#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 3.78 -0.05 -0.89 1.43 -1.26 -5.08 118.68 116.61 3h1c s LEU 2 Ca 0.00 1.66 -0.02 0.00 -1.03 0.00 0.00 54.13 54.74 3h1c s LEU 2 Cb 0.00 -4.53 0.04 0.00 0.03 0.00 0.00 46.19 41.73 3h1c s LEU 2 CO 0.00 -0.52 0.11 0.54 0.23 0.00 0.00 176.35 176.71 3h1c s ASN 3 N -2.57 0.14 0.41 2.29 2.20 -1.26 -5.15 114.94 111.00 3h1c s ASN 3 Ca 0.61 0.22 -0.02 0.00 -0.94 0.00 0.00 52.86 52.73 3h1c s ASN 3 Cb -0.10 0.10 -0.03 0.00 -2.00 0.00 0.00 41.25 39.22 3h1c s ASN 3 CO 0.22 -0.16 0.66 -2.16 -2.94 0.00 0.00 177.10 172.72 3h1c s PRO 4 N 1.37 3.50 -0.29 3.55 0.04 -1.26 -4.43 135.00 137.48 3h1c s PRO 4 Ca -0.07 -0.10 -0.02 0.00 0.04 0.00 0.00 61.00 60.86 3h1c s PRO 4 Cb -0.12 -2.53 0.04 0.00 0.04 0.00 0.00 34.50 31.93 3h1c s PRO 4 CO -0.05 -0.02 -0.01 0.42 0.04 0.00 0.00 177.00 177.37 3h1c s ILE 5 N -2.52 2.97 -0.10 0.56 1.01 -0.82 -4.99 121.20 117.32 3h1c s ILE 5 Ca 0.43 -1.30 -0.00 0.00 0.00 0.00 0.00 60.65 59.79 3h1c s ILE 5 Cb -0.10 -2.66 -0.03 0.00 0.01 0.00 0.00 42.46 39.68 3h1c s ILE 5 CO 0.40 -0.04 -0.09 -0.69 0.00 0.00 0.00 174.94 174.53 3h1c s VAL 6 N 1.27 3.52 -0.06 2.92 1.01 -1.26 -2.56 120.40 125.24 3h1c s VAL 6 Ca -0.04 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.43 3h1c s VAL 6 Cb -0.19 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.74 3h1c s VAL 6 CO -0.02 0.56 -0.08 -0.13 0.00 0.00 0.00 175.10 175.43 3h1c s ARG 7 N -0.28 1.29 -0.05 2.72 0.52 -0.49 -4.99 118.95 117.66 3h1c s ARG 7 Ca 0.03 -0.26 0.05 0.00 -0.52 0.00 0.00 55.73 55.03 3h1c s ARG 7 Cb -0.13 -1.15 -0.00 0.00 0.52 0.00 0.00 34.95 34.19 3h1c s ARG 7 CO 0.03 -0.04 -0.19 0.15 0.02 0.00 0.00 175.30 175.26 3h1c s LYS 8 N 0.84 2.08 -0.03 3.54 1.02 -1.26 -0.95 119.74 124.98 3h1c s LYS 8 Ca -0.12 -0.70 -0.10 0.00 0.02 0.00 0.00 55.97 55.08 3h1c s LYS 8 Cb -0.15 -1.76 0.01 0.00 -0.52 0.00 0.00 37.83 35.41 3h1c s LYS 8 CO 0.01 0.26 0.22 -0.59 -0.92 0.00 0.00 175.35 174.33 3h1c s PHE 9 N 0.05 -0.11 0.04 3.18 -0.71 -1.08 -5.03 117.98 114.32 3h1c s PHE 9 Ca -0.06 0.21 -0.30 0.00 -1.04 0.00 0.00 56.93 55.74 3h1c s PHE 9 Cb -0.13 0.04 -0.04 0.00 -1.21 0.00 0.00 43.02 41.67 3h1c s PHE 9 CO 0.03 -0.27 1.07 -0.65 -1.34 0.00 0.00 175.22 174.06 3h1c s GLN 10 N -0.93 4.52 -0.34 1.99 -1.52 -1.26 -2.34 119.66 119.78 3h1c s GLN 10 Ca -0.10 1.58 -0.01 0.00 -1.95 0.00 0.00 55.36 54.88 3h1c s GLN 10 Cb -0.05 -3.40 0.13 0.00 -0.22 0.00 0.00 33.01 29.47 3h1c s GLN 10 CO 0.02 -0.10 0.19 -0.47 -0.25 0.00 0.00 175.29 174.68 3h1c s TYR 11 N 0.88 0.73 0.00 0.91 5.04 -0.32 -4.98 117.35 119.62 3h1c s TYR 11 Ca 0.54 -1.52 0.00 0.00 -2.44 0.00 0.00 57.07 53.65 3h1c s TYR 11 Cb -0.25 -0.98 0.00 0.00 0.35 0.00 0.00 41.96 41.08 3h1c s TYR 11 CO 0.29 -0.83 0.00 0.41 -1.34 0.00 0.00 175.55 174.08 3h1c n GLY 12 N 4.27 2.17 0.42 8.97 0.00 -1.26 -2.41 105.19 117.35 3h1c n GLY 12 Ca 0.08 -0.24 0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 6.48 1.62 -4.24 1.61 6.02 -1.26 -5.01 117.38 122.60 3h1c n GLN 13 Ca 0.00 -0.93 -0.26 0.00 -0.01 0.00 0.00 57.00 55.80 3h1c n GLN 13 Cb 0.00 -1.29 -0.08 0.00 1.02 0.00 0.00 30.24 29.89 3h1c n GLN 13 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 3h1c s HIS 14 N -1.85 2.77 -0.20 1.08 3.76 -1.01 -5.11 115.29 114.74 3h1c s HIS 14 Ca 0.15 -0.17 -0.04 0.00 -0.15 0.00 0.00 55.06 54.84 3h1c s HIS 14 Cb 0.13 -1.33 -0.02 0.00 1.11 0.00 0.00 32.58 32.47 3h1c s HIS 14 CO 0.38 0.53 -0.02 0.99 -0.85 0.00 0.00 174.74 175.77 3h1c s THR 15 N -1.80 3.78 -0.21 1.30 2.01 -1.26 -1.18 115.64 118.29 3h1c s THR 15 Ca 0.27 -0.37 -0.09 0.00 0.31 0.00 0.00 61.69 61.81 3h1c s THR 15 Cb -0.09 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 3h1c s THR 15 CO 0.18 0.43 0.11 -0.69 -0.69 0.00 0.00 174.62 173.96 3h1c s VAL 16 N 1.04 5.07 -0.11 3.82 1.01 -0.99 -3.95 120.40 126.28 3h1c s VAL 16 Ca 0.01 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.07 3h1c s VAL 16 Cb -0.14 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 3h1c s VAL 16 CO 0.01 0.40 -0.13 -0.89 0.00 0.00 0.00 175.10 174.50 3h1c s THR 17 N 0.73 3.12 -0.17 3.92 2.01 -1.25 -2.62 115.64 121.39 3h1c s THR 17 Ca 0.06 -0.65 0.02 0.00 0.31 0.00 0.00 61.69 61.42 3h1c s THR 17 Cb -0.13 -2.30 0.02 0.00 0.01 0.00 0.00 72.50 70.10 3h1c s THR 17 CO 0.02 0.54 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.52 3h1c s LEU 18 N 0.12 2.12 -0.06 4.42 1.43 -0.12 -3.01 118.68 123.58 3h1c s LEU 18 Ca -0.06 -0.63 0.04 0.00 -1.03 0.00 0.00 54.13 52.45 3h1c s LEU 18 Cb -0.15 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.61 3h1c s LEU 18 CO 0.04 0.03 -0.18 -0.70 0.23 0.00 0.00 176.35 175.77 3h1c s GLU 19 N 1.12 2.05 0.03 1.70 2.12 -1.12 -1.40 118.70 123.21 3h1c s GLU 19 Ca 0.01 -0.64 -0.13 0.00 0.36 0.00 0.00 54.97 54.57 3h1c s GLU 19 Cb -0.14 -1.71 0.02 0.00 0.26 0.00 0.00 34.13 32.56 3h1c s GLU 19 CO -0.09 0.20 0.27 -0.08 -0.54 0.00 0.00 175.26 175.02 3h1c s THR 20 N 0.20 0.09 0.00 -1.70 -1.32 -1.06 -0.31 115.64 111.53 3h1c s THR 20 Ca -0.09 -0.71 0.00 0.00 -1.21 0.00 0.00 61.69 59.69 3h1c s THR 20 Cb -0.14 -0.88 0.00 0.00 -1.51 0.00 0.00 72.50 69.97 3h1c s THR 20 CO 0.04 -0.39 0.00 0.61 -2.21 0.00 0.00 174.62 172.67 3h1c n GLY 21 N 0.71 1.32 0.65 6.08 0.00 -1.26 -1.94 105.19 110.75 3h1c n GLY 21 Ca -0.19 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.76 3h1c n GLY 21 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3h1c n MET 22 N -1.23 0.14 -2.77 1.61 0.00 -1.26 -4.87 117.12 108.73 3h1c n MET 22 Ca 0.00 0.06 -0.40 0.00 0.00 0.00 0.00 57.70 57.35 3h1c n MET 22 Cb 0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 33.22 32.36 3h1c n MET 22 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 3h1c s MET 23 N -2.12 4.77 -0.70 2.12 -1.94 -1.26 -4.31 119.30 115.86 3h1c s MET 23 Ca -0.09 1.43 -0.12 0.00 -1.71 0.00 0.00 55.69 55.20 3h1c s MET 23 Cb 0.03 -3.31 0.02 0.00 2.01 0.00 0.00 34.83 33.58 3h1c s MET 23 CO 0.12 0.42 0.63 0.00 -0.01 0.00 0.00 175.02 176.18 3h1c n ALA 24 N 1.94 -2.65 0.28 3.03 0.00 -1.26 -4.74 120.51 117.11 3h1c n ALA 24 Ca -0.01 -0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.50 3h1c n ALA 24 Cb 0.48 -1.27 0.15 0.00 0.00 0.00 0.00 19.45 18.81 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 0.52 0.00 -0.14 0.00 3.08 -1.90 -3.30 114.38 112.64 3h1c h ARG 25 Ca -0.58 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.33 3h1c h ARG 25 Cb 1.38 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.42 3h1c h ARG 25 CO 0.32 0.00 -0.51 0.37 -1.07 0.00 0.00 179.97 179.08 3h1c h GLN 26 N 0.00 0.39 -7.01 0.04 4.15 -1.96 -3.44 115.11 107.28 3h1c h GLN 26 Ca 0.00 -0.23 -0.48 0.00 0.77 0.00 0.00 58.65 58.71 3h1c h GLN 26 Cb 0.94 0.02 0.03 0.00 0.21 0.00 0.00 27.48 28.68 3h1c h GLN 26 CO 0.00 0.81 0.41 0.00 -1.93 0.00 0.00 178.83 178.12 3h1c s ALA 27 N -4.00 2.98 0.43 3.38 0.00 -1.24 -4.93 121.76 118.38 3h1c s ALA 27 Ca -0.06 0.69 0.18 0.00 0.00 0.00 0.00 51.96 52.77 3h1c s ALA 27 Cb 0.12 -3.28 1.10 0.00 0.00 0.00 0.00 23.12 21.07 3h1c s ALA 27 CO 0.81 -0.31 1.89 1.79 0.00 0.00 0.00 175.76 179.94 3h1c h THR 28 N 1.87 0.73 -3.25 0.00 1.35 -1.84 -3.42 112.91 108.35 3h1c h THR 28 Ca -0.49 -0.13 -0.16 0.00 -0.55 0.00 0.00 66.41 65.08 3h1c h THR 28 Cb 1.22 0.32 -0.24 0.00 -1.73 0.00 0.00 68.15 67.72 3h1c h THR 28 CO 0.61 0.07 -0.45 0.00 -0.25 0.00 0.00 175.52 175.50 3h1c s ALA 29 N -5.38 -0.52 -0.28 6.62 0.00 -0.95 -4.52 121.76 116.73 3h1c s ALA 29 Ca -0.08 0.42 -0.02 0.00 0.00 0.00 0.00 51.96 52.27 3h1c s ALA 29 Cb 0.22 -0.21 0.16 0.00 0.00 0.00 0.00 23.12 23.29 3h1c s ALA 29 CO 0.77 -0.15 0.52 0.00 0.00 0.00 0.00 175.76 176.91 3h1c s ALA 30 N -0.39 -1.82 -0.10 0.00 0.00 -1.26 -1.93 121.76 116.27 3h1c s ALA 30 Ca -0.05 1.57 0.02 0.00 0.00 0.00 0.00 51.96 53.50 3h1c s ALA 30 Cb -0.03 -1.95 0.01 0.00 0.00 0.00 0.00 23.12 21.15 3h1c s ALA 30 CO 0.01 -1.26 -0.16 0.08 0.00 0.00 0.00 175.76 174.43 3h1c s VAL 31 N 2.75 1.54 -0.69 0.00 1.01 -0.79 -4.24 120.40 119.98 3h1c s VAL 31 Ca 0.16 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.30 3h1c s VAL 31 Cb -0.15 -1.39 0.17 0.00 0.00 0.00 0.00 36.38 35.01 3h1c s VAL 31 CO -0.19 0.45 0.66 -0.32 0.00 0.00 0.00 175.10 175.70 3h1c s MET 32 N 0.80 3.31 -0.42 2.72 1.75 0.57 -2.59 119.30 125.45 3h1c s MET 32 Ca -0.10 -2.06 -0.16 0.00 -1.25 0.00 0.00 55.69 52.13 3h1c s MET 32 Cb -0.16 -4.38 0.03 0.00 2.84 0.00 0.00 34.83 33.16 3h1c s MET 32 CO 0.01 -1.34 0.34 0.08 -0.65 0.00 0.00 175.02 173.46 3h1c s VAL 33 N 1.00 5.22 -0.12 10.11 1.01 -1.26 -2.78 120.40 133.58 3h1c s VAL 33 Ca 0.12 -0.63 -0.02 0.00 0.00 0.00 0.00 61.98 61.45 3h1c s VAL 33 Cb -0.19 -3.97 0.04 0.00 0.00 0.00 0.00 36.38 32.25 3h1c s VAL 33 CO -0.03 -0.36 0.00 -0.94 0.00 0.00 0.00 175.10 173.77 3h1c s SER 34 N 1.79 2.16 0.00 3.32 1.04 -1.16 -1.39 113.70 119.46 3h1c s SER 34 Ca 0.06 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.11 3h1c s SER 34 Cb -0.19 -0.57 0.00 0.00 0.10 0.00 0.00 66.02 65.36 3h1c s SER 34 CO 0.10 -0.22 0.00 0.23 0.98 0.00 0.00 173.24 174.33 3h1c n MET 35 N 5.07 2.87 -1.76 4.02 2.81 0.78 -3.75 117.12 127.16 3h1c n MET 35 Ca -0.09 0.00 -0.19 0.00 -1.81 0.00 0.00 57.70 55.62 3h1c n MET 35 Cb 0.49 0.00 -0.07 0.00 -0.71 0.00 0.00 33.22 32.93 3h1c n MET 35 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3h1c s ASP 36 N -1.00 4.32 -0.23 7.83 1.11 -1.25 -3.82 116.67 123.63 3h1c s ASP 36 Ca 0.00 -0.41 -0.05 0.00 0.18 0.00 0.00 52.55 52.27 3h1c s ASP 36 Cb 0.00 -2.56 0.01 0.00 1.07 0.00 0.00 42.92 41.44 3h1c s ASP 36 CO 0.00 -3.55 0.20 -0.90 1.18 0.00 0.00 175.17 172.10 3h1c n ASP 37 N 16.97 -5.71 0.00 0.27 5.68 -1.26 -4.64 116.55 127.86 3h1c n ASP 37 Ca 0.44 0.58 0.00 0.00 -0.50 0.00 0.00 54.79 55.31 3h1c n ASP 37 Cb 0.45 -3.71 0.00 0.00 -1.14 0.00 0.00 41.12 36.72 3h1c n ASP 37 CO 0.00 0.00 0.00 1.07 -1.33 0.00 0.00 177.20 176.94 3h1c n THR 38 N -0.01 0.00 -3.83 2.12 5.66 -1.25 0.16 114.28 117.13 3h1c n THR 38 Ca 0.04 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.98 3h1c n THR 38 Cb 0.16 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.92 3h1c n THR 38 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3h1c s ALA 39 N -1.25 -1.32 -0.33 1.79 0.00 0.86 -0.16 121.76 121.36 3h1c s ALA 39 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 51.96 51.74 3h1c s ALA 39 Cb 0.00 0.81 0.12 0.00 0.00 0.00 0.00 23.12 24.05 3h1c s ALA 39 CO 0.00 -1.03 0.18 0.08 0.00 0.00 0.00 175.76 174.98 3h1c s VAL 40 N -3.79 0.14 -0.08 0.00 1.01 -0.48 -2.96 120.40 114.24 3h1c s VAL 40 Ca 0.11 -1.36 -0.29 0.00 0.00 0.00 0.00 61.98 60.44 3h1c s VAL 40 Cb -0.05 -1.12 -0.07 0.00 0.00 0.00 0.00 36.38 35.14 3h1c s VAL 40 CO 0.06 -0.87 1.98 0.12 0.00 0.00 0.00 175.10 176.39 3h1c s PHE 41 N 1.47 1.38 -0.12 5.22 5.36 -0.01 -4.32 117.98 126.97 3h1c s PHE 41 Ca 0.14 -0.00 0.02 0.00 -0.96 0.00 0.00 56.93 56.13 3h1c s PHE 41 Cb -0.20 -4.10 -0.01 0.00 -0.34 0.00 0.00 43.02 38.37 3h1c s PHE 41 CO -0.15 -4.71 -0.18 0.08 -1.46 0.00 0.00 175.22 168.80 3h1c s VAL 42 N 5.69 2.65 0.00 3.12 1.01 -1.07 -1.41 120.40 130.39 3h1c s VAL 42 Ca 0.89 -0.81 0.06 0.00 0.00 0.00 0.00 61.98 62.12 3h1c s VAL 42 Cb -0.37 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 3h1c s VAL 42 CO 0.37 0.54 -0.20 0.42 0.00 0.00 0.00 175.10 176.24 3h1c s THR 43 N 0.32 1.55 -0.11 3.92 -4.23 -0.81 -1.89 115.64 114.40 3h1c s THR 43 Ca -0.14 -0.92 0.03 0.00 -1.18 0.00 0.00 61.69 59.48 3h1c s THR 43 Cb -0.17 -1.31 -0.00 0.00 1.34 0.00 0.00 72.50 72.36 3h1c s THR 43 CO 0.07 0.37 -0.20 -0.69 -0.54 0.00 0.00 174.62 173.62 3h1c s VAL 44 N -0.55 2.37 -0.13 2.29 1.01 -0.81 -2.06 120.40 122.52 3h1c s VAL 44 Ca 0.07 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3h1c s VAL 44 Cb -0.08 -1.94 0.02 0.00 0.00 0.00 0.00 36.38 34.38 3h1c s VAL 44 CO -0.00 0.55 -0.12 -0.69 0.00 0.00 0.00 175.10 174.83 3h1c s VAL 45 N 0.38 1.40 -0.10 2.92 1.01 -0.68 -2.24 120.40 123.09 3h1c s VAL 45 Ca -0.16 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.32 3h1c s VAL 45 Cb -0.17 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 34.89 3h1c s VAL 45 CO 0.07 0.43 -0.18 -0.83 0.00 0.00 0.00 175.10 174.59 3h1c s GLY 46 N 1.50 1.12 0.15 4.51 0.00 -1.26 -1.24 107.32 112.09 3h1c s GLY 46 Ca 0.04 -0.79 -0.30 0.00 0.00 0.00 0.00 44.72 43.67 3h1c s GLY 46 CO -0.09 0.01 1.19 1.20 0.00 0.00 0.00 173.10 175.40 3h1c s GLN 47 N 0.71 4.49 0.21 2.90 -0.21 -1.03 -4.95 119.66 121.78 3h1c s GLN 47 Ca -0.12 1.82 0.01 0.00 0.02 0.00 0.00 55.36 57.10 3h1c s GLN 47 Cb -0.16 -3.28 0.18 0.00 1.00 0.00 0.00 33.01 30.75 3h1c s GLN 47 CO 0.03 -0.12 1.52 0.87 -2.12 0.00 0.00 175.29 175.47 3h1c h LYS 48 N 5.71 0.35 -5.24 2.91 1.79 -2.00 -3.43 116.57 116.66 3h1c h LYS 48 Ca -0.44 -0.25 -0.60 0.00 -2.18 0.00 0.00 60.65 57.18 3h1c h LYS 48 Cb 1.21 0.04 -0.13 0.00 -1.58 0.00 0.00 32.23 31.77 3h1c h LYS 48 CO 0.76 0.86 -0.50 0.15 -1.08 0.00 0.00 179.45 179.64 3h1c s LYS 49 N -3.80 4.16 0.64 3.15 1.02 -1.26 -5.09 119.74 118.56 3h1c s LYS 49 Ca -0.05 -0.23 -0.09 0.00 0.02 0.00 0.00 55.97 55.61 3h1c s LYS 49 Cb 0.11 -3.43 0.00 0.00 -0.52 0.00 0.00 37.83 34.00 3h1c s LYS 49 CO 0.82 0.26 1.01 0.00 -0.92 0.00 0.00 175.35 176.52 3h1c s ALA 50 N 0.47 3.08 1.38 5.17 0.00 -1.26 -4.84 121.76 125.75 3h1c s ALA 50 Ca 0.08 -0.41 -0.20 0.00 0.00 0.00 0.00 51.96 51.43 3h1c s ALA 50 Cb -0.11 -2.88 0.30 0.00 0.00 0.00 0.00 23.12 20.43 3h1c s ALA 50 CO -0.01 -0.91 0.72 1.17 0.00 0.00 0.00 175.76 176.73 3h1c n LYS 51 N -2.79 -4.21 -0.04 0.00 3.00 -1.26 -4.99 118.16 107.87 3h1c n LYS 51 Ca 0.06 -1.20 -0.20 0.00 -0.00 0.00 0.00 58.31 56.96 3h1c n LYS 51 Cb 0.57 -1.51 -0.13 0.00 0.00 0.00 0.00 35.03 33.95 3h1c n LYS 51 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 3h1c h PRO 52 N 0.00 0.13 -0.00 1.64 0.13 -2.01 -3.40 132.00 128.49 3h1c h PRO 52 Ca -0.32 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 3h1c h PRO 52 Cb 1.07 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3h1c h PRO 52 CO 0.19 1.11 -0.19 0.41 -0.23 0.00 0.00 178.00 179.30 3h1c n GLY 53 N 1.64 0.17 2.30 1.56 0.00 -1.26 -5.05 105.19 104.54 3h1c n GLY 53 Ca -0.25 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 3h1c n GLY 53 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3h1c n GLN 54 N -0.77 0.00 -0.04 1.61 -0.06 -1.26 -4.85 117.38 112.01 3h1c n GLN 54 Ca 0.02 0.00 -0.08 0.00 -2.00 0.00 0.00 57.00 54.94 3h1c n GLN 54 Cb 0.10 -0.94 -0.03 0.00 -4.06 0.00 0.00 30.24 25.31 3h1c n GLN 54 CO 0.00 0.00 0.00 -0.40 -0.20 0.00 0.00 177.06 176.46 3h1c n ASP 55 N 2.05 0.62 -4.90 1.69 5.75 -1.26 -4.95 116.55 115.56 3h1c n ASP 55 Ca 0.17 0.10 -0.29 0.00 -0.01 0.00 0.00 54.79 54.77 3h1c n ASP 55 Cb -0.01 -0.25 0.01 0.00 -1.03 0.00 0.00 41.12 39.84 3h1c n ASP 55 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3h1c s PHE 56 N -2.15 3.49 -0.38 2.11 -0.12 -1.26 -4.88 117.98 114.78 3h1c s PHE 56 Ca -0.11 0.94 -0.23 0.00 -0.05 0.00 0.00 56.93 57.49 3h1c s PHE 56 Cb 0.04 -2.61 0.01 0.00 -0.63 0.00 0.00 43.02 39.84 3h1c s PHE 56 CO 0.14 -0.62 0.76 0.12 -0.05 0.00 0.00 175.22 175.56 3h1c s PHE 57 N -2.99 3.09 -0.81 3.49 5.36 -1.26 -4.82 117.98 120.04 3h1c s PHE 57 Ca 0.52 0.43 -0.19 0.00 -0.96 0.00 0.00 56.93 56.73 3h1c s PHE 57 Cb -0.11 -3.41 0.12 0.00 -0.34 0.00 0.00 43.02 39.29 3h1c s PHE 57 CO 0.48 -0.77 1.00 -1.25 -1.46 0.00 0.00 175.22 173.22 3h1c s PRO 58 N 3.07 3.41 -0.24 10.12 0.04 -1.26 -5.00 135.00 145.14 3h1c s PRO 58 Ca 0.30 -1.56 -0.06 0.00 0.04 0.00 0.00 61.00 59.72 3h1c s PRO 58 Cb -0.13 -4.63 -0.02 0.00 0.04 0.00 0.00 34.50 29.76 3h1c s PRO 58 CO 0.18 -1.71 0.02 -1.17 0.04 0.00 0.00 177.00 174.36 3h1c s LEU 59 N 2.76 3.20 -0.13 -3.56 2.96 -1.26 -3.27 118.68 119.39 3h1c s LEU 59 Ca 0.26 -0.29 0.02 0.00 -0.22 0.00 0.00 54.13 53.90 3h1c s LEU 59 Cb -0.11 -1.84 0.01 0.00 0.50 0.00 0.00 46.19 44.75 3h1c s LEU 59 CO -0.03 -0.03 -0.18 0.28 -1.32 0.00 0.00 176.35 175.08 3h1c s THR 60 N 1.54 1.74 -0.18 3.68 -1.32 -1.21 -5.09 115.64 114.81 3h1c s THR 60 Ca 0.06 -0.78 -0.00 0.00 -1.21 0.00 0.00 61.69 59.75 3h1c s THR 60 Cb -0.15 -1.57 0.01 0.00 -1.51 0.00 0.00 72.50 69.28 3h1c s THR 60 CO 0.01 0.49 -0.15 -0.69 -2.21 0.00 0.00 174.62 172.06 3h1c s VAL 61 N 0.97 2.52 -0.36 5.08 1.01 -1.26 -2.53 120.40 125.83 3h1c s VAL 61 Ca -0.05 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.14 3h1c s VAL 61 Cb -0.15 -2.08 0.10 0.00 0.00 0.00 0.00 36.38 34.25 3h1c s VAL 61 CO -0.03 0.51 0.11 0.20 0.00 0.00 0.00 175.10 175.89 3h1c s ASN 62 N 1.19 4.98 -0.33 3.32 0.01 -1.19 -4.94 114.94 117.99 3h1c s ASN 62 Ca 0.02 -2.01 -0.12 0.00 -0.71 0.00 0.00 52.86 50.04 3h1c s ASN 62 Cb -0.14 -1.72 -0.01 0.00 0.41 0.00 0.00 41.25 39.78 3h1c s ASN 62 CO -0.07 -0.44 0.21 -0.47 -1.51 0.00 0.00 177.10 174.83 3h1c s TYR 63 N 1.04 3.21 0.07 2.20 5.04 -1.26 -1.45 117.35 126.21 3h1c s TYR 63 Ca 0.08 -0.33 0.07 0.00 -2.44 0.00 0.00 57.07 54.45 3h1c s TYR 63 Cb -0.21 -2.44 -0.03 0.00 0.35 0.00 0.00 41.96 39.63 3h1c s TYR 63 CO -0.06 -0.39 -0.19 1.14 -1.34 0.00 0.00 175.55 174.71 3h1c s GLN 64 N 1.69 1.13 -0.44 4.97 -2.07 -0.04 -4.68 119.66 120.21 3h1c s GLN 64 Ca 0.06 -1.03 0.02 0.00 -1.82 0.00 0.00 55.36 52.59 3h1c s GLN 64 Cb -0.17 -1.29 0.12 0.00 -1.09 0.00 0.00 33.01 30.57 3h1c s GLN 64 CO 0.09 0.31 0.18 -1.21 -1.32 0.00 0.00 175.29 173.35 3h1c s GLU 65 N -1.60 1.85 0.27 9.60 2.02 -1.26 -2.26 118.70 127.31 3h1c s GLU 65 Ca 0.05 -2.16 -0.30 0.00 0.02 0.00 0.00 54.97 52.58 3h1c s GLU 65 Cb -0.09 -3.37 -0.10 0.00 0.10 0.00 0.00 34.13 30.66 3h1c s GLU 65 CO 0.03 -1.04 1.48 1.03 0.02 0.00 0.00 175.26 176.78 3h1c s ARG 66 N 0.50 4.22 0.54 1.61 1.81 -1.20 -4.92 118.95 121.51 3h1c s ARG 66 Ca 0.13 2.39 0.33 0.00 -1.72 0.00 0.00 55.73 56.86 3h1c s ARG 66 Cb -0.22 -3.08 1.33 0.00 -0.45 0.00 0.00 34.95 32.53 3h1c s ARG 66 CO -0.05 -0.48 1.97 0.00 -0.68 0.00 0.00 175.30 176.07 3h1c h THR 67 N 3.46 0.05 0.00 0.02 1.03 -1.88 -2.97 112.91 112.63 3h1c h THR 67 Ca -0.46 -0.56 0.00 0.00 -0.01 0.00 0.00 66.41 65.37 3h1c h THR 67 Cb 1.22 1.53 0.00 0.00 -1.07 0.00 0.00 68.15 69.83 3h1c h THR 67 CO 0.77 0.02 0.00 0.00 -0.01 0.00 0.00 175.52 176.30 3h1c n TYR 68 N -3.12 0.00 0.08 0.00 4.11 -1.26 -2.98 117.16 113.99 3h1c n TYR 68 Ca 0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 57.90 57.88 3h1c n TYR 68 Cb 0.32 -0.07 0.23 0.00 -0.00 0.00 0.00 39.34 39.81 3h1c n TYR 68 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 3h1c h ALA 69 N 3.64 1.12 0.00 -3.48 0.00 -1.66 -3.11 119.26 115.78 3h1c h ALA 69 Ca 0.00 -0.39 -0.12 0.00 0.00 0.00 0.00 54.91 54.40 3h1c h ALA 69 Cb 0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3h1c h ALA 69 CO 0.00 0.57 -1.85 0.00 0.00 0.00 0.00 179.25 177.97 3h1c n ALA 70 N -2.48 2.28 -0.28 