#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1c s LEU 2 N 0.00 4.50 -0.16 -0.89 1.43 -1.26 -5.08 118.68 117.22 3h1c s LEU 2 Ca 0.00 1.48 0.00 0.00 -1.03 0.00 0.00 54.13 54.58 3h1c s LEU 2 Cb 0.00 -3.30 0.03 0.00 0.03 0.00 0.00 46.19 42.96 3h1c s LEU 2 CO 0.00 0.17 -0.09 0.20 0.23 0.00 0.00 176.35 176.86 3h1c s ASN 3 N -1.31 2.83 0.37 2.29 0.01 -1.26 -5.09 114.94 112.78 3h1c s ASN 3 Ca 0.37 -0.62 -0.16 0.00 -0.71 0.00 0.00 52.86 51.74 3h1c s ASN 3 Cb -0.20 -1.04 -0.09 0.00 0.41 0.00 0.00 41.25 40.33 3h1c s ASN 3 CO 0.23 -0.13 0.80 -2.16 -1.51 0.00 0.00 177.10 174.33 3h1c s PRO 4 N 1.55 4.01 -0.38 -0.60 0.04 -1.26 -4.23 135.00 134.13 3h1c s PRO 4 Ca 0.02 0.75 -0.01 0.00 0.04 0.00 0.00 61.00 61.80 3h1c s PRO 4 Cb -0.14 -2.35 0.10 0.00 0.04 0.00 0.00 34.50 32.14 3h1c s PRO 4 CO -0.09 0.06 0.14 0.42 0.04 0.00 0.00 177.00 177.57 3h1c s ILE 5 N -2.13 3.06 -0.07 0.56 1.01 -0.14 -4.99 121.20 118.49 3h1c s ILE 5 Ca 0.56 -2.00 0.03 0.00 0.00 0.00 0.00 60.65 59.23 3h1c s ILE 5 Cb -0.10 -3.07 -0.02 0.00 0.01 0.00 0.00 42.46 39.28 3h1c s ILE 5 CO 0.20 -0.58 -0.15 0.54 0.00 0.00 0.00 174.94 174.94 3h1c s VAL 6 N 1.11 2.92 -0.22 2.92 0.11 -1.26 -2.30 120.40 123.68 3h1c s VAL 6 Ca 0.07 -0.75 -0.03 0.00 -2.93 0.00 0.00 61.98 58.33 3h1c s VAL 6 Cb -0.22 -2.16 0.11 0.00 -1.53 0.00 0.00 36.38 32.59 3h1c s VAL 6 CO -0.04 0.57 0.30 -0.60 -3.33 0.00 0.00 175.10 171.99 3h1c s ARG 7 N -0.34 0.27 0.09 1.54 3.52 -0.93 -5.03 118.95 118.08 3h1c s ARG 7 Ca 0.03 0.37 0.03 0.00 -0.13 0.00 0.00 55.73 56.03 3h1c s ARG 7 Cb -0.13 -0.85 -0.04 0.00 -1.56 0.00 0.00 34.95 32.38 3h1c s ARG 7 CO 0.02 -0.65 0.09 -1.59 -0.81 0.00 0.00 175.30 172.36 3h1c s LYS 8 N 2.43 2.88 0.04 5.12 -2.85 -1.26 -2.82 119.74 123.28 3h1c s LYS 8 Ca 0.10 -0.71 -0.11 0.00 -1.00 0.00 0.00 55.97 54.24 3h1c s LYS 8 Cb -0.16 -2.72 0.01 0.00 -2.06 0.00 0.00 37.83 32.91 3h1c s LYS 8 CO -0.14 0.56 0.23 -0.59 0.10 0.00 0.00 175.35 175.51 3h1c s PHE 9 N -1.43 -0.00 0.17 1.78 -0.71 -0.54 -5.02 117.98 112.22 3h1c s PHE 9 Ca 0.29 -0.18 -0.30 0.00 -1.04 0.00 0.00 56.93 55.71 3h1c s PHE 9 Cb -0.12 0.01 -0.07 0.00 -1.21 0.00 0.00 43.02 41.63 3h1c s PHE 9 CO 0.22 -0.45 1.01 -0.65 -1.34 0.00 0.00 175.22 174.01 3h1c s GLN 10 N -2.50 4.69 -0.40 1.99 -1.52 -1.26 -1.58 119.66 119.07 3h1c s GLN 10 Ca -0.05 1.57 0.03 0.00 -1.95 0.00 0.00 55.36 54.95 3h1c s GLN 10 Cb -0.01 -3.32 0.16 0.00 -0.22 0.00 0.00 33.01 29.63 3h1c s GLN 10 CO -0.03 0.23 0.34 -0.47 -0.25 0.00 0.00 175.29 175.10 3h1c s TYR 11 N -0.36 0.81 0.00 0.91 5.04 -0.13 -4.91 117.35 118.71 3h1c s TYR 11 Ca 0.46 -2.05 0.00 0.00 -2.44 0.00 0.00 57.07 53.05 3h1c s TYR 11 Cb -0.26 -0.82 0.00 0.00 0.35 0.00 0.00 41.96 41.22 3h1c s TYR 11 CO 0.32 -0.86 0.00 0.41 -1.34 0.00 0.00 175.55 174.08 3h1c n GLY 12 N 3.12 1.86 0.01 8.97 0.00 -1.26 -2.58 105.19 115.30 3h1c n GLY 12 Ca 0.25 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.22 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 2.85 0.16 -4.34 1.61 1.13 -1.26 -4.98 117.38 112.54 3h1c n GLN 13 Ca 0.00 -0.03 -0.25 0.00 -1.94 0.00 0.00 57.00 54.78 3h1c n GLN 13 Cb 0.00 -1.52 -0.09 0.00 0.11 0.00 0.00 30.24 28.74 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 -3.12 2.56 -0.20 1.08 3.76 -1.07 -5.12 115.29 113.19 3h1c s HIS 14 Ca 0.05 -0.25 -0.06 0.00 -0.15 0.00 0.00 55.06 54.65 3h1c s HIS 14 Cb 0.16 -1.18 -0.03 0.00 1.11 0.00 0.00 32.58 32.63 3h1c s HIS 14 CO 0.85 0.59 0.02 0.99 -0.85 0.00 0.00 174.74 176.33 3h1c s THR 15 N -2.07 4.10 -0.22 1.30 2.01 -1.26 -0.96 115.64 118.54 3h1c s THR 15 Ca 0.28 -0.26 -0.09 0.00 0.31 0.00 0.00 61.69 61.92 3h1c s THR 15 Cb -0.07 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.53 3h1c s THR 15 CO 0.16 0.42 0.12 -0.69 -0.69 0.00 0.00 174.62 173.94 3h1c s VAL 16 N 0.99 5.07 -0.08 3.82 1.01 -0.62 -3.41 120.40 127.18 3h1c s VAL 16 Ca 0.02 0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.12 3h1c s VAL 16 Cb -0.14 -3.34 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 3h1c s VAL 16 CO 0.02 0.38 -0.20 -0.89 0.00 0.00 0.00 175.10 174.41 3h1c s THR 17 N 0.92 2.47 -0.12 3.92 2.01 -0.48 -1.47 115.64 122.89 3h1c s THR 17 Ca 0.06 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.18 3h1c s THR 17 Cb -0.13 -1.95 0.00 0.00 0.01 0.00 0.00 72.50 70.43 3h1c s THR 17 CO 0.03 0.56 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.55 3h1c s LEU 18 N -0.11 2.19 -0.04 4.42 1.43 -1.13 -1.79 118.68 123.66 3h1c s LEU 18 Ca -0.04 -0.54 0.03 0.00 -1.03 0.00 0.00 54.13 52.55 3h1c s LEU 18 Cb -0.14 -1.45 0.01 0.00 0.03 0.00 0.00 46.19 44.63 3h1c s LEU 18 CO 0.04 0.13 -0.11 -0.70 0.23 0.00 0.00 176.35 175.94 3h1c s GLU 19 N 0.53 1.25 0.09 1.70 2.12 -0.14 -2.18 118.70 122.07 3h1c s GLU 19 Ca -0.13 -0.36 -0.10 0.00 0.36 0.00 0.00 54.97 54.73 3h1c s GLU 19 Cb -0.17 -1.12 0.01 0.00 0.26 0.00 0.00 34.13 33.11 3h1c s GLU 19 CO 0.05 0.10 0.23 -0.08 -0.54 0.00 0.00 175.26 175.02 3h1c s THR 20 N 0.32 0.12 0.00 -1.70 -1.32 -0.97 0.44 115.64 112.53 3h1c s THR 20 Ca -0.06 -1.01 0.00 0.00 -1.21 0.00 0.00 61.69 59.40 3h1c s THR 20 Cb -0.11 -1.24 0.00 0.00 -1.51 0.00 0.00 72.50 69.64 3h1c s THR 20 CO 0.01 -0.56 0.00 0.61 -2.21 0.00 0.00 174.62 172.47 3h1c n GLY 21 N 0.04 2.42 0.08 6.08 0.00 -1.26 -0.96 105.19 111.59 3h1c n GLY 21 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 3h1c n GLY 21 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3h1c h MET 22 N 0.34 0.00 -6.01 1.61 -1.53 -1.92 -3.45 114.93 103.97 3h1c h MET 22 Ca 0.00 0.00 -0.58 0.00 -3.44 0.00 0.00 59.70 55.68 3h1c h MET 22 Cb 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 31.60 30.99 3h1c h MET 22 CO 0.00 0.42 -0.10 -1.64 0.14 0.00 0.00 176.91 175.73 3h1c s MET 23 N -2.25 4.20 -0.65 0.39 -1.94 -1.26 -4.51 119.30 113.27 3h1c s MET 23 Ca -0.20 0.58 -0.09 0.00 -1.71 0.00 0.00 55.69 54.28 3h1c s MET 23 Cb 0.03 -3.31 0.01 0.00 2.01 0.00 0.00 34.83 33.57 3h1c s MET 23 CO 0.37 0.46 0.65 0.00 -0.01 0.00 0.00 175.02 176.48 3h1c n ALA 24 N 2.52 -2.67 0.09 3.03 0.00 -1.26 -4.67 120.51 117.55 3h1c n ALA 24 Ca -0.09 0.26 -0.02 0.00 0.00 0.00 0.00 53.44 53.59 3h1c n ALA 24 Cb 0.51 -1.96 -0.05 0.00 0.00 0.00 0.00 19.45 17.96 3h1c n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h1c h ARG 25 N 0.86 0.00 0.00 0.00 3.08 -1.87 -3.31 114.38 113.13 3h1c h ARG 25 Ca -0.22 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.74 3h1c h ARG 25 Cb 1.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 3h1c h ARG 25 CO 0.28 0.62 -0.46 0.37 -1.07 0.00 0.00 179.97 179.71 3h1c h GLN 26 N 0.00 0.00 -7.36 0.04 4.15 -1.97 -3.44 115.11 106.53 3h1c h GLN 26 Ca -0.05 0.00 -0.51 0.00 0.77 0.00 0.00 58.65 58.86 3h1c h GLN 26 Cb 1.58 0.00 0.10 0.00 0.21 0.00 0.00 27.48 29.37 3h1c h GLN 26 CO 0.08 0.46 0.37 0.00 -1.93 0.00 0.00 178.83 177.81 3h1c s ALA 27 N -3.40 2.62 0.17 3.38 0.00 -1.25 -4.99 121.76 118.29 3h1c s ALA 27 Ca 0.01 0.01 -0.13 0.00 0.00 0.00 0.00 51.96 51.85 3h1c s ALA 27 Cb 0.10 -3.15 0.06 0.00 0.00 0.00 0.00 23.12 20.13 3h1c s ALA 27 CO 0.71 -1.30 1.76 1.15 0.00 0.00 0.00 175.76 178.08 3h1c h THR 28 N -0.78 1.20 -2.24 0.00 2.02 -1.84 -3.45 112.91 107.82 3h1c h THR 28 Ca -0.44 -0.54 -0.07 0.00 0.77 0.00 0.00 66.41 66.13 3h1c h THR 28 Cb 1.22 0.55 -0.21 0.00 -1.74 0.00 0.00 68.15 67.97 3h1c h THR 28 CO 0.58 0.22 0.03 0.00 0.37 0.00 0.00 175.52 176.72 3h1c s ALA 29 N -5.75 -1.53 -0.15 6.16 0.00 -0.98 -4.66 121.76 114.84 3h1c s ALA 29 Ca -0.13 1.55 -0.05 0.00 0.00 0.00 0.00 51.96 53.33 3h1c s ALA 29 Cb 0.12 -0.70 0.08 0.00 0.00 0.00 0.00 23.12 22.61 3h1c s ALA 29 CO 0.77 -0.31 0.30 0.00 0.00 0.00 0.00 175.76 176.52 3h1c s ALA 30 N -0.14 -0.70 -0.16 0.00 0.00 -1.26 -0.97 121.76 118.52 3h1c s ALA 30 Ca -0.04 1.02 0.01 0.00 0.00 0.00 0.00 51.96 52.96 3h1c s ALA 30 Cb -0.03 -1.14 0.02 0.00 0.00 0.00 0.00 23.12 21.97 3h1c s ALA 30 CO 0.03 -0.73 -0.18 0.08 0.00 0.00 0.00 175.76 174.96 3h1c s VAL 31 N 2.47 1.87 -0.45 0.00 1.01 -0.87 -4.35 120.40 120.08 3h1c s VAL 31 Ca 0.01 -0.83 -0.26 0.00 0.00 0.00 0.00 61.98 60.90 3h1c s VAL 31 Cb -0.12 -1.70 0.03 0.00 0.00 0.00 0.00 36.38 34.58 3h1c s VAL 31 CO -0.10 0.51 0.98 -0.32 0.00 0.00 0.00 175.10 176.17 3h1c s MET 32 N 1.27 3.64 -0.18 2.72 1.75 0.17 -3.24 119.30 125.43 3h1c s MET 32 Ca 0.03 0.34 -0.02 0.00 -1.25 0.00 0.00 55.69 54.79 3h1c s MET 32 Cb -0.13 -3.90 -0.01 0.00 2.84 0.00 0.00 34.83 33.63 3h1c s MET 32 CO -0.10 -1.21 -0.09 0.08 -0.65 0.00 0.00 175.02 173.05 3h1c s VAL 33 N 3.87 3.12 -0.01 10.11 1.01 -1.20 -0.96 120.40 136.33 3h1c s VAL 33 Ca 0.40 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 61.83 3h1c s VAL 33 Cb -0.10 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 3h1c s VAL 33 CO 0.26 0.48 -0.18 -0.94 0.00 0.00 0.00 175.10 174.72 3h1c s SER 34 N 0.98 2.07 -0.41 3.32 1.04 -0.74 -1.35 113.70 118.61 3h1c s SER 34 Ca -0.01 -0.32 0.01 0.00 0.48 0.00 0.00 55.95 56.11 3h1c s SER 34 Cb -0.15 -0.24 0.14 0.00 0.10 0.00 0.00 66.02 65.88 3h1c s SER 34 CO -0.01 0.22 0.24 -0.32 0.98 0.00 0.00 173.24 174.35 3h1c s MET 35 N -0.41 0.98 -0.55 4.02 1.75 0.51 -1.39 119.30 124.21 3h1c s MET 35 Ca 0.07 -1.77 -0.16 0.00 -1.25 0.00 0.00 55.69 52.58 3h1c s MET 35 Cb -0.07 -1.85 0.02 0.00 2.84 0.00 0.00 34.83 35.78 3h1c s MET 35 CO -0.01 -1.21 0.64 -0.25 -0.65 0.00 0.00 175.02 173.55 3h1c n ASP 36 N 3.64 -7.02 0.00 1.11 9.92 -1.22 -3.08 116.55 119.91 3h1c n ASP 36 Ca 0.12 0.07 0.00 0.00 -0.53 0.00 0.00 54.79 54.45 3h1c n ASP 36 Cb 0.37 -4.12 0.00 0.00 -0.64 0.00 0.00 41.12 36.73 3h1c n ASP 36 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3h1c n ASP 37 N -0.88 -0.12 -4.25 -2.24 8.00 -1.26 -4.61 116.55 111.19 3h1c n ASP 37 Ca -0.01 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.09 3h1c n ASP 37 Cb 0.55 -1.90 -0.09 0.00 -0.02 0.00 0.00 41.12 39.65 3h1c n ASP 37 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3h1c s THR 38 N -1.73 4.26 -0.09 -3.53 2.01 -1.18 -3.23 115.64 112.15 3h1c s THR 38 Ca 0.00 -1.53 0.03 0.00 0.31 0.00 0.00 61.69 60.50 3h1c s THR 38 Cb 0.00 -3.68 -0.01 0.00 0.01 0.00 0.00 72.50 68.82 3h1c s THR 38 CO 0.00 -0.61 -0.19 0.00 -0.69 0.00 0.00 174.62 173.13 3h1c s ALA 39 N 1.41 2.40 -0.15 7.40 0.00 0.21 -0.36 121.76 132.67 3h1c s ALA 39 Ca 0.04 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.04 3h1c s ALA 39 Cb -0.24 -0.95 0.02 0.00 0.00 0.00 0.00 23.12 21.95 3h1c s ALA 39 CO 0.01 0.34 -0.15 0.08 0.00 0.00 0.00 175.76 176.04 3h1c s VAL 40 N 0.07 1.64 -0.32 0.00 1.01 -0.46 -2.47 120.40 119.88 3h1c s VAL 40 Ca -0.08 -0.68 -0.23 0.00 0.00 0.00 0.00 61.98 60.99 3h1c s VAL 40 Cb -0.15 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.70 3h1c s VAL 40 CO 0.05 0.47 0.76 0.12 0.00 0.00 0.00 175.10 176.51 3h1c s PHE 41 N 1.45 3.19 -0.12 5.22 5.36 0.18 -3.24 117.98 130.02 3h1c s PHE 41 Ca 0.05 0.73 0.02 0.00 -0.96 0.00 0.00 56.93 56.77 3h1c s PHE 41 Cb -0.13 -3.22 -0.00 0.00 -0.34 0.00 0.00 43.02 39.33 3h1c s PHE 41 CO -0.11 -0.58 -0.19 0.08 -1.46 0.00 0.00 175.22 172.95 3h1c s VAL 42 N 2.93 2.43 0.03 3.12 1.01 -1.20 -1.17 120.40 127.56 3h1c s VAL 42 Ca 0.31 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.49 3h1c s VAL 42 Cb -0.14 -1.98 -0.02 0.00 0.00 0.00 0.00 36.38 34.24 3h1c s VAL 42 CO 0.13 0.54 -0.23 0.42 0.00 0.00 0.00 175.10 175.97 3h1c s THR 43 N 0.47 1.83 -0.11 3.92 -4.23 -0.42 -2.04 115.64 115.05 3h1c s THR 43 Ca -0.13 -1.22 0.02 0.00 -1.18 0.00 0.00 61.69 59.17 3h1c s THR 43 Cb -0.17 -1.57 0.01 0.00 1.34 0.00 0.00 72.50 72.12 3h1c s THR 43 CO 0.05 0.30 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.59 3h1c s VAL 44 N -0.76 1.51 -0.15 2.29 1.01 -0.14 -1.06 120.40 123.10 3h1c s VAL 44 Ca 0.09 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.44 3h1c s VAL 44 Cb -0.09 -1.39 0.01 0.00 0.00 0.00 0.00 36.38 34.91 3h1c s VAL 44 CO 0.01 0.44 -0.21 -0.69 0.00 0.00 0.00 175.10 174.66 3h1c s VAL 45 N 1.01 2.15 -0.10 2.92 1.01 -1.08 -2.31 120.40 124.00 3h1c s VAL 45 Ca -0.06 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 60.99 3h1c s VAL 45 Cb -0.15 -1.87 0.02 0.00 0.00 0.00 0.00 36.38 34.38 3h1c s VAL 45 CO -0.02 0.54 -0.12 -0.83 0.00 0.00 0.00 175.10 174.67 3h1c s GLY 46 N 0.91 0.92 0.12 4.51 0.00 -1.26 -2.60 107.32 109.93 3h1c s GLY 46 Ca -0.04 -0.60 -0.30 0.00 0.00 0.00 0.00 44.72 43.77 3h1c s GLY 46 CO -0.04 0.35 1.09 1.20 0.00 0.00 0.00 173.10 175.70 3h1c s GLN 47 N 1.09 4.57 0.18 2.90 -0.21 -1.16 -4.96 119.66 122.07 3h1c s GLN 47 Ca -0.06 1.65 -0.11 0.00 0.02 0.00 0.00 55.36 56.87 3h1c s GLN 47 Cb -0.14 -3.33 0.09 0.00 1.00 0.00 0.00 33.01 30.63 3h1c s GLN 47 CO -0.02 0.02 1.73 0.87 -2.12 0.00 0.00 175.29 175.77 3h1c h LYS 48 N 5.71 0.97 -6.21 2.91 1.79 -2.00 -3.44 116.57 116.31 3h1c h LYS 48 Ca -0.43 -0.18 -0.65 0.00 -2.18 0.00 0.00 60.65 57.20 3h1c h LYS 48 Cb 1.21 -0.15 -0.12 0.00 -1.58 0.00 0.00 32.23 31.59 3h1c h LYS 48 CO 0.74 0.82 -0.64 -1.59 -1.08 0.00 0.00 179.45 177.71 3h1c s LYS 49 N -5.52 2.75 0.45 3.15 -2.85 -1.26 -5.07 119.74 111.39 3h1c s LYS 49 Ca -0.13 -0.69 0.02 0.00 -1.00 0.00 0.00 55.97 54.18 3h1c s LYS 49 Cb 0.14 -2.66 0.00 0.00 -2.06 0.00 0.00 37.83 33.25 3h1c s LYS 49 CO 0.81 0.59 0.65 0.00 0.10 0.00 0.00 175.35 177.50 3h1c s ALA 50 N -1.22 3.90 0.19 0.59 0.00 -1.26 -4.81 121.76 119.14 3h1c s ALA 50 Ca 0.24 -1.21 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 3h1c s ALA 50 Cb -0.12 -2.03 -0.09 0.00 0.00 0.00 0.00 23.12 20.89 3h1c s ALA 50 CO 0.15 -0.39 1.38 0.21 0.00 0.00 0.00 175.76 177.12 3h1c s LYS 51 N -4.52 4.33 0.32 0.00 2.47 -1.26 -4.94 119.74 116.14 3h1c s LYS 51 Ca 0.50 2.14 0.06 0.00 -1.56 0.00 0.00 55.97 57.11 3h1c s LYS 51 Cb -0.10 -3.18 0.71 0.00 -1.46 0.00 0.00 37.83 33.80 3h1c s LYS 51 CO 0.37 -0.37 1.85 -1.35 0.16 0.00 0.00 175.35 176.00 3h1c h PRO 52 N 5.78 0.79 -2.22 4.03 0.11 -2.00 -2.97 132.00 135.52 3h1c h PRO 52 Ca -0.44 -0.05 -0.70 0.00 0.11 0.00 0.00 66.00 64.92 3h1c h PRO 52 Cb 1.21 -0.18 -0.34 0.00 0.11 0.00 0.00 31.00 31.80 3h1c h PRO 52 CO 0.81 0.52 0.21 0.41 -0.21 0.00 0.00 178.00 179.75 3h1c n GLY 53 N -1.39 5.88 3.25 -0.55 0.00 -1.26 -5.01 105.19 106.10 3h1c n GLY 53 Ca 0.19 -2.68 -0.32 0.00 0.00 0.00 0.00 46.02 43.21 3h1c n GLY 53 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h1c s GLN 54 N -3.91 2.83 0.00 1.61 -1.52 -1.12 -5.00 119.66 112.54 3h1c s GLN 54 Ca 0.44 -0.89 0.00 0.00 -1.95 0.00 0.00 55.36 52.97 3h1c s GLN 54 Cb 0.25 -2.24 0.00 0.00 -0.22 0.00 0.00 33.01 30.80 3h1c s GLN 54 CO -0.15 0.27 0.00 -0.40 -0.25 0.00 0.00 175.29 174.76 3h1c n ASP 55 N 3.25 4.05 -4.94 5.90 5.75 -1.26 -5.02 116.55 124.29 3h1c n ASP 55 Ca -0.18 0.00 -0.25 0.00 -0.01 0.00 0.00 54.79 54.35 3h1c n ASP 55 Cb 0.53 0.11 -0.02 0.00 -1.03 0.00 0.00 41.12 40.70 3h1c n ASP 55 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3h1c s PHE 56 N -1.96 3.48 -0.32 2.11 -0.12 -1.26 -4.97 117.98 114.94 3h1c s PHE 56 Ca 0.00 0.31 -0.24 0.00 -0.05 0.00 0.00 56.93 56.95 3h1c s PHE 56 Cb 0.00 -1.84 0.00 0.00 -0.63 0.00 0.00 43.02 40.55 3h1c s PHE 56 CO 0.00 0.28 0.82 0.12 -0.05 0.00 0.00 175.22 176.39 3h1c s PHE 57 N -2.07 3.17 -0.37 3.49 5.36 -1.26 -4.79 117.98 121.51 3h1c s PHE 57 Ca 0.39 0.78 -0.22 0.00 -0.96 0.00 0.00 56.93 56.92 3h1c s PHE 57 Cb -0.10 -3.32 0.01 0.00 -0.34 0.00 0.00 43.02 39.27 3h1c s PHE 57 CO 0.32 -0.63 0.74 -1.25 -1.46 0.00 0.00 175.22 172.93 3h1c s PRO 58 N 3.07 3.69 -0.08 10.12 0.04 -1.26 -5.03 135.00 145.54 3h1c s PRO 58 Ca 0.33 0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.56 3h1c s PRO 58 Cb -0.14 -3.82 0.02 0.00 0.04 0.00 0.00 34.50 30.60 3h1c s PRO 58 CO 0.14 -0.85 -0.07 -1.17 0.04 0.00 0.00 177.00 175.09 3h1c s LEU 59 N 3.00 1.26 -0.18 -3.56 2.96 -1.26 -3.15 118.68 117.75 3h1c s LEU 59 Ca 0.29 -0.24 -0.02 0.00 -0.22 0.00 0.00 54.13 53.94 3h1c s LEU 59 Cb -0.13 -0.72 0.05 0.00 0.50 0.00 0.00 46.19 45.89 3h1c s LEU 59 CO 0.17 -0.08 -0.00 0.28 -1.32 0.00 0.00 176.35 175.40 3h1c s THR 60 N 1.32 0.79 -0.25 3.68 -1.32 -1.22 -5.08 115.64 113.57 3h1c s THR 60 Ca -0.03 -0.59 -0.05 0.00 -1.21 0.00 0.00 61.69 59.81 3h1c s THR 60 Cb -0.14 -1.15 -0.00 0.00 -1.51 0.00 0.00 72.50 69.70 3h1c s THR 60 CO -0.03 -0.06 0.00 -0.69 -2.21 0.00 0.00 174.62 171.63 3h1c s VAL 61 N 1.75 3.59 -0.28 5.08 1.01 -1.26 -2.58 120.40 127.70 3h1c s VAL 61 Ca -0.01 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 3h1c s VAL 61 Cb -0.16 -2.73 0.04 0.00 0.00 0.00 0.00 36.38 33.53 3h1c s VAL 61 CO -0.07 0.28 -0.03 0.54 0.00 0.00 0.00 175.10 175.82 3h1c s ASN 62 N 1.48 4.69 -0.23 3.32 2.20 -0.98 -4.80 114.94 120.62 3h1c s ASN 62 Ca 0.04 -1.18 -0.14 0.00 -0.94 0.00 0.00 52.86 50.64 3h1c s ASN 62 Cb -0.16 -1.68 -0.04 0.00 -2.00 0.00 0.00 41.25 37.37 3h1c s ASN 62 CO -0.01 -0.22 0.33 -0.47 -2.94 0.00 0.00 177.10 173.79 3h1c s TYR 63 N 1.26 3.32 -0.06 1.54 5.04 -1.26 -2.78 117.35 124.40 3h1c s TYR 63 Ca -0.04 0.45 0.03 0.00 -2.44 0.00 0.00 57.07 55.07 3h1c s TYR 63 Cb -0.19 -2.47 0.01 0.00 0.35 0.00 0.00 41.96 39.66 3h1c s TYR 63 CO -0.02 -0.05 -0.15 1.14 -1.34 0.00 0.00 175.55 175.13 3h1c s GLN 64 N 1.45 1.90 -0.17 4.97 -2.07 -0.63 -4.68 119.66 120.43 3h1c s GLN 64 Ca 0.15 -0.52 -0.11 0.00 -1.82 0.00 0.00 55.36 53.06 3h1c s GLN 64 Cb -0.15 -1.55 -0.05 0.00 -1.09 0.00 0.00 33.01 30.17 3h1c s GLN 64 CO 0.08 0.10 0.19 -1.21 -1.32 0.00 0.00 175.29 173.12 3h1c s GLU 65 N 0.47 4.10 -0.07 9.60 2.02 -1.26 -1.56 118.70 132.01 3h1c s GLU 65 Ca -0.13 -0.09 0.03 0.00 0.02 0.00 0.00 54.97 54.80 3h1c s GLU 65 Cb -0.15 -3.38 -0.02 0.00 0.10 0.00 0.00 34.13 30.67 3h1c s GLU 65 CO 0.04 0.36 -0.14 1.03 0.02 0.00 0.00 175.26 176.57 3h1c s ARG 66 N 0.16 2.72 0.40 1.61 0.52 -1.22 -4.96 118.95 118.18 3h1c s ARG 66 Ca 0.12 -0.69 0.20 0.00 -0.52 0.00 0.00 55.73 54.84 3h1c s ARG 66 Cb -0.12 -2.44 0.81 0.00 0.52 0.00 0.00 34.95 33.72 3h1c s ARG 66 CO 0.01 0.53 1.79 1.79 0.02 0.00 0.00 175.30 179.44 3h1c h THR 67 N 4.60 0.81 0.00 0.02 1.35 -1.89 -2.85 112.91 114.95 3h1c h THR 67 Ca -0.41 -1.32 0.00 0.00 -0.55 0.00 0.00 66.41 64.13 3h1c h THR 67 Cb 1.17 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 3h1c h THR 67 CO 0.52 0.31 0.00 0.00 -0.25 0.00 0.00 175.52 176.10 3h1c n TYR 68 N -3.55 0.00 0.04 4.73 4.11 -1.25 -2.51 117.16 118.73 3h1c n TYR 68 Ca -0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.90 57.86 3h1c n TYR 68 Cb 0.46 -0.38 0.18 0.00 -0.00 0.00 0.00 39.34 39.60 3h1c n TYR 68 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 3h1c h ALA 69 N 2.84 1.03 0.01 -3.48 0.00 -1.68 -3.19 119.26 114.79 3h1c h ALA 69 Ca 0.00 -0.40 -0.32 0.00 0.00 0.00 0.00 54.91 54.19 3h1c h ALA 69 Cb 0.26 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 3h1c h ALA 69 CO 0.00 0.60 -1.89 0.00 0.00 0.00 0.00 