -0.00 0.00 0.51 0.00 0.00 43.02 40.10 3h1c s PHE 103 CO 0.56 -1.47 1.21 -1.25 0.70 0.00 0.00 175.22 174.97 3h1c s PRO 104 N -0.53 2.58 0.01 0.24 0.04 -1.26 -4.96 135.00 131.13 3h1c s PRO 104 Ca 0.53 1.80 -0.30 0.00 0.04 0.00 0.00 61.00 63.07 3h1c s PRO 104 Cb -0.35 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.25 3h1c s PRO 104 CO 0.40 -1.50 1.35 -2.00 0.04 0.00 0.00 177.00 175.28 3h1c s GLU 105 N -3.61 4.31 0.00 4.56 2.12 -1.26 -2.89 118.70 121.93 3h1c s GLU 105 Ca 0.76 1.91 0.00 0.00 0.36 0.00 0.00 54.97 58.00 3h1c s GLU 105 Cb -0.30 -3.51 0.00 0.00 0.26 0.00 0.00 34.13 30.58 3h1c s GLU 105 CO 0.39 -0.50 0.00 0.41 -0.54 0.00 0.00 175.26 175.02 3h1c n GLY 106 N 3.54 0.70 3.57 -1.50 0.00 -1.26 -4.93 105.19 105.31 3h1c n GLY 106 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 3.10 -0.40 1.61 5.36 -1.14 -4.84 117.98 119.66 3h1c s PHE 107 Ca 0.00 0.44 0.04 0.00 -0.96 0.00 0.00 56.93 56.46 3h1c s PHE 107 Cb 0.00 -3.40 0.11 0.00 -0.34 0.00 0.00 43.02 39.39 3h1c s PHE 107 CO 0.00 -0.76 1.03 0.28 -1.46 0.00 0.00 175.22 174.31 3h1c n VAL 108 N 5.82 0.85 -2.46 3.12 0.31 -1.26 -4.54 118.33 120.17 3h1c n VAL 108 Ca 0.02 -0.92 -0.40 0.00 -0.01 0.00 0.00 64.34 63.02 3h1c n VAL 108 Cb 0.48 0.59 -0.04 0.00 -0.91 0.00 0.00 33.84 33.96 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 -0.91 7.24 -0.09 4.52 0.01 -1.26 -4.55 114.94 119.91 3h1c s ASN 109 Ca 0.09 2.27 -0.30 0.00 -0.71 0.00 0.00 52.86 54.21 3h1c s ASN 109 Cb 0.05 -2.63 -0.02 0.00 0.41 0.00 0.00 41.25 39.06 3h1c s ASN 109 CO 0.06 -0.18 1.12 -0.70 -1.51 0.00 0.00 177.10 175.90 3h1c s GLU 110 N -1.31 4.37 -0.00 -0.60 2.12 -1.26 -4.47 118.70 117.54 3h1c s GLU 110 Ca 0.45 1.55 0.05 0.00 0.36 0.00 0.00 54.97 57.38 3h1c s GLU 110 Cb -0.32 -3.56 -0.01 0.00 0.26 0.00 0.00 34.13 30.49 3h1c s GLU 110 CO 0.41 -0.41 -0.16 0.14 -0.54 0.00 0.00 175.26 174.70 3h1c s VAL 111 N 2.22 1.28 -0.09 3.70 -7.23 -1.18 -2.90 120.40 116.20 3h1c s VAL 111 Ca 0.52 -0.75 0.02 0.00 -1.81 0.00 0.00 61.98 59.97 3h1c s VAL 111 Cb -0.22 -1.08 0.01 0.00 0.56 0.00 0.00 36.38 35.66 3h1c s VAL 111 CO 0.19 0.32 -0.14 -1.58 -0.31 0.00 0.00 175.10 173.59 3h1c s GLN 112 N -0.49 1.98 -0.42 4.82 0.74 -0.38 -2.61 119.66 123.30 3h1c s GLN 112 Ca 0.06 -0.48 -0.09 0.00 0.05 0.00 0.00 55.36 54.90 3h1c s GLN 112 Cb -0.06 -1.70 0.08 0.00 1.10 0.00 0.00 33.01 32.43 3h1c s GLN 112 CO -0.00 -0.05 0.26 0.08 -0.55 0.00 0.00 175.29 175.03 3h1c s VAL 113 N 0.93 4.13 -0.40 1.34 1.01 -0.80 -1.42 120.40 125.19 3h1c s VAL 113 Ca -0.09 -1.48 -0.16 0.00 0.00 0.00 0.00 61.98 60.25 3h1c s VAL 113 Cb -0.15 -3.57 0.01 0.00 0.00 0.00 0.00 36.38 32.68 3h1c s VAL 113 CO -0.00 -0.54 0.38 -0.63 0.00 0.00 0.00 175.10 174.31 3h1c s ILE 114 N 1.39 5.16 -0.29 2.22 1.09 0.70 -1.80 121.20 129.67 3h1c s ILE 114 Ca 0.03 -0.38 -0.02 0.00 -1.10 0.00 0.00 60.65 59.18 3h1c s ILE 114 Cb -0.23 -3.97 0.04 0.00 -1.06 0.00 0.00 42.46 37.24 3h1c s ILE 114 CO 0.01 -0.33 -0.00 0.00 -0.10 0.00 0.00 174.94 174.52 3h1c s ALA 115 N 1.97 2.82 -0.09 9.38 0.00 -0.96 -0.46 121.76 134.43 3h1c s ALA 115 Ca 0.10 -1.66 0.03 0.00 0.00 0.00 0.00 51.96 50.42 3h1c s ALA 115 Cb -0.18 -1.91 -0.02 0.00 0.00 0.00 0.00 23.12 21.01 3h1c s ALA 115 CO 0.12 -1.14 -0.17 -0.08 0.00 0.00 0.00 175.76 174.49 3h1c s THR 116 N 1.30 2.71 -0.07 0.00 -1.32 -0.05 -1.91 115.64 116.31 3h1c s THR 116 Ca -0.03 -0.81 -0.30 0.00 -1.21 0.00 0.00 61.69 59.34 3h1c s THR 116 Cb -0.19 -2.08 -0.02 0.00 -1.51 0.00 0.00 72.50 68.70 3h1c s THR 116 CO -0.01 0.56 1.04 -0.69 -2.21 0.00 0.00 174.62 173.30 3h1c s VAL 117 N -0.05 4.69 -0.16 5.08 1.01 -0.99 0.00 120.40 129.98 3h1c s VAL 117 Ca -0.04 1.95 -0.13 0.00 0.00 0.00 0.00 61.98 63.76 3h1c s VAL 117 Cb -0.14 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 31.93 3h1c s VAL 117 CO 0.04 0.04 -0.21 0.52 0.00 0.00 0.00 175.10 175.49 3h1c n VAL 118 N 4.41 1.45 -4.20 2.92 0.31 0.58 -3.66 118.33 120.14 3h1c n VAL 118 Ca 0.09 0.16 -0.13 0.00 -0.01 0.00 0.00 64.34 64.45 3h1c n VAL 118 Cb 0.49 -2.35 -0.10 0.00 -0.91 0.00 0.00 33.84 30.97 3h1c n VAL 118 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3h1c s SER 119 N -5.90 1.46 -0.05 4.52 1.04 -0.95 -3.80 113.70 110.01 3h1c s SER 119 Ca -0.20 -0.96 -0.04 0.00 0.48 0.00 0.00 55.95 55.23 3h1c s SER 119 Cb 0.03 0.03 0.02 0.00 0.10 0.00 0.00 66.02 66.20 3h1c s SER 119 CO 0.31 -0.36 0.13 0.54 0.98 0.00 0.00 173.24 174.83 3h1c s VAL 120 N -3.21 -0.01 -0.17 5.02 0.11 -1.08 -0.23 120.40 120.83 3h1c s VAL 120 Ca 0.12 0.05 -0.06 0.00 -2.93 0.00 0.00 61.98 59.16 3h1c s VAL 120 Cb 0.02 -0.19 -0.03 0.00 -1.53 0.00 0.00 36.38 34.64 3h1c s VAL 120 CO -0.02 0.02 0.01 0.21 -3.33 0.00 0.00 175.10 172.00 3h1c s ASN 121 N 0.34 5.19 0.00 3.54 2.47 -1.26 -4.65 114.94 120.58 3h1c s ASN 121 Ca -0.02 -0.04 0.00 0.00 0.42 0.00 0.00 52.86 53.22 3h1c s ASN 121 Cb -0.04 -1.87 0.00 0.00 -1.45 0.00 0.00 41.25 37.89 3h1c s ASN 121 CO -0.01 0.16 0.61 -2.65 -3.72 0.00 0.00 177.10 171.49 3h1c n PRO 122 N 3.62 0.00 -0.12 0.43 -0.02 -1.26 -2.53 135.00 135.12 3h1c n PRO 122 Ca -0.17 0.14 -0.24 0.00 -2.02 0.00 0.00 63.50 61.21 3h1c n PRO 122 Cb 0.52 -1.51 -0.09 0.00 -0.02 0.00 0.00 33.50 32.40 3h1c n PRO 122 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3h1c n GLN 123 N -1.11 0.54 -3.40 -0.52 1.13 -1.26 -4.60 117.38 108.16 3h1c n GLN 123 Ca 0.00 0.21 -0.37 0.00 -1.94 0.00 0.00 57.00 54.90 3h1c n GLN 123 Cb 0.01 -1.41 -0.06 0.00 0.11 0.00 0.00 30.24 28.89 3h1c n GLN 123 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 3h1c s VAL 124 N -2.46 5.23 0.71 5.09 -7.23 -1.05 -3.02 120.40 117.68 3h1c s VAL 124 Ca -0.34 0.80 -0.11 0.00 -1.81 0.00 0.00 61.98 60.52 3h1c s VAL 124 Cb 0.12 -3.75 0.02 0.00 0.56 0.00 0.00 36.38 33.34 3h1c s VAL 124 CO 0.47 0.35 1.07 0.21 -0.31 0.00 0.00 175.10 176.89 3h1c s ASN 125 N 0.57 5.07 0.00 4.85 2.47 -1.26 -4.46 114.94 122.17 3h1c s ASN 125 Ca 0.22 1.74 0.17 0.00 0.42 0.00 0.00 52.86 55.41 3h1c s ASN 125 Cb -0.14 -2.51 0.29 0.00 -1.45 0.00 0.00 41.25 37.44 3h1c s ASN 125 CO 0.08 -1.66 1.21 -0.81 -3.72 0.00 0.00 177.10 172.20 3h1c n PRO 126 N -3.14 2.04 0.00 0.43 -0.04 -1.26 -4.53 135.00 128.50 3h1c n PRO 126 Ca 0.08 -1.91 0.00 0.00 -0.04 0.00 0.00 63.50 61.63 3h1c n PRO 126 Cb 0.53 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 3h1c n PRO 126 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3h1c n ASP 127 N 1.04 0.00 0.32 3.54 8.00 -1.26 -1.58 116.55 126.61 3h1c n ASP 127 Ca 0.14 0.83 0.22 0.00 0.71 0.00 0.00 54.79 56.69 3h1c n ASP 127 Cb 0.48 -0.33 1.16 0.00 -0.02 0.00 0.00 41.12 42.41 3h1c n ASP 127 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3h1c h ILE 128 N 0.00 0.00 -0.27 0.53 2.04 -1.97 0.22 117.51 118.06 3h1c h ILE 128 Ca 0.00 -0.01 -0.17 0.00 1.00 0.00 0.00 64.86 65.68 3h1c h ILE 128 Cb 0.00 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 3h1c h ILE 128 CO 0.00 0.00 -0.51 0.58 0.00 0.00 0.00 178.15 178.22 3h1c h VAL 129 N 0.00 1.29 0.00 1.67 2.07 -1.72 -2.96 116.25 116.60 3h1c h VAL 129 Ca 0.00 -1.71 -0.13 0.00 0.82 0.00 0.00 66.70 65.68 3h1c h VAL 129 Cb 0.01 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 3h1c h VAL 129 CO 0.00 0.55 -0.63 0.00 0.02 0.00 0.00 177.57 177.51 3h1c h ALA 130 N 0.82 0.92 0.00 1.67 0.00 0.46 -3.14 119.26 119.99 3h1c h ALA 130 Ca 0.02 -0.57 -0.12 0.00 0.00 0.00 0.00 54.91 54.24 3h1c h ALA 130 Cb 1.09 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3h1c h ALA 130 CO 0.11 0.79 -0.56 0.52 0.00 0.00 0.00 179.25 180.11 3h1c h MET 131 N 0.00 0.00 -0.22 0.00 2.07 -1.44 -2.52 114.93 112.81 3h1c h MET 131 Ca -0.01 0.00 -0.15 0.00 -2.07 0.00 0.00 59.70 57.47 3h1c h MET 131 Cb 1.14 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.87 3h1c h MET 131 CO 0.08 0.56 -0.48 0.82 1.07 0.00 0.00 176.91 178.96 3h1c h ILE 132 N 0.00 1.31 -0.24 -1.22 2.04 -1.49 -2.79 117.51 115.12 3h1c h ILE 132 Ca -0.01 -1.69 -0.03 0.00 1.00 0.00 0.00 64.86 64.13 3h1c h ILE 132 Cb 1.00 1.66 -0.01 0.00 -0.74 0.00 0.00 36.82 38.73 3h1c h ILE 132 CO 0.07 0.53 0.05 1.23 0.00 0.00 0.00 178.15 180.03 3h1c h GLY 133 N 1.03 0.42 2.00 5.37 0.00 -1.46 0.21 103.07 110.64 3h1c h GLY 133 Ca 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3h1c h GLY 133 CO 0.09 0.25 0.00 0.00 0.00 0.00 0.00 176.54 176.89 3h1c h ALA 134 N 0.86 1.00 0.09 3.60 0.00 -1.52 0.55 119.26 123.84 3h1c h ALA 134 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.67 3h1c h ALA 134 Cb 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3h1c h ALA 134 CO 0.00 0.00 -1.65 1.03 0.00 0.00 0.00 179.25 178.63 3h1c h SER 135 N 0.00 0.29 0.15 0.00 0.87 -1.16 -3.29 113.55 110.41 3h1c h SER 135 Ca 0.00 -0.48 -0.22 0.00 -1.23 0.00 0.00 61.79 59.86 3h1c h SER 135 Cb 0.38 -0.09 0.02 0.00 -0.44 0.00 0.00 62.40 62.27 3h1c h SER 135 CO 0.00 1.41 -1.00 0.00 -0.53 0.00 0.00 176.83 176.71 3h1c h ALA 136 N 0.55 -0.05 -0.24 6.23 0.00 -0.22 -3.27 119.26 122.25 3h1c h ALA 136 Ca -0.28 -0.79 -0.04 0.00 0.00 0.00 0.00 54.91 53.80 3h1c h ALA 136 Cb 2.01 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.97 3h1c h ALA 136 CO 0.13 0.49 -0.00 0.00 0.00 0.00 0.00 179.25 179.87 3h1c h ALA 137 N 0.06 0.32 0.00 0.00 0.00 -1.10 -2.49 119.26 116.06 3h1c h ALA 137 Ca -0.19 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 3h1c h ALA 137 Cb 1.72 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 3h1c h ALA 137 CO 0.15 0.06 -0.22 -0.07 0.00 0.00 0.00 179.25 179.17 3h1c h LEU 138 N 0.20 0.00 -0.15 0.00 3.38 -1.73 0.14 115.31 117.14 3h1c h LEU 138 Ca 0.07 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 3h1c h LEU 138 Cb 0.42 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 3h1c h LEU 138 CO 0.01 0.22 -0.65 0.77 0.09 0.00 0.00 178.44 178.88 3h1c h SER 139 N 0.00 0.00 0.84 -0.43 4.64 -1.60 -3.26 113.55 113.74 3h1c h SER 139 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h1c h SER 139 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3h1c h SER 139 CO 0.03 0.65 -0.57 0.18 -0.87 0.00 0.00 176.83 176.25 3h1c n LEU 140 N -3.33 0.66 -0.09 5.97 4.32 -0.40 -4.23 117.00 119.90 3h1c n LEU 140 Ca 0.01 0.22 -0.09 0.00 -0.02 0.00 0.00 56.01 56.13 3h1c n LEU 140 Cb 0.77 -0.21 0.06 0.00 -1.62 0.00 0.00 43.42 42.42 3h1c n LEU 140 CO 0.42 -0.03 0.66 0.77 -1.22 0.00 0.00 177.39 177.99 3h1c h SER 141 N 0.00 0.83 0.00 -1.43 4.64 -0.84 -2.73 113.55 114.02 3h1c h SER 141 Ca 0.00 -0.32 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 3h1c h SER 141 Cb 0.70 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3h1c h SER 141 CO 0.00 1.05 0.00 0.61 -0.87 0.00 0.00 176.83 177.62 3h1c n GLY 142 N -0.13 3.22 3.71 -0.77 0.00 -1.26 -4.82 105.19 105.13 3h1c n GLY 142 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.79 2.40 -0.58 -0.61 1.01 -1.26 -0.04 121.20 119.34 3h1c s ILE 143 Ca 0.00 0.16 -0.34 0.00 0.00 0.00 0.00 60.65 60.48 3h1c s ILE 143 Cb 0.00 -3.11 -0.15 0.00 0.01 0.00 0.00 42.46 39.22 3h1c s ILE 143 CO 0.00 0.01 2.36 -0.81 0.00 0.00 0.00 174.94 176.50 3h1c n PRO 144 N 4.64 0.61 -3.55 2.79 -0.04 -1.26 -4.87 135.00 133.32 3h1c n PRO 144 Ca 0.16 0.11 -0.11 0.00 -0.04 0.00 0.00 63.50 63.62 3h1c n PRO 144 Cb 0.37 -2.22 -0.10 0.00 -0.04 0.00 0.00 33.50 31.51 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 8.47 -0.67 0.70 0.54 5.36 -1.26 -4.46 117.98 126.65 3h1c s PHE 145 Ca 1.16 1.06 -0.11 0.00 -0.96 0.00 0.00 56.93 58.08 3h1c s PHE 145 Cb -0.95 0.07 0.01 0.00 -0.34 0.00 0.00 43.02 41.82 3h1c s PHE 145 CO 0.48 -0.54 1.07 -0.80 -1.46 0.00 0.00 175.22 173.97 3h1c s ASN 146 N 2.52 5.47 0.00 6.13 0.01 -1.16 -4.88 114.94 123.02 3h1c s ASN 146 Ca 0.04 1.38 0.00 0.00 -0.71 0.00 0.00 52.86 53.57 3h1c s ASN 146 Cb -0.13 -2.26 0.00 0.00 0.41 0.00 0.00 41.25 39.27 3h1c s ASN 146 CO -0.13 -1.36 0.00 0.61 -1.51 0.00 0.00 177.10 174.72 3h1c n GLY 147 N -2.48 0.21 3.90 0.66 0.00 -1.26 -4.70 105.19 101.52 3h1c n GLY 147 Ca 0.07 -1.38 -0.28 0.00 0.00 0.00 0.00 46.02 44.42 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 0.00 2.69 0.38 1.61 0.04 -1.26 -4.78 135.00 133.68 3h1c s PRO 148 Ca 0.00 0.15 -0.18 0.00 0.04 0.00 0.00 61.00 61.00 3h1c s PRO 148 Cb 0.00 -2.13 -0.10 0.00 0.04 0.00 0.00 34.50 32.31 3h1c s PRO 148 CO 0.00 -1.00 0.86 0.96 0.04 0.00 0.00 177.00 177.85 3h1c s ILE 149 N -3.23 4.51 0.01 0.56 -4.36 -1.26 -4.31 121.20 113.11 3h1c s ILE 149 Ca 0.57 1.26 0.00 0.00 -0.26 0.00 0.00 60.65 62.23 3h1c s ILE 149 Cb -0.11 -3.61 -0.04 0.00 1.25 0.00 0.00 42.46 39.96 3h1c s ILE 149 CO 0.48 -0.26 0.06 -0.83 0.24 0.00 0.00 174.94 174.63 3h1c s GLY 150 N -2.21 1.98 -0.17 6.27 0.00 -0.84 -4.77 107.32 107.58 3h1c s GLY 150 Ca 0.58 -0.91 -0.02 0.00 0.00 0.00 0.00 44.72 44.37 3h1c s GLY 150 CO 0.15 -0.79 -0.08 0.00 0.00 0.00 0.00 173.10 172.38 3h1c s ALA 151 N -1.19 2.77 -0.06 3.20 0.00 -1.26 -3.62 121.76 121.60 3h1c s ALA 151 Ca 0.23 -1.00 -0.05 0.00 0.00 0.00 0.00 51.96 51.14 3h1c s ALA 151 Cb -0.12 -1.49 0.02 0.00 0.00 0.00 0.00 23.12 21.53 3h1c s ALA 151 CO 0.14 -0.06 0.15 0.00 0.00 0.00 0.00 175.76 175.98 3h1c s ALA 152 N 0.86 -0.35 -0.14 0.00 0.00 -1.06 -4.83 121.76 116.23 3h1c s ALA 152 Ca -0.02 0.46 -0.01 0.00 0.00 0.00 0.00 51.96 52.38 3h1c s ALA 152 Cb -0.15 -0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 3h1c s ALA 152 CO 0.01 -0.08 -0.10 0.50 0.00 0.00 0.00 175.76 176.09 3h1c s ARG 153 N 0.23 3.49 -0.16 0.00 3.52 -1.26 -1.16 118.95 123.61 3h1c s ARG 153 Ca -0.01 -0.63 -0.02 0.00 -0.13 0.00 0.00 55.73 54.94 3h1c s ARG 153 Cb -0.02 -2.73 -0.02 0.00 -1.56 0.00 0.00 34.95 30.61 3h1c s ARG 153 CO -0.01 0.22 -0.08 0.08 -0.81 0.00 0.00 175.30 174.71 3h1c s VAL 154 N 0.36 3.42 0.49 7.11 1.01 -0.20 0.07 120.40 132.65 3h1c s VAL 154 Ca -0.08 -0.52 0.07 0.00 0.00 0.00 0.00 61.98 61.45 3h1c s VAL 154 Cb -0.15 -2.48 0.02 0.00 0.00 0.00 0.00 36.38 33.76 3h1c s VAL 154 CO 0.05 0.49 0.46 -0.83 0.00 0.00 0.00 175.10 175.27 3h1c s GLY 155 N 0.60 2.15 -0.30 4.51 0.00 0.90 -2.77 107.32 112.40 3h1c s GLY 155 Ca -0.05 -1.70 0.00 0.00 0.00 0.00 0.00 44.72 42.97 3h1c s GLY 155 CO 0.03 -1.78 0.32 -0.47 0.00 0.00 0.00 173.10 171.19 3h1c s TYR 156 N -2.61 -0.46 -0.07 1.90 5.04 -1.22 -2.03 117.35 117.90 3h1c s TYR 156 Ca 0.46 -0.27 0.03 0.00 -2.44 0.00 0.00 57.07 54.84 3h1c s TYR 156 Cb -0.03 -0.44 0.01 0.00 0.35 0.00 0.00 41.96 41.85 3h1c s TYR 156 CO 0.27 -0.93 -0.15 0.42 -1.34 0.00 0.00 175.55 173.83 3h1c s ILE 157 N 2.20 1.31 -1.33 3.14 1.09 -0.85 -1.65 121.20 125.11 3h1c s ILE 157 Ca 0.11 -0.59 -0.05 0.00 -1.10 0.00 0.00 60.65 59.02 3h1c s ILE 157 Cb -0.14 -1.17 0.02 0.00 -1.06 0.00 0.00 42.46 40.10 3h1c s ILE 157 CO -0.27 0.39 0.97 0.59 -0.10 0.00 0.00 174.94 176.52 3h1c n ASN 158 N 3.70 -3.50 -3.05 3.58 3.02 -1.26 -2.46 115.26 115.29 3h1c n ASN 158 Ca -0.22 -0.68 -0.22 0.00 -0.03 0.00 0.00 54.58 53.44 3h1c n ASN 158 Cb 0.52 -4.60 0.02 0.00 -0.61 0.00 0.00 39.78 35.10 3h1c n ASN 158 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3h1c n ASP 159 N -3.03 -5.08 -3.82 6.41 8.00 -1.26 -4.98 116.55 112.80 3h1c n ASP 159 Ca -0.15 -0.26 -0.12 0.00 0.71 0.00 0.00 54.79 54.96 3h1c n ASP 159 Cb 0.62 -4.15 -0.12 0.00 -0.02 0.00 0.00 41.12 37.45 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 -5.71 0.29 0.11 -1.24 2.00 -1.03 -5.15 119.66 108.93 3h1c s GLN 160 Ca 0.29 0.13 -0.30 0.00 -2.00 0.00 0.00 55.36 53.48 3h1c s GLN 160 Cb -0.14 0.14 -0.06 0.00 0.80 0.00 0.00 33.01 33.75 3h1c s GLN 160 CO 0.36 -0.05 1.01 0.71 -0.50 0.00 0.00 175.29 176.82 3h1c s TYR 161 N -0.23 3.72 -0.12 1.67 1.51 -1.26 -2.00 117.35 120.64 3h1c s TYR 161 Ca -0.03 1.71 0.03 0.00 -1.01 0.00 0.00 57.07 57.77 3h1c s TYR 161 Cb -0.03 -3.13 0.01 0.00 -0.11 0.00 0.00 41.96 38.70 3h1c s TYR 161 CO 0.01 -0.08 -0.22 0.08 -1.11 0.00 0.00 175.55 174.23 3h1c s VAL 162 N 0.17 1.99 0.01 0.71 1.01 -0.86 -4.96 120.40 118.47 3h1c s VAL 162 Ca 0.49 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 61.21 3h1c s VAL 162 Cb -0.25 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 3h1c s VAL 162 CO 0.31 0.54 1.08 -0.22 0.00 0.00 0.00 175.10 176.80 3h1c s LEU 163 N 0.68 4.35 -0.52 3.92 2.96 -1.26 -0.07 118.68 128.75 3h1c s LEU 163 Ca -0.11 1.79 -0.23 0.00 -0.22 0.00 0.00 54.13 55.36 3h1c s LEU 163 Cb -0.16 -3.57 0.03 0.00 0.50 0.00 0.00 46.19 42.99 3h1c s LEU 163 CO 0.01 -0.38 0.64 0.59 -1.32 0.00 0.00 176.35 175.89 3h1c n ASN 164 N 4.13 -6.54 -4.76 3.68 3.02 0.11 -4.88 115.26 110.03 3h1c n ASN 164 Ca 0.08 0.01 -0.40 0.00 -0.03 0.00 0.00 54.58 54.24 3h1c n ASN 164 Cb 0.49 -3.37 -0.06 0.00 -0.61 0.00 0.00 39.78 36.23 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 -2.85 4.75 0.89 3.52 0.04 -1.26 -5.00 135.00 135.09 3h1c s PRO 165 Ca 0.25 1.37 -0.14 0.00 0.04 0.00 0.00 61.00 62.53 3h1c s PRO 165 Cb -0.04 -3.28 0.14 0.00 0.04 0.00 0.00 34.50 31.35 3h1c s PRO 165 CO 0.83 0.51 1.22 0.95 0.04 0.00 0.00 177.00 180.55 3h1c s THR 166 N -1.05 1.99 0.42 1.26 -4.23 -1.26 -4.75 115.64 108.00 3h1c s THR 166 Ca 0.40 0.00 0.08 0.00 -1.18 0.00 0.00 61.69 60.99 3h1c s THR 166 Cb -0.25 -2.95 0.26 0.00 1.34 0.00 0.00 72.50 70.90 3h1c s THR 166 CO 0.30 0.00 2.06 1.56 -0.54 0.00 0.00 174.62 178.00 3h1c h GLN 167 N -1.37 0.47 -0.01 3.99 1.08 -1.79 0.24 115.11 117.72 3h1c h GLN 167 Ca -0.46 -0.03 -0.18 0.00 -1.45 0.00 0.00 58.65 56.53 3h1c h GLN 167 Cb 1.29 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 28.60 3h1c h GLN 167 CO 0.54 0.32 -0.80 -0.44 -0.95 0.00 0.00 178.83 177.51 3h1c h ASP 168 N 0.49 0.17 1.43 1.46 3.32 -1.90 -3.24 116.42 118.14 3h1c h ASP 168 Ca 0.13 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 3h1c h ASP 168 Cb -0.03 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 3h1c h ASP 168 CO -0.03 0.90 -0.51 -0.33 -1.72 0.00 0.00 179.24 177.55 3h1c h GLU 169 N 0.08 0.00 0.00 3.56 5.08 -1.59 -3.25 114.58 118.46 3h1c h GLU 169 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3h1c h GLU 169 Cb 1.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.65 3h1c h GLU 169 CO 0.12 0.51 0.00 -0.07 -1.00 0.00 0.00 179.01 178.57 3h1c h LEU 170 N 0.00 0.00 -1.13 1.33 3.38 -0.60 -2.75 115.31 115.54 3h1c h LEU 170 Ca -0.01 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 3h1c h LEU 170 Cb 1.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 3h1c h LEU 170 CO 0.07 0.00 -0.33 0.11 0.09 0.00 0.00 178.44 178.37 3h1c h LYS 171 N 0.00 0.00 0.00 1.13 1.57 -1.61 -3.09 116.57 114.57 3h1c h LYS 171 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3h1c h LYS 171 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.96 3h1c h LYS 171 CO 0.00 0.33 -0.93 0.39 -0.57 0.00 0.00 179.45 178.68 3h1c n GLU 172 N -3.62 1.47 -2.02 3.15 -0.58 -1.18 -5.01 120.64 112.85 3h1c n GLU 172 Ca -0.01 -0.02 -0.32 0.00 -0.42 0.00 0.00 57.16 56.38 3h1c n GLU 172 Cb 0.45 -1.28 0.01 0.00 -0.57 0.00 0.00 31.44 30.05 3h1c n GLU 172 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3h1c s SER 173 N -2.75 5.83 -0.20 1.62 0.15 -1.05 -4.87 113.70 112.43 3h1c s SER 173 Ca 0.04 1.76 -0.01 0.00 0.70 0.00 0.00 55.95 58.44 3h1c s SER 173 Cb 0.12 -2.52 -0.13 0.00 -1.71 0.00 0.00 66.02 61.78 3h1c s SER 173 CO 0.67 -1.13 -0.20 0.29 1.20 0.00 0.00 173.24 174.07 3h1c n LYS 174 N -2.13 0.50 -4.63 5.44 4.01 -0.66 -4.96 118.16 115.73 3h1c n LYS 174 Ca 0.08 0.13 -0.34 0.00 -0.51 0.00 0.00 58.31 57.68 3h1c n LYS 174 Cb 0.53 -1.38 -0.11 0.00 -0.51 0.00 0.00 35.03 33.56 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 -6.34 3.15 -0.30 -0.35 0.20 -1.26 -2.84 118.68 110.92 3h1c s LEU 175 Ca -0.28 -0.04 -0.03 0.00 0.69 0.00 0.00 54.13 54.48 3h1c s LEU 175 Cb 0.08 -1.69 0.11 0.00 -0.43 0.00 0.00 46.19 44.26 3h1c s LEU 175 CO 0.45 0.35 0.14 -0.62 -0.29 0.00 0.00 176.35 176.38 3h1c s ASP 176 N -0.75 3.52 0.05 3.68 2.15 0.12 -3.46 116.67 121.98 3h1c s ASP 176 Ca 0.11 -1.47 0.05 0.00 0.43 0.00 0.00 52.55 51.68 3h1c s ASP 176 Cb -0.11 -0.42 -0.02 0.00 -0.30 0.00 0.00 42.92 42.06 3h1c s ASP 176 CO 0.01 -0.42 -0.15 -1.48 -0.17 0.00 0.00 175.17 172.97 3h1c s LEU 177 N 1.88 2.21 -0.22 -1.34 0.05 -1.12 -0.36 118.68 119.79 3h1c s LEU 177 Ca 0.10 -0.52 -0.04 0.00 0.05 0.00 0.00 54.13 53.73 3h1c s LEU 177 Cb -0.17 -0.62 -0.01 0.00 -2.05 0.00 0.00 46.19 43.34 3h1c s LEU 177 CO -0.30 0.01 -0.04 -0.69 -0.55 0.00 0.00 176.35 174.78 3h1c s VAL 178 N -0.98 3.39 -0.12 1.48 1.01 0.12 -1.03 120.40 124.26 3h1c s VAL 178 Ca 0.01 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 3h1c s VAL 178 Cb -0.09 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 3h1c s VAL 178 CO 0.02 0.42 -0.09 0.54 0.00 0.00 0.00 175.10 175.99 3h1c s VAL 179 N 1.46 3.42 0.03 2.92 0.11 -0.31 -1.57 120.40 126.45 3h1c s VAL 179 Ca 0.06 -0.54 0.03 0.00 -2.93 0.00 0.00 61.98 58.59 3h1c s VAL 179 Cb -0.14 -2.44 -0.02 0.00 -1.53 0.00 0.00 36.38 32.25 3h1c s VAL 179 CO -0.03 0.53 -0.09 0.00 -3.33 0.00 0.00 175.10 172.18 3h1c s ALA 180 N 0.07 0.76 0.00 1.54 0.00 -1.11 -2.57 121.76 120.45 3h1c s ALA 180 Ca -0.03 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.30 3h1c s ALA 180 Cb -0.14 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.89 3h1c s ALA 180 CO 0.04 0.11 0.00 0.41 0.00 0.00 0.00 175.76 176.32 3h1c n GLY 181 N 2.09 1.55 3.77 0.00 0.00 -1.24 -0.54 105.19 110.81 3h1c n GLY 181 Ca -0.18 -0.84 -0.30 0.00 0.00 0.00 0.00 46.02 44.70 3h1c n GLY 181 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3h1c s THR 182 N -2.00 1.81 0.33 2.61 -1.32 -0.19 -1.98 115.64 114.91 3h1c s THR 182 Ca 0.00 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.49 3h1c s THR 182 Cb 0.00 -2.75 0.24 0.00 -1.51 0.00 0.00 72.50 68.48 3h1c s THR 182 CO 0.00 0.00 1.97 -0.08 -2.21 0.00 0.00 174.62 174.30 3h1c h GLU 183 N -2.07 0.90 0.04 7.08 4.81 -1.87 -3.17 114.58 120.29 3h1c h GLU 183 Ca -0.45 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 58.56 3h1c h GLU 183 Cb 1.27 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 30.47 3h1c h GLU 183 CO 0.37 0.63 -0.62 0.00 -0.73 0.00 0.00 179.01 178.66 3h1c h ALA 184 N 1.53 0.02 -2.63 2.92 0.00 -1.97 -3.49 119.26 115.65 3h1c h ALA 184 Ca 0.24 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 3h1c h ALA 184 Cb -0.04 0.05 -0.13 0.00 0.00 0.00 0.00 17.79 17.67 3h1c h ALA 184 CO -0.05 0.33 -0.27 0.00 0.00 0.00 0.00 179.25 179.26 3h1c s ALA 185 N -2.97 -0.31 0.52 0.00 0.00 -1.20 -4.86 121.76 112.95 3h1c s ALA 185 Ca -0.14 -0.60 -0.17 0.00 0.00 0.00 0.00 51.96 51.05 3h1c s ALA 185 Cb 0.02 0.70 -0.07 0.00 0.00 0.00 0.00 23.12 23.77 3h1c s ALA 185 CO 0.81 -0.61 1.01 0.08 0.00 0.00 0.00 175.76 177.05 3h1c s VAL 186 N -3.90 4.23 0.00 0.00 1.01 -1.26 -1.02 120.40 119.46 3h1c s VAL 186 Ca 0.10 1.15 0.00 0.00 0.00 0.00 0.00 61.98 63.23 3h1c s VAL 186 Cb 0.03 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.83 3h1c s VAL 186 CO -0.06 -0.53 0.00 0.18 0.00 0.00 0.00 175.10 174.69 3h1c n LEU 187 N -1.49 0.16 -4.51 3.92 4.77 0.30 -4.77 117.00 115.38 3h1c n LEU 187 Ca 0.08 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.80 3h1c n LEU 187 Cb 0.53 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.54 3h1c n LEU 187 CO 0.44 -0.11 -0.20 -0.32 -1.33 0.00 0.00 177.39 175.87 3h1c s MET 188 N -1.98 1.91 -0.30 3.23 0.00 -0.09 -1.86 119.30 120.21 3h1c s MET 188 Ca 0.00 -2.15 -0.14 0.00 0.00 0.00 0.00 55.69 53.39 3h1c s MET 188 Cb 0.00 -0.64 0.15 0.00 0.00 0.00 0.00 34.83 34.34 3h1c s MET 188 CO 0.00 -0.45 0.90 0.08 0.00 0.00 0.00 175.02 175.55 3h1c s VAL 189 N -3.22 -0.50 -0.25 10.11 1.01 -0.81 -2.76 120.40 123.98 3h1c s VAL 189 Ca 0.25 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.21 3h1c s VAL 189 Cb 0.03 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.43 3h1c s VAL 189 CO 0.14 0.00 -0.06 -0.70 0.00 0.00 0.00 175.10 174.48 3h1c s GLU 190 N 2.33 2.87 0.22 2.72 2.56 -0.61 -0.98 118.70 127.81 3h1c s GLU 190 Ca -0.05 -0.95 0.10 0.00 0.00 0.00 0.00 54.97 54.07 3h1c s GLU 190 Cb -0.07 -2.99 -0.04 0.00 2.00 0.00 0.00 34.13 33.03 3h1c s GLU 190 CO -0.18 -0.38 -0.12 -1.54 -0.56 0.00 0.00 175.26 172.48 3h1c s SER 191 N 1.34 4.05 -0.34 -1.70 1.04 -1.16 -0.71 113.70 116.22 3h1c s SER 191 Ca 0.01 -0.73 0.05 0.00 0.48 0.00 0.00 55.95 55.75 3h1c s SER 191 Cb -0.16 -0.59 0.17 0.00 0.10 0.00 0.00 66.02 65.54 3h1c s SER 191 CO -0.04 0.07 0.49 -0.70 0.98 0.00 0.00 173.24 174.04 3h1c s GLU 192 N -3.12 0.59 0.10 4.02 2.12 0.52 -4.43 118.70 118.50 3h1c s GLU 192 Ca 0.27 -0.10 0.00 0.00 0.36 0.00 0.00 54.97 55.49 3h1c s GLU 192 Cb -0.07 -0.18 0.00 0.00 0.26 0.00 0.00 34.13 34.13 3h1c s GLU 192 CO 0.15 -1.11 0.00 0.00 -0.54 0.00 0.00 175.26 173.76 3h1c n ALA 193 N 4.89 0.08 -1.58 6.30 0.00 -0.42 -0.70 120.51 129.08 3h1c n ALA 193 Ca 0.06 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.07 3h1c n ALA 193 Cb 0.51 0.24 0.00 0.00 0.00 0.00 0.00 19.45 20.20 3h1c n ALA 193 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3h1c n GLN 194 N -0.25 0.00 -1.27 0.00 1.13 -1.13 -4.58 117.38 111.29 3h1c n GLN 194 Ca -0.04 0.00 0.01 0.00 -1.94 0.00 0.00 57.00 55.03 3h1c n GLN 194 Cb 0.12 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.47 3h1c n GLN 194 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3h1c n LEU 195 N 0.00 0.50 -4.06 1.08 4.77 -1.26 -4.15 117.00 113.89 3h1c n LEU 195 Ca 0.00 -1.86 -0.23 0.00 -0.03 0.00 0.00 56.01 53.89 3h1c n LEU 195 Cb 0.00 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.22 3h1c n LEU 195 CO 0.00 0.67 -0.44 0.18 -1.33 0.00 0.00 177.39 176.47 3h1c n LEU 196 N 0.34 -1.90 0.00 2.23 4.77 -1.24 -3.87 117.00 117.32 3h1c n LEU 196 Ca -0.01 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 3h1c n LEU 196 Cb 1.00 -0.76 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 3h1c n LEU 196 CO -0.05 -3.00 0.00 -1.54 -1.33 0.00 0.00 177.39 171.47 3h1c n SER 197 N -0.37 0.00 0.09 -1.43 3.41 -1.26 -0.98 113.62 113.07 3h1c n SER 197 Ca 0.03 -0.99 -0.13 0.00 -0.26 0.00 0.00 58.87 57.51 3h1c n SER 197 Cb 0.45 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.32 3h1c n SER 197 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3h1c h GLU 198 N 0.00 0.30 -0.06 4.33 3.07 -1.95 -3.17 114.58 117.09 3h1c h GLU 198 Ca 0.00 -0.39 -0.17 0.00 -0.50 0.00 0.00 59.36 58.29 3h1c h GLU 198 Cb 0.00 0.13 0.01 0.00 -0.84 0.00 0.00 28.75 28.05 3h1c h GLU 198 CO 0.00 1.12 -0.64 0.22 -1.40 0.00 0.00 179.01 178.31 3h1c h ASP 199 N 0.13 0.67 1.42 1.42 3.58 -2.00 -3.12 116.42 118.53 3h1c h ASP 199 Ca -0.09 -0.69 -0.05 0.00 0.42 0.00 0.00 57.03 56.62 3h1c h ASP 199 Cb 1.73 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 42.58 3h1c h ASP 199 CO 0.17 1.26 -0.22 0.06 -2.88 0.00 0.00 179.24 177.63 3h1c h GLN 200 N 0.14 0.00 -0.09 0.28 3.07 -1.98 -2.45 115.11 114.08 3h1c h GLN 200 Ca -0.06 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 58.48 3h1c h GLN 200 Cb 1.30 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.86 3h1c h GLN 200 CO 0.13 0.22 -0.75 1.98 0.09 0.00 0.00 178.83 180.51 3h1c h MET 201 N 0.00 0.49 0.04 0.06 4.05 -1.61 -3.05 114.93 114.91 3h1c h MET 201 Ca -0.00 -0.41 -0.23 0.00 -0.28 0.00 0.00 59.70 58.78 3h1c h MET 201 Cb 1.00 0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.88 3h1c h MET 201 CO 0.03 1.04 -1.01 1.25 0.23 0.00 0.00 176.91 178.44 3h1c h LEU 202 N 0.33 0.34 -1.56 3.39 6.46 -1.51 -3.29 115.31 119.47 3h1c h LEU 202 Ca -0.04 -0.31 -0.04 0.00 -0.12 0.00 0.00 57.88 57.37 3h1c h LEU 202 Cb 1.33 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 41.15 3h1c h LEU 202 CO 0.13 1.16 -0.19 1.23 -0.62 0.00 0.00 178.44 180.15 3h1c h GLY 203 N 1.76 0.04 1.97 3.75 0.00 -1.45 -2.36 103.07 106.79 3h1c h GLY 203 Ca -0.08 -0.03 -0.13 0.00 0.00 0.00 0.00 47.33 47.10 3h1c h GLY 203 CO 0.16 0.02 -0.62 0.00 0.00 0.00 0.00 176.54 176.11 3h1c h ALA 204 N 1.77 0.96 -0.29 3.60 0.00 -1.60 -1.07 119.26 122.63 3h1c h ALA 204 Ca 0.01 -0.56 -0.15 0.00 0.00 0.00 0.00 54.91 54.20 3h1c h ALA 204 Cb 0.36 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3h1c h ALA 204 CO 0.03 0.77 -0.42 0.28 0.00 0.00 0.00 179.25 179.91 3h1c h VAL 205 N 0.02 1.29 -0.32 0.00 2.07 -1.53 -2.44 116.25 115.33 3h1c h VAL 205 Ca -0.01 -1.60 -0.15 0.00 0.82 0.00 0.00 66.70 65.76 3h1c h VAL 205 Cb 1.10 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 3h1c h VAL 205 CO 0.08 0.52 -0.41 0.58 0.02 0.00 0.00 177.57 178.36 3h1c h VAL 206 N 0.54 1.28 0.13 2.57 2.07 -1.42 -2.75 116.25 118.67 3h1c h VAL 206 Ca 0.03 -1.58 -0.00 0.00 0.82 0.00 0.00 66.70 65.96 3h1c h VAL 206 Cb 1.01 1.47 -0.00 0.00 -1.52 0.00 0.00 31.29 32.25 3h1c h VAL 206 CO 0.10 0.52 -0.07 0.15 0.02 0.00 0.00 177.57 178.28 3h1c h PHE 207 N 0.65 -0.18 -0.28 1.57 3.57 -1.18 -2.36 116.94 118.72 3h1c h PHE 207 Ca 0.05 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.48 3h1c h PHE 207 Cb 0.97 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.76 3h1c h PHE 207 CO 0.05 -0.11 -0.10 0.78 -2.23 0.00 0.00 178.31 176.70 3h1c h GLY 208 N -0.19 0.49 1.81 2.40 0.00 -1.47 -2.00 103.07 104.11 3h1c h GLY 208 Ca -0.01 -0.32 -0.11 0.00 0.00 0.00 0.00 47.33 46.89 3h1c h GLY 208 CO 0.02 0.30 -0.43 0.84 0.00 0.00 0.00 176.54 177.26 3h1c h HIS 209 N 0.42 0.24 0.02 5.60 -0.00 -1.39 -1.72 115.15 118.33 3h1c h HIS 209 Ca 0.08 -0.07 -0.21 0.00 -0.00 0.00 0.00 60.37 60.17 3h1c h HIS 209 Cb 0.44 -0.05 -0.01 0.00 -0.00 0.00 0.00 27.41 27.79 3h1c h HIS 209 CO 0.01 0.61 -0.95 0.93 -0.00 0.00 0.00 177.93 178.53 3h1c h GLU 210 N 0.17 0.18 0.03 5.26 5.08 -1.09 -3.32 114.58 120.89 3h1c h GLU 210 Ca 0.01 -0.23 -0.22 0.00 -1.00 0.00 0.00 59.36 57.93 3h1c h GLU 210 Cb 0.84 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 3h1c h GLU 210 CO 0.07 1.00 -0.98 1.96 -1.00 0.00 0.00 179.01 180.06 3h1c h GLN 211 N 0.09 0.21 0.00 2.33 1.08 -1.25 -3.23 115.11 114.34 3h1c h GLN 211 Ca -0.05 -0.26 0.00 0.00 -1.45 0.00 0.00 58.65 56.88 3h1c h GLN 211 Cb 1.61 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 29.13 3h1c h GLN 211 CO 0.14 1.03 0.00 0.00 -0.95 0.00 0.00 178.83 179.05 3h1c n GLN 212 N -3.60 0.35 0.27 1.46 10.64 -0.66 -3.52 117.38 122.32 3h1c n GLN 212 Ca -0.04 0.07 0.14 0.00 -1.83 0.00 0.00 57.00 55.33 3h1c n GLN 212 Cb 0.87 -1.50 0.79 0.00 -0.86 0.00 0.00 30.24 29.54 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 0.00 0.00 -0.37 2.61 1.08 -1.65 -2.55 115.11 114.23 3h1c h GLN 213 Ca 0.00 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.13 3h1c h GLN 213 Cb 0.20 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.62 