0.00 0.00 -1.21 -1.27 120.51 117.54 3h1c n ALA 70 Ca -0.01 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.74 3h1c n ALA 70 Cb 0.46 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.21 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 1.40 0.72 3.21 0.00 0.00 -1.18 -5.02 105.19 104.32 3h1c n GLY 71 Ca -0.12 -0.43 -0.13 0.00 0.00 0.00 0.00 46.02 45.34 3h1c n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3h1c s ARG 72 N -1.08 0.38 -0.07 1.61 3.52 -1.16 -5.04 118.95 117.12 3h1c s ARG 72 Ca 0.00 0.44 -0.30 0.00 -0.13 0.00 0.00 55.73 55.74 3h1c s ARG 72 Cb 0.00 0.18 -0.02 0.00 -1.56 0.00 0.00 34.95 33.55 3h1c s ARG 72 CO 0.00 -0.05 1.03 0.42 -0.81 0.00 0.00 175.30 175.90 3h1c s ILE 73 N 0.15 4.71 0.32 4.11 1.01 -1.26 -4.10 121.20 126.13 3h1c s ILE 73 Ca -0.00 1.97 -0.29 0.00 0.00 0.00 0.00 60.65 62.32 3h1c s ILE 73 Cb -0.02 -4.26 -0.11 0.00 0.01 0.00 0.00 42.46 38.07 3h1c s ILE 73 CO 0.00 0.05 1.53 -2.16 0.00 0.00 0.00 174.94 174.37 3h1c s PRO 74 N 1.75 4.14 -1.23 2.79 0.04 -1.26 -4.92 135.00 136.31 3h1c s PRO 74 Ca 0.51 2.54 -0.16 0.00 0.04 0.00 0.00 61.00 63.92 3h1c s PRO 74 Cb -0.20 -3.01 0.12 0.00 0.04 0.00 0.00 34.50 31.44 3h1c s PRO 74 CO 0.21 -0.57 1.57 0.20 0.04 0.00 0.00 177.00 178.45 3h1c s GLY 75 N 0.24 1.97 0.26 0.56 0.00 -1.26 -4.58 107.32 104.51 3h1c s GLY 75 Ca 0.59 -3.08 -0.00 0.00 0.00 0.00 0.00 44.72 42.23 3h1c s GLY 75 CO 0.53 2.40 0.25 -0.56 0.00 0.00 0.00 173.10 175.72 3h1c s SER 76 N 3.63 0.64 0.22 1.64 0.01 -1.26 -5.01 113.70 113.57 3h1c s SER 76 Ca 0.48 -1.45 0.04 0.00 1.31 0.00 0.00 55.95 56.32 3h1c s SER 76 Cb 0.00 0.49 0.19 0.00 0.21 0.00 0.00 66.02 66.91 3h1c s SER 76 CO 0.03 -0.99 1.52 0.15 0.41 0.00 0.00 173.24 174.35 3h1c h PHE 77 N 2.38 0.31 0.00 2.43 3.57 -1.96 -3.17 116.94 120.50 3h1c h PHE 77 Ca -0.31 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.06 3h1c h PHE 77 Cb 1.24 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.93 3h1c h PHE 77 CO 0.88 0.83 -0.92 1.19 -2.23 0.00 0.00 178.31 178.06 3h1c n PHE 78 N -3.82 0.10 -3.55 0.41 3.01 -1.26 -4.99 117.46 107.35 3h1c n PHE 78 Ca -0.03 0.03 -0.25 0.00 1.01 0.00 0.00 57.45 58.21 3h1c n PHE 78 Cb 0.66 -0.24 0.06 0.00 -0.01 0.00 0.00 39.48 39.94 3h1c n PHE 78 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3h1c n ARG 79 N -1.70 -6.72 -3.83 -1.08 5.12 -1.20 -5.00 116.66 102.25 3h1c n ARG 79 Ca 0.03 0.78 -0.12 0.00 -1.93 0.00 0.00 57.85 56.62 3h1c n ARG 79 Cb 0.38 -5.76 -0.11 0.00 -1.16 0.00 0.00 32.46 25.81 3h1c n ARG 79 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 3h1c s ARG 80 N -6.26 0.37 -0.35 5.56 3.52 -1.26 -4.67 118.95 115.86 3h1c s ARG 80 Ca 0.55 -0.05 -0.28 0.00 -0.13 0.00 0.00 55.73 55.81 3h1c s ARG 80 Cb -0.25 0.16 -0.01 0.00 -1.56 0.00 0.00 34.95 33.29 3h1c s ARG 80 CO 0.67 -0.08 1.72 -1.21 -0.81 0.00 0.00 175.30 175.60 3h1c s GLU 81 N -0.64 3.38 0.00 5.12 0.41 -1.26 -4.96 118.70 120.74 3h1c s GLU 81 Ca -0.07 1.32 0.00 0.00 -0.41 0.00 0.00 54.97 55.81 3h1c s GLU 81 Cb -0.04 -4.16 0.00 0.00 -1.78 0.00 0.00 34.13 28.14 3h1c s GLU 81 CO 0.01 -1.81 0.00 0.41 -0.49 0.00 0.00 175.26 173.38 3h1c n GLY 82 N 5.36 0.70 3.76 -1.39 0.00 -1.26 -5.02 105.19 107.33 3h1c n GLY 82 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 3h1c n GLY 82 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h1c s ARG 83 N 1.96 4.53 0.34 1.61 0.52 -1.26 -4.97 118.95 121.69 3h1c s ARG 83 Ca 0.00 1.88 -0.27 0.00 -0.52 0.00 0.00 55.73 56.82 3h1c s ARG 83 Cb 0.00 -3.11 -0.13 0.00 0.52 0.00 0.00 34.95 32.23 3h1c s ARG 83 CO 0.00 0.09 1.02 -2.30 0.02 0.00 0.00 175.30 174.13 3h1c n PRO 84 N 1.00 1.41 -0.19 3.54 -0.02 -1.26 -5.02 135.00 134.45 3h1c n PRO 84 Ca -0.00 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3h1c n PRO 84 Cb 0.44 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 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 0.94 0.00 -0.09 2.55 3.41 -1.26 -4.86 113.62 114.31 3h1c n SER 85 Ca 0.09 -0.65 -0.05 0.00 -0.26 0.00 0.00 58.87 58.00 3h1c n SER 85 Cb 0.35 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.46 3h1c n SER 85 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3h1c h GLU 86 N 0.00 0.76 -0.03 4.33 4.81 -2.00 -2.94 114.58 119.51 3h1c h GLU 86 Ca 0.00 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 58.98 3h1c h GLU 86 Cb 0.00 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.30 3h1c h GLU 86 CO 0.00 0.81 -0.07 0.78 -0.73 0.00 0.00 179.01 179.80 3h1c h GLY 87 N 0.97 0.10 1.63 1.92 0.00 -2.01 -3.22 103.07 102.47 3h1c h GLY 87 Ca 0.13 -0.13 0.04 0.00 0.00 0.00 0.00 47.33 47.37 3h1c h GLY 87 CO 0.03 0.11 0.17 0.83 0.00 0.00 0.00 176.54 177.68 3h1c h GLU 88 N -0.46 0.16 -0.05 4.80 5.08 -1.87 -1.48 114.58 120.76 3h1c h GLU 88 Ca -0.00 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.19 3h1c h GLU 88 Cb 0.66 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 3h1c h GLU 88 CO 0.01 0.11 -0.69 1.15 -1.00 0.00 0.00 179.01 178.59 3h1c h THR 89 N 0.17 1.42 -0.14 1.13 2.02 -1.60 -3.05 112.91 112.85 3h1c h THR 89 Ca 0.11 -2.18 -0.04 0.00 0.77 0.00 0.00 66.41 65.06 3h1c h THR 89 Cb 0.21 2.14 -0.00 0.00 -1.74 0.00 0.00 68.15 68.76 3h1c h THR 89 CO -0.02 0.64 -0.09 -0.07 0.37 0.00 0.00 175.52 176.36 3h1c h LEU 90 N 0.16 0.32 -0.97 2.58 3.38 -1.28 -2.71 115.31 116.80 3h1c h LEU 90 Ca -0.02 -0.43 -0.07 0.00 0.09 0.00 0.00 57.88 57.45 3h1c h LEU 90 Cb 1.24 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 3h1c h LEU 90 CO 0.11 0.68 0.01 0.40 0.09 0.00 0.00 178.44 179.73 3h1c h ILE 91 N -0.04 1.24 -0.67 1.22 5.03 -1.63 -2.38 117.51 120.27 3h1c h ILE 91 Ca 0.03 -0.96 0.08 0.00 -0.12 0.00 0.00 64.86 63.89 3h1c h ILE 91 Cb 0.57 0.87 -0.04 0.00 -3.03 0.00 0.00 36.82 35.19 3h1c h ILE 91 CO 0.02 0.34 0.44 0.00 -0.68 0.00 0.00 178.15 178.28 3h1c h ALA 92 N 1.30 1.82 -0.04 1.87 0.00 -1.47 -1.14 119.26 121.60 3h1c h ALA 92 Ca 0.14 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 3h1c h ALA 92 Cb 0.42 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3h1c h ALA 92 CO 0.02 0.06 -0.74 0.00 0.00 0.00 0.00 179.25 178.59 3h1c h ARG 93 N 0.62 0.25 0.00 0.00 3.08 -1.11 -1.71 114.38 115.51 3h1c h ARG 93 Ca 0.30 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.14 3h1c h ARG 93 Cb 0.37 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.46 3h1c h ARG 93 CO -0.10 0.88 0.00 1.28 -1.07 0.00 0.00 179.97 180.96 3h1c n LEU 94 N -3.78 0.35 -0.10 3.04 4.32 -0.50 -1.41 117.00 118.93 3h1c n LEU 94 Ca -0.03 0.58 -0.17 0.00 -0.02 0.00 0.00 56.01 56.37 3h1c n LEU 94 Cb 0.71 -0.52 -0.13 0.00 -1.62 0.00 0.00 43.42 41.86 3h1c n LEU 94 CO 0.46 -0.36 -1.20 -0.38 -1.22 0.00 0.00 177.39 174.69 3h1c n ILE 95 N -1.88 1.53 0.05 -0.08 5.41 -0.80 -4.55 119.36 119.03 3h1c n ILE 95 Ca 0.03 -0.64 -0.13 0.00 1.00 0.00 0.00 62.75 63.02 3h1c n ILE 95 Cb 0.23 -1.31 -0.03 0.00 -0.71 0.00 0.00 39.64 37.82 3h1c n ILE 95 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 3h1c h ASP 96 N 0.01 0.60 -0.30 4.38 3.58 -1.16 -3.34 116.42 120.18 3h1c h ASP 96 Ca -0.54 -0.44 -0.11 0.00 0.42 0.00 0.00 57.03 56.37 3h1c h ASP 96 Cb 1.98 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 42.84 3h1c h ASP 96 CO -0.04 1.21 -0.24 -0.09 -2.88 0.00 0.00 179.24 177.21 3h1c h ARG 97 N 0.30 0.69 0.00 0.28 2.43 -1.48 -2.99 114.38 113.61 3h1c h ARG 97 Ca -0.06 -0.34 -0.17 0.00 -0.81 0.00 0.00 59.98 58.60 3h1c h ARG 97 Cb 1.47 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.99 3h1c h ARG 97 CO 0.15 0.95 -0.79 -1.35 -1.51 0.00 0.00 179.97 177.42 3h1c h PRO 98 N 0.44 0.00 0.01 0.20 0.11 -1.80 -3.34 132.00 127.62 3h1c h PRO 98 Ca 0.06 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.96 3h1c h PRO 98 Cb 0.79 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.88 3h1c h PRO 98 CO 0.06 0.79 -0.97 -0.84 -0.21 0.00 0.00 178.00 176.83 3h1c h ILE 99 N 0.00 1.65 -0.33 4.15 3.07 -1.68 -3.38 117.51 120.99 3h1c h ILE 99 Ca -0.01 -3.19 0.00 0.00 1.55 0.00 0.00 64.86 63.21 3h1c h ILE 99 Cb 1.44 2.75 -0.02 0.00 -0.27 0.00 0.00 36.82 40.73 3h1c h ILE 99 CO 0.10 0.92 0.21 -0.09 -1.05 0.00 0.00 178.15 178.24 3h1c h ARG 100 N 0.01 0.43 0.00 0.16 2.43 -1.64 -2.56 114.38 113.22 3h1c h ARG 100 Ca -0.02 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3h1c h ARG 100 Cb 1.70 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 31.15 3h1c h ARG 100 CO 0.13 0.29 0.00 -1.35 -1.51 0.00 0.00 179.97 177.54 3h1c h PRO 101 N 0.44 0.00 0.00 0.20 0.11 -1.77 -3.05 132.00 127.93 3h1c h PRO 101 Ca 0.12 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.17 3h1c h PRO 101 Cb -0.04 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 3h1c h PRO 101 CO -0.03 0.00 -0.30 -0.07 -0.21 0.00 0.00 178.00 177.39 3h1c h LEU 102 N 0.00 0.00 -9.61 2.35 3.38 -1.66 -3.44 115.31 106.33 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 0.41 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.19 3h1c h LEU 102 CO 0.00 0.30 0.71 -0.36 0.09 0.00 0.00 178.44 179.18 3h1c s PHE 103 N -3.36 3.22 0.62 1.13 0.40 -1.16 -2.82 117.98 116.01 3h1c s PHE 103 Ca 0.02 1.03 -0.18 0.00 -0.60 0.00 0.00 56.93 57.20 3h1c s PHE 103 Cb 0.09 -3.68 -0.02 0.00 0.51 0.00 0.00 43.02 39.91 3h1c s PHE 103 CO 0.68 -2.31 1.24 -1.25 0.70 0.00 0.00 175.22 174.28 3h1c s PRO 104 N 0.55 2.80 0.09 0.24 0.04 -1.26 -4.96 135.00 132.50 3h1c s PRO 104 Ca 0.62 1.91 -0.31 0.00 0.04 0.00 0.00 61.00 63.26 3h1c s PRO 104 Cb -0.38 -1.90 -0.06 0.00 0.04 0.00 0.00 34.50 32.20 3h1c s PRO 104 CO 0.34 -1.37 1.23 -2.00 0.04 0.00 0.00 177.00 175.24 3h1c s GLU 105 N -3.37 4.43 0.00 4.56 2.12 -1.26 -2.92 118.70 122.26 3h1c s GLU 105 Ca 0.79 1.84 0.00 0.00 0.36 0.00 0.00 54.97 57.96 3h1c s GLU 105 Cb -0.33 -3.31 0.00 0.00 0.26 0.00 0.00 34.13 30.75 3h1c s GLU 105 CO 0.36 -0.25 0.00 0.41 -0.54 0.00 0.00 175.26 175.24 3h1c n GLY 106 N 3.07 0.55 3.59 -1.50 0.00 -1.26 -4.92 105.19 104.71 3h1c n GLY 106 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 3h1c n GLY 106 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3h1c s PHE 107 N -2.00 3.04 -0.59 1.61 5.36 -1.15 -4.88 117.98 119.36 3h1c s PHE 107 Ca 0.00 0.63 0.05 0.00 -0.96 0.00 0.00 56.93 56.65 3h1c s PHE 107 Cb 0.00 -3.70 0.03 0.00 -0.34 0.00 0.00 43.02 39.02 3h1c s PHE 107 CO 0.00 -0.89 0.63 0.28 -1.46 0.00 0.00 175.22 173.78 3h1c n VAL 108 N 6.07 0.00 -2.01 3.12 0.31 -1.26 -4.53 118.33 120.03 3h1c n VAL 108 Ca 0.06 -0.49 -0.42 0.00 -0.01 0.00 0.00 64.34 63.48 3h1c n VAL 108 Cb 0.48 1.10 -0.03 0.00 -0.91 0.00 0.00 33.84 34.48 3h1c n VAL 108 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3h1c s ASN 109 N -0.47 6.66 -0.07 4.52 0.01 -1.26 -4.55 114.94 119.77 3h1c s ASN 109 Ca 0.06 2.57 -0.30 0.00 -0.71 0.00 0.00 52.86 54.48 3h1c s ASN 109 Cb 0.04 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.06 3h1c s ASN 109 CO 0.07 -0.75 1.34 -1.61 -1.51 0.00 0.00 177.10 174.64 3h1c s GLU 110 N 0.63 4.27 0.06 -0.60 2.02 -1.26 -4.70 118.70 119.13 3h1c s GLU 110 Ca 0.65 1.83 0.08 0.00 0.02 0.00 0.00 54.97 57.55 3h1c s GLU 110 Cb -0.42 -3.68 -0.03 0.00 0.10 0.00 0.00 34.13 30.10 3h1c s GLU 110 CO 0.35 -0.62 -0.21 0.14 0.02 0.00 0.00 175.26 174.94 3h1c s VAL 111 N 2.90 1.70 -0.13 2.63 -7.23 -1.20 -2.47 120.40 116.60 3h1c s VAL 111 Ca 0.60 -1.32 -0.01 0.00 -1.81 0.00 0.00 61.98 59.45 3h1c s VAL 111 Cb -0.27 -1.50 0.03 0.00 0.56 0.00 0.00 36.38 35.20 3h1c s VAL 111 CO 0.22 0.13 -0.04 -1.58 -0.31 0.00 0.00 175.10 173.52 3h1c s GLN 112 N -1.41 1.20 -0.40 4.82 0.74 -0.37 -3.34 119.66 120.90 3h1c s GLN 112 Ca 0.07 -0.27 -0.03 0.00 0.05 0.00 0.00 55.36 55.18 3h1c s GLN 112 Cb -0.09 -1.63 0.10 0.00 1.10 0.00 0.00 33.01 32.49 3h1c s GLN 112 CO 0.03 -0.36 0.18 0.08 -0.55 0.00 0.00 175.29 174.66 3h1c s VAL 113 N 1.76 3.25 0.00 1.34 1.01 -1.05 -1.69 120.40 125.02 3h1c s VAL 113 Ca 0.03 -1.99 0.01 0.00 0.00 0.00 0.00 61.98 60.03 3h1c s VAL 113 Cb -0.14 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 3h1c s VAL 113 CO -0.07 -0.63 0.04 0.27 0.00 0.00 0.00 175.10 174.70 3h1c s ILE 114 N 1.15 4.39 -0.09 2.22 -5.25 -0.87 -3.17 121.20 119.59 3h1c s ILE 114 Ca 0.07 -0.54 0.01 0.00 -0.99 0.00 0.00 60.65 59.20 3h1c s ILE 114 Cb -0.22 -2.99 0.02 0.00 2.95 0.00 0.00 42.46 42.21 3h1c s ILE 114 CO -0.04 0.35 -0.11 0.00 -1.79 0.00 0.00 174.94 173.35 3h1c s ALA 115 N -1.15 1.34 -0.10 2.27 0.00 -0.53 -1.91 121.76 121.68 3h1c s ALA 115 Ca 0.21 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 51.70 3h1c s ALA 115 Cb -0.12 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.29 3h1c s ALA 115 CO 0.12 -0.09 -0.17 -0.08 0.00 0.00 0.00 175.76 175.54 3h1c s THR 116 N 1.06 1.62 -0.22 0.00 -1.32 -0.50 -0.86 115.64 115.42 3h1c s THR 116 Ca -0.07 -0.74 -0.28 0.00 -1.21 0.00 0.00 61.69 59.39 3h1c s THR 116 Cb -0.15 -1.45 0.00 0.00 -1.51 0.00 0.00 72.50 69.40 3h1c s THR 116 CO -0.01 0.46 0.99 -0.69 -2.21 0.00 0.00 174.62 173.16 3h1c s VAL 117 N 0.75 4.73 -0.03 5.08 1.01 -0.96 -0.83 120.40 130.15 3h1c s VAL 117 Ca -0.11 1.93 0.14 0.00 0.00 0.00 0.00 61.98 63.94 3h1c s VAL 117 Cb -0.16 -4.27 -0.21 0.00 0.00 0.00 0.00 36.38 31.74 3h1c s VAL 117 CO 0.02 -0.13 0.28 0.52 0.00 0.00 0.00 175.10 175.79 3h1c n VAL 118 N 5.21 0.09 -3.44 2.92 0.31 -1.16 -3.27 118.33 119.00 3h1c n VAL 118 Ca 0.10 -0.35 -0.11 0.00 -0.01 0.00 0.00 64.34 63.97 3h1c n VAL 118 Cb 0.47 0.09 -0.02 0.00 -0.91 0.00 0.00 33.84 33.47 3h1c n VAL 118 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3h1c s SER 119 N -3.72 -0.54 -0.13 4.52 0.15 -1.25 -4.03 113.70 108.70 3h1c s SER 119 Ca -0.05 -0.01 -0.10 0.00 0.70 0.00 0.00 55.95 56.49 3h1c s SER 119 Cb 0.09 0.57 0.04 0.00 -1.71 0.00 0.00 66.02 65.00 3h1c s SER 119 CO 0.58 -0.92 0.33 0.54 1.20 0.00 0.00 173.24 174.97 3h1c s VAL 120 N -3.66 -0.01 -0.15 4.45 0.11 -0.40 -0.10 120.40 120.64 3h1c s VAL 120 Ca 0.02 0.04 -0.04 0.00 -2.93 0.00 0.00 61.98 59.07 3h1c s VAL 120 Cb -0.01 -0.47 -0.03 0.00 -1.53 0.00 0.00 36.38 34.34 3h1c s VAL 120 CO -0.12 0.02 -0.03 0.21 -3.33 0.00 0.00 175.10 171.84 3h1c s ASN 121 N 0.58 4.83 0.21 3.54 2.47 0.42 -4.61 114.94 122.39 3h1c s ASN 121 Ca -0.03 -0.11 0.11 0.00 0.42 0.00 0.00 52.86 53.25 3h1c s ASN 121 Cb -0.05 -1.76 0.61 0.00 -1.45 0.00 0.00 41.25 38.61 3h1c s ASN 121 CO -0.04 0.18 1.28 -2.65 -3.72 0.00 0.00 177.10 172.16 3h1c n PRO 122 N 3.43 0.07 -0.11 0.43 -0.02 -1.26 -1.93 135.00 135.61 3h1c n PRO 122 Ca -0.17 0.53 -0.14 0.00 -2.02 0.00 0.00 63.50 61.70 3h1c n PRO 122 Cb 0.52 -1.87 -0.14 0.00 -0.02 0.00 0.00 33.50 32.00 3h1c n PRO 122 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3h1c n GLN 123 N -1.89 0.69 -3.60 -0.52 1.13 -1.26 -4.62 117.38 107.31 3h1c n GLN 123 Ca -0.01 0.07 -0.38 0.00 -1.94 0.00 0.00 57.00 54.74 3h1c n GLN 123 Cb 0.14 -1.51 -0.11 0.00 0.11 0.00 0.00 30.24 28.87 3h1c n GLN 123 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3h1c s VAL 124 N -2.50 5.24 0.12 5.09 1.01 -0.81 -2.79 120.40 125.77 3h1c s VAL 124 Ca -0.22 0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.59 3h1c s VAL 124 Cb 0.07 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.89 3h1c s VAL 124 CO 0.70 0.25 1.09 0.21 0.00 0.00 0.00 175.10 177.35 3h1c s ASN 125 N 1.75 7.28 0.00 3.32 2.47 -1.26 -4.27 114.94 124.22 3h1c s ASN 125 Ca 0.07 1.98 0.20 0.00 0.42 0.00 0.00 52.86 55.53 3h1c s ASN 125 Cb -0.16 -2.59 1.18 0.00 -1.45 0.00 0.00 41.25 38.22 3h1c s ASN 125 CO 0.11 -0.25 1.58 -0.81 -3.72 0.00 0.00 177.10 174.00 3h1c n PRO 126 N 2.91 0.66 -0.03 0.43 -0.04 -1.26 -3.95 135.00 133.72 3h1c n PRO 126 Ca 0.04 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.37 3h1c n PRO 126 Cb 0.47 -1.46 -0.09 0.00 -0.04 0.00 0.00 33.50 32.38 3h1c n PRO 126 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 3h1c h ASP 127 N 0.00 0.15 1.52 3.54 2.03 -1.99 -2.44 116.42 119.22 3h1c h ASP 127 Ca 0.00 -0.54 -0.06 0.00 -0.73 0.00 0.00 57.03 55.70 3h1c h ASP 127 Cb 0.00 -0.04 -0.01 0.00 -0.83 0.00 0.00 39.33 38.45 3h1c h ASP 127 CO 0.00 0.66 -0.28 0.16 -1.03 0.00 0.00 179.24 178.74 3h1c h ILE 128 N -0.36 0.52 -0.29 4.15 3.07 -1.97 -2.70 117.51 119.93 3h1c h ILE 128 Ca 0.00 -1.59 -0.13 0.00 1.55 0.00 0.00 64.86 64.69 3h1c h ILE 128 Cb 0.62 2.14 -0.01 0.00 -0.27 0.00 0.00 36.82 39.31 3h1c h ILE 128 CO 0.02 0.28 -0.37 0.58 -1.05 0.00 0.00 178.15 177.60 3h1c h VAL 129 N 0.00 1.29 -0.03 0.16 2.07 -1.73 -1.65 116.25 116.36 3h1c h VAL 129 Ca -0.00 -1.53 -0.16 0.00 0.82 0.00 0.00 66.70 65.83 3h1c h VAL 129 Cb 1.12 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 3h1c h VAL 129 CO 0.04 0.49 -0.71 0.00 0.02 0.00 0.00 177.57 177.41 3h1c h ALA 130 N 1.04 0.75 -0.22 1.67 0.00 -1.39 -1.79 119.26 119.31 3h1c h ALA 130 Ca 0.05 -0.62 -0.16 0.00 0.00 0.00 0.00 54.91 54.18 3h1c h ALA 130 Cb 0.89 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 3h1c h ALA 130 CO 0.08 0.82 -0.53 0.52 0.00 0.00 0.00 179.25 180.14 3h1c h MET 131 N 0.11 0.65 -0.14 0.00 2.07 -1.31 -1.42 114.93 114.89 3h1c h MET 131 Ca -0.02 -0.40 -0.16 0.00 -2.07 0.00 0.00 59.70 57.06 3h1c h MET 131 Cb 1.26 0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 31.03 3h1c h MET 131 CO 0.10 1.01 -0.57 0.82 1.07 0.00 0.00 176.91 179.35 3h1c h ILE 132 N 0.50 1.34 -0.61 -1.22 2.04 -1.34 -2.66 117.51 115.57 3h1c h ILE 132 Ca 0.01 -1.85 0.00 0.00 1.00 0.00 0.00 64.86 64.03 3h1c h ILE 132 Cb 1.09 1.85 -0.03 0.00 -0.74 0.00 0.00 36.82 38.99 3h1c h ILE 132 CO 0.11 0.56 0.39 1.23 0.00 0.00 0.00 178.15 180.44 3h1c h GLY 133 N 1.19 0.86 1.86 5.37 0.00 -1.06 0.30 103.07 111.60 3h1c h GLY 133 Ca 0.00 -0.33 -0.15 0.00 0.00 0.00 0.00 47.33 46.85 3h1c h GLY 133 CO 0.10 0.32 -0.66 0.00 0.00 0.00 0.00 176.54 176.30 3h1c h ALA 134 N 1.21 0.84 -0.36 3.60 0.00 -1.31 -1.96 119.26 121.27 3h1c h ALA 134 Ca 0.22 -0.59 -0.14 0.00 0.00 0.00 0.00 54.91 54.41 3h1c h ALA 134 Cb -0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3h1c h ALA 134 CO -0.05 0.79 -0.32 1.03 0.00 0.00 0.00 179.25 180.70 3h1c h SER 135 N 0.09 0.84 0.28 0.00 0.87 -1.09 -1.97 113.55 112.57 3h1c h SER 135 Ca -0.01 -0.35 -0.23 0.00 -1.23 0.00 0.00 61.79 59.97 3h1c h SER 135 Cb 1.18 -0.23 0.01 0.00 -0.44 0.00 0.00 62.40 62.91 3h1c h SER 135 CO 0.10 1.09 -0.96 0.00 -0.53 0.00 0.00 176.83 176.52 3h1c h ALA 136 N 0.96 0.32 -0.01 6.23 0.00 -0.93 -3.21 119.26 122.63 3h1c h ALA 136 Ca 0.07 -0.71 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 3h1c h ALA 136 Cb 0.86 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3h1c h ALA 136 CO 0.08 0.79 -0.03 0.00 0.00 0.00 0.00 179.25 180.09 3h1c h ALA 137 N 0.68 0.02 0.00 0.00 0.00 -1.34 -2.63 119.26 115.99 3h1c h ALA 137 Ca -0.09 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 3h1c h ALA 137 Cb 1.60 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 3h1c