179.25 177.96 3h1c n ALA 70 N -2.49 1.43 0.00 0.00 0.00 -1.13 -2.43 120.51 115.89 3h1c n ALA 70 Ca -0.01 -0.87 0.00 0.00 0.00 0.00 0.00 53.44 52.56 3h1c n ALA 70 Cb 0.47 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 19.23 3h1c n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h1c n GLY 71 N 1.66 1.07 3.21 0.00 0.00 -1.10 -5.03 105.19 104.99 3h1c n GLY 71 Ca -0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.04 0.94 -0.17 1.61 0.52 -1.04 -5.02 118.95 115.74 3h1c s ARG 72 Ca 0.00 -1.29 -0.16 0.00 -0.52 0.00 0.00 55.73 53.76 3h1c s ARG 72 Cb 0.00 -0.55 -0.04 0.00 0.52 0.00 0.00 34.95 34.88 3h1c s ARG 72 CO 0.00 0.07 0.38 0.42 0.02 0.00 0.00 175.30 176.20 3h1c s ILE 73 N -2.89 5.23 0.36 1.52 1.01 -1.26 -3.84 121.20 121.32 3h1c s ILE 73 Ca 0.11 0.71 -0.28 0.00 0.00 0.00 0.00 60.65 61.18 3h1c s ILE 73 Cb -0.00 -3.72 -0.11 0.00 0.01 0.00 0.00 42.46 38.64 3h1c s ILE 73 CO -0.00 0.30 1.47 -0.81 0.00 0.00 0.00 174.94 175.90 3h1c n PRO 74 N 4.08 2.60 -2.36 2.79 -0.04 -1.26 -4.90 135.00 135.91 3h1c n PRO 74 Ca -0.09 0.91 -0.43 0.00 -0.04 0.00 0.00 63.50 63.85 3h1c n PRO 74 Cb 0.51 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 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 0.69 3.83 3.12 0.55 0.00 -1.26 -4.70 105.19 107.41 3h1c n GLY 75 Ca 0.03 -1.78 -0.08 0.00 0.00 0.00 0.00 46.02 44.18 3h1c n GLY 75 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h1c s SER 76 N 2.76 0.41 0.21 1.61 0.15 -1.26 -5.02 113.70 112.57 3h1c s SER 76 Ca 0.46 -1.05 -0.02 0.00 0.70 0.00 0.00 55.95 56.05 3h1c s SER 76 Cb 0.07 0.24 0.18 0.00 -1.71 0.00 0.00 66.02 64.79 3h1c s SER 76 CO -0.00 -0.65 1.55 0.15 1.20 0.00 0.00 173.24 175.49 3h1c h PHE 77 N 3.04 0.64 0.00 3.44 3.04 -1.95 -2.67 116.94 122.49 3h1c h PHE 77 Ca -0.34 -0.21 0.00 0.00 3.98 0.00 0.00 57.97 61.40 3h1c h PHE 77 Cb 1.16 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 39.54 3h1c h PHE 77 CO 0.50 0.91 -0.16 1.19 -2.02 0.00 0.00 178.31 178.72 3h1c n PHE 78 N -3.98 0.75 -2.11 0.41 3.01 -1.26 -4.96 117.46 109.31 3h1c n PHE 78 Ca -0.02 0.22 -0.15 0.00 1.01 0.00 0.00 57.45 58.50 3h1c n PHE 78 Cb 0.56 -0.82 -0.02 0.00 -0.01 0.00 0.00 39.48 39.19 3h1c n PHE 78 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 3h1c n ARG 79 N -2.15 -1.16 -4.00 -1.08 3.00 -1.01 -5.00 116.66 105.26 3h1c n ARG 79 Ca 0.05 0.78 -0.09 0.00 -0.00 0.00 0.00 57.85 58.59 3h1c n ARG 79 Cb 0.42 -5.08 -0.06 0.00 0.00 0.00 0.00 32.46 27.75 3h1c n ARG 79 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 3h1c s ARG 80 N -4.45 1.50 -0.15 -0.14 1.70 -1.26 -4.65 118.95 111.50 3h1c s ARG 80 Ca 0.00 -1.26 -0.29 0.00 -0.47 0.00 0.00 55.73 53.71 3h1c s ARG 80 Cb 0.00 0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 34.79 3h1c s ARG 80 CO 0.00 -0.61 1.77 -1.21 -1.08 0.00 0.00 175.30 174.17 3h1c s GLU 81 N -4.02 3.81 0.00 3.89 8.01 -1.26 -4.92 118.70 124.21 3h1c s GLU 81 Ca 0.23 1.95 0.00 0.00 0.01 0.00 0.00 54.97 57.16 3h1c s GLU 81 Cb 0.00 -4.10 0.00 0.00 -4.31 0.00 0.00 34.13 25.72 3h1c s GLU 81 CO 0.08 -1.30 0.00 0.41 0.01 0.00 0.00 175.26 174.46 3h1c n GLY 82 N 4.73 1.57 3.43 -1.39 0.00 -1.26 -5.06 105.19 107.22 3h1c n GLY 82 Ca 0.20 0.00 -0.30 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 0.22 1.98 0.10 1.61 1.70 -1.26 -5.09 118.95 118.21 3h1c s ARG 83 Ca 0.00 -1.03 -0.34 0.00 -0.47 0.00 0.00 55.73 53.89 3h1c s ARG 83 Cb 0.00 -2.13 -0.18 0.00 -0.57 0.00 0.00 34.95 32.07 3h1c s ARG 83 CO 0.00 0.53 0.79 -2.30 -1.08 0.00 0.00 175.30 173.24 3h1c n PRO 84 N 1.55 0.00 -0.12 3.89 -0.02 -1.26 -5.00 135.00 134.03 3h1c n PRO 84 Ca -0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 3h1c n PRO 84 Cb 0.52 -1.24 0.00 0.00 -0.02 0.00 0.00 33.50 32.76 3h1c n PRO 84 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3h1c n SER 85 N 1.73 0.00 -0.07 2.55 3.41 -1.26 -4.89 113.62 115.09 3h1c n SER 85 Ca 0.19 -0.29 -0.07 0.00 -0.26 0.00 0.00 58.87 58.43 3h1c n SER 85 Cb 0.16 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.21 3h1c n SER 85 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3h1c h GLU 86 N 0.00 0.72 -0.04 4.33 5.08 -2.01 -3.11 114.58 119.56 3h1c h GLU 86 Ca 0.00 -0.30 -0.12 0.00 -1.00 0.00 0.00 59.36 57.94 3h1c h GLU 86 Cb 0.00 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.23 3h1c h GLU 86 CO 0.00 0.90 -0.44 0.78 -1.00 0.00 0.00 179.01 179.25 3h1c h GLY 87 N 0.97 0.42 2.00 -3.84 0.00 -2.00 -3.27 103.07 97.36 3h1c h GLY 87 Ca 0.08 -0.65 -0.02 0.00 0.00 0.00 0.00 47.33 46.74 3h1c h GLY 87 CO 0.06 0.58 -0.09 0.83 0.00 0.00 0.00 176.54 177.92 3h1c h GLU 88 N -0.12 0.00 0.00 4.80 5.08 -1.89 -1.90 114.58 120.55 3h1c h GLU 88 Ca -0.04 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.15 3h1c h GLU 88 Cb 1.13 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 3h1c h GLU 88 CO 0.09 0.09 -0.79 1.15 -1.00 0.00 0.00 179.01 178.55 3h1c h THR 89 N 0.00 1.52 -0.35 1.13 2.02 -1.63 -2.96 112.91 112.64 3h1c h THR 89 Ca -0.00 -2.75 -0.14 0.00 0.77 0.00 0.00 66.41 64.29 3h1c h THR 89 Cb 0.18 2.50 -0.01 0.00 -1.74 0.00 0.00 68.15 69.09 3h1c h THR 89 CO 0.01 0.77 -0.33 -0.07 0.37 0.00 0.00 175.52 176.28 3h1c h LEU 90 N 0.00 0.89 -0.64 2.58 3.38 -1.39 -1.14 115.31 118.99 3h1c h LEU 90 Ca -0.01 -0.46 -0.15 0.00 0.09 0.00 0.00 57.88 57.35 3h1c h LEU 90 Cb 1.44 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 3h1c h LEU 90 CO 0.10 1.17 -0.56 0.40 0.09 0.00 0.00 178.44 179.64 3h1c h ILE 91 N 0.62 1.35 -0.70 1.22 5.03 -1.64 -1.07 117.51 122.33 3h1c h ILE 91 Ca 0.06 -1.86 -0.01 0.00 -0.12 0.00 0.00 64.86 62.93 3h1c h ILE 91 Cb 0.91 1.88 -0.03 0.00 -3.03 0.00 0.00 36.82 36.55 3h1c h ILE 91 CO 0.08 0.56 0.41 0.00 -0.68 0.00 0.00 178.15 178.53 3h1c h ALA 92 N 1.13 1.42 0.00 1.87 0.00 -1.36 -1.08 119.26 121.23 3h1c h ALA 92 Ca 0.00 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 3h1c h ALA 92 Cb 1.07 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3h1c h ALA 92 CO 0.09 0.50 -0.70 0.00 0.00 0.00 0.00 179.25 179.15 3h1c h ARG 93 N 0.96 0.00 0.00 0.00 3.08 -1.02 -2.35 114.38 115.05 3h1c h ARG 93 Ca 0.25 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.27 3h1c h ARG 93 Cb -0.03 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 3h1c h ARG 93 CO -0.05 0.70 -0.14 1.25 -1.07 0.00 0.00 179.97 180.67 3h1c h LEU 94 N 0.00 0.00 0.12 3.04 5.85 -0.19 -2.11 115.31 122.02 3h1c h LEU 94 Ca -0.01 0.00 -0.36 0.00 0.84 0.00 0.00 57.88 58.36 3h1c h LEU 94 Cb 1.24 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.26 3h1c h LEU 94 CO 0.09 0.14 -1.95 -0.38 -0.34 0.00 0.00 178.44 176.00 3h1c n ILE 95 N -3.27 1.77 0.06 4.05 5.41 -0.51 -4.45 119.36 122.43 3h1c n ILE 95 Ca 0.01 -0.62 -0.05 0.00 1.00 0.00 0.00 62.75 63.09 3h1c n ILE 95 Cb 0.40 -1.76 0.13 0.00 -0.71 0.00 0.00 39.64 37.70 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 -0.00 0.36 0.11 4.38 3.58 -1.36 -3.33 116.42 120.15 3h1c h ASP 96 Ca -0.42 -0.19 -0.01 0.00 0.42 0.00 0.00 57.03 56.84 3h1c h ASP 96 Cb 1.99 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.94 3h1c h ASP 96 CO 0.07 0.83 -0.05 -0.09 -2.88 0.00 0.00 179.24 177.11 3h1c h ARG 97 N 0.25 -0.14 0.00 0.28 2.43 -1.60 -2.97 114.38 112.63 3h1c h ARG 97 Ca 0.01 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.10 3h1c h ARG 97 Cb 1.02 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.59 3h1c h ARG 97 CO 0.09 -0.00 -0.42 -1.00 -1.51 0.00 0.00 179.97 177.12 3h1c h PRO 98 N -0.26 0.00 0.00 0.20 0.13 -1.81 -3.33 132.00 126.94 3h1c h PRO 98 Ca -0.02 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.00 3h1c h PRO 98 Cb 0.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.32 3h1c h PRO 98 CO 0.03 0.42 -0.72 -0.84 -0.23 0.00 0.00 178.00 176.66 3h1c h ILE 99 N 0.00 0.72 -0.26 -3.56 3.07 -1.66 -3.38 117.51 112.44 3h1c h ILE 99 Ca -0.00 -2.09 -0.03 0.00 1.55 0.00 0.00 64.86 64.29 3h1c h ILE 99 Cb 1.09 2.29 -0.01 0.00 -0.27 0.00 0.00 36.82 39.92 3h1c h ILE 99 CO 0.05 0.41 0.06 -0.09 -1.05 0.00 0.00 178.15 177.54 3h1c h ARG 100 N 0.00 0.42 0.00 0.16 2.43 -1.63 -2.95 114.38 112.81 3h1c h ARG 100 Ca -0.04 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 3h1c h ARG 100 Cb 1.41 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.90 3h1c h ARG 100 CO 0.06 0.52 0.00 -2.30 -1.51 0.00 0.00 179.97 176.74 3h1c n PRO 101 N -4.70 0.09 0.17 0.20 -0.02 -1.26 -3.03 135.00 126.45 3h1c n PRO 101 Ca -0.03 0.28 0.05 0.00 -2.02 0.00 0.00 63.50 61.78 3h1c n PRO 101 Cb 0.19 -1.66 0.21 0.00 -0.02 0.00 0.00 33.50 32.22 3h1c n PRO 101 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3h1c h LEU 102 N 0.00 0.00 -9.61 2.45 3.38 -1.72 -3.44 115.31 106.37 3h1c h LEU 102 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3h1c h LEU 102 Cb 0.36 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.14 3h1c h LEU 102 CO 0.00 0.41 0.69 -0.36 0.09 0.00 0.00 178.44 179.28 3h1c s PHE 103 N -3.30 3.24 0.49 1.13 0.40 -1.17 -3.01 117.98 115.76 3h1c s PHE 103 Ca 0.02 1.07 -0.24 0.00 -0.60 0.00 0.00 56.93 57.18 3h1c s PHE 103 Cb 0.09 -3.65 -0.07 0.00 0.51 0.00 0.00 43.02 39.90 3h1c s PHE 103 CO 0.71 -2.18 1.36 -1.25 0.70 0.00 0.00 175.22 174.55 3h1c s PRO 104 N 0.53 3.49 0.06 0.24 0.04 -1.26 -4.94 135.00 133.16 3h1c s PRO 104 Ca 0.61 2.25 -0.31 0.00 0.04 0.00 0.00 61.00 63.59 3h1c s PRO 104 Cb -0.37 -2.48 -0.06 0.00 0.04 0.00 0.00 34.50 31.63 3h1c s PRO 104 CO 0.34 -0.91 1.33 -2.00 0.04 0.00 0.00 177.00 175.80 3h1c s GLU 105 N -2.64 4.35 0.00 4.56 2.12 -1.26 -2.82 118.70 123.01 3h1c s GLU 105 Ca 0.65 1.94 0.00 0.00 0.36 0.00 0.00 54.97 57.92 3h1c s GLU 105 Cb -0.40 -3.37 0.00 0.00 0.26 0.00 0.00 34.13 30.62 3h1c s GLU 105 CO 0.50 -0.42 0.00 0.41 -0.54 0.00 0.00 175.26 175.21 3h1c n GLY 106 N 3.44 2.38 3.67 -1.50 0.00 -1.26 -4.98 105.19 106.93 3h1c n GLY 106 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.19 2.88 0.00 1.61 5.36 -1.13 -4.90 117.98 119.61 3h1c s PHE 107 Ca 0.00 1.01 0.00 0.00 -0.96 0.00 0.00 56.93 56.98 3h1c s PHE 107 Cb 0.00 -3.51 0.00 0.00 -0.34 0.00 0.00 43.02 39.17 3h1c s PHE 107 CO 0.00 -1.72 0.76 1.33 -1.46 0.00 0.00 175.22 174.14 3h1c n VAL 108 N 5.24 0.58 -2.41 3.12 0.24 -1.26 -4.42 118.33 119.42 3h1c n VAL 108 Ca 0.13 -0.70 -0.40 0.00 -2.04 0.00 0.00 64.34 61.33 3h1c n VAL 108 Cb 0.45 0.76 -0.04 0.00 -1.47 0.00 0.00 33.84 33.55 3h1c n VAL 108 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 3h1c s ASN 109 N -0.58 7.04 -0.23 -1.34 0.01 -1.26 -4.56 114.94 114.02 3h1c s ASN 109 Ca 0.00 2.31 -0.29 0.00 -0.71 0.00 0.00 52.86 54.17 3h1c s ASN 109 Cb 0.00 -2.62 -0.00 0.00 0.41 0.00 0.00 41.25 39.03 3h1c s ASN 109 CO 0.00 -0.31 1.24 -0.70 -1.51 0.00 0.00 177.10 175.82 3h1c s GLU 110 N -1.73 4.11 0.01 -0.60 2.12 -1.26 -4.55 118.70 116.80 3h1c s GLU 110 Ca 0.48 1.43 0.05 0.00 0.36 0.00 0.00 54.97 57.29 3h1c s GLU 110 Cb -0.32 -3.79 -0.02 0.00 0.26 0.00 0.00 34.13 30.27 3h1c s GLU 110 CO 0.41 -0.86 -0.16 0.14 -0.54 0.00 0.00 175.26 174.24 3h1c s VAL 111 N 3.79 1.28 0.03 3.70 -7.23 -1.19 -3.01 120.40 117.78 3h1c s VAL 111 Ca 0.53 -0.85 0.03 0.00 -1.81 0.00 0.00 61.98 59.89 3h1c s VAL 111 Cb -0.18 -1.10 -0.02 0.00 0.56 0.00 0.00 36.38 35.64 3h1c s VAL 111 CO 0.17 0.24 -0.09 0.00 -0.31 0.00 0.00 175.10 175.10 3h1c s GLN 112 N -0.71 0.64 -0.29 4.82 -2.07 -1.07 -3.38 119.66 117.61 3h1c s GLN 112 Ca 0.05 -0.60 -0.01 0.00 -1.82 0.00 0.00 55.36 52.98 3h1c s GLN 112 Cb -0.07 -0.55 0.05 0.00 -1.09 0.00 0.00 33.01 31.34 3h1c s GLN 112 CO 0.00 0.13 -0.02 0.08 -1.32 0.00 0.00 175.29 174.16 3h1c s VAL 113 N -0.85 2.89 -0.45 3.63 1.01 -1.06 -2.64 120.40 122.93 3h1c s VAL 113 Ca -0.03 -1.34 -0.13 0.00 0.00 0.00 0.00 61.98 60.48 3h1c s VAL 113 Cb -0.07 -2.63 0.07 0.00 0.00 0.00 0.00 36.38 33.75 3h1c s VAL 113 CO 0.01 -0.04 0.33 -0.63 0.00 0.00 0.00 175.10 174.76 3h1c s ILE 114 N 1.25 4.79 -0.28 2.22 1.01 -0.23 -2.32 121.20 127.65 3h1c s ILE 114 Ca -0.05 -1.20 -0.07 0.00 0.00 0.00 0.00 60.65 59.34 3h1c s ILE 114 Cb -0.19 -3.88 -0.00 0.00 0.01 0.00 0.00 42.46 38.39 3h1c s ILE 114 CO -0.02 -0.54 0.08 0.00 0.00 0.00 0.00 174.94 174.46 3h1c s ALA 115 N 1.55 3.09 -0.07 9.38 0.00 -1.12 -1.30 121.76 133.29 3h1c s ALA 115 Ca 0.04 -1.35 0.06 0.00 0.00 0.00 0.00 51.96 50.70 3h1c s ALA 115 Cb -0.24 -2.13 -0.01 0.00 0.00 0.00 0.00 23.12 20.75 3h1c s ALA 115 CO 0.05 -0.79 -0.25 -0.08 0.00 0.00 0.00 175.76 174.69 3h1c s THR 116 N 1.54 2.05 -0.32 0.00 -1.32 -0.32 -1.60 115.64 115.67 3h1c s THR 116 Ca 0.04 -1.06 -0.26 0.00 -1.21 0.00 0.00 61.69 59.20 3h1c s THR 116 Cb -0.16 -1.75 0.01 0.00 -1.51 0.00 0.00 72.50 69.09 3h1c s THR 116 CO 0.03 0.57 0.93 -0.69 -2.21 0.00 0.00 174.62 173.24 3h1c s VAL 117 N -0.04 4.65 -0.06 5.08 1.01 -0.60 -0.64 120.40 129.79 3h1c s VAL 117 Ca -0.07 1.41 0.07 0.00 0.00 0.00 0.00 61.98 63.39 3h1c s VAL 117 Cb -0.15 -4.28 -0.11 0.00 0.00 0.00 0.00 36.38 31.84 3h1c s VAL 117 CO 0.05 -0.38 0.18 0.55 0.00 0.00 0.00 175.10 175.50 3h1c n VAL 118 N 5.73 0.00 -3.71 2.92 3.14 -1.09 -3.44 118.33 121.88 3h1c n VAL 118 Ca 0.08 -0.19 -0.11 0.00 -2.96 0.00 0.00 64.34 61.15 3h1c n VAL 118 Cb 0.48 0.43 -0.11 0.00 -1.06 0.00 0.00 33.84 33.57 3h1c n VAL 118 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 3h1c s SER 119 N -2.67 -0.43 -0.02 6.55 0.15 -1.03 -4.25 113.70 112.00 3h1c s SER 119 Ca -0.02 0.78 0.01 0.00 0.70 0.00 0.00 55.95 57.42 3h1c s SER 119 Cb 0.05 0.69 0.01 0.00 -1.71 0.00 0.00 66.02 65.06 3h1c s SER 119 CO 0.30 -0.17 -0.02 0.54 1.20 0.00 0.00 173.24 175.09 3h1c s VAL 120 N 1.10 0.25 -0.25 4.45 0.11 -1.02 0.65 120.40 125.68 3h1c s VAL 120 Ca -0.07 -0.04 -0.11 0.00 -2.93 0.00 0.00 61.98 58.83 3h1c s VAL 120 Cb -0.07 -0.27 -0.05 0.00 -1.53 0.00 0.00 36.38 34.45 3h1c s VAL 120 CO -0.09 0.12 0.17 0.21 -3.33 0.00 0.00 175.10 172.18 3h1c s ASN 121 N 0.51 6.09 0.00 3.54 2.47 -1.20 -4.56 114.94 121.78 3h1c s ASN 121 Ca -0.05 0.07 0.00 0.00 0.42 0.00 0.00 52.86 53.30 3h1c s ASN 121 Cb -0.08 -2.11 0.00 0.00 -1.45 0.00 0.00 41.25 37.61 3h1c s ASN 121 CO -0.01 0.02 0.74 -2.65 -3.72 0.00 0.00 177.10 171.49 3h1c n PRO 122 N 4.56 0.00 -0.10 0.43 -0.02 -1.26 -1.59 135.00 137.02 3h1c n PRO 122 Ca -0.15 0.26 -0.10 0.00 -2.02 0.00 0.00 63.50 61.49 3h1c n PRO 122 Cb 0.52 -1.52 -0.15 0.00 -0.02 0.00 0.00 33.50 32.33 3h1c n PRO 122 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 3h1c n GLN 123 N -1.24 0.89 -4.07 -0.52 -0.06 -1.26 -4.86 117.38 106.25 3h1c n GLN 123 Ca 0.00 0.00 -0.35 0.00 -2.00 0.00 0.00 57.00 54.65 3h1c n GLN 123 Cb 0.02 -1.49 -0.12 0.00 -4.06 0.00 0.00 30.24 24.60 3h1c n GLN 123 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 3h1c s VAL 124 N -2.46 4.21 0.08 1.69 1.01 -0.62 -3.21 120.40 121.10 3h1c s VAL 124 Ca -0.11 -0.23 -0.30 0.00 0.00 0.00 0.00 61.98 61.34 3h1c s VAL 124 Cb 0.06 -2.90 -0.06 0.00 0.00 0.00 0.00 36.38 33.48 3h1c s VAL 124 CO 0.76 0.43 1.18 0.21 0.00 0.00 0.00 175.10 177.68 3h1c s ASN 125 N 0.82 7.11 0.00 3.32 3.84 -1.26 -4.47 114.94 124.30 3h1c s ASN 125 Ca 0.01 2.03 0.09 0.00 0.21 0.00 0.00 52.86 55.20 3h1c s ASN 125 Cb -0.14 -2.58 0.41 0.00 -0.55 0.00 0.00 41.25 38.38 3h1c s ASN 125 CO 0.02 -0.42 1.28 -0.81 -2.79 0.00 0.00 177.10 174.38 3h1c n PRO 126 N 3.63 1.29 -0.05 0.43 -0.05 -1.26 -4.16 135.00 134.82 3h1c n PRO 126 Ca 0.08 -0.44 -0.11 0.00 -0.05 0.00 0.00 63.50 62.98 3h1c n PRO 126 Cb 0.46 -1.18 0.03 0.00 -0.05 0.00 0.00 33.50 32.76 3h1c n PRO 126 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 175.50 175.83 3h1c h ASP 127 N 0.77 0.80 1.07 3.54 2.03 -2.00 -2.52 116.42 120.10 3h1c h ASP 127 Ca 0.00 -0.39 -0.09 0.00 -0.73 0.00 0.00 57.03 55.81 3h1c h ASP 127 Cb 0.17 -0.23 -0.02 0.00 -0.83 0.00 0.00 39.33 38.43 3h1c h ASP 127 CO 0.00 1.14 -0.98 0.16 -1.03 0.00 0.00 179.24 178.53 3h1c h ILE 128 N 0.58 0.40 -0.40 4.15 3.07 -1.96 -3.26 117.51 120.09 3h1c h ILE 128 Ca 0.03 -1.69 -0.10 0.00 1.55 0.00 0.00 64.86 64.65 3h1c h ILE 128 Cb 1.03 1.97 -0.02 0.00 -0.27 0.00 0.00 36.82 39.54 3h1c h ILE 128 CO 0.10 0.23 -0.17 0.58 -1.05 0.00 0.00 178.15 177.84 3h1c h VAL 129 N 0.00 1.26 0.00 0.16 2.07 -1.75 -1.41 116.25 116.58 3h1c h VAL 129 Ca -0.07 -1.25 -0.12 0.00 0.82 0.00 0.00 66.70 66.08 3h1c h VAL 129 Cb 1.33 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 3h1c h VAL 129 CO 0.03 0.42 -0.59 0.00 0.02 0.00 0.00 177.57 177.46 3h1c h ALA 130 N 1.14 0.98 -0.21 1.67 0.00 -1.57 -2.25 119.26 119.02 3h1c h ALA 130 Ca 0.11 -0.53 -0.19 0.00 0.00 0.00 0.00 54.91 54.29 3h1c h ALA 130 Cb 0.66 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3h1c h ALA 130 CO 0.05 0.73 -0.63 0.52 0.00 0.00 0.00 179.25 179.92 3h1c h MET 131 N 0.00 0.74 -0.23 0.00 2.07 -1.51 -2.44 114.93 113.56 3h1c h MET 131 Ca -0.01 -0.51 -0.12 0.00 -2.07 0.00 0.00 59.70 56.99 3h1c h MET 131 Cb 1.07 0.08 -0.01 0.00 -1.87 0.00 0.00 31.60 30.86 3h1c h MET 131 CO 0.08 1.14 -0.36 0.82 1.07 0.00 0.00 176.91 179.66 3h1c h ILE 132 N 0.54 1.29 -0.63 -1.22 2.04 -1.26 -2.34 117.51 115.93 3h1c h ILE 132 Ca -0.01 -1.47 -0.00 0.00 1.00 0.00 0.00 64.86 64.37 3h1c h ILE 132 Cb 1.23 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 38.78 3h1c h ILE 132 CO 0.13 0.46 0.38 1.23 0.00 0.00 0.00 178.15 180.35 3h1c h GLY 133 N 1.07 0.91 1.87 5.37 0.00 -1.29 -0.87 103.07 110.13 3h1c h GLY 133 Ca 0.05 -0.37 -0.14 0.00 0.00 0.00 0.00 47.33 46.86 3h1c h GLY 133 CO 0.07 0.36 -0.62 0.00 0.00 0.00 0.00 176.54 176.35 3h1c h ALA 134 N 1.20 0.89 -0.31 3.60 0.00 -1.41 -1.71 119.26 121.51 3h1c h ALA 134 Ca 0.23 -0.56 -0.10 0.00 0.00 0.00 0.00 54.91 54.47 3h1c h ALA 134 Cb -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3h1c h ALA 134 CO -0.04 0.76 -0.23 1.03 0.00 0.00 0.00 179.25 180.76 3h1c h SER 135 N 0.09 0.60 0.47 0.00 0.87 -1.04 -2.01 113.55 112.55 3h1c h SER 135 Ca -0.01 -0.21 -0.30 0.00 -1.23 0.00 0.00 61.79 60.04 3h1c h SER 135 Cb 1.12 -0.16 0.01 0.00 -0.44 0.00 0.00 62.40 62.93 3h1c h SER 135 CO 0.09 0.83 -1.41 0.00 -0.53 0.00 0.00 176.83 175.81 3h1c h ALA 136 N 1.22 0.09 -0.20 6.23 0.00 -1.11 -3.25 119.26 122.24 3h1c h ALA 136 Ca 0.08 -0.96 -0.21 0.00 0.00 0.00 0.00 54.91 53.82 3h1c h ALA 136 Cb 0.69 0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.63 3h1c h ALA 136 CO 0.05 0.96 -0.67 0.00 0.00 0.00 0.00 179.25 179.59 3h1c h ALA 137 N 0.43 0.36 0.00 0.00 0.00 -1.30 -2.66 119.26 116.09 3h1c h ALA 137 Ca -0.20 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.12 3h1c h ALA 137 Cb 2.04 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.79 3h1c h ALA 137 CO 0.21 0.66 -0.10 -0.07 0.00 0.00 0.00 179.25 179.94 3h1c h LEU 138 N 0.57 0.00 0.09 0.00 3.38 -1.52 -2.23 115.31 115.60 3h1c h LEU 138 Ca -0.03 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.68 3h1c h LEU 138 Cb 1.