3h1c h GLN 213 CO 0.00 0.08 -0.03 0.28 -0.95 0.00 0.00 178.83 178.21 3h1c h VAL 214 N 0.00 1.27 -0.55 -0.54 2.07 -1.82 -2.80 116.25 113.88 3h1c h VAL 214 Ca -0.00 -1.05 -0.05 0.00 0.82 0.00 0.00 66.70 66.42 3h1c h VAL 214 Cb 0.24 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 3h1c h VAL 214 CO 0.01 0.35 0.16 0.58 0.02 0.00 0.00 177.57 178.69 3h1c h VAL 215 N 0.49 1.24 -0.60 2.57 2.07 -1.72 -2.73 116.25 117.56 3h1c h VAL 215 Ca 0.10 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.80 3h1c h VAL 215 Cb 0.51 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 3h1c h VAL 215 CO 0.02 0.30 0.38 0.40 0.02 0.00 0.00 177.57 178.70 3h1c h ILE 216 N 0.76 1.17 -0.17 4.57 2.04 -1.51 -2.42 117.51 121.96 3h1c h ILE 216 Ca 0.17 -0.35 -0.11 0.00 1.00 0.00 0.00 64.86 65.58 3h1c h ILE 216 Cb 0.30 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 3h1c h ILE 216 CO -0.00 0.17 -0.37 1.56 0.00 0.00 0.00 178.15 179.50 3h1c h GLN 217 N 0.82 0.36 0.00 2.37 4.20 -1.44 -2.71 115.11 118.71 3h1c h GLN 217 Ca 0.22 -0.17 -0.13 0.00 0.06 0.00 0.00 58.65 58.63 3h1c h GLN 217 Cb -0.05 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 3h1c h GLN 217 CO -0.04 0.69 -0.61 -0.91 -0.67 0.00 0.00 178.83 177.28 3h1c h ASN 218 N 0.31 0.00 -0.06 1.46 2.35 -1.25 -2.93 115.58 115.45 3h1c h ASN 218 Ca 0.03 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.60 3h1c h ASN 218 Cb 0.80 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.18 3h1c h ASN 218 CO 0.06 0.61 -0.68 0.40 -1.65 0.00 0.00 177.43 176.17 3h1c h ILE 219 N 0.00 1.35 -0.42 2.81 2.04 -1.37 -3.07 117.51 118.85 3h1c h ILE 219 Ca -0.01 -2.00 0.02 0.00 1.00 0.00 0.00 64.86 63.87 3h1c h ILE 219 Cb 1.19 2.31 -0.02 0.00 -0.74 0.00 0.00 36.82 39.56 3h1c h ILE 219 CO 0.08 0.61 0.28 0.78 0.00 0.00 0.00 178.15 179.89 3h1c h ASN 220 N 0.18 0.42 0.75 1.72 2.35 -1.48 -0.89 115.58 118.64 3h1c h ASN 220 Ca -0.07 -0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.55 3h1c h ASN 220 Cb 1.34 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.60 3h1c h ASN 220 CO 0.14 0.30 -0.60 -0.33 -1.65 0.00 0.00 177.43 175.29 3h1c h GLU 221 N 0.49 0.00 0.00 0.81 4.39 -1.58 -3.18 114.58 115.51 3h1c h GLU 221 Ca 0.16 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.72 3h1c h GLU 221 Cb 0.05 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 3h1c h GLU 221 CO -0.04 0.60 -0.68 1.25 -1.16 0.00 0.00 179.01 178.97 3h1c h LEU 222 N 0.00 0.00 -0.52 1.33 6.46 -1.10 -2.90 115.31 118.57 3h1c h LEU 222 Ca -0.01 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.65 3h1c h LEU 222 Cb 1.13 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 41.05 3h1c h LEU 222 CO 0.08 0.68 -0.08 0.58 -0.62 0.00 0.00 178.44 179.08 3h1c h VAL 223 N 0.00 1.27 0.00 1.05 2.07 -1.29 0.78 116.25 120.13 3h1c h VAL 223 Ca -0.01 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.30 3h1c h VAL 223 Cb 1.37 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.13 3h1c h VAL 223 CO 0.09 0.43 0.00 0.29 0.02 0.00 0.00 177.57 178.40 3h1c n LYS 224 N -4.21 0.38 -0.10 1.57 4.01 -1.21 -1.70 118.16 116.90 3h1c n LYS 224 Ca 0.01 0.02 -0.17 0.00 -0.51 0.00 0.00 58.31 57.67 3h1c n LYS 224 Cb 0.38 -1.50 -0.09 0.00 -0.51 0.00 0.00 35.03 33.31 3h1c n LYS 224 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 3h1c n GLU 225 N -1.29 0.48 0.00 1.97 2.13 -1.00 -4.86 120.64 118.07 3h1c n GLU 225 Ca 0.13 0.14 0.00 0.00 0.66 0.00 0.00 57.16 58.09 3h1c n GLU 225 Cb 0.22 -1.35 0.00 0.00 0.27 0.00 0.00 31.44 30.59 3h1c n GLU 225 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3h1c n ALA 226 N -3.37 0.55 -1.77 4.31 0.00 0.23 -5.09 120.51 115.38 3h1c n ALA 226 Ca -0.37 -0.01 -0.39 0.00 0.00 0.00 0.00 53.44 52.67 3h1c n ALA 226 Cb 0.85 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.29 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 -0.25 2.89 0.48 0.00 0.00 -0.69 -5.01 107.32 104.75 3h1c s GLY 227 Ca 0.00 1.10 -0.21 0.00 0.00 0.00 0.00 44.72 45.62 3h1c s GLY 227 CO 0.00 1.65 1.05 0.54 0.00 0.00 0.00 173.10 176.34 3h1c s LYS 228 N -2.32 3.80 0.63 2.90 1.02 -1.03 -4.89 119.74 119.84 3h1c s LYS 228 Ca 0.58 1.41 -0.19 0.00 0.02 0.00 0.00 55.97 57.79 3h1c s LYS 228 Cb -0.34 -2.14 -0.02 0.00 -0.52 0.00 0.00 37.83 34.81 3h1c s LYS 228 CO 0.43 -0.44 1.31 -1.25 -0.92 0.00 0.00 175.35 174.48 3h1c s PRO 229 N -3.15 2.64 0.50 -1.68 0.04 -1.26 -4.33 135.00 127.76 3h1c s PRO 229 Ca 0.67 2.10 -0.22 0.00 0.04 0.00 0.00 61.00 63.59 3h1c s PRO 229 Cb -0.18 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 3h1c s PRO 229 CO 0.22 -1.54 1.23 -0.98 0.04 0.00 0.00 177.00 175.97 3h1c s ARG 230 N -3.31 3.46 0.32 4.56 3.03 -1.26 -4.45 118.95 121.30 3h1c s ARG 230 Ca 0.81 1.93 -0.29 0.00 2.03 0.00 0.00 55.73 60.21 3h1c s ARG 230 Cb -0.38 -2.30 -0.10 0.00 -1.03 0.00 0.00 34.95 31.14 3h1c s ARG 230 CO 0.41 -0.84 1.30 -1.58 -1.13 0.00 0.00 175.30 173.45 3h1c s TRP 231 N -1.47 3.09 -1.38 5.89 0.52 0.95 -4.93 118.94 121.60 3h1c s TRP 231 Ca 0.68 1.41 -0.12 0.00 0.02 0.00 0.00 56.10 58.09 3h1c s TRP 231 Cb -0.33 -3.66 0.09 0.00 -1.15 0.00 0.00 33.47 28.43 3h1c s TRP 231 CO 0.39 -1.81 2.05 -3.47 0.02 0.00 0.00 176.95 174.13 3h1c n ASP 232 N 0.94 4.42 -4.60 2.95 2.03 -1.26 -4.86 116.55 116.17 3h1c n ASP 232 Ca 0.00 -2.95 -0.34 0.00 0.52 0.00 0.00 54.79 52.02 3h1c n ASP 232 Cb 0.42 -1.59 -0.10 0.00 -0.72 0.00 0.00 41.12 39.12 3h1c n ASP 232 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 3h1c s TRP 233 N 2.16 3.15 -0.06 -0.67 -0.00 -1.26 -5.10 118.94 117.17 3h1c s TRP 233 Ca 0.44 -0.03 0.03 0.00 -0.00 0.00 0.00 56.10 56.54 3h1c s TRP 233 Cb 0.11 -1.97 0.01 0.00 -0.00 0.00 0.00 33.47 31.63 3h1c s TRP 233 CO -0.04 0.16 -0.12 1.14 -0.00 0.00 0.00 176.95 178.09 3h1c s GLN 234 N 0.06 1.59 0.69 5.86 1.03 -1.26 -5.12 119.66 122.52 3h1c s GLN 234 Ca 0.03 -0.42 -0.15 0.00 0.04 0.00 0.00 55.36 54.85 3h1c s GLN 234 Cb -0.13 -1.35 0.02 0.00 0.03 0.00 0.00 33.01 31.59 3h1c s GLN 234 CO 0.02 0.07 1.15 -1.25 -2.54 0.00 0.00 175.29 172.74 3h1c s PRO 235 N 0.50 2.47 0.07 9.60 0.04 -1.26 -4.93 135.00 141.49 3h1c s PRO 235 Ca -0.11 1.57 -0.32 0.00 0.04 0.00 0.00 61.00 62.17 3h1c s PRO 235 Cb -0.14 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 32.39 3h1c s PRO 235 CO 0.03 -1.54 1.81 -1.91 0.04 0.00 0.00 177.00 175.43 3h1c n GLU 236 N -2.57 2.53 -1.67 4.56 2.13 -1.26 -4.88 120.64 119.48 3h1c n GLU 236 Ca 0.12 0.92 -0.46 0.00 0.66 0.00 0.00 57.16 58.40 3h1c n GLU 236 Cb 0.51 -2.79 -0.03 0.00 0.27 0.00 0.00 31.44 29.40 3h1c n GLU 236 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3h1c n PRO 237 N 5.65 2.04 -1.93 5.31 -0.04 -1.26 -4.85 135.00 139.93 3h1c n PRO 237 Ca 0.19 0.73 -0.35 0.00 -0.04 0.00 0.00 63.50 64.03 3h1c n PRO 237 Cb 0.34 -2.44 -0.03 0.00 -0.04 0.00 0.00 33.50 31.33 3h1c n PRO 237 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3h1c s VAL 238 N 0.38 3.28 -0.60 0.52 -7.23 -1.26 -4.92 120.40 110.58 3h1c s VAL 238 Ca 0.73 0.07 -0.27 0.00 -1.81 0.00 0.00 61.98 60.71 3h1c s VAL 238 Cb -0.68 -3.73 0.01 0.00 0.56 0.00 0.00 36.38 32.54 3h1c s VAL 238 CO 0.44 -0.71 1.52 0.21 -0.31 0.00 0.00 175.10 176.26 3h1c s ASN 239 N 9.01 5.90 0.43 4.85 2.47 -1.26 -4.85 114.94 131.48 3h1c s ASN 239 Ca 0.74 0.19 0.28 0.00 0.42 0.00 0.00 52.86 54.49 3h1c s ASN 239 Cb -0.13 -2.54 0.93 0.00 -1.45 0.00 0.00 41.25 38.06 3h1c s ASN 239 CO 0.18 -1.91 1.80 -0.08 -3.72 0.00 0.00 177.10 173.37 3h1c h GLU 240 N 11.94 0.00 -0.33 0.43 4.81 -1.98 -2.80 114.58 126.65 3h1c h GLU 240 Ca -0.27 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.86 3h1c h GLU 240 Cb 1.10 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 3h1c h GLU 240 CO 1.20 0.00 -0.19 0.00 -0.73 0.00 0.00 179.01 179.29 3h1c h ALA 241 N 2.11 0.47 0.00 2.92 0.00 -2.00 -3.13 119.26 119.64 3h1c h ALA 241 Ca 0.00 -0.36 -0.24 0.00 0.00 0.00 0.00 54.91 54.31 3h1c h ALA 241 Cb 0.66 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3h1c h ALA 241 CO 0.00 0.41 -1.27 -0.07 0.00 0.00 0.00 179.25 178.32 3h1c h LEU 242 N 0.49 0.00 -0.86 0.00 3.38 -1.98 -3.02 115.31 113.33 3h1c h LEU 242 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3h1c h LEU 242 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 3h1c h LEU 242 CO 0.06 1.00 0.00 0.59 0.09 0.00 0.00 178.44 180.17 3h1c n ASN 243 N -3.23 0.61 -0.01 -0.43 4.13 -1.06 -1.03 115.26 114.25 3h1c n ASN 243 Ca -0.07 0.68 0.07 0.00 1.68 0.00 0.00 54.58 56.95 3h1c n ASN 243 Cb 0.98 -0.80 -0.11 0.00 -1.54 0.00 0.00 39.78 38.31 3h1c n ASN 243 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3h1c n ALA 244 N -1.76 2.71 0.09 5.41 0.00 -1.18 -4.07 120.51 121.70 3h1c n ALA 244 Ca 0.01 -0.35 -0.23 0.00 0.00 0.00 0.00 53.44 52.87 3h1c n ALA 244 Cb 0.18 -0.50 -0.15 0.00 0.00 0.00 0.00 19.45 18.97 3h1c n ALA 244 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3h1c h ARG 245 N 0.00 0.42 0.09 0.00 2.43 -1.25 -3.12 114.38 112.95 3h1c h ARG 245 Ca 0.00 -0.73 -0.28 0.00 -0.81 0.00 0.00 59.98 58.16 3h1c h ARG 245 Cb 0.62 0.27 0.02 0.00 -0.42 0.00 0.00 29.97 30.47 3h1c h ARG 245 CO 0.00 1.35 -1.18 0.28 -1.51 0.00 0.00 179.97 178.91 3h1c h VAL 246 N -0.03 1.32 0.00 0.20 2.07 -1.34 -3.31 116.25 115.17 3h1c h VAL 246 Ca -0.26 -2.48 -0.06 0.00 0.82 0.00 0.00 66.70 64.73 3h1c h VAL 246 Cb 2.00 2.63 -0.01 0.00 -1.52 0.00 0.00 31.29 34.39 3h1c h VAL 246 CO 0.20 0.75 -0.26 0.00 0.02 0.00 0.00 177.57 178.28 3h1c h ALA 247 N 0.40 1.39 0.00 1.67 0.00 -1.71 -0.59 119.26 120.42 3h1c h ALA 247 Ca -0.16 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3h1c h ALA 247 Cb 1.84 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.59 3h1c h ALA 247 CO 0.22 0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.80 3h1c n ALA 248 N -2.41 1.79 0.00 0.00 0.00 -1.18 -1.95 120.51 116.77 3h1c n ALA 248 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3h1c n ALA 248 Cb 0.34 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.53 3h1c n ALA 248 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3h1c n LEU 249 N -1.42 0.00 -0.08 0.00 0.00 -0.86 -4.89 117.00 109.76 3h1c n LEU 249 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 56.01 55.95 3h1c n LEU 249 Cb 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 43.42 43.52 3h1c n LEU 249 CO 0.14 0.00 -1.00 0.00 0.00 0.00 0.00 177.39 176.53 3h1c n ALA 250 N -1.80 1.71 0.21 1.96 0.00 -0.28 -4.57 120.51 117.72 3h1c n ALA 250 Ca 0.00 -0.65 0.07 0.00 0.00 0.00 0.00 53.44 52.86 3h1c n ALA 250 Cb 0.34 0.17 0.57 0.00 0.00 0.00 0.00 19.45 20.53 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 -0.07 0.10 -0.42 0.00 4.81 -1.58 0.49 114.58 117.91 3h1c h GLU 251 Ca -0.35 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 58.74 3h1c h GLU 251 Cb 1.50 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.85 3h1c h GLU 251 CO -0.07 0.10 -0.26 0.00 -0.73 0.00 0.00 179.01 178.05 3h1c h ALA 252 N 1.91 0.60 0.11 2.92 0.00 -1.83 -2.87 119.26 120.10 3h1c h ALA 252 Ca 0.03 -0.40 -0.29 0.00 0.00 0.00 0.00 54.91 54.24 3h1c h ALA 252 Cb 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3h1c h ALA 252 CO -0.00 0.61 -1.44 0.00 0.00 0.00 0.00 179.25 178.43 3h1c h ARG 253 N 0.75 0.23 0.00 0.00 3.08 -1.64 -3.33 114.38 113.47 3h1c h ARG 253 Ca 0.09 -0.39 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 3h1c h ARG 253 Cb 0.84 0.15 -0.00 0.00 0.08 0.00 0.00 29.97 31.03 3h1c h ARG 253 CO 0.07 1.11 -0.02 -0.07 -1.07 0.00 0.00 179.97 179.98 3h1c h LEU 254 N 0.06 0.00 -0.46 3.04 3.38 -1.01 -2.01 115.31 118.32 3h1c h LEU 254 Ca -0.20 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.59 3h1c h LEU 254 Cb 1.99 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.74 3h1c h LEU 254 CO 0.17 0.02 -0.63 -1.28 0.09 0.00 0.00 178.44 176.81 3h1c h SER 255 N 0.00 0.58 1.69 -0.43 0.87 -1.61 -3.15 113.55 111.51 3h1c h SER 255 Ca -0.00 -0.34 -0.01 0.00 -1.23 0.00 0.00 61.79 60.21 3h1c h SER 255 Cb 0.60 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.39 3h1c h SER 255 CO 0.00 1.07 -0.31 0.44 -0.53 0.00 0.00 176.83 177.50 3h1c h ASP 256 N 0.37 0.00 0.67 6.23 3.32 -1.61 -3.33 116.42 122.08 3h1c h ASP 256 Ca -0.01 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 3h1c h ASP 256 Cb 1.19 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.72 3h1c h ASP 256 CO 0.12 0.05 -0.57 0.00 -1.72 0.00 0.00 179.24 177.12 3h1c h ALA 257 N 1.95 0.98 -0.59 3.45 0.00 -1.33 -3.24 119.26 120.48 3h1c h ALA 257 Ca -0.00 -0.52 -0.31 0.00 0.00 0.00 0.00 54.91 54.08 3h1c h ALA 257 Cb 1.04 -0.09 -0.18 0.00 0.00 0.00 0.00 17.79 18.56 3h1c h ALA 257 CO 0.01 0.71 0.40 0.66 0.00 0.00 0.00 179.25 181.03 3h1c n TYR 258 N -3.74 1.82 0.11 0.00 4.01 -1.21 -3.57 117.16 114.57 3h1c n TYR 258 Ca -0.01 -1.39 0.01 0.00 -0.16 0.00 0.00 57.90 56.36 3h1c n TYR 258 Cb 0.59 -0.70 0.01 0.00 -0.31 0.00 0.00 39.34 38.93 3h1c n TYR 258 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3h1c n ARG 259 N -0.41 0.30 -2.65 -0.72 1.74 -1.22 -4.52 116.66 109.18 3h1c n ARG 259 Ca 0.35 -0.57 -0.41 0.00 -0.77 0.00 0.00 57.85 56.45 3h1c n ARG 259 Cb 1.13 -0.99 -0.04 0.00 -1.02 0.00 0.00 32.46 31.54 3h1c n ARG 259 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3h1c s ILE 260 N -0.36 4.42 -0.02 0.55 1.01 -1.23 -4.85 121.20 120.72 3h1c s ILE 260 Ca 0.03 1.91 -0.23 0.00 0.00 0.00 0.00 60.65 62.36 3h1c s ILE 260 Cb 0.02 -4.22 -0.21 0.00 0.01 0.00 0.00 42.46 38.06 3h1c s ILE 260 CO 0.04 0.25 1.14 0.74 0.00 0.00 0.00 174.94 177.11 3h1c h THR 261 N 4.23 1.47 -3.70 2.92 2.02 -1.90 -3.41 112.91 114.53 3h1c h THR 261 Ca -0.42 -1.69 -0.52 0.00 0.77 0.00 0.00 66.41 64.55 3h1c h THR 261 Cb 1.21 2.45 0.03 0.00 -1.74 0.00 0.00 68.15 70.10 3h1c h THR 261 CO 0.74 0.47 0.56 -0.62 0.37 0.00 0.00 175.52 177.04 3h1c s ASP 262 N -6.22 7.04 0.11 4.18 2.15 -1.26 -4.77 116.67 117.89 3h1c s ASP 262 Ca -0.15 2.40 -0.13 0.00 0.43 0.00 0.00 52.55 55.10 3h1c s ASP 262 Cb 0.02 -2.63 -0.13 0.00 -0.30 0.00 0.00 42.92 39.88 3h1c s ASP 262 CO 0.74 -0.35 1.34 0.50 -0.17 0.00 0.00 175.17 177.23 3h1c h LYS 263 N 4.19 0.81 -0.54 4.34 3.64 -1.99 -2.72 116.57 124.31 3h1c h LYS 263 Ca -0.47 -0.61 -0.08 0.00 -1.27 0.00 0.00 60.65 58.22 3h1c h LYS 263 Cb 1.22 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.12 3h1c h LYS 263 CO 0.69 1.22 0.00 1.96 -2.27 0.00 0.00 179.45 181.06 3h1c h GLN 264 N 0.56 0.92 -0.02 1.90 4.20 -1.99 -1.39 115.11 119.29 3h1c h GLN 264 Ca -0.03 -0.27 -0.18 0.00 0.06 0.00 0.00 58.65 58.24 3h1c h GLN 264 Cb 1.30 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.97 3h1c h GLN 264 CO 0.14 0.91 -0.79 0.93 -0.67 0.00 0.00 178.83 179.36 3h1c h GLU 265 N 0.85 0.19 0.03 1.46 5.08 -1.97 -2.94 114.58 117.26 3h1c h GLU 265 Ca 0.16 -0.18 -0.12 0.00 -1.00 0.00 0.00 59.36 58.22 3h1c h GLU 265 Cb 0.50 0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.81 3h1c h GLU 265 CO 0.02 0.88 -0.49 -0.09 -1.00 0.00 0.00 179.01 178.33 3h1c h ARG 266 N 0.11 0.28 0.00 2.33 2.43 -1.36 -2.82 114.38 115.36 3h1c h ARG 266 Ca -0.03 -0.34 -0.07 0.00 -0.81 0.00 0.00 59.98 58.73 3h1c h ARG 266 Cb 1.38 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 31.02 3h1c h ARG 266 CO 0.12 