h ALA 137 CO 0.17 -0.16 -0.12 -0.07 0.00 0.00 0.00 179.25 179.07 3h1c h LEU 138 N -0.53 0.00 -0.17 0.00 3.38 -1.50 0.63 115.31 117.12 3h1c h LEU 138 Ca -0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 3h1c h LEU 138 Cb 0.63 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3h1c h LEU 138 CO 0.01 0.12 -0.96 0.28 0.09 0.00 0.00 178.44 177.98 3h1c h SER 139 N 0.00 0.32 0.80 -0.43 0.02 -1.59 -3.25 113.55 109.41 3h1c h SER 139 Ca -0.00 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 3h1c h SER 139 Cb 0.23 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.67 3h1c h SER 139 CO 0.02 1.11 -0.39 0.18 -1.14 0.00 0.00 176.83 176.60 3h1c n LEU 140 N -3.63 0.49 -0.10 5.07 4.77 -0.85 -4.17 117.00 118.58 3h1c n LEU 140 Ca -0.05 0.22 -0.14 0.00 -0.03 0.00 0.00 56.01 56.02 3h1c n LEU 140 Cb 0.86 -0.29 -0.04 0.00 -2.33 0.00 0.00 43.42 41.62 3h1c n LEU 140 CO 0.49 0.02 0.50 -1.28 -1.33 0.00 0.00 177.39 175.80 3h1c h SER 141 N 0.00 0.93 0.00 -1.43 0.87 -0.92 -3.12 113.55 109.87 3h1c h SER 141 Ca 0.00 -0.50 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 3h1c h SER 141 Cb 0.60 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 3h1c h SER 141 CO 0.00 1.24 0.00 0.61 -0.53 0.00 0.00 176.83 178.15 3h1c n GLY 142 N 0.25 3.13 3.69 5.77 0.00 -1.26 -4.78 105.19 111.99 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 -2.71 2.91 -0.61 -0.61 1.01 -1.26 -1.97 121.20 117.95 3h1c s ILE 143 Ca 0.00 0.40 -0.37 0.00 0.00 0.00 0.00 60.65 60.68 3h1c s ILE 143 Cb 0.00 -3.26 -0.18 0.00 0.01 0.00 0.00 42.46 39.03 3h1c s ILE 143 CO 0.00 0.00 2.14 -2.65 0.00 0.00 0.00 174.94 174.43 3h1c n PRO 144 N 5.48 0.00 -3.72 2.79 -0.01 -1.26 -4.89 135.00 133.39 3h1c n PRO 144 Ca 0.16 0.00 -0.16 0.00 -0.01 0.00 0.00 63.50 63.50 3h1c n PRO 144 Cb 0.40 -1.38 -0.15 0.00 -0.01 0.00 0.00 33.50 32.36 3h1c n PRO 144 CO 0.00 0.00 0.00 0.12 -0.01 0.00 0.00 175.50 175.61 3h1c s PHE 145 N 6.42 -0.11 -0.27 6.00 5.36 -1.26 -4.48 117.98 129.64 3h1c s PHE 145 Ca 1.15 0.44 0.02 0.00 -0.96 0.00 0.00 56.93 57.59 3h1c s PHE 145 Cb -1.31 -0.21 0.39 0.00 -0.34 0.00 0.00 43.02 41.56 3h1c s PHE 145 CO 0.56 -0.19 1.53 0.09 -1.46 0.00 0.00 175.22 175.75 3h1c n ASN 146 N 4.68 3.44 -1.22 6.13 3.02 -1.13 -4.88 115.26 125.30 3h1c n ASN 146 Ca -0.17 -2.93 0.00 0.00 -0.03 0.00 0.00 54.58 51.44 3h1c n ASN 146 Cb 0.51 -0.70 0.00 0.00 -0.61 0.00 0.00 39.78 38.98 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 -0.45 1.31 3.92 7.41 0.00 -1.26 -5.00 105.19 111.12 3h1c n GLY 147 Ca 0.35 -1.61 -0.26 0.00 0.00 0.00 0.00 46.02 44.50 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 1.75 2.87 0.21 1.61 0.05 -1.26 -4.94 135.00 135.28 3h1c s PRO 148 Ca 0.00 -0.06 0.06 0.00 0.05 0.00 0.00 61.00 61.05 3h1c s PRO 148 Cb 0.00 -2.28 -0.04 0.00 0.05 0.00 0.00 34.50 32.23 3h1c s PRO 148 CO 0.00 -0.71 0.18 0.96 0.05 0.00 0.00 177.00 177.47 3h1c s ILE 149 N -2.98 4.52 0.22 0.56 -4.36 -1.26 -4.22 121.20 113.68 3h1c s ILE 149 Ca 0.54 -1.22 0.08 0.00 -0.26 0.00 0.00 60.65 59.79 3h1c s ILE 149 Cb -0.11 -3.38 -0.04 0.00 1.25 0.00 0.00 42.46 40.19 3h1c s ILE 149 CO 0.45 -0.23 0.06 -0.83 0.24 0.00 0.00 174.94 174.63 3h1c s GLY 150 N -3.49 1.62 -0.06 6.27 0.00 -0.61 -4.71 107.32 106.33 3h1c s GLY 150 Ca 0.32 -1.46 0.01 0.00 0.00 0.00 0.00 44.72 43.59 3h1c s GLY 150 CO 0.24 -1.50 -0.09 0.00 0.00 0.00 0.00 173.10 171.75 3h1c s ALA 151 N -2.04 1.08 -0.15 3.20 0.00 -1.26 -3.48 121.76 119.11 3h1c s ALA 151 Ca 0.30 -0.31 -0.12 0.00 0.00 0.00 0.00 51.96 51.83 3h1c s ALA 151 Cb -0.08 -0.57 0.04 0.00 0.00 0.00 0.00 23.12 22.52 3h1c s ALA 151 CO 0.21 -0.00 0.39 0.00 0.00 0.00 0.00 175.76 176.36 3h1c s ALA 152 N 0.90 -0.97 -0.16 0.00 0.00 -1.14 -4.88 121.76 115.51 3h1c s ALA 152 Ca -0.11 1.20 -0.12 0.00 0.00 0.00 0.00 51.96 52.93 3h1c s ALA 152 Cb -0.15 -0.71 -0.05 0.00 0.00 0.00 0.00 23.12 22.21 3h1c s ALA 152 CO 0.01 -0.20 0.24 0.50 0.00 0.00 0.00 175.76 176.31 3h1c s ARG 153 N 0.55 4.14 -0.12 0.00 3.52 -1.26 -1.64 118.95 124.14 3h1c s ARG 153 Ca -0.03 0.01 -0.09 0.00 -0.13 0.00 0.00 55.73 55.49 3h1c s ARG 153 Cb -0.04 -3.39 -0.03 0.00 -1.56 0.00 0.00 34.95 29.93 3h1c s ARG 153 CO -0.03 0.33 -0.18 0.28 -0.81 0.00 0.00 175.30 174.89 3h1c n VAL 154 N 3.31 1.16 -0.71 7.11 0.31 -0.98 -0.16 118.33 128.36 3h1c n VAL 154 Ca -0.14 0.26 0.10 0.00 -0.01 0.00 0.00 64.34 64.55 3h1c n VAL 154 Cb 0.52 -2.21 -0.03 0.00 -0.91 0.00 0.00 33.84 31.21 3h1c n VAL 154 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h1c n GLY 155 N 1.60 -1.81 3.10 2.92 0.00 -1.26 -3.31 105.19 106.43 3h1c n GLY 155 Ca -0.07 -1.33 0.01 0.00 0.00 0.00 0.00 46.02 44.63 3h1c n GLY 155 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3h1c s TYR 156 N -1.94 -1.54 -0.09 1.61 5.04 -1.25 -4.47 117.35 114.72 3h1c s TYR 156 Ca 0.00 1.30 0.01 0.00 -2.44 0.00 0.00 57.07 55.94 3h1c s TYR 156 Cb 0.00 0.36 0.02 0.00 0.35 0.00 0.00 41.96 42.69 3h1c s TYR 156 CO 0.00 -0.93 -0.11 0.42 -1.34 0.00 0.00 175.55 173.58 3h1c s ILE 157 N 2.78 1.16 -1.30 3.14 1.01 -0.61 -1.78 121.20 125.61 3h1c s ILE 157 Ca 0.16 -0.45 -0.02 0.00 0.00 0.00 0.00 60.65 60.34 3h1c s ILE 157 Cb -0.13 -1.09 -0.00 0.00 0.01 0.00 0.00 42.46 41.24 3h1c s ILE 157 CO -0.23 0.37 0.67 0.59 0.00 0.00 0.00 174.94 176.35 3h1c n ASN 158 N 4.18 -1.49 -2.07 3.58 3.02 -1.26 -1.72 115.26 119.51 3h1c n ASN 158 Ca -0.20 -0.85 -0.18 0.00 -0.03 0.00 0.00 54.58 53.32 3h1c n ASN 158 Cb 0.51 -3.92 -0.03 0.00 -0.61 0.00 0.00 39.78 35.73 3h1c n ASN 158 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3h1c n ASP 159 N -3.03 -5.06 -4.21 6.41 8.00 -1.26 -4.97 116.55 112.44 3h1c n ASP 159 Ca -0.28 0.20 -0.12 0.00 0.71 0.00 0.00 54.79 55.30 3h1c n ASP 159 Cb 0.67 -4.34 -0.10 0.00 -0.02 0.00 0.00 41.12 37.33 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 -4.46 1.04 -0.08 -1.24 -1.52 -0.70 -5.16 119.66 107.53 3h1c s GLN 160 Ca 0.00 -1.50 -0.02 0.00 -1.95 0.00 0.00 55.36 51.89 3h1c s GLN 160 Cb 0.00 -0.05 -0.03 0.00 -0.22 0.00 0.00 33.01 32.70 3h1c s GLN 160 CO 0.00 -0.19 -0.00 0.71 -0.25 0.00 0.00 175.29 175.56 3h1c s TYR 161 N -3.82 3.15 -0.12 0.91 1.51 -1.26 -1.57 117.35 116.14 3h1c s TYR 161 Ca 0.24 0.18 -0.01 0.00 -1.01 0.00 0.00 57.07 56.48 3h1c s TYR 161 Cb 0.07 -1.78 0.04 0.00 -0.11 0.00 0.00 41.96 40.17 3h1c s TYR 161 CO 0.03 0.46 -0.02 0.14 -1.11 0.00 0.00 175.55 175.06 3h1c s VAL 162 N -0.89 0.64 0.06 0.71 -7.23 -1.21 -4.99 120.40 107.50 3h1c s VAL 162 Ca 0.13 -0.20 -0.30 0.00 -1.81 0.00 0.00 61.98 59.80 3h1c s VAL 162 Cb -0.11 -0.84 -0.09 0.00 0.56 0.00 0.00 36.38 35.90 3h1c s VAL 162 CO 0.02 0.17 1.86 -0.22 -0.31 0.00 0.00 175.10 176.62 3h1c s LEU 163 N 1.85 4.40 -0.56 1.32 2.96 -1.26 -3.80 118.68 123.59 3h1c s LEU 163 Ca 0.03 2.65 -0.21 0.00 -0.22 0.00 0.00 54.13 56.38 3h1c s LEU 163 Cb -0.14 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.04 3h1c s LEU 163 CO -0.07 -1.01 0.64 0.59 -1.32 0.00 0.00 176.35 175.19 3h1c n ASN 164 N 6.62 -6.31 -4.77 3.68 3.02 0.77 -4.83 115.26 113.45 3h1c n ASN 164 Ca 0.18 -0.12 -0.39 0.00 -0.03 0.00 0.00 54.58 54.23 3h1c n ASN 164 Cb 0.40 -3.11 -0.01 0.00 -0.61 0.00 0.00 39.78 36.45 3h1c n ASN 164 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3h1c s PRO 165 N -3.05 4.00 0.96 3.52 0.04 -1.25 -5.00 135.00 134.22 3h1c s PRO 165 Ca 0.23 1.94 -0.13 0.00 0.04 0.00 0.00 61.00 63.08 3h1c s PRO 165 Cb -0.04 -2.69 0.17 0.00 0.04 0.00 0.00 34.50 31.98 3h1c s PRO 165 CO 0.84 -0.40 1.15 0.95 0.04 0.00 0.00 177.00 179.58 3h1c s THR 166 N -1.36 1.95 0.44 1.26 -4.23 -1.26 -4.78 115.64 107.67 3h1c s THR 166 Ca 0.57 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 61.22 3h1c s THR 166 Cb -0.33 -2.72 0.19 0.00 1.34 0.00 0.00 72.50 70.98 3h1c s THR 166 CO 0.42 0.00 2.00 -0.61 -0.54 0.00 0.00 174.62 175.89 3h1c h GLN 167 N -1.68 0.06 0.08 3.99 5.75 -1.78 0.06 115.11 121.59 3h1c h GLN 167 Ca -0.50 -0.01 -0.25 0.00 -0.15 0.00 0.00 58.65 57.74 3h1c h GLN 167 Cb 1.32 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.86 3h1c h GLN 167 CO 0.56 0.20 -1.12 -0.44 -2.65 0.00 0.00 178.83 175.37 3h1c h ASP 168 N 0.05 0.37 1.70 -0.69 3.32 -1.90 -3.29 116.42 115.98 3h1c h ASP 168 Ca 0.01 -0.36 0.00 0.00 0.02 0.00 0.00 57.03 56.70 3h1c h ASP 168 Cb 0.28 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3h1c h ASP 168 CO 0.02 1.25 0.00 -0.33 -1.72 0.00 0.00 179.24 178.46 3h1c h GLU 169 N 0.09 0.00 0.00 3.56 5.08 -1.76 -3.26 114.58 118.28 3h1c h GLU 169 Ca -0.10 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 3h1c h GLU 169 Cb 1.83 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.07 3h1c h GLU 169 CO 0.18 0.00 -0.43 1.25 -1.00 0.00 0.00 179.01 179.01 3h1c h LEU 170 N 0.00 0.00 -0.88 1.33 5.85 -1.07 -2.84 115.31 117.70 3h1c h LEU 170 Ca 0.00 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 3h1c h LEU 170 Cb 0.85 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 3h1c h LEU 170 CO 0.00 0.43 -0.32 0.11 -0.34 0.00 0.00 178.44 178.32 3h1c h LYS 171 N 0.00 0.44 0.00 1.25 1.57 -1.70 -2.84 116.57 115.29 3h1c h LYS 171 Ca -0.00 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 3h1c h LYS 171 Cb 0.92 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.22 3h1c h LYS 171 CO 0.06 0.72 -0.37 0.93 -0.57 0.00 0.00 179.45 180.21 3h1c h GLU 172 N 0.38 0.00 -6.98 3.15 4.39 -1.72 -3.47 114.58 110.33 3h1c h GLU 172 Ca 0.05 0.00 -0.48 0.00 0.34 0.00 0.00 59.36 59.27 3h1c h GLU 172 Cb 0.75 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.41 3h1c h GLU 172 CO 0.06 0.00 0.40 0.45 -1.16 0.00 0.00 179.01 178.75 3h1c s SER 173 N -5.16 6.76 0.00 1.42 0.15 -1.07 -4.87 113.70 110.93 3h1c s SER 173 Ca 0.06 1.97 0.22 0.00 0.70 0.00 0.00 55.95 58.90 3h1c s SER 173 Cb 0.10 -2.58 -0.03 0.00 -1.71 0.00 0.00 66.02 61.80 3h1c s SER 173 CO 0.69 -0.48 1.04 0.29 1.20 0.00 0.00 173.24 175.98 3h1c n LYS 174 N -0.20 1.16 -4.16 5.44 4.01 -0.73 -4.95 118.16 118.73 3h1c n LYS 174 Ca 0.06 -0.89 -0.16 0.00 -0.51 0.00 0.00 58.31 56.81 3h1c n LYS 174 Cb 0.50 -1.46 -0.13 0.00 -0.51 0.00 0.00 35.03 33.44 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 -2.48 2.18 -0.30 -0.35 2.96 -1.26 -0.77 118.68 118.65 3h1c s LEU 175 Ca 0.17 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.66 3h1c s LEU 175 Cb 0.17 -0.31 0.14 0.00 0.50 0.00 0.00 46.19 46.70 3h1c s LEU 175 CO 0.58 -0.08 0.33 -0.62 -1.32 0.00 0.00 176.35 175.24 3h1c s ASP 176 N -1.14 1.40 0.03 3.68 2.15 0.79 -3.88 116.67 119.71 3h1c s ASP 176 Ca -0.04 -0.85 0.04 0.00 0.43 0.00 0.00 52.55 52.13 3h1c s ASP 176 Cb -0.08 0.60 -0.02 0.00 -0.30 0.00 0.00 42.92 43.13 3h1c s ASP 176 CO 0.01 -0.36 -0.11 -1.48 -0.17 0.00 0.00 175.17 173.06 3h1c s LEU 177 N 2.22 2.18 -0.22 -1.34 0.05 -1.26 -0.47 118.68 119.84 3h1c s LEU 177 Ca 0.11 -0.43 -0.01 0.00 0.05 0.00 0.00 54.13 53.84 3h1c s LEU 177 Cb -0.14 -0.41 0.02 0.00 -2.05 0.00 0.00 46.19 43.61 3h1c s LEU 177 CO -0.27 -0.04 -0.10 -0.69 -0.55 0.00 0.00 176.35 174.70 3h1c s VAL 178 N -0.91 2.73 -0.12 1.48 1.01 0.53 -2.32 120.40 122.80 3h1c s VAL 178 Ca -0.02 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.05 3h1c s VAL 178 Cb -0.08 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 3h1c s VAL 178 CO 0.01 0.35 -0.01 0.54 0.00 0.00 0.00 175.10 175.99 3h1c s VAL 179 N 1.35 4.14 -0.03 2.92 0.11 -0.65 -1.90 120.40 126.34 3h1c s VAL 179 Ca 0.03 -0.29 0.03 0.00 -2.93 0.00 0.00 61.98 58.82 3h1c s VAL 179 Cb -0.15 -2.78 0.00 0.00 -1.53 0.00 0.00 36.38 31.92 3h1c s VAL 179 CO -0.07 0.54 -0.11 0.00 -3.33 0.00 0.00 175.10 172.14 3h1c s ALA 180 N -0.24 1.04 -0.15 1.54 0.00 -0.85 -2.86 121.76 120.22 3h1c s ALA 180 Ca 0.05 -0.41 -0.34 0.00 0.00 0.00 0.00 51.96 51.26 3h1c s ALA 180 Cb -0.13 -0.38 0.13 0.00 0.00 0.00 0.00 23.12 22.74 3h1c s ALA 180 CO 0.02 0.16 1.21 0.20 0.00 0.00 0.00 175.76 177.35 3h1c s GLY 181 N 0.22 -0.32 0.17 0.00 0.00 -1.23 -0.69 107.32 105.47 3h1c s GLY 181 Ca -0.04 1.43 -0.03 0.00 0.00 0.00 0.00 44.72 46.08 3h1c s GLY 181 CO 0.01 0.46 0.23 -1.30 0.00 0.00 0.00 173.10 172.49 3h1c n THR 182 N -0.16 0.00 0.11 0.90 -2.24 0.21 -1.58 114.28 111.53 3h1c n THR 182 Ca -0.01 -0.18 -0.00 0.00 -2.27 0.00 0.00 64.05 61.58 3h1c n THR 182 Cb 0.59 -1.84 0.28 0.00 -2.10 0.00 0.00 70.33 67.26 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 0.20 0.02 -0.78 4.81 -1.93 -3.33 114.58 113.57 3h1c h GLU 183 Ca -0.07 -0.08 -0.16 0.00 -0.13 0.00 0.00 59.36 58.92 3h1c h GLU 183 Cb 0.21 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3h1c h GLU 183 CO 0.05 0.53 -0.84 0.00 -0.73 0.00 0.00 179.01 178.02 3h1c h ALA 184 N 1.47 0.16 -2.59 2.92 0.00 -1.95 -3.50 119.26 115.78 3h1c h ALA 184 Ca 0.02 -0.94 -0.10 0.00 0.00 0.00 0.00 54.91 53.89 3h1c h ALA 184 Cb 0.70 0.44 -0.13 0.00 0.00 0.00 0.00 17.79 18.79 3h1c h ALA 184 CO 0.05 0.47 -0.35 0.00 0.00 0.00 0.00 179.25 179.43 3h1c s ALA 185 N -2.33 -0.05 0.59 0.00 0.00 -1.25 -4.85 121.76 113.87 3h1c s ALA 185 Ca -0.24 -0.81 -0.14 0.00 0.00 0.00 0.00 51.96 50.77 3h1c s ALA 185 Cb 0.02 0.73 -0.05 0.00 0.00 0.00 0.00 23.12 23.83 3h1c s ALA 185 CO 0.65 -0.59 1.02 0.08 0.00 0.00 0.00 175.76 176.93 3h1c s VAL 186 N -3.93 4.35 0.00 0.00 1.01 -1.26 -0.62 120.40 119.95 3h1c s VAL 186 Ca 0.13 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.07 3h1c s VAL 186 Cb 0.04 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.78 3h1c s VAL 186 CO -0.04 -0.81 0.00 0.18 0.00 0.00 0.00 175.10 174.44 3h1c n LEU 187 N -2.25 0.38 -4.32 3.92 4.77 0.04 -4.82 117.00 114.73 3h1c n LEU 187 Ca 0.07 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.88 3h1c n LEU 187 Cb 0.54 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.52 3h1c n LEU 187 CO 0.51 -0.14 -0.25 -0.32 -1.33 0.00 0.00 177.39 175.86 3h1c s MET 188 N -1.74 1.42 -0.30 3.23 0.00 0.13 -0.78 119.30 121.27 3h1c s MET 188 Ca 0.00 -1.77 -0.12 0.00 0.00 0.00 0.00 55.69 53.80 3h1c s MET 188 Cb 0.00 -0.28 0.13 0.00 0.00 0.00 0.00 34.83 34.68 3h1c s MET 188 CO 0.00 -0.29 0.74 0.08 0.00 0.00 0.00 175.02 175.55 3h1c s VAL 189 N -3.74 -0.75 -0.17 10.11 1.01 -0.23 -2.01 120.40 124.62 3h1c s VAL 189 Ca 0.38 0.00 -0.00 0.00 0.00 0.00 0.00 61.98 62.36 3h1c s VAL 189 Cb 0.08 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.46 3h1c s VAL 189 CO 0.14 0.00 -0.15 -0.70 0.00 0.00 0.00 175.10 174.39 3h1c s GLU 190 N 2.61 3.17 0.08 2.72 2.56 -0.80 -1.43 118.70 127.63 3h1c s GLU 190 Ca -0.06 -0.75 0.01 0.00 0.00 0.00 0.00 54.97 54.17 3h1c s GLU 190 Cb -0.10 -2.67 -0.04 0.00 2.00 0.00 0.00 34.13 33.33 3h1c s GLU 190 CO -0.19 -0.08 -0.06 -1.54 -0.56 0.00 0.00 175.26 172.83 3h1c s SER 191 N 1.05 1.01 -0.10 -1.70 1.04 -1.09 -0.34 113.70 113.57 3h1c s SER 191 Ca -0.01 -0.95 -0.04 0.00 0.48 0.00 0.00 55.95 55.43 3h1c s SER 191 Cb -0.15 0.10 0.05 0.00 0.10 0.00 0.00 66.02 66.13 3h1c s SER 191 CO -0.04 -0.46 0.20 -0.70 0.98 0.00 0.00 173.24 173.22 3h1c s GLU 192 N -3.59 0.10 0.09 4.02 2.12 0.38 -4.05 118.70 117.77 3h1c s GLU 192 Ca 0.09 0.57 0.05 0.00 0.36 0.00 0.00 54.97 56.04 3h1c s GLU 192 Cb 0.04 -0.17 -0.03 0.00 0.26 0.00 0.00 34.13 34.23 3h1c s GLU 192 CO -0.05 -0.25 -0.13 0.00 -0.54 0.00 0.00 175.26 174.29 3h1c s ALA 193 N 1.95 1.21 -1.10 6.30 0.00 0.65 -0.15 121.76 130.62 3h1c s ALA 193 Ca -0.02 -1.10 -0.04 0.00 0.00 0.00 0.00 51.96 50.80 3h1c s ALA 193 Cb -0.12 -0.06 0.29 0.00 0.00 0.00 0.00 23.12 23.24 3h1c s ALA 193 CO -0.07 0.10 1.60 1.04 0.00 0.00 0.00 175.76 178.43 3h1c n GLN 194 N 0.95 4.55 -2.96 0.00 6.02 0.05 -4.37 117.38 121.62 3h1c n GLN 194 Ca -0.19 -4.44 -0.10 0.00 -0.01 0.00 0.00 57.00 52.25 3h1c n GLN 194 Cb 0.56 -2.55 0.01 0.00 1.02 0.00 0.00 30.24 29.28 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 1.37 -7.14 -4.53 1.08 4.32 -1.14 -4.99 117.00 105.96 3h1c n LEU 195 Ca 0.31 0.35 -0.29 0.00 -0.02 0.00 0.00 56.01 56.36 3h1c n LEU 195 Cb 0.32 -3.18 -0.10 0.00 -1.62 0.00 0.00 43.42 38.83 3h1c n LEU 195 CO 0.71 -1.90 -0.45 -0.76 -1.22 0.00 0.00 177.39 173.76 3h1c s LEU 196 N -2.84 2.87 0.84 2.23 1.02 -1.00 -4.61 118.68 117.19 3h1c s LEU 196 Ca 0.22 -0.49 -0.11 0.00 0.02 0.00 0.00 54.13 53.77 3h1c s LEU 196 Cb -0.06 -1.68 0.10 0.00 0.02 0.00 0.00 46.19 44.57 3h1c s LEU 196 CO 0.78 0.17 1.09 -0.94 0.02 0.00 0.00 176.35 177.47 3h1c s SER 197 N -2.25 4.01 0.25 2.29 1.04 -1.26 -0.19 113.70 117.59 3h1c s SER 197 Ca 0.20 1.44 -0.05 0.00 0.48 0.00 0.00 55.95 58.03 3h1c s SER 197 Cb -0.11 -2.15 0.28 0.00 0.10 0.00 0.00 66.02 64.15 3h1c s SER 197 CO 0.12 -2.29 1.83 -0.33 0.98 0.00 0.00 173.24 173.55 3h1c h GLU 198 N -1.31 1.06 -0.36 4.02 3.07 -1.96 -1.17 114.58 117.93 3h1c h GLU 198 Ca -0.48 -0.18 -0.12 0.00 -0.50 0.00 0.00 59.36 58.08 3h1c h GLU 198 Cb 1.27 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.99 3h1c h GLU 198 CO 0.56 0.86 -0.27 -0.44 -1.40 0.00 0.00 179.01 178.32 3h1c h ASP 199 N 1.04 0.76 0.65 1.42 3.32 -1.99 -1.10 116.42 120.53 3h1c h ASP 199 Ca 0.24 -0.29 -0.20 0.00 0.02 0.00 0.00 57.03 56.81 3h1c h ASP 199 Cb 0.19 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3h1c h ASP 199 CO -0.02 0.99 -0.88 1.56 -1.72 0.00 0.00 179.24 179.17 3h1c h GLN 200 N 0.64 0.15 -0.02 3.56 4.20 -1.90 -2.08 115.11 119.66 3h1c h GLN 200 Ca 0.08 -0.17 -0.23 0.00 0.06 0.00 0.00 58.65 58.39 3h1c h GLN 200 Cb 0.78 0.05 0.01 0.00 0.30 0.00 0.00 27.48 28.62 3h1c h GLN 200 CO 0.06 0.94 -0.92 1.98 -0.67 0.00 0.00 178.83 180.22 3h1c h MET 201 N 0.08 0.50 -0.08 1.46 4.05 -1.13 -2.82 114.93 117.00 3h1c h MET 201 Ca -0.04 -0.51 -0.24 0.00 -0.28 0.00 0.00 59.70 58.63 3h1c h MET 201 Cb 1.52 0.14 0.01 0.00 -0.80 0.00 0.00 31.60 32.47 3h1c h MET 201 CO 0.13 1.15 -0.88 1.25 0.23 0.00 0.00 176.91 178.79 3h1c h LEU 202 N 0.30 0.85 -1.83 3.39 5.85 -1.26 -3.19 115.31 119.42 3h1c h LEU 202 Ca -0.08 -0.61 -0.02 0.00 0.84 0.00 0.00 57.88 58.01 3h1c h LEU 202 Cb 1.56 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 42.33 3h1c h LEU 202 CO 0.17 1.41 -0.08 1.23 -0.34 0.00 0.00 178.44 180.83 3h1c h GLY 203 N 0.64 0.00 1.32 3.75 0.00 -1.43 -2.73 103.07 104.62 3h1c h GLY 203 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.03 3h1c h GLY 203 CO 0.17 0.00 -0.84 0.00 0.00 0.00 0.00 176.54 175.87 3h1c h ALA 204 N 1.92 0.34 -0.50 3.60 0.00 -1.49 -2.13 119.26 121.01 3h1c h ALA 204 Ca -0.00 -0.63 -0.10 0.00 0.00 0.00 0.00 54.91 54.18 3h1c h ALA 204 Cb 0.40 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3h1c h ALA 204 CO 0.01 0.72 -0.08 0.28 0.00 0.00 0.00 179.25 180.17 3h1c h VAL 205 N 0.42 1.26 -0.32 0.00 2.07 -1.50 -2.57 116.25 115.61 3h1c h VAL 205 Ca -0.07 -1.19 -0.14 0.00 0.82 0.00 0.00 66.70 66.12 3h1c h VAL 205 Cb 1.46 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 32.19 3h1c h VAL 205 CO 0.16 0.42 -0.35 0.58 0.02 0.00 0.00 177.57 178.40 3h1c h VAL 206 N 0.82 1.29 0.09 2.57 2.07 -1.54 -2.78 116.25 118.77 3h1c h VAL 206 Ca 0.14 -1.52 0.01 0.00 0.82 0.00 0.00 66.70 66.14 3h1c h VAL 206 Cb 0.60 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 3h1c h VAL 206 CO 0.04 0.50 -0.11 0.15 0.02 0.00 0.00 177.57 178.16 3h1c h PHE 207 N 0.57 -0.29 -0.13 1.57 3.57 -1.29 -1.89 116.94 119.05 3h1c h PHE 207 Ca 0.05 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.49 3h1c h PHE 207 Cb 0.93 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 3h1c h PHE 207 CO 0.07 -0.17 -0.21 0.78 -2.23 0.00 0.00 178.31 176.55 3h1c h GLY 208 N -0.24 0.24 1.73 2.40 0.00 -1.53 -2.12 103.07 103.55 3h1c h GLY 208 Ca 0.01 -0.17 -0.14 0.00 0.00 0.00 0.00 47.33 47.03 3h1c h GLY 208 CO -0.05 0.15 -0.58 0.84 0.00 0.00 0.00 176.54 176.90 3h1c h HIS 209 N 0.21 0.36 -0.01 5.60 -0.00 -1.32 -2.49 115.15 117.50 3h1c h HIS 209 Ca 0.04 -0.13 -0.20 0.00 -0.00 0.00 0.00 60.37 60.08 3h1c h HIS 209 Cb 0.49 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.83 3h1c h HIS 209 CO 0.01 0.79 -0.85 0.93 -0.00 0.00 0.00 177.93 178.81 3h1c h GLU 210 N 0.21 0.26 0.00 5.26 5.08 -1.02 -3.29 114.58 121.08 3h1c h GLU 210 Ca -0.00 -0.27 -0.12 0.00 -1.00 0.00 0.00 59.36 57.97 3h1c h GLU 210 Cb 1.08 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.38 3h1c h GLU 210 CO 0.09 0.97 -0.56 1.96 -1.00 0.00 0.00 179.01 180.47 3h1c h GLN 211 N 0.15 0.00 -0.03 2.33 1.08 -1.37 -3.19 115.11 114.09 3h1c h GLN 211 Ca -0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 3h1c h GLN 211 Cb 1.47 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.90 3h1c h GLN 211 CO 0.14 0.56 0.00 0.00 -0.95 0.00 0.00 178.83 178.58 3h1c n GLN 212 N -3.30 1.32 0.14 1.46 10.64 -0.94 -3.93 117.38 122.77 3h1c n GLN 212 Ca 0.01 -0.47 0.01 0.00 -1.83 0.00 0.00 57.00 54.72 3h1c n GLN 212 Cb 0.73 -1.45 0.33 0.00 -0.86 0.00 0.00 30.24 28.99 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 1.10 0.15 0.00 2.61 1.08 -1.62 -2.73 115.11 115.70 3h1c h GLN 213 Ca 0.00 -0.05 -0.08 0.00 -1.45 0.00 0.00 58.65 57.07 3h1c h GLN 213 Cb 0.24 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 3h1c h GLN 213 CO 0.00 0.44 -0.39 -0.24 -0.95 0.00 0.00 178.83 177.69 3h1c h VAL 214 N 0.14 1.05 -0.23 -0.54 3.04 -1.82 -2.35 116.25 115.54 3h1c h VAL 214 Ca 0.02 -1.44 -0.09 0.00 -1.01 0.00 0.00 66.70 64.18 3h1c h VAL 214 Cb 0.59 1.83 -0.00 0.00 -2.01 0.00 0.00 31.29 31.70 3h1c h VAL 214 CO 0.04 0.38 -0.20 0.58 -1.01 0.00 0.00 177.57 177.36 3h1c h VAL 215 N 0.00 1.32 -0.72 1.51 2.07 -1.75 -2.63 116.25 116.05 3h1c h VAL 215 Ca -0.00 -1.