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 3h1c h LEU 138 CO 0.14 0.10 -1.25 0.28 0.09 0.00 0.00 178.44 177.81 3h1c h SER 139 N 0.00 0.29 0.24 -0.43 0.02 -1.57 -3.31 113.55 108.78 3h1c h SER 139 Ca -0.00 -0.33 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 3h1c h SER 139 Cb 0.68 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.13 3h1c h SER 139 CO 0.01 1.26 -0.28 0.18 -1.14 0.00 0.00 176.83 176.86 3h1c n LEU 140 N -3.45 1.03 0.05 5.07 4.32 -1.01 -4.23 117.00 118.78 3h1c n LEU 140 Ca -0.08 -0.27 -0.09 0.00 -0.02 0.00 0.00 56.01 55.56 3h1c n LEU 140 Cb 1.01 -0.12 0.06 0.00 -1.62 0.00 0.00 43.42 42.74 3h1c n LEU 140 CO 0.51 0.20 0.41 0.77 -1.22 0.00 0.00 177.39 178.06 3h1c h SER 141 N 1.17 0.46 0.00 -1.43 4.64 -1.49 -3.13 113.55 113.77 3h1c h SER 141 Ca 0.00 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3h1c h SER 141 Cb 0.52 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3h1c h SER 141 CO 0.00 0.99 0.00 0.61 -0.87 0.00 0.00 176.83 177.56 3h1c n GLY 142 N 0.42 3.33 3.71 -0.77 0.00 -1.26 -4.86 105.19 105.76 3h1c n GLY 142 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.66 2.28 -0.75 -0.61 1.01 -1.26 -0.31 121.20 118.90 3h1c s ILE 143 Ca 0.00 0.04 -0.34 0.00 0.00 0.00 0.00 60.65 60.36 3h1c s ILE 143 Cb 0.00 -3.03 -0.18 0.00 0.01 0.00 0.00 42.46 39.26 3h1c s ILE 143 CO 0.00 0.00 2.48 -0.81 0.00 0.00 0.00 174.94 176.62 3h1c n PRO 144 N 4.79 0.27 -3.71 2.79 -0.04 -1.26 -4.90 135.00 132.94 3h1c n PRO 144 Ca 0.17 0.03 -0.18 0.00 -0.04 0.00 0.00 63.50 63.48 3h1c n PRO 144 Cb 0.37 -1.88 -0.17 0.00 -0.04 0.00 0.00 33.50 31.78 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 8.61 0.02 -0.18 0.54 5.36 -1.26 -4.45 117.98 126.63 3h1c s PHE 145 Ca 1.24 0.24 0.01 0.00 -0.96 0.00 0.00 56.93 57.47 3h1c s PHE 145 Cb -1.12 -0.36 0.21 0.00 -0.34 0.00 0.00 43.02 41.41 3h1c s PHE 145 CO 0.49 -0.16 1.26 0.09 -1.46 0.00 0.00 175.22 175.45 3h1c n ASN 146 N 4.84 3.19 -2.12 6.13 3.02 -1.16 -4.87 115.26 124.28 3h1c n ASN 146 Ca -0.13 -2.48 0.00 0.00 -0.03 0.00 0.00 54.58 51.93 3h1c n ASN 146 Cb 0.50 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 3h1c n ASN 146 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h1c n GLY 147 N 0.00 0.59 3.93 7.41 0.00 -1.26 -4.98 105.19 110.88 3h1c n GLY 147 Ca 0.18 -1.68 -0.26 0.00 0.00 0.00 0.00 46.02 44.26 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 1.02 2.25 0.23 1.61 0.05 -1.26 -5.02 135.00 133.88 3h1c s PRO 148 Ca 0.00 -0.21 0.09 0.00 0.05 0.00 0.00 61.00 60.93 3h1c s PRO 148 Cb 0.00 -2.17 -0.04 0.00 0.05 0.00 0.00 34.50 32.34 3h1c s PRO 148 CO 0.00 -1.21 -0.04 0.96 0.05 0.00 0.00 177.00 176.77 3h1c s ILE 149 N -3.24 3.36 0.14 0.56 -4.36 -1.26 -4.46 121.20 111.94 3h1c s ILE 149 Ca 0.60 -1.82 0.04 0.00 -0.26 0.00 0.00 60.65 59.21 3h1c s ILE 149 Cb -0.11 -2.75 -0.04 0.00 1.25 0.00 0.00 42.46 40.82 3h1c s ILE 149 CO 0.45 -0.28 0.14 -0.83 0.24 0.00 0.00 174.94 174.66 3h1c s GLY 150 N -3.36 1.80 -0.11 6.27 0.00 -0.71 -4.59 107.32 106.61 3h1c s GLY 150 Ca 0.29 -1.14 0.01 0.00 0.00 0.00 0.00 44.72 43.88 3h1c s GLY 150 CO 0.18 -1.14 -0.11 0.00 0.00 0.00 0.00 173.10 172.03 3h1c s ALA 151 N -1.66 1.45 -0.14 3.20 0.00 -1.26 -3.54 121.76 119.81 3h1c s ALA 151 Ca 0.31 -0.60 -0.09 0.00 0.00 0.00 0.00 51.96 51.59 3h1c s ALA 151 Cb -0.11 -0.83 0.05 0.00 0.00 0.00 0.00 23.12 22.23 3h1c s ALA 151 CO 0.24 -0.22 0.34 0.00 0.00 0.00 0.00 175.76 176.12 3h1c s ALA 152 N 1.29 -0.85 -0.07 0.00 0.00 -1.06 -4.89 121.76 116.18 3h1c s ALA 152 Ca -0.02 1.24 -0.01 0.00 0.00 0.00 0.00 51.96 53.16 3h1c s ALA 152 Cb -0.14 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 3h1c s ALA 152 CO -0.04 -0.22 0.00 -0.98 0.00 0.00 0.00 175.76 174.52 3h1c s ARG 153 N 1.09 2.95 -0.04 0.00 1.70 -1.26 -0.76 118.95 122.63 3h1c s ARG 153 Ca -0.07 -0.44 0.02 0.00 -0.47 0.00 0.00 55.73 54.76 3h1c s ARG 153 Cb -0.08 -2.77 0.01 0.00 -0.57 0.00 0.00 34.95 31.54 3h1c s ARG 153 CO -0.09 0.69 -0.08 0.54 -1.08 0.00 0.00 175.30 175.29 3h1c s VAL 154 N -0.93 0.73 0.50 4.99 0.11 -0.81 0.03 120.40 125.04 3h1c s VAL 154 Ca 0.15 -0.28 0.05 0.00 -2.93 0.00 0.00 61.98 58.96 3h1c s VAL 154 Cb -0.11 -0.69 0.09 0.00 -1.53 0.00 0.00 36.38 34.14 3h1c s VAL 154 CO 0.04 0.25 0.69 0.61 -3.33 0.00 0.00 175.10 173.37 3h1c n GLY 155 N 3.67 1.49 2.37 6.54 0.00 -0.65 -3.33 105.19 115.28 3h1c n GLY 155 Ca -0.22 -2.14 -0.23 0.00 0.00 0.00 0.00 46.02 43.44 3h1c n GLY 155 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3h1c n TYR 156 N -2.20 -1.14 -3.39 1.61 9.36 -1.25 -2.79 117.16 117.34 3h1c n TYR 156 Ca 0.13 -3.13 -0.37 0.00 3.32 0.00 0.00 57.90 57.85 3h1c n TYR 156 Cb 0.47 0.24 -0.06 0.00 -0.63 0.00 0.00 39.34 39.36 3h1c n TYR 156 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 3h1c s ILE 157 N -0.26 5.20 -1.30 2.97 1.01 -0.86 -3.09 121.20 124.87 3h1c s ILE 157 Ca 0.33 0.84 -0.07 0.00 0.00 0.00 0.00 60.65 61.75 3h1c s ILE 157 Cb 0.09 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.82 3h1c s ILE 157 CO -0.16 0.38 0.14 -0.46 0.00 0.00 0.00 174.94 174.84 3h1c n ASN 158 N 3.40 -0.20 -3.59 3.58 0.23 -1.26 -1.37 115.26 116.06 3h1c n ASN 158 Ca -0.09 -1.14 -0.21 0.00 -0.53 0.00 0.00 54.58 52.61 3h1c n ASN 158 Cb 0.52 -1.40 0.07 0.00 -2.08 0.00 0.00 39.78 36.88 3h1c n ASN 158 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 3h1c n ASP 159 N -2.34 -3.37 -3.72 0.53 8.00 -1.26 -5.02 116.55 109.37 3h1c n ASP 159 Ca -0.25 -0.66 -0.12 0.00 0.71 0.00 0.00 54.79 54.48 3h1c n ASP 159 Cb 0.59 -4.74 -0.11 0.00 -0.02 0.00 0.00 41.12 36.84 3h1c n ASP 159 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3h1c s GLN 160 N -5.89 0.41 -0.10 -1.24 -1.52 -0.47 -5.14 119.66 105.70 3h1c s GLN 160 Ca 0.24 0.65 -0.30 0.00 -1.95 0.00 0.00 55.36 54.00 3h1c s GLN 160 Cb -0.11 0.09 -0.01 0.00 -0.22 0.00 0.00 33.01 32.76 3h1c s GLN 160 CO 0.76 -0.11 1.01 0.71 -0.25 0.00 0.00 175.29 177.41 3h1c s TYR 161 N 0.79 3.51 -0.17 0.91 1.51 -1.26 -2.02 117.35 120.62 3h1c s TYR 161 Ca -0.05 1.59 0.01 0.00 -1.01 0.00 0.00 57.07 57.61 3h1c s TYR 161 Cb -0.06 -3.19 0.01 0.00 -0.11 0.00 0.00 41.96 38.61 3h1c s TYR 161 CO -0.06 -0.25 -0.20 0.08 -1.11 0.00 0.00 175.55 174.01 3h1c s VAL 162 N 2.00 2.12 0.02 0.71 1.01 -1.12 -4.98 120.40 120.15 3h1c s VAL 162 Ca 0.49 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 61.23 3h1c s VAL 162 Cb -0.19 -1.87 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 3h1c s VAL 162 CO 0.18 0.54 1.26 -0.22 0.00 0.00 0.00 175.10 176.86 3h1c s LEU 163 N 1.10 4.34 -0.63 3.92 2.96 -1.26 -1.64 118.68 127.47 3h1c s LEU 163 Ca 0.00 2.01 -0.16 0.00 -0.22 0.00 0.00 54.13 55.76 3h1c s LEU 163 Cb -0.14 -3.57 0.02 0.00 0.50 0.00 0.00 46.19 43.00 3h1c s LEU 163 CO -0.08 -0.57 0.64 0.59 -1.32 0.00 0.00 176.35 175.61 3h1c n ASN 164 N 4.54 -5.91 -4.80 3.68 3.02 0.10 -4.87 115.26 111.02 3h1c n ASN 164 Ca 0.10 -0.35 -0.34 0.00 -0.03 0.00 0.00 54.58 53.96 3h1c n ASN 164 Cb 0.45 -2.68 -0.06 0.00 -0.61 0.00 0.00 39.78 36.88 3h1c n ASN 164 CO 0.00 0.00 0.00 -2.84 -2.62 0.00 0.00 177.26 171.80 3h1c s PRO 165 N -3.48 4.19 0.92 3.52 0.02 -1.26 -4.97 135.00 133.94 3h1c s PRO 165 Ca 0.17 1.25 -0.13 0.00 0.02 0.00 0.00 61.00 62.31 3h1c s PRO 165 Cb -0.02 -2.30 0.14 0.00 0.02 0.00 0.00 34.50 32.34 3h1c s PRO 165 CO 0.85 -0.08 1.15 0.95 -0.33 0.00 0.00 177.00 179.54 3h1c s THR 166 N -1.99 1.99 0.41 0.99 -4.23 -1.26 -4.76 115.64 106.78 3h1c s THR 166 Ca 0.61 0.00 0.19 0.00 -1.18 0.00 0.00 61.69 61.31 3h1c s THR 166 Cb -0.13 -2.76 0.21 0.00 1.34 0.00 0.00 72.50 71.16 3h1c s THR 166 CO 0.18 0.00 1.99 -0.61 -0.54 0.00 0.00 174.62 175.63 3h1c h GLN 167 N -1.53 0.00 0.00 3.99 5.75 -1.88 0.27 115.11 121.71 3h1c h GLN 167 Ca -0.50 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 57.91 3h1c h GLN 167 Cb 1.33 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.86 3h1c h GLN 167 CO 0.60 0.20 -0.45 -0.44 -2.65 0.00 0.00 178.83 176.08 3h1c h ASP 168 N 0.00 0.00 1.10 -0.69 3.32 -1.93 -3.23 116.42 115.00 3h1c h ASP 168 Ca -0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 3h1c h ASP 168 Cb 0.41 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 3h1c h ASP 168 CO 0.03 0.45 -0.92 -0.33 -1.72 0.00 0.00 179.24 176.75 3h1c h GLU 169 N 0.00 0.00 -0.09 3.56 5.08 -1.56 -3.37 114.58 118.19 3h1c h GLU 169 Ca -0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 3h1c h GLU 169 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 3h1c h GLU 169 CO 0.06 0.07 -0.58 1.25 -1.00 0.00 0.00 179.01 178.81 3h1c h LEU 170 N 0.00 0.34 -0.58 1.33 5.85 -0.54 -2.76 115.31 118.95 3h1c h LEU 170 Ca -0.03 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.50 3h1c h LEU 170 Cb 1.12 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.05 3h1c h LEU 170 CO 0.01 0.85 0.00 0.07 -0.34 0.00 0.00 178.44 179.03 3h1c h LYS 171 N 0.23 0.00 0.00 1.25 2.10 -1.72 -2.84 116.57 115.58 3h1c h LYS 171 Ca -0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.60 3h1c h LYS 171 Cb 1.09 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.41 3h1c h LYS 171 CO 0.09 0.00 -1.23 0.39 -2.00 0.00 0.00 179.45 176.70 3h1c n GLU 172 N -2.46 0.62 -2.49 0.07 -0.58 -1.09 -4.95 120.64 109.76 3h1c n GLU 172 Ca 0.03 0.11 -0.28 0.00 -0.42 0.00 0.00 57.16 56.60 3h1c n GLU 172 Cb 0.32 -1.78 0.01 0.00 -0.57 0.00 0.00 31.44 29.41 3h1c n GLU 172 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3h1c s SER 173 N -5.36 6.17 0.00 1.62 1.04 -1.06 -4.81 113.70 111.29 3h1c s SER 173 Ca -0.02 0.98 0.16 0.00 0.48 0.00 0.00 55.95 57.54 3h1c s SER 173 Cb 0.10 -2.21 -0.05 0.00 0.10 0.00 0.00 66.02 63.96 3h1c s SER 173 CO 0.81 -0.69 0.80 0.29 0.98 0.00 0.00 173.24 175.43 3h1c n LYS 174 N -2.38 1.74 -4.24 4.02 4.01 -1.18 -4.93 118.16 115.20 3h1c n LYS 174 Ca 0.02 -0.59 -0.17 0.00 -0.51 0.00 0.00 58.31 57.06 3h1c n LYS 174 Cb 0.55 -1.26 -0.13 0.00 -0.51 0.00 0.00 35.03 33.67 3h1c n LYS 174 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 3h1c s LEU 175 N -2.23 2.12 -0.33 -0.35 2.96 -1.26 -1.42 118.68 118.17 3h1c s LEU 175 Ca 0.11 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 53.70 3h1c s LEU 175 Cb 0.13 -0.39 0.14 0.00 0.50 0.00 0.00 46.19 46.57 3h1c s LEU 175 CO 0.47 -0.00 0.30 -0.62 -1.32 0.00 0.00 176.35 175.18 3h1c s ASP 176 N -0.81 1.79 -0.01 3.68 2.15 -0.44 -3.96 116.67 119.07 3h1c s ASP 176 Ca -0.01 -1.27 0.06 0.00 0.43 0.00 0.00 52.55 51.75 3h1c s ASP 176 Cb -0.06 0.35 -0.01 0.00 -0.30 0.00 0.00 42.92 42.90 3h1c s ASP 176 CO 0.00 -0.34 -0.18 -1.48 -0.17 0.00 0.00 175.17 173.00 3h1c s LEU 177 N 1.84 2.03 -0.23 -1.34 0.05 -1.21 -1.59 118.68 118.23 3h1c s LEU 177 Ca 0.13 -0.33 -0.06 0.00 0.05 0.00 0.00 54.13 53.92 3h1c s LEU 177 Cb -0.16 -0.95 -0.02 0.00 -2.05 0.00 0.00 46.19 43.02 3h1c s LEU 177 CO -0.18 0.22 0.03 -0.69 -0.55 0.00 0.00 176.35 175.18 3h1c s VAL 178 N -0.42 4.01 -0.04 1.48 1.01 0.35 -1.91 120.40 124.87 3h1c s VAL 178 Ca 0.07 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 61.79 3h1c s VAL 178 Cb -0.07 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 3h1c s VAL 178 CO -0.01 0.38 -0.09 0.54 0.00 0.00 0.00 175.10 175.92 3h1c s VAL 179 N 1.48 3.53 0.01 2.92 0.11 0.06 -1.52 120.40 127.00 3h1c s VAL 179 Ca 0.06 -0.62 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 3h1c s VAL 179 Cb -0.15 -2.46 -0.01 0.00 -1.53 0.00 0.00 36.38 32.23 3h1c s VAL 179 CO 0.01 0.54 -0.03 0.00 -3.33 0.00 0.00 175.10 172.30 3h1c s ALA 180 N -0.84 0.14 0.00 1.54 0.00 0.20 -2.57 121.76 120.22 3h1c s ALA 180 Ca 0.13 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.69 3h1c s ALA 180 Cb -0.11 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.09 3h1c s ALA 180 CO 0.03 -0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.11 3h1c n GLY 181 N 2.12 1.41 0.33 0.00 0.00 -1.23 -0.27 105.19 107.55 3h1c n GLY 181 Ca -0.20 -0.95 -0.02 0.00 0.00 0.00 0.00 46.02 44.85 3h1c n GLY 181 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h1c n THR 182 N -0.57 0.00 0.12 2.61 -2.24 -0.75 -1.75 114.28 111.71 3h1c n THR 182 Ca 0.00 -0.10 -0.00 0.00 -2.27 0.00 0.00 64.05 61.68 3h1c n THR 182 Cb 0.00 -1.80 0.28 0.00 -2.10 0.00 0.00 70.33 66.72 3h1c n THR 182 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3h1c h GLU 183 N 0.00 0.17 0.13 -0.78 4.81 -1.96 -3.32 114.58 113.64 3h1c h GLU 183 Ca -0.03 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 3h1c h GLU 183 Cb 0.10 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.48 3h1c h GLU 183 CO 0.03 0.52 -0.06 0.00 -0.73 0.00 0.00 179.01 178.76 3h1c h ALA 184 N 1.48 -0.18 -2.81 2.92 0.00 -1.94 -3.49 119.26 115.24 3h1c h ALA 184 Ca 0.02 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 3h1c h ALA 184 Cb 0.71 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.47 3h1c h ALA 184 CO 0.05 -0.21 -0.17 0.00 0.00 0.00 0.00 179.25 178.92 3h1c s ALA 185 N -3.23 -0.11 0.35 0.00 0.00 -1.25 -4.88 121.76 112.64 3h1c s ALA 185 Ca -0.10 -0.95 -0.26 0.00 0.00 0.00 0.00 51.96 50.65 3h1c s ALA 185 Cb -0.00 1.10 -0.09 0.00 0.00 0.00 0.00 23.12 24.12 3h1c s ALA 185 CO 0.36 -0.83 1.05 0.08 0.00 0.00 0.00 175.76 176.43 3h1c s VAL 186 N -4.03 3.69 0.00 0.00 1.01 -1.26 -1.80 120.40 118.01 3h1c s VAL 186 Ca 0.24 1.43 0.00 0.00 0.00 0.00 0.00 61.98 63.65 3h1c s VAL 186 Cb 0.00 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.58 3h1c s VAL 186 CO 0.09 0.14 0.00 0.18 0.00 0.00 0.00 175.10 175.51 3h1c n LEU 187 N 0.40 0.00 -3.71 3.92 4.77 0.63 -4.81 117.00 118.19 3h1c n LEU 187 Ca 0.03 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.89 3h1c n LEU 187 Cb 0.48 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.46 3h1c n LEU 187 CO 0.48 0.00 0.03 -0.04 -1.33 0.00 0.00 177.39 176.53 3h1c s MET 188 N -1.92 0.38 -0.03 3.23 1.00 0.46 -2.43 119.30 120.00 3h1c s MET 188 Ca 0.00 0.68 0.01 0.00 0.00 0.00 0.00 55.69 56.38 3h1c s MET 188 Cb 0.00 0.03 0.02 0.00 0.00 0.00 0.00 34.83 34.88 3h1c s MET 188 CO 0.00 -0.13 -0.03 0.08 0.00 0.00 0.00 175.02 174.94 3h1c s VAL 189 N 1.05 0.37 -0.09 -6.03 1.01 -0.94 0.58 120.40 116.34 3h1c s VAL 189 Ca -0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 3h1c s VAL 189 Cb -0.07 -0.39 0.03 0.00 0.00 0.00 0.00 36.38 35.95 3h1c s VAL 189 CO -0.08 0.16 0.02 -0.70 0.00 0.00 0.00 175.10 174.50 3h1c s GLU 190 N 0.60 0.48 0.07 2.72 2.56 -0.58 -1.28 118.70 123.28 3h1c s GLU 190 Ca -0.07 0.06 0.01 0.00 0.00 0.00 0.00 54.97 54.97 3h1c s GLU 190 Cb -0.10 -1.12 -0.04 0.00 2.00 0.00 0.00 34.13 34.87 3h1c s GLU 190 CO -0.01 -0.38 -0.06 -1.54 -0.56 0.00 0.00 175.26 172.72 3h1c s SER 191 N 2.00 0.85 -0.02 -1.70 1.04 -0.91 -0.50 113.70 114.46 3h1c s SER 191 Ca 0.04 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.63 3h1c s SER 191 Cb -0.13 0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.11 3h1c s SER 191 CO -0.06 -0.42 0.00 -1.83 0.98 0.00 0.00 173.24 171.92 3h1c s GLU 192 N -3.08 0.17 0.06 4.02 -1.05 -0.62 -3.74 118.70 114.46 3h1c s GLU 192 Ca 0.03 0.05 0.02 0.00 -0.15 0.00 0.00 54.97 54.92 3h1c s GLU 192 Cb 0.01 -0.30 -0.03 0.00 -0.44 0.00 0.00 34.13 33.36 3h1c s GLU 192 CO -0.04 -0.08 -0.08 0.00 0.95 0.00 0.00 175.26 176.01 3h1c s ALA 193 N 0.64 0.73 -1.12 -0.84 0.00 0.75 -1.32 121.76 120.60 3h1c s ALA 193 Ca -0.06 -0.98 -0.05 0.00 0.00 0.00 0.00 51.96 50.87 3h1c s ALA 193 Cb -0.09 0.08 0.28 0.00 0.00 0.00 0.00 23.12 23.40 3h1c s ALA 193 CO -0.01 -0.09 1.59 1.04 0.00 0.00 0.00 175.76 178.28 3h1c n GLN 194 N 0.92 4.39 -3.18 0.00 6.02 -0.51 -4.35 117.38 120.68 3h1c n GLN 194 Ca -0.19 -4.37 -0.09 0.00 -0.01 0.00 0.00 57.00 52.35 3h1c n GLN 194 Cb 0.57 -2.58 0.00 0.00 1.02 0.00 0.00 30.24 29.25 3h1c n GLN 194 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3h1c n LEU 195 N 1.69 -5.85 -4.64 1.08 4.77 -1.10 -4.99 117.00 107.96 3h1c n LEU 195 Ca 0.30 -0.13 -0.27 0.00 -0.03 0.00 0.00 56.01 55.88 3h1c n LEU 195 Cb 0.33 -2.92 -0.08 0.00 -2.33 0.00 0.00 43.42 38.42 3h1c n LEU 195 CO 0.74 -1.02 -0.36 -0.76 -1.33 0.00 0.00 177.39 174.66 3h1c s LEU 196 N -3.82 3.23 0.90 2.23 1.43 -1.02 -4.61 118.68 117.02 3h1c s LEU 196 Ca 0.07 -0.40 -0.12 0.00 -1.03 0.00 0.00 54.13 52.65 3h1c s LEU 196 Cb -0.02 -1.92 0.13 0.00 0.03 0.00 0.00 46.19 44.41 3h1c s LEU 196 CO 0.79 0.12 1.10 -0.94 0.23 0.00 0.00 176.35 177.64 3h1c s SER 197 N -2.74 3.53 0.21 2.29 1.04 -1.26 -0.00 113.70 116.78 3h1c s SER 197 Ca 0.26 1.32 -0.08 0.00 0.48 0.00 0.00 55.95 57.92 3h1c s SER 197 Cb -0.10 -1.99 0.16 0.00 0.10 0.00 0.00 66.02 64.19 3h1c s SER 197 CO 0.17 -2.58 1.80 -0.33 0.98 0.00 0.00 173.24 173.29 3h1c h GLU 198 N -1.51 1.16 -0.01 4.02 3.07 -1.96 -2.23 114.58 117.12 3h1c h GLU 198 Ca -0.50 -0.17 -0.11 0.00 -0.50 0.00 0.00 59.36 58.08 3h1c h GLU 198 Cb 1.30 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.98 3h1c h GLU 198 CO 0.57 0.90 -0.51 -0.44 -1.40 0.00 0.00 179.01 178.14 3h1c h ASP 199 N 1.14 0.01 0.83 1.42 3.32 -1.98 -0.27 116.42 120.89 3h1c h ASP 199 Ca 0.27 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.18 3h1c h ASP 199 Cb 0.13 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 3h1c h ASP 199 CO -0.03 0.52 -0.63 1.56 -1.72 0.00 0.00 179.24 178.93 3h1c h GLN 200 N 0.01 0.00 0.10 3.56 4.20 -1.87 -2.05 115.11 119.07 3h1c h GLN 200 Ca -0.00 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.41 3h1c h GLN 200 Cb 0.90 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.67 3h1c h GLN 200 CO 0.07 0.63 -1.45 0.52 -0.67 0.00 0.00 178.83 177.93 3h1c h MET 201 N 0.00 0.22 -0.19 1.46 2.86 -1.17 -3.16 114.93 114.95 3h1c h MET 201 Ca -0.01 -0.37 -0.22 0.00 -2.06 0.00 0.00 59.70 57.04 3h1c h MET 201 Cb 1.22 0.14 0.01 0.00 0.06 0.00 0.00 31.60 33.03 3h1c h MET 201 CO 0.08 1.09 -0.73 1.25 1.06 0.00 0.00 176.91 179.66 3h1c h LEU 202 N 0.06 0.96 -1.09 1.22 5.85 -1.08 -3.14 115.31 118.09 3h1c h LEU 202 Ca -0.21 -0.60 -0.07 0.00 0.84 0.00 0.00 57.88 57.84 3h1c h LEU 202 Cb 1.99 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.73 3h1c h LEU 202 CO 0.16 1.41 -0.34 1.23 -0.34 0.00 0.00 178.44 180.56 3h1c h GLY 203 N 0.58 0.00 1.65 3.75 0.00 -1.51 -2.95 103.07 104.60 3h1c h GLY 203 Ca -0.04 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.12 3h1c h GLY 203 CO 0.15 0.00 -0.68 0.00 0.00 0.00 0.00 176.54 176.01 3h1c h ALA 204 N 1.66 0.69 -0.41 3.60 0.00 -1.55 -0.96 119.26 122.30 3h1c h ALA 204 Ca -0.00 -0.58 -0.14 0.00 0.00 0.00 0.00 54.91 54.18 3h1c h ALA 204 Cb 0.80 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3h1c h ALA 204 CO 0.04 0.76 -0.28 0.28 0.00 0.00 0.00 179.25 180.05 3h1c h VAL 205 N 0.24 1.28 -0.27 0.00 2.07 -1.49 -2.56 116.25 115.52 3h1c h VAL 205 Ca -0.02 -1.45 -0.04 0.00 0.82 0.00 0.00 66.70 66.01 3h1c h VAL 205 Cb 1.23 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.30 