1.07 -0.33 1.88 -1.51 0.00 0.00 179.97 181.20 3h1c h TYR 267 N -0.35 0.00 0.00 2.20 0.05 -1.36 -0.51 116.97 117.00 3h1c h TYR 267 Ca -0.07 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.56 3h1c h TYR 267 Cb 1.26 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.98 3h1c h TYR 267 CO 0.18 0.33 -0.71 0.00 -1.05 0.00 0.00 178.16 176.91 3h1c h ALA 268 N 1.67 0.73 0.02 3.88 0.00 -1.61 -3.06 119.26 120.89 3h1c h ALA 268 Ca -0.00 -0.65 -0.06 0.00 0.00 0.00 0.00 54.91 54.20 3h1c h ALA 268 Cb 0.61 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.29 3h1c h ALA 268 CO 0.04 0.89 -0.24 0.37 0.00 0.00 0.00 179.25 180.31 3h1c h GLN 269 N 0.00 0.13 0.00 0.00 5.75 -1.13 -3.19 115.11 116.67 3h1c h GLN 269 Ca -0.01 -0.17 -0.02 0.00 -0.15 0.00 0.00 58.65 58.31 3h1c h GLN 269 Cb 1.33 0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.93 3h1c h GLN 269 CO 0.09 0.97 -0.08 -0.39 -2.65 0.00 0.00 178.83 176.77 3h1c h VAL 270 N -0.63 0.28 -0.15 2.39 -1.51 -1.23 -2.25 116.25 113.15 3h1c h VAL 270 Ca -0.04 -0.59 -0.20 0.00 -1.23 0.00 0.00 66.70 64.65 3h1c h VAL 270 Cb 1.07 1.46 0.00 0.00 -2.13 0.00 0.00 31.29 31.68 3h1c h VAL 270 CO 0.05 0.08 -0.70 -0.78 -1.23 0.00 0.00 177.57 174.99 3h1c h ASP 271 N 0.00 0.74 -0.33 4.19 3.58 -1.63 -2.11 116.42 120.86 3h1c h ASP 271 Ca -0.00 -0.46 -0.08 0.00 0.42 0.00 0.00 57.03 56.91 3h1c h ASP 271 Cb 0.45 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 3h1c h ASP 271 CO 0.01 1.22 -0.11 0.58 -2.88 0.00 0.00 179.24 178.06 3h1c h VAL 272 N 0.45 1.28 -0.69 2.25 2.07 -1.41 -0.67 116.25 119.53 3h1c h VAL 272 Ca -0.03 -1.19 -0.03 0.00 0.82 0.00 0.00 66.70 66.27 3h1c h VAL 272 Cb 1.30 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 32.40 3h1c h VAL 272 CO 0.14 0.39 0.32 0.40 0.02 0.00 0.00 177.57 178.83 3h1c h ILE 273 N 0.44 1.23 -0.11 4.57 2.04 -1.47 -1.98 117.51 122.22 3h1c h ILE 273 Ca 0.08 -0.68 -0.10 0.00 1.00 0.00 0.00 64.86 65.16 3h1c h ILE 273 Cb 0.62 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 3h1c h ILE 273 CO 0.04 0.28 -0.38 0.11 0.00 0.00 0.00 178.15 178.20 3h1c h LYS 274 N 0.97 0.24 0.13 2.37 1.57 -1.32 -2.99 116.57 117.54 3h1c h LYS 274 Ca 0.24 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 3h1c h LYS 274 Cb 0.15 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3h1c h LYS 274 CO -0.03 0.59 -0.06 0.77 -0.57 0.00 0.00 179.45 180.15 3h1c h SER 275 N 0.20 -0.15 1.26 0.86 0.02 -0.71 -3.24 113.55 111.80 3h1c h SER 275 Ca 0.02 -0.39 -0.08 0.00 -0.84 0.00 0.00 61.79 60.50 3h1c h SER 275 Cb 0.77 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 3h1c h SER 275 CO 0.06 0.37 -0.36 1.05 -1.14 0.00 0.00 176.83 176.81 3h1c h GLU 276 N -0.74 0.00 -0.20 3.45 4.11 -1.47 -2.10 114.58 117.63 3h1c h GLU 276 Ca -0.02 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.35 3h1c h GLU 276 Cb 0.53 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 3h1c h GLU 276 CO 0.03 0.36 -0.12 1.15 0.07 0.00 0.00 179.01 180.50 3h1c h THR 277 N 0.00 1.31 -0.38 -1.06 2.02 -1.65 -1.00 112.91 112.15 3h1c h THR 277 Ca -0.00 -1.21 -0.12 0.00 0.77 0.00 0.00 66.41 65.85 3h1c h THR 277 Cb 1.09 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 69.16 3h1c h THR 277 CO 0.05 0.37 -0.24 0.40 0.37 0.00 0.00 175.52 176.47 3h1c h ILE 278 N 0.13 1.27 -0.70 3.11 2.04 -1.57 -2.08 117.51 119.70 3h1c h ILE 278 Ca 0.04 -1.36 -0.02 0.00 1.00 0.00 0.00 64.86 64.53 3h1c h ILE 278 Cb 0.62 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 3h1c h ILE 278 CO 0.03 0.45 0.38 0.00 0.00 0.00 0.00 178.15 179.01 3h1c h ALA 279 N 1.06 1.34 -0.10 1.87 0.00 -1.29 0.13 119.26 122.27 3h1c h ALA 279 Ca 0.09 -0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.67 3h1c h ALA 279 Cb 0.75 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.26 3h1c h ALA 279 CO 0.06 0.54 -0.81 1.15 0.00 0.00 0.00 179.25 180.19 3h1c h THR 280 N 0.98 1.32 -0.01 0.00 2.02 -1.09 -2.24 112.91 113.89 3h1c h THR 280 Ca 0.25 -2.09 -0.11 0.00 0.77 0.00 0.00 66.41 65.23 3h1c h THR 280 Cb 0.04 2.10 -0.01 0.00 -1.74 0.00 0.00 68.15 68.53 3h1c h THR 280 CO -0.04 0.65 -0.51 -0.07 0.37 0.00 0.00 175.52 175.92 3h1c h LEU 281 N 0.42 0.03 -0.51 2.58 3.38 -0.98 -1.15 115.31 119.08 3h1c h LEU 281 Ca -0.06 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.76 3h1c h LEU 281 Cb 1.43 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 42.15 3h1c h LEU 281 CO 0.16 0.53 -0.68 -0.07 0.09 0.00 0.00 178.44 178.46 3h1c h LEU 282 N 0.02 0.00 -0.69 1.67 3.38 -0.76 -2.95 115.31 115.98 3h1c h LEU 282 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 3h1c h LEU 282 Cb 0.90 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 3h1c h LEU 282 CO 0.07 0.68 -0.61 0.00 0.09 0.00 0.00 178.44 178.67 3h1c h ALA 283 N 1.32 0.90 0.49 1.53 0.00 -0.93 -3.28 119.26 119.29 3h1c h ALA 283 Ca -0.01 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.33 3h1c h ALA 283 Cb 1.28 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3h1c h ALA 283 CO 0.09 0.76 -0.23 0.93 0.00 0.00 0.00 179.25 180.80 3h1c h GLU 284 N 0.00 -0.63 -2.44 0.00 4.39 -1.20 -3.47 114.58 111.23 3h1c h GLU 284 Ca -0.01 0.04 -0.09 0.00 0.34 0.00 0.00 59.36 59.65 3h1c h GLU 284 Cb 1.14 0.14 -0.20 0.00 -0.10 0.00 0.00 28.75 29.73 3h1c h GLU 284 CO 0.08 -0.33 -0.03 0.16 -1.16 0.00 0.00 179.01 177.73 3h1c s ASP 285 N -4.81 -0.49 0.00 1.42 -4.77 -1.12 -5.05 116.67 101.85 3h1c s ASP 285 Ca -0.13 0.65 0.16 0.00 -3.30 0.00 0.00 52.55 49.93 3h1c s ASP 285 Cb 0.02 0.66 0.58 0.00 -1.09 0.00 0.00 42.92 43.08 3h1c s ASP 285 CO 0.46 -0.43 1.43 -0.62 0.70 0.00 0.00 175.17 176.71 3h1c n GLU 286 N 1.61 1.72 0.14 2.11 1.02 -1.25 -3.99 120.64 122.00 3h1c n GLU 286 Ca -0.18 -1.10 -0.25 0.00 -0.02 0.00 0.00 57.16 55.61 3h1c n GLU 286 Cb 0.56 -1.34 -0.16 0.00 -0.02 0.00 0.00 31.44 30.49 3h1c n GLU 286 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3h1c h THR 287 N 2.04 1.23 -1.59 2.62 1.35 -1.92 -3.46 112.91 113.18 3h1c h THR 287 Ca 0.00 -2.68 -0.70 0.00 -0.55 0.00 0.00 66.41 62.48 3h1c h THR 287 Cb 0.45 3.01 0.05 0.00 -1.73 0.00 0.00 68.15 69.93 3h1c h THR 287 CO 0.00 0.82 0.51 0.18 -0.25 0.00 0.00 175.52 176.78 3h1c n LEU 288 N -3.70 1.64 -4.60 3.87 4.77 -1.26 -4.84 117.00 112.88 3h1c n LEU 288 Ca -0.18 1.12 -0.43 0.00 -0.03 0.00 0.00 56.01 56.49 3h1c n LEU 288 Cb 1.11 -1.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 3h1c n LEU 288 CO 0.60 -1.00 1.29 -0.62 -1.33 0.00 0.00 177.39 176.33 3h1c s ASP 289 N 1.06 6.28 0.05 -1.43 2.15 -1.26 -4.94 116.67 118.58 3h1c s ASP 289 Ca 0.88 0.97 -0.10 0.00 0.43 0.00 0.00 52.55 54.72 3h1c s ASP 289 Cb -1.01 -2.54 -0.02 0.00 -0.30 0.00 0.00 42.92 39.05 3h1c s ASP 289 CO 0.52 -1.45 1.11 1.21 -0.17 0.00 0.00 175.17 176.39 3h1c n GLU 290 N 8.08 -0.15 -0.23 4.34 2.13 -1.26 -1.82 120.64 131.73 3h1c n GLU 290 Ca 0.18 1.10 -0.09 0.00 0.66 0.00 0.00 57.16 59.01 3h1c n GLU 290 Cb 0.48 -1.64 -0.05 0.00 0.27 0.00 0.00 31.44 30.50 3h1c n GLU 290 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 3h1c h ASN 291 N 0.00 -1.64 -0.74 4.31 2.35 -2.00 0.15 115.58 118.01 3h1c h ASN 291 Ca 0.05 0.26 0.24 0.00 -0.55 0.00 0.00 56.30 56.30 3h1c h ASN 291 Cb 0.14 0.73 -0.14 0.00 0.05 0.00 0.00 38.32 39.10 3h1c h ASN 291 CO -0.31 -0.33 0.15 1.21 -1.65 0.00 0.00 177.43 176.50 3h1c n GLU 292 N -5.39 -0.05 -0.00 0.81 4.07 -0.76 0.32 120.64 119.64 3h1c n GLU 292 Ca 0.01 1.08 -0.03 0.00 -0.06 0.00 0.00 57.16 58.16 3h1c n GLU 292 Cb 0.34 -1.79 0.21 0.00 -0.06 0.00 0.00 31.44 30.14 3h1c n GLU 292 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 3h1c h LEU 293 N 0.00 0.53 -1.83 4.31 3.38 -0.62 -2.68 115.31 118.40 3h1c h LEU 293 Ca 0.51 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.29 3h1c h LEU 293 Cb 1.18 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 3h1c h LEU 293 CO -0.65 0.73 -0.14 1.23 0.09 0.00 0.00 178.44 179.69 3h1c h GLY 294 N 0.98 0.00 1.28 0.83 0.00 0.53 -1.54 103.07 105.15 3h1c h GLY 294 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.16 3h1c h GLY 294 CO 0.04 0.00 -1.44 0.83 0.00 0.00 0.00 176.54 175.97 3h1c h GLU 295 N 0.00 0.00 -0.17 4.80 5.08 -1.15 -2.89 114.58 120.25 3h1c h GLU 295 Ca -0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 3h1c h GLU 295 Cb 0.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 3h1c h GLU 295 CO 0.02 0.59 -0.18 0.82 -1.00 0.00 0.00 179.01 179.26 3h1c h ILE 296 N 0.00 1.34 -0.44 3.13 2.04 -1.17 -1.35 117.51 121.05 3h1c h ILE 296 Ca -0.19 -1.34 -0.02 0.00 1.00 0.00 0.00 64.86 64.31 3h1c h ILE 296 Cb 1.87 1.82 -0.02 0.00 -0.74 0.00 0.00 36.82 39.75 3h1c h ILE 296 CO 0.09 0.40 0.17 -0.07 0.00 0.00 0.00 178.15 178.74 3h1c h LEU 297 N 0.08 0.57 -0.71 1.44 3.38 -1.42 -1.84 115.31 116.80 3h1c h LEU 297 Ca 0.03 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 3h1c h LEU 297 Cb 0.72 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 3h1c h LEU 297 CO 0.04 0.52 -0.62 -0.74 0.09 0.00 0.00 178.44 177.73 3h1c h HIS 298 N 0.62 0.10 -0.07 1.13 2.76 -1.45 -2.45 115.15 115.78 3h1c h HIS 298 Ca 0.15 -0.04 -0.15 0.00 -2.20 0.00 0.00 60.37 58.13 3h1c h HIS 298 Cb 0.13 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.06 3h1c h HIS 298 CO 0.01 0.68 -0.61 0.00 -1.30 0.00 0.00 177.93 176.71 3h1c h ALA 299 N 1.31 0.83 -0.27 5.26 0.00 -0.66 -2.29 119.26 123.44 3h1c h ALA 299 Ca -0.01 -0.55 -0.11 0.00 0.00 0.00 0.00 54.91 54.25 3h1c h ALA 299 Cb 1.11 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 3h1c h ALA 299 CO 0.09 0.73 -0.26 0.82 0.00 0.00 0.00 179.25 180.63 3h1c h ILE 300 N 0.19 1.31 -0.61 0.00 2.04 -1.28 -1.60 117.51 117.56 3h1c h ILE 300 Ca -0.01 -1.42 0.02 0.00 1.00 0.00 0.00 64.86 64.45 3h1c h ILE 300 Cb 1.12 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 38.78 3h1c h ILE 300 CO 0.10 0.45 0.40 -0.33 0.00 0.00 0.00 178.15 178.77 3h1c h GLU 301 N 0.38 0.76 -0.09 2.37 5.08 -1.39 -0.59 114.58 121.10 3h1c h GLU 301 Ca 0.04 -0.05 -0.21 0.00 -1.00 0.00 0.00 59.36 58.15 3h1c h GLU 301 Cb 0.82 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.91 3h1c h GLU 301 CO 0.07 0.50 -0.80 -0.22 -1.00 0.00 0.00 179.01 177.55 3h1c h LYS 302 N 0.78 0.56 -0.05 2.33 3.64 -1.34 -3.22 116.57 119.28 3h1c h LYS 302 Ca 0.23 -0.49 -0.18 0.00 -1.27 0.00 0.00 60.65 58.94 3h1c h LYS 302 Cb -0.02 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 3h1c h LYS 302 CO -0.06 1.12 -0.76 -0.97 -2.27 0.00 0.00 179.45 176.52 3h1c h ASN 303 N 0.37 0.38 -0.26 4.20 -1.24 -0.73 -2.83 115.58 115.46 3h1c h ASN 303 Ca -0.05 -0.26 -0.07 0.00 0.71 0.00 0.00 56.30 56.63 3h1c h ASN 303 Cb 1.41 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 40.34 3h1c h ASN 303 CO 0.15 1.00 -0.13 0.58 -1.29 0.00 0.00 177.43 177.74 3h1c h VAL 304 N 0.20 1.30 0.04 2.57 2.07 -1.22 -2.88 116.25 118.33 3h1c h VAL 304 Ca -0.03 -1.21 -0.00 0.00 0.82 0.00 0.00 66.70 66.28 3h1c h VAL 304 Cb 1.33 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 3h1c h VAL 304 CO 0.12 0.38 -0.02 0.58 0.02 0.00 0.00 177.57 178.65 3h1c h VAL 305 N 0.27 1.26 -0.57 2.57 2.07 -1.63 -3.22 116.25 117.02 3h1c h VAL 305 Ca 0.06 -1.05 -0.07 0.00 0.82 0.00 0.00 66.70 66.46 3h1c h VAL 305 Cb 0.63 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 32.33 3h1c h VAL 305 CO 0.04 0.26 0.08 0.03 0.02 0.00 0.00 177.57 178.00 3h1c h ARG 306 N -0.53 0.92 -0.10 1.57 3.08 -1.60 -3.00 114.38 114.72 3h1c h ARG 306 Ca -0.01 -0.23 -0.13 0.00 0.07 0.00 0.00 59.98 59.69 3h1c h ARG 306 Cb 0.47 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 3h1c h ARG 306 CO 0.01 0.86 -0.51 1.03 -1.07 0.00 0.00 179.97 180.29 3h1c h SER 307 N 0.86 0.30 0.68 7.04 0.87 -1.62 -2.90 113.55 118.78 3h1c h SER 307 Ca 0.18 -0.15 -0.15 0.00 -1.23 0.00 0.00 61.79 60.44 3h1c h SER 307 Cb 0.40 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.25 3h1c h SER 307 CO 0.01 0.76 -0.72 0.03 -0.53 0.00 0.00 176.83 176.38 3h1c h ARG 308 N 0.22 0.03 -0.12 2.24 3.08 -1.53 -2.85 114.38 115.44 3h1c h ARG 308 Ca 0.01 -0.02 -0.23 0.00 0.07 0.00 0.00 59.98 59.80 3h1c h ARG 308 Cb 0.97 0.01 0.01 0.00 0.08 0.00 0.00 29.97 31.04 3h1c h ARG 308 CO 0.08 0.73 -0.83 0.28 -1.07 0.00 0.00 179.97 179.17 3h1c h VAL 309 N 0.02 1.28 -0.15 2.04 2.07 -1.48 -2.07 116.25 117.96 3h1c h VAL 309 Ca -0.01 -2.03 -0.11 0.00 0.82 0.00 0.00 66.70 65.37 3h1c h VAL 309 Cb 1.27 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 33.08 3h1c h VAL 309 CO 0.10 0.64 -0.38 -0.07 0.02 0.00 0.00 177.57 177.88 3h1c h LEU 310 N 0.50 0.35 -0.71 2.57 3.38 -1.53 -3.13 115.31 116.74 3h1c h LEU 310 Ca -0.07 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.63 3h1c h LEU 310 Cb 1.46 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 3h1c h LEU 310 CO 0.17 0.70 -0.63 0.00 0.09 0.00 0.00 178.44 178.77 3h1c h ALA 311 N 1.32 0.92 0.00 1.53 0.00 -1.56 -3.47 119.26 118.00 3h1c h ALA 311 Ca 0.03 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3h1c h ALA 311 Cb 0.80 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3h1c h ALA 311 CO 0.06 0.77 0.00 0.41 0.00 0.00 0.00 179.25 180.50 3h1c n GLY 312 N 0.29 0.99 3.79 0.00 0.00 -1.18 -5.12 105.19 103.96 3h1c n GLY 312 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.32 3.65 0.70 1.61 2.02 -0.78 -5.01 118.70 120.57 3h1c s GLU 313 Ca 0.00 1.41 -0.16 0.00 0.02 0.00 0.00 54.97 56.24 3h1c s GLU 313 Cb 0.00 -2.07 -0.02 0.00 0.10 0.00 0.00 34.13 32.14 3h1c s GLU 313 CO 0.00 -0.57 0.75 -2.30 0.02 0.00 0.00 175.26 173.16 3h1c n PRO 314 N -1.13 0.45 0.00 0.39 -0.02 -1.26 -4.48 135.00 128.94 3h1c n PRO 314 Ca 0.10 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 3h1c n PRO 314 Cb 0.52 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 3h1c n PRO 314 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3h1c n ARG 315 N -1.17 -0.55 0.29 -0.52 1.74 -1.10 -4.80 116.66 110.55 3h1c n ARG 315 Ca 0.12 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 57.03 3h1c n ARG 315 Cb 0.49 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.85 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 -1.26 0.00 0.00 0.55 1.08 -1.88 -1.65 117.51 114.34 3h1c h ILE 316 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 3h1c h ILE 316 Cb 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.75 3h1c h ILE 316 CO 0.00 0.00 0.00 -0.90 -0.69 0.00 0.00 178.15 176.56 3h1c n ASP 317 N -5.16 0.26 -2.51 1.72 5.75 -1.26 -4.32 116.55 111.03 3h1c n ASP 317 Ca -0.11 -1.92 -0.10 0.00 -0.01 0.00 0.00 54.79 52.64 3h1c n ASP 317 Cb 0.42 -0.13 0.05 0.00 -1.03 0.00 0.00 41.12 40.43 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 0.34 -0.09 3.20 6.12 0.00 -0.62 -4.89 105.19 109.25 3h1c n GLY 318 Ca 0.00 -0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 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 -4.72 1.51 0.86 1.61 0.52 -1.26 -4.76 118.95 112.71 3h1c s ARG 319 Ca 0.03 -0.72 -0.14 0.00 -0.52 0.00 0.00 55.73 54.38 3h1c s ARG 319 Cb -0.00 -1.49 0.22 0.00 0.52 0.00 0.00 34.95 34.20 3h1c s ARG 319 CO 0.45 0.40 0.57 0.39 0.02 0.00 0.00 175.30 177.14 3h1c n GLU 320 N 2.50 -3.37 -0.04 3.54 -0.58 -1.26 -2.69 120.64 118.73 3h1c n GLU 320 Ca -0.15 -0.95 -0.14 0.00 -0.42 0.00 0.00 57.16 55.50 3h1c n GLU 320 Cb 