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.12 3h1c h VAL 215 Cb 0.80 1.67 -0.03 0.00 -1.52 0.00 0.00 31.29 32.21 3h1c h VAL 215 CO 0.05 0.42 0.24 0.40 0.02 0.00 0.00 177.57 178.70 3h1c h ILE 216 N 0.25 1.25 -0.45 4.57 2.04 -1.43 -2.15 117.51 121.60 3h1c h ILE 216 Ca 0.04 -0.86 -0.10 0.00 1.00 0.00 0.00 64.86 64.95 3h1c h ILE 216 Cb 0.74 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 3h1c h ILE 216 CO 0.05 0.34 -0.11 1.56 0.00 0.00 0.00 178.15 179.99 3h1c h GLN 217 N 1.06 0.81 0.00 2.37 4.20 -1.43 -2.08 115.11 120.04 3h1c h GLN 217 Ca 0.24 -0.27 -0.12 0.00 0.06 0.00 0.00 58.65 58.55 3h1c h GLN 217 Cb 0.27 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 3h1c h GLN 217 CO -0.01 0.89 -0.58 -0.91 -0.67 0.00 0.00 178.83 177.55 3h1c h ASN 218 N 0.73 0.00 -0.08 1.46 2.35 -1.27 -2.92 115.58 115.85 3h1c h ASN 218 Ca 0.12 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.73 3h1c h ASN 218 Cb 0.60 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.98 3h1c h ASN 218 CO 0.04 0.58 -0.49 0.40 -1.65 0.00 0.00 177.43 176.31 3h1c h ILE 219 N 0.00 1.38 -0.66 2.81 2.04 -1.31 -3.17 117.51 118.60 3h1c h ILE 219 Ca -0.01 -1.85 0.05 0.00 1.00 0.00 0.00 64.86 64.05 3h1c h ILE 219 Cb 1.27 2.28 -0.04 0.00 -0.74 0.00 0.00 36.82 39.59 3h1c h ILE 219 CO 0.08 0.55 0.44 0.78 0.00 0.00 0.00 178.15 179.99 3h1c h ASN 220 N 0.04 0.63 0.73 1.72 2.35 -1.38 -1.57 115.58 118.10 3h1c h ASN 220 Ca -0.04 -0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.61 3h1c h ASN 220 Cb 1.15 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 39.36 3h1c h ASN 220 CO 0.10 0.42 -0.49 -0.33 -1.65 0.00 0.00 177.43 175.48 3h1c h GLU 221 N 0.72 0.00 0.01 0.81 4.39 -1.59 -2.68 114.58 116.24 3h1c h GLU 221 Ca 0.28 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.78 3h1c h GLU 221 Cb 0.18 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 3h1c h GLU 221 CO -0.08 0.49 -0.90 1.25 -1.16 0.00 0.00 179.01 178.60 3h1c h LEU 222 N 0.00 0.21 -0.69 1.33 6.46 -1.29 -2.88 115.31 118.46 3h1c h LEU 222 Ca -0.00 -0.18 -0.12 0.00 -0.12 0.00 0.00 57.88 57.46 3h1c h LEU 222 Cb 0.99 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.84 3h1c h LEU 222 CO 0.06 1.00 -0.25 0.58 -0.62 0.00 0.00 178.44 179.21 3h1c h VAL 223 N 0.08 1.27 0.00 1.05 2.07 -1.25 0.28 116.25 119.75 3h1c h VAL 223 Ca -0.04 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 66.11 3h1c h VAL 223 Cb 1.55 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 3h1c h VAL 223 CO 0.13 0.45 0.00 0.29 0.02 0.00 0.00 177.57 178.47 3h1c n LYS 224 N -4.10 0.18 -0.10 1.57 5.02 -1.02 -2.12 118.16 117.59 3h1c n LYS 224 Ca -0.00 0.29 -0.20 0.00 -2.02 0.00 0.00 58.31 56.38 3h1c n LYS 224 Cb 0.45 -1.77 -0.08 0.00 -0.02 0.00 0.00 35.03 33.61 3h1c n LYS 224 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3h1c n GLU 225 N -2.10 0.45 -1.81 1.97 2.13 -1.02 -4.81 120.64 115.45 3h1c n GLU 225 Ca 0.04 0.17 -0.02 0.00 0.66 0.00 0.00 57.16 58.01 3h1c n GLU 225 Cb 0.31 -1.27 0.07 0.00 0.27 0.00 0.00 31.44 30.81 3h1c n GLU 225 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3h1c n ALA 226 N -3.67 3.18 -2.61 4.31 0.00 0.95 -5.08 120.51 117.59 3h1c n ALA 226 Ca -0.38 -2.92 -0.38 0.00 0.00 0.00 0.00 53.44 49.75 3h1c n ALA 226 Cb 0.81 -0.63 -0.06 0.00 0.00 0.00 0.00 19.45 19.57 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 -3.08 2.39 0.36 0.00 0.00 -0.90 -4.89 107.32 101.20 3h1c s GLY 227 Ca 0.36 -0.30 -0.27 0.00 0.00 0.00 0.00 44.72 44.51 3h1c s GLY 227 CO -0.07 0.23 1.16 0.54 0.00 0.00 0.00 173.10 174.96 3h1c s LYS 228 N -0.56 4.27 0.20 2.90 1.02 -1.18 -4.96 119.74 121.43 3h1c s LYS 228 Ca 0.22 1.85 -0.32 0.00 0.02 0.00 0.00 55.97 57.74 3h1c s LYS 228 Cb -0.15 -2.86 -0.15 0.00 -0.52 0.00 0.00 37.83 34.15 3h1c s LYS 228 CO 0.10 -0.14 1.26 -2.30 -0.92 0.00 0.00 175.35 173.36 3h1c n PRO 229 N 0.47 1.53 -2.15 -1.68 -0.02 -1.26 -4.42 135.00 127.47 3h1c n PRO 229 Ca 0.02 0.54 -0.36 0.00 -2.02 0.00 0.00 63.50 61.69 3h1c n PRO 229 Cb 0.46 -2.10 0.01 0.00 -0.02 0.00 0.00 33.50 31.85 3h1c n PRO 229 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3h1c s ARG 230 N -0.42 3.23 0.25 -0.52 1.81 -1.26 -4.73 118.95 117.31 3h1c s ARG 230 Ca 0.71 1.73 -0.30 0.00 -1.72 0.00 0.00 55.73 56.15 3h1c s ARG 230 Cb -0.76 -2.02 -0.09 0.00 -0.45 0.00 0.00 34.95 31.63 3h1c s ARG 230 CO 0.51 -0.98 1.25 -1.58 -0.68 0.00 0.00 175.30 173.83 3h1c s TRP 231 N -1.66 3.29 -1.38 -0.53 0.52 -0.83 -4.91 118.94 113.44 3h1c s TRP 231 Ca 0.74 1.40 -0.14 0.00 0.02 0.00 0.00 56.10 58.12 3h1c s TRP 231 Cb -0.27 -3.53 0.08 0.00 -1.15 0.00 0.00 33.47 28.59 3h1c s TRP 231 CO 0.31 -1.50 2.01 -3.47 0.02 0.00 0.00 176.95 174.31 3h1c n ASP 232 N 1.81 4.41 -4.33 2.95 2.03 -1.26 -4.90 116.55 117.25 3h1c n ASP 232 Ca 0.03 -2.91 -0.32 0.00 0.52 0.00 0.00 54.79 52.11 3h1c n ASP 232 Cb 0.43 -1.65 -0.15 0.00 -0.72 0.00 0.00 41.12 39.03 3h1c n ASP 232 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 3h1c s TRP 233 N 2.88 2.55 -0.01 -0.67 -0.00 -1.26 -5.13 118.94 117.29 3h1c s TRP 233 Ca 0.47 -0.56 0.02 0.00 -0.00 0.00 0.00 56.10 56.03 3h1c s TRP 233 Cb 0.10 -1.64 -0.00 0.00 -0.00 0.00 0.00 33.47 31.93 3h1c s TRP 233 CO -0.03 -0.11 -0.07 -0.65 -0.00 0.00 0.00 176.95 176.08 3h1c s GLN 234 N -0.24 0.69 0.80 5.86 -0.21 -1.26 -5.12 119.66 120.18 3h1c s GLN 234 Ca -0.00 -0.25 -0.11 0.00 0.02 0.00 0.00 55.36 55.01 3h1c s GLN 234 Cb -0.13 -0.67 0.08 0.00 1.00 0.00 0.00 33.01 33.28 3h1c s GLN 234 CO 0.03 0.12 1.12 -1.25 -2.12 0.00 0.00 175.29 173.20 3h1c s PRO 235 N 0.02 1.91 0.19 2.91 0.04 -1.26 -4.94 135.00 133.87 3h1c s PRO 235 Ca 0.00 1.38 -0.33 0.00 0.04 0.00 0.00 61.00 62.10 3h1c s PRO 235 Cb -0.05 -1.84 -0.12 0.00 0.04 0.00 0.00 34.50 32.52 3h1c s PRO 235 CO -0.00 -1.94 1.69 0.39 0.04 0.00 0.00 177.00 177.19 3h1c n GLU 236 N -3.53 2.61 -1.68 4.56 1.02 -1.26 -4.89 120.64 117.46 3h1c n GLU 236 Ca 0.11 0.94 -0.42 0.00 -0.02 0.00 0.00 57.16 57.76 3h1c n GLU 236 Cb 0.52 -2.77 -0.03 0.00 -0.02 0.00 0.00 31.44 29.14 3h1c n GLU 236 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3h1c s PRO 237 N 1.23 3.95 -0.21 3.49 0.04 -1.26 -4.93 135.00 137.32 3h1c s PRO 237 Ca 0.77 2.47 -0.29 0.00 0.04 0.00 0.00 61.00 63.99 3h1c s PRO 237 Cb -0.55 -4.19 -0.01 0.00 0.04 0.00 0.00 34.50 29.78 3h1c s PRO 237 CO 0.34 -1.17 1.31 0.54 0.04 0.00 0.00 177.00 178.07 3h1c s VAL 238 N 5.16 4.17 -0.09 -0.36 0.11 -1.26 -5.02 120.40 123.11 3h1c s VAL 238 Ca 0.90 1.39 -0.00 0.00 -2.93 0.00 0.00 61.98 61.33 3h1c s VAL 238 Cb -0.40 -4.01 -0.03 0.00 -1.53 0.00 0.00 36.38 30.41 3h1c s VAL 238 CO 0.40 -0.25 -0.06 0.54 -3.33 0.00 0.00 175.10 172.40 3h1c s ASN 239 N 2.43 4.70 0.00 3.54 4.22 -1.26 -5.01 114.94 123.55 3h1c s ASN 239 Ca 0.57 -0.04 0.27 0.00 -2.14 0.00 0.00 52.86 51.52 3h1c s ASN 239 Cb -0.21 -1.32 0.81 0.00 1.28 0.00 0.00 41.25 41.81 3h1c s ASN 239 CO 0.19 0.32 1.61 -0.62 -2.04 0.00 0.00 177.10 176.56 3h1c n GLU 240 N 2.49 0.44 0.12 3.55 1.02 -1.26 -3.30 120.64 123.71 3h1c n GLU 240 Ca -0.18 -0.22 -0.02 0.00 -0.02 0.00 0.00 57.16 56.72 3h1c n GLU 240 Cb 0.53 -1.50 0.11 0.00 -0.02 0.00 0.00 31.44 30.56 3h1c n GLU 240 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h1c h ALA 241 N 3.37 0.81 0.01 0.62 0.00 -1.99 -2.94 119.26 119.14 3h1c h ALA 241 Ca 0.00 -0.62 -0.36 0.00 0.00 0.00 0.00 54.91 53.93 3h1c h ALA 241 Cb 0.47 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 3h1c h ALA 241 CO 0.00 0.85 -2.27 -0.11 0.00 0.00 0.00 179.25 177.72 3h1c n LEU 242 N -3.64 1.30 -0.05 0.00 7.94 -1.25 -3.93 117.00 117.38 3h1c n LEU 242 Ca -0.01 0.05 -0.12 0.00 -1.11 0.00 0.00 56.01 54.82 3h1c n LEU 242 Cb 0.69 -0.14 -0.06 0.00 0.53 0.00 0.00 43.42 44.44 3h1c n LEU 242 CO 0.43 0.65 0.77 0.78 -1.11 0.00 0.00 177.39 178.91 3h1c h ASN 243 N 0.01 0.25 1.14 1.96 2.35 -1.65 -2.77 115.58 116.87 3h1c h ASN 243 Ca -0.50 -0.27 -0.02 0.00 -0.55 0.00 0.00 56.30 54.95 3h1c h ASN 243 Cb 2.09 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 40.39 3h1c h ASN 243 CO 0.01 0.46 -0.09 0.00 -1.65 0.00 0.00 177.43 176.16 3h1c h ALA 244 N 0.80 1.00 -0.17 -0.83 0.00 -1.75 -0.70 119.26 117.60 3h1c h ALA 244 Ca 0.05 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 3h1c h ALA 244 Cb 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3h1c h ALA 244 CO 0.00 0.12 -0.45 -0.09 0.00 0.00 0.00 179.25 178.84 3h1c h ARG 245 N 0.00 0.43 0.12 0.00 2.43 -1.64 -2.73 114.38 112.98 3h1c h ARG 245 Ca -0.00 -0.23 -0.35 0.00 -0.81 0.00 0.00 59.98 58.59 3h1c h ARG 245 Cb 0.69 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.23 3h1c h ARG 245 CO 0.01 0.79 -1.88 0.28 -1.51 0.00 0.00 179.97 177.66 3h1c h VAL 246 N 0.35 0.75 -0.19 0.20 2.07 -1.30 -3.38 116.25 114.75 3h1c h VAL 246 Ca 0.02 -2.46 -0.03 0.00 0.82 0.00 0.00 66.70 65.06 3h1c h VAL 246 Cb 0.92 2.56 -0.01 0.00 -1.52 0.00 0.00 31.29 33.24 3h1c h VAL 246 CO 0.08 0.83 -0.02 0.00 0.02 0.00 0.00 177.57 178.48 3h1c h ALA 247 N 0.24 1.62 0.00 1.67 0.00 -1.18 0.32 119.26 121.94 3h1c h ALA 247 Ca -0.38 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3h1c h ALA 247 Cb 2.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.74 3h1c h ALA 247 CO 0.11 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.64 3h1c n ALA 248 N -2.49 2.57 0.00 0.00 0.00 -1.03 -2.85 120.51 116.71 3h1c n ALA 248 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3h1c n ALA 248 Cb 0.19 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.46 3h1c n ALA 248 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3h1c n LEU 249 N -0.68 0.00 -0.04 0.00 7.94 -0.45 -4.94 117.00 118.84 3h1c n LEU 249 Ca 0.08 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 54.94 3h1c n LEU 249 Cb 0.04 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 43.94 3h1c n LEU 249 CO 0.06 0.00 -0.77 0.00 -1.11 0.00 0.00 177.39 175.57 3h1c n ALA 250 N -1.03 1.81 0.09 1.96 0.00 0.10 -4.52 120.51 118.92 3h1c n ALA 250 Ca 0.00 -0.46 0.03 0.00 0.00 0.00 0.00 53.44 53.01 3h1c n ALA 250 Cb 0.17 0.16 0.40 0.00 0.00 0.00 0.00 19.45 20.18 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 0.00 0.31 -0.13 0.00 4.81 -1.68 0.14 114.58 118.03 3h1c h GLU 251 Ca -0.21 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 58.83 3h1c h GLU 251 Cb 1.41 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.73 3h1c h GLU 251 CO -0.01 0.37 -0.53 0.00 -0.73 0.00 0.00 179.01 178.12 3h1c h ALA 252 N 1.66 0.85 0.05 2.92 0.00 -1.83 -2.50 119.26 120.41 3h1c h ALA 252 Ca 0.07 -0.50 -0.24 0.00 0.00 0.00 0.00 54.91 54.24 3h1c h ALA 252 Cb 0.27 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.00 3h1c h ALA 252 CO 0.01 0.68 -0.97 0.00 0.00 0.00 0.00 179.25 178.97 3h1c h ARG 253 N 0.29 0.57 0.00 0.00 3.08 -1.59 -3.32 114.38 113.41 3h1c h ARG 253 Ca 0.01 -0.68 -0.02 0.00 0.07 0.00 0.00 59.98 59.36 3h1c h ARG 253 Cb 1.02 0.21 -0.00 0.00 0.08 0.00 0.00 29.97 31.28 3h1c h ARG 253 CO 0.09 1.28 -0.08 -0.07 -1.07 0.00 0.00 179.97 180.12 3h1c h LEU 254 N 0.16 0.00 -0.45 3.04 3.38 -0.79 -2.28 115.31 118.37 3h1c h LEU 254 Ca -0.13 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.69 3h1c h LEU 254 Cb 1.66 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.40 3h1c h LEU 254 CO 0.19 0.08 -0.30 -1.28 0.09 0.00 0.00 178.44 177.22 3h1c h SER 255 N 0.00 1.02 1.34 -0.43 0.87 -1.55 -3.04 113.55 111.76 3h1c h SER 255 Ca -0.00 -0.42 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 3h1c h SER 255 Cb 0.71 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 3h1c h SER 255 CO 0.01 1.23 -0.35 0.44 -0.53 0.00 0.00 176.83 177.63 3h1c h ASP 256 N 0.82 0.00 1.40 6.23 3.32 -1.65 -3.33 116.42 123.21 3h1c h ASP 256 Ca 0.09 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3h1c h ASP 256 Cb 0.89 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.44 3h1c h ASP 256 CO 0.08 0.03 0.00 0.00 -1.72 0.00 0.00 179.24 177.63 3h1c h ALA 257 N 2.31 1.00 -0.56 3.45 0.00 -1.30 -2.96 119.26 121.20 3h1c h ALA 257 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h1c h ALA 257 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3h1c h ALA 257 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.91 3h1c n TYR 258 N -3.04 1.68 0.32 0.00 4.01 -1.21 -4.06 117.16 114.86 3h1c n TYR 258 Ca 0.02 -0.70 0.06 0.00 -0.16 0.00 0.00 57.90 57.13 3h1c n TYR 258 Cb 0.39 -0.38 0.09 0.00 -0.31 0.00 0.00 39.34 39.14 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 0.66 1.38 0.24 -0.72 1.74 -1.12 -4.43 116.66 114.41 3h1c n ARG 259 Ca 0.26 -1.52 0.13 0.00 -0.77 0.00 0.00 57.85 55.95 3h1c n ARG 259 Cb 1.03 -1.27 0.43 0.00 -1.02 0.00 0.00 32.46 31.63 3h1c n ARG 259 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3h1c h ILE 260 N 2.47 0.20 0.00 0.55 1.08 -1.72 -3.47 117.51 116.62 3h1c h ILE 260 Ca 0.00 -0.93 0.00 0.00 -0.39 0.00 0.00 64.86 63.54 3h1c h ILE 260 Cb 0.60 1.78 0.00 0.00 -3.07 0.00 0.00 36.82 36.14 3h1c h ILE 260 CO 0.00 0.09 0.00 0.35 -0.69 0.00 0.00 178.15 177.90 3h1c n THR 261 N -3.17 0.00 -2.32 -0.27 -2.24 -1.23 -4.85 114.28 100.20 3h1c n THR 261 Ca 0.02 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.38 3h1c n THR 261 Cb 0.43 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.63 3h1c n THR 261 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3h1c s ASP 262 N 0.00 7.01 0.10 3.42 2.15 -1.26 -4.78 116.67 123.31 3h1c s ASP 262 Ca 0.00 2.24 -0.20 0.00 0.43 0.00 0.00 52.55 55.02 3h1c s ASP 262 Cb 0.00 -2.60 -0.08 0.00 -0.30 0.00 0.00 42.92 39.94 3h1c s ASP 262 CO 0.00 -0.46 1.67 0.50 -0.17 0.00 0.00 175.17 176.71 3h1c h LYS 263 N 5.78 0.28 -0.60 4.34 3.64 -1.99 -0.61 116.57 127.41 3h1c h LYS 263 Ca -0.44 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 58.81 3h1c h LYS 263 Cb 1.21 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 3h1c h LYS 263 CO 0.78 0.31 0.02 1.96 -2.27 0.00 0.00 179.45 180.25 3h1c h GLN 264 N 0.19 1.03 0.00 1.90 4.20 -1.97 -1.43 115.11 119.03 3h1c h GLN 264 Ca 0.07 -0.31 -0.08 0.00 0.06 0.00 0.00 58.65 58.39 3h1c h GLN 264 Cb 0.12 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 3h1c h GLN 264 CO -0.01 0.99 -0.38 1.49 -0.67 0.00 0.00 178.83 180.25 3h1c h GLU 265 N 0.95 0.00 0.05 1.46 4.81 -1.93 -2.73 114.58 117.18 3h1c h GLU 265 Ca 0.17 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.28 3h1c h GLU 265 Cb 0.52 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.91 3h1c h GLU 265 CO 0.03 0.38 -0.50 -0.09 -0.73 0.00 0.00 179.01 178.09 3h1c h ARG 266 N 0.00 0.26 0.00 1.92 2.43 -0.95 -3.00 114.38 115.04 3h1c h ARG 266 Ca -0.00 -0.34 -0.08 0.00 -0.81 0.00 0.00 59.98 58.75 3h1c h ARG 266 Cb 1.24 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.89 3h1c h ARG 266 CO 0.05 1.09 -0.37 1.88 -1.51 0.00 0.00 179.97 181.10 3h1c h TYR 267 N -0.41 0.00 -0.13 2.20 -1.99 -1.33 -0.61 116.97 114.70 3h1c h TYR 267 Ca -0.08 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.46 3h1c h TYR 267 Cb 1.30 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 40.03 3h1c h TYR 267 CO 0.19 0.37 -0.70 0.00 -0.00 0.00 0.00 178.16 178.02 3h1c h ALA 268 N 1.63 0.53 -0.09 3.88 0.00 -1.59 -2.76 119.26 120.84 3h1c h ALA 268 Ca -0.00 -0.58 -0.24 0.00 0.00 0.00 0.00 54.91 54.08 3h1c h ALA 268 Cb 0.71 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.47 3h1c h ALA 268 CO 0.05 0.72 -0.88 0.37 0.00 0.00 0.00 179.25 179.51 3h1c h GLN 269 N 0.40 0.75 0.00 0.00 5.75 -1.34 -3.01 115.11 117.65 3h1c h GLN 269 Ca -0.03 -0.68 -0.05 0.00 -0.15 0.00 0.00 58.65 57.74 3h1c h GLN 269 Cb 1.29 0.16 -0.01 0.00 1.07 0.00 0.00 27.48 30.00 3h1c h GLN 269 CO 0.13 1.28 -0.23 -0.24 -2.65 0.00 0.00 178.83 177.12 3h1c h VAL 270 N 0.48 0.56 0.10 2.39 3.04 -1.18 -2.91 116.25 118.72 3h1c h VAL 270 Ca -0.08 -1.17 -0.26 0.00 -1.01 0.00 0.00 66.70 64.18 3h1c h VAL 270 Cb 1.52 1.80 0.01 0.00 -2.01 0.00 0.00 31.29 32.60 3h1c h VAL 270 CO 0.18 0.23 -1.16 -0.78 -1.01 0.00 0.00 177.57 175.03 3h1c h ASP 271 N 0.00 0.47 -0.44 3.17 3.58 -1.53 -3.12 116.42 118.55 3h1c h ASP 271 Ca -0.00 -0.46 -0.02 0.00 0.42 0.00 0.00 57.03 56.97 3h1c h ASP 271 Cb 0.78 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 3h1c h ASP 271 CO 0.03 1.32 