3h1c h VAL 205 CO 0.11 0.49 0.01 0.58 0.02 0.00 0.00 177.57 178.78 3h1c h VAL 206 N 0.73 1.25 -0.43 2.57 2.07 -1.46 -2.06 116.25 118.92 3h1c h VAL 206 Ca 0.08 -0.90 0.01 0.00 0.82 0.00 0.00 66.70 66.70 3h1c h VAL 206 Cb 0.86 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 3h1c h VAL 206 CO 0.08 0.29 0.29 0.15 0.02 0.00 0.00 177.57 178.39 3h1c h PHE 207 N 0.27 0.54 -0.18 1.57 3.57 -1.19 -1.09 116.94 120.43 3h1c h PHE 207 Ca 0.08 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.49 3h1c h PHE 207 Cb 0.41 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 3h1c h PHE 207 CO 0.03 0.34 -0.32 0.78 -2.23 0.00 0.00 178.31 176.91 3h1c h GLY 208 N 0.58 0.40 1.68 2.40 0.00 -1.47 -2.32 103.07 104.34 3h1c h GLY 208 Ca 0.16 -0.35 -0.14 0.00 0.00 0.00 0.00 47.33 47.00 3h1c h GLY 208 CO -0.04 0.32 -0.53 0.84 0.00 0.00 0.00 176.54 177.13 3h1c h HIS 209 N 0.32 0.42 0.00 5.60 -0.00 -1.05 -2.07 115.15 118.37 3h1c h HIS 209 Ca 0.04 -0.14 -0.13 0.00 -0.00 0.00 0.00 60.37 60.14 3h1c h HIS 209 Cb 0.73 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 28.04 3h1c h HIS 209 CO 0.02 0.80 -0.61 0.93 -0.00 0.00 0.00 177.93 179.07 3h1c h GLU 210 N 0.27 0.00 0.00 5.26 5.08 -1.06 -3.28 114.58 120.84 3h1c h GLU 210 Ca 0.01 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 3h1c h GLU 210 Cb 1.02 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 3h1c h GLU 210 CO 0.09 0.61 -0.94 1.96 -1.00 0.00 0.00 179.01 179.73 3h1c h GLN 211 N 0.00 0.00 -0.03 2.33 1.08 -1.33 -3.28 115.11 113.87 3h1c h GLN 211 Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 3h1c h GLN 211 Cb 1.29 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.72 3h1c h GLN 211 CO 0.08 0.29 0.00 0.00 -0.95 0.00 0.00 178.83 178.25 3h1c n GLN 212 N -2.98 1.23 0.07 1.46 10.64 -0.79 -3.96 117.38 123.06 3h1c n GLN 212 Ca -0.03 -0.34 -0.01 0.00 -1.83 0.00 0.00 57.00 54.79 3h1c n GLN 212 Cb 0.73 -1.39 0.28 0.00 -0.86 0.00 0.00 30.24 29.00 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 0.74 0.33 0.00 2.61 1.08 -1.64 -2.79 115.11 115.44 3h1c h GLN 213 Ca 0.00 -0.11 -0.03 0.00 -1.45 0.00 0.00 58.65 57.06 3h1c h GLN 213 Cb 0.16 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.56 3h1c h GLN 213 CO 0.00 0.55 -0.16 -0.39 -0.95 0.00 0.00 178.83 177.88 3h1c h VAL 214 N 0.30 0.42 -0.08 -0.54 -1.51 -1.84 -1.09 116.25 111.91 3h1c h VAL 214 Ca 0.05 -0.94 -0.04 0.00 -1.23 0.00 0.00 66.70 64.54 3h1c h VAL 214 Cb 0.57 1.68 -0.00 0.00 -2.13 0.00 0.00 31.29 31.41 3h1c h VAL 214 CO 0.04 0.16 -0.12 0.58 -1.23 0.00 0.00 177.57 177.00 3h1c h VAL 215 N 0.00 1.39 -0.57 7.19 2.07 -1.76 -2.67 116.25 121.90 3h1c h VAL 215 Ca -0.00 -1.37 -0.08 0.00 0.82 0.00 0.00 66.70 66.07 3h1c h VAL 215 Cb 0.66 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 3h1c h VAL 215 CO 0.02 0.38 0.04 0.40 0.02 0.00 0.00 177.57 178.44 3h1c h ILE 216 N -0.22 1.25 0.00 4.57 2.04 -1.47 -2.47 117.51 121.21 3h1c h ILE 216 Ca 0.01 -1.04 -0.10 0.00 1.00 0.00 0.00 64.86 64.73 3h1c h ILE 216 Cb 0.68 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 3h1c h ILE 216 CO 0.03 0.38 -0.48 1.56 0.00 0.00 0.00 178.15 179.64 3h1c h GLN 217 N 0.89 0.00 0.00 2.37 4.20 -1.25 -2.76 115.11 118.56 3h1c h GLN 217 Ca 0.17 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.68 3h1c h GLN 217 Cb 0.46 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.21 3h1c h GLN 217 CO 0.02 0.48 -1.38 -0.91 -0.67 0.00 0.00 178.83 176.37 3h1c h ASN 218 N 0.00 0.00 -0.27 1.46 2.35 -1.38 -3.28 115.58 114.46 3h1c h ASN 218 Ca -0.00 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.62 3h1c h ASN 218 Cb 0.93 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.30 3h1c h ASN 218 CO 0.06 0.74 -0.31 0.40 -1.65 0.00 0.00 177.43 176.67 3h1c h ILE 219 N 0.00 1.31 -0.54 2.81 2.04 -1.44 -3.04 117.51 118.64 3h1c h ILE 219 Ca -0.17 -1.50 0.07 0.00 1.00 0.00 0.00 64.86 64.26 3h1c h ILE 219 Cb 1.71 1.64 -0.03 0.00 -0.74 0.00 0.00 36.82 39.41 3h1c h ILE 219 CO 0.07 0.48 0.36 0.78 0.00 0.00 0.00 178.15 179.83 3h1c h ASN 220 N 0.42 0.41 0.71 1.72 2.35 -1.62 -0.91 115.58 118.65 3h1c h ASN 220 Ca 0.04 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.66 3h1c h ASN 220 Cb 0.89 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 39.16 3h1c h ASN 220 CO 0.08 0.26 -0.62 -0.33 -1.65 0.00 0.00 177.43 175.17 3h1c h GLU 221 N 0.46 0.00 0.02 0.81 4.39 -1.61 -2.39 114.58 116.27 3h1c h GLU 221 Ca 0.24 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.73 3h1c h GLU 221 Cb 0.34 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 3h1c h GLU 221 CO -0.06 0.62 -0.93 1.25 -1.16 0.00 0.00 179.01 178.72 3h1c h LEU 222 N 0.00 0.30 -0.76 1.33 6.46 -1.12 -2.55 115.31 118.97 3h1c h LEU 222 Ca -0.01 -0.26 -0.11 0.00 -0.12 0.00 0.00 57.88 57.39 3h1c h LEU 222 Cb 1.14 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 40.96 3h1c h LEU 222 CO 0.08 1.08 -0.19 0.58 -0.62 0.00 0.00 178.44 179.37 3h1c h VAL 223 N 0.12 1.27 0.00 1.05 2.07 -1.18 -1.35 116.25 118.22 3h1c h VAL 223 Ca -0.06 -1.27 -0.06 0.00 0.82 0.00 0.00 66.70 66.14 3h1c h VAL 223 Cb 1.58 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 3h1c h VAL 223 CO 0.15 0.42 -0.26 0.50 0.02 0.00 0.00 177.57 178.40 3h1c h LYS 224 N 0.65 0.00 0.00 1.57 3.64 -1.38 -1.89 116.57 119.16 3h1c h LYS 224 Ca 0.10 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.36 3h1c h LYS 224 Cb 0.68 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.48 3h1c h LYS 224 CO 0.05 0.26 -0.77 1.49 -2.27 0.00 0.00 179.45 178.21 3h1c h GLU 225 N 0.00 0.00 -0.46 1.90 4.81 -1.20 -3.44 114.58 116.19 3h1c h GLU 225 Ca -0.00 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.98 3h1c h GLU 225 Cb 0.70 0.00 -0.36 0.00 0.63 0.00 0.00 28.75 29.72 3h1c h GLU 225 CO 0.03 0.69 -1.00 0.00 -0.73 0.00 0.00 179.01 178.00 3h1c n ALA 226 N -3.27 2.72 -2.37 2.92 0.00 -0.53 -5.10 120.51 114.88 3h1c n ALA 226 Ca -0.20 -2.55 -0.38 0.00 0.00 0.00 0.00 53.44 50.31 3h1c n ALA 226 Cb 0.50 -0.89 -0.06 0.00 0.00 0.00 0.00 19.45 19.00 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 -3.28 2.60 0.49 0.00 0.00 -0.71 -4.92 107.32 101.50 3h1c s GLY 227 Ca 0.25 -0.06 -0.23 0.00 0.00 0.00 0.00 44.72 44.68 3h1c s GLY 227 CO -0.04 0.37 1.26 0.54 0.00 0.00 0.00 173.10 175.23 3h1c s LYS 228 N -1.03 3.54 0.28 2.90 1.02 -1.19 -4.94 119.74 120.32 3h1c s LYS 228 Ca 0.27 2.01 -0.30 0.00 0.02 0.00 0.00 55.97 57.97 3h1c s LYS 228 Cb -0.18 -2.40 -0.13 0.00 -0.52 0.00 0.00 37.83 34.60 3h1c s LYS 228 CO 0.17 -0.80 1.37 -0.35 -0.92 0.00 0.00 175.35 174.82 3h1c n PRO 229 N -0.62 2.08 -2.09 -1.68 -0.04 -1.26 -4.41 135.00 126.99 3h1c n PRO 229 Ca 0.08 0.74 -0.41 0.00 -0.04 0.00 0.00 63.50 63.87 3h1c n PRO 229 Cb 0.46 -2.37 -0.02 0.00 -0.04 0.00 0.00 33.50 31.54 3h1c n PRO 229 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3h1c s ARG 230 N -0.92 4.33 0.21 0.54 1.81 -1.26 -4.59 118.95 119.07 3h1c s ARG 230 Ca 0.64 2.24 -0.32 0.00 -1.72 0.00 0.00 55.73 56.57 3h1c s ARG 230 Cb -0.62 -3.07 -0.13 0.00 -0.45 0.00 0.00 34.95 30.68 3h1c s ARG 230 CO 0.54 -0.24 1.65 0.91 -0.68 0.00 0.00 175.30 177.48 3h1c n TRP 231 N 1.06 2.61 -1.86 -0.53 7.02 0.58 -4.88 117.44 121.44 3h1c n TRP 231 Ca 0.01 0.15 -0.42 0.00 -1.02 0.00 0.00 57.50 56.22 3h1c n TRP 231 Cb 0.41 -2.62 -0.00 0.00 -2.42 0.00 0.00 31.31 26.68 3h1c n TRP 231 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 3h1c n ASP 232 N 3.50 4.00 -4.37 -0.99 2.03 -1.26 -4.85 116.55 114.60 3h1c n ASP 232 Ca 0.15 -2.85 -0.32 0.00 0.52 0.00 0.00 54.79 52.29 3h1c n ASP 232 Cb 0.33 -1.66 -0.15 0.00 -0.72 0.00 0.00 41.12 38.93 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 3.50 2.67 -0.04 -0.67 -0.00 -1.26 -5.12 118.94 118.03 3h1c s TRP 233 Ca 0.49 -0.52 -0.00 0.00 -0.00 0.00 0.00 56.10 56.07 3h1c s TRP 233 Cb 0.12 -1.71 0.03 0.00 -0.00 0.00 0.00 33.47 31.91 3h1c s TRP 233 CO -0.05 -0.09 0.00 -0.65 -0.00 0.00 0.00 176.95 176.16 3h1c s GLN 234 N -0.14 0.36 0.78 5.86 -1.52 -1.26 -5.10 119.66 118.64 3h1c s GLN 234 Ca -0.02 0.09 -0.12 0.00 -1.95 0.00 0.00 55.36 53.36 3h1c s GLN 234 Cb -0.14 -0.60 0.07 0.00 -0.22 0.00 0.00 33.01 32.12 3h1c s GLN 234 CO 0.04 -0.17 1.12 -1.25 -0.25 0.00 0.00 175.29 174.77 3h1c s PRO 235 N 1.27 2.04 0.23 2.91 0.04 -1.26 -4.95 135.00 135.29 3h1c s PRO 235 Ca -0.06 1.38 -0.31 0.00 0.04 0.00 0.00 61.00 62.05 3h1c s PRO 235 Cb -0.13 -1.86 -0.11 0.00 0.04 0.00 0.00 34.50 32.44 3h1c s PRO 235 CO -0.02 -1.84 1.65 -1.21 0.04 0.00 0.00 177.00 175.63 3h1c s GLU 236 N -4.56 4.14 0.60 4.56 2.02 -1.26 -4.96 118.70 119.24 3h1c s GLU 236 Ca 0.65 2.56 -0.19 0.00 0.02 0.00 0.00 54.97 58.02 3h1c s GLU 236 Cb -0.21 -3.07 -0.03 0.00 0.10 0.00 0.00 34.13 30.93 3h1c s GLU 236 CO 0.52 -0.69 1.24 -1.25 0.02 0.00 0.00 175.26 175.11 3h1c s PRO 237 N 0.55 2.87 -0.07 0.39 0.04 -1.26 -4.93 135.00 132.58 3h1c s PRO 237 Ca 0.70 1.93 -0.30 0.00 0.04 0.00 0.00 61.00 63.37 3h1c s PRO 237 Cb -0.48 -1.93 -0.05 0.00 0.04 0.00 0.00 34.50 32.08 3h1c s PRO 237 CO 0.38 -1.31 1.52 0.54 0.04 0.00 0.00 177.00 178.17 3h1c s VAL 238 N -1.51 3.76 -0.88 -0.36 0.11 -1.26 -4.95 120.40 115.30 3h1c s VAL 238 Ca 0.78 0.96 -0.20 0.00 -2.93 0.00 0.00 61.98 60.59 3h1c s VAL 238 Cb -0.33 -3.62 0.10 0.00 -1.53 0.00 0.00 36.38 31.00 3h1c s VAL 238 CO 0.36 -0.07 1.15 0.21 -3.33 0.00 0.00 175.10 173.41 3h1c s ASN 239 N 2.79 6.51 0.30 3.54 2.47 -1.26 -4.88 114.94 124.40 3h1c s ASN 239 Ca 0.67 -1.71 0.03 0.00 0.42 0.00 0.00 52.86 52.28 3h1c s ASN 239 Cb -0.30 -2.43 0.48 0.00 -1.45 0.00 0.00 41.25 37.55 3h1c s ASN 239 CO 0.25 -1.23 1.79 -0.33 -3.72 0.00 0.00 177.10 173.86 3h1c h GLU 240 N 9.16 0.51 0.00 0.43 5.08 -1.99 0.25 114.58 128.03 3h1c h GLU 240 Ca 0.06 -0.15 -0.09 0.00 -1.00 0.00 0.00 59.36 58.18 3h1c h GLU 240 Cb 1.03 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 3h1c h GLU 240 CO 1.18 0.64 -0.42 0.00 -1.00 0.00 0.00 179.01 179.41 3h1c h ALA 241 N 1.39 0.94 0.11 3.43 0.00 -2.00 -3.00 119.26 120.12 3h1c h ALA 241 Ca 0.08 -0.38 -0.35 0.00 0.00 0.00 0.00 54.91 54.27 3h1c h ALA 241 Cb 0.52 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3h1c h ALA 241 CO 0.03 0.53 -1.88 1.25 0.00 0.00 0.00 179.25 179.18 3h1c h LEU 242 N 0.00 0.36 -0.59 0.00 6.46 -1.88 -3.28 115.31 116.38 3h1c h LEU 242 Ca -0.00 -0.74 -0.07 0.00 -0.12 0.00 0.00 57.88 56.94 3h1c h LEU 242 Cb 0.98 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.77 3h1c h LEU 242 CO 0.05 1.66 0.09 0.78 -0.62 0.00 0.00 178.44 180.40 3h1c h ASN 243 N 0.06 0.94 0.88 1.25 4.21 -1.01 -1.52 115.58 120.39 3h1c h ASN 243 Ca -0.37 -0.26 -0.08 0.00 1.21 0.00 0.00 56.30 56.80 3h1c h ASN 243 Cb 2.04 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 38.98 3h1c h ASN 243 CO 0.10 0.97 -0.37 0.00 -1.29 0.00 0.00 177.43 176.84 3h1c h ALA 244 N 1.01 0.98 -0.15 -0.83 0.00 -1.72 -1.85 119.26 116.70 3h1c h ALA 244 Ca 0.18 -0.34 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 3h1c h ALA 244 Cb 0.43 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.16 3h1c h ALA 244 CO 0.01 0.47 -0.60 -0.09 0.00 0.00 0.00 179.25 179.04 3h1c h ARG 245 N 0.00 0.68 -0.12 0.00 2.43 -1.55 -2.83 114.38 112.99 3h1c h ARG 245 Ca -0.00 -0.52 -0.08 0.00 -0.81 0.00 0.00 59.98 58.56 3h1c h ARG 245 Cb 0.91 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 3h1c h ARG 245 CO 0.05 1.14 -0.25 0.28 -1.51 0.00 0.00 179.97 179.68 3h1c h VAL 246 N 0.36 1.38 -0.70 0.20 2.07 -1.25 -3.28 116.25 115.03 3h1c h VAL 246 Ca -0.03 -1.53 0.04 0.00 0.82 0.00 0.00 66.70 65.99 3h1c h VAL 246 Cb 1.23 2.07 -0.04 0.00 -1.52 0.00 0.00 31.29 33.03 3h1c h VAL 246 CO 0.13 0.45 0.46 0.00 0.02 0.00 0.00 177.57 178.63 3h1c h ALA 247 N 0.53 1.61 0.00 1.67 0.00 -1.42 -0.85 119.26 120.80 3h1c h ALA 247 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3h1c h ALA 247 Cb 0.85 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 3h1c h ALA 247 CO 0.06 0.31 -0.00 0.00 0.00 0.00 0.00 179.25 179.62 3h1c h ALA 248 N 1.59 1.18 -0.00 0.00 0.00 -1.56 0.17 119.26 120.63 3h1c h ALA 248 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3h1c h ALA 248 Cb 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3h1c h ALA 248 CO -0.08 0.00 -0.17 1.28 0.00 0.00 0.00 179.25 180.28 3h1c n LEU 249 N -3.34 0.84 -0.01 0.00 4.77 -0.70 -4.84 117.00 113.72 3h1c n LEU 249 Ca -0.03 -0.71 -0.05 0.00 -0.03 0.00 0.00 56.01 55.19 3h1c n LEU 249 Cb 0.08 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 3h1c n LEU 249 CO 0.23 0.18 -0.52 0.00 -1.33 0.00 0.00 177.39 175.95 3h1c n ALA 250 N -0.50 2.63 0.28 -1.18 0.00 -0.41 -4.68 120.51 116.66 3h1c n ALA 250 Ca 0.02 -0.20 0.13 0.00 0.00 0.00 0.00 53.44 53.39 3h1c n ALA 250 Cb 0.13 0.36 0.81 0.00 0.00 0.00 0.00 19.45 20.76 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 -0.19 0.00 -0.18 0.00 4.81 -1.21 0.46 114.58 118.26 3h1c h GLU 251 Ca -0.10 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.95 3h1c h GLU 251 Cb 0.84 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.22 3h1c h GLU 251 CO -0.06 0.02 -0.62 0.00 -0.73 0.00 0.00 179.01 177.63 3h1c h ALA 252 N 1.98 0.32 -0.07 2.92 0.00 -1.87 -2.63 119.26 119.91 3h1c h ALA 252 Ca -0.00 -0.54 -0.21 0.00 0.00 0.00 0.00 54.91 54.16 3h1c h ALA 252 Cb 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3h1c h ALA 252 CO 0.00 0.59 -0.81 0.00 0.00 0.00 0.00 179.25 179.02 3h1c h ARG 253 N 0.46 0.49 0.00 0.00 3.08 -1.56 -3.28 114.38 113.57 3h1c h ARG 253 Ca -0.02 -0.44 -0.03 0.00 0.07 0.00 0.00 59.98 59.55 3h1c h ARG 253 Cb 1.24 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.39 3h1c h ARG 253 CO 0.13 1.08 -0.16 -0.07 -1.07 0.00 0.00 179.97 179.88 3h1c h LEU 254 N 0.32 0.00 -0.50 3.04 3.38 -1.00 -2.22 115.31 118.32 3h1c h LEU 254 Ca -0.05 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.76 3h1c h LEU 254 Cb 1.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 3h1c h LEU 254 CO 0.15 0.16 -0.44 -1.28 0.09 0.00 0.00 178.44 177.11 3h1c h SER 255 N 0.00 0.79 1.18 -0.43 0.87 -1.52 -3.07 113.55 111.36 3h1c h SER 255 Ca -0.00 -0.38 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 3h1c h SER 255 Cb 0.80 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 3h1c h SER 255 CO 0.02 1.12 -0.59 0.44 -0.53 0.00 0.00 176.83 177.28 3h1c h ASP 256 N 0.59 0.00 -0.20 6.23 5.19 -1.65 -3.36 116.42 123.22 3h1c h ASP 256 Ca 0.04 -0.07 -0.16 0.00 -0.62 0.00 0.00 57.03 56.21 3h1c h ASP 256 Cb 1.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.50 3h1c h ASP 256 CO 0.09 0.04 -0.47 0.00 -3.12 0.00 0.00 179.24 175.78 3h1c h ALA 257 N 2.22 0.62 -0.55 3.45 0.00 -1.32 -3.19 119.26 120.50 3h1c h ALA 257 Ca 0.00 -0.48 -0.30 0.00 0.00 0.00 0.00 54.91 54.13 3h1c h ALA 257 Cb 0.89 -0.10 -0.17 0.00 0.00 0.00 0.00 17.79 18.41 3h1c h ALA 257 CO 0.00 0.68 0.38 0.66 0.00 0.00 0.00 179.25 180.96 3h1c n TYR 258 N -4.01 1.69 0.25 0.00 4.01 -1.17 -3.52 117.16 114.40 3h1c n TYR 258 Ca -0.03 -1.36 0.03 0.00 -0.16 0.00 0.00 57.90 56.38 3h1c n TYR 258 Cb 0.58 -0.69 -0.02 0.00 -0.31 0.00 0.00 39.34 38.90 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 -0.32 4.12 -2.44 -0.72 1.74 -1.20 -4.41 116.66 113.43 3h1c n ARG 259 Ca 0.33 -0.18 -0.41 0.00 -0.77 0.00 0.00 57.85 56.82 3h1c n ARG 259 Cb 1.06 -0.83 -0.03 0.00 -1.02 0.00 0.00 32.46 31.64 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 -1.29 3.85 -0.02 0.55 1.01 -1.23 -4.81 121.20 119.26 3h1c s ILE 260 Ca 0.03 1.48 -0.25 0.00 0.00 0.00 0.00 60.65 61.91 3h1c s ILE 260 Cb 0.04 -3.95 -0.20 0.00 0.01 0.00 0.00 42.46 38.37 3h1c s ILE 260 CO 0.19 0.20 1.25 0.71 0.00 0.00 0.00 174.94 177.28 3h1c h THR 261 N 4.03 1.41 -3.87 2.92 1.35 -1.86 -3.42 112.91 113.46 3h1c h THR 261 Ca -0.43 -1.24 -0.49 0.00 -0.55 0.00 0.00 66.41 63.70 3h1c h THR 261 Cb 1.21 2.20 0.00 0.00 -1.73 0.00 0.00 68.15 69.84 3h1c h THR 261 CO 0.76 0.33 0.41 -0.62 -0.25 0.00 0.00 175.52 176.15 3h1c s ASP 262 N -5.79 7.15 0.06 5.36 2.15 -1.26 -4.71 116.67 119.63 3h1c s ASP 262 Ca -0.16 2.05 -0.19 0.00 0.43 0.00 0.00 52.55 54.68 3h1c s ASP 262 Cb 0.02 -2.60 -0.11 0.00 -0.30 0.00 0.00 42.92 39.93 3h1c s ASP 262 CO 0.69 -0.21 1.43 0.50 -0.17 0.00 0.00 175.17 177.41 3h1c h LYS 263 N 3.25 0.41 -0.73 4.34 3.64 -1.99 -2.77 116.57 122.72 3h1c h LYS 263 Ca -0.47 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 58.73 3h1c h LYS 263 Cb 1.21 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.98 3h1c h LYS 263 CO 0.65 0.69 0.44 1.96 -2.27 0.00 0.00 179.45 180.92 3h1c h GLN 264 N 0.12 0.98 0.00 1.90 4.20 -1.98 0.20 115.11 120.53 3h1c h GLN 264 Ca 0.05 -0.08 -0.14 0.00 0.06 0.00 0.00 58.65 58.53 3h1c h GLN 264 Cb 0.56 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 3h1c h GLN 264 CO 0.03 0.68 -0.69 0.93 -0.67 0.00 0.00 178.83 179.11 3h1c h GLU 265 N 1.00 0.00 0.04 1.46 5.08 -1.98 -2.96 114.58 117.22 3h1c h GLU 265 Ca 0.26 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.52 3h1c h GLU 265 Cb -0.05 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.21 3h1c h GLU 265 CO -0.05 0.69 -0.42 -0.09 -1.00 0.00 0.00 179.01 178.13 3h1c h ARG 266 N 0.00 0.22 0.00 2.33 2.43 -1.07 -2.99 114.38 115.30 3h1c h ARG 266 Ca -0.01 -0.29 -0.06 0.00 -0.81 0.00 0.00 59.98 58.82 3h1c h ARG 266 Cb 1.46 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 31.10 3h1c h ARG 266 CO 0.09 1.06 -0.29 1.88 -1.51 0.00 0.00 179.97 181.20 3h1c h TYR 267 N -0.48 0.00 -0.00 2.20 0.05 -0.75 -0.45 116.97 117.54 3h1c h TYR 267 Ca -0.06 0.00 -0.25 0.00 0.05 0.00 0.00 58.73 58.46 3h1c h TYR 267 Cb 1.23 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.99 3h1c h TYR 267 CO 0.20 0.29 -1.01 0.00 -1.05 0.00 0.00 178.16 176.59 3h1c h ALA 268 N 1.71 0.22 -0.15 3.88 0.00 -1.63 -3.00 119.26 120.29 3h1c h ALA 268 Ca -0.00 -0.70 -0.21 0.00 0.00 0.00 0.00 54.91 53.99 3h1c h ALA 268 Cb 0.71 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.54 3h1c h ALA 268 CO 0.04 0.73 -0.74 0.37 0.00 0.00 0.00 179.25 179.65 3h1c h GLN 269 N 0.34 0.77 0.00 0.00 5.75 -1.34 -3.05 115.11 117.57 3h1c h GLN 269 Ca -0.11 -0.62 -0.03 0.00 -0.15 0.00 0.00 58.65 57.74 3h1c h GLN 269 Cb 1.65 0.13 -0.00 0.00 1.07 0.00 0.00 27.48 30.33 3h1c h GLN 269 CO 0.19 1.23 -0.14 -0.24 -2.65 0.00 0.00 178.83 177.23 3h1c h VAL 270 N 0.49 0.39 0.02 2.39 3.04 -1.19 -2.55 116.25 118.84 3h1c h VAL 270 Ca -0.05 -0.79 -0.21 0.00 -1.01 0.00 0.00 66.70 64.64 3h1c h VAL 270 Cb 1.37 1.58 -0.01 0.00 -2.01 0.00 0.00 31.29 32.22 3h1c h VAL 270 CO 0.15 0.13 -0.94 -0.78 -1.01 0.00 0.00 177.57 175.13 3h1c h ASP 271 N 0.00 0.29 -0.35 3.17 3.58 -1.52 -2.58 116.42 119.01 3h1c h ASP 271 Ca -0.00 -0.25 -0.06 0.00 0.42 0.00 0.00 57.03 57.14 3h1c h ASP 271 Cb 0.56 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 