0.53 -1.12 -0.12 0.00 -0.57 0.00 0.00 31.44 30.17 3h1c n GLU 320 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 3h1c h LYS 321 N 0.00 0.05 -0.01 3.49 2.10 -1.94 -3.31 116.57 116.95 3h1c h LYS 321 Ca -0.25 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.35 3h1c h LYS 321 Cb 0.80 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.15 3h1c h LYS 321 CO 0.15 0.84 0.00 -0.40 -2.00 0.00 0.00 179.45 178.04 3h1c n ASP 322 N -4.64 0.75 -4.83 7.07 5.68 -1.26 -0.10 116.55 119.22 3h1c n ASP 322 Ca -0.10 -1.27 -0.36 0.00 -0.50 0.00 0.00 54.79 52.57 3h1c n ASP 322 Cb 0.43 -0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 40.35 3h1c n ASP 322 CO 0.00 0.00 0.00 -0.04 -1.33 0.00 0.00 177.20 175.83 3h1c s MET 323 N -1.99 4.13 0.46 0.11 -1.94 -1.25 -4.88 119.30 113.95 3h1c s MET 323 Ca 0.42 0.69 0.05 0.00 -1.71 0.00 0.00 55.69 55.14 3h1c s MET 323 Cb 0.21 -2.99 -0.04 0.00 2.01 0.00 0.00 34.83 34.03 3h1c s MET 323 CO 0.35 0.49 0.09 0.96 -0.01 0.00 0.00 175.02 176.89 3h1c s ILE 324 N -1.40 1.70 0.79 2.53 -4.36 -1.26 -4.63 121.20 114.57 3h1c s ILE 324 Ca 0.38 -1.88 -0.12 0.00 -0.26 0.00 0.00 60.65 58.77 3h1c s ILE 324 Cb -0.17 -2.58 0.06 0.00 1.25 0.00 0.00 42.46 41.02 3h1c s ILE 324 CO 0.20 0.00 1.12 -0.13 0.24 0.00 0.00 174.94 176.37 3h1c s ARG 325 N -3.88 2.17 0.64 0.37 0.52 -1.26 -5.04 118.95 112.47 3h1c s ARG 325 Ca 0.25 0.40 -0.17 0.00 -0.52 0.00 0.00 55.73 55.69 3h1c s ARG 325 Cb 0.04 -1.95 -0.01 0.00 0.52 0.00 0.00 34.95 33.55 3h1c s ARG 325 CO 0.14 -1.51 1.15 0.20 0.02 0.00 0.00 175.30 175.30 3h1c s GLY 326 N -4.24 2.39 -0.00 -3.53 0.00 -1.26 -4.70 107.32 95.98 3h1c s GLY 326 Ca 0.61 0.75 0.08 0.00 0.00 0.00 0.00 44.72 46.15 3h1c s GLY 326 CO 0.52 1.12 -0.26 1.08 0.00 0.00 0.00 173.10 175.56 3h1c s LEU 327 N -4.56 2.08 -0.15 0.66 1.43 -1.26 -0.52 118.68 116.36 3h1c s LEU 327 Ca 0.71 -0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 53.31 3h1c s LEU 327 Cb -0.24 -1.30 0.04 0.00 0.03 0.00 0.00 46.19 44.71 3h1c s LEU 327 CO 0.38 0.30 -0.02 -0.62 0.23 0.00 0.00 176.35 176.61 3h1c s ASP 328 N -0.76 2.53 -0.22 2.29 2.15 0.04 -5.01 116.67 117.70 3h1c s ASP 328 Ca 0.10 -0.55 -0.04 0.00 0.43 0.00 0.00 52.55 52.49 3h1c s ASP 328 Cb -0.10 -0.74 -0.01 0.00 -0.30 0.00 0.00 42.92 41.77 3h1c s ASP 328 CO -0.00 -0.21 -0.03 -0.69 -0.17 0.00 0.00 175.17 174.07 3h1c s VAL 329 N 1.76 3.51 -0.15 1.11 1.01 -1.26 -1.10 120.40 125.27 3h1c s VAL 329 Ca 0.02 -0.45 -0.00 0.00 0.00 0.00 0.00 61.98 61.54 3h1c s VAL 329 Cb -0.15 -2.60 0.03 0.00 0.00 0.00 0.00 36.38 33.67 3h1c s VAL 329 CO -0.07 0.42 -0.07 -0.13 0.00 0.00 0.00 175.10 175.25 3h1c s ARG 330 N 1.45 1.53 -0.14 2.72 0.52 -0.77 -5.03 118.95 119.23 3h1c s ARG 330 Ca 0.05 -0.44 -0.06 0.00 -0.52 0.00 0.00 55.73 54.76 3h1c s ARG 330 Cb -0.14 -1.89 -0.04 0.00 0.52 0.00 0.00 34.95 33.40 3h1c s ARG 330 CO -0.02 -0.37 0.05 0.99 0.02 0.00 0.00 175.30 175.98 3h1c s THR 331 N 1.64 4.75 -0.27 0.02 2.01 -1.26 -0.47 115.64 122.05 3h1c s THR 331 Ca 0.02 -0.06 -0.01 0.00 0.31 0.00 0.00 61.69 61.95 3h1c s THR 331 Cb -0.14 -3.09 -0.01 0.00 0.01 0.00 0.00 72.50 69.27 3h1c s THR 331 CO -0.08 0.53 0.23 0.61 -0.69 0.00 0.00 174.62 175.22 3h1c n GLY 332 N 2.88 0.35 0.13 4.40 0.00 -0.60 -5.00 105.19 107.35 3h1c n GLY 332 Ca -0.18 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.33 1.36 -3.20 1.61 3.04 -1.82 -3.46 116.25 113.45 3h1c h VAL 333 Ca -0.15 -2.85 -0.58 0.00 -1.01 0.00 0.00 66.70 62.11 3h1c h VAL 333 Cb 1.08 2.99 -0.04 0.00 -2.01 0.00 0.00 31.29 33.31 3h1c h VAL 333 CO 0.11 0.85 -0.24 -0.76 -1.01 0.00 0.00 177.57 176.52 3h1c s LEU 334 N -7.37 4.29 -0.18 3.16 1.43 -1.26 -5.06 118.68 113.68 3h1c s LEU 334 Ca -0.07 0.76 -0.24 0.00 -1.03 0.00 0.00 54.13 53.55 3h1c s LEU 334 Cb 0.05 -3.23 -0.22 0.00 0.03 0.00 0.00 46.19 42.82 3h1c s LEU 334 CO 0.92 0.08 0.41 1.55 0.23 0.00 0.00 176.35 179.54 3h1c h PRO 335 N 3.19 0.01 -2.00 1.29 0.13 -2.02 -3.41 132.00 129.19 3h1c h PRO 335 Ca -0.48 -0.02 -0.74 0.00 -0.87 0.00 0.00 66.00 63.89 3h1c h PRO 335 Cb 1.18 0.01 -0.30 0.00 0.13 0.00 0.00 31.00 32.02 3h1c h PRO 335 CO 0.69 1.01 0.73 0.54 -0.23 0.00 0.00 178.00 180.73 3h1c n ARG 336 N -4.47 3.47 -4.37 0.86 1.74 -1.26 -4.95 116.66 107.68 3h1c n ARG 336 Ca -0.25 -3.98 -0.18 0.00 -0.77 0.00 0.00 57.85 52.67 3h1c n ARG 336 Cb 0.63 -2.31 -0.10 0.00 -1.02 0.00 0.00 32.46 29.65 3h1c n ARG 336 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 3h1c s THR 337 N -4.95 1.00 -0.04 0.55 -1.32 -1.26 -5.08 115.64 104.54 3h1c s THR 337 Ca 0.48 -2.02 -0.22 0.00 -1.21 0.00 0.00 61.69 58.72 3h1c s THR 337 Cb 0.37 -2.55 -0.16 0.00 -1.51 0.00 0.00 72.50 68.65 3h1c s THR 337 CO -0.31 -0.15 0.95 0.45 -2.21 0.00 0.00 174.62 173.34 3h1c h HIS 338 N 2.34 -0.20 -3.60 9.09 3.86 -1.93 -3.47 115.15 121.24 3h1c h HIS 338 Ca -0.39 -0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 58.61 3h1c h HIS 338 Cb 1.23 0.06 -0.27 0.00 1.06 0.00 0.00 27.41 29.50 3h1c h HIS 338 CO 0.55 0.25 -0.64 0.20 0.86 0.00 0.00 177.93 179.15 3h1c s GLY 339 N -3.23 -0.02 -0.03 2.45 0.00 -1.05 -3.72 107.32 101.71 3h1c s GLY 339 Ca -0.13 0.11 -0.09 0.00 0.00 0.00 0.00 44.72 44.61 3h1c s GLY 339 CO 0.51 0.08 0.21 -1.35 0.00 0.00 0.00 173.10 172.54 3h1c s SER 340 N -0.15 -0.12 -0.05 1.64 1.04 -1.26 -0.46 113.70 114.34 3h1c s SER 340 Ca -0.02 0.10 -0.10 0.00 0.48 0.00 0.00 55.95 56.41 3h1c s SER 340 Cb -0.02 0.32 0.02 0.00 0.10 0.00 0.00 66.02 66.45 3h1c s SER 340 CO 0.00 -0.28 0.25 0.00 0.98 0.00 0.00 173.24 174.19 3h1c s ALA 341 N -0.81 -0.61 -0.41 5.32 0.00 0.71 -1.56 121.76 124.40 3h1c s ALA 341 Ca -0.09 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.33 3h1c s ALA 341 Cb -0.05 -0.18 0.12 0.00 0.00 0.00 0.00 23.12 23.02 3h1c s ALA 341 CO 0.02 -0.18 0.19 -1.17 0.00 0.00 0.00 175.76 174.62 3h1c s LEU 342 N -0.58 3.10 -0.22 0.00 2.96 0.38 -1.61 118.68 122.70 3h1c s LEU 342 Ca -0.07 -2.42 -0.11 0.00 -0.22 0.00 0.00 54.13 51.32 3h1c s LEU 342 Cb -0.04 -1.17 -0.05 0.00 0.50 0.00 0.00 46.19 45.43 3h1c s LEU 342 CO 0.02 -0.31 0.16 0.12 -1.32 0.00 0.00 176.35 175.02 3h1c s PHE 343 N 0.59 3.37 -0.06 5.38 5.36 -1.20 -1.85 117.98 129.56 3h1c s PHE 343 Ca 0.15 0.30 0.02 0.00 -0.96 0.00 0.00 56.93 56.45 3h1c s PHE 343 Cb -0.23 -2.23 0.01 0.00 -0.34 0.00 0.00 43.02 40.24 3h1c s PHE 343 CO -0.06 0.17 -0.13 0.99 -1.46 0.00 0.00 175.22 174.74 3h1c s THR 344 N 0.72 1.18 -0.31 0.12 2.01 -0.26 -1.95 115.64 117.14 3h1c s THR 344 Ca 0.08 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 61.59 3h1c s THR 344 Cb -0.12 -1.07 0.09 0.00 0.01 0.00 0.00 72.50 71.41 3h1c s THR 344 CO 0.02 0.36 0.06 -0.60 -0.69 0.00 0.00 174.62 173.77 3h1c s ARG 345 N 0.58 1.15 3.52 4.92 3.52 -0.18 -0.78 118.95 131.68 3h1c s ARG 345 Ca -0.13 -1.39 0.00 0.00 -0.13 0.00 0.00 55.73 54.07 3h1c s ARG 345 Cb -0.15 -2.58 0.00 0.00 -1.56 0.00 0.00 34.95 30.66 3h1c s ARG 345 CO 0.04 -0.91 0.00 0.41 -0.81 0.00 0.00 175.30 174.02 3h1c n GLY 346 N 4.58 1.26 0.56 8.12 0.00 0.32 -2.29 105.19 117.75 3h1c n GLY 346 Ca -0.01 0.27 0.05 0.00 0.00 0.00 0.00 46.02 46.33 3h1c n GLY 346 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3h1c n GLU 347 N 0.00 0.79 -4.23 1.61 0.28 -1.26 -4.94 120.64 112.88 3h1c n GLU 347 Ca 0.00 -2.23 -0.19 0.00 -0.16 0.00 0.00 57.16 54.58 3h1c n GLU 347 Cb 0.00 -1.00 -0.16 0.00 1.43 0.00 0.00 31.44 31.72 3h1c n GLU 347 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 177.13 176.89 3h1c s THR 348 N -1.69 0.58 0.01 3.84 -1.32 -0.97 -4.34 115.64 111.75 3h1c s THR 348 Ca 0.25 -0.21 -0.11 0.00 -1.21 0.00 0.00 61.69 60.42 3h1c s THR 348 Cb 0.25 -0.55 0.01 0.00 -1.51 0.00 0.00 72.50 70.70 3h1c s THR 348 CO -0.04 0.21 0.22 -1.10 -2.21 0.00 0.00 174.62 171.70 3h1c s GLN 349 N 0.48 0.63 -0.07 7.08 -0.21 -0.55 -1.01 119.66 126.01 3h1c s GLN 349 Ca -0.06 -0.42 -0.00 0.00 0.02 0.00 0.00 55.36 54.89 3h1c s GLN 349 Cb -0.10 0.27 0.02 0.00 1.00 0.00 0.00 33.01 34.20 3h1c s GLN 349 CO 0.00 -0.17 -0.04 0.00 -2.12 0.00 0.00 175.29 172.96 3h1c s ALA 350 N -1.85 0.85 -0.71 6.09 0.00 -0.83 -2.24 121.76 123.08 3h1c s ALA 350 Ca -0.11 -0.21 -0.24 0.00 0.00 0.00 0.00 51.96 51.41 3h1c s ALA 350 Cb -0.04 -0.66 0.06 0.00 0.00 0.00 0.00 23.12 22.47 3h1c s ALA 350 CO 0.00 -0.27 1.11 -1.17 0.00 0.00 0.00 175.76 175.44 3h1c s LEU 351 N 1.49 3.88 -0.18 0.00 2.96 0.18 -3.24 118.68 123.77 3h1c s LEU 351 Ca -0.02 -0.82 -0.06 0.00 -0.22 0.00 0.00 54.13 53.01 3h1c s LEU 351 Cb -0.13 -2.48 -0.03 0.00 0.50 0.00 0.00 46.19 44.05 3h1c s LEU 351 CO -0.04 -1.59 0.02 -0.69 -1.32 0.00 0.00 176.35 172.73 3h1c s VAL 352 N 4.73 4.29 0.10 1.68 1.01 -0.64 -0.45 120.40 131.12 3h1c s VAL 352 Ca 0.28 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 62.14 3h1c s VAL 352 Cb -0.12 -2.93 -0.03 0.00 0.00 0.00 0.00 36.38 33.29 3h1c s VAL 352 CO 0.11 0.45 -0.21 0.42 0.00 0.00 0.00 175.10 175.86 3h1c s THR 353 N 0.62 1.75 0.04 3.92 -4.23 0.12 -0.20 115.64 117.66 3h1c s THR 353 Ca 0.01 -1.51 0.09 0.00 -1.18 0.00 0.00 61.69 59.09 3h1c s THR 353 Cb -0.14 -1.58 -0.03 0.00 1.34 0.00 0.00 72.50 72.10 3h1c s THR 353 CO 0.02 -0.01 -0.25 0.00 -0.54 0.00 0.00 174.62 173.85 3h1c s ALA 354 N -1.10 2.32 -0.00 3.99 0.00 0.40 -0.83 121.76 126.52 3h1c s ALA 354 Ca 0.07 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 50.83 3h1c s ALA 354 Cb -0.10 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.47 3h1c s ALA 354 CO 0.04 0.54 -0.10 0.99 0.00 0.00 0.00 175.76 177.23 3h1c s THR 355 N -0.80 0.76 0.10 0.00 2.01 0.28 -2.53 115.64 115.45 3h1c s THR 355 Ca 0.12 -0.45 0.08 0.00 0.31 0.00 0.00 61.69 61.75 3h1c s THR 355 Cb -0.10 -0.64 -0.04 0.00 0.01 0.00 0.00 72.50 71.73 3h1c s THR 355 CO 0.02 0.19 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.22 3h1c s LEU 356 N -0.30 2.78 0.00 4.42 1.43 -1.26 -1.28 118.68 124.47 3h1c s LEU 356 Ca 0.03 -0.49 -0.04 0.00 -1.03 0.00 0.00 54.13 52.61 3h1c s LEU 356 Cb -0.04 -1.62 0.02 0.00 0.03 0.00 0.00 46.19 44.58 3h1c s LEU 356 CO -0.00 0.19 0.21 0.61 0.23 0.00 0.00 176.35 177.59 3h1c n GLY 357 N 0.91 1.68 3.92 -3.19 0.00 -0.78 -5.02 105.19 102.72 3h1c n GLY 357 Ca -0.15 -1.06 -0.26 0.00 0.00 0.00 0.00 46.02 44.55 3h1c n GLY 357 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h1c s THR 358 N -2.74 3.65 -0.42 2.61 2.01 -1.26 -2.71 115.64 116.77 3h1c s THR 358 Ca 0.04 -0.09 0.21 0.00 0.31 0.00 0.00 61.69 62.15 3h1c s THR 358 Cb -0.01 -3.43 0.21 0.00 0.01 0.00 0.00 72.50 69.27 3h1c s THR 358 CO 0.03 -0.42 1.63 0.00 -0.69 0.00 0.00 174.62 175.16 3h1c n ALA 359 N -2.51 1.34 0.24 7.40 0.00 -1.26 -1.99 120.51 123.74 3h1c n ALA 359 Ca 0.04 0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.74 3h1c n ALA 359 Cb 0.58 -1.32 0.44 0.00 0.00 0.00 0.00 19.45 19.15 3h1c n ALA 359 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 3h1c h ARG 360 N 0.00 0.00 -0.53 0.00 -0.00 -1.99 -3.12 114.38 108.74 3h1c h ARG 360 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 3h1c h ARG 360 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.14 3h1c h ARG 360 CO 0.00 0.05 0.00 -0.25 -0.00 0.00 0.00 179.97 179.77 3h1c n ASP 361 N -3.14 2.48 -4.76 0.08 8.00 -0.84 -4.93 116.55 113.44 3h1c n ASP 361 Ca 0.02 -2.17 -0.40 0.00 0.71 0.00 0.00 54.79 52.94 3h1c n ASP 361 Cb 0.42 -0.38 -0.04 0.00 -0.02 0.00 0.00 41.12 41.11 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 -1.65 3.41 -0.34 2.24 0.00 -1.18 -4.98 121.76 119.26 3h1c s ALA 362 Ca 0.25 0.97 -0.29 0.00 0.00 0.00 0.00 51.96 52.90 3h1c s ALA 362 Cb 0.16 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.92 3h1c s ALA 362 CO 0.13 -0.28 1.38 -1.14 0.00 0.00 0.00 175.76 175.85 3h1c s GLN 363 N -1.59 3.76 -0.70 0.00 0.74 -1.10 -4.88 119.66 115.89 3h1c s GLN 363 Ca 0.46 1.16 -0.25 0.00 0.05 0.00 0.00 55.36 56.78 3h1c s GLN 363 Cb -0.33 -3.96 0.05 0.00 1.10 0.00 0.00 33.01 29.87 3h1c s GLN 363 CO 0.43 -1.33 1.13 0.08 -0.55 0.00 0.00 175.29 175.05 3h1c s VAL 364 N 4.92 4.01 -0.23 1.34 1.01 -1.26 -1.18 120.40 129.01 3h1c s VAL 364 Ca 0.60 0.03 -0.23 0.00 0.00 0.00 0.00 61.98 62.38 3h1c s VAL 364 Cb -0.16 -4.81 -0.01 0.00 0.00 0.00 0.00 36.38 31.40 3h1c s VAL 364 CO 0.28 -1.67 0.75 -0.76 0.00 0.00 0.00 175.10 173.70 3h1c s LEU 365 N 4.92 4.09 -1.13 3.92 1.43 -0.35 -4.98 118.68 126.58 3h1c s LEU 365 Ca 0.29 0.94 -0.06 0.00 -1.03 0.00 0.00 54.13 54.27 3h1c s LEU 365 Cb -0.12 -3.07 0.27 0.00 0.03 0.00 0.00 46.19 43.30 3h1c s LEU 365 CO 0.13 -0.44 1.52 -0.67 0.23 0.00 0.00 176.35 177.12 3h1c n ASP 366 N 5.73 6.04 -4.83 2.29 2.03 -1.26 -2.41 116.55 124.14 3h1c n ASP 366 Ca 0.03 -3.30 -0.31 0.00 0.52 0.00 0.00 54.79 51.73 3h1c n ASP 366 Cb 0.48 -1.33 0.06 0.00 -0.72 0.00 0.00 41.12 39.61 3h1c n ASP 366 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3h1c s GLU 367 N -1.88 2.75 0.19 -0.67 2.02 -1.24 -4.99 118.70 114.88 3h1c s GLU 367 Ca 0.33 0.78 -0.03 0.00 0.02 0.00 0.00 54.97 56.07 3h1c s GLU 367 Cb 0.04 -1.98 0.12 0.00 0.10 0.00 0.00 34.13 32.41 3h1c s GLU 367 CO 0.06 -1.19 1.52 1.25 0.02 0.00 0.00 175.26 176.92 3h1c h LEU 368 N -0.78 0.63 -0.28 1.80 5.85 -1.98 -3.23 115.31 117.32 3h1c h LEU 368 Ca -0.45 -0.33 -0.20 0.00 0.84 0.00 0.00 57.88 57.74 3h1c h LEU 368 Cb 1.23 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 3h1c h LEU 368 CO 0.59 1.03 -0.86 0.24 -0.34 0.00 0.00 178.44 179.10 3h1c h MET 369 N 0.45 0.30 0.00 1.25 2.86 -1.96 -3.44 114.93 114.39 3h1c h MET 369 Ca 0.02 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 3h1c h MET 369 Cb 1.06 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.80 3h1c h MET 369 CO 0.10 0.99 0.00 0.41 1.06 0.00 0.00 176.91 179.47 3h1c n GLY 370 N 0.82 1.40 3.65 8.32 0.00 -1.22 -4.78 105.19 113.39 3h1c n GLY 370 Ca -0.05 -0.39 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 3h1c n GLY 370 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h1c s GLU 371 N -2.00 4.24 0.08 1.61 2.12 -1.26 -3.70 118.70 119.79 3h1c s GLU 371 Ca 0.00 1.23 0.03 0.00 0.36 0.00 0.00 54.97 56.59 3h1c s GLU 371 Cb 0.00 -3.64 -0.03 0.00 0.26 0.00 0.00 34.13 30.72 3h1c s GLU 371 CO 0.00 -0.59 -0.10 -0.98 -0.54 0.00 0.00 175.26 173.05 3h1c s ARG 372 N 3.08 0.78 -0.16 4.30 1.70 -1.01 -5.02 118.95 122.62 3h1c s ARG 372 Ca 0.41 -1.06 -0.05 0.00 -0.47 0.00 0.00 55.73 54.55 3h1c s ARG 372 Cb -0.15 -0.50 -0.03 0.00 -0.57 0.00 0.00 34.95 33.69 3h1c s ARG 372 CO 0.06 0.08 0.02 0.95 -1.08 0.00 0.00 175.30 175.34 3h1c s THR 373 N -2.16 4.42 -0.24 4.99 -4.23 -1.26 -1.22 115.64 115.94 3h1c s THR 373 Ca 0.02 -0.17 -0.13 0.00 -1.18 0.00 0.00 61.69 60.23 3h1c s THR 373 Cb -0.05 -2.95 -0.05 0.00 1.34 0.00 0.00 72.50 70.79 3h1c s THR 373 CO 0.00 0.49 0.25 -0.62 -0.54 0.00 0.00 174.62 174.21 3h1c s ASP 374 N 0.17 6.20 -0.17 3.99 2.15 -0.32 -4.97 116.67 123.72 3h1c s ASP 374 Ca 0.02 0.22 -0.24 0.00 0.43 0.00 0.00 52.55 52.98 3h1c s ASP 374 Cb -0.13 -2.15 -0.23 0.00 -0.30 0.00 0.00 42.92 40.11 3h1c s ASP 374 CO 0.01 -0.02 0.47 0.74 -0.17 0.00 0.00 175.17 176.20 3h1c h THR 375 N 5.13 1.27 -3.35 1.71 2.02 -1.95 -2.91 112.91 114.84 3h1c h THR 375 Ca -0.36 -2.27 -0.58 0.00 0.77 0.00 0.00 66.41 63.97 3h1c h THR 375 Cb 1.17 2.74 -0.07 0.00 -1.74 0.00 0.00 68.15 70.25 3h1c h THR 375 CO 0.65 0.47 0.22 