0.20 0.58 -2.88 0.00 0.00 179.24 178.50 3h1c h VAL 272 N 0.12 1.19 -0.41 2.25 2.07 -1.37 -0.23 116.25 119.87 3h1c h VAL 272 Ca -0.12 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 3h1c h VAL 272 Cb 1.86 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.34 3h1c h VAL 272 CO 0.19 0.21 0.25 0.40 0.02 0.00 0.00 177.57 178.64 3h1c h ILE 273 N 0.57 1.13 -0.64 4.57 2.04 -1.62 -0.60 117.51 122.96 3h1c h ILE 273 Ca 0.15 -0.30 -0.04 0.00 1.00 0.00 0.00 64.86 65.67 3h1c h ILE 273 Cb 0.14 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 3h1c h ILE 273 CO -0.02 0.13 0.23 0.11 0.00 0.00 0.00 178.15 178.60 3h1c h LYS 274 N 0.54 0.95 0.00 2.37 1.57 -1.45 0.16 116.57 120.71 3h1c h LYS 274 Ca 0.15 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 3h1c h LYS 274 Cb -0.00 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 3h1c h LYS 274 CO -0.03 0.79 -0.21 0.77 -0.57 0.00 0.00 179.45 180.21 3h1c h SER 275 N 0.92 0.00 0.05 0.86 0.02 -0.70 -3.24 113.55 111.47 3h1c h SER 275 Ca 0.21 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.79 3h1c h SER 275 Cb 0.22 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 3h1c h SER 275 CO -0.01 0.21 -2.20 -0.62 -1.14 0.00 0.00 176.83 173.06 3h1c n GLU 276 N -3.22 0.68 -0.20 3.45 1.02 -0.26 -3.70 120.64 118.40 3h1c n GLU 276 Ca 0.02 0.24 -0.04 0.00 -0.02 0.00 0.00 57.16 57.36 3h1c n GLU 276 Cb 0.52 -1.61 0.13 0.00 -0.02 0.00 0.00 31.44 30.47 3h1c n GLU 276 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3h1c h THR 277 N -0.17 1.24 -0.23 2.62 2.02 -1.10 -0.02 112.91 117.28 3h1c h THR 277 Ca -0.52 -0.84 -0.17 0.00 0.77 0.00 0.00 66.41 65.66 3h1c h THR 277 Cb 1.87 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 3h1c h THR 277 CO -0.07 0.32 -0.52 0.40 0.37 0.00 0.00 175.52 176.03 3h1c h ILE 278 N 0.96 1.30 -0.40 3.11 2.04 -1.78 -3.09 117.51 119.65 3h1c h ILE 278 Ca 0.21 -1.73 -0.09 0.00 1.00 0.00 0.00 64.86 64.25 3h1c h ILE 278 Cb 0.28 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 3h1c h ILE 278 CO -0.01 0.55 -0.13 0.00 0.00 0.00 0.00 178.15 178.56 3h1c h ALA 279 N 0.62 1.02 0.00 1.87 0.00 -1.56 -1.91 119.26 119.31 3h1c h ALA 279 Ca -0.00 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 3h1c h ALA 279 Cb 1.13 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3h1c h ALA 279 CO 0.11 0.59 -0.53 0.00 0.00 0.00 0.00 179.25 179.42 3h1c h THR 280 N 0.65 1.15 0.01 0.00 1.03 -1.09 -2.62 112.91 112.04 3h1c h THR 280 Ca 0.11 -1.97 -0.21 0.00 -0.01 0.00 0.00 66.41 64.32 3h1c h THR 280 Cb 0.60 2.14 -0.02 0.00 -1.07 0.00 0.00 68.15 69.79 3h1c h THR 280 CO 0.04 0.52 -1.00 -0.07 -0.01 0.00 0.00 175.52 174.99 3h1c h LEU 281 N 0.00 0.06 -0.82 0.00 3.38 -1.43 -3.12 115.31 113.38 3h1c h LEU 281 Ca -0.01 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 3h1c h LEU 281 Cb 1.09 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 3h1c h LEU 281 CO 0.07 1.02 -0.55 -0.07 0.09 0.00 0.00 178.44 179.00 3h1c h LEU 282 N 0.01 0.00 -0.86 1.67 3.38 -1.29 0.23 115.31 118.46 3h1c h LEU 282 Ca -0.03 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 3h1c h LEU 282 Cb 1.75 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.48 3h1c h LEU 282 CO 0.14 0.55 -0.55 0.00 0.09 0.00 0.00 178.44 178.67 3h1c h ALA 283 N 1.45 1.04 0.14 1.53 0.00 -1.49 -3.00 119.26 118.92 3h1c h ALA 283 Ca -0.01 -0.50 -0.33 0.00 0.00 0.00 0.00 54.91 54.07 3h1c h ALA 283 Cb 1.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3h1c h ALA 283 CO 0.07 0.69 -1.71 1.49 0.00 0.00 0.00 179.25 179.79 3h1c h GLU 284 N 0.00 0.30 -2.26 0.00 4.81 -1.45 -3.46 114.58 112.52 3h1c h GLU 284 Ca -0.01 -0.51 -0.26 0.00 -0.13 0.00 0.00 59.36 58.46 3h1c h GLU 284 Cb 1.01 0.19 -0.33 0.00 0.63 0.00 0.00 28.75 30.24 3h1c h GLU 284 CO 0.07 1.24 -0.57 0.34 -0.73 0.00 0.00 179.01 179.36 3h1c s ASP 285 N -7.13 0.97 0.00 1.04 2.15 0.78 -5.03 116.67 109.46 3h1c s ASP 285 Ca -0.20 -0.10 0.21 0.00 0.43 0.00 0.00 52.55 52.89 3h1c s ASP 285 Cb 0.05 0.67 0.72 0.00 -0.30 0.00 0.00 42.92 44.07 3h1c s ASP 285 CO 0.79 -0.32 1.53 -1.84 -0.17 0.00 0.00 175.17 175.16 3h1c n GLU 286 N 5.34 1.77 -0.06 4.34 0.28 -1.13 -3.86 120.64 127.31 3h1c n GLU 286 Ca -0.04 -1.16 0.12 0.00 -0.16 0.00 0.00 57.16 55.91 3h1c n GLU 286 Cb 0.50 -1.40 0.37 0.00 1.43 0.00 0.00 31.44 32.34 3h1c n GLU 286 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 3h1c n THR 287 N 0.39 0.16 -3.26 3.84 -2.24 -1.26 -4.92 114.28 106.99 3h1c n THR 287 Ca 0.16 -0.39 -0.34 0.00 -2.27 0.00 0.00 64.05 61.22 3h1c n THR 287 Cb 0.34 0.60 -0.06 0.00 -2.10 0.00 0.00 70.33 69.12 3h1c n THR 287 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3h1c s LEU 288 N -1.73 4.24 -0.05 3.22 1.43 -1.25 -5.05 118.68 119.49 3h1c s LEU 288 Ca 0.34 1.17 -0.30 0.00 -1.03 0.00 0.00 54.13 54.31 3h1c s LEU 288 Cb 0.19 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.77 3h1c s LEU 288 CO 0.29 -0.02 1.09 -0.62 0.23 0.00 0.00 176.35 177.32 3h1c s ASP 289 N -1.97 7.19 0.26 2.29 2.15 -1.26 -4.94 116.67 120.39 3h1c s ASP 289 Ca 0.45 1.71 0.05 0.00 0.43 0.00 0.00 52.55 55.18 3h1c s ASP 289 Cb -0.13 -2.56 0.34 0.00 -0.30 0.00 0.00 42.92 40.26 3h1c s ASP 289 CO 0.20 -0.46 1.63 -0.08 -0.17 0.00 0.00 175.17 176.29 3h1c h GLU 290 N 7.11 0.27 -0.03 4.34 4.81 -1.98 -3.15 114.58 125.96 3h1c h GLU 290 Ca -0.35 -0.15 -0.08 0.00 -0.13 0.00 0.00 59.36 58.64 3h1c h GLU 290 Cb 1.17 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 3h1c h GLU 290 CO 0.84 0.71 -0.35 -0.97 -0.73 0.00 0.00 179.01 178.51 3h1c h ASN 291 N 0.22 0.06 0.41 1.04 -1.24 -1.96 -2.87 115.58 111.24 3h1c h ASN 291 Ca 0.01 -0.02 -0.23 0.00 0.71 0.00 0.00 56.30 56.77 3h1c h ASN 291 Cb 0.95 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.99 3h1c h ASN 291 CO 0.08 0.41 -0.97 -0.08 -1.29 0.00 0.00 177.43 175.58 3h1c h GLU 292 N 0.05 0.36 -0.30 6.67 4.81 -1.97 -3.26 114.58 120.94 3h1c h GLU 292 Ca 0.00 -0.41 -0.08 0.00 -0.13 0.00 0.00 59.36 58.75 3h1c h GLU 292 Cb 0.64 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 3h1c h GLU 292 CO 0.05 1.10 -0.13 -0.07 -0.73 0.00 0.00 179.01 179.22 3h1c h LEU 293 N 0.19 0.51 -0.96 1.64 3.38 -1.47 -2.65 115.31 115.96 3h1c h LEU 293 Ca -0.08 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.64 3h1c h LEU 293 Cb 1.61 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.21 3h1c h LEU 293 CO 0.16 0.67 -0.51 1.23 0.09 0.00 0.00 178.44 180.09 3h1c h GLY 294 N 0.94 0.04 1.67 0.83 0.00 -1.60 -2.26 103.07 102.69 3h1c h GLY 294 Ca 0.09 -0.04 -0.18 0.00 0.00 0.00 0.00 47.33 47.20 3h1c h GLY 294 CO 0.03 0.04 -0.74 0.83 0.00 0.00 0.00 176.54 176.70 3h1c h GLU 295 N 0.03 0.32 -0.26 4.80 5.08 -1.53 -1.99 114.58 121.02 3h1c h GLU 295 Ca -0.00 -0.27 -0.13 0.00 -1.00 0.00 0.00 59.36 57.95 3h1c h GLU 295 Cb 0.91 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.21 3h1c h GLU 295 CO 0.07 0.92 -0.35 0.82 -1.00 0.00 0.00 179.01 179.47 3h1c h ILE 296 N 0.21 1.31 -0.26 3.13 1.08 -1.40 -2.43 117.51 119.15 3h1c h ILE 296 Ca -0.03 -1.54 -0.04 0.00 -0.39 0.00 0.00 64.86 62.85 3h1c h ILE 296 Cb 1.31 1.67 -0.01 0.00 -3.07 0.00 0.00 36.82 36.72 3h1c h ILE 296 CO 0.12 0.49 -0.03 -0.07 -0.69 0.00 0.00 178.15 177.97 3h1c h LEU 297 N 0.43 0.36 -0.88 1.44 3.38 -1.41 -1.50 115.31 117.14 3h1c h LEU 297 Ca 0.03 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 3h1c h LEU 297 Cb 0.94 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3h1c h LEU 297 CO 0.08 0.45 -0.52 -0.74 0.09 0.00 0.00 178.44 177.80 3h1c h HIS 298 N 0.38 0.11 -0.03 1.13 2.76 -1.30 -1.69 115.15 116.51 3h1c h HIS 298 Ca 0.08 -0.04 -0.17 0.00 -2.20 0.00 0.00 60.37 58.05 3h1c h HIS 298 Cb 0.30 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.22 3h1c h HIS 298 CO 0.01 0.60 -0.74 0.00 -1.30 0.00 0.00 177.93 176.49 3h1c h ALA 299 N 1.40 0.69 -0.21 5.26 0.00 -0.87 -2.20 119.26 123.32 3h1c h ALA 299 Ca -0.00 -0.64 -0.16 0.00 0.00 0.00 0.00 54.91 54.11 3h1c h ALA 299 Cb 0.95 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3h1c h ALA 299 CO 0.07 0.83 -0.48 0.82 0.00 0.00 0.00 179.25 180.49 3h1c h ILE 300 N 0.13 1.31 -0.82 0.00 2.04 -1.18 -2.00 117.51 116.99 3h1c h ILE 300 Ca -0.02 -1.70 0.07 0.00 1.00 0.00 0.00 64.86 64.20 3h1c h ILE 300 Cb 1.31 1.83 -0.05 0.00 -0.74 0.00 0.00 36.82 39.17 3h1c h ILE 300 CO 0.11 0.54 0.54 -0.33 0.00 0.00 0.00 178.15 179.00 3h1c h GLU 301 N 0.42 0.86 -0.22 2.37 5.08 -1.30 -1.65 114.58 120.13 3h1c h GLU 301 Ca 0.00 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.16 3h1c h GLU 301 Cb 1.09 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 3h1c h GLU 301 CO 0.11 0.57 -0.48 -0.22 -1.00 0.00 0.00 179.01 177.98 3h1c h LYS 302 N 0.89 0.60 -0.00 2.33 3.64 -1.29 -3.18 116.57 119.56 3h1c h LYS 302 Ca 0.36 -0.34 -0.16 0.00 -1.27 0.00 0.00 60.65 59.23 3h1c h LYS 302 Cb 0.25 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3h1c h LYS 302 CO -0.13 0.95 -0.76 -0.97 -2.27 0.00 0.00 179.45 176.27 3h1c h ASN 303 N 0.48 0.03 -0.01 4.20 -1.24 -0.69 -2.99 115.58 115.36 3h1c h ASN 303 Ca 0.02 -0.02 -0.01 0.00 0.71 0.00 0.00 56.30 57.00 3h1c h ASN 303 Cb 1.02 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 40.06 3h1c h ASN 303 CO 0.09 0.77 -0.03 0.58 -1.29 0.00 0.00 177.43 177.55 3h1c h VAL 304 N 0.01 1.52 -0.28 2.57 2.07 -1.36 -3.02 116.25 117.76 3h1c h VAL 304 Ca -0.01 -1.57 -0.15 0.00 0.82 0.00 0.00 66.70 65.79 3h1c h VAL 304 Cb 1.34 2.56 -0.00 0.00 -1.52 0.00 0.00 31.29 33.66 3h1c h VAL 304 CO 0.10 0.41 -0.40 0.58 0.02 0.00 0.00 177.57 178.29 3h1c h VAL 305 N -0.61 1.30 -0.27 2.57 2.07 -1.66 -3.01 116.25 116.63 3h1c h VAL 305 Ca -0.00 -1.58 -0.14 0.00 0.82 0.00 0.00 66.70 65.80 3h1c h VAL 305 Cb 0.70 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 3h1c h VAL 305 CO 0.01 0.51 -0.40 0.03 0.02 0.00 0.00 177.57 177.74 3h1c h ARG 306 N 0.51 0.64 -0.02 1.57 3.08 -1.66 -2.94 114.38 115.55 3h1c h ARG 306 Ca 0.03 -0.32 -0.16 0.00 0.07 0.00 0.00 59.98 59.60 3h1c h ARG 306 Cb 0.99 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 3h1c h ARG 306 CO 0.09 0.92 -0.71 0.77 -1.07 0.00 0.00 179.97 179.98 3h1c h SER 307 N 0.53 0.17 0.55 7.04 0.02 -1.59 -1.47 113.55 118.80 3h1c h SER 307 Ca 0.05 -0.12 -0.13 0.00 -0.84 0.00 0.00 61.79 60.75 3h1c h SER 307 Cb 0.91 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.39 3h1c h SER 307 CO 0.08 0.82 -0.62 0.03 -1.14 0.00 0.00 176.83 176.01 3h1c h ARG 308 N 0.10 0.06 0.00 3.45 3.08 -1.50 -3.04 114.38 116.52 3h1c h ARG 308 Ca -0.02 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3h1c h ARG 308 Cb 1.26 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.31 3h1c h ARG 308 CO 0.10 0.66 -1.08 1.55 -1.07 0.00 0.00 179.97 180.14 3h1c n VAL 309 N -3.82 0.39 -0.11 2.04 3.14 -1.12 -3.74 118.33 115.11 3h1c n VAL 309 Ca -0.02 -0.42 -0.13 0.00 -2.96 0.00 0.00 64.34 60.82 3h1c n VAL 309 Cb 0.62 -0.12 -0.03 0.00 -1.06 0.00 0.00 33.84 33.24 3h1c n VAL 309 CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 3h1c h LEU 310 N 0.00 0.78-10.38 6.55 5.85 -1.24 -3.45 115.31 113.42 3h1c h LEU 310 Ca 0.00 -0.44 -0.46 0.00 0.84 0.00 0.00 57.88 57.82 3h1c h LEU 310 Cb 0.89 -0.22 0.04 0.00 0.37 0.00 0.00 40.66 41.74 3h1c h LEU 310 CO 0.00 1.05 -0.03 0.00 -0.34 0.00 0.00 178.44 179.12 3h1c s ALA 311 N -4.49 3.66 -1.04 1.25 0.00 -1.15 -4.94 121.76 115.05 3h1c s ALA 311 Ca -0.12 -0.98 -0.24 0.00 0.00 0.00 0.00 51.96 50.62 3h1c s ALA 311 Cb 0.09 -2.25 -0.07 0.00 0.00 0.00 0.00 23.12 20.90 3h1c s ALA 311 CO 0.83 -0.49 1.94 0.20 0.00 0.00 0.00 175.76 178.24 3h1c s GLY 312 N -4.24 0.19 -0.22 0.00 0.00 -1.26 -4.85 107.32 96.93 3h1c s GLY 312 Ca 0.50 -1.82 -0.13 0.00 0.00 0.00 0.00 44.72 43.26 3h1c s GLY 312 CO 0.40 3.51 0.55 1.85 0.00 0.00 0.00 173.10 179.40 3h1c s GLU 313 N 6.73 0.56 0.42 2.90 2.12 -1.25 -5.12 118.70 125.06 3h1c s GLU 313 Ca 0.69 0.97 -0.24 0.00 0.36 0.00 0.00 54.97 56.75 3h1c s GLU 313 Cb -0.04 0.09 -0.11 0.00 0.26 0.00 0.00 34.13 34.33 3h1c s GLU 313 CO 0.06 -0.14 0.93 -2.30 -0.54 0.00 0.00 175.26 173.27 3h1c n PRO 314 N 4.10 1.20 0.00 4.30 -0.02 -1.26 -4.45 135.00 138.87 3h1c n PRO 314 Ca -0.21 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 3h1c n PRO 314 Cb 0.57 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 3h1c n PRO 314 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 3h1c n ARG 315 N 0.20 0.78 0.25 -0.52 1.85 -1.03 -4.85 116.66 113.34 3h1c n ARG 315 Ca 0.10 0.00 0.10 0.00 -1.00 0.00 0.00 57.85 57.05 3h1c n ARG 315 Cb 0.39 0.00 0.63 0.00 -1.05 0.00 0.00 32.46 32.43 3h1c n ARG 315 CO 0.00 0.00 0.00 -0.84 -0.01 0.00 0.00 177.63 176.78 3h1c h ILE 316 N -0.33 0.80 -0.01 8.89 3.07 -1.90 -2.98 117.51 125.05 3h1c h ILE 316 Ca 0.00 -0.59 0.00 0.00 1.55 0.00 0.00 64.86 65.82 3h1c h ILE 316 Cb 0.00 1.35 0.00 0.00 -0.27 0.00 0.00 36.82 37.90 3h1c h ILE 316 CO 0.00 0.15 -0.48 -0.90 -1.05 0.00 0.00 178.15 175.86 3h1c n ASP 317 N -3.91 1.08 0.00 2.16 5.75 -1.26 -3.50 116.55 116.87 3h1c n ASP 317 Ca -0.02 -1.04 0.00 0.00 -0.01 0.00 0.00 54.79 53.72 3h1c n ASP 317 Cb 0.24 0.74 0.00 0.00 -1.03 0.00 0.00 41.12 41.08 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 1.21 0.70 3.81 6.12 0.00 -1.13 -4.91 105.19 110.99 3h1c n GLY 318 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 3h1c n GLY 318 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3h1c s ARG 319 N -0.55 2.53 0.00 1.61 1.04 -1.26 -4.75 118.95 117.56 3h1c s ARG 319 Ca 0.00 0.86 0.00 0.00 -1.04 0.00 0.00 55.73 55.55 3h1c s ARG 319 Cb 0.00 -1.95 0.00 0.00 -2.04 0.00 0.00 34.95 30.96 3h1c s ARG 319 CO 0.00 -1.37 0.00 0.39 -0.04 0.00 0.00 175.30 174.28 3h1c n GLU 320 N -3.30 0.73 -0.01 3.89 -0.58 -1.26 -2.46 120.64 117.65 3h1c n GLU 320 Ca 0.07 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.95 3h1c n GLU 320 Cb 0.54 0.00 0.39 0.00 -0.57 0.00 0.00 31.44 31.81 3h1c n GLU 320 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 3h1c n LYS 321 N -0.66 1.87 0.00 3.49 2.85 -1.26 -3.92 118.16 120.53 3h1c n LYS 321 Ca 0.00 -1.27 0.00 0.00 -1.05 0.00 0.00 58.31 55.99 3h1c n LYS 321 Cb 0.00 -1.47 0.00 0.00 -0.65 0.00 0.00 35.03 32.91 3h1c n LYS 321 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 3h1c n ASP 322 N 0.53 1.23 -4.71 -5.58 5.75 -1.26 -3.26 116.55 109.25 3h1c n ASP 322 Ca 0.17 -0.22 -0.42 0.00 -0.01 0.00 0.00 54.79 54.31 3h1c n ASP 322 Cb 0.42 0.69 -0.03 0.00 -1.03 0.00 0.00 41.12 41.18 3h1c n ASP 322 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 3h1c s MET 323 N -0.94 4.26 0.24 0.11 -1.94 -1.25 -4.70 119.30 115.07 3h1c s MET 323 Ca 0.00 2.23 0.05 0.00 -1.71 0.00 0.00 55.69 56.26 3h1c s MET 323 Cb 0.00 -3.25 -0.03 0.00 2.01 0.00 0.00 34.83 33.56 3h1c s MET 323 CO 0.00 -0.55 0.31 0.96 -0.01 0.00 0.00 175.02 175.73 3h1c s ILE 324 N 1.31 5.04 0.83 2.53 -4.36 -1.26 -4.57 121.20 120.72 3h1c s ILE 324 Ca 0.68 -1.09 -0.11 0.00 -0.26 0.00 0.00 60.65 59.87 3h1c s ILE 324 Cb -0.40 -3.73 0.09 0.00 1.25 0.00 0.00 42.46 39.67 3h1c s ILE 324 CO 0.31 -0.32 1.09 -0.13 0.24 0.00 0.00 174.94 176.13 3h1c s ARG 325 N -3.90 1.77 0.70 0.37 0.52 -1.26 -5.01 118.95 112.13 3h1c s ARG 325 Ca 0.34 0.99 -0.15 0.00 -0.52 0.00 0.00 55.73 56.38 3h1c s ARG 325 Cb -0.09 -1.85 0.02 0.00 0.52 0.00 0.00 34.95 33.55 3h1c s ARG 325 CO 0.28 -1.93 1.17 0.20 0.02 0.00 0.00 175.30 175.03 3h1c s GLY 326 N -3.42 2.28 0.08 -3.53 0.00 -1.26 -4.71 107.32 96.77 3h1c s GLY 326 Ca 0.62 0.75 0.10 0.00 0.00 0.00 0.00 44.72 46.19 3h1c s GLY 326 CO 0.56 1.13 -0.27 1.08 0.00 0.00 0.00 173.10 175.61 3h1c s LEU 327 N -4.99 2.24 -0.38 0.66 1.43 -1.26 -0.50 118.68 115.88 3h1c s LEU 327 Ca 0.71 -0.66 0.01 0.00 -1.03 0.00 0.00 54.13 53.16 3h1c s LEU 327 Cb -0.26 -1.25 0.14 0.00 0.03 0.00 0.00 46.19 44.86 3h1c s LEU 327 CO 0.43 0.22 0.22 -0.62 0.23 0.00 0.00 176.35 176.83 3h1c s ASP 328 N -1.62 3.09 -0.21 2.29 2.15 -0.02 -5.00 116.67 117.35 3h1c s ASP 328 Ca 0.13 -2.35 -0.24 0.00 0.43 0.00 0.00 52.55 50.51 3h1c s ASP 328 Cb -0.10 -0.58 -0.01 0.00 -0.30 0.00 0.00 42.92 41.93 3h1c s ASP 328 CO 0.04 -0.29 0.80 -0.69 -0.17 0.00 0.00 175.17 174.86 3h1c s VAL 329 N 0.82 4.88 -0.02 1.11 1.01 -1.26 -2.47 120.40 124.46 3h1c s VAL 329 Ca 0.19 1.53 -0.02 0.00 0.00 0.00 0.00 61.98 63.68 3h1c s VAL 329 Cb -0.22 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.07 3h1c s VAL 329 CO -0.00 -0.01 0.05 -0.60 0.00 0.00 0.00 175.10 174.54 3h1c s ARG 330 N 2.49 0.05 0.03 2.72 3.52 -0.58 -5.01 118.95 122.17 3h1c s ARG 330 Ca 0.35 0.10 -0.06 0.00 -0.13 0.00 0.00 55.73 55.99 3h1c s ARG 330 Cb -0.16 -0.01 -0.01 0.00 -1.56 0.00 0.00 34.95 33.21 3h1c s ARG 330 CO 0.09 -0.03 0.11 -0.08 -0.81 0.00 0.00 175.30 174.58 3h1c s THR 331 N 0.19 0.12 -0.35 4.11 -1.32 -1.26 0.22 115.64 117.36 3h1c s THR 331 Ca -0.01 -0.98 -0.01 0.00 -1.21 0.00 0.00 61.69 59.48 3h1c s THR 331 Cb -0.02 -0.76 0.00 0.00 -1.51 0.00 0.00 72.50 70.20 3h1c s THR 331 CO -0.01 -0.54 0.09 0.61 -2.21 0.00 0.00 174.62 172.57 3h1c n GLY 332 N 0.95 0.35 0.19 6.08 0.00 -0.99 -4.96 105.19 106.82 3h1c n GLY 332 Ca -0.20 -0.62 0.10 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.21 0.16 -4.33 1.61 3.04 -1.89 -3.45 116.25 111.17 3h1c h VAL 333 Ca -0.11 -1.24 -0.70 0.00 -1.01 0.00 0.00 66.70 63.65 3h1c h VAL 333 Cb 1.08 2.04 -0.27 0.00 -2.01 0.00 0.00 31.29 32.13 3h1c h VAL 333 CO 0.12 0.09 -0.86 -0.76 -1.01 0.00 0.00 177.57 175.15 3h1c s LEU 334 N -6.18 2.24 -0.10 3.16 1.43 -1.26 -5.07 118.68 112.90 3h1c s LEU 334 Ca 0.06 -0.50 -0.02 0.00 -1.03 0.00 0.00 54.13 52.64 3h1c s LEU 334 Cb 0.06 -1.36 -0.01 0.00 0.03 0.00 0.00 46.19 44.91 3h1c s LEU 334 CO 0.70 0.29 -0.04 1.55 0.23 0.00 0.00 176.35 179.07 3h1c h PRO 335 N 5.03 0.00 -0.20 1.29 0.14 -2.00 -3.41 132.00 132.85 3h1c h PRO 335 Ca -0.46 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.68 3h1c h PRO 335 Cb 1.14 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.28 3h1c h PRO 335 CO 0.46 0.00 0.00 0.54 0.14 0.00 0.00 178.00 179.14 3h1c n ARG 336 N -4.40 1.51 -3.90 0.86 5.12 -1.26 -4.84 116.66 109.75 3h1c n ARG 336 Ca -0.02 -0.78 -0.22 0.00 -1.93 0.00 0.00 57.85 54.90 3h1c n ARG 336 Cb 0.07 -1.22 -0.02 0.00 -1.16 0.00 0.00 32.46 30.13 3h1c n ARG 336 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 3h1c s THR 337 N -1.74 5.25 0.08 0.55 -1.32 -1.26 -5.04 115.64 112.16 3h1c s THR 337 Ca 0.19 -0.87 -0.27 0.00 -1.21 0.00 0.00 61.69 59.52 3h1c s THR 337 Cb 0.10 -3.84 -0.17 0.00 -1.51 0.00 0.00 72.50 67.08 3h1c s THR 337 CO 0.14 -0.32 1.67 0.45 -2.21 0.00 0.00 174.62 174.35 3h1c h HIS 338 N 1.28 -0.38 -4.02 9.09 3.86 -1.89 -3.44 115.15 119.66 3h1c h HIS 338 Ca -0.51 -0.01 -0.44 0.00 -1.16 0.00 0.00 60.37 58.25 3h1c h HIS 338 Cb 1.22 0.13 -0.30 0.00 1.06 0.00 0.00 27.41 29.52 3h1c h HIS 338 CO 0.47 -0.23 -0.79 0.20 0.86 0.00 0.00 177.93 178.44 3h1c s GLY 339 N -2.15 0.56 -0.00 2.45 0.00 -1.00 -3.87 107.32 103.30 3h1c s GLY 339 Ca -0.15 -0.45 0.06 0.00 0.00 0.00 0.00 44.72 44.18 3h1c s GLY 339 CO 0.64 -0.31 -0.18 -0.56 0.00 0.00 0.00 173.10 172.69 3h1c s SER 340 N -0.12 2.14 -0.11 1.64 0.01 -1.26 -1.83 113.70 114.16 3h1c s SER 340 Ca 0.02 -0.37 -0.15 0.00 1.31 0.00 0.00 55.95 56.76 3h1c s SER 340 Cb -0.06 -0.22 0.04 0.00 0.21 0.00 0.00 66.02 65.99 3h1c s SER 340 CO -0.00 0.20 0.39 0.00 0.41 0.00 0.00 173.24 174.24 3h1c s ALA 341 N -0.51 -0.98 -0.26 1.44 0.00 -0.48 -2.35 121.76 118.62 3h1c s ALA 341 Ca 0.07 0.95 -0.04 0.00 0.00 0.00 0.00 51.96 52.94 3h1c s ALA 341 Cb -0.07 -0.45 0.09 0.00 0.00 0.00 0.00 23.12 22.69 3h1c s ALA 341 CO -0.00 -0.22 0.12 -1.17 0.00 0.00 0.00 175.76 174.49 3h1c s LEU 342 N -0.22 0.62 -0.16 0.00 2.96 0.13 -1.95 118.68 120.06 3h1c s LEU 342 Ca -0.04 -1.16 -0.03 0.00 -0.22 0.00 0.00 54.13 52.68 3h1c s LEU 342 Cb -0.03 -0.37 -0.03 0.00 0.50 0.00 0.00 46.19 46.27 3h1c s LEU 342 CO 0.02 -0.42 -0.05 0.12 -1.32 0.00 0.00 176.35 174.71 3h1c s PHE 343 N 2.07 3.00 -0.07 5.38 5.36 -1.14 -1.52 117.98 131.06 3h1c s PHE 343 Ca 0.07 -0.36 0.01 0.00 -0.96 0.00 0.00 56.93 55.69 3h1c s PHE 343 Cb -0.16 -1.95 0.02 0.00 -0.34 0.00 0.00 43.02 40.59 3h1c s PHE 343 CO -0.30 -0.08 -0.08 0.99 -1.46 0.00 0.00 175.22 174.30 3h1c s THR 344 N 0.41 0.87 -0.43 0.12 2.01 -1.03 -1.40 115.64 116.19 3h1c s THR 344 Ca -0.05 -0.28 0.03 0.00 0.31 0.00 0.00 61.69 61.70 3h1c s THR 344 Cb -0.14 -0.85 0.12 0.00 0.01 0.00 0.00 72.50 71.63 3h1c s THR 344 CO 0.03 0.31 0.18 -0.60 -0.69 0.00 0.00 174.62 173.85 3h1c s ARG 345 N 1.07 1.53 0.65 4.92 3.52 0.26 -0.84 118.95 130.07 3h1c s ARG 345 Ca -0.08 -2.10 0.00 0.00 -0.13 0.00 0.00 55.73 53.43 3h1c s ARG 345 Cb -0.14 -2.89 0.00 0.00 -1.56 0.00 0.00 34.95 30.36 3h1c s ARG 345 CO -0.01 -1.06 0.00 0.41 -0.81 0.00 0.00 175.30 173.83 3h1c n GLY 346 N 3.71 1.44 0.00 8.12 0.00 0.34 -2.27 105.19 116.54 3h1c n GLY 346 Ca 0.05 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.41 3h1c n GLY 346 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h1c n GLU 347 N 0.00 0.25 -4.44 1.61 1.02 -1.26 -4.95 120.64 112.86 3h1c n GLU 347 Ca 0.00 -0.54 -0.32 0.00 -0.02 0.00 0.00 57.16 56.29 3h1c n GLU 347 Cb 0.00 -0.75 -0.10 0.00 -0.02 0.00 0.00 31.44 30.56 3h1c n GLU 347 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 3h1c s THR 348 N -0.19 3.54 -0.01 2.62 -1.32 -0.96 -3.87 115.64 115.44 3h1c s THR 348 Ca 0.00 -0.88 -0.04 0.00 -1.21 0.00 0.00 61.69 59.56 3h1c s THR 348 Cb 0.00 -2.55 0.00 0.00 -1.51 0.00 0.00 72.50 68.44 3h1c s THR 348 CO 0.00 0.35 0.08 -1.58 -2.21 0.00 0.00 174.62 171.26 3h1c s GLN 349 N -1.54 0.26 -0.16 7.08 0.74 0.03 -0.57 119.66 125.50 3h1c s GLN 349 Ca 0.18 -0.17 -0.05 0.00 0.05 0.00 0.00 55.36 55.37 3h1c s GLN 349 Cb -0.11 0.11 0.06 0.00 1.10 0.00 0.00 33.01 34.17 3h1c s GLN 349 CO 0.08 -0.05 0.09 0.00 -0.55 0.00 0.00 175.29 174.86 3h1c s ALA 350 N -0.66 0.40 -0.59 1.58 0.00 -0.50 -2.10 121.76 119.89 3h1c s ALA 350 Ca -0.07 -0.26 -0.27 0.00 0.00 0.00 0.00 51.96 51.35 3h1c s ALA 350 Cb -0.05 -1.01 0.03 0.00 0.00 0.00 0.00 23.12 22.09 3h1c s ALA 350 CO 0.00 -1.13 1.14 -1.17 0.00 0.00 0.00 175.76 174.60 3h1c s LEU 351 N 2.15 3.58 -0.14 0.00 2.96 0.17 -2.87 118.68 124.53 3h1c s LEU 351 Ca 0.02 -0.05 -0.04 0.00 -0.22 0.00 0.00 54.13 53.84 3h1c s LEU 351 Cb -0.16 -3.03 -0.03 0.00 0.50 0.00 0.00 46.19 43.47 3h1c s LEU 351 CO -0.09 -1.46 -0.01 -0.69 -1.32 0.00 0.00 176.35 172.79 3h1c s VAL 352 N 4.79 4.17 0.21 1.68 1.01 -0.82 -0.05 120.40 131.39 3h1c s VAL 352 Ca 0.39 -0.27 0.11 0.00 0.00 0.00 0.00 61.98 62.22 3h1c s VAL 352 Cb -0.09 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 3h1c s VAL 352 CO 0.23 0.52 -0.22 0.42 0.00 0.00 0.00 175.10 176.05 3h1c s THR 353 N 0.01 2.46 -0.01 3.92 -4.23 -0.24 -1.38 115.64 116.17 3h1c s THR 353 Ca 0.02 -2.10 0.06 0.00 -1.18 0.00 0.00 61.69 58.49 3h1c s THR 353 Cb -0.13 -2.21 -0.02 0.00 1.34 0.00 0.00 72.50 71.48 3h1c s THR 353 CO 0.02 -0.19 -0.19 0.00 -0.54 0.00 0.00 174.62 173.72 3h1c s ALA 354 N -1.89 1.61 -0.03 3.99 0.00 -0.76 -2.34 121.76 122.35 3h1c s ALA 354 Ca 0.23 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.35 3h1c s ALA 354 Cb -0.07 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.66 3h1c s ALA 354 CO 0.12 0.39 -0.04 0.99 0.00 0.00 0.00 175.76 177.22 3h1c s THR 355 N -0.49 0.44 -0.01 0.00 2.01 0.25 -2.38 115.64 115.47 3h1c s THR 355 Ca 0.07 -0.12 -0.00 0.00 0.31 0.00 0.00 61.69 61.95 3h1c s THR 355 Cb -0.08 -0.45 -0.04 0.00 0.01 0.00 0.00 72.50 71.95 3h1c s THR 355 CO -0.00 0.18 0.08 -0.76 -0.69 0.00 0.00 174.62 173.42 3h1c s LEU 356 N 0.62 3.89 0.29 4.42 1.43 -1.26 -0.63 118.68 127.43 3h1c s LEU 356 Ca -0.07 0.15 -0.15 0.00 -1.03 0.00 0.00 54.13 53.02 3h1c s LEU 356 Cb -0.11 -2.25 0.01 0.00 0.03 0.00 0.00 46.19 43.87 3h1c s LEU 356 CO -0.00 0.28 0.60 -0.83 0.23 0.00 0.00 176.35 176.63 3h1c s GLY 357 N -1.70 0.41 0.84 -3.19 0.00 -0.33 -5.00 107.32 98.35 3h1c s GLY 357 Ca 0.22 -0.74 -0.06 0.00 0.00 0.00 0.00 44.72 44.14 3h1c s GLY 357 CO 0.13 -0.45 1.15 -0.51 0.00 0.00 0.00 173.10 173.43 3h1c s THR 358 N -3.63 2.02 -0.86 0.90 -4.23 -1.26 -0.81 115.64 107.77 3h1c s THR 358 Ca 0.19 -0.39 0.12 0.00 -1.18 0.00 0.00 61.69 60.43 3h1c s THR 358 Cb -0.03 -2.63 0.11 0.00 1.34 0.00 0.00 72.50 71.29 3h1c s THR 358 CO 0.10 0.00 1.39 0.00 -0.54 0.00 0.00 174.62 175.57 3h1c n ALA 359 N -3.25 1.43 0.02 3.99 0.00 -1.26 -2.06 120.51 119.37 3h1c n ALA 359 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.55 3h1c n ALA 359 Cb 0.60 -1.20 0.12 0.00 0.00 0.00 0.00 19.45 18.97 3h1c n ALA 359 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3h1c h ARG 360 N 0.00 0.49 -0.60 0.00 2.43 -2.00 -3.16 114.38 111.54 3h1c h ARG 360 Ca 0.00 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 3h1c h ARG 360 Cb 0.18 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3h1c h ARG 360 CO 0.00 0.83 0.00 -0.25 -1.51 0.00 0.00 179.97 179.04 3h1c n ASP 361 N -4.01 2.71 -4.77 -3.80 8.00 -0.88 -4.94 116.55 108.86 3h1c n ASP 361 Ca -0.02 -2.25 -0.39 0.00 0.71 0.00 0.00 54.79 52.84 3h1c n ASP 361 Cb 0.52 -0.43 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 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 -1.71 3.31 -0.29 2.24 0.00 -1.20 -4.97 121.76 119.14 3h1c s ALA 362 Ca 0.26 0.99 -0.29 0.00 0.00 0.00 0.00 51.96 52.91 3h1c s ALA 362 Cb 0.17 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 3h1c s ALA 362 CO 0.12 -0.40 1.46 -1.14 0.00 0.00 0.00 175.76 175.80 3h1c s GLN 363 N -1.91 3.78 -0.63 0.00 2.00 -0.90 -4.88 119.66 117.11 3h1c s GLN 363 Ca 0.51 1.35 -0.22 0.00 -2.00 0.00 0.00 55.36 55.00 3h1c s GLN 363 Cb -0.32 -3.98 0.08 0.00 0.80 0.00 0.00 33.01 29.58 3h1c s GLN 363 CO 0.42 -1.31 0.89 0.08 -0.50 0.00 0.00 175.29 174.87 3h1c s VAL 364 N 5.01 4.47 -0.19 1.34 1.01 -1.26 -0.20 120.40 130.58 3h1c s VAL 364 Ca 0.64 -0.48 -0.22 0.00 0.00 0.00 0.00 61.98 61.92 3h1c s VAL 364 Cb -0.19 -4.61 -0.02 0.00 0.00 0.00 0.00 36.38 31.55 3h1c s VAL 364 CO 0.28 -1.33 0.68 -0.76 0.00 0.00 0.00 175.10 173.97 3h1c s LEU 365 N 3.67 4.15 -1.08 3.92 1.43 -0.31 -5.00 118.68 125.46 3h1c s LEU 365 Ca 0.20 0.93 -0.06 0.00 -1.03 0.00 0.00 54.13 54.16 3h1c s LEU 365 Cb -0.19 -2.98 0.29 0.00 0.03 0.00 0.00 46.19 43.34 3h1c s LEU 365 CO 0.10 -0.31 1.24 -0.67 0.23 0.00 0.00 176.35 176.94 3h1c n ASP 366 N 5.09 5.77 -4.90 2.29 2.03 -1.26 -2.40 116.55 123.18 3h1c n ASP 366 Ca 0.00 -3.21 -0.29 0.00 0.52 0.00 0.00 54.79 51.82 3h1c n ASP 366 Cb 0.49 -1.30 0.09 0.00 -0.72 0.00 0.00 41.12 39.69 3h1c n ASP 366 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3h1c s GLU 367 N -1.95 1.97 0.22 -0.67 2.02 -1.24 -5.00 118.70 114.05 3h1c s GLU 367 Ca 0.31 0.07 -0.01 0.00 0.02 0.00 0.00 54.97 55.36 3h1c s GLU 367 Cb -0.03 -1.97 0.19 0.00 0.10 0.00 0.00 34.13 32.42 3h1c s GLU 367 CO -0.01 -1.57 1.56 1.25 0.02 0.00 0.00 175.26 176.51 3h1c h LEU 368 N -1.02 0.54 -0.08 1.80 5.85 -1.96 -3.26 115.31 117.18 3h1c h LEU 368 Ca -0.46 -0.27 -0.10 0.00 0.84 0.00 0.00 57.88 57.89 3h1c h LEU 368 Cb 1.33 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.21 3h1c h LEU 368 CO 0.65 0.94 -0.35 0.24 -0.34 0.00 0.00 178.44 179.58 3h1c h MET 369 N 0.39 0.38 0.00 1.25 2.86 -1.97 -3.44 114.93 114.40 3h1c h MET 369 Ca 0.02 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 3h1c h MET 369 Cb 1.00 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.72 3h1c h MET 369 CO 0.09 0.94 0.00 0.41 1.06 0.00 0.00 176.91 179.41 3h1c n GLY 370 N 0.68 0.66 3.71 8.32 0.00 -1.23 -4.96 105.19 112.37 3h1c n GLY 370 Ca -0.08 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 3h1c n GLY 370 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h1c s GLU 371 N -2.00 4.51 0.07 1.61 2.02 -1.26 -3.65 118.70 119.99 3h1c s GLU 371 Ca 0.00 1.51 0.01 0.00 0.02 0.00 0.00 54.97 56.51 3h1c s GLU 371 Cb 0.00 -3.44 -0.04 0.00 0.10 0.00 0.00 34.13 30.75 3h1c s GLU 371 CO 0.00 -0.14 -0.06 -0.98 0.02 0.00 0.00 175.26 174.11 3h1c s ARG 372 N 1.15 0.66 -0.16 1.61 1.70 -1.01 -5.03 118.95 117.87 3h1c s ARG 372 Ca 0.53 -1.10 -0.05 0.00 -0.47 0.00 0.00 55.73 54.64 3h1c s ARG 372 Cb -0.23 -0.10 -0.03 0.00 -0.57 0.00 0.00 34.95 34.01 3h1c s ARG 372 CO 0.27 -0.03 0.02 0.95 -1.08 0.00 0.00 175.30 175.43 3h1c s THR 373 N -2.94 4.39 -0.23 4.99 -4.23 -1.26 -1.17 115.64 115.19 3h1c s THR 373 Ca 0.03 -0.18 -0.09 0.00 -1.18 0.00 0.00 61.69 60.26 3h1c s THR 373 Cb 0.01 -2.94 -0.04 0.00 1.34 0.00 0.00 72.50 70.86 3h1c s THR 373 CO -0.04 0.50 0.12 -0.62 -0.54 0.00 0.00 174.62 174.04 3h1c s ASP 374 N 0.15 5.87 -0.19 3.99 2.15 0.72 -4.96 116.67 124.39 3h1c s ASP 374 Ca 0.02 0.06 -0.21 0.00 0.43 0.00 0.00 52.55 52.85 3h1c s ASP 374 Cb -0.13 -2.05 -0.21 0.00 -0.30 0.00 0.00 42.92 40.23 3h1c s ASP 374 CO 0.02 0.08 0.31 0.74 -0.17 0.00 0.00 175.17 176.14 3h1c h THR 375 N 5.06 0.99 -3.37 1.71 2.02 -1.95 -2.39 112.91 114.98 3h1c h THR 375 Ca -0.38 -2.23 -0.56 0.00 0.77 0.00 0.00 66.41 64.02 3h1c h THR 375 Cb 1.17 2.40 -0.05 0.00 -1.74 0.00 0.00 68.15 69.94 3h1c h THR 375 CO 0.66 0.42 0.10 0.12 0.37 0.00 0.00 175.52 177.18 3h1c s PHE 376 N -2.37 3.65 -0.04 3.16 5.36 -1.26 -2.53 117.98 123.95 3h1c s PHE 376 Ca -0.27 1.32 0.05 0.00 -0.96 0.00 0.00 56.93 57.08 3h1c s PHE 376 Cb 0.05 -2.78 -0.01 0.00 -0.34 0.00 0.00 43.02 39.94 3h1c s PHE 376 CO 0.63 0.19 -0.20 -0.51 -1.46 0.00 0.00 175.22 173.87 3h1c s LEU 377 N 0.37 1.99 -0.04 6.12 1.43 0.38 -4.99 118.68 123.93 3h1c s LEU 377 Ca 0.37 -0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 53.06 3h1c s LEU 377 Cb -0.19 -1.10 0.03 0.00 0.03 0.00 0.00 46.19 44.96 3h1c s LEU 377 CO 0.20 0.20 0.02 0.12 0.23 0.00 0.00 176.35 177.12 3h1c s PHE 378 N -0.15 0.28 -0.06 0.29 5.36 -1.26 -0.46 117.98 121.98 3h1c s PHE 378 Ca -0.01 0.05 0.05 0.00 -0.96 0.00 0.00 56.93 56.07 3h1c s PHE 378 Cb -0.11 -0.48 -0.01 0.00 -0.34 0.00 0.00 43.02 42.09 3h1c s PHE 378 CO 0.02 -0.18 -0.22 -1.01 -1.46 0.00 0.00 175.22 172.38 3h1c s HIS 379 N 1.50 2.14 -0.28 10.12 3.76 0.14 -4.75 115.29 127.92 3h1c s HIS 379 Ca -0.03 -0.65 -0.02 0.00 -0.15 0.00 0.00 55.06 54.21 3h1c s HIS 379 Cb -0.13 -1.42 0.04 0.00 1.11 0.00 0.00 32.58 32.18 3h1c s HIS 379 CO -0.03 -0.22 -0.03 -0.47 -0.85 0.00 0.00 174.74 173.15 3h1c s TYR 380 N -0.02 3.18 -0.20 1.40 5.04 -1.26 -0.87 117.35 124.61 3h1c s TYR 380 Ca -0.05 -1.72 -0.06 0.00 -2.44 0.00 0.00 57.07 52.79 3h1c s TYR 380 Cb -0.13 -2.09 -0.03 0.00 0.35 0.00 0.00 41.96 40.06 3h1c s TYR 380 CO 0.04 -0.77 0.04 -0.80 -1.34 0.00 0.00 175.55 172.72 3h1c s ASN 381 N 1.29 5.21 -0.55 4.32 0.01 -0.77 -4.71 114.94 119.74 3h1c s ASN 381 Ca -0.03 -0.09 0.04 0.00 -0.71 0.00 0.00 52.86 52.08 3h1c s ASN 381 Cb -0.18 -1.90 0.14 0.00 0.41 0.00 0.00 41.25 39.71 3h1c s ASN 381 CO -0.02 0.09 0.30 0.12 -1.51 0.00 0.00 177.10 176.08 3h1c s PHE 382 N 0.84 3.24 0.61 2.20 5.36 -1.26 -2.85 117.98 126.12 3h1c s PHE 382 Ca 0.02 -3.21 -0.12 0.00 -0.96 0.00 0.00 56.93 52.66 3h1c s PHE 382 Cb -0.14 -2.80 -0.04 0.00 -0.34 0.00 0.00 43.02 39.70 3h1c s PHE 382 CO 0.02 -0.71 1.03 -1.25 -1.46 0.00 0.00 175.22 172.85 3h1c s PRO 383 N -0.48 3.57 0.53 10.12 0.04 -1.26 -4.98 135.00 142.53 3h1c s PRO 383 Ca 0.18 0.84 0.30 0.00 0.04 0.00 0.00 61.00 62.36 3h1c s PRO 383 Cb -0.23 -2.08 1.45 0.00 0.04 0.00 0.00 34.50 33.68 3h1c s PRO 383 CO -0.03 -0.59 2.04 -1.00 0.04 0.00 0.00 177.00 177.47 3h1c h PRO 384 N -0.09 0.00 0.00 0.56 0.13 -1.92 -2.93 132.00 127.75 3h1c h PRO 384 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3h1c h PRO 384 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3h1c h PRO 384 CO 0.61 0.11 0.00 2.48 -0.23 0.00 0.00 178.00 180.97 3h1c n TYR 385 N -3.43 0.00 -0.02 1.56 4.11 -1.25 -1.94 117.16 116.18 3h1c n TYR 385 Ca -0.01 0.00 -0.16 0.00 -0.00 0.00 0.00 57.90 57.73 3h1c n TYR 385 Cb 0.27 -0.06 -0.10 0.00 -0.00 0.00 0.00 39.34 39.44 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 0.39 1.14 9.48 4.64 -1.64 -3.32 113.55 124.24 3h1c h SER 386 Ca 0.00 -0.71 -0.08 0.00 -0.47 0.00 0.00 61.79 60.54 3h1c h SER 386 Cb 0.05 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 3h1c h SER 386 CO 0.00 1.04 -0.90 1.62 -0.87 0.00 0.00 176.83 177.72 3h1c h VAL 387 N -0.23 0.34 0.00 0.95 3.04 -1.78 -1.96 116.25 116.61 3h1c h VAL 387 Ca -0.04 -1.58 0.00 0.00 -1.01 0.00 0.00 66.70 64.07 3h1c h VAL 387 Cb 1.06 1.94 0.00 0.00 -2.01 0.00 0.00 31.29 32.28 3h1c h VAL 387 CO 0.07 0.19 0.00 0.61 -1.01 0.00 0.00 177.57 177.44 3h1c n GLY 388 N 1.25 1.15 3.47 3.17 0.00 -1.17 -4.98 105.19 108.08 3h1c n GLY 388 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.14 1.85 -0.08 1.61 2.02 -0.82 -5.03 118.70 118.11 3h1c s GLU 389 Ca 0.00 -2.11 0.04 0.00 0.02 0.00 0.00 54.97 52.92 3h1c s GLU 389 Cb 0.00 -0.48 -0.01 0.00 0.10 0.00 0.00 34.13 33.74 3h1c s GLU 389 CO 0.00 -0.47 -0.21 0.95 0.02 0.00 0.00 175.26 175.55 3h1c s THR 390 N -3.29 2.37 0.32 3.63 -4.23 -1.26 -3.96 115.64 109.22 3h1c s THR 390 Ca 0.28 -0.94 -0.09 0.00 -1.18 0.00 0.00 61.69 59.76 3h1c s THR 390 Cb 0.03 -1.91 0.04 0.00 1.34 0.00 0.00 72.50 72.00 3h1c s THR 390 CO 0.16 0.56 0.58 0.61 -0.54 0.00 0.00 174.62 175.99 3h1c n GLY 391 N 3.14 1.52 3.55 3.99 0.00 -1.26 -5.06 105.19 111.08 3h1c n GLY 391 Ca -0.18 -1.35 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 3h1c n GLY 391 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h1c s MET 392 N -2.29 3.57 0.65 1.61 -1.94 -1.26 -4.89 119.30 114.75 3h1c s MET 392 Ca 0.17 -0.09 0.21 0.00 -1.71 0.00 0.00 55.69 54.27 3h1c s MET 392 Cb -0.03 -3.84 1.07 0.00 2.01 0.00 0.00 34.83 34.03 3h1c s MET 392 CO 0.13 -0.79 1.59 0.28 -0.01 0.00 0.00 175.02 176.23 3h1c h VAL 393 N 5.71 0.05 -2.72 -6.03 2.07 -1.99 -3.42 116.25 109.92 3h1c h VAL 393 Ca -0.26 0.00 -0.50 0.00 0.82 0.00 0.00 66.70 66.75 3h1c h VAL 393 Cb 1.11 0.41 0.23 0.00 -1.52 0.00 0.00 31.29 31.52 3h1c h VAL 393 CO 0.84 0.00 -1.03 0.61 0.02 0.00 0.00 177.57 178.01 3h1c n GLY 394 N -1.38 -2.53 3.19 2.17 0.00 -1.26 -5.02 105.19 100.36 3h1c n GLY 394 Ca 0.02 -0.73 -0.08 0.00 0.00 0.00 0.00 46.02 45.23 3h1c n GLY 394 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h1c n SER 395 N -0.62 -1.91 -4.23 1.61 3.41 -1.26 -4.81 113.62 105.82 3h1c n SER 395 Ca 0.03 -2.38 -0.32 0.00 -0.26 0.00 0.00 58.87 55.94 3h1c n SER 395 Cb 0.58 3.20 -0.16 0.00 -0.26 0.00 0.00 64.21 67.56 3h1c n SER 395 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 3h1c s PRO 396 N -2.12 3.09 1.14 4.33 0.04 -1.26 -5.16 135.00 135.06 3h1c s PRO 396 Ca 0.14 -0.84 -0.17 0.00 0.04 0.00 0.00 61.00 60.17 3h1c s PRO 396 Cb -0.04 -2.38 0.17 0.00 0.04 0.00 0.00 34.50 32.28 3h1c s PRO 396 CO 0.11 0.13 0.31 0.36 0.04 0.00 0.00 177.00 177.96 3h1c n LYS 397 N 3.67 -1.91 0.08 4.56 0.00 -1.26 -4.81 118.16 118.48 3h1c n LYS 397 Ca -0.19 -0.54 -0.13 0.00 -0.00 0.00 0.00 58.31 57.45 3h1c n LYS 397 Cb 0.53 -1.84 -0.08 0.00 -0.00 0.00 0.00 35.03 33.63 3h1c n LYS 397 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 3h1c h ARG 398 N -2.28 -0.24 -1.18 -1.58 2.43 -2.00 -2.84 114.38 106.70 3h1c h ARG 398 Ca -0.57 0.02 0.34 0.00 -0.81 0.00 0.00 59.98 58.96 3h1c h ARG 398 Cb 1.35 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.91 3h1c h ARG 398 CO 0.42 0.14 0.90 0.00 -1.51 0.00 0.00 179.97 179.92 3h1c h ARG 399 N -0.67 0.00 -0.18 0.20 3.08 -1.98 1.55 114.38 116.37 3h1c h ARG 399 Ca -0.02 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.88 3h1c h ARG 399 Cb 0.48 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 3h1c h ARG 399 CO 0.04 0.00 -0.51 0.93 -1.07 0.00 0.00 179.97 179.37 3h1c h GLU 400 N 0.00 0.49 0.16 0.04 5.08 -1.81 -1.79 114.58 116.74 3h1c h GLU 400 Ca 0.56 -0.29 -0.31 0.00 -1.00 0.00 0.00 59.36 58.32 3h1c h GLU 400 Cb 2.36 0.03 0.03 0.00 0.50 0.00 0.00 28.75 31.67 3h1c h GLU 400 CO -0.01 0.88 -1.31 0.82 -1.00 0.00 0.00 179.01 178.40 3h1c h ILE 401 N 0.39 1.29 -0.53 3.13 2.04 0.22 -2.80 117.51 121.24 3h1c h ILE 401 Ca 0.02 -2.55 -0.06 0.00 1.00 0.00 0.00 64.86 63.26 3h1c h ILE 401 Cb 1.02 2.79 -0.02 0.00 -0.74 0.00 0.00 36.82 39.87 3h1c h ILE 401 CO 0.09 0.77 0.09 1.23 0.00 0.00 0.00 178.15 180.33 3h1c h GLY 402 N 0.35 0.91 1.74 5.37 0.00 -0.68 -2.50 103.07 108.26 3h1c h GLY 402 Ca -0.20 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.57 3h1c h GLY 402 CO 0.25 0.52 -0.21 0.45 0.00 0.00 0.00 176.54 177.55 3h1c h HIS 403 N 0.80 0.00 -0.18 5.60 3.86 -1.43 -2.99 115.15 120.81 3h1c h HIS 403 Ca 0.17 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.25 3h1c h HIS 403 Cb 0.36 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.83 3h1c h HIS 403 CO 0.02 0.00 -0.37 0.78 0.86 0.00 0.00 177.93 179.22 3h1c h GLY 404 N 4.41 0.63 2.00 2.45 0.00 -1.17 -2.99 103.07 108.40 3h1c h GLY 404 Ca 0.00 -0.75 -0.13 0.00 0.00 0.00 0.00 47.33 46.45 3h1c h GLY 404 CO 0.00 0.67 -0.62 -0.09 0.00 0.00 0.00 176.54 176.50 3h1c h ARG 405 N 0.24 0.00 -0.19 4.80 9.65 -1.60 -2.89 114.38 124.39 3h1c h ARG 405 Ca 0.01 0.00 0.03 0.00 -1.10 0.00 0.00 59.98 58.91 3h1c h ARG 405 Cb 0.97 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.52 3h1c h ARG 405 CO 0.08 0.62 0.02 1.25 2.80 0.00 0.00 179.97 184.74 3h1c h LEU 406 N 0.00 -0.03 -0.61 3.80 6.46 -1.51 -0.76 115.31 122.66 3h1c h LEU 406 Ca -0.01 0.04 -0.06 0.00 -0.12 0.00 0.00 57.88 57.73 3h1c h LEU 406 Cb 1.27 0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 41.25 3h1c h LEU 406 CO 0.08 0.01 -0.31 0.00 -0.62 0.00 0.00 178.44 177.61 3h1c h ALA 407 N 1.15 0.90 -0.27 1.25 0.00 -1.58 -3.14 119.26 117.56 3h1c h ALA 407 Ca 0.09 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 3h1c h ALA 407 Cb 