3h1c h ASP 271 CO 0.02 1.08 -0.01 0.58 -2.88 0.00 0.00 179.24 178.02 3h1c h VAL 272 N 0.11 1.26 -0.78 2.25 2.07 -1.35 -1.39 116.25 118.42 3h1c h VAL 272 Ca -0.06 -1.00 -0.05 0.00 0.82 0.00 0.00 66.70 66.41 3h1c h VAL 272 Cb 1.59 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 32.55 3h1c h VAL 272 CO 0.15 0.33 0.28 0.40 0.02 0.00 0.00 177.57 178.75 3h1c h ILE 273 N 0.43 1.26 -0.04 4.57 2.04 -1.55 0.14 117.51 124.37 3h1c h ILE 273 Ca 0.10 -0.87 -0.08 0.00 1.00 0.00 0.00 64.86 65.01 3h1c h ILE 273 Cb 0.48 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 3h1c h ILE 273 CO 0.02 0.35 -0.36 0.11 0.00 0.00 0.00 178.15 178.27 3h1c h LYS 274 N 1.14 0.07 0.00 2.37 1.57 -1.36 -2.82 116.57 117.55 3h1c h LYS 274 Ca 0.26 -0.03 -0.30 0.00 -1.87 0.00 0.00 60.65 58.71 3h1c h LYS 274 Cb 0.26 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.51 3h1c h LYS 274 CO -0.02 0.42 -1.78 -1.13 -0.57 0.00 0.00 179.45 176.38 3h1c n SER 275 N -4.10 0.79 0.09 0.86 3.41 -0.53 -3.56 113.62 110.57 3h1c n SER 275 Ca -0.02 0.37 -0.15 0.00 -0.26 0.00 0.00 58.87 58.82 3h1c n SER 275 Cb 0.41 0.04 -0.14 0.00 -0.26 0.00 0.00 64.21 64.26 3h1c n SER 275 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3h1c h GLU 276 N 0.00 0.24 -0.17 4.33 5.08 -1.03 -3.04 114.58 119.99 3h1c h GLU 276 Ca -0.31 -0.40 -0.19 0.00 -1.00 0.00 0.00 59.36 57.45 3h1c h GLU 276 Cb 2.04 0.15 0.00 0.00 0.50 0.00 0.00 28.75 31.44 3h1c h GLU 276 CO 0.07 1.17 -0.68 1.15 -1.00 0.00 0.00 179.01 179.73 3h1c h THR 277 N 0.06 1.31 0.00 1.13 2.02 -1.68 -2.55 112.91 113.20 3h1c h THR 277 Ca -0.14 -1.93 -0.08 0.00 0.77 0.00 0.00 66.41 65.03 3h1c h THR 277 Cb 1.96 1.90 -0.01 0.00 -1.74 0.00 0.00 68.15 70.26 3h1c h THR 277 CO 0.19 0.60 -0.38 -0.29 0.37 0.00 0.00 175.52 176.01 3h1c h ILE 278 N 0.48 0.90 0.04 3.11 2.10 -1.67 -2.77 117.51 119.70 3h1c h ILE 278 Ca -0.02 -1.55 -0.26 0.00 1.08 0.00 0.00 64.86 64.11 3h1c h ILE 278 Cb 1.27 1.94 -0.03 0.00 -1.09 0.00 0.00 36.82 38.92 3h1c h ILE 278 CO 0.13 0.37 -1.33 0.00 -1.08 0.00 0.00 178.15 176.25 3h1c h ALA 279 N 1.62 0.41 -0.23 0.18 0.00 -1.52 -3.15 119.26 116.57 3h1c h ALA 279 Ca -0.00 -1.10 -0.18 0.00 0.00 0.00 0.00 54.91 53.63 3h1c h ALA 279 Cb 0.91 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 3h1c h ALA 279 CO 0.05 1.28 -0.59 1.15 0.00 0.00 0.00 179.25 181.13 3h1c h THR 280 N 0.02 1.29 -0.08 0.00 2.02 -1.43 -2.36 112.91 112.38 3h1c h THR 280 Ca -0.15 -1.81 -0.11 0.00 0.77 0.00 0.00 66.41 65.11 3h1c h THR 280 Cb 1.91 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 70.06 3h1c h THR 280 CO 0.13 0.58 -0.45 -0.07 0.37 0.00 0.00 175.52 176.08 3h1c h LEU 281 N 0.56 0.21 -0.60 2.58 3.38 -1.61 -1.98 115.31 117.84 3h1c h LEU 281 Ca -0.00 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.73 3h1c h LEU 281 Cb 1.19 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 3h1c h LEU 281 CO 0.12 0.64 -0.68 -0.07 0.09 0.00 0.00 178.44 178.54 3h1c h LEU 282 N 0.16 0.14 -1.04 1.67 3.38 -1.54 -2.15 115.31 115.93 3h1c h LEU 282 Ca 0.01 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 3h1c h LEU 282 Cb 0.87 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 3h1c h LEU 282 CO 0.07 0.77 -0.43 0.00 0.09 0.00 0.00 178.44 178.94 3h1c h ALA 283 N 1.22 1.12 0.03 1.53 0.00 -1.11 -3.19 119.26 118.86 3h1c h ALA 283 Ca -0.01 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 3h1c h ALA 283 Cb 1.20 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3h1c h ALA 283 CO 0.10 0.54 -0.01 1.49 0.00 0.00 0.00 179.25 181.37 3h1c h GLU 284 N 0.00 -0.03 -2.53 0.00 4.57 -1.26 -3.47 114.58 111.86 3h1c h GLU 284 Ca -0.00 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.09 3h1c h GLU 284 Cb 0.85 0.01 -0.24 0.00 -0.16 0.00 0.00 28.75 29.21 3h1c h GLU 284 CO 0.06 0.65 -0.18 0.16 -1.18 0.00 0.00 179.01 178.52 3h1c s ASP 285 N -5.88 -0.56 0.00 1.04 -4.77 -0.82 -5.05 116.67 100.63 3h1c s ASP 285 Ca -0.16 1.01 0.23 0.00 -3.30 0.00 0.00 52.55 50.32 3h1c s ASP 285 Cb -0.01 0.96 0.72 0.00 -1.09 0.00 0.00 42.92 43.50 3h1c s ASP 285 CO 0.63 -0.19 1.54 -0.62 0.70 0.00 0.00 175.17 177.24 3h1c n GLU 286 N 3.51 1.87 0.00 2.11 1.02 -1.23 -4.08 120.64 123.83 3h1c n GLU 286 Ca -0.18 -1.30 0.14 0.00 -0.02 0.00 0.00 57.16 55.81 3h1c n GLU 286 Cb 0.56 -1.43 0.68 0.00 -0.02 0.00 0.00 31.44 31.23 3h1c n GLU 286 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 3h1c n THR 287 N 0.53 0.04 -2.59 2.62 5.66 -1.26 -4.87 114.28 114.41 3h1c n THR 287 Ca 0.17 0.01 -0.31 0.00 -3.05 0.00 0.00 64.05 60.87 3h1c n THR 287 Cb 0.39 -0.52 -0.03 0.00 -1.55 0.00 0.00 70.33 68.62 3h1c n THR 287 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 3h1c s LEU 288 N -2.78 3.70 0.30 1.09 1.43 -1.26 -5.06 118.68 116.10 3h1c s LEU 288 Ca 0.21 1.35 -0.22 0.00 -1.03 0.00 0.00 54.13 54.44 3h1c s LEU 288 Cb 0.19 -4.27 -0.09 0.00 0.03 0.00 0.00 46.19 42.05 3h1c s LEU 288 CO 0.48 -0.51 0.85 -0.62 0.23 0.00 0.00 176.35 176.78 3h1c s ASP 289 N -3.17 7.13 -0.07 2.29 2.15 -1.26 -5.01 116.67 118.72 3h1c s ASP 289 Ca 0.55 1.62 -0.27 0.00 0.43 0.00 0.00 52.55 54.87 3h1c s ASP 289 Cb -0.10 -2.50 -0.23 0.00 -0.30 0.00 0.00 42.92 39.79 3h1c s ASP 289 CO 0.32 -0.08 1.06 -0.08 -0.17 0.00 0.00 175.17 176.22 3h1c h GLU 290 N 3.01 -0.00 0.00 4.34 4.57 -1.98 -3.31 114.58 121.21 3h1c h GLU 290 Ca -0.48 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 57.68 3h1c h GLU 290 Cb 1.19 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.78 3h1c h GLU 290 CO 0.65 0.71 -0.12 -0.91 -1.18 0.00 0.00 179.01 178.15 3h1c h ASN 291 N -0.71 0.00 -0.19 1.04 2.35 -2.00 -3.24 115.58 112.84 3h1c h ASN 291 Ca -0.00 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.59 3h1c h ASN 291 Cb 0.71 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.07 3h1c h ASN 291 CO 0.00 0.12 -0.46 -0.08 -1.65 0.00 0.00 177.43 175.36 3h1c h GLU 292 N 0.00 0.75 0.00 0.81 4.81 -1.99 -3.02 114.58 115.94 3h1c h GLU 292 Ca -0.00 -0.42 -0.09 0.00 -0.13 0.00 0.00 59.36 58.72 3h1c h GLU 292 Cb 0.91 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 3h1c h GLU 292 CO 0.02 1.05 -0.42 -0.07 -0.73 0.00 0.00 179.01 178.86 3h1c h LEU 293 N 0.60 0.00 -0.88 1.64 3.38 -1.64 -2.68 115.31 115.73 3h1c h LEU 293 Ca 0.03 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 3h1c h LEU 293 Cb 1.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 3h1c h LEU 293 CO 0.10 0.42 -0.51 1.23 0.09 0.00 0.00 178.44 179.76 3h1c h GLY 294 N 1.35 0.00 1.65 0.83 0.00 -1.62 -2.59 103.07 102.69 3h1c h GLY 294 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.17 3h1c h GLY 294 CO 0.05 0.00 -0.60 0.83 0.00 0.00 0.00 176.54 176.83 3h1c h GLU 295 N 0.00 0.36 -0.20 4.80 5.08 -1.35 -2.41 114.58 120.86 3h1c h GLU 295 Ca -0.01 -0.24 -0.18 0.00 -1.00 0.00 0.00 59.36 57.93 3h1c h GLU 295 Cb 0.98 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.27 3h1c h GLU 295 CO 0.07 0.85 -0.58 0.82 -1.00 0.00 0.00 179.01 179.16 3h1c h ILE 296 N 0.27 1.30 -0.59 3.13 2.04 -1.45 -2.03 117.51 120.17 3h1c h ILE 296 Ca -0.00 -1.80 -0.04 0.00 1.00 0.00 0.00 64.86 64.02 3h1c h ILE 296 Cb 1.12 1.86 -0.03 0.00 -0.74 0.00 0.00 36.82 39.03 3h1c h ILE 296 CO 0.10 0.57 0.21 -0.07 0.00 0.00 0.00 178.15 178.96 3h1c h LEU 297 N 0.49 0.80 -0.69 1.44 3.38 -1.46 -1.64 115.31 117.63 3h1c h LEU 297 Ca -0.02 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.70 3h1c h LEU 297 Cb 1.20 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 3h1c h LEU 297 CO 0.13 0.74 -0.53 -0.74 0.09 0.00 0.00 178.44 178.12 3h1c h HIS 298 N 0.86 0.41 -0.30 1.13 2.76 -1.43 -1.99 115.15 116.60 3h1c h HIS 298 Ca 0.20 -0.14 -0.10 0.00 -2.20 0.00 0.00 60.37 58.13 3h1c h HIS 298 Cb 0.20 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 3h1c h HIS 298 CO 0.01 0.79 -0.22 0.00 -1.30 0.00 0.00 177.93 177.22 3h1c h ALA 299 N 1.18 1.06 -0.10 5.26 0.00 -0.79 -1.75 119.26 124.11 3h1c h ALA 299 Ca 0.01 -0.34 -0.23 0.00 0.00 0.00 0.00 54.91 54.34 3h1c h ALA 299 Cb 1.02 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.69 3h1c h ALA 299 CO 0.09 0.57 -0.84 0.82 0.00 0.00 0.00 179.25 179.89 3h1c h ILE 300 N 0.51 1.29 -0.85 0.00 2.04 -1.28 -2.24 117.51 116.97 3h1c h ILE 300 Ca 0.08 -2.05 0.09 0.00 1.00 0.00 0.00 64.86 63.97 3h1c h ILE 300 Cb 0.66 2.13 -0.06 0.00 -0.74 0.00 0.00 36.82 38.82 3h1c h ILE 300 CO 0.05 0.64 0.55 -0.33 0.00 0.00 0.00 178.15 179.06 3h1c h GLU 301 N 0.45 0.84 -0.20 2.37 5.08 -1.18 0.19 114.58 122.14 3h1c h GLU 301 Ca -0.08 -0.05 -0.21 0.00 -1.00 0.00 0.00 59.36 58.02 3h1c h GLU 301 Cb 1.48 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 30.55 3h1c h GLU 301 CO 0.17 0.56 -0.70 -0.22 -1.00 0.00 0.00 179.01 177.82 3h1c h LYS 302 N 0.87 0.82 -0.03 2.33 3.64 -1.34 -3.20 116.57 119.65 3h1c h LYS 302 Ca 0.39 -0.61 -0.11 0.00 -1.27 0.00 0.00 60.65 59.05 3h1c h LYS 302 Cb 0.36 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 3h1c h LYS 302 CO -0.15 1.23 -0.47 -0.97 -2.27 0.00 0.00 179.45 176.81 3h1c h ASN 303 N 0.58 0.08 -0.01 4.20 -1.24 -0.60 -2.95 115.58 115.63 3h1c h ASN 303 Ca -0.03 -0.03 -0.04 0.00 0.71 0.00 0.00 56.30 56.91 3h1c h ASN 303 Cb 1.32 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 40.35 3h1c h ASN 303 CO 0.15 0.54 -0.14 0.58 -1.29 0.00 0.00 177.43 177.26 3h1c h VAL 304 N 0.06 1.53 -0.05 2.57 2.07 -0.77 -3.21 116.25 118.46 3h1c h VAL 304 Ca 0.00 -1.76 -0.01 0.00 0.82 0.00 0.00 66.70 65.75 3h1c h VAL 304 Cb 0.86 2.65 -0.00 0.00 -1.52 0.00 0.00 31.29 33.27 3h1c h VAL 304 CO 0.06 0.48 -0.01 0.58 0.02 0.00 0.00 177.57 178.70 3h1c h VAL 305 N -0.53 1.28 0.00 2.57 2.07 -1.60 -3.08 116.25 116.96 3h1c h VAL 305 Ca -0.01 -0.86 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 3h1c h VAL 305 Cb 0.85 1.76 -0.00 0.00 -1.52 0.00 0.00 31.29 32.38 3h1c h VAL 305 CO 0.03 0.23 -0.15 0.08 0.02 0.00 0.00 177.57 177.78 3h1c h ARG 306 N -0.24 0.00 0.01 1.57 0.11 -1.69 -2.84 114.38 111.31 3h1c h ARG 306 Ca 0.01 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.90 3h1c h ARG 306 Cb 0.38 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.44 3h1c h ARG 306 CO 0.00 0.15 -0.88 0.77 0.10 0.00 0.00 179.97 180.11 3h1c h SER 307 N 0.00 0.19 0.15 0.08 0.02 -1.59 -2.42 113.55 109.99 3h1c h SER 307 Ca -0.00 -0.16 -0.10 0.00 -0.84 0.00 0.00 61.79 60.69 3h1c h SER 307 Cb 0.76 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 3h1c h SER 307 CO 0.02 0.98 -0.35 0.03 -1.14 0.00 0.00 176.83 176.36 3h1c h ARG 308 N 0.07 0.29 -0.13 3.45 2.47 -1.41 -2.07 114.38 117.05 3h1c h ARG 308 Ca -0.04 -0.12 -0.09 0.00 -1.26 0.00 0.00 59.98 58.46 3h1c h ARG 308 Cb 1.53 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.84 3h1c h ARG 308 CO 0.13 0.61 -0.29 0.28 0.56 0.00 0.00 179.97 181.26 3h1c h VAL 309 N 0.25 1.37 -0.10 2.04 2.07 -1.49 -2.97 116.25 117.43 3h1c h VAL 309 Ca 0.03 -1.57 -0.10 0.00 0.82 0.00 0.00 66.70 65.88 3h1c h VAL 309 Cb 0.75 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 3h1c h VAL 309 CO 0.06 0.46 -0.37 0.25 0.02 0.00 0.00 177.57 177.99 3h1c h LEU 310 N 0.02 0.21 -0.70 2.57 6.46 -1.38 -3.07 115.31 119.41 3h1c h LEU 310 Ca 0.00 -0.08 -0.13 0.00 -0.12 0.00 0.00 57.88 57.55 3h1c h LEU 310 Cb 0.89 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.75 3h1c h LEU 310 CO 0.06 0.57 -0.44 0.00 -0.62 0.00 0.00 178.44 178.02 3h1c h ALA 311 N 1.45 0.87 0.00 1.25 0.00 -1.44 -3.48 119.26 117.91 3h1c h ALA 311 Ca 0.02 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3h1c h ALA 311 Cb 0.74 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3h1c h ALA 311 CO 0.06 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.36 3h1c n GLY 312 N 0.01 0.91 3.80 0.00 0.00 -1.16 -5.11 105.19 103.63 3h1c n GLY 312 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.33 3.22 0.99 1.61 2.02 -1.13 -5.01 118.70 120.07 3h1c s GLU 313 Ca 0.00 1.25 -0.15 0.00 0.02 0.00 0.00 54.97 56.09 3h1c s GLU 313 Cb 0.00 -2.02 0.03 0.00 0.10 0.00 0.00 34.13 32.24 3h1c s GLU 313 CO 0.00 -0.90 0.17 -0.35 0.02 0.00 0.00 175.26 174.21 3h1c n PRO 314 N -2.09 -0.54 0.00 0.39 -0.04 -1.26 -4.56 135.00 126.90 3h1c n PRO 314 Ca 0.09 -0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 3h1c n PRO 314 Cb 0.53 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 3h1c n PRO 314 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3h1c n ARG 315 N -1.33 1.95 0.02 0.54 1.74 0.16 -4.83 116.66 114.90 3h1c n ARG 315 Ca 0.04 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.01 3h1c n ARG 315 Cb 0.56 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.92 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 0.00 1.02 0.00 0.55 5.03 -1.84 -3.34 117.51 118.93 3h1c h ILE 316 Ca 0.00 -1.31 0.00 0.00 -0.12 0.00 0.00 64.86 63.43 3h1c h ILE 316 Cb 0.00 1.74 0.00 0.00 -3.03 0.00 0.00 36.82 35.53 3h1c h ILE 316 CO 0.00 0.28 0.00 -0.90 -0.68 0.00 0.00 178.15 176.85 3h1c n ASP 317 N -4.86 0.49 0.00 1.72 5.75 -1.26 -4.26 116.55 114.13 3h1c n ASP 317 Ca -0.08 0.55 0.00 0.00 -0.01 0.00 0.00 54.79 55.25 3h1c n ASP 317 Cb 0.28 -0.68 0.00 0.00 -1.03 0.00 0.00 41.12 39.69 3h1c n ASP 317 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h1c n GLY 318 N 1.30 1.74 3.07 6.12 0.00 -1.25 -4.78 105.19 111.39 3h1c n GLY 318 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 3h1c n GLY 318 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h1c n ARG 319 N 0.00 -1.59 0.00 1.61 1.74 -1.26 -4.65 116.66 112.51 3h1c n ARG 319 Ca 0.00 -1.61 0.00 0.00 -0.77 0.00 0.00 57.85 55.47 3h1c n ARG 319 Cb 0.00 -1.19 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 3h1c n ARG 319 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3h1c n GLU 320 N -3.60 0.00 0.00 5.56 4.71 -1.26 0.35 120.64 126.40 3h1c n GLU 320 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.28 3h1c n GLU 320 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.91 3h1c n GLU 320 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 3h1c n LYS 321 N -2.10 0.00 0.02 3.49 4.81 -1.26 -4.61 118.16 118.51 3h1c n LYS 321 Ca 0.00 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.57 3h1c n LYS 321 Cb 0.00 0.00 0.41 0.00 0.02 0.00 0.00 35.03 35.46 3h1c n LYS 321 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 3h1c n ASP 322 N -0.78 0.36 -4.70 3.14 5.75 -1.26 -1.86 116.55 117.20 3h1c n ASP 322 Ca 0.00 0.19 -0.42 0.00 -0.01 0.00 0.00 54.79 54.55 3h1c n ASP 322 Cb 0.00 -0.18 -0.03 0.00 -1.03 0.00 0.00 41.12 39.88 3h1c n ASP 322 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 3h1c s MET 323 N -3.03 4.21 0.30 0.11 1.75 -1.26 -4.80 119.30 116.58 3h1c s MET 323 Ca 0.12 2.34 0.08 0.00 -1.25 0.00 0.00 55.69 56.97 3h1c s MET 323 Cb 0.17 -3.37 -0.03 0.00 2.84 0.00 0.00 34.83 34.44 3h1c s MET 323 CO 0.62 -0.66 0.20 0.96 -0.65 0.00 0.00 175.02 175.49 3h1c s ILE 324 N 1.84 3.70 0.85 10.11 -4.36 -1.26 -4.72 121.20 127.37 3h1c s ILE 324 Ca 0.72 -1.51 -0.12 0.00 -0.26 0.00 0.00 60.65 59.48 3h1c s ILE 324 Cb -0.42 -3.17 0.10 0.00 1.25 0.00 0.00 42.46 40.23 3h1c s ILE 324 CO 0.32 -0.25 1.10 -0.13 0.24 0.00 0.00 174.94 176.21 3h1c s ARG 325 N -3.88 1.63 0.72 0.37 0.52 -1.26 -5.02 118.95 112.03 3h1c s ARG 325 Ca 0.37 0.71 -0.14 0.00 -0.52 0.00 0.00 55.73 56.14 3h1c s ARG 325 Cb -0.06 -1.86 0.03 0.00 0.52 0.00 0.00 34.95 33.59 3h1c s ARG 325 CO 0.24 -1.95 1.15 0.20 0.02 0.00 0.00 175.30 174.96 3h1c s GLY 326 N -3.68 2.14 0.05 -3.53 0.00 -1.26 -4.68 107.32 96.36 3h1c s GLY 326 Ca 0.62 0.65 0.09 0.00 0.00 0.00 0.00 44.72 46.08 3h1c s GLY 326 CO 0.55 1.03 -0.26 1.08 0.00 0.00 0.00 173.10 175.51 3h1c s LEU 327 N -5.25 2.18 -0.21 0.66 1.43 -1.26 -0.41 118.68 115.81 3h1c s LEU 327 Ca 0.69 -0.59 -0.03 0.00 -1.03 0.00 0.00 54.13 53.17 3h1c s LEU 327 Cb -0.24 -1.23 0.07 0.00 0.03 0.00 0.00 46.19 44.82 3h1c s LEU 327 CO 0.46 0.24 0.07 -0.62 0.23 0.00 0.00 176.35 176.73 3h1c s ASP 328 N -1.29 2.97 -0.24 2.29 2.15 0.88 -5.01 116.67 118.42 3h1c s ASP 328 Ca 0.11 -0.92 -0.08 0.00 0.43 0.00 0.00 52.55 52.09 3h1c s ASP 328 Cb -0.10 -0.50 -0.03 0.00 -0.30 0.00 0.00 42.92 41.99 3h1c s ASP 328 CO 0.02 -0.35 0.09 -0.69 -0.17 0.00 0.00 175.17 174.07 3h1c s VAL 329 N 1.94 4.57 -0.07 1.11 1.01 -1.26 -1.44 120.40 126.26 3h1c s VAL 329 Ca 0.02 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.93 3h1c s VAL 329 Cb -0.17 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 33.10 3h1c s VAL 329 CO -0.14 0.35 -0.09 -0.13 0.00 0.00 0.00 175.10 175.09 3h1c s ARG 330 N 1.38 1.41 -0.04 2.72 0.52 -0.69 -5.01 118.95 119.24 3h1c s ARG 330 Ca 0.06 -0.28 0.07 0.00 -0.52 0.00 0.00 55.73 55.05 3h1c s ARG 330 Cb -0.15 -1.31 -0.01 0.00 0.52 0.00 0.00 34.95 34.00 3h1c s ARG 330 CO 0.04 -0.09 -0.24 0.99 0.02 0.00 0.00 175.30 176.02 3h1c s THR 331 N 1.05 1.96 0.00 0.02 2.01 -1.26 -0.82 115.64 118.60 3h1c s THR 331 Ca -0.08 -1.03 0.00 0.00 0.31 0.00 0.00 61.69 60.89 3h1c s THR 331 Cb -0.14 -1.64 0.00 0.00 0.01 0.00 0.00 72.50 70.72 3h1c s THR 331 CO -0.01 0.55 0.00 0.61 -0.69 0.00 0.00 174.62 175.08 3h1c n GLY 332 N 2.77 0.67 0.12 4.40 0.00 -1.14 -5.00 105.19 107.03 3h1c n GLY 332 Ca -0.17 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.09 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 0.00 1.17 -2.78 1.61 3.04 -1.85 -3.46 116.25 113.98 3h1c h VAL 333 Ca 0.00 -2.76 -0.01 0.00 -1.01 0.00 0.00 66.70 62.92 3h1c h VAL 333 Cb 1.00 2.82 0.00 0.00 -2.01 0.00 0.00 31.29 33.10 3h1c h VAL 333 CO 0.00 0.83 0.00 0.18 -1.01 0.00 0.00 177.57 177.58 3h1c n LEU 334 N -3.52 0.00 0.00 3.16 4.77 -1.26 -5.09 117.00 115.05 3h1c n LEU 334 Ca -0.17 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 3h1c n LEU 334 Cb 1.06 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.13 3h1c n LEU 334 CO 0.52 -0.51 0.00 -0.81 -1.33 0.00 0.00 177.39 175.26 3h1c n PRO 335 N -1.04 0.00 -1.72 3.23 -0.04 -1.26 -4.93 135.00 129.24 3h1c n PRO 335 Ca 0.00 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.14 3h1c n PRO 335 Cb 0.01 -0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 3h1c n PRO 335 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 3h1c n ARG 336 N -2.42 3.36 -3.93 0.54 3.00 -1.26 -4.84 116.66 111.11 3h1c n ARG 336 Ca 0.00 -2.85 -0.09 0.00 -0.00 0.00 0.00 57.85 54.91 3h1c n ARG 336 Cb 0.00 -2.35 -0.07 0.00 0.00 0.00 0.00 32.46 30.04 3h1c n ARG 336 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 3h1c s THR 337 N -1.85 0.10 0.01 5.15 -1.32 -1.26 -5.09 115.64 111.38 3h1c s THR 337 Ca 0.57 -1.34 -0.26 0.00 -1.21 0.00 0.00 61.69 59.45 3h1c s THR 337 Cb 0.30 -1.65 -0.16 0.00 -1.51 0.00 0.00 72.50 69.48 3h1c s THR 337 CO -0.17 -0.46 1.18 0.45 -2.21 0.00 0.00 174.62 173.42 3h1c h HIS 338 N 2.65 -0.62 -4.58 9.09 3.86 -1.89 -3.45 115.15 120.22 3h1c h HIS 338 Ca -0.33 -0.01 -0.70 0.00 -1.16 0.00 0.00 60.37 58.17 3h1c h HIS 338 Cb 1.21 0.21 -0.30 0.00 1.06 0.00 0.00 27.41 29.59 3h1c h HIS 338 CO 0.41 -0.30 -0.89 0.20 0.86 0.00 0.00 177.93 178.22 3h1c s GLY 339 N -2.58 1.29 -0.02 2.45 0.00 0.23 -3.68 107.32 105.00 3h1c s GLY 339 Ca -0.14 -1.13 0.01 0.00 0.00 0.00 0.00 44.72 43.46 3h1c s GLY 339 CO 0.49 -0.95 -0.03 -0.56 0.00 0.00 0.00 173.10 172.05 3h1c s SER 340 N -0.67 0.59 -0.14 1.64 0.01 -1.26 -2.45 113.70 111.43 3h1c s SER 340 Ca 0.10 -0.07 -0.13 0.00 1.31 0.00 0.00 55.95 57.15 3h1c s SER 340 Cb -0.10 -0.23 0.04 0.00 0.21 0.00 0.00 66.02 65.94 3h1c s SER 340 CO -0.01 -0.03 0.38 0.00 0.41 0.00 0.00 173.24 173.99 3h1c s ALA 341 N 0.58 -0.94 -0.32 1.44 0.00 -0.44 -2.88 121.76 119.21 3h1c s ALA 341 Ca -0.06 1.05 -0.02 0.00 0.00 0.00 0.00 51.96 52.92 3h1c s ALA 341 Cb -0.10 -0.59 0.11 0.00 0.00 0.00 0.00 23.12 22.54 3h1c s ALA 341 CO -0.01 -0.19 0.14 -1.17 0.00 0.00 0.00 175.76 174.53 3h1c s LEU 342 N 0.12 1.37 -0.15 0.00 2.96 0.00 -1.57 118.68 121.41 3h1c s LEU 342 Ca -0.01 -1.63 -0.07 0.00 -0.22 0.00 0.00 54.13 52.21 3h1c s LEU 342 Cb -0.03 -0.59 -0.04 0.00 0.50 0.00 0.00 46.19 46.03 3h1c s LEU 342 CO 0.01 -0.40 0.09 0.12 -1.32 0.00 0.00 176.35 174.84 3h1c s PHE 343 N 1.67 3.37 -0.10 5.38 5.36 -1.02 -1.70 117.98 130.94 3h1c s PHE 343 Ca 0.11 0.28 -0.02 0.00 -0.96 0.00 0.00 56.93 56.34 3h1c s PHE 343 Cb -0.18 -2.01 0.04 0.00 -0.34 0.00 0.00 43.02 40.53 3h1c s PHE 343 CO -0.25 0.40 0.02 0.99 -1.46 0.00 0.00 175.22 174.92 3h1c s THR 344 N -0.24 0.31 -0.31 0.12 2.01 -0.52 -1.27 115.64 115.75 3h1c s THR 344 Ca 0.09 0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.12 3h1c s THR 344 Cb -0.12 -0.57 0.07 0.00 0.01 0.00 0.00 72.50 71.89 3h1c s THR 344 CO 0.01 0.13 0.00 -0.60 -0.69 0.00 0.00 174.62 173.48 3h1c s ARG 345 N 1.99 2.12 3.64 4.92 3.52 -0.33 -0.08 118.95 134.72 3h1c s ARG 345 Ca 0.04 -1.49 0.00 0.00 -0.13 0.00 0.00 55.73 54.14 3h1c s ARG 345 Cb -0.13 -3.15 0.00 0.00 -1.56 0.00 0.00 34.95 30.11 3h1c s ARG 345 CO -0.06 -0.73 0.00 0.41 -0.81 0.00 0.00 175.30 174.11 3h1c n GLY 346 N 4.48 0.99 1.45 8.12 0.00 0.45 -1.74 105.19 118.93 3h1c n GLY 346 Ca -0.08 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.31 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 1.28 -5.12 1.61 0.28 -1.26 -4.94 120.64 112.49 3h1c n GLU 347 Ca 0.00 -2.96 -0.32 0.00 -0.16 0.00 0.00 57.16 53.72 3h1c n GLU 347 Cb 0.00 -1.10 -0.16 0.00 1.43 0.00 0.00 31.44 31.61 3h1c n GLU 347 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 3h1c s THR 348 N -2.29 2.32 -0.02 3.84 -4.23 -0.71 -3.92 115.64 110.63 3h1c s THR 348 Ca 0.37 -0.94 0.04 0.00 -1.18 0.00 0.00 61.69 59.97 3h1c s THR 348 Cb 0.38 -1.90 -0.01 0.00 1.34 0.00 0.00 72.50 72.31 3h1c s THR 348 CO -0.09 0.56 -0.13 -1.58 -0.54 0.00 0.00 174.62 172.84 3h1c s GLN 349 N 0.13 1.16 -0.17 3.99 0.74 -0.96 -1.19 119.66 123.37 3h1c s GLN 349 Ca -0.11 -0.45 -0.03 0.00 0.05 0.00 0.00 55.36 54.81 3h1c s GLN 349 Cb -0.16 -1.09 0.06 0.00 1.10 0.00 0.00 33.01 32.92 3h1c s GLN 349 CO 0.06 0.24 0.05 0.00 -0.55 0.00 0.00 175.29 175.09 3h1c s ALA 350 N -0.13 0.74 -0.76 1.58 0.00 -0.39 -0.16 121.76 122.64 3h1c s ALA 350 Ca 0.02 -0.46 -0.23 0.00 0.00 0.00 0.00 51.96 51.28 3h1c s ALA 350 Cb -0.07 -1.06 0.07 0.00 0.00 0.00 0.00 23.12 22.06 3h1c s ALA 350 CO 0.00 -1.06 1.11 -1.17 0.00 0.00 0.00 175.76 174.64 3h1c s LEU 351 N 1.98 4.12 -0.20 0.00 2.96 0.16 -2.44 118.68 125.25 3h1c s LEU 351 Ca 0.01 -1.08 -0.11 0.00 -0.22 0.00 0.00 54.13 52.73 3h1c s LEU 351 Cb -0.16 -2.46 -0.05 0.00 0.50 0.00 0.00 46.19 44.02 3h1c s LEU 351 CO -0.08 -1.48 0.18 -0.69 -1.32 0.00 0.00 176.35 172.96 3h1c s VAL 352 N 4.33 5.37 0.04 1.68 1.01 -0.61 -0.47 120.40 131.75 3h1c s VAL 352 Ca 0.29 0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.62 3h1c s VAL 352 Cb -0.11 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 3h1c s VAL 352 CO 0.06 0.40 -0.23 0.42 0.00 0.00 0.00 175.10 175.74 3h1c s THR 353 N 0.61 2.38 -0.05 3.92 -4.23 0.56 -1.32 115.64 117.52 3h1c s THR 353 Ca 0.10 -1.29 0.06 0.00 -1.18 0.00 0.00 61.69 59.38 3h1c s THR 353 Cb -0.12 -1.95 -0.01 0.00 1.34 0.00 0.00 72.50 71.75 3h1c s THR 353 CO 0.01 0.37 -0.25 0.00 -0.54 0.00 0.00 174.62 174.22 3h1c s ALA 354 N -0.84 2.18 -0.06 3.99 0.00 -1.02 -1.28 121.76 124.73 3h1c s ALA 354 Ca 0.13 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 51.03 3h1c s ALA 354 Cb -0.10 -0.65 0.02 0.00 0.00 0.00 0.00 23.12 22.39 3h1c s ALA 354 CO 0.03 0.45 -0.06 0.99 0.00 0.00 0.00 175.76 177.17 3h1c s THR 355 N -0.30 0.72 0.09 0.00 2.01 -0.54 -0.60 115.64 117.03 3h1c s THR 355 Ca 0.01 -0.20 -0.13 0.00 0.31 0.00 0.00 61.69 61.67 3h1c s THR 355 Cb -0.13 -0.73 -0.06 0.00 0.01 0.00 0.00 72.50 71.59 3h1c s THR 355 CO 0.02 0.28 0.47 -0.76 -0.69 0.00 0.00 174.62 173.94 3h1c s LEU 356 N 1.06 4.38 0.00 4.42 1.43 -1.26 -1.32 118.68 127.38 3h1c s LEU 356 Ca -0.08 0.96 0.00 0.00 -1.03 0.00 0.00 54.13 53.97 3h1c s LEU 356 Cb -0.14 -3.02 0.00 0.00 0.03 0.00 0.00 46.19 43.06 3h1c s LEU 356 CO -0.01 0.18 0.00 0.61 0.23 0.00 0.00 176.35 177.36 3h1c n GLY 357 N 1.06 4.44 3.64 -3.19 0.00 -0.15 -4.99 105.19 105.99 3h1c n GLY 357 Ca -0.08 -1.31 -0.28 0.00 0.00 0.00 0.00 46.02 44.35 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 -1.63 2.03 0.58 2.61 2.01 -1.26 -3.71 115.64 116.27 3h1c s THR 358 Ca 0.00 -1.96 0.43 0.00 0.31 0.00 0.00 61.69 60.47 3h1c s THR 358 Cb 0.00 -2.99 0.44 0.00 0.01 0.00 0.00 72.50 69.95 3h1c s THR 358 CO 0.00 0.00 2.31 0.00 -0.69 0.00 0.00 174.62 176.24 3h1c h ALA 359 N 1.72 1.01 -0.06 7.40 0.00 -1.96 -1.44 119.26 125.94 3h1c h ALA 359 Ca -0.44 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.34 3h1c h ALA 359 Cb 1.24 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3h1c h ALA 359 CO 0.80 0.00 -0.54 -0.09 0.00 0.00 0.00 179.25 179.42 3h1c h ARG 360 N 0.00 0.18 -0.05 0.00 2.43 -2.02 -3.13 114.38 111.79 3h1c h ARG 360 Ca -0.00 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 3h1c h ARG 360 Cb 0.08 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 3h1c h ARG 360 CO 0.00 0.67 0.00 -0.25 -1.51 0.00 0.00 179.97 178.88 3h1c n ASP 361 N -3.91 0.65 -4.74 -3.80 8.00 -0.54 -4.89 116.55 107.32 3h1c n ASP 361 Ca -0.02 -1.42 -0.41 0.00 0.71 0.00 0.00 54.79 53.65 3h1c n ASP 361 Cb 0.57 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.61 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 -1.94 3.53 -0.32 2.24 0.00 -1.19 -4.96 121.76 119.12 3h1c s ALA 362 Ca 0.35 1.14 -0.29 0.00 0.00 0.00 0.00 51.96 53.16 3h1c s ALA 362 Cb 0.17 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.81 3h1c s ALA 362 CO 0.28 -0.55 1.32 -1.14 0.00 0.00 0.00 175.76 175.66 3h1c s GLN 363 N -0.41 3.86 -0.28 0.00 0.74 -1.17 -4.86 119.66 117.54 3h1c s GLN 363 Ca 0.55 1.19 -0.23 0.00 0.05 0.00 0.00 55.36 56.92 3h1c s GLN 363 Cb -0.37 -3.90 -0.00 0.00 1.10 0.00 0.00 33.01 29.83 3h1c s GLN 363 CO 0.41 -1.20 0.77 0.54 -0.55 0.00 0.00 175.29 175.26 3h1c s VAL 364 N 4.54 4.84 -0.20 1.34 0.11 -1.26 -1.05 120.40 128.72 3h1c s VAL 364 Ca 0.57 1.27 -0.09 0.00 -2.93 0.00 0.00 61.98 60.80 3h1c s VAL 364 Cb -0.16 -4.10 -0.04 0.00 -1.53 0.00 0.00 36.38 30.54 3h1c s VAL 364 CO 0.25 -0.16 0.10 -0.76 -3.33 0.00 0.00 175.10 171.20 3h1c s LEU 365 N 2.85 3.98 -1.17 2.54 1.43 -0.18 -5.01 118.68 123.12 3h1c s LEU 365 Ca 0.32 0.13 -0.03 0.00 -1.03 0.00 0.00 54.13 53.51 3h1c s LEU 365 Cb -0.15 -2.03 0.22 0.00 0.03 0.00 0.00 46.19 44.27 3h1c s LEU 365 CO 0.10 0.15 2.08 0.47 0.23 0.00 0.00 176.35 179.39 3h1c n ASP 366 N 3.69 7.64 -4.77 2.29 8.00 -1.26 -2.73 116.55 129.40 3h1c n ASP 366 Ca -0.16 -3.42 -0.36 0.00 0.71 0.00 0.00 54.79 51.56 3h1c n ASP 366 Cb 0.52 -1.27 -0.01 0.00 -0.02 0.00 0.00 41.12 40.34 3h1c n ASP 366 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3h1c s GLU 367 N -2.75 3.74 0.33 -1.24 2.02 -1.26 -4.96 118.70 114.59 3h1c s GLU 367 Ca 0.46 1.68 0.07 0.00 0.02 0.00 0.00 54.97 57.20 3h1c s GLU 367 Cb 0.18 -2.33 0.60 0.00 0.10 0.00 0.00 34.13 32.68 3h1c s GLU 367 CO -0.11 -0.54 1.80 1.25 0.02 0.00 0.00 175.26 177.68 3h1c h LEU 368 N 1.91 0.27 -0.34 1.80 5.85 -1.98 -2.91 115.31 119.91 3h1c h LEU 368 Ca -0.49 -0.08 -0.19 0.00 0.84 0.00 0.00 57.88 57.95 3h1c h LEU 368 Cb 1.24 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 3h1c h LEU 368 CO 0.60 0.53 -0.81 -0.03 -0.34 0.00 0.00 178.44 178.39 3h1c h MET 369 N 0.25 0.30 0.00 1.25 4.05 -1.94 -3.46 114.93 115.37 3h1c h MET 369 Ca 0.04 -0.29 0.00 0.00 -0.28 0.00 0.00 59.70 59.17 3h1c h MET 369 Cb 0.59 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.46 3h1c h MET 369 CO 0.04 0.96 0.00 0.41 0.23 0.00 0.00 176.91 178.56 3h1c n GLY 370 N 0.72 1.73 3.70 1.39 0.00 -1.10 -4.79 105.19 106.84 3h1c n GLY 370 Ca -0.04 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.51 4.43 0.00 1.61 2.12 -1.26 -3.98 118.70 120.11 3h1c s GLU 371 Ca 0.00 1.61 -0.06 0.00 0.36 0.00 0.00 54.97 56.88 3h1c s GLU 371 Cb 0.00 -3.47 -0.00 0.00 0.26 0.00 0.00 34.13 30.92 3h1c s GLU 371 CO 0.00 -0.29 0.11 -0.98 -0.54 0.00 0.00 175.26 173.57 3h1c s ARG 372 N 1.58 0.43 -0.21 4.30 1.70 -1.11 -5.02 118.95 120.62 3h1c s ARG 372 Ca 0.55 -0.38 -0.07 0.00 -0.47 0.00 0.00 55.73 55.36 3h1c s ARG 372 Cb -0.24 0.18 -0.04 0.00 -0.57 0.00 0.00 34.95 34.27 3h1c s ARG 372 CO 0.25 -0.10 0.07 0.95 -1.08 0.00 0.00 175.30 175.39 3h1c s THR 373 N -1.26 4.64 -0.10 4.99 -4.23 -1.26 -1.01 115.64 117.41 3h1c s THR 373 Ca -0.14 -0.08 -0.15 0.00 -1.18 0.00 0.00 61.69 60.15 3h1c s THR 373 Cb -0.07 -3.12 -0.05 0.00 1.34 0.00 0.00 72.50 70.60 3h1c s THR 373 CO 0.01 0.41 0.37 -0.62 -0.54 0.00 0.00 174.62 174.25 3h1c s ASP 374 N 0.82 6.61 -0.20 3.99 2.15 -0.21 -4.96 116.67 124.86 3h1c s ASP 374 Ca 0.04 0.72 -0.17 0.00 0.43 0.00 0.00 52.55 53.57 3h1c s ASP 374 Cb -0.14 -2.23 -0.12 0.00 -0.30 0.00 0.00 42.92 40.13 3h1c s ASP 374 CO 0.02 0.15 -0.05 0.41 -0.17 0.00 0.00 175.17 175.54 3h1c n THR 375 N 3.02 1.50 -3.03 1.71 -1.04 -1.26 -3.02 114.28 112.16 3h1c n THR 375 Ca -0.11 -0.02 -0.41 0.00 -2.04 0.00 0.00 64.05 61.47 3h1c n THR 375 Cb 0.52 -2.13 -0.05 0.00 -1.82 0.00 0.00 70.33 66.85 3h1c n THR 375 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 3h1c s PHE 376 N -2.41 3.40 -0.11 -1.42 5.36 -1.26 -2.99 117.98 118.55 3h1c s PHE 376 Ca -0.27 1.07 0.01 0.00 -0.96 0.00 0.00 56.93 56.78 3h1c s PHE 376 Cb 0.06 -2.88 0.02 0.00 -0.34 0.00 0.00 43.02 39.88 3h1c s PHE 376 CO 0.46 -0.19 -0.14 -0.51 -1.46 0.00 0.00 175.22 173.38 3h1c s LEU 377 N 1.95 1.67 -0.15 6.12 1.43 -0.81 -5.03 118.68 123.86 3h1c s LEU 377 Ca 0.33 -0.41 -0.03 0.00 -1.03 0.00 0.00 54.13 52.98 3h1c s LEU 377 Cb -0.16 -1.06 -0.03 0.00 0.03 0.00 0.00 46.19 44.97 3h1c s LEU 377 CO 0.11 -0.00 -0.05 0.12 0.23 0.00 0.00 176.35 176.76 3h1c s PHE 378 N 1.08 2.98 -0.18 0.29 5.36 -1.26 -0.25 117.98 126.00 3h1c s PHE 378 Ca -0.05 -0.33 0.01 0.00 -0.96 0.00 0.00 56.93 55.60 3h1c s PHE 378 Cb -0.15 -1.92 0.02 0.00 -0.34 0.00 0.00 43.02 40.63 3h1c s PHE 378 CO -0.03 -0.04 -0.20 -1.01 -1.46 0.00 0.00 175.22 172.48 3h1c s HIS 379 N 0.28 2.77 -0.21 10.12 3.76 0.17 -4.78 115.29 127.39 3h1c s HIS 379 Ca -0.04 -1.63 -0.06 0.00 -0.15 0.00 0.00 55.06 53.17 3h1c s HIS 379 Cb -0.14 -1.91 -0.03 0.00 1.11 0.00 0.00 32.58 31.61 3h1c s HIS 379 CO 0.03 -0.80 0.03 -0.47 -0.85 0.00 0.00 174.74 172.68 3h1c s TYR 380 N 1.28 3.08 -0.14 1.40 5.04 -1.26 -0.25 117.35 126.50 3h1c s TYR 380 Ca 0.05 -0.36 0.01 0.00 -2.44 0.00 0.00 57.07 54.33 3h1c s TYR 380 Cb -0.13 -2.12 0.02 0.00 0.35 0.00 0.00 41.96 40.08 3h1c s TYR 380 CO -0.13 -0.21 -0.15 -0.80 -1.34 0.00 0.00 175.55 172.92 3h1c s ASN 381 N 1.06 2.65 -0.52 4.32 0.01 -0.85 -4.76 114.94 116.85 3h1c s ASN 381 Ca 0.03 -0.48 0.02 0.00 -0.71 0.00 0.00 52.86 51.72 3h1c s ASN 381 Cb -0.14 -1.18 0.13 0.00 0.41 0.00 0.00 41.25 40.47 3h1c s ASN 381 CO 0.02 -0.02 0.28 0.12 -1.51 0.00 0.00 177.10 175.99 3h1c s PHE 382 N 1.25 3.30 0.57 2.20 5.36 -1.26 -2.86 117.98 126.54 3h1c s PHE 382 Ca -0.00 -3.04 -0.14 0.00 -0.96 0.00 0.00 56.93 52.79 3h1c s PHE 382 Cb -0.14 -2.93 -0.06 0.00 -0.34 0.00 0.00 43.02 39.56 3h1c s PHE 382 CO -0.07 -0.79 1.01 -1.25 -1.46 0.00 0.00 175.22 172.66 3h1c s PRO 383 N -0.09 3.72 0.56 10.12 0.04 -1.26 -4.98 135.00 143.10 3h1c s PRO 383 Ca 0.16 0.89 0.35 0.00 0.04 0.00 0.00 61.00 62.44 3h1c s PRO 383 Cb -0.24 -2.10 1.50 0.00 0.04 0.00 0.00 34.50 33.70 3h1c s PRO 383 CO -0.02 -0.47 2.03 -1.00 0.04 0.00 0.00 177.00 177.59 3h1c h PRO 384 N 0.32 0.00 0.00 0.56 0.13 -1.89 -3.06 132.00 128.05 3h1c h PRO 384 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3h1c h PRO 384 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3h1c h PRO 384 CO 0.61 0.02 0.00 2.48 -0.23 0.00 0.00 178.00 180.88 3h1c n TYR 385 N -3.12 0.00 -0.08 1.56 4.11 -1.25 -2.58 117.16 115.79 3h1c n TYR 385 Ca -0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.78 3h1c n TYR 385 Cb 0.28 -0.47 0.01 0.00 -0.00 0.00 0.00 39.34 39.16 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 0.87 0.32 9.48 4.64 -1.70 -3.31 113.55 123.85 3h1c h SER 386 Ca 0.00 -0.41 -0.32 0.00 -0.47 0.00 0.00 61.79 60.58 3h1c h SER 386 Cb 0.35 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 62.15 3h1c h SER 386 CO 0.00 1.18 -1.88 1.33 -0.87 0.00 0.00 176.83 176.58 3h1c n VAL 387 N -4.04 1.64 0.00 0.95 0.24 -1.21 -2.23 118.33 113.68 3h1c n VAL 387 Ca -0.02 -0.75 0.00 0.00 -2.04 0.00 0.00 64.34 61.53 3h1c n VAL 387 Cb 0.55 -1.22 0.00 0.00 -1.47 0.00 0.00 33.84 31.71 3h1c n VAL 387 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h1c n GLY 388 N 1.73 1.97 3.46 7.63 0.00 -1.17 -4.98 105.19 113.83 3h1c n GLY 388 Ca -0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 3h1c n GLY 388 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h1c s GLU 389 N -0.23 1.72 -0.15 1.61 2.02 -1.06 -5.04 118.70 117.55 3h1c s GLU 389 Ca 0.00 -1.98 -0.05 0.00 0.02 0.00 0.00 54.97 52.95 3h1c s GLU 389 Cb 0.00 -0.76 -0.04 0.00 0.10 0.00 0.00 34.13 33.44 3h1c s GLU 389 CO 0.00 -0.28 0.03 0.95 0.02 0.00 0.00 175.26 175.98 3h1c s THR 390 N -3.31 4.54 0.15 3.63 -4.23 -1.26 -3.97 115.64 111.19 3h1c s THR 390 Ca 0.33 -0.13 -0.15 0.00 -1.18 0.00 0.00 61.69 60.56 3h1c s THR 390 Cb 0.07 -3.00 0.02 0.00 1.34 0.00 0.00 72.50 70.93 3h1c s THR 390 CO 0.15 0.51 0.39 -0.83 -0.54 0.00 0.00 174.62 174.30 3h1c s GLY 391 N -0.04 -0.07 0.43 3.99 0.00 -1.26 -5.06 107.32 105.30 3h1c s GLY 391 Ca 0.05 -0.28 -0.21 0.00 0.00 0.00 0.00 44.72 44.27 3h1c s GLY 391 CO 0.01 -0.43 0.95 1.06 0.00 0.00 0.00 173.10 174.70 3h1c s MET 392 N -3.85 4.24 -0.30 2.90 -1.94 -1.26 -4.87 119.30 114.22 3h1c s MET 392 Ca 0.07 1.14 0.19 0.00 -1.71 0.00 0.00 55.69 55.38 3h1c s MET 392 Cb 0.02 -2.21 0.47 0.00 2.01 0.00 0.00 34.83 35.12 3h1c s MET 392 CO -0.08 -0.02 1.01 0.28 -0.01 0.00 0.00 175.02 176.20 3h1c n VAL 393 N -0.58 1.13 0.00 -6.03 0.31 -1.26 -4.95 118.33 106.94 3h1c n VAL 393 Ca 0.07 -3.07 0.00 0.00 -0.01 0.00 0.00 64.34 61.33 3h1c n VAL 393 Cb 0.54 0.81 0.00 0.00 -0.91 0.00 0.00 33.84 34.27 3h1c n VAL 393 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h1c n GLY 394 N -0.25 0.41 3.78 2.92 0.00 -1.26 -5.04 105.19 105.74 3h1c n GLY 394 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 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 0.18 6.60 0.32 1.61 1.04 -1.26 -5.00 113.70 117.19 3h1c s SER 395 Ca 0.00 2.13 -0.29 0.00 0.48 0.00 0.00 55.95 58.27 3h1c s SER 395 Cb 0.00 -2.59 -0.10 0.00 0.10 0.00 0.00 66.02 63.43 3h1c s SER 395 CO 0.00 -0.61 1.33 -2.84 0.98 0.00 0.00 173.24 172.10 3h1c s PRO 396 N -2.53 4.33 0.95 4.02 0.02 -1.26 -5.02 135.00 135.51 3h1c s PRO 396 Ca 0.59 2.25 -0.13 0.00 0.02 0.00 0.00 61.00 63.73 3h1c s PRO 396 Cb -0.24 -3.07 0.16 0.00 0.02 0.00 0.00 34.50 31.37 3h1c s PRO 396 CO 0.30 -0.24 1.13 0.15 -0.33 0.00 0.00 177.00 178.02 3h1c s LYS 397 N -1.63 0.82 0.18 5.54 1.02 -1.26 -4.88 119.74 119.53 3h1c s LYS 397 Ca 0.50 0.28 -0.13 0.00 0.02 0.00 0.00 55.97 56.65 3h1c s LYS 397 Cb -0.40 -1.80 0.08 0.00 -0.52 0.00 0.00 37.83 35.19 3h1c s LYS 397 CO 0.52 -2.41 1.79 0.00 -0.92 0.00 0.00 175.35 174.33 3h1c h ARG 398 N -1.65 0.83 0.00 1.68 3.08 -2.00 -2.34 114.38 113.98 3h1c h ARG 398 Ca -0.51 -0.10 -0.03 0.00 0.07 0.00 0.00 59.98 59.41 3h1c h ARG 398 Cb 1.33 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 31.21 3h1c h ARG 398 CO 0.59 0.64 -0.14 0.07 -1.07 0.00 0.00 179.97 180.05 3h1c h ARG 399 N 0.81 0.00 0.00 0.04 0.11 -1.98 -2.97 114.38 110.38 3h1c h ARG 399 Ca 0.21 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.19 3h1c h ARG 399 Cb 0.05 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.12 3h1c h ARG 399 CO -0.03 0.14 -0.47 1.49 0.10 0.00 0.00 179.97 181.20 3h1c h GLU 400 N 0.00 0.00 0.04 0.08 4.81 -1.79 -0.27 114.58 117.46 3h1c h GLU 400 Ca -0.00 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.94 3h1c h GLU 400 Cb 1.07 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.41 3h1c h GLU 400 CO 0.02 0.47 -1.60 0.82 -0.73 0.00 0.00 179.01 177.99 3h1c h ILE 401 N 0.00 1.02 -0.58 2.32 2.04 -1.54 -3.32 117.51 117.45 3h1c h ILE 401 Ca -0.00 -2.78 -0.10 0.00 1.00 0.00 0.00 64.86 62.97 3h1c h ILE 401 Cb 0.86 2.57 -0.02 0.00 -0.74 0.00 0.00 36.82 39.49 3h1c h ILE 401 CO 0.06 0.69 -0.02 1.23 0.00 0.00 0.00 178.15 180.11 3h1c h GLY 402 N 2.71 1.13 2.00 5.37 0.00 -1.33 -2.84 103.07 110.10 3h1c h GLY 402 Ca -0.25 -0.85 -0.01 0.00 0.00 0.00 0.00 47.33 46.22 3h1c h GLY 402 CO 0.11 0.78 -0.06 0.45 0.00 0.00 0.00 176.54 177.82 3h1c h HIS 403 N 0.94 0.00 -0.44 5.60 3.86 -1.23 -3.05 115.15 120.83 3h1c h HIS 403 Ca 0.16 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.26 3h1c h HIS 403 Cb 0.58 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.04 3h1c h HIS 403 CO 0.04 0.06 -0.14 0.78 0.86 0.00 0.00 177.93 179.52 3h1c h GLY 404 N 2.84 0.95 1.91 2.45 0.00 -1.60 -2.24 103.07 107.38 3h1c h GLY 404 Ca -0.00 -0.81 -0.17 0.00 0.00 0.00 0.00 47.33 46.35 3h1c h GLY 404 CO 0.01 0.74 -0.76 -0.09 0.00 0.00 0.00 176.54 176.44 3h1c h ARG 405 N 0.71 0.09 -0.50 4.80 9.65 -1.56 -2.02 114.38 125.55 3h1c h ARG 405 Ca 0.11 -0.08 -0.03 0.00 -1.10 0.00 0.00 59.98 58.88 3h1c h ARG 405 Cb 0.70 0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.28 3h1c h ARG 405 CO 0.05 0.80 0.21 1.25 2.80 0.00 0.00 179.97 185.08 3h1c h LEU 406 N 0.06 0.68 -0.57 3.80 6.46 -1.45 -0.84 115.31 123.44 3h1c h LEU 406 Ca -0.02 -0.16 -0.06 0.00 -0.12 0.00 0.00 57.88 57.53 3h1c h LEU 406 Cb 1.34 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 41.08 3h1c h LEU 406 CO 0.11 0.65 -0.26 0.00 -0.62 0.00 0.00 178.44 178.31 3h1c h ALA 407 N 1.05 0.90 -0.26 1.25 0.00 -1.41 -3.04 119.26 117.75 3h1c h ALA 407 Ca 