0.12 0.37 0.00 0.00 175.52 177.36 3h1c s PHE 376 N -2.32 3.46 -0.06 3.16 5.36 -1.26 -2.63 117.98 123.68 3h1c s PHE 376 Ca -0.24 1.17 0.05 0.00 -0.96 0.00 0.00 56.93 56.96 3h1c s PHE 376 Cb 0.02 -2.89 -0.01 0.00 -0.34 0.00 0.00 43.02 39.80 3h1c s PHE 376 CO 0.65 -0.12 -0.23 -0.51 -1.46 0.00 0.00 175.22 173.56 3h1c s LEU 377 N 1.65 2.20 -0.04 6.12 1.43 0.80 -5.00 118.68 125.83 3h1c s LEU 377 Ca 0.36 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 53.01 3h1c s LEU 377 Cb -0.17 -1.42 0.02 0.00 0.03 0.00 0.00 46.19 44.65 3h1c s LEU 377 CO 0.14 0.25 -0.07 0.12 0.23 0.00 0.00 176.35 177.01 3h1c s PHE 378 N -0.16 0.93 -0.04 0.29 5.36 -1.26 -0.16 117.98 122.94 3h1c s PHE 378 Ca -0.03 -0.28 0.03 0.00 -0.96 0.00 0.00 56.93 55.69 3h1c s PHE 378 Cb -0.14 -0.75 0.00 0.00 -0.34 0.00 0.00 43.02 41.80 3h1c s PHE 378 CO 0.04 -0.19 -0.13 -1.01 -1.46 0.00 0.00 175.22 172.47 3h1c s HIS 379 N 0.70 1.35 -0.19 10.12 3.76 -0.03 -4.80 115.29 126.21 3h1c s HIS 379 Ca -0.11 -0.38 0.01 0.00 -0.15 0.00 0.00 55.06 54.43 3h1c s HIS 379 Cb -0.14 -0.94 0.02 0.00 1.11 0.00 0.00 32.58 32.64 3h1c s HIS 379 CO 0.01 -0.15 -0.19 -0.47 -0.85 0.00 0.00 174.74 173.10 3h1c s TYR 380 N 0.17 2.82 -0.14 1.40 5.04 -1.26 -0.83 117.35 124.55 3h1c s TYR 380 Ca -0.05 -1.64 -0.01 0.00 -2.44 0.00 0.00 57.07 52.94 3h1c s TYR 380 Cb -0.11 -1.93 -0.02 0.00 0.35 0.00 0.00 41.96 40.26 3h1c s TYR 380 CO 0.02 -0.80 -0.11 -0.80 -1.34 0.00 0.00 175.55 172.51 3h1c s ASN 381 N 1.29 4.12 -0.56 4.32 0.01 -0.80 -4.67 114.94 118.65 3h1c s ASN 381 Ca 0.04 -0.31 0.04 0.00 -0.71 0.00 0.00 52.86 51.93 3h1c s ASN 381 Cb -0.13 -1.64 0.14 0.00 0.41 0.00 0.00 41.25 40.03 3h1c s ASN 381 CO -0.12 0.15 0.31 0.12 -1.51 0.00 0.00 177.10 176.06 3h1c s PHE 382 N 0.43 3.20 0.60 2.20 5.36 -1.26 -2.75 117.98 125.76 3h1c s PHE 382 Ca -0.09 -3.18 -0.13 0.00 -0.96 0.00 0.00 56.93 52.57 3h1c s PHE 382 Cb -0.16 -2.74 -0.04 0.00 -0.34 0.00 0.00 43.02 39.75 3h1c s PHE 382 CO 0.05 -0.70 1.03 -1.25 -1.46 0.00 0.00 175.22 172.89 3h1c s PRO 383 N -0.54 3.51 0.57 10.12 0.04 -1.26 -4.98 135.00 142.46 3h1c s PRO 383 Ca 0.19 0.94 0.35 0.00 0.04 0.00 0.00 61.00 62.52 3h1c s PRO 383 Cb -0.21 -2.07 1.61 0.00 0.04 0.00 0.00 34.50 33.87 3h1c s PRO 383 CO -0.04 -0.64 2.08 -1.00 0.04 0.00 0.00 177.00 177.44 3h1c h PRO 384 N 0.10 0.00 0.00 0.56 0.13 -1.90 -2.91 132.00 127.98 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 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3h1c h PRO 384 CO 0.60 0.03 0.00 2.48 -0.23 0.00 0.00 178.00 180.87 3h1c n TYR 385 N -3.16 0.00 -0.03 1.56 4.11 -1.25 -1.99 117.16 116.40 3h1c n TYR 385 Ca -0.01 0.00 -0.15 0.00 -0.00 0.00 0.00 57.90 57.75 3h1c n TYR 385 Cb 0.25 -0.29 -0.10 0.00 -0.00 0.00 0.00 39.34 39.20 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 0.31 1.47 9.48 4.64 -1.63 -3.30 113.55 124.52 3h1c h SER 386 Ca 0.00 -0.67 -0.07 0.00 -0.47 0.00 0.00 61.79 60.58 3h1c h SER 386 Cb 0.25 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 3h1c h SER 386 CO 0.00 0.93 -0.55 -0.37 -0.87 0.00 0.00 176.83 175.97 3h1c h VAL 387 N -0.29 0.44 0.00 0.95 -1.51 -1.77 -2.36 116.25 111.72 3h1c h VAL 387 Ca -0.02 -1.66 0.00 0.00 -1.23 0.00 0.00 66.70 63.79 3h1c h VAL 387 Cb 0.93 2.12 0.00 0.00 -2.13 0.00 0.00 31.29 32.21 3h1c h VAL 387 CO 0.05 0.25 0.00 0.61 -1.23 0.00 0.00 177.57 177.25 3h1c n GLY 388 N 1.21 0.75 1.39 5.19 0.00 -1.10 -4.99 105.19 107.65 3h1c n GLY 388 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 3h1c n GLY 388 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3h1c n GLU 389 N 0.00 0.28 -4.78 1.61 0.28 -0.84 -5.03 120.64 112.16 3h1c n GLU 389 Ca 0.00 -1.19 -0.32 0.00 -0.16 0.00 0.00 57.16 55.49 3h1c n GLU 389 Cb 0.00 1.12 -0.13 0.00 1.43 0.00 0.00 31.44 33.87 3h1c n GLU 389 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 3h1c s THR 390 N -2.59 3.00 0.15 3.84 -4.23 -1.26 -3.91 115.64 110.64 3h1c s THR 390 Ca 0.13 -0.91 -0.11 0.00 -1.18 0.00 0.00 61.69 59.62 3h1c s THR 390 Cb -0.00 -2.22 0.04 0.00 1.34 0.00 0.00 72.50 71.66 3h1c s THR 390 CO 0.09 0.48 0.55 0.61 -0.54 0.00 0.00 174.62 175.80 3h1c n GLY 391 N 1.95 1.08 3.77 3.99 0.00 -1.26 -5.05 105.19 109.67 3h1c n GLY 391 Ca -0.16 -1.09 -0.38 0.00 0.00 0.00 0.00 46.02 44.38 3h1c n GLY 391 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h1c s MET 392 N -2.04 4.60 -0.03 1.61 -1.94 -1.26 -4.93 119.30 115.30 3h1c s MET 392 Ca 0.12 1.47 -0.02 0.00 -1.71 0.00 0.00 55.69 55.54 3h1c s MET 392 Cb -0.02 -2.94 0.01 0.00 2.01 0.00 0.00 34.83 33.89 3h1c s MET 392 CO 0.05 0.27 0.08 0.54 -0.01 0.00 0.00 175.02 175.94 3h1c s VAL 393 N -1.45 -0.01 0.00 -6.03 0.11 -1.26 -4.88 120.40 106.88 3h1c s VAL 393 Ca 0.48 0.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.58 3h1c s VAL 393 Cb -0.23 -0.12 0.00 0.00 -1.53 0.00 0.00 36.38 34.50 3h1c s VAL 393 CO 0.29 0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.69 3h1c n GLY 394 N 3.30 -0.31 3.79 6.54 0.00 -1.26 -5.12 105.19 112.13 3h1c n GLY 394 Ca -0.16 0.27 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 3h1c n GLY 394 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h1c s SER 395 N 0.00 6.26 0.23 1.61 1.04 -1.26 -5.08 113.70 116.50 3h1c s SER 395 Ca 0.00 0.33 -0.30 0.00 0.48 0.00 0.00 55.95 56.46 3h1c s SER 395 Cb 0.00 -2.07 -0.10 0.00 0.10 0.00 0.00 66.02 63.95 3h1c s SER 395 CO 0.00 0.28 1.40 -2.16 0.98 0.00 0.00 173.24 173.74 3h1c s PRO 396 N -0.23 4.31 0.52 4.02 0.04 -1.26 -5.03 135.00 137.36 3h1c s PRO 396 Ca 0.11 2.21 -0.06 0.00 0.04 0.00 0.00 61.00 63.30 3h1c s PRO 396 Cb -0.11 -3.14 0.12 0.00 0.04 0.00 0.00 34.50 31.40 3h1c s PRO 396 CO 0.01 -0.37 0.71 0.36 0.04 0.00 0.00 177.00 177.75 3h1c n LYS 397 N 2.51 -0.44 0.00 4.56 2.85 -1.26 -4.88 118.16 121.50 3h1c n LYS 397 Ca 0.07 -1.32 0.00 0.00 -1.05 0.00 0.00 58.31 56.01 3h1c n LYS 397 Cb 0.41 -0.66 0.00 0.00 -0.65 0.00 0.00 35.03 34.13 3h1c n LYS 397 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3h1c n ARG 398 N -2.45 0.00 -0.18 -1.58 1.74 -1.26 -2.53 116.66 110.40 3h1c n ARG 398 Ca 0.10 0.44 -0.05 0.00 -0.77 0.00 0.00 57.85 57.57 3h1c n ARG 398 Cb 0.34 -1.16 -0.04 0.00 -1.02 0.00 0.00 32.46 30.58 3h1c n ARG 398 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3h1c n ARG 399 N -1.35 -0.19 -0.16 5.56 1.74 -1.26 -0.09 116.66 120.92 3h1c n ARG 399 Ca 0.00 1.17 0.10 0.00 -0.77 0.00 0.00 57.85 58.36 3h1c n ARG 399 Cb 0.00 -1.74 0.20 0.00 -1.02 0.00 0.00 32.46 29.90 3h1c n ARG 399 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3h1c n GLU 400 N -3.96 -0.03 0.09 5.56 1.02 -1.19 0.38 120.64 122.50 3h1c n GLU 400 Ca 0.01 0.70 -0.18 0.00 -0.02 0.00 0.00 57.16 57.67 3h1c n GLU 400 Cb 0.11 -1.17 -0.11 0.00 -0.02 0.00 0.00 31.44 30.26 3h1c n GLU 400 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3h1c h ILE 401 N 0.00 1.36 -0.26 -3.67 2.04 -0.20 -2.88 117.51 113.90 3h1c h ILE 401 Ca 0.34 -2.58 -0.03 0.00 1.00 0.00 0.00 64.86 63.59 3h1c h ILE 401 Cb 0.79 2.66 -0.01 0.00 -0.74 0.00 0.00 36.82 39.52 3h1c h ILE 401 CO -0.42 0.77 0.04 1.23 0.00 0.00 0.00 178.15 179.77 3h1c h GLY 402 N 0.84 0.47 2.00 5.37 0.00 0.80 -2.26 103.07 110.29 3h1c h GLY 402 Ca -0.15 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 46.82 3h1c h GLY 402 CO 0.21 0.29 -0.24 0.45 0.00 0.00 0.00 176.54 177.25 3h1c h HIS 403 N 0.25 0.00 -0.21 5.60 3.86 -0.78 -2.08 115.15 121.79 3h1c h HIS 403 Ca 0.08 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.11 3h1c h HIS 403 Cb 0.34 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.80 3h1c h HIS 403 CO 0.02 0.24 -0.59 0.78 0.86 0.00 0.00 177.93 179.24 3h1c h GLY 404 N 1.89 0.75 1.93 2.45 0.00 -1.31 -2.24 103.07 106.53 3h1c h GLY 404 Ca -0.00 -0.91 -0.15 0.00 0.00 0.00 0.00 47.33 46.27 3h1c h GLY 404 CO 0.03 0.81 -0.68 -0.09 0.00 0.00 0.00 176.54 176.62 3h1c h ARG 405 N 0.51 0.07 -0.08 4.80 9.65 -1.24 -2.69 114.38 125.40 3h1c h ARG 405 Ca -0.00 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.81 3h1c h ARG 405 Cb 1.17 0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 29.76 3h1c h ARG 405 CO 0.12 0.72 0.02 1.25 2.80 0.00 0.00 179.97 184.88 3h1c h LEU 406 N 0.05 0.13 -1.45 3.80 5.85 -1.29 -2.08 115.31 120.31 3h1c h LEU 406 Ca -0.01 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.45 3h1c h LEU 406 Cb 1.20 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 3h1c h LEU 406 CO 0.09 0.33 -0.12 0.00 -0.34 0.00 0.00 178.44 178.40 3h1c h ALA 407 N 0.81 1.06 -0.24 1.25 0.00 -1.44 -2.64 119.26 118.06 3h1c h ALA 407 Ca 0.03 -0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 3h1c h ALA 407 Cb 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3h1c h ALA 407 CO 0.00 0.15 -0.64 -0.22 0.00 0.00 0.00 179.25 178.55 3h1c h LYS 408 N 0.00 0.85 -0.09 0.00 3.64 -1.28 -3.26 116.57 116.42 3h1c h LYS 408 Ca -0.00 -0.60 -0.09 0.00 -1.27 0.00 0.00 60.65 58.69 3h1c h LYS 408 Cb 0.56 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 3h1c h LYS 408 CO 0.02 1.22 -0.33 0.00 -2.27 0.00 0.00 179.45 178.09 3h1c h ARG 409 N 0.62 0.18 0.00 1.90 3.08 -1.02 -0.97 114.38 118.17 3h1c h ARG 409 Ca -0.01 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3h1c h ARG 409 Cb 1.26 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.30 3h1c h ARG 409 CO 0.14 0.50 0.00 0.41 -1.07 0.00 0.00 179.97 179.94 3h1c n GLY 410 N -0.43 -1.51 0.02 0.04 0.00 -1.10 -3.68 105.19 98.54 3h1c n GLY 410 Ca -0.01 0.03 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.26 0.30 -0.05 1.61 0.31 -1.10 -4.69 118.33 112.44 3h1c n VAL 411 Ca 0.04 -0.26 0.11 0.00 -0.01 0.00 0.00 64.34 64.22 3h1c n VAL 411 Cb 0.34 -0.31 0.51 0.00 -0.91 0.00 0.00 33.84 33.46 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 0.34 -0.95 7.52 5.85 -1.25 -0.04 115.31 126.78 3h1c h LEU 412 Ca -0.12 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.50 3h1c h LEU 412 Cb 0.99 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 3h1c h LEU 412 CO 0.01 0.21 -0.51 0.00 -0.34 0.00 0.00 178.44 177.80 3h1c h ALA 413 N 1.72 1.12 0.18 1.25 0.00 -1.81 -3.27 119.26 118.46 3h1c h ALA 413 Ca 0.24 -0.47 -0.30 0.00 0.00 0.00 0.00 54.91 54.38 3h1c h ALA 413 Cb 0.46 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.18 3h1c h ALA 413 CO -0.06 0.64 -1.43 0.28 0.00 0.00 0.00 179.25 178.68 3h1c h VAL 414 N 0.00 1.16 -1.75 0.00 2.07 -1.35 -3.48 116.25 112.90 3h1c h VAL 414 Ca -0.01 -2.55 -0.67 0.00 0.82 0.00 0.00 66.70 64.30 3h1c h VAL 414 Cb 0.93 2.92 0.07 0.00 -1.52 0.00 0.00 31.29 33.69 3h1c h VAL 414 CO 0.07 0.78 0.29 0.23 0.02 0.00 0.00 177.57 178.96 3h1c n MET 415 N -3.80 1.03 -2.02 1.57 2.00 -0.44 -3.14 117.12 112.31 3h1c n MET 415 Ca -0.21 0.37 -0.35 0.00 0.00 0.00 0.00 57.70 57.51 3h1c n MET 415 Cb 1.00 -1.90 0.03 0.00 0.00 0.00 0.00 33.22 32.35 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 -0.09 3.00 0.93 0.03 0.04 -1.26 -4.93 135.00 132.72 3h1c s PRO 416 Ca 0.78 1.74 -0.13 0.00 0.04 0.00 0.00 61.00 63.44 3h1c s PRO 416 Cb -0.92 -1.94 0.15 0.00 0.04 0.00 0.00 34.50 31.83 3h1c s PRO 416 CO 0.51 -1.16 1.14 0.16 0.04 0.00 0.00 177.00 177.68 3h1c s ASP 417 N -1.73 3.32 0.54 6.66 -4.77 -1.26 -4.80 116.67 114.63 3h1c s ASP 417 Ca 0.75 0.96 0.32 0.00 -3.30 0.00 0.00 52.55 51.29 3h1c s ASP 417 Cb -0.28 -1.53 1.41 0.00 -1.09 0.00 0.00 42.92 41.43 3h1c s ASP 417 CO 0.33 -2.67 2.01 0.24 0.70 0.00 0.00 175.17 175.78 3h1c h MET 418 N -1.58 0.00 0.00 2.11 2.86 -1.97 -1.45 114.93 114.90 3h1c h MET 418 Ca -0.51 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.04 3h1c h MET 418 Cb 1.33 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.98 3h1c h MET 418 CO 0.60 0.06 -0.46 -0.44 1.06 0.00 0.00 176.91 177.73 3h1c h ASP 419 N 0.00 0.00 0.00 1.22 5.19 -2.01 -3.26 116.42 117.56 3h1c h ASP 419 Ca -0.00 0.00 -0.35 0.00 -0.62 0.00 0.00 57.03 56.06 3h1c h ASP 419 Cb 0.48 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.93 3h1c h ASP 419 CO 0.01 0.46 -2.32 1.17 -3.12 0.00 0.00 179.24 175.43 3h1c n LYS 420 N -3.89 0.64 -3.67 3.56 4.81 -1.11 -4.88 118.16 113.62 3h1c n LYS 420 Ca -0.01 0.12 -0.30 0.00 -0.87 0.00 0.00 58.31 57.25 3h1c n LYS 420 Cb 0.49 -1.47 -0.14 0.00 0.02 0.00 0.00 35.03 33.94 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 -2.46 1.60 -1.25 5.64 5.36 -0.56 -5.04 117.98 121.27 3h1c s PHE 421 Ca -0.28 -1.99 -0.04 0.00 -0.96 0.00 0.00 56.93 53.65 3h1c s PHE 421 Cb 0.08 -1.62 0.17 0.00 -0.34 0.00 0.00 43.02 41.31 3h1c s PHE 421 CO 0.57 -0.83 2.23 -0.35 -1.46 0.00 0.00 175.22 175.39 3h1c n PRO 422 N 4.15 4.80 -4.09 10.12 -0.04 -1.23 -4.25 135.00 144.45 3h1c n PRO 422 Ca 0.05 -3.77 -0.15 0.00 -0.04 0.00 0.00 63.50 59.59 3h1c n PRO 422 Cb 0.38 -2.60 -0.14 0.00 -0.04 0.00 0.00 33.50 31.10 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 -1.93 0.41 -0.08 0.54 1.51 -1.26 -4.67 117.35 111.88 3h1c s TYR 423 Ca 0.50 -0.14 -0.30 0.00 -1.01 0.00 0.00 57.07 56.12 3h1c s TYR 423 Cb 0.18 -0.26 -0.02 0.00 -0.11 0.00 0.00 41.96 41.75 3h1c s TYR 423 CO -0.10 -0.02 1.06 0.95 -1.11 0.00 0.00 175.55 176.32 3h1c s THR 424 N -0.31 4.65 -0.13 -0.71 -4.23 -1.10 -4.91 115.64 108.89 3h1c s THR 424 Ca -0.00 1.92 -0.01 0.00 -1.18 0.00 0.00 61.69 62.42 3h1c s THR 424 Cb -0.03 -4.23 -0.02 0.00 1.34 0.00 0.00 72.50 69.56 3h1c s THR 424 CO -0.00 0.02 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.30 3h1c s VAL 425 N 1.94 3.21 -0.21 2.29 1.01 -1.08 -1.87 120.40 125.69 3h1c s VAL 425 Ca 0.51 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.88 3h1c s VAL 425 Cb -0.20 -2.36 0.02 0.00 0.00 0.00 0.00 36.38 33.84 3h1c s VAL 425 CO 0.20 0.52 -0.14 -0.60 0.00 0.00 0.00 175.10 175.08 3h1c s ARG 426 N 0.30 2.95 -0.22 2.72 3.52 -0.40 -0.14 118.95 127.68 3h1c s ARG 426 Ca -0.09 -0.87 -0.04 0.00 -0.13 0.00 0.00 55.73 54.59 3h1c s ARG 426 Cb -0.15 -2.74 -0.01 0.00 -1.56 0.00 0.00 34.95 30.48 3h1c s ARG 426 CO 0.05 -0.28 -0.03 0.08 -0.81 0.00 0.00 175.30 174.32 3h1c s VAL 427 N 1.31 3.54 -0.18 7.11 1.01 0.77 -0.56 120.40 133.39 3h1c s VAL 427 Ca 0.03 -0.44 -0.03 0.00 0.00 0.00 0.00 61.98 61.54 3h1c s VAL 427 Cb -0.15 -2.61 -0.01 0.00 0.00 0.00 0.00 36.38 33.61 3h1c s VAL 427 CO -0.09 0.42 -0.07 -0.69 0.00 0.00 0.00 175.10 174.66 3h1c s VAL 428 N 1.42 3.29 -0.22 2.92 1.01 -0.01 -0.85 120.40 127.95 3h1c s VAL 428 Ca 0.05 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 3h1c s VAL 428 Cb -0.14 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 3h1c s VAL 428 CO -0.02 0.47 0.03 -0.55 0.00 0.00 0.00 175.10 175.03 3h1c s SER 429 N 1.00 4.99 -0.31 3.32 0.15 -0.01 -0.70 113.70 122.13 3h1c s SER 429 Ca -0.00 -0.19 -0.03 0.00 0.70 0.00 0.00 55.95 56.42 3h1c s SER 429 Cb -0.15 -1.87 0.05 0.00 -1.71 0.00 0.00 66.02 62.34 3h1c s SER 429 CO -0.00 0.03 0.03 -1.61 1.20 0.00 0.00 173.24 172.89 3h1c s GLU 430 N 1.22 2.49 -0.47 5.44 0.41 0.40 -1.90 118.70 126.29 3h1c s GLU 430 Ca 0.04 -1.24 -0.28 0.00 -0.41 0.00 0.00 54.97 53.08 3h1c s GLU 430 Cb -0.15 -3.27 0.01 0.00 -1.78 0.00 0.00 34.13 28.94 3h1c s GLU 430 CO 0.02 -0.63 1.48 0.42 -0.49 0.00 0.00 175.26 176.06 3h1c s ILE 431 N 1.30 3.78 -0.00 -1.63 -1.09 -1.11 0.51 121.20 122.96 3h1c s ILE 431 Ca -0.04 0.74 -0.14 0.00 -2.23 0.00 0.00 60.65 58.97 