0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3h1c h ALA 407 CO -0.13 0.38 -0.38 -0.22 0.00 0.00 0.00 179.25 178.90 3h1c h LYS 408 N 0.00 0.63 0.00 0.00 3.64 -1.19 -3.02 116.57 116.62 3h1c h LYS 408 Ca -0.00 -0.31 -0.08 0.00 -1.27 0.00 0.00 60.65 58.99 3h1c h LYS 408 Cb 1.00 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 3h1c h LYS 408 CO 0.04 0.91 -0.36 0.00 -2.27 0.00 0.00 179.45 177.77 3h1c h ARG 409 N 0.52 0.00 0.00 1.90 3.08 -1.11 -2.05 114.38 116.72 3h1c h ARG 409 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3h1c h ARG 409 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.95 3h1c h ARG 409 CO 0.08 0.36 0.00 0.78 -1.07 0.00 0.00 179.97 180.12 3h1c h GLY 410 N 1.58 0.00 0.00 0.04 0.00 -1.54 -3.34 103.07 99.82 3h1c h GLY 410 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.25 3h1c h GLY 410 CO 0.05 0.00 -1.49 -0.62 0.00 0.00 0.00 176.54 174.47 3h1c n VAL 411 N -2.38 0.27 -0.23 4.60 0.31 -1.17 -4.68 118.33 115.05 3h1c n VAL 411 Ca 0.05 -0.28 0.06 0.00 -0.01 0.00 0.00 64.34 64.16 3h1c n VAL 411 Cb 0.44 -0.20 0.31 0.00 -0.91 0.00 0.00 33.84 33.48 3h1c n VAL 411 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3h1c h LEU 412 N 0.00 0.75 -0.82 7.52 5.85 -1.49 0.15 115.31 127.27 3h1c h LEU 412 Ca -0.11 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.50 3h1c h LEU 412 Cb 0.93 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 3h1c h LEU 412 CO 0.01 0.48 -0.58 0.00 -0.34 0.00 0.00 178.44 178.01 3h1c h ALA 413 N 1.57 1.01 0.13 1.25 0.00 -1.84 -3.19 119.26 118.19 3h1c h ALA 413 Ca 0.35 -0.52 -0.28 0.00 0.00 0.00 0.00 54.91 54.45 3h1c h ALA 413 Cb 0.27 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3h1c h ALA 413 CO -0.13 0.72 -1.32 0.28 0.00 0.00 0.00 179.25 178.81 3h1c h VAL 414 N 0.00 1.41 -3.12 0.00 2.07 -1.42 -3.47 116.25 111.73 3h1c h VAL 414 Ca -0.01 -3.00 -0.56 0.00 0.82 0.00 0.00 66.70 63.96 3h1c h VAL 414 Cb 1.04 2.91 0.09 0.00 -1.52 0.00 0.00 31.29 33.81 3h1c h VAL 414 CO 0.07 0.87 0.66 0.23 0.02 0.00 0.00 177.57 179.43 3h1c n MET 415 N -3.52 2.28 -1.16 1.57 2.00 0.37 -2.39 117.12 116.28 3h1c n MET 415 Ca -0.10 0.81 -0.31 0.00 0.00 0.00 0.00 57.70 58.09 3h1c n MET 415 Cb 1.03 -2.48 0.11 0.00 0.00 0.00 0.00 33.22 31.88 3h1c n MET 415 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 3h1c s PRO 416 N -1.00 2.01 0.95 0.03 0.04 -1.26 -4.90 135.00 130.85 3h1c s PRO 416 Ca 0.62 1.26 -0.13 0.00 0.04 0.00 0.00 61.00 62.80 3h1c s PRO 416 Cb -0.57 -1.86 0.16 0.00 0.04 0.00 0.00 34.50 32.26 3h1c s PRO 416 CO 0.54 -1.85 1.13 0.16 0.04 0.00 0.00 177.00 177.03 3h1c s ASP 417 N -3.20 3.18 0.30 6.66 -4.77 -1.26 -4.88 116.67 112.70 3h1c s ASP 417 Ca 0.63 0.99 0.08 0.00 -3.30 0.00 0.00 52.55 50.94 3h1c s ASP 417 Cb -0.19 -1.57 0.48 0.00 -1.09 0.00 0.00 42.92 40.56 3h1c s ASP 417 CO 0.56 -2.76 1.71 -0.03 0.70 0.00 0.00 175.17 175.35 3h1c h MET 418 N -1.64 0.17 -0.25 2.11 1.85 -1.97 -2.46 114.93 112.74 3h1c h MET 418 Ca -0.51 -0.08 -0.10 0.00 -0.61 0.00 0.00 59.70 58.39 3h1c h MET 418 Cb 1.33 -0.00 -0.00 0.00 0.43 0.00 0.00 31.60 33.36 3h1c h MET 418 CO 0.60 0.58 -0.24 -0.44 -0.40 0.00 0.00 176.91 177.01 3h1c h ASP 419 N 0.14 0.65 0.60 1.39 3.32 -2.00 -2.99 116.42 117.53 3h1c h ASP 419 Ca 0.01 -0.47 -0.23 0.00 0.02 0.00 0.00 57.03 56.36 3h1c h ASP 419 Cb 0.83 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.19 3h1c h ASP 419 CO 0.06 0.98 -1.04 0.11 -1.72 0.00 0.00 179.24 177.64 3h1c h LYS 420 N 0.32 0.24 -2.89 3.56 1.79 -1.95 -3.41 116.57 114.22 3h1c h LYS 420 Ca 0.04 -0.32 -0.57 0.00 -2.18 0.00 0.00 60.65 57.62 3h1c h LYS 420 Cb 0.79 0.11 -0.40 0.00 -1.58 0.00 0.00 32.23 31.16 3h1c h LYS 420 CO 0.06 1.08 -0.79 0.12 -1.08 0.00 0.00 179.45 178.84 3h1c s PHE 421 N -2.96 0.93 -0.97 -1.35 5.36 -0.93 -5.04 117.98 113.02 3h1c s PHE 421 Ca -0.03 -1.49 -0.04 0.00 -0.96 0.00 0.00 56.93 54.40 3h1c s PHE 421 Cb 0.09 -1.19 0.12 0.00 -0.34 0.00 0.00 43.02 41.70 3h1c s PHE 421 CO 0.85 -0.83 2.48 -0.35 -1.46 0.00 0.00 175.22 175.91 3h1c n PRO 422 N 4.55 3.80 -4.11 10.12 -0.04 -1.13 -4.37 135.00 143.83 3h1c n PRO 422 Ca 0.03 -3.15 -0.17 0.00 -0.04 0.00 0.00 63.50 60.17 3h1c n PRO 422 Cb 0.39 -2.43 -0.15 0.00 -0.04 0.00 0.00 33.50 31.27 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 -1.69 0.50 -0.10 0.54 2.02 -1.26 -4.71 117.35 112.64 3h1c s TYR 423 Ca 0.55 -0.10 -0.30 0.00 -0.37 0.00 0.00 57.07 56.85 3h1c s TYR 423 Cb 0.27 -0.41 -0.02 0.00 -0.40 0.00 0.00 41.96 41.39 3h1c s TYR 423 CO -0.16 -0.08 1.16 0.95 -1.57 0.00 0.00 175.55 175.86 3h1c s THR 424 N 0.38 4.40 -0.19 -0.71 -4.23 0.01 -4.86 115.64 110.43 3h1c s THR 424 Ca -0.04 1.70 -0.06 0.00 -1.18 0.00 0.00 61.69 62.11 3h1c s THR 424 Cb -0.08 -4.09 -0.03 0.00 1.34 0.00 0.00 72.50 69.64 3h1c s THR 424 CO -0.00 -0.05 0.03 -0.69 -0.54 0.00 0.00 174.62 173.37 3h1c s VAL 425 N 2.54 4.37 -0.22 2.29 1.01 -1.05 -1.19 120.40 128.16 3h1c s VAL 425 Ca 0.53 -0.17 -0.04 0.00 0.00 0.00 0.00 61.98 62.30 3h1c s VAL 425 Cb -0.22 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 3h1c s VAL 425 CO 0.18 0.44 -0.05 -0.60 0.00 0.00 0.00 175.10 175.07 3h1c s ARG 426 N 0.72 3.38 -0.18 2.72 3.52 0.20 -0.47 118.95 128.83 3h1c s ARG 426 Ca 0.02 -0.63 -0.02 0.00 -0.13 0.00 0.00 55.73 54.97 3h1c s ARG 426 Cb -0.14 -2.99 -0.00 0.00 -1.56 0.00 0.00 34.95 30.26 3h1c s ARG 426 CO 0.02 -0.17 -0.11 0.08 -0.81 0.00 0.00 175.30 174.31 3h1c s VAL 427 N 1.41 2.97 -0.17 7.11 1.01 0.39 -0.58 120.40 132.55 3h1c s VAL 427 Ca 0.05 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.38 3h1c s VAL 427 Cb -0.14 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.94 3h1c s VAL 427 CO -0.03 0.48 -0.16 -0.69 0.00 0.00 0.00 175.10 174.70 3h1c s VAL 428 N 1.08 2.57 -0.26 2.92 1.01 -0.99 -0.68 120.40 126.05 3h1c s VAL 428 Ca 0.00 -0.79 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 3h1c s VAL 428 Cb -0.15 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 3h1c s VAL 428 CO -0.02 0.51 0.11 -0.55 0.00 0.00 0.00 175.10 175.15 3h1c s SER 429 N 0.98 5.42 -0.33 3.32 0.15 -0.05 -1.08 113.70 122.11 3h1c s SER 429 Ca -0.02 -0.13 -0.06 0.00 0.70 0.00 0.00 55.95 56.43 3h1c s SER 429 Cb -0.15 -1.99 0.04 0.00 -1.71 0.00 0.00 66.02 62.22 3h1c s SER 429 CO -0.03 -0.03 0.10 -1.61 1.20 0.00 0.00 173.24 172.86 3h1c s GLU 430 N 1.61 2.63 -0.42 5.44 0.41 0.92 -1.85 118.70 127.44 3h1c s GLU 430 Ca 0.06 -1.17 -0.29 0.00 -0.41 0.00 0.00 54.97 53.17 3h1c s GLU 430 Cb -0.15 -3.44 0.02 0.00 -1.78 0.00 0.00 34.13 28.78 3h1c s GLU 430 CO 0.06 -0.65 1.31 0.42 -0.49 0.00 0.00 175.26 175.91 3h1c s ILE 431 N 1.40 4.03 -0.07 -1.63 -1.09 -1.13 0.46 121.20 123.16 3h1c s ILE 431 Ca -0.02 1.06 -0.18 0.00 -2.23 0.00 0.00 60.65 59.28 3h1c s ILE 431 Cb -0.19 -4.33 -0.30 0.00 -1.58 0.00 0.00 42.46 36.06 3h1c s ILE 431 CO 0.03 -0.81 0.74 0.74 -1.23 0.00 0.00 174.94 174.41 3h1c h THR 432 N 6.34 1.26 -3.63 2.92 2.02 -1.79 -3.41 112.91 116.62 3h1c h THR 432 Ca -0.26 -2.49 -0.17 0.00 0.77 0.00 0.00 66.41 64.26 3h1c h THR 432 Cb 1.09 2.96 -0.23 0.00 -1.74 0.00 0.00 68.15 70.23 3h1c h THR 432 CO 1.09 0.72 -0.58 -1.83 0.37 0.00 0.00 175.52 175.29 3h1c s GLU 433 N -2.47 0.31 -0.18 6.66 -1.05 -1.23 -3.95 118.70 116.79 3h1c s GLU 433 Ca -0.16 -0.27 0.01 0.00 -0.15 0.00 0.00 54.97 54.40 3h1c s GLU 433 Cb 0.03 0.13 0.04 0.00 -0.44 0.00 0.00 34.13 33.88 3h1c s GLU 433 CO 0.81 -0.06 -0.10 0.45 0.95 0.00 0.00 175.26 177.30 3h1c s SER 434 N -0.90 3.12 -0.27 0.83 0.15 -0.74 -0.79 113.70 115.10 3h1c s SER 434 Ca -0.10 -0.75 -0.01 0.00 0.70 0.00 0.00 55.95 55.79 3h1c s SER 434 Cb -0.06 -1.17 0.16 0.00 -1.71 0.00 0.00 66.02 63.24 3h1c s SER 434 CO 0.00 -0.13 0.46 0.21 1.20 0.00 0.00 173.24 174.99 3h1c s ASN 435 N 1.46 -0.35 0.00 5.45 2.47 -1.25 -4.67 114.94 118.05 3h1c s ASN 435 Ca 0.01 0.32 0.00 0.00 0.42 0.00 0.00 52.86 53.60 3h1c s ASN 435 Cb -0.15 1.49 0.00 0.00 -1.45 0.00 0.00 41.25 41.14 3h1c s ASN 435 CO -0.09 -0.30 0.00 0.61 -3.72 0.00 0.00 177.10 173.61 3h1c n GLY 436 N 5.39 0.86 3.35 1.21 0.00 -1.26 -4.08 105.19 110.65 3h1c n GLY 436 Ca -0.02 -1.13 -0.35 0.00 0.00 0.00 0.00 46.02 44.52 3h1c n GLY 436 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h1c s SER 437 N -4.00 4.55 -0.02 1.61 0.15 -1.26 -4.60 113.70 110.13 3h1c s SER 437 Ca 0.00 -0.36 0.16 0.00 0.70 0.00 0.00 55.95 56.45 3h1c s SER 437 Cb 0.00 -1.79 -0.22 0.00 -1.71 0.00 0.00 66.02 62.29 3h1c s SER 437 CO 0.00 -0.03 0.45 -1.54 1.20 0.00 0.00 173.24 173.32 3h1c n SER 438 N 4.83 1.15 0.07 5.45 3.41 -1.26 -4.05 113.62 123.21 3h1c n SER 438 Ca -0.18 -0.27 -0.15 0.00 -0.26 0.00 0.00 58.87 58.01 3h1c n SER 438 Cb 0.51 1.50 -0.07 0.00 -0.26 0.00 0.00 64.21 65.90 3h1c n SER 438 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3h1c h SER 439 N 0.00 0.61 0.61 4.04 0.02 -1.93 -2.74 113.55 114.17 3h1c h SER 439 Ca 0.00 -0.50 -0.15 0.00 -0.84 0.00 0.00 61.79 60.30 3h1c h SER 439 Cb 0.62 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 3h1c h SER 439 CO 0.00 1.31 -0.69 0.24 -1.14 0.00 0.00 176.83 176.55 3h1c h MET 440 N 0.25 0.06 0.00 3.45 2.86 -1.86 -3.01 114.93 116.68 3h1c h MET 440 Ca -0.10 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.43 3h1c h MET 440 Cb 1.64 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 33.31 3h1c h MET 440 CO 0.18 0.73 -0.27 0.00 1.06 0.00 0.00 176.91 178.60 3h1c h ALA 441 N 1.26 1.00 -0.06 6.32 0.00 -1.70 -2.96 119.26 123.13 3h1c h ALA 441 Ca -0.01 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 3h1c h ALA 441 Cb 1.22 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3h1c h ALA 441 CO 0.09 0.34 -0.50 0.77 0.00 0.00 0.00 179.25 179.95 3h1c h SER 442 N 0.00 0.18 -0.09 0.00 0.02 -1.35 -2.24 113.55 110.07 3h1c h SER 442 Ca -0.00 -0.09 -0.19 0.00 -0.84 0.00 0.00 61.79 60.68 3h1c h SER 442 Cb 0.81 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.30 3h1c h SER 442 CO 0.03 0.65 -0.62 0.58 -1.14 0.00 0.00 176.83 176.34 3h1c h VAL 443 N 0.13 1.30 -0.40 2.27 2.07 -1.53 -1.68 116.25 118.40 3h1c h VAL 443 Ca 0.00 -1.85 -0.10 0.00 0.82 0.00 0.00 66.70 65.57 3h1c h VAL 443 Cb 0.94 1.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.49 3h1c h VAL 443 CO 0.07 0.59 -0.17 0.00 0.02 0.00 0.00 177.57 178.08 3h1c h GLY 445 N 0.97 0.00 0.90 0.00 0.00 -1.39 -3.30 103.07 100.25 3h1c h GLY 445 Ca 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.38 3h1c h GLY 445 CO 0.05 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.59 3h1c h ALA 446 N 1.82 0.44 -0.19 3.60 0.00 -1.06 -1.83 119.26 122.04 3h1c h ALA 446 Ca -0.00 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 3h1c h ALA 446 Cb 1.03 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3h1c h ALA 446 CO 0.02 0.19 -0.23 1.03 0.00 0.00 0.00 179.25 180.26 3h1c h SER 447 N 0.37 0.34 0.61 0.00 0.87 -1.64 -1.86 113.55 112.25 3h1c h SER 447 Ca 0.09 -0.10 -0.16 0.00 -1.23 0.00 0.00 61.79 60.39 3h1c h SER 447 Cb 0.44 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.29 3h1c h SER 447 CO 0.02 0.59 -0.73 -0.07 -0.53 0.00 0.00 176.83 176.10 3h1c h LEU 448 N 0.31 0.12 -0.25 2.23 3.38 -1.61 -2.61 115.31 116.87 3h1c h LEU 448 Ca 0.05 -0.08 -0.21 0.00 0.09 0.00 0.00 57.88 57.73 3h1c h LEU 448 Cb 0.59 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3h1c h LEU 448 CO 0.04 0.81 -0.85 0.00 0.09 0.00 0.00 178.44 178.53 3h1c h ALA 449 N 1.19 0.44 -0.23 1.53 0.00 -1.07 -2.83 119.26 118.29 3h1c h ALA 449 Ca -0.02 -0.66 -0.18 0.00 0.00 0.00 0.00 54.91 54.05 3h1c h ALA 449 Cb 1.29 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 3h1c h ALA 449 CO 0.10 0.78 -0.57 -0.07 0.00 0.00 0.00 179.25 179.50 3h1c h LEU 450 N 0.28 0.79 -0.80 0.00 3.38 -1.35 -2.22 115.31 115.38 3h1c h LEU 450 Ca -0.06 -0.43 -0.13 0.00 0.09 0.00 0.00 57.88 57.35 3h1c h LEU 450 Cb 1.47 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 3h1c h LEU 450 CO 0.15 1.19 -0.59 0.24 0.09 0.00 0.00 178.44 179.52 3h1c h MET 451 N 0.54 0.04 -0.01 1.13 2.86 -1.54 0.58 114.93 118.52 3h1c h MET 451 Ca 0.01 -0.02 -0.20 0.00 -2.06 0.00 0.00 59.70 57.43 3h1c h MET 451 Cb 1.14 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 3h1c h MET 451 CO 0.12 0.61 -0.85 0.22 1.06 0.00 0.00 176.91 178.07 3h1c h ASP 452 N 0.03 0.34 0.46 1.22 3.58 -1.47 -3.26 116.42 117.32 3h1c h ASP 452 Ca -0.01 -0.26 -0.17 0.00 0.42 0.00 0.00 57.03 57.01 3h1c h ASP 452 Cb 1.04 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.98 3h1c h ASP 452 CO 0.08 1.04 -0.73 0.00 -2.88 0.00 0.00 179.24 176.76 3h1c h ALA 453 N 0.94 0.70 0.00 -0.78 0.00 -1.29 -3.44 119.26 115.39 3h1c h ALA 453 Ca -0.05 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.24 3h1c h ALA 453 Cb 1.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3h1c h ALA 453 CO 0.14 0.81 0.00 0.41 0.00 0.00 0.00 179.25 180.61 3h1c n GLY 454 N 0.54 1.40 3.66 0.00 0.00 -0.82 -4.87 105.19 105.11 3h1c n GLY 454 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 3h1c n GLY 454 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h1c s VAL 455 N -2.00 4.50 -1.18 1.61 1.01 0.13 -4.96 120.40 119.51 3h1c s VAL 455 Ca 0.00 1.80 -0.20 0.00 0.00 0.00 0.00 61.98 63.59 3h1c s VAL 455 Cb 0.00 -4.18 0.07 0.00 0.00 0.00 0.00 36.38 32.27 3h1c s VAL 455 CO 0.00 -0.18 1.60 -2.16 0.00 0.00 0.00 175.10 174.36 3h1c s PRO 456 N 3.36 3.83 0.60 2.72 0.04 -1.26 -4.40 135.00 139.89 3h1c s PRO 456 Ca 0.49 -1.68 -0.10 0.00 0.04 0.00 0.00 61.00 59.75 3h1c s PRO 456 Cb -0.18 -5.43 -0.04 0.00 0.04 0.00 0.00 34.50 28.89 3h1c s PRO 456 CO 0.10 -2.20 1.00 0.96 0.04 0.00 0.00 177.00 176.90 3h1c s ILE 457 N 4.36 4.73 0.05 0.56 -4.36 -1.26 -4.42 121.20 120.85 3h1c s ILE 457 Ca 0.50 0.81 -0.25 0.00 -0.26 0.00 0.00 60.65 61.45 3h1c s ILE 457 Cb 0.02 -3.87 -0.17 0.00 1.25 0.00 0.00 42.46 39.69 3h1c s ILE 457 CO 0.00 -1.10 1.54 0.11 0.24 0.00 0.00 174.94 175.73 3h1c h LYS 458 N -0.22 -0.20 -3.72 0.37 1.57 -1.82 -3.48 116.57 109.07 3h1c h LYS 458 Ca -0.44 0.01 -0.18 0.00 -1.87 0.00 0.00 60.65 58.17 3h1c h LYS 458 Cb 1.19 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.49 3h1c h LYS 458 CO 0.62 0.00 -0.03 0.00 -0.57 0.00 0.00 179.45 179.47 3h1c s ALA 459 N -5.54 0.21 0.29 3.86 0.00 -1.26 -5.15 121.76 114.17 3h1c s ALA 459 Ca -0.14 -1.22 -0.28 0.00 0.00 0.00 0.00 51.96 50.31 3h1c s ALA 459 Cb 0.04 0.99 -0.09 0.00 0.00 0.00 0.00 23.12 24.06 3h1c s ALA 459 CO 0.64 -0.86 1.02 0.00 0.00 0.00 0.00 175.76 176.55 3h1c s ALA 460 N -2.87 3.30 -0.03 0.00 0.00 -1.26 -5.03 121.76 115.86 3h1c s ALA 460 Ca 0.25 0.72 0.05 0.00 0.00 0.00 0.00 51.96 52.98 3h1c s ALA 460 Cb -0.02 -3.26 -0.01 0.00 0.00 0.00 0.00 23.12 19.83 3h1c s ALA 460 CO 0.17 -0.00 -0.19 0.54 0.00 0.00 0.00 175.76 176.28 3h1c s VAL 461 N -1.32 1.52 0.14 0.00 0.11 -1.26 -4.41 120.40 115.18 3h1c s VAL 461 Ca 0.47 -0.79 -0.00 0.00 -2.93 0.00 0.00 61.98 58.72 3h1c s VAL 461 Cb -0.26 -1.29 -0.04 0.00 -1.53 0.00 0.00 36.38 33.25 3h1c s VAL 461 CO 0.33 0.43 0.05 0.00 -3.33 0.00 0.00 175.10 172.58 3h1c s ALA 462 N -0.15 0.98 -0.13 1.54 0.00 -0.61 -4.26 121.76 119.12 3h1c s ALA 462 Ca 0.00 -1.50 -0.18 0.00 0.00 0.00 0.00 51.96 50.27 3h1c s ALA 462 Cb -0.10 0.82 0.05 0.00 0.00 0.00 0.00 23.12 23.88 3h1c s ALA 462 CO 0.01 -0.46 0.48 0.20 0.00 0.00 0.00 175.76 176.00 3h1c s GLY 463 N -3.08 -0.35 0.08 0.00 0.00 -1.26 -1.12 107.32 101.59 3h1c s GLY 463 Ca 0.24 1.15 -0.01 0.00 0.00 0.00 0.00 44.72 46.11 3h1c s GLY 463 CO 0.02 0.94 -0.01 -0.26 0.00 0.00 0.00 173.10 173.79 3h1c s ILE 464 N -0.27 0.26 0.11 0.90 -5.25 -0.81 -4.44 121.20 111.70 3h1c s ILE 464 Ca -0.04 -1.85 0.04 0.00 -0.99 0.00 0.00 60.65 57.80 3h1c s ILE 464 Cb -0.03 -1.69 -0.04 0.00 2.95 0.00 0.00 42.46 43.65 3h1c s ILE 464 CO 0.03 -0.84 0.08 0.00 -1.79 0.00 0.00 174.94 172.42 3h1c s ALA 465 N -3.91 3.50 0.04 2.27 0.00 -1.26 -1.94 121.76 120.45 3h1c s ALA 465 Ca 0.12 -1.11 0.06 0.00 0.00 0.00 0.00 51.96 51.04 3h1c s ALA 465 Cb 0.08 -1.35 -0.02 0.00 0.00 0.00 0.00 23.12 21.82 3h1c s ALA 465 CO -0.06 0.66 -0.18 -1.64 0.00 0.00 0.00 175.76 174.54 3h1c s MET 466 N -2.61 1.19 0.41 0.00 -1.94 0.23 -1.54 119.30 115.04 3h1c s MET 466 Ca 0.29 -0.84 0.05 0.00 -1.71 0.00 0.00 55.69 53.49 3h1c s MET 466 Cb -0.11 -1.25 -0.07 0.00 2.01 0.00 0.00 34.83 35.41 3h1c s MET 466 CO 0.22 0.32 0.02 0.20 -0.01 0.00 0.00 175.02 175.77 3h1c s GLY 467 N -1.10 2.51 -0.11 -0.03 0.00 -0.86 -0.92 107.32 106.81 3h1c s GLY 467 Ca 0.05 -1.95 -0.12 0.00 0.00 0.00 0.00 44.72 42.71 3h1c s GLY 467 CO 0.01 -2.05 0.32 -2.27 0.00 0.00 0.00 173.10 169.11 3h1c s LEU 468 N -3.69 0.78 -0.15 0.66 2.96 -1.26 -1.71 118.68 116.27 3h1c s LEU 468 Ca 0.31 0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 54.80 3h1c s LEU 468 Cb 0.08 1.12 0.04 0.00 0.50 0.00 0.00 46.19 47.93 3h1c s LEU 468 CO 0.15 -0.15 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.30 3h1c s VAL 469 N 0.02 0.99 -0.05 1.68 1.01 -1.13 -1.88 120.40 121.04 3h1c s VAL 469 Ca -0.01 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.50 3h1c s VAL 469 Cb -0.03 -1.16 0.01 0.00 0.00 0.00 0.00 36.38 35.20 3h1c s VAL 469 CO 0.01 0.17 -0.13 -0.75 0.00 0.00 0.00 175.10 174.39 3h1c s LYS 470 N 1.69 1.56 -0.35 2.72 2.20 -1.26 -2.61 119.74 123.69 3h1c s LYS 470 Ca 0.02 -0.45 -0.01 0.00 -0.36 0.00 0.00 55.97 55.17 3h1c s LYS 470 Cb -0.15 -1.34 0.12 0.00 -1.51 0.00 0.00 37.83 34.96 3h1c s LYS 470 CO -0.08 0.12 0.18 -2.00 -0.36 0.00 0.00 175.35 173.21 3h1c s GLU 471 N 0.35 0.67 0.00 4.03 2.56 -1.20 -4.99 118.70 120.12 3h1c s GLU 471 Ca -0.08 -1.26 0.00 0.00 0.00 0.00 0.00 54.97 53.62 3h1c s GLU 471 Cb -0.13 -1.63 0.00 0.00 2.00 0.00 0.00 34.13 34.37 3h1c s GLU 471 CO 0.02 -1.12 0.00 0.41 -0.56 0.00 0.00 175.26 174.02 3h1c n GLY 472 N 4.34 1.08 0.00 -1.50 0.00 -1.26 -4.35 105.19 103.50 3h1c n GLY 472 Ca 0.05 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 2.61 0.00 -4.81 1.61 5.75 -1.26 -5.11 116.55 115.35 3h1c n ASP 473 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 54.79 54.42 3h1c n ASP 473 Cb 0.00 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.03 3h1c n ASP 473 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3h1c s ASN 474 N -0.32 7.11 0.05 -1.12 4.22 -1.26 -5.08 114.94 118.54 3h1c s ASN 474 Ca 0.00 1.53 0.01 0.00 -2.14 0.00 0.00 52.86 52.26 3h1c s ASN 474 Cb 0.00 -2.46 -0.03 0.00 1.28 0.00 0.00 41.25 40.04 3h1c s ASN 474 CO 0.00 -0.03 -0.06 -0.72 -2.04 0.00 0.00 177.10 174.25 3h1c s TYR 475 N -1.61 0.61 -0.10 1.54 1.13 -1.26 -3.25 117.35 114.41 3h1c s TYR 475 Ca 0.47 -0.65 -0.00 0.00 -1.41 0.00 0.00 57.07 55.47 3h1c s TYR 475 Cb -0.16 -0.38 0.02 0.00 -1.10 0.00 0.00 41.96 40.34 3h1c s TYR 475 CO 0.21 -0.15 -0.07 0.08 -2.51 0.00 0.00 175.55 173.11 3h1c s VAL 476 N -2.13 0.94 -0.13 -3.49 1.01 -1.07 -5.04 120.40 110.49 3h1c s VAL 476 