0.17 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 3h1c h ALA 407 Cb 0.18 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3h1c h ALA 407 CO -0.02 0.33 -0.32 -0.22 0.00 0.00 0.00 179.25 179.03 3h1c h LYS 408 N 0.00 0.67 0.00 0.00 3.64 -0.95 -3.18 116.57 116.75 3h1c h LYS 408 Ca -0.00 -0.38 -0.02 0.00 -1.27 0.00 0.00 60.65 58.98 3h1c h LYS 408 Cb 0.99 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.83 3h1c h LYS 408 CO 0.03 0.99 -0.09 0.00 -2.27 0.00 0.00 179.45 178.11 3h1c h ARG 409 N 0.39 0.00 0.00 1.90 3.08 -1.15 -1.53 114.38 117.07 3h1c h ARG 409 Ca 0.03 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 3h1c h ARG 409 Cb 0.90 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.94 3h1c h ARG 409 CO 0.08 0.09 -0.28 0.78 -1.07 0.00 0.00 179.97 179.57 3h1c h GLY 410 N 2.12 0.00 -0.28 0.04 0.00 -1.51 -3.27 103.07 100.16 3h1c h GLY 410 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h1c h GLY 410 CO 0.01 0.00 0.00 -0.62 0.00 0.00 0.00 176.54 175.93 3h1c n VAL 411 N -3.32 0.16 -0.18 4.60 0.31 -1.12 -4.71 118.33 114.07 3h1c n VAL 411 Ca 0.01 -0.58 -0.10 0.00 -0.01 0.00 0.00 64.34 63.66 3h1c n VAL 411 Cb 0.52 0.98 0.02 0.00 -0.91 0.00 0.00 33.84 34.45 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 0.64 1.02 -0.72 7.52 5.85 -1.33 -2.36 115.31 125.93 3h1c h LEU 412 Ca 0.00 -0.34 -0.14 0.00 0.84 0.00 0.00 57.88 58.24 3h1c h LEU 412 Cb 0.21 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 3h1c h LEU 412 CO 0.00 1.14 -0.53 0.00 -0.34 0.00 0.00 178.44 178.71 3h1c h ALA 413 N 0.95 0.90 0.00 1.25 0.00 -1.81 -3.13 119.26 117.41 3h1c h ALA 413 Ca 0.14 -0.49 -0.17 0.00 0.00 0.00 0.00 54.91 54.38 3h1c h ALA 413 Cb 0.69 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3h1c h ALA 413 CO 0.05 0.68 -0.81 0.28 0.00 0.00 0.00 179.25 179.45 3h1c h VAL 414 N 0.23 1.52 -2.69 0.00 2.07 -1.85 -3.46 116.25 112.07 3h1c h VAL 414 Ca 0.01 -2.83 -0.53 0.00 0.82 0.00 0.00 66.70 64.17 3h1c h VAL 414 Cb 1.01 2.55 0.04 0.00 -1.52 0.00 0.00 31.29 33.37 3h1c h VAL 414 CO 0.09 0.79 0.99 -0.32 0.02 0.00 0.00 177.57 179.14 3h1c s MET 415 N -3.05 4.17 0.91 1.57 0.00 -0.89 -2.67 119.30 119.33 3h1c s MET 415 Ca 0.01 2.47 -0.11 0.00 0.00 0.00 0.00 55.69 58.06 3h1c s MET 415 Cb 0.11 -3.31 0.14 0.00 0.00 0.00 0.00 34.83 31.77 3h1c s MET 415 CO 0.79 -0.72 1.09 -1.25 0.00 0.00 0.00 175.02 174.93 3h1c s PRO 416 N 1.77 1.14 0.41 4.11 0.04 -1.26 -4.99 135.00 136.22 3h1c s PRO 416 Ca 0.74 0.96 0.03 0.00 0.04 0.00 0.00 61.00 62.77 3h1c s PRO 416 Cb -0.45 -1.78 0.08 0.00 0.04 0.00 0.00 34.50 32.38 3h1c s PRO 416 CO 0.33 -2.36 0.57 -0.40 0.04 0.00 0.00 177.00 175.17 3h1c n ASP 417 N -3.99 1.09 0.22 6.66 5.75 -1.26 -4.91 116.55 120.11 3h1c n ASP 417 Ca 0.07 -1.84 0.09 0.00 -0.01 0.00 0.00 54.79 53.10 3h1c n ASP 417 Cb 0.54 -0.34 0.46 0.00 -1.03 0.00 0.00 41.12 40.76 3h1c n ASP 417 CO 0.00 0.00 0.00 0.24 -0.11 0.00 0.00 177.20 177.33 3h1c h MET 418 N 0.00 0.00 0.00 0.11 2.86 -1.99 -1.78 114.93 114.14 3h1c h MET 418 Ca -0.19 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.39 3h1c h MET 418 Cb 0.78 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 3h1c h MET 418 CO 0.23 0.25 -0.30 -0.44 1.06 0.00 0.00 176.91 177.71 3h1c h ASP 419 N 0.00 0.00 0.00 1.22 3.32 -2.02 -3.33 116.42 115.61 3h1c h ASP 419 Ca -0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 3h1c h ASP 419 Cb 0.73 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 3h1c h ASP 419 CO 0.03 0.30 -1.48 1.17 -1.72 0.00 0.00 179.24 177.54 3h1c n LYS 420 N -4.02 1.22 -3.60 3.56 4.81 -1.22 -4.95 118.16 113.97 3h1c n LYS 420 Ca -0.02 0.03 -0.29 0.00 -0.87 0.00 0.00 58.31 57.16 3h1c n LYS 420 Cb 0.36 -1.17 -0.13 0.00 0.02 0.00 0.00 35.03 34.10 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 -2.17 1.25 -1.23 5.64 5.36 -0.67 -5.04 117.98 121.12 3h1c s PHE 421 Ca -0.09 -1.79 -0.06 0.00 -0.96 0.00 0.00 56.93 54.04 3h1c s PHE 421 Cb 0.03 -1.37 0.19 0.00 -0.34 0.00 0.00 43.02 41.53 3h1c s PHE 421 CO 0.23 -0.83 2.02 -0.35 -1.46 0.00 0.00 175.22 174.84 3h1c n PRO 422 N 4.22 4.44 -4.31 10.12 -0.04 -1.25 -4.20 135.00 143.97 3h1c n PRO 422 Ca 0.06 -3.83 -0.19 0.00 -0.04 0.00 0.00 63.50 59.49 3h1c n PRO 422 Cb 0.38 -2.67 -0.15 0.00 -0.04 0.00 0.00 33.50 31.01 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 -1.46 0.81 -0.34 0.54 1.51 -1.26 -4.86 117.35 112.29 3h1c s TYR 423 Ca 0.44 -0.19 -0.27 0.00 -1.01 0.00 0.00 57.07 56.04 3h1c s TYR 423 Cb 0.14 -0.58 0.01 0.00 -0.11 0.00 0.00 41.96 41.42 3h1c s TYR 423 CO -0.04 -0.08 0.98 0.95 -1.11 0.00 0.00 175.55 176.24 3h1c s THR 424 N 0.18 4.57 -0.19 -0.71 -4.23 -1.24 -4.91 115.64 109.11 3h1c s THR 424 Ca -0.03 1.45 -0.04 0.00 -1.18 0.00 0.00 61.69 61.89 3h1c s THR 424 Cb -0.08 -4.35 -0.02 0.00 1.34 0.00 0.00 72.50 69.40 3h1c s THR 424 CO 0.00 -0.47 -0.03 -0.69 -0.54 0.00 0.00 174.62 172.89 3h1c s VAL 425 N 3.50 3.72 -0.25 2.29 1.01 -1.16 -0.98 120.40 128.53 3h1c s VAL 425 Ca 0.41 -0.39 -0.07 0.00 0.00 0.00 0.00 61.98 61.93 3h1c s VAL 425 Cb -0.12 -2.67 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 3h1c s VAL 425 CO 0.16 0.44 0.05 -0.60 0.00 0.00 0.00 175.10 175.16 3h1c s ARG 426 N 0.98 3.50 -0.26 2.72 3.52 -0.44 -1.93 118.95 127.05 3h1c s ARG 426 Ca 0.01 -0.58 -0.05 0.00 -0.13 0.00 0.00 55.73 54.98 3h1c s ARG 426 Cb -0.14 -3.29 -0.00 0.00 -1.56 0.00 0.00 34.95 29.96 3h1c s ARG 426 CO 0.01 -0.24 0.02 0.08 -0.81 0.00 0.00 175.30 174.36 3h1c s VAL 427 N 1.57 3.69 -0.18 7.11 1.01 0.66 -1.46 120.40 132.80 3h1c s VAL 427 Ca 0.06 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 3h1c s VAL 427 Cb -0.15 -2.80 -0.01 0.00 0.00 0.00 0.00 36.38 33.42 3h1c s VAL 427 CO 0.02 0.26 -0.08 -0.69 0.00 0.00 0.00 175.10 174.61 3h1c s VAL 428 N 1.49 3.25 -0.25 2.92 1.01 -0.40 0.44 120.40 128.86 3h1c s VAL 428 Ca 0.04 -0.56 -0.08 0.00 0.00 0.00 0.00 61.98 61.38 3h1c s VAL 428 Cb -0.16 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 3h1c s VAL 428 CO -0.00 0.47 0.08 -0.55 0.00 0.00 0.00 175.10 175.10 3h1c s SER 429 N 0.93 5.21 -0.42 3.32 0.15 0.66 -0.32 113.70 123.22 3h1c s SER 429 Ca -0.01 -0.22 -0.09 0.00 0.70 0.00 0.00 55.95 56.33 3h1c s SER 429 Cb -0.15 -1.94 0.08 0.00 -1.71 0.00 0.00 66.02 62.30 3h1c s SER 429 CO 0.00 -0.05 0.25 -1.61 1.20 0.00 0.00 173.24 173.04 3h1c s GLU 430 N 1.62 2.59 -0.20 5.44 0.41 0.38 -2.00 118.70 126.94 3h1c s GLU 430 Ca 0.06 -1.47 -0.29 0.00 -0.41 0.00 0.00 54.97 52.87 3h1c s GLU 430 Cb -0.15 -3.77 -0.01 0.00 -1.78 0.00 0.00 34.13 28.41 3h1c s GLU 430 CO 0.04 -0.95 1.34 0.42 -0.49 0.00 0.00 175.26 175.62 3h1c s ILE 431 N 1.42 4.13 -0.19 -1.63 1.09 -1.13 0.36 121.20 125.24 3h1c s ILE 431 Ca 0.03 1.34 0.16 0.00 -1.10 0.00 0.00 60.65 61.08 3h1c s ILE 431 Cb -0.23 -3.98 -0.24 0.00 -1.06 0.00 0.00 42.46 36.95 3h1c s ILE 431 CO 0.02 -0.24 0.09 0.35 -0.10 0.00 0.00 174.94 175.05 3h1c n THR 432 N 5.72 1.41 -4.12 2.92 -2.24 0.77 -4.50 114.28 114.25 3h1c n THR 432 Ca 0.15 -0.83 -0.15 0.00 -2.27 0.00 0.00 64.05 60.95 3h1c n THR 432 Cb 0.45 -0.57 -0.14 0.00 -2.10 0.00 0.00 70.33 67.97 3h1c n THR 432 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3h1c s GLU 433 N -2.50 0.41 -0.27 -0.78 2.02 -1.10 -4.18 118.70 112.30 3h1c s GLU 433 Ca -0.12 -0.29 -0.03 0.00 0.02 0.00 0.00 54.97 54.55 3h1c s GLU 433 Cb 0.06 -0.35 0.11 0.00 0.10 0.00 0.00 34.13 34.05 3h1c s GLU 433 CO 0.81 0.09 0.18 0.45 0.02 0.00 0.00 175.26 176.81 3h1c s SER 434 N -0.43 2.77 0.00 -0.19 0.15 -0.95 -2.26 113.70 112.80 3h1c s SER 434 Ca -0.01 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 55.63 3h1c s SER 434 Cb -0.04 -0.06 0.00 0.00 -1.71 0.00 0.00 66.02 64.22 3h1c s SER 434 CO -0.00 -0.41 0.00 -3.20 1.20 0.00 0.00 173.24 170.83 3h1c n ASN 435 N 5.27 0.02 0.00 5.45 5.15 -1.26 -4.61 115.26 125.29 3h1c n ASN 435 Ca -0.05 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.93 3h1c n ASN 435 Cb 0.44 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.69 3h1c n ASN 435 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h1c n GLY 436 N 1.79 0.38 2.68 8.20 0.00 -1.26 0.07 105.19 117.06 3h1c n GLY 436 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3h1c n GLY 436 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h1c s SER 437 N -1.39 1.72 0.86 1.61 1.04 -1.26 -4.21 113.70 112.08 3h1c s SER 437 Ca 0.00 -0.22 -0.08 0.00 0.48 0.00 0.00 55.95 56.13 3h1c s SER 437 Cb 0.00 -0.27 0.18 0.00 0.10 0.00 0.00 66.02 66.03 3h1c s SER 437 CO 0.00 -0.27 1.14 -0.24 0.98 0.00 0.00 173.24 174.85 3h1c n SER 438 N 5.24 0.75 0.00 7.02 2.88 -1.26 -4.23 113.62 124.03 3h1c n SER 438 Ca -0.05 -1.82 0.00 0.00 -1.33 0.00 0.00 58.87 55.67 3h1c n SER 438 Cb 0.49 -0.81 0.00 0.00 -0.75 0.00 0.00 64.21 63.14 3h1c n SER 438 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3h1c n SER 439 N -3.35 0.00 -4.86 -3.46 2.88 -1.26 -4.82 113.62 98.75 3h1c n SER 439 Ca 0.16 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.39 3h1c n SER 439 Cb 0.58 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 64.05 3h1c n SER 439 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3h1c s MET 440 N 0.00 3.52 0.00 -1.46 1.00 -1.26 -3.14 119.30 117.97 3h1c s MET 440 Ca 0.00 0.80 0.00 0.00 0.00 0.00 0.00 55.69 56.49 3h1c s MET 440 Cb 0.00 -2.07 0.00 0.00 0.00 0.00 0.00 34.83 32.76 3h1c s MET 440 CO 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 175.02 174.39 3h1c n ALA 441 N -2.71 0.00 -0.09 3.03 0.00 -1.24 -4.61 120.51 114.89 3h1c n ALA 441 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.40 3h1c n ALA 441 Cb 0.54 -0.45 -0.16 0.00 0.00 0.00 0.00 19.45 19.38 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 0.00 0.20 -0.05 0.00 7.64 -1.21 -3.20 113.62 116.99 3h1c n SER 442 Ca 0.00 0.07 -0.12 0.00 1.01 0.00 0.00 58.87 59.84 3h1c n SER 442 Cb 0.00 0.78 0.01 0.00 -1.01 0.00 0.00 64.21 63.99 3h1c n SER 442 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3h1c h VAL 443 N 0.00 1.29 -0.65 0.44 2.07 -1.80 -0.81 116.25 116.79 3h1c h VAL 443 Ca -0.50 -1.68 -0.04 0.00 0.82 0.00 0.00 66.70 65.29 3h1c h VAL 443 Cb 2.20 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 33.54 3h1c h VAL 443 CO 0.04 0.54 0.23 0.00 0.02 0.00 0.00 177.57 178.40 3h1c h GLY 445 N 0.93 0.00 1.10 0.00 0.00 -1.51 -3.22 103.07 100.37 3h1c h GLY 445 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.42 3h1c h GLY 445 CO -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 176.54 176.37 3h1c h ALA 446 N 1.80 0.71 -0.10 3.60 0.00 -0.86 -1.26 119.26 123.15 3h1c h ALA 446 Ca -0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.43 3h1c h ALA 446 Cb 0.89 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3h1c h ALA 446 CO 0.03 0.66 -0.41 1.03 0.00 0.00 0.00 179.25 180.56 3h1c h SER 447 N 0.88 0.24 0.59 0.00 0.87 -1.55 -1.86 113.55 112.72 3h1c h SER 447 Ca 0.13 -0.10 -0.18 0.00 -1.23 0.00 0.00 61.79 60.41 3h1c h SER 447 Cb 0.73 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 3h1c h SER 447 CO 0.06 0.63 -0.81 -0.07 -0.53 0.00 0.00 176.83 176.11 3h1c h LEU 448 N 0.19 0.20 -0.08 2.23 3.38 -1.54 -2.84 115.31 116.84 3h1c h LEU 448 Ca 0.02 -0.15 -0.25 0.00 0.09 0.00 0.00 57.88 57.59 3h1c h LEU 448 Cb 0.81 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.51 3h1c h LEU 448 CO 0.06 0.92 -0.98 0.00 0.09 0.00 0.00 178.44 178.53 3h1c h ALA 449 N 1.07 0.23 -0.32 1.53 0.00 -1.07 -2.63 119.26 118.07 3h1c h ALA 449 Ca -0.03 -0.69 -0.13 0.00 0.00 0.00 0.00 54.91 54.06 3h1c h ALA 449 Cb 1.41 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 3h1c h ALA 449 CO 0.12 0.73 -0.34 -0.07 0.00 0.00 0.00 179.25 179.69 3h1c h LEU 450 N 0.36 0.74 -0.70 0.00 3.38 -1.40 -1.84 115.31 115.84 3h1c h LEU 450 Ca -0.10 -0.31 -0.14 0.00 0.09 0.00 0.00 57.88 57.42 3h1c h LEU 450 Cb 1.62 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.15 3h1c h LEU 450 CO 0.19 1.01 -0.64 0.24 0.09 0.00 0.00 178.44 179.33 3h1c h MET 451 N 0.59 0.04 -0.05 1.13 2.86 -1.57 0.88 114.93 118.81 3h1c h MET 451 Ca 0.06 -0.03 -0.16 0.00 -2.06 0.00 0.00 59.70 57.51 3h1c h MET 451 Cb 0.86 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.51 3h1c h MET 451 CO 0.07 0.67 -0.69 0.22 1.06 0.00 0.00 176.91 178.24 3h1c h ASP 452 N 0.03 0.29 0.66 1.22 3.58 -1.34 -3.15 116.42 117.70 3h1c h ASP 452 Ca -0.01 -0.19 -0.16 0.00 0.42 0.00 0.00 57.03 57.09 3h1c h ASP 452 Cb 1.14 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 42.08 3h1c h ASP 452 CO 0.09 0.89 -0.75 0.00 -2.88 0.00 0.00 179.24 176.59 3h1c h ALA 453 N 1.10 0.74 0.00 -0.78 0.00 -1.24 -3.44 119.26 115.64 3h1c h ALA 453 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3h1c h ALA 453 Cb 1.24 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3h1c h ALA 453 CO 0.11 0.89 0.00 0.41 0.00 0.00 0.00 179.25 180.66 3h1c n GLY 454 N 0.60 1.36 3.66 0.00 0.00 -0.76 -4.88 105.19 105.17 3h1c n GLY 454 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 3h1c n GLY 454 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h1c s VAL 455 N -2.00 4.67 -1.04 1.61 1.01 0.23 -4.95 120.40 119.93 3h1c s VAL 455 Ca 0.00 1.97 -0.22 0.00 0.00 0.00 0.00 61.98 63.73 3h1c s VAL 455 Cb 0.00 -4.31 -0.10 0.00 0.00 0.00 0.00 36.38 31.97 3h1c s VAL 455 CO 0.00 -0.21 1.93 -0.81 0.00 0.00 0.00 175.10 176.00 3h1c n PRO 456 N 6.38 1.77 -2.20 2.72 -0.04 -1.26 -4.50 135.00 137.87 3h1c n PRO 456 Ca 0.12 -2.29 -0.32 0.00 -0.04 0.00 0.00 63.50 60.97 3h1c n PRO 456 Cb 0.46 -3.35 -0.02 0.00 -0.04 0.00 0.00 33.50 30.55 3h1c n PRO 456 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3h1c s ILE 457 N 7.57 4.54 0.06 0.52 -4.36 -1.26 -4.52 121.20 123.75 3h1c s ILE 457 Ca 0.62 1.08 -0.28 0.00 -0.26 0.00 0.00 60.65 61.81 3h1c s ILE 457 Cb 0.07 -3.74 -0.17 0.00 1.25 0.00 0.00 42.46 39.86 3h1c s ILE 457 CO 0.11 -0.83 1.58 0.11 0.24 0.00 0.00 174.94 176.15 3h1c h LYS 458 N 0.47 -0.50 -3.67 0.37 1.57 -1.87 -3.48 116.57 109.46 3h1c h LYS 458 Ca -0.46 0.03 -0.19 0.00 -1.87 0.00 0.00 60.65 58.17 3h1c h LYS 458 Cb 1.19 0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.57 3h1c h LYS 458 CO 0.61 -0.29 0.02 0.00 -0.57 0.00 0.00 179.45 179.22 3h1c s ALA 459 N -5.82 0.22 0.32 3.86 0.00 -1.26 -5.16 121.76 113.92 3h1c s ALA 459 Ca -0.16 -1.26 -0.27 0.00 0.00 0.00 0.00 51.96 50.28 3h1c s ALA 459 Cb 0.04 0.94 -0.09 0.00 0.00 0.00 0.00 23.12 24.01 3h1c s ALA 459 CO 0.62 -0.87 0.99 0.00 0.00 0.00 0.00 175.76 176.49 3h1c s ALA 460 N -2.56 3.23 -0.06 0.00 0.00 -1.26 -5.03 121.76 116.09 3h1c s ALA 460 Ca 0.25 0.63 0.02 0.00 0.00 0.00 0.00 51.96 52.86 3h1c s ALA 460 Cb -0.03 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.88 3h1c s ALA 460 CO 0.18 0.05 -0.10 0.54 0.00 0.00 0.00 175.76 176.42 3h1c s VAL 461 N -1.49 0.97 0.29 0.00 0.11 -1.26 -4.27 120.40 114.74 3h1c s VAL 461 Ca 0.50 -0.38 0.03 0.00 -2.93 0.00 0.00 61.98 59.20 3h1c s VAL 461 Cb -0.22 -0.90 -0.06 0.00 -1.53 0.00 0.00 36.38 33.67 3h1c s VAL 461 CO 0.28 0.32 0.05 0.00 -3.33 0.00 0.00 175.10 172.42 3h1c s ALA 462 N 0.69 2.10 -0.17 1.54 0.00 -0.65 -4.04 121.76 121.23 3h1c s ALA 462 Ca -0.13 -1.94 -0.28 0.00 0.00 0.00 0.00 51.96 49.60 3h1c s ALA 462 Cb -0.15 0.68 0.08 0.00 0.00 0.00 0.00 23.12 23.72 3h1c s ALA 462 CO 0.03 -0.31 0.74 0.20 0.00 0.00 0.00 175.76 176.41 3h1c s GLY 463 N -3.41 -0.52 0.15 0.00 0.00 -1.26 -1.34 107.32 100.94 3h1c s GLY 463 Ca 0.35 1.77 -0.05 0.00 0.00 0.00 0.00 44.72 46.78 3h1c s GLY 463 CO 0.13 1.39 0.18 -0.26 0.00 0.00 0.00 173.10 174.54 3h1c s ILE 464 N -0.36 0.08 0.09 0.90 -5.25 -0.85 -3.65 121.20 112.15 3h1c s ILE 464 Ca -0.05 -1.63 0.06 0.00 -0.99 0.00 0.00 60.65 58.05 3h1c s ILE 464 Cb -0.03 -1.94 -0.04 0.00 2.95 0.00 0.00 42.46 43.41 3h1c s ILE 464 CO 0.04 -0.37 -0.09 0.00 -1.79 0.00 0.00 174.94 172.73 3h1c s ALA 465 N -4.01 2.98 0.22 2.27 0.00 -1.26 -1.10 121.76 120.86 3h1c s ALA 465 Ca 0.20 -1.20 0.11 0.00 0.00 0.00 0.00 51.96 51.07 3h1c s ALA 465 Cb 0.05 -0.94 -0.05 0.00 0.00 0.00 0.00 23.12 22.19 3h1c s ALA 465 CO 0.01 0.64 -0.22 -1.64 0.00 0.00 0.00 175.76 174.55 3h1c s MET 466 N -2.09 1.53 0.16 0.00 -1.94 0.12 -1.65 119.30 115.44 3h1c s MET 466 Ca 0.21 -1.59 0.04 0.00 -1.71 0.00 0.00 55.69 52.64 3h1c s MET 466 Cb -0.11 -1.72 -0.05 0.00 2.01 0.00 0.00 34.83 34.96 3h1c s MET 466 CO 0.13 0.35 -0.09 0.20 -0.01 0.00 0.00 175.02 175.60 3h1c s GLY 467 N -2.96 1.14 -0.01 -0.03 0.00 -0.51 -0.06 107.32 104.88 3h1c s GLY 467 Ca 0.23 -1.53 0.01 0.00 0.00 0.00 0.00 44.72 43.43 3h1c s GLY 467 CO 0.11 -1.60 -0.04 -2.27 0.00 0.00 0.00 173.10 169.29 3h1c s LEU 468 N -3.19 1.85 -0.24 0.66 2.96 -1.25 -0.45 118.68 119.02 3h1c s LEU 468 Ca 0.18 -0.09 0.01 0.00 -0.22 0.00 0.00 54.13 54.02 3h1c s LEU 468 Cb 0.03 -0.27 0.04 0.00 0.50 0.00 0.00 46.19 46.49 3h1c s LEU 468 CO 0.02 0.03 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.27 3h1c s VAL 469 N 0.11 2.38 -0.15 1.68 1.01 -1.19 -2.34 120.40 121.90 3h1c s VAL 469 Ca -0.01 -1.25 -0.04 0.00 0.00 0.00 0.00 61.98 60.68 3h1c s VAL 469 Cb -0.04 -2.23 0.06 0.00 0.00 0.00 0.00 36.38 34.17 3h1c s VAL 469 CO -0.00 0.20 0.14 -0.75 0.00 0.00 0.00 175.10 174.68 3h1c s LYS 470 N 1.23 0.08 -0.13 2.72 2.20 -1.26 -2.91 119.74 121.66 3h1c s LYS 470 Ca -0.02 0.16 -0.07 0.00 -0.36 0.00 0.00 55.97 55.68 3h1c s LYS 470 Cb -0.17 -1.24 -0.06 0.00 -1.51 0.00 0.00 37.83 34.85 3h1c s LYS 470 CO -0.07 -0.57 -0.18 -1.91 -0.36 0.00 0.00 175.35 172.27 3h1c n GLU 471 N 5.30 0.29 0.00 4.03 2.13 -1.26 -4.98 120.64 126.15 3h1c n GLU 471 Ca -0.06 0.13 0.00 0.00 0.66 0.00 0.00 57.16 57.89 3h1c n GLU 471 Cb 0.49 -0.99 0.00 0.00 0.27 0.00 0.00 31.44 31.22 3h1c n GLU 471 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3h1c n GLY 472 N 2.18 1.34 0.00 8.31 0.00 -1.26 -4.96 105.19 110.79 3h1c n GLY 472 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3h1c n GLY 472 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3h1c n ASP 473 N 0.00 0.93 -4.77 1.61 5.75 -1.26 -5.05 116.55 113.76 3h1c n ASP 473 Ca 0.00 -1.07 -0.38 0.00 -0.01 0.00 0.00 54.79 53.33 3h1c n ASP 473 Cb 0.00 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.05 3h1c n ASP 473 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 3h1c s ASN 474 N -0.07 6.89 -0.02 -1.12 0.02 -1.26 -5.06 114.94 114.31 3h1c s ASN 474 Ca 0.00 2.16 -0.03 0.00 -1.02 0.00 0.00 52.86 53.96 3h1c s ASN 474 Cb 0.00 -2.60 0.00 0.00 0.02 0.00 0.00 41.25 38.67 3h1c s ASN 474 CO 0.00 -0.41 0.08 -0.72 0.02 0.00 0.00 177.10 176.08 3h1c s TYR 475 N -1.46 -0.04 -0.17 2.20 1.13 -1.26 -3.99 117.35 113.77 3h1c s TYR 475 Ca 0.53 0.10 -0.01 0.00 -1.41 0.00 0.00 57.07 56.29 3h1c s TYR 475 Cb -0.27 -0.00 0.04 0.00 -1.10 0.00 0.00 41.96 40.63 3h1c s TYR 475 CO 0.34 -0.10 -0.05 0.08 -2.51 0.00 0.00 175.55 173.31 3h1c s VAL 