3h1c s ILE 431 Cb -0.20 -4.22 -0.34 0.00 -1.58 0.00 0.00 42.46 36.13 3h1c s ILE 431 CO 0.00 -0.88 0.88 0.71 -1.23 0.00 0.00 174.94 174.42 3h1c h THR 432 N 6.50 1.16 -3.26 2.92 1.35 -1.81 -3.41 112.91 116.37 3h1c h THR 432 Ca -0.28 -2.63 -0.14 0.00 -0.55 0.00 0.00 66.41 62.82 3h1c h THR 432 Cb 1.11 2.95 -0.21 0.00 -1.73 0.00 0.00 68.15 70.27 3h1c h THR 432 CO 1.12 0.82 -0.40 -1.83 -0.25 0.00 0.00 175.52 174.99 3h1c s GLU 433 N -2.59 0.52 -0.04 4.72 -1.05 -1.17 -3.92 118.70 115.17 3h1c s GLU 433 Ca -0.12 -0.18 -0.00 0.00 -0.15 0.00 0.00 54.97 54.52 3h1c s GLU 433 Cb 0.04 0.23 0.03 0.00 -0.44 0.00 0.00 34.13 33.99 3h1c s GLU 433 CO 0.91 -0.13 0.01 0.45 0.95 0.00 0.00 175.26 177.46 3h1c s SER 434 N -1.08 0.66 0.00 0.83 0.15 -0.89 -1.48 113.70 111.89 3h1c s SER 434 Ca -0.12 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.52 3h1c s SER 434 Cb -0.06 -0.24 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 3h1c s SER 434 CO 0.02 -0.13 0.00 -3.20 1.20 0.00 0.00 173.24 171.13 3h1c n ASN 435 N 4.41 1.00 0.00 5.45 5.15 -1.26 -4.59 115.26 125.41 3h1c n ASN 435 Ca -0.21 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.77 3h1c n ASN 435 Cb 0.50 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.75 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 2.00 0.78 3.57 8.20 0.00 -1.26 0.63 105.19 119.10 3h1c n GLY 436 Ca 0.00 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 1.00 5.52 -0.11 1.61 0.15 -1.26 -4.83 113.70 115.78 3h1c s SER 437 Ca 0.00 -0.03 0.08 0.00 0.70 0.00 0.00 55.95 56.70 3h1c s SER 437 Cb 0.00 -1.97 -0.12 0.00 -1.71 0.00 0.00 66.02 62.22 3h1c s SER 437 CO 0.00 0.08 0.00 -1.20 1.20 0.00 0.00 173.24 173.32 3h1c n SER 438 N 4.19 2.51 -0.11 5.45 7.64 -1.26 -4.19 113.62 127.85 3h1c n SER 438 Ca -0.16 -0.02 -0.13 0.00 1.01 0.00 0.00 58.87 59.58 3h1c n SER 438 Cb 0.52 0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 64.24 3h1c n SER 438 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3h1c h SER 439 N 0.00 0.83 0.00 6.43 4.64 -1.93 -3.28 113.55 120.24 3h1c h SER 439 Ca -0.29 -0.45 0.00 0.00 -0.47 0.00 0.00 61.79 60.58 3h1c h SER 439 Cb 1.61 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 3h1c h SER 439 CO 0.00 1.10 0.00 0.23 -0.87 0.00 0.00 176.83 177.30 3h1c n MET 440 N -4.22 0.00 -0.29 4.77 2.00 -1.26 -3.61 117.12 114.51 3h1c n MET 440 Ca -0.03 0.45 -0.02 0.00 0.00 0.00 0.00 57.70 58.10 3h1c n MET 440 Cb 0.47 -1.40 0.01 0.00 0.00 0.00 0.00 33.22 32.31 3h1c n MET 440 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3h1c n ALA 441 N -1.85 -0.15 -0.29 3.04 0.00 -1.26 -0.06 120.51 119.93 3h1c n ALA 441 Ca 0.00 0.73 -0.08 0.00 0.00 0.00 0.00 53.44 54.10 3h1c n ALA 441 Cb 0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 19.45 19.08 3h1c n ALA 441 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3h1c n SER 442 N -5.08 -0.73 -0.41 0.00 7.64 -1.24 0.28 113.62 114.08 3h1c n SER 442 Ca 0.07 1.26 0.36 0.00 1.01 0.00 0.00 58.87 61.57 3h1c n SER 442 Cb 0.29 -0.17 0.69 0.00 -1.01 0.00 0.00 64.21 64.01 3h1c n SER 442 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 3h1c h VAL 443 N 0.00 0.32 -0.19 0.44 -1.51 -0.54 2.85 116.25 117.62 3h1c h VAL 443 Ca 0.11 -0.03 -0.19 0.00 -1.23 0.00 0.00 66.70 65.35 3h1c h VAL 443 Cb 0.28 0.21 0.00 0.00 -2.13 0.00 0.00 31.29 29.65 3h1c h VAL 443 CO -0.65 0.02 -0.65 0.00 -1.23 0.00 0.00 177.57 175.05 3h1c h GLY 445 N 0.82 0.14 1.03 0.00 0.00 0.61 -3.13 103.07 102.54 3h1c h GLY 445 Ca -0.02 -0.18 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 3h1c h GLY 445 CO 0.13 0.16 -0.18 0.00 0.00 0.00 0.00 176.54 176.65 3h1c h ALA 446 N 1.26 0.58 -0.37 3.60 0.00 0.84 -1.16 119.26 124.02 3h1c h ALA 446 Ca -0.01 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 3h1c h ALA 446 Cb 1.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3h1c h ALA 446 CO 0.09 0.53 0.02 1.03 0.00 0.00 0.00 179.25 180.93 3h1c h SER 447 N 0.68 0.53 0.70 0.00 0.87 -1.54 0.41 113.55 115.20 3h1c h SER 447 Ca 0.09 -0.10 -0.21 0.00 -1.23 0.00 0.00 61.79 60.34 3h1c h SER 447 Cb 0.74 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 3h1c h SER 447 CO 0.06 0.59 -0.97 -0.07 -0.53 0.00 0.00 176.83 175.90 3h1c h LEU 448 N 0.55 0.21 -0.10 2.23 3.38 -1.48 -2.95 115.31 117.15 3h1c h LEU 448 Ca 0.12 -0.20 -0.24 0.00 0.09 0.00 0.00 57.88 57.65 3h1c h LEU 448 Cb 0.32 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.01 3h1c h LEU 448 CO 0.01 1.06 -0.91 0.00 0.09 0.00 0.00 178.44 178.69 3h1c h ALA 449 N 0.91 0.25 -0.15 1.53 0.00 -0.82 -2.42 119.26 118.56 3h1c h ALA 449 Ca -0.05 -0.65 -0.13 0.00 0.00 0.00 0.00 54.91 54.07 3h1c h ALA 449 Cb 1.65 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 3h1c h ALA 449 CO 0.15 0.70 -0.47 -0.07 0.00 0.00 0.00 179.25 179.56 3h1c h LEU 450 N 0.44 0.41 0.36 0.00 3.38 -1.03 -1.63 115.31 117.24 3h1c h LEU 450 Ca -0.09 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 3h1c h LEU 450 Cb 1.55 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.19 3h1c h LEU 450 CO 0.18 0.82 -0.17 0.24 0.09 0.00 0.00 178.44 179.60 3h1c h MET 451 N 0.31 -0.46 -0.95 1.13 2.86 -1.57 -1.53 114.93 114.72 3h1c h MET 451 Ca 0.02 0.03 0.27 0.00 -2.06 0.00 0.00 59.70 57.96 3h1c h MET 451 Cb 0.94 0.10 -0.05 0.00 0.06 0.00 0.00 31.60 32.66 3h1c h MET 451 CO 0.08 -0.14 0.67 0.22 1.06 0.00 0.00 176.91 178.80 3h1c h ASP 452 N -0.93 0.08 -0.04 1.22 3.58 -1.33 0.39 116.42 119.39 3h1c h ASP 452 Ca -0.05 0.01 -0.16 0.00 0.42 0.00 0.00 57.03 57.25 3h1c h ASP 452 Cb 0.53 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 3h1c h ASP 452 CO 0.08 0.02 -0.51 0.00 -2.88 0.00 0.00 179.24 175.95 3h1c h ALA 453 N 1.54 0.70 0.00 -0.78 0.00 -1.20 -3.43 119.26 116.09 3h1c h ALA 453 Ca 0.46 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3h1c h ALA 453 Cb 1.72 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.42 3h1c h ALA 453 CO -0.04 0.68 0.00 0.41 0.00 0.00 0.00 179.25 180.29 3h1c n GLY 454 N 0.20 1.35 3.66 0.00 0.00 0.14 -4.78 105.19 105.75 3h1c n GLY 454 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.96 4.43 -1.23 1.61 1.01 -0.60 -4.95 120.40 118.71 3h1c s VAL 455 Ca 0.00 1.72 -0.20 0.00 0.00 0.00 0.00 61.98 63.50 3h1c s VAL 455 Cb 0.00 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 32.23 3h1c s VAL 455 CO 0.00 -0.20 1.81 -2.16 0.00 0.00 0.00 175.10 174.55 3h1c s PRO 456 N 3.45 3.35 0.54 2.72 0.04 -1.26 -4.40 135.00 139.43 3h1c s PRO 456 Ca 0.50 -1.59 -0.19 0.00 0.04 0.00 0.00 61.00 59.76 3h1c s PRO 456 Cb -0.18 -5.40 -0.06 0.00 0.04 0.00 0.00 34.50 28.89 3h1c s PRO 456 CO 0.12 -2.96 1.10 0.96 0.04 0.00 0.00 177.00 176.27 3h1c s ILE 457 N 7.06 3.34 0.02 0.56 -4.36 -1.26 -4.44 121.20 122.11 3h1c s ILE 457 Ca 0.60 0.81 -0.25 0.00 -0.26 0.00 0.00 60.65 61.54 3h1c s ILE 457 Cb 0.02 -3.32 -0.17 0.00 1.25 0.00 0.00 42.46 40.23 3h1c s ILE 457 CO 0.09 -0.20 1.39 0.11 0.24 0.00 0.00 174.94 176.57 3h1c h LYS 458 N 1.17 -0.20 -2.84 0.37 1.57 -1.90 -3.47 116.57 111.27 3h1c h LYS 458 Ca -0.50 0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.20 3h1c h LYS 458 Cb 1.25 0.05 -0.19 0.00 0.08 0.00 0.00 32.23 33.41 3h1c h LYS 458 CO 0.57 0.09 -0.16 0.00 -0.57 0.00 0.00 179.45 179.38 3h1c s ALA 459 N -5.04 -1.01 0.24 3.86 0.00 -1.26 -5.14 121.76 113.41 3h1c s ALA 459 Ca -0.15 0.51 -0.31 0.00 0.00 0.00 0.00 51.96 52.01 3h1c s ALA 459 Cb 0.03 0.11 -0.12 0.00 0.00 0.00 0.00 23.12 23.14 3h1c s ALA 459 CO 0.62 -0.31 1.68 0.00 0.00 0.00 0.00 175.76 177.74 3h1c s ALA 460 N -1.50 3.87 -0.02 0.00 0.00 -1.26 -4.97 121.76 117.88 3h1c s ALA 460 Ca -0.12 1.59 0.07 0.00 0.00 0.00 0.00 51.96 53.51 3h1c s ALA 460 Cb -0.03 -3.68 -0.02 0.00 0.00 0.00 0.00 23.12 19.38 3h1c s ALA 460 CO 0.04 -0.95 -0.24 0.54 0.00 0.00 0.00 175.76 175.15 3h1c s VAL 461 N 0.76 2.20 0.05 0.00 0.11 -1.26 -3.87 120.40 118.39 3h1c s VAL 461 Ca 0.71 -1.06 0.01 0.00 -2.93 0.00 0.00 61.98 58.71 3h1c s VAL 461 Cb -0.49 -1.78 -0.00 0.00 -1.53 0.00 0.00 36.38 32.58 3h1c s VAL 461 CO 0.38 0.58 0.03 0.00 -3.33 0.00 0.00 175.10 172.76 3h1c n ALA 462 N 2.40 0.10 0.00 1.54 0.00 -0.36 -4.24 120.51 119.95 3h1c n ALA 462 Ca -0.16 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 52.98 3h1c n ALA 462 Cb 0.51 0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.19 3h1c n ALA 462 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h1c n GLY 463 N 0.71 1.69 3.05 0.00 0.00 -1.26 -1.19 105.19 108.20 3h1c n GLY 463 Ca 0.00 -0.11 -0.08 0.00 0.00 0.00 0.00 46.02 45.84 3h1c n GLY 463 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3h1c s ILE 464 N -1.37 0.16 0.02 -0.61 -5.25 -0.50 -4.12 121.20 109.54 3h1c s ILE 464 Ca 0.00 -1.36 -0.05 0.00 -0.99 0.00 0.00 60.65 58.25 3h1c s ILE 464 Cb 0.00 -0.94 -0.05 0.00 2.95 0.00 0.00 42.46 44.42 3h1c s ILE 464 CO 0.00 -0.75 0.26 0.00 -1.79 0.00 0.00 174.94 172.66 3h1c s ALA 465 N -2.79 3.88 0.32 2.27 0.00 -1.26 -1.99 121.76 122.19 3h1c s ALA 465 Ca -0.04 -0.63 0.10 0.00 0.00 0.00 0.00 51.96 51.39 3h1c s ALA 465 Cb -0.00 -2.02 -0.06 0.00 0.00 0.00 0.00 23.12 21.04 3h1c s ALA 465 CO -0.06 0.68 -0.08 -1.64 0.00 0.00 0.00 175.76 174.67 3h1c s MET 466 N -1.93 1.91 0.36 0.00 1.00 0.12 -2.31 119.30 118.46 3h1c s MET 466 Ca 0.29 -1.78 0.06 0.00 0.00 0.00 0.00 55.69 54.26 3h1c s MET 466 Cb -0.13 -1.84 -0.03 0.00 0.00 0.00 0.00 34.83 32.84 3h1c s MET 466 CO 0.18 0.21 0.22 0.20 0.00 0.00 0.00 175.02 175.83 3h1c s GLY 467 N -3.62 2.46 -0.17 -0.03 0.00 -0.86 -0.31 107.32 104.79 3h1c s GLY 467 Ca 0.32 -1.70 -0.14 0.00 0.00 0.00 0.00 44.72 43.21 3h1c s GLY 467 CO 0.17 -1.62 0.43 -2.27 0.00 0.00 0.00 173.10 169.81 3h1c s LEU 468 N -3.47 0.22 -0.34 0.66 2.96 -1.26 -1.92 118.68 115.54 3h1c s LEU 468 Ca 0.33 0.88 0.04 0.00 -0.22 0.00 0.00 54.13 55.16 3h1c s LEU 468 Cb 0.02 1.46 0.10 0.00 0.50 0.00 0.00 46.19 48.27 3h1c s LEU 468 CO 0.22 -0.16 0.05 -0.69 -1.32 0.00 0.00 176.35 174.45 3h1c s VAL 469 N 0.54 2.19 -0.14 1.68 1.01 -0.86 -1.62 120.40 123.20 3h1c s VAL 469 Ca -0.03 -2.27 -0.01 0.00 0.00 0.00 0.00 61.98 59.67 3h1c s VAL 469 Cb -0.04 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 3h1c s VAL 469 CO -0.03 -0.59 -0.10 -0.75 0.00 0.00 0.00 175.10 173.63 3h1c s LYS 470 N 0.95 3.47 -0.27 2.72 2.20 -1.26 -2.44 119.74 125.11 3h1c s LYS 470 Ca 0.10 -0.63 -0.03 0.00 -0.36 0.00 0.00 55.97 55.05 3h1c s LYS 470 Cb -0.19 -2.73 0.11 0.00 -1.51 0.00 0.00 37.83 33.51 3h1c s LYS 470 CO -0.09 0.20 0.20 -2.00 -0.36 0.00 0.00 175.35 173.31 3h1c s GLU 471 N 0.40 0.23 2.11 4.03 2.56 -1.17 -5.04 118.70 121.82 3h1c s GLU 471 Ca -0.08 -0.23 0.00 0.00 0.00 0.00 0.00 54.97 54.66 3h1c s GLU 471 Cb -0.15 -1.04 0.00 0.00 2.00 0.00 0.00 34.13 34.94 3h1c s GLU 471 CO 0.04 -0.93 0.00 0.41 -0.56 0.00 0.00 175.26 174.22 3h1c n GLY 472 N 5.29 1.52 0.00 -1.50 0.00 -1.26 -4.06 105.19 105.18 3h1c n GLY 472 Ca -0.05 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 3.68 3.41 -4.84 1.61 5.75 -1.26 -5.08 116.55 119.82 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 0.18 0.02 0.00 -1.03 0.00 0.00 41.12 40.29 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 -3.17 5.92 0.08 -1.12 4.22 -1.26 -5.08 114.94 114.53 3h1c s ASN 474 Ca 0.00 1.59 -0.15 0.00 -2.14 0.00 0.00 52.86 52.16 3h1c s ASN 474 Cb 0.00 -2.50 0.03 0.00 1.28 0.00 0.00 41.25 40.06 3h1c s ASN 474 CO 0.00 -1.07 0.34 -0.72 -2.04 0.00 0.00 177.10 173.61 3h1c s TYR 475 N -2.91 -0.14 -0.09 1.54 -0.85 -1.26 -3.05 117.35 110.60 3h1c s TYR 475 Ca 0.58 -0.08 0.01 0.00 -0.52 0.00 0.00 57.07 57.06 3h1c s TYR 475 Cb -0.13 0.15 0.02 0.00 0.38 0.00 0.00 41.96 42.39 3h1c s TYR 475 CO 0.47 -0.59 -0.08 0.08 -1.52 0.00 0.00 175.55 173.91 3h1c s VAL 476 N -3.15 0.95 -0.15 -3.49 1.01 -1.02 -5.01 120.40 109.54 3h1c s VAL 476 Ca -0.01 -0.30 -0.18 0.00 0.00 0.00 0.00 61.98 61.50 3h1c s VAL 476 Cb 0.01 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 3h1c s VAL 476 CO -0.07 0.34 0.46 -0.69 0.00 0.00 0.00 175.10 175.14 3h1c s VAL 477 N 1.28 5.18 -0.10 2.92 1.01 -1.26 -2.03 120.40 127.40 3h1c s VAL 477 Ca -0.04 0.89 -0.04 0.00 0.00 0.00 0.00 61.98 62.79 3h1c s VAL 477 Cb -0.14 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 3h1c s VAL 477 CO -0.03 0.29 0.06 -0.76 0.00 0.00 0.00 175.10 174.66 3h1c s LEU 478 N 0.92 3.91 -0.19 3.92 1.02 -0.81 -4.64 118.68 122.81 3h1c s LEU 478 Ca 0.24 0.28 -0.06 0.00 0.02 0.00 0.00 54.13 54.60 3h1c s LEU 478 Cb -0.15 -1.92 -0.03 0.00 0.02 0.00 0.00 46.19 44.11 3h1c s LEU 478 CO 0.09 0.39 0.03 -0.44 0.02 0.00 0.00 176.35 176.44 3h1c s SER 479 N -0.94 5.25 -0.59 2.29 0.01 0.86 -2.02 113.70 118.57 3h1c s SER 479 Ca 0.14 -0.04 -0.12 0.00 1.31 0.00 0.00 55.95 57.24 3h1c s SER 479 Cb -0.12 -1.90 0.02 0.00 0.21 0.00 0.00 66.02 64.24 3h1c s SER 479 CO 0.03 0.13 0.64 -0.67 0.41 0.00 0.00 173.24 173.79 3h1c n ASP 480 N 3.80 -7.17 -4.77 2.44 2.03 -0.98 -4.57 116.55 107.33 3h1c n ASP 480 Ca -0.17 0.04 -0.34 0.00 0.52 0.00 0.00 54.79 54.84 3h1c n ASP 480 Cb 0.52 -4.37 0.03 0.00 -0.72 0.00 0.00 41.12 36.57 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 -2.63 3.10 0.44 5.18 -4.36 -1.22 -4.82 121.20 116.89 3h1c s ILE 481 Ca 0.15 0.61 -0.00 0.00 -0.26 0.00 0.00 60.65 61.15 3h1c s ILE 481 Cb -0.03 -3.18 0.09 0.00 1.25 0.00 0.00 42.46 40.58 3h1c s ILE 481 CO 0.79 -0.22 0.60 0.18 0.24 0.00 0.00 174.94 176.53 3h1c n LEU 482 N -1.81 0.00 -0.15 0.37 4.77 -1.26 -4.38 117.00 114.54 3h1c n LEU 482 Ca 0.11 -1.24 -0.10 0.00 -0.03 0.00 0.00 56.01 54.75 3h1c n LEU 482 Cb 0.51 -0.39 0.03 0.00 -2.33 0.00 0.00 43.42 41.24 3h1c n LEU 482 CO 0.45 -0.80 0.70 1.23 -1.33 0.00 0.00 177.39 177.64 3h1c h GLY 483 N -0.37 1.03 2.00 -0.72 0.00 -0.13 -2.85 103.07 102.02 3h1c h GLY 483 Ca -0.20 -0.88 0.00 0.00 0.00 0.00 0.00 47.33 46.25 3h1c h GLY 483 CO 0.21 0.80 0.00 -0.55 0.00 0.00 0.00 176.54 177.00 3h1c h ASP 484 N 0.83 0.00 0.37 0.19 3.32 -1.96 -2.91 116.42 116.26 3h1c h ASP 484 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3h1c h ASP 484 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3h1c h ASP 484 CO 0.06 0.00 -0.38 -0.62 -1.72 0.00 0.00 179.24 176.58 3h1c n GLU 485 N -2.70 0.41 -0.12 3.56 1.02 -1.14 -3.26 120.64 118.41 3h1c n GLU 485 Ca 0.04 -0.24 -0.20 0.00 -0.02 0.00 0.00 57.16 56.74 3h1c n GLU 485 Cb 0.46 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.28 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 -1.09 2.03 0.16 1.62 2.03 -1.09 -3.10 116.55 117.11 3h1c n ASP 486 Ca 0.09 0.02 0.02 0.00 0.52 0.00 0.00 54.79 55.44 3h1c n ASP 486 Cb 0.34 -0.50 0.23 0.00 -0.72 0.00 0.00 41.12 40.47 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 -0.31 0.00 -0.01 -0.67 3.86 -1.68 -3.17 115.15 113.17 3h1c h HIS 487 Ca -0.57 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.64 3h1c h HIS 487 Cb 1.74 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.21 3h1c h HIS 487 CO -0.01 0.50 -0.54 1.28 0.86 0.00 0.00 177.93 180.02 3h1c n LEU 488 N -3.59 1.15 0.00 2.43 4.77 -1.20 -5.01 117.00 115.55 3h1c n LEU 488 Ca -0.00 -0.63 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 3h1c n LEU 488 Cb 0.58 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 3h1c n LEU 488 CO 0.39 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 