Ca -0.05 -0.26 -0.17 0.00 0.00 0.00 0.00 61.98 61.49 3h1c s VAL 476 Cb -0.05 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 3h1c s VAL 476 CO -0.02 0.35 0.44 -0.69 0.00 0.00 0.00 175.10 175.17 3h1c s VAL 477 N 1.52 5.21 -0.06 2.92 1.01 -1.26 -2.85 120.40 126.89 3h1c s VAL 477 Ca 0.01 0.86 -0.01 0.00 0.00 0.00 0.00 61.98 62.84 3h1c s VAL 477 Cb -0.13 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.44 3h1c s VAL 477 CO -0.05 0.33 0.00 -0.76 0.00 0.00 0.00 175.10 174.62 3h1c s LEU 478 N 0.67 3.56 -0.15 3.92 1.02 -0.69 -4.67 118.68 122.34 3h1c s LEU 478 Ca 0.24 0.10 -0.04 0.00 0.02 0.00 0.00 54.13 54.44 3h1c s LEU 478 Cb -0.15 -1.89 -0.03 0.00 0.02 0.00 0.00 46.19 44.14 3h1c s LEU 478 CO 0.09 0.35 -0.01 -0.44 0.02 0.00 0.00 176.35 176.36 3h1c s SER 479 N -1.10 5.07 -0.67 2.29 0.01 -1.20 -2.02 113.70 116.07 3h1c s SER 479 Ca 0.15 -0.04 -0.08 0.00 1.31 0.00 0.00 55.95 57.29 3h1c s SER 479 Cb -0.11 -1.79 0.01 0.00 0.21 0.00 0.00 66.02 64.33 3h1c s SER 479 CO 0.05 0.19 0.65 -0.67 0.41 0.00 0.00 173.24 173.87 3h1c n ASP 480 N 3.37 -6.62 -4.79 2.44 2.03 -0.59 -4.63 116.55 107.76 3h1c n ASP 480 Ca -0.17 -0.25 -0.33 0.00 0.52 0.00 0.00 54.79 54.56 3h1c n ASP 480 Cb 0.52 -3.72 0.03 0.00 -0.72 0.00 0.00 41.12 37.23 3h1c n ASP 480 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 3h1c s ILE 481 N -2.72 3.55 0.87 5.18 -4.36 -1.25 -4.78 121.20 117.70 3h1c s ILE 481 Ca 0.10 0.72 -0.09 0.00 -0.26 0.00 0.00 60.65 61.12 3h1c s ILE 481 Cb -0.02 -3.25 0.18 0.00 1.25 0.00 0.00 42.46 40.62 3h1c s ILE 481 CO 0.82 -0.45 1.19 -0.76 0.24 0.00 0.00 174.94 175.98 3h1c s LEU 482 N -4.70 2.84 0.02 0.37 1.02 -1.26 -4.18 118.68 112.79 3h1c s LEU 482 Ca 0.65 -0.11 -0.10 0.00 0.02 0.00 0.00 54.13 54.59 3h1c s LEU 482 Cb -0.18 -2.00 -0.05 0.00 0.02 0.00 0.00 46.19 43.98 3h1c s LEU 482 CO 0.40 -2.44 1.16 1.23 0.02 0.00 0.00 176.35 176.71 3h1c h GLY 483 N -1.20 -0.85 -0.16 -3.19 0.00 -1.81 -2.98 103.07 92.88 3h1c h GLY 483 Ca -0.40 0.38 0.08 0.00 0.00 0.00 0.00 47.33 47.39 3h1c h GLY 483 CO 0.36 -0.29 -0.32 -0.55 0.00 0.00 0.00 176.54 175.74 3h1c h ASP 484 N -0.29 -1.05 -1.70 0.19 3.32 -1.96 0.88 116.42 115.80 3h1c h ASP 484 Ca -0.02 0.19 0.52 0.00 0.02 0.00 0.00 57.03 57.74 3h1c h ASP 484 Cb 0.25 0.50 -0.10 0.00 0.22 0.00 0.00 39.33 40.20 3h1c h ASP 484 CO -0.02 -0.31 1.19 -0.33 -1.72 0.00 0.00 179.24 178.05 3h1c h GLU 485 N -0.24 0.01 -0.06 3.56 5.08 -1.94 1.37 114.58 122.37 3h1c h GLU 485 Ca 0.18 -0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.29 3h1c h GLU 485 Cb 0.53 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.79 3h1c h GLU 485 CO -0.54 0.01 -0.92 0.22 -1.00 0.00 0.00 179.01 176.78 3h1c h ASP 486 N 0.01 0.86 0.18 1.42 3.58 -0.66 0.27 116.42 122.09 3h1c h ASP 486 Ca 0.89 -0.63 -0.27 0.00 0.42 0.00 0.00 57.03 57.43 3h1c h ASP 486 Cb 3.30 -0.26 0.02 0.00 1.72 0.00 0.00 39.33 44.11 3h1c h ASP 486 CO -0.17 1.43 -1.13 0.45 -2.88 0.00 0.00 179.24 176.94 3h1c h HIS 487 N 0.43 0.90 -0.01 0.28 3.86 0.17 -3.30 115.15 117.48 3h1c h HIS 487 Ca -0.09 -0.53 0.00 0.00 -1.16 0.00 0.00 60.37 58.59 3h1c h HIS 487 Cb 1.55 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 29.94 3h1c h HIS 487 CO 0.09 1.37 -0.33 1.28 0.86 0.00 0.00 177.93 181.20 3h1c n LEU 488 N -3.78 1.18 0.00 2.43 4.77 0.78 -4.90 117.00 117.48 3h1c n LEU 488 Ca -0.11 -0.34 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 3h1c n LEU 488 Cb 0.93 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 3h1c n LEU 488 CO 0.56 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 3h1c n GLY 489 N 1.37 1.00 0.00 -0.72 0.00 0.08 -4.90 105.19 102.03 3h1c n GLY 489 Ca 0.11 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.69 3h1c n GLY 489 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h1c n ASP 490 N 0.00 1.63 -3.82 1.61 8.00 -0.79 -4.99 116.55 118.19 3h1c n ASP 490 Ca 0.00 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.39 3h1c n ASP 490 Cb 0.00 0.13 -0.08 0.00 -0.02 0.00 0.00 41.12 41.14 3h1c n ASP 490 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h1c s MET 491 N -1.34 0.69 -0.76 -1.24 0.23 -1.26 -0.60 119.30 115.02 3h1c s MET 491 Ca 0.00 -0.54 -0.01 0.00 -1.03 0.00 0.00 55.69 54.11 3h1c s MET 491 Cb 0.00 0.29 0.19 0.00 -1.53 0.00 0.00 34.83 33.78 3h1c s MET 491 CO 0.00 -0.20 0.60 0.34 -2.03 0.00 0.00 175.02 173.73 3h1c s ASP 492 N -1.93 5.46 -0.67 -1.18 2.15 -0.68 -4.23 116.67 115.59 3h1c s ASP 492 Ca -0.07 -3.44 -0.22 0.00 0.43 0.00 0.00 52.55 49.26 3h1c s ASP 492 Cb -0.02 -1.83 0.08 0.00 -0.30 0.00 0.00 42.92 40.85 3h1c s ASP 492 CO -0.02 -0.23 0.93 0.12 -0.17 0.00 0.00 175.17 175.80 3h1c s PHE 493 N -0.91 2.76 -0.20 -5.34 5.36 -0.10 -2.95 117.98 116.60 3h1c s PHE 493 Ca 0.23 -0.69 -0.10 0.00 -0.96 0.00 0.00 56.93 55.41 3h1c s PHE 493 Cb -0.12 -4.25 -0.05 0.00 -0.34 0.00 0.00 43.02 38.27 3h1c s PHE 493 CO -0.10 -1.58 0.13 0.15 -1.46 0.00 0.00 175.22 172.36 3h1c s LYS 494 N 3.72 4.16 -0.09 10.12 1.02 0.69 0.77 119.74 140.14 3h1c s LYS 494 Ca 0.21 -0.23 0.01 0.00 0.02 0.00 0.00 55.97 55.98 3h1c s LYS 494 Cb -0.17 -3.41 0.02 0.00 -0.52 0.00 0.00 37.83 33.75 3h1c s LYS 494 CO 0.08 0.28 -0.10 0.08 -0.92 0.00 0.00 175.35 174.77 3h1c s VAL 495 N 0.41 1.07 -0.05 3.17 1.01 -0.82 -0.69 120.40 124.51 3h1c s VAL 495 Ca 0.08 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.69 3h1c s VAL 495 Cb -0.11 -1.03 0.01 0.00 0.00 0.00 0.00 36.38 35.25 3h1c s VAL 495 CO -0.01 0.36 -0.10 0.00 0.00 0.00 0.00 175.10 175.35 3h1c s ALA 496 N 1.17 1.02 -0.02 5.51 0.00 0.55 -1.92 121.76 128.07 3h1c s ALA 496 Ca -0.05 -0.31 -0.06 0.00 0.00 0.00 0.00 51.96 51.54 3h1c s ALA 496 Cb -0.14 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.54 3h1c s ALA 496 CO -0.02 0.10 0.25 0.41 0.00 0.00 0.00 175.76 176.50 3h1c n GLY 497 N 3.69 0.34 0.00 0.00 0.00 -0.28 -0.24 105.19 108.70 3h1c n GLY 497 Ca -0.22 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.19 0.09 0.12 1.61 3.41 -0.39 -1.58 113.62 116.69 3h1c n SER 498 Ca 0.01 -0.13 -0.03 0.00 -0.26 0.00 0.00 58.87 58.46 3h1c n SER 498 Cb 0.11 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.14 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 -1.97 -3.37 114.38 115.81 3h1c h ARG 499 Ca 0.00 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.05 3h1c h ARG 499 Cb 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 3h1c h ARG 499 CO 0.00 0.72 -0.67 -0.44 -1.51 0.00 0.00 179.97 178.07 3h1c h ASP 500 N 0.00 0.00 -3.44 -3.80 3.32 -1.95 -3.50 116.42 107.05 3h1c h ASP 500 Ca -0.01 -0.61 -0.24 0.00 0.02 0.00 0.00 57.03 56.19 3h1c h ASP 500 Cb 1.30 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.79 3h1c h ASP 500 CO 0.09 1.19 -0.20 0.61 -1.72 0.00 0.00 179.24 179.21 3h1c n GLY 501 N 1.53 3.04 3.67 2.75 0.00 -1.26 -4.72 105.19 110.21 3h1c n GLY 501 Ca -0.20 -1.69 -0.35 0.00 0.00 0.00 0.00 46.02 43.78 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 -2.75 5.01 -0.15 -0.61 1.01 0.73 -1.26 121.20 123.19 3h1c s ILE 502 Ca 0.21 0.05 -0.01 0.00 0.00 0.00 0.00 60.65 60.90 3h1c s ILE 502 Cb 0.00 -3.27 -0.23 0.00 0.01 0.00 0.00 42.46 38.97 3h1c s ILE 502 CO 0.15 0.45 0.23 -1.54 0.00 0.00 0.00 174.94 174.23 3h1c n SER 503 N 3.53 1.86 -3.83 3.58 3.41 0.67 -2.36 113.62 120.48 3h1c n SER 503 Ca -0.16 0.13 -0.12 0.00 -0.26 0.00 0.00 58.87 58.46 3h1c n SER 503 Cb 0.52 -0.58 -0.11 0.00 -0.26 0.00 0.00 64.21 63.79 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 -2.55 -0.45 -0.07 7.33 0.00 0.56 -0.26 121.76 126.34 3h1c s ALA 504 Ca -0.23 0.25 -0.03 0.00 0.00 0.00 0.00 51.96 51.95 3h1c s ALA 504 Cb 0.07 -0.11 0.04 0.00 0.00 0.00 0.00 23.12 23.12 3h1c s ALA 504 CO 0.73 -0.15 0.13 -1.17 0.00 0.00 0.00 175.76 175.30 3h1c s LEU 505 N -0.63 0.30 -0.11 0.00 2.96 -1.26 -0.33 118.68 119.61 3h1c s LEU 505 Ca -0.07 0.26 0.03 0.00 -0.22 0.00 0.00 54.13 54.12 3h1c s LEU 505 Cb -0.04 0.21 -0.00 0.00 0.50 0.00 0.00 46.19 46.85 3h1c s LEU 505 CO 0.01 -0.21 -0.20 -1.58 -1.32 0.00 0.00 176.35 173.05 3h1c s GLN 506 N 1.82 3.15 -0.26 1.98 0.74 0.13 -2.67 119.66 124.55 3h1c s GLN 506 Ca -0.01 -0.82 0.02 0.00 0.05 0.00 0.00 55.36 54.60 3h1c s GLN 506 Cb -0.12 -2.42 0.07 0.00 1.10 0.00 0.00 33.01 31.64 3h1c s GLN 506 CO -0.05 0.17 -0.05 1.41 -0.55 0.00 0.00 175.29 176.22 3h1c s MET 507 N 0.39 1.76 -0.75 1.67 1.75 -0.51 -0.22 119.30 123.39 3h1c s MET 507 Ca -0.15 -1.26 0.03 0.00 -1.25 0.00 0.00 55.69 53.06 3h1c s MET 507 Cb -0.17 -2.76 0.18 0.00 2.84 0.00 0.00 34.83 34.92 3h1c s MET 507 CO 0.07 -0.67 0.56 -0.51 -0.65 0.00 0.00 175.02 173.83 3h1c s ASP 508 N 1.23 5.13 -0.08 1.11 1.01 -1.15 -1.06 116.67 122.85 3h1c s ASP 508 Ca -0.03 -3.82 -0.25 0.00 0.71 0.00 0.00 52.55 49.16 3h1c s ASP 508 Cb -0.19 -1.71 -0.03 0.00 1.01 0.00 0.00 42.92 42.00 3h1c s ASP 508 CO -0.07 -0.11 0.79 -0.63 0.21 0.00 0.00 175.17 175.36 3h1c s ILE 509 N -1.42 4.97 -1.62 0.77 1.01 0.04 -1.69 121.20 123.26 3h1c s ILE 509 Ca 0.25 1.61 0.20 0.00 0.00 0.00 0.00 60.65 62.72 3h1c s ILE 509 Cb -0.05 -4.12 -0.07 0.00 0.01 0.00 0.00 42.46 38.23 3h1c s ILE 509 CO -0.15 0.18 0.97 0.29 0.00 0.00 0.00 174.94 176.22 3h1c n LYS 510 N 4.17 1.12 -4.31 2.79 5.02 0.23 -4.74 118.16 122.45 3h1c n LYS 510 Ca 0.02 -0.68 -0.19 0.00 -2.02 0.00 0.00 58.31 55.43 3h1c n LYS 510 Cb 0.51 -1.42 -0.13 0.00 -0.02 0.00 0.00 35.03 33.96 3h1c n LYS 510 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3h1c s ILE 511 N -2.47 0.96 0.60 -0.18 -4.36 -1.25 -4.79 121.20 109.71 3h1c s ILE 511 Ca 0.14 -0.90 -0.06 0.00 -0.26 0.00 0.00 60.65 59.57 3h1c s ILE 511 Cb 0.16 -0.88 0.01 0.00 1.25 0.00 0.00 42.46 43.00 3h1c s ILE 511 CO 0.60 -0.01 0.92 -1.83 0.24 0.00 0.00 174.94 174.86 3h1c s GLU 512 N -1.03 2.91 0.00 0.37 -1.05 -1.26 -4.43 118.70 114.21 3h1c s GLU 512 Ca 0.00 0.03 0.00 0.00 -0.15 0.00 0.00 54.97 54.85 3h1c s GLU 512 Cb -0.07 -2.25 0.00 0.00 -0.44 0.00 0.00 34.13 31.36 3h1c s GLU 512 CO 0.01 -0.73 0.00 0.41 0.95 0.00 0.00 175.26 175.90 3h1c n GLY 513 N -2.62 0.93 3.74 -3.83 0.00 -1.26 -5.06 105.19 97.09 3h1c n GLY 513 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 3h1c n GLY 513 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3h1c s ILE 514 N -2.01 2.60 0.15 -0.61 2.07 -1.26 -5.01 121.20 117.13 3h1c s ILE 514 Ca 0.00 0.49 -0.03 0.00 -1.41 0.00 0.00 60.65 59.70 3h1c s ILE 514 Cb 0.00 -3.31 -0.05 0.00 0.13 0.00 0.00 42.46 39.23 3h1c s ILE 514 CO 0.00 0.07 0.35 -0.89 -1.91 0.00 0.00 174.94 172.56 3h1c s THR 515 N 0.20 5.22 0.30 4.00 2.01 -1.26 -4.67 115.64 121.44 3h1c s THR 515 Ca 0.62 -0.16 0.04 0.00 0.31 0.00 0.00 61.69 62.49 3h1c s THR 515 Cb -0.43 -3.66 0.09 0.00 0.01 0.00 0.00 72.50 68.51 3h1c s THR 515 CO 0.42 -0.01 1.76 0.50 -0.69 0.00 0.00 174.62 176.60 3h1c h LYS 516 N 2.61 0.46 -0.36 4.92 3.64 -2.00 -3.15 116.57 122.69 3h1c h LYS 516 Ca -0.46 -0.15 -0.06 0.00 -1.27 0.00 0.00 60.65 58.71 3h1c h LYS 516 Cb 1.17 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 3h1c h LYS 516 CO 0.72 0.64 -0.01 1.49 -2.27 0.00 0.00 179.45 180.02 3h1c h GLU 517 N 0.41 0.57 0.00 1.90 4.22 -2.02 -2.77 114.58 116.89 3h1c h GLU 517 Ca 0.07 -0.13 0.00 0.00 0.08 0.00 0.00 59.36 59.38 3h1c h GLU 517 Cb 0.59 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3h1c h GLU 517 CO 0.04 0.60 -0.24 -0.84 -2.18 0.00 0.00 179.01 176.40 3h1c h ILE 518 N 0.54 0.00 -0.03 2.32 3.07 -1.97 -3.32 117.51 118.13 3h1c h ILE 518 Ca 0.11 -0.78 -0.21 0.00 1.55 0.00 0.00 64.86 65.53 3h1c h ILE 518 Cb 0.36 1.65 -0.00 0.00 -0.27 0.00 0.00 36.82 38.56 3h1c h ILE 518 CO 0.01 0.00 -0.86 0.24 -1.05 0.00 0.00 178.15 176.49 3h1c h MET 519 N 0.00 0.40 0.00 0.16 2.86 -1.46 -2.41 114.93 114.48 3h1c h MET 519 Ca 0.00 -0.39 -0.05 0.00 -2.06 0.00 0.00 59.70 57.20 3h1c h MET 519 Cb 0.89 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 3h1c h MET 519 CO 0.00 1.05 -0.24 -0.56 1.06 0.00 0.00 176.91 178.22 3h1c h GLN 520 N 0.24 0.00 0.10 1.72 3.07 -1.64 -2.03 115.11 116.57 3h1c h GLN 520 Ca -0.06 0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.46 3h1c h GLN 520 Cb 1.48 0.00 0.02 0.00 0.08 0.00 0.00 27.48 29.06 3h1c h GLN 520 CO 0.15 0.24 -0.91 0.28 0.09 0.00 0.00 178.83 178.68 3h1c h VAL 521 N 0.00 1.41 -0.07 1.86 2.07 -1.64 -2.66 116.25 117.22 3h1c h VAL 521 Ca -0.00 -2.38 -0.10 0.00 0.82 0.00 0.00 66.70 65.04 3h1c h VAL 521 Cb 0.87 2.85 -0.01 0.00 -1.52 0.00 0.00 31.29 33.48 3h1c h VAL 521 CO 0.03 0.70 -0.41 0.00 0.02 0.00 0.00 177.57 177.91 3h1c h ALA 522 N 0.22 1.20 0.12 1.67 0.00 -1.39 -1.58 119.26 119.50 3h1c h ALA 522 Ca -0.14 -0.40 -0.27 0.00 0.00 0.00 0.00 54.91 54.10 3h1c h ALA 522 Cb 1.65 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 19.36 3h1c h ALA 522 CO 0.17 0.56 -1.22 1.25 0.00 0.00 0.00 179.25 180.02 3h1c h LEU 523 N 0.12 0.48 -0.46 0.00 5.85 -1.47 -2.72 115.31 117.11 3h1c h LEU 523 Ca 0.01 -0.49 -0.17 0.00 0.84 0.00 0.00 57.88 58.07 3h1c h LEU 523 Cb 0.78 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.65 3h1c h LEU 523 CO 0.06 1.37 -0.59 -1.13 -0.34 0.00 0.00 178.44 177.81 3h1c h ASN 524 N 0.10 0.65 0.75 1.25 -1.24 -1.39 -2.66 115.58 113.05 3h1c h ASN 524 Ca -0.14 -0.36 -0.09 0.00 0.71 0.00 0.00 56.30 56.42 3h1c h ASN 524 Cb 1.93 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 40.78 3h1c h ASN 524 CO 0.20 1.09 -0.45 -0.61 -1.29 0.00 0.00 177.43 176.38 3h1c h GLN 525 N 0.43 0.00 0.00 6.67 4.15 -1.38 -2.89 115.11 122.10 3h1c h GLN 525 Ca -0.00 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.30 3h1c h GLN 525 Cb 1.15 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.82 3h1c h GLN 525 CO 0.11 0.45 -0.56 0.00 -1.93 0.00 0.00 178.83 176.91 3h1c h ALA 526 N 1.55 1.00 -0.32 3.38 0.00 -1.36 -2.77 119.26 120.75 3h1c h ALA 526 Ca -0.00 -0.51 -0.06 0.00 0.00 0.00 0.00 54.91 54.34 3h1c h ALA 526 Cb 0.95 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 3h1c h ALA 526 CO 0.06 0.70 -0.04 -0.22 0.00 0.00 0.00 179.25 179.74 3h1c h LYS 527 N 0.00 0.59 -0.35 0.00 3.64 -1.26 -1.56 116.57 117.63 3h1c h LYS 527 Ca -0.01 -0.21 -0.08 0.00 -1.27 0.00 0.00 60.65 59.09 3h1c h LYS 527 Cb 1.03 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.79 3h1c h LYS 527 CO 0.07 0.75 -0.11 0.78 -2.27 0.00 0.00 179.45 178.68 3h1c h GLY 528 N 0.37 0.65 2.00 5.01 0.00 -1.53 -2.51 103.07 107.06 3h1c h GLY 528 Ca 0.08 -0.46 -0.13 0.00 0.00 0.00 0.00 47.33 46.82 3h1c h GLY 528 CO 0.02 0.42 -0.64 0.00 0.00 0.00 0.00 176.54 176.35 3h1c h ALA 529 N 1.33 0.90 -0.08 3.60 0.00 -1.44 -3.20 119.26 120.37 3h1c h ALA 529 Ca 0.10 -0.58 -0.17 0.00 0.00 0.00 0.00 54.91 54.26 3h1c h ALA 529 Cb 0.52 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3h1c h ALA 529 CO 0.03 0.80 -0.67 -0.09 0.00 0.00 0.00 179.25 179.32 3h1c h ARG 530 N 0.00 0.34 0.00 0.00 2.43 -1.00 -3.14 114.38 113.01 3h1c h ARG 530 Ca -0.01 -0.26 -0.04 0.00 -0.81 0.00 0.00 59.98 58.87 3h1c h ARG 530 Cb 1.16 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 3h1c h ARG 530 CO 0.08 0.89 -0.17 -0.07 -1.51 0.00 0.00 179.97 179.19 3h1c h LEU 531 N 0.24 0.00 -0.32 3.80 4.07 -1.45 -2.19 115.31 119.47 3h1c h LEU 531 Ca -0.02 0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.76 3h1c h LEU 531 Cb 1.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.95 3h1c h LEU 531 CO 0.11 0.17 -0.58 -0.74 -1.08 0.00 0.00 178.44 176.32 3h1c h HIS 532 N 0.00 1.03 -0.46 1.13 2.76 -1.55 -1.84 115.15 116.21 3h1c h HIS 532 Ca -0.00 -0.38 -0.11 0.00 -2.20 0.00 0.00 60.37 57.67 3h1c h HIS 532 Cb 0.68 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 29.43 3h1c h HIS 532 CO 0.00 1.20 -0.16 0.82 -1.30 0.00 0.00 177.93 178.49 3h1c h ILE 533 N 0.62 1.27 -0.04 6.26 1.08 -1.53 -3.18 117.51 121.99 3h1c h ILE 533 Ca 0.00 -1.30 -0.12 0.00 -0.39 0.00 0.00 64.86 63.06 3h1c h ILE 533 Cb 1.18 1.14 -0.01 0.00 -3.07 0.00 0.00 36.82 36.06 3h1c h ILE 533 CO 0.12 0.45 -0.52 0.25 -0.69 0.00 0.00 178.15 177.76 3h1c h LEU 534 N 0.77 0.10 -0.59 1.44 5.85 -1.39 -2.55 115.31 118.94 3h1c h LEU 534 Ca 0.11 -0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.67 3h1c h LEU 534 Cb 0.72 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 3h1c h LEU 534 CO 0.06 0.61 -0.11 1.23 -0.34 0.00 0.00 178.44 179.88 3h1c h GLY 535 N 1.49 1.09 1.91 3.75 0.00 -1.32 -1.39 103.07 108.60 3h1c h GLY 535 Ca -0.00 -0.88 -0.18 0.00 0.00 0.00 0.00 47.33 46.28 3h1c h GLY 535 CO 0.07 0.80 -0.81 -2.08 0.00 0.00 0.00 176.54 174.52 3h1c h VAL 536 N 0.89 1.53 -0.37 4.60 2.07 -1.53 -2.82 116.25 120.62 3h1c h VAL 536 Ca 0.14 -2.64 -0.11 0.00 0.82 0.00 0.00 66.70 64.91 3h1c h VAL 536 Cb 0.67 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.87 3h1c h VAL 536 CO 0.05 0.76 -0.22 0.24 0.02 0.00 0.00 177.57 178.42 3h1c h MET 537 N 0.05 0.73 0.00 1.57 2.07 -1.31 -2.85 114.93 115.18 3h1c h MET 537 Ca -0.02 -0.29 -0.04 0.00 -2.07 0.00 0.00 59.70 57.28 3h1c h MET 537 Cb 1.42 -0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 31.11 3h1c h MET 537 CO 0.11 0.89 -0.18 0.93 1.07 0.00 0.00 176.91 179.74 3h1c h GLU 538 N 0.64 0.00 -0.28 1.72 5.08 -1.24 -2.11 114.58 118.40 3h1c h GLU 538 Ca 0.09 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.33 3h1c h GLU 538 Cb 0.72 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 3h1c h GLU 538 CO 0.05 0.18 -0.35 0.37 -1.00 0.00 0.00 179.01 178.26 3h1c h GLN 539 N 0.00 0.61 0.02 2.33 4.15 -1.26 -3.20 115.11 117.76 3h1c h GLN 539 Ca -0.00 -0.29 -0.28 0.00 0.77 0.00 0.00 58.65 58.85 3h1c h GLN 539 Cb 0.82 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.46 3h1c h GLN 539 CO 0.02 0.87 -1.56 0.00 -1.93 0.00 0.00 178.83 176.24 3h1c h ALA 540 N 1.10 0.61 -1.89 3.38 0.00 -1.49 -3.47 119.26 117.51 3h1c h ALA 540 Ca 0.05 -1.31 0.02 0.00 0.00 0.00 0.00 54.91 53.68 3h1c h ALA 540 Cb 0.84 0.35 -0.22 0.00 0.00 0.00 0.00 17.79 18.75 3h1c h ALA 540 CO 0.07 1.45 0.15 -1.50 0.00 0.00 0.00 179.25 179.42 3h1c s ILE 541 N -2.62 0.00 0.00 0.00 2.07 -0.80 -5.04 121.20 114.81 3h1c s ILE 541 Ca -0.05 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.19 3h1c s ILE 541 Cb 0.08 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.67 3h1c s ILE 541 CO 0.82 0.00 0.66 -0.46 -1.91 0.00 0.00 174.94 174.06 3h1c n ASN 542 N 3.61 1.10 -3.57 4.50 0.23 -1.25 -3.57 115.26 116.31 3h1c n ASN 542 Ca -0.18 -1.44 -0.06 0.00 -0.53 0.00 0.00 54.58 52.37 3h1c n ASN 542 Cb 0.57 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.25 3h1c n ASN 542 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3h1c s ALA 543 N -0.44 -1.99 -2.75 -2.53 0.00 -1.26 -5.02 121.76 107.78 3h1c s ALA 543 Ca 0.00 1.47 0.26 0.00 0.00 0.00 0.00 51.96 53.69 3h1c s ALA 543 Cb 0.00 -0.20 0.63 0.00 0.00 0.00 0.00 23.12 23.55 3h1c s ALA 543 CO 0.00 -0.54 1.51 -2.30 0.00 0.00 0.00 175.76 174.43