476 N -0.32 1.07 -0.15 -3.49 1.01 -1.15 -5.01 120.40 112.37 3h1c s VAL 476 Ca -0.04 -0.63 -0.28 0.00 0.00 0.00 0.00 61.98 61.04 3h1c s VAL 476 Cb -0.03 -1.27 -0.01 0.00 0.00 0.00 0.00 36.38 35.08 3h1c s VAL 476 CO 0.00 0.10 0.93 -0.69 0.00 0.00 0.00 175.10 175.45 3h1c s VAL 477 N 1.65 4.82 -0.12 2.92 1.01 -1.26 -3.16 120.40 126.25 3h1c s VAL 477 Ca 0.00 1.86 -0.05 0.00 0.00 0.00 0.00 61.98 63.80 3h1c s VAL 477 Cb -0.15 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 3h1c s VAL 477 CO -0.08 -0.00 0.08 -0.76 0.00 0.00 0.00 175.10 174.34 3h1c s LEU 478 N 2.19 3.99 -0.12 3.92 1.02 0.40 -4.57 118.68 125.51 3h1c s LEU 478 Ca 0.43 0.27 -0.05 0.00 0.02 0.00 0.00 54.13 54.81 3h1c s LEU 478 Cb -0.17 -1.96 -0.04 0.00 0.02 0.00 0.00 46.19 44.04 3h1c s LEU 478 CO 0.14 0.34 0.04 -0.44 0.02 0.00 0.00 176.35 176.46 3h1c s SER 479 N -0.65 5.54 -0.83 2.29 0.01 -0.77 -1.42 113.70 117.87 3h1c s SER 479 Ca 0.12 0.17 -0.03 0.00 1.31 0.00 0.00 55.95 57.52 3h1c s SER 479 Cb -0.12 -1.75 -0.00 0.00 0.21 0.00 0.00 66.02 64.36 3h1c s SER 479 CO 0.02 0.31 0.67 -0.67 0.41 0.00 0.00 173.24 173.99 3h1c n ASP 480 N 2.59 -6.23 -4.79 2.44 2.03 -0.66 -4.72 116.55 107.21 3h1c n ASP 480 Ca -0.18 -0.58 -0.34 0.00 0.52 0.00 0.00 54.79 54.21 3h1c n ASP 480 Cb 0.53 -3.51 -0.02 0.00 -0.72 0.00 0.00 41.12 37.41 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 -3.05 3.60 0.92 5.18 -4.36 -1.23 -4.82 121.20 117.44 3h1c s ILE 481 Ca 0.06 0.98 -0.12 0.00 -0.26 0.00 0.00 60.65 61.30 3h1c s ILE 481 Cb -0.02 -3.39 0.20 0.00 1.25 0.00 0.00 42.46 40.50 3h1c s ILE 481 CO 0.83 -0.24 1.26 -0.76 0.24 0.00 0.00 174.94 176.27 3h1c s LEU 482 N -3.67 2.80 0.25 0.37 1.02 -1.26 -4.03 118.68 114.16 3h1c s LEU 482 Ca 0.69 -0.01 0.03 0.00 0.02 0.00 0.00 54.13 54.85 3h1c s LEU 482 Cb -0.18 -2.03 0.29 0.00 0.02 0.00 0.00 46.19 44.29 3h1c s LEU 482 CO 0.23 -2.65 1.61 1.23 0.02 0.00 0.00 176.35 176.80 3h1c h GLY 483 N -1.44 0.40 2.00 -3.19 0.00 -0.53 -1.67 103.07 98.63 3h1c h GLY 483 Ca -0.42 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 46.45 3h1c h GLY 483 CO 0.34 0.38 -0.20 -0.55 0.00 0.00 0.00 176.54 176.51 3h1c h ASP 484 N 0.29 0.00 0.79 0.19 3.32 -1.95 -1.82 116.42 117.25 3h1c h ASP 484 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3h1c h ASP 484 Cb 0.95 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.50 3h1c h ASP 484 CO 0.08 0.20 -0.53 -0.62 -1.72 0.00 0.00 179.24 176.65 3h1c n GLU 485 N -3.25 0.19 -0.09 3.56 1.02 -1.07 -3.15 120.64 117.86 3h1c n GLU 485 Ca 0.01 0.06 -0.23 0.00 -0.02 0.00 0.00 57.16 56.99 3h1c n GLU 485 Cb 0.49 -1.62 -0.12 0.00 -0.02 0.00 0.00 31.44 30.17 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 -1.90 1.99 -0.00 1.62 2.03 -0.65 -3.04 116.55 116.59 3h1c n ASP 486 Ca 0.04 0.21 -0.17 0.00 0.52 0.00 0.00 54.79 55.39 3h1c n ASP 486 Cb 0.40 -0.77 -0.07 0.00 -0.72 0.00 0.00 41.12 39.96 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 -0.44 1.02 -0.01 -0.67 3.86 -1.51 -3.22 115.15 114.19 3h1c h HIS 487 Ca -0.50 -0.47 0.00 0.00 -1.16 0.00 0.00 60.37 58.23 3h1c h HIS 487 Cb 1.73 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 30.05 3h1c h HIS 487 CO 0.04 1.30 -0.38 1.28 0.86 0.00 0.00 177.93 181.03 3h1c n LEU 488 N -3.91 0.91 0.00 2.43 4.77 -1.19 -4.93 117.00 115.09 3h1c n LEU 488 Ca -0.08 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 3h1c n LEU 488 Cb 0.77 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 3h1c n LEU 488 CO 0.53 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 3h1c n GLY 489 N 1.40 -1.08 0.00 -0.72 0.00 -1.17 -4.93 105.19 98.69 3h1c n GLY 489 Ca 0.09 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.59 0.10 -3.76 1.61 8.00 -0.99 -4.95 116.55 113.97 3h1c n ASP 490 Ca 0.00 -0.44 -0.13 0.00 0.71 0.00 0.00 54.79 54.93 3h1c n ASP 490 Cb 0.00 0.59 -0.11 0.00 -0.02 0.00 0.00 41.12 41.58 3h1c n ASP 490 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3h1c s MET 491 N -0.59 0.35 -0.50 -1.24 1.75 -1.26 -1.35 119.30 116.46 3h1c s MET 491 Ca 0.00 0.46 0.02 0.00 -1.25 0.00 0.00 55.69 54.92 3h1c s MET 491 Cb 0.00 0.14 0.13 0.00 2.84 0.00 0.00 34.83 37.94 3h1c s MET 491 CO 0.00 -0.06 0.26 0.34 -0.65 0.00 0.00 175.02 174.91 3h1c s ASP 492 N 0.33 4.70 -0.93 1.11 2.15 -0.43 -3.97 116.67 119.64 3h1c s ASP 492 Ca -0.01 -2.74 -0.06 0.00 0.43 0.00 0.00 52.55 50.18 3h1c s ASP 492 Cb -0.03 -1.71 0.23 0.00 -0.30 0.00 0.00 42.92 41.11 3h1c s ASP 492 CO -0.01 -0.32 0.85 0.12 -0.17 0.00 0.00 175.17 175.64 3h1c s PHE 493 N 0.10 3.95 -0.24 -5.34 5.36 0.91 -2.01 117.98 120.72 3h1c s PHE 493 Ca 0.15 -2.78 -0.12 0.00 -0.96 0.00 0.00 56.93 53.22 3h1c s PHE 493 Cb -0.23 -3.49 -0.05 0.00 -0.34 0.00 0.00 43.02 38.91 3h1c s PHE 493 CO -0.03 -0.84 0.25 -1.59 -1.46 0.00 0.00 175.22 171.55 3h1c s LYS 494 N -1.02 4.08 -0.04 10.12 -2.85 -1.08 0.16 119.74 129.11 3h1c s LYS 494 Ca 0.26 -0.12 0.07 0.00 -1.00 0.00 0.00 55.97 55.18 3h1c s LYS 494 Cb -0.10 -3.56 -0.01 0.00 -2.06 0.00 0.00 37.83 32.10 3h1c s LYS 494 CO -0.10 -0.02 -0.24 0.08 0.10 0.00 0.00 175.35 175.17 3h1c s VAL 495 N 1.29 1.90 -0.01 1.79 1.01 -0.26 -1.92 120.40 124.21 3h1c s VAL 495 Ca 0.11 -1.01 0.04 0.00 0.00 0.00 0.00 61.98 61.13 3h1c s VAL 495 Cb -0.14 -1.60 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 3h1c s VAL 495 CO 0.07 0.54 -0.14 0.00 0.00 0.00 0.00 175.10 175.56 3h1c s ALA 496 N -0.35 1.19 0.00 5.51 0.00 0.85 -2.00 121.76 126.97 3h1c s ALA 496 Ca 0.03 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.36 3h1c s ALA 496 Cb -0.11 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.71 3h1c s ALA 496 CO 0.01 0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.47 3h1c n GLY 497 N 2.67 -1.18 0.00 0.00 0.00 -0.45 -0.05 105.19 106.18 3h1c n GLY 497 Ca -0.14 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 0.15 0.00 0.18 1.61 3.41 -0.69 -1.64 113.62 116.64 3h1c n SER 498 Ca 0.00 -0.28 0.06 0.00 -0.26 0.00 0.00 58.87 58.39 3h1c n SER 498 Cb 0.00 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.20 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 0.00 0.00 4.33 2.43 -1.96 -3.36 114.38 115.82 3h1c h ARG 499 Ca 0.00 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 3h1c h ARG 499 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3h1c h ARG 499 CO 0.00 0.37 -0.44 -0.44 -1.51 0.00 0.00 179.97 177.95 3h1c h ASP 500 N 0.00 0.00 -0.06 -3.80 3.32 -1.94 -3.51 116.42 110.43 3h1c h ASP 500 Ca -0.00 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.57 3h1c h ASP 500 Cb 1.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.59 3h1c h ASP 500 CO 0.05 0.99 0.00 0.61 -1.72 0.00 0.00 179.24 179.17 3h1c n GLY 501 N 1.60 4.37 3.55 2.75 0.00 -1.26 -4.79 105.19 111.40 3h1c n GLY 501 Ca -0.14 -1.19 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 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 -1.74 3.89 -0.20 -0.61 1.01 1.00 -1.70 121.20 122.85 3h1c s ILE 502 Ca 0.00 -0.38 0.08 0.00 0.00 0.00 0.00 60.65 60.35 3h1c s ILE 502 Cb 0.00 -2.66 -0.18 0.00 0.01 0.00 0.00 42.46 39.63 3h1c s ILE 502 CO 0.00 0.54 -0.08 -1.54 0.00 0.00 0.00 174.94 173.86 3h1c n SER 503 N 2.97 1.55 -3.83 3.58 3.41 0.93 -2.43 113.62 119.81 3h1c n SER 503 Ca -0.18 -0.07 -0.12 0.00 -0.26 0.00 0.00 58.87 58.25 3h1c n SER 503 Cb 0.53 0.23 -0.10 0.00 -0.26 0.00 0.00 64.21 64.61 3h1c n SER 503 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h1c s ALA 504 N -2.44 -0.48 -0.19 7.33 0.00 0.14 -0.18 121.76 125.94 3h1c s ALA 504 Ca -0.20 0.20 -0.07 0.00 0.00 0.00 0.00 51.96 51.89 3h1c s ALA 504 Cb 0.07 -0.06 0.09 0.00 0.00 0.00 0.00 23.12 23.21 3h1c s ALA 504 CO 0.61 -0.18 0.42 -1.17 0.00 0.00 0.00 175.76 175.43 3h1c s LEU 505 N -0.85 -0.57 -0.12 0.00 2.96 -1.24 -0.10 118.68 118.76 3h1c s LEU 505 Ca -0.09 0.97 0.02 0.00 -0.22 0.00 0.00 54.13 54.81 3h1c s LEU 505 Cb -0.05 1.34 0.01 0.00 0.50 0.00 0.00 46.19 47.99 3h1c s LEU 505 CO 0.02 -0.23 -0.19 -1.58 -1.32 0.00 0.00 176.35 173.05 3h1c s GLN 506 N 2.44 2.60 -0.23 1.98 0.74 -0.81 -2.14 119.66 124.24 3h1c s GLN 506 Ca -0.03 -0.70 -0.04 0.00 0.05 0.00 0.00 55.36 54.63 3h1c s GLN 506 Cb -0.11 -2.11 -0.01 0.00 1.10 0.00 0.00 33.01 31.87 3h1c s GLN 506 CO -0.13 -0.00 -0.02 1.41 -0.55 0.00 0.00 175.29 176.00 3h1c s MET 507 N 0.81 3.41 -0.30 1.67 -2.45 -0.40 -2.65 119.30 119.38 3h1c s MET 507 Ca -0.09 -0.61 -0.02 0.00 -1.25 0.00 0.00 55.69 53.72 3h1c s MET 507 Cb -0.16 -3.07 0.05 0.00 1.25 0.00 0.00 34.83 32.90 3h1c s MET 507 CO 0.00 -0.21 0.00 -0.51 1.05 0.00 0.00 175.02 175.36 3h1c s ASP 508 N 1.50 4.91 -0.22 1.11 1.01 -0.85 -2.22 116.67 121.90 3h1c s ASP 508 Ca 0.06 -1.27 -0.09 0.00 0.71 0.00 0.00 52.55 51.95 3h1c s ASP 508 Cb -0.14 -1.72 -0.04 0.00 1.01 0.00 0.00 42.92 42.02 3h1c s ASP 508 CO -0.02 -0.26 0.12 -0.63 0.21 0.00 0.00 175.17 174.59 3h1c s ILE 509 N 1.26 5.08 -0.19 0.77 -1.09 -1.02 -1.31 121.20 124.70 3h1c s ILE 509 Ca -0.05 0.08 0.10 0.00 -2.23 0.00 0.00 60.65 58.55 3h1c s ILE 509 Cb -0.20 -3.35 -0.22 0.00 -1.58 0.00 0.00 42.46 37.11 3h1c s ILE 509 CO -0.01 0.38 0.10 0.29 -1.23 0.00 0.00 174.94 174.47 3h1c n LYS 510 N 4.09 0.68 -0.04 2.79 5.02 -0.46 -4.83 118.16 125.42 3h1c n LYS 510 Ca -0.16 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 3h1c n LYS 510 Cb 0.52 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 3h1c n LYS 510 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 3h1c n ILE 511 N -3.02 0.00 -0.07 -0.18 -5.35 -1.25 -4.82 119.36 104.67 3h1c n ILE 511 Ca -0.34 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 61.98 3h1c n ILE 511 Cb 1.08 -1.50 -0.05 0.00 -1.74 0.00 0.00 39.64 37.43 3h1c n ILE 511 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3h1c n GLU 512 N -0.08 0.33 -3.29 6.28 -0.58 -1.26 -4.98 120.64 117.06 3h1c n GLU 512 Ca 0.00 0.14 -0.43 0.00 -0.42 0.00 0.00 57.16 56.46 3h1c n GLU 512 Cb 0.00 -1.06 -0.08 0.00 -0.57 0.00 0.00 31.44 29.72 3h1c n GLU 512 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 3h1c s GLY 513 N -5.19 1.87 -0.12 0.62 0.00 -1.26 -4.44 107.32 98.80 3h1c s GLY 513 Ca -0.22 -1.44 -0.00 0.00 0.00 0.00 0.00 44.72 43.06 3h1c s GLY 513 CO 0.28 1.21 -0.09 -0.42 0.00 0.00 0.00 173.10 174.07 3h1c s ILE 514 N 2.23 1.13 0.58 0.90 -1.09 -1.26 -5.11 121.20 118.58 3h1c s ILE 514 Ca 0.14 -0.35 -0.02 0.00 -2.23 0.00 0.00 60.65 58.18 3h1c s ILE 514 Cb -0.17 -1.13 0.03 0.00 -1.58 0.00 0.00 42.46 39.62 3h1c s ILE 514 CO 0.14 0.38 0.84 0.42 -1.23 0.00 0.00 174.94 175.50 3h1c s THR 515 N 1.67 2.90 0.22 2.92 -4.23 -1.26 -4.54 115.64 113.32 3h1c s THR 515 Ca 0.05 -0.44 0.03 0.00 -1.18 0.00 0.00 61.69 60.15 3h1c s THR 515 Cb -0.13 -3.14 -0.06 0.00 1.34 0.00 0.00 72.50 70.52 3h1c s THR 515 CO -0.09 -0.12 1.53 0.11 -0.54 0.00 0.00 174.62 175.51 3h1c h LYS 516 N -0.09 0.27 0.00 3.99 1.57 -2.01 -3.23 116.57 117.07 3h1c h LYS 516 Ca -0.44 -0.19 -0.12 0.00 -1.87 0.00 0.00 60.65 58.03 3h1c h LYS 516 Cb 1.29 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.62 3h1c h LYS 516 CO 0.56 0.82 -0.57 1.05 -0.57 0.00 0.00 179.45 180.74 3h1c h GLU 517 N 0.19 0.00 0.00 3.15 9.09 -2.01 -3.07 114.58 121.93 3h1c h GLU 517 Ca -0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.40 3h1c h GLU 517 Cb 1.16 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.26 3h1c h GLU 517 CO 0.10 0.57 -0.32 -0.84 0.05 0.00 0.00 179.01 178.57 3h1c h ILE 518 N 0.00 0.00 -0.06 -1.06 3.07 -1.98 -3.28 117.51 114.21 3h1c h ILE 518 Ca -0.01 -0.87 -0.24 0.00 1.55 0.00 0.00 64.86 65.29 3h1c h ILE 518 Cb 1.12 1.70 0.01 0.00 -0.27 0.00 0.00 36.82 39.38 3h1c h ILE 518 CO 0.07 0.00 -0.93 0.24 -1.05 0.00 0.00 178.15 176.49 3h1c h MET 519 N 0.00 0.69 0.00 0.16 2.86 -1.55 -3.11 114.93 113.97 3h1c h MET 519 Ca 0.00 -0.66 -0.11 0.00 -2.06 0.00 0.00 59.70 56.86 3h1c h MET 519 Cb 0.94 0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.75 3h1c h MET 519 CO 0.00 1.26 -0.54 -0.56 1.06 0.00 0.00 176.91 178.13 3h1c h GLN 520 N 0.42 0.00 -0.17 1.72 3.07 -1.65 -2.64 115.11 115.86 3h1c h GLN 520 Ca -0.09 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.52 3h1c h GLN 520 Cb 1.57 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.13 3h1c h GLN 520 CO 0.18 0.54 -0.39 0.28 0.09 0.00 0.00 178.83 179.54 3h1c h VAL 521 N 0.00 1.34 0.00 1.86 2.07 -1.64 -1.33 116.25 118.55 3h1c h VAL 521 Ca -0.01 -1.64 -0.09 0.00 0.82 0.00 0.00 66.70 65.79 3h1c h VAL 521 Cb 1.18 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 32.89 3h1c h VAL 521 CO 0.07 0.50 -0.41 0.00 0.02 0.00 0.00 177.57 177.76 3h1c h ALA 522 N 0.57 1.29 0.14 1.67 0.00 -1.56 -1.48 119.26 119.89 3h1c h ALA 522 Ca 0.00 -0.37 -0.28 0.00 0.00 0.00 0.00 54.91 54.26 3h1c h ALA 522 Cb 0.99 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.73 3h1c h ALA 522 CO 0.09 0.51 -1.28 1.25 0.00 0.00 0.00 179.25 179.81 3h1c h LEU 523 N 0.00 0.46 -0.50 0.00 5.85 -1.46 -2.79 115.31 116.87 3h1c h LEU 523 Ca -0.00 -0.50 -0.16 0.00 0.84 0.00 0.00 57.88 58.05 3h1c h LEU 523 Cb 0.73 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 3h1c h LEU 523 CO 0.05 1.39 -0.75 -1.13 -0.34 0.00 0.00 178.44 177.67 3h1c h ASN 524 N 0.08 0.08 1.06 1.25 -1.24 -1.15 -2.93 115.58 112.72 3h1c h ASN 524 Ca -0.15 -0.06 -0.08 0.00 0.71 0.00 0.00 56.30 56.72 3h1c h ASN 524 Cb 1.99 -0.02 -0.01 0.00 0.73 0.00 0.00 38.32 41.01 3h1c h ASN 524 CO 0.21 0.80 -0.37 -0.61 -1.29 0.00 0.00 177.43 176.17 3h1c h GLN 525 N 0.04 0.00 0.00 6.67 4.15 -1.35 -2.93 115.11 121.69 3h1c h GLN 525 Ca -0.01 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.33 3h1c h GLN 525 Cb 1.32 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.00 3h1c h GLN 525 CO 0.10 0.37 -0.37 0.00 -1.93 0.00 0.00 178.83 177.00 3h1c h ALA 526 N 1.63 1.01 -0.15 3.38 0.00 -1.32 -2.78 119.26 121.04 3h1c h ALA 526 Ca -0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 3h1c h ALA 526 Cb 1.00 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 3h1c h ALA 526 CO 0.05 0.47 -0.08 -0.22 0.00 0.00 0.00 179.25 179.47 3h1c h LYS 527 N 0.00 0.31 -0.67 0.00 3.64 -1.35 -2.29 116.57 116.21 3h1c h LYS 527 Ca -0.00 -0.14 -0.07 0.00 -1.27 0.00 0.00 60.65 59.17 3h1c h LYS 527 Cb 0.88 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.66 3h1c h LYS 527 CO 0.05 0.64 0.13 0.78 -2.27 0.00 0.00 179.45 178.78 3h1c h GLY 528 N -0.03 1.17 1.95 5.01 0.00 -1.54 -2.06 103.07 107.57 3h1c h GLY 528 Ca 0.03 -0.75 -0.11 0.00 0.00 0.00 0.00 47.33 46.50 3h1c h GLY 528 CO 0.02 0.70 -0.51 0.00 0.00 0.00 0.00 176.54 176.75 3h1c h ALA 529 N 1.11 1.12 -0.09 3.60 0.00 -1.55 -3.03 119.26 120.41 3h1c h ALA 529 Ca 0.21 -0.47 -0.16 0.00 0.00 0.00 0.00 54.91 54.49 3h1c h ALA 529 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3h1c h ALA 529 CO 0.01 0.64 -0.64 -0.09 0.00 0.00 0.00 179.25 179.17 3h1c h ARG 530 N 0.04 0.36 0.00 0.00 2.43 -1.13 -3.16 114.38 112.92 3h1c h ARG 530 Ca -0.00 -0.26 -0.07 0.00 -0.81 0.00 0.00 59.98 58.84 3h1c h ARG 530 Cb 0.92 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 3h1c h ARG 530 CO 0.07 0.88 -0.33 -0.07 -1.51 0.00 0.00 179.97 179.01 3h1c h LEU 531 N 0.26 0.00 -0.44 3.80 3.38 -1.26 -2.37 115.31 118.69 3h1c h LEU 531 Ca -0.01 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 3h1c h LEU 531 Cb 1.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 3h1c h LEU 531 CO 0.11 0.33 -0.46 -0.74 0.09 0.00 0.00 178.44 177.77 3h1c h HIS 532 N 0.00 0.97 -0.25 1.13 2.76 -1.51 -2.56 115.15 115.69 3h1c h HIS 532 Ca -0.00 -0.31 -0.12 0.00 -2.20 0.00 0.00 60.37 57.73 3h1c h HIS 532 Cb 0.59 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 29.35 3h1c h HIS 532 CO 0.00 1.10 -0.31 0.82 -1.30 0.00 0.00 177.93 178.24 3h1c h ILE 533 N 0.63 1.31 -0.16 6.26 2.04 -1.54 -3.11 117.51 122.95 3h1c h ILE 533 Ca 0.04 -1.50 -0.04 0.00 1.00 0.00 0.00 64.86 64.36 3h1c h ILE 533 Cb 1.04 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.79 3h1c h ILE 533 CO 0.10 0.47 -0.07 -0.07 0.00 0.00 0.00 178.15 178.59 3h1c h LEU 534 N 0.38 0.22 -0.62 1.44 3.38 -1.45 -0.57 115.31 118.10 3h1c h LEU 534 Ca 0.03 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 3h1c h LEU 534 Cb 0.89 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 3h1c h LEU 534 CO 0.08 0.32 -0.16 1.23 0.09 0.00 0.00 178.44 179.99 3h1c h GLY 535 N 0.62 1.00 1.67 0.83 0.00 -1.44 -1.03 103.07 104.72 3h1c h GLY 535 Ca 0.05 -0.83 -0.21 0.00 0.00 0.00 0.00 47.33 46.34 3h1c h GLY 535 CO 0.01 0.76 -0.90 -2.08 0.00 0.00 0.00 176.54 174.33 3h1c h VAL 536 N 0.81 1.45 -0.35 4.60 2.07 -1.40 -2.90 116.25 120.54 3h1c h VAL 536 Ca 0.12 -2.53 -0.11 0.00 0.82 0.00 0.00 66.70 65.00 3h1c h VAL 536 Cb 0.71 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.90 3h1c h VAL 536 CO 0.05 0.75 -0.24 0.24 0.02 0.00 0.00 177.57 178.39 3h1c h MET 537 N 0.16 0.68 0.00 1.57 2.07 -1.02 -2.83 114.93 115.57 3h1c h MET 537 Ca -0.06 -0.27 0.00 0.00 -2.07 0.00 0.00 59.70 57.30 3h1c h MET 537 Cb 1.53 -0.03 0.00 0.00 -1.87 0.00 0.00 31.60 31.23 3h1c h MET 537 CO 0.15 0.86 0.00 0.93 1.07 0.00 0.00 176.91 179.91 3h1c h GLU 538 N 0.60 0.00 -0.12 1.72 5.08 -1.22 -2.89 114.58 117.75 3h1c h GLU 538 Ca 0.08 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.31 3h1c h GLU 538 Cb 0.72 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3h1c h GLU 538 CO 0.06 0.00 -0.51 0.37 -1.00 0.00 0.00 179.01 177.93 3h1c h GLN 539 N 0.00 0.33 0.00 2.33 4.15 -1.28 -3.34 115.11 117.30 3h1c h GLN 539 Ca 0.00 -0.19 -0.01 0.00 0.77 0.00 0.00 58.65 59.21 3h1c h GLN 539 Cb 0.78 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.49 3h1c h GLN 539 CO 0.00 0.77 -0.18 0.00 -1.93 0.00 0.00 178.83 177.49 3h1c h ALA 540 N 1.20 0.01 -3.93 3.38 0.00 -1.54 -3.48 119.26 114.91 3h1c h ALA 540 Ca 0.01 -0.25 -0.35 0.00 0.00 0.00 0.00 54.91 54.32 3h1c h ALA 540 Cb 0.99 0.15 -0.28 0.00 0.00 0.00 0.00 17.79 18.65 3h1c h ALA 540 CO 0.08 0.15 -0.76 0.96 0.00 0.00 0.00 179.25 179.68 3h1c s ILE 541 N -1.84 0.55 -0.05 0.00 -4.36 -1.09 -5.05 121.20 109.35 3h1c s ILE 541 Ca -0.08 -0.34 0.02 0.00 -0.26 0.00 0.00 60.65 59.99 3h1c s ILE 541 Cb 0.00 -0.47 -0.04 0.00 1.25 0.00 0.00 42.46 43.20 3h1c s ILE 541 CO 0.18 0.13 -0.03 -0.46 0.24 0.00 0.00 174.94 175.00 3h1c n ASN 542 N 2.84 3.71 -3.91 4.36 6.94 -1.26 -4.02 115.26 123.91 3h1c n ASN 542 Ca -0.14 -0.02 -0.12 0.00 -0.02 0.00 0.00 54.58 54.29 3h1c n ASN 542 Cb 0.57 0.15 -0.13 0.00 -2.36 0.00 0.00 39.78 38.01 3h1c n ASN 542 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3h1c s ALA 543 N -2.11 0.10 -2.00 -2.53 0.00 -1.26 -4.96 121.76 109.01 3h1c s ALA 543 Ca -0.06 -0.20 0.11 0.00 0.00 0.00 0.00 51.96 51.81 3h1c s ALA 543 Cb 0.02 0.03 0.68 0.00 0.00 0.00 0.00 23.12 23.84 3h1c s ALA 543 CO 0.14 -0.03 1.11 -0.35 0.00 0.00 0.00 175.76 176.63