3h1c n GLY 489 N 1.26 -1.38 0.03 -0.72 0.00 -1.18 -4.95 105.19 98.25 3h1c n GLY 489 Ca 0.05 -1.62 0.01 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.66 1.97 -3.58 1.61 8.00 -0.64 -4.96 116.55 116.28 3h1c n ASP 490 Ca 0.00 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.38 3h1c n ASP 490 Cb 0.00 1.22 -0.04 0.00 -0.02 0.00 0.00 41.12 42.28 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 -2.62 1.08 -0.78 -1.24 0.23 -1.26 -0.44 119.30 114.27 3h1c s MET 491 Ca -0.05 -0.51 0.03 0.00 -1.03 0.00 0.00 55.69 54.12 3h1c s MET 491 Cb 0.06 0.48 0.21 0.00 -1.53 0.00 0.00 34.83 34.06 3h1c s MET 491 CO 0.53 -0.42 0.69 -3.47 -2.03 0.00 0.00 175.02 170.32 3h1c n ASP 492 N -0.02 3.74 -4.57 -1.18 -0.08 0.89 -4.17 116.55 111.16 3h1c n ASP 492 Ca -0.17 -3.25 -0.42 0.00 -1.51 0.00 0.00 54.79 49.44 3h1c n ASP 492 Cb 0.63 -0.86 -0.01 0.00 2.34 0.00 0.00 41.12 43.21 3h1c n ASP 492 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 3h1c s PHE 493 N -1.72 2.72 -0.03 -0.67 5.36 0.57 -3.32 117.98 120.90 3h1c s PHE 493 Ca 0.29 -1.40 -0.27 0.00 -0.96 0.00 0.00 56.93 54.59 3h1c s PHE 493 Cb -0.01 -4.73 -0.03 0.00 -0.34 0.00 0.00 43.02 37.91 3h1c s PHE 493 CO -0.11 -1.84 0.86 0.15 -1.46 0.00 0.00 175.22 172.82 3h1c s LYS 494 N 4.41 4.51 -0.03 10.12 1.02 0.13 0.16 119.74 140.05 3h1c s LYS 494 Ca 0.51 1.19 0.01 0.00 0.02 0.00 0.00 55.97 57.71 3h1c s LYS 494 Cb 0.03 -3.45 0.02 0.00 -0.52 0.00 0.00 37.83 33.90 3h1c s LYS 494 CO 0.02 0.00 -0.04 0.08 -0.92 0.00 0.00 175.35 174.49 3h1c s VAL 495 N 0.91 0.46 -0.02 3.17 1.01 -0.84 -0.47 120.40 124.62 3h1c s VAL 495 Ca 0.46 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.33 3h1c s VAL 495 Cb -0.20 -0.48 0.02 0.00 0.00 0.00 0.00 36.38 35.72 3h1c s VAL 495 CO 0.24 0.19 -0.01 0.00 0.00 0.00 0.00 175.10 175.52 3h1c s ALA 496 N 0.71 0.35 0.10 5.51 0.00 -0.51 -1.40 121.76 126.52 3h1c s ALA 496 Ca -0.09 0.07 -0.15 0.00 0.00 0.00 0.00 51.96 51.80 3h1c s ALA 496 Cb -0.12 -0.27 0.05 0.00 0.00 0.00 0.00 23.12 22.78 3h1c s ALA 496 CO -0.00 -0.03 0.69 0.41 0.00 0.00 0.00 175.76 176.84 3h1c n GLY 497 N 3.85 0.79 0.00 0.00 0.00 -0.33 -1.49 105.19 108.01 3h1c n GLY 497 Ca -0.24 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.72 3h1c n GLY 497 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h1c n SER 498 N -1.01 0.14 0.01 1.61 3.41 -0.00 -1.22 113.62 116.56 3h1c n SER 498 Ca -0.01 -0.30 -0.06 0.00 -0.26 0.00 0.00 58.87 58.24 3h1c n SER 498 Cb 0.38 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.47 3h1c n SER 498 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3h1c h ARG 499 N 0.00 0.49 0.00 4.33 9.65 -1.94 -3.36 114.38 123.55 3h1c h ARG 499 Ca 0.00 -0.23 -0.09 0.00 -1.10 0.00 0.00 59.98 58.56 3h1c h ARG 499 Cb 0.00 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.56 3h1c h ARG 499 CO 0.00 0.80 -0.64 -0.44 2.80 0.00 0.00 179.97 182.48 3h1c h ASP 500 N 0.41 0.00 -0.26 -3.80 3.32 -1.94 -3.50 116.42 110.65 3h1c h ASP 500 Ca 0.04 -0.37 0.00 0.00 0.02 0.00 0.00 57.03 56.73 3h1c h ASP 500 Cb 0.85 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.40 3h1c h ASP 500 CO 0.07 1.05 0.00 0.61 -1.72 0.00 0.00 179.24 179.25 3h1c n GLY 501 N 1.57 5.07 3.41 2.75 0.00 -1.25 -4.87 105.19 111.87 3h1c n GLY 501 Ca -0.16 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.10 3.36 -0.10 -0.61 1.01 -0.16 -0.82 121.20 122.78 3h1c s ILE 502 Ca 0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 60.65 60.08 3h1c s ILE 502 Cb 0.00 -2.44 -0.01 0.00 0.01 0.00 0.00 42.46 40.03 3h1c s ILE 502 CO 0.00 0.51 -0.03 0.77 0.00 0.00 0.00 174.94 176.19 3h1c h SER 503 N 6.77 0.00 -3.88 3.58 4.64 -1.48 -3.30 113.55 119.87 3h1c h SER 503 Ca -0.28 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.94 3h1c h SER 503 Cb 1.20 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.06 3h1c h SER 503 CO 0.58 0.51 -0.13 0.00 -0.87 0.00 0.00 176.83 176.92 3h1c s ALA 504 N -2.62 -1.25 0.01 5.18 0.00 -0.56 -1.30 121.76 121.22 3h1c s ALA 504 Ca -0.03 1.45 0.05 0.00 0.00 0.00 0.00 51.96 53.43 3h1c s ALA 504 Cb 0.00 -0.84 -0.02 0.00 0.00 0.00 0.00 23.12 22.26 3h1c s ALA 504 CO 0.04 -0.24 -0.14 -0.48 0.00 0.00 0.00 175.76 174.93 3h1c s LEU 505 N 0.33 2.09 -0.18 0.00 0.05 -1.26 -1.43 118.68 118.28 3h1c s LEU 505 Ca -0.01 -0.35 -0.03 0.00 0.05 0.00 0.00 54.13 53.79 3h1c s LEU 505 Cb -0.04 -0.68 -0.02 0.00 -2.05 0.00 0.00 46.19 43.40 3h1c s LEU 505 CO -0.00 0.12 -0.05 -1.58 -0.55 0.00 0.00 176.35 174.29 3h1c s GLN 506 N -0.69 3.50 -0.31 1.48 0.74 0.38 -2.99 119.66 121.76 3h1c s GLN 506 Ca 0.04 -0.59 -0.06 0.00 0.05 0.00 0.00 55.36 54.80 3h1c s GLN 506 Cb -0.07 -2.94 0.03 0.00 1.10 0.00 0.00 33.01 31.13 3h1c s GLN 506 CO 0.00 0.02 0.08 1.41 -0.55 0.00 0.00 175.29 176.26 3h1c s MET 507 N 0.91 2.81 -0.33 1.67 -2.45 -0.15 -0.69 119.30 121.07 3h1c s MET 507 Ca -0.01 -1.04 0.02 0.00 -1.25 0.00 0.00 55.69 53.42 3h1c s MET 507 Cb -0.15 -3.39 0.10 0.00 1.25 0.00 0.00 34.83 32.65 3h1c s MET 507 CO 0.01 -0.56 0.06 -0.51 1.05 0.00 0.00 175.02 175.08 3h1c s ASP 508 N 1.43 4.51 -0.13 1.11 1.01 -1.21 -1.92 116.67 121.48 3h1c s ASP 508 Ca 0.00 -1.97 -0.03 0.00 0.71 0.00 0.00 52.55 51.25 3h1c s ASP 508 Cb -0.18 -1.37 -0.03 0.00 1.01 0.00 0.00 42.92 42.35 3h1c s ASP 508 CO 0.02 -0.39 -0.01 -0.63 0.21 0.00 0.00 175.17 174.37 3h1c s ILE 509 N 1.15 4.15 -0.40 0.77 1.01 -0.78 -0.08 121.20 127.02 3h1c s ILE 509 Ca 0.10 -0.28 0.22 0.00 0.00 0.00 0.00 60.65 60.69 3h1c s ILE 509 Cb -0.18 -2.79 -0.22 0.00 0.01 0.00 0.00 42.46 39.28 3h1c s ILE 509 CO -0.14 0.53 0.78 0.29 0.00 0.00 0.00 174.94 176.40 3h1c n LYS 510 N 2.97 0.42 -4.40 2.79 5.02 0.42 -4.85 118.16 120.53 3h1c n LYS 510 Ca -0.18 -0.07 -0.29 0.00 -2.02 0.00 0.00 58.31 55.75 3h1c n LYS 510 Cb 0.53 -1.57 -0.13 0.00 -0.02 0.00 0.00 35.03 33.84 3h1c n LYS 510 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3h1c s ILE 511 N -3.31 2.29 -0.10 -0.18 -4.36 -1.25 -4.77 121.20 109.52 3h1c s ILE 511 Ca -0.01 -1.73 -0.13 0.00 -0.26 0.00 0.00 60.65 58.52 3h1c s ILE 511 Cb 0.14 -2.01 -0.05 0.00 1.25 0.00 0.00 42.46 41.79 3h1c s ILE 511 CO 0.86 0.10 0.30 -1.83 0.24 0.00 0.00 174.94 174.61 3h1c s GLU 512 N -2.04 4.00 0.00 0.37 -1.05 -1.26 -4.48 118.70 114.25 3h1c s GLU 512 Ca 0.14 0.15 0.00 0.00 -0.15 0.00 0.00 54.97 55.11 3h1c s GLU 512 Cb -0.10 -3.32 0.00 0.00 -0.44 0.00 0.00 34.13 30.27 3h1c s GLU 512 CO 0.06 0.47 0.00 0.41 0.95 0.00 0.00 175.26 177.15 3h1c n GLY 513 N 2.65 1.03 3.76 -3.83 0.00 -1.26 -5.05 105.19 102.50 3h1c n GLY 513 Ca -0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 3h1c n GLY 513 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h1c s ILE 514 N -1.36 3.51 0.30 -0.61 -1.09 -1.26 -5.04 121.20 115.65 3h1c s ILE 514 Ca 0.00 1.48 0.11 0.00 -2.23 0.00 0.00 60.65 60.01 3h1c s ILE 514 Cb 0.00 -3.92 -0.05 0.00 -1.58 0.00 0.00 42.46 36.90 3h1c s ILE 514 CO 0.00 0.32 -0.16 0.42 -1.23 0.00 0.00 174.94 174.29 3h1c s THR 515 N -1.22 2.43 0.06 2.92 -4.23 -1.26 -4.49 115.64 109.85 3h1c s THR 515 Ca 0.46 -2.32 0.27 0.00 -1.18 0.00 0.00 61.69 58.91 3h1c s THR 515 Cb -0.31 -2.43 0.29 0.00 1.34 0.00 0.00 72.50 71.39 3h1c s THR 515 CO 0.39 -0.33 1.85 0.07 -0.54 0.00 0.00 174.62 176.06 3h1c h LYS 516 N 2.17 0.00 -0.26 3.99 -0.00 -1.98 -2.45 116.57 118.04 3h1c h LYS 516 Ca -0.41 0.00 -0.18 0.00 -0.00 0.00 0.00 60.65 60.06 3h1c h LYS 516 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.49 3h1c h LYS 516 CO 0.63 0.14 -0.54 1.49 -0.00 0.00 0.00 179.45 181.17 3h1c h GLU 517 N 0.00 0.84 0.00 0.07 4.22 -2.01 -2.87 114.58 114.82 3h1c h GLU 517 Ca -0.00 -0.55 0.00 0.00 0.08 0.00 0.00 59.36 58.89 3h1c h GLU 517 Cb 0.71 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.03 3h1c h GLU 517 CO 0.02 1.18 -0.23 0.44 -2.18 0.00 0.00 179.01 178.23 3h1c n ILE 518 N -4.04 0.33 0.05 2.32 -5.35 -1.19 -3.33 119.36 108.15 3h1c n ILE 518 Ca -0.05 -0.19 -0.09 0.00 -0.27 0.00 0.00 62.75 62.16 3h1c n ILE 518 Cb 0.63 -0.34 0.05 0.00 -1.74 0.00 0.00 39.64 38.24 3h1c n ILE 518 CO 0.00 0.00 0.00 -0.03 -1.76 0.00 0.00 176.55 174.76 3h1c h MET 519 N 0.00 0.40 -0.39 6.28 4.05 -1.35 -3.04 114.93 120.88 3h1c h MET 519 Ca 0.00 -0.30 -0.13 0.00 -0.28 0.00 0.00 59.70 58.99 3h1c h MET 519 Cb 0.66 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.50 3h1c h MET 519 CO 0.00 0.93 -0.28 0.37 0.23 0.00 0.00 176.91 178.16 3h1c h GLN 520 N 0.29 0.84 -0.47 0.39 4.15 -1.50 -1.67 115.11 117.13 3h1c h GLN 520 Ca -0.02 -0.38 -0.12 0.00 0.77 0.00 0.00 58.65 58.90 3h1c h GLN 520 Cb 1.22 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.88 3h1c h GLN 520 CO 0.11 1.01 -0.19 0.28 -1.93 0.00 0.00 178.83 178.12 3h1c h VAL 521 N 0.72 1.27 0.00 2.39 2.07 -1.64 -0.61 116.25 120.45 3h1c h VAL 521 Ca 0.08 -1.35 -0.08 0.00 0.82 0.00 0.00 66.70 66.18 3h1c h VAL 521 Cb 0.83 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 3h1c h VAL 521 CO 0.07 0.46 -0.39 0.00 0.02 0.00 0.00 177.57 177.73 3h1c h ALA 522 N 0.86 1.06 0.24 1.67 0.00 -1.48 -2.06 119.26 119.54 3h1c h ALA 522 Ca 0.11 -0.36 -0.33 0.00 0.00 0.00 0.00 54.91 54.33 3h1c h ALA 522 Cb 0.76 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.53 3h1c h ALA 522 CO 0.06 0.49 -1.47 1.25 0.00 0.00 0.00 179.25 179.58 3h1c h LEU 523 N 0.00 0.79 -0.07 0.00 5.85 -1.10 -3.17 115.31 117.61 3h1c h LEU 523 Ca -0.00 -0.86 -0.25 0.00 0.84 0.00 0.00 57.88 57.61 3h1c h LEU 523 Cb 0.86 -0.26 0.02 0.00 0.37 0.00 0.00 40.66 41.64 3h1c h LEU 523 CO 0.05 1.67 -0.96 -1.13 -0.34 0.00 0.00 178.44 177.73 3h1c h ASN 524 N 0.14 0.86 0.74 1.25 -1.24 -1.09 -3.13 115.58 113.11 3h1c h ASN 524 Ca -0.25 -0.66 -0.08 0.00 0.71 0.00 0.00 56.30 56.02 3h1c h ASN 524 Cb 2.15 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 40.93 3h1c h ASN 524 CO 0.27 1.46 -0.40 -0.61 -1.29 0.00 0.00 177.43 176.86 3h1c h GLN 525 N 0.41 0.00 0.00 6.67 4.15 -1.53 -2.64 115.11 122.17 3h1c h GLN 525 Ca -0.10 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.22 3h1c h GLN 525 Cb 1.61 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.28 3h1c h GLN 525 CO 0.19 0.40 -0.48 0.00 -1.93 0.00 0.00 178.83 177.01 3h1c h ALA 526 N 1.60 1.06 -0.02 3.38 0.00 -1.58 -2.89 119.26 120.80 3h1c h ALA 526 Ca -0.00 -0.43 -0.20 0.00 0.00 0.00 0.00 54.91 54.27 3h1c h ALA 526 Cb 0.88 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 3h1c h ALA 526 CO 0.05 0.60 -0.86 1.57 0.00 0.00 0.00 179.25 180.61 3h1c h LYS 527 N 0.00 0.35 -0.29 0.00 2.10 -1.42 -0.52 116.57 116.79 3h1c h LYS 527 Ca -0.00 -0.35 -0.11 0.00 -2.00 0.00 0.00 60.65 58.19 3h1c h LYS 527 Cb 0.93 0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 32.34 3h1c h LYS 527 CO 0.06 1.02 -0.27 0.78 -2.00 0.00 0.00 179.45 179.04 3h1c h GLY 528 N 1.40 0.63 2.00 0.07 0.00 -1.50 -2.77 103.07 102.91 3h1c h GLY 528 Ca -0.05 -0.55 -0.18 0.00 0.00 0.00 0.00 47.33 46.55 3h1c h GLY 528 CO 0.14 0.50 -0.84 0.00 0.00 0.00 0.00 176.54 176.35 3h1c h ALA 529 N 1.19 0.58 -0.34 3.60 0.00 -1.44 -3.16 119.26 119.69 3h1c h ALA 529 Ca 0.07 -0.76 -0.12 0.00 0.00 0.00 0.00 54.91 54.09 3h1c h ALA 529 Cb 0.74 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3h1c h ALA 529 CO 0.06 1.05 -0.28 -0.09 0.00 0.00 0.00 179.25 179.98 3h1c h ARG 530 N 0.00 0.72 0.00 0.00 2.43 -1.00 -2.52 114.38 114.02 3h1c h ARG 530 Ca -0.01 -0.31 -0.07 0.00 -0.81 0.00 0.00 59.98 58.78 3h1c h ARG 530 Cb 1.52 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 31.04 3h1c h ARG 530 CO 0.11 0.92 -0.33 -0.07 -1.51 0.00 0.00 179.97 179.08 3h1c h LEU 531 N 0.62 0.00 -0.44 3.80 3.38 -1.56 -2.90 115.31 118.21 3h1c h LEU 531 Ca 0.08 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 3h1c h LEU 531 Cb 0.79 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 3h1c h LEU 531 CO 0.07 0.33 -0.66 -0.74 0.09 0.00 0.00 178.44 177.53 3h1c h HIS 532 N 0.00 0.65 -0.41 1.13 2.76 -1.44 -1.74 115.15 116.09 3h1c h HIS 532 Ca -0.00 -0.26 -0.07 0.00 -2.20 0.00 0.00 60.37 57.83 3h1c h HIS 532 Cb 0.84 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.67 3h1c h HIS 532 CO 0.00 1.01 -0.02 0.82 -1.30 0.00 0.00 177.93 178.44 3h1c h ILE 533 N 0.36 1.26 0.00 6.26 1.08 -1.38 -3.14 117.51 121.95 3h1c h ILE 533 Ca -0.02 -1.06 -0.07 0.00 -0.39 0.00 0.00 64.86 63.32 3h1c h ILE 533 Cb 1.22 1.13 -0.01 0.00 -3.07 0.00 0.00 36.82 36.08 3h1c h ILE 533 CO 0.12 0.36 -0.35 -0.07 -0.69 0.00 0.00 178.15 177.51 3h1c h LEU 534 N 0.57 0.00 -1.54 1.44 3.38 -1.47 -2.02 115.31 115.67 3h1c h LEU 534 Ca 0.11 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 3h1c h LEU 534 Cb 0.51 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3h1c h LEU 534 CO 0.03 0.35 -0.24 1.23 0.09 0.00 0.00 178.44 179.90 3h1c h GLY 535 N 1.69 0.00 0.74 0.83 0.00 -1.26 -0.22 103.07 104.84 3h1c h GLY 535 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.01 3h1c h GLY 535 CO 0.05 0.00 -1.88 -0.62 0.00 0.00 0.00 176.54 174.08 3h1c n VAL 536 N -3.88 1.58 -0.12 4.60 0.31 -1.09 -3.63 118.33 116.11 3h1c n VAL 536 Ca -0.02 -0.79 -0.12 0.00 -0.01 0.00 0.00 64.34 63.41 3h1c n VAL 536 Cb 0.32 -1.01 0.00 0.00 -0.91 0.00 0.00 33.84 32.24 3h1c n VAL 536 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 3h1c h MET 537 N 0.01 0.91 0.00 5.55 2.07 -1.17 -2.99 114.93 119.31 3h1c h MET 537 Ca -0.36 -0.45 0.00 0.00 -2.07 0.00 0.00 59.70 56.82 3h1c h MET 537 Cb 2.06 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 31.79 3h1c h MET 537 CO 0.07 1.10 0.00 0.93 1.07 0.00 0.00 176.91 180.08 3h1c h GLU 538 N 0.76 0.00 -0.12 1.72 5.08 -1.17 -2.88 114.58 117.97 3h1c h GLU 538 Ca 0.07 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 3h1c h GLU 538 Cb 0.92 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 3h1c h GLU 538 CO 0.09 0.00 -0.49 0.37 -1.00 0.00 0.00 179.01 177.98 3h1c h GLN 539 N 0.00 0.32 0.00 2.33 4.15 -1.59 -3.35 115.11 116.97 3h1c h GLN 539 Ca 0.00 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.24 3h1c h GLN 539 Cb 0.69 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.39 3h1c h GLN 539 CO 0.00 0.74 -0.16 0.00 -1.93 0.00 0.00 178.83 177.48 3h1c h ALA 540 N 1.23 0.00 -4.00 3.38 0.00 -1.56 -3.48 119.26 114.84 3h1c h ALA 540 Ca 0.01 -0.17 -0.41 0.00 0.00 0.00 0.00 54.91 54.34 3h1c h ALA 540 Cb 0.96 0.16 -0.29 0.00 0.00 0.00 0.00 17.79 18.61 3h1c h ALA 540 CO 0.08 0.16 -0.78 0.96 0.00 0.00 0.00 179.25 179.66 3h1c s ILE 541 N -1.69 0.76 0.00 0.00 -4.36 -1.09 -5.03 121.20 109.79 3h1c s ILE 541 Ca -0.05 -0.39 0.00 0.00 -0.26 0.00 0.00 60.65 59.95 3h1c s ILE 541 Cb 0.01 -0.64 0.00 0.00 1.25 0.00 0.00 42.46 43.07 3h1c s ILE 541 CO 0.07 0.22 0.09 -0.46 0.24 0.00 0.00 174.94 175.10 3h1c n ASN 542 N 2.95 0.18 -3.83 4.36 0.23 -1.26 -4.00 115.26 113.89 3h1c n ASN 542 Ca -0.15 -0.52 -0.13 0.00 -0.53 0.00 0.00 54.58 53.26 3h1c n ASN 542 Cb 0.56 0.35 -0.14 0.00 -2.08 0.00 0.00 39.78 38.47 3h1c n ASN 542 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3h1c s ALA 543 N -0.35 -0.07 -2.00 -2.53 0.00 -1.26 -5.04 121.76 110.52 3h1c s ALA 543 Ca 0.00 0.18 0.16 0.00 0.00 0.00 0.00 51.96 52.30 3h1c s ALA 543 Cb 0.00 -0.12 0.97 0.00 0.00 0.00 0.00 23.12 23.97 3h1c s ALA 543 CO 0.00 -0.04 1.38 -0.35 0.00 0.00 0.00 175.76 176.75